# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-08T14:02:31+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (year = 2007 AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"1101114","12.28","0.002","27.44","0.002","15.13","0.002","90","","100.82","0.02","90","","5007.6","1.2","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H48 Cu2 I2 N4 -","- C56 H48 Cu2 I2 N4 -","- C224 H192 Cu8 I8 N16 -","4","1","","Kia, Reza; Mirkhani, Valiollah; Harkema, Sybolt; van Hummel, Gerrit J.","Synthesis and characterization of the 1:1 adducts of copper(I) halides with bidentate N,N'-bis(benzophenone)-1,2-diiminoethane Schiff base: Crystal structures of [Cu(bz2en)2][CuX2] (X = Br, I) complexes","Inorganica Chimica Acta","2007","360","10","3369","3375","10.5517/ccngnf5","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1500005","27.4534","0.0016","13.1997","0.0008","14.468","0.0008","90","","90","","90","","5242.9","0.5","298","2","298","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","Hexaammine cobalt(III) hydrogenarseniate tetrahydrate","","- As3 Co2 H47 N12 O16 -","- As3 Co2 H47 N12 O16 -","- As24 Co16 H376 N96 O128 -","8","1","","Ritu Bala; Raj Pal Sharma; Rajni Sharma; Juan M. Salas; Miguel Quirós; William T.A. Harrison","Cationic cobaltammines as anion receptors: Synthesis, characterization an X-ray structure of bis-(hexaamminecobalt(III)) tris-(hydrogenarsenate) tetrahydrate","Journal of Molecular Structure","2007","828","","174","180","10.1016/j.molstruc.2006.05.047","","","0.71073","MoKα","","0.0335","0.0264","","","0.06","0.0622","","","","","","1.071","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1500019","9.4668","0.0007","8.8177","0.0006","25.9413","0.0018","90","","90","","90","","2165.5","0.3","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H11 N O2 -","- C13 H11 N O2 -","- C104 H88 N8 O16 -","8","1","","Maria Lalia Kantouri; Christos D. Papadopoulos; Antonios G. Hatzdimitriou; Miguel Quirós","Synthesis and characterization of new Co(III) mixed-ligand complexes, containing 2-hydroxy-aryloximes and α-diimines. Crystal and molecular strucutre of [Co(saox)(bipy)~2~]Br","Polyhedron","2007","26","","1292","1302","10.1016/j.poly.2006.10.047","","","0.71073","MoKα","","0.0584","0.0467","","","0.1264","0.1347","","","","","","1.033","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1500022","17.7483","0.001","36.829","0.002","17.3196","0.001","90","","90","","90","","11320.9","1.1","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C28.81 H26.43 Br Co N5.33 O3.9 -","- C28.815 H26.432 Br Co N5.333 O3.9 -","- C461.04 H422.912 Br16 Co16 N85.328 O62.4 -","16","2","","Maria Lalia-Kantouri; Christos D. Papadopoulos; Antonios G. Hatzidimitriou; Miguel Quirós","Synthesis and characterization of new Co(III) mixed-ligand complexes, containing 2-hydroxy-aryloximes and α-diimines. Crystal and molecular strucutre of [Co(saox)(bipy)~2~]Br","Polyhedron","2007","26","","1292","1302","10.1016/j.poly.2006.10.047","","","0.71073","MoKα","","0.0406","0.0306","","0.087","0.0728","0.0728","","","","","","1.0498","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1500039","5.05506","0.00012","5.51404","0.00014","22.95644","0.00091","90","","101.291","0.002","90","","627.5","0.03","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Benzamide","","","- C7 H7 N O -","- C7 H7 N O -","- C28 H28 N4 O4 -","4","1","","Thun, Jürgen; Seyfarth, Lena; Senker, Jürgen; Dinnebier, Robert E.; Breu, Josef","Polymorphism in benzamide: solving a 175-year-old riddle.","Angewandte Chemie (International ed. in English)","2007","46","35","6729","6731","10.1002/anie.200701383","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1501470","19.648","0.003","5.9969","0.0008","4.8691","0.0006","90","","90","","90","","573.71","0.14","298","","298","","","","","","","","","3","P m c a","-P 2ac 2a","57","","","","- Li2 O7 Si3 -","- Li2 O7 Si3 -","- Li8 O28 Si12 -","4","0.5","","Krüger, Hannes; Kahlenberg, Volker; Kaindl, R.","Li2Si3O7: Crystal structure and Raman Spectroscopy","Journal of Solid State Chemistry","2007","180","","936","942","","","","0.71073","MoKα","","0.0505","0.035","","","0.0374","0.0399","","","","2.46","2.46","2.34","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1501565","8.0049","0.0004","8.5815","0.0004","32.3805","0.0016","90","","90","","90","","2224.35","0.19","296","2","296","2","","","","","","","Synthesized by the authors. See text","2","P 21 21 21","P 2ac 2ab","19","","","","- C16 H14 -","- C16 H14 -","- C128 H112 -","8","2","","Hung Dang; Thierry Maris; Ji-Hyun Yi; Federico Rosei; Antonio Nancy; James D. Wuest","Ensuring Homology between 2D and 3D Molecular Crystals","Langmuir","2007","23","","11980","11985","10.1021/la702885y","","","1.54178","CuKα","","0.0461","0.0418","","","0.0906","0.0912","","","","","","1.118","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1501566","9.7778","0.0002","9.7778","0.0002","14.0111","0.0005","90","","90","","90","","1339.54","0.06","150","2","150","2","","","","","","","Synthesized by the authors. See text","3","P 43 21 2","P 4nw 2abw","96","","","","- C18 H14 O4 -","- C18 H14 O4 -","- C72 H56 O16 -","4","0.5","","Hung Dang; Thierry Maris; Ji-Hyun Yi; Federico Rosei; Antonio Nancy; James D. Wuest","Ensuring Homology between 2D and 3D Molecular Crystals","Langmuir","2007","23","","11980","11985","10.1021/la702885y","","","1.54178","CuKα","","0.0564","0.0548","","","0.1349","0.1351","","","","","","1.023","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1501616","11.1911","0.0009","13.9932","0.0011","24.378","0.002","84.436","0.005","83.004","0.005","68.693","0.005","3524.4","0.5","100","2","100","2","","","","","","","Synthesized by the authors. See text","4","P -1","-P 1","2","","","","- C84 H66 N6 O12 -","- C84 H66 N6 O12 -","- C168 H132 N12 O24 -","2","1","","Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest","The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene","Tetrahedron","2007","63","","6603","6613","10.1016/j.tet.2007.03.101","","","1.54178","CuKα","","0.0734","0.065","","","0.1447","0.1465","","","","","","1.051","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1501617","11.533","0.002","13.037","0.003","14.014","0.003","105.1","0.03","108.37","0.03","110.42","0.03","1703.7","1.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C70 H80 N6 O26 -","- C70 H80 N6 O26 -","- C70 H80 N6 O26 -","1","0.5","","Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest","The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene","Tetrahedron","2007","63","","6603","6613","10.1016/j.tet.2007.03.101","","","1.54178","CuKα","","0.0602","0.0567","","","0.1321","0.1327","","","","","","0.978","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1501618","11.237","0.002","20.367","0.005","19.002","0.004","90","","102.048","0.011","90","","4253.1","1.6","100","2","100","2","","","","","","","Synthesized by the authors. See text","4","C 1 2/c 1","-C 2yc","15","","","","- C46 H30 N8 O12 -","- C46 H30 N8 O12 -","- C184 H120 N32 O48 -","4","0.5","","Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest","The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene","Tetrahedron","2007","63","","6603","6613","10.1016/j.tet.2007.03.101","","","1.54178","CuKα","","0.0652","0.0568","","","0.1281","0.1292","","","","","","1.017","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1501619","11.18","0.02","20.59","0.03","20.07","0.04","90","","104.74","0.07","90","","4468","14","100","2","100","2","","","","","","","Synthesized by the authors. See text","4","C 1 2/c 1","-C 2yc","15","","","","- C48 H36 N6 O14 -","- C48 H36 N6 O14 -","- C192 H144 N24 O56 -","4","0.5","","Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest","The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene","Tetrahedron","2007","63","","6603","6613","10.1016/j.tet.2007.03.101","","","1.54178","CuKα","","0.063","0.0542","","","0.1575","0.167","","","","","","1.036","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1501620","10.7355","0.001","13.931","0.0014","14.1161","0.0015","90","","98.039","0.006","90","","2090.4","0.4","100","2","100","2","","","","","","","Synthesized by the authors. See text","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H36 N6 O14 -","- C46 H36 N6 O14 -","- C92 H72 N12 O28 -","2","0.5","","Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest","The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene","Tetrahedron","2007","63","","6603","6613","10.1016/j.tet.2007.03.101","","","1.54178","CuKα","","0.0863","0.0665","","","0.1376","0.1422","","","","","","0.832","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1501621","11.6772","0.0013","17.9809","0.0019","11.9334","0.0013","90","","116.183","0.006","90","","2248.5","0.4","100","2","100","2","","","","","","","Synthesized by the authors. See text","4","P 1 21 1","P 2yb","4","","","","- C48 H38 N8 O14 -","- C48 H38 N8 O14 -","- C96 H76 N16 O28 -","2","1","","Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest","The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene","Tetrahedron","2007","63","","6603","6613","10.1016/j.tet.2007.03.101","","","1.54178","CuKα","","0.0838","0.0567","","","0.1329","0.1442","","","","","","1.154","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505006","11.8954","0.0003","13.3664","0.0004","16.6714","0.0005","85.6016","0.0016","79.3536","0.0016","69.328","0.0016","2437.19","0.12","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H47 Cl3 Fe2 N4 O6 S2 -","- C37 H47 Cl3 Fe2 N4 O6 S2 -","- C74 H94 Cl6 Fe4 N8 O12 S4 -","2","1","","Khan, Mohammad A. K.; Long, Yi-Tao; Schatte, Gabriele; Kraatz, Heinz-Bernhard","Surface Studies of Aminoferrocene Derivatives on Gold: Electrochemical Sensors for Chemical Warfare Agents","Analytical Chemistry","2007","79","7","2877","","10.1021/ac061981m","","","0.71073","MoKα","","0.0682","0.0512","","","0.1451","0.1548","","","","","","1.046","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505007","10.0825","0.0007","18.239","0.003","13.8361","0.0012","90","","96.606","0.006","90","","2527.5","0.5","290","2","290","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H34 B N3 O -","- C29 H34 B N3 O -","- C116 H136 B4 N12 O4 -","4","1","","Soutullo, Morgan D.; Odom, Carl I.; Salter, E. Alan; Stenson, Alexandra C.; Sykora, Richard E.; Wierzbicki, Andrzej; Davis, James H.","Ultra-Easy Access to NH2-Functionalized TSILs, Their Potential as Highly Volume-Efficient Electrophile Scavengers, and Insights into the Electronics of Girard's Reagent T, A Venerable Chemical Work Horse","Journal of Combinatorial Chemistry","2007","9","4","571","","10.1021/cc060151j","","","0.71073","MoKα","","0.1184","0.0421","","","0.1045","0.1271","","","","","","0.985","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505008","12.7145","0.0017","15.8471","0.0017","15.7636","0.0015","90","","100.298","0.009","90","","3125","0.6","290","2","290","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H39 B N4 O2 -","- C36 H39 B N4 O2 -","- C144 H156 B4 N16 O8 -","4","1","","Soutullo, Morgan D.; Odom, Carl I.; Salter, E. Alan; Stenson, Alexandra C.; Sykora, Richard E.; Wierzbicki, Andrzej; Davis, James H.","Ultra-Easy Access to NH2-Functionalized TSILs, Their Potential as Highly Volume-Efficient Electrophile Scavengers, and Insights into the Electronics of Girard's Reagent T, A Venerable Chemical Work Horse","Journal of Combinatorial Chemistry","2007","9","4","571","","10.1021/cc060151j","","","0.71073","MoKα","","0.0701","0.0376","","","0.0959","0.1097","","","","","","1.019","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505009","16.63","0.002","13.9808","0.0015","12.999","0.003","90","","91.48","0.02","90","","3021.3","0.9","290","2","290","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H40 B N3 O -","- C33 H40 B N3 O -","- C132 H160 B4 N12 O4 -","4","1","","Soutullo, Morgan D.; Odom, Carl I.; Salter, E. Alan; Stenson, Alexandra C.; Sykora, Richard E.; Wierzbicki, Andrzej; Davis, James H.","Ultra-Easy Access to NH2-Functionalized TSILs, Their Potential as Highly Volume-Efficient Electrophile Scavengers, and Insights into the Electronics of Girard's Reagent T, A Venerable Chemical Work Horse","Journal of Combinatorial Chemistry","2007","9","4","571","","10.1021/cc060151j","","","0.71073","MoKα","","0.2422","0.0511","","","0.1019","0.148","","","","","","0.92","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505010","14.1478","0.0011","10.2584","0.0008","21.693","0.007","90","","103.87","0.01","90","","3056.6","1.1","290","2","290","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H39 B N4 O2 -","- C33 H39 B N4 O2 -","- C132 H156 B4 N16 O8 -","4","1","","Soutullo, Morgan D.; Odom, Carl I.; Salter, E. Alan; Stenson, Alexandra C.; Sykora, Richard E.; Wierzbicki, Andrzej; Davis, James H.","Ultra-Easy Access to NH2-Functionalized TSILs, Their Potential as Highly Volume-Efficient Electrophile Scavengers, and Insights into the Electronics of Girard's Reagent T, A Venerable Chemical Work Horse","Journal of Combinatorial Chemistry","2007","9","4","571","","10.1021/cc060151j","","","0.71073","MoKα","","0.0923","0.0597","","","0.1672","0.1893","","","","","","1.045","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505011","36.34","0.015","11.78","0.005","11.87","0.005","90","","102.714","0.005","90","","4957","4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H27 Cl N4 O3 -","- C28 H27 Cl N4 O3 -","- C224 H216 Cl8 N32 O24 -","8","1","","Tu, Shujiang; Li, Chunmei; Li, Guigen; Cao, Longji; Shao, Qingqing; Zhou, Dianxiang; Jiang, Bo; Zhou, Jianfeng; Xia, Min","Microwave-Assisted Combinatorial Synthesis of Polysubstituent Imidazo[1,2-a]quinoline, Pyrimido[1,2-a]quinoline and Quinolino[1,2-a]quinazoline Derivatives","Journal of Combinatorial Chemistry","2007","9","6","1144","","10.1021/cc700124g","","","0.71073","MoKα","","0.1448","0.0738","","","0.1776","0.2164","","","","","","1.022","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505012","10.378","0.005","10.131","0.005","18.143","0.009","90","","97.406","0.008","90","","1891.6","1.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H20 Cl N3 O2 -","- C21 H20 Cl N3 O2 -","- C84 H80 Cl4 N12 O8 -","4","1","","Tu, Shujiang; Li, Chunmei; Li, Guigen; Cao, Longji; Shao, Qingqing; Zhou, Dianxiang; Jiang, Bo; Zhou, Jianfeng; Xia, Min","Microwave-Assisted Combinatorial Synthesis of Polysubstituent Imidazo[1,2-a]quinoline, Pyrimido[1,2-a]quinoline and Quinolino[1,2-a]quinazoline Derivatives","Journal of Combinatorial Chemistry","2007","9","6","1144","","10.1021/cc700124g","","","0.71073","MoKα","","0.184","0.0644","","","0.1503","0.2226","","","","","","1.018","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505013","10.781","0.003","14.937","0.004","9.839","0.003","90","","106.27","0.005","90","","1521","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 F N3 O2 -","- C18 H14 F N3 O2 -","- C72 H56 F4 N12 O8 -","4","1","","Tu, Shujiang; Li, Chunmei; Li, Guigen; Cao, Longji; Shao, Qingqing; Zhou, Dianxiang; Jiang, Bo; Zhou, Jianfeng; Xia, Min","Microwave-Assisted Combinatorial Synthesis of Polysubstituent Imidazo[1,2-a]quinoline, Pyrimido[1,2-a]quinoline and Quinolino[1,2-a]quinazoline Derivatives","Journal of Combinatorial Chemistry","2007","9","6","1144","","10.1021/cc700124g","","","0.71073","MoKα","","0.1168","0.0465","","","0.0845","0.1118","","","","","","1.005","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505014","10.9684","0.0013","11.1701","0.0014","12.9433","0.0015","87.15","0.002","67.964","0.002","81.135","0.002","1452.3","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C38 H32 O -","- C38 H32 O -","- C76 H64 O2 -","2","1","","Yao, Liang-Feng; Shi, Min","Lewis acid-catalyzed cascade reactions of arylmethylenecyclopropanes with 1,1,3-triarylprop-2-yn-1-ols or their methyl ethers.","Organic letters","2007","9","25","5187","5190","10.1021/ol7022592","","","0.71073","MoKα","","0.0856","0.0524","","","0.1271","0.1437","","","","","","0.915","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505015","11.9815","0.0012","28.144","0.003","9.7933","0.001","90","","111.828","0.002","90","","3065.6","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C39 H34 O2 -","- C39 H34 O2 -","- C156 H136 O8 -","4","1","","Yao, Liang-Feng; Shi, Min","Lewis acid-catalyzed cascade reactions of arylmethylenecyclopropanes with 1,1,3-triarylprop-2-yn-1-ols or their methyl ethers.","Organic letters","2007","9","25","5187","5190","10.1021/ol7022592","","","0.71073","MoKα","","0.1335","0.052","","","0.1163","0.1447","","","","","","0.813","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505016","8.346","0.001","14.28","0.004","8.376","0.003","90","","93.43","0.02","90","","996.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14 H14 Cl4 Cu2 N10 -","- C14 H14 Cl4 Cu2 N10 -","- C28 H28 Cl8 Cu4 N20 -","2","0.5","","Tardito, Saverio; Bussolati, Ovidio; Maffini, Monica; Tegoni, Matteo; Giannetto, Marco; Dall'asta, Valeria; Franchi-Gazzola, Renata; Lanfranchi, Maurizio; Pellinghelli, Maria Angela; Mucchino, Claudio; Mori, Giovanni; Marchio, Luciano","Thioamido coordination in a thioxo-1,2,4-triazole copper(II) complex enhances nonapoptotic programmed cell death associated with copper accumulation and oxidative stress in human cancer cells.","Journal of medicinal chemistry","2007","50","8","1916","1924","10.1021/jm061174f","","","1.5418","CuKα","","0.0915","0.0375","","","0.0523","0.0605","","","","","","0.997","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505017","8.827","0.002","10.796","0.005","16.59","0.008","72.92","0.02","85.5","0.02","66.58","0.02","1385.4","1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H21 Cl4 Cu2 N10 O1.5 S2 -","- C20 H21 Cl4 Cu2 N10 O1.5 S2 -","- C40 H42 Cl8 Cu4 N20 O3 S4 -","2","1","","Tardito, Saverio; Bussolati, Ovidio; Maffini, Monica; Tegoni, Matteo; Giannetto, Marco; Dall'asta, Valeria; Franchi-Gazzola, Renata; Lanfranchi, Maurizio; Pellinghelli, Maria Angela; Mucchino, Claudio; Mori, Giovanni; Marchio, Luciano","Thioamido coordination in a thioxo-1,2,4-triazole copper(II) complex enhances nonapoptotic programmed cell death associated with copper accumulation and oxidative stress in human cancer cells.","Journal of medicinal chemistry","2007","50","8","1916","1924","10.1021/jm061174f","","","1.5418","CuKα","","0.048","0.0427","","","0.1142","0.1216","","","","","","1.039","","","","has coordinates","198667","2020-10-21","18:00:00",""
"1505018","8.649","0.003","9.313","0.005","9.371","0.004","68.69","0.02","71.86","0.02","79.27","0.02","666","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H11 Cl2 Cu N5 S -","- C9 H11 Cl2 Cu N5 S -","- C18 H22 Cl4 Cu2 N10 S2 -","2","1","","Tardito, Saverio; Bussolati, Ovidio; Maffini, Monica; Tegoni, Matteo; Giannetto, Marco; Dall'asta, Valeria; Franchi-Gazzola, Renata; Lanfranchi, Maurizio; Pellinghelli, Maria Angela; Mucchino, Claudio; Mori, Giovanni; Marchio, Luciano","Thioamido coordination in a thioxo-1,2,4-triazole copper(II) complex enhances nonapoptotic programmed cell death associated with copper accumulation and oxidative stress in human cancer cells.","Journal of medicinal chemistry","2007","50","8","1916","1924","10.1021/jm061174f","","","0.71073","mokα","","0.0743","0.039","","","0.061","0.0673","","","","","","1.009","","","","has coordinates","189846","2020-10-21","18:00:00",""
"1505019","9.554","0.0001","39.491","0.0004","9.8412","0.0001","90","","90.729","0.001","90","","3712.75","0.07","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C14 H19.5 Cl2 N Na O6.75 -","- C14 H19.5 Cl2 N Na O6.75 -","- C112 H156 Cl16 N8 Na8 O54 -","8","4","","Llinàs, Antonio; Burley, Jonathan C.; Box, Karl J.; Glen, Robert C.; Goodman, Jonathan M.","Diclofenac solubility: independent determination of the intrinsic solubility of three crystal forms.","Journal of medicinal chemistry","2007","50","5","979","983","10.1021/jm0612970","","","0.71073","MoKα","","0.0337","0.0323","","","0.0943","0.0965","","","","","","1.091","","","","has coordinates","183088","2020-10-21","18:00:00",""
"1505020","10.509","0.004","31.892","0.012","10.564","0.004","90","","117.63","0.006","90","","3137","2","193","2","193","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C24 H39.5 Cl N8 O8.25 Pt S -","- C24 H37 Cl N8 O8.25 Pt S -","- C96 H148 Cl4 N32 O33 Pt4 S4 -","4","2","","Guddneppanavar, Rajsekhar; Choudhury, Jayati Roy; Kheradi, Alexander R.; Steen, Bartlett D.; Saluta, Gilda; Kucera, Gregory L.; Day, Cynthia S.; Bierbach, Ulrich","Effect of the diamine nonleaving group in platinum-acridinylthiourea conjugates on DNA damage and cytotoxicity.","Journal of medicinal chemistry","2007","50","9","2259","2263","10.1021/jm0614376","","","0.71073","MoKα","","0.0917","0.0689","","","0.1168","0.1251","","","","","","1.07","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505021","10.6463","0.0015","10.9812","0.0015","13.1259","0.0018","90.642","0.002","99.622","0.002","113.788","0.002","1379.1","0.3","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H33 Cl N8 O7 Pt S -","- C21 H32 Cl N8 O7 Pt S -","- C42 H64 Cl2 N16 O14 Pt2 S2 -","2","1","","Guddneppanavar, Rajsekhar; Choudhury, Jayati Roy; Kheradi, Alexander R.; Steen, Bartlett D.; Saluta, Gilda; Kucera, Gregory L.; Day, Cynthia S.; Bierbach, Ulrich","Effect of the diamine nonleaving group in platinum-acridinylthiourea conjugates on DNA damage and cytotoxicity.","Journal of medicinal chemistry","2007","50","9","2259","2263","10.1021/jm0614376","","","0.71073","MoKα","","0.0383","0.0344","","","0.0826","0.0849","","","","","","1.033","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505022","7.266","0.0007","11.8032","0.0012","17.193","0.0017","95.598","0.002","92.629","0.002","94.082","0.002","1461.7","0.3","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H37 Cl N8 O6 Pt S -","- C24 H37 Cl N8 O6 Pt S -","- C48 H74 Cl2 N16 O12 Pt2 S2 -","2","1","","Guddneppanavar, Rajsekhar; Choudhury, Jayati Roy; Kheradi, Alexander R.; Steen, Bartlett D.; Saluta, Gilda; Kucera, Gregory L.; Day, Cynthia S.; Bierbach, Ulrich","Effect of the diamine nonleaving group in platinum-acridinylthiourea conjugates on DNA damage and cytotoxicity.","Journal of medicinal chemistry","2007","50","9","2259","2263","10.1021/jm0614376","","","0.71073","MoKα","","0.0403","0.0357","","","0.0846","0.0868","","","","","","1.044","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505023","14.4746","0.0013","18.7922","0.0016","19.543","0.0017","103.44","0.001","98.838","0.001","95.471","0.001","5061.2","0.8","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H37 Cl N8 O10 Pt S -","- C28 H31.3333 Cl N8 O10 Pt S -","- C168 H188 Cl6 N48 O60 Pt6 S6 -","6","3","","Guddneppanavar, Rajsekhar; Choudhury, Jayati Roy; Kheradi, Alexander R.; Steen, Bartlett D.; Saluta, Gilda; Kucera, Gregory L.; Day, Cynthia S.; Bierbach, Ulrich","Effect of the diamine nonleaving group in platinum-acridinylthiourea conjugates on DNA damage and cytotoxicity.","Journal of medicinal chemistry","2007","50","9","2259","2263","10.1021/jm0614376","","","0.71073","MoKα","","0.0786","0.0479","","","0.1125","0.1266","","","","","","1.036","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505024","10.6994","0.0005","29.8522","0.0017","18.8571","0.001","90","","116.835","0.004","90","","5374.4","0.5","140","2","140","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","p-CymRuCl2(anthraimid)","","","- C68 H58 B Cl N4 Ru -","- C68 H58 B Cl N4 Ru -","- C272 H232 B4 Cl4 N16 Ru4 -","4","1","","Vock, Carsten A.; Ang, Wee Han; Scolaro, Claudine; Phillips, Andrew D.; Lagopoulos, Lucienne; Juillerat-Jeanneret, Lucienne; Sava, Gianni; Scopelliti, Rosario; Dyson, Paul J.","Development of ruthenium antitumor drugs that overcome multidrug resistance mechanisms.","Journal of medicinal chemistry","2007","50","9","2166","2175","10.1021/jm070039f","","","0.71073","MoKα","","0.1149","0.0369","","","0.0361","0.0491","","","","","","0.7","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505025","14.34","0.002","12.4234","0.0015","15.156","0.0017","90","","117.502","0.009","90","","2394.9","0.6","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","[p-CymRuCl(anthraimid)2]BPh4","","","- C27 H26 Cl2 N2 Ru -","- C27 H26 Cl2 N2 Ru -","- C108 H104 Cl8 N8 Ru4 -","4","1","","Vock, Carsten A.; Ang, Wee Han; Scolaro, Claudine; Phillips, Andrew D.; Lagopoulos, Lucienne; Juillerat-Jeanneret, Lucienne; Sava, Gianni; Scopelliti, Rosario; Dyson, Paul J.","Development of ruthenium antitumor drugs that overcome multidrug resistance mechanisms.","Journal of medicinal chemistry","2007","50","9","2166","2175","10.1021/jm070039f","","","0.71073","MoKα","","0.0915","0.0548","","","0.123","0.1433","","","","","","1.086","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505026","12.658","0.003","14.916","0.005","17.958","0.004","90","","102.445","0.018","90","","3310.9","1.6","100","2","100","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","p-CymRuCl2(phenoxbenzimid).EtOAc","","","- C35 H37 Cl2 N3 O4 Ru -","- C35 H37 Cl2 N3 O4 Ru -","- C140 H148 Cl8 N12 O16 Ru4 -","4","1","","Vock, Carsten A.; Ang, Wee Han; Scolaro, Claudine; Phillips, Andrew D.; Lagopoulos, Lucienne; Juillerat-Jeanneret, Lucienne; Sava, Gianni; Scopelliti, Rosario; Dyson, Paul J.","Development of ruthenium antitumor drugs that overcome multidrug resistance mechanisms.","Journal of medicinal chemistry","2007","50","9","2166","2175","10.1021/jm070039f","","","0.71073","MoKα","","0.1463","0.0722","","","0.1101","0.1319","","","","","","1.211","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505027","14.443","0.002","5.797","0.001","15.243","0.002","90","","115.4","0.01","90","","1152.9","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-[(2-tert-butoxymethyl-3-hydroxy-6-isopropoxy-3,6-dihydro-2H- pyran-4-yl)hydroxy-methyl]-benzonitrile","","- C22 H29 N O6 -","- C22 H29 N O6 -","- C44 H58 N2 O12 -","2","1","","Saquib, Mohammad; Gupta, Manish K.; Sagar, Ram; Prabhakar, Yenamandra S.; Shaw, Arun K.; Kumar, Rishi; Maulik, Prakas R.; Gaikwad, Anil N.; Sinha, Sudhir; Srivastava, Anil K.; Chaturvedi, Vinita; Srivastava, Ranjana; Srivastava, Brahm S.","C-3 alkyl/arylalkyl-2,3-dideoxy hex-2-enopyranosides as antitubercular agents: synthesis, biological evaluation, and QSAR study.","Journal of medicinal chemistry","2007","50","13","2942","2950","10.1021/jm070110h","","","0.71073","MoKα","","0.1206","0.0875","","","0.2265","0.2551","","","","","","1.033","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505028","21.134","0.004","10.7258","0.0016","23.111","0.004","90","","90","","90","","5238.8","1.6","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C23 H36 Cl Cu N5 O8 -","- C23 H34 Cl Cu N5 O8 -","- C184 H272 Cl8 Cu8 N40 O64 -","8","1","","Sprague, Jennifer E.; Peng, Yijie; Fiamengo, Ashley L.; Woodin, Katrina S.; Southwick, Evan A.; Weisman, Gary R.; Wong, Edward H.; Golen, James A.; Rheingold, Arnold L.; Anderson, Carolyn J.","Synthesis, characterization and in vivo studies of Cu(II)-64-labeled cross-bridged tetraazamacrocycle-amide complexes as models of peptide conjugate imaging agents.","Journal of medicinal chemistry","2007","50","10","2527","2535","10.1021/jm070204r","","","0.71073","MoKα","","0.0712","0.0542","","","0.1303","0.1398","","","","","","1.049","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505029","6.6883","0.0013","5.6677","0.0011","27.611","0.006","90","","95.9","0.03","90","","1041.1","0.4","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H27 N3 O5 -","- C22 H27 N3 O5 -","- C44 H54 N6 O10 -","2","1","","Robins, Morris J.; Nowak, Ireneusz; Rajwanshi, Vivek K.; Miranda, Karl; Cannon, John F.; Peterson, Matt A.; Andrei, Graciela; Snoeck, Robert; De Clercq, Erik; Balzarini, Jan","Synthesis and antiviral evaluation of 6-(alkyl-heteroaryl)furo[2,3-d]pyrimidin-2(3H)-one nucleosides and analogues with ethynyl, ethenyl, and ethyl spacers at C6 of the furopyrimidine core.","Journal of medicinal chemistry","2007","50","16","3897","3905","10.1021/jm070210n","","","1.54178","CuKα","","0.0422","0.0356","","","0.0819","0.0854","","","","","","1.021","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505030","6.6665","0.0013","5.7707","0.0012","25.533","0.005","90","","95.15","0.03","90","","978.3","0.3","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H24 N2 O5 -","- C21 H24 N2 O5 -","- C42 H48 N4 O10 -","2","1","","Robins, Morris J.; Nowak, Ireneusz; Rajwanshi, Vivek K.; Miranda, Karl; Cannon, John F.; Peterson, Matt A.; Andrei, Graciela; Snoeck, Robert; De Clercq, Erik; Balzarini, Jan","Synthesis and antiviral evaluation of 6-(alkyl-heteroaryl)furo[2,3-d]pyrimidin-2(3H)-one nucleosides and analogues with ethynyl, ethenyl, and ethyl spacers at C6 of the furopyrimidine core.","Journal of medicinal chemistry","2007","50","16","3897","3905","10.1021/jm070210n","","","0.71073","MoKα","","0.0793","0.0569","","","0.1037","0.1132","","","","","","1.273","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505031","6.3428","0.0007","10.563","0.002","31.962","0.006","90","","90","","90","","2141.4","0.6","103","1","103","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C23 H32 O8 -","- C23 H32 O8 -","- C92 H128 O32 -","4","1","","Simpson, Denise S.; Katavic, Peter L.; Lozama, Anthony; Harding, Wayne W.; Parrish, Damon; Deschamps, Jeffrey R.; Dersch, Christina M.; Partilla, John S.; Rothman, Richard B.; Navarro, Hernan; Prisinzano, Thomas E.","Synthetic studies of neoclerodane diterpenes from Salvia divinorum: preparation and opioid receptor activity of salvinicin analogues.","Journal of medicinal chemistry","2007","50","15","3596","3603","10.1021/jm070393d","","","0.71073","MoKα","","0.0443","0.0414","","","0.1203","0.123","","","","","","1.007","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505032","6.135","0.002","6.77","0.003","17.17","0.007","92.3","0.03","97.87","0.03","99.35","0.03","695.6","0.5","293","2","293","2","","","","","","","","4","P 1","P 1","1","Steroid 1","Compound 1.","","- C30 H48 N2 O3 -","- C30 H48 N2 O3 -","- C30 H48 N2 O3 -","1","1","","Sauvaître, Thibault; Barlier, Mireille; Herlem, Denyse; Gresh, Nohad; Chiaroni, Angèle; Guenard, Daniel; Guillou, Catherine","New potent acetylcholinesterase inhibitors in the tetracyclic triterpene series.","Journal of medicinal chemistry","2007","50","22","5311","5323","10.1021/jm070536w","","","0.71073","MoKα","","0.057","0.0501","","","0.1343","0.1419","","","","","","1.024","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505033","8.6763","0.0005","14.897","0.0009","20.9747","0.0013","90","","90","","90","","2711","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H35 N O6 -","- C28 H35 N O6 -","- C112 H140 N4 O24 -","4","1","","Vyavahare, Vinod P.; Chakraborty, Chaitali; Maity, Biswanath; Chattopadhyay, Subrata; Puranik, Vedavati G.; Dhavale, Dilip D.","Synthesis of 1-deoxy-1-hydroxymethyl- and 1-deoxy-1-epi-hydroxymethyl castanospermine as new potential immunomodulating agents.","Journal of medicinal chemistry","2007","50","22","5519","5523","10.1021/jm070660f","","","0.71073","MoKα","","0.1195","0.0508","","","0.1051","0.1269","","","","","","0.987","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505034","7.1718","0.0007","6.9079","0.0007","10.864","0.0011","90","","107.338","0.002","90","","513.77","0.09","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C9 H17 N O4 -","- C9 H17 N O4 -","- C18 H34 N2 O8 -","2","1","","Vyavahare, Vinod P.; Chakraborty, Chaitali; Maity, Biswanath; Chattopadhyay, Subrata; Puranik, Vedavati G.; Dhavale, Dilip D.","Synthesis of 1-deoxy-1-hydroxymethyl- and 1-deoxy-1-epi-hydroxymethyl castanospermine as new potential immunomodulating agents.","Journal of medicinal chemistry","2007","50","22","5519","5523","10.1021/jm070660f","","","0.71073","MoKα","","0.0456","0.0411","","","0.1108","0.1168","","","","","","1.105","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505035","8.96","0.0002","14.8156","0.0003","6.7569","0.0002","90","","102.962","0.002","90","","874.11","0.04","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Benzo[1,2-b;4,3-b']dithiophene-4,5-dione","Benzo[1,2-b;4,3-b']dithiophene-4,5-dione","","- C10 H4 O2 S2 -","- C10 H4 O2 S2 -","- C40 H16 O8 S8 -","4","1","","Hyatt, Janice L.; Wadkins, Randy M.; Tsurkan, Lyudmila; Hicks, Latorya D.; Hatfield, M. Jason; Edwards, Carol C.; Ross, 2nd, Charles R; Cantalupo, Stephanie A.; Crundwell, Guy; Danks, Mary K.; Guy, R. Kip; Potter, Philip M.","Planarity and constraint of the carbonyl groups in 1,2-diones are determinants for selective inhibition of human carboxylesterase 1.","Journal of medicinal chemistry","2007","50","23","5727","5734","10.1021/jm0706867","","","0.71073","MoKα","","0.0686","0.0347","","","0.0903","0.1029","","","","","","0.982","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505036","23.5231","0.001","10.6395","0.0004","8.1822","0.0003","90","","90","","90","","2047.79","0.14","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","(OC-6-33)-Diamminebis(3-carboxypropanoato)dichloroplatinum(IV) diethyl ether solvate","","- C12 H26 Cl2 N2 O9 Pt -","- C12 H26 Cl2 N2 O9 Pt -","- C48 H104 Cl8 N8 O36 Pt4 -","4","1","","Reithofer, Michael R.; Valiahdi, Seied M.; Jakupec, Michael A.; Arion, Vladimir B.; Egger, Alexander; Galanski, Markus; Keppler, Bernhard K.","Novel di- and tetracarboxylatoplatinum(IV) complexes. Synthesis, characterization, cytotoxic activity, and DNA platination.","Journal of medicinal chemistry","2007","50","26","6692","6699","10.1021/jm070897b","","","0.71073","MoKα","","0.0288","0.0267","","","0.064","0.0649","","","","","","1.082","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505037","10.8951","0.001","20.05","0.002","8.6412","0.0009","90","","90.16","0.004","90","","1887.6","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-Nitro-6-(alpha-picolylamino)-7,12-dihydroindolo[3,2-d][1]benzazepine","","- C22 H17 N5 O2 -","- C22 H17 N5 O2 -","- C88 H68 N20 O8 -","4","1","","Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K.","Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy.","Journal of medicinal chemistry","2007","50","25","6343","6355","10.1021/jm701042w","","","0.71073","MoKα","","0.0679","0.0405","","","0.097","0.1102","","","","","","1.014","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505038","9.872","0.002","9.6208","0.0019","17.434","0.004","90","","104.05","0.03","90","","1606.3","0.6","100","2","100","2","","","","","","","","6","P 1 c 1","P -2yc","7","","(hapto^6^-p-Cymene)[9-pyridin-kappaN-2-yl-(E)-methylidene)amino-kappaN-7,12- dihydroindolo[3,2-d][1]benzazepin-6(5H)-one]chlororuthenium(II) chloride acetone solvate","","- C35 H36 Cl2 N4 O2 Ru -","- C35 H36 Cl2 N4 O2 Ru -","- C70 H72 Cl4 N8 O4 Ru2 -","2","1","","Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K.","Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy.","Journal of medicinal chemistry","2007","50","25","6343","6355","10.1021/jm701042w","","","0.71073","MoKα","","0.0598","0.0537","","","0.1325","0.1347","","","","","","1.164","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505039","12.2485","0.0004","12.6418","0.0005","14.3132","0.0005","95.421","0.002","108.122","0.002","118.054","0.002","1780.65","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(hapto^6^-p-Cymene){9-nitro-6-[(alpha-picolyl-kappaN)imino-kappaN]-7,12- dihydroindolo[3,2-d][1]benzazepine}chlororuthenium(II) chloride diethanol solvate","","- C36 H43 Cl2 N5 O4 Ru -","- C36 H43 Cl2 N5 O4 Ru -","- C72 H86 Cl4 N10 O8 Ru2 -","2","1","","Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K.","Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy.","Journal of medicinal chemistry","2007","50","25","6343","6355","10.1021/jm701042w","","","0.71073","MoKα","","0.0334","0.028","","","0.0682","0.0711","","","","","","1.069","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505040","9.876","0.002","9.6263","0.0019","17.46","0.004","90","","104.32","0.03","90","","1608.3","0.6","100","2","100","2","","","","","","","","6","P 1 c 1","P -2yc","7","","(hapto^6^-p-Cymene)[9-pyridin-kappaN-2-yl-(E)-methylidene)amino-kappaN-7,12- dihydroindolo[3,2-d][1]benzazepin-6(5H)-one]chloroosmium(II) chloride acetone solvate","","- C35 H36 Cl2 N4 O2 Os -","- C35 H36 Cl2 N4 O2 Os -","- C70 H72 Cl4 N8 O4 Os2 -","2","1","","Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K.","Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy.","Journal of medicinal chemistry","2007","50","25","6343","6355","10.1021/jm701042w","","","0.71073","MoKα","","0.0241","0.0219","","","0.0447","0.0453","","","","","","1.051","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505041","13.8319","0.0005","14.1376","0.0005","18.3912","0.0006","98.511","0.002","107.338","0.002","102.012","0.002","3271.8","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","(hapto^6^-p-Cymene){9-bromo-6-[(alpha-picolyl-kappaN)imino-kappaN]-7,12- dihydroindolo[3,2-d][1]benzazepine}chloroosmium(II) chloride ethanol water solvate","","- C130 H133 Br4 Cl8 N16 O3.5 Os4 -","- C130 H133 Br4 Cl8 N16 O3.5 Os4 -","- C130 H133 Br4 Cl8 N16 O3.5 Os4 -","1","0.5","","Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K.","Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy.","Journal of medicinal chemistry","2007","50","25","6343","6355","10.1021/jm701042w","","","0.71073","MoKα","","0.0815","0.0445","","","0.0961","0.1117","","","","","","1.03","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505042","12.2836","0.0004","12.6756","0.0004","14.2592","0.0006","95.491","0.002","107.998","0.002","118.072","0.002","1784.59","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(hapto^6^-p-Cymene){9-nitro-6-[(alpha-picolyl-kappaN)imino-kappaN]-7,12- dihydroindolo[3,2-d][1]benzazepine}chloroosmium(II) chloride ethanol water solvate","","- C35.9 H42.95 Cl2 N5 O4.08 Os -","- C35.9 H41.75 Cl2 N5 O4.2 Os -","- C71.8 H83.5 Cl4 N10 O8.4 Os2 -","2","1","","Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K.","Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy.","Journal of medicinal chemistry","2007","50","25","6343","6355","10.1021/jm701042w","","","0.71073","MoKα","","0.0373","0.0279","","","0.0626","0.0655","","","","","","1.039","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505043","13.958","0.0007","14.0949","0.0007","18.3531","0.0009","96.749","0.003","108.022","0.003","102.05","0.003","3292.9","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","(hapto^6^-p-Cymene){6-[(alpha-picolyl-kappaN)imino-kappaN]-7,12- dihydroindolo[3,2-d][1]benzazepine}chloroosmium(II) chloride water solvate","","- C32 H32.5 Cl2 N4 O0.25 Os -","- C32 H32 Cl2 N4 O0.25 Os -","- C128 H128 Cl8 N16 O Os4 -","4","2","","Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K.","Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy.","Journal of medicinal chemistry","2007","50","25","6343","6355","10.1021/jm701042w","","","0.71073","MoKα","","0.1199","0.0562","","","0.1623","0.1934","","","","","","1.101","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505044","10.771","0.002","25.04","0.005","13.238","0.003","90","","91.84","0.03","90","","3568.5","1.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(hapto^6^-p-Cymene){9-nitro-6-[(alpha-picolyl-kappaN)imino-kappaN]-7,12- dihydroindolo[3,2-d][1]benzazepine}chlororuthenium(II) chloride diethanol water solvate","","- C36 H45 Cl2 N5 O5 Ru -","- C36 H45 Cl2 N5 O5 Ru -","- C144 H180 Cl8 N20 O20 Ru4 -","4","1","","Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K.","Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy.","Journal of medicinal chemistry","2007","50","25","6343","6355","10.1021/jm701042w","","","0.71073","MoKα","","0.072","0.0433","","","0.0929","0.1053","","","","","","1.021","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505045","11.9998","0.0004","18.2129","0.0005","7.9427","0.0002","90","","108.075","0.002","90","","1650.22","0.08","100","2","100","2","","","","","","","","2","C 1 c 1","C -2yc","9","","","","- C26 H16 -","- C26 H15.6 -","- C104 H62.4 -","4","1","","Tong, H.; Dong, Y.; Hong, Y.; Haussler, M.; Lam, J.W.Y.; Sung, H.H.-Y.; Yu, X.; Sun, J.; Williams, I.D.; Kwok, H.S.; Tang, B.Z.","Aggregation-Induced Emission: Effects of Molecular Structure, Solid-State Conformation, and Morphological Packing Arrangement on Light-Emitting Behaviors of Diphenyldibenzofulvene Derivatives","Journal of Physical Chemistry C","2007","111","5","2287","","10.1021/jp0630828","","","0.71073","MoKα","","0.0449","0.0404","","","0.1024","0.1067","","","","","","1.057","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505046","13.263","0.003","23.046","0.005","22.945","0.005","90","","91.51","0.03","90","","7011","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C78 H75 Dy N6 O8 P2 -","- C78 H75 Dy N6 O8 P2 -","- C312 H300 Dy4 N24 O32 P8 -","4","1","","Li, Z.-F.; Zhou, L.; Yu, J.-B.; Zhang, H.-J.; Deng, R.-P.; Peng, Z.-P.; Guo, Z.-Y.","Synthesis, Structure, Photoluminescence, and Electroluminescence Properties of a New Dysprosium Complex","Journal of Physical Chemistry C","2007","111","5","2295","","10.1021/jp064749t","","","0.71073","MoKα","","0.0756","0.0461","","","0.0958","0.1154","","","","","","1.082","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505047","17.982","0.001","17.985","0.001","14.619","0.001","90","","114.33","0.01","90","","4308","0.6","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ca1.9 Mg0.17 O44.11 Si16 -","- Ca1.92 Mg0.168 O44.572 Si16 -","- Ca7.68 Mg0.672 O178.288 Si64 -","4","0.5","","Alberti, A.; Cruciani, G.; Galli, E.; Millini, R.; Zanardi, S.","In Situ X-ray Single-Crystal Study on the Dehydration Mechanism in the Monoclinic Polytype of Tschernichite, the Mineral Analog of Zeolite Beta","Journal of Physical Chemistry C","2007","111","12","4503","","10.1021/jp065145s","","","0.71073","MoKα","","0.201","0.1381","","","0.3695","0.421","","","","","","1.077","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505048","17.879","0.001","17.888","0.001","14.635","0.001","90","","114.34","0.01","90","","4264.5","0.6","353","2","353","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ca1.9 Mg0.17 O36.44 Si16 -","- Ca1.9 Mg0.18 O36.45 Si16 -","- Ca7.6 Mg0.72 O145.8 Si64 -","4","0.5","","Alberti, A.; Cruciani, G.; Galli, E.; Millini, R.; Zanardi, S.","In Situ X-ray Single-Crystal Study on the Dehydration Mechanism in the Monoclinic Polytype of Tschernichite, the Mineral Analog of Zeolite Beta","Journal of Physical Chemistry C","2007","111","12","4503","","10.1021/jp065145s","","","0.71073","MoKα","","0.2163","0.1406","","","0.3442","0.413","","","","","","1.059","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505049","17.863","0.001","17.857","0.001","14.636","0.001","90","","114.35","0.01","90","","4253.3","0.6","423","2","423","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Ca1.84 K0 Mg0.11 Na0 O33.96 Si16 -","- Ca1.814 Mg0.114 O33.884 Si16 -","- Ca7.256 Mg0.456 O135.536 Si64 -","4","0.5","","Alberti, A.; Cruciani, G.; Galli, E.; Millini, R.; Zanardi, S.","In Situ X-ray Single-Crystal Study on the Dehydration Mechanism in the Monoclinic Polytype of Tschernichite, the Mineral Analog of Zeolite Beta","Journal of Physical Chemistry C","2007","111","12","4503","","10.1021/jp065145s","","","0.71073","MoKα","","0.2441","0.1283","","","0.3344","0.4176","","","","","","1.005","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505050","17.829","0.002","17.828","0.003","14.671","0.002","90","","114.22","0.01","90","","4252.8","1.1","523","2","523","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ca1.86 Mg0.18 O32 Si16 -","- Ca1.842 Mg0.168 O32 Si16 -","- Ca7.368 Mg0.672 O128 Si64 -","4","0.5","","Alberti, A.; Cruciani, G.; Galli, E.; Millini, R.; Zanardi, S.","In Situ X-ray Single-Crystal Study on the Dehydration Mechanism in the Monoclinic Polytype of Tschernichite, the Mineral Analog of Zeolite Beta","Journal of Physical Chemistry C","2007","111","12","4503","","10.1021/jp065145s","","","0.71073","MoKα","","0.2877","0.1492","","","0.3536","0.4562","","","","","","0.972","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505051","7.9343","0.0012","8.4797","0.0013","10.2782","0.0015","103.404","0.003","99.567","0.003","111.62","0.003","600.67","0.16","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H18 N2 O3 S -","- C9 H18 N2 O3 S -","- C18 H36 N4 O6 S2 -","2","1","","Santos, C.S.; Rivera-Rubero, S.; Dibrov, S.; Baldelli, S.","Ions at the Surface of a Room-Temperature Ionic Liquid","Journal of Physical Chemistry C","2007","111","21","7682","","10.1021/jp0652751","","","0.71073","MoKα","","0.0526","0.0443","","","0.1134","0.1187","","","","","","1.044","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505052","8.624","0.015","20.82","0.04","7.967","0.014","90","","113.38","0.05","90","","1313","4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H18 N2 O4 S -","- C9 H18 N2 O4 S -","- C36 H72 N8 O16 S4 -","4","1","","Santos, C.S.; Rivera-Rubero, S.; Dibrov, S.; Baldelli, S.","Ions at the Surface of a Room-Temperature Ionic Liquid","Journal of Physical Chemistry C","2007","111","21","7682","","10.1021/jp0652751","","","0.71073","MoKα","","0.0929","0.0627","","","0.1626","0.1839","","","","","","0.959","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505053","9.588","0.002","10.322","0.003","10.861","0.003","72.139","0.005","64.783","0.005","62.722","0.005","856","0.4","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H24 Ar1.15 N2 O8 Rh2 -","- C32 H24 Ar1.16 N2 O8 Rh2 -","- C32 H24 Ar1.16 N2 O8 Rh2 -","1","0.5","","Ueda, T.; Kurokawa, K.; Eguchi, T.; Kachi-Terajima, C.; Takamizawa, S.","Local Structure and Xenon Adsorption Behavior of Metal-Organic Framework System [M2(O2CPh)4(pyz)]n (M = Rh and Cu) As Studied with Use of Single-Crystal X-ray Diffraction, Adsorption Isotherm, and Xenon-129 NMR","Journal of Physical Chemistry C","2007","111","3","1524","","10.1021/jp065321x","","","0.71073","MoKα","","0.1034","0.0606","","","0.1399","0.1777","","","","","","1.015","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505054","9.587","0.002","10.364","0.002","10.822","0.002","71.867","0.005","65.518","0.005","63.237","0.005","863.4","0.3","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H24 Kr1.51 N2 O8 Rh2 -","- C32 H24 Kr1.51 N2 O8 Rh2 -","- C32 H24 Kr1.51 N2 O8 Rh2 -","1","0.5","","Ueda, T.; Kurokawa, K.; Eguchi, T.; Kachi-Terajima, C.; Takamizawa, S.","Local Structure and Xenon Adsorption Behavior of Metal-Organic Framework System [M2(O2CPh)4(pyz)]n (M = Rh and Cu) As Studied with Use of Single-Crystal X-ray Diffraction, Adsorption Isotherm, and Xenon-129 NMR","Journal of Physical Chemistry C","2007","111","3","1524","","10.1021/jp065321x","","","0.71073","MoKα","","0.1787","0.084","","","0.1705","0.2334","","","","","","0.942","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505055","9.578","0.008","10.408","0.01","10.837","0.01","70.593","0.019","65.599","0.018","63.48","0.02","865.7","1.4","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H24 N2 O8 Rh2 Xe2 -","- C32 H24 N2 O8 Rh2 Xe2 -","- C32 H24 N2 O8 Rh2 Xe2 -","1","0.5","","Ueda, T.; Kurokawa, K.; Eguchi, T.; Kachi-Terajima, C.; Takamizawa, S.","Local Structure and Xenon Adsorption Behavior of Metal-Organic Framework System [M2(O2CPh)4(pyz)]n (M = Rh and Cu) As Studied with Use of Single-Crystal X-ray Diffraction, Adsorption Isotherm, and Xenon-129 NMR","Journal of Physical Chemistry C","2007","111","3","1524","","10.1021/jp065321x","","","0.71073","MoKα","","0.2406","0.1244","","","0.2874","0.3415","","","","","","0.921","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505056","18.396","0.004","9.702","0.002","19.188","0.004","90","","98.001","0.005","90","","3391.3","1.2","298","","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H24 Ar1.04 Cu2 N2 O8 -","- C32 H24 Ar1.02 Cu2 N2 O8 -","- C128 H96 Ar4.08 Cu8 N8 O32 -","4","0.5","","Ueda, T.; Kurokawa, K.; Eguchi, T.; Kachi-Terajima, C.; Takamizawa, S.","Local Structure and Xenon Adsorption Behavior of Metal-Organic Framework System [M2(O2CPh)4(pyz)]n (M = Rh and Cu) As Studied with Use of Single-Crystal X-ray Diffraction, Adsorption Isotherm, and Xenon-129 NMR","Journal of Physical Chemistry C","2007","111","3","1524","","10.1021/jp065321x","","","0.71073","MoKα","","0.1652","0.0685","","","0.1512","0.1924","","","","","","0.954","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505057","18.631","0.003","9.7039","0.0013","19.276","0.003","90","","99.002","0.003","90","","3442","0.9","298","","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H24 Cu2 Kr1.72 N2 O8 -","- C32 H24 Cu2 Kr1.72 N2 O8 -","- C128 H96 Cu8 Kr6.88 N8 O32 -","4","0.5","","Ueda, T.; Kurokawa, K.; Eguchi, T.; Kachi-Terajima, C.; Takamizawa, S.","Local Structure and Xenon Adsorption Behavior of Metal-Organic Framework System [M2(O2CPh)4(pyz)]n (M = Rh and Cu) As Studied with Use of Single-Crystal X-ray Diffraction, Adsorption Isotherm, and Xenon-129 NMR","Journal of Physical Chemistry C","2007","111","3","1524","","10.1021/jp065321x","","","0.71073","MoKα","","0.1696","0.0658","","","0.142","0.1805","","","","","","0.97","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505058","9.74","0.006","10.471","0.007","10.867","0.007","70.741","0.012","65.519","0.012","63.558","0.013","888.7","1","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H24 Cu2 N2 O8 Xe2 -","- C32 H24 Cu2 N2 O8 Xe2 -","- C32 H24 Cu2 N2 O8 Xe2 -","1","0.5","","Ueda, T.; Kurokawa, K.; Eguchi, T.; Kachi-Terajima, C.; Takamizawa, S.","Local Structure and Xenon Adsorption Behavior of Metal-Organic Framework System [M2(O2CPh)4(pyz)]n (M = Rh and Cu) As Studied with Use of Single-Crystal X-ray Diffraction, Adsorption Isotherm, and Xenon-129 NMR","Journal of Physical Chemistry C","2007","111","3","1524","","10.1021/jp065321x","","","0.71073","MoKα","","0.2329","0.1049","","","0.2504","0.2867","","","","","","0.969","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505059","6.8955","0.0005","5.9218","0.0005","7.2123","0.0005","90","","114.141","0.005","90","","268.75","0.04","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Cl H4 N O -","- Cl H4 N O -","- Cl4 H16 N4 O4 -","4","1","","Nelyubina, Yulia V.; Antipin, Mikhail Yu; Lyssenko, Konstantin A.","Are halide...halide contacts a feature of rock-salts only?","The journal of physical chemistry. A","2007","111","6","1091","1095","10.1021/jp066049u","","","0.71073","MoKα","","0.024","0.0176","","","0.0448","0.0489","","","","","","1","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505060","13.3063","0.0002","31.7409","0.0006","13.5077","0.0002","90","","110.924","0.0004","90","","5328.81","0.15","296.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C51 H31 Eu F18 O8 P2 -","- C51 H31 Eu F18 O8 P2 -","- C204 H124 Eu4 F72 O32 P8 -","4","1","","Nakamura, Kazuki; Hasegawa, Yasuchika; Kawai, Hideki; Yasuda, Naoki; Kanehisa, Nobuko; Kai, Yasushi; Nagamura, Toshihiko; Yanagida, Shozo; Wada, Yuji","Enhanced lasing properties of dissymmetric Eu(III) complex with bidentate phosphine ligands.","The journal of physical chemistry. A","2007","111","16","3029","3037","10.1021/jp067672h","","","0.7107","MoKα","","","0.0671","","","","0.1429","","","","","","1.247","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505061","7.1338","0.0004","14.2416","0.0008","12.8338","0.0006","90","","104.758","0.003","90","","1260.86","0.12","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H18 N2 O5 S -","- C9 H18 N2 O5 S -","- C36 H72 N8 O20 S4 -","4","1","","Nockemann, Peter; Thijs, Ben; Driesen, Kris; Janssen, Colin R.; Van Hecke, Kristof; Van Meervelt, Luc; Kossmann, Simone; Kirchner, Barbara; Binnemans, Koen","Choline saccharinate and choline acesulfamate: ionic liquids with low toxicities.","The journal of physical chemistry. B","2007","111","19","5254","5263","10.1021/jp068446a","","","1.54178","CuKα","","0.0635","0.0579","","","0.1473","0.1533","","","","","","1.063","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505062","25.654","0.003","10.4439","0.001","10.2801","0.0012","90","","90","","90","","2754.3","0.5","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H18 N2 O4 S -","- C12 H18 N2 O4 S -","- C96 H144 N16 O32 S8 -","8","1","","Nockemann, Peter; Thijs, Ben; Driesen, Kris; Janssen, Colin R.; Van Hecke, Kristof; Van Meervelt, Luc; Kossmann, Simone; Kirchner, Barbara; Binnemans, Koen","Choline saccharinate and choline acesulfamate: ionic liquids with low toxicities.","The journal of physical chemistry. B","2007","111","19","5254","5263","10.1021/jp068446a","","","1.54178","CuKα","","0.0747","0.0535","","","0.1353","0.153","","","","","","1.071","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505063","5.8915","0.0002","6.8875","0.0002","8.2113","0.0002","73.895","0.001","79.228","0.001","85.917","0.003","314.412","0.016","113","0.2","113","0.2","","","","","","","see text","4","P -1","-P 1","2","","","","- C8 H18 N4 S2 -","- C8 H18 N4 S2 -","- C8 H18 N4 S2 -","1","0.5","","Munshi, Parthapratim; Cameron, Elinor; Row, Tayur N Guru; Ferrara, Joseph D.; Cameron, T. Stanley","Investigation of inter-ion interactions in N,N,N',N'-tetramethylethylenediammonium dithiocyanate via experimental and theoretical charge density studies.","The journal of physical chemistry. A","2007","111","32","7888","7897","10.1021/jp068554x","","x-ray","0.71073","MoKα","","0.0288","0.0187","","","","0.0174","","","","","","1.6901","","","","has coordinates","191011","2020-10-21","18:00:00",""
"1505064","5.6794","0.0001","18.1714","0.0008","21.4441","0.0001","90","","96.877","0.0007","90","","2197.17","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H54 Cl6 N2 O2 -","- C42 H54 Cl6 N2 O2 -","- C84 H108 Cl12 N4 O4 -","2","0.5","","Wang, Jia; Zhao, Yunfeng; Dou, Chuandong; Sun, Hui; Xu, Peng; Ye, Kaiqi; Zhang, Jingying; Jiang, Shimei; Li, Fei; Wang, Yue","Alkyl and dendron substituted quinacridones: synthesis, structures, and luminescent properties.","The journal of physical chemistry. B","2007","111","19","5082","5089","10.1021/jp068646m","","","0.71073","MoKα","","0.2711","0.0475","","","0.1053","0.1782","","","","","","0.679","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505065","3.759","0.0008","10.307","0.002","17.29","0.004","90","","90","","90","","669.9","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C6 H7 N3 O2 -","- C6 H7 N3 O2 -","- C24 H28 N12 O8 -","4","1","","Kolev, Tsonko; Koleva, Bojidarka B.; Spiteller, Michael; Mayer-Figge, Heike; Sheldrick, William S.","2-amino-4-nitroaniline, a known compound with unexpected properties.","The journal of physical chemistry. A","2007","111","40","10084","10089","10.1021/jp068761x","","","0.71073","MoKα","","0.0471","0.0388","","","0.1037","0.1085","","","","","","1.07","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505066","10.241","0.003","10.262","0.003","12.302","0.003","96.838","0.005","94.763","0.005","98.469","0.005","1263","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H14 Cl4 N2 O10 -","- C25 H14 Cl4 N2 O10 -","- C50 H28 Cl8 N4 O20 -","2","1","","Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K.","Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads.","The journal of physical chemistry. B","2007","111","24","6655","6666","10.1021/jp068994o","","","0.71073","MoKα","","0.0906","0.0538","","","0.1158","0.1282","","","","","","0.926","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505067","10.188","0.003","10.745","0.003","10.888","0.003","72.261","0.006","66.57","0.006","83.284","0.006","1041.6","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H21 Cl N O7 -","- C22 H21 Cl N O7 -","- C44 H42 Cl2 N2 O14 -","2","1","","Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K.","Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads.","The journal of physical chemistry. B","2007","111","24","6655","6666","10.1021/jp068994o","","","0.71073","MoKα","","0.2275","0.0485","","","0.0738","0.1083","","","","","","0.629","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505068","10.422","0.003","10.711","0.003","10.787","0.003","87.701","0.007","74.392","0.006","89.976","0.007","1158.7","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H16 Cl4 N2 O6 -","- C21 H16 Cl4 N2 O6 -","- C42 H32 Cl8 N4 O12 -","2","1","","Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K.","Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads.","The journal of physical chemistry. B","2007","111","24","6655","6666","10.1021/jp068994o","","","0.71073","MoKα","","0.1646","0.0856","","","0.1347","0.1499","","","","","","1.184","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505069","6.5845","0.0015","5.2356","0.0012","9.99","0.002","90","","95.582","0.004","90","","342.76","0.13","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C8 H6 O4 -","- C8 H6 O4 -","- C16 H12 O8 -","2","0.5","","Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K.","Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads.","The journal of physical chemistry. B","2007","111","24","6655","6666","10.1021/jp068994o","","","0.71073","MoKα","","0.0455","0.0425","","","0.1193","0.1223","","","","","","1.051","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505070","7.982","0.0015","7.9976","0.0016","10.609","0.002","96.96","0.003","107.75","0.003","110.499","0.003","584.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H6 Cl6 O4 Sb -","- C8 H6 Cl6 O4 Sb -","- C16 H12 Cl12 O8 Sb2 -","2","1","","Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K.","Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads.","The journal of physical chemistry. B","2007","111","24","6655","6666","10.1021/jp068994o","","","0.71073","MoKα","","0.0686","0.0641","","","0.2027","0.2067","","","","","","1.128","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505071","5.8509","0.0009","6.7912","0.001","7.6199","0.0012","75.221","0.003","85.481","0.003","79.402","0.003","287.6","0.08","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C12 H14 O4 -","- C12 H14 O4 -","- C12 H14 O4 -","1","0.5","","Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K.","Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads.","The journal of physical chemistry. B","2007","111","24","6655","6666","10.1021/jp068994o","","","0.71073","MoKα","","0.0611","0.0579","","","0.1997","0.2011","","","","","","1.33","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505072","7.8863","0.0013","14.082","0.002","14.387","0.002","113.899","0.003","101.326","0.003","91.302","0.003","1423","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H22 Cl6 N0 O4 Sb -","- C19 H22 Cl6 O4 Sb -","- C38 H44 Cl12 O8 Sb2 -","2","1","","Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K.","Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads.","The journal of physical chemistry. B","2007","111","24","6655","6666","10.1021/jp068994o","","","0.71073","MoKα","","0.0444","0.0339","","","0.066","0.0683","","","","","","0.911","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505073","10.448","0.005","8.208","0.004","17.462","0.008","90","","95.726","0.01","90","","1490","1.2","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 N6 -","- C16 H16 N6 -","- C64 H64 N24 -","4","1","","Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K.","Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads.","The journal of physical chemistry. B","2007","111","24","6655","6666","10.1021/jp068994o","","","0.71073","MoKα","","0.1267","0.0588","","","0.128","0.1477","","","","","","0.891","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505074","20.069","0.004","6.8937","0.0014","20.918","0.004","90","","115","0.03","90","","2622.9","1.1","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","{[(o-C6F4Hg)3][C10H7Cl]}","","","- C28 H7 Cl F12 Hg3 -","- C28 H7 Cl F12 Hg3 -","- C112 H28 Cl4 F48 Hg12 -","4","1","","Elbjeirami, O.; Burress, C.N.; Gabbai, F.P.; Omary, M.A.","Simultaneous External and Internal Heavy-Atom Effects in Binary Adducts of 1-Halonaphthalenes with Trinuclear Perfluoro-ortho-phenylene Mercury(II): A Structural and Photophysical Study","Journal of Physical Chemistry C","2007","111","26","9522","","10.1021/jp070110t","","","0.71073","MoKα","","0.0561","0.0435","","","0.1014","0.1092","","","","","","1","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505075","7.5525","0.0015","15.968","0.003","22.542","0.005","88.35","0.03","85","0.03","86.94","0.03","2703.5","1","273","2","273","2","","","","","","","","5","P -1","-P 1","2","{[(o-C6F4Hg)3][C10H7Br]}","","","- C28 H7 Br F12 Hg3 -","- C28 H7 Br F12 Hg3 -","- C112 H28 Br4 F48 Hg12 -","4","2","","Elbjeirami, O.; Burress, C.N.; Gabbai, F.P.; Omary, M.A.","Simultaneous External and Internal Heavy-Atom Effects in Binary Adducts of 1-Halonaphthalenes with Trinuclear Perfluoro-ortho-phenylene Mercury(II): A Structural and Photophysical Study","Journal of Physical Chemistry C","2007","111","26","9522","","10.1021/jp070110t","","","0.71073","MoKα","","0.0599","0.0433","","","0.0993","0.1245","","","","","","1.004","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505076","15.993","0.003","7.5544","0.0015","22.787","0.005","90","","98.43","0.03","90","","2723.3","1","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","{[(o-C6F4Hg)3][C10H7I]}","","","- C28 H7 F12 Hg3 I -","- C28 H7 F12 Hg3 I -","- C112 H28 F48 Hg12 I4 -","4","1","","Elbjeirami, O.; Burress, C.N.; Gabbai, F.P.; Omary, M.A.","Simultaneous External and Internal Heavy-Atom Effects in Binary Adducts of 1-Halonaphthalenes with Trinuclear Perfluoro-ortho-phenylene Mercury(II): A Structural and Photophysical Study","Journal of Physical Chemistry C","2007","111","26","9522","","10.1021/jp070110t","","","0.71073","MoKα","","0.0853","0.0577","","","0.108","0.1183","","","","","","1.003","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505077","44.525","0.002","6.2063","0.0003","19.6664","0.0009","90","","92.087","0.003","90","","5430.9","0.4","296","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C33 H32 O S2 -","- C33 H32 O S2 -","- C264 H256 O8 S16 -","8","1","","Liu, Y.; Tao, X.; Wang, F.; Shi, J.; Sun, J.; Yu, W.; Ren, Y.; Zou, D.; Jiang, M.","Intermolecular Hydrogen Bonds Induce Highly Emissive Excimers: Enhancement of Solid-State Luminescence","Journal of Physical Chemistry C","2007","111","17","6544","","10.1021/jp070288f","","","0.71073","MoKα","","0.2546","0.0883","","","0.1547","0.1952","","","","","","1.098","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505078","9.7418","0.0014","9.7418","0.0014","9.7418","0.0014","90","","90","","90","","924.5","0.2","223","2","223","2","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","closo-1-phospha-7-carbadodecaborane","","- C H11 B10 P -","- C0.99996 H11 B9.99996 P0.99996 -","- C3.99984 H44.0002 B39.9998 P3.99984 -","4","0.166667","","Balaz, Snjezana; Caruso, A. N.; Platt, N. P.; Dimov, D. I.; Boag, N. M.; Brand, J. I.; Losovyj, Ya B.; Dowben, P. A.","The influence of the molecular dipole on the electronic structure of isomeric icosahedral dicarbadodecaborane and phosphacarbadodecaborane molecular films.","The journal of physical chemistry. B","2007","111","25","7009","7016","10.1021/jp0703760","","","0.71073","MoKα","","0.0545","0.0445","","","0.1288","0.1369","","","","","","1.141","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505079","34.527","0.005","10.543","0.005","29.876","0.005","90","0.005","123.54","0.005","90","0.005","9065","5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H54 N4 O11 S2 -","- C45 H54 N4 O11 S2 -","- C360 H432 N32 O88 S16 -","8","1","","Yuan, C.-X.; Tao, X.-T.; Ren, Y.; Li, Y.; Yang, J.-X.; Yu, W.-T.; Wang, L.; Jiang, M.-H.","Synthesis, Structure, and Aggregation-Induced Emission of a Novel Lambda (Λ)-Shaped Pyridinium Salt Based on Tröger's Base","Journal of Physical Chemistry C","2007","111","34","12811","","10.1021/jp0711601","","","0.71069","MoKα","","0.1223","0.0742","","","0.2197","0.2545","","","","","","1.048","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505080","12.069","0.003","12.069","0.003","12.069","0.003","90","","90","","90","","1758","0.8","173","2","173","2","","","","","","","","3","P m -3 n","-P 4n 2 3","223","Trimethylene oxide hydrate","","","- C3 H21.33 O8.67 -","- C3.12 H21.5733 O8.70667 -","- C18.72 H129.44 O52.24 -","6","0.125","","Udachin, Konstantin A.; Ratcliffe, Christopher I.; Ripmeester, John A.","Structure, dynamics and ordering in structure i ether clathrate hydrates from single-crystal X-ray diffraction and 2H NMR spectroscopy.","The journal of physical chemistry. B","2007","111","39","11366","11372","10.1021/jp071342v","","","0.7107","MoKα","","0.0182","0.0138","","","0.0375","0.0386","","","","","","1.238","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505081","11.9454","0.0019","11.9454","0.0019","11.9454","0.0019","90","","90","","90","","1704.5","0.5","173","2","173","2","","","","","","","","3","P m -3 n","-P 4n 2 3","223","Ehyleneoxide hydrate","","","- C2.28 H19.9 O8.81 -","- C2.4 H20.6133 O8.86667 -","- C14.4 H123.68 O53.2 -","6","0.125","","Udachin, Konstantin A.; Ratcliffe, Christopher I.; Ripmeester, John A.","Structure, dynamics and ordering in structure i ether clathrate hydrates from single-crystal X-ray diffraction and 2H NMR spectroscopy.","The journal of physical chemistry. B","2007","111","39","11366","11372","10.1021/jp071342v","","","0.71073","MoKα","","0.0237","0.0125","","","0.0349","0.0456","","","","","","0.58","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505082","9.9567","0.0007","7.9025","0.0005","15.4975","0.0012","90","","102.025","0.004","90","","1192.63","0.15","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H38 N2 O Si -","- C25 H38 N2 O Si -","- C50 H76 N4 O2 Si2 -","2","1","","Busygin, I.; Tkachenko, O.P.; Nieminen, V.; Borokov, V.Yu.; Sillanpaa, R.; Toukoniitty, E.; Kustov, L.M.; Murzin, D.Yu.; Leino, R.","Interaction of Cinchonidine and 1-Phenyl-1,2-Propanedione on the Surface of a Chirally Modified Pt/Al2O3 Hydrogenation Catalyst","Journal of Physical Chemistry C","2007","111","26","9374","","10.1021/jp071818a","","x-ray","0.71073","MoKα","","0.104","0.0706","","","0.1184","0.1331","","","","","","1.118","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505083","9.9439","0.0001","11.0047","0.0001","13.9991","0.0004","90","","97.908","0.0019","90","","1517.35","0.05","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H44 N2 O2 -","- C36 H44 N2 O2 -","- C72 H88 N4 O4 -","2","0.5","","Wang, J.; Zhao, Y.; Zhang, J.; Zhang, J.; Yang, B.; Wang, Y.; Zhang, D.; You, H.; Ma, D.","Assembly of One-Dimensional Organic Luminescent Nanowires Based on Quinacridone Derivatives","Journal of Physical Chemistry C","2007","111","26","9177","","10.1021/jp072488x","","","0.71073","MoKα","","0.0831","0.0606","","","0.1873","0.1989","","","","","","1.057","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505084","16.53","0.006","20.372","0.009","31.649","0.009","89.77","0.02","79.83","0.02","89.14","0.02","10489","7","93","2","93","2","","","","","","","","8","P -1","-P 1","2","","","","- C190 H175 Au25 Cl2 F12 P10 S5 Sb2 -","- C190 H175 Au25 Cl2 F12 P10 S5 Sb2 -","- C380 H350 Au50 Cl4 F24 P20 S10 Sb4 -","2","1","","Shichibu, Y.; Negishi, Y.; Watanabe, T.; Chaki, N.K.; Kawaguchi, H.; Tsukuda, T.","Biicosahedral Gold Clusters [Au25(PPh3)10(SCnH2n+1)5Cl2]2+ (n = 2-18): A Stepping Stone to Cluster-Assembled Materials","Journal of Physical Chemistry C","2007","111","22","7845","","10.1021/jp073101t","","","0.7107","MoKα","","0.205","0.1717","","","0.3858","0.4029","","","","","","1.077","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505085","9.6751","0.0012","10.2214","0.0012","10.6522","0.0013","90","","96.993","0.002","90","","1045.6","0.2","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C28 H24 O2 -","- C28 H24 O2 -","- C56 H48 O4 -","2","1","","Tong, Hui; Hong, Yuning; Dong, Yongqiang; Häussler, Matthias; Li, Zhen; Lam, Jacky W. Y.; Dong, Yuping; Sung, Herman H.-Y.; Williams, Ian D.; Tang, Ben Zhong","Protein detection and quantitation by tetraphenylethene-based fluorescent probes with aggregation-induced emission characteristics.","The journal of physical chemistry. B","2007","111","40","11817","11823","10.1021/jp073147m","","","0.71073","MoKα","","0.0498","0.0392","","","0.0891","0.0949","","","","","","1.012","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505086","8.1775","0.0005","11.2472","0.0006","11.474","0.0006","90","","100.745","0.001","90","","1036.81","0.1","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","tetramethylimidazolidinium dichloride","","","- C7 H18 Cl2 N2 -","- C7 H18 Cl2 N2 -","- C28 H72 Cl8 N8 -","4","1","","Regler, Brian P.; Emge, Thomas J.; Elliott, James J.; Sauers, Ronald R.; Potenza, Joseph A.; Romsted, Laurence S.","Structural, infrared, and density functional theory studies of N,N,N',N'-Tetramethylimidazolidinium dichloride: a model for cation-anion association of headgroups and counterions in the interfacial regions of gemini micelles.","The journal of physical chemistry. B","2007","111","49","13668","13674","10.1021/jp073260c","","","0.71073","MoKα","","0.0247","0.0223","","","0.0567","0.0578","","","","","","1.006","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505087","8.3743","0.0006","12.0821","0.0008","9.6014","0.0008","90","","104.59","0.007","90","","940.13","0.12","140","2","140","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H11 I N2 O -","- C6 H11 I N2 O -","- C24 H44 I4 N8 O4 -","4","1","","Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J.","Revisiting ether-derivatized imidazolium-based ionic liquids.","The journal of physical chemistry. B","2007","111","34","10095","10108","10.1021/jp073419l","","","0.71073","MoKα","","0.0276","0.0249","","","0.0636","0.0647","","","","","","1.049","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505088","9.4059","0.0005","16.3399","0.0009","13.6066","0.0007","90","","91.547","0.004","90","","2090.46","0.19","140","2","140","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H13 I N2 O -","- C7 H13 I N2 O -","- C56 H104 I8 N16 O8 -","8","2","","Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J.","Revisiting ether-derivatized imidazolium-based ionic liquids.","The journal of physical chemistry. B","2007","111","34","10095","10108","10.1021/jp073419l","","","0.71073","MoKα","","0.0334","0.0281","","","0.0717","0.0735","","","","","","1.02","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505089","15.2411","0.0014","8.2598","0.0007","32.681","0.002","90","","90","","90","","4114.2","0.6","140","2","140","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C7 H13 I N2 O -","- C7 H13 I N2 O -","- C112 H208 I16 N32 O16 -","16","4","","Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J.","Revisiting ether-derivatized imidazolium-based ionic liquids.","The journal of physical chemistry. B","2007","111","34","10095","10108","10.1021/jp073419l","","","0.71073","MoKα","","0.0722","0.0558","","","0.119","0.1313","","","","","","1.022","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505090","9.5223","0.0005","8.0828","0.0004","15.406","0.0012","90","","106.029","0.005","90","","1139.65","0.12","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H15 I N2 O2 -","- C8 H15 I N2 O2 -","- C32 H60 I4 N8 O8 -","4","1","","Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J.","Revisiting ether-derivatized imidazolium-based ionic liquids.","The journal of physical chemistry. B","2007","111","34","10095","10108","10.1021/jp073419l","","","0.71073","MoKα","","0.0164","0.0134","","","0.027","0.0285","","","","","","1.135","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505091","7.155","0.0012","14.609","0.003","11.88","0.003","90","","105.698","0.016","90","","1195.5","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H17 Br N2 O2 -","- C9 H17 Br N2 O2 -","- C36 H68 Br4 N8 O8 -","4","1","","Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J.","Revisiting ether-derivatized imidazolium-based ionic liquids.","The journal of physical chemistry. B","2007","111","34","10095","10108","10.1021/jp073419l","","","0.71073","MoKα","","0.0985","0.0583","","","0.1207","0.1378","","","","","","1.155","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505092","9.7948","0.0013","13.0859","0.0012","9.9372","0.0014","90","","103.711","0.012","90","","1237.4","0.3","140","2","140","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H17 I N2 O2 -","- C9 H17 I N2 O2 -","- C36 H68 I4 N8 O8 -","4","1","","Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J.","Revisiting ether-derivatized imidazolium-based ionic liquids.","The journal of physical chemistry. B","2007","111","34","10095","10108","10.1021/jp073419l","","","0.71073","MoKα","","0.0578","0.0498","","","0.1355","0.14","","","","","","1.166","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505093","9.2803","0.0019","18.613","0.002","15.189","0.002","90","","93.9","0.02","90","","2617.6","0.7","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H52 N4 O16 Re4 -","- C48 H52 N4 O16 Re4 -","- C96 H104 N8 O32 Re8 -","2","0.5","","Thanasekaran, P.; Wu, Jing-Yun; Manimaran, Bala; Rajendran, T.; Chang, I-Jy; Rajagopal, S.; Lee, Gene-Hsiang; Peng, Shie-Ming; Lu, Kuang-Lieh","Aggregate of alkoxy-bridged Re(I)-rectangles as a probe for photoluminescence quenching.","The journal of physical chemistry. A","2007","111","43","10953","10960","10.1021/jp0742315","","","0.71073","MoKα","","0.0627","0.0307","","","0.0712","0.0786","","","","","","1.036","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505094","11.4616","0.0006","12.8653","0.0007","14.7649","0.0007","97.696","0.004","98.263","0.004","114.376","0.005","1916.9","0.2","110","","110","","","","","","","","","2","P -1","-P 1","2","","","","- C32 H16 -","- C32 H16 -","- C128 H64 -","4","2","","Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T.","Enantiotropic Polymorphism in Di-indenoperylene","Journal of Physical Chemistry C","2007","111","51","18878","","10.1021/jp0748967","","","0.71073","MoKα","","0.1","0.0426","","0.1051","0.0959","0.1051","","","","","","0.3918","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505095","11.5164","0.0006","12.9066","0.0007","14.8197","0.0007","97.872","0.004","98.19","0.004","114.443","0.005","1937.4","0.2","293","","200","","","","","","","","","2","P -1","-P 1","2","","","","- C32 H16 -","- C32 H16 -","- C128 H64 -","4","2","","Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T.","Enantiotropic Polymorphism in Di-indenoperylene","Journal of Physical Chemistry C","2007","111","51","18878","","10.1021/jp0748967","","","0.71073","MoKα","","0.1134","0.0358","","0.073","0.0678","0.073","","","","","","0.437","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505096","11.5824","0.0006","12.9617","0.0007","14.8812","0.0007","98.128","0.004","98.091","0.004","114.516","0.005","1962.3","0.2","298","","298","","","","","","","","","2","P -1","-P 1","2","","","","- C32 H16 -","- C32 H16 -","- C128 H64 -","4","2","","Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T.","Enantiotropic Polymorphism in Di-indenoperylene","Journal of Physical Chemistry C","2007","111","51","18878","","10.1021/jp0748967","","","0.71073","MoKα","","0.1178","0.0335","","0.0684","0.0646","0.0684","","","","","","0.4942","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505097","11.6284","0.0008","12.9916","0.0009","14.9311","0.0009","98.294","0.005","98.05","0.005","114.543","0.007","1979.7","0.3","363","","363","","","","","","","","","2","P -1","-P 1","2","","","","- C32 H16 -","- C32 H16 -","- C128 H64 -","4","2","","Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T.","Enantiotropic Polymorphism in Di-indenoperylene","Journal of Physical Chemistry C","2007","111","51","18878","","10.1021/jp0748967","","","0.71073","MoKα","","0.1182","0.0347","","0.0695","0.0664","0.0695","","","","","","0.5634","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505098","11.6432","0.0008","13.0004","0.0009","14.948","0.001","98.36","0.006","98.042","0.006","114.545","0.007","1985.2","0.3","383","","383","","","","","","","","","2","P -1","-P 1","2","","","","- C32 H16 -","- C32 H16 -","- C128 H64 -","4","2","","Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T.","Enantiotropic Polymorphism in Di-indenoperylene","Journal of Physical Chemistry C","2007","111","51","18878","","10.1021/jp0748967","","","0.71073","MoKα","","0.1134","0.0285","","0.0524","0.049","0.0524","","","","","","0.4954","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505099","11.6592","0.0008","13.0102","0.0009","14.9663","0.001","98.44","0.006","98.023","0.006","114.548","0.007","1991.3","0.3","403","","403","","","","","","","","","2","P -1","-P 1","2","","","","- C32 H16 -","- C32 H16 -","- C128 H64 -","4","2","","Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T.","Enantiotropic Polymorphism in Di-indenoperylene","Journal of Physical Chemistry C","2007","111","51","18878","","10.1021/jp0748967","","","0.71073","MoKα","","0.1927","0.0354","","0.131","0.0872","0.131","","","","","","1.324","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505100","7.1709","0.0008","8.5496","0.0009","16.7981","0.0018","90","","92.416","0.011","90","","1028.95","0.19","423","","423","","","","","","","","","2","P 1 21/a 1","-P 2yab","14","","","","- C32 H16 -","- C32 H16 -","- C64 H32 -","2","0.5","","Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T.","Enantiotropic Polymorphism in Di-indenoperylene","Journal of Physical Chemistry C","2007","111","51","18878","","10.1021/jp0748967","","","0.71073","MoKα","","0.2571","0.0327","","0.1088","0.0598","0.1088","","","","","","1.199","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505101","9.2737","0.0006","12.4464","0.0008","14.1679","0.0009","94.581","0.001","107.837","0.001","110.335","0.001","1427.54","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","7,7-bis(4-bromoanilino)-8,8-dicyanoquinodimethane","7,7-bis(4-bromoanilino)-8,8-dicyanoquinodimethane","","- C28 H14 Br2 N6 O2 -","- C28 H14 Br2 N6 O2 -","- C56 H28 Br4 N12 O4 -","2","1","","Patra, A.; Hebalkar, N.; Sreedhar, B.; Radhakrishnan, T.P.","Formation and Growth of Molecular Nanocrystals Probed by their Optical Properties","Journal of Physical Chemistry C","2007","111","44","16184","","10.1021/jp075103j","","","0.71073","MoKα","","0.0466","0.0368","","","0.1003","0.1063","","","","","","1.046","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505102","19.194","0.004","11.297","0.002","10.366","0.002","90","","95.35","0.03","90","","2237.9","0.8","150","2","150","2","","","","","","","Synthesized by the authors. See text","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 N2 S2 -","- C12 H8 N2 S2 -","- C96 H64 N16 S16 -","8","2","","Dufresne, Stéphane; Hanan, Garry S.; Skene, W. G.","Preparation, photophysics, and electrochemistry of segmented comonomers consisting of thiophene and pyrimidine units: new monomers for hybrid copolymers.","The journal of physical chemistry. B","2007","111","39","11407","11418","10.1021/jp075259j","","","1.54178","CuKα","","0.0451","0.039","","","0.1088","0.1123","","","","","","1.061","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505103","10.9541","0.0003","7.5673","0.0002","14.1753","0.0003","90","","101.63","0.002","90","","1150.91","0.05","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C2 H10 N8 O6 S2 Zn -","- C2 H10 N8 O6 S2 Zn -","- C8 H40 N32 O24 S8 Zn4 -","4","0.5","","Novaković, Sladjana B; Bogdanović, Goran A; Fraisse, Bernard; Ghermani, Nour Eddine; Bouhmaida, Nouzha; Spasojević-de Biré, Anne","Topological features of both electron density and electrostatic potential in the bis(thiosemicarbazide)zinc(II) dinitrate complex.","The journal of physical chemistry. A","2007","111","51","13492","13505","10.1021/jp075456i","","","0.71073","MoKα","","0.0189","0.0189","","","0.044","0.044","","","","","","1.03","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505104","20.0578","0.0004","19.9466","0.0004","13.407","0.0003","90","","90","","90","","5363.94","0.19","293","","293","","","","","","","","reaction solution","5","P n m a","-P 2ac 2n","62","TPA-Silicalite-1","catena-(octatetraconta-oxa-tricosa-silicon tetra-n-propyl-ammonium hydroxide)","","- C12 H29 N O49 Si24 -","- C12 N O49 Si24 -","- C48 N4 O196 Si96 -","4","0.5","","Schmidt, Wolfgang; Wilczok, Ursula; Weidenthaler, Claudia; Medenbach, Olaf; Goddard, Richard; Buth, Gernot; Cepak, Alexander","Preparation and morphology of pyramidal MFI single-crystal segments.","The journal of physical chemistry. B","2007","111","48","13538","13543","10.1021/jp075934p","","","1.54188","CuKα","","0.1166","0.0663","","","0.1826","0.2308","","","","","","0.993","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505105","20.0837","0.0009","19.97","0.0009","13.4146","0.0004","90","","90","","90","","5380.2","0.4","293","","293","","","","","","","","reaction solution","5","P n m a","-P 2ac 2n","62","TPA ZSM-5","tetra-n-propyl-ammonium hydroxide tecto-alumosilicate","","- C12 H29 N O49 Si24 -","- C12 N O49 Si24 -","- C48 N4 O196 Si96 -","4","0.5","","Schmidt, Wolfgang; Wilczok, Ursula; Weidenthaler, Claudia; Medenbach, Olaf; Goddard, Richard; Buth, Gernot; Cepak, Alexander","Preparation and morphology of pyramidal MFI single-crystal segments.","The journal of physical chemistry. B","2007","111","48","13538","13543","10.1021/jp075934p","","","0.71073","MoKα","","0.1739","0.0819","","","0.1746","0.218","","","","","","1.018","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505106","13.382","0.003","20.125","0.005","19.89","0.005","90","","90.547","0.006","90","","5356","2","293","","293","","","","","","","","reaction solution","2","P 1 21/n 1","-P 2yn","14","ZSM-5","catena-(alumosilicate)","","- O2 Si -","- O2 Si -","- O192 Si96 -","96","24","","Schmidt, Wolfgang; Wilczok, Ursula; Weidenthaler, Claudia; Medenbach, Olaf; Goddard, Richard; Buth, Gernot; Cepak, Alexander","Preparation and morphology of pyramidal MFI single-crystal segments.","The journal of physical chemistry. B","2007","111","48","13538","13543","10.1021/jp075934p","","","0.8","synchrotronradiation","","0.0911","0.0723","","","0.176","0.184","","","","","","1.212","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505107","8.2498","0.0004","8.4731","0.0003","11.977","0.0005","94.3739","0.0016","104.872","0.0019","110.386","0.002","745.69","0.06","220","2","220","2","","","","","","","Synthesized by the authors. See text","3","P -1","-P 1","2","","","","- C14 H18 O7 -","- C14 H18 O7 -","- C28 H36 O14 -","2","1","","Nath, K.G.; Ivasenko, O.; MacLeod, J.M.; Miwa, J.A.; Wuest, J.D.; Nanci, A.; Perepichka, D.F.; Rosei, F.","Crystal Engineering in Two Dimensions: An Approach to Molecular Nanopatterning","Journal of Physical Chemistry C","2007","111","45","16996","","10.1021/jp0762774","","","1.54178","CuKα","","0.0363","0.035","","","0.1001","0.1018","","","","","","1.062","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505108","9.0542","0.0006","9.0561","0.0007","9.2927","0.0009","63.157","0.004","88.488","0.004","83.962","0.004","675.9","0.1","220","2","220","2","","","","","","","Synthesized by the authors. See text","3","P -1","-P 1","2","","","","- C13 H16 O7 -","- C13 H16 O7 -","- C26 H32 O14 -","2","1","","Nath, K.G.; Ivasenko, O.; MacLeod, J.M.; Miwa, J.A.; Wuest, J.D.; Nanci, A.; Perepichka, D.F.; Rosei, F.","Crystal Engineering in Two Dimensions: An Approach to Molecular Nanopatterning","Journal of Physical Chemistry C","2007","111","45","16996","","10.1021/jp0762774","","","1.54178","CuKα","","0.0547","0.0533","","","0.2216","0.2237","","","","","","1.192","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505109","8.2763","0.0004","8.6205","0.0004","11.993","0.0005","104.199","0.003","93.133","0.002","110.892","0.002","765.37","0.06","220","2","220","2","","","","","","","Synthesized by the authors. See text","3","P -1","-P 1","2","","","","- C15 H20 O7 -","- C15 H20 O7 -","- C30 H40 O14 -","2","1","","Nath, K.G.; Ivasenko, O.; MacLeod, J.M.; Miwa, J.A.; Wuest, J.D.; Nanci, A.; Perepichka, D.F.; Rosei, F.","Crystal Engineering in Two Dimensions: An Approach to Molecular Nanopatterning","Journal of Physical Chemistry C","2007","111","45","16996","","10.1021/jp0762774","","","1.54178","CuKα","","0.0662","0.0548","","","0.147","0.1565","","","","","","1.038","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505110","6.062","0.0013","8.22","0.0018","14.48","0.003","85.41","0.004","89.54","0.004","83.89","0.004","715.1","0.3","183","2","183","2","","","","","","","","3","P -1","-P 1","2","","","","- C36 H22 F10 -","- C36 H22 F10 -","- C36 H22 F10 -","1","0.5","","Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki","Fluorinated diphenylpolyenes: crystal structures and emission properties.","The journal of physical chemistry. A","2007","111","51","13441","13451","10.1021/jp0766104","","","0.71069","MoKα","","0.0704","0.0489","","","0.1385","0.1622","","","","","","0.923","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505111","9.582","0.004","11.523","0.005","12.89","0.005","85.425","0.008","84.296","0.009","75.81","0.008","1370.7","1","183","2","183","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H14 F2 -","- C18 H14 F2 -","- C72 H56 F8 -","4","2","","Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki","Fluorinated diphenylpolyenes: crystal structures and emission properties.","The journal of physical chemistry. A","2007","111","51","13441","13451","10.1021/jp0766104","","","0.71073","MoKα","","0.1948","0.0663","","","0.1169","0.1642","","","","","","0.928","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505112","6.752","0.003","7.414","0.003","7.515","0.003","85.677","0.008","73.17","0.008","79.341","0.007","353.8","0.3","183","2","183","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H12 F4 -","- C18 H12 F4 -","- C18 H12 F4 -","1","0.5","","Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki","Fluorinated diphenylpolyenes: crystal structures and emission properties.","The journal of physical chemistry. A","2007","111","51","13441","13451","10.1021/jp0766104","","","0.71069","MoKα","","0.0863","0.0605","","","0.1621","0.1844","","","","","","1.079","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505113","6.9822","0.0008","7.2167","0.0009","7.3338","0.0009","88.901","0.002","79.877","0.002","77.54","0.002","355.15","0.07","183","2","183","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H10 F6 -","- C18 H10 F6 -","- C18 H10 F6 -","1","0.5","","Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki","Fluorinated diphenylpolyenes: crystal structures and emission properties.","The journal of physical chemistry. A","2007","111","51","13441","13451","10.1021/jp0766104","","","0.71073","MoKα","","0.0497","0.0483","","","0.1321","0.1352","","","","","","1.085","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505114","5.9392","0.0013","8.1021","0.0018","8.5594","0.0019","80.335","0.003","78.54","0.004","73.542","0.004","384.39","0.15","183","2","183","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H6 F10 -","- C18 H6 F10 -","- C18 H6 F10 -","1","0.5","","Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki","Fluorinated diphenylpolyenes: crystal structures and emission properties.","The journal of physical chemistry. A","2007","111","51","13441","13451","10.1021/jp0766104","","","0.71073","MoKα","","0.0462","0.0422","","","0.1446","0.1492","","","","","","1.134","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505115","6.0911","0.0018","8.179","0.003","14.72","0.005","78.667","0.005","87.639","0.005","83.47","0.006","714.2","0.4","183","2","183","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H11 F5 -","- C18 H11 F5 -","- C36 H22 F10 -","2","1","","Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki","Fluorinated diphenylpolyenes: crystal structures and emission properties.","The journal of physical chemistry. A","2007","111","51","13441","13451","10.1021/jp0766104","","","0.71073","MoKα","","0.1188","0.0655","","","0.165","0.191","","","","","","1.016","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505116","8.2269","0.0005","15.4634","0.001","11.0881","0.0007","90","","99.872","0.005","90","","1389.7","0.15","100","2","100","2","","","101.325","","","","Synthesis in Lab","5","P 1 21 1","P 2yb","4","","3-[((2,6-Bis{3,5-bistrifluoromethylphenyl}phenyl)amino)methylene] -1,1,1,5,5,5-hexafluoropentane-2,4-dione","","- C28 H11 F18 N O2 -","- C28 H11 F17.88 N O2 -","- C56 H22 F35.76 N2 O4 -","2","1","","Yu, Sze-Man; Berkefeld, Andreas; Göttker-Schnetmann, Inigo; Müller, Gerhard; Mecking, Stefan","Synthesis of Aqueous Polyethylene Dispersions with Electron-Deficient Neutral Nickel(II) Catalysts with Enolatoimine Ligands","Macromolecules","2007","40","3","421","","10.1021/ma061804n","","","0.71073","MoKα","","0.0525","0.0472","","","0.1191","0.1223","","","","","","1.037","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505117","10.152","0.003","11.566","0.006","17.265","0.007","99.561","0.017","90.613","0.017","110.05","0.02","1872.9","1.4","123.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C21 H14 B I2 N O -","- C21 H14 B I2 N O -","- C84 H56 B4 I8 N4 O4 -","4","2","","Nagata, Yuuya; Chujo, Yoshiki","Main-Chain-Type Organoboron Quinolate Polymers: Synthesis and Photoluminescence Properties","Macromolecules","2007","40","1","6","","10.1021/ma062007s","","","0.71075","MoKα","","","0.0497","","","","0.0903","","","","","","1.046","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505118","11.4152","0.0007","26.7147","0.0015","11.664","0.0007","90","","104.492","0.001","90","","3443.8","0.4","187","2","187","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H55 Al N2 O2 -","- C36 H55 Al N2 O2 -","- C144 H220 Al4 N8 O8 -","4","1","","Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin","Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity","Macromolecules","2007","40","6","1904","","10.1021/ma062194u","","","0.71073","MoKα","","0.1021","0.0607","","","0.1275","0.147","","","","","","0.988","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505119","28.122","0.002","10.3119","0.0008","18.5167","0.0014","90","","124.053","0.001","90","","4448.9","0.6","187","2","187","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24.5 H29 Al N2 O2 -","- C24.5 H27 Al N2 O2 -","- C196 H216 Al8 N16 O16 -","8","1","","Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin","Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity","Macromolecules","2007","40","6","1904","","10.1021/ma062194u","","","0.71073","MoKα","","0.0763","0.0523","","","0.1275","0.1428","","","","","","0.995","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505120","11.3955","0.0008","17.6046","0.0011","11.5904","0.0008","90","","99.763","0.001","90","","2291.5","0.3","187","2","187","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H21 Al Cl4 N2 O2 -","- C21 H21 Al Cl4 N2 O2 -","- C84 H84 Al4 Cl16 N8 O8 -","4","1","","Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin","Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity","Macromolecules","2007","40","6","1904","","10.1021/ma062194u","","","0.71073","MoKα","","0.0763","0.0485","","","0.1002","0.112","","","","","","1.014","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505121","13.7448","0.0018","17.259","0.002","21.561","0.003","90","","107.278","0.002","90","","4883.9","1.1","187","2","187","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C22 H23 Al Cl4 N2 O3 -","- C22 H23 Al Cl4 N2 O3 -","- C176 H184 Al8 Cl32 N16 O24 -","8","2","","Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin","Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity","Macromolecules","2007","40","6","1904","","10.1021/ma062194u","","","0.71073","MoKα","","0.0846","0.0709","","","0.1676","0.1816","","","","","","1.027","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505122","13.4404","0.001","14.5891","0.001","10.7266","0.0008","90","","112.879","0.001","90","","1937.8","0.2","187","2","187","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 Al Cl4 N2 O2 -","- C18 H15 Al Cl4 N2 O2 -","- C72 H60 Al4 Cl16 N8 O8 -","4","1","","Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin","Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity","Macromolecules","2007","40","6","1904","","10.1021/ma062194u","","","0.71073","MoKα","","0.0469","0.0374","","","0.0881","0.0935","","","","","","1.033","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505123","11.0321","0.0009","10.2287","0.0008","18.3383","0.0015","90","","94.061","0.001","90","","2064.2","0.3","187","2","187","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H27 Al N2 O3 -","- C22 H27 Al N2 O3 -","- C88 H108 Al4 N8 O12 -","4","1","","Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin","Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity","Macromolecules","2007","40","6","1904","","10.1021/ma062194u","","","0.71073","MoKα","","0.0847","0.0646","","","0.1478","0.1604","","","","","","1.025","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505124","7.476","0.0001","10.075","0.0001","21.871","0.0003","92.96","0.0005","96.22","0.0005","94.345","0.0005","1629.96","0.04","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C70 H100 F10 O4 -","- C70 H100 F10 O4 -","- C70 H100 F10 O4 -","1","0.5","","Woody, Kathy B.; Bullock, Joseph E.; Parkin, Sean R.; Watson, Mark D.","Alternating Arene−Perfluoroarene Poly(phenylene ethynylenes)","Macromolecules","2007","40","13","4470","","10.1021/ma062667x","","","0.71073","MoKα","","0.0608","0.0429","","","0.1205","0.1329","","","","","","1.057","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505125","18.0411","0.0004","4.3133","0.0001","26.474","0.0006","90","","101.214","0.001","90","","2020.79","0.08","90","2","90","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C46 H62 O4 -","- C46 H62 O4 -","- C92 H124 O8 -","2","0.5","","Woody, Kathy B.; Bullock, Joseph E.; Parkin, Sean R.; Watson, Mark D.","Alternating Arene−Perfluoroarene Poly(phenylene ethynylenes)","Macromolecules","2007","40","13","4470","","10.1021/ma062667x","","","1.54178","CuKα","","0.0424","0.0371","","","0.096","0.1004","","","","","","1.035","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505126","11.0552","0.0012","12.727","0.0015","14.9106","0.0017","84.318","0.006","83.423","0.006","68.015","0.005","1929","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H54 Hf N2 -","- C45 H54 Hf N2 -","- C90 H108 Hf2 N4 -","2","1","","Domski, Gregory J.; Lobkovsky, Emil B.; Coates, Geoffrey W.","Polymerization of α-Olefins with Pyridylamidohafnium Catalysts: Living Behavior and Unexpected Isoselectivity from aCs-Symmetric Catalyst Precursor","Macromolecules","2007","40","9","3510","","10.1021/ma062824s","","","0.71073","MoKα","","0.0393","0.0272","","","0.0657","0.0697","","","","","","1.024","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505127","11.0762","0.0007","11.953","0.0008","12.8362","0.0009","79.555","0.003","66.82","0.003","67.872","0.003","1446.09","0.17","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C33 H40 Hf N2 -","- C33 H40 Hf N2 -","- C66 H80 Hf2 N4 -","2","1","","Domski, Gregory J.; Lobkovsky, Emil B.; Coates, Geoffrey W.","Polymerization of α-Olefins with Pyridylamidohafnium Catalysts: Living Behavior and Unexpected Isoselectivity from aCs-Symmetric Catalyst Precursor","Macromolecules","2007","40","9","3510","","10.1021/ma062824s","","","0.71073","MoKα","","0.0296","0.0224","","","0.0541","0.0566","","","","","","1.029","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505128","9.3898","0.0005","10.7845","0.0006","13.8529","0.0007","87.005","0.002","78.576","0.002","86.78","0.003","1371.63","0.13","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H36 Hf N2 -","- C32 H36 Hf N2 -","- C64 H72 Hf2 N4 -","2","1","","Domski, Gregory J.; Lobkovsky, Emil B.; Coates, Geoffrey W.","Polymerization of α-Olefins with Pyridylamidohafnium Catalysts: Living Behavior and Unexpected Isoselectivity from aCs-Symmetric Catalyst Precursor","Macromolecules","2007","40","9","3510","","10.1021/ma062824s","","","0.71073","MoKα","","0.0372","0.0243","","","0.0468","0.0485","","","","","","1","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505129","10.921","0.003","11.414","0.003","11.879","0.003","86.788","0.005","63.327","0.005","86.606","0.006","1320.1","0.6","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H13 N3 O -","- C16 H13 N3 O -","- C64 H52 N12 O4 -","4","2","","Qin, Anjun; Jim, Cathy K. W.; Lu, Weixin; Lam, Jacky W. Y.; Häussler, Matthias; Dong, Yongqiang; Sung, Herman H. Y.; Williams, Ian D.; Wong, George K. L.; Tang, Ben Zhong","Click Polymerization: Facile Synthesis of Functional Poly(aroyltriazole)s by Metal-Free, Regioselective 1,3-Dipolar Polycycloaddition","Macromolecules","2007","40","7","2308","","10.1021/ma062859s","","","0.71073","MoKα","","0.1978","0.0478","","","0.0539","0.0765","","","","","","0.941","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505130","10.3535","0.0008","10.2064","0.0008","17.3231","0.0014","90","","94.573","0.002","90","","1824.7","0.2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H15 N O2 -","- C24 H15 N O2 -","- C96 H60 N4 O8 -","4","1","","Qin, Anjun; Lam, Jacky W. Y.; Dong, Hongchen; Lu, Weixin; Jim, Cathy K. W.; Dong, Yongqiang; Häussler, Matthias; Sung, Herman H. Y.; Williams, Ian D.; Wong, George K. L.; Tang, Ben Zhong","Metal-Free, Regioselective Diyne Polycyclotrimerization: Synthesis, Photoluminescence, Solvatochromism, and Two-Photon Absorption of a Triphenylamine-Containing Hyperbranched Poly(aroylarylene)","Macromolecules","2007","40","14","4879","","10.1021/ma070200w","","","0.71073","MoKα","","0.0596","0.0377","","","0.0929","0.1002","","","","","","1.047","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505131","15.3215","0.0015","10.6382","0.0011","9.4347","0.0009","90","","95.448","0.002","90","","1530.8","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 N O -","- C21 H15 N O -","- C84 H60 N4 O4 -","4","1","","Qin, Anjun; Lam, Jacky W. Y.; Dong, Hongchen; Lu, Weixin; Jim, Cathy K. W.; Dong, Yongqiang; Häussler, Matthias; Sung, Herman H. Y.; Williams, Ian D.; Wong, George K. L.; Tang, Ben Zhong","Metal-Free, Regioselective Diyne Polycyclotrimerization: Synthesis, Photoluminescence, Solvatochromism, and Two-Photon Absorption of a Triphenylamine-Containing Hyperbranched Poly(aroylarylene)","Macromolecules","2007","40","14","4879","","10.1021/ma070200w","","","0.71073","MoKα","","0.0519","0.0357","","","0.0853","0.0907","","","","","","1.041","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505132","29.61","0.013","29.61","0.013","5.579","0.003","90","","90","","90","","4891","4","103.15","","103","2","","","","","","","","5","I 4","I 4","79","","","","- C21 H14 Br2 F9 O4.5 -","- C21 H13 Br2 F9 O4.5 -","- C168 H104 Br16 F72 O36 -","8","1","","Sakakibara, Ken; Nakano, Koji; Nozaki, Kyoko","Regioregular Polymerization of Fluorine-Containing Epoxides","Macromolecules","2007","40","17","6136","","10.1021/ma070428j","","","0.7107","MoKα","","0.0875","0.0704","","","0.1364","0.1442","","","","","","1.142","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505133","5.32","0.008","8.24","0.012","18.92","0.03","90","0.006","96.93","0.007","90","0.006","823","2","103.15","","103","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H10 F5 I O4 -","- C16 H9 F5 I O4 -","- C32 H18 F10 I2 O8 -","2","1","","Sakakibara, Ken; Nakano, Koji; Nozaki, Kyoko","Regioregular Polymerization of Fluorine-Containing Epoxides","Macromolecules","2007","40","17","6136","","10.1021/ma070428j","","","0.7107","MoKα","","0.059","0.0553","","","0.1491","0.1528","","","","","","1.066","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505134","5.7","0.002","19.459","0.008","20.815","0.008","90","","90","","90","","2308.7","1.5","103.15","","103","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H13 F5 I2 O4 -","- C23 H13 F5 I2 O4 -","- C92 H52 F20 I8 O16 -","4","1","","Sakakibara, Ken; Nakano, Koji; Nozaki, Kyoko","Regioregular Polymerization of Fluorine-Containing Epoxides","Macromolecules","2007","40","17","6136","","10.1021/ma070428j","","","0.7107","MoKα","","0.0643","0.0569","","","0.0947","0.0982","","","","","","1.161","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505135","20.64","0.0004","6.718","0.0008","11.579","0.0007","90","","90","","90","","1605.5","0.2","150","1","150","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C20 H30 N O -","- C20 H30 N O -","- C80 H120 N4 O4 -","4","0.5","","Debuigne, Antoine; Chan-Seng, Delphine; Li, Lichun; Hamer, Gordon K.; Georges, Michael K.","Synthesis and Evaluation of Sterically Hindered 1,1-Diadamantyl Nitroxide as a Low-Temperature Mediator for the Stable Free Radical Polymerization Process","Macromolecules","2007","40","17","6224","","10.1021/ma070691k","","","0.71073","MoKα","","0.1234","0.0651","","","0.1733","0.2025","","","","","","1.063","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505136","6.3916","0.0003","14.6153","0.0009","15.2826","0.0008","75.722","0.003","84.056","0.003","84.58","0.003","1372.57","0.13","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C35 H43 N O3 -","- C35 H43 N O3 -","- C70 H86 N2 O6 -","2","1","","Debuigne, Antoine; Chan-Seng, Delphine; Li, Lichun; Hamer, Gordon K.; Georges, Michael K.","Synthesis and Evaluation of Sterically Hindered 1,1-Diadamantyl Nitroxide as a Low-Temperature Mediator for the Stable Free Radical Polymerization Process","Macromolecules","2007","40","17","6224","","10.1021/ma070691k","","","0.71073","MoKα","","0.1034","0.0558","","","0.1219","0.1435","","","","","","1.028","","","","has coordinates","198632","2020-10-21","18:00:00",""
"1505137","6.3039","0.0002","15.2176","0.0004","22.4312","0.0005","80.19","0.0016","85.752","0.0015","84.344","0.0015","2106.44","0.1","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C24 H31 N O3 -","- C24 H31 N O3 -","- C96 H124 N4 O12 -","4","2","","Debuigne, Antoine; Chan-Seng, Delphine; Li, Lichun; Hamer, Gordon K.; Georges, Michael K.","Synthesis and Evaluation of Sterically Hindered 1,1-Diadamantyl Nitroxide as a Low-Temperature Mediator for the Stable Free Radical Polymerization Process","Macromolecules","2007","40","17","6224","","10.1021/ma070691k","","","0.71073","MoKα","","0.0881","0.0678","","","0.1905","0.2027","","","","","","1.103","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505138","7.186","0.001","9.546","0.001","9.894","0.0012","63.082","0.01","86.77","0.005","80.046","0.006","595.87","0.14","230","0.1","230","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C12 H32 Cl4 O6 Ti2 -","- C12 H32 Cl4 O6 Ti2 -","- C12 H32 Cl4 O6 Ti2 -","1","0.5","","Gueta-Neyroud, Tal; Tumanskii, Boris; Kapon, Moshe; Eisen, Moris S.","Synthesis and Characterization of Dichlorotitanium Alkoxide Complex and Its Activity in the Polymerization of α-Olefins","Macromolecules","2007","40","15","5261","","10.1021/ma070771o","","","0.71073","MoKα","","0.0649","0.0353","","","0.0838","0.0873","","","","","","0.867","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505139","35.233","0.012","5.694","0.0019","9.603","0.003","90","","99.248","0.017","90","","1901.5","1.1","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.0971","0.0615","","","0.1604","0.1745","","","","","","1.06","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505140","36.6","0.04","5.488","0.003","10.054","0.013","90","","101.03","0.06","90","","1982","4","123","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.0751","0.0642","","","0.1773","0.1947","","","","","","1.092","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505141","34.738","0.005","5.7074","0.0005","9.4062","0.0012","90","","98.357","0.006","90","","1845.1","0.4","123","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.0544","0.045","","","0.1251","0.1375","","","","","","1.098","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505142","34.714","0.004","5.7047","0.0005","9.4233","0.0009","90","","98.352","0.005","90","","1846.3","0.3","123","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.0448","0.0401","","","0.1066","0.1094","","","","","","1.093","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505143","39.539","0.006","5.7087","0.001","9.6807","0.0017","90","","90.464","0.006","90","","2185","0.6","203","2","203","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C24 H26 O6 -","- C24 H26 O6 -","- C96 H104 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71069","MoKα","","0.1568","0.13","","","0.3518","0.3814","","","","","","1.463","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505144","40.046","0.019","5.616","0.003","9.632","0.005","90","","91.05","0.04","90","","2165.9","1.9","203","2","203","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C24 H26 O6 -","- C24 H26 O6 -","- C96 H104 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.1417","0.0604","","","0.1288","0.1517","","","","","","0.985","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505145","38.96","0.02","5.714","0.003","9.351","0.005","90","","90.27","0.02","90","","2081.7","1.9","203","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C24 H26 O6 -","- C24 H26 O6 -","- C96 H104 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.1744","0.1043","","","0.2589","0.2991","","","","","","0.929","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505146","35.4","0.03","5.677","0.004","9.614","0.008","90","","99.59","0.04","90","","1905","3","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.0897","0.0554","","","0.1349","0.148","","","","","","1.03","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505147","35.66","0.03","5.712","0.003","9.662","0.007","90","","99","0.03","90","","1944","2","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.0957","0.0525","","","0.115","0.1276","","","","","","0.994","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505148","35.33","0.015","5.687","0.002","9.574","0.003","90","","99.224","0.019","90","","1898.8","1.2","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.0953","0.0575","","","0.1394","0.1521","","","","","","1.068","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505149","35.436","0.013","5.7178","0.0018","9.566","0.003","90","","99.033","0.017","90","","1914.2","1.1","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22.406 H22 O5.594 -","- C89.624 H88 O22.376 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.0985","0.0552","","","0.1315","0.1461","","","","","","1.048","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505150","35.254","0.014","5.714","0.002","9.551","0.003","90","","98.736","0.015","90","","1901.6","1.2","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.0967","0.0543","","","0.1361","0.1488","","","","","","1.075","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505151","35.339","0.016","5.699","0.002","9.517","0.005","90","","98.9","0.02","90","","1893.6","1.5","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.0965","0.0531","","","0.1236","0.1374","","","","","","1.034","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505152","35.289","0.012","5.6995","0.0019","9.516","0.004","90","","98.96","0.03","90","","1890.6","1.2","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.1086","0.0632","","","0.1588","0.1729","","","","","","1.094","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505153","35.223","0.01","5.6846","0.0012","9.5","0.003","90","","98.793","0.009","90","","1879.8","0.9","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.0934","0.0545","","","0.1291","0.142","","","","","","1","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505154","35.066","0.016","5.687","0.002","9.466","0.003","90","","98.89","0.03","90","","1865","1.2","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.1047","0.0617","","","0.1499","0.1636","","","","","","1.07","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505155","34.68","0.1","5.714","0.01","9.43","0.02","90","","98.21","0.08","90","","1850","7","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O6 -","- C22 H22 O6 -","- C88 H88 O24 -","4","0.5","","Furukawa, Daisuke; Matsumoto, Akikazu","Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters","Macromolecules","2007","40","17","6048","","10.1021/ma070802f","","","0.71075","MoKα","","0.0962","0.0567","","","0.1378","0.1518","","","","","","1.02","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505156","12.132","0.004","5.2501","0.0014","14.966","0.005","90","","93.362","0.012","90","","951.6","0.5","113.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H19 N3 O2 -","- C23 H19 N3 O2 -","- C46 H38 N6 O4 -","2","1","","Fujii, Toru; Shiotsuki, Masashi; Inai, Yoshihito; Sanda, Fumio; Masuda, Toshio","Synthesis of Helical Poly(N-propargylamides) Carrying Azobenzene Moieties in Side Chains. Reversible Arrangement-Disarrangement of Helical Side Chain Arrays upon Photoirradiation Keeping Helical Main Chain Intact","Macromolecules","2007","40","20","7079","","10.1021/ma070917j","","","0.71075","MoKα","","","0.0649","","","","0.0778","","","","","","1.037","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505157","9.3573","0.0001","27.8567","0.0003","14.4282","0.0002","90","","98.634","0.0006","90","","3718.28","0.08","200","","200","","","","","","","","local","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H36 Cl2 Ir2 Mo2 O10 -","- C33 H36 Cl2 Ir2 Mo2 O10 -","- C132 H144 Cl8 Ir8 Mo8 O40 -","4","1","","Randles, Michael D.; Lucas, Nigel T.; Cifuentes, Marie P.; Humphrey, Mark G.; Smith, Matthew K.; Willis, Anthony C.; Samoc, Marek","Mixed-Metal Cluster Chemistry. 30.1Syntheses and Optical Limiting Properties of Cluster-Containing Oligo- and Polyurethanes","Macromolecules","2007","40","22","7807","","10.1021/ma0710582","","","0.71073","MoKα","","0.0462","0.028","","0.0391","0.0325","0.0325","","","","","","1.0805","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505158","9.2483","0.0002","14.1908","0.0004","37.5723","0.001","90","","90.836","0.0014","90","","4930.5","0.2","200","","200","","","","","","","","local","7","P 1 21/n 1","-P 2yn","14","","","","- C42.5 H56 Cl Ir2 Mo2 N2 O12.5 -","- C42.5 H55 Cl Ir2 Mo2 N2 O12.5 -","- C170 H220 Cl4 Ir8 Mo8 N8 O50 -","4","1","","Randles, Michael D.; Lucas, Nigel T.; Cifuentes, Marie P.; Humphrey, Mark G.; Smith, Matthew K.; Willis, Anthony C.; Samoc, Marek","Mixed-Metal Cluster Chemistry. 30.1Syntheses and Optical Limiting Properties of Cluster-Containing Oligo- and Polyurethanes","Macromolecules","2007","40","22","7807","","10.1021/ma0710582","","","0.71073","MoKα","","0.1179","0.055","","0.0545","0.045","0.045","","","","","","1.1205","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505159","38.741","0.004","12.0548","0.0014","9.6188","0.0011","90","","90","","90","","4492.1","0.9","120","2","120","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","HT-TDA-HT","","- C22 H30 N2 S3 -","- C22 H30 N2 S3 -","- C176 H240 N16 S24 -","8","1","","Pang, Hao; Skabara, Peter J.; Crouch, David J.; Duffy, Warren; Heeney, Martin; McCulloch, Iain; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B.","Structural and Electronic Effects of 1,3,4-Thiadiazole Units Incorporated into Polythiophene Chains","Macromolecules","2007","40","18","6585","","10.1021/ma071242n","","","0.71073","MoKα","","0.1155","0.0633","","","0.1471","0.1965","","","","","","1.143","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505160","38.796","0.003","12.1462","0.0005","9.6432","0.0006","90","","90","","90","","4544.1","0.5","120","2","120","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","HS-TDA-HS","","- C22 H30 N2 S Se2 -","- C22 H30 N2 S Se2 -","- C176 H240 N16 S8 Se16 -","8","1","","Pang, Hao; Skabara, Peter J.; Crouch, David J.; Duffy, Warren; Heeney, Martin; McCulloch, Iain; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B.","Structural and Electronic Effects of 1,3,4-Thiadiazole Units Incorporated into Polythiophene Chains","Macromolecules","2007","40","18","6585","","10.1021/ma071242n","","","0.71073","MoKα","","0.1143","0.0513","","","0.1142","0.1537","","","","","","1.087","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505161","9.0402","0.0002","15.3519","0.0005","11.8801","0.0004","90","","91.095","0.002","90","","1648.47","0.09","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","EDTT-TDA-EDTT","","- C14 H10 N2 S7 -","- C14 H10 N2 S7 -","- C56 H40 N8 S28 -","4","1","","Pang, Hao; Skabara, Peter J.; Crouch, David J.; Duffy, Warren; Heeney, Martin; McCulloch, Iain; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B.","Structural and Electronic Effects of 1,3,4-Thiadiazole Units Incorporated into Polythiophene Chains","Macromolecules","2007","40","18","6585","","10.1021/ma071242n","","","0.71073","MoKα","","0.0337","0.0295","","","0.0676","0.07","","","","","","1.031","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505162","7.6833","0.0002","10.8879","0.0012","18.395","0.005","92.007","0.018","100.266","0.01","105.411","0.007","1454.2","0.4","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","DT-TDA-DT","","- C30 H46 N2 S3 -","- C30 H46 N2 S3 -","- C60 H92 N4 S6 -","2","1","","Pang, Hao; Skabara, Peter J.; Crouch, David J.; Duffy, Warren; Heeney, Martin; McCulloch, Iain; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B.","Structural and Electronic Effects of 1,3,4-Thiadiazole Units Incorporated into Polythiophene Chains","Macromolecules","2007","40","18","6585","","10.1021/ma071242n","","","0.71073","MoKα","","0.1662","0.0911","","","0.1579","0.1855","","","","","","1.059","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505163","9.729","0.006","9.983","0.006","10.716","0.006","72.516","0.012","65.094","0.011","68.434","0.011","864.7","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H24 Mg N2 O2 -","- C16 H24 Mg N2 O2 -","- C32 H48 Mg2 N4 O4 -","2","1","","Tang, Hui-Yi; Chen, Hsuan-Ying; Huang, Jui-Hsien; Lin, Chu-Chieh","Synthesis and Structural Characterization of Magnesium Ketiminate Complexes: Efficient Initiators for the Ring-Opening Polymerization ofl-Lactide","Macromolecules","2007","40","25","8855","","10.1021/ma071540k","","","0.71073","MoKα","","0.0915","0.074","","","0.2206","0.2554","","","","","","1.009","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505164","14.27","0.003","12.986","0.002","21.712","0.003","90","","102.302","0.01","90","","3931.1","1.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Ni(II)_bis(methoxybenzylphenyl_benzimidazole)","Bis[1-(2-methoxybenzyl)-2-(2-methoxyphenyl)-1H-benzimidazole]nickel(II)dibromide","","- C44 H40 Br2 N4 Ni O4 -","- C44 H40 Br2 N4 Ni O4 -","- C176 H160 Br8 N16 Ni4 O16 -","4","1","","Tarte, Naresh H.; Cho, Hyun Yong; Woo, Seong Ihl","Efficient Route for Cyclic Olefin Polymerization: Nonchelated Monodentate Benzimidazole Nickel(II) Complex Catalysts for Vinyl Polymerization of Norbornene","Macromolecules","2007","40","23","8162","","10.1021/ma071696k","","","0.71073","MoKα","","0.185","0.0669","","","0.1255","0.1607","","","","","","0.983","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505165","10.0205","0.0002","24.0291","0.0005","13.9318","0.0003","90","","110.291","0.001","90","","3146.38","0.12","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Ni(II)_bis(difluorophenyl_benzimidazole)","Bis[2-(2,6-difluorophenyl)-1H-benzimidazole]nickel(II)Dibromide","","- C30 H22 Br2 F4 N6 Ni -","- C30 H22 Br2 F4 N6 Ni -","- C120 H88 Br8 F16 N24 Ni4 -","4","1","","Tarte, Naresh H.; Cho, Hyun Yong; Woo, Seong Ihl","Efficient Route for Cyclic Olefin Polymerization: Nonchelated Monodentate Benzimidazole Nickel(II) Complex Catalysts for Vinyl Polymerization of Norbornene","Macromolecules","2007","40","23","8162","","10.1021/ma071696k","","","0.71073","MoKα","","0.1171","0.0612","","","0.1438","0.171","","","","","","1.024","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505166","9.6638","0.0002","10.4904","0.0002","18.0444","0.0003","90","","91.062","0.001","90","","1828.98","0.06","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","- C88 H80 N8 O8 -","4","1","","Tarte, Naresh H.; Cho, Hyun Yong; Woo, Seong Ihl","Efficient Route for Cyclic Olefin Polymerization: Nonchelated Monodentate Benzimidazole Nickel(II) Complex Catalysts for Vinyl Polymerization of Norbornene","Macromolecules","2007","40","23","8162","","10.1021/ma071696k","","","0.71073","MoKα","","0.0839","0.0438","","","0.1103","0.1296","","","","","","1.013","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505167","15.31","0.003","11.863","0.002","12.988","0.002","90","","107.74","0.002","90","","2246.7","0.7","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C31 H20 O4 -","- C31 H20 O4 -","- C124 H80 O16 -","4","1","","Al-Kaysi, Rabih O.; Dillon, Robert J.; Kaiser, J. Michael; Mueller, Leonard J.; Guirado, Gonzalo; Bardeen, Christopher J.","Photopolymerization of Organic Molecular Crystal Nanorods","Macromolecules","2007","40","25","9040","","10.1021/ma0717082","","","0.71073","MoKα","","0.0878","0.0709","","","0.1881","0.2011","","","","","","1.106","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505168","13.8475","0.0006","16.2027","0.0007","19.3485","0.0009","90","","90","","90","","4341.2","0.3","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C31 H20 O4 -","- C31 H20 O4 -","- C248 H160 O32 -","8","1","","Al-Kaysi, Rabih O.; Dillon, Robert J.; Kaiser, J. Michael; Mueller, Leonard J.; Guirado, Gonzalo; Bardeen, Christopher J.","Photopolymerization of Organic Molecular Crystal Nanorods","Macromolecules","2007","40","25","9040","","10.1021/ma0717082","","","0.71073","MoKα","","0.0491","0.0412","","","0.1112","0.1192","","","","","","1.025","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505169","4.80255","0.00009","9.70196","0.00018","17.3834","0.0003","95.195","0.001","99.137","0.001","97.232","0.001","788.26","0.03","293","2","293","2","","","","","","","","3","P -1","-P 1","2","T-dinonylT2-T","poly(2-[2,2']bithiophen-5-yl-3,6-dinonylthieno[3,2-b]thiophene)","","- C32 H44 S4 -","- C32 H44 S4 -","- C32 H44 S4 -","1","0.5","","San Miguel, Lidaris; Matzger, Adam J.","Dialkyl-Substituted Thieno[3,2-b]thiophene-Based Polymers Containing 2,2‘-Bithiophene, Thieno[3,2-b]thiophene, and Ethynylene Spacers","Macromolecules","2007","40","26","9233","","10.1021/ma702073m","","","1.54187","CuKα","","0.0672","0.0489","","","0.1249","0.1363","","","","","","1.062","","","","has coordinates,has disorder","194611","2020-10-21","18:00:00",""
"1505170","5.6367","0.0004","32.91","0.003","9.4476","0.0007","90","","102.342","0.006","90","","1712.1","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","{1[(1-benzimidazolyl)methyl]-4[(1-pyrazolyl)methyl]benzene}2, succinic acid","","- C40 H38 N8 O4 -","- C40 H38 N8 O4 -","- C80 H76 N16 O8 -","2","0.5","","Aakeröy, Christer B.; Fasulo, Meg E.; Desper, John","Cocrystal or Salt: Does It Really Matter?","Molecular Pharmaceutics","2007","4","3","317","","10.1021/mp060126o","","","0.71073","MoKα","","0.0918","0.0545","","","0.1276","0.1448","","","","","","0.92","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505171","7.1555","0.0008","17.958","0.002","10.9686","0.0012","90","","101.301","0.002","90","","1382.1","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(4-pyridyl)-pyrazole, 2,6-difluorobenzoic acid","","- C15 H11 F2 N3 O2 -","- C15 H11 F2 N3 O2 -","- C60 H44 F8 N12 O8 -","4","1","","Aakeröy, Christer B.; Fasulo, Meg E.; Desper, John","Cocrystal or Salt: Does It Really Matter?","Molecular Pharmaceutics","2007","4","3","317","","10.1021/mp060126o","","","0.71073","MoKα","","0.0607","0.0453","","","0.1056","0.1137","","","","","","1.05","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505172","8.8864","0.0005","11.9875","0.0007","13.7015","0.0008","99.38","0.001","93.191","0.001","107.556","0.001","1364.42","0.14","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","MF-34-33 3-(4-pyridyl)pyrazole, (Me5-PhCOOH)2","","- C32 H39 N3 O4 -","- C32 H39 N3 O4 -","- C64 H78 N6 O8 -","2","1","","Aakeröy, Christer B.; Fasulo, Meg E.; Desper, John","Cocrystal or Salt: Does It Really Matter?","Molecular Pharmaceutics","2007","4","3","317","","10.1021/mp060126o","","","0.71073","MoKα","","0.0788","0.0529","","","0.124","0.1331","","","","","","0.947","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505173","9.7657","0.0006","11.7691","0.0007","14.0803","0.0009","86.227","0.001","74.163","0.001","86.202","0.001","1551.53","0.17","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","1-[(1-benzimidazolyl)methyl]-3-[(1-pyrazolyl)methyl]benzene (3,5-diNO2PhCOOH)2","","- C32 H24 N8 O12 -","- C32 H24 N8 O12 -","- C64 H48 N16 O24 -","2","1","","Aakeröy, Christer B.; Fasulo, Meg E.; Desper, John","Cocrystal or Salt: Does It Really Matter?","Molecular Pharmaceutics","2007","4","3","317","","10.1021/mp060126o","","","0.71073","MoKα","","0.0513","0.0456","","","0.124","0.1294","","","","","","1.024","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505174","8.7478","0.0002","6.5361","0.0001","12.5842","0.0002","90","","107.296","0.001","90","","686.98","0.02","100","2","100","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","theophylline:sorbic acid cocrystal (1:1)","theophylline sorbic acid","","- C13 H16 N4 O4 -","- C13 H16 N4 O4 -","- C26 H32 N8 O8 -","2","0.5","","Childs, Scott L.; Stahly, G. Patrick; Park, Aeri","The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State","Molecular Pharmaceutics","2007","4","3","323","","10.1021/mp0601345","","","1.54178","CuKα","","0.0454","0.0381","","","0.1005","0.1221","","","","","","1.192","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505175","6.9183","0.0003","25.9086","0.001","7.9749","0.0004","90","","104.754","0.003","90","","1382.32","0.11","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","theophylline:salicylic acid cocrystal (1:1)","theophylline salicylic acid","","- C14 H15 N4 O5 -","- C14 H14 N4 O5 -","- C56 H56 N16 O20 -","4","1","","Childs, Scott L.; Stahly, G. Patrick; Park, Aeri","The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State","Molecular Pharmaceutics","2007","4","3","323","","10.1021/mp0601345","","","1.54178","CuKα","","0.0777","0.0508","","","0.1045","0.1119","","","","","","1.014","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505176","11.814","0.003","31.707","0.008","8.92","0.002","90","","98.072","0.007","90","","3308.2","1.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","theophylline:1-hydroxy-2-naphthoic acid cocrystal (1:1)","theophylline 1-hydroxy-2-naphthoic acid","","- C18 H16 N4 O5 -","- C18 H16 N4 O5 -","- C144 H128 N32 O40 -","8","2","","Childs, Scott L.; Stahly, G. Patrick; Park, Aeri","The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State","Molecular Pharmaceutics","2007","4","3","323","","10.1021/mp0601345","","","1.54178","CuKα","","0.1865","0.0689","","","0.1536","0.2098","","","","","","0.909","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505177","7.1201","0.0018","7.928","0.002","24.763","0.006","90","","91.66","0.007","90","","1397.2","0.6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","theophylline:4-hydroxybenzoic acid cocrystal (1:1)","theophylline 4-hydroxybenzoic acid","","- C14 H14 N4 O5 -","- C14 H14 N4 O5 -","- C56 H56 N16 O20 -","4","1","","Childs, Scott L.; Stahly, G. Patrick; Park, Aeri","The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State","Molecular Pharmaceutics","2007","4","3","323","","10.1021/mp0601345","","","1.54178","CuKα","","0.0637","0.0361","","","0.0792","0.0863","","","","","","1.011","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505178","8.7337","0.0002","15.3838","0.0003","11.5271","0.0003","90","","99.256","0.002","90","","1528.59","0.06","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","theophylline:acetaminophen cocrystal (1:1)","theophylline:acetaminophen cocrystal (1:1)","","- C15 H17 N5 O4 -","- C15 H17 N5 O4 -","- C60 H68 N20 O16 -","4","1","","Childs, Scott L.; Stahly, G. Patrick; Park, Aeri","The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State","Molecular Pharmaceutics","2007","4","3","323","","10.1021/mp0601345","","","1.54178","CuKα","","0.0607","0.0441","","","0.1221","0.1505","","","","","","1.168","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505179","8.7804","0.0005","6.5989","0.0004","16.0041","0.001","90","","102.292","0.004","90","","906.04","0.1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","anhydrous aminophylline","theophylline ethylenediamine","","- C8 H12 N5 O2 -","- C8 H12 N5 O2 -","- C32 H48 N20 O8 -","4","1","","Childs, Scott L.; Stahly, G. Patrick; Park, Aeri","The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State","Molecular Pharmaceutics","2007","4","3","323","","10.1021/mp0601345","","","1.54178","CuKα","","0.0941","0.0794","","","0.2394","0.2473","","","","","","1.217","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505180","8.3936","0.0007","10.2277","0.0006","11.8295","0.0006","78.839","0.003","77.795","0.004","81.075","0.004","966.87","0.11","173","2","173","2","","","","","","","","4","P -1","-P 1","2","aminophylline hydrate","theophylline ethylenediamine hydrate","","- C16 H26 N10 O5 -","- C16 H26 N10 O5 -","- C32 H52 N20 O10 -","2","1","","Childs, Scott L.; Stahly, G. Patrick; Park, Aeri","The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State","Molecular Pharmaceutics","2007","4","3","323","","10.1021/mp0601345","","","1.54178","CuKα","","0.039","0.036","","","0.0915","0.0945","","","","","","0.849","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505181","8.1434","0.0005","20.7559","0.0011","10.6511","0.0007","90","","110.276","0.003","90","","1688.73","0.18","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","niflumic acid:maleic acid salt (1:1)","2-(3-(trifluoromethyl)anilino)-nicotinic acid maleic acid","","- C17 H13 F3 N2 O6 -","- C17 H13 F3 N2 O6 -","- C68 H52 F12 N8 O24 -","4","1","","Childs, Scott L.; Stahly, G. Patrick; Park, Aeri","The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State","Molecular Pharmaceutics","2007","4","3","323","","10.1021/mp0601345","","","1.54178","CuKα","","0.0778","0.0531","","","0.1058","0.1118","","","","","","1.06","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505182","7.6063","0.0017","14.042","0.003","16.327","0.004","90","","94.03","0.004","90","","1739.5","0.7","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","caffeine 1-hydroxy-2-naphthoic acid","","","- C19 H18 N4 O5 -","- C19 H18 N4 O5 -","- C76 H72 N16 O20 -","4","1","","Bučar, Dejan-Krešimir; Henry, Rodger F.; Lou, Xiaochun; Duerst, Richard W.; Borchardt, Thomas B.; MacGillivray, Leonard R.; Zhang, Geoff G. Z.","Co-Crystals of Caffeine and Hydroxy-2-naphthoic Acids: Unusual Formation of the Carboxylic Acid Dimer in the Presence of a Heterosynthon","Molecular Pharmaceutics","2007","4","3","339","","10.1021/mp070004b","","","0.71073","MoKα","","0.1198","0.0926","","","0.204","0.2166","","","","","","1.258","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505183","9.04","0.009","24.42","0.02","8.654","0.008","90","","117.015","0.014","90","","1702","3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","caffeine 3-hydroxy-2-naphthoic acid","","","- C19 H18 N4 O5 -","- C19 H18 N4 O5 -","- C76 H72 N16 O20 -","4","1","","Bučar, Dejan-Krešimir; Henry, Rodger F.; Lou, Xiaochun; Duerst, Richard W.; Borchardt, Thomas B.; MacGillivray, Leonard R.; Zhang, Geoff G. Z.","Co-Crystals of Caffeine and Hydroxy-2-naphthoic Acids: Unusual Formation of the Carboxylic Acid Dimer in the Presence of a Heterosynthon","Molecular Pharmaceutics","2007","4","3","339","","10.1021/mp070004b","","","0.71073","MoKα","","0.1038","0.0631","","","0.0972","0.1011","","","","","","1.559","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505184","8.029","0.003","8.592","0.003","13.996","0.005","106.475","0.005","98.162","0.005","104.904","0.006","870.3","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H18 N4 O5 -","- C19 H18 N4 O5 -","- C38 H36 N8 O10 -","2","1","","Bučar, Dejan-Krešimir; Henry, Rodger F.; Lou, Xiaochun; Duerst, Richard W.; Borchardt, Thomas B.; MacGillivray, Leonard R.; Zhang, Geoff G. Z.","Co-Crystals of Caffeine and Hydroxy-2-naphthoic Acids: Unusual Formation of the Carboxylic Acid Dimer in the Presence of a Heterosynthon","Molecular Pharmaceutics","2007","4","3","339","","10.1021/mp070004b","","","0.71073","MoKα","","0.0757","0.0605","","","0.1149","0.1187","","","","","","1.53","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505185","17.9217","0.0002","6.1766","0.0001","15.3751","0.0003","90","","105.212","0.001","90","","1642.32","0.05","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2","theophylline-citric acid-water 1/1/1","","- C13 H18 N4 O10 -","- C13 H18 N4 O10 -","- C52 H72 N16 O40 -","4","1","","Karki, Shyam; Friščić, Tomislav; Jones, William; Motherwell, W. D. Samuel","Screening for Pharmaceutical Cocrystal Hydrates via Neat and Liquid-Assisted Grinding","Molecular Pharmaceutics","2007","4","3","347","","10.1021/mp0700054","","","0.71073","MoKα","","0.0431","0.0393","","","0.1155","0.1189","","","","","","1.086","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505186","7.3874","0.0001","8.3967","0.0002","13.5053","0.0003","91.333","0.001","99.04","0.001","99.588","0.001","814.72","0.03","120","2","120","2","","","","","","","","4","P -1","-P 1","2","3","caffeine-citric acid 1/1","","- C14 H18 N4 O9 -","- C14 H18 N4 O9 -","- C28 H36 N8 O18 -","2","1","","Karki, Shyam; Friščić, Tomislav; Jones, William; Motherwell, W. D. Samuel","Screening for Pharmaceutical Cocrystal Hydrates via Neat and Liquid-Assisted Grinding","Molecular Pharmaceutics","2007","4","3","347","","10.1021/mp0700054","","","0.71073","MoKα","","0.044","0.0382","","","0.1055","0.1102","","","","","","1.085","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505187","11.231","0.002","12.33","0.002","6.9082","0.0012","90","","90","","90","","956.6","0.3","297","2","297","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C2 H5 O5.5 -","- C2 H5 O5.5 -","- C16 H40 O44 -","8","1","","Wenger, Mazal; Bernstein, Joel","Cocrystal Design Gone Awry? A New Dimorphic Hydrate of Oxalic Acid","Molecular Pharmaceutics","2007","4","3","355","","10.1021/mp070006w","","","0.71073","MoKα","","0.0605","0.0571","","","0.1745","0.1795","","","","","","1.073","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505188","6.337","0.002","7.247","0.003","10.571","0.004","94.345","0.01","100.244","0.009","97.674","0.011","471","0.3","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","","","- C4 H9 O11 -","- C4 H10 O11 -","- C8 H20 O22 -","2","1","","Wenger, Mazal; Bernstein, Joel","Cocrystal Design Gone Awry? A New Dimorphic Hydrate of Oxalic Acid","Molecular Pharmaceutics","2007","4","3","355","","10.1021/mp070006w","","","0.71073","MoKα","","0.0618","0.0518","","","0.1416","0.1514","","","","","","1.075","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505189","13.223","0.003","6.1971","0.0012","14.63","0.003","90","","113.661","0.003","90","","1098.1","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 N4 O2 -","- C26 H22 N4 O2 -","- C52 H44 N8 O4 -","2","0.5","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.0803","0.0597","","","0.1463","0.155","","","","","","1.103","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505190","18.715","0.008","7.228","0.003","23.208","0.009","90","","90.478","0.012","90","","3139","2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H15 N3 O -","- C19 H15 N3 O -","- C152 H120 N24 O8 -","8","1","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.1331","0.0688","","","0.1307","0.149","","","","","","1.002","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505191","16.5421","0.0017","7.5056","0.0008","18.709","0.002","90","","106.763","0.002","90","","2224.2","0.4","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 N4 O2 -","- C26 H20 N4 O2 -","- C104 H80 N16 O8 -","4","1","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.0593","0.0504","","","0.1434","0.1501","","","","","","1.069","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505192","20.866","0.006","7.437","0.002","6.7662","0.0018","90","","98.142","0.005","90","","1039.4","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18 N4 O2 -","- C24 H18 N4 O2 -","- C48 H36 N8 O4 -","2","0.5","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.1006","0.0685","","","0.1467","0.1747","","","","","","1.082","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505193","9.906","0.012","21.65","0.03","7.59","0.009","90","","112.14","0.02","90","","1508","3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 N2 O -","- C18 H14 N2 O -","- C72 H56 N8 O4 -","4","1","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.0992","0.0558","","","0.125","0.1461","","","","","","0.924","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505194","12.7871","0.0017","7.2838","0.0009","44.445","0.006","90","","90.895","0.003","90","","4139","0.9","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H18 N4 O2 -","- C24 H18 N4 O2 -","- C192 H144 N32 O16 -","8","2","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.1655","0.051","","","0.1177","0.1654","","","","","","0.812","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505195","26.217","0.013","7.481","0.005","19.41","0.01","90","","128.31","0.014","90","","2987","3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H14 N2 O -","- C18 H14 N2 O -","- C144 H112 N16 O8 -","8","1","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.1238","0.063","","","0.1577","0.1753","","","","","","0.809","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505196","3.8483","0.0017","8.755","0.004","14.364","0.006","96.647","0.007","94.498","0.008","95.474","0.007","476.5","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H18 N4 O2 -","- C24 H18 N4 O2 -","- C24 H18 N4 O2 -","1","0.5","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.0906","0.0659","","","0.1676","0.1926","","","","","","1.042","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505197","11.195","0.003","7.335","0.002","13.53","0.004","90","","99.465","0.007","90","","1095.9","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 N4 O2 -","- C26 H22 N4 O2 -","- C52 H44 N8 O4 -","2","0.5","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.1144","0.0672","","","0.1377","0.1752","","","","","","1.044","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505198","18.503","0.003","7.5019","0.001","21.971","0.003","90","","92.181","0.004","90","","3047.5","0.8","100","2","100","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C19 H15 N3 O -","- C19 H15 N3 O -","- C152 H120 N24 O8 -","8","2","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.0635","0.0528","","","0.1179","0.1281","","","","","","1.038","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505199","7.616","0.002","10.003","0.003","22.497","0.006","87.342","0.005","81.024","0.006","69.737","0.006","1588.1","0.8","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H15 N3 O -","- C19 H15 N3 O -","- C76 H60 N12 O4 -","4","2","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.1392","0.0502","","","0.0962","0.1291","","","","","","0.791","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505200","14.66","0.003","4.11","0.0008","18.29","0.004","90","","90.74","0.03","90","","1101.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 N4 O2 -","- C26 H20 N4 O2 -","- C52 H40 N8 O4 -","2","0.5","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.1319","0.0502","","","0.107","0.1307","","","","","","0.814","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505201","39.87","0.02","7.586","0.005","6.915","0.004","90","","91.972","0.019","90","","2090","2","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H18 N4 O2 -","- C24 H18 N4 O2 -","- C96 H72 N16 O8 -","4","0.5","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.1894","0.0724","","","0.1568","0.197","","","","","","0.717","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505202","7.889","0.003","8.156","0.003","19.673","0.007","83.866","0.007","85.627","0.006","63.512","0.005","1125.9","0.7","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H18 N6 O3 -","- C24 H18 N6 O3 -","- C48 H36 N12 O6 -","2","1","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.1106","0.0586","","","0.1357","0.1676","","","","","","0.938","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505203","9.171","0.004","9.941","0.005","10.265","0.005","95.674","0.008","94.987","0.008","114.784","0.008","836.9","0.7","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H14 N4 O2 -","- C18 H14 N4 O2 -","- C36 H28 N8 O4 -","2","1","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.0593","0.0506","","","0.1329","0.1397","","","","","","1.058","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505204","8.274","0.003","10.172","0.003","18.601","0.007","87.521","0.007","78.256","0.006","71.067","0.007","1449.4","0.9","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H24 F4 N4 O4 S -","- C30 H24 F4 N4 O4 S -","- C60 H48 F8 N8 O8 S2 -","2","1","","Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J.","Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor","Molecular Pharmaceutics","2007","4","3","401","","10.1021/mp070012s","","","0.71073","MoKα","","0.094","0.0554","","","0.129","0.1498","","","","","","1.028","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505205","10.385","0.0009","7.2222","0.0006","16.3763","0.0014","90","","93.686","0.001","90","","1225.72","0.18","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1:1 complex of barbituric acid and quinoxaline-N,N'-oxide","","- C12 H10 N4 O5 -","- C12 H10 N4 O5 -","- C48 H40 N16 O20 -","4","1","","Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini","Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides","Molecular Pharmaceutics","2007","4","3","417","","10.1021/mp070014c","","","0.71073","MoKα","","0.0503","0.0381","","","0.0949","0.1018","","","","","","1.029","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505206","8.4083","0.0007","9.8893","0.0009","10.6761","0.0009","73.201","0.001","79.022","0.002","74.182","0.002","811.64","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1:2 Cocrystal of Barbituric acid and 4-methylpyridine N-oxide","","- C16 H18 N4 O5 -","- C16 H18 N4 O5 -","- C32 H36 N8 O10 -","2","1","","Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini","Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides","Molecular Pharmaceutics","2007","4","3","417","","10.1021/mp070014c","","","0.71073","MoKα","","0.0726","0.0516","","","0.1197","0.1316","","","","","","1.042","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505207","5.258","0.003","6.478","0.003","22.118","0.011","90","","95.795","0.008","90","","749.5","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2:1 Cocrystal of Barbituric acid and 4,4'pyrazine-N,N'-dioxide","","- C6 H6 N3 O4 -","- C6 H6 N3 O4 -","- C24 H24 N12 O16 -","4","1","","Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini","Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides","Molecular Pharmaceutics","2007","4","3","417","","10.1021/mp070014c","","","0.71073","MoKα","","0.0464","0.0434","","","0.1053","0.1079","","","","","","1.064","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505208","6.5207","0.0004","14.0377","0.0009","13.1232","0.0009","90","","104.28","0.001","90","","1164.12","0.13","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1:1 complex of saccharin and bipyridine-N,N'-oxide","","- C24 H18 N4 O8 S2 -","- C24 H18 N4 O8 S2 -","- C48 H36 N8 O16 S4 -","2","0.5","","Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini","Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides","Molecular Pharmaceutics","2007","4","3","417","","10.1021/mp070014c","","","0.71073","MoKα","","0.0411","0.0362","","","0.0921","0.0954","","","","","","1.076","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505209","7.2276","0.0005","19.5811","0.0012","9.9928","0.0006","90","","98.136","0.001","90","","1399.99","0.15","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2:1 cocrystal of 4-methylpyridine-N-oxide and barbital","","- C13 H17 N3 O4 -","- C13 H17 N3 O4 -","- C52 H68 N12 O16 -","4","1","","Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini","Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides","Molecular Pharmaceutics","2007","4","3","417","","10.1021/mp070014c","","","0.71073","MoKα","","0.0446","0.0398","","","0.1073","0.1116","","","","","","1.045","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505210","8.2106","0.0005","23.9166","0.0015","20.6318","0.0013","90","","96.67","0.001","90","","4024","0.4","100","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2:4 Cocrystal of Barbital acid and 4-methylpyridine N-oxide","","- C20 H26 N4 O5 -","- C20 H26 N4 O5 -","- C160 H208 N32 O40 -","8","2","","Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini","Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides","Molecular Pharmaceutics","2007","4","3","417","","10.1021/mp070014c","","","0.71073","MoKα","","0.0988","0.0537","","","0.1406","0.1696","","","","","","1.012","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505211","5.692","0.004","9.482","0.006","10.751","0.007","69.893","0.01","84.232","0.01","84.969","0.01","541.2","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1:1 cocrystal of 4-hydroxybenzamide and bipyridine-N,N'-dioxide","","- C24 H22 N4 O6 -","- C24 H22 N4 O6 -","- C24 H22 N4 O6 -","1","0.5","","Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini","Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides","Molecular Pharmaceutics","2007","4","3","417","","10.1021/mp070014c","","","0.71073","MoKα","","0.0665","0.0455","","","0.1201","0.1323","","","","","","1.028","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505212","6.409","0.004","7.372","0.004","11.064","0.006","96.127","0.014","97.22","0.03","105.35","0.009","494.7","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Hydrate of 1:1 cocrystal of 4-hydroxy benzamide and pyrazine-4,4'-dioxide","","- C9 H11 N2 O4 -","- C9 H11 N2 O4 -","- C18 H22 N4 O8 -","2","1","","Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini","Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides","Molecular Pharmaceutics","2007","4","3","417","","10.1021/mp070014c","","","0.71073","MoKα","","0.0844","0.0473","","","0.1118","0.1309","","","","","","0.973","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505213","7.284","0.002","10.688","0.004","14.132","0.005","100.25","0.005","102.463","0.005","109.079","0.005","977.8","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1:0.5 cocrystal of Carbamazepine and Quinoxaline-N,N'-dioxide","","- C23 H18 N4 O3 -","- C23 H18 N4 O3 -","- C46 H36 N8 O6 -","2","1","","Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini","Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides","Molecular Pharmaceutics","2007","4","3","417","","10.1021/mp070014c","","","0.71073","MoKα","","0.0798","0.0548","","","0.1189","0.1295","","","","","","1.061","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505214","10.237","0.004","27.247","0.012","5.135","0.002","90","","102.708","0.007","90","","1397.2","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1:0.5 cocrystal of Carbamazepine and pyrazine-N,N'-dioxide","","- C17 H14 N3 O2 -","- C17 H14 N3 O2 -","- C68 H56 N12 O8 -","4","1","","Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini","Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides","Molecular Pharmaceutics","2007","4","3","417","","10.1021/mp070014c","","","0.71073","MoKα","","0.1589","0.138","","","0.2768","0.2868","","","","","","1.294","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505215","4.6757","0.0009","8.502","0.0016","19.718","0.005","85.993","0.009","88.432","0.008","82.788","0.013","775.6","0.3","130","2","130","2","","","","","","","","4","P -1","-P 1","2","Alexf002","Alex002","","- C40 H42 N2 O4 -","- C40 H42 N2 O4 -","- C40 H42 N2 O4 -","1","0.5","","Briseno, Alejandro L.; Mannsfeld, Stefan C. B.; Reese, Colin; Hancock, Jessica M.; Xiong, Yujie; Jenekhe, Samson A.; Bao, Zhenan; Xia, Younan","Perylenediimide nanowires and their use in fabricating field-effect transistors and complementary inverters.","Nano letters","2007","7","9","2847","2853","10.1021/nl071495u","","","0.71073","MoKα","","0.3145","0.091","","","0.1549","0.2247","","","","","","0.93","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505216","13.0624","0.0002","29.0453","0.0005","58.4559","0.0011","90","","90","","90","","22178.2","0.7","90","2","90","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H29 N O4 -","- C19 H29 N O4 -","- C912 H1392 N48 O192 -","48","12","","Stadler, Marc; Bitzer, Jens; Mayer-Bartschmid, Anke; Müller, Hartwig; Benet-Buchholz, Jordi; Gantner, Florian; Tichy, Hans-Volker; Reinemer, Peter; Bacon, Kevin B.","Cinnabaramides A-G: analogues of lactacystin and salinosporamide from a terrestrial streptomycete.","Journal of natural products","2007","70","2","246","252","10.1021/np060162u","","","1.54178","CuKα","","0.1039","0.0781","","","0.1832","0.1989","","","","","","1.076","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505217","34.5928","0.0015","6.8066","0.0003","16.9849","0.0007","90","","97.148","0.002","90","","3968.2","0.3","93","2","93","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O9 -","- C22 H22 O9 -","- C176 H176 O72 -","8","1","","Lang, Gerhard; Cole, Anthony L. J.; Blunt, John W.; Robinson, Ward T.; Munro, Murray H. G.","Excelsione, a depsidone from an endophytic fungus isolated from the New Zealand endemic tree Knightia excelsa.","Journal of natural products","2007","70","2","310","311","10.1021/np060202u","","","0.71073","MoKα","","0.093","0.0526","","","0.1375","0.171","","","","","","1.041","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505218","7.34","0.002","9.715","0.003","9.555","0.003","90","","99.39","0.008","90","","672.2","0.3","294","2","294","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C15 H16 O5 -","- C15 H16 O5 -","- C30 H32 O10 -","2","1","","Fei, Dong-Qing; Li, Shi-Gang; Liu, Chun-Mei; Wu, Gang; Gao, Kun","Eremophilane-type sesquiterpene derivatives from the roots of Ligularia lapathifolia.","Journal of natural products","2007","70","2","241","245","10.1021/np060304k","","","0.71073","MoKα","","0.0375","0.035","","","0.1098","0.1139","","","","","","0.938","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505219","7.631","0.0003","12.049","0.0005","14.522","0.0007","90","","90","","90","","1335.24","0.1","298","","","","","","","","","","Local laboratory","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H22 O2 -","- C15 H22 O2 -","- C60 H88 O8 -","4","1","","Harinantenaina, Liva; Asakawa, Yoshinori; De Clercq, Erik","Cinnamacrins A-C, cinnafragrin D, and cytostatic metabolites with alpha-glucosidase inhibitory activity from Cinnamosma macrocarpa.","Journal of natural products","2007","70","2","277","282","10.1021/np060435l","","","0.71073","MoKα","","0.0624","0.0576","","","0.154","0.1652","","","","","","1.174","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505220","8.7505","0.0009","5.1734","0.0005","10.6057","0.0011","90","","98.682","0.001","90","","474.62","0.08","273","2","273","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C9 H14 O6 -","- C9 H14 O6 -","- C18 H28 O12 -","2","1","","Valladares, María Guadalupe; Rios, María Yolanda","Iridoids from Crescentia alata.","Journal of natural products","2007","70","1","100","102","10.1021/np060499w","","","0.71073","MoKα","","0.0287","0.0284","","","0.0746","0.0749","","","","","","1.08","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505221","10.0874","0.0002","12.5229","0.0002","13.6632","0.0002","65.648","0.001","88.15","0.001","86.102","0.001","1568.77","0.05","200","2","200","2","","","","","","","Isolated from Streptomyces cyaneogriseus ssp. noncyanogenus (LL-F28249).","4","P 1","P 1","1","Wyeth CL-118,773 [ L-24525-179-8 ]","21-Hydroxyoligomycin A Bis(Chloroform) Tris(Methanol) Solvate","","- C50 H88 Cl6 O15 -","- C50 H88 Cl6 O15 -","- C50 H88 Cl6 O15 -","1","1","","Wagenaar, Melissa M.; Williamson, R. Thomas; Ho, Douglas M.; Carter, Guy T.","Structure and absolute stereochemistry of 21-hydroxyoligomycin A.","Journal of natural products","2007","70","3","367","371","10.1021/np060519u","","","0.71073","MoKα","","0.0807","0.0603","","0.1738","","0.1539","","","1.034","","","1.058","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505222","11.0682","0.0006","17.38","0.001","29.355","0.002","90","","90","","90","","5646.9","0.6","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H40.5 Cl O4.75 -","- C25 H39 Cl O4.75 -","- C200 H312 Cl8 O38 -","8","2","","Nguyen, Hung Phi; Zhang, Dahai; Lee, Uk; Kang, Jung Sook; Choi, Hong Dae; Son, Byeng Wha","Dehydroxychlorofusarielin B, an antibacterial polyoxygenated decalin derivative from the marine-derived fungus Aspergillus sp.","Journal of natural products","2007","70","7","1188","1190","10.1021/np060552g","","","0.71073","MoKα","","0.2537","0.105","","","0.2329","0.3119","","","","","","1.029","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1505223","7.156","0.002","30.155","0.009","8.678","0.003","90","","103.888","0.005","90","","1817.9","1","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C31 H53 N5 O11 -","- C31 H53 N5 O11 -","- C62 H106 N10 O22 -","2","1","","Huang, Huarong; She, Zhigang; Lin, Yongcheng; Vrijmoed, L. L. P.; Lin, Wenhan","Cyclic peptides from an endophytic fungus obtained from a mangrove leaf (Kandelia candel).","Journal of natural products","2007","70","11","1696","1699","10.1021/np0605891","","","0.71073","MoKα","","0.0802","0.0566","","","0.1572","0.1741","","","","","","1.038","","","","has coordinates","287882","2023-11-30","11:36:46",""
"1505224","7.089","0.003","28.71","0.014","8.77","0.004","90","","103.606","0.007","90","","1734.8","1.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C30 H49 N5 O9 -","- C30 H49 N5 O9 -","- C60 H98 N10 O18 -","2","1","","Huang, Huarong; She, Zhigang; Lin, Yongcheng; Vrijmoed, L. L. P.; Lin, Wenhan","Cyclic peptides from an endophytic fungus obtained from a mangrove leaf (Kandelia candel).","Journal of natural products","2007","70","11","1696","1699","10.1021/np0605891","","","0.71073","MoKα","","0.1023","0.0702","","","0.1643","0.1825","","","","","","1.052","","","","has coordinates,has disorder","287882","2023-11-30","11:37:01",""
"1505225","10.8338","0.0013","12.2421","0.0015","14.0333","0.0016","90","","96.445","0.002","90","","1849.5","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C35 H48 O17 -","- C35 H48 O17 -","- C70 H96 O34 -","2","1","","Yin, Sheng; Wang, Xiao-Ning; Fan, Cheng-Qi; Lin, Li-Ping; Ding, Jian; Yue, Jian-Min","Limonoids from the seeds of the marine mangrove Xylocarpus granatum.","Journal of natural products","2007","70","4","682","685","10.1021/np060632k","","","0.71073","MoKα","","0.0828","0.0608","","","0.1551","0.169","","","","","","0.978","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505226","13.491","0.003","15.501","0.003","21.975","0.004","90","","90","","90","","4595.5","1.6","295","2","295","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","(1S,4R,5R,8S,9S,10R,13S,14S,16S,17S)-11-ethyl-16-methoxy-13- (methoxymethyl)-11-azahexacy-clo[7.7.2.12,5.01,10.03,8.013,17] nonadecane-4,5,8,14,17-pentaol","","- C24 H39 N O8 -","- C24 H39 N O8 -","- C192 H312 N8 O64 -","8","1","","Gao, Feng; Chen, Qiao-Hong; Wang, Feng-Peng","C19-diterpenoid alkaloids from Aconitum hemsleyanum var. circinatum.","Journal of natural products","2007","70","5","876","879","10.1021/np0700117","","","0.71073","MoKα","","0.0411","0.0391","","","0.1508","0.164","","","","","","1.58","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505227","9.186","0.0018","10.212","0.002","54.792","0.011","90","","90","","90","","5139.9","1.8","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H43 N O8 -","- C26 H43 N O8 -","- C208 H344 N8 O64 -","8","2","","Gao, Feng; Chen, Qiao-Hong; Wang, Feng-Peng","C19-diterpenoid alkaloids from Aconitum hemsleyanum var. circinatum.","Journal of natural products","2007","70","5","876","879","10.1021/np0700117","","","0.71073","MoKα","","0.0647","0.0621","","","0.1358","0.1391","","","","","","1.099","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505228","10.6156","0.0007","11.2307","0.0007","21.7108","0.0014","90","","90","","90","","2588.4","0.3","273","2","273","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","withametelin I","","","- C28 H40 O8 -","- C28 H40 O8 -","- C112 H160 O32 -","4","1","","Pan, Yuanhu; Wang, Xiaochuan; Hu, Xianming","Cytotoxic withanolides from the flowers of Datura metel.","Journal of natural products","2007","70","7","1127","1132","10.1021/np070096b","","","0.71073","MoKα","","0.0394","0.033","","","0.0614","0.064","","","","","","1.022","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505229","7.687","0.002","14.383","0.004","16.341","0.005","90","","90","","90","","1806.7","0.9","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 O5 -","- C20 H26 O5 -","- C80 H104 O20 -","4","1","","Wang, Qi; Mu, Qing; Shibano, Makio; Morris-Natschke, Susan L; Lee, Kuo-Hsiung; Chen, Dao-Feng","Eremophilane sesquiterpenes from Ligularia macrophylla.","Journal of natural products","2007","70","8","1259","1262","10.1021/np070113x","","","0.71073","MoKα","","0.0429","0.0368","","","0.0914","0.0944","","","","","","0.991","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505230","11.136","0.002","11.655","0.003","15.148","0.004","90","","90.617","0.007","90","","1965.9","0.8","298","","","","","","","","","","Local laboratory","3","P 1 21 1","P 2yb","4","","","","- C32 H56 O11 -","- C32 H53 O18 -","- C64 H106 O36 -","2","1","","Socolsky, Cecilia; Asakawa, Yoshinori; Bardón, Alicia","Diterpenoid glycosides from the bitter fern Gleichenia quadripartita.","Journal of natural products","2007","70","12","1837","1845","10.1021/np070119m","","","0.71073","MoKα","","0.104","0.0755","","","0.2097","0.2417","","","","","","1.023","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505231","12.667","0.003","23.829","0.005","8.134","0.004","90","0.03","90","0.03","90","0.02","2455.2","1.4","268","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","N134xvii","Numata 134-XVII (amagata)","","- C28 H40 O3 -","- C28 H40 O3 -","- C112 H160 O12 -","4","1","","Amagata, Taro; Tanaka, Makoto; Yamada, Takeshi; Doi, Mitsunobu; Minoura, Katsuhiko; Ohishi, Hirofumi; Yamori, Takao; Numata, Atsushi","Variation in cytostatic constituents of a sponge-derived Gymnascella dankaliensis by manipulating the carbon source.","Journal of natural products","2007","70","11","1731","1740","10.1021/np070165m","","","1.5418","CuKα","","0.0746","0.0625","","","0.1504","0.1599","","","","","","1.036","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505232","22.038","0.006","34.524","0.01","6.446","0.002","90","","90","","90","","4904","2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","gymnasterone D","","","- C28 H38 O2 -","- C28 H38 O2 -","- C224 H304 O16 -","8","2","","Amagata, Taro; Tanaka, Makoto; Yamada, Takeshi; Doi, Mitsunobu; Minoura, Katsuhiko; Ohishi, Hirofumi; Yamori, Takao; Numata, Atsushi","Variation in cytostatic constituents of a sponge-derived Gymnascella dankaliensis by manipulating the carbon source.","Journal of natural products","2007","70","11","1731","1740","10.1021/np070165m","","","1.54178","CuKα","","0.1966","0.1012","","0.3157","0.23","","","","1.168","1.284","1.284","","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505233","7.5523","0.0012","11.1218","0.0014","22.853","0.003","90","","90","","90","","1919.5","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H20 N2 O7 S3 -","- C18 H20 N2 O7 S3 -","- C72 H80 N8 O28 S12 -","4","1","","Zhang, Yonggang; Liu, Shuchun; Che, Yongsheng; Liu, Xingzhong","Epicoccins A-D, epipolythiodioxopiperazines from a Cordyceps-colonizing isolate of Epicoccum nigrum.","Journal of natural products","2007","70","9","1522","1525","10.1021/np070239u","","","0.7107","MoKα","","0.0414","0.0375","","","0.0751","0.0799","","","","","","1.042","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505234","7.7441","0.0005","6.2696","0.0005","35.046","0.003","90","","92.327","0.007","90","","1700.2","0.2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-(4-bromophenyl)-5-(4-tert-butylphenyl)furan","","","- C20 H19 Br O -","- C20 H19 Br O -","- C80 H76 Br4 O4 -","4","1","","Sniady, Adam; Durham, Audrey; Morreale, Marco S.; Wheeler, Kraig A.; Dembinski, Roman","Room temperature zinc chloride-catalyzed cycloisomerization of Alk-3-yn-1-ones: synthesis of substituted furans.","Organic letters","2007","9","7","1175","1178","10.1021/ol062539t","","","1.54178","CuKα","","0.0567","0.0467","","","0.1214","0.1307","","","","","","1.04","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505235","12.2411","0.0009","8.0506","0.0006","16.9934","0.0012","90","","97.352","0.001","90","","1660.9","0.2","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(3-phenyl-1H-indene)-1-spiro-3'-(indolin-2'-one)","","- C22 H15 N O -","- C22 H15 N O -","- C88 H60 N4 O4 -","4","1","","Basavaiah, Deevi; Reddy, Kanumuri Ramesh","Simple and one-pot protocol for synthesis of indene-spiro-oxindoles involving tandem Prins and Friedel-Crafts reactions.","Organic letters","2007","9","1","57","60","10.1021/ol062561m","","","0.71073","MoKα","","0.051","0.0425","","","0.1104","0.117","","","","","","1.022","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505236","23.3988","0.0015","9.0998","0.0006","19.3653","0.0013","90","","113.243","0.001","90","","3788.7","0.4","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","'[6-Methoxy-3-(4-methoxyphenyl) -1H-indene]-1-spiro-3'-(indolin-2'-one)","","- C24 H19 N O3 -","- C24 H19 N O3 -","- C192 H152 N8 O24 -","8","2","","Basavaiah, Deevi; Reddy, Kanumuri Ramesh","Simple and one-pot protocol for synthesis of indene-spiro-oxindoles involving tandem Prins and Friedel-Crafts reactions.","Organic letters","2007","9","1","57","60","10.1021/ol062561m","","","0.71073","MoKα","","0.1204","0.0661","","","0.0998","0.1138","","","","","","1.021","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505237","12.038","0.002","12.112","0.002","14.089","0.002","90","","114.892","0.003","90","","1863.4","0.5","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(3-Phenyl-1H-indene)-1-spiro-3'-(1'-ethylindolin-2'-one)","","- C24 H19 N O -","- C24 H19 N O -","- C96 H76 N4 O4 -","4","1","","Basavaiah, Deevi; Reddy, Kanumuri Ramesh","Simple and one-pot protocol for synthesis of indene-spiro-oxindoles involving tandem Prins and Friedel-Crafts reactions.","Organic letters","2007","9","1","57","60","10.1021/ol062561m","","","0.71073","MoKα","","0.0822","0.0522","","","0.1277","0.1397","","","","","","1.001","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505238","11.237","0.003","17.495","0.004","14.195","0.004","90","","94.841","0.005","90","","2780.7","1.3","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,3-Bis(2,2-diphenylvinyl)indolin-2-one","","- C36 H27 N O -","- C36 H27 N O -","- C144 H108 N4 O4 -","4","1","","Basavaiah, Deevi; Reddy, Kanumuri Ramesh","Simple and one-pot protocol for synthesis of indene-spiro-oxindoles involving tandem Prins and Friedel-Crafts reactions.","Organic letters","2007","9","1","57","60","10.1021/ol062561m","","","0.71073","MoKα","","0.1261","0.0482","","","0.0865","0.106","","","","","","0.867","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505239","16.109","0.007","9.036","0.003","19.383","0.008","90","0.007","94.544","0.007","90","0.007","2812.5","1.9","150.1","","","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C82 H66 -","- C82 H66 -","- C164 H132 -","2","0.5","","Kubo, Takashi; Shimizu, Akihiro; Uruichi, Mikio; Yakushi, Kyuya; Nakano, Masayoshi; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Morita, Yasushi; Nakasuji, Kazuhiro","Singlet biradical character of phenalenyl-based Kekulé hydrocarbon with naphthoquinoid structure.","Organic letters","2007","9","1","81","84","10.1021/ol062604z","","","0.7107","MoKα","","","0.0705","","","","0.1841","","","","","","1.144","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505240","8.9171","0.0015","10.8286","0.0017","11.756","0.002","90","0.0007","94.3574","0.0007","90","0.0007","1131.9","0.3","103","2","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 S2 Si2 -","- C26 H22 S2 Si2 -","- C52 H44 S4 Si4 -","2","0.5","","Mouri, Kazuhiro; Wakamiya, Atsushi; Yamada, Hiroshi; Kajiwara, Takashi; Yamaguchi, Shigehiro","Ladder distyrylbenzenes with silicon and chalcogen bridges: synthesis, structures, and properties.","Organic letters","2007","9","1","93","96","10.1021/ol062615s","","","0.7107","MoKα","","0.032","0.028","","","0.0741","0.076","","","","","","1.053","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505241","11.383","0.003","6.8442","0.0018","15.037","0.004","90","","93.264","0.004","90","","1169.6","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 S2 Si2 -","- C26 H22 S2 Si2 -","- C52 H44 S4 Si4 -","2","0.5","","Mouri, Kazuhiro; Wakamiya, Atsushi; Yamada, Hiroshi; Kajiwara, Takashi; Yamaguchi, Shigehiro","Ladder distyrylbenzenes with silicon and chalcogen bridges: synthesis, structures, and properties.","Organic letters","2007","9","1","93","96","10.1021/ol062615s","","","0.7107","MoKα","","0.0366","0.0309","","","0.0827","0.0849","","","","","","0.997","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505242","8.8891","0.0016","9.8528","0.0018","26.162","0.005","90","0.001","90.8205","0.001","90","0.001","2291.1","0.7","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 Se2 Si2 -","- C26 H22 Se2 Si2 -","- C104 H88 Se8 Si8 -","4","1","","Mouri, Kazuhiro; Wakamiya, Atsushi; Yamada, Hiroshi; Kajiwara, Takashi; Yamaguchi, Shigehiro","Ladder distyrylbenzenes with silicon and chalcogen bridges: synthesis, structures, and properties.","Organic letters","2007","9","1","93","96","10.1021/ol062615s","","","0.7107","MoKα","","0.0353","0.0282","","","0.0652","0.0688","","","","","","1.08","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505243","13.042","0.004","6.878","0.002","14.555","0.005","90","0.0011","106.698","0.0014","90","0.0011","1250.6","0.7","123","2","123","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C26 H22 O4 S2 Si2 -","- C26 H22 O4 S2 Si2 -","- C52 H44 O8 S4 Si4 -","2","0.5","","Mouri, Kazuhiro; Wakamiya, Atsushi; Yamada, Hiroshi; Kajiwara, Takashi; Yamaguchi, Shigehiro","Ladder distyrylbenzenes with silicon and chalcogen bridges: synthesis, structures, and properties.","Organic letters","2007","9","1","93","96","10.1021/ol062615s","","","0.7107","MoKα","","0.07","0.0523","","","0.1107","0.1198","","","","","","1.128","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505244","9.057","0.003","13.776","0.004","10.813","0.004","90","0.0009","113.927","0.0011","90","0.0009","1233.2","0.7","103","2","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 O4 S2 Si2 -","- C26 H22 O4 S2 Si2 -","- C52 H44 O8 S4 Si4 -","2","0.5","","Mouri, Kazuhiro; Wakamiya, Atsushi; Yamada, Hiroshi; Kajiwara, Takashi; Yamaguchi, Shigehiro","Ladder distyrylbenzenes with silicon and chalcogen bridges: synthesis, structures, and properties.","Organic letters","2007","9","1","93","96","10.1021/ol062615s","","","0.7107","MoKα","","0.0675","0.0498","","","0.1139","0.1239","","","","","","1.115","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505245","5.9407","0.0012","10.466","0.002","9.3103","0.0019","90","","90","0.03","90","","578.9","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C11 H19 N O4 -","- C11 H19 N O4 -","- C22 H38 N2 O8 -","2","1","","Shing, Tony K. M.; Wong, Wai F.; Ikeno, Taketo; Yamada, Tohru","trans-acetonide controlled endo-selective intramolecular nitrone-alkene cycloaddition of hept-6-enoses: a facile entry to calystegines, tropanes, and hydroxylated aminocycloheptanes.","Organic letters","2007","9","2","207","209","10.1021/ol062621o","","","0.71073","MoKα","","0.067","0.0493","","","0.125","0.136","","","","","","1.036","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505246","9.6762","0.001","11.9288","0.0013","19.077","0.002","90","","90","","90","","2202","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H29 N O5 -","- C24 H29 N O5 -","- C96 H116 N4 O20 -","4","1","","Shing, Tony K. M.; Wong, Wai F.; Ikeno, Taketo; Yamada, Tohru","trans-acetonide controlled endo-selective intramolecular nitrone-alkene cycloaddition of hept-6-enoses: a facile entry to calystegines, tropanes, and hydroxylated aminocycloheptanes.","Organic letters","2007","9","2","207","209","10.1021/ol062621o","","","0.71073","MoKα","","0.1418","0.0545","","","0.1338","0.1916","","","","","","1.074","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505247","8.3847","0.0017","10.637","0.002","22.556","0.005","90","","90","","90","","2011.7","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H33 N O4 Si -","- C17 H33 N O4 Si -","- C68 H132 N4 O16 Si4 -","4","1","","Shing, Tony K. M.; Wong, Wai F.; Ikeno, Taketo; Yamada, Tohru","trans-acetonide controlled endo-selective intramolecular nitrone-alkene cycloaddition of hept-6-enoses: a facile entry to calystegines, tropanes, and hydroxylated aminocycloheptanes.","Organic letters","2007","9","2","207","209","10.1021/ol062621o","","","0.71073","MoKα","","0.2339","0.0666","","","0.1517","0.2074","","","","","","0.941","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505248","8.1168","0.0019","10.068","0.002","11.493","0.003","93.001","0.004","98.563","0.004","98.08","0.004","916.9","0.4","292","2","292","2","","","","","","","","2","P -1","-P 1","2","","","","- C25 H22 -","- C25 H22 -","- C50 H44 -","2","1","","Shao, Li-Xiong; Zhang, Yun-Peng; Qi, Ming-Hui; Shi, Min","Lewis acid catalyzed rearrangement of vinylcyclopropenes for the construction of naphthalene and indene skeletons.","Organic letters","2007","9","1","117","120","10.1021/ol0626746","","","0.71073","MoKα","","0.0933","0.0655","","","0.1722","0.1867","","","","","","1.033","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505249","12.5896","0.0012","9.1294","0.0008","17.6833","0.0016","90","","102.192","0.002","90","","1986.6","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C25 H20 F2 -","- C25 H20 F2 -","- C100 H80 F8 -","4","1","","Shao, Li-Xiong; Zhang, Yun-Peng; Qi, Ming-Hui; Shi, Min","Lewis acid catalyzed rearrangement of vinylcyclopropenes for the construction of naphthalene and indene skeletons.","Organic letters","2007","9","1","117","120","10.1021/ol0626746","","","0.71073","MoKα","","0.0733","0.0431","","","0.1098","0.121","","","","","","0.895","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505250","5.51","0.01","15.22","0.01","10.76","0.01","90","","95.3","0.1","90","","898.5","1.9","296.2","","296.2","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H20 Br N3 O4 -","- C18 H20 Br N3 O4 -","- C36 H40 Br2 N6 O8 -","2","1","","Suga, Hiroyuki; Funyu, Akira; Kakehi, Akikazu","Highly enantioselective and diastereoselective 1,3-dipolar cycloaddition reactions between azomethine imines and 3-acryloyl-2-oxazolidinone catalyzed by binaphthyldiimine-Ni(II) complexes.","Organic letters","2007","9","1","97","100","10.1021/ol062675y","","","0.7107","MoKα","","0.0757","0.076","","0.051","","0.051","","","4.054","","","4.05","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505251","6.2966","0.0001","12.3168","0.0003","26.7947","0.0007","90","","90","","90","","2078.04","0.08","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","rac-(1R,2S,6R,7R,10R)-1,10-dibromotricyclo[5.2.2.0^2,6^]undeca-4,8-diene","","- C11 H12 Br2 -","- C11 H12 Br2 -","- C88 H96 Br16 -","8","2","","Su, Kuan-Jen; Mieusset, Jean-Luc; Arion, Vladimir B.; Brecker, Lothar; Brinker, Udo H.","Cope rearrangement versus a novel tandem retro-Diels-Alder-Diels-Alder reaction with role reversal.","Organic letters","2007","9","1","113","115","10.1021/ol0626793","","","0.71073","MoKα","","0.0409","0.0261","","","0.0435","0.0473","","","","","","1.039","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505252","9.6375","0.0008","10.0279","0.0008","11.1469","0.0009","90","","109.864","0.004","90","","1013.18","0.14","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4,4-dibromotetracyclo[6.2.1.0^2,7^.0^3,5^]undec-9-ene","","- C11 H12 Br2 -","- C11 H12 Br2 -","- C44 H48 Br8 -","4","1","","Su, Kuan-Jen; Mieusset, Jean-Luc; Arion, Vladimir B.; Brecker, Lothar; Brinker, Udo H.","Cope rearrangement versus a novel tandem retro-Diels-Alder-Diels-Alder reaction with role reversal.","Organic letters","2007","9","1","113","115","10.1021/ol0626793","","","0.71073","MoKα","","0.0248","0.0204","","","0.0524","0.0546","","","","","","1.014","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505253","13.0891","0.0012","10.9312","0.0009","14.527","0.0013","90","","90","","90","","2078.5","0.3","100","2","100","2","","","","","","","","3","P n a 21","P 2c -2n","33","","4,5exo-dibromo-endo-tricyclo[6.2.1.0^2,7^]undeca-3,9-diene","","- C11 H12 Br2 -","- C11 H12 Br2 -","- C88 H96 Br16 -","8","2","","Su, Kuan-Jen; Mieusset, Jean-Luc; Arion, Vladimir B.; Brecker, Lothar; Brinker, Udo H.","Cope rearrangement versus a novel tandem retro-Diels-Alder-Diels-Alder reaction with role reversal.","Organic letters","2007","9","1","113","115","10.1021/ol0626793","","","0.71073","MoKα","","0.0387","0.0277","","","0.0627","0.0669","","","","","","1.039","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505254","12.886","0.003","11.131","0.002","7.185","0.001","90","","90","","90","","1030.6","0.3","100","2","100","2","","","","","","","","3","P n a 21","P 2c -2n","33","","rac-(1R,2S,6R,7R,10R)-1,10-dibromotricyclo[5.2.2.0^2,6^]undeca-3,8-diene","","- C11 H12 Br2 -","- C11 H12 Br2 -","- C44 H48 Br8 -","4","1","","Su, Kuan-Jen; Mieusset, Jean-Luc; Arion, Vladimir B.; Brecker, Lothar; Brinker, Udo H.","Cope rearrangement versus a novel tandem retro-Diels-Alder-Diels-Alder reaction with role reversal.","Organic letters","2007","9","1","113","115","10.1021/ol0626793","","","0.71073","MoKα","","0.0255","0.0199","","","0.0369","0.0378","","","","","","1.021","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505255","7.615","0.016","9.91","0.02","12.33","0.02","98.11","0.02","96.8","0.02","96.62","0.03","906","3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H17 I O4 -","- C20 H17 I O4 -","- C40 H34 I2 O8 -","2","1","","Bi, Hai-Peng; Guo, Li-Na; Duan, Xin-Hua; Gou, Fa-Rong; Huang, Shu-Hao; Liu, Xue-Yuan; Liang, Yong-Min","Highly regio- and stereoselective synthesis of indene derivatives via electrophilic cyclization.","Organic letters","2007","9","3","397","400","10.1021/ol062683e","","","0.71073","MoKα","","0.0992","0.0789","","","0.1902","0.2136","","","","","","1.008","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505256","10.437","0.004","14.854","0.005","15.209","0.005","78.149","0.007","73.206","0.007","81.63","0.006","2199.8","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H43 N11 O14 Zn2 -","- C41 H43 N11 O14 Zn2 -","- C82 H86 N22 O28 Zn4 -","2","1","","Lee, Han Na; Swamy, K. M. K.; Kim, Sook Kyung; Kwon, Ji-Young; Kim, Youngmee; Kim, Sung-Jin; Yoon, Yeo Joon; Yoon, Juyoung","Simple but effective way to sense pyrophosphate and inorganic phosphate by fluorescence changes.","Organic letters","2007","9","2","243","246","10.1021/ol062685z","","","0.71073","MoKα","","0.1754","0.0465","","","0.0687","0.0864","","","","","","0.497","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505257","9.153","0.002","15.111","0.001","10.39","0.001","90","","104.49","0.01","90","","1391.3","0.4","223.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H19 Ni P S -","- C12 H19 Ni P S -","- C48 H76 Ni4 P4 S4 -","4","1","","Hua, Ruimao; Takeda, Hideaki; Onozawa, Shun-ya; Abe, Yoshimoto; Tanaka, Masato","Nickel-catalyzed thioallylation of alkynes with allyl phenyl sulfides.","Organic letters","2007","9","2","263","266","10.1021/ol062686r","","","0.7107","MoKα","","","0.0295","","","","0.0966","","","","","","1.127","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505258","16.382","0.002","17.248","0.002","6.272","0.003","90","","90","","90","","1772.2","0.9","203.2","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C23 H20 S -","- C23 H20 S -","- C92 H80 S4 -","4","1","","Hua, Ruimao; Takeda, Hideaki; Onozawa, Shun-ya; Abe, Yoshimoto; Tanaka, Masato","Nickel-catalyzed thioallylation of alkynes with allyl phenyl sulfides.","Organic letters","2007","9","2","263","266","10.1021/ol062686r","","","0.7107","MoKα","","","0.0412","","","","0.1035","","","","","","1.078","","","","has coordinates,has disorder","201954","2020-10-21","18:00:00",""
"1505259","7.296","0.005","26.087","0.005","9.364","0.005","90","","126.758","0.005","90","","1427.9","1.3","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 I N O3 -","- C14 H14 I N O3 -","- C56 H56 I4 N4 O12 -","4","1","","Conreaux, David; Bossharth, Emmanuel; Monteiro, Nuno; Desbordes, Philippe; Vors, Jean-Pierre; Balme, Geneviève","Flexible strategy for differentially 3,5-disubstituted 4-oxypyridin-2(1H)-ones based on site-selective Pd-catalyzed cross-coupling reactions.","Organic letters","2007","9","2","271","274","10.1021/ol062721u","","","0.71069","MoKα","","0.0643","0.0273","","0.0542","0.0308","0.0308","","","","","","1.0891","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505260","6.751","","11.662","","23.577","","90","","90","","90","","1856.22","","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 O4 -","- C20 H26 O4 -","- C80 H104 O16 -","4","1","","Xu, Gang; Hou, Ai-Jun; Zheng, Yong-Tang; Zhao, Yu; Li, Xiao-Li; Peng, Li-Yan; Zhao, Qin-Shi","Przewalskin B, a novel diterpenoid with an unprecedented skeleton from Salvia przewalskii maxim.","Organic letters","2007","9","2","291","293","10.1021/ol062748d","","","0.71073","MoKα","","0.1436","0.0752","","","0.1421","0.1671","","","","","","0.91","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505261","8.6574","0.0011","6.3454","0.0008","14.4396","0.0018","90","","102.638","0.002","90","","774.02","0.17","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H16 N2 -","- C20 H16 N2 -","- C40 H32 N4 -","2","1","","Liu, Yuanhong; Song, Zhiquan; Yan, Bin","General and direct synthesis of 3-aminoindolizines and their analogues via Pd/Cu-catalyzed sequential cross-coupling/cycloisomerization reactions.","Organic letters","2007","9","3","409","412","10.1021/ol062766v","","","0.71073","MoKα","","0.0507","0.039","","","0.0821","0.0873","","","","","","0.949","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505262","28.02","0.0012","10.6337","0.0003","10.9221","0.0004","90","","100.33","0.003","90","","3201.6","0.2","110.1","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C42 H28 N6 -","- C42 H28 N6 -","- C168 H112 N24 -","4","0.5","","Han, Fu She; Higuchi, Masayoshi; Kurth, Dirk G.","Diverse synthesis of novel Bisterpyridines via Suzuki-type cross-coupling.","Organic letters","2007","9","4","559","562","10.1021/ol062788h","","","1.54187","CuKα","","","0.0445","","","","0.1404","","","","","","1.046","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505263","6.0896","0.0011","22.401","0.004","26.176","0.005","90","","90","","90","","3570.8","1.1","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C42 H48 O6 -","- C42 H48 O6 -","- C168 H192 O24 -","4","1","","Ko, Haye Min; Lee, Dong Gil; Kim, Min Ah; Kim, Hak Joong; Park, Jaejoon; Lah, Myoung Soo; Lee, Eun","Total synthesis of (-)-blepharocalyxin D.","Organic letters","2007","9","1","141","144","10.1021/ol0627956","","","0.71073","MoKα","","0.1181","0.0691","","","0.1265","0.1417","","","","","","1.057","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505264","7.251","0.0004","8.4985","0.0005","14.7866","0.0009","96.0595","0.0017","106.766","0.0015","109.7","0.0014","800.33","0.08","173.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C15 H20 Cl2 Ir N O -","- C15 H19 Cl2 Ir N O -","- C30 H38 Cl4 Ir2 N2 O2 -","2","1","","Fujita, Ken-ichi; Tanino, Nobuhide; Yamaguchi, Ryohei","Ligand-promoted dehydrogenation of alcohols catalyzed by Cp*Ir complexes. A new catalytic system for oxidant-free oxidation of alcohols.","Organic letters","2007","9","1","109","111","10.1021/ol062806v","","","0.71075","MoKα","","","0.0438","","","","0.0571","","","","","","1.045","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505265","7.2559","0.0002","13.5691","0.0003","8.4425","0.0002","90","","109.208","0.0009","90","","784.94","0.03","173.1","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C15 H20 Cl2 Ir N O -","- C15 H19 Cl2 Ir N O -","- C30 H38 Cl4 Ir2 N2 O2 -","2","1","","Fujita, Ken-ichi; Tanino, Nobuhide; Yamaguchi, Ryohei","Ligand-promoted dehydrogenation of alcohols catalyzed by Cp*Ir complexes. A new catalytic system for oxidant-free oxidation of alcohols.","Organic letters","2007","9","1","109","111","10.1021/ol062806v","","","0.71075","MoKα","","","0.0298","","","","0.0298","","","","","","0.926","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505266","14.1344","0.0004","14.996","0.0004","15.2331","0.0004","90","","90","","90","","3228.8","0.15","173.1","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C15 H20 Cl2 Ir N O -","- C15 H19 Cl2 Ir N O -","- C120 H152 Cl16 Ir8 N8 O8 -","8","1","","Fujita, Ken-ichi; Tanino, Nobuhide; Yamaguchi, Ryohei","Ligand-promoted dehydrogenation of alcohols catalyzed by Cp*Ir complexes. A new catalytic system for oxidant-free oxidation of alcohols.","Organic letters","2007","9","1","109","111","10.1021/ol062806v","","","0.71075","MoKα","","","0.0271","","","","0.031","","","","","","1.099","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505267","7.848","0.0002","12.7189","0.0003","15.2177","0.0004","90","","90","","90","","1519","0.07","173.1","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H19 Cl Ir N O -","- C15 H19 Cl Ir N O -","- C60 H76 Cl4 Ir4 N4 O4 -","4","1","","Fujita, Ken-ichi; Tanino, Nobuhide; Yamaguchi, Ryohei","Ligand-promoted dehydrogenation of alcohols catalyzed by Cp*Ir complexes. A new catalytic system for oxidant-free oxidation of alcohols.","Organic letters","2007","9","1","109","111","10.1021/ol062806v","","","0.71075","MoKα","","","0.0334","","","","0.0374","","","","","","1.089","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505268","11.7745","0.0002","16.8129","0.0003","19.8021","0.0004","90","","90","","90","","3920.09","0.12","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C47 H50 O7 S -","- C47 H50 O7 S -","- C188 H200 O28 S4 -","4","1","","Yakovenko, Anton V.; Boyko, Vyacheslav I.; Danylyuk, Oksana; Suwinska, Kinga; Lipkowski, Janusz; Kalchenko, Vitaly I.","Diastereoselective lower rim (1S)-camphorsulfonylation as the shortest way to the inherently chiral calix[4]arene.","Organic letters","2007","9","7","1183","1185","10.1021/ol0628513","","","0.71073","MoKα","","0.0487","0.0346","","","0.0675","0.0698","","","","","","0.961","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505269","11.1455","0.0002","15.2453","0.0003","11.5346","0.0002","90","","95.8198","0.0008","90","","1949.82","0.06","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C42 H45 Cl3 O7 S -","- C42 H45 Cl3 O7 S -","- C84 H90 Cl6 O14 S2 -","2","1","","Yakovenko, Anton V.; Boyko, Vyacheslav I.; Danylyuk, Oksana; Suwinska, Kinga; Lipkowski, Janusz; Kalchenko, Vitaly I.","Diastereoselective lower rim (1S)-camphorsulfonylation as the shortest way to the inherently chiral calix[4]arene.","Organic letters","2007","9","7","1183","1185","10.1021/ol0628513","","","0.71073","MoKα","","0.0555","0.0423","","","0.1027","0.1079","","","","","","1.064","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505270","14.0769","0.0008","10.8418","0.0006","30.997","0.0017","90","","98.333","0.001","90","","4680.8","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C48.5 H60 O10 S2 -","- C48.5 H56 O10 S2 -","- C194 H224 O40 S8 -","4","1","","Lee, Jai Young; Kwon, Jongchul; Park, Chul Soon; Lee, Ji-Eun; Sim, Wonbo; Kim, Jong Seung; Seo, Joobeom; Yoon, Il; Jung, Jong Hwa; Lee, Shim Sung","Calix[4]thiacrowns as ditopic hosts for homo- and heterobinuclear accommodation: first report of a chopsticks-type pi-coordination.","Organic letters","2007","9","3","493","496","10.1021/ol062863o","","","0.71073","MoKα","","0.1259","0.075","","","0.2282","0.2672","","","","","","1.093","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505271","18.5095","0.0016","11.1086","0.001","22.85","0.002","90","","90","","90","","4698.3","0.7","546","2","546","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C48 H60 O8 S4 -","- C48 H60 O8 S4 -","- C192 H240 O32 S16 -","4","1","","Lee, Jai Young; Kwon, Jongchul; Park, Chul Soon; Lee, Ji-Eun; Sim, Wonbo; Kim, Jong Seung; Seo, Joobeom; Yoon, Il; Jung, Jong Hwa; Lee, Shim Sung","Calix[4]thiacrowns as ditopic hosts for homo- and heterobinuclear accommodation: first report of a chopsticks-type pi-coordination.","Organic letters","2007","9","3","493","496","10.1021/ol062863o","","","0.71073","MoKα","","0.168","0.0808","","","0.1443","0.1734","","","","","","1.092","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505272","16.4451","0.001","17.1416","0.001","21.7675","0.0012","90","","96.026","0.001","90","","6102.3","0.6","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C27 H37 Ag F6 N O5 P S2 -","- C27 H37 Ag F6 N O5 P S2 -","- C216 H296 Ag8 F48 N8 O40 P8 S16 -","8","1","","Lee, Jai Young; Kwon, Jongchul; Park, Chul Soon; Lee, Ji-Eun; Sim, Wonbo; Kim, Jong Seung; Seo, Joobeom; Yoon, Il; Jung, Jong Hwa; Lee, Shim Sung","Calix[4]thiacrowns as ditopic hosts for homo- and heterobinuclear accommodation: first report of a chopsticks-type pi-coordination.","Organic letters","2007","9","3","493","496","10.1021/ol062863o","","","0.71073","MoKα","","0.0517","0.0351","","","0.0821","0.0906","","","","","","1.053","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505273","10.9278","0.0012","10.6803","0.0011","24.621","0.003","90","","90","","90","","2873.6","0.6","203","2","203","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C16 H19 N O4 -","- C16 H19 N O4 -","- C128 H152 N8 O32 -","8","1","","Souweha, Michael Santos; Arab, Akram; ApSimon, Megan; Fallis, Alex G.","Diene-transmissive cycloadditions: control of monocycloaddition by self-assembly on a Lewis acid template.","Organic letters","2007","9","4","615","618","10.1021/ol062869d","","","0.71073","MoKα","","0.0642","0.0401","","","0.0977","0.115","","","","","","1.041","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505274","7.434","0.003","11.335","0.005","16.304","0.007","90","","90","","90","","1373.8","1","210","2","210","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C16 H19 N O4 -","- C16 H19 N O4 -","- C64 H76 N4 O16 -","4","1","","Souweha, Michael Santos; Arab, Akram; ApSimon, Megan; Fallis, Alex G.","Diene-transmissive cycloadditions: control of monocycloaddition by self-assembly on a Lewis acid template.","Organic letters","2007","9","4","615","618","10.1021/ol062869d","","","0.71073","MoKα","","0.0348","0.0307","","","0.0826","0.0851","","","","","","1.057","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505275","8.2927","0.0016","9.8597","0.0019","10.814","0.002","104.025","0.002","103.657","0.002","95.315","0.002","823","0.3","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 N2 O5 -","- C18 H22 N2 O5 -","- C36 H44 N4 O10 -","2","1","","Souweha, Michael Santos; Arab, Akram; ApSimon, Megan; Fallis, Alex G.","Diene-transmissive cycloadditions: control of monocycloaddition by self-assembly on a Lewis acid template.","Organic letters","2007","9","4","615","618","10.1021/ol062869d","","","0.71073","MoKα","","0.0772","0.0505","","","0.1278","0.1445","","","","","","1.016","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505276","8.6357","0.0017","9.0665","0.0018","15.412","0.003","90","","90","","90","","1206.7","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H15 N O5 -","- C11 H15 N O5 -","- C44 H60 N4 O20 -","4","1","","Shing, Tony K. M.; Wong, Wai F.; Cheng, Hau M.; Kwok, Wun S.; So, King H.","Intramolecular nitrile oxide-alkene cycloaddition of sugar derivatives with unmasked hydroxyl group(s).","Organic letters","2007","9","5","753","756","10.1021/ol062873p","","","0.71073","MoKα","","0.0861","0.0487","","","0.1319","0.1497","","","","","","1.02","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505277","8.0623","0.0012","10.3743","0.0016","15.809","0.002","90","","90","","90","","1322.3","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H17 N O5 -","- C12 H17 N O5 -","- C48 H68 N4 O20 -","4","1","","Shing, Tony K. M.; Wong, Wai F.; Cheng, Hau M.; Kwok, Wun S.; So, King H.","Intramolecular nitrile oxide-alkene cycloaddition of sugar derivatives with unmasked hydroxyl group(s).","Organic letters","2007","9","5","753","756","10.1021/ol062873p","","","0.71073","MoKα","","0.0863","0.0419","","","0.101","0.1241","","","","","","0.998","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505278","7.241","0.0009","8.3118","0.0011","9.2383","0.0012","90","","112.902","0.002","90","","512.18","0.11","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H15 N O4 -","- C10 H15 N O4 -","- C20 H30 N2 O8 -","2","1","","Shing, Tony K. M.; Wong, Wai F.; Cheng, Hau M.; Kwok, Wun S.; So, King H.","Intramolecular nitrile oxide-alkene cycloaddition of sugar derivatives with unmasked hydroxyl group(s).","Organic letters","2007","9","5","753","756","10.1021/ol062873p","","","0.71073","MoKα","","0.0388","0.035","","","0.0876","0.0911","","","","","","1.04","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505279","7.1732","0.0019","7.1417","0.0019","14.467","0.004","90","","96.269","0.005","90","","736.7","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H21 N O6 -","- C13 H21 N O6 -","- C26 H42 N2 O12 -","2","1","","Shing, Tony K. M.; Wong, Wai F.; Cheng, Hau M.; Kwok, Wun S.; So, King H.","Intramolecular nitrile oxide-alkene cycloaddition of sugar derivatives with unmasked hydroxyl group(s).","Organic letters","2007","9","5","753","756","10.1021/ol062873p","","","0.71073","MoKα","","0.0565","0.0378","","","0.0909","0.1045","","","","","","1.026","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505280","7.6885","0.0002","13.6801","0.0003","8.0672","0.0002","90","","106.725","0.001","90","","812.61","0.03","223","2","223","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H17 N O3 S -","- C18 H17 N O3 S -","- C36 H34 N2 O6 S2 -","2","1","","Li, Hao; Wang, Jian; Xie, Hexin; Zu, Liansuo; Jiang, Wei; Duesler, Eileen N.; Wang, Wei","Chiral Diphenylprolinol TES ether promoted conjugate addition-aldol-dehydration reactions between alpha,beta-unsaturated aldehydes and 2-N-protected amino benzaldehydes.","Organic letters","2007","9","6","965","968","10.1021/ol062877u","","","0.71073","MoKα","","0.0548","0.0387","","","0.0953","0.1074","","","","","","1.056","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505281","8.6266","0.0017","14.638","0.003","19.114","0.004","90","","90","","90","","2413.6","0.9","133","2","133","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H36 N2 O3 -","- C26 H36 N2 O3 -","- C104 H144 N8 O12 -","4","1","","Sünnemann, Hans Wolf; Hofmeister, Anja; Magull, Jörg; Banwell, Martin G.; de Meijere, Armin","Stille/Diels-Alder reaction sequences: diversity-oriented access to novel steroids.","Organic letters","2007","9","3","517","520","10.1021/ol062878m","","","0.71073","MoKα","","0.0413","0.0341","","","0.0715","0.0738","","","","","","1.058","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505282","5.9811","0.0002","11.312","0.0003","33.5143","0.001","90","","90","","90","","2267.52","0.12","133","2","133","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C26 H36 O6 -","- C26 H36 O6 -","- C104 H144 O24 -","4","1","","Sünnemann, Hans Wolf; Hofmeister, Anja; Magull, Jörg; Banwell, Martin G.; de Meijere, Armin","Stille/Diels-Alder reaction sequences: diversity-oriented access to novel steroids.","Organic letters","2007","9","3","517","520","10.1021/ol062878m","","","0.71073","MoKα","","0.0282","0.026","","","0.0652","0.0662","","","","","","0.996","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505283","23.8","0.01","6.428","0.003","15.69","0.008","90","","121.35","0.02","90","","2049.9","1.7","93.1","","","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C22 H26 N2 O7 -","- C22 H26 N2 O7 -","- C88 H104 N8 O28 -","4","1","","Watanabe, Hideaki; Takano, Masashi; Umino, Akinori; Ito, Toshiya; Ishikawa, Hiroyuki; Nakada, Masahisa","Enantioselective total synthesis of (-)-erinacine B.","Organic letters","2007","9","2","359","362","10.1021/ol0628816","","","0.7107","MoKα","","","0.032","","","","0.089","","","","","","0.994","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505284","14.8357","0.0003","27.4469","0.0006","34.5254","0.001","90","","93.01","0.01","90","","14039.1","0.6","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C148 H176 O26 -","- C136 H152 O20 -","- C544 H608 O80 -","4","1","","Srinivasan, Kannupal; Gibb, Bruce C.","Electrophilic substitution of deep cavity cavitands: selective exo functionalization of molecular concavity.","Organic letters","2007","9","5","745","748","10.1021/ol062897w","","","0.71073","MoKα","","0.2153","0.1048","","","0.1762","0.1867","","","","","","1.926","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505285","11.681","0.004","14.113","0.004","14.416","0.005","90","","99.034","0.007","90","","2347.1","1.3","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H54 Cl2 N6 O16 -","- C44 H54 Cl2 N6 O16 -","- C88 H108 Cl4 N12 O32 -","2","0.5","","Li, Liwei; Clarkson, Guy J.","New bis(benzimidazole) cations for threading through dibenzo-24-crown-8.","Organic letters","2007","9","3","497","500","10.1021/ol062912x","","","0.71073","MoKα","","0.1275","0.0524","","","0.1174","0.1403","","","","","","0.894","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505286","12.05","0.002","14.681","0.003","13.807","0.003","90","","91.924","0.006","90","","2441.2","0.8","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H54 F12 N6 O8 P2 -","- C44 H54 F12 N6 O8 P2 -","- C88 H108 F24 N12 O16 P4 -","2","0.5","","Li, Liwei; Clarkson, Guy J.","New bis(benzimidazole) cations for threading through dibenzo-24-crown-8.","Organic letters","2007","9","3","497","500","10.1021/ol062912x","","","0.71073","MoKα","","0.1277","0.0609","","","0.1341","0.1584","","","","","","1","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505287","8.9434","0.0004","11.1496","0.0006","12.0657","0.0006","81.761","0.001","80.448","0.001","77.741","0.001","1152.09","0.1","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H54 Cl2 N6 O20 -","- C42 H54 Cl2 N6 O20 -","- C42 H54 Cl2 N6 O20 -","1","0.5","","Li, Liwei; Clarkson, Guy J.","New bis(benzimidazole) cations for threading through dibenzo-24-crown-8.","Organic letters","2007","9","3","497","500","10.1021/ol062912x","","","0.71073","MoKα","","0.0676","0.0439","","","0.1023","0.1088","","","","","","0.908","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505288","9.087","0.002","11.84","0.003","12.043","0.003","87.468","0.006","86.957","0.007","84.55","0.006","1287","0.5","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H54 F6 N6 O18 S2 -","- C44 H54 F6 N6 O18 S2 -","- C44 H54 F6 N6 O18 S2 -","1","0.5","","Li, Liwei; Clarkson, Guy J.","New bis(benzimidazole) cations for threading through dibenzo-24-crown-8.","Organic letters","2007","9","3","497","500","10.1021/ol062912x","","","0.71073","MoKα","","0.1373","0.0785","","","0.1602","0.1987","","","","","","1.033","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505289","11.526","0.01","14.191","0.013","14.332","0.013","90","","100.314","0.015","90","","2306","4","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H54 B2 F8 N6 O8 -","- C44 H54 B2 F8 N6 O8 -","- C88 H108 B4 F16 N12 O16 -","2","0.5","","Li, Liwei; Clarkson, Guy J.","New bis(benzimidazole) cations for threading through dibenzo-24-crown-8.","Organic letters","2007","9","3","497","500","10.1021/ol062912x","","","0.71073","MoKα","","0.0818","0.0614","","","0.15","0.1615","","","","","","1.038","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505290","11.863","0.011","14.597","0.013","14.378","0.013","90","","90.232","0.016","90","","2490","4","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H54 F12 N6 O12 P2 -","- C42 H54 F12 N6 O12 P2 -","- C84 H108 F24 N12 O24 P4 -","2","0.5","","Li, Liwei; Clarkson, Guy J.","New bis(benzimidazole) cations for threading through dibenzo-24-crown-8.","Organic letters","2007","9","3","497","500","10.1021/ol062912x","","","0.71073","MoKα","","0.1089","0.0669","","","0.1677","0.1906","","","","","","1.028","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505291","8.8787","0.0016","11.0339","0.0013","12.038","0.002","81.477","0.012","79.33","0.015","77.735","0.012","1125.2","0.3","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H54 B2 F8 N6 O12 -","- C42 H54 B2 F8 N6 O12 -","- C42 H54 B2 F8 N6 O12 -","1","0.5","","Li, Liwei; Clarkson, Guy J.","New bis(benzimidazole) cations for threading through dibenzo-24-crown-8.","Organic letters","2007","9","3","497","500","10.1021/ol062912x","","","0.71073","MoKα","","0.0889","0.0594","","","0.1653","0.1736","","","","","","1.023","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505292","7.3631","0.0007","7.7051","0.0007","41.717","0.004","90","","90","","90","","2366.7","0.4","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H13 B Br N -","- C12 H13 B Br N -","- C96 H104 B8 Br8 N8 -","8","2","","Pan, Jun; Kampf, Jeff W.; Ashe, 3rd, Arthur J","Electrophilic aromatic substitution reactions of 1,2-dihydro-1,2-azaborines.","Organic letters","2007","9","4","679","681","10.1021/ol062968r","","","0.71073","MoKα","","0.0326","0.031","","","0.0719","0.0724","","","","","","1.24","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505293","28.966","0.003","6.2068","0.0006","7.5794","0.0007","90","","102.961","0.002","90","","1328","0.2","298","2","298","2","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C18 H13 Cl -","- C18 H13 Cl -","- C72 H52 Cl4 -","4","1","","Su, Weike; Jin, Can","First catalytic and green synthesis of aryl-(Z)-vinyl chlorides and its plausible addition-elimination mechanism.","Organic letters","2007","9","6","993","996","10.1021/ol062991c","","","0.71073","MoKα","","0.0362","0.0356","","","0.0897","0.0901","","","","","","1.162","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505294","11.214","0.005","5.672","0.002","13.715","0.006","90","","105.745","0.007","90","","839.6","0.6","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H19 N O6 -","- C17 H19 N O6 -","- C34 H38 N2 O12 -","2","1","","Kotkar, Shriram P.; Chavan, Vilas B.; Sudalai, Arumugam","Organocatalytic sequential alpha-amination-Horner-Wadsworth-Emmons olefination of aldehydes: enantioselective synthesis of gamma-amino-alpha,beta-unsaturated esters.","Organic letters","2007","9","6","1001","1004","10.1021/ol063012j","","","0.71073","MoKα","","0.0627","0.0426","","","0.0797","0.0887","","","","","","1.049","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505295","10.3024","0.0011","13.1964","0.0013","11.0369","0.0011","90","","91.614","0.002","90","","1499.9","0.3","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H14 N2 O2 -","- C19 H14 N2 O2 -","- C76 H56 N8 O8 -","4","2","","Sliwinska, Anna; Czardybon, Wojciech; Warkentin, John","Zwitterion from a cyclopropane with geminal donor and acceptor groups.","Organic letters","2007","9","4","695","698","10.1021/ol063021s","","","0.71073","MoKα","","0.053","0.0449","","","0.1153","0.1222","","","","","","1.038","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505296","24.9214","0.0014","9.2923","0.0005","14.641","0.0008","90","","121.845","0.002","90","","2880.2","0.3","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H20 N2 O2 -","- C16 H20 N2 O2 -","- C128 H160 N16 O16 -","8","1","","Sliwinska, Anna; Czardybon, Wojciech; Warkentin, John","Zwitterion from a cyclopropane with geminal donor and acceptor groups.","Organic letters","2007","9","4","695","698","10.1021/ol063021s","","","1.54178","CuKα","","0.0525","0.0379","","","0.0969","0.1061","","","","","","1.038","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505297","5.811","0.003","20.027","0.01","12.31","0.005","90","","113.28","0.02","90","","1316","1.1","98","2","98","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 Br2 N2 O2 -","- C13 H12 Br2 N2 O2 -","- C52 H48 Br8 N8 O8 -","4","1","","Meketa, Matthew L.; Weinreb, Steven M.","A new total synthesis of the zinc matrixmetalloproteinase inhibitor ageladine A featuring a biogenetically patterned 6pi-2-azatriene electrocyclization.","Organic letters","2007","9","5","853","855","10.1021/ol063038a","","","0.71073","MoKα","","0.0568","0.0434","","","0.1143","0.124","","","","","","1.035","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505298","20.566","0.004","8.9517","0.0019","12.707","0.003","90","","105.591","0.014","90","","2253.3","0.9","295","","295","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","beta(T2-T2)","3,3'-bi(thieno[3,2-b]thiophene)","","- C12 H6 S4 -","- C12 H6 S4 -","- C96 H48 S32 -","8","1","","San Miguel, Lidaris; Porter, 3rd, William W; Matzger, Adam J.","Planar beta-linked oligothiophenes based on thieno[3,2-b]thiophene and dithieno[3,2-b:2',3'-d]thiophene fused units.","Organic letters","2007","9","6","1005","1008","10.1021/ol0630393","","","1.5418","CuKα","","0.0503","0.0386","","","0.1151","0.1339","","","","","","1.182","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505299","27.992","0.005","10.3519","0.0018","11.1225","0.0019","90","","94.607","0.013","90","","3212.6","1","295","","295","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","beta(T2-T2-T2)","3,3';6',3''-ter(thieno[3,2-b]thiophene)","","- C18 H8 S6 -","- C18 H8 S6 -","- C144 H64 S48 -","8","1","","San Miguel, Lidaris; Porter, 3rd, William W; Matzger, Adam J.","Planar beta-linked oligothiophenes based on thieno[3,2-b]thiophene and dithieno[3,2-b:2',3'-d]thiophene fused units.","Organic letters","2007","9","6","1005","1008","10.1021/ol0630393","","","1.5418","CuKα","","0.0989","0.0535","","","0.1188","0.1483","","","","","","0.934","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505300","11.677","0.003","3.9584","0.001","16.868","0.004","90","","108.18","0.017","90","","740.8","0.3","295","","295","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","beta(T3-T3)","3,3'-bis(dithieno[3,2-b:2',3'-d]thiophene)","","- C16 H6 S6 -","- C16 H6 S6 -","- C32 H12 S12 -","2","0.5","","San Miguel, Lidaris; Porter, 3rd, William W; Matzger, Adam J.","Planar beta-linked oligothiophenes based on thieno[3,2-b]thiophene and dithieno[3,2-b:2',3'-d]thiophene fused units.","Organic letters","2007","9","6","1005","1008","10.1021/ol0630393","","","1.5418","CuKα","","0.0641","0.0475","","","0.1139","0.1228","","","","","","1.093","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505301","9.4794","0.0006","12.9657","0.0009","16.3977","0.0011","96.245","0.001","103.061","0.001","103.806","0.001","1878.1","0.2","295","2","295","2","","","","","","","","2","P -1","-P 1","2","","","","- C52 H44 -","- C52 H44 -","- C104 H88 -","2","1","","Zhang, Yanzhong; Petersen, Jeffrey L.; Wang, Kung K.","Synthesis and structures of diindeno-fused 1,12-diphenylbenzo[c]phenanthrene and 1,14-diphenyl[5]helicene bearing severe helical twists.","Organic letters","2007","9","6","1025","1028","10.1021/ol063056s","","","0.71073","MoKα","","0.1164","0.0648","","","0.1594","0.1903","","","","","","1.011","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505302","18.5363","0.0013","15.7011","0.0011","13.4032","0.0009","90","","93.638","0.001","90","","3893","0.5","295","2","295","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- C56 H46 -","- C56 H46 -","- C224 H184 -","4","0.5","","Zhang, Yanzhong; Petersen, Jeffrey L.; Wang, Kung K.","Synthesis and structures of diindeno-fused 1,12-diphenylbenzo[c]phenanthrene and 1,14-diphenyl[5]helicene bearing severe helical twists.","Organic letters","2007","9","6","1025","1028","10.1021/ol063056s","","","0.71073","MoKα","","0.0803","0.0516","","","0.1341","0.155","","","","","","1.001","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505303","12.8832","0.0008","14.0578","0.0009","20.2839","0.0013","90","","90","","90","","3673.6","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C37 H36 Cl2 I2 N4 Pd -","- C37 H36 Cl2 I2 N4 Pd -","- C148 H144 Cl8 I8 N16 Pd4 -","4","1","","Chen, Tao; Jiang, Jia-Jun; Xu, Qin; Shi, Min","Axially chiral NHC-Pd(II) complexes in the oxidative kinetic resolution of secondary alcohols using molecular oxygen as a terminal oxidant.","Organic letters","2007","9","5","865","868","10.1021/ol063061w","","","0.71073","MoKα","","0.0741","0.0543","","","0.1246","0.1327","","","","","","0.947","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505304","13.3076","0.0006","13.3076","0.0006","27.1044","0.0015","90","","90","","90","","4800","0.4","93.1","","","","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","","","- C48 H42 F12 N4 O4 S2 Zn -","- C48 H42 F12 N4 O4 S2 Zn -","- C192 H168 F48 N16 O16 S8 Zn4 -","4","0.5","","Honjo, Takashi; Nakao, Michiyasu; Sano, Shigeki; Shiro, Motoo; Yamaguchi, Kentaro; Sei, Yoshihisa; Nagao, Yoshimitsu","Nonenzymatic enantioselective monoacetylation of prochiral 2-protectedamino-2-alkyl-1,3-propanediols utilizing a chiral sulfonamide-Zn complex catalyst.","Organic letters","2007","9","3","509","512","10.1021/ol063063g","","","1.54178","CuKα","","","0.0515","","","","0.1081","","","","","","1.092","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505305","6.5707","0.0006","8.7506","0.0008","15.3161","0.0014","90","","90","","90","","880.64","0.14","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C9 H12 O4 -","- C9 H12 O4 -","- C36 H48 O16 -","4","1","","Clark, J. Stephen; Grainger, Damian M.; Ehkirch, Alexandra A.-C.; Blake, Alexander J.; Wilson, Claire","Synthesis of the fused polyether core of hemibrevetoxin B by two-directional ring-closing metathesis.","Organic letters","2007","9","6","1033","1036","10.1021/ol0630651","","","0.71073","MoKα","","0.0313","0.0303","","","0.079","0.08","","","","","","1.13","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505306","8.1273","0.0005","28.154","0.002","6.078","0.0004","90","","90","","90","","1390.74","0.16","150","2","150","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","","","- C13 H24 O5 -","- C13 H24 O5 -","- C52 H96 O20 -","4","1","","Clark, J. Stephen; Grainger, Damian M.; Ehkirch, Alexandra A.-C.; Blake, Alexander J.; Wilson, Claire","Synthesis of the fused polyether core of hemibrevetoxin B by two-directional ring-closing metathesis.","Organic letters","2007","9","6","1033","1036","10.1021/ol0630651","","","0.71073","MoKα","","0.0344","0.0336","","","0.0845","0.085","","","","","","1.06","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505307","9.091","0.0014","7.4742","0.0011","9.4591","0.0014","90","","94.804","0.003","90","","640.47","0.17","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C13 H20 O5 -","- C13 H20 O5 -","- C26 H40 O10 -","2","1","","Clark, J. Stephen; Grainger, Damian M.; Ehkirch, Alexandra A.-C.; Blake, Alexander J.; Wilson, Claire","Synthesis of the fused polyether core of hemibrevetoxin B by two-directional ring-closing metathesis.","Organic letters","2007","9","6","1033","1036","10.1021/ol0630651","","","0.71073","MoKα","","0.0349","0.0316","","","0.074","0.0753","","","","","","0.95","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505308","9.695","0.0017","10.0104","0.0017","15.698","0.003","90","","90","","90","","1523.5","0.5","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H22 O5 -","- C17 H22 O5 -","- C68 H88 O20 -","4","1","","Clark, J. Stephen; Grainger, Damian M.; Ehkirch, Alexandra A.-C.; Blake, Alexander J.; Wilson, Claire","Synthesis of the fused polyether core of hemibrevetoxin B by two-directional ring-closing metathesis.","Organic letters","2007","9","6","1033","1036","10.1021/ol0630651","","","0.71073","MoKα","","0.0454","0.0396","","","0.1055","0.1112","","","","","","1.027","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505309","23.712","0.001","15.364","0.001","12.061","0.001","90","","108.05","0.01","90","","4177.7","0.5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C26 H21 N3 -","- C26 H21 N3 -","- C208 H168 N24 -","8","1","","Lyaskovskyy, Volodymyr; Bergander, Klaus; Fröhlich, Roland; Würthwein, Ernst-Ulrich","Novel synthesis of azepine derivatives via copper-mediated cyclization of 2-aza-hepta-2,4-dien-6-ynyl anions. Intramolecular addition of organocopper centers to the C-C triple bond.","Organic letters","2007","9","6","1049","1052","10.1021/ol063081y","","","1.54178","CuKα","","0.0452","0.0412","","","0.1127","0.1169","","","","","","1.005","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505310","18.143","0.001","5.596","0.001","18.413","0.001","90","","95.66","0.01","90","","1860.3","0.4","223","2","223","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H21 N -","- C26 H21 N -","- C104 H84 N4 -","4","1","","Lyaskovskyy, Volodymyr; Bergander, Klaus; Fröhlich, Roland; Würthwein, Ernst-Ulrich","Novel synthesis of azepine derivatives via copper-mediated cyclization of 2-aza-hepta-2,4-dien-6-ynyl anions. Intramolecular addition of organocopper centers to the C-C triple bond.","Organic letters","2007","9","6","1049","1052","10.1021/ol063081y","","","1.54178","CuKα","","0.0407","0.0399","","","0.1015","0.1023","","","","","","1.063","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505311","9.2379","0.0006","9.1401","0.0006","14.956","0.0009","90","","102.026","0.001","90","","1235.1","0.14","100","1","100","1","","","","","","","","4","P 1 21 1","P 2yb","4","","4-hydroxy-4-[(1-phenylthio)cyclopropyl]-2-butanone","","- C13 H16 O2 S -","- C13 H16 O2 S -","- C52 H64 O8 S4 -","4","2","","Bernard, Angela M.; Frongia, Angelo; Guillot, Regis; Piras, Pier P.; Secci, Francesco; Spiga, Marco","l-Proline-catalyzed direct intermolecular asymmetric aldol reactions of 1-phenylthiocycloalkyl carboxaldehydes with ketones. Easy access to spiro- and fused-cyclobutyl tetrahydrofurans and cyclopentanones.","Organic letters","2007","9","3","541","544","10.1021/ol063084a","","x-ray","0.71073","MoKα","","0.0357","0.0284","","","0.0714","0.0749","","","","","","1.031","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505312","6.5872","0.0002","9.5697","0.0002","20.8343","0.0005","90","","90","","90","","1313.34","0.06","100","1","100","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-hydroxy-4-[(1-phenylthio)cyclobutyl]-2-butanone","","- C14 H18 O2 S -","- C14 H18 O2 S -","- C56 H72 O8 S4 -","4","1","","Bernard, Angela M.; Frongia, Angelo; Guillot, Regis; Piras, Pier P.; Secci, Francesco; Spiga, Marco","l-Proline-catalyzed direct intermolecular asymmetric aldol reactions of 1-phenylthiocycloalkyl carboxaldehydes with ketones. Easy access to spiro- and fused-cyclobutyl tetrahydrofurans and cyclopentanones.","Organic letters","2007","9","3","541","544","10.1021/ol063084a","","x-ray","0.71073","MoKα","","0.0339","0.0288","","","0.0736","0.0761","","","","","","1.055","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505313","10.9997","0.0008","7.7914","0.0006","14.7177","0.0011","90","","100.291","0.002","90","","1241.06","0.16","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-methyl-1-(phenylsulfonyl)-2-oxabicyclo[3.2.0]heptane","","- C13 H16 O3 S -","- C13 H16 O3 S -","- C52 H64 O12 S4 -","4","1","","Bernard, Angela M.; Frongia, Angelo; Guillot, Regis; Piras, Pier P.; Secci, Francesco; Spiga, Marco","l-Proline-catalyzed direct intermolecular asymmetric aldol reactions of 1-phenylthiocycloalkyl carboxaldehydes with ketones. Easy access to spiro- and fused-cyclobutyl tetrahydrofurans and cyclopentanones.","Organic letters","2007","9","3","541","544","10.1021/ol063084a","","x-ray","0.71073","MoKα","","0.0468","0.0329","","","0.0914","0.0993","","","","","","1.025","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505314","7.7681","0.001","7.3319","0.0009","21.899","0.003","90","","93.692","0.003","90","","1244.7","0.3","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-methyl-1-(phenylsulfonyl)-2-oxabicyclo[3.2.0]heptane","","- C13 H16 O3 S -","- C13 H16 O3 S -","- C52 H64 O12 S4 -","4","1","","Bernard, Angela M.; Frongia, Angelo; Guillot, Regis; Piras, Pier P.; Secci, Francesco; Spiga, Marco","l-Proline-catalyzed direct intermolecular asymmetric aldol reactions of 1-phenylthiocycloalkyl carboxaldehydes with ketones. Easy access to spiro- and fused-cyclobutyl tetrahydrofurans and cyclopentanones.","Organic letters","2007","9","3","541","544","10.1021/ol063084a","","x-ray","0.71073","MoKα","","0.0717","0.0492","","","0.1102","0.1173","","","","","","1.068","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505315","9.635","0.002","10.304","0.002","19.145","0.004","90","","90","","90","","1900.7","0.7","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H22 O Si -","- C24 H22 O Si -","- C96 H88 O4 Si4 -","4","1","","Shen, Ruichao; Corey, E. J.","Studies of the stereochemistry of [2+2]-photocycloaddition reactions of 2-cyclohexenones with olefins.","Organic letters","2007","9","6","1057","1059","10.1021/ol063092r","","","0.71073","MoKα","","0.0407","0.0392","","","0.1005","0.1012","","","","","","1.082","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505316","12.45","0.04","12.94","0.04","22.63","0.07","80.74","0.05","86.74","0.05","79.99","0.06","3542","19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H40 O2 S2 Si2 -","- C33 H40 O2 S2 Si2 -","- C132 H160 O8 S8 Si8 -","4","2","","Xie, Ling-Hai; Hou, Xiao-Ya; Hua, Yu-Ran; Huang, Yan-Qin; Zhao, Bao-Min; Liu, Feng; Peng, Bo; Wei, Wei; Huang, Wei","An effective strategy to tune supramolecular interaction via a spiro-bridged spacer in oligothiophene-S,S-dioxides and their anomalous photoluminescent behavior.","Organic letters","2007","9","9","1619","1622","10.1021/ol070006u","","","0.71073","MoKα","","0.2879","0.0715","","","0.1559","0.2273","","","","","","0.556","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505317","55.844","0.004","13.8967","0.001","15.0754","0.001","90","","93.664","0.005","90","","11675.3","1.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H83.5 N4 S Si4 -","- C52 H83.5 N4 S Si4 -","- C416 H668 N32 S8 Si32 -","8","2","","Miao, Shaobin; Schleyer, Paul v R; Wu, Judy I.; Hardcastle, Kenneth I.; Bunz, Uwe H. F.","A thiadiazole-fused N,N-dihydroquinoxaline: antiaromatic but isolable.","Organic letters","2007","9","6","1073","1076","10.1021/ol070013i","","","1.54178","CuKα","","0.1927","0.1116","","","0.2979","0.3541","","","","","","1.024","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505318","20.39","0.004","18.3","0.004","22.938","0.005","90","","92.504","0.004","90","","8551","3","113","2","113","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C82 H86 F24 N7 O8.5 P4 -","- C82 H85 F24 N7 O8.5 P4 -","- C328 H340 F96 N28 O34 P16 -","4","2","","Peng, Xiao-Xia; Lu, Hai-Yan; Han, Tao; Chen, Chuan-Feng","Synthesis of a novel triptycene-based molecular tweezer and its complexation with paraquat derivatives.","Organic letters","2007","9","5","895","898","10.1021/ol070017n","","","0.7107","MoKα","","0.1033","0.0913","","","0.2487","0.2654","","","","","","1.05","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505319","8.576","0.002","7.604","0.0018","24.573","0.006","90","","99.323","0.004","90","","1581.3","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C72 H84 N4 O16 -","4","1","","Li, Wei-Dong Z; Wang, Xin-Wei","Novel formal synthesis of cephalotaxine via a facile Friedel-Crafts cyclization.","Organic letters","2007","9","7","1211","1214","10.1021/ol070024b","","","0.71073","MoKα","","0.0903","0.0454","","","0.1213","0.1451","","","","","","1.017","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505320","7.477","0.009","10.37","0.013","11.367","0.014","92.785","0.014","94.308","0.016","92.272","0.015","877","1.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H26 Cl N O4 -","- C18 H26 Cl N O4 -","- C36 H52 Cl2 N2 O8 -","2","1","","Li, Wei-Dong Z; Wang, Xin-Wei","Novel formal synthesis of cephalotaxine via a facile Friedel-Crafts cyclization.","Organic letters","2007","9","7","1211","1214","10.1021/ol070024b","","","0.71073","MoKα","","0.0714","0.0484","","","0.1387","0.1761","","","","","","1.01","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505321","8.3368","0.0016","9.1981","0.0017","8.8279","0.0017","90","","115.081","0.003","90","","613.1","0.2","208","2","208","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H13 P S -","- C14 H13 P S -","- C28 H26 P2 S2 -","2","1","","Brunker, Tim J.; Anderson, Brian J.; Blank, Natalia F.; Glueck, David S.; Rheingold, Arnold L.","Enantioselective synthesis of P-stereogenic benzophospholanes via palladium-catalyzed intramolecular cyclization.","Organic letters","2007","9","6","1109","1112","10.1021/ol0700512","","","0.71073","MoKα","","0.0344","0.0339","","","0.0845","0.085","","","","","","1.163","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505322","9.4071","0.0012","11.3293","0.0016","12.9898","0.0016","90","","90","","90","","1384.4","0.3","208","2","208","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 B P -","- C15 H18 B P -","- C60 H72 B4 P4 -","4","1","","Brunker, Tim J.; Anderson, Brian J.; Blank, Natalia F.; Glueck, David S.; Rheingold, Arnold L.","Enantioselective synthesis of P-stereogenic benzophospholanes via palladium-catalyzed intramolecular cyclization.","Organic letters","2007","9","6","1109","1112","10.1021/ol0700512","","","0.71073","MoKα","","0.0478","0.0428","","","0.1105","0.1139","","","","","","1.041","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505323","12.7723","0.0005","7.1792","0.0002","14.2615","0.0007","90","","105.767","0.0018","90","","1258.5","0.09","200","1","200","1","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C15 H17 N O3 -","- C15 H17 N O3 -","- C60 H68 N4 O12 -","4","1","","Rostami, Ali; Wang, Yong; Arif, Atta M.; McDonald, Robert; West, F. G.","Intramolecular azide trapping of the Nazarov intermediate: formation of peroxy-bridged indolizidinones via a deep-seated rearrangement and aerobic oxidation.","Organic letters","2007","9","4","703","706","10.1021/ol070053m","","","0.71073","MoKα","","0.0506","0.039","","","0.093","0.0994","","","","","","1.05","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505324","8.8461","0.0006","12.6516","0.0009","9.8467","0.0007","90","","95.999","0.001","90","","1095.98","0.13","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H19 N O2 -","- C12 H19 N O2 -","- C48 H76 N4 O8 -","4","1","","Rostami, Ali; Wang, Yong; Arif, Atta M.; McDonald, Robert; West, F. G.","Intramolecular azide trapping of the Nazarov intermediate: formation of peroxy-bridged indolizidinones via a deep-seated rearrangement and aerobic oxidation.","Organic letters","2007","9","4","703","706","10.1021/ol070053m","","","0.71073","MoKα","","0.0456","0.0398","","","0.1052","0.1101","","","","","","1.049","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505325","16.168","0.003","16.531","0.002","16.623","0.004","98.556","0.017","118.638","0.016","90.865","0.017","3836.8","1.4","301","2","301","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H25 Cl2 N S -","- C16 H25 Cl2 N S -","- C128 H200 Cl16 N8 S8 -","8","4","","Gonzalez, Ana Z.; Soderquist, John A.","Beta-silylated homopropargylic amines via the asymmetric allenylboration of aldimines.","Organic letters","2007","9","6","1081","1084","10.1021/ol070074g","","","0.71073","MoKα","","0.1687","0.0888","","","0.2582","0.3159","","","","","","1.036","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505326","17.216","0.006","11.078","0.006","16.173","0.007","90","0.04","108.63","0.04","90","0.04","2923","2","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C33 H36 O8 -","- C33 H36 O8 -","- C132 H144 O32 -","4","1","","Yang, Sheng-Ping; Gao, Zhao-Bing; Wang, Fang-Dao; Liao, Shang-Gao; Chen, Hua-Dong; Zhang, Chuan-Rui; Hu, Guo-Yuan; Yue, Jian-Min","Chlorahololides A and B, two potent and selective blockers of the potassium channel isolated from Chloranthus holostegius.","Organic letters","2007","9","5","903","906","10.1021/ol0700759","","","0.71073","MoKα","","0.0761","0.0366","","","0.0893","0.1039","","","","","","1.085","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505327","6.5548","0.0002","11.6014","0.0004","22.6301","0.0008","90","","90","","90","","1720.9","0.1","153","2","153","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H22 Cl2 N2 O -","- C18 H22 Cl2 N2 O -","- C72 H88 Cl8 N8 O4 -","4","1","","Miller, Kenneth A.; Martin, Stephen F.","Concise, enantioselective total synthesis of (-)-alstonerine.","Organic letters","2007","9","6","1113","1116","10.1021/ol0700761","","","0.71073","MoKα","","0.0638","0.0456","","","0.102","0.1115","","","","","","1.084","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505328","21.502","0.003","12.3765","0.0015","27.044","0.003","90","","107.412","0.002","90","","6867.2","1.5","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H17 N O3 Si -","- C10 H17 N O3 Si -","- C240 H408 N24 O72 Si24 -","24","3","","Pidaparthi, Ramakrishna R.; Welker, Mark E.; Day, Cynthia S.; Wright, Marcus W.","Preparation of 2-trialkylsiloxy- substituted 1,3-dienes and their diels-alder/cross-coupling reactions.","Organic letters","2007","9","9","1623","1626","10.1021/ol070089e","","","0.71073","MoKα","","0.0706","0.0541","","","0.1309","0.1411","","","","","","1.04","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505329","11.545","0.002","10.647","0.002","12.953","0.003","90","","96.352","0.003","90","","1582.4","0.5","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H21 N O6 Si -","- C15 H21 N O6 Si -","- C60 H84 N4 O24 Si4 -","4","1","","Pidaparthi, Ramakrishna R.; Welker, Mark E.; Day, Cynthia S.; Wright, Marcus W.","Preparation of 2-trialkylsiloxy- substituted 1,3-dienes and their diels-alder/cross-coupling reactions.","Organic letters","2007","9","9","1623","1626","10.1021/ol070089e","","","0.71073","MoKα","","0.0977","0.0677","","","0.1725","0.1916","","","","","","1.035","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505330","12.445","0.002","15.623","0.003","13.259","0.002","90","","108.108","0.003","90","","2450.2","0.7","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H29 K O6 Si -","- C24 H29 K O6 Si -","- C96 H116 K4 O24 Si4 -","4","1","","Pidaparthi, Ramakrishna R.; Welker, Mark E.; Day, Cynthia S.; Wright, Marcus W.","Preparation of 2-trialkylsiloxy- substituted 1,3-dienes and their diels-alder/cross-coupling reactions.","Organic letters","2007","9","9","1623","1626","10.1021/ol070089e","","","0.71073","MoKα","","0.1187","0.0709","","","0.1337","0.1525","","","","","","1.047","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505331","21.557","0.003","6.5449","0.0008","24.219","0.003","90","","111.723","0.002","90","","3174.4","0.7","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","06266a","","","- C25 H26 N2 O3 -","- C25 H26 N2 O3 -","- C150 H156 N12 O18 -","6","3","","Antoline, Jennifer E.; Hsung, Richard P.; Huang, Jian; Song, Zhenlei; Li, Gang","Highly stereoselective [4 + 3] cycloadditions of nitrogen-stabilized oxyallyl cations with pyrroles: an approach to parvineostemonine.","Organic letters","2007","9","7","1275","1278","10.1021/ol070103n","","","0.71073","MoKα","","0.0865","0.0482","","","0.1156","0.1386","","","","","","1.035","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505332","13.256","0.0011","8.107","0.0009","15.475","0.0015","90","","113.411","0.007","90","","1526.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H17 N2 O5 P -","- C14 H17 N2 O5 P -","- C56 H68 N8 O20 P4 -","4","1","","Muruganantham, R.; Mobin, Shaikh M.; Namboothiri, Irishi N. N.","Base-mediated reaction of the Bestmann-Ohira reagent with nitroalkenes for the regioselective synthesis of phosphonylpyrazoles.","Organic letters","2007","9","6","1125","1128","10.1021/ol070107s","","","0.71073","MoKα","","0.1773","0.0664","","","0.1516","0.1879","","","","","","1.01","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505333","12.1732","0.001","12.2995","0.001","12.9091","0.0011","98.217","0.002","112.027","0.002","101.331","0.001","1706.2","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","N-(rhodamine-6G)lactam-N-phenylthiourea-ethylenediamine","","- C37 H40 N6 O2 S -","- C37 H40 N6 O2 S -","- C74 H80 N12 O4 S2 -","2","1","","Wu, Jia-Sheng; Hwang, In-Chul; Kim, Kwang S.; Kim, Jong Seung","Rhodamine-based Hg2±selective chemodosimeter in aqueous solution: fluorescent OFF-ON.","Organic letters","2007","9","5","907","910","10.1021/ol070109c","","","0.71073","MoKα","","0.083","0.0693","","","0.1613","0.1705","","","","","","1.176","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505334","16.3149","0.0005","18.2602","0.0005","12.8582","0.0004","90","","108.045","0.001","90","","3642.21","0.19","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H24 O4 -","- C22 H24 O4 -","- C176 H192 O32 -","8","1","","Shukla, Ruchi; Lindeman, Sergey V.; Rathore, Rajendra","Electron transfer prompted ejection of a tightly bound K(+) from the ethereal cavity of a hexaarylbenzene-based receptor.","Organic letters","2007","9","7","1291","1294","10.1021/ol070122x","","","1.54178","CuKα","","0.0325","0.0316","","","0.0819","0.0826","","","","","","1.024","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505335","41.8513","0.0006","20.8606","0.0003","20.4544","0.0003","90","","103.928","0.001","90","","17332.5","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C92 H100 B K O14 -","- C96.645 H99 B K O16.887 -","- C773.16 H792 B8 K8 O135.096 -","8","1","","Shukla, Ruchi; Lindeman, Sergey V.; Rathore, Rajendra","Electron transfer prompted ejection of a tightly bound K(+) from the ethereal cavity of a hexaarylbenzene-based receptor.","Organic letters","2007","9","7","1291","1294","10.1021/ol070122x","","","1.54178","CuKα","","0.0529","0.0515","","","0.1411","0.1424","","","","","","1.009","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505336","21.612","0.002","5.5038","0.0006","11.8718","0.0012","90","","121.939","0.006","90","","1198.3","0.2","193","","193","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C31 H24 Cl2 N2 O2 -","- C31 H24 Cl2 N2 O2 -","- C62 H48 Cl4 N4 O4 -","2","0.5","","Wada, Azusa; Noguchi, Keiichi; Hirano, Masao; Tanaka, Ken","Enantioselective synthesis of C2 -symmetric spirobipyridine ligands through cationic Rh(I)/modified-BINAP- catalyzed double [2 + 2 + 2] cycloaddition.","Organic letters","2007","9","7","1295","1298","10.1021/ol070129e","","","1.54187","CuKα","","0.0321","0.0306","","","0.0787","0.0803","","","","","","1.043","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505337","12.239","0.007","22.483","0.012","9.188","0.005","90","","103.324","0.012","90","","2460","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H28 Cl N2 O5 -","- C27 H29 Cl N2 O5 -","- C108 H116 Cl4 N8 O20 -","4","1","","Akritopoulou-Zanze, Irini; Whitehead, Alan; Waters, Jan E.; Henry, Rodger F.; Djuric, Stevan W.","Synthesis of novel and uniquely shaped 3-azabicyclo[4.2.0]octan-4-one derivatives by sequential Ugi/[2+2] ene-enone photocycloadditions.","Organic letters","2007","9","7","1299","1302","10.1021/ol070164l","","","0.71073","MoKα","","0.3085","0.1197","","","0.2337","0.3103","","","","","","0.868","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505338","9.0803","0.0009","21.286","0.002","9.9234","0.0009","90","","101.687","0.002","90","","1878.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 N2 O3 -","- C24 H20 N2 O3 -","- C96 H80 N8 O12 -","4","1","","Liu, Le-Ping; Lu, Jian-Mei; Shi, Min","PhI(OAc)2 -mediated novel 1,3-dipolar cycloaddition of methylenecyclopropanes (MCPs), vinylidenecyclopropanes (VCPs), and methylenecyclobutane (MCB) with phthalhydrazide.","Organic letters","2007","9","7","1303","1306","10.1021/ol070178r","","","0.71073","MoKα","","0.0693","0.047","","","0.1026","0.112","","","","","","0.921","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505339","8.1292","0.0011","5.7648","0.0008","12.434","0.002","90","","97.293","0.013","90","","577.98","0.15","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H16 N2 O3 -","- C12 H16 N2 O3 -","- C24 H32 N4 O6 -","2","1","","Guha, Samit; Drew, Michael G. B.; Banerjee, Arindam","A new molecular scaffold for the formation of supramolecular peptide double helices: the crystallographic insight.","Organic letters","2007","9","7","1347","1350","10.1021/ol0701870","","","0.71073","MoKα","","0.1212","0.0733","","","0.1255","0.1354","","","","","","1.042","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505340","11.1153","0.0015","5.4908","0.0008","16.1643","0.0017","90","","91.345","0.01","90","","986.3","0.2","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C8 H16 N2 O3 -","- C8 H16 N2 O3 -","- C32 H64 N8 O12 -","4","2","","Guha, Samit; Drew, Michael G. B.; Banerjee, Arindam","A new molecular scaffold for the formation of supramolecular peptide double helices: the crystallographic insight.","Organic letters","2007","9","7","1347","1350","10.1021/ol0701870","","","0.71073","MoKα","","0.1322","0.0683","","","0.1548","0.1645","","","","","","0.749","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505341","12.5522","0.0014","5.516","0.0005","15.9248","0.0019","89.816","0.009","87.074","0.01","89.234","0.008","1101.1","0.2","150","2","150","2","","","","","","","","4","P 1","P 1","1","","","","- C9 H18 N2 O3 -","- C9 H18 N2 O3 -","- C36 H72 N8 O12 -","4","4","","Guha, Samit; Drew, Michael G. B.; Banerjee, Arindam","A new molecular scaffold for the formation of supramolecular peptide double helices: the crystallographic insight.","Organic letters","2007","9","7","1347","1350","10.1021/ol0701870","","","0.71073","MoKα","","0.1079","0.1028","","","0.2926","0.2992","","","","","","1.019","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505342","13.9345","0.0012","5.5848","0.0005","15.406","0.0013","90","","92.408","0.007","90","","1197.86","0.18","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H16 N2 O3 -","- C12 H16 N2 O3 -","- C48 H64 N8 O12 -","4","2","","Guha, Samit; Drew, Michael G. B.; Banerjee, Arindam","A new molecular scaffold for the formation of supramolecular peptide double helices: the crystallographic insight.","Organic letters","2007","9","7","1347","1350","10.1021/ol0701870","","","0.71073","MoKα","","0.0392","0.0317","","","0.0876","0.0901","","","","","","0.851","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505343","13.042","0.009","13.746","0.009","7.51","0.006","90","","90.74","0.05","90","","1346.2","1.7","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","SIMEON061","","","- C14 H22 O4 -","- C14 H22 O4 -","- C56 H88 O16 -","4","1","","Chanu, Angéline; Safir, Imad; Basak, Ramkrishna; Chiaroni, Angèle; Arseniyadis, Siméon","Enantioselective total synthesis of 1-epi-pathylactone A.","Organic letters","2007","9","7","1351","1354","10.1021/ol070207y","","","0.71073","MoKα","","0.0739","0.0623","","","0.1719","0.186","","","","","","1.036","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505344","5.638","0.007","10.936","0.013","11.297","0.013","62.895","0.019","88.76","0.019","81.63","0.02","612.6","1.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H13 F3 O2 -","- C13 H13 F3 O2 -","- C26 H26 F6 O4 -","2","1","","Wang, Xiao-Jin; Zhao, Yan; Liu, Jin-Tao","Regiospecific organocatalytic asymmetric aldol reaction of methyl ketones and alpha,beta-unsaturated trifluoromethyl ketones.","Organic letters","2007","9","7","1343","1345","10.1021/ol070217z","","","0.71073","MoKα","","0.1355","0.0909","","","0.2339","0.2661","","","","","","0.958","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505345","5.707","0.0009","7.7939","0.0012","15.67","0.002","90","","99.496","0.002","90","","687.45","0.18","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H12 Br F3 O2 -","- C13 H12 Br F3 O2 -","- C26 H24 Br2 F6 O4 -","2","1","","Wang, Xiao-Jin; Zhao, Yan; Liu, Jin-Tao","Regiospecific organocatalytic asymmetric aldol reaction of methyl ketones and alpha,beta-unsaturated trifluoromethyl ketones.","Organic letters","2007","9","7","1343","1345","10.1021/ol070217z","","","0.71073","MoKα","","0.0715","0.0628","","","0.1573","0.1759","","","","","","0.994","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505346","9.962","0.003","14.881","0.004","15.08","0.005","65.539","0.005","77.155","0.005","81.79","0.005","1980.7","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C80 H88 Ca2 N4 O20 -","- C80 H88 Ca2 N4 O20 -","- C80 H88 Ca2 N4 O20 -","1","0.5","","Cotter, Juliet; Hogan, Anne-Marie L; O'Shea, Donal F","Development and application of a direct vinyl lithiation of cis-stilbene and a directed vinyl lithiation of an unsymmetrical cis-stilbene.","Organic letters","2007","9","8","1493","1496","10.1021/ol070239l","","","0.71073","MoKα","","0.1138","0.0513","","","0.0968","0.1162","","","","","","0.94","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505347","6.0929","0.0004","15.5857","0.0011","22.3343","0.0016","90","","90","","90","","2120.9","0.3","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C10 H16 O4 -","- C10 H16 O4 -","- C80 H128 O32 -","8","2","","Knapp, Spencer; Yu, Younong","Synthesis of the oxygenated pactamycin core.","Organic letters","2007","9","7","1359","1362","10.1021/ol0702472","","","0.71073","MoKα","","0.062","0.0475","","","0.1059","0.1136","","","","","","1.002","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505348","20.9886","0.0018","22.092","0.003","22.856","0.006","104.509","0.006","104.619","0.006","94.833","0.006","9804","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C216 H244 F72 N48 O20 P12 Pd12 -","- C216 H244 F72 N48 O20 P12 Pd12 -","- C216 H244 F72 N48 O20 P12 Pd12 -","1","0.5","","Yu, Shu-Yan; Jiao, Qing; Li, Sheng-Hui; Huang, Hai-Ping; Li, Yi-Zhi; Pan, Yuan-Jiang; Sei, Yoshihisa; Yamaguchi, Kentaro","Self-assembly of tripyrazolate-linked macrotricyclic M(12)L(4) cages with dimetallic clips.","Organic letters","2007","9","7","1379","1382","10.1021/ol070286d","","","0.71073","MoKα","","0.0788","0.0499","","","0.0929","0.0973","","","","","","1.07","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505349","18.7397","0.001","8.0855","0.0004","17.6231","0.0009","90","","109.35","0.001","90","","2519.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H35 O P S -","- C27 H35 O P S -","- C108 H140 O4 P4 S4 -","4","1","","Kondoh, Azusa; Yorimitsu, Hideki; Oshima, Koichiro","Palladium-catalyzed anti-hydrothiolation of 1-alkynylphosphines.","Organic letters","2007","9","7","1383","1385","10.1021/ol0702876","","","0.71073","MoKα","","0.0567","0.0453","","","0.1291","0.1364","","","","","","1.014","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505350","9.8585","0.0012","10.0769","0.0012","10.5489","0.0012","96.168","0.002","113.843","0.002","103.781","0.002","906.12","0.19","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H19 Cl -","- C24 H19 Cl -","- C48 H38 Cl2 -","2","1","","Huang, Xian; Yang, Yewei","Acylation of alkylidenecyclopropanes for the facile synthesis of alpha,beta-unsaturated ketone and benzofulvene derivatives with high stereoselectivity.","Organic letters","2007","9","9","1667","1670","10.1021/ol070331h","","","0.71073","MoKα","","0.0817","0.0577","","","0.1378","0.1501","","","","","","0.926","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505351","11.087","0.002","13.811","0.003","14.609","0.003","90","","96.23","0.004","90","","2223.8","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H13 Cl O -","- C12 H13 Cl O -","- C96 H104 Cl8 O8 -","8","2","","Huang, Xian; Yang, Yewei","Acylation of alkylidenecyclopropanes for the facile synthesis of alpha,beta-unsaturated ketone and benzofulvene derivatives with high stereoselectivity.","Organic letters","2007","9","9","1667","1670","10.1021/ol070331h","","","0.71073","MoKα","","0.0922","0.0527","","","0.13","0.1493","","","","","","0.892","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505352","10.355","0.002","13.627","0.003","18.942","0.004","90.28","0.03","92.84","0.03","110.76","0.03","2495.5","1","293","2","293","2","","","","","","","","3","P -1","-P 1","2","3f(I)","spiro[1,3-benzodioxine-2,1'-cyclohexane]","","- C32 H30 O3 -","- C32 H30 O3 -","- C128 H120 O12 -","4","2","","Wang, Pengfei; Hu, Huayou; Wang, Yun","Novel photolabile protecting group for carbonyl compounds.","Organic letters","2007","9","8","1533","1535","10.1021/ol070346f","","","0.71073","MoKα","","0.1333","0.0583","","","0.1496","0.1808","","","","","","0.995","","","","has coordinates,has disorder","201954","2020-10-21","18:00:00",""
"1505353","14.6224","0.0007","24.827","0.0012","11.467","0.0006","90","","98.278","0.001","90","","4119.5","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H35 Cl2 N5 -","- C52 H35 Cl2 N5 -","- C208 H140 Cl8 N20 -","4","1","","Kashiwagi, Norimasa; Akeda, Takeshi; Morimoto, Tatsuki; Ishizuka, Tomoya; Furuta, Hiroyuki","Synthesis and isomerization of imino-fused N-confused porphyrin.","Organic letters","2007","9","9","1733","1736","10.1021/ol0703534","","","0.71073","MoKα","","0.134","0.0877","","","0.229","0.2642","","","","","","1.038","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505354","7.7674","0.0005","26.8846","0.0017","17.828","0.0011","90","","99.531","0.002","90","","3671.5","0.4","223","2","223","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C51 H33 N5 -","- C51 H33 N5 -","- C204 H132 N20 -","4","1","","Kashiwagi, Norimasa; Akeda, Takeshi; Morimoto, Tatsuki; Ishizuka, Tomoya; Furuta, Hiroyuki","Synthesis and isomerization of imino-fused N-confused porphyrin.","Organic letters","2007","9","9","1733","1736","10.1021/ol0703534","","","0.71073","MoKα","","0.1211","0.0523","","","0.1096","0.1322","","","","","","0.951","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505355","11.677","0.002","12.549","0.002","15.744","0.003","89.721","0.004","70.098","0.005","71.093","0.004","2037.7","0.6","223","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C54 H41 N5 -","- C54 H41 N5 -","- C108 H82 N10 -","2","1","","Kashiwagi, Norimasa; Akeda, Takeshi; Morimoto, Tatsuki; Ishizuka, Tomoya; Furuta, Hiroyuki","Synthesis and isomerization of imino-fused N-confused porphyrin.","Organic letters","2007","9","9","1733","1736","10.1021/ol0703534","","","0.71073","MoKα","","0.2292","0.0749","","","0.1261","0.1736","","","","","","0.91","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505356","4.9615","0.0015","9.864","0.003","46.603","0.015","90","","90","","90","","2280.8","1.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","GRp-Cl","","","- C29 H23 Cl N2 O -","- C29 H23 Cl N2 O -","- C116 H92 Cl4 N8 O4 -","4","1","","Rowland, Gerald B.; Rowland, Emily B.; Liang, Yuxue; Perman, Jason A.; Antilla, Jon C.","The highly enantioselective addition of indoles to N-acyl imines with use of a chiral phosphoric acid catalyst.","Organic letters","2007","9","14","2609","2611","10.1021/ol0703579","","","0.71073","MoKα","","0.0912","0.0737","","","0.1512","0.1628","","","","","","1.167","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505357","8.7778","0.0004","14.5771","0.0006","18.0574","0.0008","90","","90","","90","","2310.53","0.17","298","","298","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Aza-5,5-dimethyl-10-ethoxycarbonyltricyclo[10.4.0.0(superscript 3,8)] hexadeca-3(8),10,12,14,16-pentaen-7-one","","- C24 H31 N O5 -","- C24 H31 N O5 -","- C96 H124 N4 O20 -","4","1","","Basavaiah, Deevi; Aravindu, Kunche","The Baylis-Hillman acetates as a valuable source for one-pot multistep synthesis: a facile synthesis of functionalized tri-/tetracyclic frameworks containing azocine moiety.","Organic letters","2007","9","13","2453","2456","10.1021/ol070380u","","","0.71073","MoKα","","0.0595","0.0494","","","0.1445","0.1525","","","","","","1.042","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505358","9.3008","0.0013","13.4894","0.0019","13.871","0.002","90","","92.959","0.003","90","","1738","0.4","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Aza-14,15-dimethoxy-10-methoxycarbonyltricyclo[10.4.0.0(superscript 3,8)] hexadeca-3(8),10,12,14,16-pentaen-7-one","","- C19 H21 N O5 -","- C19 H21 N O5 -","- C76 H84 N4 O20 -","4","1","","Basavaiah, Deevi; Aravindu, Kunche","The Baylis-Hillman acetates as a valuable source for one-pot multistep synthesis: a facile synthesis of functionalized tri-/tetracyclic frameworks containing azocine moiety.","Organic letters","2007","9","13","2453","2456","10.1021/ol070380u","","","0.71073","MoKα","","0.0656","0.0432","","","0.106","0.1153","","","","","","0.941","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505359","28.377","0.005","7.1394","0.0012","15.034","0.003","90","","121.081","0.002","90","","2608.5","0.8","298","","298","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-Aza-10-methoxycarbonyltricyclo[10.3.0.0(superscript 3,8)] pentadeca-1(12),3,5,7,9-pentaen-13-one","","- C16 H15 N O3 -","- C16 H15 N O3 -","- C128 H120 N8 O24 -","8","1","","Basavaiah, Deevi; Aravindu, Kunche","The Baylis-Hillman acetates as a valuable source for one-pot multistep synthesis: a facile synthesis of functionalized tri-/tetracyclic frameworks containing azocine moiety.","Organic letters","2007","9","13","2453","2456","10.1021/ol070380u","","","0.71073","MoKα","","0.0765","0.0483","","","0.1063","0.116","","","","","","0.995","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505360","11.06","0.002","13.996","0.003","13.578","0.003","90","","112.323","0.003","90","","1944.3","0.7","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Aza-19,19-dimethyl-14-methoxycarbonyltetracyclo[14.4.0.0(superscript 3,12). 0(superscript 4,9)]eicosa-1(16),3,5,7,9,11,13-heptaen-17-one","","- C23 H23 N O3 -","- C23 H23 N O3 -","- C92 H92 N4 O12 -","4","1","","Basavaiah, Deevi; Aravindu, Kunche","The Baylis-Hillman acetates as a valuable source for one-pot multistep synthesis: a facile synthesis of functionalized tri-/tetracyclic frameworks containing azocine moiety.","Organic letters","2007","9","13","2453","2456","10.1021/ol070380u","","","0.71073","MoKα","","0.0999","0.0434","","","0.0917","0.1071","","","","","","0.87","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505361","35.284","0.007","14.2","0.003","18.567","0.004","90","","116.7","0.03","90","","8311","4","143","2","143","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C68 H21 O9 -","- C68 H21 O9 -","- C544 H168 O72 -","8","1","","Wang, Fudong; Xiao, Zuo; Gan, Liangbing; Jia, Zhenshan; Jiang, Zhongping; Zhang, Shiwei; Zheng, Bo; Gu, Yuan","From fullerene-mixed peroxide to open-cage oxafulleroid C(59)(O)(3)(OH)(2)(OO(t)()Bu)(2) embedded with furan and lactone motifs.","Organic letters","2007","9","9","1741","1743","10.1021/ol070386j","","","0.71073","MoKα","","0.126","0.0617","","","0.147","0.1621","","","","","","0.998","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505362","6.3462","0.0001","10.8112","0.0002","19.3646","0.0004","90","","92.4184","0.0011","90","","1327.42","0.04","296.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 N2 O2 -","- C15 H18 N2 O2 -","- C60 H72 N8 O8 -","4","1","","Fujioka, Hiromichi; Murai, Kenichi; Kubo, Ozora; Ohba, Yusuke; Kita, Yasuyuki","New three-component reaction: novel formation of a seven-membered ring by the unexpected reaction at the gamma-position of the beta-keto ester.","Organic letters","2007","9","9","1687","1690","10.1021/ol070402c","","","1.54187","CuKα","","","0.0532","","","","0.1374","","","","","","1","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505363","36.322","0.005","13.144","0.005","25.296","0.005","90","0.005","132.682","0.005","90","0.005","8878","4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(4-Bromo-phenyl)-5a-hydroxy-7,7-dimethyl-3-phenyl-4,5,5a,6,7,8-hexahydro- 1H-1,2,9a-triaza-cyclopenta[a]naphthalen-9-one","","- C25 H26.5 Br N3 O2.25 -","- C25 H26.5 Br N3 O2.25 -","- C400 H424 Br16 N48 O36 -","16","2","","Chebanov, Valentin A.; Saraev, Vyacheslav E.; Desenko, Sergey M.; Chernenko, Vitaliy N.; Shishkina, Svetlana V.; Shishkin, Oleg V.; Kobzar, Kiril M.; Kappe, C. Oliver","One-pot, multicomponent route to pyrazoloquinolizinones.","Organic letters","2007","9","9","1691","1694","10.1021/ol070411l","","","0.71069","MoKα","","0.1065","0.0656","","","0.162","0.1924","","","","","","0.967","","","","has coordinates","215051","2020-10-21","18:00:00",""
"1505364","23.5483","0.0014","11.9852","0.0007","26.1138","0.0015","90","","108.463","0.001","90","","6990.8","0.7","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C77 H91 Cl3 O9 -","- C77 H82 Cl3 O9 -","- C308 H328 Cl12 O36 -","4","1","","Kuno, Lev; Seri, Noa; Biali, Silvio E.","Tetraaddition of PhLi to a ketocalixarene derivative.","Organic letters","2007","9","8","1577","1580","10.1021/ol070429w","","","0.71073","MoKα","","0.0831","0.0678","","","0.1804","0.1905","","","","","","1.039","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505365","16.8655","0.0009","12.438","0.0006","16.02","0.0008","90","","94.15","0.001","90","","3351.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H30 I2 N2 O2 Pd -","- C34 H30 I2 N2 O2 Pd -","- C136 H120 I8 N8 O8 Pd4 -","4","1","","López-Alberca, María P; Mancheño, María J; Fernandez, Israel; Gómez-Gallego, Mar; Sierra, Miguel A.; Torres, Rosario","Divergent pathways in the reaction of Fischer carbenes and palladium.","Organic letters","2007","9","9","1757","1759","10.1021/ol070431n","","","0.71073","MoKα","","0.0957","0.038","","","0.0808","0.0954","","","","","","0.889","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505366","20.844","0.003","5.1846","0.0007","19.858","0.003","90","","117.621","0.004","90","","1901.4","0.5","120","","120","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H28 O6 -","- C21 H28 O6 -","- C84 H112 O24 -","4","1","","Zhou, Jingye; Snider, Barry B.","Biomimetic synthesis of the tetracyclic core of berkelic acid.","Organic letters","2007","9","11","2071","2074","10.1021/ol0704338","","","0.71073","MoKα","","0.0763","0.0513","","0.1447","0.1304","0.1447","","","","","","0.9088","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505367","15.527","0.004","10.577","0.003","17.467","0.004","90","","107.358","0.004","90","","2738","1.2","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H29 I N4 O8 -","- C28 H29 I N4 O8 -","- C112 H116 I4 N16 O32 -","4","1","","Chen, Yunfeng; She, Nengfang; Meng, Xianggao; Yin, Guodong; Wu, Anxin; Isaacs, Lyle","Chiral molecular clips control orthogonal crystalline organization.","Organic letters","2007","9","10","1899","1902","10.1021/ol0704340","","","0.71073","MoKα","","0.1042","0.0742","","","0.2154","0.2359","","","","","","1.079","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505368","12.8778","0.001","14.69","0.0011","17.433","0.0013","90","","102.971","0.002","90","","3213.7","0.4","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 N4 O8 -","- C36 H34 N4 O8 -","- C144 H136 N16 O32 -","4","1","","Chen, Yunfeng; She, Nengfang; Meng, Xianggao; Yin, Guodong; Wu, Anxin; Isaacs, Lyle","Chiral molecular clips control orthogonal crystalline organization.","Organic letters","2007","9","10","1899","1902","10.1021/ol0704340","","","0.71073","mokα","","0.1442","0.0656","","","0.168","0.1934","","","","","","0.842","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505369","15.534","0.003","14.428","0.003","16.511","0.003","90","","114.274","0.003","90","","3373.4","1.1","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C37 H36 N4 O9 -","- C37 H36 N4 O9 -","- C148 H144 N16 O36 -","4","1","","Chen, Yunfeng; She, Nengfang; Meng, Xianggao; Yin, Guodong; Wu, Anxin; Isaacs, Lyle","Chiral molecular clips control orthogonal crystalline organization.","Organic letters","2007","9","10","1899","1902","10.1021/ol0704340","","","0.71073","MoKα","","0.2097","0.0746","","","0.1463","0.1788","","","","","","0.837","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505370","12.683","0.005","21.153","0.008","12.275","0.005","90","","105.316","0.007","90","","3176","2","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H33 N5 O8 -","- C32 H33 N5 O8 -","- C128 H132 N20 O32 -","4","1","","Chen, Yunfeng; She, Nengfang; Meng, Xianggao; Yin, Guodong; Wu, Anxin; Isaacs, Lyle","Chiral molecular clips control orthogonal crystalline organization.","Organic letters","2007","9","10","1899","1902","10.1021/ol0704340","","","0.71073","MoKα","","0.152","0.0769","","","0.2026","0.2328","","","","","","1.028","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505371","9.8983","0.0011","12.4761","0.0013","14.5525","0.0016","114.321","0.002","95.803","0.002","99.911","0.002","1583.3","0.3","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H35 N5 O8 -","- C36 H35 N5 O8 -","- C72 H70 N10 O16 -","2","1","","Chen, Yunfeng; She, Nengfang; Meng, Xianggao; Yin, Guodong; Wu, Anxin; Isaacs, Lyle","Chiral molecular clips control orthogonal crystalline organization.","Organic letters","2007","9","10","1899","1902","10.1021/ol0704340","","","0.71073","MoKα","","0.1584","0.0517","","","0.0766","0.0995","","","","","","0.726","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505372","32.003","0.003","29.92","0.003","15.6588","0.0015","90","","94.868","0.002","90","","14940","3","292","2","292","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C143 H144 Cl4 Cu2 I4 N20 O36 -","- C143 H144 Cl4 Cu2 I4 N20 O36 -","- C572 H576 Cl16 Cu8 I16 N80 O144 -","4","0.5","","Chen, Yunfeng; She, Nengfang; Meng, Xianggao; Yin, Guodong; Wu, Anxin; Isaacs, Lyle","Chiral molecular clips control orthogonal crystalline organization.","Organic letters","2007","9","10","1899","1902","10.1021/ol0704340","","","0.71073","MoKα","","0.2061","0.0967","","","0.2416","0.2842","","","","","","0.9","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505373","10.6408","0.0008","6.0649","0.0005","13.6002","0.001","90","","101.346","0.004","90","","860.54","0.12","446","2","446","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H21 N O3 Si -","- C16 H21 N O3 Si -","- C32 H42 N2 O6 Si2 -","2","1","","Koo, Bonsuk; McDonald, Frank E.","Fischer carbene catalysis of alkynol cycloisomerization: application to the synthesis of the altromycin B disaccharide.","Organic letters","2007","9","9","1737","1740","10.1021/ol070435s","","","1.54178","CuKα","","0.0293","0.0279","","","0.0716","0.0729","","","","","","1.016","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505374","11.461","0.0003","9.3131","0.0002","18.6652","0.0004","90","","106.458","0.0011","90","","1910.64","0.08","293","2","293","2","","","","","","","synthetised","4","P 1 21/n 1","-P 2yn","14","","1-(para-methoxybenzyl)-3'-pyrrolidinocarbonylspiro[3H-indole-3,2'-oxiran] -2(1H)-one","","- C22 H22 N2 O4 -","- C22 H22 N2 O4 -","- C88 H88 N8 O16 -","4","1","","Schulz, Verena; Davoust, Marion; Lemarié, Margareth; Lohier, Jean-François; Santos, Jana Sopkova de Oliveira; Metzner, Patrick; Brière, Jean-François","Straightforward stereoselective synthesis of spiro-epoxyoxindoles.","Organic letters","2007","9","9","1745","1748","10.1021/ol070439x","","","0.71073","MoKα","","0.0692","0.0487","","","0.1418","0.1694","","","","","","1.034","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"1505375","7.0535","0.0001","8.553","0.0002","10.4821","0.0002","93.399","0.001","95.478","0.001","98.802","0.001","620.31","0.02","100","2","100","2","","","","","","","synthetised","4","P -1","-P 1","2","","3'-benzoylspiro[3H-indole-3,2'-oxiran]-2(1H)-one","","- C16 H11 N O3 -","- C16 H11 N O3 -","- C32 H22 N2 O6 -","2","1","","Schulz, Verena; Davoust, Marion; Lemarié, Margareth; Lohier, Jean-François; Santos, Jana Sopkova de Oliveira; Metzner, Patrick; Brière, Jean-François","Straightforward stereoselective synthesis of spiro-epoxyoxindoles.","Organic letters","2007","9","9","1745","1748","10.1021/ol070439x","","","0.71073","MoKα","","0.0731","0.0475","","","0.125","0.1454","","","","","","1.061","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505376","6.6275","0.0006","8.0268","0.0008","15.9888","0.0016","76.221","0.002","89.339","0.002","84.059","0.002","821.58","0.14","100","","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H22 Cl2 O5 -","- C15 H22 Cl2 O5 -","- C30 H44 Cl4 O10 -","2","1","","Khan, Faiz Ahmed; Rao, G. Hari Mangeswara; Satapathy, Rashmirekha; Parasuraman, Karuppasamy","Serendipitously discovered diazomethane-mediated novel molecular rearrangements of norbornyl alpha-ketohemiketals.","Organic letters","2007","9","8","1581","1584","10.1021/ol070442g","","","0.71073","MoKα","","0.0707","0.0503","","","0.1021","0.1491","","","","","","1.027","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505377","8.5183","0.0008","10.7917","0.001","16.3","0.0015","90","","90","","90","","1498.4","0.2","100","","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H18 Br2 O5 -","- C13 H18 Br2 O5 -","- C52 H72 Br8 O20 -","4","1","","Khan, Faiz Ahmed; Rao, G. Hari Mangeswara; Satapathy, Rashmirekha; Parasuraman, Karuppasamy","Serendipitously discovered diazomethane-mediated novel molecular rearrangements of norbornyl alpha-ketohemiketals.","Organic letters","2007","9","8","1581","1584","10.1021/ol070442g","","","0.71073","MoKα","","0.0526","0.0421","","","0.0898","0.1116","","","","","","1.122","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505378","8.849","0.003","11.325","0.003","11.675","0.003","75.847","0.019","102.21","0.02","90.56","0.02","1107.7","0.6","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H20 O S -","- C30 H20 O S -","- C60 H40 O2 S2 -","2","1","","Lin, Yi-Chun; Lin, Chih-Hsiu","Synthesis of tetracene sulfoxide and tetracene sulfone via a cascade cyclization reaction.","Organic letters","2007","9","11","2075","2078","10.1021/ol070467f","","","0.71073","MoKα","","0.1327","0.0448","","","0.1145","0.1478","","","","","","0.99","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505379","22.344","0.005","29.436","0.006","14.928","0.003","90","","90","","90","","9818","4","150","","150","","","","","","","","F. Douelle","6","F d d 2","F 2 -2d","43","","","","- C21 H20 I N3 O10 S -","- C21 H20 I N3 O10 S -","- C336 H320 I16 N48 O160 S16 -","16","1","","Douelle, Frederic; Capes, Amy S.; Greaney, Michael F.","Highly diastereoselective synthesis of vicinal quaternary and tertiary stereocenters using the iodo-aldol cyclization.","Organic letters","2007","9","10","1931","1934","10.1021/ol070482k","","","0.71073","MoKα","","0.0319","0.0295","","0.0666","0.0627","0.0666","","","","","","0.9975","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505380","13.2772","0.0003","14.9744","0.0003","13.9581","0.0003","90","","91.649","0.001","90","","2773.97","0.1","150","","150","","","","","","","","Frederic Douelle","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 I N3 O10 S -","- C23 H24 I N3 O10 S -","- C92 H96 I4 N12 O40 S4 -","4","1","","Douelle, Frederic; Capes, Amy S.; Greaney, Michael F.","Highly diastereoselective synthesis of vicinal quaternary and tertiary stereocenters using the iodo-aldol cyclization.","Organic letters","2007","9","10","1931","1934","10.1021/ol070482k","","","0.71073","MoKα","","0.0577","0.041","","0.1024","0.0982","0.1024","","","","","","0.9319","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505381","17.22","0.003","11.154","0.002","27.154","0.005","90","","90","","90","","5215.5","1.6","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C28 H35 N3 O2 S -","- C28 H35 N3 O2 S -","- C224 H280 N24 O16 S8 -","8","1","","Xu, Xiaoliang; Cheng, Dongping; Li, Jinghua; Guo, Hongyun; Yan, Jie","Copper-catalyzed highly efficient multicomponent reactions: synthesis of 2-(sulfonylimino)-4-(alkylimino)azetidine derivatives.","Organic letters","2007","9","8","1585","1587","10.1021/ol070485x","","","0.71069","MoKα","","0.057","0.0411","","","0.109","0.1173","","","","","","1.064","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505382","22.745","0.006","7.5665","0.0017","25.334","0.005","90","","113.35","0.02","90","","4002.9","1.7","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H18 O2 S2 -","- C26 H18 O2 S2 -","- C208 H144 O16 S16 -","8","2","","Kühni, Joël; Belser, Peter","Gated photochromism of 1,2-diarylethenes.","Organic letters","2007","9","10","1915","1918","10.1021/ol070487h","","","0.71073","MoKα","","0.3931","0.0838","","","0.1824","0.2898","","","","","","0.746","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505383","7.1901","0.0003","16.9644","0.0006","18.5261","0.0007","78.899","0.001","79.339","0.001","83.573","0.001","2172.34","0.14","144","2","144","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H22 N2 O8 -","- C23 H22 N2 O8 -","- C92 H88 N8 O32 -","4","2","","Abramite, Joseph A.; Sammakia, Tarek","Application of the intramolecular Yamamoto vinylogous aldol reaction to the synthesis of macrolides.","Organic letters","2007","9","11","2103","2106","10.1021/ol0704901","","","0.71073","MoKα","","0.1238","0.0688","","","0.1658","0.1966","","","","","","0.987","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505384","8.4598","0.0005","11.1436","0.0007","11.9093","0.0007","103.344","0.001","111.13","0.001","99.178","0.001","981.85","0.1","148","2","148","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H18 N2 O8 -","- C21 H18 N2 O8 -","- C42 H36 N4 O16 -","2","1","","Abramite, Joseph A.; Sammakia, Tarek","Application of the intramolecular Yamamoto vinylogous aldol reaction to the synthesis of macrolides.","Organic letters","2007","9","11","2103","2106","10.1021/ol0704901","","","0.71073","MoKα","","0.0649","0.0576","","","0.1521","0.1613","","","","","","1.034","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505385","10.0686","0.0005","22.4772","0.0013","10.2181","0.0006","90","","112.67","0.001","90","","2133.8","0.2","147","2","147","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H18 N2 O8 -","- C21 H18 N2 O8 -","- C84 H72 N8 O32 -","4","1","","Abramite, Joseph A.; Sammakia, Tarek","Application of the intramolecular Yamamoto vinylogous aldol reaction to the synthesis of macrolides.","Organic letters","2007","9","11","2103","2106","10.1021/ol0704901","","","0.71073","MoKα","","0.1083","0.0602","","","0.139","0.1561","","","","","","0.93","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505386","9.6672","0.0004","15.3296","0.0007","22.8756","0.0011","90","","90","","90","","3390","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C39 H42 O6 S3 -","- C39 H42 O6 S3 -","- C156 H168 O24 S12 -","4","1","","Lélias-Vanderperre, Anne; Chambron, Jean-Claude; Espinosa, Enrique; Terrier, Peran; Leize-Wagner, Emmanuelle","Macrotricycles featuring a pi-basic tetrahedral cavity: preference for NH4+ detected by electrospray ionization mass spectrometry.","Organic letters","2007","9","16","2961","2964","10.1021/ol070498a","","","0.71073","MoKα","","0.029","0.0268","","","0.0663","0.0675","","","","","","1.036","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505387","10.881","0.005","9.452","0.004","25.882","0.012","90","","97.981","0.008","90","","2636","2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H33 N O2 -","- C31 H33 N O2 -","- C124 H132 N4 O8 -","4","1","","Lu, Jian-Mei; Shi, Min","Lewis acid catalyzed reaction of arylvinylidenecyclopropanes with ethyl (arylimino)acetates: a facile synthetic protocol for pyrrolidine and 1,2,3,4-tetrahydroquinoline derivatives.","Organic letters","2007","9","9","1805","1808","10.1021/ol070501q","","","0.71073","MoKα","","0.1141","0.0686","","","0.1976","0.2255","","","","","","0.945","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505388","10.4511","0.0004","18.9558","0.0007","9.7638","0.0004","90","","105.932","0.002","90","","1860","0.13","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H26 Br2 O -","- C19 H26 Br2 O -","- C76 H104 Br8 O4 -","4","1","","Liu, Feng; Loh, Teck-Peng","Highly stereoselective prins cyclization of (Z)- and (E)-gamma-brominated homoallylic alcohols to 2,4,5,6-tetrasubstituted tetrahydropyrans.","Organic letters","2007","9","11","2063","2066","10.1021/ol070506n","","","0.71073","MoKα","","0.0426","0.0264","","","0.0553","0.0599","","","","","","1.024","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505389","11.132","0.001","12.407","0.001","11.655","0.001","90","","107.67","0.01","90","","1533.8","0.2","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C31 H40 O11 -","- C31 H40 O11 -","- C62 H80 O22 -","2","1","","Huang, Sheng-Xiong; Li, Rong-Tao; Liu, Jing-Ping; Lu, Yang; Chang, Ying; Lei, Chun; Xiao, Wei-Lie; Yang, Li-Bin; Zheng, Qi-Tai; Sun, Han-Dong","Isolation and characterization of biogenetically related highly oxygenated nortriterpenoids from Schisandra chinensis.","Organic letters","2007","9","11","2079","2082","10.1021/ol070510z","","","0.71073","MoKα","","0.0685","0.0666","","","0.1833","0.1883","","","","","","1.084","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505390","8.214","0.002","15.608","0.005","11.522","0.003","90","","90.982","0.004","90","","1477","0.7","273","2","273","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C29 H38 O12 -","- C29 H38 O12 -","- C58 H76 O24 -","2","1","","Huang, Sheng-Xiong; Li, Rong-Tao; Liu, Jing-Ping; Lu, Yang; Chang, Ying; Lei, Chun; Xiao, Wei-Lie; Yang, Li-Bin; Zheng, Qi-Tai; Sun, Han-Dong","Isolation and characterization of biogenetically related highly oxygenated nortriterpenoids from Schisandra chinensis.","Organic letters","2007","9","11","2079","2082","10.1021/ol070510z","","","0.71073","MoKα","","0.0928","0.0429","","","0.1001","0.1266","","","","","","1.031","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505391","11.5794","0.0003","13.935","0.0004","16.6418","0.0005","90","","105.578","0.001","90","","2586.66","0.13","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H30 Cl2 N2 O Ru -","- C27 H30 Cl2 N2 O Ru -","- C108 H120 Cl8 N8 O4 Ru4 -","4","1","","Stewart, Ian C.; Ung, Thay; Pletnev, Alexandre A.; Berlin, Jacob M.; Grubbs, Robert H.; Schrodi, Yann","Highly efficient ruthenium catalysts for the formation of tetrasubstituted olefins via ring-closing metathesis.","Organic letters","2007","9","8","1589","1592","10.1021/ol0705144","","","0.71073","MoKα","","0.0575","0.0348","","","0.0652","0.0688","","","","","","1.35","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"1505392","13.031","0.003","9.94","0.002","13.631","0.003","90","","113.908","0.013","90","","1614.1","0.6","123.1","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C19 H18 O3 S -","- C19 H18 O3 S -","- C76 H72 O12 S4 -","4","1","","Shindo, Mitsuru; Yoshimura, Yutaka; Hayashi, Maiko; Soejima, Hiroe; Yoshikawa, Takashi; Matsumoto, Kenji; Shishido, Kozo","Synthesis of multisubstituted furans, pyrroles, and thiophenes via ynolates.","Organic letters","2007","9","10","1963","1966","10.1021/ol0705200","","","1.54187","CuKα","","","0.0397","","","","0.1064","","","","","","1.08","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505393","10.483","0.002","11.118","0.002","15.144","0.003","90","","91.38","0.02","90","","1764.5","0.6","289","2","289","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H20 N2 O3 -","- C22 H19.25 N2 O3 -","- C88 H77 N8 O12 -","4","2","","Cai, Xiang-Hai; Du, Zhi-Zhi; Luo, Xiao-Dong","Unique monoterpenoid indole alkaloids from Alstonia scholaris.","Organic letters","2007","9","9","1817","1820","10.1021/ol0705301","","","0.71073","MoKα","","0.0465","0.0346","","","0.0756","0.0787","","","","","","1.005","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505394","7.225","0.0014","12.294","0.003","24.673","0.005","90","","90.5","0.03","90","","2191.5","0.8","120","","120","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C13 H16 O2 -","- C13 H16 O2 -","- C104 H128 O16 -","8","2","","Zou, Yefen; Chen, Chun-Hsing; Taylor, Christopher D.; Foxman, Bruce M.; Snider, Barry B.","Formal synthesis of (+/-)-platensimycin.","Organic letters","2007","9","9","1825","1828","10.1021/ol070563g","","","0.71073","MoKα","","0.0582","0.0409","","0.1027","0.0975","0.1027","","","","","","0.8545","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505395","8.7665","0.0003","10.4942","0.0003","12.5707","0.0004","72.629","0.002","73.576","0.002","79.924","0.002","1053.5","0.06","120","","120","","","","","","","","","3","P -1","-P 1","2","","","","- C13 H16 O2 -","- C13 H16 O2 -","- C52 H64 O8 -","4","2","","Zou, Yefen; Chen, Chun-Hsing; Taylor, Christopher D.; Foxman, Bruce M.; Snider, Barry B.","Formal synthesis of (+/-)-platensimycin.","Organic letters","2007","9","9","1825","1828","10.1021/ol070563g","","","0.71073","MoKα","","0.0642","0.0441","","0.1152","0.1057","0.1152","","","","","","0.9385","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505396","9.5518","0.0003","5.4857","0.0002","16.4179","0.0005","90","","97.103","0.002","90","","853.67","0.05","223","2","223","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H20 O3 S -","- C19 H20 O3 S -","- C38 H40 O6 S2 -","2","1","","Li, Hao; Zu, Liansuo; Xie, Hexin; Wang, Jian; Jiang, Wei; Wang, Wei","Enantioselective organocatalytic double Michael addition reactions.","Organic letters","2007","9","9","1833","1835","10.1021/ol070581y","","","0.71073","MoKα","","0.0463","0.0379","","","0.0792","0.0837","","","","","","0.98","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505397","53.0849","0.0014","6.5227","0.0002","9.6315","0.0005","90","","95.929","0.0014","90","","3317.1","0.2","93","2","93","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C29 H6 F28 S4 -","- C29 H6 F28 S4 -","- C116 H24 F112 S16 -","4","0.5","","Ie, Yutaka; Nitani, Masashi; Ishikawa, Motomi; Nakayama, Ken-ichi; Tada, Hirokazu; Kaneda, Takahiro; Aso, Yoshio","Electronegative oligothiophenes for n-type semiconductors: difluoromethylene-bridged bithiophene and its oligomers.","Organic letters","2007","9","11","2115","2118","10.1021/ol070584a","","","1.54187","CuKα","","0.109","0.0767","","","0.1931","0.2252","","","","","","1.218","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505398","9.118","0.003","19.012","0.003","11.942","0.005","90","","93.65","0.02","90","","2066","1.1","193","2","193","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C21 H30 O9 -","- C21 H30 O9 -","- C84 H120 O36 -","4","2","","Niu, Xue-Mei; Li, Sheng-Hong; Görls, Helmar; Schollmeyer, Dieter; Hilliger, Matthias; Grabley, Susanne; Sattler, Isabel","Abyssomicin E, a highly functionalized polycyclic metabolite from Streptomyces species.","Organic letters","2007","9","13","2437","2440","10.1021/ol0705999","","","1.54178","CuKα","","0.0732","0.0572","","","0.1581","0.2109","","","","","","1.087","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505399","11.2502","0.0003","13.2372","0.0003","23.032","0.0007","98.059","0.002","94.078","0.002","106.16","0.002","3239.95","0.16","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C76 H83 N5 Ni O4 -","- C76 H83 N5 Ni O4 -","- C152 H166 N10 Ni2 O8 -","2","1","","Alonso, Cristina M. A.; Serra, Vanda I. V.; Neves, Maria G. P. M. S.; Tomé, Augusto C; Silva, Artur M. S.; Paz, Filipe A. A.; Cavaleiro, José A S","An easy synthetic approach to pyridoporphyrins by domino reactions.","Organic letters","2007","9","12","2305","2308","10.1021/ol070601w","","","1.54178","MoKα","","0.1033","0.0671","","","0.1813","0.2096","","","","","","1.038","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505400","12.67","0.006","4.943","0.002","17.744","0.008","90","","110.918","0.005","90","","1038","0.8","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C23 H28 O6 -","- C23 H28 O6 -","- C46 H56 O12 -","2","1","","Clark, J. Stephen; Conroy, Joanne; Blake, Alexander J.","Rapid synthesis of the A-E fragment of ciguatoxin CTX3C.","Organic letters","2007","9","11","2091","2094","10.1021/ol0706096","","","0.71073","MoKα","","0.0835","0.0519","","","0.121","0.135","","","","","","0.94","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505401","4.5818","0.0013","13.616","0.004","36.927","0.01","90","","90","","90","","2303.7","1.1","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C26 H32 O6 -","- C26 H32 O6 -","- C104 H128 O24 -","4","1","","Clark, J. Stephen; Conroy, Joanne; Blake, Alexander J.","Rapid synthesis of the A-E fragment of ciguatoxin CTX3C.","Organic letters","2007","9","11","2091","2094","10.1021/ol0706096","","","0.7848","synchrotron","","0.0601","0.0448","","","0.103","0.113","","","","","","1.11","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505402","18.7743","0.0003","29.9639","0.0006","31.9847","0.0008","90","","90","","90","","17993","0.6","123.1","","","","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C42 H52 B2 F8 I2 O8 -","- C42 H52 B2 F8 I2 O8 -","- C672 H832 B32 F128 I32 O128 -","16","1","","Miyamoto, Kazunori; Hirobe, Masaya; Saito, Motomichi; Shiro, Motoo; Ochiai, Masahito","One-pot regioselective synthesis of chromanyl(phenyl)-lambda(3)-iodanes: tandem oxidative cyclization and lambda(3)-iodanation of 3-phenylpropanols.","Organic letters","2007","9","10","1995","1998","10.1021/ol0706105","","","0.71069","MoKα","","","0.027","","","","0.058","","","","","","1.068","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505403","14.8561","0.0018","22.866","0.003","21.756","0.003","90","","102.704","0.002","90","","7209.6","1.6","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18.67 F6 N2 O1.33 S -","- C24 H18 F6 N2 O1.33333 S -","- C288 H216 F72 N24 O16 S12 -","12","3","","Pu, Shouzhi; Liu, Gang; Shen, Liang; Xu, Jingkun","Efficient synthesis and properties of isomeric photochromic diarylethenes having a pyrrole unit.","Organic letters","2007","9","11","2139","2142","10.1021/ol070622q","","","0.71073","MoKα","","0.2253","0.0844","","","0.2141","0.3204","","","","","","0.999","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505404","23.12","0.003","8.9474","0.0011","11.4416","0.0013","90","","101.835","0.001","90","","2316.5","0.5","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18 F6 N2 O S -","- C24 H18 F6 N2 O S -","- C96 H72 F24 N8 O4 S4 -","4","1","","Pu, Shouzhi; Liu, Gang; Shen, Liang; Xu, Jingkun","Efficient synthesis and properties of isomeric photochromic diarylethenes having a pyrrole unit.","Organic letters","2007","9","11","2139","2142","10.1021/ol070622q","","","0.71073","MoKα","","0.0715","0.0537","","","0.1364","0.1524","","","","","","1.038","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505405","8.7448","0.0002","13.9102","0.0003","14.4931","0.0003","90","","90","","90","","1762.97","0.07","220","2","220","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C13 H16 Cl3 N O4 S2 -","- C13 H16 Cl3 N O4 S2 -","- C52 H64 Cl12 N4 O16 S8 -","4","1","","Zajac, Marian; Peters, René","Catalytic asymmetric formation of beta-sultams.","Organic letters","2007","9","10","2007","2010","10.1021/ol070644c","","","0.7107","MoKα","","0.0335","0.0305","","","0.0803","0.0827","","","","","","1.07","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505406","7.5166","0.0005","16.9331","0.001","21.0741","0.0011","90","","97.855","0.004","90","","2657.1","0.3","150","","150","","","","","","","","M. Scansetti","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H31 N O9 -","- C28 H31 N O9 -","- C112 H124 N4 O36 -","4","1","","Scansetti, Myriam; Hu, Xiangping; McDermott, Benjamin P.; Lam, Hon Wai","Synthesis of pyroglutamic acid derivatives via double michael reactions of alkynones.","Organic letters","2007","9","11","2159","2162","10.1021/ol070674f","","","0.71073","MoKα","","0.1085","0.0666","","0.1943","0.1604","0.1943","","","","","","1.0626","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505407","7.9893","0.0014","27.158","0.005","11.724","0.002","90","","93.637","0.003","90","","2538.7","0.8","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H23 N3 O14 S2 -","- C20 H23 N3 O14 S2 -","- C80 H92 N12 O56 S8 -","4","2","","Knapp, Spencer; Abdo, Mohannad; Ajayi, Kehinde; Huhn, Richard A.; Emge, Thomas J.; Kim, Eun Ju; Hanover, John A.","Tautomeric modification of GlcNAc-thiazoline.","Organic letters","2007","9","12","2321","2324","10.1021/ol0706814","","","0.71073","MoKα","","0.0779","0.0631","","","0.1459","0.1564","","","","","","1.023","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505408","9.857","0.003","12.751","0.005","31.634","0.009","90","","90","","90","","3976","2","198","2","198","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H24 N4 O6 -","- C17 H24 N4 O6 -","- C136 H192 N32 O48 -","8","2","","Snyder, Seth E.; Volkers, Phillip I.; Engebretson, David A.; Lee, Wonjae; Pirkle, William H.; Carey, James R.","Strong enantioselective self-recognition of a small chiral molecule.","Organic letters","2007","9","12","2341","2343","10.1021/ol070703m","","","0.71073","MoKα","","0.0988","0.0587","","","0.1526","0.1976","","","","","","1.106","","","","has coordinates","189977","2020-10-21","18:00:00",""
"1505409","20.525","0.004","12.332","0.003","32.577","0.008","90","","108.199","0.004","90","","7833","3","193","2","193","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C17 H24 N4 O6 -","- C17 H24 N4 O6 -","- C272 H384 N64 O96 -","16","2","","Snyder, Seth E.; Volkers, Phillip I.; Engebretson, David A.; Lee, Wonjae; Pirkle, William H.; Carey, James R.","Strong enantioselective self-recognition of a small chiral molecule.","Organic letters","2007","9","12","2341","2343","10.1021/ol070703m","","","0.71073","MoKα","","0.1927","0.0427","","","0.0701","0.0943","","","","","","0.792","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505410","13.532","0.0005","5.4471","0.0002","15.2633","0.0006","90","","113.234","0.001","90","","1033.82","0.07","90","2","90","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C23 H16 Br2 F3 N O -","- C23 H16 Br2 F3 N O -","- C46 H32 Br4 F6 N2 O2 -","2","1","","Denton, Justin R.; Sukumaran, Dinesh; Davies, Huw M. L.","Enantioselective synthesis of trifluoromethyl-substituted cyclopropanes.","Organic letters","2007","9","14","2625","2628","10.1021/ol070714f","","","0.71073","MoKα","","0.0484","0.0382","","","0.0897","0.0947","","","","","","1.024","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505411","9.46","0.0018","6.0405","0.0012","13.586","0.003","90","","108.872","0.003","90","","734.6","0.3","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","05070","","","- C18 H15 N O3 -","- C18 H15 N O3 -","- C36 H30 N2 O6 -","2","1","","Oppenheimer, Jossian; Johnson, Whitney L.; Tracey, Michael R.; Hsung, Richard P.; Yao, Pei-Yuan; Liu, Renhe; Zhao, Kang","A rhodium(I)-catalyzed demethylation-cyclization of o-anisole-substituted ynamides in the synthesis of chiral 2-amido benzofurans.","Organic letters","2007","9","12","2361","2364","10.1021/ol0707362","","","0.71073","MoKα","","0.0355","0.0328","","","0.0889","0.0909","","","","","","1.031","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505412","11.0209","0.0002","12.2273","0.0002","31.3304","0.0004","90","","90","","90","","4221.95","0.12","150","","150","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C36 H66 O11 S Si2 -","- C36 H66 O11 S Si2 -","- C144 H264 O44 S4 Si8 -","4","1","","Kim, Youngsoon; Fuchs, Philip L.","Lactol-directed osmylation. Stereodivergent synthesis of four C-19,20 apoptolidin diols from a single allylic hemiacetal.","Organic letters","2007","9","13","2445","2448","10.1021/ol0707564","","","0.71073","MO-Kα","","0.056","0.044","","","0.09","0.095","","","","","","1.04","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505413","7.292","0.0004","17.7683","0.0017","17.7243","0.0011","90","","98.805","0.004","90","","2269.4","0.3","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C38 H66 O12 S Si2 -","- C38 H66 O12 S Si2 -","- C76 H132 O24 S2 Si4 -","2","1","","Kim, Youngsoon; Fuchs, Philip L.","Lactol-directed osmylation. Stereodivergent synthesis of four C-19,20 apoptolidin diols from a single allylic hemiacetal.","Organic letters","2007","9","13","2445","2448","10.1021/ol0707564","","","0.71073","MO-Kα","","0.091","0.088","","","0.181","0.182","","","","","","1.213","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505414","6.725","","13.858","","16.061","","90","","90","","90","","1496.81","","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H16 I N O4 -","- C14 H16 I N O4 -","- C56 H64 I4 N4 O16 -","4","1","","Pattarozzi, Mariella; Zonta, Cristiano; Broxterman, Quirinus B.; Kaptein, Bernard; De Zorzi, Rita; Randaccio, Lucio; Scrimin, Paolo; Licini, Giulia","Stereoselective iodocyclization of (S)-allylalanine derivatives: gamma-lactone vs cyclic carbamate formation.","Organic letters","2007","9","12","2365","2368","10.1021/ol070764k","","","0.71073","MoKα","","0.0627","0.0536","","","0.1444","0.1534","","","","","","1.069","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505415","11.3244","0.0009","16.2185","0.0013","23.641","0.0017","90","","90.462","0.005","90","","4341.9","0.6","296","","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C23 H25 N O3 S -","- C19.688 H21.4 N0.856 O2.568 S0.856 -","- C157.504 H171.2 N6.848 O20.544 S6.848 -","8","1","","Tanaka, Ken; Otake, Yousuke; Wada, Azusa; Noguchi, Keiichi; Hirano, Masao","Cationic Rh(I)/modified-BINAP-catalyzed reactions of carbonyl compounds with 1,6-diynes leading to dienones and ortho-functionalized aryl ketones.","Organic letters","2007","9","11","2203","2206","10.1021/ol0707721","","","1.54187","CuKα","","0.0898","0.0685","","","0.2237","0.2381","","","","","","1.054","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505416","6.0607","0.0008","15.52","0.002","20.018","0.003","90","","90","","90","","1882.9","0.4","95","2","95","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","cmc0546b","","","- C20 H30 N2 O3 -","- C20 H30 N2 O3 -","- C80 H120 N8 O12 -","4","1","","Song, Zhenlei; Hsung, Richard P.","A formal total synthesis of (+)-zincophorin. Observation of an unusual urea-directed Stork-Crabtree hydrogenation.","Organic letters","2007","9","11","2199","2202","10.1021/ol070791a","","","0.49594","synchrotron","","0.0463","0.044","","","0.1211","0.1228","","","","","","1.128","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505417","9.8192","0.0006","9.8192","0.0006","24.526","0.003","90","","90","","120","","2047.9","0.3","173","2","173","2","","","","","","","","3","P 32 2 1","P 32 2""","154","07009a","","","- C13 H22 O3 -","- C13 H22 O3 -","- C78 H132 O18 -","6","1","","Song, Zhenlei; Hsung, Richard P.","A formal total synthesis of (+)-zincophorin. Observation of an unusual urea-directed Stork-Crabtree hydrogenation.","Organic letters","2007","9","11","2199","2202","10.1021/ol070791a","","","0.71073","MoKα","","0.0343","0.0312","","","0.0817","0.0836","","","","","","1.083","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505418","23.045","0.0008","6.8145","0.0005","23.8953","0.0008","90","","97.8218","0.0013","90","","3717.6","0.3","120","","120","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C90 H122 O2 -","- C90 H122 O2 -","- C180 H244 O4 -","2","0.5","","Dou, Xi; Yang, Xiaoyin; Bodwell, Graham J.; Wagner, Manfred; Enkelmann, Volker; Müllen, Klaus","Unexpected phenyl group rearrangement during an intramolecular Scholl reaction leading to an alkoxy-substituted hexa-peri-hexabenzocoronene.","Organic letters","2007","9","13","2485","2488","10.1021/ol0708018","","","0.71073","MoKα","","0.0486","0.0504","","0.047","0.047","0.047","","","","","","0.9049","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505419","16.489","0.0017","14.7552","0.0014","14.3559","0.0013","90","","101.286","0.003","90","","3425.2","0.6","100","1","100","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H22 N2 O3.5 -","- C12 H22 N2 O3.5 -","- C96 H176 N16 O28 -","8","1","","Hoang, Cam Thuy; Alezra, Valérie; Guillot, Régis; Kouklovsky, Cyrille","A stereoselective entry into functionalized 1,2-diamines by zinc-mediated homologation of alpha-aminoacids.","Organic letters","2007","9","13","2521","2524","10.1021/ol0708020","","x-ray","0.71073","MoKα","","0.108","0.0695","","","0.1232","0.1783","","","","","","1.107","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505420","9.848","0.0007","9.704","0.0007","30.58","0.002","90","","90","","90","","2922.4","0.4","293","2","293","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H34 F2 O7 -","- C31 H34 F2 O7 -","- C124 H136 F8 O28 -","4","1","","Moreno, Benjamin; Quehen, Cindy; Rose-Hélène, Maureen; Leclerc, Eric; Quirion, Jean-Charles","Addition of difluoromethyl radicals to glycals: a new route to alpha-CF2-D-glycosides.","Organic letters","2007","9","13","2477","2480","10.1021/ol070835f","","x-ray","0.71073","MoKα","","0.0604","0.042","","","0.073","0.0769","","","","","","1.041","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505421","12.231","0.003","14.444","0.004","23.916","0.006","82.718","0.006","87.233","0.006","69.734","0.005","3931.5","1.8","123","1","123","1","","","","","","","","4","P -1","-P 1","2","","","","- C84 H93 N3 O18 -","- C84 H90 N3 O18 -","- C168 H180 N6 O36 -","2","1","","Kogan, Katerina; Biali, Silvio E.","Intramolecular SNAr reactions in a large-ring ketocalix[6]arene.","Organic letters","2007","9","12","2393","2396","10.1021/ol070870m","","","0.71073","MoKα","","0.1817","0.0594","","","0.1194","0.1394","","","","","","0.73","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505422","11.1681","0.0013","12.5022","0.0015","13.1463","0.0015","104.302","0.002","100.131","0.002","112.057","0.002","1573","0.3","173","1","173","1","","","","","","","","3","P -1","-P 1","2","","","","- C72 H84 O12 -","- C72 H84 O12 -","- C72 H84 O12 -","1","0.5","","Kogan, Katerina; Biali, Silvio E.","Intramolecular SNAr reactions in a large-ring ketocalix[6]arene.","Organic letters","2007","9","12","2393","2396","10.1021/ol070870m","","","0.71073","MoKα","","0.0815","0.0752","","","0.17","0.1741","","","","","","1.175","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505423","14.665","0.004","18.699","0.005","25.185","0.007","96.674","0.005","94.722","0.005","97.918","0.005","6760","3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C73 H82.5 N1.5 O11 -","- C73 H78 N1.5 O11 -","- C292 H312 N6 O44 -","4","2","","Kogan, Katerina; Biali, Silvio E.","Intramolecular SNAr reactions in a large-ring ketocalix[6]arene.","Organic letters","2007","9","12","2393","2396","10.1021/ol070870m","","","0.71073","MoKα","","0.1159","0.0784","","","0.2428","0.2643","","","","","","1.081","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505424","11.7096","0.0019","20.183","0.003","31.905","0.005","98.296","0.003","94.448","0.003","96.059","0.003","7387","2","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C77 H94 Cl3 N6 O Zn -","- C77 H94 Cl3 N6 O Zn -","- C308 H376 Cl12 N24 O4 Zn4 -","4","2","","Maeda, Chihiro; Shinokubo, Hiroshi; Osuka, Atsuhiro","Synthesis of meso-5-azaindolyl-appended Zn(II) porphyrins via Pd-catalyzed annulation.","Organic letters","2007","9","13","2493","2496","10.1021/ol070885k","","","0.71073","MoKα","","0.1702","0.0932","","","0.2266","0.2783","","","","","","1.065","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505425","6.1304","0.0006","10.4292","0.001","11.9236","0.0011","90","","90","","90","","762.34","0.13","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C5 H8 Cl N O3 -","- C5 H8 Cl N O3 -","- C20 H32 Cl4 N4 O12 -","4","1","","Thomas, P. J.; Axtell, Alex T.; Klosin, Jerzy; Peng, Wei; Rand, Cynthia L.; Clark, Thomas P.; Landis, Clark R.; Abboud, Khalil A.","Asymmetric hydroformylation of vinyl acetate: application in the synthesis of optically active isoxazolines and imidazoles.","Organic letters","2007","9","14","2665","2668","10.1021/ol070900l","","","0.71073","MoKα","","0.0325","0.0319","","","0.0787","0.0793","","","","","","1.084","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505426","5.4291","0.001","30.429","0.006","10.873","0.002","90","","99.416","0.003","90","","1772","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H20 O4 S -","- C19 H20 O4 S -","- C76 H80 O16 S4 -","4","1","","Tian, Guo-Qiang; Shi, Min","Brønsted acid-mediated stereoselective cascade construction of functionalized tetrahydropyrans from 2-(arylmethylene)cyclopropylcarbinols and aldehydes.","Organic letters","2007","9","12","2405","2408","10.1021/ol0709026","","","0.71073","MoKα","","0.1014","0.0486","","","0.1014","0.1134","","","","","","0.802","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505427","5.7054","0.0017","10.466","0.003","17.168","0.005","80.479","0.005","83.302","0.005","79.666","0.006","990.6","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H21 Br O5 S -","- C19 H21 Br O5 S -","- C38 H42 Br2 O10 S2 -","2","1","","Tian, Guo-Qiang; Shi, Min","Brønsted acid-mediated stereoselective cascade construction of functionalized tetrahydropyrans from 2-(arylmethylene)cyclopropylcarbinols and aldehydes.","Organic letters","2007","9","12","2405","2408","10.1021/ol0709026","","","0.71073","MoKα","","0.1395","0.073","","","0.1809","0.2188","","","","","","0.878","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505428","9.738","0.016","10.632","0.018","19.29","0.03","90","","103.06","0.03","90","","1946","6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H24 O4 S -","- C21 H24 O4 S -","- C84 H96 O16 S4 -","4","1","","Tian, Guo-Qiang; Shi, Min","Brønsted acid-mediated stereoselective cascade construction of functionalized tetrahydropyrans from 2-(arylmethylene)cyclopropylcarbinols and aldehydes.","Organic letters","2007","9","12","2405","2408","10.1021/ol0709026","","","0.71073","MoKα","","0.089","0.0674","","","0.1526","0.1685","","","","","","1.004","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505429","11.714","0.002","12.064","0.002","12.691","0.003","117.1","0.03","112.07","0.03","95.88","0.03","1395.8","0.9","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H48 O3 Si -","- C27 H48 O3 Si -","- C54 H96 O6 Si2 -","2","1","","Huang, Jie; Wang, Huan; Wu, Chunrui; Wulff, William D.","Intramolecular cyclohexadienone annulations of Fischer carbene complexes: model studies for the synthesis of Phomactins.","Organic letters","2007","9","15","2799","2802","10.1021/ol070904q","","","0.71073","MoKα","","0.061","0.0436","","","0.1271","0.1364","","","","","","0.921","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505430","12.336","0.003","11.201","0.002","18.593","0.004","90","","99.52","0.03","90","","2533.7","1","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C28 H40 O4 -","- C28 H40 O4 -","- C112 H160 O16 -","4","1","","Huang, Jie; Wang, Huan; Wu, Chunrui; Wulff, William D.","Intramolecular cyclohexadienone annulations of Fischer carbene complexes: model studies for the synthesis of Phomactins.","Organic letters","2007","9","15","2799","2802","10.1021/ol070904q","","","0.71073","MoKα","","0.126","0.0557","","","0.1297","0.164","","","","","","0.894","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505431","10.2279","0.0013","10.6309","0.0013","15.392","0.0019","80.421","0.002","71.857","0.002","89.308","0.002","1566.8","0.3","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H22 O3 -","- C18 H22 O3 -","- C72 H88 O12 -","4","2","","Malik, Chanchal K.; Ghosh, Subrata","Domino metathesis involving ROM-RCM of substituted norbornenes. Rapid access to densely functionalized tricyclic bridged and condensed ring systems","Organic Letters","2007","9","13","2537","2540","10.1021/ol070906a","","","0.71073","MoKα","","0.1124","0.059","","","0.1502","0.1872","","","","","","0.95","","","","has coordinates","218624","2020-10-21","18:00:00",""
"1505432","26.729","0.003","6.1676","0.0008","11.6348","0.0014","90","","114.247","0.004","90","","1748.8","0.4","173","2","173","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C20 H22 O6 -","- C20 H22 O6 -","- C80 H88 O24 -","4","1","","Takikawa, Hiroshi; Suzuki, Keisuke","Modified chiral triazolium salts for enantioselective benzoin cyclization of enolizable keto-aldehydes: synthesis of (+)-sappanone B.","Organic letters","2007","9","14","2713","2716","10.1021/ol070929p","","x-ray","0.71073","MoKα","","0.0583","0.0428","","","0.0998","0.1075","","","","","","0.986","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505433","6.195","0.0011","17.387","0.003","19.004","0.003","90","","90","","90","","2047","0.6","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C25 H24 O6 -","- C25 H24 O6 -","- C100 H96 O24 -","4","1","","Takikawa, Hiroshi; Suzuki, Keisuke","Modified chiral triazolium salts for enantioselective benzoin cyclization of enolizable keto-aldehydes: synthesis of (+)-sappanone B.","Organic letters","2007","9","14","2713","2716","10.1021/ol070929p","","x-ray","0.71073","MoKα","","0.1234","0.0508","","","0.0842","0.0986","","","","","","0.841","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505434","6.3","0.001","13.636","0.002","21.235","0.004","90","","90","","90","","1824.2","0.5","223.2","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H24 O5 -","- C21 H24 O5 -","- C84 H96 O20 -","4","1","","Takikawa, Hiroshi; Suzuki, Keisuke","Modified chiral triazolium salts for enantioselective benzoin cyclization of enolizable keto-aldehydes: synthesis of (+)-sappanone B.","Organic letters","2007","9","14","2713","2716","10.1021/ol070929p","","","1.5419","CuKα","","","0.0667","","","","0.1814","","","","","","1.877","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505435","13.937","0.006","5.674","0.002","14.021","0.006","90","","90.777","0.009","90","","1108.7","0.8","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H21 Br O7 -","- C25 H21 Br O7 -","- C50 H42 Br2 O14 -","2","1","","Takikawa, Hiroshi; Suzuki, Keisuke","Modified chiral triazolium salts for enantioselective benzoin cyclization of enolizable keto-aldehydes: synthesis of (+)-sappanone B.","Organic letters","2007","9","14","2713","2716","10.1021/ol070929p","","","0.71073","MoKα","","0.1348","0.0613","","","0.1344","0.154","","","","","","0.839","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505436","7.356","0.003","6.447","0.003","26.303","0.01","90","","91.214","0.007","90","","1247.1","0.9","290","2","290","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 N2 O3 -","- C14 H12 N2 O3 -","- C56 H48 N8 O12 -","4","1","","De, Prithwiraj; Nonappa,; Pandurangan, Komala; Maitra, Uday; Wailes, Steve","CuI-mediated cross-coupling of aryl halides with oximes: a direct access to O-aryloximes.","Organic letters","2007","9","15","2767","2770","10.1021/ol0709578","","","0.71073","MoKα","","0.1019","0.06","","","0.1454","0.1669","","","","","","1.031","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505437","5.1268","0.0003","27.0317","0.0012","7.1313","0.0003","90","","109.3","0.006","90","","932.76","0.09","","","110","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(R)-6-((S)-2,4-Dihydroxy-butyl)-piperidin-2-one","","- C9 H17 N O3 -","- C9 H17 N O3 -","- C36 H68 N4 O12 -","4","1","","Maio, William A.; Sinishtaj, Sandra; Posner, Gary H.","Cyclopentanone ring expansion leading to functionalized delta-lactams: short synthesis of simple sedum alkaloids.","Organic letters","2007","9","14","2673","2676","10.1021/ol070960r","","","0.71073","MoKα","","0.0819","0.0565","","","0.0954","0.1055","","","","","","1.108","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505438","6.16","0.0014","8.885","0.003","9.942","0.003","65.3","0.03","88.44","0.02","77.37","0.03","481.1","0.3","","","110","","","","","","","","","4","P -1","-P 1","2","","(R)-6-((R)-2,4-Dihydroxy-butyl)-piperidin-2-one","","- C9 H17 N O3 -","- C9 H17 N O3 -","- C18 H34 N2 O6 -","2","1","","Maio, William A.; Sinishtaj, Sandra; Posner, Gary H.","Cyclopentanone ring expansion leading to functionalized delta-lactams: short synthesis of simple sedum alkaloids.","Organic letters","2007","9","14","2673","2676","10.1021/ol070960r","","","0.71073","MoKα","","0.0749","0.0393","","","0.0812","0.0899","","","","","","0.896","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505439","23.861","0.004","13.199","0.002","26.839","0.005","90","","115.663","0.002","90","","7619","2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C80 H82 F12 N8 O14 P2 -","- C80 H82 F12 N8 O14 P2 -","- C320 H328 F48 N32 O56 P8 -","4","0.5","","Liu, Yi; Klivansky, Liana M.; Khan, Saeed I.; Zhang, Xiyun","Templated synthesis of desymmetrized [2]catenanes with excellent translational selectivity.","Organic letters","2007","9","13","2577","2580","10.1021/ol070970s","","","0.71073","MoKα","","0.1151","0.0721","","","0.1794","0.2031","","","","","","1.038","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505440","13.711","0.001","38.401","0.003","26.934","0.002","90","","90.402","0.001","90","","14180.8","1.8","179.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C68.5 H76.5 F12 N4 O16.25 P2 -","- C69.54 H69 F12 N4 O16.07 P2 -","- C556.32 H552 F96 N32 O128.56 P16 -","8","2","","Liu, Yi; Klivansky, Liana M.; Khan, Saeed I.; Zhang, Xiyun","Templated synthesis of desymmetrized [2]catenanes with excellent translational selectivity.","Organic letters","2007","9","13","2577","2580","10.1021/ol070970s","","","0.7107","MoKα","","0.1592","0.0871","","0.1041","","0.0938","","","","","","2.902","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505441","9.3832","0.0019","13.585","0.003","15.427","0.003","109.12","0.03","94.12","0.03","106.63","0.03","1750.3","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H24 Cl2 N6 O10 -","- C36 H24 Cl2 N6 O10 -","- C72 H48 Cl4 N12 O20 -","2","1","","Wang, Qi-Qiang; Wang, De-Xian; Zheng, Qi-Yu; Wang, Mei-Xiang","Formation and conformational conversion of flattened partial cone oxygen bridged calix[2]arene[2]triazines.","Organic letters","2007","9","15","2847","2850","10.1021/ol0710008","","","0.71073","MoKα","","0.0894","0.0548","","","0.1422","0.1659","","","","","","1.066","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505442","9.3404","0.0019","27.574","0.006","17.783","0.004","90","","102.76","0.03","90","","4466.9","1.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C50 H38 N6 O10 -","- C50 H38 N6 O10 -","- C200 H152 N24 O40 -","4","0.5","","Wang, Qi-Qiang; Wang, De-Xian; Zheng, Qi-Yu; Wang, Mei-Xiang","Formation and conformational conversion of flattened partial cone oxygen bridged calix[2]arene[2]triazines.","Organic letters","2007","9","15","2847","2850","10.1021/ol0710008","","","0.71073","MoKα","","0.1272","0.0613","","","0.1462","0.1741","","","","","","1.007","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505443","13.358","0.003","13.955","0.003","15.064","0.003","62.93","0.03","81.83","0.03","69.41","0.03","2340.2","1.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C53 H44 N6 O11 -","- C53 H44 N6 O11 -","- C106 H88 N12 O22 -","2","1","","Wang, Qi-Qiang; Wang, De-Xian; Zheng, Qi-Yu; Wang, Mei-Xiang","Formation and conformational conversion of flattened partial cone oxygen bridged calix[2]arene[2]triazines.","Organic letters","2007","9","15","2847","2850","10.1021/ol0710008","","","0.71073","MoKα","","0.3012","0.146","","","0.3475","0.4385","","","","","","1.025","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505444","14.451","0.003","17.782","0.004","19.083","0.004","89.89","0.03","107.15","0.03","90.21","0.03","4685.6","1.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H54 N6 O6 -","- C48 H54 N6 O6 -","- C192 H216 N24 O24 -","4","2","","Wang, Qi-Qiang; Wang, De-Xian; Zheng, Qi-Yu; Wang, Mei-Xiang","Formation and conformational conversion of flattened partial cone oxygen bridged calix[2]arene[2]triazines.","Organic letters","2007","9","15","2847","2850","10.1021/ol0710008","","","0.71073","MoKα","","0.2244","0.1513","","","0.4055","0.4439","","","","","","1.236","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505445","14.89","0.003","17.963","0.004","18.365","0.004","90","","91.79","0.03","90","","4909.7","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C49 H54 Cl2 N6 O6 -","- C49 H54 Cl2 N6 O6 -","- C196 H216 Cl8 N24 O24 -","4","0.5","","Wang, Qi-Qiang; Wang, De-Xian; Zheng, Qi-Yu; Wang, Mei-Xiang","Formation and conformational conversion of flattened partial cone oxygen bridged calix[2]arene[2]triazines.","Organic letters","2007","9","15","2847","2850","10.1021/ol0710008","","","0.71073","MoKα","","0.1722","0.1285","","","0.3186","0.3472","","","","","","1.127","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505446","6.081","0.002","15.034","0.005","12.304","0.004","90","","102.928","0.006","90","","1096.3","0.6","187","2","187","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","CBTA","1,2,3,4-cyclobutane tetracarboxylic acid","","- C8 H12 O10 -","- C8 H12 O10 -","- C32 H48 O40 -","4","1","","Mei, Xuefeng; Liu, Shuanglong; Wolf, Christian","Template-controlled face-to-face stacking of olefinic and aromatic carboxylic acids in the solid state.","Organic letters","2007","9","14","2729","2732","10.1021/ol071039c","","","0.71073","MoKα","","0.0664","0.0432","","","0.1135","0.1228","","","","","","1.046","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505447","15.782","0.002","20.108","0.003","18.301","0.002","90","","112.96","0.002","90","","5347.6","1.2","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4-naphthalenecarboxylic acid and 1,8-dipyridylnaphthalene","1,4-naphthalenecarboxylic acid and 1,8-dipyridylnaphthalene","","- C32 H12 N2 O4 -","- C32 H22 N2 O4 -","- C256 H176 N16 O32 -","8","2","","Mei, Xuefeng; Liu, Shuanglong; Wolf, Christian","Template-controlled face-to-face stacking of olefinic and aromatic carboxylic acids in the solid state.","Organic letters","2007","9","14","2729","2732","10.1021/ol071039c","","","0.71073","MoKα","","0.2617","0.1382","","","0.4037","0.4488","","","","","","1.367","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505448","21.959","0.004","7.0127","0.0012","30.552","0.005","90","","110.878","0.002","90","","4395.9","1.3","163","2","163","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","template and terephthalic acid","1,8-dipyridylnaphthalene and terephthalic acid","","- C28 H18 N2 O4 -","- C26.6 H18.6 N1.65 O4 -","- C212.8 H148.8 N13.2 O32 -","8","1","","Mei, Xuefeng; Liu, Shuanglong; Wolf, Christian","Template-controlled face-to-face stacking of olefinic and aromatic carboxylic acids in the solid state.","Organic letters","2007","9","14","2729","2732","10.1021/ol071039c","","","0.71073","MoKα","","0.2263","0.1263","","","0.3708","0.4079","","","","","","1.295","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505449","11.5485","0.0018","13.991","0.002","13","0.002","90","","110.375","0.003","90","","1969.1","0.5","187","2","187","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","fumaric acid and template","1,8-dipyridyl naphthalene and fumaric acid","","- C24 H18 N2 O4 -","- C24 H18 N2 O4 -","- C96 H72 N8 O16 -","4","1","","Mei, Xuefeng; Liu, Shuanglong; Wolf, Christian","Template-controlled face-to-face stacking of olefinic and aromatic carboxylic acids in the solid state.","Organic letters","2007","9","14","2729","2732","10.1021/ol071039c","","","0.71073","MoKα","","0.1634","0.0512","","","0.1083","0.1311","","","","","","0.895","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505450","31.358","0.003","7.4247","0.0008","21.751","0.002","90","","107.672","0.002","90","","4825.2","0.8","163","2","163","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","2,6-naphthalenedicarboxylic acid and 1,8-dipyridylnaphthalene","2,6-naphthalenedicarboxylic acid and 1,8-dipyridylnaphthalene","","- C64 H44 N4 O8 -","- C64 H44 N4 O8 -","- C256 H176 N16 O32 -","4","0.5","","Mei, Xuefeng; Liu, Shuanglong; Wolf, Christian","Template-controlled face-to-face stacking of olefinic and aromatic carboxylic acids in the solid state.","Organic letters","2007","9","14","2729","2732","10.1021/ol071039c","","","0.71073","MoKα","","0.1214","0.053","","","0.131","0.1446","","","","","","1.022","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505451","17.4562","0.0007","15.5902","0.0004","17.8949","0.0007","90","","90","","90","","4870","0.3","123","2","123","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H17 N O2 -","- C14 H17 N O2 -","- C224 H272 N16 O32 -","16","2","","Murphy, John A.; Mahesh, Mohan; McPheators, Gary; Anand, R. Vijaya; McGuire, Thomas M.; Carling, Robert; Kennedy, Alan R.","Fragmentation of nitrone triflates to 9-membered rings.","Organic letters","2007","9","17","3233","3236","10.1021/ol071049d","","","0.71073","MoKα","","0.1275","0.0592","","","0.1171","0.1427","","","","","","1.018","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505452","11.0647","0.0008","11.1233","0.0008","12.2123","0.0009","70.0811","0.0013","86.9756","0.0014","75.9468","0.0013","1370.09","0.17","100","2","100","2","","","","","","","Lash laboratory","3","P -1","-P 1","2","","6,21-diphenyl-13,14-diethyl-2-azabenziporphyrin","","- C37 H30 N4 -","- C37 H30 N4 -","- C74 H60 N8 -","2","1","","Lash, Timothy D.; Pokharel, Komal; Serling, Jill M.; Yant, Valerie R.; Ferrence, Gregory M.","Aromatic and nonaromatic pyriporphyrins.","Organic letters","2007","9","15","2863","2866","10.1021/ol071052x","","x-ray","0.71073","MoKα","","0.0779","0.054","","","0.1163","0.1281","","","","","","1.019","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505453","9.6636","0.0003","7.7296","0.0002","15.8534","0.0004","90","","102.349","0.001","90","","1156.78","0.06","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-Hydroxy-1-methyl-6-methylene-octahydro-naphthalene-4a-carbonitrile","","- C13 H19 N O -","- C13 H19 N O -","- C52 H76 N4 O4 -","4","1","","Fleming, Fraser F.; Wei, Yunjing; Liu, Wang; Zhang, Zhiyu","Metalated nitriles: cation-controlled cyclizations.","Organic letters","2007","9","14","2733","2736","10.1021/ol071084k","","","0.71073","MoKα","","0.079","0.0645","","","0.1709","0.1875","","","","","","1.013","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505454","8.0156","0.0005","10.2134","0.0006","23.4505","0.0013","90","","95.475","0.003","90","","1911.1","0.2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H30 N2 O2 -","- C20 H30 N2 O2 -","- C80 H120 N8 O8 -","4","1","","Yuan, Weicheng; Du, Haifeng; Zhao, Baoguo; Shi, Yian","A mild Cu(I)-catalyzed regioselective diamination of conjugated dienes.","Organic letters","2007","9","13","2589","2591","10.1021/ol071105a","","","0.71073","MoKα","","0.1188","0.0568","","","0.1112","0.1333","","","","","","1","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505455","6.6652","0.0003","10.356","0.0005","12.7813","0.0006","109.931","0.002","91.021","0.003","104.591","0.003","797.41","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H26 N2 O3 -","- C15 H26 N2 O3 -","- C30 H52 N4 O6 -","2","1","","Yuan, Weicheng; Du, Haifeng; Zhao, Baoguo; Shi, Yian","A mild Cu(I)-catalyzed regioselective diamination of conjugated dienes.","Organic letters","2007","9","13","2589","2591","10.1021/ol071105a","","","0.71073","MoKα","","0.0988","0.0822","","","0.241","0.2495","","","","","","1.122","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505456","15.224","0.003","14.665","0.003","9.2482","0.0017","90","","104.47","0.003","90","","1999.3","0.7","108","2","108","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H29 N O2 -","- C24 H29 N O2 -","- C96 H116 N4 O8 -","4","1","","Bertrand, Myra Beaudoin; Wolfe, John P.","Palladium-catalyzed synthesis of cyclopentane-fused benzocyclobutenes via tandem directed carbopalladation/C-H bond functionalization.","Organic letters","2007","9","16","3073","3075","10.1021/ol071120f","","","0.71073","MoKα","","0.0655","0.0411","","","0.0883","0.0983","","","","","","1.03","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505457","8.1759","0.0001","11.752","0.0002","14.6138","0.0003","101.743","0.001","90.778","0.001","101.284","0.001","1346.09","0.04","296","2","295","2","","","","","","","","4","P -1","-P 1","2","TIPSAntHT","2,6-bis(5'-hexyl-thiophene-2'-yl)-9,10-bis(triisopropylsilylethynyl)anthracene","","- C56 H78 S2 Si2 -","- C56 H78 S2 Si2 -","- C56 H78 S2 Si2 -","1","0.5","","Park, Jong-Hwa; Chung, Dae Sung; Park, Jong-Won; Ahn, Taek; Kong, Hoyoul; Jung, Young Kwan; Lee, Jonghee; Yi, Mi Hye; Park, Chan Eon; Kwon, Soon-Ki; Shim, Hong-Ku","Soluble and easily crystallized anthracene derivatives: precursors of solution-processable semiconducting molecules.","Organic letters","2007","9","13","2573","2576","10.1021/ol071135d","","","0.71073","MoKα","","0.1653","0.0935","","","0.2938","0.3542","","","","","","1.097","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505458","8.4979","0.0001","11.3921","0.0002","12.3339","0.0002","76.88","0.001","81.092","0.001","82.806","0.001","1143.79","0.03","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C52 H62 Si2 -","- C52 H62 Si2 -","- C52 H62 Si2 -","1","0.5","","Park, Jong-Hwa; Chung, Dae Sung; Park, Jong-Won; Ahn, Taek; Kong, Hoyoul; Jung, Young Kwan; Lee, Jonghee; Yi, Mi Hye; Park, Chan Eon; Kwon, Soon-Ki; Shim, Hong-Ku","Soluble and easily crystallized anthracene derivatives: precursors of solution-processable semiconducting molecules.","Organic letters","2007","9","13","2573","2576","10.1021/ol071135d","","","0.71073","MoKα","","0.0768","0.0479","","","0.1242","0.1403","","","","","","1.055","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505459","5.8833","0.0003","21.1342","0.001","30.2541","0.0014","79.193","0.001","89.668","0.001","85.256","0.001","3682.2","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H39 N7 O8 S -","- C41 H39 N7 O8 S -","- C164 H156 N28 O32 S4 -","4","2","","Sivappa, Rasapalli; Hernandez, Nora M.; He, Yong; Lovely, Carl J.","Studies toward the total synthesis of axinellamine and massadine.","Organic letters","2007","9","20","3861","3864","10.1021/ol0711568","","","0.71073","MoKα","","0.0725","0.0471","","","0.0957","0.1037","","","","","","0.99","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505460","10.5085","0.0008","13.2808","0.001","11.0909","0.0009","90","","101.738","0.001","90","","1515.5","0.2","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","07078a","","","- C18 H14 O6 -","- C18 H14 O6 -","- C72 H56 O24 -","4","1","","Sessions, E. Hampton; O'Connor, Jr, Roger T; Jacobi, Peter A.","Furanosteroid studies. Stereoselective synthesis of the A,B,E-ring core of wortmannin.","Organic letters","2007","9","17","3221","3224","10.1021/ol071158s","","","0.71073","MoKα","","0.0475","0.038","","","0.105","0.1099","","","","","","1.12","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505461","6.2943","0.0009","8.9846","0.0013","10.6357","0.0015","97.208","0.003","96.303","0.003","98.602","0.003","584.91","0.15","293","2","293","2","","","","","","","","2","P -1","-P 1","2","","","","- C32 H34 -","- C32 H34 -","- C32 H34 -","1","0.5","","Caraballo-Martínez, Noelia; Heras, María Del Rosario Colorado; Blazquez, Myriam Mba; Barcina, José Osío; Martínez, Antonio García; Salvador, María Del Rosario Torres","Synthesis of homoconjugated oligomers derived from 7,7-diphenylnorbornane.","Organic letters","2007","9","15","2943","2946","10.1021/ol071161b","","","0.71073","MoKα","","0.0911","0.0439","","","0.093","0.1143","","","","","","0.907","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505462","9.083","0.0018","9.104","0.0018","15.642","0.003","90","","102.6","0.03","90","","1262.3","0.5","295","2","295","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C29 H26 Fe N O P S -","- C29 H26 Fe N O P S -","- C58 H52 Fe2 N2 O2 P2 S2 -","2","1","","Cheemala, Murthy N.; Knochel, Paul","New P,N-ferrocenyl ligands for the asymmetric Ir-catalyzed hydrogenation of imines.","Organic letters","2007","9","16","3089","3092","10.1021/ol071168t","","","0.71073","MoKα","","0.0388","0.0363","","","0.0975","0.0998","","","","","","1.099","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505463","8.0414","0.001","11.4829","0.0014","8.497","0.0011","90","","93.684","0.002","90","","782.98","0.17","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H18 O4 -","- C19 H18 O4 -","- C38 H36 O8 -","2","1","","Song, Juan; Shen, Qi; Xu, Fan; Lu, Xiyan","Cationic Pd(II)-catalyzed enantioselective cyclization of aroylmethyl 2-alkynoates initiated by carbopalladation of alkynes with arylboronic acids.","Organic letters","2007","9","15","2947","2950","10.1021/ol0711772","","","0.71073","MoKα","","0.0497","0.0433","","","0.0998","0.1025","","","","","","0.979","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505464","8.2199","0.0006","24.5947","0.0017","8.0807","0.0006","90","","111.629","0.001","90","","1518.62","0.19","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H19 N O5 -","- C17 H19 N O5 -","- C68 H76 N4 O20 -","4","1","","Henry, Christopher E.; Kwon, Ohyun","Phosphine-catalyzed synthesis of highly functionalized coumarins.","Organic letters","2007","9","16","3069","3072","10.1021/ol071181d","","","0.71073","MoKα","","0.0482","0.0387","","","0.0963","0.1013","","","","","","1.067","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1505465","10.4432","0.0014","10.3372","0.0014","13.1172","0.0017","90","","97.524","0.002","90","","1403.9","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 Br N O4 -","- C15 H14 Br N O4 -","- C60 H56 Br4 N4 O16 -","4","1","","Henry, Christopher E.; Kwon, Ohyun","Phosphine-catalyzed synthesis of highly functionalized coumarins.","Organic letters","2007","9","16","3069","3072","10.1021/ol071181d","","","0.71073","MoKα","","0.0515","0.0301","","","0.0697","0.0778","","","","","","1.008","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505466","9.907","0.003","16.144","0.006","17.827","0.006","90","","90","","90","","2851.2","1.7","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C15 H14 Br N O4 -","- C15 H14 Br N O4 -","- C120 H112 Br8 N8 O32 -","8","1","","Henry, Christopher E.; Kwon, Ohyun","Phosphine-catalyzed synthesis of highly functionalized coumarins.","Organic letters","2007","9","16","3069","3072","10.1021/ol071181d","","","0.71073","MoKα","","0.0783","0.034","","","0.0658","0.0784","","","","","","0.993","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505467","7.113","0.007","8.547","0.009","14.99","0.01","78.64","0.08","76.36","0.08","65.54","0.08","801","1.4","200.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C21 H16 N4 -","- C21 H16 N4 -","- C42 H32 N8 -","2","1","","Matsumoto, Kouzou; Kannami, Masaki; Inokuchi, Daisuke; Kurata, Hiroyuki; Kawase, Takeshi; Oda, Masaji","Tetrakis(4-pyridyl)methane: synthesis, properties, and a diamondoid network structure of its silver(I) complex.","Organic letters","2007","9","15","2903","2906","10.1021/ol071189n","","","0.7107","MoKα","","","0.044","","","","0.1222","","","","","","0.903","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505468","13.871","0.006","13.979","0.005","17.52","0.006","90","","90","","90","","3397","2","200.2","","","","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C21 H16 Ag B F4 N4 -","- C21 H16 Ag B F2 N4 -","- C84 H64 Ag4 B4 F8 N16 -","4","1","","Matsumoto, Kouzou; Kannami, Masaki; Inokuchi, Daisuke; Kurata, Hiroyuki; Kawase, Takeshi; Oda, Masaji","Tetrakis(4-pyridyl)methane: synthesis, properties, and a diamondoid network structure of its silver(I) complex.","Organic letters","2007","9","15","2903","2906","10.1021/ol071189n","","","0.7107","MoKα","","","0.1319","","","","0.4005","","","","","","1.08","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505469","13.344","0.004","17.307","0.005","7.109","0.002","90","","100.812","0.004","90","","1612.6","0.8","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H9 Br Cl3 N O3 -","- C16 H9 Br Cl3 N O3 -","- C64 H36 Br4 Cl12 N4 O12 -","4","1","","Markey, Michael D.; Fu, Ying; Kelly, T. Ross","Synthesis of santiagonamine.","Organic letters","2007","9","17","3255","3257","10.1021/ol0711974","","","0.71073","MoKα","","0.0851","0.0461","","","0.1072","0.1229","","","","","","1.009","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505470","10.055","0.002","10.084","0.002","20.606","0.002","90","","90","","90","","2089.3","0.6","294","2","294","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H26 N2 O4 S -","- C23 H26 N2 O4 S -","- C92 H104 N8 O16 S4 -","4","1","","Amat, Mercedes; Santos, Maria M. M.; Gómez, Antonia M; Jokic, Danica; Molins, Elies; Bosch, Joan","Enantioselective spirocyclizations from tryptophanol-derived oxazolopiperidone lactams.","Organic letters","2007","9","15","2907","2910","10.1021/ol0712327","","x-ray","0.71073","MoKα","","0.0584","0.0377","","","0.0898","0.0991","","","","","","1.076","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505471","19.635","0.0016","4.6545","0.0004","14.8606","0.0012","90","","90","","90","","1358.13","0.19","180","2","180","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C18 H10 N2 O3 -","- C18 H10 N2 O3 -","- C72 H40 N8 O12 -","4","1","","Liu, Wei; Buck, Matthew; Chen, Nan; Shang, Muhong; Taylor, Nicholas J.; Asoud, Jalil; Wu, Xing; Hasinoff, Brian B.; Dmitrienko, Gary I.","Total synthesis of isoprekinamycin: structural evidence for enhanced diazonium ion character and growth inhibitory activity toward cancer cells.","Organic letters","2007","9","15","2915","2918","10.1021/ol0712374","","","0.71073","MoKα","","0.0414","0.0344","","","0.0656","0.0673","","","","","","1.044","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505472","4.8053","0.0005","14.6913","0.0016","18.927","0.002","90","","91.02","0.003","90","","1336","0.2","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H10 N2 O4 -","- C18 H10 N2 O4 -","- C72 H40 N8 O16 -","4","1","","Liu, Wei; Buck, Matthew; Chen, Nan; Shang, Muhong; Taylor, Nicholas J.; Asoud, Jalil; Wu, Xing; Hasinoff, Brian B.; Dmitrienko, Gary I.","Total synthesis of isoprekinamycin: structural evidence for enhanced diazonium ion character and growth inhibitory activity toward cancer cells.","Organic letters","2007","9","15","2915","2918","10.1021/ol0712374","","","0.71073","MoKα","","0.0847","0.0598","","","0.0993","0.1051","","","","","","1.186","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505473","13.2576","0.0014","26.161","0.003","13.3645","0.0014","90","","96.638","0.003","90","","4604.2","0.9","143","1","143","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C45 H68 O9 Si -","- C45 H68 O9 Si -","- C180 H272 O36 Si4 -","4","2","","Smith, 3rd, Amos B; Kim, Dae-Shik","The spirastrellolides: construction of the southern C(1)-C(25) fragment exploiting anion relay chemistry.","Organic letters","2007","9","17","3311","3314","10.1021/ol071282b","","","0.71073","MoKα","","0.1066","0.0673","","","0.1486","0.1838","","","","","","1.075","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505474","15.0131","0.0014","24.929","0.002","27.333","0.003","112.829","0.002","99.283","0.002","104.036","0.002","8765.8","1.5","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C144 H190 Li N39 Na2 O48 P6 Zn6 -","- C144 H93 Li N39 Na2 O48 P6 Zn6 -","- C288 H186 Li2 N78 Na4 O96 P12 Zn12 -","2","1","","Lee, Jae Han; Park, Jaejoon; Lah, Myoung Soo; Chin, Jik; Hong, Jong-In","High-affinity pyrophosphate receptor by a synergistic effect between metal coordination and hydrogen bonding in water.","Organic letters","2007","9","19","3729","3731","10.1021/ol071306e","","","0.71073","MoKα","","0.1318","0.0921","","","0.25","0.286","","","","","","1.023","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505475","13.531","0.003","13.512","0.002","14.864","0.003","90","","115.449","0.002","90","","2453.9","0.8","173","1","173","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C48 H60 N12 O4 -","- C48 H60 N12 O4 -","- C96 H120 N24 O8 -","2","1","","Columbus, Ishay; Biali, Silvio E.","The nucleophilic substitution route. A facile method for the fourfold functionalization of the methylene bridges of calix[4]arene.","Organic letters","2007","9","15","2927","2929","10.1021/ol0713178","","","0.71073","MoKα","","0.0881","0.0781","","","0.1806","0.1897","","","","","","1.09","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505476","10.917","0.002","13.554","0.003","38.189","0.007","90","","90","","90","","5650.8","1.9","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C49.5 H61.5 Br4 Cl4.5 O4.5 -","- C49.5 H61.5 Br4 Cl4.5 O4.5 -","- C198 H246 Br16 Cl18 O18 -","4","1","","Columbus, Ishay; Biali, Silvio E.","The nucleophilic substitution route. A facile method for the fourfold functionalization of the methylene bridges of calix[4]arene.","Organic letters","2007","9","15","2927","2929","10.1021/ol0713178","","","0.71073","MoKα","","0.0958","0.0648","","","0.1811","0.1896","","","","","","0.988","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505477","10.613","0.002","25.517","0.006","16.593","0.004","90","","101.414","0.004","90","","4404.7","1.7","173","1","173","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C52 H48 O8 -","- C52 H48 O8 -","- C208 H192 O32 -","4","1","","Columbus, Ishay; Biali, Silvio E.","The nucleophilic substitution route. A facile method for the fourfold functionalization of the methylene bridges of calix[4]arene.","Organic letters","2007","9","15","2927","2929","10.1021/ol0713178","","","0.71073","MoKα","","0.0701","0.0574","","","0.1657","0.175","","","","","","1.069","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505478","18.373","0.004","20.15","0.004","24.444","0.005","90","","96.11","0.03","90","","8998","3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Heptaphyrin","","","- C77 H38 F27 N4 O8 S3 -","- C77 H38 F27 N4 O8 S3 -","- C308 H152 F108 N16 O32 S12 -","4","1","","Gokulnath, Sabapathi; Prabhuraja, Viswanathan; Chandrashekar, Tavarekere K.","One-pot synthesis of oxidized and reduced heptaphyrins with unusual TFA binding.","Organic letters","2007","9","17","3355","3357","10.1021/ol0713180","","","0.71073","MoKα","","0.1397","0.0942","","","0.2419","0.2639","","","","","","1.036","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505479","16.3949","0.0002","16.3949","0.0002","37.937","0.0008","90","","90","","120","","8831","0.2","143","1","143","1","","","","","","","","5","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C68 H52 K3 O8 Yb -","- C68 H52 K3 O8 Yb -","- C408 H312 K18 O48 Yb6 -","6","0.5","","Wooten, Alfred J.; Carroll, Patrick J.; Walsh, Patrick J.","Impact of Na- and K-C pi-interactions on the structure and binding of M3(sol)n(BINOLate)3Ln catalysts.","Organic letters","2007","9","17","3359","3362","10.1021/ol0713234","","","0.71069","MoKα","","0.0382","0.0351","","","0.0935","0.0954","","","","","","1.142","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505480","17.988","0.0006","31.6872","0.001","14.5672","0.0005","90","","90","","90","","8303.1","0.5","143","1","143","1","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C97.5 H73.5 Li3 N7.5 O6 Yb -","- C97.5 H73.5 Li3 N7.5 O6 Yb -","- C390 H294 Li12 N30 O24 Yb4 -","4","1","","Wooten, Alfred J.; Carroll, Patrick J.; Walsh, Patrick J.","Impact of Na- and K-C pi-interactions on the structure and binding of M3(sol)n(BINOLate)3Ln catalysts.","Organic letters","2007","9","17","3359","3362","10.1021/ol0713234","","","0.71069","MoKα","","0.0649","0.0519","","","0.1411","0.1524","","","","","","1.056","","","","has coordinates","215051","2020-10-21","18:00:00",""
"1505481","26.793","0.003","26.793","0.003","55.967","0.005","90","","90","","120","","34794","6","143","1","143","1","","","","","","","","6","P 32","P 32","145","","","","- C538 H402 K18 N34 O38 Yb6 -","- C538 H402 K18 N34 O38 Yb6 -","- C1614 H1206 K54 N102 O114 Yb18 -","3","1","","Wooten, Alfred J.; Carroll, Patrick J.; Walsh, Patrick J.","Impact of Na- and K-C pi-interactions on the structure and binding of M3(sol)n(BINOLate)3Ln catalysts.","Organic letters","2007","9","17","3359","3362","10.1021/ol0713234","","","0.71069","MoKα","","0.0904","0.074","","","0.1861","0.2001","","","","","","1.062","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505482","15.2265","0.001","15.2265","0.001","18.1119","0.0012","90","","90","","120","","3636.6","0.4","143","1","143","1","","","","","","","","5","P 63","P 6c","173","","","","- C84 H84 La Na3 O12 -","- C84 H84 La Na3 O12 -","- C168 H168 La2 Na6 O24 -","2","0.333333","","Wooten, Alfred J.; Carroll, Patrick J.; Walsh, Patrick J.","Impact of Na- and K-C pi-interactions on the structure and binding of M3(sol)n(BINOLate)3Ln catalysts.","Organic letters","2007","9","17","3359","3362","10.1021/ol0713234","","","0.71069","MoKα","","0.032","0.0292","","","0.0745","0.0776","","","","","","1.082","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505483","15.152","0.009","15.152","0.009","18.2","0.02","90","","90","","120","","3619","5","143","1","143","1","","","","","","","","5","P 63","P 6c","173","","","","- C84 H84 Eu Na3 O12 -","- C84 H84 Eu Na3 O12 -","- C168 H168 Eu2 Na6 O24 -","2","0.333333","","Wooten, Alfred J.; Carroll, Patrick J.; Walsh, Patrick J.","Impact of Na- and K-C pi-interactions on the structure and binding of M3(sol)n(BINOLate)3Ln catalysts.","Organic letters","2007","9","17","3359","3362","10.1021/ol0713234","","","0.71069","MoKα","","0.0444","0.0397","","","0.1085","0.111","","","","","","1.143","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505484","5.09253","0.00014","8.33537","0.00037","14.89683","0.00042","90.1645","0.0018","95.5873","0.0017","99.7283","0.0022","620.17","0.04","298","","298","","","","","","","","","5","P -1","-P 1","2","theobromine trifluoroacetic acid","theobromine trifluoroacetic acid","","- C9 H9 F3 N4 O4 -","- C9 H9 F3 N4 O4 -","- C18 H18 F6 N8 O8 -","2","1","","Karki, Shyam; Fábián, László; Friscić, Tomislav; Jones, William","Powder X-ray diffraction as an emerging method to structurally characterize organic solids.","Organic letters","2007","9","16","3133","3136","10.1021/ol071329t","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","0.03122","1.585","","","","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505485","12.44248","0.0006","12.90355","0.00055","7.67255","0.00026","90","","91.2464","0.0023","90","","1231.55","0.09","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","theobromine malonic acid","theobromine malonic acid","","- C10 H12 N4 O6 -","- C10 H12 N4 O6 -","- C40 H48 N16 O24 -","4","1","","Karki, Shyam; Fábián, László; Friscić, Tomislav; Jones, William","Powder X-ray diffraction as an emerging method to structurally characterize organic solids.","Organic letters","2007","9","16","3133","3136","10.1021/ol071329t","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","0.02868","1.57","","","","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505486","11.7543","0.0007","13.8627","0.0009","8.3208","0.0006","90","","90","","90","","1355.84","0.15","200.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H15 N O3 -","- C16 H15 N O3 -","- C64 H60 N4 O12 -","4","1","","Tanaka, Masahiro; Ubukata, Minoru; Matsuo, Takafumi; Yasue, Katsutaka; Matsumoto, Katsuya; Kajimoto, Yasuyuki; Ogo, Takashi; Inaba, Takashi","One-step synthesis of heteroaromatic-fused pyrrolidines via cyclopropane ring-opening reaction: application to the PKCbeta inhibitor JTT-010.","Organic letters","2007","9","17","3331","3334","10.1021/ol071336h","","","1.54178","CuKα","","","0.0327","","","","0.1113","","","","","","1.056","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505487","10.909","0.003","14.832","0.004","22.953","0.006","90","","99.361","0.004","90","","3664.4","1.7","100","2","100","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C67.5 H105 Co F6 N2 O5 Sb Si2 -","- C67.48 H105.96 Co F6 N2 O4.87 Sb Si2 -","- C134.96 H211.92 Co2 F12 N4 O9.74 Sb2 Si4 -","2","1","","Hutson, Gerri E.; Dave, Apurva H.; Rawal, Viresh H.","Highly enantioselective carbonyl-ene reactions catalyzed by a hindered silyl-salen-cobalt complex.","Organic letters","2007","9","20","3869","3872","10.1021/ol071342d","","","0.71073","MoKα","","0.0729","0.0536","","","0.114","0.1197","","","","","","0.947","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505488","16.3003","0.0004","16.3003","0.0004","29.5212","0.001","90","","90","","120","","6792.9","0.3","200","","200","","","","","","","","local","4","R 3 :H","R 3","146","","","","- C16 H20 N O5.5 -","- C16 H16.5 N O5.5 -","- C288 H297 N18 O99 -","18","2","","Banwell, Martin G.; Kokas, Okanya J.; Willis, Anthony C.","Chemoenzymatic approaches to the montanine alkaloids: a total synthesis of (+)-brunsvigine.","Organic letters","2007","9","18","3503","3506","10.1021/ol071344y","","","0.71073","MoKα","","0.0644","0.0535","","0.0478","0.0457","0.0457","","","","","","1.1064","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505489","9.3047","0.0001","33.0047","0.0003","13.9912","0.0001","90","","91.6476","0.0005","90","","4294.9","0.07","200","","200","","","","","","","","local","5","P 1 21 1","P 2yb","4","","","","- C18 H24 Br I O6 -","- C18 H24 Br I O6 -","- C144 H192 Br8 I8 O48 -","8","4","","Banwell, Martin G.; Kokas, Okanya J.; Willis, Anthony C.","Chemoenzymatic approaches to the montanine alkaloids: a total synthesis of (+)-brunsvigine.","Organic letters","2007","9","18","3503","3506","10.1021/ol071344y","","","0.71073","MoKα","","0.046","0.0263","","0.036","0.0288","0.0288","","","","","","1.1209","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505490","9.1808","0.0003","9.4965","0.0002","9.8483","0.0003","75.5622","0.0017","70.7497","0.0013","74.6515","0.0017","769.22","0.04","200","","200","","","","","","","","local","4","P -1","-P 1","2","","","","- C16 H17 Cl O4 -","- C16 H17 Cl O4 -","- C32 H34 Cl2 O8 -","2","1","","Banwell, Martin G.; Kokas, Okanya J.; Willis, Anthony C.","Chemoenzymatic approaches to the montanine alkaloids: a total synthesis of (+)-brunsvigine.","Organic letters","2007","9","18","3503","3506","10.1021/ol071344y","","","0.71073","MoKα","","0.0434","0.0331","","0.0382","0.0359","0.0359","","","","","","1.1172","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505491","6.497","0.003","17.382","0.007","15.516","0.007","90","","97.91","0.03","90","","1735.6","1.3","93.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 B Cl F5 I -","- C15 H18 B Cl F5 I -","- C60 H72 B4 Cl4 F20 I4 -","4","1","","Ochiai, Masahito; Hirobe, Masaya; Yoshimura, Akira; Nishi, Yoshio; Miyamoto, Kazunori; Shiro, Motoo","Internal delivery of soft chlorine and bromine atoms: stereoselective synthesis of (E)-beta-halogenovinyl(aryl)-lambda3-iodanes through domino lambda3-iodanation-1,4-halogen shift-fluorination of alkynes.","Organic letters","2007","9","17","3335","3338","10.1021/ol071345q","","","0.71075","MoKα","","","0.054","","","","0.194","","","","","","0.956","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505492","12.92","0.01","9.946","0.009","13.64","0.01","90","","98.4","0.1","90","","1734","2","123.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 B Cl F5 I -","- C14 H18 B Cl F5 I -","- C56 H72 B4 Cl4 F20 I4 -","4","1","","Ochiai, Masahito; Hirobe, Masaya; Yoshimura, Akira; Nishi, Yoshio; Miyamoto, Kazunori; Shiro, Motoo","Internal delivery of soft chlorine and bromine atoms: stereoselective synthesis of (E)-beta-halogenovinyl(aryl)-lambda3-iodanes through domino lambda3-iodanation-1,4-halogen shift-fluorination of alkynes.","Organic letters","2007","9","17","3335","3338","10.1021/ol071345q","","","0.7107","MoKα","","","0.042","","","","0.111","","","","","","0.987","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505493","6.3772","0.0018","17.736","0.005","14.396","0.004","90","","100.597","0.005","90","","1600.5","0.8","100.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H16 B Cl F5 I -","- C13 H16 B Cl F5 I -","- C52 H64 B4 Cl4 F20 I4 -","4","1","","Ochiai, Masahito; Hirobe, Masaya; Yoshimura, Akira; Nishi, Yoshio; Miyamoto, Kazunori; Shiro, Motoo","Internal delivery of soft chlorine and bromine atoms: stereoselective synthesis of (E)-beta-halogenovinyl(aryl)-lambda3-iodanes through domino lambda3-iodanation-1,4-halogen shift-fluorination of alkynes.","Organic letters","2007","9","17","3335","3338","10.1021/ol071345q","","","0.7107","MoKα","","","0.0356","","","","0.109","","","","","","1.11","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505494","8.0917","0.0008","8.5743","0.0008","19.9195","0.0019","90","","94.195","0.002","90","","1378.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H17 N O4 S -","- C13 H17 N O4 S -","- C52 H68 N4 O16 S4 -","4","1","","Dai, Lun-Zhi; Qi, Ming-Juan; Shi, Yong-Ling; Liu, Xu-Guang; Shi, Min","Gold(I)-catalyzed cascade cyclization reaction: highly regio- and diastereoselective intermolecular addition of water and alcohols to epoxy alkynes.","Organic letters","2007","9","16","3191","3194","10.1021/ol0713640","","","0.71073","MoKα","","0.0651","0.0517","","","0.1265","0.1344","","","","","","1.054","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505495","7.163","0.004","8.579","0.005","15.981","0.009","83.494","0.009","85.812","0.01","84.49","0.009","969.3","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H24 Br N O5 S -","- C16 H24 Br N O5 S -","- C32 H48 Br2 N2 O10 S2 -","2","1","","Dai, Lun-Zhi; Qi, Ming-Juan; Shi, Yong-Ling; Liu, Xu-Guang; Shi, Min","Gold(I)-catalyzed cascade cyclization reaction: highly regio- and diastereoselective intermolecular addition of water and alcohols to epoxy alkynes.","Organic letters","2007","9","16","3191","3194","10.1021/ol0713640","","","0.71073","MoKα","","0.1451","0.0628","","","0.1493","0.1809","","","","","","0.856","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505496","8.7636","0.0015","11.4311","0.0019","22.392","0.004","84.673","0.003","84.832","0.003","83.554","0.003","2212.2","0.7","173","2","173","2","","","","","","","","4","P -1","-P 1","2","Me2 3T O2","","","- C22 H28 O2 S3 -","- C22 H28 O2 S3 -","- C88 H112 O8 S12 -","4","2","","Pappenfus, Ted M.; Melby, Jacob H.; Hansen, Brent B.; Sumption, Devin M.; Hubers, Scott A.; Janzen, Daron E.; Ewbank, Paul C.; McGee, Kari A.; Burand, Michael W.; Mann, Kent R.","Reverse selectivity in m-CPBA oxidation of oligothiophenes to sulfones.","Organic letters","2007","9","19","3721","3724","10.1021/ol071369x","","","0.71073","MoKα","","0.0829","0.0509","","","0.1152","0.125","","","","","","1.04","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505497","8.142","0.0016","10.833","0.002","13.146","0.003","103.28","0.03","103.16","0.03","95.53","0.03","1085.3","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Me2 6T O4","","","- C21.25 H25.5 Cl0.5 O2 S3 -","- C21.25 H25.5 Cl0.5 O2 S3 -","- C42.5 H51 Cl O4 S6 -","2","1","","Pappenfus, Ted M.; Melby, Jacob H.; Hansen, Brent B.; Sumption, Devin M.; Hubers, Scott A.; Janzen, Daron E.; Ewbank, Paul C.; McGee, Kari A.; Burand, Michael W.; Mann, Kent R.","Reverse selectivity in m-CPBA oxidation of oligothiophenes to sulfones.","Organic letters","2007","9","19","3721","3724","10.1021/ol071369x","","","0.71073","MoKα","","0.0594","0.0509","","","0.1403","0.146","","","","","","1.068","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505498","11.6972","0.0016","18.122","0.003","18.781","0.003","111.384","0.002","96.243","0.001","90.948","0.001","3678.3","1","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C177.9 H200.9 O12 -","- C177.9 H200.9 O12 -","- C177.9 H200.9 O12 -","1","0.5","","Nuñez, Jose E; Natarajan, Arunkumar; Khan, Saeed I.; Garcia-Garibay, Miguel A","Synthesis of a triply-bridged molecular gyroscope by a directed meridional cyclization strategy.","Organic letters","2007","9","18","3559","3561","10.1021/ol071379y","","","0.71073","MoKα","","0.0798","0.055","","","0.1336","0.1498","","","","","","1.033","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505499","12.3347","0.001","4.0116","0.0003","13.6384","0.0011","90","","109.384","0.003","90","","636.6","0.09","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H10 S2 -","- C18 H10 S2 -","- C36 H20 S4 -","2","0.5","","Pietrangelo, Agostino; MacLachlan, Mark J.; Wolf, Michael O.; Patrick, Brian O.","Synthesis and structures of novel luminescent bent acenedithiophenes.","Organic letters","2007","9","18","3571","3573","10.1021/ol071387e","","","0.71073","MoKα","","0.0408","0.0355","","","0.0966","0.1013","","","","","","1.125","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505500","9.6096","0.0004","11.4063","0.0005","24.2743","0.0011","90","","90","","90","","2660.7","0.2","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1R,4S,5R,8S)-4,8-bis(dimethylbenzylammonium)-2,6-dioxabicyclo [3.3.0] octane iodide‒water (1/1)","","- C24 H36 I2 N2 O3 -","- C24 H36 I2 N2 O3 -","- C96 H144 I8 N8 O12 -","4","1","","Kumar, Vineet; Olsen, Carl E.; Schäffer, Susan J C; Parmar, Virinder S.; Malhotra, Sanjay V.","Synthesis and applications of novel bis(ammonium) chiral ionic liquids derived from isomannide.","Organic letters","2007","9","20","3905","3908","10.1021/ol071390y","","","0.71073","MoKα","","0.0211","0.0206","","","0.0481","0.0488","","","","","","1.125","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505501","19.778","0.012","8.141","0.005","12.696","0.008","90","","109","0.03","90","","1933","2","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","Iodo-Compound","Myrionine hydroiodide, compound 10","","- C15 H27 I2 N2 O -","- C15 H27 I2 N2 O -","- C60 H108 I8 N8 O4 -","4","1","","Pham, Van Cuong; Jossang, Akino; Chiaroni, Angèle; Sévenet, Thierry; Nguyen, Van Hung; Bodo, Bernard","Solution and crystal conformations of myrionine, a new 8beta-alkyl-cis-decahydroquinoline of Myrioneuron nutans.","Organic letters","2007","9","18","3531","3534","10.1021/ol071393a","","","0.71073","MoKα","","0.0539","0.0406","","","0.0867","0.0934","","","","","","1.03","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505502","7.319","0.004","8.911","0.003","12.178","0.007","90","","93.29","0.02","90","","792.9","0.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Chloro-Compound","Myrionine hydrochloride, compound 9","","- C15 H27 Cl N2 O -","- C15 H27 Cl N2 O -","- C30 H54 Cl2 N4 O2 -","2","1","","Pham, Van Cuong; Jossang, Akino; Chiaroni, Angèle; Sévenet, Thierry; Nguyen, Van Hung; Bodo, Bernard","Solution and crystal conformations of myrionine, a new 8beta-alkyl-cis-decahydroquinoline of Myrioneuron nutans.","Organic letters","2007","9","18","3531","3534","10.1021/ol071393a","","","0.71073","MoKα","","0.0365","0.0348","","","0.0897","0.0912","","","","","","1.102","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505503","10.0439","0.0007","9.8777","0.0007","27.4151","0.0019","90","","90","","90","","2719.9","0.3","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C17 H18 O3 -","- C17 H18 O3 -","- C136 H144 O24 -","8","1","","Lim, Choongmin; Kang, Ji-Eun; Lee, Ji-Eun; Shin, Seunghoon","Gold-catalyzed tandem C-C and C-O bond formation: a highly diastereoselective formation of cyclohex-4-ene-1,2-diol derivatives.","Organic letters","2007","9","18","3539","3542","10.1021/ol071402f","","","0.71073","MoKα","","0.0896","0.0642","","","0.1605","0.1738","","","","","","1.15","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505504","15.833","0.005","23.216","0.007","12.201","0.004","90","","94.278","0.007","90","","4472","2","126","2","126","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C49.9 H54.25 Cl1.65 N3 O6.45 -","- C49.896 H54.24 Cl1.656 N3 O6.448 -","- C199.584 H216.96 Cl6.624 N12 O25.792 -","4","1","","Jiang, Xuan; Vieweger, Mario C.; Bollinger, John C.; Dragnea, Bogdan; Lee, Dongwhan","Reactivity-based fluoride detection: evolving design principles for spring-loaded turn-on fluorescent probes.","Organic letters","2007","9","18","3579","3582","10.1021/ol7014187","","","0.71073","MoKα","","0.1062","0.0553","","","0.1307","0.1645","","","","","","1.044","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505505","11.7079","0.001","15.3735","0.001","11.8425","0.001","90","","90.763","0.01","90","","2131.4","0.3","293","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 N6 O -","- C23 H24 N6 O -","- C92 H96 N24 O4 -","4","1","","Bostai, Beatrix; Novák, Zoltán; Bényei, Attila C; Kotschy, András","Quinoidal tetrazines: formation of a fascinating compound class.","Organic letters","2007","9","17","3437","3439","10.1021/ol701442h","","x-ray","0.71073","MoKα","","","0.0629","","","","0.2407","","","","","","1.18","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505506","35.16","0.003","6.0221","0.0005","11.589","0.001","90","","106.518","0.001","90","","2352.6","0.3","208","2","208","2","","","","","","","","4","C 1 2 1","C 2y","5","KOB07","","","- C26 H29 N O5 -","- C26 H29 N O5 -","- C104 H116 N4 O20 -","4","1","","Gilley, Cynthia B.; Buller, Matthew J.; Kobayashi, Yoshihisa","New entry to convertible isocyanides for the Ugi reaction and its application to the stereocontrolled formal total synthesis of the proteasome inhibitor omuralide.","Organic letters","2007","9","18","3631","3634","10.1021/ol701446y","","","0.71073","MoKα","","0.0485","0.0419","","","0.1105","0.1148","","","","","","1.041","","","","has coordinates","204147","2020-10-21","18:00:00",""
"1505507","8.525","0.0009","12.077","0.0014","25.174","0.003","90","","90","","90","","2591.8","0.5","208","2","208","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","CG-712","","","- C28 H36 N2 O7 -","- C28 H36 N2 O7 -","- C112 H144 N8 O28 -","4","1","","Gilley, Cynthia B.; Buller, Matthew J.; Kobayashi, Yoshihisa","New entry to convertible isocyanides for the Ugi reaction and its application to the stereocontrolled formal total synthesis of the proteasome inhibitor omuralide.","Organic letters","2007","9","18","3631","3634","10.1021/ol701446y","","","0.71073","MoKα","","0.0506","0.0427","","","0.0899","0.0928","","","","","","1.09","","","","has coordinates","204147","2020-10-21","18:00:00",""
"1505508","11.014","0.007","10.562","0.005","11.34","0.02","90","","100.35","0.05","90","","1298","3","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H35 N O6 S2 -","- C24 H35 N O6 S2 -","- C48 H70 N2 O12 S4 -","2","1","","Guaragna, Annalisa; D'Errico, Stefano; D'Alonzo, Daniele; Pedatella, Silvana; Palumbo, Giovanni","A general approach to the synthesis of 1-deoxy-L-iminosugars.","Organic letters","2007","9","17","3473","3476","10.1021/ol7014847","","","0.71069","MoKα","","0.1266","0.0483","","","0.1166","0.1403","","","","","","1.008","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505509","7.1046","0.0002","7.8696","0.0003","10.7309","0.0003","70.758","0.002","82.91","0.002","85.12","0.002","561.49","0.03","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H10 Br O5 P -","- C10 H10 Br O5 P -","- C20 H20 Br2 O10 P2 -","2","1","","Badkar, Pallavi A.; Rath, Nigam P.; Spilling, Christopher D.","Asymmetric synthesis of 2-alkyl-3-phosphonopropanoic acids via P-C bond formation and hydrogenation.","Organic letters","2007","9","18","3619","3622","10.1021/ol701500s","","","0.71073","MoKα","","0.0365","0.0265","","","0.0587","0.0621","","","","","","1.023","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505510","9.5558","0.001","12.2056","0.001","13.2116","0.0011","72.667","0.007","86.351","0.008","72.532","0.007","1402.6","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H20 N2 O S8 -","- C28 H20 N2 O S8 -","- C56 H40 N4 O2 S16 -","2","1","","Dolder, Stefan; Liu, Shi-Xia; Le Derf, Franck; Sallé, Marc; Neels, Antonia; Decurtins, Silvio","An original redox-responsive ligand based on a pi-extended TTF framework.","Organic letters","2007","9","19","3753","3756","10.1021/ol7015127","","","0.71073","MoKα","","0.0453","0.0291","","","0.0637","0.0665","","","","","","0.905","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505511","9.058","0.0016","14.253","0.002","14.978","0.003","108.679","0.013","93.288","0.014","94.969","0.014","1817.5","0.6","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C29.5 H25 Cl3 N2 Ni O2 S8 -","- C29.5 H25 Cl3 N2 Ni O2 S8 -","- C59 H50 Cl6 N4 Ni2 O4 S16 -","2","1","","Dolder, Stefan; Liu, Shi-Xia; Le Derf, Franck; Sallé, Marc; Neels, Antonia; Decurtins, Silvio","An original redox-responsive ligand based on a pi-extended TTF framework.","Organic letters","2007","9","19","3753","3756","10.1021/ol7015127","","","0.71073","MoKα","","0.1166","0.0624","","","0.1614","0.1851","","","","","","0.931","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505512","5.7753","0.0005","14.7522","0.0014","16.0657","0.0015","116.528","0.001","91.539","0.002","94.751","0.002","1217.32","0.19","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C60 H60 N2 O9 -","- C60 H60 N2 O9 -","- C60 H60 N2 O9 -","1","1","","Imai, Yoshitane; Murata, Katuzo; Kawaguchi, Kakuhiro; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio","A solid-state fluorescence sensing system consisting of chiral (1R,2S)-2-amino-1,2-diphenylethanol and fluorescent 2-anthracenecarboxylic acid.","Organic letters","2007","9","17","3457","3460","10.1021/ol701513a","","","0.71073","MoKα","","0.0641","0.0575","","","0.1349","0.1402","","","","","","1.038","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505513","9.839","0.005","9.925","0.005","17.139","0.007","101.693","0.01","91.224","0.017","112.63","0.015","1503.6","1.3","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H34 Br4 N2 O4 -","- C30 H34 Br4 N2 O4 -","- C60 H68 Br8 N4 O8 -","2","1","","Gao, Xike; Qiu, Wenfeng; Yang, Xiaodi; Liu, Yunqi; Wang, Ying; Zhang, Hengjun; Qi, Ting; Liu, Ying; Lu, Kun; Du, Chunyan; Shuai, Zhigang; Yu, Gui; Zhu, Daoben","First synthesis of 2,3,6,7-tetrabromonaphthalene diimide.","Organic letters","2007","9","20","3917","3920","10.1021/ol701539z","","","0.7107","MoKα","","0.11","0.0797","","","0.1854","0.2105","","","","","","0.951","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505514","16.7363","0.0003","16.7363","0.0003","34.0261","0.0011","90","","90","","90","","9530.8","0.4","100","2","100","2","","","","","","","","2","I 41 c d","I 4bw -2c","110","","","","- C38 H24 -","- C38 H24 -","- C608 H384 -","16","1","","Debroy, Paromita; Lindeman, Sergey V.; Rathore, Rajendra","Hexabenzo[4.4.4]propellane: a helical molecular platform for the construction of electroactive materials.","Organic letters","2007","9","21","4091","4094","10.1021/ol7015466","","","1.54178","CuKα","","0.0215","0.021","","","0.0557","0.0559","","","","","","1.055","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505515","13.9425","0.0002","25.564","0.0004","14.1545","0.0002","90","","103.492","0.001","90","","4905.8","0.13","100","2","100","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C62 H72 -","- C62 H72 -","- C248 H288 -","4","1","","Debroy, Paromita; Lindeman, Sergey V.; Rathore, Rajendra","Hexabenzo[4.4.4]propellane: a helical molecular platform for the construction of electroactive materials.","Organic letters","2007","9","21","4091","4094","10.1021/ol7015466","","","1.54178","CuKα","","0.0608","0.0569","","","0.1454","0.1484","","","","","","1.023","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505516","43.6564","0.0009","8.5048","0.0002","20.2741","0.0004","90","","116.617","0.001","90","","6729.8","0.3","100","2","100","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- C46 H40 -","- C46 H40 -","- C368 H320 -","8","1","","Debroy, Paromita; Lindeman, Sergey V.; Rathore, Rajendra","Hexabenzo[4.4.4]propellane: a helical molecular platform for the construction of electroactive materials.","Organic letters","2007","9","21","4091","4094","10.1021/ol7015466","","","1.54178","CuKα","","0.0394","0.0339","","","0.0876","0.0911","","","","","","0.99","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505517","12.0923","0.0003","12.6176","0.0003","13.3467","0.0003","85.524","0.001","73.727","0.001","67.982","0.001","1811.39","0.08","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C44.85 H37.7 Cl1.7 O6 -","- C44.852 H37.704 Cl1.704 O6 -","- C89.704 H75.408 Cl3.408 O12 -","2","1","","Debroy, Paromita; Lindeman, Sergey V.; Rathore, Rajendra","Hexabenzo[4.4.4]propellane: a helical molecular platform for the construction of electroactive materials.","Organic letters","2007","9","21","4091","4094","10.1021/ol7015466","","","1.54178","CuKα","","0.0452","0.0445","","","0.109","0.1096","","","","","","1.01","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505518","30.1511","0.0005","16.3086","0.0003","41.8224","0.0007","90","","90","0.001","90","","20565","0.6","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C82 H68 Cl18 O6 Sb3 -","- C82 H68 Cl18 O6 Sb3 -","- C656 H544 Cl144 O48 Sb24 -","8","1","","Debroy, Paromita; Lindeman, Sergey V.; Rathore, Rajendra","Hexabenzo[4.4.4]propellane: a helical molecular platform for the construction of electroactive materials.","Organic letters","2007","9","21","4091","4094","10.1021/ol7015466","","","1.54178","CuKα","","0.1141","0.1015","","","0.3042","0.3118","","","","","","2.205","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505519","11.0746","0.0003","35.7942","0.0008","16.0263","0.0004","90","","96.306","0.001","90","","6314.5","0.3","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C38 H18 Br6 -","- C38 H18 Br6 -","- C304 H144 Br48 -","8","2","","Debroy, Paromita; Lindeman, Sergey V.; Rathore, Rajendra","Hexabenzo[4.4.4]propellane: a helical molecular platform for the construction of electroactive materials.","Organic letters","2007","9","21","4091","4094","10.1021/ol7015466","","","1.54178","CuKα","","0.1221","0.0735","","","0.18","0.1954","","","","","","0.996","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505520","8.0014","0.0001","8.2641","0.0002","28.8922","0.0006","90","","90","","90","","1910.48","0.07","200","","200","","","","","","","","local","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H19 N O9 -","- C20 H19 N O9 -","- C80 H76 N4 O36 -","4","1","","Matveenko, Maria; Kokas, Okanya J.; Banwell, Martin G.; Willis, Anthony C.","Chemoenzymatic approaches to lycorine-type Amaryllidaceae alkaloids: total syntheses of ent-lycoricidine, 3-epi-ent-lycoricidine, and 4-deoxy-3-epi-ent-lycoricidine.","Organic letters","2007","9","18","3683","3685","10.1021/ol701552r","","","0.71073","MoKα","","0.0428","0.029","","0.0389","0.0339","0.0339","","","","","","1.1637","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505521","5.849","0.0001","16.363","0.0004","20.729","0.0005","90","","90","","90","","1983.91","0.08","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H23 N O2 -","- C24 H23 N O2 -","- C96 H92 N4 O8 -","4","1","","Hong, Young-Taek; Cho, Chang-Woo; Skucas, Eduardas; Krische, Michael J.","Enantioselective reductive coupling of 1,3-enynes to glyoxalates mediated by hydrogen: asymmetric synthesis of beta,gamma-unsaturated alpha-hydroxy esters.","Organic letters","2007","9","19","3745","3748","10.1021/ol7015548","","","0.71073","MoKα","","0.1029","0.0525","","","0.1014","0.1175","","","","","","1.048","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505522","16.2372","0.0013","7.5016","0.0006","10.8942","0.0009","90","","100.061","0.0011","90","","1306.56","0.18","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-chloro-7-methoxy-9b-methyl-2,3,3a,4,5,9b-hexahydro-1H- cyclopenta[a]naphthalen-1-one","","- C15 H17 Cl O2 -","- C15 H17 Cl O2 -","- C60 H68 Cl4 O8 -","4","1","","Grant, Tina N.; West, F. G.","Interrupted nazarov reactions using dichlorocyclopropanes: a novel mode of arene trapping.","Organic letters","2007","9","19","3789","3792","10.1021/ol7015669","","","0.71073","MoKα","","0.0384","0.0352","","","0.0966","0.1002","","","","","","1.037","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505523","15.9739","0.0017","8.89","0.001","18.522","0.002","90","","90","","90","","2630.3","0.5","193","2","193","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C15 H17 Cl O2 -","- C15 H17 Cl O2 -","- C120 H136 Cl8 O16 -","8","1","","Grant, Tina N.; West, F. G.","Interrupted nazarov reactions using dichlorocyclopropanes: a novel mode of arene trapping.","Organic letters","2007","9","19","3789","3792","10.1021/ol7015669","","","0.71073","MoKα","","0.0382","0.0333","","","0.0894","0.0943","","","","","","1.027","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505524","6.7178","0.0005","10.7213","0.0007","10.9182","0.0007","102.072","0.0009","90.4764","0.0009","91.3604","0.001","768.69","0.09","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H17 Cl O2 -","- C19 H17 Cl O2 -","- C38 H34 Cl2 O4 -","2","1","","Grant, Tina N.; West, F. G.","Interrupted nazarov reactions using dichlorocyclopropanes: a novel mode of arene trapping.","Organic letters","2007","9","19","3789","3792","10.1021/ol7015669","","","0.71073","MoKα","","0.0374","0.0344","","","0.0935","0.0961","","","","","","1.096","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505525","12.4189","0.0003","14.1141","0.0004","13.3855","0.0005","90","","108.808","0.001","90","","2220.95","0.12","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 Cl N5 O S -","- C24 H20 Cl N5 O S -","- C96 H80 Cl4 N20 O4 S4 -","4","1","","Guo, Jixi; Liu, Lang; Liu, Guangfei; Jia, Dianzeng; Xie, Xiaolin","Synthesis and solid-state photochromism of 1,3-diphenyl-4- (2-chlorobenzal)-5-hydroxypyrazole 4-methylthiosemicarbazone.","Organic letters","2007","9","20","3989","3992","10.1021/ol7016005","","","0.71073","MoKα","","0.0419","0.0387","","","0.1003","0.1022","","","","","","1.038","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505526","16.0128","0.0008","6.0024","0.0003","18.8175","0.0011","90","","104.291","0.002","90","","1752.68","0.16","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H15 Cl N2 O2 -","- C22 H15 Cl N2 O2 -","- C88 H60 Cl4 N8 O8 -","4","1","","Guo, Jixi; Liu, Lang; Liu, Guangfei; Jia, Dianzeng; Xie, Xiaolin","Synthesis and solid-state photochromism of 1,3-diphenyl-4- (2-chlorobenzal)-5-hydroxypyrazole 4-methylthiosemicarbazone.","Organic letters","2007","9","20","3989","3992","10.1021/ol7016005","","","0.71073","MoKα","","0.0824","0.0649","","","0.1741","0.1867","","","","","","1.078","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505527","18.2817","0.0003","18.2817","0.0003","5.1851","0.0002","90","","90","","120","","1500.79","0.07","90","2","90","2","","","","","","","","5","P 32","P 32","145","4-SF5-pyrazole","","","- C3 H3 F5 N2 S -","- C3 H3 F5 N2 S -","- C27 H27 F45 N18 S9 -","9","3","","Ye, Chengfeng; Gard, Gary L.; Winter, Rolf W.; Syvret, Robert G.; Twamley, Brendan; Shreeve, Jean'ne M.","Synthesis of pentafluorosulfanylpyrazole and pentafluorosulfanyl-1,2,3-triazole and their derivatives as energetic materials by click chemistry.","Organic letters","2007","9","19","3841","3844","10.1021/ol701602a","","x-ray","0.71073","MoKα","","0.0529","0.0482","","","0.1056","0.108","","","","","","1.096","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505528","10.5484","0.0005","6.0792","0.0003","10.0794","0.0005","90","","113.311","0.001","90","","593.59","0.05","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2,3-dihydro-1H-[1,2,3]triazole-4-SF5","","","- C2 H2 F5 N3 S -","- C2 H2 F5 N3 S -","- C8 H8 F20 N12 S4 -","4","1","","Ye, Chengfeng; Gard, Gary L.; Winter, Rolf W.; Syvret, Robert G.; Twamley, Brendan; Shreeve, Jean'ne M.","Synthesis of pentafluorosulfanylpyrazole and pentafluorosulfanyl-1,2,3-triazole and their derivatives as energetic materials by click chemistry.","Organic letters","2007","9","19","3841","3844","10.1021/ol701602a","","x-ray","0.71073","MoKα","","0.0273","0.0269","","","0.0742","0.0758","","","","","","1.074","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505529","19.365","0.004","11.66","0.002","15.931","0.003","90","","124.003","0.003","90","","2982.1","1","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 O2 -","- C20 H16 O2 -","- C160 H128 O16 -","8","1","","Taylor, Mark S.; Swager, Timothy M.","Triptycenediols by rhodium-catalyzed [2+2+2] cycloaddition.","Organic letters","2007","9","18","3695","3697","10.1021/ol701642j","","","0.71073","MoKα","","0.0651","0.0484","","","0.1217","0.1335","","","","","","1.026","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505530","6.1272","0.0008","11.9338","0.0016","10.1958","0.0013","90","","92.659","0.002","90","","744.72","0.17","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C17 H20 O4 -","- C17 H20 O4 -","- C34 H40 O8 -","2","1","","Cao, Chun-Li; Sun, Xiu-Li; Kang, Yan-Biao; Tang, Yong","Enantioselective formal [3+3] annulation for the direct construction of bicyclic skeletons with four stereogenic centers.","Organic letters","2007","9","21","4151","4154","10.1021/ol701669b","","","0.71073","MoKα","","0.0461","0.0443","","","0.1145","0.116","","","","","","1.036","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505531","7.0918","0.0013","10.3796","0.0019","11.126","0.002","90","","98.132","0.003","90","","810.8","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H19 Br O4 -","- C17 H19 Br O4 -","- C34 H38 Br2 O8 -","2","1","","Cao, Chun-Li; Sun, Xiu-Li; Kang, Yan-Biao; Tang, Yong","Enantioselective formal [3+3] annulation for the direct construction of bicyclic skeletons with four stereogenic centers.","Organic letters","2007","9","21","4151","4154","10.1021/ol701669b","","","0.71073","MoKα","","0.0784","0.0476","","","0.1352","0.1619","","","","","","1.055","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505532","6.6196","0.001","20.669","0.003","11.6156","0.0017","90","","100.003","0.002","90","","1565.1","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H20 O5 -","- C17 H20 O5 -","- C68 H80 O20 -","4","1","","Cao, Chun-Li; Sun, Xiu-Li; Kang, Yan-Biao; Tang, Yong","Enantioselective formal [3+3] annulation for the direct construction of bicyclic skeletons with four stereogenic centers.","Organic letters","2007","9","21","4151","4154","10.1021/ol701669b","","","0.71073","MoKα","","0.0799","0.0494","","","0.1037","0.1117","","","","","","0.878","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505533","5.826","0.0001","10.946","0.0003","28.979","0.0007","90","","90","","90","","1848.03","0.07","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H32 O5 S -","- C16 H32 O5 S -","- C64 H128 O20 S4 -","4","1","","Colobert, Françoise; Choppin, Sabine; Ferreiro-Mederos, Leticia; Obringer, Michel; Arratta, Sandra Luengo; Urbano, Antonio; Carreño, M Carmen","Polysubstituted oxygen heterocycles by a Reformatsky-type reaction/reductive cyclization approach from enantiopure beta-ketosulfoxides.","Organic letters","2007","9","22","4451","4454","10.1021/ol701670g","","","0.71073","MoKα","","0.0508","0.0399","","","0.0767","0.0808","","","","","","1.052","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505534","9.8046","0.0008","14.0001","0.0012","26.276","0.002","90","","90","","90","","3606.8","0.5","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","07026","","","- C38 H47 N O10 S -","- C38 H47 N O10 S -","- C152 H188 N4 O40 S4 -","4","1","","Oppenheimer, Jossian; Hsung, Richard P.; Figueroa, Ruth; Johnson, Whitney L.","Stereochemical control of both C-C and C-N axial chirality in the synthesis of chiral N,O-biaryls.","Organic letters","2007","9","20","3969","3972","10.1021/ol701692m","","","0.71073","MoKα","","0.0531","0.0442","","","0.1204","0.1306","","","","","","1.017","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505535","11.6601","0.001","10.7203","0.0009","21.3025","0.0018","90","","92.575","0.002","90","","2660.1","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","07035","","","- C29 H35 N O7 -","- C29 H35 N O7 -","- C116 H140 N4 O28 -","4","1","","Oppenheimer, Jossian; Hsung, Richard P.; Figueroa, Ruth; Johnson, Whitney L.","Stereochemical control of both C-C and C-N axial chirality in the synthesis of chiral N,O-biaryls.","Organic letters","2007","9","20","3969","3972","10.1021/ol701692m","","","0.71073","MoKα","","0.0546","0.0418","","","0.1164","0.1297","","","","","","1.017","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505536","6.8783","0.0012","10.2073","0.0018","12.061","0.002","74.717","0.003","80.936","0.004","82.909","0.003","803.7","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H17 Cl O3 -","- C20.07 H16 Cl O3 -","- C40.14 H32 Cl2 O6 -","2","1","","Shi, Min; Tang, Xiang-Ying; Yang, Yong-Hua","Lewis acid mediated reactions of 1-cyclopropyl-2-arylethanones with allenic esters: a facile synthetic protocol for the preparation of dihydrofuro[2,3-h]chromen-2-one derivatives.","Organic letters","2007","9","20","4017","4020","10.1021/ol701713y","","","0.71073","MoKα","","0.1176","0.0855","","","0.2556","0.2846","","","","","","1.007","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505537","7.1088","0.001","8.1024","0.0011","22.341","0.003","90","","90","","90","","1286.8","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H16 O3 -","- C16 H16 O3 -","- C64 H64 O12 -","4","1","","Shi, Min; Tang, Xiang-Ying; Yang, Yong-Hua","Lewis acid mediated reactions of 1-cyclopropyl-2-arylethanones with allenic esters: a facile synthetic protocol for the preparation of dihydrofuro[2,3-h]chromen-2-one derivatives.","Organic letters","2007","9","20","4017","4020","10.1021/ol701713y","","","0.71073","MoKα","","0.0526","0.0399","","","0.0852","0.0886","","","","","","0.918","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505538","7.545","0.0008","12.3334","0.0013","15.3243","0.0016","77.685","0.002","80.438","0.002","74.498","0.002","1333.5","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H12 Cl2 O2 -","- C15 H12 Cl2 O2 -","- C60 H48 Cl8 O8 -","4","2","","Shi, Min; Tang, Xiang-Ying; Yang, Yong-Hua","Lewis acid mediated reactions of 1-cyclopropyl-2-arylethanones with allenic esters: a facile synthetic protocol for the preparation of dihydrofuro[2,3-h]chromen-2-one derivatives.","Organic letters","2007","9","20","4017","4020","10.1021/ol701713y","","","0.71073","MoKα","","0.0705","0.0513","","","0.127","0.136","","","","","","0.946","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505539","12.568","0.007","16.286","0.009","24.219","0.014","90","","99.468","0.006","90","","4890","5","113","2","113","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C52 H72 Br N O4 -","- C52 H72 Br N O4 -","- C208 H288 Br4 N4 O16 -","4","2","","Xu, Zhen-Xiang; Zhang, Chun; Zheng, Qi-Yu; Chen, Chuan-Feng; Huang, Zhi-Tang","A new approach to enantiopure inherently chiral calix[4]arenes: determination of their absolute configurations.","Organic letters","2007","9","22","4447","4450","10.1021/ol701714q","","","0.7107","MoKα","","0.0911","0.0677","","","0.1293","0.1411","","","","","","1.083","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505540","13.7323","0.0006","13.6624","0.0006","32.8806","0.0017","90","","96.449","0.002","90","","6129.9","0.5","113","2","113","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C64.5 H95 N3 O7.5 -","- C64.5 H95 N3 O7.5 -","- C258 H380 N12 O30 -","4","2","","Xu, Zhen-Xiang; Zhang, Chun; Zheng, Qi-Yu; Chen, Chuan-Feng; Huang, Zhi-Tang","A new approach to enantiopure inherently chiral calix[4]arenes: determination of their absolute configurations.","Organic letters","2007","9","22","4447","4450","10.1021/ol701714q","","","0.7107","MoKα","","0.066","0.0597","","","0.1527","0.1578","","","","","","1.072","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505541","18.3891","0.0003","9.4372","0.0001","18.776","0.0003","90","","90","","90","","3258.42","0.08","100","2","100","2","","","","","","","synthesis as described","4","P n a 21","P 2c -2n","33","","","","- C17 H21 N O5 -","- C17 H21 N O5 -","- C136 H168 N8 O40 -","8","2","","Isambert, Nicolas; Cruz, Montse; Arévalo, María José; Gómez, Elena; Lavilla, Rodolfo","Enol esters: versatile substrates for Mannich-type multicomponent reactions.","Organic letters","2007","9","21","4199","4202","10.1021/ol701717z","","x-ray","0.7107","MoKα","","0.0412","0.036","","","0.087","0.0896","","","","","","1.036","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505542","9.5653","0.0014","18.264","0.002","11.4924","0.0016","90","","101.294","0.002","90","","1968.9","0.5","243","2","243","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C17 H22 Br N3 O3 S -","- C17 H22 Br N3 O3 S -","- C68 H88 Br4 N12 O12 S4 -","4","2","","Perl, Nicholas R.; Leighton, James L.","Enantioselective imidazole-directed allylation of aldimines and ketimines.","Organic letters","2007","9","18","3699","3701","10.1021/ol701723w","","","0.71073","MoKα","","0.0861","0.0404","","","0.0984","0.1182","","","","","","1.021","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505543","7.6121","0.0018","11.628","0.004","12.241","0.004","98.942","0.011","106.273","0.012","96.624","0.011","1012.9","0.5","103.15","","103","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H23 F6 N O4 P -","- C18 H23 F6 N O4 P -","- C36 H46 F12 N2 O8 P2 -","2","1","","Tanabe, Kana; Yasuda, Takuma; Yoshio, Masafumi; Kato, Takashi","Viologen-based redox-active ionic liquid crystals forming columnar phases.","Organic letters","2007","9","21","4271","4274","10.1021/ol701741e","","","0.7107","MoKα","","0.0367","0.0302","","","0.0792","0.0826","","","","","","1.002","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505544","7.1777","0.0003","10.2206","0.0005","18.6229","0.0009","90","","90","","90","","1366.18","0.11","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","00135M","","","- C14 H16 Br N O3 -","- C14 H16 Br N O3 -","- C56 H64 Br4 N4 O12 -","4","1","","Ko, Changhong; Hsung, Richard P.; Al-Rashid, Ziyad F; Feltenberger, John B.; Lu, Ting; Yang, Jin-Haek; Wei, Yonggang; Zificsak, Craig A.","A stereoselective intramolecular halo-etherification of chiral enamides in the synthesis of halogenated cyclic ethers.","Organic letters","2007","9","22","4459","4462","10.1021/ol701768n","","","0.71073","MoKα","","0.0272","0.0248","","","0.0566","0.0578","","","","","","1.012","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505545","20.682","0.004","5.9165","0.001","11.67","0.002","90","","115.333","0.002","90","","1290.7","0.4","173","2","173","2","","","","","","","","5","C 1 2 1","C 2y","5","07112a","","","- C13 H14 Br N O3 -","- C13 H14 Br N O3 -","- C52 H56 Br4 N4 O12 -","4","1","","Ko, Changhong; Hsung, Richard P.; Al-Rashid, Ziyad F; Feltenberger, John B.; Lu, Ting; Yang, Jin-Haek; Wei, Yonggang; Zificsak, Craig A.","A stereoselective intramolecular halo-etherification of chiral enamides in the synthesis of halogenated cyclic ethers.","Organic letters","2007","9","22","4459","4462","10.1021/ol701768n","","","0.71073","MoKα","","0.0455","0.0352","","","0.0791","0.083","","","","","","0.977","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505546","12.706","0.003","20.186","0.004","19.259","0.004","90","","105.74","0.03","90","","4754.4","1.9","113","2","113","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C47.33 H51.97 F7.2 N2.2 O9.19 P1.2 -","- C47.436 H51.058 F7.2 N2.2 O9.206 P1.2 -","- C189.744 H204.232 F28.8 N8.8 O36.824 P4.8 -","4","1","","Han, Tao; Chen, Chuan-Feng","Formation of ternary complexes between a macrotricyclic host and hetero-guest pairs: an acid-base controlled selective complexation process.","Organic letters","2007","9","21","4207","4210","10.1021/ol701770h","","","0.71073","MoKα","","0.142","0.1278","","","0.3852","0.3975","","","","","","1.626","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505547","9.6754","0.0014","20.321","0.005","13.4329","0.0019","90","","103.72","0.012","90","","2565.7","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H31 Cl N4 O3 S -","- C26 H31 Cl N4 O3 S -","- C104 H124 Cl4 N16 O12 S4 -","4","1","","Ryabukhin, Sergey V.; Plaskon, Andrey S.; Ostapchuk, Eugeniy N.; Volochnyuk, Dmitriy M.; Shishkin, Oleg V.; Shivanyuk, Alexander N.; Tolmachev, Andrey A.","A one-step fusion of 1,3-thiazine and pyrimidine cycles.","Organic letters","2007","9","21","4215","4218","10.1021/ol701782v","","","0.71073","MoKα","","0.0734","0.0472","","","0.1279","0.1376","","","","","","0.969","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505548","16.405","0.006","8.826","0.002","16.6428","0.0009","90","","99.179","0.012","90","","2378.9","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H23 N3 O3 S -","- C26 H23 N3 O3 S -","- C104 H92 N12 O12 S4 -","4","1","","Ryabukhin, Sergey V.; Plaskon, Andrey S.; Ostapchuk, Eugeniy N.; Volochnyuk, Dmitriy M.; Shishkin, Oleg V.; Shivanyuk, Alexander N.; Tolmachev, Andrey A.","A one-step fusion of 1,3-thiazine and pyrimidine cycles.","Organic letters","2007","9","21","4215","4218","10.1021/ol701782v","","","0.71073","MoKα","","0.1021","0.0573","","","0.1541","0.1847","","","","","","0.995","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505549","11.5379","0.0013","10.6801","0.0012","13.8158","0.0015","90","","100.801","0.005","90","","1672.3","0.3","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C35 H54 O6 -","- C35 H54 O6 -","- C70 H108 O12 -","2","1","","Korapala, Chandra Sekhar; Qin, Jun; Friestad, Gregory K.","Quinine synthesis studies: a radical-ionic annulation via Mn-mediated addition to chiral N-acylhydrazones.","Organic letters","2007","9","21","4243","4246","10.1021/ol7017938","","","0.71073","MoKα","","0.0464","0.0432","","","0.1107","0.1137","","","","","","1.078","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505550","18.774","0.004","14.394","0.003","6.8848","0.0014","90","","99.94","0.03","90","","1832.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 N2 O4 -","- C22 H16 N2 O4 -","- C88 H64 N8 O16 -","4","1","","Li, Yuanzhen; Zou, Haixia; Gong, Jianxian; Xiang, Jing; Luo, Tuoping; Quan, Junmin; Wang, Guoxin; Yang, Zhen","Efficient synthesis of maleimides and carbazoles via Zn(OTf)(2)-catalyzed tandem annulations of isonitriles and allenic esters.","Organic letters","2007","9","20","4057","4060","10.1021/ol7018086","","","0.71073","MoKα","","0.1045","0.0562","","","0.1349","0.1479","","","","","","1.08","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505551","19.368","0.004","14.472","0.003","7.2337","0.0014","90","","100.02","0.03","90","","1996.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H20 N2 O4 -","- C23 H20 N2 O4 -","- C92 H80 N8 O16 -","4","1","","Li, Yuanzhen; Zou, Haixia; Gong, Jianxian; Xiang, Jing; Luo, Tuoping; Quan, Junmin; Wang, Guoxin; Yang, Zhen","Efficient synthesis of maleimides and carbazoles via Zn(OTf)(2)-catalyzed tandem annulations of isonitriles and allenic esters.","Organic letters","2007","9","20","4057","4060","10.1021/ol7018086","","","0.71073","MoKα","","0.1378","0.0441","","","0.0668","0.0728","","","","","","1.003","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505552","10.858","0.008","3.941","0.003","15.241","0.015","90","","103.6","0.03","90","","633.9","0.9","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2a","BBBT","","- C18 H10 S2 -","- C18 H10 S2 -","- C36 H20 S4 -","2","0.5","","Ebata, Hideaki; Miyazaki, Eigo; Yamamoto, Tatsuya; Takimiya, Kazuo","Synthesis, properties, and structures of benzo[1,2-b:4,5-b']bis[b]benzothiophene and benzo[1,2-b:4,5-b']bis[b]benzoselenophene.","Organic letters","2007","9","22","4499","4502","10.1021/ol701815j","","","0.71069","MoKα","","0.0781","0.0666","","","0.1946","0.2198","","","","","","0.95","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505553","14.646","0.002","8.669","0.001","10.955","0.001","90","","103.934","0.009","90","","1350","0.3","298.2","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C18 H10 Se2 -","- C18 H10 Se2 -","- C72 H40 Se8 -","4","1","","Ebata, Hideaki; Miyazaki, Eigo; Yamamoto, Tatsuya; Takimiya, Kazuo","Synthesis, properties, and structures of benzo[1,2-b:4,5-b']bis[b]benzothiophene and benzo[1,2-b:4,5-b']bis[b]benzoselenophene.","Organic letters","2007","9","22","4499","4502","10.1021/ol701815j","","","0.7107","MoKα","","","0.0314","","","","0.1197","","","","","","0.79","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505554","11.8531","0.0004","15.0607","0.0006","12.8521","0.0006","90","","109.452","0.002","90","","2163.35","0.15","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 N2 O5 S -","- C24 H24 N2 O5 S -","- C96 H96 N8 O20 S4 -","4","1","","Sunderhaus, James D.; Dockendorff, Chris; Martin, Stephen F.","Applications of multicomponent reactions for the synthesis of diverse heterocyclic scaffolds.","Organic letters","2007","9","21","4223","4226","10.1021/ol7018357","","","0.71073","MoKα","","0.0566","0.039","","","0.0911","0.1005","","","","","","0.993","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505555","7.9092","0.0002","11.1819","0.0003","18.8422","0.0005","90","","93.523","0.001","90","","1663.25","0.08","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H20 Br Cl N2 O2 -","- C15 H20 Br Cl N2 O2 -","- C60 H80 Br4 Cl4 N8 O8 -","4","1","","Sunderhaus, James D.; Dockendorff, Chris; Martin, Stephen F.","Applications of multicomponent reactions for the synthesis of diverse heterocyclic scaffolds.","Organic letters","2007","9","21","4223","4226","10.1021/ol7018357","","","0.71073","MoKα","","0.1009","0.0471","","","0.1064","0.1287","","","","","","0.998","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505556","14.5524","0.0002","16.6177","0.0003","16.8513","0.0003","90","","90","","90","","4075.11","0.12","153","2","153","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H29 I N O2 -","- C21 H29 I N O2 -","- C168 H232 I8 N8 O16 -","8","1","","Sunderhaus, James D.; Dockendorff, Chris; Martin, Stephen F.","Applications of multicomponent reactions for the synthesis of diverse heterocyclic scaffolds.","Organic letters","2007","9","21","4223","4226","10.1021/ol7018357","","","0.71073","MoKα","","0.0478","0.0314","","","0.0754","0.0829","","","","","","1.028","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505557","21.8166","0.0015","9.6838","0.0007","13.0549","0.0009","90","","100.884","0.001","90","","2708.5","0.3","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H13 N O4 -","- C17 H13 N O4 -","- C136 H104 N8 O32 -","8","1","","Song, Jinhua; Mishima, Masaaki; Rappoport, Zvi","Isomeric solid enols on ring- and amide-carbonyls of substituted 2-carbanilido-1,3-indandiones.","Organic letters","2007","9","21","4307","4310","10.1021/ol7018554","","","0.71073","MoKα","","0.0593","0.0559","","","0.1247","0.1266","","","","","","1.181","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505558","3.832","0.0005","32.309","0.004","11.8364","0.0016","90","","93.452","0.002","90","","1462.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 N O5 -","- C18 H15 N O5 -","- C72 H60 N4 O20 -","4","1","","Song, Jinhua; Mishima, Masaaki; Rappoport, Zvi","Isomeric solid enols on ring- and amide-carbonyls of substituted 2-carbanilido-1,3-indandiones.","Organic letters","2007","9","21","4307","4310","10.1021/ol7018554","","","0.71073","MoKα","","0.0691","0.0572","","","0.1195","0.1257","","","","","","1.191","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505559","54.515","0.005","3.8897","0.0004","26.331","0.003","90","","103.117","0.002","90","","5437.7","1","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H13 N O4 -","- C17 H13 N O4 -","- C272 H208 N16 O64 -","16","2","","Song, Jinhua; Mishima, Masaaki; Rappoport, Zvi","Isomeric solid enols on ring- and amide-carbonyls of substituted 2-carbanilido-1,3-indandiones.","Organic letters","2007","9","21","4307","4310","10.1021/ol7018554","","","0.71073","MoKα","","0.1261","0.0928","","","0.1509","0.1638","","","","","","1.273","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505560","15.0309","0.0004","15.0309","0.0004","37.985","0.002","90","","90","","90","","8581.9","0.6","173","2","173","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C46 H54 N2 O7 S2 -","- C46 H54 N2 O7 S2 -","- C368 H432 N16 O56 S16 -","8","1","","Harmata, Michael; Chen, Yugang; Barnes, Charles L.","Benzothiazines in organic synthesis. Stereoselectivity in the intermolecular Michael addition reactions of benzothiazines.","Organic letters","2007","9","23","4701","4704","10.1021/ol701863y","","","0.71073","MoKα","","0.1551","0.0926","","","0.1473","0.1657","","","","","","1.072","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505561","12.5267","0.001","12.6609","0.001","21.3678","0.0017","90","","90","","90","","3388.9","0.5","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C36 H45 N O5 S -","- C36 H45 N O5 S -","- C144 H180 N4 O20 S4 -","4","1","","Harmata, Michael; Chen, Yugang; Barnes, Charles L.","Benzothiazines in organic synthesis. Stereoselectivity in the intermolecular Michael addition reactions of benzothiazines.","Organic letters","2007","9","23","4701","4704","10.1021/ol701863y","","","0.71073","MoKα","","0.0387","0.0332","","","0.0782","0.081","","","","","","1.03","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505562","12.2363","0.0004","6.9249","0.0002","21.8636","0.0007","90","","91.375","0.001","90","","1852.08","0.1","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C40 H53 N O5 S -","- C40 H53 N O5 S -","- C80 H106 N2 O10 S2 -","2","1","","Harmata, Michael; Chen, Yugang; Barnes, Charles L.","Benzothiazines in organic synthesis. Stereoselectivity in the intermolecular Michael addition reactions of benzothiazines.","Organic letters","2007","9","23","4701","4704","10.1021/ol701863y","","","0.71073","MoKα","","0.0352","0.0321","","","0.0807","0.0831","","","","","","1.029","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505563","14.267","0.003","7.619","0.0016","34.013","0.007","90","","91.388","0.004","90","","3696.1","1.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H32 N2 O4 S -","- C25 H32 N2 O4 S -","- C150 H192 N12 O24 S6 -","6","3","","Harmata, Michael; Chen, Yugang; Barnes, Charles L.","Benzothiazines in organic synthesis. Stereoselectivity in the intermolecular Michael addition reactions of benzothiazines.","Organic letters","2007","9","23","4701","4704","10.1021/ol701863y","","","0.71073","MoKα","","0.0886","0.0663","","","0.1541","0.1658","","","","","","1.06","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505564","9.8222","0.0017","12.934","0.002","14.118","0.003","113.965","0.002","93.434","0.003","109.602","0.003","1503.3","0.5","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H30 Br2 N2 O2 S -","- C33 H30 Br2 N2 O2 S -","- C66 H60 Br4 N4 O4 S2 -","2","1","","Wei, Jingqiang; Shaw, Jared T.","Diastereoselective synthesis of gamma-lactams by a one-pot, four-component reaction.","Organic letters","2007","9","20","4077","4080","10.1021/ol701911u","","","0.71073","MoKα","","0.0937","0.0693","","","0.1453","0.1562","","","","","","1.089","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505565","13.69","0.002","5.8634","0.0008","20.31","0.003","90","","103.935","0.003","90","","1582.3","0.4","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 N O3 -","- C19 H19 N O3 -","- C76 H76 N4 O12 -","4","1","","Wei, Jingqiang; Shaw, Jared T.","Diastereoselective synthesis of gamma-lactams by a one-pot, four-component reaction.","Organic letters","2007","9","20","4077","4080","10.1021/ol701911u","","","0.71073","MoKα","","0.0619","0.039","","","0.0927","0.1047","","","","","","1.021","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505566","9.786","0.001","10.0112","0.0011","10.4204","0.0011","90","","107.503","0.002","90","","973.62","0.18","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H24 N2 O8 -","- C18 H24 N2 O8 -","- C36 H48 N4 O16 -","2","1","","Namiki, Hidenori; Chamberland, Stephen; Gubler, Daniel A.; Williams, Robert M.","Synthetic and biosynthetic studies on FR900482 and mitomycin C: an efficient and stereoselective hydroxymethylation of an advanced benzazocane intermediate.","Organic letters","2007","9","26","5341","5344","10.1021/ol701960v","","","0.71073","MoKα","","0.0374","0.0368","","","0.103","0.104","","","","","","1.041","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505567","6.215","0.006","7.015","0.006","26.6","0.02","90","","90.404","0.012","90","","1159.7","1.7","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 O3 -","- C13 H14 O3 -","- C52 H56 O12 -","4","1","","Shen, Quansheng; Huang, Wen; Wang, Jialiang; Zhou, Xigeng","SmCl3-catalyzed C-acylation of 1,3-dicarbonyl compounds and malononitrile.","Organic letters","2007","9","22","4491","4494","10.1021/ol701961z","","","0.71073","MoKα","","0.1186","0.1028","","","0.3046","0.314","","","","","","1.171","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505568","8.2834","0.0007","8.7572","0.0008","11.1751","0.0011","68.344","0.003","78.448","0.004","87.094","0.004","737.92","0.12","193","2","193","2","","","","","","","","5","P -1","-P 1","2","FROCJ01","","","- C13 H23 Br N O4 -","- C13 H23 Br N O4 -","- C26 H46 Br2 N2 O8 -","2","1","","Jiang, Chao; Frontier, Alison J.","Stereoselective synthesis of pyrrolidine derivatives via reduction of substituted pyrroles.","Organic letters","2007","9","24","4939","4942","10.1021/ol701962w","","","0.71073","MoKα","","0.0333","0.0297","","","0.0875","0.0893","","","","","","1.072","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505569","6.3792","0.0005","9.5181","0.0009","22.6948","0.0019","90","","90","","90","","1378","0.2","150","2","150","2","","","","","","","Ralph Lumby, reaction RJL2/6MAD","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H21 N O3 -","- C14 H21 N O3 -","- C56 H84 N4 O12 -","4","1","","Lumby, Ralph J. R.; Joensuu, Pekka M.; Lam, Hon Wai","Diastereoselective intermolecular cobalt-catalyzed reductive aldol reactions of alpha,beta-unsaturated amides with ketones.","Organic letters","2007","9","21","4367","4370","10.1021/ol701980e","","","0.71073","MoKα","","0.0551","0.0345","","","0.0637","0.0683","","","","","","0.949","","","","has coordinates","211332","2020-10-21","18:00:00",""
"1505570","11.7337","0.0002","17.5364","0.0004","26.0481","0.0005","90","","91.162","0.001","90","","5358.73","0.18","150","","150","","","","","","","","Ralph Lamby, RJL2/56MAD","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H23 N O3 -","- C12 H23 N O3 -","- C192 H368 N16 O48 -","16","4","","Lumby, Ralph J. R.; Joensuu, Pekka M.; Lam, Hon Wai","Diastereoselective intermolecular cobalt-catalyzed reductive aldol reactions of alpha,beta-unsaturated amides with ketones.","Organic letters","2007","9","21","4367","4370","10.1021/ol701980e","","","0.71073","MoKα","","0.069","0.0317","","0.1123","0.08","0.1123","","","","","","0.9462","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505571","6.0237","0.0001","10.011","0.0002","22.8384","0.0005","90","","92.22","0.001","90","","1376.2","0.05","150","2","150","2","","","","","","","Ralph Lumby","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H25 N O3 -","- C13 H25 N O3 -","- C52 H100 N4 O12 -","4","1","","Lumby, Ralph J. R.; Joensuu, Pekka M.; Lam, Hon Wai","Diastereoselective intermolecular cobalt-catalyzed reductive aldol reactions of alpha,beta-unsaturated amides with ketones.","Organic letters","2007","9","21","4367","4370","10.1021/ol701980e","","","0.71073","MoKα","","0.0758","0.0509","","","0.1206","0.1317","","","","","","1.033","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505572","10.085","0.001","16.279","0.002","13.421","0.002","90","","101.56","0.01","90","","2158.7","0.5","287","2","287","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 N2 O7 -","- C24 H20 N2 O7 -","- C96 H80 N8 O28 -","4","1","","Guo, Xin; Huang, Haoxi; Yang, Liping; Hu, Wenhao","Trapping of oxonium ylide with isatins: efficient and stereoselective construction of adjacent quaternary carbon centers.","Organic letters","2007","9","23","4721","4723","10.1021/ol7019857","","","0.71073","MoKα","","0.0605","0.0397","","","0.0997","0.1048","","","","","","1.004","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505573","8.7609","0.0004","10.2902","0.0005","18.3852","0.0008","101.069","0.002","100.895","0.002","92.606","0.003","1591.54","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","DPM","","","- C44 H36 Fe N2 -","- C44.39 H35.745 Fe N1.805 -","- C88.78 H71.49 Fe2 N3.61 -","2","1","","Ramakrishnan, S.; Srinivasan, Alagar","ansa-Metallocene-based cyclic[2]pyrroles.","Organic letters","2007","9","23","4769","4772","10.1021/ol702021k","","","0.71073","MoKα","","0.1563","0.0908","","","0.2375","0.2562","","","","","","1.048","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505574","17.8893","0.0014","10.0632","0.0007","19.1662","0.0015","90","","92.893","0.004","90","","3446","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Fe-calix","","","- C47 H40 Fe N2 -","- C47 H40 Fe N2 -","- C188 H160 Fe4 N8 -","4","1","","Ramakrishnan, S.; Srinivasan, Alagar","ansa-Metallocene-based cyclic[2]pyrroles.","Organic letters","2007","9","23","4769","4772","10.1021/ol702021k","","","0.71073","MoKα","","0.083","0.0722","","","0.1851","0.1932","","","","","","1.183","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505575","17.9925","0.0012","10.1572","0.0006","19.0746","0.0013","90","","90.827","0.002","90","","3485.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ru-calix","","","- C47 H40 N2 Ru -","- C47 H40 N2 Ru -","- C188 H160 N8 Ru4 -","4","1","","Ramakrishnan, S.; Srinivasan, Alagar","ansa-Metallocene-based cyclic[2]pyrroles.","Organic letters","2007","9","23","4769","4772","10.1021/ol702021k","","","0.71073","MoKα","","0.1264","0.1084","","","0.2581","0.2717","","","","","","1.315","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505576","34.7389","0.0005","34.7389","0.0005","14.3489","0.0002","90","","90","","90","","17316.1","0.4","295","2","295","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C80 H104 Cl2 N2 Na2 O26 -","- C80 H104 Cl2 N2 Na2 O26 -","- C640 H832 Cl16 N16 Na16 O208 -","8","0.5","","Hsueh, Sheng-Yao; Lai, Chien-Chen; Liu, Yi-Hung; Wang, Yu; Peng, Shie-Ming; Chiu, Sheng-Hsien","Protecting a squaraine near-IR dye through its incorporation in a slippage-derived [2]rotaxane.","Organic letters","2007","9","22","4523","4526","10.1021/ol702050w","","","0.71073","MoKα","","0.1578","0.0838","","","0.2386","0.2796","","","","","","1.291","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505577","18.691","0.005","20.136","0.006","18.096","0.005","90","","115.595","0.005","90","","6142","3","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","lithium-1,2-bis(diphenylphosphoryl)benzene 1:2 complex","","","- C60 H48 Li O11 P4 -","- C60 H48 Li O11 P4 -","- C240 H192 Li4 O44 P16 -","4","1","","Hatano, Manabu; Takagi, Eri; Ishihara, Kazuaki","Sodium phenoxide-phosphine oxides as extremely active Lewis base catalysts for the Mukaiyama aldol reaction with ketones.","Organic letters","2007","9","22","4527","4530","10.1021/ol702052r","","","0.71073","MoKα","","0.2656","0.1262","","","0.3283","0.3725","","","","","","1.584","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505578","11.1746","0.0003","11.3015","0.0003","14.1456","0.0005","90","","90","","90","","1786.44","0.09","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H25 Br N2 O2 S -","- C16 H25 Br N2 O2 S -","- C64 H100 Br4 N8 O8 S4 -","4","1","","Zhao, Baoguo; Yuan, Weicheng; Du, Haifeng; Shi, Yian","Cu(I)-catalyzed intermolecular diamination of activated terminal olefins.","Organic letters","2007","9","24","4943","4945","10.1021/ol702061s","","","0.71073","MoKα","","0.1145","0.0642","","","0.1294","0.1525","","","","","","0.951","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505579","12.3183","0.0007","12.3183","0.0007","29.975","0.002","90","","90","","120","","3939","0.4","153","2","153","2","","","","","","","synthesis as described","4","P 32 2 1","P 32 2""","154","","","","- C23 H22 N4 O15 -","- C23 H22 N4 O15 -","- C138 H132 N24 O90 -","6","1","","König, Christian M; Harms, Klaus; Koert, Ulrich","Stereoselective synthesis of methyl 7-dihydro-trioxacarcinoside B.","Organic letters","2007","9","23","4777","4779","10.1021/ol702078t","","x-ray","0.71073","MoKα","","0.0851","0.0379","","","0.0507","0.0595","","","","","","0.874","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505580","23.563","0.001","8.728","0.001","19.397","0.001","90","","90.48","0.01","90","","3989","0.5","295","2","295","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C80 H134 N4 O13 -","- C80 H134 N4 O13 -","- C160 H268 N8 O26 -","2","0.5","","Zhang, Yu-Mei; Tan, Ning-Hua; Lu, Yang; Chang, Ying; Jia, Rui-Rui","Chamobtusin A, a novel skeleton diterpenoid alkaloid from Chamaecyparis obtusa cv. tetragon.","Organic letters","2007","9","22","4579","4581","10.1021/ol702087h","","","0.71073","MoKα","","0.0612","0.0543","","","0.1449","0.1523","","","","","","1.053","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505581","5.1439","0.0005","12.3424","0.0012","15.4385","0.0015","90","","90","","90","","980.16","0.17","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H12 Cl N O -","- C10 H12 Cl N O -","- C40 H48 Cl4 N4 O4 -","4","1","","Rawal, Girish K.; Kumar, Amit; Tawar, Urmila; Vankar, Yashwant D.","New method for chloroamidation of olefins. Application in the synthesis of N-glycopeptides and anticancer agents.","Organic letters","2007","9","25","5171","5174","10.1021/ol702097q","","","0.71073","MoKα","","0.0496","0.0448","","","0.0994","0.102","","","","","","1.084","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505582","10.4278","0.0014","8.5518","0.0012","19.106","0.003","90","","90","","90","","1703.8","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C7 H12 Cl N O2 -","- C7 H12 Cl N O2 -","- C56 H96 Cl8 N8 O16 -","8","1","","Rawal, Girish K.; Kumar, Amit; Tawar, Urmila; Vankar, Yashwant D.","New method for chloroamidation of olefins. Application in the synthesis of N-glycopeptides and anticancer agents.","Organic letters","2007","9","25","5171","5174","10.1021/ol702097q","","","0.71073","MoKα","","0.0755","0.0557","","","0.1176","0.1254","","","","","","1.081","","","","has coordinates","287986","2023-12-04","13:33:14",""
"1505583","9.3175","0.0008","16.5043","0.0013","12.3112","0.001","90","","109.498","0.002","90","","1784.6","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H20 Cl N O8 -","- C14 H20 Cl N O8 -","- C56 H80 Cl4 N4 O32 -","4","2","","Rawal, Girish K.; Kumar, Amit; Tawar, Urmila; Vankar, Yashwant D.","New method for chloroamidation of olefins. Application in the synthesis of N-glycopeptides and anticancer agents.","Organic letters","2007","9","25","5171","5174","10.1021/ol702097q","","","0.71073","MoKα","","0.0723","0.0602","","","0.1207","0.1278","","","","","","0.997","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505584","8.1991","0.0007","8.786","0.0008","23.326","0.002","90","","90","","90","","1680.3","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H20 Cl N O8 -","- C14 H20 Cl N O8 -","- C56 H80 Cl4 N4 O32 -","4","1","","Rawal, Girish K.; Kumar, Amit; Tawar, Urmila; Vankar, Yashwant D.","New method for chloroamidation of olefins. Application in the synthesis of N-glycopeptides and anticancer agents.","Organic letters","2007","9","25","5171","5174","10.1021/ol702097q","","","0.71073","MoKα","","0.0527","0.0468","","","0.0992","0.102","","","","","","1.098","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505585","8.3733","0.0008","9.3073","0.0009","22.912","0.0002","90","","90","","90","","1785.6","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H20 Cl N O8 -","- C14 H20 Cl N O8 -","- C56 H80 Cl4 N4 O32 -","4","1","","Rawal, Girish K.; Kumar, Amit; Tawar, Urmila; Vankar, Yashwant D.","New method for chloroamidation of olefins. Application in the synthesis of N-glycopeptides and anticancer agents.","Organic letters","2007","9","25","5171","5174","10.1021/ol702097q","","","0.71073","MoKα","","0.0711","0.0559","","","0.1099","0.1157","","","","","","1.063","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505586","12.532","0.003","21.325","0.004","19.032","0.004","90","","109.06","0.03","90","","4807","2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H30 Cl N O4 -","- C27 H30 Cl N O4 -","- C216 H240 Cl8 N8 O32 -","8","4","","Rawal, Girish K.; Kumar, Amit; Tawar, Urmila; Vankar, Yashwant D.","New method for chloroamidation of olefins. Application in the synthesis of N-glycopeptides and anticancer agents.","Organic letters","2007","9","25","5171","5174","10.1021/ol702097q","","","0.71073","MoKα","","0.1359","0.1181","","","0.2518","0.2598","","","","","","1.165","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505587","13.4998","0.0002","14.643","0.0002","16.4422","0.0003","90","","90","","90","","3250.25","0.09","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C35 H49 N O5 -","- C35 H49 N O5 -","- C140 H196 N4 O20 -","4","1","","Pettersson, Martin; Knueppel, Daniel; Martin, Stephen F.","Concise, stereoselective approach to the spirooxindole ring system of citrinadin A.","Organic letters","2007","9","22","4623","4626","10.1021/ol702132v","","","0.71073","MoKα","","0.0667","0.0487","","","0.1127","0.123","","","","","","1.015","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505588","17.558","0.003","5.4049","0.0009","20.711","0.003","90","","92.475","0.003","90","","1963.6","0.5","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H31 N O3 -","- C19 H31 N O3 -","- C76 H124 N4 O12 -","4","2","","Howard, Brett E.; Woerpel, K. A.","Synthesis of tertiary alpha-hydroxy acids by silylene transfer to alpha-keto esters.","Organic letters","2007","9","22","4651","4653","10.1021/ol702148x","","","0.71073","MoKα","","0.0945","0.0597","","","0.1453","0.1698","","","","","","1.05","","","","has coordinates","211332","2020-10-21","18:00:00",""
"1505589","24.272","0.003","9.5983","0.001","17.1748","0.0018","90","","90","","90","","4001.2","0.8","100","2","100","2","","","","","","","Synthesized by the authors. See text","6","P n c 2","P 2 -2bc","30","","","","- C22 H23 B2 Cu F8 N5 -","- C22 H23 B2 Cu F8 N5 -","- C132 H138 B12 Cu6 F48 N30 -","6","1.5","","Lebel, Hélène; Lectard, Sylvain; Parmentier, Michaël","Copper-catalyzed alkene aziridination with N-tosyloxycarbamates.","Organic letters","2007","9","23","4797","4800","10.1021/ol702152e","","","1.54178","CuKα","","0.0516","0.0495","","","0.1361","0.1381","","","","","","1.034","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505590","15.13","0.002","14.1193","0.0013","20.129","0.003","90","","98.892","0.013","90","","4248.4","0.9","183","2","183","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H50 F12 N6 O12 S4 -","- C24 H44 F12 N6 O12 S4 -","- C96 H176 F48 N24 O48 S16 -","4","1","","Medina-Molner, Alfredo; Blacque, Olivier; Spingler, Bernhard","The synthesis of 1,2-bis(1,5,9-triazacyclododecyl)ethane: a showcase for the importance of the linker length within bis(alkylating) reagents.","Organic letters","2007","9","23","4829","4831","10.1021/ol7021627","","","1.54186","CuKα","","0.2178","0.1283","","","0.3067","0.3789","","","","","","1.028","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505591","15.4218","0.0008","12.2877","0.0004","23.2598","0.0011","90","","108.149","0.006","90","","4188.4","0.4","183","2","183","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H23 F6 N3 O6 S2 -","- C14 H23 F6 N3 O6 S2 -","- C112 H184 F48 N24 O48 S16 -","8","2","","Medina-Molner, Alfredo; Blacque, Olivier; Spingler, Bernhard","The synthesis of 1,2-bis(1,5,9-triazacyclododecyl)ethane: a showcase for the importance of the linker length within bis(alkylating) reagents.","Organic letters","2007","9","23","4829","4831","10.1021/ol7021627","","","0.71073","MoKα","","0.0794","0.0612","","","0.1792","0.1917","","","","","","1.089","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505592","10.9082","0.0019","15.094","0.003","15.126","0.003","67.366","0.014","86.69","0.015","70.747","0.014","2163.3","0.8","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H52 F12 N6 O13 S4 -","- C26 H51 F12 N6 O13 S4 -","- C52 H102 F24 N12 O26 S8 -","2","1","","Medina-Molner, Alfredo; Blacque, Olivier; Spingler, Bernhard","The synthesis of 1,2-bis(1,5,9-triazacyclododecyl)ethane: a showcase for the importance of the linker length within bis(alkylating) reagents.","Organic letters","2007","9","23","4829","4831","10.1021/ol7021627","","","1.54186","CuKα","","0.1358","0.092","","","0.2617","0.2896","","","","","","1.032","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505593","5.4217","0.0009","19.233","0.003","10.91","0.0019","90","","96.859","0.003","90","","1129.5","0.3","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H15 N O2 S -","- C11 H15 N O2 S -","- C44 H60 N4 O8 S4 -","4","1","","Liang, Fushun; Li, Dazhi; Zhang, Lei; Gao, Jingjie; Liu, Qun","Efficient one-pot synthesis of polyfunctionalized thiophenes via an amine-mediated ring opening of EWG-activated 2-methylene-1,3-dithioles.","Organic letters","2007","9","23","4845","4848","10.1021/ol7021752","","","0.71073","MoKα","","0.1007","0.0848","","","0.2536","0.2741","","","","","","1.063","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505594","7.7587","0.0005","11.5886","0.0007","13.9186","0.0009","106.539","0.003","97.759","0.003","98.19","0.003","1166.94","0.13","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H23 Br N2 O4 -","- C28 H23 Br N2 O4 -","- C56 H46 Br2 N4 O8 -","2","1","","Su, Shun; Porco, Jr, John A","1,2-dihydroisoquinolines as templates for cascade reactions to access isoquinoline alkaloid frameworks.","Organic letters","2007","9","24","4983","4986","10.1021/ol702176h","","","0.71073","MoKα","","0.0594","0.0341","","","0.0753","0.0806","","","","","","1.055","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505595","10.4646","0.0003","7.4563","0.0002","13.8704","0.0004","90","","101.473","0.002","90","","1060.64","0.05","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H25 N O4 -","- C25 H25 N O4 -","- C50 H50 N2 O8 -","2","1","","Su, Shun; Porco, Jr, John A","1,2-dihydroisoquinolines as templates for cascade reactions to access isoquinoline alkaloid frameworks.","Organic letters","2007","9","24","4983","4986","10.1021/ol702176h","","","0.71073","MoKα","","0.0585","0.0398","","","0.104","0.1131","","","","","","1.02","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505596","8.4962","0.0016","9.3365","0.0018","23.868","0.004","90","","90","","90","","1893.3","0.6","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H18 Br N O6 -","- C22 H18 Br N O6 -","- C88 H72 Br4 N4 O24 -","4","1","","Su, Shun; Porco, Jr, John A","1,2-dihydroisoquinolines as templates for cascade reactions to access isoquinoline alkaloid frameworks.","Organic letters","2007","9","24","4983","4986","10.1021/ol702176h","","","0.71073","MoKα","","0.1035","0.0465","","","0.0831","0.0897","","","","","","0.828","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505597","15.5984","0.0003","13.5175","0.0003","6.6823","0.0001","90","","91.9718","0.0014","90","","1408.14","0.05","200","","200","","","","","","","","local","5","C 1 c 1","C -2yc","9","","","","- C15 H17 Cl2 N O -","- C15 H17 Cl2 N O -","- C60 H68 Cl8 N4 O4 -","4","1","","Bissember, Alex C.; Phillis, Andrew T.; Banwell, Martin G.; Willis, Anthony C.","Base-promoted reactions of dichlorocarbene adducts of cyclic enamines: a new route to annulated pyrroles.","Organic letters","2007","9","26","5421","5424","10.1021/ol7021774","","","0.71073","MoKα","","0.0209","0.0197","","0.0241","0.023","0.023","","","","","","1.0814","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505598","11.1383","0.0002","20.8602","0.0003","12.2758","0.0002","90","","90.0844","0.001","90","","2852.24","0.08","200","","200","","","","","","","","local","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 Cl2 N O -","- C15 H17 Cl2 N O -","- C120 H136 Cl16 N8 O8 -","8","2","","Bissember, Alex C.; Phillis, Andrew T.; Banwell, Martin G.; Willis, Anthony C.","Base-promoted reactions of dichlorocarbene adducts of cyclic enamines: a new route to annulated pyrroles.","Organic letters","2007","9","26","5421","5424","10.1021/ol7021774","","","0.71073","MoKα","","0.0486","0.0258","","0.0434","0.0308","0.0308","","","","","","1.0862","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505599","8.0935","0.0003","8.065","0.0003","35.0669","0.0015","90","","90","","90","","2288.96","0.16","200","","200","","","","","","","","local","4","P b c a","-P 2ac 2ab","61","","","","- C15 H15 N O -","- C15 H15 N O -","- C120 H120 N8 O8 -","8","1","","Bissember, Alex C.; Phillis, Andrew T.; Banwell, Martin G.; Willis, Anthony C.","Base-promoted reactions of dichlorocarbene adducts of cyclic enamines: a new route to annulated pyrroles.","Organic letters","2007","9","26","5421","5424","10.1021/ol7021774","","","0.71073","MoKα","","0.0558","0.0321","","0.0474","0.0407","0.0407","","","","","","1.1185","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505600","12.499","0.0002","7.7906","0.0001","13.1409","0.0002","90","","95.0722","0.0011","90","","1274.58","0.03","200","","200","","","","","","","","local","3","P 1 21/a 1","-P 2yab","14","","","","- C15 H18 O2 -","- C15 H18 O2 -","- C60 H72 O8 -","4","1","","Bissember, Alex C.; Phillis, Andrew T.; Banwell, Martin G.; Willis, Anthony C.","Base-promoted reactions of dichlorocarbene adducts of cyclic enamines: a new route to annulated pyrroles.","Organic letters","2007","9","26","5421","5424","10.1021/ol7021774","","","0.71073","MoKα","","0.0562","0.0341","","0.054","0.0417","0.0417","","","","","","1.1294","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505601","8.8875","0.0002","19.4706","0.0003","9.093","0.0001","90","","92.3248","0.0011","90","","1572.2","0.05","200","","200","","","","","","","","local","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 Cl N O2 -","- C19 H16 Cl N O2 -","- C76 H64 Cl4 N4 O8 -","4","1","","Bissember, Alex C.; Phillis, Andrew T.; Banwell, Martin G.; Willis, Anthony C.","Base-promoted reactions of dichlorocarbene adducts of cyclic enamines: a new route to annulated pyrroles.","Organic letters","2007","9","26","5421","5424","10.1021/ol7021774","","","0.71073","MoKα","","0.0389","0.0273","","0.0401","0.0323","0.0323","","","","","","1.1255","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505602","9.7467","0.0005","16.6619","0.0009","12.1852","0.0007","90","","100.679","0.003","90","","1944.59","0.18","200","","200","","","","","","","","local","4","P 1 21/a 1","-P 2yab","14","","","","- C27 H21 N O2 -","- C27 H21 N O2 -","- C108 H84 N4 O8 -","4","1","","Bissember, Alex C.; Phillis, Andrew T.; Banwell, Martin G.; Willis, Anthony C.","Base-promoted reactions of dichlorocarbene adducts of cyclic enamines: a new route to annulated pyrroles.","Organic letters","2007","9","26","5421","5424","10.1021/ol7021774","","","0.71073","MoKα","","0.0851","0.0623","","0.0549","0.0518","0.0518","","","","","","1.1188","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505603","10.448","0.0002","12.9271","0.0003","22.4611","0.0005","97.74","0.001","90.629","0.001","109.354","0.001","2831.12","0.11","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H54 Cl2 N8 O17 Zn2 -","- C51 H54 Cl2 N8 O17 Zn2 -","- C102 H108 Cl4 N16 O34 Zn4 -","2","1","","Wang, Huan-Huan; Gan, Quan; Wang, Xiao-Jun; Xue, Lin; Liu, Sheng-Hua; Jiang, Hua","A water-soluble, small molecular fluorescent sensor with femtomolar sensitivity for zinc ion.","Organic letters","2007","9","24","4995","4998","10.1021/ol702192m","","","0.71073","MoKα","","0.1051","0.0615","","","0.1696","0.1964","","","","","","1.033","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505604","8.7696","0.0005","11.2545","0.0006","12.6605","0.0007","111.203","0.004","93.678","0.004","93.657","0.004","1157.48","0.12","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H26 N4 O3 -","- C26 H26 N4 O3 -","- C52 H52 N8 O6 -","2","1","","Wang, Huan-Huan; Gan, Quan; Wang, Xiao-Jun; Xue, Lin; Liu, Sheng-Hua; Jiang, Hua","A water-soluble, small molecular fluorescent sensor with femtomolar sensitivity for zinc ion.","Organic letters","2007","9","24","4995","4998","10.1021/ol702192m","","","0.71073","MoKα","","0.1119","0.0559","","","0.1022","0.1191","","","","","","1.042","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505605","9.5921","0.0001","9.5921","0.0001","55.2591","0.0014","90","","90","","90","","5084.3","0.15","123","2","123","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","06222","","","- C27 H36 O5 Si -","- C27 H36 O5 Si -","- C216 H288 O40 Si8 -","8","1","","Figueroa, Ruth; Hsung, Richard P.; Guevarra, Christle C.","An enantioselective total synthesis of (+)-aigialospirol.","Organic letters","2007","9","23","4857","4859","10.1021/ol702195w","","","0.71073","MoKα","","0.0418","0.04","","","0.0951","0.096","","","","","","1.033","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505606","26.3354","0.0007","8.4373","0.0002","17.027","0.0004","90","","110.475","0.0016","90","","3544.37","0.16","200","","200","","","","","","","","?","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H19 Cl2 N2 O4 -","- C17 H19 Cl2 N2 O4 -","- C136 H152 Cl16 N16 O32 -","8","1","","Bradford, Tanya A.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S.","Cross-coupling for cross-conjugation: practical synthesis and Diels-Alder reactions of [3]dendralenes.","Organic letters","2007","9","23","4861","4864","10.1021/ol7021998","","","0.71073","MoKα","","0.0544","0.048","","0.0654","0.0605","0.0605","","","","","","1.0811","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505607","10.381","0.0002","17.5494","0.0004","11.4583","0.0002","90","","108.5","0.0011","90","","1979.61","0.07","200","","200","","","","","","","","local","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 N2 O5 -","- C23 H24 N2 O5 -","- C92 H96 N8 O20 -","4","1","","Bradford, Tanya A.; Payne, Alan D.; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S.","Cross-coupling for cross-conjugation: practical synthesis and Diels-Alder reactions of [3]dendralenes.","Organic letters","2007","9","23","4861","4864","10.1021/ol7021998","","","0.71073","MoKα","","0.059","0.0342","","0.054","0.0411","0.0411","","","","","","1.1404","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505608","11.521","0.0006","13.0999","0.0007","13.39","0.0007","64.202","0.001","65.368","0.001","82.898","0.001","1649.77","0.15","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H23 Cl2 N9 O8 Zn -","- C28 H31 Cl2 N9 O8 Zn -","- C56 H62 Cl4 N18 O16 Zn2 -","2","1","","Huang, Sha; Clark, Ronald J.; Zhu, Lei","Highly sensitive fluorescent probes for zinc ion based on triazolyl-containing tetradentate coordination motifs.","Organic letters","2007","9","24","4999","5002","10.1021/ol702208y","","","0.71073","MoKα","","0.0561","0.0526","","","0.1273","0.1292","","","","","","1.155","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505609","12.4808","0.0005","13.1112","0.0006","17.6147","0.0008","90","","97.676","0.001","90","","2856.6","0.2","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H25 Cl2 N7 O9.25 Zn -","- C24 H25 Cl2 N7 O9.175 Zn -","- C96 H100 Cl8 N28 O36.7 Zn4 -","4","1","","Huang, Sha; Clark, Ronald J.; Zhu, Lei","Highly sensitive fluorescent probes for zinc ion based on triazolyl-containing tetradentate coordination motifs.","Organic letters","2007","9","24","4999","5002","10.1021/ol702208y","","","0.71073","MoKα","","0.0439","0.0408","","","0.1","0.1017","","","","","","1.11","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505610","8.894","0.002","8.121","0.0018","13.609","0.003","90","","100.875","0.004","90","","965.3","0.4","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 Si2 -","- C22 H22 Si2 -","- C44 H44 Si4 -","2","0.5","","Li, Liangchun; Xiang, Junfeng; Xu, Caihong","Synthesis of novel ladder bis-silicon-bridged p-terphenyls.","Organic letters","2007","9","23","4877","4879","10.1021/ol702215m","","","0.71073","MoKα","","0.0442","0.0359","","","0.1004","0.1107","","","","","","1.106","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505611","8.7417","0.0001","9.6098","0.0001","10.645","0.0005","84.719","0.01","79.763","0.01","63.414","0.007","786.88","0.07","113","2","113","2","","","","","","","","3","P -1","-P 1","2","","","","- C42 H30 Si2 -","- C42 H30 Si2 -","- C42 H30 Si2 -","1","0.5","","Li, Liangchun; Xiang, Junfeng; Xu, Caihong","Synthesis of novel ladder bis-silicon-bridged p-terphenyls.","Organic letters","2007","9","23","4877","4879","10.1021/ol702215m","","","0.7107","MoKα","","0.048","0.0385","","","0.0956","0.1004","","","","","","1.09","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505612","27.301","0.008","9.969","0.003","18.683","0.005","90","","104.455","0.004","90","","4924","2","100","0.1","100","0.1","","","","","","","synthesis as described","4","C 1 2 1","C 2y","5","","(S)-MPA thioester of 1-thio-beta-D-glucose tetraacetate","","- C23 H28 O11 S -","- C23 H28 O11 S -","- C184 H224 O88 S8 -","8","2","","Porto, Silvia; Seco, José Manuel; Ortiz, Aurelio; Quiñoá, Emilio; Riguera, Ricardo","Chiral thiols: the assignment of their absolute configuration by 1H NMR.","Organic letters","2007","9","24","5015","5018","10.1021/ol7022196","","x-ray","0.71073","MoKα","","0.0717","0.0512","","","0.1236","0.1342","","","","","","1.009","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505613","21.2572","0.0004","7.53","0.0002","17.5917","0.0005","90","","114.053","0.002","90","","2571.34","0.12","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H24 Br4 N4 -","- C26 H24 Br4 N4 -","- C104 H96 Br16 N16 -","4","0.5","","Kamplain, Justin W.; Lynch, Vincent M.; Bielawski, Christopher W.","Synthesis and study of differentially substituted dibenzotetraazafulvalenes.","Organic letters","2007","9","26","5401","5404","10.1021/ol702230r","","","0.71073","MoKα","","0.0725","0.0543","","","0.132","0.1431","","","","","","1.124","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505614","36.0899","0.0008","7.7059","0.0002","14.9303","0.0003","90","","108.213","0.001","90","","3944.17","0.16","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C36 H32 Br8 N8 -","- C18 H16 Br4 N4 -","- C144 H128 Br32 N32 -","8","1","","Kamplain, Justin W.; Lynch, Vincent M.; Bielawski, Christopher W.","Synthesis and study of differentially substituted dibenzotetraazafulvalenes.","Organic letters","2007","9","26","5401","5404","10.1021/ol702230r","","","0.71073","MoKα","","0.0846","0.0597","","","0.0947","0.1018","","","","","","1.243","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505615","11.2612","0.0002","11.6629","0.0003","11.9967","0.0003","80.504","0.002","63.344","0.002","63.165","0.002","1255.12","0.06","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H24 Cl4 N4 O -","- C24 H24 Cl4 N4 O -","- C48 H48 Cl8 N8 O2 -","2","1","","Kamplain, Justin W.; Lynch, Vincent M.; Bielawski, Christopher W.","Synthesis and study of differentially substituted dibenzotetraazafulvalenes.","Organic letters","2007","9","26","5401","5404","10.1021/ol702230r","","","0.71073","MoKα","","0.0534","0.0381","","","0.093","0.1023","","","","","","1.015","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505616","11.545","0.002","11.531","0.002","32.792","0.009","90","","99.89","0.003","90","","4300.6","1.6","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22 H28 N4 O4 -","- C22 H28 N4 O4 -","- C176 H224 N32 O32 -","8","1","","Kamplain, Justin W.; Lynch, Vincent M.; Bielawski, Christopher W.","Synthesis and study of differentially substituted dibenzotetraazafulvalenes.","Organic letters","2007","9","26","5401","5404","10.1021/ol702230r","","","0.71073","MoKα","","0.1669","0.1149","","","0.2108","0.222","","","","","","2.678","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505617","6.8118","0.0001","9.889","0.0002","12.2513","0.0002","91.288","0.001","105.065","0.001","103.457","0.001","772","0.02","123","","123","","","","","","","","","4","P 1","P 1","1","","","","- C16 H14 Br2 S2 -","- C16 H14 Br2 S2 -","- C32 H28 Br4 S4 -","2","2","","Tanaka, Ken; Hori, Tomoko; Osaka, Takuya; Noguchi, Keiichi; Hirano, Masao","Rhodium-catalyzed reactions of dithiols and 1,4-bis(bromomethyl)benzenes leading to enantioenriched dithiaparacyclophanes.","Organic letters","2007","9","23","4881","4884","10.1021/ol702242x","","","1.54187","CuKα","","0.0446","0.0434","","","0.0991","0.1","","","","","","1.079","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505618","9.2804","0.0008","10.1749","0.0009","17.6738","0.0016","80.247","0.002","77.003","0.002","64.981","0.002","1468.3","0.2","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H35 Cl N O4 -","- C37 H35 Cl N O4 -","- C74 H70 Cl2 N2 O8 -","2","1","","Imai, Yoshitane; Kido, Shingo; Kamon, Kensaku; Kinuta, Takafumi; Sato, Tomohiro; Tajima, Nobuo; Kuroda, Reiko; Matsubara, Yoshio","A charge-transfer complex of 10,10'-dihydroxy-9,9'-biphenanthryl and methylviologen as a visual inclusion host system.","Organic letters","2007","9","24","5047","5050","10.1021/ol702286r","","","0.71073","MoKα","","0.0979","0.0625","","","0.1299","0.145","","","","","","1.022","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505619","9.3019","0.0006","11.4319","0.0007","15.3935","0.001","87.323","0.001","85.289","0.001","69.64","0.001","1529.18","0.17","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H37 Cl N O4 -","- C38 H37 Cl N O4 -","- C76 H74 Cl2 N2 O8 -","2","1","","Imai, Yoshitane; Kido, Shingo; Kamon, Kensaku; Kinuta, Takafumi; Sato, Tomohiro; Tajima, Nobuo; Kuroda, Reiko; Matsubara, Yoshio","A charge-transfer complex of 10,10'-dihydroxy-9,9'-biphenanthryl and methylviologen as a visual inclusion host system.","Organic letters","2007","9","24","5047","5050","10.1021/ol702286r","","","0.71073","MoKα","","0.0661","0.0535","","","0.1355","0.1446","","","","","","1.02","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505620","6.7308","0.0008","10.0398","0.0012","10.0115","0.0012","90","","92.66","0.002","90","","675.81","0.14","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H20 O2 -","- C14 H20 O2 -","- C28 H40 O4 -","2","0.5","","Hayashi, Naoto; Yoshikawa, Takahiro; Ohnuma, Takahiro; Higuchi, Hiroyuki; Sako, Katsuya; Uekusa, Hidehiro","Synthesis, structure, and properties of benzoquinone dimer and trimers bearing t-Bu substituents.","Organic letters","2007","9","26","5417","5420","10.1021/ol702289u","","","0.71073","MoKα","","0.0639","0.0493","","","0.1304","0.1387","","","","","","1.045","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505621","10.392","0.002","6.462","0.002","13.048","0.002","90","","94.84","0.02","90","","873.1","0.3","200","2","200","2","","","","","","","","3","C 1 2 1","C 2y","5","","5,5'-di-tert-butyl-2,2'-bis-p-benzoquinone","","- C20 H22 O4 -","- C20 H22 O4 -","- C40 H44 O8 -","2","0.5","","Hayashi, Naoto; Yoshikawa, Takahiro; Ohnuma, Takahiro; Higuchi, Hiroyuki; Sako, Katsuya; Uekusa, Hidehiro","Synthesis, structure, and properties of benzoquinone dimer and trimers bearing t-Bu substituents.","Organic letters","2007","9","26","5417","5420","10.1021/ol702289u","","","0.71069","MoKα","","0.0513","0.0448","","","0.1268","0.1411","","","","","","1.052","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505622","5.5601","0.0004","8.3699","0.0006","31.058","0.002","90","","94.512","0.002","90","","1440.88","0.17","110","2","110","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H18 O4 -","- C17 H18 O4 -","- C68 H72 O16 -","4","1","","Burns, Michael J.; Fairlamb, Ian J. S.; Kapdi, Anant R.; Sehnal, Petr; Taylor, Richard J. K.","Simple palladium(II) precatalyst for Suzuki-Miyaura couplings: efficient reactions of benzylic, aryl, heteroaryl, and vinyl coupling partners.","Organic letters","2007","9","26","5397","5400","10.1021/ol702291r","","","0.71073","MoKα","","0.0489","0.0411","","","0.107","0.1121","","","","","","1.038","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505623","5.3133","0.0008","8.0571","0.0011","36.533","0.005","90","","90","","90","","1564","0.4","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H17 N O5 -","- C18 H17 N O5 -","- C72 H68 N4 O20 -","4","1","","Nasveschuk, Christopher G.; Frein, Jeffrey D.; Jui, Nathan T.; Rovis, Tomislav","A diastereoselective intermolecular heck reaction of 1,3-dioxepins.","Organic letters","2007","9","24","5099","5102","10.1021/ol702294u","","","0.71073","MoKα","","0.2461","0.0861","","","0.1656","0.2244","","","","","","0.937","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505624","23.1988","0.0003","9.9193","0.0001","41.9034","0.0005","90","","90.54","0.001","90","","9642.2","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C44 H62 Cl9 N3 -","- C44 H61 Cl8.996 N3 -","- C352 H488 Cl71.968 N24 -","8","1","","Clift, Michael D.; Taylor, Carla N.; Thomson, Regan J.","Oxidative carbon-carbon bond formation via silyl bis-enol ethers: controlled cross-coupling for the synthesis of quaternary centers.","Organic letters","2007","9","22","4667","4669","10.1021/ol702306z","","","0.71073","MoKα","","0.0738","0.0502","","","0.1333","0.1423","","","","","","1.076","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505625","14.615","0.001","22.868","0.002","13.732","0.001","90","","109.329","0.006","90","","4330.8","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C43 H58 Cl2 N6 O6 -","- C43 H56 Cl2 N6 O6 -","- C172 H224 Cl8 N24 O24 -","4","1","","Yoshimitsu, Takehiko; Matsuda, Kenichi; Nagaoka, Hiroto; Tsukamoto, Koji; Tanaka, Tetsuaki","Radical fixation of functionalized carbon resources: alpha-sp3C-H carbamoylation of tertiary amines with aryl isocyanates.","Organic letters","2007","9","24","5115","5118","10.1021/ol7023295","","","1.54178","CuKα","","0.229","0.0961","","","0.1886","0.2223","","","","","","0.984","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505626","7.9482","0.0001","14.7857","0.0003","15.3689","0.0003","111.074","0.001","102.263","0.001","90.336","0.001","1640.18","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-Diethylboranyl-1-methyl-pipecolanilide","","- C17 H27 B N2 O -","- C17 H27 B N2 O -","- C68 H108 B4 N8 O4 -","4","2","","Yoshimitsu, Takehiko; Matsuda, Kenichi; Nagaoka, Hiroto; Tsukamoto, Koji; Tanaka, Tetsuaki","Radical fixation of functionalized carbon resources: alpha-sp3C-H carbamoylation of tertiary amines with aryl isocyanates.","Organic letters","2007","9","24","5115","5118","10.1021/ol7023295","","","1.54187","CuKα","","0.0932","0.0498","","","0.1347","0.1996","","","","","","1.053","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505627","12.1354","0.0003","10.5342","0.0003","29.4482","0.0007","90","","90","","90","","3764.56","0.17","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H24 Cl N3 O2 -","- C20 H24 Cl N3 O2 -","- C160 H192 Cl8 N24 O16 -","8","1","","Yoshimitsu, Takehiko; Matsuda, Kenichi; Nagaoka, Hiroto; Tsukamoto, Koji; Tanaka, Tetsuaki","Radical fixation of functionalized carbon resources: alpha-sp3C-H carbamoylation of tertiary amines with aryl isocyanates.","Organic letters","2007","9","24","5115","5118","10.1021/ol7023295","","","1.54187","CuKα","","0.1157","0.0501","","","0.1027","0.1163","","","","","","0.92","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505628","15.6298","0.0002","7.5395","0.0001","26.9183","0.0004","90","","105.851","0.001","90","","3051.46","0.07","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 N2 O5 -","- C18 H16 N2 O5 -","- C144 H128 N16 O40 -","8","1","","Vacas, Tatiana; Alvarez, Eleuterio; Chiara, Jose Luis","Phthalimides as exceptionally efficient single electron transfer acceptors in reductive coupling reactions promoted by samarium diiodide.","Organic letters","2007","9","26","5445","5448","10.1021/ol7023357","","","0.71073","MoKα","","0.0413","0.0382","","","0.1027","0.1056","","","","","","1.049","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505629","9.5421","0.0007","11.3451","0.0008","15.2978","0.0011","80.669","0.002","82.832","0.002","87.598","0.002","1621","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H20 N2 O3 -","- C19 H20 N2 O3 -","- C76 H80 N8 O12 -","4","2","","Vacas, Tatiana; Alvarez, Eleuterio; Chiara, Jose Luis","Phthalimides as exceptionally efficient single electron transfer acceptors in reductive coupling reactions promoted by samarium diiodide.","Organic letters","2007","9","26","5445","5448","10.1021/ol7023357","","","0.71073","MoKα","","0.0717","0.0441","","","0.095","0.1069","","","","","","1.027","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505630","7.3633","0.0003","15.3041","0.0006","14.7261","0.0006","90","","99.448","0.002","90","","1636.95","0.11","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H20 N2 O3 -","- C19 H20 N2 O3 -","- C76 H80 N8 O12 -","4","1","","Vacas, Tatiana; Alvarez, Eleuterio; Chiara, Jose Luis","Phthalimides as exceptionally efficient single electron transfer acceptors in reductive coupling reactions promoted by samarium diiodide.","Organic letters","2007","9","26","5445","5448","10.1021/ol7023357","","","0.71073","MoKα","","0.0743","0.0467","","","0.1085","0.1276","","","","","","1.084","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505631","14.023","0.003","13.658","0.003","17.593","0.005","90","","113.469","0.003","90","","3090.8","1.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H19 N3 O2 -","- C18 H19 N3 O2 -","- C144 H152 N24 O16 -","8","2","","Ribelin, Timothy P.; Judd, Andrew S.; Akritopoulou-Zanze, Irini; Henry, Rodger F.; Cross, Jeffrey L.; Whittern, David N.; Djuric, Stevan W.","Concise construction of novel bridged bicyclic lactams by sequenced Ugi/RCM/Heck reactions.","Organic letters","2007","9","24","5119","5122","10.1021/ol7023373","","","0.71073","MoKα","","0.0754","0.0698","","","0.192","0.1995","","","","","","1.063","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505632","18.61","0.004","7.6918","0.0018","20.026","0.005","90","","90","","90","","2866.6","1.2","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C17 H20 N2 O2 -","- C17 H20 N2 O2 -","- C136 H160 N16 O16 -","8","1","","Ribelin, Timothy P.; Judd, Andrew S.; Akritopoulou-Zanze, Irini; Henry, Rodger F.; Cross, Jeffrey L.; Whittern, David N.; Djuric, Stevan W.","Concise construction of novel bridged bicyclic lactams by sequenced Ugi/RCM/Heck reactions.","Organic letters","2007","9","24","5119","5122","10.1021/ol7023373","","","0.71073","MoKα","","0.0934","0.0703","","","0.1717","0.1874","","","","","","0.99","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505633","24.724","0.004","9.0148","0.0014","17.464","0.003","90","","129.305","0.002","90","","3011.9","0.9","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H20 N2 O2 -","- C17 H20 N2 O2 -","- C136 H160 N16 O16 -","8","1","","Ribelin, Timothy P.; Judd, Andrew S.; Akritopoulou-Zanze, Irini; Henry, Rodger F.; Cross, Jeffrey L.; Whittern, David N.; Djuric, Stevan W.","Concise construction of novel bridged bicyclic lactams by sequenced Ugi/RCM/Heck reactions.","Organic letters","2007","9","24","5119","5122","10.1021/ol7023373","","","0.71073","MoKα","","0.0608","0.0541","","","0.1521","0.1602","","","","","","1.059","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505634","8.5329","0.0017","10.238","0.002","18.578","0.004","90","","102.188","0.003","90","","1586.4","0.6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 N2 O2 -","- C18 H22 N2 O2 -","- C72 H88 N8 O8 -","4","1","","Ribelin, Timothy P.; Judd, Andrew S.; Akritopoulou-Zanze, Irini; Henry, Rodger F.; Cross, Jeffrey L.; Whittern, David N.; Djuric, Stevan W.","Concise construction of novel bridged bicyclic lactams by sequenced Ugi/RCM/Heck reactions.","Organic letters","2007","9","24","5119","5122","10.1021/ol7023373","","","0.71073","MoKα","","0.0717","0.0615","","","0.1624","0.1716","","","","","","1.056","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505635","8.479","0.019","22.03","0.05","8.403","0.019","90","","116.06","0.04","90","","1410","6","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C16 H18 N2 O2 -","- C16 H18 N2 O2 -","- C64 H72 N8 O8 -","4","1","","Ribelin, Timothy P.; Judd, Andrew S.; Akritopoulou-Zanze, Irini; Henry, Rodger F.; Cross, Jeffrey L.; Whittern, David N.; Djuric, Stevan W.","Concise construction of novel bridged bicyclic lactams by sequenced Ugi/RCM/Heck reactions.","Organic letters","2007","9","24","5119","5122","10.1021/ol7023373","","","0.71073","MoKα","","0.1028","0.0924","","","0.225","0.2365","","","","","","1.017","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505636","6.5983","0.0013","9.3785","0.0019","13.16","0.003","75.32","0.03","83.75","0.03","73.23","0.03","753.7","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H22 O3 Si -","- C15 H22 O3 Si -","- C30 H44 O6 Si2 -","2","1","","Li, Dongzhen; Liu, Guangzhen; Hu, Qiaoshu; Wang, Chao; Xi, Zhenfeng","Lewis Acid promoted tandem intermolecular Diels-Alder/intramolecular allylation reactions of silyl-substituted 1,3-butadienes leading to multisubstituted 7-norbornenones and related polycyclic compounds.","Organic letters","2007","9","26","5433","5436","10.1021/ol702379s","","","0.71073","MoKα","","0.0793","0.0506","","","0.1231","0.1319","","","","","","0.998","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505637","6.5493","0.0013","11.954","0.002","14.124","0.003","102.24","0.03","93.57","0.03","102.03","0.03","1050.3","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H32 O3 Si -","- C19 H32 O3 Si -","- C38 H64 O6 Si2 -","2","1","","Li, Dongzhen; Liu, Guangzhen; Hu, Qiaoshu; Wang, Chao; Xi, Zhenfeng","Lewis Acid promoted tandem intermolecular Diels-Alder/intramolecular allylation reactions of silyl-substituted 1,3-butadienes leading to multisubstituted 7-norbornenones and related polycyclic compounds.","Organic letters","2007","9","26","5433","5436","10.1021/ol702379s","","","0.71073","MoKα","","0.0984","0.0503","","","0.1177","0.126","","","","","","1.108","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505638","8.0468","0.0012","8.2968","0.0013","15.361","0.002","90","","93.584","0.002","90","","1023.5","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H14 B N O3 -","- C9 H14 B N O3 -","- C36 H56 B4 N4 O12 -","4","1","","Marwitz, Adam J. V.; Abbey, Eric R.; Jenkins, Jesse T.; Zakharov, Lev N.; Liu, Shih-Yuan","Diversity through isosterism: the case of boron-substituted 1,2-dihydro-1,2-azaborines.","Organic letters","2007","9","23","4905","4908","10.1021/ol702383u","","","0.71073","MoKα","","0.0445","0.0376","","","0.1046","0.1125","","","","","","1.001","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505639","12.1477","0.001","15.0735","0.0008","17.2611","0.0015","113.643","0.007","100.049","0.007","101.645","0.006","2718.4","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C59 H56 Cl3 D N4 O10 -","- C59 H56 Cl3 D N4 O10 -","- C118 H112 Cl6 D2 N8 O20 -","2","1","","Singh, Rekha; Ghosh, Sunil K.","Regioselective tandem dimethylsulfonium methylide addition-eliminative olefination of diendioates: a novel route to 1,3-butadien-2-ylmalonates.","Organic letters","2007","9","24","5071","5074","10.1021/ol702384s","","","0.71073","MoKα","","0.0801","0.0578","","","0.1565","0.1703","","","","","","1.04","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505640","10.4452","0.0009","26.656","0.002","26.723","0.002","90","","95.279","0.001","90","","7408.9","1","150","2","150","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C44.5 H40.5 Cl1.5 P2 -","- C44.5 H40.5 Cl1.5 P2 -","- C356 H324 Cl12 P16 -","8","2","","Doherty, Simon; Knight, Julian G.; Smyth, Catherine H.; Harrington, Ross W.; Clegg, William","Rhodium-catalyzed double [2 + 2 + 2] cycloaddition of 1,4-bis(diphenylphosphinoyl)buta-1,3-diyne with tethered diynes: a modular, highly versatile single-pot synthesis of NU-BIPHEP biaryl diphosphines.","Organic letters","2007","9","23","4925","4928","10.1021/ol702390p","","","0.71073","MoKα","","0.0424","0.0357","","","0.0897","0.0943","","","","","","1.025","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1505641","11.8411","0.0012","14.8589","0.0015","16.1237","0.0016","105.211","0.002","98.298","0.002","107.125","0.002","2539.5","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H48 Cl10 P2 Pt -","- C44 H40 Cl2 P2 Pt -","- C88 H80 Cl4 P4 Pt2 -","2","1","","Doherty, Simon; Knight, Julian G.; Smyth, Catherine H.; Harrington, Ross W.; Clegg, William","Rhodium-catalyzed double [2 + 2 + 2] cycloaddition of 1,4-bis(diphenylphosphinoyl)buta-1,3-diyne with tethered diynes: a modular, highly versatile single-pot synthesis of NU-BIPHEP biaryl diphosphines.","Organic letters","2007","9","23","4925","4928","10.1021/ol702390p","","","0.71073","MoKα","","0.038","0.0333","","","0.0868","0.0889","","","","","","1.085","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505642","6.8425","0.0009","15.5174","0.0019","26.14","0.003","90","","90","","90","","2775.5","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H19 F2 N3 O12 -","- C28 H19 F2 N3 O12 -","- C112 H76 F8 N12 O48 -","4","1","","Yang, Yan-Yan; Xu, Jun; You, Zheng-Wei; Xu, Xiu-Hua; Qiu, Xiao-Long; Qing, Feng-Ling","Synthesis of 3',3'-difluoro-2'- hydroxymethyl-4',5'-unsaturated carbocyclic nucleosides.","Organic letters","2007","9","26","5437","5440","10.1021/ol7023955","","","0.71073","MoKα","","0.1057","0.0604","","","0.1261","0.1461","","","","","","0.957","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505643","7.7456","0.0005","7.7456","0.0005","34.484","0.003","90","","90","","120","","1791.7","0.2","293","2","293","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C11 H12 F2 N2 O3 -","- C11 H12 F2 N2 O3 -","- C66 H72 F12 N12 O18 -","6","1","","Yang, Yan-Yan; Xu, Jun; You, Zheng-Wei; Xu, Xiu-Hua; Qiu, Xiao-Long; Qing, Feng-Ling","Synthesis of 3',3'-difluoro-2'- hydroxymethyl-4',5'-unsaturated carbocyclic nucleosides.","Organic letters","2007","9","26","5437","5440","10.1021/ol7023955","","","0.71073","MoKα","","0.0533","0.0504","","","0.1346","0.1373","","","","","","1.102","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505644","10.3199","0.0002","6.1986","0.0001","18.0875","0.0004","90","","105.511","0.001","90","","1114.9","0.04","90","1","90","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H11 N O S -","- C14 H11 N O S -","- C56 H44 N4 O4 S4 -","4","1","","Fuller, Peter H.; Chemler, Sherry R.","Copper(II) carboxylate-promoted intramolecular carboamination of alkenes for the synthesis of polycyclic lactams.","Organic letters","2007","9","26","5477","5480","10.1021/ol702401w","","x-ray","0.71073","MoKα","","0.0756","0.0704","","","0.134","0.1361","","","","","","1.172","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"1505645","18.9835","0.0005","9.6994","0.0003","15.3657","0.0004","90","","113.592","0.001","90","","2592.79","0.13","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C48 H58 N2 S14 -","- C48 H58 N2 S14 -","- C96 H116 N4 S28 -","2","0.5","","Poulsen, Thomas; Nielsen, Kent A.; Bond, Andrew D.; Jeppesen, Jan O.","Bis(tetrathiafulvalene)-calix[2]pyrrole[2]- thiophene and its complexation with TCNQ.","Organic letters","2007","9","26","5485","5488","10.1021/ol7024235","","","0.7107","MoKα","","0.0491","0.0299","","","0.0615","0.0663","","","","","","1.044","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505646","17.2","0.001","13.359","0.001","35.987","0.003","90","","103.334","0.006","90","","8046","1","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C73 H68 Cl2 N10 S14 -","- C73 H68 Cl2 N10 S14 -","- C292 H272 Cl8 N40 S56 -","4","1","","Poulsen, Thomas; Nielsen, Kent A.; Bond, Andrew D.; Jeppesen, Jan O.","Bis(tetrathiafulvalene)-calix[2]pyrrole[2]- thiophene and its complexation with TCNQ.","Organic letters","2007","9","26","5485","5488","10.1021/ol7024235","","","0.897","synchrotron","","0.237","0.1892","","","0.4383","0.449","","","","","","2.389","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505647","15.0927","0.0008","31.3789","0.0016","15.938","0.0009","90","","108.825","0.002","90","","7144.4","0.7","100","","100","","","","","","","","local","5","P 1 21/a 1","-P 2yab","14","","","","- C13 H18 N2 O2 Si -","- C13 H18 N2 O2 Si -","- C260 H360 N40 O40 Si20 -","20","5","","Pinkerton, David M.; Banwell, Martin G.; Willis, Anthony C.","Total syntheses of tambjamines C, E, F, G, H, I and J, BE-18591, and a related alkaloid from the marine bacterium Pseudoalteromonas tunicata.","Organic letters","2007","9","24","5127","5130","10.1021/ol7024313","","","0.71073","MoKα","","0.0633","0.0456","","0.0563","0.0441","0.0441","","","","","","1.1516","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505648","7.2483","0.0004","5.7003","0.0003","10.8181","0.0006","90","","94.877","0.003","90","","445.36","0.04","100","0.1","100","0.1","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","2007ms02jh02d","(S)-3-amino-1,1,1-trifluoro-2-phenyl-propan-2-ol","","- C9 H10 F3 N O -","- C9 H10 F3 N O -","- C18 H20 F6 N2 O2 -","2","1","","Tur, Fernando; Saá, José M","Direct, catalytic enantioselective nitroaldol (Henry) reaction of trifluoromethyl ketones: an asymmetric entry to alpha-trifluoromethyl-substituted quaternary carbons.","Organic letters","2007","9","24","5079","5082","10.1021/ol702434t","","x-ray","1.54178","CuKα","","0.045","0.044","","","0.1221","0.1236","","","","","","1.131","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505649","5.3752","0.0004","8.487","0.0006","21.9878","0.0016","90","","90","","90","","1003.07","0.13","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H12 N O S -","- C10 H12 N O S -","- C40 H48 N4 O4 S4 -","4","1","","Harmata, Michael; Zheng, Pinguan","A stereospecific synthesis of chiral cyclic sulfinamides.","Organic letters","2007","9","25","5251","5253","10.1021/ol7024394","","","0.71073","MoKα","","0.031","0.0303","","","0.0837","0.0843","","","","","","1.113","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505650","6.9809","0.0013","9.8145","0.0018","29.979","0.005","90","","90","","90","","2054","0.6","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H31 N O2 S -","- C21 H31 N O2 S -","- C84 H124 N4 O8 S4 -","4","1","","Harmata, Michael; Zheng, Pinguan","A stereospecific synthesis of chiral cyclic sulfinamides.","Organic letters","2007","9","25","5251","5253","10.1021/ol7024394","","","0.71073","MoKα","","0.0835","0.0549","","","0.1081","0.1193","","","","","","1.071","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505651","17.933","0.004","5.5887","0.0011","18.881","0.004","90","","109.225","0.003","90","","1786.8","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H18 O4 -","- C25 H18 O4 -","- C100 H72 O16 -","4","1","","Wu, Kun-Liang; Wilkinson, Stephanie; Reich, Norbert O.; Pettus, Thomas R. R.","Facile synthesis of naphthoquinone spiroketals by diastereoselective oxidative [3 + 2] cycloaddition.","Organic letters","2007","9","26","5537","5540","10.1021/ol702450d","","","0.71073","MoKα","","0.3154","0.1115","","","0.2074","0.2734","","","","","","1.015","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505652","6.2538","0.0009","29.083","0.003","9.86","0.001","90","","107.277","0.006","90","","1712.4","0.4","193.2","","","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C14 H18 F3 N O3 S2 -","- C14 H18 F3 N O3 S2 -","- C56 H72 F12 N4 O12 S8 -","4","1","","Murai, Toshiaki; Fukushima, Kozue; Mutoh, Yuichiro","Synthesis and properties of 1-methylthiopropargylammonium salts and their use as key precursors to sulfur-containing enediynes.","Organic letters","2007","9","25","5295","5298","10.1021/ol7024923","","","0.7107","MoKα","","","0.0345","","","","0.0869","","","","","","1.055","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505653","8.861","0.003","9.632","0.004","11.954","0.005","83.02","0.01","79.53","0.01","71.495","0.009","949.2","0.6","253.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C44 H36 S2 Si2 -","- C44 H36 S2 Si2 -","- C44 H36 S2 Si2 -","1","0.5","","Murai, Toshiaki; Fukushima, Kozue; Mutoh, Yuichiro","Synthesis and properties of 1-methylthiopropargylammonium salts and their use as key precursors to sulfur-containing enediynes.","Organic letters","2007","9","25","5295","5298","10.1021/ol7024923","","","0.7107","MoKα","","","0.0534","","","","0.1725","","","","","","1.154","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505654","8.9486","0.0017","13.132","0.003","12.841","0.003","90","","109.123","0.003","90","","1425.7","0.5","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 N O3 -","- C16 H17 N O3 -","- C64 H68 N4 O12 -","4","1","","Okamoto, Iwao; Yamasaki, Ryu; Sawamura, Mika; Kato, Takako; Nagayama, Naomi; Takeya, Tetsuya; Tamura, Osamu; Masu, Hyuma; Azumaya, Isao; Yamaguchi, Kentaro; Kagechika, Hiroyuki; Tanatani, Aya","Redox-induced conformational alteration of n,n-diarylamides.","Organic letters","2007","9","26","5545","5547","10.1021/ol702504x","","","0.71073","MoKα","","0.0771","0.0417","","","0.1042","0.1231","","","","","","1.018","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505655","6.3427","0.0001","11.2959","0.0002","16.3905","0.0004","90","","90","","90","","1174.32","0.04","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H13 N O3 -","- C14 H13 N O3 -","- C56 H52 N4 O12 -","4","1","","Okamoto, Iwao; Yamasaki, Ryu; Sawamura, Mika; Kato, Takako; Nagayama, Naomi; Takeya, Tetsuya; Tamura, Osamu; Masu, Hyuma; Azumaya, Isao; Yamaguchi, Kentaro; Kagechika, Hiroyuki; Tanatani, Aya","Redox-induced conformational alteration of n,n-diarylamides.","Organic letters","2007","9","26","5545","5547","10.1021/ol702504x","","","0.71073","MoKα","","0.0593","0.0457","","","0.1279","0.1418","","","","","","0.953","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505656","11.58","0.01","15.72","0.03","6.701","0.007","90","","90","","90","","1220","3","298.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H11 N O3 -","- C14 H11 N O3 -","- C56 H44 N4 O12 -","4","1","","Okamoto, Iwao; Yamasaki, Ryu; Sawamura, Mika; Kato, Takako; Nagayama, Naomi; Takeya, Tetsuya; Tamura, Osamu; Masu, Hyuma; Azumaya, Isao; Yamaguchi, Kentaro; Kagechika, Hiroyuki; Tanatani, Aya","Redox-induced conformational alteration of n,n-diarylamides.","Organic letters","2007","9","26","5545","5547","10.1021/ol702504x","","","0.7107","MoKα","","","0.0589","","","","0.1601","","","","","","0.999","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505657","11.775","0.002","14.08","0.003","14.801","0.003","117.56","0.03","109.34","0.03","92.84","0.03","1991.5","1.1","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H52 F6 N O9 P -","- C37 H52 F6 N O9 P -","- C74 H104 F12 N2 O18 P2 -","2","1","","Zhang, Chuanju; Li, Shijun; Zhang, Jinqiang; Zhu, Kelong; Li, Ning; Huang, Feihe","Benzo-21-crown-7/secondary dialkylammonium salt [2]pseudorotaxane- and [2]rotaxane-type threaded structures.","Organic letters","2007","9","26","5553","5556","10.1021/ol702510c","","","0.71073","MoKα","","0.1048","0.0922","","","0.2734","0.2866","","","","","","1.095","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505658","11.978","0.014","14.62","0.03","14.881","0.018","90","","90","","90","","2606","7","123.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H28 Fe N3 P -","- C32 H28 Fe N3 P -","- C128 H112 Fe4 N12 P4 -","4","1","","Fukuzawa, Shin-ichi; Oki, Hiroshi; Hosaka, Mitsuteru; Sugasawa, Jun; Kikuchi, Satoshi","ClickFerrophos: new chiral ferrocenyl phosphine ligands synthesized by click chemistry and the use of their metal complexes as catalysts for asymmetric hydrogenation and allylic substitution.","Organic letters","2007","9","26","5557","5560","10.1021/ol702519f","","","0.7107","MoKα","","","0.0544","","","","0.0545","","","","","","1","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505659","10.135","0.018","10.972","0.011","23.73","0.02","90","","90","","90","","2639","6","123.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H28 Fe N3 P -","- C32 H28 Fe N3 P -","- C128 H112 Fe4 N12 P4 -","4","1","","Fukuzawa, Shin-ichi; Oki, Hiroshi; Hosaka, Mitsuteru; Sugasawa, Jun; Kikuchi, Satoshi","ClickFerrophos: new chiral ferrocenyl phosphine ligands synthesized by click chemistry and the use of their metal complexes as catalysts for asymmetric hydrogenation and allylic substitution.","Organic letters","2007","9","26","5557","5560","10.1021/ol702519f","","","0.7107","MoKα","","","0.0402","","","","0.0712","","","","","","1","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505660","13.618","0.017","10.383","0.011","13.95","0.02","90","","116.34","0.04","90","","1768","4","123.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H37 Fe N3 P2 -","- C44 H37 Fe N3 P2 -","- C88 H74 Fe2 N6 P4 -","2","1","","Fukuzawa, Shin-ichi; Oki, Hiroshi; Hosaka, Mitsuteru; Sugasawa, Jun; Kikuchi, Satoshi","ClickFerrophos: new chiral ferrocenyl phosphine ligands synthesized by click chemistry and the use of their metal complexes as catalysts for asymmetric hydrogenation and allylic substitution.","Organic letters","2007","9","26","5557","5560","10.1021/ol702519f","","","0.7107","MoKα","","","0.0326","","","","0.0345","","","","","","1.005","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505661","5.881","0.0009","9.0184","0.0015","36.938","0.009","90","","90","","90","","1959.1","0.7","103.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C27 H18 Cl N -","- C27 H18 Cl N -","- C108 H72 Cl4 N4 -","4","1","","Matsuzawa, Hiroshi; Kanao, Keiichiro; Miyake, Yoshihiro; Nishibayashi, Yoshiaki","Remarkable effect of N-substituent on enantioselective ruthenium-catalyzed propargylation of indoles with propargylic alcohols.","Organic letters","2007","9","26","5561","5564","10.1021/ol7025203","","","0.7107","MoKα","","","0.0503","","","","0.0892","","","","","","1","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505662","13.1833","0.0012","6.6134","0.0006","13.7973","0.0012","90","","109.32","0.01","90","","1135.19","0.19","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","N-2,4-Dinitrophenyl 3-(tert-butyldimethylsilyloxy|)-2-methoxy-4 -methylpent-4-enamide","","- C19 H29 N3 O7 Si -","- C19 H29 N3 O7 Si -","- C38 H58 N6 O14 Si2 -","2","1","","Batsanov, Andrei S.; Knowles, Jonathan P.; Lightfoot, Andrew P.; Maw, Graham; Thirsk, Carl E.; Twiddle, Steven J. R.; Whiting, Andrew","A novel, efficient, diastereo- and enantioselective Mukaiyama aldol-based synthesis of a vinyl cyclopentanone core derivative of viridenomycin.","Organic letters","2007","9","26","5565","5568","10.1021/ol7025262","","","0.71073","MoKα","","0.0425","0.0369","","","0.0945","0.0979","","","","","","1.047","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505663","10.726","0.001","8.1169","0.0005","11.027","0.001","90","","115.27","0.01","90","","868.16","0.14","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","ozonide","[(1R,4S,5R,6R)-5-(tert-Butyl-dimethyl-silanyloxy)-6- methoxy-4-methyl-2,3,7-trioxa-bicyclo[2.2.1]hept-1-yl]- acetonitrile","","- C14 H25 N O5 Si -","- C14 H25 N O5 Si -","- C28 H50 N2 O10 Si2 -","2","1","","Batsanov, Andrei S.; Knowles, Jonathan P.; Lightfoot, Andrew P.; Maw, Graham; Thirsk, Carl E.; Twiddle, Steven J. R.; Whiting, Andrew","A novel, efficient, diastereo- and enantioselective Mukaiyama aldol-based synthesis of a vinyl cyclopentanone core derivative of viridenomycin.","Organic letters","2007","9","26","5565","5568","10.1021/ol7025262","","","0.71073","MoKα","","0.0281","0.0271","","","0.0728","0.0738","","","","","","1.07","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505664","9.3539","0.0011","8.0181","0.0009","31.277","0.004","90","","97.27","0.002","90","","2326.9","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H24 O6 S -","- C27 H24 O6 S -","- C108 H96 O24 S4 -","4","2","","Lu, Ping; Ma, Shengming","Rh-catalyzed triple allene approach to bicyclo[4.4.0]decene derivatives and its application for the stepwise synthesis of steroid-like tetracyclic skeletons.","Organic letters","2007","9","25","5319","5321","10.1021/ol702557s","","","0.71073","MoKα","","0.1305","0.0578","","","0.1198","0.1621","","","","","","0.775","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505665","13.4994","0.0015","21.855","0.002","8.6424","0.001","90","","91.605","0.002","90","","2548.8","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 O4 S2 -","- C30 H28 O4 S2 -","- C120 H112 O16 S8 -","4","1","","Lu, Ping; Ma, Shengming","Rh-catalyzed triple allene approach to bicyclo[4.4.0]decene derivatives and its application for the stepwise synthesis of steroid-like tetracyclic skeletons.","Organic letters","2007","9","25","5319","5321","10.1021/ol702557s","","","0.71073","MoKα","","0.0844","0.0557","","","0.1269","0.1379","","","","","","0.919","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505666","16.4936","0.0014","9.15","0.0008","23.709","0.002","90","","109.587","0.002","90","","3371","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H35 N O6 S2 -","- C40 H35 N O6 S2 -","- C160 H140 N4 O24 S8 -","4","1","","Lu, Ping; Ma, Shengming","Rh-catalyzed triple allene approach to bicyclo[4.4.0]decene derivatives and its application for the stepwise synthesis of steroid-like tetracyclic skeletons.","Organic letters","2007","9","25","5319","5321","10.1021/ol702557s","","","0.71073","MoKα","","0.0754","0.0529","","","0.119","0.1276","","","","","","0.954","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505667","14.74","0.01","16.07","0.01","16.6","0.01","80.43","0.03","73.17","0.03","71.15","0.02","3550","4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36.5 H41 Cl O10 S2 -","- C36.5 H41 Cl O10 S2 -","- C146 H164 Cl4 O40 S8 -","4","2","","Lu, Ping; Ma, Shengming","Rh-catalyzed triple allene approach to bicyclo[4.4.0]decene derivatives and its application for the stepwise synthesis of steroid-like tetracyclic skeletons.","Organic letters","2007","9","25","5319","5321","10.1021/ol702557s","","","0.71073","MoKα","","0.1107","0.0688","","","0.1791","0.2031","","","","","","0.966","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1505668","8.2971","0.0017","9.7116","0.0019","14.452","0.003","81","0.03","81.81","0.03","66.27","0.03","1048.9","0.4","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H17 F4 N3 O5 S -","- C22 H17 F4 N3 O5 S -","- C44 H34 F8 N6 O10 S2 -","2","1","","Hashimoto, Akihiro; Pais, Godwin C. G.; Wang, Qiuping; Lucien, Edlaine; Incarvito, Christopher D.; Deshpande, Milind; Bradbury, Barton J.; Wiles, Jason A.","Practical Synthesis and Molecular Structure of a Potent Broad-Spectrum Antibacterial Isothiazoloquinolone","Organic Process Research & Development","2007","11","3","389","","10.1021/op700014t","","","0.71073","MoKα","","0.0887","0.0533","","","0.1352","0.1499","","","","","","1.067","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505669","8.6649","0.0017","9.1625","0.0018","14.151","0.003","79.77","0.03","74.02","0.03","74.16","0.03","1032.7","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H12 F8 N2 O7 S -","- C18 H12 F8 N2 O7 S -","- C36 H24 F16 N4 O14 S2 -","2","1","","Hashimoto, Akihiro; Pais, Godwin C. G.; Wang, Qiuping; Lucien, Edlaine; Incarvito, Christopher D.; Deshpande, Milind; Bradbury, Barton J.; Wiles, Jason A.","Practical Synthesis and Molecular Structure of a Potent Broad-Spectrum Antibacterial Isothiazoloquinolone","Organic Process Research & Development","2007","11","3","389","","10.1021/op700014t","","","0.71073","MoKα","","0.0811","0.0598","","","0.1742","0.1858","","","","","","1.262","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1505670","24.528","0.005","7.134","0.0014","21.125","0.004","90","","114.89","0.03","90","","3353.2","1.4","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H17 F2 N O6 S -","- C17 H17 F2 N O6 S -","- C136 H136 F16 N8 O48 S8 -","8","2","","Hashimoto, Akihiro; Pais, Godwin C. G.; Wang, Qiuping; Lucien, Edlaine; Incarvito, Christopher D.; Deshpande, Milind; Bradbury, Barton J.; Wiles, Jason A.","Practical Synthesis and Molecular Structure of a Potent Broad-Spectrum Antibacterial Isothiazoloquinolone","Organic Process Research & Development","2007","11","3","389","","10.1021/op700014t","","","0.71073","MoKα","","0.1526","0.0778","","","0.1743","0.2018","","","","","","1.042","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505671","8.8361","0.0018","9.6639","0.0019","10.439","0.002","101.76","0.03","99.69","0.03","113.51","0.03","768.7","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H15 F2 N O4 S -","- C16 H15 F2 N O4 S -","- C32 H30 F4 N2 O8 S2 -","2","1","","Hashimoto, Akihiro; Pais, Godwin C. G.; Wang, Qiuping; Lucien, Edlaine; Incarvito, Christopher D.; Deshpande, Milind; Bradbury, Barton J.; Wiles, Jason A.","Practical Synthesis and Molecular Structure of a Potent Broad-Spectrum Antibacterial Isothiazoloquinolone","Organic Process Research & Development","2007","11","3","389","","10.1021/op700014t","","","0.71073","MoKα","","0.07","0.0507","","","0.1459","0.1581","","","","","","1.089","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1505672","30.683","0.005","30.683","0.005","8.352","0.002","90","","90","","90","","7863","3","193","2","193","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C16 H29 Cl N4 O4 -","- C16 H29 Cl N4 O4 -","- C256 H464 Cl16 N64 O64 -","16","1","","Barkalow, Jufang H.; Breting, Jeffrey; Gaede, Bruce J.; Haight, Anthony R.; Henry, Rodger; Kotecki, Brian; Mei, Jianzhang; Pearl, Kurt B.; Tedrow, Jason S.; Viswanath, Shekhar K.","Process Development for ABT-472, a Benzimidazole PARP Inhibitor","Organic Process Research & Development","2007","11","4","693","","10.1021/op7000194","","","0.71073","MoKα","","0.0658","0.0563","","","0.152","0.1617","","","","","","1.059","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1505673","17.36","0.004","9.944","0.002","18.696","0.004","90","","108.13","0.03","90","","3067.2","1.3","100","2","100","2","","","","","","","Synthetic","5","P 1 21 1","P 2yb","4","","(R)-7-Benzyloxy-2-methyl-4-(4-methylsulfanyl-phenyl)- 1,2,3,4-tetrahydro-isoquinoline (S)-(S)-2,3-Bis-(4-methyl-benzoyloxy)-succinic acid","","- C69 H71 N2 O11 S2 -","- C69 H71 N2 O11 S2 -","- C138 H142 N4 O22 S4 -","2","1","","Deng, Xiaohu; Liang, Jimmy T.; Liu, Jing; McAllister, Heather; Schubert, Carsten; Mani, Neelakandha S.","A Practical Synthesis of Enantiopure 7-Alkoxy-4-aryl-tetrahydroisoquinoline, a Dual Serotonin Reuptake Inhibitor/Histamine H3Antagonist","Organic Process Research & Development","2007","11","6","1043","","10.1021/op700183q","","x-ray","1.54178","CuKα","","0.0481","0.0479","","","0.1167","0.117","","","","","","1.201","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1507765","8.528","0.0007","7.3938","0.0006","13.2368","0.0011","90","","128.777","0.002","90","","650.67","0.09","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C6 H20 Al2 F10 N4 -","- C6 H20 Al2 F10 N4 -","- C12 H40 Al4 F20 N8 -","2","0.5","","Adil, K; Le Bail, A; Dujardin, G; Maisonneuve, V","A new 1D hybrid fluoroaluminate templated by an original tetramine","Polyhedron","2007","26","","2493","2497","10.1016/j.poly.2006.12.041","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1507766","11.651","0.003","8.159","0.002","6.8473","0.0014","90","","101.53","0.03","90","","637.8","0.3","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C6 H20 Cl4 N4 -","- C6 H20 Cl4 N4 -","- C12 H40 Cl8 N8 -","2","0.25","","Adil, K; Le Bail, A; Dujardin, G; Maisonneuve, V","A new 1D hybrid fluoroaluminate templated by an original tetramine","Polyhedron","2007","26","","2493","2497","10.1016/j.poly.2006.12.041","","","0.71069","MoKα","","0.0587","0.0475","","","0.1304","0.1398","","","","","","1.1","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1507780","9.9355","0.0008","14.1122","0.0011","10.963","0.0009","90","","90.55","0.006","90","","1537.1","0.2","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C7 H20 Cl2 N4 Ni O8 -","- C7 H20 Cl2 N4 Ni O8 -","- C28 H80 Cl8 N16 Ni4 O32 -","4","1","","Hatzipanayioti, D; Veneris, A; Parsons, S","Synthesis and spectroscopic investigation of new nickel(II) complexes with the open chain asymmetric tetraamine 1,4,7,11-tetraazaundecane: Crystal structure of the square-planar complex","Inorganica Chimica Acta","2007","360","","2857","2861","10.1016/j.ica.2007.01.019","","","0.71073","MoKα","","0.0758","0.0611","","","0.1636","0.173","","","","","","1.075","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1507783","13.395","0.003","13.474","0.006","15.877","0.003","76.99","0.03","77.8","0.02","61.03","0.02","2425","1.4","295","","295","","","","","","","","?","6","P -1","-P 1","2","","","","- C50 H46 Mo2 O12 P2 Si -","- C50 H46 Mo2 O12 P2 Si -","- C100 H92 Mo4 O24 P4 Si2 -","2","1","","Salles, L; Piquemal, J Y; Mahha, Y; Gentil,M; Herson, P; Bregeault, M","Crystal structures of three novel dioxotetraperoxodi(molybdenum) heteropolyanions in [PPh4]2[R2SiO2{Mo2O2(mu-O2)2(O2)2}] (R2 = (CH3)2, (i-C4H9)2 or (CH3)(CH2Cl)) and characterization of their tungsten analogues","Polyhedron","2007","26","17","4786","4792","10.1016/j.poly.2007.06.007","","","0.71073","MoKα","","0.0914","0.0453","","0.0557","0.0532","0.0532","","","","","","1.1236","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1507784","10.646","0.003","11.086","0.002","24.237","0.007","100.81","0.02","96.56","0.02","101.36","0.02","2720.5","1.3","295","","295","","","","","","","","?","6","P -1","-P 1","2","","","","- C56 H58 Mo2 O12 P2 Si -","- C56 H58 Mo2 O12 P2 Si -","- C112 H116 Mo4 O24 P4 Si2 -","2","1","","Salles, L; Piquemal, J Y; Mahha, Y; Gentil, M; Herson, P; Bregeault, M","Crystal structures of three novel dioxotetraperoxodi(molybdenum) heteropolyanions in [PPh4]2[R2SiO2{Mo2O2(mu-O2)2(O2)2}] (R2 = (CH3)2, (i-C4H9)2 or (CH3)(CH2Cl)) and characterization of their tungsten analogues","Polyhedron","2007","26","17","4786","4792","10.1016/j.poly.2007.06.007","","","0.71073","MoKα","","0.0517","0.0331","","0.0421","0.0399","0.0399","","","","","","1.1389","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1507785","13.467","0.003","13.548","0.003","15.931","0.003","76.03","0.02","79.39","0.02","61.18","0.02","2463.4","1","295","","295","","","","","","","","?","7","P -1","-P 1","2","","","","- C50 H45 Cl Mo2 O12 P2 Si -","- C50 H45 Cl Mo2 O12 P2 Si -","- C100 H90 Cl2 Mo4 O24 P4 Si2 -","2","1","","Salles, L; Piquemal, J Y; Mahha, Y; Gentil, M; Herson, P; Bregeault, M","Crystal structures of three novel dioxotetraperoxodi(molybdenum) heteropolyanions in [PPh4]2[R2SiO2{Mo2O2(mu-O2)2(O2)2}] (R2 = (CH3)2, (i-C4H9)2 or (CH3)(CH2Cl)) and characterization of their tungsten analogues","Polyhedron","2007","26","17","4786","4792","10.1016/j.poly.2007.06.007","","","0.71069","MoKα","","0.0637","0.0533","","0.0589","0.0583","0.0583","","","","","","1.0605","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509010","10.2898","","10.2898","","5.7334","","90","","90","","120","","525.723","","","","","","","","","","","","","5","P 63","P 6c","173","","Silver cerium sulfide chloride thiosilicate (0.63/3/2.63/0.37/1)","","- Ag0.627 Ce3 Cl0.37 S6.63 Si -","- Ag0.627 Ce3 Cl0.369 S6.6279 Si0.9999 -","- Ag1.254 Ce6 Cl0.738 S13.2558 Si1.9998 -","2","0.333333","","Schleid, T.; Hartenbach, I.; Nilges, T.","Thiosilicates of the rare-earth elements. IV. The quasi-isostructural compounds Na Sm3 S3 [Si S4], Cu Ce3 S3 [Si S4], Ag0.63 Ce3 S2.63 Cl0.37 [Si S4] and Sm3 S2 Cl [Si S4] - synthesis, crystal structure and investigations of the silver-cation motion","Zeitschrift fuer Anorganische und Allgemeine Chemie","2007","633","","2445","2452","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509292","6.1295","","6.1295","","6.1295","","90","","90","","90","","230.29","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Ag Cu Se -","- Ag Cu0.998 Se -","- Ag4 Cu3.992 Se4 -","4","0.0208333","","Beskrovnyi, A.I.; Yadrovskii, E.L.; Mikolaichuk, A.N.; Stepanov, Yu.M.; Sagdatkireeva, M.B.; Karimov, L.Z.; Bikkulova, N.N.; Skomorokhov, A.N.","Lattice dynamics and ion transport in structurally disordered chalcogenides of copper and silver","Kristallografiya","2007","52","","474","476","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1509632","14.838","","14.838","","14.838","","90","","90","","90","","3266.83","","","","","","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","Ag15 (P S4)4 Cl3","","- Ag15 Cl3 P4 S16 -","- Ag15 Cl3 P4 S16 -","- Ag60 Cl12 P16 S64 -","4","0.0833333","","Mewis, A.; Joergens, S.","Ag5 P S4 Cl2 and Ag15 (P S4)4 Cl3 - crystal structures and their relation to Ag3 P S4","Solid State Sciences","2007","9","","213","217","10.1016/j.solidstatesciences.2006.09.003","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509917","7.409","","11.143","","6.258","","90","","90","","90","","516.651","","","","","","","","","","","","","4","A m m 2","A 2 -2","38","","Ag5 (P S4) Cl2","","- Ag5 Cl2 P S4 -","- Ag5 Cl2 P S4 -","- Ag10 Cl4 P2 S8 -","2","0.25","","Mewis, A.; Joergens, S.","Ag5 P S4 Cl2 and Ag15 (P S4)4 Cl3 - crystal structures and their relation to Ag3 P S4","Solid State Sciences","2007","9","","213","217","10.1016/j.solidstatesciences.2006.09.003","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509924","5.9405","","5.9405","","6.4349","","90","","90","","120","","196.661","","","","","","","","","","","","","3","P -3 1 m","-P 3 2","162","","Ag5 Pb2 O6","","- Ag5 O6 Pb2 -","- Ag5 O5.97 Pb1.99 -","- Ag5 O5.97 Pb1.99 -","1","0.0833333","","Shimojo, Y.; Abe, H.; Morii, Y.; Yoshii, K.; Uruga, T.; Nakamura, A.; Ishii, Y.; Mizumaki, M.; Kato, K.","Neutron diffraction and x-ray absorption study of Ag5 Pb2 O6","Journal of Solid State Chemistry","2007","180","","377","381","10.1016/j.jssc.2006.10.025","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510021","2.9331","","2.9331","","28.313","","90","","90","","120","","210.945","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ag3 Ni2 O4 -","- Ag3 Ni2 O4 -","- Ag6 Ni4 O8 -","2","0.0833333","","Jansen, M.; Soergel, T.","Ag3 Ni2 O4: A new stage-2 intercalation compound of 2H-Ag Ni O2 and physical properties of 2H-Ag Ni O2 above ambient temperature","Journal of Solid State Chemistry","2007","180","","8","15","10.1016/j.jssc.2006.08.033","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1510028","7.647","","6.858","","6.506","","90","","90","","90","","341.195","","","","","","","","","","","","","3","P m n 21","P 2ac -2","31","","","","- Ag3 P S4 -","- Ag3 P S4 -","- Ag6 P2 S8 -","2","0.5","","Joergens, S.; Mewis, A.","Ag5 P S4 Cl2 and Ag15 (P S4)4 Cl3 - crystal structures and their relation to Ag3 P S4","Solid State Sciences","2007","9","","213","217","10.1016/j.solidstatesciences.2006.09.003","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1510786","9.2465","","5.5232","","4.4288","","90","","108.3","","90","","214.741","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Ni B2 O4","","- B2 Ni O4 -","- B2 Ni O4 -","- B8 Ni4 O16 -","4","0.5","","Roessner, F.; Kinski, I.; Knyrim, J.S.; Johrendt, D.; Glaum, R.; Jakob, S.; Huppertz, H.","Formation of edge-sharing B O4 tetrahedra in the high-pressure borate HP-Ni B2 O4","Angew. Chem. Int. ed.","2007","46","","9097","9100","10.1002/anie.200703399","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511252","12.567","","10.29","","10.21","","90","","92.492","","90","","1319.05","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Na3 B P2 O8","","- B Na3 O8 P2 -","- B Na3 O8 P2 -","- B8 Na24 O64 P16 -","8","1","","Xiong Dingbang; Yang Xinxin; Zhao Jingthai; Chen Haohong","Low-temperature flux syntheses and characterizations of two 1-D anhydrous borophosphates: Na3 B6 P O13 and Na3 B P2 O8","Journal of Solid State Chemistry","2007","180","","233","239","10.1016/j.jssc.2006.09.034","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511426","8.223","","8.223","","4.16","","90","","90","","120","","243.604","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Li6 B18 (Li2 O)0.70","","- B18 Li7.4 O0.7 -","- B18 Li7.276 O0.699 -","- B18 Li7.276 O0.699 -","1","0.0416667","","Woerle, M.; von Schnering, H.G.; Nesper, R.; Mair, G.","Li6 B18 (Li2 O)(x) - a boride with a porous framework of B6 octahedra","Solid State Sciences","2007","9","","459","464","10.1016/j.solidstatesciences.2007.03.029","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511550","7.838","","12.288","","18.18","","90","","90","","90","","1750.98","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Na3 Mg (B5 O10)","","- B5 Mg Na3 O10 -","- B5 Mg Na3 O10 -","- B40 Mg8 Na24 O80 -","8","1","","Xiao Weiqiang; Zang Hegui; Li Ming; Chang Xinan; Zuo Jianlong; Chen Xuean","Syntheses and crystal structures of two pentaborates, Na3 Ca B5 O10 and Na3 Mg B5 O10","Solid State Sciences","2007","9","","678","685","10.1016/j.solidstatesciences.2007.05.013","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511560","12.1508","","12.1508","","6.8618","","90","","90","","90","","1013.09","","","","","","","","","","","","","5","P 42 n m","P 4n -2n","102","","Ba2 Ga B4 O9 Cl","","- B4 Ba2 Cl Ga O9 -","- B4 Ba1.9997 Cl Ga O9 -","- B16 Ba7.9988 Cl4 Ga4 O36 -","4","0.5","","Barbier, J.","The non - centrosymmetric borate chlorides Ba2 T B4 O9 Cl (T = Al, Ga)","Solid State Sciences","2007","9","","344","350","10.1016/j.solidstatesciences.2007.02.005","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511625","9.3727","","16.2307","","6.7232","","90","","90","","90","","1022.77","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Na3 B6 P O13","","- B6 Na3 O13 P -","- B6 Na3 O13 P -","- B24 Na12 O52 P4 -","4","0.5","","Zhao Jingthai; Chen Haohong; Xiong Dingbang; Yang Xinxin","Low-temperature flux syntheses and characterizations of two 1-D anhydrous borophosphates: Na3 B6 P O13 and Na3 B P2 O8","Journal of Solid State Chemistry","2007","180","","233","239","10.1016/j.jssc.2006.09.034","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1512870","9.5394","0.0002","9.6303","0.0002","11.7396","0.0003","106.85","0.001","91.995","0.001","91.001","0.001","1031.13","0.04","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H60 N2 O8 U -","- C44 H60 N2 O8 U -","- C44 H60 N2 O8 U -","1","0.5","","Harri Sopo; Ari Väisänen; Reijo Sillanpää","Uranyl ion complexes with long chain aminoalcoholbis(phenolate) [O,N,O,O′] donor ligands","Polyhedron","2007","26","1","184","196","10.1016/j.poly.2006.08.006","","x-ray","0.71073","MoKα","","0.0281","0.028","","","0.0565","0.0566","","","","","","1.139","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512871","8.8922","0.0002","11.7134","0.0002","12.2525","0.0003","74.976","0.001","69.694","0.001","79.265","0.001","1149.42","0.04","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H66 N4 O8 U -","- C48 H66 N4 O8 U -","- C48 H66 N4 O8 U -","1","0.5","","Harri Sopo; Ari Väisänen; Reijo Sillanpää","Uranyl ion complexes with long chain aminoalcoholbis(phenolate) [O,N,O,O′] donor ligands","Polyhedron","2007","26","1","184","196","10.1016/j.poly.2006.08.006","","x-ray","0.71073","MoKα","","0.0293","0.0292","","","0.0591","0.0593","","","","","","1.132","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512872","9.1043","0.0003","10.9246","0.0004","13.0396","0.0004","93.197","0.002","108.741","0.002","93.142","0.002","1222.62","0.07","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H70 N4 O8 U -","- C50 H70 N4 O8 U -","- C50 H70 N4 O8 U -","1","0.5","","Harri Sopo; Ari Väisänen; Reijo Sillanpää","Uranyl ion complexes with long chain aminoalcoholbis(phenolate) [O,N,O,O′] donor ligands","Polyhedron","2007","26","1","184","196","10.1016/j.poly.2006.08.006","","x-ray","0.71073","MoKα","","0.0283","0.0274","","","0.0609","0.0614","","","","","","1.081","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512873","9.4243","0.0003","12.9906","0.0003","14.2802","0.0005","109.058","0.002","99.946","0.002","104.502","0.002","1536.7","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H94 N4 O8 U -","- C62 H94 N4 O8 U -","- C62 H94 N4 O8 U -","1","0.5","","Harri Sopo; Ari Väisänen; Reijo Sillanpää","Uranyl ion complexes with long chain aminoalcoholbis(phenolate) [O,N,O,O′] donor ligands","Polyhedron","2007","26","1","184","196","10.1016/j.poly.2006.08.006","","x-ray","0.71073","MoKα","","0.0369","0.0351","","","0.065","0.0659","","","","","","1.033","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512874","15.3013","0.0003","24.3376","0.0004","23.6905","0.0005","90","","108.254","0.001","90","","8378.3","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C88 H124 N2 O8 U -","- C88 H123 N2 O8 U -","- C352 H492 N8 O32 U4 -","4","0.5","","Harri Sopo; Ari Väisänen; Reijo Sillanpää","Uranyl ion complexes with long chain aminoalcoholbis(phenolate) [O,N,O,O′] donor ligands","Polyhedron","2007","26","1","184","196","10.1016/j.poly.2006.08.006","","x-ray","0.71073","MoKα","","0.0511","0.0283","","","0.0579","0.0644","","","","","","1.042","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1512875","9.4697","0.0002","11.1762","0.0003","15.0633","0.0004","94.738","0.001","104.745","0.001","111.795","0.001","1403.4","0.06","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H86 N4 O6 U -","- C58 H86 N4 O6 U -","- C58 H86 N4 O6 U -","1","0.5","","Harri Sopo; Kamal Goljahanpoor; Reijo Sillanpää","Aminoalkylbis(phenolate) [O,N,O] donor ligands for uranyl(VI) ion coordination: Syntheses, structures, and extraction studies","Polyhedron","2007","26","13","3397","3408","10.1016/j.poly.2007.03.032","","x-ray","0.71073","MoKα","","0.0535","0.0484","","","0.0877","0.0922","","","","","","1.15","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512876","9.4543","0.0003","11.2111","0.0004","13.3303","0.0005","103.444","0.002","98.87","0.002","94.052","0.002","1349.4","0.08","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H84 N2 O6 U -","- C56 H84 N2 O6 U -","- C56 H84 N2 O6 U -","1","0.5","","Harri Sopo; Kamal Goljahanpoor; Reijo Sillanpää","Aminoalkylbis(phenolate) [O,N,O] donor ligands for uranyl(VI) ion coordination: Syntheses, structures, and extraction studies","Polyhedron","2007","26","13","3397","3408","10.1016/j.poly.2007.03.032","","x-ray","0.71073","MoKα","","0.048","0.0471","","","0.099","0.0999","","","","","","1.114","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1512877","9.4071","0.0002","11.7023","0.0002","15.3342","0.0004","100.565","0.001","105.633","0.001","95.305","0.002","1580.01","0.06","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H98 N4 O6 U -","- C64 H98 N4 O6 U -","- C64 H98 N4 O6 U -","1","0.5","","Harri Sopo; Kamal Goljahanpoor; Reijo Sillanpää","Aminoalkylbis(phenolate) [O,N,O] donor ligands for uranyl(VI) ion coordination: Syntheses, structures, and extraction studies","Polyhedron","2007","26","13","3397","3408","10.1016/j.poly.2007.03.032","","x-ray","0.71073","MoKα","","0.0464","0.0436","","","0.0812","0.0833","","","","","","1.115","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512878","9.9942","0.0002","25.7977","0.0005","10.8009","0.0003","90","","98.197","0.001","90","","2756.32","0.11","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C60 H88 N2 O6 U -","- C60 H88 N2 O6 U -","- C120 H176 N4 O12 U2 -","2","0.5","","Harri Sopo; Kamal Goljahanpoor; Reijo Sillanpää","Aminoalkylbis(phenolate) [O,N,O] donor ligands for uranyl(VI) ion coordination: Syntheses, structures, and extraction studies","Polyhedron","2007","26","13","3397","3408","10.1016/j.poly.2007.03.032","","x-ray","0.71073","MoKα","","0.0764","0.0435","","","0.0712","0.0798","","","","","","1.103","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512915","9.085","0.003","16.764","0.005","18.141","0.006","70.307","0.005","85.569","0.006","89.84","0.005","2592.7","1.4","203","2","203","2","","","","","","","","6","P -1","-P 1","2","(1) Mg(TFA)2(py)4","","","- C24 H20 F6 Mg N4 O4 -","- C24 H20 F6 Mg N4 O4 -","- C96 H80 F24 Mg4 N16 O16 -","4","2","","Timothy J. Boyle; Pratt, III, Harry D.; Todd M. Alam; Mark A. Rodriguez; Paul G. Clem","Synthesis and characterization of solvated trifluoroacetate alkaline earth derivatives","Polyhedron","2007","26","17","5095","5103","10.1016/j.poly.2007.07.009","","","0.71073","MoKα","","0.1486","0.108","","","0.2807","0.3055","","","","","","1.094","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512916","10.0952","0.0006","20.8523","0.0013","17.1268","0.0011","90","","90.58","0.001","90","","3605.1","0.4","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(2) [Ca2(u-TFA)3(THF)4](u-TFA)","","","- C24 H32 Ca2 F12 O12 -","- C24 H32 Ca2 F12 O12 -","- C96 H128 Ca8 F48 O48 -","4","1","","Timothy J. Boyle; Pratt, III, Harry D.; Todd M. Alam; Mark A. Rodriguez; Paul G. Clem","Synthesis and characterization of solvated trifluoroacetate alkaline earth derivatives","Polyhedron","2007","26","17","5095","5103","10.1016/j.poly.2007.07.009","","","0.71073","MoKα","","0.1123","0.0961","","","0.2522","0.268","","","","","","1.044","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512917","18.967","0.013","14.068","0.01","8.31","0.006","90","","90","","90","","2217","3","203","2","203","2","","","","","","","","6","P n a 21","P 2c -2n","33","(3) (u-TFA)2Sr(H-TFA)","","","- C16 H11 F9 N2 O6 Sr -","- C16 H10 F9 N2 O6 Sr -","- C64 H40 F36 N8 O24 Sr4 -","4","1","","Timothy J. Boyle; Pratt, III, Harry D.; Todd M. Alam; Mark A. Rodriguez; Paul G. Clem","Synthesis and characterization of solvated trifluoroacetate alkaline earth derivatives","Polyhedron","2007","26","17","5095","5103","10.1016/j.poly.2007.07.009","","","0.71073","MoKα","","0.1123","0.054","","","0.1016","0.1221","","","","","","1.009","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512918","13.177","0.003","19.169","0.004","8.5978","0.0017","90","","102.418","0.003","90","","2120.9","0.8","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(4)Ba(TFA)2(H-TFA)py","","","- C16 H11 Ba F9 N2 O6 -","- C16 H11 Ba F9 N2 O6 -","- C64 H44 Ba4 F36 N8 O24 -","4","1","","Timothy J. Boyle; Pratt, III, Harry D.; Todd M. Alam; Mark A. Rodriguez; Paul G. Clem","Synthesis and characterization of solvated trifluoroacetate alkaline earth derivatives","Polyhedron","2007","26","17","5095","5103","10.1016/j.poly.2007.07.009","","","0.71073","MoKα","","0.0549","0.0395","","","0.0767","0.0824","","","","","","1.075","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512978","13.9443","0.0016","6.895","0.0008","19.39","0.002","90","","109.953","0.002","90","","1752.4","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H21 N3 O4 -","- C19 H21 N3 O4 -","- C76 H84 N12 O16 -","4","1","","P. Mosae Selvakumar; E. Suresh; P.S. Subramanian","Synthesis, spectral characterization and structural investigation on some 4-aminoantipyrine containing Schiff base Cu(II) complexes and their molecular association","Polyhedron","2007","26","4","749","756","10.1016/j.poly.2006.09.004","","","0.71073","MoKα","","0.0646","0.0534","","","0.1285","0.1443","","","","","","1.098","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512979","7.0141","0.0008","8.0449","0.0009","30.487","0.003","90","","90.972","0.002","90","","1720.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 Cl2 N3 O2 -","- C18 H15 Cl2 N3 O2 -","- C72 H60 Cl8 N12 O8 -","4","1","","P. Mosae Selvakumar; E. Suresh; P.S. Subramanian","Synthesis, spectral characterization and structural investigation on some 4-aminoantipyrine containing Schiff base Cu(II) complexes and their molecular association","Polyhedron","2007","26","4","749","756","10.1016/j.poly.2006.09.004","","","0.71073","MoKα","","0.0645","0.0482","","","0.1237","0.1448","","","","","","1.069","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512980","10.2073","0.0016","12.1721","0.0019","13.776","0.002","74.189","0.003","74.273","0.003","80.569","0.003","1577.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H32 Cu N6 O6 -","- C36 H32 Cu N6 O6 -","- C72 H64 Cu2 N12 O12 -","2","1","","P. Mosae Selvakumar; E. Suresh; P.S. Subramanian","Synthesis, spectral characterization and structural investigation on some 4-aminoantipyrine containing Schiff base Cu(II) complexes and their molecular association","Polyhedron","2007","26","4","749","756","10.1016/j.poly.2006.09.004","","","0.71073","MoKα","","0.0915","0.0621","","","0.1526","0.1809","","","","","","1.018","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1512981","23.197","0.002","6.7034","0.0006","22.443","0.002","90","","90.918","0.003","90","","3489.4","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H14 Cl2 Cu0.5 N3 O2 -","- C18 H14 Cl2 Cu0.5 N3 O2 -","- C144 H112 Cl16 Cu4 N24 O16 -","8","1","","P. Mosae Selvakumar; E. Suresh; P.S. Subramanian","Synthesis, spectral characterization and structural investigation on some 4-aminoantipyrine containing Schiff base Cu(II) complexes and their molecular association","Polyhedron","2007","26","4","749","756","10.1016/j.poly.2006.09.004","","","0.71073","MoKα","","0.0487","0.0382","","","0.0954","0.0997","","","","","","1.09","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1514034","4.5725","0.0001","5.7419","0.0002","2.8037","0.0001","90","","90","","90","","73.611","0.004","","","","","","","","","","","","3","P m n m :2","-P 2c 2a","59","","Lithium Manganate(III) - Ht","","- Li Mn O2 -","- Li Mn O2 -","- Li2 Mn2 O4 -","2","0.25","","Wei, Y.-J.; Ehrenberg, H.; Bramnik, N. N.; Nikolowski, K.; Baehtz, C.; Fuess, H.","In situ synchrotron diffraction study of high temperature prepared orthorhombic Li Mn O2","Solid State Ionics","2007","178","","253","257","10.1016/j.ssi.2006.11.018","","","","","","0.108","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514046","2.80473","0.00004","4.57419","0.00008","5.74873","0.00009","90","","90","","90","","73.753","0.002","","","","","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","Lithium Manganese Oxide (0.98/1/2)","","- Li0.98 Mn O2 -","- Li0.977 Mn1.023 O2 -","- Li1.954 Mn2.046 O4 -","2","0.25","","Kellerman, D. G.; Medvedeva, J. E.; Gorshkov, V. S.; Kurbakov, A. I.; Zubkov, V. G.; Tyutyunnik, A. P.; Trunov, V. A.","Structural and magnetic properties of orthorhombic Li(x) Mn O2","Solid State Sciences","2007","9","2","196","204","10.1016/j.solidstatesciences.2006.11.013","","","","","","0.0325","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514047","2.80644","0.00003","4.57536","0.00007","5.75092","0.00008","90","","90","","90","","73.8445","0.0017","","","","","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","Lithium Manganese Dioxide","","- Li Mn O2 -","- Li0.996 Mn1.004 O2 -","- Li1.992 Mn2.008 O4 -","2","0.25","","Kellerman, D. G.; Medvedeva, J. E.; Gorshkov, V. S.; Kurbakov, A. I.; Zubkov, V. G.; Tyutyunnik, A. P.; Trunov, V. A.","Structural and magnetic properties of orthorhombic Li(x) Mn O2","Solid State Sciences","2007","9","2","196","204","10.1016/j.solidstatesciences.2006.11.013","","","","","","0.0261","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514048","2.80661","0.00002","4.57749","0.00004","5.75147","0.00005","90","","90","","90","","73.8905","0.0011","","","","","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","Lithium Manganese Oxide (1.02/1/2)","","- Li1.02 Mn O2 -","- Li1.016 Mn0.984 O2 -","- Li2.032 Mn1.968 O4 -","2","0.25","","Kellerman, D. G.; Medvedeva, J. E.; Gorshkov, V. S.; Kurbakov, A. I.; Zubkov, V. G.; Tyutyunnik, A. P.; Trunov, V. A.","Structural and magnetic properties of orthorhombic Li(x) Mn O2","Solid State Sciences","2007","9","2","196","204","10.1016/j.solidstatesciences.2006.11.013","","","","","","0.0277","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514082","25.3068","0.0011","10.567","0.0004","21.5706","0.0013","90","","101.372","0.003","90","","5655.1","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C63 H57 Cl3 N10 O6 -","- C63 H57 Cl3 N10 O6 -","- C252 H228 Cl12 N40 O24 -","4","1","","Kai-Chi Chang; In-Hao Su; Gene-Hsiang Lee; Wen-Sheng Chung","Triazole- and azo-coupled calix[4]arene as a highly sensitive chromogenic sensor for Ca2+ and Pb2+ ions","Tetrahedron Letters","2007","48","41","7274","7278","10.1016/j.tetlet.2007.08.045","","","0.71073","MoKα","","0.2174","0.1076","","","0.2617","0.3089","","","","","","1.158","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1514237","4.451","0.008","4.451","0.008","4.451","0.008","90","","90","","90","","88.2","0.3","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Manganese Oxide","","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Trukhanov, S. V.; Troyanchuk, I. O.; Bobrikov, I. A.; Simkin, V. G.; Balagurov, A. M.","Structure phase separation in the anion-deficient La0.70 Sr0.30 Mn O3- d manganite system","Poverkhnostnye Fizika, Khimiya, Mekhanika","2007","12","","11","17","","","","","","","","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514238","9.4173","0.0011","9.4173","0.0011","9.4173","0.0011","90","","90","","90","","835.18","0.17","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","Dimanganese(III) Oxide","","- Mn2 O3 -","- Mn2 O3 -","- Mn32 O48 -","16","0.333333","","Wang, Xiaofeng; Li, Guanghua; Chu, Qingxin; Liu, Xiaoyang; Feng, Shouhua","Synthesis, structure characterization and magnetic properties of single crystal of dimanganese trioxide","Gaodeng Xuexiao Huaxue Xuebao","2007","28","4","821","823","","","","","","","0.0659","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1516036","7.1035","0.0002","8.6768","0.0003","22.2831","0.0008","90","","94.802","0.001","90","","1368.61","0.08","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H9 N3 O6 S -","- C13 H9 N3 O6 S -","- C52 H36 N12 O24 S4 -","4","1","","McHugh, Callum J.; Kennedy, Alan R.; Smith, W. Ewen; Graham, Duncan","TNT stilbene derivatives as SERRS active species.","The Analyst","2007","132","10","986","988","10.1039/b712231d","","","0.71073","MoKα","","0.0899","0.0469","","","0.1001","0.1141","","","","","","0.986","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516037","7.1622","0.0002","9.0664","0.0003","20.6429","0.0007","90","","90","","90","","1340.45","0.07","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H8 N4 O6 -","- C13 H8 N4 O6 -","- C52 H32 N16 O24 -","4","1","","McHugh, Callum J.; Kennedy, Alan R.; Smith, W. Ewen; Graham, Duncan","TNT stilbene derivatives as SERRS active species.","The Analyst","2007","132","10","986","988","10.1039/b712231d","","","0.71073","MoKα","","0.066","0.0422","","","0.0904","0.0997","","","","","","1.034","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516038","9.5594","0.0012","5.8786","0.0007","29.704","0.004","90","","96.345","0.002","90","","1659","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H19 N O3 -","- C19 H19 N O3 -","- C76 H76 N4 O12 -","4","2","","O'Mahony, John; Karlsson, Bjorn C. G.; Mizaikoff, Boris; Nicholls, Ian A.","Correlated theoretical, spectroscopic and X-ray crystallographic studies of a non-covalent molecularly imprinted polymerisation system.","The Analyst","2007","132","11","1161","1168","10.1039/b706258c","","","0.71073","MoKα","","0.0609","0.0532","","","0.1493","0.1628","","","","","","1.067","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516039","12.158","0.002","16.063","0.003","18.733","0.003","64.59","0.02","83.11","0.02","74.52","0.02","3184.6","1.1","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C70 H78 Au3 Cu2 N -","- C70 H78 Au3 Cu2 N -","- C140 H156 Au6 Cu4 N2 -","2","1","","Yip, Sung-Kong; Chan, Chui-Ling; Lam, Wai Han; Cheung, Kung-Kai; Yam, Vivian Wing-Wah","Synthesis, structure and luminescence studies of heterometallic gold(I)-copper(I) and -silver(I) alkynyl clusters/aggregates.","Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology","2007","6","4","365","371","10.1039/b612334a","","","","","","","0.045","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1516040","13.0556","0.0011","12.7471","0.0011","18.9654","0.0016","90","","109.859","0.001","90","","2968.5","0.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H34 Cr N10 O7 Yb -","- C18 H34 Cr N10 O7 Yb -","- C72 H136 Cr4 N40 O28 Yb4 -","4","1","","Lazarides, Theodore; Davies, Graham M.; Adams, Harry; Sabatini, Cristiana; Barigelletti, Francesco; Barbieri, Andrea; Pope, Simon J. A.; Faulkner, Stephen; Ward, Michael D.","Ligand-field excited states of hexacyanochromate and hexacyanocobaltate as sensitisers for near-infrared luminescence from Nd(iii) and Yb(iii) in cyanide-bridged d-f assemblies.","Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology","2007","6","11","1152","1157","10.1039/b708683k","","","0.71073","MoKα","","0.0414","0.0293","","","0.0654","0.0693","","","","","","0.984","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516041","9.5027","0.0006","8.2756","0.0005","17.7737","0.0011","90","","98.642","0.001","90","","1381.86","0.15","120","2","120","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","Bis(2-tbutylphynylethynyl) anthracene","Bis(2-tbutylphynylethynyl) anthracene","","- C38 H34 -","- C38 H34 -","- C76 H68 -","2","0.5","","Beeby, Andrew; Findlay, Karen S.; Goeta, Andrés E; Porrès, Laurent; Rutter, Simon R.; Thompson, Amber L.","Engineering a twist in 9,10-diethynylanthracenes by steric interactions.","Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology","2007","6","9","982","986","10.1039/b707750e","","","0.71073","MoKα","","0.0959","0.0538","","","0.1121","0.1262","","","","","","1.03","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516623","9.777","0.002","10.96","0.002","19.356","0.004","96.59","0.03","100.37","0.03","91.1","0.03","2025.1","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H6 F19 N O2 -","- C15 H6 F19 N O2 -","- C60 H24 F76 N4 O8 -","4","2","","O'Neal, Kristi L; Geib, Steven; Weber, Stephen G.","Extraction of pyridines into fluorous solvents based on hydrogen bond complex formation with carboxylic acid receptors.","Analytical chemistry","2007","79","8","3117","3125","10.1021/ac062287+","","","0.71073","MoKα","","0.186","0.1669","","","0.4511","0.4582","","","","","","1.04","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516636","7.5875","0.0005","11.1085","0.0005","14.9042","0.0009","90","","92.772","0.003","90","","1254.74","0.13","123.1","0.5","123.1","0.5","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","4-methylbenzo[c]phenanthrene","","","- C19 H14 -","- C19 H14 -","- C76 H56 -","4","1","","Wolstenholme, David J.; Matta, Chérif F; Cameron, T. Stanley","Experimental and theoretical electron density study of a highly twisted polycyclic aromatic hydrocarbon: 4-methyl-[4]helicene.","The journal of physical chemistry. A","2007","111","36","8803","8813","10.1021/jp071002+","","","0.7107","MoKα","","0.104","0.038","","","","0.043","","","","","","2.087","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516637","14.273","0.002","4.6009","0.0006","10.7534","0.0016","90","","90","","90","","706.16","0.17","297","2","297","2","","","","","","","","4","P c a 21","P 2c -2ac","29","[2-BrPyH][Br]","","","- C5 H5 Br2 N -","- C5 H5 Br2 N -","- C20 H20 Br8 N4 -","4","1","","Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan","The nature of halogen...halide synthons: theoretical and crystallographic studies.","The journal of physical chemistry. A","2007","111","12","2319","2328","10.1021/jp0660684","","","0.71073","MoKα","","0.0348","0.0282","","","0.0594","0.0617","","","","","","1.032","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516638","14.274","0.003","4.4396","0.0009","10.581","0.002","90","","90","","90","","670.5","0.2","297","2","297","2","","","","","","","","5","P c a 21","P 2c -2ac","29","[2-BrPyH][Cl]'","","","- C5 H5 Br Cl N -","- C5 H5 Br Cl N -","- C20 H20 Br4 Cl4 N4 -","4","1","","Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan","The nature of halogen...halide synthons: theoretical and crystallographic studies.","The journal of physical chemistry. A","2007","111","12","2319","2328","10.1021/jp0660684","","","0.71073","MoKα","","0.089","0.0463","","","0.0851","0.0982","","","","","","0.984","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516639","14.2891","0.0018","4.8298","0.0006","10.9546","0.0014","90","","90","","90","","756.02","0.17","85","2","85","2","","","","","","","","5","P c a 21","P 2c -2ac","29","[2-BrPyH][I]","","","- C5 H5 Br I N -","- C5 H5 Br I N -","- C20 H20 Br4 I4 N4 -","4","1","","Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan","The nature of halogen...halide synthons: theoretical and crystallographic studies.","The journal of physical chemistry. A","2007","111","12","2319","2328","10.1021/jp0660684","","","0.71073","MoKα","","0.0281","0.0272","","","0.0648","0.0651","","","","","","1.064","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516641","6.9272","0.0018","6.6251","0.0019","8.512","0.002","90","","103.19","0.02","90","","380.34","0.17","295","2","295","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C5 H5 Cl I N -","- C5 H5 Cl I N -","- C10 H10 Cl2 I2 N2 -","2","0.5","","Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan","The nature of halogen...halide synthons: theoretical and crystallographic studies.","The journal of physical chemistry. A","2007","111","12","2319","2328","10.1021/jp0660684","","","0.71073","MoKα","","0.0377","0.0306","","","0.0696","0.073","","","","","","1.083","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516642","4.7691","0.001","7.7441","0.0015","9.1529","0.0018","84.26","0.03","76.91","0.03","86.06","0.03","327.23","0.12","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C5 H5 Br Cl N -","- C5 H5 Br Cl N -","- C10 H10 Br2 Cl2 N2 -","2","1","","Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan","The nature of halogen...halide synthons: theoretical and crystallographic studies.","The journal of physical chemistry. A","2007","111","12","2319","2328","10.1021/jp0660684","","","0.71073","MoKα","","0.0451","0.0421","","","0.1084","0.1103","","","","","","1.032","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516643","4.805","0.0014","14.391","0.003","11.121","0.002","90","","94.69","0.03","90","","766.4","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H5 Br I N -","- C5 H5 Br I N -","- C20 H20 Br4 I4 N4 -","4","1","","Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan","The nature of halogen...halide synthons: theoretical and crystallographic studies.","The journal of physical chemistry. A","2007","111","12","2319","2328","10.1021/jp0660684","","","0.71073","MoKα","","0.0463","0.032","","","0.0727","0.0787","","","","","","1.066","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516644","4.9079","0.0013","7.8016","0.0009","9.2523","0.0012","83.626","0.013","77.592","0.019","86.92","0.015","343.69","0.11","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C5 H5 Br Cl N -","- C5 H5 Br Cl N -","- C10 H10 Br2 Cl2 N2 -","2","1","","Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan","The nature of halogen...halide synthons: theoretical and crystallographic studies.","The journal of physical chemistry. A","2007","111","12","2319","2328","10.1021/jp0660684","","","0.71073","MoKα","","0.07","0.0474","","","0.1128","0.1229","","","","","","1.04","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516645","5.1279","0.0019","8.224","0.006","9.276","0.006","83.82","0.05","74.66","0.05","86.82","0.06","374.9","0.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C5 H5 Cl I N -","- C5 H5 Cl I N -","- C10 H10 Cl2 I2 N2 -","2","1","","Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan","The nature of halogen...halide synthons: theoretical and crystallographic studies.","The journal of physical chemistry. A","2007","111","12","2319","2328","10.1021/jp0660684","","","0.71073","MoKα","","0.0589","0.0514","","","0.1279","0.133","","","","","","1.096","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516646","4.3924","0.0009","8.1794","0.0016","9.4338","0.0019","90","","95.83","0.03","90","","337.18","0.12","295","2","295","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C5 H5 Br Cl N -","- C5 H5 Br Cl N -","- C10 H10 Br2 Cl2 N2 -","2","0.5","","Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan","The nature of halogen...halide synthons: theoretical and crystallographic studies.","The journal of physical chemistry. A","2007","111","12","2319","2328","10.1021/jp0660684","","","0.71073","MoKα","","0.069","0.0459","","","0.1078","0.1229","","","","","","1.104","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516647","4.981","0.0011","8.5067","0.0016","9.4529","0.0019","80.18","0.02","79.48","0.02","88.909","0.018","388","0.14","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C5 H5 Br I N -","- C5 H5 Br I N -","- C10 H10 Br2 I2 N2 -","2","1","","Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan","The nature of halogen...halide synthons: theoretical and crystallographic studies.","The journal of physical chemistry. A","2007","111","12","2319","2328","10.1021/jp0660684","","","0.71073","MoKα","","0.0626","0.0436","","","0.1046","0.1157","","","","","","1.061","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516648","4.6993","0.0008","8.1822","0.0016","9.1028","0.0017","90","","100.045","0.013","90","","344.64","0.11","295","2","295","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C5 H5 Br Cl N -","- C5 H5 Br Cl N -","- C10 H10 Br2 Cl2 N2 -","2","0.5","","Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan","The nature of halogen...halide synthons: theoretical and crystallographic studies.","The journal of physical chemistry. A","2007","111","12","2319","2328","10.1021/jp0660684","","","0.71073","MoKα","","0.0753","0.0445","","","0.0958","0.1069","","","","","","1.065","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516649","5.09","0.0011","8.5759","0.0014","9.1018","0.0013","83.513","0.011","76.39","0.02","89.059","0.019","383.66","0.12","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C5 H5 Cl I N -","- C5 H5 Cl I N -","- C10 H10 Cl2 I2 N2 -","2","1","","Awwadi, Firas F.; Willett, Roger D.; Peterson, Kirk A.; Twamley, Brendan","The nature of halogen...halide synthons: theoretical and crystallographic studies.","The journal of physical chemistry. A","2007","111","12","2319","2328","10.1021/jp0660684","","","0.71073","MoKα","","0.0772","0.0449","","","0.0761","0.0858","","","","","","1.008","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516650","12.8482","0.0004","18.7165","0.0005","19.2753","0.0006","90","","108.773","0.001","90","","4388.6","0.2","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C51 H68 O5 -","- C51 H68 O5 -","- C204 H272 O20 -","4","1","","Yang, Yong; Swager, Timothy M.","Main-Chain Calix[4]arene Elastomers by Ring-Opening Metathesis Polymerization","Macromolecules","2007","40","21","7437","","10.1021/ma071304+","","","0.71073","MoKα","","0.0759","0.0633","","","0.1707","0.1833","","","","","","1.033","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1516651","14.9565","0.0008","15.7696","0.0009","17.7243","0.001","82.483","0.002","88.559","0.002","65.016","0.001","3754.6","0.4","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C86.5 H118 O4 -","- C86.5 H118 O4 -","- C173 H236 O8 -","2","1","","Yang, Yong; Swager, Timothy M.","Main-Chain Calix[4]arene Elastomers by Ring-Opening Metathesis Polymerization","Macromolecules","2007","40","21","7437","","10.1021/ma071304+","","","0.71073","MoKα","","0.1019","0.0719","","","0.2027","0.2306","","","","","","1.05","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1516653","13.576","0.001","8.049","0.001","10.772","0.001","90","","109.89","0.01","90","","1106.9","0.2","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H33 N O6 -","- C24 H33 N O6 -","- C48 H66 N2 O12 -","2","1","","Li, Chun-Shun; Di, Ying-Tong; He, Hong-Ping; Gao, Suo; Wang, Yue-Hu; Lu, Yang; Zhong, Jia-Liang; Hao, Xiao-Jiang","Daphlongeranines A and B, two novel alkaloids possessing unprecedented skeletons from Daphniphyllum longeracemosum.","Organic letters","2007","9","13","2509","2512","10.1021/ol070942+","","","0.71073","MoKα","","0.0384","0.038","","","0.1","0.1007","","","","","","1.049","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1516654","9.332","0.0006","12.2796","0.0009","25.7432","0.0017","90","","90","","90","","2950","0.3","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C19 H34 F6 N2 O10 S2 Zn -","- C19 H34 F6 N2 O10 S2 Zn -","- C76 H136 F24 N8 O40 S8 Zn4 -","4","1","","Monge, David; Martín-Zamora, Eloísa; Vazquez, Juan; Alcarazo, Manuel; Alvarez, Eleuterio; Fernandez, Rosario; Lassaletta, José M","Enantioselective conjugate addition of N,N-dialkylhydrazones to alpha-hydroxy enones.","Organic letters","2007","9","15","2867","2870","10.1021/ol071055+","","","0.71073","MoKα","","0.032","0.0264","","","0.0545","0.0562","","","","","","1.028","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516655","11.9304","0.0005","13.1965","0.0005","14.3418","0.0005","85.259","0.002","78.176","0.002","79.079","0.002","2167.77","0.15","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C53 H35 Cl3 N4 O2 -","- C53 H35 Cl3 N4 O2 -","- C106 H70 Cl6 N8 O4 -","2","1","","Leung, Man-kit; Yang, Chih-Chiang; Lee, Jiun-Haw; Tsai, Hsin-Hung; Lin, Chi-Feng; Huang, Chih-Yen; Su, Yuhlong Oliver; Chiu, Chi-Feng","The unusual electrochemical and photophysical behavior of 2,2'-bis(1,3,4-oxadiazol-2-yl)biphenyls, effective electron transport hosts for phosphorescent organic light emitting diodes.","Organic letters","2007","9","2","235","238","10.1021/ol062668+","","","0.71073","MoKα","","0.1529","0.0796","","","0.204","0.2648","","","","","","1.047","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516656","14.9947","0.0003","7.2016","0.0001","15.2457","0.0003","90","","113.94","0.001","90","","1504.69","0.05","295","2","295","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C40 H26 N4 O2 -","- C40 H26 N4 O2 -","- C80 H52 N8 O4 -","2","0.5","","Leung, Man-kit; Yang, Chih-Chiang; Lee, Jiun-Haw; Tsai, Hsin-Hung; Lin, Chi-Feng; Huang, Chih-Yen; Su, Yuhlong Oliver; Chiu, Chi-Feng","The unusual electrochemical and photophysical behavior of 2,2'-bis(1,3,4-oxadiazol-2-yl)biphenyls, effective electron transport hosts for phosphorescent organic light emitting diodes.","Organic letters","2007","9","2","235","238","10.1021/ol062668+","","","0.71073","MoKα","","0.0682","0.0503","","","0.1251","0.1431","","","","","","1.112","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516657","11.3862","0.0005","10.0904","0.0006","18.8335","0.0009","90","","90","","90","","2163.81","0.19","295","2","295","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C28 H18 N4 O2 -","- C28 H18 N4 O2 -","- C112 H72 N16 O8 -","4","0.5","","Leung, Man-kit; Yang, Chih-Chiang; Lee, Jiun-Haw; Tsai, Hsin-Hung; Lin, Chi-Feng; Huang, Chih-Yen; Su, Yuhlong Oliver; Chiu, Chi-Feng","The unusual electrochemical and photophysical behavior of 2,2'-bis(1,3,4-oxadiazol-2-yl)biphenyls, effective electron transport hosts for phosphorescent organic light emitting diodes.","Organic letters","2007","9","2","235","238","10.1021/ol062668+","","","0.71073","MoKα","","0.1237","0.0537","","","0.1217","0.1648","","","","","","1.109","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516658","11.0052","0.0002","13.4251","0.0002","14.8416","0.0003","90","","102.384","0.001","90","","2141.76","0.07","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C53 H33 Cl3 N6 O2 -","- C53 H33 Cl3 N6 O2 -","- C106 H66 Cl6 N12 O4 -","2","0.5","","Leung, Man-kit; Yang, Chih-Chiang; Lee, Jiun-Haw; Tsai, Hsin-Hung; Lin, Chi-Feng; Huang, Chih-Yen; Su, Yuhlong Oliver; Chiu, Chi-Feng","The unusual electrochemical and photophysical behavior of 2,2'-bis(1,3,4-oxadiazol-2-yl)biphenyls, effective electron transport hosts for phosphorescent organic light emitting diodes.","Organic letters","2007","9","2","235","238","10.1021/ol062668+","","","0.71073","MoKα","","0.107","0.078","","","0.2245","0.249","","","","","","1.722","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516659","12.063","0.002","11.771","0.002","11.209","0.002","90","","106.55","0.03","90","","1525.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 N O2 -","- C18 H17 N O2 -","- C72 H68 N4 O8 -","4","1","","Yang, Luo; Deng, Gang; Wang, De-Xian; Huang, Zhi-Tang; Zhu, Jie-Ping; Wang, Mei-Xiang","Highly efficient and stereoselective N-vinylation of oxiranecarboxamides and unprecedented 8-endo-epoxy-arene cyclization: expedient and biomimetic synthesis of some Clausena alkaloids.","Organic letters","2007","9","7","1387","1390","10.1021/ol070292+","","","0.71073","MoKα","","0.0932","0.0662","","","0.1721","0.1959","","","","","","1.033","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516660","11.1671","0.0006","16.1513","0.0009","13.1889","0.0007","90","","95.155","0.0017","90","","2369.2","0.2","123.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H27 N O3 S -","- C28 H27 N O3 S -","- C112 H108 N4 O12 S4 -","4","1","","Tsuchikama, Kyoji; Kuwata, Yusuke; Tahara, Yu-ki; Yoshinami, Yusuke; Shibata, Takanori","Rh-catalyzed cyclization of diynes and enynes initiated by carbonyl-directed activation of aromatic and vinylic C-H bonds.","Organic letters","2007","9","16","3097","3099","10.1021/ol0711669","","","0.71075","MoKα","","","0.0389","","","","0.1207","","","","","","0.989","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1516661","9.6928","0.0003","10.3932","0.0003","15.2434","0.0005","90","","100.477","0.002","90","","1510.01","0.08","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H21 N O3 -","- C18 H21 N O3 -","- C72 H84 N4 O12 -","4","1","","Su, Shun; Porco, Jr, John A","1,2-dihydroisoquinolines as templates for cascade reactions to access isoquinoline alkaloid frameworks.","Organic letters","2007","9","24","4983","4986","10.1021/ol702176h","","","0.71073","MoKα","","0.0512","0.0393","","","0.1103","0.1189","","","","","","1.045","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516662","8.2919","0.0008","18.2388","0.0018","10.7413","0.001","90","","106.478","0.002","90","","1557.7","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C32 H44 O11 -","- C32 H44 O11 -","- C64 H88 O22 -","2","1","","Yin, Sheng; Wang, Xiao-Ning; Fan, Cheng-Qi; Liao, Shang-Gao; Yue, Jian-Min","The first limonoid peroxide in the Meliaceae family: walsuronoid A from Walsura robusta.","Organic letters","2007","9","12","2353","2356","10.1021/ol070735+","","","0.71073","MoKα","","0.0609","0.0542","","","0.1248","0.1286","","","","","","0.96","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1516663","16.0338","0.0017","5.4918","0.0004","16.9616","0.0018","90","","117.095","0.004","90","","1329.6","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H16 O3 S -","- C13 H16 O3 S -","- C52 H64 O12 S4 -","4","2","","Jung, Jae Hoon; Kim, Yong Wook; Kim, Min Ah; Choi, Soo Young; Chung, Young Keun; Kim, Tae-Rae; Shin, Seokmin; Lee, Eun","Efficient chirality transfer in the SmI2-mediated cyclization of aldehydo beta-alkoxyvinyl sulfoxides: asymmetric synthesis of 3-hydroxyoxanes.","Organic letters","2007","9","17","3225","3228","10.1021/ol071176+","","","0.71073","MoKα","","0.1215","0.0606","","","0.1253","0.1507","","","","","","1.029","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517788","3.884","","3.884","","12.6","","90","","90","","90","","190.077","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Distrontium Titanate","","- O4 Sr2 Ti -","- O4 Sr2 Ti -","- O8 Sr4 Ti2 -","2","0.0625","","Miwa, K.; Kagomiya, I.; Ohsato, H.; Sakai, H.; Maeda, Y.","Electrical properties of the Sr2 Ru1-x Tix O4 solid solutions","Journal of the European Ceramic Society","2007","27","","4287","4290","10.1016/j.jeurceramsoc.2007.02.146","","","","","","","","","","","","","","","","","","","","","has coordinates","177091","2020-10-21","18:00:00",""
"1519787","6.9077","0.0008","24.201","0.003","7.7428","0.0007","90","","100.062","0.006","90","","1274.5","0.2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H11 F N4 O3 -","- C13 H11 F N4 O3 -","- C52 H44 F4 N16 O12 -","4","1","","Springer, Caroline J.; Suijkerbuijk, Bart M. J. M.; Davies, Lawrence; Horton, Peter N.; Hursthouse, Michael B.","8-(4-amino-3-fluorophenoxy)pyrido[2,3-b]pyrazin-2(1H)-one","Crystal Structure Report Archive","2007","","","105","","","","","0.71073","MoKα","","0.1575","0.0919","","","0.1507","0.1822","","","","","","1.115","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519788","9.6827","0.0001","22.3776","0.0002","16.0124","0.0002","90","","91.846","0.001","90","","3467.7","0.06","120","2","120","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C10 H15 Cl3 N5 O P3 -","- C10 H15 Cl3 N5 O P3 -","- C80 H120 Cl24 N40 O8 P24 -","8","4","","Davies, David B.; Besli, S.; Kilic, A.; Coles, Simon J.; Hursthouse, Michael B.","C10H15Cl3N5OP3","Crystal Structure Report Archive","2007","","","346","","","","","0.71073","MoKα","","0.0345","0.0316","","","0.0696","0.0714","","","","","","1.034","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519789","7.916","0.005","9.901","0.005","20.661","0.005","90","0.005","99.445","0.005","90","0.005","1597.4","1.3","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H15 F6 N2 O2 P -","- C14 H15 F6 N2 O2 P -","- C56 H60 F24 N8 O8 P4 -","4","1","","Tomkinson, N; Coles, Simon J.","C14H15N2O2 . PF6","Crystal Structure Report Archive","2007","","","349","","","","","0.71073","MoKα","","0.2326","0.1137","","","0.3083","0.3783","","","","","","1.042","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519790","7.373","0.0005","13.2476","0.001","30.324","0.002","90","","93.123","0.004","90","","2957.5","0.4","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H11 Cl Fe N2 -","- C18 H11 Cl Fe N2 -","- C144 H88 Cl8 Fe8 N16 -","8","2","","Barnes, Sarah; Holliman, Peter J.; Male, Louise; Hursthouse, Michael B.","C18H11ClFeN2","Crystal Structure Report Archive","2007","","","105","","","","","0.71073","MoKα","","0.1121","0.0617","","","0.1066","0.1245","","","","","","1.063","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519791","8.5795","0.0003","8.5965","0.0002","11.4708","0.0003","90","","98.957","0.002","90","","835.7","0.04","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H10 N4 O3 -","- C7 H10 N4 O3 -","- C28 H40 N16 O12 -","4","1","","McDonald, E.; Horton, Peter N.; Hursthouse, Michael B.","3-Amino-2-methyl-2,7-dihydro-pyrazolo[4,3-c]pyridine-4,6-dione hydrate","Crystal Structure Report Archive","2007","","","353","","","","","0.71073","MoKα","","0.0423","0.0349","","","0.0879","0.0937","","","","","","1.048","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519792","7.8484","0.0006","8.3983","0.0007","24.1255","0.0018","90","","90","","90","","1590.2","0.2","120","2","120","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C9 H10 O3 -","- C9 H10 O3 -","- C72 H80 O24 -","8","2","","Huth, Susanne L.; Hursthouse, Michael B.","2,3-Dihydro-1,4-benzodioxin-5-ylmethanol","Crystal Structure Report Archive","2007","","","375","","","","","0.71073","MoKα","","0.1106","0.0938","","","0.2549","0.2736","","","","","","1.123","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519793","9.8821","0.0004","10.9251","0.0005","7.1627","0.0003","90","","90","","90","","773.31","0.06","120","2","120","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C9 H10 N2 -","- C9 H10 N2 -","- C36 H40 N8 -","4","1","","Huth, Susanne L.; Hursthouse, Michael B.","1-Methyl-1H-indole-5-amine","Crystal Structure Report Archive","2007","","","376","","","","","0.71073","MoKα","","0.0414","0.0371","","","0.0982","0.1028","","","","","","0.931","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519794","5.1078","0.0004","5.8535","0.0005","16.0142","0.0014","90","","90.624","0.005","90","","478.77","0.07","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C5 H4 O3 -","- C5 H4 O3 -","- C20 H16 O12 -","4","1","","Huth, Susanne L.; Hursthouse, Michael B.","3-Furoic acid - C5H4O3","Crystal Structure Report Archive","2007","","","377","","","","","0.71073","MoKα","","0.0689","0.0407","","","0.0939","0.1048","","","","","","1.037","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519795","9.2976","0.0002","27.3184","0.0005","8.7746","0.0002","90","","107.834","0.001","90","","2121.62","0.08","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H18 Cl Mo N3 O3 -","- C23 H18 Cl Mo N3 O3 -","- C92 H72 Cl4 Mo4 N12 O12 -","4","1","","Hodson, Annabelle; Stephenson, Richard A.; Hursthouse, Michael B.","C23H18Cl1Mo1N3O3","Crystal Structure Report Archive","2007","","","381","","","","","0.71073","MoKα","","0.052","0.0461","","","0.0953","0.0982","","","","","","1.201","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519796","6.6318","0.0003","9.4254","0.0004","12.0872","0.0004","112.574","0.002","90.804","0.002","96.144","0.002","692.39","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H14 N4 O3 S -","- C14 H14 N4 O3 S -","- C28 H28 N8 O6 S2 -","2","1","","Collins, Ian; Horton, Peter N.; Hursthouse, Michael B.","3-Amino-6-methyl-2-(toluene-4-sulfonyl)-2,5-dihydro-pyrazolo[4,3-c]pyridin- 4-one","Crystal Structure Report Archive","2007","","","439","","","","","0.71073","MoKα","","0.0785","0.0572","","","0.1083","0.1203","","","","","","1.076","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519797","11.9613","0.0005","6.6856","0.0002","13.445","0.0004","90","","106.263","0.002","90","","1032.15","0.06","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H14 N2 O -","- C11 H14 N2 O -","- C44 H56 N8 O4 -","4","1","","Harrison, W. T. A.; Male, Louise; Hursthouse, Michael B.","C11H14N2O","Crystal Structure Report Archive","2007","","","337","","","","","0.71073","MoKα","","0.0804","0.0617","","","0.1321","0.146","","","","","","1.049","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519798","13.2503","0.0003","6.9083","0.0002","16.9813","0.0005","90","","102.287","0.002","90","","1518.81","0.07","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H8 Br2 O2 S2 -","- C14 H8 Br2 O2 S2 -","- C56 H32 Br8 O8 S8 -","4","1","","Skabara, P.J.; Coles, Simon J.; Hursthouse, Michael B.","2-(5-Bromo-4H-1,4-thiophen-2 -ylmethylene)-3-(5-bromo-thiophen-2-ylmethylene)- succinaldehyde","Crystal Structure Report Archive","2007","","","342","","","","","0.71073","MoKα","","0.0495","0.0341","","","0.0648","0.0697","","","","","","1.062","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519799","5.1231","0.0002","8.7759","0.0003","9.2683","0.0003","62.246","0.002","75.259","0.002","82.642","0.002","356.6","0.02","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H5 N O5 -","- C7 H5 N O5 -","- C14 H10 N2 O10 -","2","1","","Montis, Riccardo; Cridlin, Rachel; Horton, Peter N.; Male, Louise","2-Hydroxy-5-Nitrobenzoic Acid","Crystal Structure Report Archive","2007","","","343","","","","","0.71073","MoKα","","0.0443","0.0388","","","0.1011","0.1055","","","","","","1.046","","","","has coordinates","137101","2020-10-21","18:00:00",""
"1519800","3.9766","0.0003","16.1062","0.0013","11.5115","0.0009","90","","90.407","0.005","90","","737.27","0.1","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 O4 -","- C8 H8 O4 -","- C32 H32 O16 -","4","1","","Montis, Riccardo; Hook, Callum S.; Horton, Peter N.; Hursthouse, Michael B.","2-Hydroxy-5-Methoxybenzoic acid","Crystal Structure Report Archive","2007","","","344","","","","","0.71073","MoKα","","0.084","0.0511","","","0.1165","0.1333","","","","","","1.022","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519801","9.7504","0.0003","10.2281","0.0003","14.053","0.0005","95.766","0.002","107.842","0.002","96.617","0.002","1311.46","0.08","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H11 N O -","- C11 H11 N O -","- C66 H66 N6 O6 -","6","3","","Spencer, John; Male, Louise; Hursthouse, Michael B.","C11H11N1O1","Crystal Structure Report Archive","2007","","","348","","","","","0.71073","MoKα","","0.1204","0.0788","","","0.1445","0.1681","","","","","","1.078","","","","has coordinates","137103","2020-10-21","18:00:00",""
"1519802","5.3732","0.0001","13.4962","0.0004","15.8088","0.0005","95.389","0.001","98.498","0.002","101.201","0.002","1103.32","0.05","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H15 N O -","- C14 H15 N O -","- C56 H60 N4 O4 -","4","2","","Spencer, John; Male, Louise; Hursthouse, Michael B.","C14H15NO","Crystal Structure Report Archive","2007","","","351","","","","","0.71073","MoKα","","0.094","0.066","","","0.121","0.136","","","","","","1.066","","","","has coordinates","137104","2020-10-21","18:00:00",""
"1519803","8.2907","0.0001","8.9556","0.0001","15.0072","0.0001","95.402","0.001","95.11","0.001","101.334","0.001","1081.05","0.02","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C3 H6 Cl9 N7 O P6 -","- C3 H6 Cl9 N7 O P6 -","- C6 H12 Cl18 N14 O2 P12 -","2","1","","Kilic, A.; Besli, S.; Coles, Simon J.","C3H6Cl9N7OP6","Crystal Structure Report Archive","2007","","","352","","","","","0.71073","MoKα","","0.0233","0.0206","","","0.0642","0.0747","","","","","","1.235","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519804","7.3989","0.0003","11.2007","0.0004","20.2402","0.0007","90","","90","","90","","1677.36","0.11","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H9 N O2 -","- C10 H9 N O2 -","- C80 H72 N8 O16 -","8","2","","Huth, Susanne L.; Hursthouse, Michael B.","1-Methyl-1H-indole-6-carboxylic acid","Crystal Structure Report Archive","2007","","","368","","","","","0.71073","MoKα","","0.0678","0.0465","","","0.1091","0.1212","","","","","","1.05","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519805","14.2845","0.0008","5.4226","0.0002","22.7593","0.0014","90","","90","","90","","1762.92","0.16","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H9 N O S -","- C10 H9 N O S -","- C80 H72 N8 O8 S8 -","8","1","","Huth, Susanne L.; Hursthouse, Michael B.","(6-Thien-2-ylpyrid-3-yl)methanol","Crystal Structure Report Archive","2007","","","373","","","","","0.71073","MoKα","","0.2077","0.1062","","","0.1572","0.1995","","","","","","1.179","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519806","13.0538","0.0003","15.5288","0.0003","19.1088","0.0004","90","","90","","90","","3873.54","0.14","120","2","120","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C20 H30 Cl N O2 S -","- C20 H30 Cl N O2 S -","- C160 H240 Cl8 N8 O16 S8 -","8","1","","Stephenson, Richard A; Dobbs, Adrian; Hursthouse, Michael B.","C20H30Cl1N1O2S1","Crystal Structure Report Archive","2007","","","388","","","","","0.71073","MoKα","","0.055","0.0406","","","0.1017","0.1096","","","","","","1.025","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519807","8.2012","0.0001","9.0665","0.0001","12.8131","0.0001","83.344","0.001","84.013","0.001","72.53","0.001","900.23","0.017","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H18 Cl4 N3 O2 P3 -","- C9 H18 Cl4 N3 O2 P3 -","- C18 H36 Cl8 N6 O4 P6 -","2","1","","Kilic, A.; Besli, S.; Coles, Simon J.; Hursthouse, Michael B.","C9H18Cl4N3O2P3","Crystal Structure Report Archive","2007","","","318","","","","","0.71073","MoKα","","0.0256","0.0235","","","0.0614","0.063","","","","","","1.064","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519808","10.7229","0.0001","10.2395","0.0001","20.153","0.0002","90","","92.7121","0.0007","90","","2210.26","0.04","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H28 N2 O2 Si2 -","- C21 H28 N2 O2 Si2 -","- C84 H112 N8 O8 Si8 -","4","1","","Taylor, P. G.; Male, Louise; Hursthouse, Michael B.","C21H28N2O2Si2","Crystal Structure Report Archive","2007","","","333","","","","","0.71073","MoKα","","0.038","0.0338","","","0.0839","0.0874","","","","","","1.063","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519809","8.8971","0.0004","9.597","0.0004","9.8882","0.0003","64.918","0.002","81.546","0.002","68.435","0.002","711.13","0.05","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H48 N8 O6 -","- C22 H48 N8 O6 -","- C22 H48 N8 O6 -","1","0.5","","Taylor, P. G.; Male, Louise; Hursthouse, Michael B.","C20H40N8O4 . 2(CH4O)","Crystal Structure Report Archive","2007","","","334","","","","","0.71073","MoKα","","0.087","0.0618","","","0.1183","0.1332","","","","","","1.076","","","","has coordinates","137111","2020-10-21","18:00:00",""
"1519810","11.9359","0.0003","17.2845","0.0005","21.4406","0.0006","90","","92.581","0.002","90","","4418.8","0.2","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H67 B Cl3 D Fe N2 -","- C46 H68 B Cl3 Fe N2 -","- C184 H272 B4 Cl12 Fe4 N8 -","4","1","","Aldridge, Simon; Male, Louise; Hursthouse, Michael B.","(C29H31BFeN) . (C16H36N) . (CDCl3)","Crystal Structure Report Archive","2007","","","338","","","","","0.71073","MoKα","","0.144","0.0815","","","0.1343","0.1617","","","","","","1.148","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519811","7.8204","0.0002","19.1689","0.0006","11.3839","0.0003","90","","100.727","0.002","90","","1676.72","0.08","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H20 Cl Fe N O3 -","- C17 H20 Cl Fe N O3 -","- C68 H80 Cl4 Fe4 N4 O12 -","4","1","","Connell, Arthur; Holliman, Peter J.; Male, Louise; Hursthouse, Michael B.","C17H20ClFeNO3","Crystal Structure Report Archive","2007","","","340","","","","","0.71073","MoKα","","0.063","0.0437","","","0.1034","0.1133","","","","","","1.061","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519812","6.5148","0.0003","11.4581","0.0005","6.8511","0.0002","90","","111.601","0.002","90","","475.5","0.03","120","2","120","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C12 H8 Fe N2 -","- C12 H8 Fe N2 -","- C24 H16 Fe2 N4 -","2","0.5","","Connell, Arthur; Holliman, Peter J.; Male, Louise; Hursthouse, Michael B.","C12H8FeN2","Crystal Structure Report Archive","2007","","","341","","","","","0.71073","MoKα","","0.0518","0.047","","","0.1137","0.1295","","","","","","1.393","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519813","6.5384","0.0009","7.6439","0.001","18.418","0.003","90","","90","","90","","920.5","0.2","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H12 N2 O -","- C11 H12 N2 O -","- C44 H48 N8 O4 -","4","1","","Huth, Susanne L.; Hursthouse, Michael B.","(1-Methyl-3-phenyl-1H-pyrazol-5-yl)methanol","Crystal Structure Report Archive","2007","","","364","","","","","0.71073","MoKα","","0.1113","0.0608","","","0.1241","0.142","","","","","","1.011","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519814","22.5496","0.0004","22.5496","0.0004","6.3581","0.0002","90","","90","","90","","3233","0.13","120","2","120","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C9 H10 O3 -","- C9 H10 O3 -","- C144 H160 O48 -","16","1","","Huth, Susanne L.; Hursthouse, Michael B.","2-Hydroxymethyl-1,4-benzodioxan","Crystal Structure Report Archive","2007","","","365","","","","","0.71073","MoKα","","0.072","0.0467","","","0.1089","0.1221","","","","","","1.052","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519815","20.4199","0.0005","9.0684","0.0004","13.7141","0.0003","90","","132.07","0.001","90","","1885.15","0.11","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H9 N3 O2 -","- C10 H9 N3 O2 -","- C80 H72 N24 O16 -","8","1","","Huth, Susanne L.; Hursthouse, Michael B.","2-(1H-1,2,4-Triazol-1-ylmethyl)benzoic acid","Crystal Structure Report Archive","2007","","","366","","","","","0.71073","MoKα","","0.0721","0.0495","","","0.0927","0.1052","","","","","","1.086","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519816","10.0846","0.0003","10.4718","0.0003","10.9149","0.0003","106.718","0.001","111.473","0.002","95.603","0.002","1000.33","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C6 H7 N O S -","- C6 H7 N O S -","- C36 H42 N6 O6 S6 -","6","3","","Huth, Susanne L.; Hursthouse, Michael B.","4-Methylthiophene-2-carboxamide","Crystal Structure Report Archive","2007","","","374","","","","","0.71073","MoKα","","0.0943","0.0699","","","0.1732","0.196","","","","","","1.126","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519817","11.9582","0.0002","23.1506","0.0003","23.5489","0.0004","79.225","0.001","82.965","0.001","75.447","0.001","6179.27","0.17","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H90 Cl4 N8 O4 -","- C58 H90 Cl4 N8 O4 -","- C232 H360 Cl16 N32 O16 -","4","2","","Navakhun, K.; Gale, Phil A.; Coles, Simon J.; Hursthouse, Michael B.","Ethyl-bis-(3,4-dichloro-5-phenylcarbamoyl-1H-pyrrole-2-carboxylic acid amide). tetrabutylammonium","Crystal Structure Report Archive","2007","","","316","","","","","0.71073","MoKα","","0.1288","0.0701","","","0.171","0.2074","","","","","","1.013","","","","has coordinates,has disorder","216710","2020-10-21","18:00:00",""
"1519818","11.4593","0.0002","16.8538","0.0002","19.0612","0.0002","90","","90","","90","","3681.34","0.09","120","2","120","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C9 H18 Cl4 N3 O2 P3 -","- C9 H18 Cl4 N3 O2 P3 -","- C72 H144 Cl32 N24 O16 P24 -","8","1","","Kilic, A.; Besli, S.; Coles, Simon J.; Hursthouse, Michael B.","C9H18Cl4N3O2P3","Crystal Structure Report Archive","2007","","","317","","","","","0.71073","MoKα","","0.0383","0.031","","","0.0779","0.0821","","","","","","1.053","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519819","8.34","0.0002","10.7116","0.0002","11.0362","0.0003","107.886","0.001","96.645","0.001","99.433","0.002","910.99","0.04","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 N O4 P -","- C18 H22 N O4 P -","- C36 H44 N2 O8 P2 -","2","1","","Tomkinson, N; Coles, Simon J.; Hursthouse, Michael B.","C18H22NO4P","Crystal Structure Report Archive","2007","","","321","","","","","0.71073","MoKα","","0.0426","0.035","","","0.0859","0.0899","","","","","","1.04","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519820","19.6704","0.0007","4.7195","0.0002","14.9893","0.0005","90","","112.153","0.002","90","","1288.8","0.09","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H11 Br O4 -","- C14 H11 Br O4 -","- C56 H44 Br4 O16 -","4","1","","Jones, Ray; Stephenson, Richard; Hursthouse, Michael B.","ethyl(3-bromo-1,4-dioxo-1,4-dihydronaphthalen-2-yl)acetate","Crystal Structure Report Archive","2007","","","322","","","","","0.71073","MoKα","","0.0625","0.0444","","","0.0828","0.0918","","","","","","1.133","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519821","9.3182","0.0001","15.1558","0.0002","18.9653","0.0002","90","","99.587","0.001","90","","2640.96","0.05","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H31 B N2 O2 -","- C32 H31 B N2 O2 -","- C128 H124 B4 N8 O8 -","4","1","","Tomkinson, N.; Coles, Simon J.; Hursthouse, Michael B.","C32H31BN2O2","Crystal Structure Report Archive","2007","","","323","","","","","0.71073","MoKα","","0.0522","0.0406","","","0.0944","0.1008","","","","","","1.031","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519822","10.6315","0.0002","12.0869","0.0002","15.6257","0.0003","90","","101.585","0.001","90","","1967.03","0.06","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H22 Cl4 N3 O2 P3 -","- C11 H22 Cl4 N3 O2 P3 -","- C44 H88 Cl16 N12 O8 P12 -","4","1","","Kilic, A.; Besli, S.; Coles, Simon J.; Hursthouse, Michael B.","C11H22Cl4N3O2P3","Crystal Structure Report Archive","2007","","","324","","","","","0.71073","MoKα","","0.036","0.0284","","","0.0667","0.0705","","","","","","1.037","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519823","15.4076","0.0003","12.9924","0.0004","9.38","0.0003","90","","90","","90","","1877.7","0.09","120","2","120","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C19 H28 Cl N O2 S -","- C19 H28 Cl N O2 S -","- C76 H112 Cl4 N4 O8 S4 -","4","1","","Fry, F. H.; Male, Louise; Hursthouse, Michael B.","C19H28ClNO2S","Crystal Structure Report Archive","2007","","","332","","","","","0.71073","MoKα","","0.0743","0.0699","","","0.1726","0.1761","","","","","","1.074","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519824","22.2448","0.0016","5.1191","0.0002","15.6074","0.001","90","","95.838","0.003","90","","1768.05","0.18","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C11 H8 O3 -","- C11 H8 O3 -","- C88 H64 O24 -","8","1","","Huth, Susanne L.; Hursthouse, Michael B.","3-(2-Furyl)benzoic acid","Crystal Structure Report Archive","2007","","","367","","","","","0.71073","MoKα","","0.1063","0.0581","","","0.1186","0.1359","","","","","","1.056","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519825","6.2391","0.0002","13.8231","0.0005","6.4019","0.0002","90","","96.887","0.002","90","","548.14","0.03","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H5 N O3 -","- C5 H5 N O3 -","- C20 H20 N4 O12 -","4","1","","Huth, Susanne L.; Hursthouse, Michael B.","3-Methylisoxazole-5-carboxylic acid","Crystal Structure Report Archive","2007","","","370","","","","","0.71073","MoKα","","0.0461","0.0424","","","0.112","0.1153","","","","","","1.203","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519826","11.2506","0.0004","7.8725","0.0004","10.5817","0.0004","90","","115.098","0.002","90","","848.74","0.06","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 N O5 -","- C8 H7 N O5 -","- C32 H28 N4 O20 -","4","1","","Huth, Susanne L.; Hursthouse, Michael B.","5-(2-Furyl)isoxazole-3-carboxylic acid","Crystal Structure Report Archive","2007","","","372","","","","","0.71073","MoKα","","0.1231","0.0724","","","0.1192","0.1428","","","","","","1.115","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519827","18.0459","0.0005","16.968","0.0005","9.5823","0.0001","90","","97.198","0.002","90","","2911","0.12","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H16 F6 N P -","- C13 H16 F6 N P -","- C104 H128 F48 N8 P8 -","8","2","","Tomkinson, N.; Coles, Simon J.; Hursthouse, Michael B.; Coles, Simon J.","1-((E)-3-Phenyl-propenyl)-pyrrolidine","Crystal Structure Report Archive","2007","","","307","","","","","0.71073","MoKα","","0.0825","0.0552","","","0.1405","0.1583","","","","","","1.04","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"1519828","11.756","0.0004","15.6189","0.0003","18.4464","0.0006","90","","90","","90","","3387.05","0.17","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C13 H19 F6 N2 O P -","- C13 H19 F6 N2 O P -","- C104 H152 F48 N16 O8 P8 -","8","2","","Tomkinson, N.; Coles, Simon J.; Hursthouse, Michael B.","5-Benzyl-2,2,3-trimethyl-imidazolidin-4-one","Crystal Structure Report Archive","2007","","","308","","","","","0.71073","MoKα","","0.1229","0.0549","","","0.1265","0.1542","","","","","","1.011","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519829","11.4892","0.0001","11.4892","0.0001","16.7646","0.0003","90","","90","","90","","2212.96","0.05","120","2","120","2","","","","","","","","6","P 41","P 4w","76","","","","- C18 H24 N5 O2 P3 S2 -","- C18 H24 N5 O2 P3 S2 -","- C72 H96 N20 O8 P12 S8 -","4","1","","Besli, S.; Kilic, A.; Davies, David B.; Coles, Simon J.; Hursthouse, Michael B.","C18H24N5O2P3S2","Crystal Structure Report Archive","2007","","","312","","","","","0.71073","MoKα","","0.0299","0.0279","","","0.0572","0.0583","","","","","","1.046","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519830","21.5033","0.0015","6.2034","0.0004","19.1972","0.0013","90","","114.465","0.007","90","","2330.9","0.3","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C27 H29 N O4 -","- C27 H29 N O4 -","- C108 H116 N4 O16 -","4","0.5","","Cheesewright, J.E.; Grossel, M.G.; Grossel, M.C.; Hursthouse, Michael B.; Coles, Simon J.","Bis(2,4,6trimethybenzyl)pyridine-2,6-dicarboxylate","Crystal Structure Report Archive","2007","","","313","","","","","0.71073","MoKα","","0.155","0.1161","","","0.3106","0.3358","","","","","","1.044","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519831","3.8278","0.0002","18.905","0.0012","10.8874","0.0006","90","","95.649","0.004","90","","784.04","0.08","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H4 Cl2 N2 -","- C8 H4 Cl2 N2 -","- C32 H16 Cl8 N8 -","4","0.5","","Coles, Simon J.; Hursthouse, Michael B.","2,3-Dichloro-quinoxaline","Crystal Structure Report Archive","2007","","","314","","","","","0.71073","MoKα","","0.0311","0.0279","","","0.0693","0.0717","","","","","","1.098","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519832","11.9582","0.0002","23.1506","0.0003","23.5489","0.0004","79.225","0.001","82.965","0.001","75.447","0.001","6179.27","0.17","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H90 Cl4 N8 O4 -","- C58 H90 Cl4 N8 O4 -","- C232 H360 Cl16 N32 O16 -","4","2","","Navakhun, K.; Gale, Phil A.; Coles, Simon J.; Hursthouse, Michael B.","Ethyl-bis-(3,4-dichloro-5-phenylcarbamoyl-1H-pyrrole-2-carboxylic acid amide). tetrabutylammonium","Crystal Structure Report Archive","2007","","","325","","","","","0.71073","MoKα","","0.1288","0.0701","","","0.171","0.2074","","","","","","1.013","","","","has coordinates,has disorder","216710","2020-10-21","18:00:00",""
"1519833","11.9582","0.0002","23.1506","0.0003","23.5489","0.0004","79.225","0.001","82.965","0.001","75.447","0.001","6179.27","0.17","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H90 Cl4 N8 O4 -","- C58 H90 Cl4 N8 O4 -","- C232 H360 Cl16 N32 O16 -","4","2","","Navakhun, K.; Gale, Phil A.; Coles, Simon J.; Hursthouse, Michael B.","Ethyl-bis-(3,4-dichloro-5-phenylcarbamoyl-1H-pyrrole-2-carboxylic acid amide). tetrabutylammonium","Crystal Structure Report Archive","2007","","","326","","","","","0.71073","MoKα","","0.1288","0.0701","","","0.171","0.2074","","","","","","1.013","","","","has coordinates,has disorder","216710","2020-10-21","18:00:00",""
"1519834","9.3955","0.0005","4.8267","0.0002","10.9702","0.0005","90","","104.999","0.003","90","","480.54","0.04","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C9 H12 N4 O -","- C9 H12 N4 O -","- C18 H24 N8 O2 -","2","1","","Huth, Susanne L.; Hursthouse, Michael B.; Withnell, James","2-(1H-1,2,4-Triazol-1-ylmethyl)aniline","Crystal Structure Report Archive","2007","","","363","","","","","0.71073","MoKα","","0.0755","0.0553","","","0.0988","0.1107","","","","","","1.133","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519835","15.3278","0.0004","4.3325","0.0002","15.1614","0.0005","90","","108.576","0.002","90","","954.38","0.06","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 Cl N O S -","- C10 H8 Cl N O S -","- C40 H32 Cl4 N4 O4 S4 -","4","1","","Huth, Susanne L.; Hursthouse, Michael B.","[2-(3-Chlorophenyl)-1,3-thiazol-4-yl]methanol","Crystal Structure Report Archive","2007","","","369","","","","","0.71073","MoKα","","0.0884","0.0623","","","0.1272","0.1425","","","","","","1.112","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519836","8.1628","0.0003","7.9648","0.0003","11.0496","0.0004","90","","95.23","0.002","90","","715.4","0.05","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H5 N O3 -","- C8 H5 N O3 -","- C32 H20 N4 O12 -","4","1","","Huth, Susanne L.; Hursthouse, Michael B.","[5-(2-Furyl)isoxazole-3-yl]methylamine","Crystal Structure Report Archive","2007","","","371","","","","","0.71073","MoKα","","0.043","0.0377","","","0.0923","0.0978","","","","","","1.085","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519837","11.0751","0.0002","4.9441","0.0001","22.847","0.0005","90","","97.556","0.001","90","","1240.16","0.04","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H12 N2 O4 -","- C13 H12 N2 O4 -","- C52 H48 N8 O16 -","4","1","","Berry, D.; Blagden, N.; Coles, Simon J.; Hursthouse, Michael B.; Coles, Simon J.","2-Hydroxy-benzoic acid nicotinamide","Crystal Structure Report Archive","2007","","","295","","","","","0.71073","MoKα","","0.0652","0.0461","","","0.1109","0.1226","","","","","","1.03","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519838","15.5139","0.0003","5.632","0.0001","18.7366","0.0004","90","","93.038","0.001","90","","1634.8","0.06","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H18 O2 -","- C22 H18 O2 -","- C88 H72 O8 -","4","1","","Knight, D.W.; Coles, Simon J.; Hursthouse, Michael B.; Coles, Simon J.","1,2,4-Triphenyl-but-3-yne-1,2-diol","Crystal Structure Report Archive","2007","","","296","","","","","0.71073","MoKα","","0.0879","0.0598","","","0.1408","0.1548","","","","","","1.124","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519839","13.3686","0.0005","10.4704","0.0004","8.7799","0.0003","90","","90","","90","","1228.96","0.08","120","2","120","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C3 H6 Cl4 N3 O2 P3 -","- C3 H6 Cl4 N3 O2 P3 -","- C12 H24 Cl16 N12 O8 P12 -","4","1","","Uslu, A.; Odlyha, M.; Kilic, A.; Shaw, R.A.; Davies, David B.; Light, Mark E.; Huth, Susanne. L.; Coles, Simon J.; Rutherford, J.S.; Hursthouse, Michael B.","2,2-trimethylenedioxy-4,4,6,6-tetrachlorocyclotriphosphazene","Crystal Structure Report Archive","2007","","","299","","","","","0.71073","MoKα","","0.0286","0.0253","","","0.0567","0.0579","","","","","","1.057","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519840","13.4804","0.0014","10.6442","0.0009","8.8479","0.0007","90","","90","","90","","1269.6","0.2","274","2","274","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C3 H6 Cl4 N3 O2 P3 -","- C3 H6 Cl4 N3 O2 P3 -","- C12 H24 Cl16 N12 O8 P12 -","4","1","","Kilic, A.; Odlyha, M.; Uslu, A.; Davies, David B.; Shaw, R.A.; Light, Mark E.; Coles, Simon J.; Huth, Susanne. L.; Hursthouse, Michael B.; Rutherford, J.S.","2,2-trimethylenedioxy-4,4,6,6-tetrachlorocyclotriphosphazene","Crystal Structure Report Archive","2007","","","300","","","","","0.71073","MoKα","","0.038","0.0334","","","0.0871","0.0905","","","","","","1.047","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519841","10.666","0.002","13.489","0.003","8.8593","0.0018","90","","90","","90","","1274.6","0.5","294","2","293","2","","","","","","","","6","C m c 21","C 2c -2","36","","","","- C3 H6 Cl4 N3 O2 P3 -","- C3 H6 Cl4 N3 O2 P3 -","- C12 H24 Cl16 N12 O8 P12 -","4","0.5","","Uslu, A.; Odlyha, M.; Kilic, A.; Shaw, R.A.; Davies, David B.; Light, Mark E.; Huth, Susanne. L.; Coles, Simon J.; Rutherford, J.S.; Hursthouse, Michael B.","2,2-trimethylenedioxy-4,4,6,6-tetrachlorocyclotriphosphazene","Crystal Structure Report Archive","2007","","","301","","","","","0.71073","MoKα","","0.0479","0.0366","","","0.0877","0.0933","","","","","","1.047","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519842","9.4791","0.0002","10.2283","0.0002","11.4144","0.0003","88.423","0.002","78.172","0.002","79.694","0.002","1065.66","0.04","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H25 Cl3 N5 P3 -","- C16 H25 Cl3 N5 P3 -","- C32 H50 Cl6 N10 P6 -","2","1","","Shaw, R.A.; Davies, David B.; Coles, Simon J.","C16H25Cl3N5P3","Crystal Structure Report Archive","2007","","","305","","","","","0.71073","MoKα","","0.0368","0.0316","","","0.0787","0.0818","","","","","","1.05","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519843","7.1493","0.0001","18.6099","0.0006","8.8649","0.0002","90","","113.221","0.002","90","","1083.91","0.05","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H26 Cl2 N2 O3 Si2 -","- C16 H26 Cl2 N2 O3 Si2 -","- C32 H52 Cl4 N4 O6 Si4 -","2","0.5","","Taylor, P. G.; Male, Louise; Hursthouse, Michael B.","C16H26Cl2N2O3Si2","Crystal Structure Report Archive","2007","","","330","","","","","0.71073","MoKα","","0.0499","0.0435","","","0.1141","0.1266","","","","","","1.279","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519844","9.2979","0.0005","18.4632","0.0008","18.9798","0.0009","90","","99.325","0.003","90","","3215.2","0.3","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H41 Ga I3 Mo O2 P -","- C27 H41 Ga I3 Mo O2 P -","- C108 H164 Ga4 I12 Mo4 O8 P4 -","4","1","","Aldridge, Simon; Male, Louise; Hursthouse, Michael B.","(C18H34P) . (C9H7GaI3MoO2)","Crystal Structure Report Archive","2007","","","339","","","","","0.71073","MoKα","","0.0947","0.0731","","","0.1836","0.2047","","","","","","1.077","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519845","8.1461","0.0003","5.973","0.0002","9.5815","0.0003","90","","100.94","0.002","90","","457.73","0.03","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H12 N2 O2 -","- C10 H12 N2 O2 -","- C20 H24 N4 O4 -","2","1","","Huth, Susanne L.; Hursthouse, Michael B.; Withnell, James","6-Morpholinopyridine-2-carbaldehyde","Crystal Structure Report Archive","2007","","","355","","","","","0.71073","MoKα","","0.0355","0.0331","","","0.0779","0.0801","","","","","","1.124","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519846","8.7992","0.0003","9.0108","0.0002","9.3873","0.0003","73.957","0.002","78.099","0.002","63.845","0.002","638.99","0.04","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C4 H14 B5 N O11 -","- C4 H14 B5 N O11 -","- C8 H28 B10 N2 O22 -","2","1","","Beckett, Michael A.; Horton, Peter N.; Hursthouse, Michael B.","C4H14B5NO11","Crystal Structure Report Archive","2007","","","427","","","","","0.71073","MoKα","","0.0457","0.0385","","","0.0817","0.0865","","","","","","1.066","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519856","11.5009","0.0001","11.5009","0.0001","16.7834","0.0001","90","","90","","90","","2219.95","0.03","120","2","120","2","","","","","","","","6","P 43","P 4cw","78","","","","- C18 H24 N5 O2 P3 S2 -","- C18 H24 N5 O2 P3 S2 -","- C72 H96 N20 O8 P12 S8 -","4","1","","Besli, S.; Kilic, A.; Davies, David B.; Coles, Simon J.; Coles, Simon J.; Hursthouse, Michael B.","C18H24N5O2P3S2","Crystal Structure Report Archive","2007","","","286","","","","","0.71073","MoKα","","0.0231","0.0218","","","0.0533","0.0539","","","","","","1.033","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519857","15.8005","0.0006","5.1763","0.0001","16.9786","0.0006","90","","99.723","0.002","90","","1368.7","0.08","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H13 N O5 S -","- C13 H13 N O5 S -","- C52 H52 N4 O20 S4 -","4","1","","McDonald, E.; Horton, Peter N.; Hursthouse, Michael B.","((E)-2-Benzenesulfonyl-2-cyano-vinyloxy)-acetic acid ethyl ester","Crystal Structure Report Archive","2007","","","288","","","","","0.71073","MoKα","","0.0722","0.0566","","","0.107","0.1168","","","","","","1.094","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519858","10.6006","0.0006","9.5629","0.0004","19.5682","0.0011","90","","91.038","0.002","90","","1983.35","0.18","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 N5 O2 P3 -","- C18 H24 N5 O2 P3 -","- C72 H96 N20 O8 P12 -","4","1","","Davies, David B.; Besli, S.; Kilic, A.; Coles, Simon J.; Hursthouse, Michael B.","C18H24N5O2P3","Crystal Structure Report Archive","2007","","","289","","","","","0.71073","MoKα","","0.0947","0.0749","","","0.1747","0.1925","","","","","","1.092","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519859","7.8088","0.0004","7.3343","0.0002","13.411","0.0007","90","","104.984","0.002","90","","741.96","0.06","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H8 N4 O2 -","- C7 H8 N4 O2 -","- C28 H32 N16 O8 -","4","1","","McDonald, E.; Horton, Peter N.; Hursthouse, Michael B.","3-Amino-2-methyl-2,7-dihydro-pyrazolo[4,3-c]pyridine-4,6-dione","Crystal Structure Report Archive","2007","","","290","","","","","0.71073","MoKα","","0.0799","0.0608","","","0.1167","0.1287","","","","","","1.105","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519860","18.5797","0.0005","10.6257","0.0003","8.3867","0.0001","90","","98.718","0.002","90","","1636.59","0.07","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 F9 N P -","- C14 H15 F9 N P -","- C56 H60 F36 N4 P4 -","4","1","","Tomkinson, N.; Coles, Simon J.; Hursthouse, Michael B.; Coles, Simon J.","C14H15NF3 . PF6","Crystal Structure Report Archive","2007","","","297","","","","","0.71073","MoKα","","0.053","0.0395","","","0.0978","0.1047","","","","","","1.047","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519861","9.7832","0.0002","10.042","0.0002","11.5984","0.0002","90","","109.228","0.001","90","","1075.9","0.04","120","2","120","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C18 H25 Cl N5 O2 P3 -","- C18 H25 Cl N5 O2 P3 -","- C36 H50 Cl2 N10 O4 P6 -","2","1","","Besli, S.; Kilic, A.; Davies, David B.; Coles, Simon J.; Coles, Simon J.; Hursthouse, Michael B.","C18H25ClN5O2P3","Crystal Structure Report Archive","2007","","","298","","","","","0.71073","MoKα","","0.0348","0.034","","","0.1002","0.1012","","","","","","1.018","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"1519862","9.4197","0.0001","9.4197","0.0001","42.348","0.0009","90","","90","","90","","3757.57","0.1","120","2","120","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C15 H17 Cl2 N4 O P3 -","- C15 H17 Cl2 N4 O P3 -","- C120 H136 Cl16 N32 O8 P24 -","8","1","","Besli, S.; Kilic, A.; Davies, David B.; Coles, Simon J.; Hursthouse, Michael B.","C15H17Cl2N4OP3","Crystal Structure Report Archive","2007","","","302","","","","","0.71073","MoKα","","0.0886","0.0563","","","0.1448","0.1695","","","","","","1.109","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519863","14.6358","0.0002","16.3497","0.0002","12.3448","0.0001","90","","107.455","0.001","90","","2817.98","0.06","120","2","120","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C12 H12 Cl8 N8 O P6 -","- C12 H12 Cl8 N8 O P6 -","- C48 H48 Cl32 N32 O4 P24 -","4","1","","Besli, S.; Kilic, A.; Davies, David B.; Coles, Simon J.; Hursthouse, Michael B.","C12H12Cl8N8OP6","Crystal Structure Report Archive","2007","","","303","","","","","0.71073","MoKα","","0.0332","0.0303","","","0.0662","0.0675","","","","","","1.034","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519864","8.6518","0.0001","11.3633","0.0001","16.0178","0.0002","90","","102.006","0.001","90","","1540.31","0.03","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H26 Cl8 N8 P6 -","- C12 H26 Cl8 N8 P6 -","- C24 H52 Cl16 N16 P12 -","2","0.5","","Besli, S.; Kilic, A.; Davies, David B.; Coles, Simon J.; Hursthouse, Michael B.","C12H26Cl8N8P6","Crystal Structure Report Archive","2007","","","304","","","","","0.71073","MoKα","","0.0321","0.0284","","","0.0705","0.0726","","","","","","1.07","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519865","7.2319","0.0001","11.072","0.0003","18.1646","0.0005","90","","90","","90","","1454.47","0.06","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H21 N O2 Si -","- C13 H21 N O2 Si -","- C52 H84 N4 O8 Si4 -","4","1","","Taylor, P. G.; Male, Louise; Hursthouse, Michael B.","C13H21NO2Si","Crystal Structure Report Archive","2007","","","331","","","","","0.71073","MoKα","","0.0492","0.0457","","","0.1094","0.1123","","","","","","1.261","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519866","9.0231","0.0006","9.1863","0.0006","12.5757","0.0009","106.174","0.004","97.221","0.004","110.245","0.004","910.31","0.12","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H25 N3 O5 -","- C14 H25 N3 O5 -","- C28 H50 N6 O10 -","2","1","","Murphy, P J.; Stephenson, Richard; Hursthouse, Michael B.","{(2E,4R)-2-[(tert-butoxycarbonyl)imino]imidazolidin-4-yl}methyl tert-butyl carbonate","Crystal Structure Report Archive","2007","","","259","","","","","0.71073","MoKα","","0.1405","0.0883","","","0.1374","0.1583","","","","","","1.145","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519867","11.4912","0.0001","11.4912","0.0001","16.789","0.0002","90","","90","","90","","2216.95","0.04","120","2","120","2","","","","","","","","6","P 41","P 4w","76","","","","- C18 H24 N5 O2 P3 S2 -","- C18 H24 N5 O2 P3 S2 -","- C72 H96 N20 O8 P12 S8 -","4","1","","Shaw, R. A.; Davies, David B.; Kilic, A.; Yesilot, S.; Coles, Simon J.; Hursthouse, Michael B.","C18H24N5O2P3S2","Crystal Structure Report Archive","2007","","","263","","","","","0.71073","MoKα","","0.0193","0.0188","","","0.0491","0.0494","","","","","","1.039","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519868","4.951","0.0001","7.8949","0.0003","18.7417","0.0007","90","","90","","90","","732.57","0.04","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,3-Dihydrothieno[3,4-B][1,4]dioxin-5-ylmethanol","","- C7 H8 O3 S -","- C7 H8 O3 S -","- C28 H32 O12 S4 -","4","1","","Hursthouse, Michael B.; Huth, Susanne. L.; Withnell, J.","2,3-Dihydrothieno[3,4-B][1,4]dioxin-5-ylmethanol","Crystal Structure Report Archive","2007","","","264","","","","","0.71073","MoKα","","0.0358","0.0312","","","0.0657","0.0683","","","","","","1.045","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519869","14.2194","0.0003","10.2937","0.0002","20.6731","0.0005","90","","95.272","0.001","90","","3013.13","0.11","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 B N O -","- C19 H18 B N O -","- C152 H144 B8 N8 O8 -","8","2","","Beckett, Michael A.; Horton, Peter N.; Hursthouse, Michael B.","2-(2-Ethoxy)pyridine diphenylborinate","Crystal Structure Report Archive","2007","","","265","","","","","0.71073","MoKα","","0.0678","0.0518","","","0.1016","0.1113","","","","","","1.097","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519870","20.9041","0.0007","14.5008","0.0005","5.9078","0.0002","90","","102.021","0.002","90","","1751.54","0.1","120","2","120","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C12 H8 Cl8 F16 N6 O4 P6 -","- C12 H8 Cl8 F16 N6 O4 P6 -","- C24 H16 Cl16 F32 N12 O8 P12 -","2","0.25","","Davies, David B.; Besli, S.; Kilic, A.; Coles, Simon J.; Hursthouse, Michael B.","C24H16Cl16F32N12O8P12","Crystal Structure Report Archive","2007","","","266","","","","","0.71073","MoKα","","0.087","0.084","","","0.2468","0.2484","","","","","","1.156","","","","has coordinates","215051","2020-10-21","18:00:00",""
"1519871","6.0475","0.0004","27.1376","0.0015","10.4986","0.0007","90","","96.177","0.003","90","","1712.97","0.19","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C6 H4 Cl4 F8 N3 O2 P3 -","- C6 H4 Cl4 F8 N3 O2 P3 -","- C24 H16 Cl16 F32 N12 O8 P12 -","4","1","","Davies, David B.; Kilic, A.; Besli, S.; Coles, Simon J.; Hursthouse, Michael B.","C6H4Cl4F8N3O2P3","Crystal Structure Report Archive","2007","","","267","","","","","0.71073","MoKα","","0.0771","0.0633","","","0.1287","0.1381","","","","","","1.1","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519872","11.054","0.0003","11.9883","0.0004","11.2576","0.0004","90","","96.475","0.002","90","","1482.33","0.08","120","2","120","2","","","","","","","Gareth Bates","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H18 F6 N4 Si -","- C10 H18 F6 N4 Si -","- C40 H72 F24 N16 Si4 -","4","0.5","","Gale, Phil A.; Bates, Gareth W.; Light, Mark E.","bis(1,3-dimethylimidazolium) hexafluorosilicate","Crystal Structure Report Archive","2007","","","276","","","","","0.71073","MoKα","","0.0523","0.0435","","","0.0944","0.1","","","","","","1.051","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519873","10.0118","0.0008","4.3353","0.0003","16.617","0.0014","90","","106.29","0.002","90","","692.29","0.09","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3-Dihydrothieno[3,4-B][1,4]dioxine-5-carbaldehyde","","- C7 H6 O3 S -","- C7 H6 O3 S -","- C28 H24 O12 S4 -","4","1","","Hursthouse, Michael B.; Huth, Susanne. L.; Withnell, J.","2,3-Dihydrothieno[3,4-B][1,4]dioxine-5-carbaldehyde","Crystal Structure Report Archive","2007","","","277","","","","","0.71073","MoKα","","0.0913","0.0727","","","0.1614","0.1854","","","","","","1.094","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519874","12.7013","0.0004","16.5159","0.0006","4.3164","0.0001","90","","90","","90","","905.47","0.05","120","2","120","2","","","","","","","","4","P n n 2","P 2 -2n","34","","[2-(1H-1,2,4-Triazol-1-ylmethyl)phenyl]methanol","","- C10 H11 N3 O -","- C10 H11 N3 O -","- C40 H44 N12 O4 -","4","1","","Hursthouse, Michael B.; Huth, Susanne. L.; Withnell, J.","[2-(1H-1,2,4-Triazol-1-ylmethyl)phenyl]methanol","Crystal Structure Report Archive","2007","","","282","","","","","0.71073","MoKα","","0.0424","0.0329","","","0.0785","0.0829","","","","","","1.105","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519875","15.0606","0.0007","14.3262","0.0007","8.1711","0.0005","90","","90","","90","","1763.01","0.16","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(Chloromethyl)-1-methyl-1H-indazole","","- C9 H9 Cl N2 -","- C9 H9 Cl N2 -","- C72 H72 Cl8 N16 -","8","2","","Hursthouse, Michael B.; Huth, Susanne. L.; Withnell, J.","3-(Chloromethyl)-1-methyl-1H-indazole","Crystal Structure Report Archive","2007","","","283","","","","","0.71073","MoKα","","0.0958","0.0656","","","0.1321","0.1497","","","","","","1.057","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519876","7.4546","0.0004","14.7589","0.0009","14.8296","0.0007","90","","94.816","0.003","90","","1625.82","0.15","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-Methyl-1H-indazole-3-carboxylic acid","","- C9 H8 N2 O2 -","- C9 H8 N2 O2 -","- C72 H64 N16 O16 -","8","2","","Hursthouse, Michael B.; Huth, Susanne. L.; Withnell, J.","1-Methyl-1H-indazole-3-carboxylic acid","Crystal Structure Report Archive","2007","","","284","","","","","0.71073","MoKα","","0.1186","0.0772","","","0.1413","0.1628","","","","","","1.104","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519877","7.817","0.0003","9.2412","0.0002","10.0613","0.0003","85.45","0.002","67.97","0.002","79.532","0.002","662.48","0.04","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","5-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)- 2,3-dihydrothieno[3,4-B][1,4]dioxine","","- C12 H17 B O4 S -","- C12 H17 B O4 S -","- C24 H34 B2 O8 S2 -","2","1","","Hursthouse, Michael B.; Huth, Susanne. L.; Withnell, J.","5-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)- 2,3-dihydrothieno[3,4-B][1,4]dioxine","Crystal Structure Report Archive","2007","","","285","","","","","0.71073","MoKα","","0.0651","0.0509","","","0.1061","0.1158","","","","","","1.055","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1524892","10.0784","","10.0784","","10.0784","","90","","90","","90","","1023.71","","","","","","","","","","","","","4","I a -3","-I 2b 2c 3","206","","(Zr1.613 Sc0.387) O1.387 N1.613","","- N1.614 O1.386 Sc0.159 Zr0.6745 -","- N1.614 O1.386 Sc0.159 Zr0.6745 -","- N25.824 O22.176 Sc2.544 Zr10.792 -","16","0.333333","","Martinez Meta, N.J.; Schweda, E.; Chasse, T.; Haug, A.; Boysen, H.; Hoelzel, M.","Zr50 Sc12 O43 N50 and Zr3 Sc4 N8 - synthesis, neutron powder diffraction an Raman spectroscopy","Zeitschrift fuer Anorganische und Allgemeine Chemie","2007","633","","790","794","","","","","","","","","","","","","","","","","","","","","","has coordinates","145746","2020-10-21","18:00:00",""
"1528326","8.4048","","8.4048","","8.4048","","90","","90","","90","","593.721","","","","","","","","","","","","","4","P 43 3 2","P 4acd 2ab 3","212","","Li Fe0.5 Ti1.5 O4","","- Fe0.5 Li O4 Ti1.5 -","- Fe0.5 Li O4 Ti1.5 -","- Fe4 Li8 O32 Ti12 -","8","0.333333","","Avdeev, G.; Petrov, K.; Mitov, I.","X-ray diffraction and Moessbauer spectroscopy studies of Li Fe0.5 Ti1.5 O4 - a new primitive cubic ordered spinel","Solid State Sciences","2007","9","","1135","1139","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528334","12.1109","","12.1109","","6.8414","","90","","90","","90","","1003.46","","","","","","","","","","","","","5","P 42 n m","P 4n -2n","102","","Ba2 Al B4 O9 Cl","","- Al B4 Ba2 Cl O9 -","- Al B4 Ba2.0001 Cl O9 -","- Al4 B16 Ba8.0004 Cl4 O36 -","4","0.5","","Barbier, J.","The non - centrosymmetric borate chlorides Ba2 T B4 O9 Cl (T = Al, Ga)","Solid State Sciences","2007","9","","344","350","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528352","12.486","","7.106","","16.9436","","90","","93.81","","90","","1500.01","","","","","","","","","","","","","3","C 1 2 1","C 2y","5","","K B21 H18","","- B21 H18 K -","- B21 H18 K -","- B84 H72 K4 -","4","1","","Bernhardt, E.; Brauer, D.J.; Finze, M.; Willner, H.","closo-[B21 H18](-): A face-fused diicosahedral borate ion","Angewandte Chemie (Edition international)","2007","46","","2927","2930","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528365","7.7746","","7.7746","","7.7746","","90","","90","","90","","469.931","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Hf V2 D4","","- D4 Hf V2 -","- D3.996 Hf V2 -","- D31.968 Hf8 V16 -","8","0.0416667","","Bogdanova, A.N.; Andre, G.; Irodova, A.V.","Saturated hydrides in the Hf V2 - D System","Kristallografiya","2007","52","","471","473","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528366","7.843","","7.843","","7.843","","90","","90","","90","","482.444","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Hf V2 D4.7","","- D4.7 Hf V2 -","- D4.704 Hf V2 -","- D37.632 Hf8 V16 -","8","0.0416667","","Bogdanova, A.N.; Irodova, A.V.; Andre, G.","Saturated hydrides in the Hf V2 - D System","Kristallografiya","2007","52","","471","473","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528367","7.881","","7.881","","7.881","","90","","90","","90","","489.49","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Hf0.7 Zr0.3) V2 D5.1","","- D5.1 Hf0.7 V2 Zr0.3 -","- D5.096 Hf0.7 V2 Zr0.3 -","- D40.768 Hf5.6 V16 Zr2.4 -","8","0.0416667","","Bogdanova, A.N.; Irodova, A.V.; Andre, G.","Saturated hydrides in the Hf V2 - D System","Kristallografiya","2007","52","","471","473","","","","","","","","","","","","","","","","","","","","","","has coordinates","150498","2020-10-21","18:00:00",""
"1528368","7.882","","7.882","","7.882","","90","","90","","90","","489.677","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Hf (V0.92 Ti0.08)2 D5.1","","- D5.1 Hf Ti0.16 V1.84 -","- D5.104 Hf Ti0.16 V1.84 -","- D40.832 Hf8 Ti1.28 V14.72 -","8","0.0416667","","Bogdanova, A.N.; Irodova, A.V.; Andre, G.","Saturated hydrides in the Hf V2 - D System","Kristallografiya","2007","52","","471","473","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528378","5.58471","","5.58471","","13.8157","","90","","90","","120","","373.168","","","","","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","Bi (Ti0.375 Fe0.25 Ni0.375) O3","","- Bi Fe0.25 Ni0.375 O3 Ti0.375 -","- Bi0.9999 Fe0.25 Ni0.375 O3 Ti0.375 -","- Bi5.9994 Fe1.5 Ni2.25 O18 Ti2.25 -","6","0.333333","","Bridges, C.A.; Kuang Xiaojun; Allix, M.; Suchomel, M.R.; Sterianou, I.; Sinclair, D.C.; Rosseinsky, M.J.","A pure bismuth A site polar perovskite synthesized at ambient pressure","Angew. Chem. Int. ed.","2007","46","","8785","8789","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528379","5.60398","","5.60398","","13.93081","","90","","90","","120","","378.879","","","","","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","Bi (Ti0.375 Fe0.25 Mg0.375) O3","","- Bi Fe0.25 Mg0.375 O3 Ti0.375 -","- Bi0.9999 Fe0.25 Mg0.375 O3 Ti0.375 -","- Bi5.9994 Fe1.5 Mg2.25 O18 Ti2.25 -","6","0.333333","","Bridges, C.A.; Allix, M.; Suchomel, M.R.; Sterianou, I.; Kuang Xiaojun; Sinclair, D.C.; Rosseinsky, M.J.","A pure bismuth A site polar perovskite synthesized at ambient pressure","Angew. Chem. Int. ed.","2007","46","","8785","8789","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528397","3.8304","","3.8304","","20.1396","","90","","90","","90","","295.487","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Sr3 Cr2 O6.95","","- Cr2 O6.95 Sr3 -","- Cr2 O6.95 Sr3 -","- Cr4 O13.9 Sr6 -","2","0.0625","","Castillo-Martinez, E.; Alario-Franco, M.A.","Revisiting the Sr - Cr(IV) - O system at high pressure and temperature with special reference to Sr3 Cr2 O7","Solid State Sciences","2007","9","","564","573","","","","","","","","","","","","","","","","","","","","","","has coordinates","150566","2020-10-21","18:00:00",""
"1528398","5.791","","5.8108","","8.1964","","90","","90","","90","","275.812","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Sr (Zr O3)","","- O3 Sr Zr -","- O3 Sr Zr -","- O12 Sr4 Zr4 -","4","0.5","","Cavalcante, L.S.; Simoes, A.Z.; Longo, E.; Sczancoski, J.C.; Erlo, R.; Escote, M.T.; Longo, V.M.; Varela, J.A.","Sr Zr O3 powders obtained by chemical method: synthesis, characterization and optical absorption behaviour","Solid State Sciences","2007","9","","1020","1027","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528411","8.144","","10.216","","12.418","","90","","105.577","","90","","995.219","","","","","","","","","","","","","6","C 1 c 1","C -2yc","9","","Ga Cl3 ((C H3)3 P O)","","- C3 H9 Cl3 Ga O P -","- C3 H9 Cl3 Ga O P -","- C12 H36 Cl12 Ga4 O4 P4 -","4","1","","Cheng Fei; Codgbrook, H.L.; Zhang Wenjian; Hector, A.L.; Reid, G.; Webster, M.; Levason, W.","Gallium(III) halide complexes with phosphines, arsines and phosphine oxides - a comparative study","Polyhedron","2007","26","","4147","4155","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528412","12.259","","12.259","","32.976","","90","","90","","90","","4955.73","","","","","","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","(Ga I2 ((C H3)3 P O)2) (Ga I4)","","- C6 H18 Ga2 I6 O2 P2 -","- C6 H18 Ga2 I6 O2 P2 -","- C48 H144 Ga16 I48 O16 P16 -","8","1","","Cheng Fei; Codgbrook, H.L.; Webster, M.; Hector, A.L.; Reid, G.; Levason, W.; Zhang Wenjian","Gallium(III) halide complexes with phosphines, arsines and phosphine oxides - a comparative study","Polyhedron","2007","26","","4147","4155","","","","","","","","","","","","","","","","","","","","","","has coordinates","150588","2020-10-21","18:00:00",""
"1528417","5.0017","","5.0017","","11.2664","","90","","90","","90","","281.852","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Ho (Cr O4)","","- Cr Ho O4 -","- Cr Ho O4 -","- Cr4 Ho4 O16 -","4","0.25","","Climent-Pascual, E.; Saez-Puche, R.; de Paz, J.R.; Gallardo-Amores, J.M.","Ferromagnetism vs. antiferromagnetism of the dimorphic Ho Cr O4 oxide","Solid State Sciences","2007","9","","574","579","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528453","4.3262","","14.181","","16.556","","90","","90","","90","","1015.71","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Pb2 Sb S2 I3","","- I3 Pb2 S2 Sb -","- I3 Pb2 S2 Sb -","- I12 Pb8 S8 Sb4 -","4","0.25","","Doussier, C.; Moelo, Y.; Meerschaut, A.; Leone, P.; Evain, M.","Crystal structure of Pb2 Sb S2 I3, and re-examination of the crystal chemistry within the group of (Pb/Sn/Sb) chalcogeno-iodides","Solid State Sciences","2007","9","","792","803","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528470","15.325","","21.014","","22.173","","83.639","","89.636","","84.175","","7059.89","","","","","","","","","","","","","7","P 1","P 1","1","","((C H3)2 N H2)12 (Zr (P2 W15 O54 (H2 O)2)2) (H2 O)21","","- C13 H52 N6.5 O129.125 P4 W30 Zr -","- C13 H52 N6.5 O129.125 P4 W30 Zr -","- C26 H104 N13 O258.25 P8 W60 Zr2 -","2","2","","Fang Xikui; Hill, C.L.","Multiple reversible protonation of polyoxoaniom surfaces: direct observation of dynamic structural effects from proton transfer","Angewandte Chemie (Edition international)","2007","46","","3877","3880","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528471","13.37","","13.4","","45.498","","88.422","","82.29","","61.94","","7122.26","","","","","","","","","","","","","7","P -1","-P 1","2","","((C H3)2 N H2)14 ((P2 W15 O54 (H2 O)2) Zr (P2 W17 O61)) (H2 O)27","","- C18 H72 N9 O127.5 P4 W32 Zr -","- C18 H72 N9 O127.5 P4 W32 Zr -","- C36 H144 N18 O255 P8 W64 Zr2 -","2","1","","Fang Xikui; Hill, C.L.","Multiple reversible protonation of polyoxoaniom surfaces: direct observation of dynamic structural effects from proton transfer","Angewandte Chemie (Edition international)","2007","46","","3877","3880","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528478","23.935","","9.903","","14.367","","90","","126.17","","90","","2749.06","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","K2 (N C B11 F10)","","- C B11 F10 K2 N -","- C B11 F10 K2 N -","- C8 B88 F80 K16 N8 -","8","1","","Finze, M.","Carbon extrusion/cluster contraction: synthesis of the fluorinated cyano-closo-undecaborate K2 [3-N C-closo-B11 F10]","Angew. Chem. Int. ed.","2007","46","","8880","8882","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528497","8.8822","","12.0817","","12.4026","","65.855","","69.604","","74.432","","1125.98","","","","","","","","","","","","","5","P -1","-P 1","2","","K4 (Np O2)3 Cl7 (H2 O)4","","- Cl7 H8 K4 Np3 O10 -","- Cl7 H8 K4 Np3 O10 -","- Cl14 H16 K8 Np6 O20 -","2","1","","Forbes, T.Z.; Burns, P.C.","The role of cation-cation interactions in a neptunyl chloride hydrate and topological aspects of neptunyl structural units","Journal of Solid State Chemistry","2007","180","","106","112","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528514","18.4588","","8.9638","","5.2848","","90","","90","","90","","874.428","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(Mg0.919 Fe0.071) (Mg0.901 Fe0.079) Si2 O6","","- Fe0.15 Mg1.82 O6 Si2 -","- Fe0.15 Mg1.82 O6 Si2 -","- Fe1.2 Mg14.56 O48 Si16 -","8","1","","Gatta, G.D.; Rinaldi, R.; Knight, K.S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in-situ neutron powder diffraction study","Physics and Chemistry of Minerals (Germany)","2007","34","","185","200","","","","","","","","","","","","","","","","","","","","","","has coordinates","150883","2020-10-21","18:00:00",""
"1528515","8.931","","16.6297","","9.9858","","90","","105.824","","90","","1426.89","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Cd Zr (C2 O4)3 (H2 O)3) (H2 O)2","","- C6 H10 Cd O17 Zr -","- C6 H10 Cd O17 Zr -","- C24 H40 Cd4 O68 Zr4 -","4","1","","Gavilan, E.; Audebrand, N.; Jeanneau, E.","A new series of mixed oxalates M M'(C2 O4)3 (H2 O)3 * n(H2 O) (M = Cd, Hg, Pb; M' = Zr, Hf) based on eight-fold coordinated metals: synthesis, crystal structure from single-crystal and powder diffraction data and thermal behaviour","Solid State Sciences","2007","9","","985","999","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528516","8.9501","","16.7923","","10.0015","","90","","105.866","","90","","1445.89","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Hg Zr (C2 O4)3 (H2 O)3) (H2 O)2","","- C6 H10 Hg O17 Zr -","- C6 H10 Hg O17 Zr -","- C24 H40 Hg4 O68 Zr4 -","4","1","","Gavilan, E.; Audebrand, N.; Jeanneau, E.","A new series of mixed oxalates M M'(C2 O4)3 (H2 O)3 * n(H2 O) (M = Cd, Hg, Pb; M' = Zr, Hf) based on eight-fold coordinated metals: synthesis, crystal structure from single-crystal and powder diffraction data and thermal behaviour","Solid State Sciences","2007","9","","985","999","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528517","8.8812","","16.597","","9.9642","","90","","105.833","","90","","1413.01","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Cd Hf (C2 O4)3 (H2 O)3) (H2 O)2","","- C6 H10 Cd Hf O17 -","- C6 Cd Hf O17 -","- C24 Cd4 Hf4 O68 -","4","1","","Gavilan, E.; Audebrand, N.; Jeanneau, E.","A new series of mixed oxalates M M'(C2 O4)3 (H2 O)3 * n(H2 O) (M = Cd, Hg, Pb; M' = Zr, Hf) based on eight-fold coordinated metals: synthesis, crystal structure from single-crystal and powder diffraction data and thermal behaviour","Solid State Sciences","2007","9","","985","999","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528518","10.0978","","14.3912","","9.6585","","90","","105.855","","90","","1350.17","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Pb Zr (C2 O4)3 (H2 O)3) (H2 O)","","- C6 H8 O16 Pb Zr -","- C6 H8 O16 Pb Zr -","- C24 H32 O64 Pb4 Zr4 -","4","1","","Gavilan, E.; Audebrand, N.; Jeanneau, E.","A new series of mixed oxalates M M'(C2 O4)3 (H2 O)3 * n(H2 O) (M = Cd, Hg, Pb; M' = Zr, Hf) based on eight-fold coordinated metals: synthesis, crystal structure from single-crystal and powder diffraction data and thermal behaviour","Solid State Sciences","2007","9","","985","999","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528519","9.789","","14.892","","9.433","","90","","106.865","","90","","1315.98","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Cd Zr (C2 O4)3 (H2 O)3) (H2 O)","","- C6 H8 Cd O16 Zr -","- C6 Cd O16 Zr -","- C24 Cd4 O64 Zr4 -","4","1","","Gavilan, E.; Audebrand, N.; Jeanneau, E.","A new series of mixed oxalates M M'(C2 O4)3 (H2 O)3 * n(H2 O) (M = Cd, Hg, Pb; M' = Zr, Hf) based on eight-fold coordinated metals: synthesis, crystal structure from single-crystal and powder diffraction data and thermal behaviour","Solid State Sciences","2007","9","","985","999","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528521","5.7403","","5.7403","","14.0771","","90","","90","","120","","401.71","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ba2 Fe0.92 Os1.08 O6","","- Ba2 Fe0.92 O6 Os1.08 -","- Ba2 Fe0.913333 O6 Os1.08667 -","- Ba6 Fe2.74 O18 Os3.26 -","3","0.25","","Gemmill, W.R.; Smith, M.D.; zur Loye, H.C.","Synthesis and structural characterization of two new hexagonal osmates: Ba2 Fe0.92 Os1.08 O6 and Ba2 Co0.77 Os1.23 O6","Solid State Sciences","2007","9","","380","384","","","","","","","","","","","","","","","","","","","","","","has coordinates","150900","2020-10-21","18:00:00",""
"1528522","5.7745","","5.7745","","14.0946","","90","","90","","120","","407.017","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ba2 Co0.77 Os1.23 O6","","- Ba2 Co0.77 O6 Os1.23 -","- Ba2 Co0.762 O6 Os1.238 -","- Ba6 Co2.286 O18 Os3.714 -","3","0.25","","Gemmill, W.R.; Smith, M.D.; zur Loye, H.C.","Synthesis and structural characterization of two new hexagonal osmates: Ba2 Fe0.92 Os1.08 O6 and Ba2 Co0.77 Os1.23 O6","Solid State Sciences","2007","9","","380","384","","","","","","","","","","","","","","","","","","","","","","has coordinates","150901","2020-10-21","18:00:00",""
"1528534","7.5532","","7.093","","7.4828","","90","","122.179","","90","","339.309","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cu0.5 Ti O (P O4)","","- Cu0.5 O5 P Ti -","- Cu0.5 O5 P Ti -","- Cu2 O20 P4 Ti4 -","4","1","","Gravereau, P.; El Jazouli, A.; Benmokhtar, S.; Chaminade, J.P.; Denux, D.; Lebraud, E.","Jahn-Teller phase transition in Cu0.50 Ti O (P O4): Powder structural characterization of the beta-variety and thermal study","Solid State Sciences","2007","9","","258","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528535","7.119","","7.718","","7.303","","90","","119.34","","90","","349.789","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cu0.5 Ti O (P O4)","","- Cu0.5 O5 P Ti -","- Cu0.5 O5 P Ti -","- Cu2 O20 P4 Ti4 -","4","1","","Gravereau, P.; Benmokhtar, S.; Lebraud, E.; Chaminade, J.P.; El Jazouli, A.; Denux, D.","Jahn-Teller phase transition in Cu0.50 Ti O (P O4): Powder structural characterization of the beta-variety and thermal study","Solid State Sciences","2007","9","","258","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528538","7.433","","7.433","","77.488","","90","","90","","120","","3707.6","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Bi9.32 Nb16.92 Fe1.08 O57.628","","- Bi9.32 Fe1.08 Nb16.92 O57.628 -","- Bi9.3198 Fe1.08 Nb16.92 O57.628 -","- Bi27.9594 Fe3.24 Nb50.76 O172.884 -","3","0.0833333","","Grey, I.E.; Vanderah, T.A.; Mumme, W.G.; Roth, R.S.; Bougerol, C.","Chemical twinning of the pyrochlore structure in the system Bi2 O3-Fe2 O3-Nb2 O5","Journal of Solid State Chemistry","2007","180","","158","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","150932","2020-10-21","18:00:00",""
"1528539","7.432","","7.432","","31.881","","90","","90","","120","","1525.01","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Bi5.789 Nb10.01 Fe0.99 O35.492","","- Bi5.789 Fe0.99 Nb10.01 O35.492 -","- Bi5.7894 Fe0.99 Nb10.01 O35.492 -","- Bi11.5788 Fe1.98 Nb20.02 O70.984 -","2","0.0833333","","Grey, I.E.; Roth, R.S.; Mumme, W.G.; Vanderah, T.A.; Bougerol, C.","Chemical twinning of the pyrochlore structure in the system Bi2 O3-Fe2 O3-Nb2 O5","Journal of Solid State Chemistry","2007","180","","158","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","150933","2020-10-21","18:00:00",""
"1528558","5.7458","","5.7458","","35.6496","","90","","90","","120","","1019.26","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(La3 Na) Pt O7","","- La3 Na O7 Pt -","- La3 Na O6.99 Pt -","- La18 Na6 O41.94 Pt6 -","6","0.166667","","Hansen, T.J.; Macquart, R.B.; Smith, M.D.; zur Loye, H.C.","Crystal growth and structures of three new platinates: Ln3 Na Pt O7 (Ln = La, Nd) and La4 Pt O7","Solid State Sciences","2007","9","","785","791","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528559","5.6862","","5.6862","","34.896","","90","","90","","120","","977.126","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(Nd3 Na) Pt O7","","- Na Nd3 O7 Pt -","- Na Nd3 O6.9999 Pt -","- Na6 Nd18 O41.9994 Pt6 -","6","0.166667","","Hansen, T.J.; Macquart, R.B.; Smith, M.D.; zur Loye, H.C.","Crystal growth and structures of three new platinates: Ln3 Na Pt O7 (Ln = La, Nd) and La4 Pt O7","Solid State Sciences","2007","9","","785","791","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528560","9.7993","","4.0014","","9.4905","","90","","91.759","","90","","371.956","","","","","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","La4 Pt O7","","- La4 O7 Pt -","- La4 O7 Pt -","- La8 O14 Pt2 -","2","0.25","","Hansen, T.J.; Macquart, R.B.; zur Loye, H.C.; Smith, M.D.","Crystal growth and structures of three new platinates: Ln3 Na Pt O7 (Ln = La, Nd) and La4 Pt O7","Solid State Sciences","2007","9","","785","791","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528578","5.52182","","7.80614","","5.52584","","90","","90","","90","","238.186","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La Ni0.53 V0.47 O3","","- La Ni0.53 O3 V0.47 -","- La Ni0.529 O3 V0.471 -","- La4 Ni2.116 O12 V1.884 -","4","0.5","","Holman, K.L.; Huang, Q.; Morosan, E.; Klimczuk, T.; Trzebiatowski, K.; Bos, J.W.G.; Lynn, J.W.; Cava, R.J.","Synthesis and properties of the double perovskites La2 Ni V O6, La2 Co V O6, and La2 Co Ti O6","Journal of Solid State Chemistry","2007","180","","75","83","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528579","5.5402","","7.8247","","5.5429","","90","","90","","90","","240.287","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La Co0.55 V0.45 O3","","- Co0.55 La O3 V0.45 -","- Co0.553 La O3 V0.447 -","- Co2.212 La4 O12 V1.788 -","4","0.5","","Holman, K.L.; Huang, Q.; Klimczuk, T.; Lynn, J.W.; Trzebiatowski, K.; Bos, J.W.G.; Cava, R.J.; Morosan, E.","Synthesis and properties of the double perovskites La2 Ni V O6, La2 Co V O6, and La2 Co Ti O6","Journal of Solid State Chemistry","2007","180","","75","83","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528580","5.5703","","5.5957","","7.8797","","90","","89.955","","90","","245.608","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","La Co0.50 Ti0.50 O3","","- Co0.5 La O3 Ti0.5 -","- Co0.5 La O3 Ti0.5 -","- Co2 La4 O12 Ti2 -","4","1","","Holman, K.L.; Huang, Q.; Trzebiatowski, K.; Klimczuk, T.; Cava, R.J.; Lynn, J.W.; Bos, J.W.G.; Morosan, E.","Synthesis and properties of the double perovskites La2 Ni V O6, La2 Co V O6, and La2 Co Ti O6","Journal of Solid State Chemistry","2007","180","","75","83","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528590","5.9757","","6.0129","","8.9881","","71.565","","79.471","","68.258","","283.796","","","","","","","","","","","","","3","P -1","-P 1","2","","Ca4 Ti N4","","- Ca4 N4 Ti -","- Ca4 N4 Ti -","- Ca8 N8 Ti2 -","2","1","","Hunting, J.L.; Szymanski, M.M.; Johnson, P.E.; Kellar, C.B.; DiSalvo, F.J.","The synthesis and structural characterization of the new ternary nitrides: Ca4 Ti N4 and Ca5 Nb N5","Journal of Solid State Chemistry","2007","180","","31","40","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528591","11.922","","6.878","","8.936","","90","","101.22","","90","","718.743","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Ca5 Nb N5","","- Ca5 N5 Nb -","- Ca5 N5 Nb -","- Ca20 N20 Nb4 -","4","0.5","","Hunting, J.L.; Szymanski, M.M.; DiSalvo, F.J.; Johnson, P.E.; Kellar, C.B.","The synthesis and structural characterization of the new ternary nitrides: Ca4 Ti N4 and Ca5 Nb N5","Journal of Solid State Chemistry","2007","180","","31","40","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528611","8.4053","","8.4053","","8.4053","","90","","90","","90","","593.827","","","","","","","","","","","","Synthetic","2","F d -3 m :2","-F 4vw 2vw 3","227","","(Fe2 O3)10.6667","Maghemite","- Fe21.3334 O32.0001 -","- Fe21.336 O32 -","- Fe21.336 O32 -","1","0.00520833","","Jorgensen, J.E.; Mosegaard, L.; Thomsen, L.E.; Jensen, T.R.; Hanson, J.C.","Formation of gamma-Fe2 O3 nanoparticles and vacancy ordering: an in situ x-ray powder diffraction study","Journal of Solid State Chemistry","2007","180","","180","185","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:11:58",""
"1528612","8.332","","8.332","","25.113","","90","","90","","90","","1743.4","","","","","","","","","","","","","2","P 41 21 2","P 4abw 2nw","92","","","","- Fe2 O3 -","- Fe2 O3 -","- Fe64 O96 -","32","4","","Jorgensen, J.E.; Mosegaard, L.; Hanson, J.C.; Jensen, T.R.; Thomsen, L.E.","Formation of gamma-Fe2 O3 nanoparticles and vacancy ordering: an in situ x-ray powder diffraction study","Journal of Solid State Chemistry","2007","180","","180","185","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1528617","6.629","","6.584","","35.916","","91.096","","94.534","","91.73","","1561.58","","","","","","","","","","","","","3","P -1","-P 1","2","","Y2 Si2 O7","","- O7 Si2 Y2 -","- O7 Si2 Y2 -","- O84 Si24 Y24 -","12","6","","Kahlenberg, V.; Kaindl, R.; Konzett, J.","eta-Y2 Si2 O7 - structural investigations on a quenchable high-pressure mixed anion silicate","Solid State Sciences","2007","9","","542","550","","","","","","","","","","","","","","","","","","","","","","has coordinates","151098","2020-10-21","18:00:00",""
"1528621","3.99644","","3.89407","","7.63427","","90","","90","","90","","118.808","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Eu Ba Fe2 O5.149","","- Ba Eu Fe2 O5.149 -","- Ba Eu Fe2 O5.149 -","- Ba Eu Fe2 O5.149 -","1","0.125","","Karen, P.; Gustafsson, K.; Linden, J.","Eu Ba Fe2 O(5+w): Valence mixing and charge ordering are two separate cooperative phenomena","Journal of Solid State Chemistry","2007","180","","148","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528622","3.96899","","3.91359","","7.65993","","90","","90","","90","","118.982","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Eu Ba Fe2 O5.224","","- Ba Eu Fe2 O5.224 -","- Ba Eu Fe2 O5.224 -","- Ba Eu Fe2 O5.224 -","1","0.125","","Karen, P.; Gustafsson, K.; Linden, J.","Eu Ba Fe2 O(5+w): Valence mixing and charge ordering are two separate cooperative phenomena","Journal of Solid State Chemistry","2007","180","","148","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528623","3.93765","","3.93253","","7.69345","","90","","90","","90","","119.133","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Eu Ba Fe2 O5.333","","- Ba Eu Fe2 O5.333 -","- Ba Eu Fe2 O5.333 -","- Ba Eu Fe2 O5.333 -","1","0.125","","Karen, P.; Gustafsson, K.; Linden, J.","Eu Ba Fe2 O(5+w): Valence mixing and charge ordering are two separate cooperative phenomena","Journal of Solid State Chemistry","2007","180","","148","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528624","3.93032","","3.93032","","7.71201","","90","","90","","90","","119.131","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Eu Ba Fe2 O5.415","","- Ba Eu Fe2 O5.415 -","- Ba Eu Fe2 O5.415 -","- Ba Eu Fe2 O5.415 -","1","0.0625","","Karen, P.; Gustafsson, K.; Linden, J.","Eu Ba Fe2 O(5+w): Valence mixing and charge ordering are two separate cooperative phenomena","Journal of Solid State Chemistry","2007","180","","148","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528625","4.04014","","3.87095","","7.58503","","90","","90","","90","","118.624","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Eu Ba Fe2 O5.007","","- Ba Eu Fe2 O5.007 -","- Ba Eu Fe2 O5.007 -","- Ba Eu Fe2 O5.007 -","1","0.125","","Karen, P.; Gustafsson, K.; Linden, J.","Eu Ba Fe2 O(5+w): Valence mixing and charge ordering are two separate cooperative phenomena","Journal of Solid State Chemistry","2007","180","","148","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528637","5.6304","","5.6226","","7.9434","","90","","90.04","","90","","251.468","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","La1.667 Mg Ta O6","","- La1.667 Mg O6 Ta -","- La1.66666 Mg O6 Ta -","- La3.33332 Mg2 O12 Ta2 -","2","0.25","","Khalyavin, D.D.; Vieira, L.G.; Senos, A.M.R.; Argyriou, D.N.; Gomes, I.T.; Mantas, P.Q.; Ribeiro, J.L.","Structure and dielectric characterization of a new A-site deficient La5/3 Mg Ta O6 perovskite","Journal of Solid State Chemistry","2007","180","","41","48","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528652","6.572","","8.805","","3.267","","90","","90","","90","","189.05","","","","","","","","","","","","","4","P n n m","-P 2 2n","58","","Co (H N C N)2","","- C2 H2 Co N4 -","- C2 Co N4 -","- C4 Co2 N8 -","2","0.25","","Krott, M.; Liu Xiaohui; Mueller, P.; Dronskowski, R.","Synthesis and structure determination of Co (H N C N)2 and Ni (H N C N)2","Journal of Solid State Chemistry","2007","180","","307","312","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528653","6.457","","8.768","","3.23","","90","","90","","90","","182.866","","","","","","","","","","","","","4","P n n m","-P 2 2n","58","","Ni (H N C N)2","","- C2 H2 N4 Ni -","- C2 H2 N4 Ni -","- C4 H4 N8 Ni2 -","2","0.25","","Krott, M.; Mueller, P.; Liu Xiaohui; Dronskowski, R.","Synthesis and structure determination of Co (H N C N)2 and Ni (H N C N)2","Journal of Solid State Chemistry","2007","180","","307","312","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528657","10.1428","","9.1579","","7.4485","","90","","90","","90","","691.867","","","","","","","","","","","","","4","I b a m","-I 2 2c","72","","(N H4) C O2 N H2","","- C H6 N2 O2 -","- C H6 N2 O2 -","- C8 H48 N16 O16 -","8","0.5","","Kuhn, N.; Stroebele, M.; Meyer, H.J.","Ueber die Identitaet eines sogenannten Ammoniumcarbonat-Praeparates","Zeitschrift fuer Anorganische und Allgemeine Chemie","2007","633","","653","656","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528686","10.0503","","10.0503","","2.94494","","90","","90","","90","","297.464","","","","","","","","","","","","","6","I 4/m","-I 4","87","","Ba1.2 Cs0.28 Fe0.82 Al1.46 Ti5.72 O16","","- Al1.46 Ba1.2 Cs0.28 Fe0.82 O16 Ti5.72 -","- Al1.456 Ba1.2 Cs0.28 Fe0.816 O16 Ti5.712 -","- Al1.456 Ba1.2 Cs0.28 Fe0.816 O16 Ti5.712 -","1","0.0625","","Leinekugel-le-Cocq-Errien, A.Y.; Deniard, P.; Jobic, S.; Gautier, E.; Aubin, V.; Evain, M.; Bart, F.","Structural characterization of the hollandite host lattice for the confinement of radioactive cesium: Quantification of the amorphous phase taking into account the incommensurate modulated character of the crystallized part","Journal of Solid State Chemistry","2007","180","","322","330","","","","","","","","","","","","","","","","","","","","","","has coordinates","151247","2020-10-21","18:00:00",""
"1528725","10.0784","","10.0784","","10.0784","","90","","90","","90","","1023.71","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","((Zr3 Sc4) N8)0.5","","- N4 Sc2 Zr1.5 -","- N4 Sc2 Zr1.5 -","- N4 Sc2 Zr1.5 -","1","0.00520833","","Martinez Meta, N.J.; Schweda, E.; Boysen, H.; Haug, A.; Chasse, T.; Hoelzel, M.","Zr50 Sc12 O43 N50 and Zr3 Sc4 N8 - synthesis, neutron powder diffraction an Raman spectroscopy","Zeitschrift fuer Anorganische und Allgemeine Chemie","2007","633","","790","794","","","","","","","","","","","","","","","","","","","","","","has coordinates","151329","2020-10-21","18:00:00",""
"1528743","10.7614","","21.68","","24.724","","100.854","","89.542","","96.211","","5631.39","","","","","","","","","","","","","5","P -1","-P 1","2","","(Mg (C H2 Si (C H3)3) (O C H2 Si (C H3)3))4","","- C32 H88 Mg4 O4 Si8 -","- C32 H88 Mg4 O4 Si8 -","- C128 H352 Mg16 O16 Si32 -","4","2","","Moreno, C.A.; Bochmann, M.; Hughes, D.L.","Synthesis and molecular structure of [Mg (C H2 Si Me3) (mu3-O C H2 Si Me3)]4","Polyhedron","2007","26","","2523","2526","","","","","","","","","","","","","","","","","","","","","","has coordinates","151371","2020-10-21","18:00:00",""
"1528767","7.08021","","7.23058","","7.25535","","88.7669","","84.7333","","75.9047","","358.727","","","","","","","","","","","","","4","P 1","P 1","1","","Sr1.02 Si2 O2 N2","","- N2 O2 Si2 Sr1.02 -","- N2 O2 Si2 Sr1.0295 -","- N8 O8 Si8 Sr4.118 -","4","4","","Oeckler, O.; Stadler, F.; Schnick, W.; Rosenthal, T.","Real structure of Sr Si2 O2 N2","Solid State Sciences","2007","9","","205","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","151421","2020-10-21","18:00:00",""
"1528773","15.926","","15.926","","12.363","","90","","90","","120","","2715.61","","","","","","","","","","","","","5","R 3 2 :H","R 3 2""","155","","(Mn (H2 O)4) (Co Mo9 O27 (O H)5) (H2 O)7","","- Co H27 Mn Mo9 O43 -","- Co Mn0.999 Mo9 O42.995 -","- Co3 Mn2.997 Mo27 O128.985 -","3","0.166667","","Oreshkina, A.V.; Rabadanov, M.Kh.; Ivanova, A.G.; Kaziev, G.Z.","Synthesis, thermal analysis, and crystal structure of manganese(II) 9-molybdocobaltate(III)","Kristallografiya","2007","52","","1096","1099","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528783","11.616","","11.616","","12.677","","90","","90","","90","","1710.53","","","","","","","","","","","","","4","P 42/n c m :2","-P 4ac 2ac","138","","(N H4) (Al F4)","","- Al F4 H4 N -","- Al F4 H4 N -","- Al20 F80 H80 N20 -","20","1.25","","Parnham, E.R.; Slawin, A.M.Z.; Morris, R.E.","Ionothermal synthesis of beta-N H4 Al F4 and the determination by single crystal x-ray diffraction of its room temperature and low temperature phases","Journal of Solid State Chemistry","2007","180","","49","53","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528785","5.255","","5.255","","11.399","","90","","90","","90","","314.784","","","","","","","","","","","","","4","I 41/a :2","-I 4ad","88","","Nd W O3.05 N0.95","","- N0.95 Nd O3.05 W -","- N0.95 Nd O3.05 W -","- N3.8 Nd4 O12.2 W4 -","4","0.25","","Pastrana-Fabregas, R.; Isasi-Marin, J.; Cascales, C.; Saez-Puche, R.","Synthesis, structure and magnetic properties of R-W-O-N (R = Nd and Eu) oxynitrides","Journal of Solid State Chemistry","2007","180","","92","97","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528786","3.976","","3.976","","3.976","","90","","90","","90","","62.855","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Eu W O1.58 N1.42","","- Eu N1.42 O1.58 W -","- Eu N1.4199 O1.5801 W -","- Eu N1.4199 O1.5801 W -","1","0.0208333","","Pastrana-Fabregas, R.; Cascales, C.; Isasi-Marin, J.; Saez-Puche, R.","Synthesis, structure and magnetic properties of R-W-O-N (R = Nd and Eu) oxynitrides","Journal of Solid State Chemistry","2007","180","","92","97","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528787","5.76715","","5.74905","","12.5206","","90","","90","","90","","415.128","","","","","","","","","","","","","4","A b m a","-A 2ab 2ab","64","","(La Sr) Sc O4","","- La O4 Sc Sr -","- La O4 Sc Sr -","- La4 O16 Sc4 Sr4 -","4","","","Patel, R.; Simon, C.; Weller, M.T.","Ln Sr Sc O4 (Ln = La, Ce, Pr, Nd and Sm) systems and structure correlations for A2 B O4 (K2 Ni F4) structure types","Journal of Solid State Chemistry","2007","180","","349","359","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528788","4.08413","","4.08413","","12.73932","","90","","90","","90","","212.493","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La Sr) Sc O4","","- La O4 Sc Sr -","- La O4 Sc Sr -","- La2 O8 Sc2 Sr2 -","2","0.0625","","Patel, R.; Simon, C.; Weller, M.T.","Ln Sr Sc O4 (Ln = La, Ce, Pr, Nd and Sm) systems and structure correlations for A2 B O4 (K2 Ni F4) structure types","Journal of Solid State Chemistry","2007","180","","349","359","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528789","5.76064","","5.7459","","12.3942","","90","","90","","90","","410.249","","","","","","","","","","","","","4","A b m a","-A 2ab 2ab","64","","(Ce Sr) Sc O4","","- Ce O4 Sc Sr -","- Ce O4 Sc Sr -","- Ce4 O16 Sc4 Sr4 -","4","","","Patel, R.; Weller, M.T.; Simon, C.","Ln Sr Sc O4 (Ln = La, Ce, Pr, Nd and Sm) systems and structure correlations for A2 B O4 (K2 Ni F4) structure types","Journal of Solid State Chemistry","2007","180","","349","359","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528790","5.76247","","5.73387","","12.3206","","90","","90","","90","","407.088","","","","","","","","","","","","","4","A b m a","-A 2ab 2ab","64","","(Pr Sr) Sc O4","","- O4 Pr Sc Sr -","- O4 Pr Sc Sr -","- O16 Pr4 Sc4 Sr4 -","4","","","Patel, R.; Simon, C.; Weller, M.T.","Ln Sr Sc O4 (Ln = La, Ce, Pr, Nd and Sm) systems and structure correlations for A2 B O4 (K2 Ni F4) structure types","Journal of Solid State Chemistry","2007","180","","349","359","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528791","4.08744","","4.08744","","12.657","","90","","90","","90","","211.463","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Pr Sr) Sc O4","","- O4 Pr Sc Sr -","- O4 Pr Sc Sr -","- O8 Pr2 Sc2 Sr2 -","2","0.0625","","Patel, R.; Simon, C.; Weller, M.T.","Ln Sr Sc O4 (Ln = La, Ce, Pr, Nd and Sm) systems and structure correlations for A2 B O4 (K2 Ni F4) structure types","Journal of Solid State Chemistry","2007","180","","349","359","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528792","5.74186","","5.70079","","12.2437","","90","","90","","90","","400.775","","","","","","","","","","","","","4","A b m a","-A 2ab 2ab","64","","(Nd Sr) Sc O4","","- Nd O4 Sc Sr -","- Nd O4 Sc Sr -","- Nd4 O16 Sc4 Sr4 -","4","","","Patel, R.; Weller, M.T.; Simon, C.","Ln Sr Sc O4 (Ln = La, Ce, Pr, Nd and Sm) systems and structure correlations for A2 B O4 (K2 Ni F4) structure types","Journal of Solid State Chemistry","2007","180","","349","359","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528793","5.73826","","5.69938","","12.2946","","90","","90","","90","","402.089","","","","","","","","","","","","","4","A b m a","-A 2ab 2ab","64","","(Sm Sr) Sc O4","","- O4 Sc Sm Sr -","- O4 Sc Sm Sr -","- O16 Sc4 Sm4 Sr4 -","4","","","Patel, R.; Simon, C.; Weller, M.T.","Ln Sr Sc O4 (Ln = La, Ce, Pr, Nd and Sm) systems and structure correlations for A2 B O4 (K2 Ni F4) structure types","Journal of Solid State Chemistry","2007","180","","349","359","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528795","6.617","","8.813","","5.426","","87.26","","85.68","","71.45","","299.034","","","","","","","","","","","","","5","P -1","-P 1","2","","Na1.93 Zr Si2 O6.93 (O H)0.07","","- H0.07 Na1.93 O7 Si2 Zr -","- Na1.934 O7 Si2 Zr -","- Na3.868 O14 Si4 Zr2 -","2","1","","Pekov, I.V.; Kolitsch, U.; Zubkova, N.V.; Pushcharovsky, D.Yu.; Tillmanns, E.","Refined crystal structure of parakeldyshite and the genetic crystal chemistry of zirconium minerals with [Si2 O7] diorthogroups","Kristallografiya","2007","52","","1100","1105","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528797","8.293","","4.7885","","16.4092","","90","","108.984","","90","","616.184","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ge (H P O4)2 (H2 O)","","- Ge H4 O9 P2 -","- Ge O9 P2 -","- Ge4 O36 P8 -","4","1","","Peters, L.; Evans, J.S.O.","Redetermination of the crystal structure of Ge (H P O4)2 * H2 O, and its thermal behaviour in the range 300 >= T >= 16 K","Journal of Solid State Chemistry","2007","180","","2363","2370","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528801","8.808","","7.2136","","9.6203","","90","","97.693","","90","","605.747","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Mn (H C O O)2 (H2 O)2)","","- C2 H6 Mn O6 -","- C2 H6 Mn O6 -","- C8 H24 Mn4 O24 -","4","1","","Poulsen, R.D.; Overgaard, J.; Jorgensen, M.R.V.; Iversen, B.B.; Morgenroth, W.; Larsen, F.K.; Graber, T.; Chen Yusheng","Synchrotron x-ray charge-density study of coordination polymer [Mn (H C O O)2 (H2 O)2](infinite)","Chemistry - A European Journal","2007","13","","9775","9790","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528855","12.9862","","3.8909","","6.7254","","90","","107.413","","90","","324.248","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Ta O N","","- N O Ta -","- N O Ta -","- N8 O8 Ta8 -","8","1","","Schilling, H.; Stork, A.; Lerch, M.; Irran, E.; Bredow, T.; Dronskowski, R.; Wolff, H.","gamma-Ta O N: A metastable polymorph of tantalum oxynitride","Angewandte Chemie (Edition international)","2007","46","","2931","2934","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528869","3.921698","","3.921698","","33.6415","","90","","90","","90","","517.397","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(Bi1.5 Sr2.5) (Nb2.5 Ru0.5) O12","","- Bi1.5 Nb2.5 O12 Ru0.5 Sr2.5 -","- Bi1.5 Nb2.5 O12 Ru0.5 Sr2.5 -","- Bi3 Nb5 O24 Ru Sr5 -","2","0.0625","","Sharma, N.; Ling, C.D.; Wrighter, G.E.; Chen, P.Y.; Kennedy, B.J.; Lee, P.L.","Three-layer Aurivillius phases containing magnetic transition metal cations: Bi(2-x) Sr(2+x) (Nb, Ta)(2+x) M(1-x) O12, M = Ru(4+), Ir(4+), Mn(4+), x = 0.5","Journal of Solid State Chemistry","2007","180","","370","376","","","","","","","","","","","","","","","","","","","","","","has coordinates","151621","2020-10-21","18:00:00",""
"1528891","13.9859","","21.187","","4.54","","90","","90","","90","","1345.29","","","","","","","","","","","","","4","I b a 2","I 2 -2c","45","","Sn (C H3 C O O)2","","- C4 H6 O4 Sn -","- C4 O4 Sn -","- C32 O32 Sn8 -","8","1","","Stafeeva, V.S.; Mitiaev, A.S.; Abakumov, A.M.; Antipov, E.V.; Makarevich, A.M.; Tsirlin, A.A.","Crystal structure and chemical bonding in tin(II) acetate","Polyhedron","2007","26","","5365","5369","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528912","2.8107","","2.8107","","14.2235","","90","","90","","120","","97.312","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Li0.68 Co O2","","- Co Li0.68 O2 -","- Co Li0.68 O2 -","- Co3 Li2.04 O6 -","3","0.0833333","","Takahashi, Y.; Kijima, N.; Dokko, K.; Nishizawa, M.; Akimoto, J.; Uchida, I.","Structure and electron density analysis of electrochemically and chemically delithiated Li Co O2 single crystals","Journal of Solid State Chemistry","2007","180","","313","321","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528913","2.809","","2.809","","14.389","","90","","90","","120","","98.325","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Li0.48 Co O2","","- Co Li0.48 O2 -","- Co Li0.48 O2 -","- Co3 Li1.44 O6 -","3","0.0833333","","Takahashi, Y.; Uchida, I.; Kijima, N.; Nishizawa, M.; Dokko, K.; Akimoto, J.","Structure and electron density analysis of electrochemically and chemically delithiated Li Co O2 single crystals","Journal of Solid State Chemistry","2007","180","","313","321","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528914","2.807","","2.807","","14.4359","","90","","90","","120","","98.505","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Li0.35 Co O2","","- Co Li0.35 O2 -","- Co Li0.35 O2 -","- Co3 Li1.05 O6 -","3","0.0833333","","Takahashi, Y.; Kijima, N.; Nishizawa, M.; Dokko, K.; Uchida, I.; Akimoto, J.","Structure and electron density analysis of electrochemically and chemically delithiated Li Co O2 single crystals","Journal of Solid State Chemistry","2007","180","","313","321","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528950","12.215","","12.394","","17.733","","85.05","","75.93","","63.74","","2334.65","","","","","","","","","","","","","5","P -1","-P 1","2","","(Sn (N (Si (C H3)3)2) C H2 Si (C H3)2 N (Si (C H3)3))2","","- C24 H70 N4 Si8 Sn2 -","- C24 H70 N4 Si8 Sn2 -","- C48 H140 N8 Si16 Sn4 -","2","1","","Veith, M.; Gasthauer, M.; Zimmer, M.; Huch, V.","Formation of a tin - tin - bond from bis(hexamethyldisilazyl)-tin(II) under fission of a C - H - bond","Zeitschrift fuer Anorganische und Allgemeine Chemie","2007","633","","2274","2277","","","","","","","","","","","","","","","","","","","","","","has coordinates","151822","2020-10-21","18:00:00",""
"1528971","7.092","","13.52","","7.166","","90","","90","","90","","687.104","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","Hf5 Ge4","","- Ge4 Hf5 -","- Ge4 Hf5 -","- Ge16 Hf20 -","4","0.5","","Warczok, P.; Mittendorfer, F.; Kresse, G.; Ipser, H.; Kroupa, A.; Richter, K.W.","Thermodynamic modelling of the partially ordered solid solution Hf(5-x) Nb(x) Ge4 supported by ab initio calculations","Solid State Sciences","2007","9","","159","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","151858","2020-10-21","18:00:00",""
"1528972","6.973","","13.506","","7.082","","90","","90","","90","","666.964","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Hf4 Nb Ge4","","- Ge4 Hf4 Nb -","- Ge4 Hf4 Nb -","- Ge16 Hf16 Nb4 -","4","0.5","","Warczok, P.; Ipser, H.; Mittendorfer, F.; Kroupa, A.; Kresse, G.; Richter, K.W.","Thermodynamic modelling of the partially ordered solid solution Hf(5-x) Nb(x) Ge4 supported by ab initio calculations","Solid State Sciences","2007","9","","159","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528973","6.816","","13.23","","6.96","","90","","90","","90","","627.623","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Hf2 Nb3 Ge4","","- Ge4 Hf2 Nb3 -","- Ge4 Hf2 Nb3 -","- Ge16 Hf8 Nb12 -","4","0.5","","Warczok, P.; Mittendorfer, F.; Kresse, G.; Kroupa, A.; Richter, K.W.; Ipser, H.","Thermodynamic modelling of the partially ordered solid solution Hf(5-x) Nb(x) Ge4 supported by ab initio calculations","Solid State Sciences","2007","9","","159","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","151860","2020-10-21","18:00:00",""
"1528974","6.754","","13.197","","6.829","","90","","90","","90","","608.686","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","Nb5 Ge4","","- Ge4 Nb5 -","- Ge4 Nb5 -","- Ge16 Nb20 -","4","0.5","","Warczok, P.; Mittendorfer, F.; Kresse, G.; Kroupa, A.; Ipser, H.; Richter, K.W.","Thermodynamic modelling of the partially ordered solid solution Hf(5-x) Nb(x) Ge4 supported by ab initio calculations","Solid State Sciences","2007","9","","159","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","151861","2020-10-21","18:00:00",""
"1528975","6.907","","13.338","","7.024","","90","","90","","90","","647.09","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Hf3 Nb2 Ge4","","- Ge4 Hf3 Nb2 -","- Ge4 Hf3 Nb2 -","- Ge16 Hf12 Nb8 -","4","0.5","","Warczok, P.; Mittendorfer, F.; Richter, K.W.; Kroupa, A.; Ipser, H.; Kresse, G.","Thermodynamic modelling of the partially ordered solid solution Hf(5-x) Nb(x) Ge4 supported by ab initio calculations","Solid State Sciences","2007","9","","159","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","151862","2020-10-21","18:00:00",""
"1529069","7.2162","","7.2162","","3.7573","","90","","90","","90","","195.656","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","Er Ni4 As2","","- As2 Er Ni4 -","- As2 Er Ni4 -","- As4 Er2 Ni8 -","2","0.125","","Zelinska, M.; Zhak, O.; Pivan, J.Y.; Polianska. T.; Oryshchyn, S.","Solid state phase equilibria in the Er-Ni-P and Er-Ni-As systems at 800","AnorganischeChemie, Organische","2007","62","","1143","1152","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529070","9.3505","","9.3505","","3.7981","","90","","90","","120","","287.585","","","","","","","","","","","","","3","P -6","P -6","174","","Er2 Ni12 As7","","- As7 Er2 Ni12 -","- As7 Er2 Ni12 -","- As7 Er2 Ni12 -","1","0.166667","","Zelinska, M.; Zhak, O.; Oryshchyn, S.; Polianska. T.; Pivan, J.Y.","Solid state phase equilibria in the Er-Ni-P and Er-Ni-As systems at 800","AnorganischeChemie, Organische","2007","62","","1143","1152","","","","","","","","","","","","","","","","","","","","","","has coordinates","152038","2020-10-21","18:00:00",""
"1529071","12.3989","","7.1873","","11.7608","","90","","90.796","","90","","1047.96","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Cr3.072 Ti1.788 Se8","","- Cr3.072 Se8 Ti1.788 -","- Cr2.061 Se4 Ti1.369 -","- Cr8.244 Se16 Ti5.476 -","4","0.5","","Wontcheu, J.; Kockelmann, W.; Huang Zhongle; Schnelle, W.; Bensch, W.","Synthesis, crystal structures, metal - atom distribution and magnetic properties of Cr(5-x) Ti(x) Se8 (x = 2, 3, 4)","Solid State Sciences","2007","9","","506","514","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1529072","12.3728","","7.167","","11.8301","","90","","90.66","","90","","1048.97","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Cr1.973 Ti2.711 Se8","","- Cr1.973 Se8 Ti2.711 -","- Cr1.3115 Se4 Ti2.0305 -","- Cr5.246 Se16 Ti8.122 -","4","0.5","","Wontcheu, J.; Kockelmann, W.; Schnelle, W.; Huang Zhongle; Bensch, W.","Synthesis, crystal structures, metal - atom distribution and magnetic properties of Cr(5-x) Ti(x) Se8 (x = 2, 3, 4)","Solid State Sciences","2007","9","","506","514","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1529073","12.3688","","7.1688","","11.931","","90","","90.62","","90","","1057.85","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Cr0.678 Ti4.03 Se8","","- Cr0.678 Se8 Ti4.03 -","- Cr0.409 Se4 Ti2.945 -","- Cr1.636 Se16 Ti11.78 -","4","0.5","","Wontcheu, J.; Kockelmann, W.; Bensch, W.; Schnelle, W.; Huang Zhongle","Synthesis, crystal structures, metal - atom distribution and magnetic properties of Cr(5-x) Ti(x) Se8 (x = 2, 3, 4)","Solid State Sciences","2007","9","","506","514","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1529417","9.01011","0.0001","9.01011","0.0001","9.01011","0.0001","90","","90","","90","","731.459","0.014","","","","","","","","","","","","6","F m -3 m","-F 4 2 3","225","","","","- F3 H12 K Mo N3 O3 -","- F3.00048 H8.00144 K Mo N2.00048 O3.00048 -","- F12.0019 H32.0058 K4 Mo4 N8.00192 O12.0019 -","4","0.0208333","","I.N. Flerov; M.V. Gorev; V.D. Fokina; A.F. Bovina; M.S. Molokeev; E.I. Pogoreltsev; N.M. Laptash","Heat capacity, structure, and p-T phase diagram of elpasolite (NH4)2KMoO3F3","Physics of the Solid State","2007","49","1","141","147","10.1134/S1063783407010234","powder diffraction","","","X-ray","","","","","","","","","5.8308","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1529418","5.9423","0.00006","14.42109","0.00012","7.14028","0.00007","90","","90","","90","","611.882","0.01","","","","","","","","","","","","5","C m c m","-C 2c 2","63","","","","- D12 F4 N2 O2 W -","- F4 N2 O2 W -","- F16 N8 O8 W4 -","4","0.25","","I.N. Flerov; V.D. Fokina; M.V. Gorev; E.V. Bogdanov; M.S. Molokeev; A.F. Bovina; A.G. Kocharova","Effect of deuteration on the thermal properties and structural parameters of the (NH4)2WO2F4 oxyfluoride","Physics of the Solid State","2007","49","6","1149","1156","10.1134/S1063783407060212","powder diffraction","","","X-ray","","","","","","","","","7.7246","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1535002","7.2016","","22.1372","","6.7662","","90","","94.932","","90","","1074.7","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(H9 O4)2 (Mo2 (S2)2 Cl8)","","- Cl8 H18 Mo2 O8 S4 -","- Cl8 H18 Mo2 O8 S4 -","- Cl16 H36 Mo4 O16 S8 -","2","0.5","","Sokolov, M.N.; Abramov, P.A.; Uvarov, N.F.; Peresypkina, E.V.; Virovets, A.V.; Gerasko, O.A.; Fedin, V.P.","Crystal structure and properties of (H9 O4)2 [Mo2 (S2)2 X8] (X = Cl, Br)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2007","633","","2288","2291","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536186","9.4424","","9.4424","","7.4105","","90","","90","","120","","572.194","","","","","","","","","","","","","5","R 3 2 :H","R 3 2""","155","","Bi Al Ga2 (B O3)4","","- Al B4 Bi Ga2 O12 -","- Al0.999 B4 Bi Ga2.001 O12 -","- Al2.997 B12 Bi3 Ga6.003 O36 -","3","0.166667","","Wang Shichao; Ye Ning","Nonlinear optical crystal Bi Al Ga2 (B O3)4","Solid State Sciences","2007","9","","713","717","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1542588","3.871","","3.871","","12.702","","90","","90","","90","","190.335","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- O4 Ru Sr2 -","- O4 Ru Sr2 -","- O8 Ru2 Sr4 -","2","0.0625","","Miwa, K.; Kagomiya, I.; Ohsato, H.; Sakai, H.; Maeda, Y.","Electrical properties of the Sr2 Ru1-x Tix O4 solid solutions","Journal of the European Ceramic Society","2007","27","","4287","4290","10.1016/j.jeurceramsoc.2007.02.146","","","","","","","","","","","","","","","","","","","","","has coordinates","177092","2020-10-21","18:00:00",""
"1544374","5.14036","0.00009","5.06489","0.00009","7.25745","0.00013","90","","90","","90","","188.95","0.006","","","","","","","","","","","","3","P n a m","-P 2c 2n","62","delta-Al(OD)3","","","- Al D3 O3 -","- Al D3 O3 -","- Al4 D12 O12 -","4","0.5","","Komatsu, K.; Sano, A.; Momma, K.; Ohtani, E.; Kudoh, Y.","Crystal structures of high-pressure phases in the alumina-water system: II. powder X-ray diffraction study of a new dense aluminum deuteroxide, delta-Al(OD)3","Z. Kristallogr.","2007","222","","13","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","187622","2020-10-21","18:00:00",""
"1544375","8.675","0.001","5.069","0.0007","9.726","0.001","90","","94.55","0.01","90","","426.34","0.09","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Al(OH)3 gibbsite","","gibbsite","- Al H3 O3 -","- Al H3 O3 -","- Al8 H24 O24 -","8","2","","Komatsu, K.; Kuribayashi, T.; Kudoh, Y.; Kagi, H.","Crystal structures of high-pressure phases in the alumina-water system: I. single crystal X-ray diffraction and molecular dynamics simulation of eta-Al(OH)3","Z. Kristallogr.","2007","222","","1","12","","","","","","","","","","","","","","","","","","","","","","has coordinates","187623","2020-10-21","18:00:00",""
"1544376","8.612","0.003","5.013","0.002","9.194","0.005","90","","90","","90","","396.9","0.3","","","","","","","","","","","","3","P 21/b 1 1","-P 2xab","14","Al(OH)3 eta phase","","eta-Al(OH)3","- Al H3 O3 -","- Al O3 -","- Al8 O24 -","8","2","","Komatsu, K.; Kuribayashi, T.; Kudoh, Y.; Kagi, H.","Crystal structures of high-pressure phases in the alumina-water system: I. single crystal X-ray diffraction and molecular dynamics simulation of eta-Al(OH)3 : sample at 3.0 GPa, RT","Z. Kristallogr.","2007","222","","1","12","","","","","","","","","","","","","","","","","","","","","","has coordinates","209174","2020-10-21","18:00:00",""
"1544454","6.6024","0.0007","12.4268","0.0001","7.4938","0.0006","90","","90","","98.35","","608.32","0.08","","","","","","","","","","","","3","P 1 21/n 1","-P 2n","14","Nd3IrO7","","","- Ir Nd3 O7 -","- Ir Nd3 O7 -","- Ir4 Nd12 O28 -","4","1","","Nishimine, H.; Doi, Y.; Hinatsu, Y.; Sato, M.","Phase transition of Ln3IrO7 (Ln=Pr,Nd,Sm,Eu) and its low-temperature structure","Journal of the Ceramic Society of Japan","2007","115","","557","581","","","","","","","","","","","","","","","","","","","","","","has coordinates","187771","2020-10-21","18:00:00",""
"1544455","10.8991","0.0001","7.4464","0.0007","7.493","0.0008","90","","90","","90","","608.12","0.09","","","","","","","","","","","","3","C m c m","-C 2c 2","63","Nd3IrO7@400K","","","- Ir Nd3 O7 -","- Ir Nd3 O7 -","- Ir4 Nd12 O28 -","4","0.25","","Nishimine, H.; Doi, Y.; Hinatsu, Y.; Sato, M.","Phase transition of Ln3IrO7 (Ln=Pr,Nd,Sm,Eu) and its low-temperature structure sample: at 400 K","Journal of the Ceramic Society of Japan","2007","115","","557","581","","","","","","","","","","","","","","","","","","","","","","has coordinates","187772","2020-10-21","18:00:00",""
"1544551","5.0365","0.0007","7.2908","0.0009","5.7491","0.0009","90","","90","","90","","211.11","0.05","","","","","","","","","","","","3","C m c m","-C 2c 2","63","AlPO4 CrVO4 structure @ 13.9 GPa","","","- Al O4 P -","- Al O4 P -","- Al4 O16 P4 -","4","0.25","","Pellicer-Porres, J.; Saitta, A.M.; Polian, A.; Itie, J.P.; Hanfland, M.","Six-fold-coordinated phosphours by oxygen in AlPO4 quartz homeotype under high pressure :Sample at 13.9 GPa","Nature Materials","2007","6","","698","702","","","","","","","","","","","","","","","","","","","","","","has coordinates","188434","2020-10-21","18:00:00",""
"1544552","3.838","0.001","2.506","0.005","4.036","0.008","90","","87.4","0.2","90","","38.78","0.11","","","","","","","","","","","","3","P 1 2/m 1","-P 2y","10","AlPO4 monoclinic CaCl2 structure @ 97.5 GPa","","","- Al O4 P -","- Al O4 P -","- Al O4 P -","1","0.25","","Pellicer-Porres, J.; Saitta, A.M.; Polian, A.; Itie, J.P.; Hanfland, M.","Six-fold-coordinated phosphours by oxygen in AlPO4 quartz homeotype under high pressure :Sample at 97.5 GPa","Nature Materials","2007","6","","698","702","","","","","","","","","","","","","","","","","","","","","","has coordinates","188435","2020-10-21","18:00:00",""
"1544562","8.46952","0.00008","8.46952","0.00008","8.46952","0.00008","90","","90","","90","","607.542","0.01","","","","","","","","","","","","3","F d -3 m","F 4d 2 3 -1d","227","Zn2TiO4 cubic spinel","","","- O4 Ti Zn2 -","- O4 Ti Zn2 -","- O32 Ti8 Zn16 -","8","","","Takai, S.; Shinohara, T.; Hoshikawa, A.; Harjo, S.; Oikawa, K.; Ishigaki, T.; Kamiyama, T.; Esaka, T.","Neutron diffraction study on the defect structure of Ta-substituted Zn2TiO4 oxide ion conductors","Journal of the Ceramic Society of Japan","2007","115","","780","785","","","","","","","","","","","","","","","","","","","","","","has coordinates","188460","2020-10-21","18:00:00",""
"1544563","8.4836","0.00006","8.4836","0.00006","8.4836","0.00006","90","","90","","90","","610.577","0.007","","","","","","","","","","","","4","F d -3 m","F 4d 2 3 -1d","227","Zn1.94Ti0.88Ta0.12O4","","","- O4 Ta0.12 Ti0.88 Zn1.94 -","- O4 Ta0.12 Ti0.88 Zn1.94 -","- O32 Ta0.96 Ti7.04 Zn15.52 -","8","","","Takai, S.; Shinohara, T.; Hoshikawa, A.; Harjo, S.; Oikawa, K.; Ishigaki, T.; Kamiyama, T.; Esaka, T.","Neutron diffraction study on the defect structure of Ta-substituted Zn2TiO4 oxide ion conductors","Journal of the Ceramic Society of Japan","2007","115","","780","785","","","","","","","","","","","","","","","","","","","","","","has coordinates","188461","2020-10-21","18:00:00",""
"1544564","8.48834","0.00008","8.48834","0.00008","8.48834","0.00008","90","","90","","90","","611.601","0.01","","","","","","","","","","","","4","F d -3 m","F 4d 2 3 -1d","227","Zn1.92Ti0.84Ta0.16O4 cubic spinel","","","- O4 Ta0.16 Ti0.84 Zn1.92 -","- O4 Ta0.16 Ti0.84 Zn1.92 -","- O32 Ta1.28 Ti6.72 Zn15.36 -","8","","","Takai, S.; Shinohara, T.; Hoshikawa, A.; Harjo, S.; Oikawa, K.; Ishigaki, T.; Kamiyama, T.; Esaka, T.","Neutron diffraction study on the defect structure of Ta-substituted Zn2TiO4 oxide ion conductors","Journal of the Ceramic Society of Japan","2007","115","","780","785","","","","","","","","","","","","","","","","","","","","","","has coordinates","188462","2020-10-21","18:00:00",""
"1544565","8.48707","0.0001","8.48707","0.0001","8.48707","0.0001","90","","90","","90","","611.327","0.012","","","","","","","","","","","","4","F d -3 m","F 4d 2 3 -1d","227","Zn1.925Ti0.85Ta0.15O4 cubic spinel","","","- O4 Ta0.15 Ti0.85 Zn1.925 -","- O4 Ta0.15 Ti0.85 Zn1.925 -","- O32 Ta1.2 Ti6.8 Zn15.4 -","8","","","Takai, S.; Shinohara, T.; Hoshikawa, A.; Harjo, S.; Oikawa, K.; Ishigaki, T.; Kamiyama, T.; Esaka, T.","Neutron diffraction study on the defect structure of Ta-substituted Zn2TiO4 oxide ion conductors","Journal of the Ceramic Society of Japan","2007","115","","780","785","","","","","","","","","","","","","","","","","","","","","","has coordinates","188463","2020-10-21","18:00:00",""
"1544566","8.48584","0.00007","8.48584","0.00007","8.48584","0.00007","90","","90","","90","","611.061","0.009","","","","","","","","","","","","4","F d -3 m","F 4d 2 3 -1d","227","Zn1.93Ti0.86Ta0.14O4 cubic spinel","","","- O4 Ta0.14 Ti0.86 Zn1.93 -","- O4 Ta0.14 Ti0.86 Zn1.93 -","- O32 Ta1.12 Ti6.88 Zn15.44 -","8","","","Takai, S.; Shinohara, T.; Hoshikawa, A.; Harjo, S.; Oikawa, K.; Ishigaki, T.; Kamiyama, T.; Esaka, T.","Neutron diffraction study on the defect structure of Ta-substituted Zn2TiO4 oxide ion conductors","Journal of the Ceramic Society of Japan","2007","115","","780","785","","","","","","","","","","","","","","","","","","","","","","has coordinates","188464","2020-10-21","18:00:00",""
"1544567","8.48705","0.00012","8.48705","0.00012","8.48705","0.00012","90","","90","","90","","611.322","0.015","","","","","","","","","","","","4","F d -3 m","F 4d 2 3 -1d","227","Zn1.95Ti0.9Ta0.1O4 cubic spinel","","","- O4 Ta0.1 Ti0.9 Zn1.95 -","- O4 Ta0.1 Ti0.9 Zn1.95 -","- O32 Ta0.8 Ti7.2 Zn15.6 -","8","","","Takai, S.; Shinohara, T.; Hoshikawa, A.; Harjo, S.; Oikawa, K.; Ishigaki, T.; Kamiyama, T.; Esaka, T.","Neutron diffraction study on the defect structure of Ta-substituted Zn2TiO4 oxide ion conductors","Journal of the Ceramic Society of Japan","2007","115","","780","785","","","","","","","","","","","","","","","","","","","","","","has coordinates","188465","2020-10-21","18:00:00",""
"1544568","6.08818","0.00016","6.08818","0.00016","8.40919","0.00029","90","","90","","90","","311.694","0.016","","","","","","","","","","","","4","P 43 2 2","P 4cw 2c","95","Zn1.7Ti0.4Ta0.6O4 tetragonal spinel","","","- O4 Ta0.6 Ti0.4 Zn1.7 -","- O4 Ta0.6 Ti0.4 Zn1.7 -","- O16 Ta2.4 Ti1.6 Zn6.8 -","4","0.5","","Takai, S.; Shinohara, T.; Hoshikawa, A.; Harjo, S.; Oikawa, K.; Ishigaki, T.; Kamiyama, T.; Esaka, T.","Neutron diffraction study on the defect structure of Ta-substituted Zn2TiO4 oxide ion conductors","Journal of the Ceramic Society of Japan","2007","115","","780","785","","","","","","","","","","","","","","","","","","","","","","has coordinates","188466","2020-10-21","18:00:00",""
"1544569","6.02256","0.00019","6.02256","0.00019","8.42382","0.00029","90","","90","","90","","305.542","0.017","","","","","","","","","","","","4","P 43 2 2","P 4cw 2c","95","Zn1.925Ti0.85Ta0.15O4 tetragonal spinel","","","- O4 Ta0.15 Ti0.85 Zn1.925 -","- O4 Ta0.15 Ti0.85 Zn1.925 -","- O16 Ta0.6 Ti3.4 Zn7.7 -","4","0.5","","Takai, S.; Shinohara, T.; Hoshikawa, A.; Harjo, S.; Oikawa, K.; Ishigaki, T.; Kamiyama, T.; Esaka, T.","Neutron diffraction study on the defect structure of Ta-substituted Zn2TiO4 oxide ion conductors","Journal of the Ceramic Society of Japan","2007","115","","780","785","","","","","","","","","","","","","","","","","","","","","","has coordinates","188467","2020-10-21","18:00:00",""
"1544616","4.762","0.002","10.216","0.002","5.99","0.002","90","","90","","90","","291.41","0.17","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","Mg1.85Fe0.14Si0.99H0.06O4 Fe-bearing hydrous forsterite","","Iron-bearing hydrous forsterite","- Fe0.14 H0.06 Mg1.85 O4 Si0.99 -","- Fe0.12 Mg1.85 O4 Si0.99 -","- Fe0.48 Mg7.4 O16 Si3.96 -","4","0.5","","Kudoh, Y.; Kuribayashi, T.; Litasov, K.; Ohtani, E.","Cation vacancies and possible hydrogen atom positions in Fe-bearing hydrous forsterite, Mg1.85Fe0.14Si0.99H0.06O4, synthesized at 13.5 GPa and 1400 ?C","Journal of Mineralogical and Petrological Sciences","2007","102","","306","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","188559","2020-10-21","18:00:00",""
"1544847","8.065","0.001","8.065","0.001","8.065","0.001","90","","90","","90","","524.58","0.11","","","","","","","1","","","","","4","F d -3 m","-F 4vw 2vw 3","227","Mg1.97SiH0.03O4 ringwoodite at 0 GPa","","ringwoodite","- H0.03 Mg1.97 O4 Si -","- Mg1.96 O4 Si -","- Mg15.68 O32 Si8 -","8","","","Kudoh, Y.; Kuribayashi, T.; Mizobata, H.; Ohtani, E.; Sasaki, S.; Tanaka, M.","Pressure dependence of u parameter in ringwoodite up to 7.9 GPa Sample: 0 GPa","Journal of Mineralogical and Petrological Sciences","2007","102","","8","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","190922","2020-10-21","18:00:00",""
"1544848","8.014","0.001","8.014","0.001","8.014","0.001","90","","90","","90","","514.69","0.11","","","","","","","3200000","","","","","4","F d -3 m","-F 4vw 2vw 3","227","Mg1.97SiH0.03O4 ringwoodite at 3.2 GPa","","ringwoodite","- H0.03 Mg1.97 O4 Si -","- Mg1.96 O4 Si -","- Mg15.68 O32 Si8 -","8","","","Kudoh, Y.; Kuribayashi, T.; Mizobata, H.; Ohtani, E.; Sasaki, S.; Tanaka, M.","Pressure dependence of u parameter in ringwoodite up to 7.9 GPa Sample: 3.2 GPa","Journal of Mineralogical and Petrological Sciences","2007","102","","8","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","190923","2020-10-21","18:00:00",""
"1544849","7.996","0.002","7.996","0.002","7.996","0.002","90","","90","","90","","511.2","0.2","","","","","","","5000000","","","","","4","F d -3 m","-F 4vw 2vw 3","227","Mg1.97SiH0.03O4 ringwoodite at 5.0 GPa","","ringwoodite","- H0.03 Mg1.97 O4 Si -","- Mg1.96 O4 Si -","- Mg15.68 O32 Si8 -","8","","","Kudoh, Y.; Kuribayashi, T.; Mizobata, H.; Ohtani, E.; Sasaki, S.; Tanaka, M.","Pressure dependence of u parameter in ringwoodite up to 7.9 GPa Sample: 5.0 GPa","Journal of Mineralogical and Petrological Sciences","2007","102","","8","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","190924","2020-10-21","18:00:00",""
"1544850","7.962","0.001","7.962","0.001","7.962","0.001","90","","90","","90","","504.74","0.11","","","","","","","7900000","","","","","4","F d -3 m","-F 4vw 2vw 3","227","Mg1.97SiH0.03O4 ringwoodite at 7.9 GPa","","ringwoodite","- H0.03 Mg1.97 O4 Si -","- Mg1.96 O4 Si -","- Mg15.68 O32 Si8 -","8","","","Kudoh, Y.; Kuribayashi, T.; Mizobata, H.; Ohtani, E.; Sasaki, S.; Tanaka, M.","Pressure dependence of u parameter in ringwoodite up to 7.9 GPa Sample: 7.9 GPa","Journal of Mineralogical and Petrological Sciences","2007","102","","8","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","190925","2020-10-21","18:00:00",""
"1544866","8.8815","0.0006","5.5956","0.0005","10.1532","0.0005","90","","115.159","0.002","90","","456.72","0.06","","","","","","","","","","","","8","P 1 21/m 1","-P 2yb","11","[Ca][Ca0.86Sr0.14][Al][Al][Al0.43Cr0.09Fe0.48]Si3O12(OH)","","chromian epidote","- Al2.43 Ca1.86 Cr0.09 Fe0.48 H O13 Si3 Sr0.14 -","- Al2.43 Ca1.86 Cr0.09 Fe0.48 O13 Si3 Sr0.14 -","- Al4.86 Ca3.72 Cr0.18 Fe0.96 O26 Si6 Sr0.28 -","2","0.5","","Nagashima, M.; Akasaka, M.; Kyono, A.; Makino, K.; Ikeda, K.","Distribution of chromium among the octahedral sites in chromian epidote from Iratsu, central Shikoku, Japan Sample: CrEp1","Journal of Mineralogical and Petrological Sciences","2007","102","","240","254","","","","","","","","","","","","","","","","","","","","","","has coordinates","189383","2020-10-21","18:00:00",""
"1544867","8.9165","0.0004","5.6226","0.0002","10.1728","0.0005","90","","115.237","0.0009","90","","461.33","0.03","","","","","","","","","","","","8","P 1 21/m 1","-P 2yb","11","[Ca][Ca0.9Sr0.1][Al0.86Cr0.14][Al][Al0.34Cr0.17Fe0.49]Si3O12(OH)","","chromian epidote","- Al2.2 Ca1.9 Cr0.17 Fe0.49 H O13 Si3 Sr0.1 -","- Al2.2 Ca1.9 Cr0.31 Fe0.49 O13 Si3 Sr0.1 -","- Al4.4 Ca3.8 Cr0.62 Fe0.98 O26 Si6 Sr0.2 -","2","0.5","","Nagashima, M.; Akasaka, M.; Kyono, A.; Makino, K.; Ikeda, K.","Distribution of chromium among the octahedral sites in chromian epidote from Iratsu, central Shikoku, Japan Sample: CrEp2","Journal of Mineralogical and Petrological Sciences","2007","102","","240","254","","","","","","","","","","","","","","","","","","","","","","has coordinates","189384","2020-10-21","18:00:00",""
"1544868","8.895","0.002","5.61","0.001","10.146","0.002","90","","115.177","0.002","90","","458.2","0.16","","","","","","","","","","","","8","P 1 21/m 1","-P 2yb","11","[Ca][Ca0.88Sr0.12][Al0.9Cr0.1][Al][Al0.37Cr0.12Fe0.51]Si3O12(OH)","","chromian epidote","- Al2.27 Ca1.88 Cr0.22 Fe0.51 H O13 Si3 Sr0.12 -","- Al2.27 Ca1.88 Cr0.22 Fe0.51 O13 Si3 Sr0.12 -","- Al4.54 Ca3.76 Cr0.44 Fe1.02 O26 Si6 Sr0.24 -","2","0.5","","Nagashima, M.; Akasaka, M.; Kyono, A.; Makino, K.; Ikeda, K.","Distribution of chromium among the octahedral sites in chromian epidote from Iratsu, central Shikoku, Japan Sample: CrEp3","Journal of Mineralogical and Petrological Sciences","2007","102","","240","254","","","","","","","","","","","","","","","","","","","","","","has coordinates","189385","2020-10-21","18:00:00",""
"1544908","15.874","0.003","15.874","0.003","7.116","0.003","90","","90","","120","","1552.9","0.8","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","(Na0.64_0.264)(Al0.415Li0.458)3Al6(BO3)3Si6O18{(OH)0.75F0.179}4","","elbaite","- Al7.2 B3 Ca0.09 F0.72 H3 K0.06 Na0.64 O30 Si6 -","- Al7.245 B3 H3 Li1.374 Na0.64 O31 Si6 -","- Al21.735 B9 H9 Li4.122 Na1.92 O93 Si18 -","3","0.166667","","Kihara, K.; Hirata, H.; Ida, A.; Okudera, H.; Morishita, T.","An X-ray single crystal study of asymmetric thermal vibrations and the positional disorder of atoms in elbaite Refinement type: harmonic","Journal of Mineralogical and Petrological Sciences","2007","102","","115","126","","","","","","","","","","","","","","","","","","","","","","has coordinates","208816","2020-10-21","18:00:00",""
"1545062","5.5177","0.0004","5.5201","0.0003","25.0229","0.0009","90","","90","","90","","762.15","0.07","","","","","","","","","","","","6","A 21 a m","A -2 2a","36","(Sr0.9Ce0.1)Bi2(Ta1.714Si0.286)O9","","","- Bi2 Ce0.1 O9 Si0.286 Sr0.9 Ta1.714 -","- Bi2 Ce0.1 O9 Si0.286 Sr0.9 Ta1.714 -","- Bi8 Ce0.4 O36 Si1.144 Sr3.6 Ta6.856 -","4","0.5","","Idemoto, Y.; Taniyama, S.","Changes in crystal structure and ferroelectric properties of Sr-Ce-Bi-Ta-Si-O ferroelectric material by Ce substitution, Bi-Si-O addition","Journal of the Ceramic Society of Japan","2007","115","","960","966","","","","","","","","","","","","","","","","","","","","","","has coordinates","190658","2020-10-21","18:00:00",""
"1545130","5.57558","0.00017","5.63998","0.00013","7.8878","0.0002","90","","90","0.01","90","","248.041","0.011","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","La2CoRuO6 double perovskite","","","- Co La2 O6 Ru -","- Co La2 O6 Ru -","- Co2 La4 O12 Ru2 -","2","0.5","","Kawano, T.; Takahashi, J.; Yamada, T.; Yamane, H.","Preparation, crystal structure and high-temperature thermoelectric properties of double perovskite-type rare-earth cobalt ruthenium oxides","Journal of the Ceramic Society of Japan","2007","115","","792","796","","","","","","","","","","","","","","","","","","","","","","has coordinates","190845","2020-10-21","18:00:00",""
"1545131","5.48355","0.00017","5.69605","0.00012","7.7841","0.0003","90","","90.01","0.01","90","","243.133","0.013","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Pr2CoRuO6 double perovskite","","","- Co O6 Pr2 Ru -","- Co0.99 O6 Pr2 Ru0.99 -","- Co1.98 O12 Pr4 Ru1.98 -","2","0.5","","Kawano, T.; Takahashi, J.; Yamada, T.; Yamane, H.","Preparation, crystal structure and high-temperature thermoelectric properties of double perovskite-type rare-earth cobalt ruthenium oxides","Journal of the Ceramic Society of Japan","2007","115","","792","796","","","","","","","","","","","","","","","","","","","","","","has coordinates","190846","2020-10-21","18:00:00",""
"1545132","5.324","0.00009","5.74387","0.0001","7.61279","0.00013","90","","90.002","0.011","90","","232.802","0.007","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Gd2CoRuO6 double perovskite","","","- Co Gd2 O6 Ru -","- Co Gd2 O6 Ru -","- Co2 Gd4 O12 Ru2 -","2","0.5","","Kawano, T.; Takahashi, J.; Yamada, T.; Yamane, H.","Preparation, crystal structure and high-temperature thermoelectric properties of double perovskite-type rare-earth cobalt ruthenium oxides","Journal of the Ceramic Society of Japan","2007","115","","792","796","","","","","","","","","","","","","","","","","","","","","","has coordinates","190847","2020-10-21","18:00:00",""
"1545133","5.34856","0.00009","5.74709","0.00009","7.6348","0.00013","90","","90.005","0.012","90","","234.683","0.007","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Eu2CoRuO6 double perovskite","","","- Co Eu2 O6 Ru -","- Co Eu2 O6 Ru -","- Co2 Eu4 O12 Ru2 -","2","0.5","","Kawano, T.; Takahashi, J.; Yamada, T.; Yamane, H.","Preparation, crystal structure and high-temperature thermoelectric properties of double perovskite-type rare-earth cobalt ruthenium oxides","Journal of the Ceramic Society of Japan","2007","115","","792","796","","","","","","","","","","","","","","","","","","","","","","has coordinates","190848","2020-10-21","18:00:00",""
"1545134","5.37936","0.00015","5.73972","0.00014","7.67067","0.00019","90","","90","0.01","90","","236.84","0.011","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Sm2CoRuO6 double perovskite","","","- Co O6 Ru Sm2 -","- Co O6 Ru Sm2 -","- Co2 O12 Ru2 Sm4 -","2","0.5","","Kawano, T.; Takahashi, J.; Yamada, T.; Yamane, H.","Preparation, crystal structure and high-temperature thermoelectric properties of double perovskite-type rare-earth cobalt ruthenium oxides","Journal of the Ceramic Society of Japan","2007","115","","792","796","","","","","","","","","","","","","","","","","","","","","","has coordinates","190849","2020-10-21","18:00:00",""
"1545135","5.44137","0.00015","5.7186","0.00015","7.7409","0.0002","90","","90.01","0.01","90","","240.874","0.011","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Nd2CoRuO6 double perovskite","","","- Co Nd2 O6 Ru -","- Co Nd2 O6 Ru -","- Co2 Nd4 O12 Ru2 -","2","0.5","","Kawano, T.; Takahashi, J.; Yamada, T.; Yamane, H.","Preparation, crystal structure and high-temperature thermoelectric properties of double perovskite-type rare-earth cobalt ruthenium oxides","Journal of the Ceramic Society of Japan","2007","115","","792","796","","","","","","","","","","","","","","","","","","","","","","has coordinates","190850","2020-10-21","18:00:00",""
"1545154","7.993","0.002","7.993","0.002","7.993","0.002","90","","90","","90","","510.7","0.2","","","","","","","6200000","","","","","4","F d -3 m","-F 4vw 2vw 3","227","Mg1.97SiH0.03O4 ringwoodite at 6.2 GPa","","ringwoodite","- H0.03 Mg1.97 O4 Si -","- Mg1.96 O4 Si -","- Mg15.68 O32 Si8 -","8","","","Kudoh, Y.; Kuribayashi, T.; Mizobata, H.; Ohtani, E.; Sasaki, S.; Tanaka, M.","Pressure dependence of u parameter in ringwoodite up to 7.9 GPa Sample: 6.2 GPa","Journal of Mineralogical and Petrological Sciences","2007","102","","8","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","190926","2020-10-21","18:00:00",""
"1547180","13.3686","0.0005","10.4704","0.0004","8.7799","0.0003","90","","90","","90","","1228.96","0.08","120","2","120","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C3 H6 Cl4 N3 O2 P3 -","- C3 H6 Cl4 N3 O2 P3 -","- C12 H24 Cl16 N12 O8 P12 -","4","1","","Simon J Coles; David B Davies; Michael B Hursthouse; Susanne L Huth; Adem Kilic; Mark E Light; Marianne Odlyha; John S Rutherford; Robert A Shaw; Aylin Uslu","Characterisation of temperature-dependent phase transitions in 2,2-trimethylenedioxy- 4,4,6,6-tetrachlorocyclotriphosphazene, N3P3Cl4[O(CH2)3O]","Chemistry Central Journal","2007","1","","20","","10.1186/1752-153X-1-20","","","0.71073","MoKα","","0.0286","0.0253","","","0.0615","0.0631","","","","","","0.922","","","","has coordinates","200920","2020-10-21","18:00:00",""
"1547181","13.4804","0.0014","10.6442","0.0009","8.8479","0.0007","90","","90","","90","","1269.6","0.2","274","2","274","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C3 H6 Cl4 N3 O2 P3 -","- C3 H6 Cl4 N3 O2 P3 -","- C12 H24 Cl16 N12 O8 P12 -","4","1","","Simon J Coles; David B Davies; Michael B Hursthouse; Susanne L Huth; Adem Kilic; Mark E Light; Marianne Odlyha; John S Rutherford; Robert A Shaw; Aylin Uslu","Characterisation of temperature-dependent phase transitions in 2,2-trimethylenedioxy- 4,4,6,6-tetrachlorocyclotriphosphazene, N3P3Cl4[O(CH2)3O]","Chemistry Central Journal","2007","1","","20","","10.1186/1752-153X-1-20","","","0.71073","MoKα","","0.038","0.0334","","","0.0871","0.0905","","","","","","1.047","","","","has coordinates","200921","2020-10-21","18:00:00",""
"1547182","10.666","0.002","13.489","0.003","8.8593","0.0018","90","","90","","90","","1274.6","0.5","293","2","293","2","","","","","","","","6","C m c 21","C 2c -2","36","","","","- C3 H6 Cl4 N3 O2 P3 -","- C3 H6 Cl4 N3 O2 P3 -","- C12 H24 Cl16 N12 O8 P12 -","4","0.5","","Simon J Coles; David B Davies; Michael B Hursthouse; Susanne L Huth; Adem Kilic; Mark E Light; Marianne Odlyha; John S Rutherford; Robert A Shaw; Aylin Uslu","Characterisation of temperature-dependent phase transitions in 2,2-trimethylenedioxy- 4,4,6,6-tetrachlorocyclotriphosphazene, N3P3Cl4[O(CH2)3O]","Chemistry Central Journal","2007","1","","20","","10.1186/1752-153X-1-20","","","0.71073","MoKα","","0.0479","0.0366","","","0.0877","0.0933","","","","","","1.047","","","","has coordinates","200922","2020-10-21","18:00:00",""
"1547248","10.2783","0.0003","13.6919","0.0003","15.4164","0.0004","102.863","0.002","102.187","0.002","108.805","0.002","1905.83","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Pyrimethamine benzene sulfonate monohydrate","'2,4-diamino-5-(p-chlorophenyl)-6-ethylpyrimidinium benzene sulfonate monohydrate'","","- C72 H76 Cl4 N16 O14 S4 -","- C72 H76 Cl4 N16 O12.82 S4 -","- C72 H76 Cl4 N16 O12.82 S4 -","1","0.5","","Kasthuri Balasubramani; Packianathan Thomas Muthiah; Daniel E Lynch","R22(8) motifs in Aminopyrimidine sulfonate/carboxylate interactions: Crystal structures of pyrimethaminium benzenesulfonate monohydrate (2:2:1) and 2-amino-4,6-dimethylpyrimidinium sulfosalicylate dihydrate (4:2:2)","Chemistry Central Journal","2007","1","","28","","10.1186/1752-153X-1-28","","","0.71073","MoKα","","0.0954","0.0509","","","0.1146","0.1314","","","","","","1.057","","","","has coordinates","201067","2020-10-21","18:00:00",""
"1547249","9.2466","0.0002","14.0976","0.0003","17.6365","0.0004","94.028","0.001","101.193","0.001","91.968","0.001","2247","0.09","120","2","120","2","","","","","","","","5","P -1","-P 1","2","tetra(2-amino-4,6-dimethylpyrimidinium) bis(sulfosalicylate) dihydrate","'tetra(2-amino-4,6-dimethylpyrimidinium) bis(sulfosalicylate) dihydrate'","","- C19 H25 N6 O7 S -","- C19 H25 N6 O7 S -","- C76 H100 N24 O28 S4 -","4","2","","Kasthuri Balasubramani; Packianathan Thomas Muthiah; Daniel E Lynch","R22(8) motifs in Aminopyrimidine sulfonate/carboxylate interactions: Crystal structures of pyrimethaminium benzenesulfonate monohydrate (2:2:1) and 2-amino-4,6-dimethylpyrimidinium sulfosalicylate dihydrate (4:2:2)","Chemistry Central Journal","2007","1","","28","","10.1186/1752-153X-1-28","","","0.71073","MoKα","","0.076","0.0592","","","0.1407","0.1518","","","","","","1.084","","","","has coordinates","214153","2020-10-21","18:00:00",""
"1549542","6.9123","0.0006","9.2484","0.0005","10.8243","0.0007","74.208","0.006","75.558","0.007","68.251","0.006","609.85","0.08","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H34 N2 Ni O16 -","- C16 H34 N2 Ni O16 -","- C16 H34 N2 Ni O16 -","1","0.5","","Köferstein, Roberto; Robl, Christian","[(C6H10)(NH3)2][Ni(H2O)4C6H2(COO)4]·4H2O ‒ A Coordination Polymer with the Chain-like Polyanion {Ni(H2O)4[C6H2(COO)4]2−}n","Zeitschrift für anorganische und allgemeine Chemie","2007","633","9","1323","","10.1002/zaac.200700139","","","","","","0.028","0.026","","","","","","","","","","","","","","has coordinates","208315","2020-10-21","18:00:00",""
"1552084","18.21","0.03","19.99","0.03","8.632","0.013","90","","100.39","0.05","90","","3091","8","223.2","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H12 N5 Ni0.5 O2.5 -","- C28 H24 N10 Ni O5 -","- C112 H96 N40 Ni4 O20 -","4","0.5","","Tapas Kumar Maj; Ryotaro Matsuda; Susumu Kitagawa","A flexible interpenetrating coordination framework with a bimodal porous functionality","Nature Materials","2007","6","","142","148","10.1038/nmat1827","","","0.7107","MoKα","","","0.0573","","","","0.0833","","","","","","1.222","","","","has coordinates","216962","2020-10-21","18:00:00",""
"1552085","18.56","0.11","19.7","0.22","8.63","0.05","90","","100.29","0.2","90","","3105","4","373.2","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C13.5 H12 N5 Ni0.5 -","- C27 H24 N10 Ni -","- C108 H96 N40 Ni4 -","4","0.5","","Tapas Kumar Maj; Ryotaro Matsuda; Susumu Kitagawa","A flexible interpenetrating coordination framework with a bimodal porous functionality","Nature Materials","2007","6","","142","148","10.1038/nmat1827","","","0.7107","MoKα","","","0.1148","","","","0.1867","","","","","","1.692","","","","has coordinates","216963","2020-10-21","18:00:00",""
"1556079","11.5652","0.0019","4.8925","0.0008","13.332","0.002","90","","92.835","0.003","90","","753.4","0.2","90","2","90","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C14 H12 Br Cl N2 O4 -","- C14 H12 Br Cl N2 O4 -","- C28 H24 Br2 Cl2 N4 O8 -","2","1","","Robins, Lori I.; Fettinger, James C.; Tinti, Dino S.; Kurth, Mark J.","Selective nucleophilic chemistry in the synthesis of 5-carbamoyl-3-sulfanylmethylisoxazole-4-carboxylic acids.","Journal of combinatorial chemistry","2007","9","1","139","142","10.1021/cc0601074","","","0.71073","MoKα","","0.0682","0.0552","","","0.1437","0.1484","","","","","","1.048","","","","has coordinates","239709","2020-10-21","18:00:00",""
"1556092","9.0288","0.0007","17.5533","0.0013","12.8039","0.001","90","","102.095","0.001","90","","1984.2","0.3","100","0.1","100","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","eispd06","","","- C23 H16 Cl N3 O4 Pt -","- C23 H16 Cl N3 O4 Pt -","- C92 H64 Cl4 N12 O16 Pt4 -","4","1","","Du, Pingwu; Schneider, Jacob; Jarosz, Paul; Zhang, Jie; Brennessel, William W.; Eisenberg, Richard","Photoinduced electron transfer in platinum(II) terpyridyl acetylide chromophores: reductive and oxidative quenching and hydrogen production.","The journal of physical chemistry. B","2007","111","24","6887","6894","10.1021/jp072187n","","","0.71073","MoKα","","0.02","0.0173","","","0.0378","0.0386","","","","","","1.044","","","","has coordinates","243452","2020-10-21","18:00:00",""
"1556116","25.446","0.002","5.8028","0.0006","16.3488","0.0015","90","","110.637","0.006","90","","2259.1","0.4","193","","193","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C24.5 H26 N O4.5 S -","- C24.5 H26 N O4.5 S -","- C98 H104 N4 O18 S4 -","4","1","","Tanaka, Ken; Osaka, Takuya; Noguchi, Keiichi; Hirano, Masao","Rhodium-catalyzed asymmetric one-pot transesterification and [2 + 2 + 2] cycloaddition leading to enantioenriched 3,3-disubstituted phthalides.","Organic letters","2007","9","7","1307","1310","10.1021/ol070179j","","","1.54187","CuKα","","0.0397","0.0381","","","0.1041","0.1056","","","","","","1.057","","","","has coordinates","244972","2020-10-21","18:00:00",""
"1556117","10.2528","0.0005","10.7389","0.0005","47.533","0.002","90","","90","","90","","5233.6","0.4","193","","193","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C31 H27 N O4 S -","- C31 H27 N O4 S -","- C248 H216 N8 O32 S8 -","8","2","","Tanaka, Ken; Osaka, Takuya; Noguchi, Keiichi; Hirano, Masao","Rhodium-catalyzed asymmetric one-pot transesterification and [2 + 2 + 2] cycloaddition leading to enantioenriched 3,3-disubstituted phthalides.","Organic letters","2007","9","7","1307","1310","10.1021/ol070179j","","","1.54187","CuKα","","0.0439","0.0391","","","0.0985","0.1026","","","","","","1.074","","","","has coordinates","244972","2020-10-21","18:00:00",""
"1560296","12.191","0.002","5.344","0.0009","13.545","0.002","90","","112.401","0.003","90","","815.8","0.2","293","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","alpha-N,N''-diacetylbiuret","alpha-1,5-diacetyl biuret","","- C6 H9 N3 O4 -","- C6 H9 N3 O4 -","- C24 H36 N12 O16 -","4","1","","Macholl, Sven; Lentz, Dieter; Börner, Frank; Buntkowsky, Gerd","Polymorphism ofN,N′′-Diacetylbiuret Studied by Solid-State13C and15N NMR Spectroscopy, DFT Calculations, and X-ray Diffraction","Chemistry - A European Journal","2007","13","21","6139","6149","10.1002/chem.200601843","","","0.71073","MoKα","","0.069","0.0586","","","0.1626","0.1779","","","","","","1.028","","","","has coordinates","261835","2021-02-07","10:51:49",""
"1560297","4.4215","0.0012","20.224","0.006","9.3","0.003","90","","93.496","0.006","90","","830.1","0.4","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","beta-N,N''-diacetylbiuret","beta-1,5-diacteyl biuret","","- C6 H9 N3 O4 -","- C6 H9 N3 O4 -","- C24 H36 N12 O16 -","4","1","","Macholl, Sven; Lentz, Dieter; Börner, Frank; Buntkowsky, Gerd","Polymorphism ofN,N′′-Diacetylbiuret Studied by Solid-State13C and15N NMR Spectroscopy, DFT Calculations, and X-ray Diffraction","Chemistry - A European Journal","2007","13","21","6139","6149","10.1002/chem.200601843","","","0.71073","MoKα","","0.0754","0.0448","","","0.0963","0.1085","","","","","","1.049","","","","has coordinates","261836","2021-02-07","10:52:48",""
"1570311","12.5009","0.0004","6.0316","0.00017","12.5303","0.0004","102.845","0.003","113.202","0.0018","74.467","0.003","829.35","0.05","","","","","","","","","","","","3","P -1","-P 1","2","Heptalithium tetrasulfidophosphate(V) heptasulfidodiphosphate(V)","","","- Li7 P3 S11 -","- Li7 P3 S11 -","- Li14 P6 S22 -","2","1","","Yamane, H.; Shibata, M.; Shimane, Y.; Junke, T.; Seino, Y.; Adams, S.; Minami, K.; Hayashi, A; Tatsumisago, M.","Crystal structure of a superionic conductor, Li7P3S11","Solid State Ionics","2007","178","15-18","1163","1167","10.1016/j.ssi.2007.05.020","","","","","","","","","","","","","","","","","","","","","has coordinates","287620","2023-11-15","17:28:15",""
"2015717","13.193","0.003","13.982","0.003","20.193","0.004","90","","91.36","0.03","90","","3723.8","1.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","decaaqua-1κ^3^O,2κ^4^O,3κ^3^O-bis(benzene-1,3,5-tricarboxylato)- 1κO,3κO-di-μ-4,4'-bipyridine-1:2κ^2^N:N';2:3κ^2^N:N'-di-4,4'-bipyridine- 1κN,3κN-tricobalt(II) 4,4'-bipyridine solvate octahydrate","","- C68 H82 Co3 N10 O30 -","- C68 H82 Co3 N10 O30 -","- C136 H164 Co6 N20 O60 -","2","0.5","AV3039","Hong-Zhen Xie; Zhi-Feng Li; Yue-Qing Zheng","A new trinuclear cobalt(II) complex: decaaqua-1κ^3^<i>O</i>,2κ^4^<i>O</i>,3κ^3^<i>O</i>-bis(benzene-1,3,5-tricarboxylato)-1κ<i>O</i>,3κ<i>O</i>-di-μ-4,4'-bipyridine-1:2κ^2^<i>N</i>:<i>N</i>';2:3κ^2^<i>N</i>:<i>N</i>'-di-4,4'-bipyridine-1κ<i>N</i>,3κ<i>N</i>-tricobalt(II) 4,4'-bipyridine solvate octahydrate","Acta Crystallographica Section C","2007","63","1","m30","m32","10.1107/S0108270106044726","","","0.71073","MoKα","","0.1468","0.0642","","","0.1249","0.1543","","","","","","1.005","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015718","12.823","0.003","8.28","0.0017","16.776","0.003","90","","101.53","0.03","90","","1745.2","0.7","298","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","poly[[μ-4,4'-bipyridine-μ~3~-pyridine,2,4,6-tricarboxylato-dicopper(I,II)] monohydrate]","","- C18 H12 Cu2 N3 O7 -","- C18 H12 Cu2 N3 O7 -","- C72 H48 Cu8 N12 O28 -","4","1","AV3040","You-Ren Dong; Xian-Wen Wang; Yue-Qing Zheng","A novel mixed-valence copper complex, poly[[μ~2~-4,4'-bipyridine-μ~3~-pyridine-2,4,6-tricarboxylato-dicopper(I,II)] monohydrate]","Acta Crystallographica Section C","2007","63","1","m19","m21","10.1107/S0108270106044751","","","0.71073","MoKα","","0.2079","0.056","","","0.082","0.1157","","","","","","0.899","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015719","7.5109","0.0012","11.9244","0.0017","8.1794","0.0012","90","","98.405","0.013","90","","724.7","0.19","113","2","113","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","1,3,5-trihydroxy-1,3,5-triazinane-2,4,6-trione dihydrate","","- C3 H7 N3 O8 -","- C3 H7 N3 O8 -","- C12 H28 N12 O32 -","4","1","AV3046","Đilović, Ivica; Matković-Čalogović, Dubravka; Kos, Ivan; Biruš, Mladen; Jadrijević-Mladar Takač, Milena","Cyclic trihydroxamic acid derivatives","Acta Crystallographica Section C","2007","63","1","o45","o47","10.1107/S0108270106049985","","","0.71073","MoKα","","0.0369","0.0335","","","0.0854","0.0881","","","","","","1.122","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2015720","7.765","0.002","12.139","0.003","12.783","0.003","66.36","0.02","76.78","0.02","82.79","0.02","1073.8","0.5","113","2","113","2","","","","","","","","4","P -1","-P 1","2","","1,3,5-benzyloxy-1,3,5-triazinane-2,4,6-trione","","- C24 H21 N3 O6 -","- C24 H21 N3 O6 -","- C48 H42 N6 O12 -","2","1","AV3046","Đilović, Ivica; Matković-Čalogović, Dubravka; Kos, Ivan; Biruš, Mladen; Jadrijević-Mladar Takač, Milena","Cyclic trihydroxamic acid derivatives","Acta Crystallographica Section C","2007","63","1","o45","o47","10.1107/S0108270106049985","","","0.71073","MoKα","","0.0722","0.0545","","","0.1441","0.1669","","","","","","1.045","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015721","8.17","0.0012","8.9036","0.0013","15.279","0.002","100.828","0.002","90.935","0.002","104.581","0.002","1054.1","0.3","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-3-nitro-1,2-benzenedicarboxylato) -κ^8^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^2^,<i>O</i>^3^;O^3^,<i>O</i>^2^:\ <i>O</i>^2^,<i>O</i>^1^ -bis[triaqua(3-nitro-2-carboxybenzoato-κ^2^<i>O</i>,<i>O</i>')lanthanum(III)] dihydrate","","- C32 H30 La2 N4 O32 -","- C32 H30 La2 N4 O32 -","- C32 H30 La2 N4 O32 -","1","0.5","AV3048","Xiong, Li-Qin; Qi, Chuan-Min","Bis(μ-3-nitrobenzene-1,2-dicarboxylato)-κ^8^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^2^,<i>O</i>^3^;O^3^,<i>O</i>^2^:<i>O</i>^2^,<i>O</i>^1^-bis[triaqua(2-carboxy-3-nitrobenzoato-κ^2^<i>O</i>,<i>O</i>')lanthanum(III)] dihydrate","Acta Crystallographica Section C","2007","63","1","m10","m12","10.1107/S0108270106047822","","","0.71073","MoKα","","0.03","0.0243","","","0.0565","0.059","","","","","","1.059","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015722","5.7037","0.0007","10.7251","0.0014","10.5678","0.0014","90","","90.267","0.002","90","","646.45","0.14","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","BTSA","Bis(tert-butylsulfonyl)ethyne","","- C10 H18 O4 S2 -","- C10 H18 O4 S2 -","- C20 H36 O8 S4 -","2","0.5","AV3049","Werz, Daniel B.; Ohlbach, Frank; Rominger, Frank; Gleiter, Rolf","Bis(<i>tert</i>-butylsulfonyl)ethyne and 1-<i>tert</i>-butylsulfinyl-2-<i>tert</i>-butylsulfonylethyne","Acta Crystallographica Section C","2007","63","1","o1","o3","10.1107/S0108270106047834","","","0.71073","MoKα","","0.0378","0.0368","","","0.0837","0.0842","","","","","","1.278","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015723","5.7463","0.0004","10.7328","0.0008","10.5299","0.0007","90","","92.109","0.001","90","","648.98","0.08","200","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-tert-Butylsulfonyl-2-tert-butylsulfinylethyne","","- C10 H18 O3 S2 -","- C10 H18 O3 S2 -","- C20 H36 O6 S4 -","2","0.5","AV3049","Werz, Daniel B.; Ohlbach, Frank; Rominger, Frank; Gleiter, Rolf","Bis(<i>tert</i>-butylsulfonyl)ethyne and 1-<i>tert</i>-butylsulfinyl-2-<i>tert</i>-butylsulfonylethyne","Acta Crystallographica Section C","2007","63","1","o1","o3","10.1107/S0108270106047834","","","","","","0.0842","0.0618","","","0.1342","0.1474","","","","","","1.052","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015724","8.256","0.002","16.343","0.003","10.647","0.005","90","","95.499","0.003","90","","1430","0.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dimagnesium μ-oxo-bis(pentachlororuthenate(IV) hexadecahydrate","","- Cl10 H32 Mg2 O17 Ru2 -","- Cl10 H32 Mg2 O17 Ru2 -","- Cl20 H64 Mg4 O34 Ru4 -","2","0.5","BC3021","Boufas, Sihem; Merazig, Hocine; Bendjeddou, Lamia; Dénés, Georges; Beghidja, Adel","Mg~2~Ru~2~Cl~10~O·16H~2~O","Acta Crystallographica Section C","2007","63","1","i7","i9","10.1107/S0108270106050839","","","0.71073","MoKα","","","0.0284","","","","0.0634","","","","","","1.039","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2015725","7.262","0.001","7.262","0.001","22.47","0.005","90","","90","","120","","1026.2","0.3","293","2","293","2","","","","","","","","4","P 63/m m c","-P 6c 2c","194","Magnesium selenite 7.5-hydrate","","","- H15 Mg O10.5 Se -","- H14.98 Mg O10.5 Se -","- H59.92 Mg4 O42 Se4 -","4","0.166667","BC3022","Michel Fleck","Orientational disorder of [Mg(H~2~O)~6~] octahedra in the novel magnesium selenite hydrate Mg(SeO~3~)·7.5H~2~O","Acta Crystallographica Section C","2007","63","1","i1","i3","10.1107/S0108270106047949","","","0.71073","MoKα","","0.0251","0.023","","","0.0519","0.0527","","","","","","1.208","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2015726","8.9333","0.0012","6.2164","0.0007","7.5815","0.0012","90","","110.238","0.013","90","","395.03","0.1","292","3","292","3","","","","","","","","4","C 1 2/m 1","-C 2y","12","copper(II) diselenite(IV) dichloride","tricopper(II) diselenium(IV) dichloride hexaoxide","","- Cl2 Cu3 O6 Se2 -","- Cl2 Cu3 O6 Se2 -","- Cl4 Cu6 O12 Se4 -","2","0.25","BC3024","Becker, Richard; Berger, Helmuth; Johnsson, Mats","Monoclinic Cu~3~(SeO~3~)~2~Cl~2~: an oxohalide with an unusual CuO~4~Cl trigonal‒bipyramidal coordination","Acta Crystallographica Section C","2007","63","1","i4","i6","10.1107/S0108270106050621","","","0.71073","MoKα","","0.0266","0.026","","","0.0762","0.0764","","","","","","1.651","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015727","8.9738","0.0006","12.8267","0.0007","11.187","0.0008","90","","98.875","0.005","90","","1272.25","0.14","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","diaquabis[6-methyl-2,2-dioxo-1,2,3-oxathiazin-4-olato-κO^4^]bis(3- methylpyridine-κN)nickel(II)}","","- C20 H26 N4 Ni O10 S2 -","- C20 H26 N4 Ni O10 S2 -","- C40 H52 N8 Ni2 O20 S4 -","2","0.5","BG3023","Dege, Necmi; İçbudak, Hasan; Adıyaman, Elif","Bis(acesulfamato-κ<i>O</i>^4^)diaquabis(3-methylpyridine-κ<i>N</i>)nickel(II)","Acta Crystallographica Section C","2007","63","1","m13","m15","10.1107/S0108270106050591","","","0.71073","MoKα","","0.0545","0.035","","","0.0795","0.0848","","","","","","1.015","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015728","12.4268","0.0002","3.796","0.0001","16.9218","0.0003","90","","107.812","0.001","90","","759.97","0.03","170","2","170","2","","","","","","","","5","P 1 21 1","P 2yb","4","","phenazine‒chloranilic acid (1/1)","","- C18 H10 Cl2 N2 O4 -","- C18 H10 Cl2 N2 O4 -","- C36 H20 Cl4 N4 O8 -","2","1","BM3017","Gotoh, Kazuma; Asaji, Tetsuo; Ishida, Hiroyuki","Hydrogen bonding in two solid phases of phenazine‒chloranilic acid (1/1) determined at 170 and 93 K","Acta Crystallographica Section C","2007","63","1","o17","o20","10.1107/S0108270106049468","","","0.71075","MoKα","","0.0443","0.0339","","","0.0911","0.0965","","","","","","1.059","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015729","12.432","0.0003","3.7702","0.0001","16.8848","0.0004","90","","107.778","0.001","90","","753.62","0.03","93","2","93","2","","","","","","","","5","P 1 21 1","P 2yb","4","","phenazinium chloranilate","","- C18 H10 Cl2 N2 O4 -","- C18 H10 Cl2 N2 O4 -","- C36 H20 Cl4 N4 O8 -","2","1","BM3017","Gotoh, Kazuma; Asaji, Tetsuo; Ishida, Hiroyuki","Hydrogen bonding in two solid phases of phenazine‒chloranilic acid (1/1) determined at 170 and 93 K","Acta Crystallographica Section C","2007","63","1","o17","o20","10.1107/S0108270106049468","","","0.71075","MoKα","","0.0427","0.0323","","","0.0841","0.0885","","","","","","1.059","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015730","22.8628","0.0011","3.6294","0.0002","9.061","0.0004","90","","107.915","0.0014","90","","715.41","0.06","296.1","","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","calcium europium tin oxide","calcium europium tin heptaoxide","","- Ca1.5 Eu3 O7 Sn0.5 -","- Ca1.5 Eu3 O7 Sn0.5 -","- Ca6 Eu12 O28 Sn2 -","4","0.5","FA3035","Yusuke Kaminaga; Takahiro Yamada; Yamane, Hisanori","Ca~1.5~Eu~3~Sn~0.5~O~7~: a calcium europium tin oxide with a novel structure","Acta Crystallographica Section C","2007","63","1","i10","i12","10.1107/S0108270106039916","","","0.71069","MoKα","","0.0297","0.0264","","","0.0579","0.0606","","","","","","1.055","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2015731","8.3908","0.0007","9.0698","0.0008","9.7303","0.001","64.734","0.005","71.721","0.01","88.198","0.011","631.33","0.11","293","2","293","2","","","","","","","","4","P 1","P 1","1","2'-Deoxy-5-propynylcytidine","4-amino-1-(2-deoxy-β-D-erythropentofuranosyl)-5-(prop-1- ynyl)pyrimidine-2(1H)-one","","- C12 H15 N3 O4 -","- C12 H15 N3 O4 -","- C24 H30 N6 O8 -","2","2","FA3048","Seela, Frank; Budow, Simone; Eickmeier, Henning; Reuter, Hans","2'-Deoxy-5-propynylcytidine: a nucleoside forming two solid-state conformations","Acta Crystallographica Section C","2007","63","1","o54","o57","10.1107/S0108270106050736","","","0.71073","MoKα","","0.0431","0.0394","","","0.1085","0.1116","","","","","","1.048","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015732","26.757","0.004","11.2998","0.0015","7.9943","0.0012","90","","96.709","0.012","90","","2400.5","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-[(<i>E</i>)-phenyldiazenyl]anilinium hydrogenphosphate","","- C24 H25 N6 O4 P -","- C24 H25 N6 O4 P -","- C96 H100 N24 O16 P4 -","4","1","FA3051","Halasz, Ivan; Kaja Lukić; Hrvoj Vančik","Hydrogen phosphate and dihydrogen phosphate salts of 4-aminoazobenzene","Acta Crystallographica Section C","2007","63","1","o61","o64","10.1107/S0108270106050979","","","0.71073","MoKα","","0.0987","0.0748","","","0.2109","0.2293","","","","","","1.046","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2015733","4.5515","0.0004","10.5973","0.0009","34.705","0.003","90","","90","","90","","1673.9","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-[(<i>E</i>)-phenyldiazenyl]anilinium dihydrogenphosphate‒phosphoric acid (1/1)","","- C12 H17 N3 O8 P2 -","- C12 H17 N3 O8 P2 -","- C48 H68 N12 O32 P8 -","4","1","FA3051","Halasz, Ivan; Kaja Lukić; Hrvoj Vančik","Hydrogen phosphate and dihydrogen phosphate salts of 4-aminoazobenzene","Acta Crystallographica Section C","2007","63","1","o61","o64","10.1107/S0108270106050979","","","0.71073","MoKα","","0.0503","0.0396","","","0.0963","0.1009","","","","","","1.073","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2015734","9.4872","0.0009","15.4477","0.0014","10.7567","0.0009","90","","105.878","0.004","90","","1516.3","0.2","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[1,4,8,11-tetraazacyclotetradecane(2+) [hepta-μ-sulfido-trisulfidohexaantimony(III)]]","","- C10 H20 N4 S10 Sb6 -","- C10 H20 N4 S10 Sb6 -","- C20 H40 N8 S20 Sb12 -","2","0.5","GA3032","Lees, Rachel J. E.; Powell, Anthony V.; Watkin, David J.; Chippindale, Ann M.","1,4,8,11-Tetraazacyclotetradecane antimony(III) sulfide","Acta Crystallographica Section C","2007","63","1","m27","m29","10.1107/S010827010605044X","","","0.71073","MoKα","","0.0554","0.0492","","0.0382","0.0377","0.0377","","","","","","1.0801","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015735","11.5432","0.0006","9.5417","0.0005","13.1351","0.0007","90","","101.904","0.002","90","","1415.61","0.13","150","2","150","2","","","","","","","","8","P 1 n 1","P -2yac","7","","chloro[(diphenylphosphinoamino)diphenylphosphine oxide]methylpalladium(II) dimethyl sulfoxide solvate","","- C27 H30 Cl N O2 P2 Pd S -","- C27 H30 Cl N O2 P2 Pd S -","- C54 H60 Cl2 N2 O4 P4 Pd2 S2 -","2","1","GD3061","Elsegood, Mark R. J.; Smith, Martin B.; Dale, Sophie H.","Two square-planar palladium(II) complexes with <i>P</i>,<i>O</i>-bidentate hybrid ligands","Acta Crystallographica Section C","2007","63","1","m7","m9","10.1107/S0108270106048530","","","0.71073","MoKα","","0.024","0.0225","","","0.0534","0.0542","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015736","17.3748","0.0005","14.3919","0.0004","18.3124","0.0005","90","","90","","90","","4579.1","0.2","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","chloro{diethoxy[2-(diphenylphosphino)phenyl]methane]methylpalladium(II)","","- C24 H28 Cl O2 P Pd -","- C24 H28 Cl O2 P Pd -","- C192 H224 Cl8 O16 P8 Pd8 -","8","1","GD3061","Elsegood, Mark R. J.; Smith, Martin B.; Dale, Sophie H.","Two square-planar palladium(II) complexes with <i>P</i>,<i>O</i>-bidentate hybrid ligands","Acta Crystallographica Section C","2007","63","1","m7","m9","10.1107/S0108270106048530","","","0.71073","MoKα","","0.0267","0.0201","","","0.0499","0.0557","","","","","","1.098","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015737","16.6938","0.0011","22.1074","0.0015","36.666","0.003","90","","94.46","0.004","90","","13490.8","1.7","133","2","133","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","{2-[2-(benzylideneamino)phenyl]-1,2-bis(methoxycarbonyl)ethenyl- κ^2^C^1^,N}iodo(triphenylphosphine-κP)palladium(II)","","- C37 H31 I N O4 P Pd -","- C37 H31 I N O4 P Pd -","- C592 H496 I16 N16 O64 P16 Pd16 -","16","4","GD3068","Jones, Peter G.; López-Serrano, Joaquín","An organometallic compound with <i>Z</i>' = 4: {2-[2-(benzylideneamino)phenyl]-1,2-bis(methoxycarbonyl)ethenyl-κ^2^<i>C</i>^1^,<i>N</i>}iodo(triphenylphosphine-κ<i>P</i>)palladium(II)","Acta Crystallographica Section C","2007","63","1","m16","m18","10.1107/S0108270106051870","","","0.71073","MoKα","","0.0543","0.0296","","","0.0636","0.0697","","","","","","0.954","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015738","7.444","0.002","10.067","0.002","15.33","0.003","85.06","0.03","89.91","0.03","80.2","0.03","1127.7","0.5","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","Bis[bis(methoxycarbimido)amine-κ^2^N,N']bis(perchlorato-κO)copper(II) bis[bis(methoxycarbimido)amine-κ^2^N,N']bis(methanol-κO)copper(II) bis(perchlorate) methanol disolvate","","- C20 H52 Cl4 Cu2 N12 O28 -","- C20 H52 Cl4 Cu2 N12 O28 -","- C20 H52 Cl4 Cu2 N12 O28 -","1","0.5","GG3051","Liu, Guang-Fei; Li, Lin-Lin; Zhang,Yong; Lang, Jian-Ping; Ng, Seik Weng","Bis[bis(methoxycarbimido)amine-κ^2^<i>N</i>,<i>N</i>']bis(perchlorato-κ<i>O</i>)copper(II) bis[bis(methoxycarbimido)amine-κ^2^<i>N</i>,<i>N</i>']bis(methanol-κ<i>O</i>)copper(II) bis(perchlorate) methanol disolvate","Acta Crystallographica Section C","2007","63","1","m1","m3","10.1107/S0108270106043265","","","0.71073","MoKα","","0.029","0.027","","","0.074","0.076","","","","","","1.01","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015739","10.5331","0.001","6.8752","0.0006","20.0035","0.0018","90","","90","","90","","1448.6","0.2","133","2","133","2","","","","","","","","2","P n a 21","P 2c -2n","33","","2',5'-Dimethyl-p-terphenyl","","- C20 H18 -","- C20 H18 -","- C80 H72 -","4","1","GG3053","Jones, Peter G.; Zemanek, Aleksander; Kuś, Piotr","Secondary interactions in two related terphenyl derivatives: 2',5'-dimethyl-<i>p</i>-terphenyl and 2',5'-bis(bromomethyl)-<i>p</i>-terphenyl","Acta Crystallographica Section C","2007","63","1","o73","o76","10.1107/S0108270106052668","","","0.71073","MoKα","","0.0773","0.0687","","","0.1433","0.1474","","","","","","1.124","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015740","11.1019","0.0012","8.2736","0.0011","17.726","0.002","90","","90.248","0.004","90","","1628.2","0.3","133","2","133","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2',5'-bis(bromomethyl)-p-terphenyl","","- C20 H16 Br2 -","- C20 H16 Br2 -","- C80 H64 Br8 -","4","1","GG3053","Jones, Peter G.; Zemanek, Aleksander; Kuś, Piotr","Secondary interactions in two related terphenyl derivatives: 2',5'-dimethyl-<i>p</i>-terphenyl and 2',5'-bis(bromomethyl)-<i>p</i>-terphenyl","Acta Crystallographica Section C","2007","63","1","o73","o76","10.1107/S0108270106052668","","","0.71073","MoKα","","0.0732","0.0452","","","0.117","0.1318","","","","","","1.039","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015741","7.2228","0.0004","8.4433","0.0003","10.5938","0.0005","98.234","0.003","107.609","0.002","97.907","0.003","598.13","0.05","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 4-(5-amino-3-methyl-1H-pyrazol-1-yl)benzoate","","- C13 H15 N3 O2 -","- C13 H15 N3 O2 -","- C26 H30 N6 O4 -","2","1","GG3055","Portilla, Jaime; Mata, Ernesto G.; Nogueras, Manuel; Cobo, Justo; Low, John N.; Glidewell, Christopher","Three substituted 4-pyrazolylbenzoates: hydrogen-bonded supramolecular structures in one, two and three dimensions","Acta Crystallographica Section C","2007","63","1","o21","o25","10.1107/S0108270106050360","","","0.71073","MoKα","","0.0841","0.0493","","","0.12","0.1355","","","","","","1.084","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015742","6.1272","0.0002","11.6374","0.0003","20.3182","0.0007","90","","98.629","0.002","90","","1432.38","0.08","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 4-(5-amino-3-tert-butyl-1H-pyrazol-1-yl)benzoate","","- C15 H19 N3 O2 -","- C15 H19 N3 O2 -","- C60 H76 N12 O8 -","4","1","GG3055","Portilla, Jaime; Mata, Ernesto G.; Nogueras, Manuel; Cobo, Justo; Low, John N.; Glidewell, Christopher","Three substituted 4-pyrazolylbenzoates: hydrogen-bonded supramolecular structures in one, two and three dimensions","Acta Crystallographica Section C","2007","63","1","o21","o25","10.1107/S0108270106050360","","","0.71073","MoKα","","0.0702","0.0418","","","0.0987","0.1121","","","","","","1.032","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015743","8.0166","0.0002","7.5082","0.0002","18.5507","0.0005","90","","91.814","0.0016","90","","1116.01","0.05","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(5-Amino-3-methyl-1H-pyrazol-1-yl)benzoic acid monohydrate","","- C11 H13 N3 O3 -","- C11 H13 N3 O3 -","- C44 H52 N12 O12 -","4","1","GG3055","Portilla, Jaime; Mata, Ernesto G.; Nogueras, Manuel; Cobo, Justo; Low, John N.; Glidewell, Christopher","Three substituted 4-pyrazolylbenzoates: hydrogen-bonded supramolecular structures in one, two and three dimensions","Acta Crystallographica Section C","2007","63","1","o21","o25","10.1107/S0108270106050360","","","0.71073","MoKα","","0.054","0.04","","","0.1122","0.1208","","","","","","1.099","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015744","12.74","0.0004","10.8595","0.0003","13.9187","0.0004","90","","110.728","0.001","90","","1801.01","0.09","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,3-Dimethoxybenzaldehyde isonicotinoylhydrazone chloroform monosolvate","","- C16 H16 Cl3 N3 O3 -","- C16 H16 Cl3 N3 O3 -","- C64 H64 Cl12 N12 O12 -","4","1","GG3058","Peralta, Monica A.; Souza, Marcus N. V. de; Wardell, Solange M. S. V.; Wardell, James L.; Low, John N.; Glidewell, Christopher","2,3-Dimethoxybenzaldehyde isonicotinoylhydrazone chloroform monosolvate, and the mono- and dihydrates of 3,4,5-trimethoxybenzaldehyde isonicotinoylhydrazone: hydrogen-bonded supramolecular structures in one, two and three dimensions","Acta Crystallographica Section C","2007","63","1","o68","o72","10.1107/S0108270106052486","","","0.71073","MoKα","","0.0538","0.0409","","","0.0839","0.0895","","","","","","1.021","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015745","10.8081","0.0006","10.3597","0.0003","14.427","0.0007","90","","95.281","0.002","90","","1608.52","0.13","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4,5-trimethoxybenzaldehyde isonicotinoylhydrazone monohydrate","","- C16 H19 N3 O5 -","- C16 H19 N3 O5 -","- C64 H76 N12 O20 -","4","1","GG3058","Peralta, Monica A.; Souza, Marcus N. V. de; Wardell, Solange M. S. V.; Wardell, James L.; Low, John N.; Glidewell, Christopher","2,3-Dimethoxybenzaldehyde isonicotinoylhydrazone chloroform monosolvate, and the mono- and dihydrates of 3,4,5-trimethoxybenzaldehyde isonicotinoylhydrazone: hydrogen-bonded supramolecular structures in one, two and three dimensions","Acta Crystallographica Section C","2007","63","1","o68","o72","10.1107/S0108270106052486","","","0.71073","MoKα","","0.085","0.0471","","","0.1168","0.1334","","","","","","1.034","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015746","8.993","0.0005","16.2713","0.001","11.6311","0.0006","90","","90.354","0.003","90","","1701.92","0.17","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,4,5-trimethoxybenzaldehyde isonicotinoylhydrazone dihydrate","","- C16 H21 N3 O6 -","- C16 H21 N3 O6 -","- C64 H84 N12 O24 -","4","1","GG3058","Peralta, Monica A.; Souza, Marcus N. V. de; Wardell, Solange M. S. V.; Wardell, James L.; Low, John N.; Glidewell, Christopher","2,3-Dimethoxybenzaldehyde isonicotinoylhydrazone chloroform monosolvate, and the mono- and dihydrates of 3,4,5-trimethoxybenzaldehyde isonicotinoylhydrazone: hydrogen-bonded supramolecular structures in one, two and three dimensions","Acta Crystallographica Section C","2007","63","1","o68","o72","10.1107/S0108270106052486","","","0.71073","MoKα","","0.1271","0.0647","","","0.1057","0.1213","","","","","","1.015","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015747","11.0921","0.0003","19.3442","0.0003","20.1742","0.0004","90","","90","","90","","4328.73","0.16","150","2","150","2","","","","","","","","4","P b c n","-P 2n 2ab","60","hexakis(4-cyanophenyl)benzene","4,4',4'',4''',4'''',4'''''-benzenehexaylhexabenzonitrile dichloromethane disolvate","","- C50 H28 Cl4 N6 -","- C50 H28 Cl4 N6 -","- C200 H112 Cl16 N24 -","4","0.5","GZ3032","Gagnon, Eric; Maly, Kenneth E.; Maris, Thierry; Wuest, James D.","A new pseudopolymorph of hexakis(4-cyanophenyl)benzene","Acta Crystallographica Section C","2007","63","1","o4","o6","10.1107/S0108270106046452","","","1.54178","CuKα","","0.0582","0.0577","","","0.1379","0.1382","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015748","3.7734","0.0005","30.03","0.004","12.075","0.0016","90","","93.894","0.002","90","","1365.1","0.3","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","6-hydroxybiochanin A monohydrate","4'-methoxy-5,6,7-trihydroxyisoflavone monohydrate","","- C16 H14 O7 -","- C16 H14 O7 -","- C64 H56 O28 -","4","1","GZ3040","Zun-Ting Zhang; Yan-Chang Wang","Hydrogen bonding and π‒π stacking in 6-hydroxybiochanin A monohydrate","Acta Crystallographica Section C","2007","63","1","o51","o53","10.1107/S0108270106044908","","","0.71073","MoKα","","0.0913","0.0461","","","0.0996","0.1219","","","","","","1.085","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015749","4.81","0.0008","10.776","0.0018","10.8756","0.0018","69.325","0.003","85.792","0.003","81.946","0.003","522.03","0.15","300","","300","","","","","","","","","4","P 1","P 1","1","Bis(glycyl-L-aspartic acid) oxalate 0.4-hydrate","bis[2-(2-ammonioacetamido)butanedioic acid] oxalate 0.4-hydrate","","- C14 H22.8 N4 O14.4 -","- C14 H22 N4 O14 -","- C14 H22 N4 O14 -","1","1","HJ3023","R. Chitra; Vijay Thiruvenkatam; R. R. Choudhury; M. V. Hosur; T. N. Guru Row","Conformation and structure of bis(glycyl-<small>L</small>-aspartic acid) oxalate 0.4-hydrate","Acta Crystallographica Section C","2007","63","1","o11","o13","10.1107/S0108270106048566","","","0.71073","MoKα","","0.072","0.0592","","","0.1277","0.1334","","","","","","1.108","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015750","5.5238","0.0007","26.581","0.003","44.093","0.005","90","","90","","90","","6474.1","1.3","105","2","105","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","glycyl-L-valine","","- C7 H14 N2 O3 -","- C7 H14 N2 O3 -","- C196 H392 N56 O84 -","28","7","JZ3047","Görbitz, Carl Henrik; Agustsdottir, Silja; Bleken, Francesca","Pearls on a string: a <i>Z</i>' = 7 structure for glycyl-<small>L</small>-valine","Acta Crystallographica Section C","2007","63","1","o58","o60","10.1107/S0108270106052474","","","0.71073","MoKα","","0.1245","0.0734","","","0.1575","0.1716","","","","","","1.284","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015751","9.435","0.001","18.098","0.008","13.612","0.002","90","","102.485","0.009","90","","2269.3","1.1","298","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diisopropylammonium 2-[(2,4-dinitrophenyl)sulfanylaminocarbonyl]benzoate","","- C20 H24 N4 O7 S -","- C20 H24 N4 O7 S -","- C80 H96 N16 O28 S4 -","4","1","LN3028","Brito, Iván; Vargas, Danitza; Reyes, Andrea; Cárdenas, Alejandro; López-Rodríguez, Matías","Diisopropylammonium 2-[(2,4-dinitrophenyl)sulfanylaminocarbonyl]benzoate","Acta Crystallographica Section C","2007","63","1","o48","o50","10.1107/S0108270106050840","","","0.71073","MoKα","","","0.0587","","","","0.1657","","","","","","1.168","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015752","10.9665","0.0014","10.9665","0.0014","30.796","0.006","90","","90","","90","","3703.7","1","120","2","120","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","3-tert-butyl-5-[(4-methoxybenzyl)amino]-1-phenyl-1H-pyrazole","","- C21 H25 N3 O -","- C21 H25 N3 O -","- C168 H200 N24 O8 -","8","1","LN3029","Abonía, Rodrigo; Rengifo, Emerson; Cobo, Justo; Low, John N.; Glidewell, Christopher","Hydrogen-bonded chains in 3-<i>tert</i>-butyl-5-[(4-methoxybenzyl)amino]-1-phenyl-1<i>H</i>-pyrazole and tetramolecular hydrogen-bonded aggregates in 5-[(benzotriazol-1-ylmethyl)(4-methoxybenzyl)amino]-3-<i>tert</i>-butyl-1-phenyl-1<i>H</i>-pyrazole","Acta Crystallographica Section C","2007","63","1","o29","o32","10.1107/S0108270106050335","","","0.71073","MoKα","","0.0888","0.0515","","","0.1042","0.1202","","","","","","1.049","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015753","12.5184","0.0002","18.5142","0.0005","21.758","0.0005","90","","96.073","0.0015","90","","5014.5","0.2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-[(benzotriazol-1-ylmethyl)(4-methoxybenzyl)amino]-3-tert-butyl-1- phenyl-1H-pyrazole","","- C28 H30 N6 O -","- C28 H30 N6 O -","- C224 H240 N48 O8 -","8","2","LN3029","Abonía, Rodrigo; Rengifo, Emerson; Cobo, Justo; Low, John N.; Glidewell, Christopher","Hydrogen-bonded chains in 3-<i>tert</i>-butyl-5-[(4-methoxybenzyl)amino]-1-phenyl-1<i>H</i>-pyrazole and tetramolecular hydrogen-bonded aggregates in 5-[(benzotriazol-1-ylmethyl)(4-methoxybenzyl)amino]-3-<i>tert</i>-butyl-1-phenyl-1<i>H</i>-pyrazole","Acta Crystallographica Section C","2007","63","1","o29","o32","10.1107/S0108270106050335","","","0.71073","MoKα","","0.1239","0.0591","","","0.0972","0.1132","","","","","","1.027","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015754","24.76","0.02","8.59","0.01","11.55","0.01","90","","107.11","0.03","90","","2348","4","296.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis(μ~2~-4-methylbenzoato-κ^2^O:O')disilver(I)(Ag—Ag)]- μ~2~-di-2-pyridylamine-κ^2^N^2^:N^2'^]","","- C26 H23 Ag2 N3 O4 -","- C26 H23 Ag2 N3 O4 -","- C104 H92 Ag8 N12 O16 -","4","0.5","RB3021","Odoko, Mamiko; Ise, Tomoyasu; Okabe, Nobuo","<i>catena</i>-Poly[[bis(μ~2~-4-methylbenzoato-κ^2^<i>O</i>:<i>O</i>')disilver(I)(<i>Ag{—</i>Ag})]-μ~2~-di-2-pyridylamine-κ^2^<i>N</i>^2^:<i>N</i>^2'^] and <i>catena</i>-poly[[(di-2-pyridylamine-κ<i>N</i>^2^)(μ~2~-4-nitrobenzoato-κ^2^<i>O</i>:<i>O</i>')disilver(I)(<i>Ag{—</i>Ag})]-μ~3~-4-nitrobenzoato-κ^3^<i>O</i>:<i>O</i>':<i>O</i>']","Acta Crystallographica Section C","2007","63","1","m22","m26","10.1107/S010827010605102X","","","0.7107","MoKα","","","0.0306","","","","0.0578","","","","","","0.802","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2015755","7.259","0.008","11.07","0.01","15.38","0.02","82.66","0.05","84.84","0.04","72.01","0.04","1164","2","296.1","","","","","","","","","","","5","P -1","-P 1","2","","catena-poly[[(di-2-pyridylamine-κN^2^)(μ~2~-4-nitrobenzoato- κ^2^O:O')disilver(I)(Ag—Ag)]-μ~3~-4-nitrobenzoato-κ^3^O:O':O']","","- C24 H17 Ag2 N5 O8 -","- C24 H17 Ag2 N5 O8 -","- C48 H34 Ag4 N10 O16 -","2","1","RB3021","Odoko, Mamiko; Ise, Tomoyasu; Okabe, Nobuo","<i>catena</i>-Poly[[bis(μ~2~-4-methylbenzoato-κ^2^<i>O</i>:<i>O</i>')disilver(I)(<i>Ag{—</i>Ag})]-μ~2~-di-2-pyridylamine-κ^2^<i>N</i>^2^:<i>N</i>^2'^] and <i>catena</i>-poly[[(di-2-pyridylamine-κ<i>N</i>^2^)(μ~2~-4-nitrobenzoato-κ^2^<i>O</i>:<i>O</i>')disilver(I)(<i>Ag{—</i>Ag})]-μ~3~-4-nitrobenzoato-κ^3^<i>O</i>:<i>O</i>':<i>O</i>']","Acta Crystallographica Section C","2007","63","1","m22","m26","10.1107/S010827010605102X","","","0.7107","MoKα","","","0.0327","","","","0.0882","","","","","","1.009","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2015756","10.9891","0.0011","11.4986","0.0011","14.8928","0.0015","82.308","0.002","83.418","0.002","66","0.002","1699.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Poly[diaqua(μ-4,4'-bipyridine)tetrakis(μ-ferrocenecarboxylato)bis(μ- ferrocenecarboxylato)trimanganese(II)]","","- C76 H66 Fe6 Mn3 N2 O14 -","- C76 H66 Fe6 Mn3 N2 O14 -","- C76 H66 Fe6 Mn3 N2 O14 -","1","0.5","SF3022","Wen-Jie Lu; Yi-Min Zhu; Kai-Long Zhong","Poly[diaqua(μ-4,4'-bipyridine)tetrakis(μ-ferrocenecarboxylato)bis(ferrocenecarboxylato)trimanganese(II)]","Acta Crystallographica Section C","2007","63","1","m4","m6","10.1107/S0108270106047196","","","0.71073","MoKα","","0.0666","0.0399","","","0.0867","0.1023","","","","","","1.027","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015757","6.0243","0.0002","7.5022","0.0003","15.9717","0.0008","90","","90","","90","","721.85","0.05","190","","190","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-deoxy-α-D-tagatopyranose","","- C6 H12 O5 -","- C6 H12 O5 -","- C24 H48 O20 -","4","1","SK3070","Jones, Nigel A.; Jenkinson, Sarah F.; Soengas, Raquel; Izumori, Ken; Fleet, George W. J.; Watkin, David J.","The concomitant crystallization of two polymorphs of 1-deoxy-α-<small>D</small>-tagatose","Acta Crystallographica Section C","2007","63","1","o7","o10","10.1107/S0108270106048591","","","0.71073","MoKα","","0.0344","0.0287","","0.0688","0.0671","0.0688","","","","","","1.0049","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015758","6.0177","0.0002","6.4672","0.0002","18.0218","0.0007","90","","90","","90","","701.37","0.04","190","","190","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-deoxy-α-D-tagatopyranose","","- C6 H12 O5 -","- C6 H12 O5 -","- C24 H48 O20 -","4","1","SK3070","Jones, Nigel A.; Jenkinson, Sarah F.; Soengas, Raquel; Izumori, Ken; Fleet, George W. J.; Watkin, David J.","The concomitant crystallization of two polymorphs of 1-deoxy-α-<small>D</small>-tagatose","Acta Crystallographica Section C","2007","63","1","o7","o10","10.1107/S0108270106048591","","","0.71073","MoKα","","0.0304","0.0272","","0.0661","0.0647","0.0661","","","","","","1.0288","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015759","10.8271","0.0002","10.8271","0.0002","19.9208","0.0003","90","","90","","90","","2335.24","0.07","120","2","120","2","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","7-Amino-2-tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine","","- C11 H16 N4 -","- C11 H16 N4 -","- C88 H128 N32 -","8","1","SK3071","Portilla, Jaime; Quiroga, Jairo; Cobo, Justo; Low, John N.; Glidewell, Christopher","7-Amino-2-<i>tert</i>-butyl-5-methylpyrazolo[1,5-<i>a</i>]pyrimidine: a three-dimensional framework structure built from two N—H···N hydrogen bonds","Acta Crystallographica Section C","2007","63","1","o26","o28","10.1107/S0108270106044817","","","0.71073","MoKα","","0.0429","0.0349","","","0.0872","0.0912","","","","","","1.05","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015760","6.3212","0.0005","9.4121","0.0011","10.2496","0.0012","90.311","0.005","94.183","0.007","92.946","0.007","607.35","0.11","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","ethyl 5-amino-1-(4-cyanophenyl)-1H-imidazole-4-carboxylate","","- C13 H12 N4 O2 -","- C13 H12 N4 O2 -","- C26 H24 N8 O4 -","2","1","SK3077","Costa, Marilia S.; Boechat, Nubia; Wardell, Solange M. S. V.; Ferreira, Vitor F.; Low, John N.; Glidewell, Christopher","Three ethyl 5-amino-1-aryl-1<i>H</i>-imidazole-4-carboxylates: hydrogen-bonded supramolecular structures in one, two and three dimensions","Acta Crystallographica Section C","2007","63","1","o33","o37","10.1107/S0108270106048402","","","0.71073","MoKα","","0.1098","0.0602","","","0.1261","0.1468","","","","","","1.036","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015761","13.1153","0.0006","8.7114","0.0004","11.5273","0.0004","90","","107.064","0.003","90","","1259.05","0.09","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","ethyl 5-amino-1-(4-chlorophenyl)-1H-imidazole-4-carboxylate","","- C12 H12 Cl N3 O2 -","- C12 H12 Cl N3 O2 -","- C48 H48 Cl4 N12 O8 -","4","1","SK3077","Costa, Marilia S.; Boechat, Nubia; Wardell, Solange M. S. V.; Ferreira, Vitor F.; Low, John N.; Glidewell, Christopher","Three ethyl 5-amino-1-aryl-1<i>H</i>-imidazole-4-carboxylates: hydrogen-bonded supramolecular structures in one, two and three dimensions","Acta Crystallographica Section C","2007","63","1","o33","o37","10.1107/S0108270106048402","","","0.71073","MoKα","","0.0645","0.0467","","","0.1143","0.1261","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015762","7.9045","0.0004","12.995","0.0007","11.7737","0.0005","90","","98.81","0.004","90","","1195.11","0.1","120","2","120","2","","","","","","","","5","C 1 c 1","C -2yc","9","","ethyl 5-amino-1-(2,6-difluorophenyl)-1H-imidazole-4-carboxylate","","- C12 H11 F2 N3 O2 -","- C12 H11 F2 N3 O2 -","- C48 H44 F8 N12 O8 -","4","1","SK3077","Costa, Marilia S.; Boechat, Nubia; Wardell, Solange M. S. V.; Ferreira, Vitor F.; Low, John N.; Glidewell, Christopher","Three ethyl 5-amino-1-aryl-1<i>H</i>-imidazole-4-carboxylates: hydrogen-bonded supramolecular structures in one, two and three dimensions","Acta Crystallographica Section C","2007","63","1","o33","o37","10.1107/S0108270106048402","","","0.71073","MoKα","","0.0455","0.0343","","","0.0745","0.0802","","","","","","1.073","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015763","13.3271","0.0005","12.7054","0.0005","15.7748","0.0006","90","","90","","90","","2671.09","0.18","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-Nitrobenzaldehyde isonicotinoylhydrazone monohydrate","","- C13 H12 N4 O4 -","- C13 H12 N4 O4 -","- C104 H96 N32 O32 -","8","1","SK3078","Wardell, Solange M. S. V.; Wardell, James L.; Low, John N.; Glidewell, Christopher","3-Nitrobenzaldehyde isonicotinoylhydrazone monohydrate redetermined at 120K: sheets built from O—H···O, O—H···N, N—H···O and C—H···O hydrogen bonds","Acta Crystallographica Section C","2007","63","1","o42","o44","10.1107/S0108270106050451","","","0.71073","MoKα","","0.0937","0.0532","","","0.1295","0.1552","","","","","","1.137","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015764","5.9233","0.0003","8.8858","0.0006","11.7819","0.0006","85.69","0.004","83.5","0.004","84.015","0.003","611.51","0.06","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","methyl 4-[(5-methyl-1H-pyrazol-3-yl)amino]-3-nitrobenzoate","","- C12 H12 N4 O4 -","- C12 H12 N4 O4 -","- C24 H24 N8 O8 -","2","1","SQ3044","Portilla, Jaime; Mata, Ernesto G.; Nogueras, Manuel; Cobo, Justo; Low, John N.; Glidewell, Christopher","Hydrogen-bonded chains of rings in methyl 4-[(5-methyl-1<i>H</i>-pyrazol-3-yl)amino]-3-nitrobenzoate and hydrogen-bonded sheets in methyl 1-(5-methyl-1<i>H</i>-pyrazol-3-yl)-1<i>H</i>-benzimidazole-5-carboxylate","Acta Crystallographica Section C","2007","63","1","o38","o41","10.1107/S0108270106044611","","","0.71073","MoKα","","0.0677","0.0463","","","0.1164","0.1275","","","","","","1.055","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015765","8.3646","0.0003","11.5735","0.0006","12.7953","0.0007","88.328","0.003","88.526","0.003","75.362","0.003","1197.75","0.1","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","methyl 1-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole-5-carboxylate","","- C13 H12 N4 O2 -","- C13 H12 N4 O2 -","- C52 H48 N16 O8 -","4","2","SQ3044","Portilla, Jaime; Mata, Ernesto G.; Nogueras, Manuel; Cobo, Justo; Low, John N.; Glidewell, Christopher","Hydrogen-bonded chains of rings in methyl 4-[(5-methyl-1<i>H</i>-pyrazol-3-yl)amino]-3-nitrobenzoate and hydrogen-bonded sheets in methyl 1-(5-methyl-1<i>H</i>-pyrazol-3-yl)-1<i>H</i>-benzimidazole-5-carboxylate","Acta Crystallographica Section C","2007","63","1","o38","o41","10.1107/S0108270106044611","","","0.71073","MoKα","","0.0996","0.0684","","","0.1619","0.1731","","","","","","1.197","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015766","9.9601","0.0014","9.0436","0.0013","20.708","0.003","90","","94.659","0.003","90","","1859.1","0.5","297","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","methyl 2-cyano-2-(trimethylphosphonio)ethenoate","","- C22 H18 N O2 P -","- C22 H18 N O2 P -","- C88 H72 N4 O8 P4 -","4","1","SQ3045","Fernando Castañeda; Clifford A. Bunton; Ricardo Baggio; María Teresa Garland","Cyano-stabilized triphenylphosphonium ylids","Acta Crystallographica Section C","2007","63","1","o65","o67","10.1107/S0108270106051201","","","0.71073","MoKα","","0.0939","0.0646","","","0.1367","0.15","","","","","","1.069","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015767","10.1144","0.0011","8.9938","0.001","19.968","0.002","90","","91.744","0.002","90","","1815.6","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-cyano-1-(trimethylphosphonio)prop-1-en-2-olate","","- C22 H18 N O P -","- C22 H18 N O P -","- C88 H72 N4 O4 P4 -","4","1","SQ3045","Fernando Castañeda; Clifford A. Bunton; Ricardo Baggio; María Teresa Garland","Cyano-stabilized triphenylphosphonium ylids","Acta Crystallographica Section C","2007","63","1","o65","o67","10.1107/S0108270106051201","","","0.71073","MoKα","","0.0698","0.0537","","","0.1321","0.1434","","","","","","1.029","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015768","18.999","0.004","3.841","0.0008","41.69","0.008","90","","122.96","0.03","90","","2552.7","1.3","174","2","174","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-chlorobenzonitrile","","- C7 H4 Cl N -","- C7 H4 Cl N -","- C112 H64 Cl16 N16 -","16","4","SQ3046","Britton, Doyle","<i>o</i>-Chloro- and <i>o</i>-bromobenzonitrile: pseudosymmetry and pseudo-isostructural packing","Acta Crystallographica Section C","2007","63","1","o14","o16","10.1107/S0108270106048451","","","0.71073","MoKα","","0.08","0.048","","","0.093","0.102","","","","","","1.03","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015769","3.9247","0.001","10.348","0.003","16.387","0.004","90","","95.011","0.004","90","","663","0.3","174","2","174","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-bromobenzonitrile","","- C7 H4 Br N -","- C7 H4 Br N -","- C28 H16 Br4 N4 -","4","1","SQ3046","Britton, Doyle","<i>o</i>-Chloro- and <i>o</i>-bromobenzonitrile: pseudosymmetry and pseudo-isostructural packing","Acta Crystallographica Section C","2007","63","1","o14","o16","10.1107/S0108270106048451","","","0.71073","MoKα","","0.029","0.022","","","0.048","0.051","","","","","","1.07","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015770","17.48","0.004","11.114","0.002","29.698","0.006","90","","93.894","0.008","90","","5756","2","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,4'-(fluorene-9,9-diyl)diphenol‒6-methyl-2H-pyridone (1/2)","","- C37 H32 N2 O4 -","- C37 H32 N2 O4 -","- C296 H256 N16 O32 -","8","1","AV3045","Lavy, T.; Meirovich, N.; Sparkes, H. A.; Howard, J. A. K.; Kaftory, M.","Cocrystals composed of 4,4'-(fluorene-9,9-diyl)diphenol and 6-methyl-2<i>H</i>-pyridone","Acta Crystallographica Section C","2007","63","2","o89","o92","10.1107/S010827010604474X","","","0.71073","MoKα","","0.0689","0.0481","","","0.1339","0.1473","","","","","","1.163","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015771","14.432","0.004","14.665","0.005","35.675","0.01","90","","90.133","0.014","90","","7550","4","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,4'-(fluorene-9,9-diyl)diphenol‒6-methyl-2H-pyridone‒water (1/3/3)","","- C43 H45 N3 O8 -","- C43 H45 N3 O8 -","- C344 H360 N24 O64 -","8","1","AV3045","Lavy, T.; Meirovich, N.; Sparkes, H. A.; Howard, J. A. K.; Kaftory, M.","Cocrystals composed of 4,4'-(fluorene-9,9-diyl)diphenol and 6-methyl-2<i>H</i>-pyridone","Acta Crystallographica Section C","2007","63","2","o89","o92","10.1107/S010827010604474X","","","0.71073","MoKα","","0.0755","0.0551","","","0.1078","0.1132","","","","","","1.277","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015772","6.1882","0.0006","15.935","0.0015","17.2295","0.0016","90","","90","","90","","1699","0.3","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-[(5-tert-Butyl-2-hydroxyphenyl)iminomethyl]-2-napthol","","- C21 H21 N O2 -","- C21 H21 N O2 -","- C84 H84 N4 O8 -","4","1","AV3047","Sun, Xu-Xia; Qi, Chuan-Min; Huang, Hai-Bo; Ma, Shu-Lan","1-[(5-<i>tert</i>-Butyl-2-hydroxyphenyl)iminomethyl]-2-napthol","Acta Crystallographica Section C","2007","63","2","o87","o88","10.1107/S0108270106051511","","","0.71073","MoKα","","0.039","0.032","","","0.0855","0.0891","","","","","","1.056","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015773","8.6343","0.0014","8.7713","0.0014","11.2379","0.0015","110.158","0.013","98.428","0.012","100.631","0.014","764.6","0.2","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","tert-Butoxycarbonylglycyl-dehydroalanyl-glycine methyl ester","","- C13 H21 N3 O6 -","- C13 H21 N3 O6 -","- C26 H42 N6 O12 -","2","1","AV3051","Ejsmont, Krzysztof; Gajda, Roman; Makowski, Maciej","Conformation of <i>tert</i>-butoxycarbonylglycyl-dehydroalanyl-glycine methyl ester in the crystalline state and calculated in the gas phase","Acta Crystallographica Section C","2007","63","2","o80","o83","10.1107/S0108270106052590","","","0.71073","MoKα","","0.0337","0.0305","","","0.0803","0.0824","","","","","","1.081","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015774","9.533","0.0005","36.635","0.002","10.0344","0.0006","90","","95.479","0.001","90","","3488.4","0.3","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dibromobis[2-(dimethylamino)methyl]tin(IV) tetrabromo[2-(dimethylamino)methyl]tin(IV)","","- C27 H37 Br6 N3 Sn2 -","- C27 H37 Br6 N3 Sn2 -","- C108 H148 Br24 N12 Sn8 -","4","1","AV3053","Varga, Richard A.; Silvestru, Cristian","Hydrogen bonding in dibromo[2-(dimethylaminomethyl)phenyl][2-(dimethylammoniomethyl)phenyl]tin(IV) tetrabromo[2-(dimethylaminomethyl)phenyl]tin(IV)","Acta Crystallographica Section C","2007","63","2","m48","m50","10.1107/S010827010605150X","","","0.71073","MoKα","","0.0663","0.0534","","","0.117","0.1221","","","","","","1.111","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2015775","18.769","0.004","42.406","0.009","7.217","0.0014","90","","90","","90","","5744","2","295","2","295","2","","","","","","","","5","F d d 2","F 2 -2d","43","","Poly[[[aqua(2,2'-bipyridine-κ^2^N,N')manganese(II)]-μ- acetylenedicarboxylato-κ^3^O,O'O''] monohydrate]","","- C14 H12 Mn N2 O6 -","- C14 H12 Mn N2 O6 -","- C224 H192 Mn16 N32 O96 -","16","1","AV3056","Wang, Huan-Yu; Gao, Shan; Huo, Li-Hua; Zhao, Jing-Gui","Poly[[[aqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-μ~3~-acetylenedicarboxylato-κ^3^<i>O</i>:<i>O</i>':<i>O</i>''] monohydrate]","Acta Crystallographica Section C","2007","63","2","m65","m67","10.1107/S0108270106056022","","","0.71073","MoKα","","0.021","0.0192","","","0.0473","0.0487","","","","","","1.045","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015776","12.651","0.001","21.071","0.005","9.262","0.001","90","","106.09","0.01","90","","2372.2","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-[N,N-Bis(2-pyridylmethyl)aminomethyl]-6-[N-(2-hydroxyanilino)methyl]- 4-methylphenol","","- C27 H28 N4 O2 -","- C27 H28 N4 O2 -","- C108 H112 N16 O8 -","4","1","BM3018","Bortoluzzi, Adailton J.; Neves, Ademir; Rey, Nicolas A.","2-{[Bis(2-pyridylmethyl)amino]methyl}-6-[(2-hydroxyanilino)methyl]-4-methylphenol: a novel binucleating asymmetric ligand as a precursor to synthetic models for metalloenzymes","Acta Crystallographica Section C","2007","63","2","o84","o86","10.1107/S0108270106050517","","","0.71073","MoKα","","0.151","0.0531","","","0.121","0.155","","","","","","1.02","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2015777","12.527","0.001","12.606","0.001","13.3233","0.0011","94.945","0.001","94.621","0.001","108.295","0.001","1977.2","0.3","100","1","100","1","","","","","","","","6","P -1","-P 1","2","","bis(μ 1,1-dimethylguanidinato)bis[(2,2'-bipyridine)platinum(II)](Pt—Pt) bis(hexafluorophosphate) bis(acetonitrile)","","- C30 H38 F12 N12 P2 Pt2 -","- C30 H38 F12 N12 P2 Pt2 -","- C60 H76 F24 N24 P4 Pt4 -","2","1","BM3021","Sakai, Ken; Yokokawa, Kazuo; Yokoyama, Yoshimi","Pt~2~^II^ and Pt~2~^III^ dimers containing a Pt~2~(2,2'-bipyridine)~2~(μ-<i>N</i>,<i>N</i>-dimethylguanidinato)~2~ unit","Acta Crystallographica Section C","2007","63","2","m36","m41","10.1107/S0108270106053601","","","0.71073","MoKα","","0.0806","0.0612","","","0.1452","0.1541","","","","","","1.15","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015778","12.6189","0.0006","28.9553","0.0014","14.4197","0.0007","90","","114.712","0.001","90","","4786.2","0.4","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(μ-N,N-dimethylguanidinato)bis[(2,2'- bipyridine)sulfatoplatinum(III)](Pt—Pt) guanidinium nitrate hexahydrate","","- C29 H54 N14 O17 Pt2 S2 -","- C29 H42 N14 O17 Pt2 S2 -","- C116 H168 N56 O68 Pt8 S8 -","4","1","BM3021","Sakai, Ken; Yokokawa, Kazuo; Yokoyama, Yoshimi","Pt~2~^II^ and Pt~2~^III^ dimers containing a Pt~2~(2,2'-bipyridine)~2~(μ-<i>N</i>,<i>N</i>-dimethylguanidinato)~2~ unit","Acta Crystallographica Section C","2007","63","2","m36","m41","10.1107/S0108270106053601","","","0.71073","MoKα","","0.0843","0.041","","","0.1027","0.1136","","","","","","0.95","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015779","9.6949","0.0002","10.4915","0.0002","16.9001","0.0002","97.645","0.001","101.458","0.001","113.215","0.001","1505.09","0.05","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","[(Acetato-κ^2^O,O')(di-2-pyridylamine-κ^2^N^2^,N^2'^)copper(II)]-μ-acetato- κ^2^O:O'-[(acetato-κO)(di-2-pyridylamine-κ^2^N^2^,N^2'^)(isothiocyanato- κN)copper(II)]","","- C27 H27 Cu2 N7 O6 S -","- C27 H27 Cu2 N7 O6 S -","- C54 H54 Cu4 N14 O12 S2 -","2","1","DN3030","Youngme, Sujittra; Chotkhun, Thidarat; Chaichit, Narongsak","μ-Acetato-1:2κ^2^<i>O</i>:<i>O</i>'-diacetato-1κ^2^<i>O</i>,<i>O</i>';2κ<i>O</i>-bis(di-2-pyridylamine)-1κ^2^<i>N</i>,<i>N</i>';2κ^2^<i>N</i>,<i>N</i>'-isothiocyanato-2κ<i>N</i>-dicopper(II)","Acta Crystallographica Section C","2007","63","2","m59","m61","10.1107/S0108270106054163","","","0.71073","MoKα","","0.0501","0.0375","","","0.0879","0.0989","","","","","","1.049","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015780","7.3964","0.0004","10.8144","0.0007","14.08","0.0011","90","","90","","90","","1126.23","0.13","110","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-poly[[(4,4'-bipyridine-κN)dioxouranium(VI)]-di-μ-hydroxo]","","- C10 H10 N2 O4 U -","- C10 H10 N2 O4 U -","- C40 H40 N8 O16 U4 -","4","1","DN3033","Thuéry, Pierre","π-Stacking and hydrogen bonding in <i>catena</i>-poly[[(4,4'-bipyridine-κ<i>N</i>)dioxouranium(VI)]-di-μ-hydroxo]","Acta Crystallographica Section C","2007","63","2","m54","m56","10.1107/S0108270106054412","","","0.71073","MoKα","","0.0387","0.0331","","","0.0833","0.0857","","","","","","1.104","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015781","10.3728","0.0002","17.1008","0.0004","12.9444","0.0003","90","","111.041","0.001","90","","2143.02","0.08","105","2","105","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 4-hydroxy-2,6-diphenyl-5-(phenylsulfanyl)pyridine-3-carboxylate","","- C26 H21 N O3 S -","- C26 H21 N O3 S -","- C104 H84 N4 O12 S4 -","4","1","DN3034","J. Suresh; R. Suresh Kumar; S. Perumal; A. Mostad; S. Natarajan","Ethyl 4-hydroxy-2,6-diphenyl-5-(phenylsulfanyl)pyridine-3-carboxylate and ethyl 2,6-bis(4-fluorophenyl)-4-hydroxy-5-(4-methylphenylsulfanyl)pyridine-3-carboxylate: supramolecular aggregation through C—H···O, C—H···F and C—H···π interactions","Acta Crystallographica Section C","2007","63","2","o141","o144","10.1107/S0108270107000224","","","0.71073","MoKα","","0.0439","0.0402","","","0.1085","0.1119","","","","","","1.024","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015782","12.092","0.001","10.489","0.001","18.496","0.002","90","","94.78","0.01","90","","2337.7","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","ethyl 2,6-bis(4-fluorophenyl)-4-hydroxy-5-(4-methylphenylsulfanyl)pyridine-3- carboxylate","","- C27 H21 F2 N O3 S -","- C27 H21 F2 N O3 S -","- C108 H84 F8 N4 O12 S4 -","4","1","DN3034","J. Suresh; R. Suresh Kumar; S. Perumal; A. Mostad; S. Natarajan","Ethyl 4-hydroxy-2,6-diphenyl-5-(phenylsulfanyl)pyridine-3-carboxylate and ethyl 2,6-bis(4-fluorophenyl)-4-hydroxy-5-(4-methylphenylsulfanyl)pyridine-3-carboxylate: supramolecular aggregation through C—H···O, C—H···F and C—H···π interactions","Acta Crystallographica Section C","2007","63","2","o141","o144","10.1107/S0108270107000224","","","0.71073","MoKα","","0.0778","0.0425","","","0.1104","0.128","","","","","","1.014","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015783","9.466","0.001","21.025","0.003","14.643","0.002","90","","98.67","0.002","90","","2881","0.6","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","rare earth MOCVD precursor","Tris(acetylacetonato-κ^2^O,O')(1,10-phenanthroline-κ^2^N,N')erbium(III)","","- C27 H29 Er N2 O6 -","- C27 H29 Er N2 O6 -","- C108 H116 Er4 N8 O24 -","4","1","DN3035","Neelgund, Gururaj M.; Shivashankar, S. A.; Narasimhamurthy, T.; Rathore, R. S.","Tris(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')erbium(III)","Acta Crystallographica Section C","2007","63","2","m74","m76","10.1107/S0108270107000248","","","0.71073","MoKα","","0.0541","0.041","","","0.094","0.0979","","","","","","1.256","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015784","3.821","0.001","11.725","0.002","15.118","0.003","90","","96.55","0.03","90","","672.9","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","ortho-chloronitrobenzene","1-chloro,2-nitrobenzene","","- C6 H4 Cl N O2 -","- C6 H4 Cl N O2 -","- C24 H16 Cl4 N4 O8 -","4","1","EM1004","Mossakowska, Izabella; Wójcik, Grażyna","1-Chloro-2-nitrobenzene: N—O···Cl halogen bonds and aromatic π‒π stacking, and thermal vibrations in the vicinity of the melting point","Acta Crystallographica Section C","2007","63","2","o123","o125","10.1107/S0108270106048797","","","0.71073","MoKα","","0.0867","0.0747","","","0.1909","0.2048","","","","","","1.091","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015785","13.0702","0.0008","21.8905","0.0016","7.7957","0.0005","90","","90","","90","","2230.5","0.3","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","3,4-di-2-pyridyl-1,2,5-oxadiazole","","- C12 H8 N4 O -","- C12 H8 N4 O -","- C96 H64 N32 O8 -","8","0.5","FA3049","Liu, Na; Cheng, Ai-Ling; Gao, En-Qing","3,4-Di-2-pyridyl-1,2,5-oxadiazole and its perchlorate salt","Acta Crystallographica Section C","2007","63","2","o93","o95","10.1107/S0108270106052401","","","0.71073","MoKα","","0.1392","0.065","","","0.0716","0.0828","","","","","","1.099","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015786","13.5254","0.0004","13.1646","0.0004","7.6908","0.0002","90","","90","","90","","1369.4","0.07","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","2-[3-(2-pyridyl)-1,2,5-oxadiazol-4-yl]pyridinium perchlorate","","- C12 H9 Cl N4 O5 -","- C12 H9 Cl N4 O5 -","- C48 H36 Cl4 N16 O20 -","4","0.5","FA3049","Liu, Na; Cheng, Ai-Ling; Gao, En-Qing","3,4-Di-2-pyridyl-1,2,5-oxadiazole and its perchlorate salt","Acta Crystallographica Section C","2007","63","2","o93","o95","10.1107/S0108270106052401","","","0.71073","MoKα","","0.1105","0.0637","","","0.1976","0.2213","","","","","","1.03","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015787","5.5515","0.0008","12.6547","0.0012","17.0171","0.0019","90","","90","","90","","1195.5","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","2'-Deoxy-2-fluorotubercidin","7-(2-deoxy-β-D-erythro-pentofuranosyl)- 2-fluoro-7H-pyrrolo[2,3-d]pyrimidin-2-amine","","- C11 H13 F N4 O3 -","- C11 H13 F N4 O3 -","- C44 H52 F4 N16 O12 -","4","1","FA3053","Seela, Frank; Peng , Xiaohua; Eickmeier, Henning; Reuter, Hans","2'-Deoxy-2-fluorotubercidin","Acta Crystallographica Section C","2007","63","2","o96","o98","10.1107/S0108270106053704","","","0.71073","MoKα","","0.0506","0.0418","","","0.1088","0.1149","","","","","","1.04","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015788","8.1272","0.0006","10.0646","0.0008","18.2504","0.0014","90","","90","","90","","1492.8","0.2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(4S)-trans-4-ethylammonio-5,6-dihydro-6-methyl-4H-thieno[2,3-b]thiopyran- 2-sulfonamide 7,7-dioxide chloride","","- C10 H17 Cl N2 O4 S3 -","- C10 H17 Cl N2 O4 S3 -","- C40 H68 Cl4 N8 O16 S12 -","4","1","GA3036","Krishnan Ravikumar; Balasubramanian Sridhar","Dorzolamide hydrochloride: an antiglaucoma agent","Acta Crystallographica Section C","2007","63","2","o108","o110","10.1107/S0108270106055338","","","0.71073","MoKα","","0.0247","0.0242","","","0.0641","0.0645","","","","","","1.055","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015789","6.2168","0.001","9.7823","0.001","14.0973","0.0007","98.977","0.003","101.16","0.002","93.697","0.007","826.83","0.16","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","(E)-4-(4-bromophenyldiazenyl)-2,6-dimethylphenyl acrylate","","- C17 H15 Br N2 O2 -","- C17 H15 Br N2 O2 -","- C34 H30 Br2 N4 O4 -","2","1","GD3067","Kocaokutgen, Hasan; Ibrahim Uçar; Gür, Mahmut; Özkınalı, Sevil; Büyükgüngör, Orhan","(<i>E</i>)-4-(4-Bromophenyldiazenyl)-2,6-dimethylphenyl acrylate and (<i>E</i>)-2,6-dimethyl-4-(4-methylphenyldiazenyl)phenyl acrylate","Acta Crystallographica Section C","2007","63","2","o111","o113","10.1107/S0108270106054369","","","0.71073","MoKα","","0.0683","0.0413","","","0.0968","0.1089","","","","","","1.018","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015790","6.1589","0.0008","11.2603","0.0015","12.3461","0.0016","82.78","0.011","80.07","0.011","85.321","0.011","835.13","0.19","297","2","297","2","","","","","","","","4","P -1","-P 1","2","","(E)-2,6-dimethyl-4-(4-methylphenyldiazenyl)phenyl acrylate","","- C18 H18 N2 O2 -","- C18 H18 N2 O2 -","- C36 H36 N4 O4 -","2","1","GD3067","Kocaokutgen, Hasan; Ibrahim Uçar; Gür, Mahmut; Özkınalı, Sevil; Büyükgüngör, Orhan","(<i>E</i>)-4-(4-Bromophenyldiazenyl)-2,6-dimethylphenyl acrylate and (<i>E</i>)-2,6-dimethyl-4-(4-methylphenyldiazenyl)phenyl acrylate","Acta Crystallographica Section C","2007","63","2","o111","o113","10.1107/S0108270106054369","","","0.71073","MoKα","","0.1549","0.0835","","","0.1847","0.2162","","","","","","1.081","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015791","9.83","0.002","12.364","0.003","11.56","0.003","90","","103.09","0.03","90","","1368.5","0.6","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","brucinium 4-nitrobenzoate methanol solvate","","- C31 H35 N3 O9 -","- C31 H35 N3 O9 -","- C62 H70 N6 O18 -","2","1","GD3069","Agata Białońska; Zbigniew Ciunik","Isomorphous brucinium 4-nitrobenzoate methanol solvate and brucinium 4-nitrobenzoate dihydrate","Acta Crystallographica Section C","2007","63","2","o120","o122","10.1107/S010827010605517X","","","0.71073","MoKα","","0.0704","0.0551","","","0.121","0.1303","","","","","","1.047","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015792","10.085","0.002","12.338","0.003","11.615","0.003","90","","108.61","0.03","90","","1369.7","0.6","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","brucinium 4-nitrobenzoate dihydrate","","- C30 H35 N3 O10 -","- C30 H35 N3 O10 -","- C60 H70 N6 O20 -","2","1","GD3069","Agata Białońska; Zbigniew Ciunik","Isomorphous brucinium 4-nitrobenzoate methanol solvate and brucinium 4-nitrobenzoate dihydrate","Acta Crystallographica Section C","2007","63","2","o120","o122","10.1107/S010827010605517X","","","0.71073","MoKα","","0.0327","0.03","","","0.0766","0.0781","","","","","","1.052","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015793","8.075","0.002","12.464","0.002","29.994","0.003","90","","90","","90","","3018.8","0.9","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","brucinium 4-nitrobenzoate 2.6 hydrate","","- C30 H36.2 N3 O10.6 -","- C30 H34.6 N3 O10.6 -","- C120 H138.4 N12 O42.4 -","4","1","GD3069","Agata Białońska; Zbigniew Ciunik","Isomorphous brucinium 4-nitrobenzoate methanol solvate and brucinium 4-nitrobenzoate dihydrate","Acta Crystallographica Section C","2007","63","2","o120","o122","10.1107/S010827010605517X","","","0.71073","MoKα","","0.1163","0.0882","","","0.2387","0.2613","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2015794","5.64","0.001","8.768","0.002","10.704","0.002","90","","92.49","0.03","90","","528.83","0.18","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","L-leucine perchlorate","L-Leucinium perchlorate","","- C6 H14 Cl N O6 -","- C6 H14 Cl N O6 -","- C12 H28 Cl2 N2 O12 -","2","1","GD3071","Jan Janczak; Genivaldo Julio Perpétuo","<small>L</small>-Leucinium perchlorate","Acta Crystallographica Section C","2007","63","2","o117","o119","10.1107/S0108270106055156","","","0.71073","MoKα","","0.057","0.0422","","","0.098","0.1068","","","","","","1.002","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015795","7.9355","0.0003","24.7376","0.0009","11.1332","0.0005","90","","106.589","0.002","90","","2094.54","0.15","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(S)-(+)-3-[5-cyano-2-(4-fluorophenyl)-1,3-dihydroisobenzofuran-2- yl]propanaminium oxalate oxalic acid 0.325-hydrate","","- C44 H46 F2 N4 O10.325 -","- C44 H46 F2 N4 O10.325 -","- C88 H92 F4 N8 O20.65 -","2","1","GD3075","Harrison, William T. A.; Yathirajan, H. S.; Bindya, S.; Anilkumar, H. G.; Devaraju","Escitalopram oxalate: co-existence of oxalate dianions and oxalic acid molecules in the same crystal","Acta Crystallographica Section C","2007","63","2","o129","o131","10.1107/S010827010605520X","","","0.71073","MoKα","","0.0751","0.0422","","","0.0825","0.0949","","","","","","1.018","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015796","40.0004","0.0007","8.8672","0.0001","16.9706","0.0004","90","","111.062","0.0008","90","","5617.17","0.18","293","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tris(2-methylquinoline-8-selenolato-κ^2^N,Se)antimony(III)","","- C30 H24 N3 Sb Se3 -","- C30 H24 N3 Sb Se3 -","- C240 H192 N24 Sb8 Se24 -","8","1","GG3054","Silina, Elga; Belyakov, Sergey; Ashaks, Janis; Pecha, Lucija; Zaruma, Daina","Tris(2-methylquinoline-8-selenolato-κ^2^<i>N</i>,<i>Se</i>)antimony(III)","Acta Crystallographica Section C","2007","63","2","m62","m64","10.1107/S0108270106053285","","","0.71073","MoKα","","0.1043","0.0486","","","0.1224","0.17","","","","","","1.064","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015797","8.3321","0.0002","18.3668","0.0004","10.8568","0.0002","90","","94.45","0.002","90","","1656.45","0.06","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(2-methoxybenzyl)-2-(2-methoxyphenyl)-1,3-thiazolidin-4-one","","- C18 H19 N O3 S -","- C18 H19 N O3 S -","- C72 H76 N4 O12 S4 -","4","1","GG3061","Cunico, Wilson; Capri, Liliane R.; Gomez, C. R. B.; Wardell, Solange M. S. V.; Low, John N.; Glidewell, Christopher","Five symmetrically substituted 2-aryl-3-benzyl-1,3-thiazolidin-4-ones: supramolecular structures in zero, one and two dimensions","Acta Crystallographica Section C","2007","63","2","o102","o107","10.1107/S0108270106055272","","","0.71073","MoKα","","0.0398","0.0347","","","0.083","0.0858","","","","","","1.043","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015798","14.223","0.0007","7.9862","0.0004","14.1156","0.0007","90","","93.908","0.003","90","","1599.63","0.14","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(4-nitrobenzyl)-2-(4-nitrophenyl)-1,3-thiazolidin-4-one","","- C16 H13 N3 O5 S -","- C16 H13 N3 O5 S -","- C64 H52 N12 O20 S4 -","4","1","GG3061","Cunico, Wilson; Capri, Liliane R.; Gomez, C. R. B.; Wardell, Solange M. S. V.; Low, John N.; Glidewell, Christopher","Five symmetrically substituted 2-aryl-3-benzyl-1,3-thiazolidin-4-ones: supramolecular structures in zero, one and two dimensions","Acta Crystallographica Section C","2007","63","2","o102","o107","10.1107/S0108270106055272","","","0.71073","MoKα","","0.1528","0.1215","","","0.4013","0.4375","","","","","","1.102","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015799","4.6687","0.0004","9.621","0.0008","35.478","0.003","90","","95.335","0.003","90","","1586.7","0.2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(4-methoxybenzyl)-2-(4-methoxyphenyl)-1,3-thiazolidin-4-one","","- C18 H19 N O3 S -","- C18 H19 N O3 S -","- C72 H76 N4 O12 S4 -","4","1","GG3061","Cunico, Wilson; Capri, Liliane R.; Gomez, C. R. B.; Wardell, Solange M. S. V.; Low, John N.; Glidewell, Christopher","Five symmetrically substituted 2-aryl-3-benzyl-1,3-thiazolidin-4-ones: supramolecular structures in zero, one and two dimensions","Acta Crystallographica Section C","2007","63","2","o102","o107","10.1107/S0108270106055272","","","0.71073","MoKα","","0.0786","0.061","","","0.2076","0.2389","","","","","","1.103","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015800","22.3","0.0004","9.9352","0.0003","14.6945","0.0004","90","","96.435","0.002","90","","3235.13","0.14","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-(2-nitrobenzyl)-2-(2-nitrophenyl)-1,3-thiazolidin-4-one","","- C16 H13 N3 O5 S -","- C16 H13 N3 O5 S -","- C128 H104 N24 O40 S8 -","8","1","GG3061","Cunico, Wilson; Capri, Liliane R.; Gomez, C. R. B.; Wardell, Solange M. S. V.; Low, John N.; Glidewell, Christopher","Five symmetrically substituted 2-aryl-3-benzyl-1,3-thiazolidin-4-ones: supramolecular structures in zero, one and two dimensions","Acta Crystallographica Section C","2007","63","2","o102","o107","10.1107/S0108270106055272","","","0.71073","MoKα","","0.0523","0.0362","","","0.088","0.0956","","","","","","1.057","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015801","13.9981","0.0006","10.1236","0.0003","10.1491","0.0004","90","","106.333","0.002","90","","1380.2","0.09","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(2-fluorobenzyl)-2-(2-fluorophenyl)-1,3-thiazolidin-4-one","","- C16 H13 F2 N O S -","- C16 H13 F2 N O S -","- C64 H52 F8 N4 O4 S4 -","4","1","GG3061","Cunico, Wilson; Capri, Liliane R.; Gomez, C. R. B.; Wardell, Solange M. S. V.; Low, John N.; Glidewell, Christopher","Five symmetrically substituted 2-aryl-3-benzyl-1,3-thiazolidin-4-ones: supramolecular structures in zero, one and two dimensions","Acta Crystallographica Section C","2007","63","2","o102","o107","10.1107/S0108270106055272","","","0.71073","MoKα","","0.0736","0.0592","","","0.1378","0.1452","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015802","10.1044","0.0003","11.7533","0.0005","12.1655","0.0005","117.232","0.002","97.48","0.003","99.585","0.002","1231.11","0.09","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","1-(6-Amino-1,3-benzodioxol-5-yl)-3-(4-pyridyl)prop-2-en-1-one","","- C15 H12 N2 O3 -","- C15 H12 N2 O3 -","- C60 H48 N8 O12 -","4","2","GG3063","Cuervo, Paola; Abonía, Rodrigo; Cobo, Justo; Low, John N.; Glidewell, Christopher","1-(6-Amino-1,3-benzodioxol-5-yl)-3-(4-pyridyl)prop-2-en-1-one crystallizes with <i>Z</i>' = 2: hydrogen-bonded supramolecular substructures in one and two dimensions, each containing only one type of molecule","Acta Crystallographica Section C","2007","63","2","o99","o101","10.1107/S0108270106055545","","","0.71073","MoKα","","0.1079","0.0589","","","0.1453","0.1689","","","","","","1.034","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015803","7.7358","0.0003","9.4543","0.0005","29.9093","0.0013","90","","90","","90","","2187.46","0.17","295","2","294","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","gold(III) tetrachloride salt of L-cocaine complex","(1R,2R,3S,5S,8S)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate tetrachlorogold(III)","","- C17 H22 Au Cl4 N O4 -","- C17 H22 Au Cl4 N O4 -","- C68 H88 Au4 Cl16 N4 O16 -","4","1","GZ3036","Wood, Matthew R.; Brettell, Thomas A.; Lalancette, Roger A.","The gold(III) tetrachloride salt of <small>L</small>-cocaine","Acta Crystallographica Section C","2007","63","2","m33","m35","10.1107/S0108270106053108","","","1.54178","CuKα","","0.029","0.028","","","0.07","0.07","","","","","","1.05","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015804","8.5473","0.001","6.2423","0.0007","9.1325","0.0011","90","","114.701","0.004","90","","442.68","0.09","200","2","200","2","","","","","","","","4","P 1 21 1","P 2yb","4","β-Erythrocytidine","1-(β-D-Erythrofuranosyl)cytidine","","- C8 H11 N3 O4 -","- C8 H11 N3 O4 -","- C16 H22 N6 O8 -","2","1","GZ3050","Kline, Paul C.; Noll, Bruce C.; Zhao, Hongqiu; Serianni, Anthony S.","1-(β-<small>D</small>-Erythrofuranosyl)cytidine (β-erythrocytidine)","Acta Crystallographica Section C","2007","63","2","o137","o140","10.1107/S0108270106055053","","","1.54178","CuKα","","0.029","0.0278","","","0.0709","0.0756","","","","","","1.088","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015805","5.699","0.001","7.428","0.001","20.053","0.002","90","","93.384","0.007","90","","847.4","0.2","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","NDSB-201","3-(1-Pyridinio)propanesulfonate","","- C8 H11 N O3 S -","- C8 H11 N O3 S -","- C32 H44 N4 O12 S4 -","4","1","GZ3054","Katarzyna D. Koclega; Maksymilian Chruszcz; Anna Gawlicka-Chruszcz; Marcin Cymborowski; Wladek Minor","3-(1-Pyridinio)propanesulfonate and 3-(benzyldimethylammonio)propanesulfonate monohydrate","Acta Crystallographica Section C","2007","63","2","o114","o116","10.1107/S0108270106054692","","","1.54179","CuKα","","0.0301","0.03","","","0.082","0.0821","","","","","","1.046","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015806","12.628","0.001","11.209","0.001","9.982","0.001","90","","107.26","0.004","90","","1349.3","0.2","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","NDSB-256","3-(benzyldimethylammonio)propanesulfonate monohydrate","","- C12 H21 N O4 S -","- C12 H21 N O4 S -","- C48 H84 N4 O16 S4 -","4","1","GZ3054","Katarzyna D. Koclega; Maksymilian Chruszcz; Anna Gawlicka-Chruszcz; Marcin Cymborowski; Wladek Minor","3-(1-Pyridinio)propanesulfonate and 3-(benzyldimethylammonio)propanesulfonate monohydrate","Acta Crystallographica Section C","2007","63","2","o114","o116","10.1107/S0108270106054692","","","1.54179","CuKα","","0.0421","0.0385","","","0.1002","0.1015","","","","","","1.083","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015807","8.9511","0.0006","24.128","0.002","12.6581","0.0009","90","","94.806","0.008","90","","2724.2","0.4","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","TrpyPdOAc^F^","Trifluoracetato-(1,3,12,14-tetramethyl-2,7,8,13- tetraethyltripyrrinato)palladium(II)","","- C28 H34 F3 N3 O2 Pd -","- C28 H34 F3 N3 O2 Pd -","- C112 H136 F12 N12 O8 Pd4 -","4","1","GZ3060","Bröring, Martin; Prikhodovski, Serguei; Köhler, Silke","(3,8,9,14-Tetraethyl-2,4,13,15-tetramethyltripyrrinato)(trifluoroacetato)palladium(II)","Acta Crystallographica Section C","2007","63","2","m68","m70","10.1107/S010827010605579X","","","0.71073","MoKα","","0.0525","0.0392","","","0.0998","0.1032","","","","","","1.185","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015808","7.6217","0.0006","15.8538","0.0013","16.3696","0.0012","90","","90","","90","","1978","0.3","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","mesitylnitramine","2,4,6-trimethyl-N-nitroaniline","","- C9 H12 N2 O2 -","- C9 H12 N2 O2 -","- C72 H96 N16 O16 -","8","1","HJ3024","Kyzioł, Janusz; Daszkiewicz, Zdzisław; Zaleski, Jacek","2,4,6-Trimethyl-<i>N</i>-nitroaniline","Acta Crystallographica Section C","2007","63","2","o126","o128","10.1107/S0108270106055776","","","0.71073","MoKα","","0.1296","0.0462","","","0.1107","0.1417","","","","","","0.981","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015809","10.8631","0.0009","5.3684","0.0005","24.661","0.002","90","","97.833","0.007","90","","1424.7","0.2","90","0.1","90","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","9-Methyl-3-phenyldiazenyl-9H-carbazole","","- C19 H15 N3 -","- C19 H15 N3 -","- C76 H60 N12 -","4","1","HJ3027","Kyzioł, Janusz B.; Ejsmont, Krzysztof","9-Methyl-3-phenyldiazenyl-9<i>H</i>-carbazole: X-ray and DFT-calculated structures","Acta Crystallographica Section C","2007","63","2","o77","o79","10.1107/S0108270106053571","","","0.71073","MoKα","","0.0832","0.0335","","","0.0536","0.0575","","","","","","0.84","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015810","9.688","0.002","7.7579","0.0017","10.219","0.004","90","","102.684","0.019","90","","749.3","0.4","122","1","122","1","","","","","","","","6","P 1 21/m 1","-P 2yb","11","Vanadyltriflate","Pentaaquaoxovanadium(IV) trifluoromethanesulfonate","","- C2 H10 F6 O12 S2 V -","- C2 H10 F6 O12 S2 V -","- C4 H20 F12 O24 S4 V2 -","2","0.5","IZ3014","Magnussen, Magnus; Brock-Nannestad, Theis; Bendix, Jesper","Pentaaquaoxovanadium(IV) bis(trifluoromethanesulfonate)","Acta Crystallographica Section C","2007","63","2","m51","m53","10.1107/S010827010605219X","","","0.71073","MoKα","","0.0434","0.0379","","","0.0986","0.1039","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015811","15.7776","0.0019","17.191","0.002","25.513","0.003","90","","93.914","0.003","90","","6903.8","1.4","291","2","291","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis(μ-acetato)(μ-2,6-bis{[(2-hydroxyethyl)(2-pyridylmethyl)amino]methyl}- 4-methylphenolato)dinickel(II) hexafluorophosphate hemihydrate","","- C29 H38 F6 N4 Ni2 O7.5 P -","- C29 H38 F6 N4 Ni2 O7.5 P -","- C232 H304 F48 N32 Ni16 O60 P8 -","8","2","LN3026","Chen, Jing-Wen; Liu, Bin; Chen, Xiao-Qing; Li, Yi-Zhi","Bis(μ-acetato)(μ-2,6-bis{[(2-hydroxyethyl)(2-pyridylmethyl)amino]methyl}-4-methylphenolato)dinickel(II) hexafluorophosphate hemihydrate","Acta Crystallographica Section C","2007","63","2","m42","m44","10.1107/S0108270106053480","","","0.71073","MoKα","","0.0989","0.0601","","","0.0945","0.1018","","","","","","1.103","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2015812","11.3575","0.0007","11.6949","0.0007","13.8332","0.0008","101.753","0.001","107.337","0.001","108.916","0.001","1564.77","0.16","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","tetra-μ~2~-acetato-diaquadi-μ~2~-chloro-tetrachlorotetrakis[μ~4~- 3-hydroxy-2,2-bis(oxidomethyl)propanolato]tetramethanoldi-μ~5~-oxo- octamanganese(II)tetramanganese(III), [Mn^III^~4~Mn^II^~8~Cl~6~O~2~(CH~3~O)~2~(C~2~H~3~O~2~)~4~(C~3~H~5~O~4~)~4~\ (CH~4~MeO)~4~(H~2~O)~2~]","","- C34 H74 Cl6 Mn12 O34 -","- C34 H74 Cl6 Mn12 O34 -","- C34 H74 Cl6 Mn12 O34 -","1","0.5","SF3024","Mukherjee, Arindam; Boskovic, Colette; Gable, Robert W.","A dodecanuclear manganese(II,III) complex of pentaerythritol","Acta Crystallographica Section C","2007","63","2","m71","m73","10.1107/S010827010700042X","","","0.71073","MoKα","","0.031","0.0284","","","0.0791","0.0807","","","","","","1.018","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015813","14.1074","0.0008","8.5839","0.0005","19.4144","0.0011","90","","95.635","0.001","90","","2339.7","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Azido-κN)bis(di-2-pyridylamine)copper(II) hexafluorophosphate","","- C20 H18 Cu F6 N9 P -","- C20 H18 Cu F6 N9 P -","- C80 H72 Cu4 F24 N36 P4 -","4","1","SF3027","Youngme, Sujittra; Phatchimkun, Jaturong; Pakawatchai, Chaveng; Prabpai, Samran; Kongsaeree, Palangpon","(Azido-κ<i>N</i>)bis(di-2-pyridylamine)copper(II) hexafluorophosphate and (azido-κ<i>N</i>)bis(di-2-pyridylamine)copper(II) chloride tetrahydrate","Acta Crystallographica Section C","2007","63","2","m45","m47","10.1107/S0108270106052693","","","0.71073","MoKα","","0.0594","0.0432","","","0.1027","0.1107","","","","","","1.049","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015814","7.056","0.0002","27.836","0.0013","12.878","0.0006","90","","99.009","0.002","90","","2498.18","0.18","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(azido-κN)bis(di-2-pyridylamine)copper(II) chloride tetrahydrate","","- C20 H26 Cl Cu N9 O4 -","- C20 H26 Cl Cu N9 O4 -","- C80 H104 Cl4 Cu4 N36 O16 -","4","1","SF3027","Youngme, Sujittra; Phatchimkun, Jaturong; Pakawatchai, Chaveng; Prabpai, Samran; Kongsaeree, Palangpon","(Azido-κ<i>N</i>)bis(di-2-pyridylamine)copper(II) hexafluorophosphate and (azido-κ<i>N</i>)bis(di-2-pyridylamine)copper(II) chloride tetrahydrate","Acta Crystallographica Section C","2007","63","2","m45","m47","10.1107/S0108270106052693","","","0.71073","MoKα","","0.0673","0.0455","","","0.1248","0.1473","","","","","","1.095","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015815","31.385","0.002","12.4151","0.0007","16.5874","0.0011","90","","100.246","0.006","90","","6360.2","0.7","296","","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(Acetonitrile){2,6-bis[1-(2-ethyl-6- methylphenylimino)ethyl]pyridine}dichlororuthenium(II) dichloromethane hemisolvate","","- C29.5 H35 Cl3 N4 Ru -","- C29.5 H35 Cl3 N4 Ru -","- C236 H280 Cl24 N32 Ru8 -","8","1","SK3081","Özdemir, Namık; Dinçer, Muharrem; Dayan, Osman; Çetinkaya, Bekir","(Acetonitrile){2,6-bis[1-(2-ethyl-6-methylphenylimino)ethyl]pyridine}dichlororuthenium(II) dichloromethane hemisolvate: a chain of edge-fused <i>R</i>~6~^6^(24) rings","Acta Crystallographica Section C","2007","63","2","m77","m80","10.1107/S0108270107001266","","","0.71073","MoKα","","0.0915","0.0529","","","0.1458","0.1592","","","","","","1.031","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015816","9.356","0.0001","9.4049","0.0001","11.1174","0.0002","90.1103","0.0005","104.308","0.0005","106.125","0.0006","907.99","0.02","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","","(Z)-2-(1-Benzyl-5-nitro-1H-indol-3-ylmethylene)-1-azabicyclo[2.2.2]octan-3-one","","- C23 H21 N3 O3 -","- C23 H21 N3 O3 -","- C46 H42 N6 O6 -","2","1","SK3086","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","(<i>Z</i>)-2-(1-Benzyl-5-nitro-1<i>H</i>-indol-3-ylmethylene)-1-azabicyclo[2.2.2]octan-3-one","Acta Crystallographica Section C","2007","63","2","o135","o136","10.1107/S0108270106055971","","","0.71073","MoKα","","0.0519","0.0399","","","0.0999","0.1071","","","","","","1.044","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015817","9.5068","0.0012","6.5035","0.001","11.4259","0.0016","90","","104.572","0.015","90","","683.71","0.17","293","1","293","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[μ~2~-chloro-μ~2~-1,4-oxathiane-κ^2^S:S-copper(I)]","","- C4 H8 Cl Cu O S -","- C4 H8 Cl Cu O S -","- C16 H32 Cl4 Cu4 O4 S4 -","4","1","SQ3054","Salivon, Natalya F.; Filinchuk, Yaroslav E.; Olijnyk, Volodymyr V.","Poly[μ~2~-chloro-μ~2~-1,4-oxathiane-κ^2^<i>S</i>:<i>S</i>-copper(I)]","Acta Crystallographica Section C","2007","63","2","m57","m58","10.1107/S0108270106054047","","","0.71069","MoKα","","0.0758","0.0337","","","0.0628","0.0699","","","","","","0.765","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015818","7.6865","0.0003","11.0294","0.0008","26.8912","0.0013","90","","90","","90","","2279.8","0.2","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","P,P'-di[3-(trimethylsilyl)-1-propyl] ethylenebisphosphonic acid","Bis[3-(trimethylsilyl)propyl] ethylenebisphosphonate","","- C14 H36 O6 P2 Si2 -","- C14 H36 O6 P2 Si2 -","- C56 H144 O24 P8 Si8 -","4","0.5","SQ3056","McLauchlan, Craig C.; Ziegler, Amanda J.; Sosnowski, Cyndi R.; Herlinger, Albert W.","Bis[3-(trimethylsilyl)propyl] ethylenebisphosphonate, H~2~DTMSP[EBP]","Acta Crystallographica Section C","2007","63","2","o132","o134","10.1107/S0108270106055818","","","0.71073","MoKα","","0.0449","0.0327","","","0.0801","0.0869","","","","","","1.051","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015819","3.9788","0.0007","21.203","0.004","3.6583","0.0007","90","","90","","90","","308.62","0.1","295","2","295","2","","","","","","","","3","C m m m","-C 2 2","65","Trimagnesium dinickel diterbium","diterbium dinickel trimagnesium","","- Mg3 Ni2 Tb2 -","- Mg3 Ni2 Tb2 -","- Mg6 Ni4 Tb4 -","2","0.125","SQ3057","Solokha, Pavlo; De Negri, Serena; Saccone, Adriana; Pavlyuk, Volodymyr; Marciniak, Bernard; Tedenac, Jean-Claude","Tb~2~Ni~2~Mg~3~: a new structure type derived from the Ru~3~Al~2~B~2~ type","Acta Crystallographica Section C","2007","63","2","i13","i16","10.1107/S0108270107001503","","","0.71073","MoKα","","0.0352","0.0323","","","0.0764","0.078","","","","","","1.1","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015820","8.8191","0.0014","10.7923","0.0018","9.3793","0.0014","90","","90.631","0.012","90","","892.7","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","ethylenediammonium oxotrithiotungstate(VI)","ethylenediammonium oxotrithiotungstate(VI)","","- C2 H10 N2 O S3 W -","- C2 H10 N2 O S3 W -","- C8 H40 N8 O4 S12 W4 -","4","1","AV3050","Srinivasan, Bikshandarkoil R.; Naik, Ashish R.; Näther, Christian; Bensch, Wolfgang","Competing hydrogen-bond acceptors in ethylenediammonium oxotrithiotungstate(VI)","Acta Crystallographica Section C","2007","63","3","m81","m84","10.1107/S0108270106056393","","","0.71073","MoKα","","0.0404","0.0261","","","0.0663","0.0697","","","","","","1.075","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015821","7.355","0.004","7.965","0.004","11.056","0.006","73.827","0.008","83.588","0.007","63.647","0.007","557.4","0.5","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","Tetraaquabis(3-carboxy-4-nitrobenzoato-κO)manganese(II) dihydrate","","- C16 H20 Mn N2 O18 -","- C16 H20 Mn N2 O18 -","- C16 H20 Mn N2 O18 -","1","0.5","AV3055","Xiong, Li-Qin; Qi, Chuan-Min; Yu, Hui; Liang, Sheng-Wen","Tetraaquabis(5-carboxy-2-nitrobenzoato-κ<i>O</i>)manganese(II) dihydrate: a metal‒water chain complex containing cyclic water tetramers","Acta Crystallographica Section C","2007","63","3","m117","m119","10.1107/S0108270106056010","","","0.71073","MoKα","","0.0347","0.0296","","","0.08","0.0839","","","","","","1.042","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015822","13.9136","0.0016","10.4852","0.0012","12.3991","0.0014","90","","102.165","0.002","90","","1768.2","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetraaqua(1,10-phenanthroline-κ^2^N,N')cobalt(II) dinitrate:","","- C12 H16 Co N4 O10 -","- C12 H16 Co N4 O10 -","- C48 H64 Co4 N16 O40 -","4","0.5","AV3059","Li, Zhi-Gang; Wang, Guan-Hua; Niu, Jia-Jia; Xu, Jing-Wei; Hu, Ning-Hai","Tetraaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II) dinitrate: a hydrogen-bonded supramolecular network","Acta Crystallographica Section C","2007","63","3","m94","m96","10.1107/S0108270107002314","","","0.71073","MoKα","","0.0315","0.0289","","","0.073","0.075","","","","","","1.051","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015823","6.9692","0.0002","12.3802","0.0005","14.5513","0.0007","90","","90","","90","","1255.49","0.09","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-Cyanobenzaldehyde isonicotinoylhydrazone monohydrate","","- C14 H12 N4 O2 -","- C14 H12 N4 O2 -","- C56 H48 N16 O8 -","4","1","AV3063","Souza, Marcus V. N. de; Wardell, Solange M. S. V.; Wardell, James L.; Low, John N.; Glidewell, Christopher","4-Cyanobenzaldehyde isonicotinoylhydrazone monohydrate: a three-dimensional hydrogen-bonded framework structure","Acta Crystallographica Section C","2007","63","3","o166","o168","10.1107/S0108270107002788","","","0.71073","MoKα","","0.0579","0.0449","","","0.1009","0.1067","","","","","","1.064","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015824","8.3859","0.0014","8.7715","0.0019","10.0402","0.001","80.784","0.013","68.195","0.011","87.373","0.014","676.8","0.2","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","bis[μ-1,2-bis(1H-1,2,4-triazol-1-yl)ethane- κ^2^N^4^:N^4'^]bis[diisothiocyanatozinc(II)]","","- C16 H16 N16 S4 Zn2 -","- C16 H16 N16 S4 Zn2 -","- C16 H16 N16 S4 Zn2 -","1","0.5","AV3065","Yu-Mei Zhang; Yu-Ping Zhang; Bao-Long Li; Yong Zhang","A novel dimeric zinc(II) complex: bis[μ-1,2-bis(1<i>H</i>-1,2,4-triazol-1-yl)ethane-κ^2^<i>N</i>^4^:<i>N</i>^4'^]bis[diisothiocyanatozinc(II)]","Acta Crystallographica Section C","2007","63","3","m120","m122","10.1107/S0108270107005215","","","0.71073","MoKα","","0.0386","0.0324","","","0.0789","0.083","","","","","","1.011","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015825","13.7129","0.0017","7.9403","0.0009","24.862","0.003","90","","101.879","0.005","90","","2649.1","0.6","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","potassium 3',4'-ethylenedithio-3-methylamidotetrathiafulvalene(+) tetraisothiocyanatomercury(II)","","- C14 H9 Hg K N5 O S10 -","- C14 H9 Hg K N5 O S10 -","- C56 H36 Hg4 K4 N20 O4 S40 -","4","1","AV3066","Simonov, Sergey; Zorina, Leokadiya; Kushch, Natal'ya; Mézière, Cécile; Batail, Patrick","3-Methylamido-3',4'-ethylenedithiotetrathiafulvalene(+) potassium tetraisothiocyanatomercury(II)","Acta Crystallographica Section C","2007","63","3","m126","m128","10.1107/S0108270107006154","","","0.71073","MoKα","","0.0596","0.0304","","","0.0622","0.0693","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015826","13.0541","0.0011","6.9672","0.0006","34.604","0.003","90","","90","","90","","3147.3","0.5","183","2","183","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","(E,Z,E)-1-(4-methoxyphenyl)-6-(4-nitrophenyl)hexa-1,3,5-triene","","- C19 H17 N O3 -","- C19 H17 N O3 -","- C152 H136 N8 O24 -","8","1","AV3067","Yoriko Sonoda; Seiji Tsuzuki; Nobuyuki Tamaoki; Midori Goto","Four (<i>E</i>,<i>Z</i>,<i>E</i>)-1-(4-alkoxyphenyl)-6-(4-nitrophenyl)hexa-1,3,5-trienes","Acta Crystallographica Section C","2007","63","3","o196","o200","10.1107/S0108270107005690","","","0.71073","MoKα","","0.0597","0.0427","","","0.121","0.1359","","","","","","1.066","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015827","18.914","0.009","6.88","0.003","25.927","0.011","90","","90","","90","","3374","3","183","2","183","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","(E,Z,E)-1-(4-ethoxyphenyl)-6-(4-nitrophenyl)hexa-1,3,5-triene","","- C20 H19 N O3 -","- C20 H19 N O3 -","- C160 H152 N8 O24 -","8","2","AV3067","Yoriko Sonoda; Seiji Tsuzuki; Nobuyuki Tamaoki; Midori Goto","Four (<i>E</i>,<i>Z</i>,<i>E</i>)-1-(4-alkoxyphenyl)-6-(4-nitrophenyl)hexa-1,3,5-trienes","Acta Crystallographica Section C","2007","63","3","o196","o200","10.1107/S0108270107005690","","","0.71073","MoKα","","0.1495","0.0638","","","0.1297","0.155","","","","","","0.921","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015828","15.3615","0.0011","6.8341","0.0005","17.6625","0.0012","90","","106.215","0.001","90","","1780.5","0.2","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E,Z,E)-1-(4-nitrophenyl)-6-(4-n-propoxyphenyl)hexa-1,3,5-triene","","- C21 H21 N O3 -","- C21 H21 N O3 -","- C84 H84 N4 O12 -","4","1","AV3067","Yoriko Sonoda; Seiji Tsuzuki; Nobuyuki Tamaoki; Midori Goto","Four (<i>E</i>,<i>Z</i>,<i>E</i>)-1-(4-alkoxyphenyl)-6-(4-nitrophenyl)hexa-1,3,5-trienes","Acta Crystallographica Section C","2007","63","3","o196","o200","10.1107/S0108270107005690","","","0.71073","MoKα","","0.0505","0.0411","","","0.1063","0.1156","","","","","","1.031","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015829","17.0571","0.001","6.7244","0.0004","17.2095","0.001","90","","105.884","0.001","90","","1898.54","0.19","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E,Z,E)-1-(4-n-butoxyphenyl)-6-(4-nitrophenyl)hexa-1,3,5-triene","","- C22 H23 N O3 -","- C22 H23 N O3 -","- C88 H92 N4 O12 -","4","1","AV3067","Yoriko Sonoda; Seiji Tsuzuki; Nobuyuki Tamaoki; Midori Goto","Four (<i>E</i>,<i>Z</i>,<i>E</i>)-1-(4-alkoxyphenyl)-6-(4-nitrophenyl)hexa-1,3,5-trienes","Acta Crystallographica Section C","2007","63","3","o196","o200","10.1107/S0108270107005690","","","0.71073","MoKα","","0.0546","0.0463","","","0.1219","0.1295","","","","","","1.047","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015830","13.914","0.0007","7.50076","0.00017","16.2547","0.0006","90","","98.806","0.002","90","","1676.43","0.11","240","2","240","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Aluminiumacetylacetonate","Tris(pentane-2,4-dionato-κ^2^O,O')aluminium(III)","","- C15 H21 Al O6 -","- C15 H21 Al O6 -","- C60 H84 Al4 O24 -","4","1","AV3070","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","α-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')aluminium(III) at 240, 210, 180, 150 and 110K: a new δ phase at 110 K","Acta Crystallographica Section C","2007","63","3","m129","m134","10.1107/S0108270107005707","","","0.71073","MoKα","","0.0564","0.0411","","","0.1138","0.1237","","","","","","1.077","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015831","13.864","0.0006","7.4755","0.0003","16.208","0.0011","90","","98.821","0.002","90","","1659.93","0.15","210","2","210","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Aluminiumacetylacetonate","Tris(pentane-2,4-dionato-κ^2^O,O')aluminium(III)","","- C15 H21 Al O6 -","- C15 H21 Al O6 -","- C60 H84 Al4 O24 -","4","1","AV3070","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","α-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')aluminium(III) at 240, 210, 180, 150 and 110K: a new δ phase at 110 K","Acta Crystallographica Section C","2007","63","3","m129","m134","10.1107/S0108270107005707","","","0.71073","MoKα","","0.0509","0.0392","","","0.1059","0.1136","","","","","","1.071","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015832","13.8385","0.0007","7.4614","0.0003","16.1873","0.0011","90","","98.871","0.002","90","","1651.42","0.16","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Aluminiumacetylacetonate","Tris(pentane-2,4-dionato-κ^2^O,O')aluminium(III)","","- C15 H21 Al O6 -","- C15 H21 Al O6 -","- C60 H84 Al4 O24 -","4","1","AV3070","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","α-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')aluminium(III) at 240, 210, 180, 150 and 110K: a new δ phase at 110 K","Acta Crystallographica Section C","2007","63","3","m129","m134","10.1107/S0108270107005707","","","0.71073","MoKα","","0.0461","0.0367","","","0.0966","0.1027","","","","","","1.082","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015833","13.7961","0.0005","7.44012","0.00017","16.1488","0.0005","90","","98.914","0.003","90","","1637.57","0.09","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Aluminiumacetylacetonate","Tris(pentane-2,4-dionato-κ^2^O,O')aluminium(III)","","- C15 H21 Al O6 -","- C15 H21 Al O6 -","- C60 H84 Al4 O24 -","4","1","AV3070","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","α-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')aluminium(III) at 240, 210, 180, 150 and 110K: a new δ phase at 110 K","Acta Crystallographica Section C","2007","63","3","m129","m134","10.1107/S0108270107005707","","","0.71073","MoKα","","0.0422","0.0341","","","0.0887","0.0939","","","","","","1.053","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015834","22.7424","0.0011","7.4467","0.0002","29.6165","0.0013","90","","103.221","0.002","90","","4882.8","0.3","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Aluminiumacetylacetonate","Tris(pentane-2,4-dionato-κ^2^O,O')aluminium(III)","","- C15 H21 Al O6 -","- C15 H21 Al O6 -","- C180 H252 Al12 O72 -","12","3","AV3070","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","α-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')aluminium(III) at 240, 210, 180, 150 and 110K: a new δ phase at 110 K","Acta Crystallographica Section C","2007","63","3","m129","m134","10.1107/S0108270107005707","","","0.71073","MoKα","","0.0514","0.0383","","","0.1025","0.1107","","","","","","1.046","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015835","8.194","0.002","9.959","0.002","15.358","0.003","104.27","0.03","103.99","0.03","91.1","0.03","1174.4","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[tetrakis(μ-propionato-κ^2^O:O')dicopper(II)]-μ-3- pyridylmethanol-κ^2^N:O-[bis(propionato-κO)bis(μ-3-pyridylmethanol- κ^2^N,O)copper(II)]-μ-3-pyridylmethanol-κO:N]","","- C42 H58 Cu3 N4 O16 -","- C42 H58 Cu3 N4 O16 -","- C42 H58 Cu3 N4 O16 -","1","0.5","BG3026","Moncol, Jan; Maroszova, Jaroslava; Melník, Milan; Koman, Marian","<i>catena</i>-Poly[[tetrakis(μ-propionato-κ^2^<i>O</i>:<i>O</i>')dicopper(II)]-μ-3-pyridylmethanol-κ^2^<i>N</i>:<i>O</i>-[bis(propionato-κ<i>O</i>)bis(3-pyridylmethanol-κ<i>N</i>)copper(II)]-μ-3-pyridylmethanol-κ<i>O</i>:<i>N</i>]","Acta Crystallographica Section C","2007","63","3","m114","m116","10.1107/S0108270107004386","","","0.71069","MoKα","","0.0947","0.0534","","","0.1383","0.1531","","","","","","1.014","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015836","12.1624","0.0004","7.2782","0.0002","21.4837","0.0007","90","","90","","90","","1901.75","0.1","243","2","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","butylammonium hexachloridotin(IV)","","- C8 H24 Cl6 N2 Sn -","- C8 H24 Cl6 N2 Sn -","- C32 H96 Cl24 N8 Sn4 -","4","0.5","BM3022","Lemmerer, Andreas; Billing, David G.; Reisinger, Sandra A.","Isostructural crystal packing and hydrogen bonding in alkylammonium tin(IV) chloride compounds","Acta Crystallographica Section C","2007","63","3","m97","m100","10.1107/S0108270107004659","","","0.71073","MoKα","","","0.0375","","","","0.1029","","","","","","1.129","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015837","12.2351","0.0005","7.2021","0.0003","24.5723","0.0009","90","","90","","90","","2165.27","0.15","243","2","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","pentylammonium hexachloridotin(IV)","","- C10 H28 Cl6 N2 Sn -","- C10 H28 Cl6 N2 Sn -","- C40 H112 Cl24 N8 Sn4 -","4","0.5","BM3022","Lemmerer, Andreas; Billing, David G.; Reisinger, Sandra A.","Isostructural crystal packing and hydrogen bonding in alkylammonium tin(IV) chloride compounds","Acta Crystallographica Section C","2007","63","3","m97","m100","10.1107/S0108270107004659","","","0.71073","MoKα","","","0.0434","","","","0.1181","","","","","","1.069","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015838","12.3622","0.0003","7.3179","0.0002","26.6245","0.0006","90","","90","","90","","2408.59","0.1","293","2","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","hexylammonium hexachloridotin(IV)","","- C12 H32 Cl6 N2 Sn -","- C12 H32 Cl6 N2 Sn -","- C48 H128 Cl24 N8 Sn4 -","4","0.5","BM3022","Lemmerer, Andreas; Billing, David G.; Reisinger, Sandra A.","Isostructural crystal packing and hydrogen bonding in alkylammonium tin(IV) chloride compounds","Acta Crystallographica Section C","2007","63","3","m97","m100","10.1107/S0108270107004659","","","0.71073","MoKα","","","0.0752","","","","0.2171","","","","","","1.112","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015839","12.243","0.002","7.1124","0.0013","13.777","0.003","90","","93.697","0.003","90","","1197.2","0.4","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(1-phenylethylammonium) hexachloridostannate(IV)","","- C16 H24 Cl6 N2 Sn -","- C16 H24 Cl6 N2 Sn -","- C32 H48 Cl12 N4 Sn2 -","2","0.5","BM3024","Billing, David G.; Lemmerer, Andreas; Rademeyer, Melanie","Bis(1-phenylethylammonium) hexachloridostannate(IV) and bis(2-phenylethylammonium) hexachloridostannate(IV)","Acta Crystallographica Section C","2007","63","3","m101","m104","10.1107/S0108270107004970","","","0.71073","MoKα","","","0.0307","","","","0.0968","","","","","","1.3","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015840","7.335","0.003","25.695","0.004","11.974","0.002","90","","90.03","0.02","90","","2256.8","1.1","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(2-phenylethylammonium) hexachloridostannate(IV)","","- C16 H24 Cl6 N2 Sn -","- C16 H24 Cl6 N2 Sn -","- C64 H96 Cl24 N8 Sn4 -","4","1","BM3024","Billing, David G.; Lemmerer, Andreas; Rademeyer, Melanie","Bis(1-phenylethylammonium) hexachloridostannate(IV) and bis(2-phenylethylammonium) hexachloridostannate(IV)","Acta Crystallographica Section C","2007","63","3","m101","m104","10.1107/S0108270107004970","","","0.71073","MoKα","","","0.0501","","","","0.122","","","","","","1.05","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015841","24.4297","0.0003","31.7167","0.0007","4.4409","0.0001","90","","90","","90","","3440.94","0.12","173","2","173","2","","","","","","","","4","F d d 2","F 2 -2d","43","2-(2,5-dihydroxyphenyl)-2-oxazoline","2-(2-Oxazolin-2-yl)benzene-1,4-diol","","- C9 H9 N O3 -","- C9 H9 N O3 -","- C144 H144 N16 O48 -","16","1","DN2121","Vratislav Langer; Eva Scholtzová; Dalma Gyepesová; Jozef Lustoň; Juraj Kronek","2-(2-Oxazolin-2-yl)benzene-1,4-diol: X-ray and density functional theory studies","Acta Crystallographica Section C","2007","63","3","o187","o189","10.1107/S0108270107004131","","","0.71073","MoKα","","0.0489","0.0365","","","0.0879","0.0963","","","","","","1.028","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015842","12.6852","0.0019","4.5157","0.0004","12.1383","0.0018","90","","113.915","0.011","90","","635.62","0.16","296","","296","","","","","","","","","5","P 1 c 1","P -2yc","7","","(E)-2-[(3-bromophenyl)iminomethyl]-4-methoxyphenol","","- C14 H12 Br N O2 -","- C14 H12 Br N O2 -","- C28 H24 Br2 N2 O4 -","2","1","DN3025","Özek, Arzu; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","Three (<i>E</i>)-2-[(bromophenyl)iminomethyl]-4-methoxyphenols","Acta Crystallographica Section C","2007","63","3","o177","o180","10.1107/S0108270107003241","","","0.71073","MoKα","","0.0669","0.0509","","","0.0974","0.1008","","","","","","1.371","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015843","14.0683","0.0012","6.9497","0.0007","6.5553","0.0006","90","","98.264","0.007","90","","634.26","0.1","296","","296","","","","","","","","","5","P 1 c 1","P -2yc","7","","(E)-2-[(4-bromophenyl)iminomethyl]-4-methoxyphenol","","- C14 H12 Br N O2 -","- C14 H12 Br N O2 -","- C28 H24 Br2 N2 O4 -","2","1","DN3025","Özek, Arzu; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","Three (<i>E</i>)-2-[(bromophenyl)iminomethyl]-4-methoxyphenols","Acta Crystallographica Section C","2007","63","3","o177","o180","10.1107/S0108270107003241","","","0.71073","MoKα","","0.0473","0.0342","","","0.0701","0.0747","","","","","","1.041","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015844","13.3255","0.0008","8.709","0.0005","11.9743","0.0006","90","","113.845","0.004","90","","1271.02","0.13","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E)-2-[(2-bromophenyl)iminomethyl]-4-methoxyphenol","","- C14 H12 Br N O2 -","- C14 H12 Br N O2 -","- C56 H48 Br4 N4 O8 -","4","1","DN3025","Özek, Arzu; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","Three (<i>E</i>)-2-[(bromophenyl)iminomethyl]-4-methoxyphenols","Acta Crystallographica Section C","2007","63","3","o177","o180","10.1107/S0108270107003241","","","0.71073","MoKα","","0.0394","0.0269","","","0.0537","0.0572","","","","","","1.045","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015845","10.4847","0.0013","14.4641","0.0018","9.2203","0.0011","90","","107.244","0.002","90","","1335.4","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-Benzyl-3,3-dichloro-1H-indol-2(3H)-one","","- C15 H11 Cl2 N O -","- C15 H11 Cl2 N O -","- C60 H44 Cl8 N4 O4 -","4","1","DN3029","Lotter, A. N. C.; Fernandes, M. A.; Otterlo, W. A. L. van; Koning, C. B. de","1-Benzyl-3,3-dichloro-1<i>H</i>-indol-2(3<i>H</i>)-one","Acta Crystallographica Section C","2007","63","3","o157","o159","10.1107/S0108270107002028","","","0.71073","MoKα","","0.0424","0.0319","","","0.0832","0.0881","","","","","","1.047","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015846","23.5972","0.0007","10.7419","0.0004","12.0086","0.0004","90","","90","","90","","3043.93","0.18","123.1","","","","","","","","","","","6","P n m a","-P 2ac 2n","62","","bis(dimethylphosphino)dimethylphosphonium trifluoromethanesulfonate","","- C7 H18 F3 O3 P3 S -","- C7 H18 F3 O3 P3 S -","- C56 H144 F24 O24 P24 S8 -","8","1","FA3074","Weigand, Jan J.; Davidson, Reagan J.; Cameron, T. Stanley; Burford, Neil","A second polymorph of bis(dimethylphosphino)dimethylphosphonium trifluoromethanesulfonate","Acta Crystallographica Section C","2007","63","3","o193","o195","10.1107/S0108270107006671","","","0.7107","MoKα","","","0.052","","","","0.063","","","","","","1.063","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015847","7.9154","0.0012","9.8527","0.0015","9.8141","0.0013","90","","94.198","0.012","90","","763.33","0.19","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2,3-difluoro-4-formylphenylboronic acid","2,3-Difluoro-4-formylphenylboronic acid","","- C7 H5 B F2 O3 -","- C7 H5 B F2 O3 -","- C28 H20 B4 F8 O12 -","4","1","FG3045","Klis, Tomasz; Lulinski, Sergiusz; Serwatowski, Janusz","2,3-Difluoro-4-formylphenylboronic acid","Acta Crystallographica Section C","2007","63","3","o145","o146","10.1107/S0108270107001576","","","0.71073","MoKα","","0.0652","0.0387","","","0.1022","0.1093","","","","","","0.895","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015848","14.0597","0.0011","9.4711","0.0007","14.5223","0.0012","90","","106.626","0.001","90","","1853","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[copper(II)-μ-2-[bis(2-pyridylmethyl)amino]butyrato- κ^4^N,N',N'',O:κO'] perchlorate]","","- C16 H18 Cl Cu N3 O6 -","- C16 H18 Cl Cu N3 O6 -","- C64 H72 Cl4 Cu4 N12 O24 -","4","1","GA3027","Choi, Ki-Young; Choi, Seung-Chul; Ko, Jaejung; Kang, Sang Ook; Han, Won-Sik","<i>catena</i>-Poly[[copper(II)-μ-2-[bis(2-pyridylmethyl)amino]butyrato-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>O</i>:κ<i>O</i>'] perchlorate]","Acta Crystallographica Section C","2007","63","3","m85","m87","10.1107/S0108270106049870","","","0.71073","MoKα","","0.0481","0.0377","","","0.1023","0.1103","","","","","","1.024","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015849","16.418","0.005","7.171","0.004","22.428","0.005","90","","102.543","0.005","90","","2577.5","1.7","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","catena-Poly[aquabarium(II)]-μ-aqua-bis(μ-2-carboxybiphenyl-2- carboxylato)barium(II)]","","- C28 H22 Ba O10 -","- C28 H22 Ba O10 -","- C112 H88 Ba4 O40 -","4","1","GD3066","Djehni Samia; Balegroune, Fadila; Guehria-Laidoudi, Achoura; Dahaoui, Slimane; Lecomte, Claude","<i>catena</i>-Poly[[aquabarium(II)]-μ-aqua-bis(μ-2'-carboxybiphenyl-2-carboxylato)]","Acta Crystallographica Section C","2007","63","3","m91","m93","10.1107/S0108270107001874","","","0.71073","MoKα","","0.0452","0.0302","","","0.0629","0.0688","","","","","","1.043","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015850","16.6521","0.0008","15.5103","0.0007","17.8922","0.0008","90","","115.34","0.002","90","","4176.5","0.3","292","2","292","2","","","","","","","","6","C 1 c 1","C -2yc","9","","catena-Poly[[[tetraaquazinc(II)]-μ-4,4'-bipyridine-κ^2^N:N'] [[μ-thiosulfato-bis[(thiosulfato-κS)zinc(II)]]-δi-μ-4,4'-bipyridine- κ^4^N:N'] dihydrate], {[Zn(C~10~H~8~N~2~)(H~2~O)~4~][Zn~2~(S~2~O~3~)~3~(C~10~H~8~N~2~)~2~].2H~2~O","","- C30 H36 N6 O15 S6 Zn3 -","- C30 H36 N6 O15 S6 Zn3 -","- C120 H144 N24 O60 S24 Zn12 -","4","1","GD3072","M. Enriqueta Díaz de Vivar; Sergio Baggio; María Teresa Garland; Ricardo Baggio","A polymeric zinc thiosulfate complex containing anionic and cationic chains based on tetrahedral and octahedral zinc sites","Acta Crystallographica Section C","2007","63","3","m123","m125","10.1107/S0108270107006166","","","0.71073","MoKα","","0.0217","0.0205","","","0.0505","0.0512","","","","","","0.904","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015851","7.9063","0.0001","9.6543","0.0002","10.7025","0.0002","70.771","0.001","71.47","0.001","73.531","0.001","716.62","0.02","120","2","","","","","","","","","","6","P -1","-P 1","2","","4,4,6,6-tetrachlorocyclo-2,2-(2,2-dimethylpropane-1,3-dioxy)triphosphazene","","- C5 H10 Cl4 N3 O2 P3 -","- C5 H10 Cl4 N3 O2 P3 -","- C10 H20 Cl8 N6 O4 P6 -","2","1","GD3078","Coles, Simon J.; Davies, David B.; Hacıvelioğlu, Ferda; Hursthouse, Michael B.; İbişoğlu, Hanife; Kılıç, Adem; Shaw, Robert A.","Dimorphism in 4,4,6,6-tetrachloro-2,2-(2,2-dimethylpropane-1,3-dioxy)cyclotriphosphazene and 6,6-dichloro-2,2:4,4-bis(2,2-dimethylpropane-1,3-dioxy)cyclotriphosphazene","Acta Crystallographica Section C","2007","63","3","o152","o156","10.1107/S0108270107003046","","","0.71073","MoKα","","","0.0256","","","","0.0687","","","","","","1.016","","","","has coordinates,has Fobs","278247","2022-09-28","15:09:32",""
"2015852","11.7673","0.0002","9.2325","0.0001","16.3007","0.0003","90","","90","","90","","1770.93","0.05","120","2","","","","","","","","","","6","P n m a","-P 2ac 2n","62","","6,6-dichlorocyclo-2,2:4,4-bis(2,2-dimethylpropane-1,3-dioxy)triphosphazene","","- C10 H20 Cl2 N3 O4 P3 -","- C10 H20 Cl2 N3 O4 P3 -","- C40 H80 Cl8 N12 O16 P12 -","4","0.5","GD3078","Coles, Simon J.; Davies, David B.; Hacıvelioğlu, Ferda; Hursthouse, Michael B.; İbişoğlu, Hanife; Kılıç, Adem; Shaw, Robert A.","Dimorphism in 4,4,6,6-tetrachloro-2,2-(2,2-dimethylpropane-1,3-dioxy)cyclotriphosphazene and 6,6-dichloro-2,2:4,4-bis(2,2-dimethylpropane-1,3-dioxy)cyclotriphosphazene","Acta Crystallographica Section C","2007","63","3","o152","o156","10.1107/S0108270107003046","","","0.71073","MoKα","","","0.0288","","","","0.0776","","","","","","1.095","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015853","18.0604","0.0004","8.321","0.0001","11.8528","0.0003","90","","99.955","0.001","90","","1754.43","0.06","120","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","","","6,6-dichlorocyclo-2,2:4,4-bis(2,2-dimethylpropane-1,3-dioxy)triphosphazene","","- C10 H20 Cl2 N3 O4 P3 -","- C10 H20 Cl2 N3 O4 P3 -","- C40 H80 Cl8 N12 O16 P12 -","4","0.5","GD3078","Coles, Simon J.; Davies, David B.; Hacıvelioğlu, Ferda; Hursthouse, Michael B.; İbişoğlu, Hanife; Kılıç, Adem; Shaw, Robert A.","Dimorphism in 4,4,6,6-tetrachloro-2,2-(2,2-dimethylpropane-1,3-dioxy)cyclotriphosphazene and 6,6-dichloro-2,2:4,4-bis(2,2-dimethylpropane-1,3-dioxy)cyclotriphosphazene","Acta Crystallographica Section C","2007","63","3","o152","o156","10.1107/S0108270107003046","","","0.71073","MoKα","","","0.0265","","","","0.0678","","","","","","1.053","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015854","11.1758","0.0003","12.1731","0.0003","13.0499","0.0003","112.201","0.001","102.2","0.001","106.856","0.001","1466.34","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[(N,N-dimethylformamide-κO)(nitrato-κ^2^O:O')silver(I)]- μ-1,2-bis(diphenylphosphino)ethane-κ^2^P:P']","","- C29 H31 Ag N2 O4 P2 -","- C29 H31 Ag N2 O4 P2 -","- C58 H62 Ag2 N4 O8 P4 -","2","1","GD3080","Menezes Vicenti, Juliano R. de; Burrow, Robert A.","<i>catena</i>-Poly[[(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)(nitrato-κ<i>O</i>)silver(I)]-μ-1,2-bis(diphenylphosphino)ethane-κ^2^<i>P</i>:<i>P</i>'] at 100 and 293K: temperature effects on the volume of the solvent pocket","Acta Crystallographica Section C","2007","63","3","m88","m90","10.1107/S010827010700306X","","","0.71073","MoKα","","0.0785","0.0444","","","0.0971","0.1109","","","","","","1.037","","","","has coordinates,has Fobs","278247","2022-09-28","15:09:32",""
"2015855","11.0869","0.0003","11.9653","0.0004","12.9618","0.0004","112.322","0.002","102.41","0.002","106.216","0.002","1424.15","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[(N,N-dimethylformamide-κO)(nitrato-κ^2^O:O')silver(I)]- μ-1,2-bis(diphenylphosphino)ethane-κ^2^P:P']","","- C29 H31 Ag N2 O4 P2 -","- C29 H31 Ag N2 O4 P2 -","- C58 H62 Ag2 N4 O8 P4 -","2","1","GD3080","Menezes Vicenti, Juliano R. de; Burrow, Robert A.","<i>catena</i>-Poly[[(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)(nitrato-κ<i>O</i>)silver(I)]-μ-1,2-bis(diphenylphosphino)ethane-κ^2^<i>P</i>:<i>P</i>'] at 100 and 293K: temperature effects on the volume of the solvent pocket","Acta Crystallographica Section C","2007","63","3","m88","m90","10.1107/S010827010700306X","","","0.71073","MoKα","","0.0433","0.034","","","0.0761","0.0805","","","","","","1.041","","","","has coordinates,has Fobs","278247","2022-09-28","15:09:32",""
"2015856","11.2597","0.0004","4.4118","0.0002","17.6256","0.0006","90","","98.253","0.003","90","","866.49","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1-(2-cyanoethyl)thymine","3-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)propanenitrile","","- C8 H9 N3 O2 -","- C8 H9 N3 O2 -","- C32 H36 N12 O8 -","4","1","GD3083","Borowiak, Teresa; Dutkiewicz, Grzegorz; Spychała, Jarosław","Supramolecular motifs in 1-(2-cyanoethyl)thymine and 1-(3-cyanopropyl)thymine","Acta Crystallographica Section C","2007","63","3","o201","o203","10.1107/S0108270107006385","","","0.71073","MoKα","","0.0589","0.0365","","","0.0973","0.1174","","","","","","1.036","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015857","4.8591","0.0008","9.8205","0.0012","10.5979","0.0011","75.815","0.01","78.364","0.012","80.78","0.011","476.94","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","1-(3-cyanopropyl)thymine","4-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)butanenitrile","","- C9 H11 N3 O2 -","- C9 H11 N3 O2 -","- C18 H22 N6 O4 -","2","1","GD3083","Borowiak, Teresa; Dutkiewicz, Grzegorz; Spychała, Jarosław","Supramolecular motifs in 1-(2-cyanoethyl)thymine and 1-(3-cyanopropyl)thymine","Acta Crystallographica Section C","2007","63","3","o201","o203","10.1107/S0108270107006385","","","0.71073","MoKα","","0.049","0.0392","","","0.111","0.1207","","","","","","1.069","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015858","23.227","0.005","14.526","0.003","20.765","0.004","90","","94.99","0.02","90","","6979","2","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Aqua(phthalocyaninato)magnesium n-propylamine disolvate","","- C38 H36 Mg N10 O -","- C38 H36 Mg N10 O -","- C304 H288 Mg8 N80 O8 -","8","1","GD3085","Vasyl Kinzhybalo; Jan Janczak","Aqua(phthalocyaninato)magnesium <i>n</i>-propylamine disolvate","Acta Crystallographica Section C","2007","63","3","m105","m107","10.1107/S0108270107004921","","","0.71073","MoKα","","0.1439","0.0483","","","0.0913","0.1073","","","","","","1.006","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015859","6.7725","0.0006","11.0759","0.001","12.3543","0.001","101.734","0.002","91.725","0.002","97.031","0.002","899.08","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4,5-Dibromophthalimide","","- C8 H3 Br2 N O2 -","- C8 H3 Br2 N O2 -","- C32 H12 Br8 N4 O8 -","4","2","GD3087","Williamson, Craig; Harrison, William T. A.","4,5-Dibromophthalimide forms two centrosymmetric dimers, one linked by C—H···O hydrogen bonds and one by N—H···O hydrogen bonds","Acta Crystallographica Section C","2007","63","3","o185","o186","10.1107/S0108270107005239","","","0.71073","MoKα","","0.0834","0.0472","","","0.1061","0.1163","","","","","","0.911","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015860","7.8817","0.0017","8.6832","0.0011","14.5715","0.0015","90","","90","","90","","997.2","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","6-aza-2'-deoxyuridine","2-(2-deoxy-β-D-erythro-pentofuranosyl)-1,2,4-triazin-3,5(2H,4H)-dione","","- C8 H11 N3 O5 -","- C8 H11 N3 O5 -","- C32 H44 N12 O20 -","4","1","GG3052","Seela, Frank; Chittepu, Padmaja; He, Yang; Eickmeier, Henning; Reuter, Hans","6-Aza-2'-deoxyuridine and <i>N</i>^3^-anisoyl-6-aza-2'-deoxyuridine","Acta Crystallographica Section C","2007","63","3","o173","o176","10.1107/S0108270107002016","","","0.71073","MoKα","","0.0554","0.0449","","","0.1153","0.1212","","","","","","1.071","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015861","7.452","0.003","9.117","0.001","24.78","0.003","90","","90","","90","","1683.6","0.7","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N^3^-anisoyl-6-aza-2'-deoxyuridine","2-(2-deoxy-β-D-erythro-pentofuranosyl)-N^4^-(2-methoxybenzoyl)-1,2,4- triazin-3,5(2H,4H)-dione","","- C16 H17 N3 O7 -","- C16 H17 N3 O7 -","- C64 H68 N12 O28 -","4","1","GG3052","Seela, Frank; Chittepu, Padmaja; He, Yang; Eickmeier, Henning; Reuter, Hans","6-Aza-2'-deoxyuridine and <i>N</i>^3^-anisoyl-6-aza-2'-deoxyuridine","Acta Crystallographica Section C","2007","63","3","o173","o176","10.1107/S0108270107002016","","","0.71073","MoKα","","0.0495","0.0348","","","0.0854","0.0938","","","","","","1.016","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015862","9.5695","0.001","13.895","0.0016","22.229","0.003","90","","101.72","0.009","90","","2894.1","0.6","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aquabis(3-methoxy-2-pyridonato)(2,2':6',2''- terpyridine)ruthenium(II)‒acetonitrile‒water (1/1/1)","","- C29 H30 N6 O6 Ru -","- C29 H29.658 N6 O6 Ru -","- C116 H118.632 N24 O24 Ru4 -","4","1","GZ3063","Kelson, Eric P.; Dean, Norman S.; Algarín, Edgar","Aquabis(3-methoxy-2-pyridonato)(2,2':6',2''-terpyridine)ruthenium(II)‒acetonitrile‒water (1/1/1)","Acta Crystallographica Section C","2007","63","3","m108","m110","10.1107/S0108270107004246","","","0.71073","MoKα","","0.059","0.0571","","","0.1138","0.1149","","","","","","1.091","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015863","12.7","0.003","6.9721","0.0017","18.422","0.005","90","","107.275","0.003","90","","1557.6","0.7","169","2","169","2","","","","","","","","3","C 1 2 1","C 2y","5","(1S,2R,3R,4S,5S,6R,7S,8S,11S)-myo-inositol-1,2-camphor acetal","5,6-(1,7,7-trimethylbicyclo[2.2.1]heptane-2,2-diyldioxy)benzene-1,2,3,4-tetrol","","- C16 H26 O6 -","- C16 H26 O6 -","- C64 H104 O24 -","4","1","GZ3065","Gainsford, Graeme J.; Baars, Sylvia M.; Falshaw, Andrew","Cocrystallization and configurations of <i>myo</i>-inositol-1,2-<small>L</small>-camphor acetals in two crystal structures","Acta Crystallographica Section C","2007","63","3","o169","o172","10.1107/S0108270107004416","","","0.71073","MoKα","","0.1049","0.0571","","","0.0993","0.1129","","","","","","1.075","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015864","13.1708","0.0017","6.9513","0.0009","20.737","0.003","90","","97.899","0.002","90","","1880.5","0.4","163","2","163","2","","","","","","","","3","C 1 2 1","C 2y","5","(1R,2S,3S,4R,5R,6S,7R/S,8S,11S)-myo-inositol-1,2-camphor acetal trihydrate","5,6-(1,7,7-trimethylbicyclo[2.2.1]heptane-2,2-diyldioxy)benzene-1,2,3,4-tetrol","","- C16 H32 O9 -","- C16 H32 O9 -","- C64 H128 O36 -","4","1","GZ3065","Gainsford, Graeme J.; Baars, Sylvia M.; Falshaw, Andrew","Cocrystallization and configurations of <i>myo</i>-inositol-1,2-<small>L</small>-camphor acetals in two crystal structures","Acta Crystallographica Section C","2007","63","3","o169","o172","10.1107/S0108270107004416","","","0.71073","MoKα","","0.0363","0.0274","","","0.0575","0.0594","","","","","","0.961","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015865","12.91","0.003","7.077","0.004","14.001","0.003","90","","111.67","0.03","90","","1188.8","0.8","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(3S)-Benzyl N-(1-hydroxy-2,5-dioxopyrrolidin-3-yl)carbamate","","- C12 H12 N2 O5 -","- C12 H12 N2 O5 -","- C48 H48 N8 O20 -","4","2","GZ3069","Stefanowicz, Piotr; Jaremko, Mariusz; Jaremko, Łukasz; Kochel, Andrzej","(3<i>S</i>)-Benzyl <i>N</i>-(1-hydroxy-2,5-dioxopyrrolidin-3-yl)carbamate: two-dimensional sheets built from O—H···O, N—H···O, C=O···C=O and C—H···O interactions linked into a three-dimensional complex framework <i>via</i> C—H···π(arene) interactions","Acta Crystallographica Section C","2007","63","3","o204","o206","10.1107/S0108270107006646","","","0.71073","MoKα","","0.054","0.0397","","","0.0786","0.0832","","","","","","1.004","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015866","11.5195","0.0013","8.6516","0.0007","15.9173","0.0011","90","","109.865","0.005","90","","1492","0.2","294","1","294","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Ia","6-(4-Fluorophenyl)-8-phenyl-2,3-dihydro-4H-imidazo[5,1-b][1,3]thiazin-4-one","","- C18 H13 F N2 O S -","- C18 H13 F N2 O S -","- C72 H52 F4 N8 O4 S4 -","4","1","HJ3028","Gallagher, John F.; Le Bas, Marie-Delphine H.; Coleman, Claire M.; O'Shea, Donal F.","6-(4-Fluorophenyl)-8-phenyl-2,3-dihydro-4<i>H</i>-imidazo[5,1-<i>b</i>][1,3]thiazin-4-one: an unusual [6‒5] fused-ring system","Acta Crystallographica Section C","2007","63","3","o160","o162","10.1107/S0108270107002375","","","0.71073","MolybdenumKα","","0.0428","0.0349","","","0.088","0.0933","","","","","","1.043","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015867","11.387","0.002","12.135","0.003","13.804","0.003","97.48","0.03","106.37","0.03","116.39","0.04","1565.3","1","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","1-phenylbiguanidium 5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate monohydrate","","- C12 H16 N8 O6 -","- C12 H16 N8 O6 -","- C48 H64 N32 O24 -","4","2","HJ3031","Gustavo Portalone; Marcello Colapietro","The 1:1 cocrystals of the proton-transfer compound dilituric acid‒phenylbiguanide monohydrate","Acta Crystallographica Section C","2007","63","3","o181","o184","10.1107/S0108270107005483","","","0.710689","MoKα","","0.0672","0.0643","","","0.1877","0.1907","","","","","","1.066","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015868","4.634","0.001","14.672","0.003","15.153","0.003","90","","93.11","0.03","90","","1028.7","0.4","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","cesium aluminium bis[dihydrogen arsenate(V)] hydrogen arsenate(V)","","- Al As3 Cs H5 O12 -","- Al As3 Cs H5 O12 -","- Al4 As12 Cs4 H20 O48 -","4","1","IZ3017","Schwendtner, Karolina; Kolitsch, Uwe","CsAl(H~2~AsO~4~)~2~(HAsO~4~): a new monoclinic protonated arsenate with decorated kröhnkite-like chains","Acta Crystallographica Section C","2007","63","3","i17","i20","10.1107/S0108270106045550","","","0.71073","MoKα","","0.027","0.0243","","","0.0597","0.0612","","","","","","1.02","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2015869","47.506","0.008","5.392","0.002","8.288","0.002","90","","100.38","0.02","90","","2088.2","1","178","2","178","2","","","","","","","","3","C 1 2 1","C 2y","5","","1,17-Diphenyl-2,4,6,8,10,12,14,16-octaoxaheptadecane","","- C21 H28 O8 -","- C21 H28 O8 -","- C84 H112 O32 -","4","1","JZ3053","Bats, Jan W.; Miculka, Christian; Noe, Christian R.","1,17-Diphenyl-2,4,6,8,10,12,14,16-octaoxaheptadecane","Acta Crystallographica Section C","2007","63","3","o190","o192","10.1107/S0108270107004830","","","1.5418","CuKα","","0.0366","0.0356","","","0.0987","0.1001","","","","","","1.079","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015870","9.7735","0.0002","24.4098","0.0005","19.7439","0.0005","90","","93.865","0.001","90","","4699.57","0.18","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tert-butyl 6_benzyl-2-(3,3-diethylureido)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine- 3-carboxylate","","- C24 H33 N3 O3 S -","- C24 H33 N3 O3 S -","- C192 H264 N24 O24 S8 -","8","2","SK3083","Pietsch, Markus; Nieger, Martin; Gütschow, Michael","<i>N</i>-Benzyltetrahydropyrido-anellated thiophene derivatives: new anticholinesterases","Acta Crystallographica Section C","2007","63","3","o147","o151","10.1107/S0108270107001461","","","0.71073","MoKα","","0.0921","0.0507","","","0.1163","0.1281","","","","","","0.974","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015871","12.0595","0.0004","8.9892","0.0003","18.0483","0.0006","90","","106.503","0.001","90","","1875.93","0.11","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","7-Benzyl-2-diethylamino-5,6,7,8-tetrahydro-3-oxa-9-thia-1,7-diazafluoren-4-one","","- C20 H23 N3 O2 S -","- C20 H23 N3 O2 S -","- C80 H92 N12 O8 S4 -","4","1","SK3083","Pietsch, Markus; Nieger, Martin; Gütschow, Michael","<i>N</i>-Benzyltetrahydropyrido-anellated thiophene derivatives: new anticholinesterases","Acta Crystallographica Section C","2007","63","3","o147","o151","10.1107/S0108270107001461","","","0.71073","MoKα","","0.0423","0.0328","","","0.0867","0.0904","","","","","","1.075","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015872","9.2927","0.0002","29.3299","0.0006","7.5645","0.0001","90","","106.015","0.001","90","","1981.72","0.07","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(7-Benzyl-4-oxo-5,6,7,8-tetrahydro-4H-3,9-dithia-1,7-diazafluoren- 2-yl)benzamide","","- C23 H19 N3 O2 S2 -","- C23 H19 N3 O2 S2 -","- C92 H76 N12 O8 S8 -","4","1","SK3083","Pietsch, Markus; Nieger, Martin; Gütschow, Michael","<i>N</i>-Benzyltetrahydropyrido-anellated thiophene derivatives: new anticholinesterases","Acta Crystallographica Section C","2007","63","3","o147","o151","10.1107/S0108270107001461","","","0.71073","MoKα","","0.0391","0.0332","","","0.0873","0.0904","","","","","","1.041","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015873","19.068","0.006","13.431","0.004","15.92","0.005","90","","104.744","0.004","90","","3943","2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","μ-{N,N'-Bis[2-(dimethylamino)ethyl]oxamidato(2-)}- 1κ^2^O,O':2κ^4^N,N',N'',N'''-bis(4,4'-dimethyl-2,2'-bipyridine- 1κ^2^N,N')dinickel(II) bis(perchlorate)","","- C34 H44 Cl2 N8 Ni2 O10 -","- C34 H44 Cl2 N8 Ni2 O10 -","- C136 H176 Cl8 N32 Ni8 O40 -","4","0.5","SK3088","Wei Sun; Yan-Tuan Li; Zhi-Yong Wu; Ning-Yu Xiao","μ-{<i>N</i>,<i>N</i>'-Bis[2-(dimethylamino)ethyl]oxamidato(2‒)}-1κ^2^<i>O</i>,<i>O</i>':2κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>'''-bis(4,4'-dimethyl-2,2'-bipyridine-1κ^2^<i>N</i>,<i>N</i>')dinickel(II) bis(perchlorate)","Acta Crystallographica Section C","2007","63","3","m111","m113","10.1107/S010827010700282X","","","0.71073","MoKα","","0.0724","0.0407","","","0.0932","0.1129","","","","","","1.022","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015874","13.9047","0.0007","5.4818","0.0003","16.8837","0.0009","90","","104.243","0.001","90","","1247.36","0.11","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","rac-erythro-1,2-diphenyl-1,3-propanediol","","- C15 H16 O2 -","- C15 H16 O2 -","- C60 H64 O8 -","4","1","SK3092","Langer, Vratislav; Li, Shiming; Lundquist, Knut","Stereoisomers of 1,2-diaryl-1,3-propanediols: <i>erythro</i> forms","Acta Crystallographica Section C","2007","63","3","o163","o165","10.1107/S0108270107001928","","","0.71073","MoKα","","0.0641","0.0452","","","0.1148","0.1264","","","","","","1.001","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015875","11.3363","0.0009","11.3363","0.0009","11.1523","0.0013","90","","90","","120","","1241.2","0.2","274","2","274","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","catena-Poly[[[tetraaquanickel(II)]-μ-4,4'-bipyridine-κ^2^N:N'] thiosulfate dihydrate]","","- C10 H20 N2 Ni O9 S2 -","- C10 H20 N2 Ni O9 S2 -","- C30 H60 N6 Ni3 O27 S6 -","3","0.5","AV3057","M. Enriqueta Díaz de Vivar; Sergio Baggio; María Teresa Garland; Ricardo Baggio","An unusual <i>P</i>3~1~2 framework for the Ni(4,4'-bipyridine)(H~2~O)~4~ chain","Acta Crystallographica Section C","2007","63","4","m153","m156","10.1107/S0108270107007214","","","0.71073","MoKα","","0.0411","0.0353","","","0.0793","0.0818","","","","","","0.984","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2015876","11.2916","0.001","11.2916","0.001","23.66","0.003","90","","90","","120","","2612.5","0.5","273","2","273","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","catena-poly[[[tetraaquanickel(II)]-μ-4,4'-bipyridine-κ^2^N:N'] sulfate methanol solvate monohydrate","","- C11 H22 N2 Ni O10 S -","- C11 H22 N2 Ni O10 S -","- C66 H132 N12 Ni6 O60 S6 -","6","1","AV3057","M. Enriqueta Díaz de Vivar; Sergio Baggio; María Teresa Garland; Ricardo Baggio","An unusual <i>P</i>3~1~2 framework for the Ni(4,4'-bipyridine)(H~2~O)~4~ chain","Acta Crystallographica Section C","2007","63","4","m153","m156","10.1107/S0108270107007214","","","0.71073","MoKα","","0.0915","0.0678","","","0.1346","0.1441","","","","","","0.923","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015877","10.728","0.006","7.731","0.005","8.674","0.005","90","","110.068","0.005","90","","675.7","0.7","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","poly[μ~5~-pyrazine-2,3-dicarboxylato-cadmium(II)]","","- C6 H2 Cd N2 O4 -","- C6 H2 Cd N2 O4 -","- C24 H8 Cd4 N8 O16 -","4","1","AV3069","Yun-Yu Liu; Guang-Shan Zhu; Shi-Lun Qiu","A new two-dimensional Cd^II^ coordination polymer constructed by pyrazine-2,3-dicarboxylate","Acta Crystallographica Section C","2007","63","4","m159","m160","10.1107/S0108270107009699","","","0.71069","MoKα","","0.0253","0.0229","","","0.0535","0.0543","","","","","","1.145","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015878","7.9602","0.0013","11.6135","0.0018","26.586","0.005","90","","90","","90","","2457.8","0.7","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","3,4-Diethylmaleinimide","3,4-Diethyl-2,5-dihydro-1H-pyrrole-2,5-dione","","- C8 H11 N O2 -","- C8 H11 N O2 -","- C96 H132 N12 O24 -","12","3","AV3071","Bröring, Martin; Brégier, Frédérique; Kleeberg, Christian","3,4-Diethyl-2,5-dihydro-1<i>H</i>-pyrrole-2,5-dione","Acta Crystallographica Section C","2007","63","4","o225","o227","10.1107/S0108270107006737","","","0.71073","MoKα","","0.1011","0.0471","","","0.0974","0.1078","","","","","","0.8","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015879","10.78","0.0016","11.88","0.0011","11.47","0.0015","90","","114.82","0.005","90","","1333.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4'-Bipyridyl N,N'-dioxide‒3-hydroxy-2-naphthoic acid (1/2)","","- C32 H24 N2 O8 -","- C32 H24 N2 O8 -","- C64 H48 N4 O16 -","2","0.5","AV3073","Lou, Ben-Yong; Huang, Yan-Bin","4,4'-Bipyridyl <i>N</i>,<i>N</i>'-dioxide‒3-hydroxy-2-naphthoic acid (1/2)","Acta Crystallographica Section C","2007","63","4","o246","o248","10.1107/S0108270107009717","","","0.71073","MoKα","","0.0727","0.0514","","","0.124","0.1372","","","","","","1.083","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015880","11.273","0.005","9.858","0.004","8.077","0.005","90","","99.43","0.03","90","","885.5","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","nicotinamadium perchlorate","3-(aminocarbonyl)pyridinium perchlorate","","- C6 H7 Cl N2 O5 -","- C6 H7 Cl N2 O5 -","- C24 H28 Cl4 N8 O20 -","4","1","AV3074","S. Athimoolam; S. Natarajan","Lamellar aggregation and hydrogen-bonding motifs in 3-(aminocarbonyl)pyridinium perchlorate and hydrogen oxalate","Acta Crystallographica Section C","2007","63","4","o263","o266","10.1107/S0108270107010098","","","0.71073","MoKα","","0.111","0.0706","","","0.191","0.2203","","","","","","1.041","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015881","12.8295","0.0007","6.3148","0.0005","11.1883","0.0009","90","","104.95","0.012","90","","875.75","0.12","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Nicotinamidium oxalate","3-(aminocarbonyl)pyridinium oxalate","","- C8 H8 N2 O5 -","- C8 H8 N2 O5 -","- C32 H32 N8 O20 -","4","1","AV3074","S. Athimoolam; S. Natarajan","Lamellar aggregation and hydrogen-bonding motifs in 3-(aminocarbonyl)pyridinium perchlorate and hydrogen oxalate","Acta Crystallographica Section C","2007","63","4","o263","o266","10.1107/S0108270107010098","","","0.71073","MoKα","","0.0577","0.0397","","","0.0989","0.1092","","","","","","1.06","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015882","17.176","0.002","8.2272","0.001","5.8996","0.0007","90","","90","","90","","833.67","0.17","295","2","","","","","","","","","","4","C m c m","-C 2c 2","63","","Copper(I,II) pentachromium(III) germanate","","- Cr4.56 Cu1.44 Ge2 O12 -","- Cr4.559 Cu1.441 Ge2 O12 -","- Cr18.236 Cu5.764 Ge8 O48 -","4","0.25","BC3029","Redhammer, Günther J.; Roth, Georg; Amthauer, Georg","Cu(Cu~0.44~Cr~4.56~)Ge~2~O~12~: a close-packed oxide with CuO~4~ tetrahedra","Acta Crystallographica Section C","2007","63","4","i21","i24","10.1107/S0108270107005355","","","0.71073","MoKα","","","0.0238","","","","0.0526","","","","","","1.041","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015883","9.2994","0.0013","10.9817","0.0016","11.6053","0.0017","85.816","0.007","88.349","0.006","71.349","0.007","1119.9","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","catena-poly[[bis(1,3-diphenylpropane-1,3-dionato-κ^2^O,O')cobalt(II)]-μ- ethylenebis(diphenylphosphine oxide)-κ^2^O:O']","","- C56 H46 Co O6 P2 -","- C56 H46 Co O6 P2 -","- C56 H46 Co O6 P2 -","1","0.5","BG3025","Harding, David J.; Harding, Phimphaka; Thurakitseree, Theerapol; Adams, Harry","Unexpected oxidation of a diphosphine by bis(1,3-diphenylpropane-1,3-dionato)cobalt(II), [Co(dbm)~2~]","Acta Crystallographica Section C","2007","63","4","m163","m165","10.1107/S010827010700933X","","","0.71073","MoKα","","0.0976","0.0522","","","0.1115","0.128","","","","","","1.017","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015884","20.1983","0.0007","14.188","0.0005","6.3","0.0002","90","","99.935","0.013","90","","1778.34","0.13","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","sodium nicotinate","Sodium 3-pyridine-3-carboxylate","","- C6 H4 N Na O2 -","- C6 H4 N Na O2 -","- C72 H48 N12 Na12 O24 -","12","1.5","DN2134","Forsyth, Craig M.; Dean, Pamela M.; MacFarlane, Douglas R.","Sodium pyridine-3-carboxylate","Acta Crystallographica Section C","2007","63","4","m169","m170","10.1107/S0108270107009936","","","0.71073","MoKα","","0.0305","0.0291","","","0.0821","0.0835","","","","","","1.071","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2015885","11.1205","0.0007","11.1205","0.0007","14.843","0.001","90","","90","","120","","1589.65","0.18","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","lithium trimanganese bis[trioxoselenate(IV)] hexakis[hydrogentrioxoselenate(IV)]","","- H6 Li Mn3 O24 Se8 -","- H6 Li Mn3 O24 Se8 -","- H18 Li3 Mn9 O72 Se24 -","3","0.166667","FA3060","Johnston, Magnus G.; Harrison, William T. A.","LiMn~3~(SeO~3~)~2~(HSeO~3~)~6~","Acta Crystallographica Section C","2007","63","4","i28","i30","10.1107/S0108270107001588","","","0.71073","MoKα","","0.0366","0.0238","","","0.0485","0.0508","","","","","","0.969","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015886","9.4829","0.0004","9.5307","0.0004","25.3955","0.0008","90","","90","","90","","2295.21","0.15","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-((E)-{(1R,2R)-2-[(E)-(2-Hydroxy-1- naphthyl)methyleneamino]cyclohexyl}iminiomethyl)naphthalen-2-olate","","- C28 H26 N2 O2 -","- C28 H26 N2 O2 -","- C112 H104 N8 O8 -","4","1","FA3062","Karabıyık, Hasan; Güzel, Bilgehan; Aygün, Muhittin; Boğa, Gülnaz; Büyükgüngör, Orhan","1-((<i>E</i>)-{(1<i>R</i>,2<i>R</i>)-2-[(<i>E</i>)-(2-Hydroxy-1-naphthyl)methyleneamino]cyclohexyl}iminiomethyl)naphthalen-2-olate: a Schiff base compound having both OH and NH character","Acta Crystallographica Section C","2007","63","4","o215","o218","10.1107/S0108270107005689","","","0.71073","MoKα","","0.0444","0.033","","","0.0765","0.0816","","","","","","0.918","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015887","5.958","0.0005","12.2984","0.001","11.9168","0.0009","90","","90.185","0.001","90","","873.19","0.12","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-bis(2-methoxybenzylidene)phenylene-1,4-diamine","","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","- C44 H40 N4 O4 -","2","0.5","FA3067","Ojala, William H.; Arola, Trina M.; Herrera, Nell; Balidemaj, Barjeta; Ojala, Charles R.","Isomeric Schiff bases related by dual imino-group reversals","Acta Crystallographica Section C","2007","63","4","o207","o211","10.1107/S0108270107006233","","","0.71073","MoKα","","0.043","0.0389","","","0.0918","0.0938","","","","","","1.142","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015888","7.1825","0.0004","7.2077","0.0004","17.3048","0.001","90","","91.068","0.001","90","","895.7","0.09","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-dimethoxy-(p-phenylenedimethylene)dianiline","","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","- C44 H40 N4 O4 -","2","0.5","FA3067","Ojala, William H.; Arola, Trina M.; Herrera, Nell; Balidemaj, Barjeta; Ojala, Charles R.","Isomeric Schiff bases related by dual imino-group reversals","Acta Crystallographica Section C","2007","63","4","o207","o211","10.1107/S0108270107006233","","","0.71073","MoKα","","0.038","0.0321","","","0.0845","0.09","","","","","","1.062","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015889","4.1216","0.0004","15.2474","0.0016","11.0751","0.0012","90","","90.707","0.002","90","","695.95","0.12","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-iodobenzaldehyde azine","(E,E)-1,4-bis(3-iodophenyl)-2,3-diazabuta-1,3-diene","","- C14 H10 I2 N2 -","- C14 H10 I2 N2 -","- C28 H20 I4 N4 -","2","0.5","FA3067","Ojala, William H.; Arola, Trina M.; Herrera, Nell; Balidemaj, Barjeta; Ojala, Charles R.","Isomeric Schiff bases related by dual imino-group reversals","Acta Crystallographica Section C","2007","63","4","o207","o211","10.1107/S0108270107006233","","","0.71073","MoKα","","0.0156","0.0145","","","0.0345","0.0348","","","","","","1.152","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015890","11.2377","0.0002","19.8722","0.0004","11.243","0.0002","90","","90.142","0.001","90","","2510.75","0.08","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","hexapotassium cerium dihydrogensulfate tethrasulfate monohydrate","hexapotassium cerium dihydrogensulfate tethrasulfate monohydrate","","- Ce H2 K6 O25 S6 -","- Ce K6 O25 S6 -","- Ce4 K24 O100 S24 -","4","1","FA3068","Barbara M. Casari; Vratislav Langer","A pseudo-merohedrally twinned rare-earth sulfate: K~6~[Ce(HSO~4~)~2~(SO~4~)~4~]·H~2~O, a novel structure type","Acta Crystallographica Section C","2007","63","4","i25","i27","10.1107/S010827010700875X","","","0.71073","MoKα","","0.0439","0.0327","","","0.0822","0.0886","","","","","","1.008","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015891","9.8574","0.0011","11.4847","0.0013","12.5957","0.0014","94.245","0.002","103.258","0.002","93.898","0.002","1378.8","0.3","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","Bis(2-amino-3,5-dibromo-4,6-dimethylpyridinium) hexabromidostannate(IV)","","- C14 H18 Br10 N4 Sn -","- C14 H18 Br10 N4 Sn -","- C28 H36 Br20 N8 Sn2 -","2","1","GA3039","Al-Far, Rawhi; Ali, Basem Fares","Bis(2-amino-3,5-dibromo-4,6-dimethylpyridinium) hexabromidostannate(IV)","Acta Crystallographica Section C","2007","63","4","m137","m139","10.1107/S0108270107006452","","","0.71073","MoKα","","0.0454","0.0323","","","0.071","0.0758","","","","","","1.036","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015892","4.9322","0.0002","15.3739","0.0005","16.4044","0.0005","90","","92.388","0.002","90","","1242.82","0.07","273","2","273","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Poly[μ~2~-trans-1,2-di-4-pyridylethylene-κ^2^N:N'-μ~2~-sulfato- κ^2^O:O'-zinc(II)]","","- C12 H10 N2 O4 S Zn -","- C12 H10 N2 O4 S Zn -","- C48 H40 N8 O16 S4 Zn4 -","4","0.5","GA3040","Yi-Cheng Shen; Zhao-Ji Li; Ye-Yan Qin; Yuan-Gen Yao","Poly[μ~2~-<i>trans</i>-1,2-di-4-pyridylethylene-κ^2^<i>N</i>:<i>N</i>'-μ~2~-sulfato-κ^2^<i>O</i>:<i>O</i>'-zinc(II)]","Acta Crystallographica Section C","2007","63","4","m135","m136","10.1107/S0108270107007123","","","0.71073","MoKα","","","0.037","","","0.0711","0.0766","","","","","","0.907","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015893","12.4717","0.0015","5.0859","0.0006","21.0412","0.0019","90","","105.243","0.011","90","","1287.7","0.3","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3,5,6-tetrakis(phenoxymethyl)pyrazine","","- C32 H28 N2 O4 -","- C32 H28 N2 O4 -","- C64 H56 N4 O8 -","2","0.5","GA3041","Tokouré Assoumatine; Gilles Gasser; Helen Stoeckli-Evans","2,3,5,6-Tetrakis(phenoxymethyl)pyrazine and 2,3,5,6-tetrakis(phenylsulfanylmethyl)pyrazine","Acta Crystallographica Section C","2007","63","4","o219","o222","10.1107/S010827010700710X","","","0.71073","MoKα","","0.1268","0.0621","","","0.1223","0.1503","","","","","","1.102","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015894","6.4278","0.0007","9.7152","0.0012","12.0602","0.0012","91.152","0.01","102.748","0.008","107.217","0.008","698.69","0.14","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","2,3,5,6-tetrakis(phenylsulfanylmethyl)pyrazine","","- C32 H28 N2 S4 -","- C32 H28 N2 S4 -","- C32 H28 N2 S4 -","1","0.5","GA3041","Tokouré Assoumatine; Gilles Gasser; Helen Stoeckli-Evans","2,3,5,6-Tetrakis(phenoxymethyl)pyrazine and 2,3,5,6-tetrakis(phenylsulfanylmethyl)pyrazine","Acta Crystallographica Section C","2007","63","4","o219","o222","10.1107/S010827010700710X","","","0.71073","MoKα","","0.0418","0.033","","","0.0792","0.0821","","","","","","1.037","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015895","6.7854","0.0007","10.2766","0.0011","16.0242","0.0015","101.338","0.008","94.775","0.008","99.492","0.008","1072.82","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-Methoxy-4-[(5-oxo-2-phenyl-4,5-dihydrooxazol-4-ylidene)methyl]phenyl 4-methylphenylsulfonate","","- C24 H19 N O6 S -","- C24 H19 N O6 S -","- C48 H38 N2 O12 S2 -","2","1","GD3084","Betül Şen; Gülsiye Öztürk; Serap Alp; Aygün, Muhittin; Büyükgüngör, Orhan","2-Methoxy-4-[(5-oxo-2-phenyl-4,5-dihydro-1,3-oxazol-4-ylidene)methyl]phenyl 4-methylbenzenesulfonate","Acta Crystallographica Section C","2007","63","4","o223","o224","10.1107/S0108270107005720","","","0.71073","MoKα","","0.0878","0.0503","","","0.115","0.1325","","","","","","1.015","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015896","9.397","0.003","18.314","0.002","7.399","0.004","90","","90","","90","","1273.3","0.8","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4,6-Dimethyl-2-(3-pyridyl)quinolin-5-amine","","- C16 H15 N3 -","- C16 H15 N3 -","- C64 H60 N12 -","4","1","GD3088","Montaño, Ángela Marcela; Henao, José Antonio; Vargas-Méndez, Leonor Y.; Kouznetsov, Vladimir V.; Atencio, Reinaldo","4,6-Dimethyl-2-(3-pyridyl)quinolin-5-amine","Acta Crystallographica Section C","2007","63","4","o228","o230","10.1107/S0108270107006221","","","0.71073","MoKα","","0.0465","0.0379","","","0.0961","0.1026","","","","","","1.078","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015897","12.2197","0.001","11.0048","0.0011","17.2631","0.0014","90","","90","","90","","2321.5","0.4","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","(Croconato-κ^2^O,O')bis(1,10-phenanthroline-κ^2^N,N')cobalt(II)","","- C29 H16 Co N4 O5 -","- C29 H16 Co N4 O5 -","- C116 H64 Co4 N16 O20 -","4","0.5","GD3090","Chen, Xia; Chen, Hong-Feng; Xue, Gang; Chen, Hong-Yu; Yu, Wen-Tao; Fang, Qi","(Croconato-κ^2^<i>O</i>,<i>O</i>')bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II), and the nickel(II) and copper(II) analogues","Acta Crystallographica Section C","2007","63","4","m166","m168","10.1107/S0108270107009377","","","0.71073","MoKα","","0.0827","0.0408","","","0.0787","0.0914","","","","","","0.981","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015898","12.2618","0.0016","10.929","0.002","17.171","0.003","90","","90","","90","","2301.1","0.7","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","(Croconato-κ^2^O,O')bis(1,10-phenanthroline-κ^2^N,N')nickel(II)","","- C29 H16 N4 Ni O5 -","- C29 H16 N4 Ni O5 -","- C116 H64 N16 Ni4 O20 -","4","0.5","GD3090","Chen, Xia; Chen, Hong-Feng; Xue, Gang; Chen, Hong-Yu; Yu, Wen-Tao; Fang, Qi","(Croconato-κ^2^<i>O</i>,<i>O</i>')bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II), and the nickel(II) and copper(II) analogues","Acta Crystallographica Section C","2007","63","4","m166","m168","10.1107/S0108270107009377","","","0.71073","MoKα","","0.0838","0.0429","","","0.0928","0.1162","","","","","","1.044","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015899","14.6737","0.0016","10.5316","0.0013","15.7783","0.0017","90","","106.666","0.009","90","","2335.9","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(Croconato-κ^2^O,O')bis(1,10-phenanthroline-κ^2^N,N')copper(II)","","- C29 H16 Cu N4 O5 -","- C29 H16 Cu N4 O5 -","- C116 H64 Cu4 N16 O20 -","4","0.5","GD3090","Chen, Xia; Chen, Hong-Feng; Xue, Gang; Chen, Hong-Yu; Yu, Wen-Tao; Fang, Qi","(Croconato-κ^2^<i>O</i>,<i>O</i>')bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II), and the nickel(II) and copper(II) analogues","Acta Crystallographica Section C","2007","63","4","m166","m168","10.1107/S0108270107009377","","","0.71073","MoKα","","0.0631","0.0391","","","0.0791","0.0879","","","","","","1.011","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015900","7.717","0.0004","19.7883","0.0008","9.6468","0.0008","90","","128.155","0.005","90","","1158.38","0.15","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","triacetone aminium nitrate","2,2,6,6-Tetramethyl-4-oxopiperidinium nitrate","","- C9 H18 N2 O4 -","- C9 H18 N2 O4 -","- C36 H72 N8 O16 -","4","1","GD3091","Rodrigues, V. H.; Cardoso, C.; Paixão, J. A.; Costa, M.M.R.R.","2,2,6,6-Tetramethyl-4-oxopiperidinium nitrate","Acta Crystallographica Section C","2007","63","4","o243","o245","10.1107/S0108270107008268","","","1.54184","CuKα","","0.1","0.0589","","","0.1637","0.1907","","","","","","1.044","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015901","8.8127","0.0007","11.5868","0.0009","13.5365","0.0011","81.433","0.006","77.957","0.006","73.665","0.006","1291.22","0.18","296","","296","","","","","","","","","7","P -1","-P 1","2","","trans-Diaqua{5,5'-[(E,E)-pyridine-2,6- diylbis(methylidynenitrilo)]bis[pyrimidine-2,4(1H,3H)-dione]}zinc(II) nitrate hexafluoridophosphate trihydrate","","- C15 H21 F6 N8 O12 P Zn -","- C15 H21 F6 N8 O12 P Zn -","- C30 H42 F12 N16 O24 P2 Zn2 -","2","1","GD3092","Özdemir, Namık; Dinçer, Muharrem; Doğaner, Gamze; Astley, Demet; Astley, Stephen T.","<i>trans</i>-Diaqua{5,5'-[(<i>E</i>,<i>E</i>)-pyridine-2,6-diylbis(methylidynenitrilo)]bis[pyrimidine-2,4(1<i>H</i>,3<i>H</i>)-dione]}zinc(II) nitrate hexafluorophosphate trihydrate","Acta Crystallographica Section C","2007","63","4","m147","m149","10.1107/S0108270107008633","","","0.71073","MoKα","","0.0367","0.0297","","","0.0802","0.0826","","","","","","1.038","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015902","21.423","0.003","9.515","0.001","15.613","0.002","90","","90","","90","","3182.6","0.7","290","2","290","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","Naphthalene-1,7-diol","","- C10 H8 O2 -","- C10 H8 O2 -","- C160 H128 O32 -","16","2","GG3057","Marciniak, Bernard","Naphthalene-1,7-diol","Acta Crystallographica Section C","2007","63","4","o252","o254","10.1107/S0108270107009109","","","0.71073","MoKα","","0.068","0.039","","","0.0946","0.1229","","","","","","1.091","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015903","9.5433","0.0002","9.1416","0.0002","21.8652","0.0004","90","","90","","90","","1907.54","0.07","150","1","150","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","metamitron","4-amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one","","- C10 H10 N4 O -","- C10 H10 N4 O -","- C80 H80 N32 O8 -","8","1","GG3068","Ludvík, Jir̆í; Urban, Jir̆í; Fábry, Jan; Císar̆ová, Ivana","4-Amino-3-methyl-6-phenyl-1,2,4-triazin-5(4<i>H</i>)-one (metamitron) and 4-amino-6-methyl-3-phenyl-1,2,4-triazin-5(4<i>H</i>)-one (isometamitron)","Acta Crystallographica Section C","2007","63","4","o259","o262","10.1107/S0108270107009596","","","0.71069","MoKα","","0.0486","0.0388","","","0.0947","0.0993","","","","","","1.071","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015904","11.6164","0.0003","7.1361","0.0002","12.0604","0.0003","90","","112.826","0.0015","90","","921.46","0.04","150","","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","isometamitron","4-amino-6-methyl-3-phenyl-1,2,4-triazin-5(4H)-one","","- C10 H10 N4 O -","- C10 H10 N4 O -","- C40 H40 N16 O4 -","4","1","GG3068","Ludvík, Jir̆í; Urban, Jir̆í; Fábry, Jan; Císar̆ová, Ivana","4-Amino-3-methyl-6-phenyl-1,2,4-triazin-5(4<i>H</i>)-one (metamitron) and 4-amino-6-methyl-3-phenyl-1,2,4-triazin-5(4<i>H</i>)-one (isometamitron)","Acta Crystallographica Section C","2007","63","4","o259","o262","10.1107/S0108270107009596","","","0.71073","MoKα","","0.045","0.0375","","","0.0949","0.0991","","","","","","1.05","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015905","11.483","0.004","7.612","0.003","16.903","0.006","90","","95.79","0.03","90","","1469.9","0.9","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","α-epoxide","3β-acetoxy-9α,11-epoxy-5α-lanost-9(11)-en-7-one","","- C32 H52 O4 -","- C32 H52 O4 -","- C64 H104 O8 -","2","1","GG3071","Parvez, Masood; Edwards, Oliver E.; Paryzek, Zdzisław","The α- and β-epoxides of 3β-acetoxy-5α-lanost-9(11)-en-7-one","Acta Crystallographica Section C","2007","63","4","o249","o251","10.1107/S0108270107009754","","","0.71073","MoKα","","0.049","0.039","","","0.092","0.098","","","","","","1.05","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015906","13.356","0.006","6.233","0.013","18.104","0.016","90","","92.14","0.07","90","","1506","3","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","β-epoxide","3β-acetoxy-9β,11-epoxy-5α-lanost-9(11)-en-7-one","","- C32 H52 O4 -","- C32 H52 O4 -","- C64 H104 O8 -","2","1","GG3071","Parvez, Masood; Edwards, Oliver E.; Paryzek, Zdzisław","The α- and β-epoxides of 3β-acetoxy-5α-lanost-9(11)-en-7-one","Acta Crystallographica Section C","2007","63","4","o249","o251","10.1107/S0108270107009754","","","0.71073","MoKα","","0.087","0.056","","","0.135","0.154","","","","","","1.098","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015907","13.5266","0.0009","9.8617","0.0007","14.4429","0.0009","90","","112.083","0.003","90","","1785.3","0.2","213","2","213","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquabis[4-(4H-1,2,4-triazol-4-yl)benzoato-κ^2^O,O']cobalt(II)","","- C18 H16 Co N6 O6 -","- C18 H16 Co N6 O6 -","- C72 H64 Co4 N24 O24 -","4","0.5","GG3077","Lukashuk, Liliana V.; Lysenko, Andrey B.; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.","Diaquabis[4-(4<i>H</i>-1,2,4-triazol-4-yl)benzoato-κ^2^<i>O</i>,<i>O</i>']cobalt(II), and the cadmium(II) and copper(II) analogues: new self-complementary hydrogen-bond donor/acceptor modules for designing hydrogen-bonded frameworks","Acta Crystallographica Section C","2007","63","4","m140","m143","10.1107/S0108270107009080","","","0.71073","MoKα","","0.0387","0.0278","","","0.0657","0.0681","","","","","","0.938","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015908","13.7301","0.0006","9.8915","0.0005","14.8111","0.001","90","","112.063","0.003","90","","1864.21","0.18","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquabis[4-(4H-1,2,4-triazol-4-yl)benzoato-κ^2^O,O']cadmium(II)","","- C18 H16 Cd N6 O6 -","- C18 H16 Cd N6 O6 -","- C72 H64 Cd4 N24 O24 -","4","0.5","GG3077","Lukashuk, Liliana V.; Lysenko, Andrey B.; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.","Diaquabis[4-(4<i>H</i>-1,2,4-triazol-4-yl)benzoato-κ^2^<i>O</i>,<i>O</i>']cobalt(II), and the cadmium(II) and copper(II) analogues: new self-complementary hydrogen-bond donor/acceptor modules for designing hydrogen-bonded frameworks","Acta Crystallographica Section C","2007","63","4","m140","m143","10.1107/S0108270107009080","","","0.71073","MoKα","","0.039","0.0327","","","0.0825","0.086","","","","","","1.063","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015909","13.4483","0.0004","10.0101","0.0003","14.4749","0.0005","90","","111.674","0.002","90","","1810.83","0.1","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis[4-(4H-1,2,4-triazol-4-yl)benzoato-κ^2^O,O']copper(II)","","- C18 H16 Cu N6 O6 -","- C18 H16 Cu N6 O6 -","- C72 H64 Cu4 N24 O24 -","4","1","GG3077","Lukashuk, Liliana V.; Lysenko, Andrey B.; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.","Diaquabis[4-(4<i>H</i>-1,2,4-triazol-4-yl)benzoato-κ^2^<i>O</i>,<i>O</i>']cobalt(II), and the cadmium(II) and copper(II) analogues: new self-complementary hydrogen-bond donor/acceptor modules for designing hydrogen-bonded frameworks","Acta Crystallographica Section C","2007","63","4","m140","m143","10.1107/S0108270107009080","","","0.71073","MoKα","","0.0556","0.0377","","","0.0946","0.1048","","","","","","1.037","","","","has coordinates,has Fobs","209316","2020-10-21","18:00:00",""
"2015910","16.581","0.003","4.7819","0.001","19.23","0.004","90","","100.674","0.003","90","","1498.3","0.5","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Poly[[μ~2~-4,4'-bipyridine-di-μ~3~-sulfito-dizinc(II)] monohydrate]","","- C10 H10 N2 O7 S2 Zn2 -","- C10 H10 N2 O7 S2 Zn2 -","- C40 H40 N8 O28 S8 Zn8 -","4","0.5","HJ3032","M. Enriqueta Díaz de Vivar; Sergio Baggio; María Teresa Garland; Ricardo Baggio","Poly[[μ~2~-4,4'-bipyridine-di-μ~3~-sulfito-dizinc(II)] monohydrate]","Acta Crystallographica Section C","2007","63","4","m157","m158","10.1107/S0108270107009535","","","0.71073","MoKα","","0.0449","0.0342","","","0.0835","0.0891","","","","","","1.025","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015911","7.73","0.002","20.439","0.003","13.321","0.002","90","","104.169","0.018","90","","2040.6","0.7","100","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","acetato(2,2'-{iminobis[(<i>E</i>)-propane-3,1- diylnitrilomethylylidyne]}diphenolato)cobalt(III)","","- C22 H26 Co N3 O4 -","- C22 H26 Co N3 O4 -","- C88 H104 Co4 N12 O16 -","4","1","JZ3056","Munro, Orde Q.; Govender, Santham","A new polymorph of a cobalt(III) Schiff base complex exhibits a one-dimensional C—H···O hydrogen-bonded extended structure with helical 2~1~ symmetry","Acta Crystallographica Section C","2007","63","4","m150","m152","10.1107/S0108270107007494","","","0.71073","MoKα","","","0.0332","","","","0.0827","","","","","","1.053","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015912","7.01","0.0005","33.052","0.002","24.2496","0.0017","90","","90","","90","","5618.5","0.7","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","bis(adeninium) phthalate phthalic acid 1.45-hydrate","","- C26 H24.91 N10 O9.45 -","- C26 H24.908 N10 O9.454 -","- C208 H199.264 N80 O75.632 -","8","1","LN3036","Sridhar, Balasubramanian; Ravikumar, Krishnan","Supramolecular hydrogen-bonding networks in bis(adeninium) phthalate phthalic acid 1.45-hydrate","Acta Crystallographica Section C","2007","63","4","o212","o214","10.1107/S0108270107006300","","","0.71073","MoKα","","0.0437","0.0399","","","0.1015","0.1044","","","","","","1.059","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015913","7.2265","0.0014","9.698","0.0019","12.319","0.003","96.69","0.03","93.34","0.03","90.29","0.03","856","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Aqua(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^N,N')(oxydiacetato- κ^3^O,O',O'')cobalt(II) trihydrate","","- C10 H18 Co N4 O9 S2 -","- C10 H18 Co N4 O9 S2 -","- C20 H36 Co2 N8 O18 S4 -","2","1","LN3044","Zhi-Yong Wu; Wei Sun; Yan-Tuan Li","Aqua(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')(oxydiacetato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')cobalt(II) trihydrate","Acta Crystallographica Section C","2007","63","4","m177","m180","10.1107/S0108270107011468","","","0.71073","MoKα","","0.0374","0.0303","","","0.0748","0.0783","","","","","","1.011","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015914","7.0927","0.0014","10.092","0.002","10.633","0.002","101.76","0.03","96.29","0.03","98.09","0.03","730.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","bis(4,4'-bipyridinium) diaquadioxalatoferrate(II) bis(hydrogen oxalate)","","- C28 H26 Fe N4 O18 -","- C28 H26 Fe N4 O18 -","- C28 H26 Fe N4 O18 -","1","0.5","SF3025","Xin Yang; Jiang Li; Xin-Hua Zhao; Hai-Wen Wang; Yong-Kui Shan","Hydrogen bonding and π‒π stacking in the three-dimensional supramolecular complex bis(4,4'-bipyridinium) diaquadioxalatoferrate(II) bis(hydrogen oxalate)","Acta Crystallographica Section C","2007","63","4","m171","m173","10.1107/S0108270107006440","","","0.71073","MoKα","","0.0767","0.0527","","","0.1112","0.1228","","","","","","1.076","","","","has coordinates","197922","2020-10-21","18:00:00",""
"2015915","31.578","0.014","8.006","0.004","12.006","0.006","90","","90","","90","","3035","3","298","2","298","2","","","","","","","","6","P n a 21","P 2c -2n","33","","μ-2,6-dimethylpyridine-3,5-dicarboxylato-κ^4^O^3^,O^3'^:O^5^,O^5'^- bis[chloro(1,10-phenanthroline-κ^2^N,N')zinc(II)]","","- C33 H23 Cl2 N5 O4 Zn2 -","- C33 H23 Cl2 N5 O4 Zn2 -","- C132 H92 Cl8 N20 O16 Zn8 -","4","1","SF3026","Yan-Ting He; Kun-Lin Huang; Chang-Wen Hu; Wan-Long Pan; Ying-Nan Chi","A new two-dimensional supramolecule composed of μ-2,6-dimethylpyridine-3,5-dicarboxylato-κ^4^<i>O</i>^3^,<i>O</i>^3'^:<i>O</i>^5^,<i>O</i>^5'^-bis[chloro(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II)]","Acta Crystallographica Section C","2007","63","4","m161","m162","10.1107/S0108270107009663","","","0.71073","MoKα","","0.0914","0.0465","","","0.0744","0.0887","","","","","","1.034","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015916","14.3288","0.0005","12.0353","0.0004","13.1364","0.0005","90","","108.131","0.001","90","","2152.91","0.13","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Chlorobis[(2-oxoazocan-1-yl)methyl]germanium(IV) trifluoromethanesulfonate","","- C17 H28 Cl F3 Ge N2 O5 S -","- C17 H28 Cl F3 Ge N2 O5 S -","- C68 H112 Cl4 F12 Ge4 N8 O20 S4 -","4","1","SK3085","Komissarov, Eugene A.; Korlyukov, Alexander A.; Kramarova, Eugeniya P.; Bylikin, Sergey Yu.; Negrebetsky, Vadim V.; Baukov, Yuri I.","Chloridobis[(2-oxoazocan-1-yl)methyl]germanium(IV) trifluoromethanesulfonate","Acta Crystallographica Section C","2007","63","4","m144","m146","10.1107/S0108270107008736","","","0.71073","MoKα","","0.0503","0.0293","","","0.0612","0.0648","","","","","","1","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015917","7.0932","0.0003","8.2032","0.0004","10.0526","0.0004","66.613","0.002","88.822","0.003","77.387","0.003","522.49","0.04","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","Acetone 2,4-dinitrophenylhydrazone","","- C9 H10 N4 O4 -","- C9 H10 N4 O4 -","- C18 H20 N8 O8 -","2","1","SK3098","Wardell, James L.; Low, John N.; Glidewell, Christopher","A re-examination of supramolecular aggregation in two polymorphs of acetone 2,4-dinitrophenylhydrazone","Acta Crystallographica Section C","2007","63","4","o231","o233","10.1107/S0108270107006981","","","0.71073","MoKα","","0.0553","0.0413","","","0.1068","0.1171","","","","","","1.042","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015918","8.2526","0.0006","6.521","0.0002","19.7707","0.0002","90","","90","","90","","1063.96","0.08","120","2","120","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Ethyl N-[2-(hydroxyacetyl)phenyl]carbamate","","- C11 H13 N O4 -","- C11 H13 N O4 -","- C44 H52 N4 O16 -","4","0.5","SK3102","Garden, Simon J.; Corrêa, Marilza B.; Pinto, Angelo C.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Ethyl <i>N</i>-[2-(hydroxyacetyl)phenyl]carbamate, ethyl <i>N</i>-[2-(hydroxyacetyl)-4-iodophenyl]carbamate and ethyl <i>N</i>-[2-(hydroxyacetyl)-4-methylphenyl]carbamate","Acta Crystallographica Section C","2007","63","4","o234","o238","10.1107/S0108270107008682","","","0.71073","MoKα","","0.0515","0.0399","","","0.0997","0.1062","","","","","","1.035","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015919","4.7535","0.0002","15.7179","0.0004","16.07","0.0005","90","","97.123","0.002","90","","1191.4","0.07","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl N-[2-(hydroxyacetyl)-4-iodophenyl]carbamate","","- C11 H12 I N O4 -","- C11 H12 I N O4 -","- C44 H48 I4 N4 O16 -","4","1","SK3102","Garden, Simon J.; Corrêa, Marilza B.; Pinto, Angelo C.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Ethyl <i>N</i>-[2-(hydroxyacetyl)phenyl]carbamate, ethyl <i>N</i>-[2-(hydroxyacetyl)-4-iodophenyl]carbamate and ethyl <i>N</i>-[2-(hydroxyacetyl)-4-methylphenyl]carbamate","Acta Crystallographica Section C","2007","63","4","o234","o238","10.1107/S0108270107008682","","","0.71073","MoKα","","0.0527","0.039","","","0.0715","0.0773","","","","","","1.162","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015920","7.085","0.007","10.711","0.011","15.587","0.016","87.916","0.011","80.861","0.013","89.664","0.011","1167","2","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","Ethyl N-[2-(hydroxyacetyl)-4-methylphenyl]carbamate","","- C12 H15 N O4 -","- C12 H15 N O4 -","- C48 H60 N4 O16 -","4","2","SK3102","Garden, Simon J.; Corrêa, Marilza B.; Pinto, Angelo C.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Ethyl <i>N</i>-[2-(hydroxyacetyl)phenyl]carbamate, ethyl <i>N</i>-[2-(hydroxyacetyl)-4-iodophenyl]carbamate and ethyl <i>N</i>-[2-(hydroxyacetyl)-4-methylphenyl]carbamate","Acta Crystallographica Section C","2007","63","4","o234","o238","10.1107/S0108270107008682","","","0.7848","synchrotron(Clegg,2000)","","0.1117","0.0836","","","0.2284","0.2454","","","","","","1.021","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015921","8.662","0.0009","15.682","0.0012","15.691","0.0013","80.501","0.009","85.131","0.011","85.19","0.011","2089.3","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","dibromidotetrakis(tetrahydrofuran-κO)magnesium","","- C16 H32 Br2 Mg O4 -","- C16 H32 Br2 Mg O4 -","- C64 H128 Br8 Mg4 O16 -","4","2","SK3104","Lorbach, Andreas; Lerner, Hans-Wolfram; Bolte, Michael","A twinned triclinic polymorph of dibromidotetrakis(tetrahydrofuran-κ<i>O</i>)magnesium(II)","Acta Crystallographica Section C","2007","63","4","m174","m176","10.1107/S0108270107010694","","","0.71073","MoKα","","0.1163","0.0872","","","0.2211","0.2321","","","","","","1.438","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015922","9.1548","0.0005","9.3937","0.0005","16.7305","0.001","90","","90","","90","","1438.78","0.14","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N,N'-bis(2-hydroxy-1-methylethyl)phthalamide","","- C14 H20 N2 O4 -","- C14 H20 N2 O4 -","- C56 H80 N8 O16 -","4","1","SQ3062","Guzei, Ilia A.; Spencer, Lara C.; McGaff, Robert W.; Kieler, Heidi M.; Robinson, Jerome R.","Constructor graph description of hydrogen bonding in a supramolecular assembly of <i>N</i>,<i>N</i>'-bis(2-hydroxy-1-methylethyl)phthalamide","Acta Crystallographica Section C","2007","63","4","o255","o258","10.1107/S0108270107009146","","","0.71073","Mo-Kα","","0.0399","0.0317","","","0.0785","0.0832","","","","","","1.127","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015923","14.3378","0.0017","9.1666","0.0011","16.2696","0.0019","90","","100.711","0.002","90","","2101","0.4","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","methyl ethyl 2-(triphenylphosphoranylidene)malonate","","- C24 H23 O4 P -","- C24 H23 O4 P -","- C96 H92 O16 P4 -","4","1","SQ3064","Fernando Castañeda; Carolina Jullian; Clifford A. Bunton; María Teresa Garland; Ricardo Baggio","Differences in the crystal structures of two dialkyl diester triphenylphosphonium ylids","Acta Crystallographica Section C","2007","63","4","o267","o270","10.1107/S0108270107010542","","","0.71073","MoKα","","0.1185","0.0651","","","0.1351","0.153","","","","","","1.016","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015924","10.1031","0.0008","14.6961","0.0011","26.756","0.002","90","","92.734","0.001","90","","3968.1","0.5","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","dimethyl 2-(triphenylphosphoranylidene)malonate","","- C23 H21 O4 P -","- C23 H21 O4 P -","- C184 H168 O32 P8 -","8","2","SQ3064","Fernando Castañeda; Carolina Jullian; Clifford A. Bunton; María Teresa Garland; Ricardo Baggio","Differences in the crystal structures of two dialkyl diester triphenylphosphonium ylids","Acta Crystallographica Section C","2007","63","4","o267","o270","10.1107/S0108270107010542","","","0.71073","MoKα","","0.0825","0.056","","","0.1307","0.1451","","","","","","1.037","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015925","5.7982","0.0005","13.0702","0.0012","15.554","0.0012","90","","108.191","0.003","90","","1119.83","0.17","293","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","ethyl 6-chloro-2-oxo-2H-chromene-3-carboxylate","","- C12 H9 Cl O4 -","- C12 H9 Cl O4 -","- C48 H36 Cl4 O16 -","4","1","SU3001","Rocio J. Santos-Contreras; Francisco J. Martínez-Martínez; Efrén V. García-Báez; Itzia I. Padilla-Martínez; Ana L. Peraza; Herbert Höpfl","Carbonyl‒carbonyl, carbonyl‒π and carbonyl‒halogen dipolar interactions as the directing motifs of the supramolecular structure of ethyl 6-chloro-2-oxo-2<i>H</i>-chromene-3-carboxylate and ethyl 6-bromo-2-oxo-2<i>H</i>-chromene-3-carboxylate","Acta Crystallographica Section C","2007","63","4","o239","o242","10.1107/S0108270107008712","","","0.71073","MoKα","","0.0617","0.0554","","","0.1497","0.1552","","","","","","1.077","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015926","5.8432","0.0006","13.2073","0.0014","15.6959","0.0015","90","","109.327","0.003","90","","1143","0.2","293","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","ethyl 6-bromo-2-oxo-2H-chromene-3-carboxylate","","- C12 H9 Br O4 -","- C12 H9 Br O4 -","- C48 H36 Br4 O16 -","4","1","SU3001","Rocio J. Santos-Contreras; Francisco J. Martínez-Martínez; Efrén V. García-Báez; Itzia I. Padilla-Martínez; Ana L. Peraza; Herbert Höpfl","Carbonyl‒carbonyl, carbonyl‒π and carbonyl‒halogen dipolar interactions as the directing motifs of the supramolecular structure of ethyl 6-chloro-2-oxo-2<i>H</i>-chromene-3-carboxylate and ethyl 6-bromo-2-oxo-2<i>H</i>-chromene-3-carboxylate","Acta Crystallographica Section C","2007","63","4","o239","o242","10.1107/S0108270107008712","","","0.71073","MoKα","","0.0612","0.0446","","","0.1133","0.1226","","","","","","1.049","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015927","6.4451","0.0001","13.9619","0.0002","14.0081","0.0002","90","","90","","90","","1260.53","0.03","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(4aS,7R,8aR)-7-Isopropenyl-4a-methyl-3-methyleneperhydrochromen-2-one","","- C14 H20 O2 -","- C14 H20 O2 -","- C56 H80 O8 -","4","1","AV3076","Wojciechowski, Jakub; Krawczyk, Henryk; Śliwiński, Marcin; Kafarska, Karolina; Wolf, Wojciech M.","X-ray investigations of bicyclic α-methylene-δ-valerolactones. V. (4a<i>S</i>,7<i>R</i>,8a<i>R</i>)-7-Isopropenyl-4a-methyl-3-methyleneperhydrochromen-2-one","Acta Crystallographica Section C","2007","63","5","o280","o282","10.1107/S0108270107011821","","","1.54178","CuKα","","0.0345","0.0341","","","0.0969","0.0974","","","","","","1.054","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015928","10.3441","0.0005","21.4937","0.001","15.4717","0.0007","90","","125.629","0.003","90","","2795.9","0.2","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[1,3-Bis(2,3,4,5,6-pentafluorobenzyl)benzimidazol-2- ylidene]bromido(η^4^-cycloocta-1,5-diene)rhodium(I)","","- C29 H20 Br F10 N2 Rh -","- C29 H20 Br F10 N2 Rh -","- C116 H80 Br4 F40 N8 Rh4 -","4","1","AV3078","Dinçer, Muharrem; Özdemir, Namık; Gülcemal, Süleyman; Çetinkaya, Bekir; Büyükgüngör, Orhan","[1,3-Bis(2,3,4,5,6-pentafluorobenzyl)benzimidazol-2-ylidene]bromido(η^4^-cycloocta-1,5-diene)rhodium(I)","Acta Crystallographica Section C","2007","63","5","m228","m230","10.1107/S0108270107015417","","","0.71073","MoKα","","0.0509","0.0379","","","0.0949","0.1005","","","","","","1.045","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015929","9.5188","0.0004","15.4474","0.0007","17.8238","0.0008","90","","93.833","0.001","90","","2615","0.2","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-Bis(4-pyridylmethyl)oxalamide","","- C14 H14 N4 O2 -","- C14 H14 N4 O2 -","- C112 H112 N32 O16 -","8","2","AV3082","Lee, Gene-Hsiang; Wang, Hsin-Ta","Hydrogen-bonded supramolecule of <i>N</i>,<i>N</i>'-bis(4-pyridylmethyl)oxalamide and a zigzag chain structure of <i>catena</i>-poly[[[dichloridocobalt(II)]-μ-<i>N</i>,<i>N</i>'-bis(4-pyridylmethyl)oxalamide-κ^2^<i>N</i>^4^:<i>N</i>^4'^] hemihydrate]","Acta Crystallographica Section C","2007","63","5","m216","m219","10.1107/S0108270107014527","","","0.71073","MoKα","","0.0825","0.0602","","","0.1322","0.1427","","","","","","1.127","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015930","7.4566","0.0002","11.8572","0.0004","22.6024","0.0007","90","","90","","90","","1998.38","0.11","150","2","150","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","catena-poly[[[dichloridocobalt(II)]-μ-N,N'-bis(4-4-pyridylmethyl)oxalamide- κ^2^N:N'] hemihydrate]","","- C14 H15 Cl2 Co N4 O2.5 -","- C14 H15 Cl2 Co N4 O2.5 -","- C56 H60 Cl8 Co4 N16 O10 -","4","0.5","AV3082","Lee, Gene-Hsiang; Wang, Hsin-Ta","Hydrogen-bonded supramolecule of <i>N</i>,<i>N</i>'-bis(4-pyridylmethyl)oxalamide and a zigzag chain structure of <i>catena</i>-poly[[[dichloridocobalt(II)]-μ-<i>N</i>,<i>N</i>'-bis(4-pyridylmethyl)oxalamide-κ^2^<i>N</i>^4^:<i>N</i>^4'^] hemihydrate]","Acta Crystallographica Section C","2007","63","5","m216","m219","10.1107/S0108270107014527","","","0.71073","MoKα","","0.0889","0.0602","","","0.1747","0.1889","","","","","","1.186","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2015931","30.895","0.004","5.5976","0.0007","9.7522","0.0013","90","","90.027","0.002","90","","1686.5","0.4","293","2","293","2","","","","","","","","6","I 1 2 1","I 2y","5","","Ammonium trisilver bis[fluorophosphate(V)]","","- Ag3 F2 H4 N O6 P2 -","- Ag3 F2 N O6 P2 -","- Ag24 F16 N8 O48 P16 -","8","2","BC3036","Weil, Matthias","NH~4~Ag~3~(PO~3~F)~2~, a layered monofluorophosphate(V) with seven different Ag sites","Acta Crystallographica Section C","2007","63","5","i31","i33","10.1107/S0108270107008967","","","0.71073","MoKα","","0.0381","0.0322","","","0.0733","0.0762","","","","","","1.07","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015932","7.6699","0.0008","10.2612","0.0011","7.6571","0.0008","90","","100.004","0.002","90","","593.47","0.11","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","dizinc selenium trioxo dichloride","Dizinc selenium dichloride trioxide","","- Cl2 O3 Se Zn2 -","- Cl2 O3 Se Zn2 -","- Cl8 O12 Se4 Zn8 -","4","1","BC3038","Johnsson, Mats; Törnroos, Karl W.","Zinc selenium oxochloride, β-Zn~2~(SeO~3~)Cl~2~, a synthetic polymorph of the mineral sophiite","Acta Crystallographica Section C","2007","63","5","i34","i36","10.1107/S0108270107012541","","","0.71073","MoKα","","0.0154","0.0133","","","0.0312","0.0318","","","","","","1.076","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015933","19.2178","0.0004","5.8299","0.0001","11.9673","0.0002","90","","112.287","0.002","90","","1240.63","0.04","120","2","393","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[Diaquabis(isothiocyanato)iron(II)]-μ-4,4'-bi-1,2,4-triazole]","","- C6 H8 Fe N8 O2 S2 -","- C6 H8 Fe N8 O2 S2 -","- C24 H32 Fe4 N32 O8 S8 -","4","0.5","BG3030","Pillet, Sébastien; Lecomte, Claude","<i>catena</i>-Poly[[diaquadiisothiocyanatoiron(II)]-μ-4,4'-bi-1,2,4-triazole]: a one-dimensional coordination polymer","Acta Crystallographica Section C","2007","63","5","m184","m186","10.1107/S010827010701030X","","","0.71073","MoKα","","0.0324","0.0278","","","0.0704","0.073","","","","","","1.088","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015934","10.472","0.001","10.2339","0.0007","14.518","0.002","90","","99.051","0.009","90","","1536.5","0.3","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ammonium bis(tetraethylammonium) hexacyanoferrate(III) trihydrate","","- C22 H50 Fe N9 O3 -","- C22 H50 Fe N9 O3 -","- C44 H100 Fe2 N18 O6 -","2","0.5","DN3040","Miroslava Matiková Maľarová; Juraj Černák; Werner Massa","Ammonium bis(tetraethylammonium) hexacyanidoferrate(III) trihydrate","Acta Crystallographica Section C","2007","63","5","m187","m189","10.1107/S0108270107010499","","","0.71069","MoKα","","0.0661","0.0388","","","0.0928","0.0999","","","","","","1.009","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015935","6.089","0.0007","15.3562","0.0009","23.1522","0.0011","90","","90","","90","","2164.8","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R)-3,5-Bis[(E)-benzylidene]-1-(1-phenylethyl)piperidin-4-one","","- C27 H25 N O -","- C27 H25 N O -","- C108 H100 N4 O4 -","4","1","DN3041","J. Suresh; R. Suresh Kumar; S. Perumal; S. Natarajan","(<i>R</i>)-3,5-Bis[(<i>E</i>)-benzylidene]-1-(1-phenylethyl)piperidin-4-one, 3,5-bis[(<i>E</i>)-4-chlorobenzylidene]-1-[(<i>R</i>)-1-phenylethyl]piperidin-4-one and 3,5-bis[(<i>E</i>)-2-chlorobenzylidene]-1-[(<i>R</i>)-1-phenylethyl]piperidin-4-one","Acta Crystallographica Section C","2007","63","5","o315","o318","10.1107/S0108270107011626","","","0.71073","MoKα","","0.0792","0.0319","","","0.0743","0.0934","","","","","","1.058","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015936","6.6409","0.0003","12.9466","0.0001","13.1274","0.0008","90","","94.2","0.016","90","","1125.62","0.09","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","3,5-bis[(E)-4-chlorobenzylidene]-1-[(R)-1-phenylethyl]piperidin-4-one","","- C27 H23 Cl2 N O -","- C27 H23 Cl2 N O -","- C54 H46 Cl4 N2 O2 -","2","1","DN3041","J. Suresh; R. Suresh Kumar; S. Perumal; S. Natarajan","(<i>R</i>)-3,5-Bis[(<i>E</i>)-benzylidene]-1-(1-phenylethyl)piperidin-4-one, 3,5-bis[(<i>E</i>)-4-chlorobenzylidene]-1-[(<i>R</i>)-1-phenylethyl]piperidin-4-one and 3,5-bis[(<i>E</i>)-2-chlorobenzylidene]-1-[(<i>R</i>)-1-phenylethyl]piperidin-4-one","Acta Crystallographica Section C","2007","63","5","o315","o318","10.1107/S0108270107011626","","","0.71073","MoKα","","0.0598","0.049","","","0.1296","0.1392","","","","","","1.071","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015937","25.746","0.005","6.1251","0.0009","16.1829","0.0019","90","","113.55","0.01","90","","2339.4","0.7","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","3,5-bis[(E)-2-chlorobenzylidene]-1-[(R)-1-phenylethyl]piperidin-4-one","","- C27 H23 Cl2 N O -","- C27 H23 Cl2 N O -","- C108 H92 Cl8 N4 O4 -","4","1","DN3041","J. Suresh; R. Suresh Kumar; S. Perumal; S. Natarajan","(<i>R</i>)-3,5-Bis[(<i>E</i>)-benzylidene]-1-(1-phenylethyl)piperidin-4-one, 3,5-bis[(<i>E</i>)-4-chlorobenzylidene]-1-[(<i>R</i>)-1-phenylethyl]piperidin-4-one and 3,5-bis[(<i>E</i>)-2-chlorobenzylidene]-1-[(<i>R</i>)-1-phenylethyl]piperidin-4-one","Acta Crystallographica Section C","2007","63","5","o315","o318","10.1107/S0108270107011626","","","0.71073","MoKα","","0.0588","0.034","","","0.0761","0.0858","","","","","","1.036","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015938","9.4426","0.0001","8.3584","0.0001","15.7881","0.0003","90","","103.213","0.002","90","","1213.09","0.03","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-Bis(dimethyl sulfoxide-κO)bis(3-oxoquinoxaline-2-carboxylato-κ^2^N^1^,O^2^)copper(II)","","- C22 H22 Cu N4 O8 S2 -","- C22 H22 Cu N4 O8 S2 -","- C44 H44 Cu2 N8 O16 S4 -","2","0.5","FA3073","Popović, Zora; Pavlović, Gordana; Kukovec, Boris‒Marko","<i>trans</i>-Bis(dimethyl sulfoxide-κ<i>O</i>)bis(3-oxo-3,4-dihydroquinoxaline-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>^2^)copper(II)","Acta Crystallographica Section C","2007","63","5","m181","m183","10.1107/S0108270107010979","","","0.71073","MoKα","","0.0425","0.0348","","","0.0818","0.0871","","","","","","1.111","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015939","10.384","0.002","8.187","0.001","13.013","0.003","90","","111.75","0.02","90","","1027.5","0.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,4-Diamino-6-methyl-1,3,5-triazin-1-ium trifluoroacetate","","- C6 H8 F3 N5 O2 -","- C6 H8 F3 N5 O2 -","- C24 H32 F12 N20 O8 -","4","1","FA3075","Genivaldo Júlio Perpétuo; Jan Janczak","2,4-Diamino-6-methyl-1,3,5-triazin-1-ium trifluoroacetate","Acta Crystallographica Section C","2007","63","5","o271","o273","10.1107/S0108270107010165","","","0.71073","MoKα","","0.0907","0.0529","","","0.1489","0.1654","","","","","","1.105","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015940","7.12899","0.00002","7.93194","0.00003","7.17658","0.00002","90","","90","","90","","405.812","0.002","4.5","","","","","","","","","","","4","C m c m","-C 2c 2","63","dimethyl sulfone","Perdeuterodimethyl sulfone","","- C2 D6 O2 S -","- C2 D6 O2 S -","- C8 D24 O8 S4 -","4","0.25","FA3079","Ibberson, R. M.","Neutron powder diffraction study of perdeuterodimethyl sulfone","Acta Crystallographica Section C","2007","63","5","o292","o294","10.1107/S0108270107012164","","neutron","","time-of-flightneutron","","","","","","","","","","1.98","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2015941","9.8171","0.0006","10.4167","0.0011","10.1713","0.0012","90","","112.078","0.009","90","","963.87","0.17","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","4-aminobenzoic acid bis(L-proline)","4-Aminobenzoic acid‒L-proline (1/2) monohydrate","","- C17 H27 N3 O7 -","- C17 H27 N3 O7 -","- C34 H54 N6 O14 -","2","1","FA3080","S. Athimoolam; S. Natarajan","Hydrogen-bonding features in the 1:2 adduct of 4-aminobenzoic acid and <small>L</small>-proline","Acta Crystallographica Section C","2007","63","5","o283","o286","10.1107/S0108270107013832","","","0.71073","MoKα","","0.0522","0.044","","","0.109","0.1149","","","","","","1.086","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015942","9.806","0.0003","10.182","0.0003","13.818","0.002","97.035","0.006","104.455","0.006","96.171","0.003","1312.2","0.2","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","6-(1H-indol-3-yl)-3-methyl-4-(4-methylphenyl)-1-phenyl-1H- pyrazolo[3,4-b]pyridine-5-carbonitrile","","- C32 H28 N6 O -","- C32 H28 N6 O -","- C64 H56 N12 O2 -","2","1","FA3082","Low, John N.; Cobo, Justo; Sánchez, Ana; Trilleras, Jorge; Glidewell, Christopher","Supramolecular aggregation in three 4-aryl-6-(1<i>H</i>-indol-3-yl)-3-methyl-1-phenyl-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine-5-carbonitriles","Acta Crystallographica Section C","2007","63","5","o287","o291","10.1107/S0108270107013649","","","0.71073","MoKα","","0.1022","0.0504","","","0.1143","0.1461","","","","","","1.063","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015943","30.303","0.003","11.349","0.0016","20.344","0.003","90","","131.01","0.005","90","","5279.5","1.3","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","6-(1H-indol-3-yl)-3-methyl-4-(4-methoxyphenyl)-1-phenyl-1H- pyrazolo[3,4-b]pyridine-5-carbonitrile","","- C32 H28 N6 O2 -","- C32 H28 N6 O2 -","- C256 H224 N48 O16 -","8","1","FA3082","Low, John N.; Cobo, Justo; Sánchez, Ana; Trilleras, Jorge; Glidewell, Christopher","Supramolecular aggregation in three 4-aryl-6-(1<i>H</i>-indol-3-yl)-3-methyl-1-phenyl-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine-5-carbonitriles","Acta Crystallographica Section C","2007","63","5","o287","o291","10.1107/S0108270107013649","","","0.71073","MoKα","","0.1361","0.0686","","","0.1777","0.2373","","","","","","1.067","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015944","8.8241","0.001","11.9901","0.0009","12.913","0.0017","99.372","0.009","108.822","0.012","90.994","0.007","1272.3","0.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","6-(1H-indol-3-yl)-3-methyl-1-phenyl-4-(3,4,5-trimethoxyphenyl)-1H- pyrazolo[3,4-b]pyridine-5-carbonitrile","","- C31 H25 N5 O3 -","- C31 H25 N5 O3 -","- C62 H50 N10 O6 -","2","1","FA3082","Low, John N.; Cobo, Justo; Sánchez, Ana; Trilleras, Jorge; Glidewell, Christopher","Supramolecular aggregation in three 4-aryl-6-(1<i>H</i>-indol-3-yl)-3-methyl-1-phenyl-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine-5-carbonitriles","Acta Crystallographica Section C","2007","63","5","o287","o291","10.1107/S0108270107013649","","","0.71073","MoKα","","0.1363","0.0549","","","0.1167","0.1515","","","","","","1.06","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015945","6.4641","0.0004","7.8224","0.0005","18.6122","0.0013","90","","90","","90","","941.12","0.11","298","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-3-(Ammoniomethyl)-5-methylhexanoate","","- C8 H17 N O2 -","- C8 H17 N O2 -","- C32 H68 N4 O8 -","4","1","GA3046","Venu, Nalivela; Vishweshwar, Peddy; Ram, Thaimattam; Surya, Devarakonda; Apurba, Bhattacharya","(<i>S</i>)-3-(Ammoniomethyl)-5-methylhexanoate (pregabalin)","Acta Crystallographica Section C","2007","63","5","o306","o308","10.1107/S0108270107016952","","","0.7107","MoKα","","","0.051","","","","0.056","","","","","","1.097","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015947","10.7451","0.0004","11.0327","0.0004","31.2265","0.0012","90","","90","","90","","3701.8","0.2","100","1","100","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Diaqua[methyl 4-O-benzyl-2,3,6-tri-O-(2-picolyl)-α-D-mannopyranoside]cobalt(II) bis(perchlorate) monohydrate","","- C32 H41 Cl2 Co N3 O17 -","- C32 H41 Cl2 Co N3 O17 -","- C128 H164 Cl8 Co4 N12 O68 -","4","1","GD3097","Cisnetti, Federico; Guillot, Regis; Thérisod, Michel; Policar, Clotilde","Diaqua[methyl 4-<i>O</i>-benzyl-2,3,6-tri-<i>O</i>-(2-picolyl)-α-<small>D</small>-mannopyranoside]cobalt(II) bis(perchlorate) monohydrate: partial coordination of a ligand derived from <small>D</small>-mannose","Acta Crystallographica Section C","2007","63","5","m201","m203","10.1107/S0108270107013522","","","0.71073","MoKα","","0.0377","0.0317","","","0.0686","0.0702","","","","","","1.001","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015948","26.709","0.005","25.884","0.005","3.779","0.001","90","","90","","90","","2612.6","1","295","2","295","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","2,4,6-Triamino-1,3,5-triazine‒1H-isoindole-1,3(2H)-dione (1/3)","","- C27 H21 N9 O6 -","- C27 H21 N9 O6 -","- C108 H84 N36 O24 -","4","0.5","GG3088","Genivaldo Júlio Perpétuo; Jan Janczak","2,4,6-Triamino-1,3,5-triazine‒1<i>H</i>-isoindole-1,3(2<i>H</i>)-dione (1/3)","Acta Crystallographica Section C","2007","63","5","o301","o302","10.1107/S0108270107015880","","","0.71073","MoKα","","0.0567","0.0336","","","0.0818","0.0923","","","","","","1.002","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015949","11.2058","0.0002","12.7677","0.0002","15.0499","0.0003","90","","99.3278","0.0009","90","","2124.75","0.07","90","0.2","90","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Z)-2-[(1-Phenylsulfonyl-1H-indol-3-yl)methylene]-1-azabicyclo[2.2.2]octan-3-one semicarbazone","","- C23 H23 N5 O3 S -","- C23 H23 N5 O3 S -","- C92 H92 N20 O12 S4 -","4","1","HJ3030","Sonar, Vijayakumar N.; M. Venkatraj; Parkin, Sean; Crooks, Peter A.","(<i>Z</i>)-2-[(1-Phenylsulfonyl-1<i>H</i>-indol-3-yl)methylene]-1-azabicyclo[2.2.2]octan-3-one semicarbazone","Acta Crystallographica Section C","2007","63","5","o277","o279","10.1107/S0108270107006129","","","0.71073","MoKα","","0.0587","0.0396","","","0.1012","0.1109","","","","","","1.06","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015950","9.7596","0.0002","10.1025","0.0002","10.7227","0.0002","80.173","0.001","76.633","0.001","71.442","0.001","969.68","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","2-{[(4-Methylphenyl)sulfonyl]amino}phenyl 4-methylbenzenesulfonate","","- C20 H19 N O5 S2 -","- C20 H19 N O5 S2 -","- C40 H38 N2 O10 S4 -","2","1","HJ3033","Morgans, G. L.; Scalzullo, S. M.; Fernandes, M. A.; Michael, J. P.; van Otterlo, W. A. L.","2-{[(4-Methylphenyl)sulfonyl]amino}phenyl 4-methylbenzenesulfonate","Acta Crystallographica Section C","2007","63","5","o309","o311","10.1107/S0108270107015430","","","0.71073","MoKα","","0.0454","0.0383","","","0.1007","0.1046","","","","","","1.091","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015951","7.4094","0.0002","12.6262","0.0005","14.0648","0.0005","90","","94.26","0.001","90","","1312.16","0.08","150","1","150","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","poly[3-aminopyridinium μ~3~-hydroxido-di-μ~3~-sulfato-bis[aquasulfatocopper(II)]]","","- C5 H12 Cu2 N2 O11 S2 -","- C5 H12 Cu2 N2 O11 S2 -","- C20 H48 Cu8 N8 O44 S8 -","4","1","HJ3034","Lah, Nina; Leban, Ivan; Giester, Gerald","A new copper(II) basic sulfate: poly[3-aminopyridinium μ~3~-hydroxido-di-μ~3~-sulfato-bis[aquacopper(II)]]","Acta Crystallographica Section C","2007","63","5","m222","m224","10.1107/S0108270107013285","","","0.71073","MoKα","","0.0205","0.0199","","","0.0526","0.0528","","","","","","1.067","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015952","6.5347","0.0005","7.517","0.0008","12.4428","0.0005","80.022","0.006","80.203","0.005","67.25","0.008","551.54","0.08","294","","294","","","","","","","","","6","P -1","-P 1","2","","Bis(2-amino-2-thiazolinium) tetra-μ-formato-κ^8^O:O')bis[(formato-κO)copper(II)]","","- C12 H20 Cu2 N4 O12 S2 -","- C12 H20 Cu2 N4 O12 S2 -","- C12 H20 Cu2 N4 O12 S2 -","1","0.5","HJ3035","Sieroń, Lesław","Bis(2-amino-2-thiazolinium) tetra-μ-formato-κ^8^<i>O</i>:<i>O</i>'-bis[(formato-κ<i>O</i>)copper(II)]","Acta Crystallographica Section C","2007","63","5","m199","m200","10.1107/S0108270107013303","","","0.71073","MoKα","","0.0316","0.0249","","","0.0672","0.072","","","","","","1.087","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015953","8.6963","0.0004","24.5966","0.0011","14.3247","0.0007","90","","90","","90","","3064","0.2","105","2","","","","","","","","","","5","P c a 21","P 2c -2ac","29","","2-Chloro-6-(2-furyl)-9-(4-methoxybenzyl)-9H-purine","","- C17 H13 Cl N4 O2 -","- C17 H13 Cl N4 O2 -","- C136 H104 Cl8 N32 O16 -","8","2","LN3042","Braendvang, Morten; Gundersen, Lise-Lotte","2-Chloro-6-(2-furyl)-9-(4-methoxybenzyl)-9<i>H</i>-purine","Acta Crystallographica Section C","2007","63","5","o274","o276","10.1107/S0108270107011596","","","0.71073","MoKα","","","0.0385","","","","0.088","","","","","","0.891","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015954","5.4331","0.0002","10.6173","0.0004","19.189","0.0005","90","","97.771","0.002","90","","1096.75","0.06","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tetraaquaberyllium 4-oxo-4H-pyran-2,6-dicarboxylate","","- C7 H10 Be O10 -","- C7 H10 Be O10 -","- C28 H40 Be4 O40 -","4","1","LN3043","Yasodha, Vaduganathan; Govindarajan, Subbaiah; Low, John N.; Glidewell, Christopher","Cationic, neutral and anionic metal(II) complexes derived from 4-oxo-4<i>H</i>-pyran-2,6-dicarboxylic acid (chelidonic acid)","Acta Crystallographica Section C","2007","63","5","m207","m215","10.1107/S010827010701459X","","","0.71073","MoKα","","0.0463","0.0369","","","0.1029","0.118","","","","","","1.15","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015955","6.4669","0.0002","7.0797","0.0003","18.8278","0.0006","90","","97.372","0.002","90","","854.88","0.05","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","hydrazinium(2+) diaqua(4-oxo-4H-pyran-2,6-dicarboxylato)calcate","","- C14 H14 Ca N2 O14 -","- C14 H14 Ca N2 O14 -","- C28 H28 Ca2 N4 O28 -","2","0.5","LN3043","Yasodha, Vaduganathan; Govindarajan, Subbaiah; Low, John N.; Glidewell, Christopher","Cationic, neutral and anionic metal(II) complexes derived from 4-oxo-4<i>H</i>-pyran-2,6-dicarboxylic acid (chelidonic acid)","Acta Crystallographica Section C","2007","63","5","m207","m215","10.1107/S010827010701459X","","","0.71073","MoKα","","0.0378","0.0363","","","0.1111","0.1161","","","","","","1.204","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015956","7.4343","0.0002","10.1176","0.0003","10.229","0.0003","61.935","0.002","78.219","0.003","69.061","0.002","633.49","0.03","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","bis(μ-4-oxo-4H-pyran-2,6-dicarboxylato)bis[tetraaquamanganese(II)] tetrahydrate","","- C14 H28 Mn2 O24 -","- C14 H28 Mn2 O24 -","- C14 H28 Mn2 O24 -","1","0.5","LN3043","Yasodha, Vaduganathan; Govindarajan, Subbaiah; Low, John N.; Glidewell, Christopher","Cationic, neutral and anionic metal(II) complexes derived from 4-oxo-4<i>H</i>-pyran-2,6-dicarboxylic acid (chelidonic acid)","Acta Crystallographica Section C","2007","63","5","m207","m215","10.1107/S010827010701459X","","","0.71073","MoKα","","0.0438","0.0302","","","0.0679","0.0737","","","","","","1.077","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015957","4.9593","0.0006","9.8973","0.0014","10.4697","0.0012","94.237","0.009","94.955","0.009","97.353","0.006","505.88","0.11","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","tetraaqua(4-oxo-4H-pyran-2,6-dicarboxylato)copper(II)","","- C7 H10 Cu O10 -","- C7 H10 Cu O10 -","- C14 H20 Cu2 O20 -","2","1","LN3043","Yasodha, Vaduganathan; Govindarajan, Subbaiah; Low, John N.; Glidewell, Christopher","Cationic, neutral and anionic metal(II) complexes derived from 4-oxo-4<i>H</i>-pyran-2,6-dicarboxylic acid (chelidonic acid)","Acta Crystallographica Section C","2007","63","5","m207","m215","10.1107/S010827010701459X","","","0.71073","MoKα","","0.0572","0.052","","","0.15","0.1559","","","","","","1.12","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015958","5.3262","0.0002","6.2885","0.0002","8.1008","0.0003","97.733","0.002","105.055","0.0017","110.436","0.0018","237.795","0.015","120","2","120","2","","","","","","","","4","P 1","P 1","1","","diaqua(4-oxo-4H-pyran-2,6-dicarboxylato)cadmium monohydrate","","- C7 H8 Cd O9 -","- C7 H8 Cd O9 -","- C7 H8 Cd O9 -","1","1","LN3043","Yasodha, Vaduganathan; Govindarajan, Subbaiah; Low, John N.; Glidewell, Christopher","Cationic, neutral and anionic metal(II) complexes derived from 4-oxo-4<i>H</i>-pyran-2,6-dicarboxylic acid (chelidonic acid)","Acta Crystallographica Section C","2007","63","5","m207","m215","10.1107/S010827010701459X","","","0.71073","MoKα","","0.0179","0.0179","","","0.0419","0.0419","","","","","","1.152","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015959","8.9567","0.0018","11.118","0.002","11.568","0.002","106.71","0.03","98.67","0.03","99.21","0.03","1065.2","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","dichlorido(2,4,6-tri-2-pyridyl-1,3,5-triazine)cadmium(II) trihydrate","","- C18 H18 Cd Cl2 N6 O3 -","- C18 H18 Cd Cl2 N6 O3 -","- C36 H36 Cd2 Cl4 N12 O6 -","2","1","LN3046","Xie, Hong-Zhen; Pan, Wei-Juan","A planar cyclic hexamer of water molecules in dichlorido(2,4,6-tri-2-pyridyl-1,3,5-triazine)cadmium(II) trihydrate","Acta Crystallographica Section C","2007","63","5","m204","m206","10.1107/S0108270107015703","","","0.71073","MoKα","","0.0468","0.0393","","","0.1099","0.1138","","","","","","1.077","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015960","11.6289","0.0017","12.179","0.002","3.8538","0.0007","90","","90","","90","","545.81","0.16","293","2","293","2","","","","","","","","5","C m m m","-C 2 2","65","[HgCl~2~(4,4'-Bipy)]~n~","poly[μ~2~-4,4'-bipyridyl-di-μ~2~-chloro-mercury(II)]","","- C10 H8 Cl2 Hg N2 -","- C10 H8 Cl2 Hg N2 -","- C20 H16 Cl4 Hg2 N4 -","2","0.125","LN3048","Yi-Ming Xie; Ji-Huai Wu","The layered compound poly[μ~2~-4,4'-bipyridyl-di-μ~2~-chlorido-mercury(II)]","Acta Crystallographica Section C","2007","63","5","m220","m221","10.1107/S0108270107016800","","","0.71073","MoKα","","0.0188","0.0188","","","0.0451","0.0451","","","","","","1.094","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015961","6.971","0.0002","10.9014","0.0003","18.3749","0.0006","90","","93.631","0.002","90","","1393.57","0.07","120","","120","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-amino-4,6-dimethoxypyrimidinium 4-hydroxybenzoate monohydrate","","- C13 H17 N3 O6 -","- C13 H17 N3 O6 -","- C52 H68 N12 O24 -","4","1","OB3031","Kaliyaperumal Thanigaimani; Packianathan Thomas Muthiah; Daniel E. Lynch","Hydrogen-bonded supramolecular motifs in 2-amino-4,6-dimethoxypyrimidinium 4-hydroxybenzoate monohydrate, 2-amino-4,6-dimethoxypyrimidinium 6-carboxypyridine-2-carboxylate monohydrate and 2-amino-4,6-dimethoxypyrimidinium hydrogen (2<i>R</i>,3<i>R</i>)-tartrate 2-amino-4,6-dimethoxypyrimidine","Acta Crystallographica Section C","2007","63","5","o295","o300","10.1107/S0108270107005677","","","0.71073","MoKα","","0.0781","0.0554","","","0.1272","0.1399","","","","","","1.086","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015962","6.8247","0.0006","7.9273","0.0005","14.4038","0.001","82.558","0.005","88.133","0.004","75.075","0.005","746.63","0.1","120","","120","","","","","","","","","4","P -1","-P 1","2","","2-amino-4,6-dimethoxypyrimidinium 6-carboxypyridine-2-carboxylate monohydrate","","- C13 H16 N4 O7 -","- C13 H16 N4 O7 -","- C26 H32 N8 O14 -","2","1","OB3031","Kaliyaperumal Thanigaimani; Packianathan Thomas Muthiah; Daniel E. Lynch","Hydrogen-bonded supramolecular motifs in 2-amino-4,6-dimethoxypyrimidinium 4-hydroxybenzoate monohydrate, 2-amino-4,6-dimethoxypyrimidinium 6-carboxypyridine-2-carboxylate monohydrate and 2-amino-4,6-dimethoxypyrimidinium hydrogen (2<i>R</i>,3<i>R</i>)-tartrate 2-amino-4,6-dimethoxypyrimidine","Acta Crystallographica Section C","2007","63","5","o295","o300","10.1107/S0108270107005677","","","0.71073","MoKα","","0.093","0.0644","","","0.156","0.1745","","","","","","1.065","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015963","7.3245","0.0002","15.8349","0.0006","8.9264","0.0003","90","","105.251","0.002","90","","998.85","0.06","120","","120","","","","","","","","","4","P 1 21 1","P 2yb","4","","2-amino-4,6-dimethoxypyrimidinium hydrogen L-tartrate 2-amino-4,6-dimethoxypyrimidine","","- C16 H24 N6 O10 -","- C16 H24 N6 O10 -","- C32 H48 N12 O20 -","2","1","OB3031","Kaliyaperumal Thanigaimani; Packianathan Thomas Muthiah; Daniel E. Lynch","Hydrogen-bonded supramolecular motifs in 2-amino-4,6-dimethoxypyrimidinium 4-hydroxybenzoate monohydrate, 2-amino-4,6-dimethoxypyrimidinium 6-carboxypyridine-2-carboxylate monohydrate and 2-amino-4,6-dimethoxypyrimidinium hydrogen (2<i>R</i>,3<i>R</i>)-tartrate 2-amino-4,6-dimethoxypyrimidine","Acta Crystallographica Section C","2007","63","5","o295","o300","10.1107/S0108270107005677","","","0.71073","MoKα","","0.0564","0.0491","","","0.1056","0.1103","","","","","","1.147","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015964","6.4711","0.0013","9.781","0.002","12.524","0.003","90","","90","","90","","792.7","0.3","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N-carbamoyl-L-proline","(2S)-1-Carbamoylpyrrolidine-2-carboxylic acid","","- C6 H10 N2 O3 -","- C6 H10 N2 O3 -","- C24 H40 N8 O12 -","4","1","SK3108","Seijas, Luis E.; Delgado, Gerzon E.; Mora, Asiloé J.; Bahsas, Ali; Briceño, Alexander","(2<i>S</i>)-1-Carbamoylpyrrolidine-2-carboxylic acid","Acta Crystallographica Section C","2007","63","5","o303","o305","10.1107/S0108270107014102","","","0.7107","MoKα","","0.0574","0.0478","","","0.1227","0.1322","","","","","","1.054","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015965","5.1056","0.0003","16.5856","0.001","9.6587","0.0006","90","","99.962","0.001","90","","805.56","0.08","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4'-(Azinodimethylene)dipyridinium bis(tetrafluoroborate)","","- C12 H12 B2 F8 N4 -","- C12 H12 B2 F8 N4 -","- C24 H24 B4 F16 N8 -","2","0.5","SK3115","Ghazzali, Mohamed; Langer, Vratislav; Öhrström, Lars; Abu-Youssef, Morsy","4,4'-(Azinodimethylene)dipyridinium bis(tetrafluoroborate) and 4-[(4-pyridylmethylene)hydrazonomethyl]pyridinium perchlorate: two different hydrogen-bonding motifs","Acta Crystallographica Section C","2007","63","5","o312","o314","10.1107/S0108270107015764","","","0.71073","MoKα","","0.0604","0.04","","","0.1056","0.1189","","","","","","0.999","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015966","15.0896","0.0006","11.5525","0.0005","7.8694","0.0003","90","","90","","90","","1371.81","0.1","153","2","153","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","4-[4-pyridylmethylene)hydrazonomethyl]pyridinium perchlorate","","- C12 H11 Cl N4 O4 -","- C12 H11 Cl N4 O4 -","- C48 H44 Cl4 N16 O16 -","4","1","SK3115","Ghazzali, Mohamed; Langer, Vratislav; Öhrström, Lars; Abu-Youssef, Morsy","4,4'-(Azinodimethylene)dipyridinium bis(tetrafluoroborate) and 4-[(4-pyridylmethylene)hydrazonomethyl]pyridinium perchlorate: two different hydrogen-bonding motifs","Acta Crystallographica Section C","2007","63","5","o312","o314","10.1107/S0108270107015764","","","0.71073","MoKα","","0.0415","0.0322","","","0.0779","0.0822","","","","","","1.003","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015967","10.89","0.002","7.7642","0.0016","12.272","0.003","90","","111.87","0.03","90","","962.9","0.4","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Poly[[diaqua(N,N-dimethylformamide-κO)manganese(II)]-μ~3~-sulfato]","","- C3 H11 Mn N O7 S -","- C3 H11 Mn N O7 S -","- C12 H44 Mn4 N4 O28 S4 -","4","1","SQ3072","Deng, Zhao-Peng; Gao, Shan; Huo, Li-Hua; Zhao, Hui","Poly[[diaqua(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)manganese(II)]-μ~3~-sulfato]","Acta Crystallographica Section C","2007","63","5","m225","m227","10.1107/S010827010701791X","","","0.71073","MoKα","","0.0209","0.0201","","","0.0547","0.0552","","","","","","1.075","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015968","20.3809","0.0008","9.5957","0.0003","15.737","0.0006","90","","90","","90","","3077.67","0.19","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","cis-dichloro(phenanthrolinedione) trans-dipyridinecobalt(II) pyridine solvate","<i>cis</i>-dichlorido(1,10-phenanthroline-5,6-dione-κ^2^N,N')-<i>trans</i>- dipyridinecobalt(II) pyridine disolvate","","- C32 H26 Cl2 Co N6 O2 -","- C32 H26 Cl2 Co N6 O2 -","- C128 H104 Cl8 Co4 N24 O8 -","4","1","SU3002","Cédric Desroches; Lars Öhrström","Transformations of the chameleon ligand 1,10-phenanthroline-5,6-dione/diol: <i>cis</i>-dichlorido(1,10-phenanthroline-5,6-dione-κ^2^<i>N</i>,<i>N</i>')-<i>trans</i>-dipyridinecobalt(II) pyridine disolvate prepared from the diol","Acta Crystallographica Section C","2007","63","5","m190","m192","10.1107/S0108270107010554","","","0.71073","MoKα","","0.1038","0.0511","","","0.125","0.1267","","","","","","0.897","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2015969","39.627","0.002","22.3406","0.0011","23.7155","0.001","90","","107.687","0.002","90","","20002.7","1.7","90","0.2","90","0.2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Octakis(ε-caprolactam-κO)erbium(III) hexaisothiocyanatochromate(III)","","- C54 H88 Cr Er N14 O8 S6 -","- C54 H88 Cr Er N14 O8 S6 -","- C648 H1056 Cr12 Er12 N168 O96 S72 -","12","1.5","SU3006","Elisaveta V. Cherkasova; Eugenia V. Peresypkina; Alexander V. Virovets; Nina V. Podberezskaya; Tatyana G. Cherkasova","Octakis(ε-caprolactam-κ<i>O</i>)erbium(III) hexaisothiocyanatochromate(III)","Acta Crystallographica Section C","2007","63","5","m195","m198","10.1107/S0108270107015181","","","0.71073","MoKα","","0.0968","0.0449","","","0.0801","0.1007","","","","","","1.023","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015970","8.314","0.002","6.968","0.002","19.46","0.002","90","","90.645","0.005","90","","1127.3","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-poly[[[aquacopper(II)]-μ-<i>N</i>-(3-carboxy-2- oxidobenzylidene-κO^2^)glycinato-κ^3^N,O':O'] monohydrate]","","- C10 H11 Cu N O7 -","- C10 H11 Cu N O7 -","- C40 H44 Cu4 N4 O28 -","4","1","AV3081","Cai, Jin-Hua; Wu, Zhi-Hong; Huang, Ying-Heng; Yin, Xu-Ju; Jiang, Yi-Min","A novel helical copper complex: <i>catena</i>-poly[[[aquacopper(II)]-μ-<i>N</i>-(3-carboxy-2-oxidobenzylidene-κ<i>O</i>^2^)glycinato-κ^3^<i>N</i>,<i>O</i>':<i>O</i>'] monohydrate]","Acta Crystallographica Section C","2007","63","6","m267","m269","10.1107/S0108270107019312","","","0.71073","MoKα","","0.0581","0.0525","","","0.147","0.1499","","","","","","1.108","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015971","5.1135","0.0002","6.9059","0.0003","7.5925","0.0003","90","","100.662","0.004","90","","263.48","0.03","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-Aspartic acid","L-Aspartic acid","","- C4 H7 N O4 -","- C4 H7 N O4 -","- C8 H14 N2 O8 -","2","1","AV3087","Bendeif, El-eulmi; Jelsch, Christian","The experimental library multipolar atom model refinement of <i>L</i>-aspartic acid","Acta Crystallographica, Section C","2007","63","6","o361","o364","10.1107/S0108270107021671","","","0.71073","MoKα","","0.0451","0.0428","","","0.0402","0.019","","","","","","1.467","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2015972","5.1135","0.0002","6.9059","0.0003","7.5925","0.0003","90","","100.662","0.004","90","","263.48","0.03","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-Aspartic acid","","- C4 H7 N O4 -","- C4 H7 N O4 -","- C8 H14 N2 O8 -","2","1","AV3087","Bendeif, El-eulmi; Jelsch, Christian","The experimental library multipolar atom model refinement of <i>L</i>-aspartic acid","Acta Crystallographica, Section C","2007","63","6","o361","o364","10.1107/S0108270107021671","","","0.71073","MoKα","","0.0532","0.0553","","","0.0522","0.0255","","","","","","1.883","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2015973","10.184","0.002","10.842","0.001","11.034","0.002","98.72","0.03","110.42","0.02","92.42","0.03","1122.6","0.4","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","2,6-Bis[(2-hydroxy-3-methoxybenzylidene)hydrazinocarbonyl]pyridine monohydrate","","- C23 H23 N5 O7 -","- C23 H23 N5 O7 -","- C46 H46 N10 O14 -","2","1","AV3088","Zhi-Feng Li; Ping Wang; Qian Zhang; Zao-Ming Chen; Chun-Xiang Wang","2,6-Bis[(2-hydroxy-3-methoxybenzylidene)hydrazinocarbonyl]pyridine monohydrate","Acta Crystallographica Section C","2007","63","6","o369","o370","10.1107/S0108270107021920","","","0.71073","MoKα","","0.107","0.0527","","","0.1195","0.1388","","","","","","1.005","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015974","13.307","0.002","5.0336","0.0005","12.1142","0.0018","90","","116.218","0.005","90","","727.95","0.17","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","catena-Poly[[diaquazinc(II)]-μ-4,4'-sulfonyldibenzoato-κ^2^O:O']","","- C14 H12 O8 S Zn -","- C14 H12 O8 S Zn -","- C28 H24 O16 S2 Zn2 -","2","0.5","BM3026","Peng-Bin Pan; Lei Zhang; Zhao-Ji Li; Xin-Yi Cao; Yuan-Gen Yao","<i>catena</i>-Poly[[diaquazinc(II)]-μ-4,4'-sulfonyldibenzoato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section C","2007","63","6","m270","m272","10.1107/S0108270107008244","","","0.71073","MoKα","","0.0453","0.037","","","0.0844","0.0897","","","","","","1.018","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015975","32.3762","0.0004","43.4056","0.0002","5.5618","0.0001","90","","90","","90","","7816.04","0.17","183","2","183","2","","","","","","","","4","F d d 2","F 2 -2d","43","","3-(4-Bromophenyl)-5-(4-dimethylaminophenyl)-1-phenyl-2-pyrazoline","","- C23 H22 Br N3 -","- C23 H22 Br N3 -","- C368 H352 Br16 N48 -","16","1","DN3043","Langer, Vratislav; Scholtzová, Eva; Koóš, Miroslav","3-(4-Bromophenyl)-5-(4-dimethylaminophenyl)-1-phenyl-2-pyrazoline: X-ray and density functional theory (DFT) studies","Acta Crystallographica Section C","2007","63","6","o340","o342","10.1107/S0108270107020689","","","0.71073","MoKα","","0.0561","0.0443","","","0.105","0.113","","","","","","1.003","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015976","7.8089","0.0012","10.5225","0.0017","12.3618","0.0019","91.787","0.002","91.722","0.002","106.632","0.003","972","0.3","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","(2,2'-biquinoline-κ^2^N,N')bis(dihydrogenphosphato-κO)copper(II)/zinc(II) (0.88/0.12)","","- C18 H16 Cu0.12 N2 O8 P2 Zn0.88 -","- C18 H16 Cu0.12 N2 O8 P2 Zn0.88 -","- C36 H32 Cu0.24 N4 O16 P4 Zn1.76 -","2","1","FA3081","Yanko Moreno; Patricio Hermosilla; María Teresa Garland; Octavio Peña; Ricardo Baggio","Two polymorphic forms of a mixed zinc/copper biquinoline dihydrogenphosphate","Acta Crystallographica Section C","2007","63","6","m249","m252","10.1107/S0108270107020033","","","0.71073","MoKα","","0.0688","0.0573","","","0.1299","0.1356","","","","","","1.137","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015977","9.3801","0.0012","20.528","0.003","10.2991","0.0013","90","","98.791","0.002","90","","1959.8","0.5","295","2","295","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(2,2'-biquinoline-κ^2^N,N')bis(dihydrogenphosphato-κO)copper(II)/zinc(II) (0.90/0.10)","","- C18 H16 Cu0.1 N2 O8 P2 Zn0.9 -","- C18 H16 Cu0.1 N2 O8 P2 Zn0.9 -","- C72 H64 Cu0.4 N8 O32 P8 Zn3.6 -","4","1","FA3081","Yanko Moreno; Patricio Hermosilla; María Teresa Garland; Octavio Peña; Ricardo Baggio","Two polymorphic forms of a mixed zinc/copper biquinoline dihydrogenphosphate","Acta Crystallographica Section C","2007","63","6","m249","m252","10.1107/S0108270107020033","","","0.71073","MoKα","","0.0907","0.0591","","","0.1013","0.1094","","","","","","1.021","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015978","11.9883","0.001","8.9128","0.0005","12.4236","0.0015","90","","90.499","0.008","90","","1327.4","0.2","296","","296","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diaquabis(4-fluorobenzoato-κO)bis(nicotinamide-κN)cobalt(II)","","- C26 H24 Co F2 N4 O8 -","- C26 H24 Co F2 N4 O8 -","- C52 H48 Co2 F4 N8 O16 -","2","0.5","FA3085","Şahin, Onur; Büyükgüngör, Orhan; Köse, Dursun Ali; Ozturkkan, Elif Fureyya; Necefoglu, Hacali","Diaquabis(4-fluorobenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>)cobalt(II)","Acta Crystallographica Section C","2007","63","6","m243","m245","10.1107/S0108270107019750","","","0.71073","MoKα","","0.0487","0.043","","","0.1169","0.121","","","","","","1.062","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2015979","6.2809","0.0005","21.9393","0.0019","9.6452","0.0009","90","","100.495","0.002","90","","1306.9","0.2","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2-Dimethyl-5-nitroso-1,3-dioxan-5-yl benzoate","","- C13 H15 N O5 -","- C13 H15 N O5 -","- C52 H60 N4 O20 -","4","1","GA3047","Calvet, Géraldine; Blanchard, Nicolas; Kouklovsky, Cyrille; Guillot, Régis","2,2-Dimethyl-5-nitroso-1,3-dioxan-5-yl benzoate, 2,2-dimethyl-5-nitroso-1,3-dioxan-5-yl 4-chlorobenzoate and 5-nitroso-1,3-dioxan-5-yl 4-chlorobenzoate","Acta Crystallographica Section C","2007","63","6","o365","o368","10.1107/S0108270107021804","","","0.71073","MoKα","","0.0602","0.0498","","","0.1335","0.1499","","","","","","1.116","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015980","21.716","0.003","6.195","0.0008","20.398","0.002","90","","96.927","0.002","90","","2724.1","0.6","100","1","100","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2,2-Dimethyl-5-nitroso-1,3-dioxan-5-yl 4-chlorobenzoate","","- C13 H14 Cl N O5 -","- C13 H14 Cl N O5 -","- C104 H112 Cl8 N8 O40 -","8","1","GA3047","Calvet, Géraldine; Blanchard, Nicolas; Kouklovsky, Cyrille; Guillot, Régis","2,2-Dimethyl-5-nitroso-1,3-dioxan-5-yl benzoate, 2,2-dimethyl-5-nitroso-1,3-dioxan-5-yl 4-chlorobenzoate and 5-nitroso-1,3-dioxan-5-yl 4-chlorobenzoate","Acta Crystallographica Section C","2007","63","6","o365","o368","10.1107/S0108270107021804","","","0.71073","MoKα","","0.0419","0.0374","","","0.106","0.1103","","","","","","1.088","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015981","9.3969","0.0005","9.4328","0.0005","12.2133","0.0007","90","","90","","90","","1082.58","0.1","100","1","100","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5-nitroso-1,3-dioxan-5-yl 4-chlorobenzoate","","- C11 H11 N O5 -","- C11 H11 N O5 -","- C44 H44 N4 O20 -","4","1","GA3047","Calvet, Géraldine; Blanchard, Nicolas; Kouklovsky, Cyrille; Guillot, Régis","2,2-Dimethyl-5-nitroso-1,3-dioxan-5-yl benzoate, 2,2-dimethyl-5-nitroso-1,3-dioxan-5-yl 4-chlorobenzoate and 5-nitroso-1,3-dioxan-5-yl 4-chlorobenzoate","Acta Crystallographica Section C","2007","63","6","o365","o368","10.1107/S0108270107021804","","","0.71073","MoKα","","0.042","0.0339","","","0.0869","0.0909","","","","","","1.031","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015982","22.9326","0.0011","12.1235","0.0006","7.0111","0.0003","90","","96.707","0.002","90","","1935.91","0.16","93","2","93","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","N^4^-(Pyrrol-1-yl)-1,2,4-triazole","","- C6 H6 N4 -","- C6 H6 N4 -","- C72 H72 N48 -","12","1.5","GA3049","Hellyer, Ryan M.; Joule, John A.; Larsen, David S.; Brooker, Sally","4-(Pyrrol-1-yl)-1,2,4-triazole","Acta Crystallographica Section C","2007","63","6","o358","o360","10.1107/S0108270107020112","","","0.71073","MoKα","","0.0391","0.0356","","","0.0866","0.0893","","","","","","1.102","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2015983","11.0883","0.0019","26.405","0.005","6.801","0.0012","90","","90","","90","","1991.2","0.6","294","2","294","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","poly[[aquastrontium(II)]-μ~6~-4-nitrobenzene-1,3-dicarboxylato- κ^7^<i>O</i>^1^:<i>O</i>^2^:<i>O</i>^2^:<i>O</i>^3^:\ <i>O</i>^3^,<i>O</i>^4^:<i>O</i>^4^]","","- C8 H5 N O7 Sr -","- C8 H5 N O7 Sr -","- C64 H40 N8 O56 Sr8 -","8","1","GA3050","Xiong, Li-Qin; Qi, Chuan-Min","A novel two-dimensional layered framework built of strontium(II) with 4-nitrobenzene-1,3-dicarboxylic acid","Acta Crystallographica Section C","2007","63","6","m246","m248","10.1107/S0108270107020100","","","0.71073","MoKα","","0.0515","0.0363","","","0.0751","0.0806","","","","","","1.15","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015984","6.2254","0.0002","10.7538","0.0003","15.3703","0.0006","98.214","0.001","93.37","0.001","101.247","0.002","994.89","0.06","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","4,4'-(cyclohexane-1,1'-diyl)diphenol‒3-chlorophenol (1/1)","","- C24 H25 Cl O3 -","- C24 H25 Cl O3 -","- C48 H50 Cl2 O6 -","2","1","GD3095","Luigi R. Nassimbeni; Hong Su","Inclusion of chlorophenols by 4,4'-(cyclohexane-1,1-diyl)diphenol: structures and kinetics of decomposition","Acta Crystallographica Section C","2007","63","6","o319","o322","10.1107/S0108270107013352","","","0.71073","MoKα","","0.0792","0.045","","","0.0953","0.1089","","","","","","1.037","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015985","6.2593","0.0002","10.8408","0.0003","15.6476","0.0006","99.705","0.001","92.366","0.001","105.376","0.002","1004.99","0.06","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","4,4'-(cyclohexane-1,1'-diyl)diphenol‒4-chlorophenol (1/1)","","- C24 H25 Cl O3 -","- C24 H25 Cl O3 -","- C48 H50 Cl2 O6 -","2","1","GD3095","Luigi R. Nassimbeni; Hong Su","Inclusion of chlorophenols by 4,4'-(cyclohexane-1,1-diyl)diphenol: structures and kinetics of decomposition","Acta Crystallographica Section C","2007","63","6","o319","o322","10.1107/S0108270107013352","","","0.71073","MoKα","","0.0932","0.047","","","0.1001","0.1185","","","","","","1.028","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015986","15.711","0.007","15.711","0.007","5.792","0.002","90","","90","","120","","1238.1","0.9","298","2","298","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","tripivaloylmethane","4-(2,2-dimethylpropanoyl)-2,2,6,6-tetramethylheptane-3,5-dione","","- C16 H28 O3 -","- C16 H28 O3 -","- C48 H84 O9 -","3","0.166667","GD3098","Branko Kaitner; Vladimir Stilinović","Conformational enantiomeric disorder in tripivaloylmethane","Acta Crystallographica Section C","2007","63","6","o353","o354","10.1107/S0108270107012474","","","0.71073","MoKα","","","0.0749","","","","0.2339","","","","","","1.07","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2015987","7.4829","0.0009","8.4881","0.001","10.9267","0.001","67.172","0.009","88.971","0.008","67.092","0.008","581.93","0.13","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","Poly[[μ~4~-4,4'-bipyridazine-μ~5~-sulfato-disilver(I)] monohydrate]","","- C8 H8 Ag2 N4 O5 S -","- C8 H8 Ag2 N4 O5 S -","- C16 H16 Ag4 N8 O10 S2 -","2","1","GD3101","Domasevitch, Konstantin V.; Gural'skiy, Il'ya A.; Solntsev, Pavlo V.; Rusanov, Eduard B.; Chernega, Alexander N.","Silver(I) sulfate coordination polymers with 4,4'-bipyridazine and pyridazino[4,5-<i>d</i>]pyridazine","Acta Crystallographica Section C","2007","63","6","m259","m263","10.1107/S0108270107021154","","","0.71073","MoKα","","0.0324","0.0278","","","0.072","0.0733","","","","","","1.052","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015988","8.3733","0.0002","8.779","0.0002","8.9006","0.0003","85.927","0.001","74.334","0.002","68.816","0.001","587.14","0.03","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","Poly[[aqua-μ~4~-pyridazino[4,5-d]pyridazine-μ~3~-sulfato-disilver(I)] monohydrate]","","- C6 H8 Ag2 N4 O6 S -","- C6 H8 Ag2 N4 O6 S -","- C12 H16 Ag4 N8 O12 S2 -","2","1","GD3101","Domasevitch, Konstantin V.; Gural'skiy, Il'ya A.; Solntsev, Pavlo V.; Rusanov, Eduard B.; Chernega, Alexander N.","Silver(I) sulfate coordination polymers with 4,4'-bipyridazine and pyridazino[4,5-<i>d</i>]pyridazine","Acta Crystallographica Section C","2007","63","6","m259","m263","10.1107/S0108270107021154","","","0.71073","MoKα","","0.0254","0.0224","","","0.0528","0.0542","","","","","","1.038","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015989","17.418","0.003","13.802","0.0017","14.982","0.006","90","","91.9","0.05","90","","3599.7","1.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-[1,3-Bis(2,4,6-trimethylphenyl)imidazolidin-2- ylidene]dichlorido(triphenylphosphine-κP)palladium(II)","","- C39 H41 Cl2 N2 P Pd -","- C39 H41 Cl2 N2 P Pd -","- C156 H164 Cl8 N8 P4 Pd4 -","4","1","GD3106","Sevinçek, Resul; Türkmen, Hayati; Aygün, Muhittin; Çetinkaya, Bekir; García-Granda, Santiago","<i>trans</i>-[1,3-Bis(2,4,6-trimethylphenyl)imidazolidin-2-ylidene]dichlorido(triphenylphosphine-κ<i>P</i>)palladium(II)","Acta Crystallographica Section C","2007","63","6","m277","m279","10.1107/S0108270107021622","","","0.71073","MoKα","","0.0845","0.0467","","","0.1395","0.1611","","","","","","1.104","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015990","8.7124","0.0006","9.0668","0.0006","11.986","0.0008","84.085","0.001","82.476","0.001","87.554","0.001","933.26","0.11","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","iodido(2,2':6',2''-terpyridine)platinum(II) diiodidoaurate(I)","","- C15 H11 Au I3 N3 Pt -","- C15 H11 Au I3 N3 Pt -","- C30 H22 Au2 I6 N6 Pt2 -","2","1","GG3082","Angle, Christina S.; Woolard, Kathryn J.; Kahn, Michael I.; Golen, James A.; Rheingold, Arnold L.; Doerrer, Linda H.","Metallophilic interactions in iodido(2,2':6',2''-terpyridine)platinum(II) diiodidoaurate(I)","Acta Crystallographica Section C","2007","63","6","m231","m234","10.1107/S0108270107015843","","","0.71073","MoKα","","0.0265","0.0259","","","0.0645","0.0651","","","","","","1.088","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015991","21.585","0.008","14.573","0.004","16.523","0.005","90","","126.013","0.01","90","","4204","2","173","2","173","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Tris(thianthrenediium) bis(dodecamethylcarba-closo-dodecaborate) dichloromethane tetrasolvate","","- C66 H104 B22 Cl8 S6 -","- C66 H104 B22 Cl8 S6 -","- C132 H208 B44 Cl16 S12 -","2","0.25","GG3084","Rosokha, Sergiy V.; Lu, Jianjiang; Rosokha, Tetyana Y.; Kochi, Jay K.","Tris(thianthrene)(2+) bis(dodecamethylcarba-<i>closo</i>-dodecaborate) dichloromethane tetrasolvate: a crossed triple-decker π-trimer dication","Acta Crystallographica Section C","2007","63","6","o347","o349","10.1107/S0108270107018136","","","0.71073","MoKα","","0.056","0.0448","","","0.1328","0.1393","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2015992","11.3324","0.0015","11.3324","0.0015","10.894","0.002","90","","90","","90","","1399","0.4","110","","110","","","","","","","","","5","P 4/n n c :2","-P 4a 2bc","126","","<i>trans</i>-Dichloridotetrakis(3,5-dimethylpyridine)copper(II)","","- C28 H36 Cl2 Cu N4 -","- C28 H36 Cl2 Cu N4 -","- C56 H72 Cl4 Cu2 N8 -","2","0.125","GZ3084","Martone, Daniel P.; Maverick, Andrew W.; Fronczek, Frank R.","<i>trans</i>-Dichloridotetrakis(3,5-dimethylpyridine)copper(II)","Acta Crystallographica Section C","2007","63","6","m238","m239","10.1107/S0108270107018471","","","0.71073","MoKα","","0.044","0.03","","","0.075","0.081","","","","","","1.064","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015993","7.633","0.0015","8.7","0.0017","11.174","0.002","107.86","0.02","96.556","0.007","94.816","0.006","696.1","0.2","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","Poly[propylene-1,3-diammonium [tetra-μ~3~-oxo-hexaoxotrimolybdenum(VI)] dihydrate]","","- C3 H16 Mo3 N2 O12 -","- C3 H16 Mo3 N2 O12 -","- C6 H32 Mo6 N4 O24 -","2","1","GZ3086","Cong Deng; Bi-Zhou Lin; Guo-Hua Han; Ling Bai","Poly[propane-1,3-diammonium [tetra-μ~3~-oxo-hexaoxotrimolybdenum(VI)] dihydrate]","Acta Crystallographica Section C","2007","63","6","m256","m258","10.1107/S0108270107021051","","","0.71073","MoKα","","0.0465","0.0463","","","0.1361","0.1362","","","","","","1.043","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015994","9.4182","0.0015","6.8889","0.0011","9.7931","0.0015","90","","109.448","0.002","90","","599.13","0.16","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dimethyl 2,2'-bipyridine-6,6'-dicarboxylate","","- C14 H12 N2 O4 -","- C14 H12 N2 O4 -","- C28 H24 N4 O8 -","2","0.5","HJ3036","Alexander J. Blake; Neil R. Champness; Pamela V. Mason; Claire Wilson","Dimethyl 2,2'-bipyridine-6,6'-dicarboxylate and bis(dimethyl 2,2'-bipyridine-6,6'-dicarboxylato-κ^2^<i>N</i>,<i>N</i>')copper(I) tetrafluoroborate","Acta Crystallographica Section C","2007","63","6","m280","m282","10.1107/S0108270107020914","","","0.71073","MoKα","","0.0429","0.0375","","","0.109","0.113","","","","","","1.13","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2015995","7.777","0.002","27.434","0.006","13.965","0.003","90","","103.254","0.003","90","","2900.1","1.2","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","bis(dimethyl 2,2'-bipyridine-6,6'-dicarboxylato-κ^2^N,N')copper(I) tetrafluoroborate","","- C28 H24 B Cu F4 N4 O8 -","- C28 H24 B Cu F4 N4 O8 -","- C112 H96 B4 Cu4 F16 N16 O32 -","4","1","HJ3036","Alexander J. Blake; Neil R. Champness; Pamela V. Mason; Claire Wilson","Dimethyl 2,2'-bipyridine-6,6'-dicarboxylate and bis(dimethyl 2,2'-bipyridine-6,6'-dicarboxylato-κ^2^<i>N</i>,<i>N</i>')copper(I) tetrafluoroborate","Acta Crystallographica Section C","2007","63","6","m280","m282","10.1107/S0108270107020914","","","0.71073","MoKα","","0.0925","0.0543","","","0.1201","0.1372","","","","","","1.03","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2015996","10.2192","0.0005","18.3059","0.0013","20.9425","0.0012","90","","94.089","0.004","90","","3907.8","0.4","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2,6-Bis{1-[4- (dimethylamino)phenylimino]ethyl}pyridine)dichlorido(triphenylphosphine- κP)ruthenium(II)","","- C43 H44 Cl2 N5 P Ru -","- C43 H44 Cl2 N5 P Ru -","- C172 H176 Cl8 N20 P4 Ru4 -","4","1","HJ3041","Özdemir, Namık; Dinçer, Muharrem; Dayan, Osman; Çetinkaya, Bekir","(2,6-Bis{1-[4-(dimethylamino)phenylimino]ethyl}pyridine)dichlorido(triphenylphosphine-κ<i>P</i>)ruthenium(II): a zigzag chain of fused centrosymmetric <i>R</i>^2^~2~(12) rings","Acta Crystallographica Section C","2007","63","6","m264","m266","10.1107/S0108270107021610","","","0.71073","MoKα","","0.1315","0.0524","","","0.061","0.0747","","","","","","0.906","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2015997","10.827","0.002","14.932","0.003","15.486","0.003","90","","110.07","0.03","90","","2351.6","0.9","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-amino-<i>N</i>-(2-pyridyl)benzenesulfonamide","","- C11 H11 N3 O2 S -","- C11 H11 N3 O2 S -","- C88 H88 N24 O16 S8 -","8","2","JZ3060","Gelbrich, Thomas; Threlfall, Terence L.; Bingham, Ann L.; Hursthouse, Michael B.","Polymorph VI of sulfapyridine: interpenetrating two- and three-dimensional hydrogen-bonded nets formed from two tautomeric forms","Acta Crystallographica Section C","2007","63","6","o323","o326","10.1107/S0108270107017817","","","0.71073","MoKα","","0.1315","0.0554","","","0.1117","0.1295","","","","","","0.904","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015998","7.358","0.007","9.377","0.003","10.758","0.004","97.53","0.03","97.09","0.03","93.96","0.05","727.5","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-(4-fluorophenyl)-1,5,7-trimethyl-1,2,3,4- tetrahydropyrido[2,3-d]pyrimidine-2,4-dione","","- C16 H14 F N3 O2 -","- C16 H14 F N3 O2 -","- C32 H28 F2 N6 O4 -","2","1","LN3041","Patel, Urmila H.; Patel, Pinal D.; Thakker, Neha","C—H···O hydrogen-bonding and C—H···π interactions in 3-(4-fluorophenyl)-1,5,7-trimethyl-1,2,3,4-tetrahydropyrido[2,3-<i>d</i>]pyrimidine-2,4-dione","Acta Crystallographica Section C","2007","63","6","o337","o339","10.1107/S0108270107017155","","","0.71073","MoKα","","0.0843","0.0535","","","0.1465","0.1671","","","","","","1.031","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2015999","12.2793","0.0016","9.7588","0.0012","18.422","0.002","90","","97.444","0.002","90","","2188.9","0.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tetra-<i>n</i>-butylammonium 4-nitro-5-oxo-2-pentenenitrilate","","- C21 H39 N3 O3 -","- C21 H39 N3 O3 -","- C84 H156 N12 O12 -","4","1","LN3045","Zeller, Matthias; Pett, Virginia B.; Haynes, LeRoy W.","Ring opening of pyridines: the pseudo-<i>cis</i> and pseudo-<i>trans</i> isomers of tetra-<i>n</i>-butylammonium 4-nitro-5-oxo-2-pentenenitrilate","Acta Crystallographica Section C","2007","63","6","o343","o346","10.1107/S0108270107019506","","","0.71073","MoKα","","0.0818","0.0686","","","0.1691","0.1746","","","","","","1.13","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016000","9.7894","0.0009","18.3872","0.0016","12.2327","0.0011","90","","95.894","0.002","90","","2190.2","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tetra-<i>n</i>-butylammonium 4-nitro-5-oxo-2-pentenenitrilate","","- C21 H39 N3 O3 -","- C21 H39 N3 O3 -","- C84 H156 N12 O12 -","4","1","LN3045","Zeller, Matthias; Pett, Virginia B.; Haynes, LeRoy W.","Ring opening of pyridines: the pseudo-<i>cis</i> and pseudo-<i>trans</i> isomers of tetra-<i>n</i>-butylammonium 4-nitro-5-oxo-2-pentenenitrilate","Acta Crystallographica Section C","2007","63","6","o343","o346","10.1107/S0108270107019506","","","0.71073","MoKα","","0.0646","0.0579","","","0.1326","0.1358","","","","","","1.186","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016001","6.126","0.002","8.941","0.006","12.02","0.004","90","","99.68","0.03","90","","649","0.5","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","chlorpropamide","4-chloro-<i>N</i>-(propylaminocarbonyl)benzenesulfonamide","","- C10 H13 Cl N2 O3 S -","- C10 H13 Cl N2 O3 S -","- C20 H26 Cl2 N4 O6 S2 -","2","1","LN3052","Tatiana N. Drebushchak; Nikita V. Chukanov; Elena V. Boldyreva","A new γ-polymorph of chlorpropamide: 4-chloro-<i>N</i>-(propylaminocarbonyl)benzenesulfonamide","Acta Crystallographica Section C","2007","63","6","o355","o357","10.1107/S010827010701952X","","","0.71073","MoKα","","0.1631","0.0753","","","0.1267","0.1631","","","","","","1.174","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016002","12.649","0.003","16.258","0.005","8.756","0.003","90","","90","","90","","1800.6","0.9","295","2","295","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","bis(2-hydroxybenzohydroxamato)dioxouranium(VI) bihydrate","catena-poly[[[dioxouranium(VI)]-bis(μ-2-hydroxybenzohydroxamato)] dihydrate]","","- C14 H16 N2 O10 U -","- C14 H16 N2 O10 U -","- C56 H64 N8 O40 U4 -","4","0.5","LN3054","Roberto Centore; Gaetano De Tommaso; Mauro Iuliano; Angela Tuzi","An organouranium coordination polymer containing infinite metal oxide chains","Acta Crystallographica Section C","2007","63","6","m253","m255","10.1107/S0108270107019798","","","0.71073","MoKα","","0.0998","0.0364","","","0.0622","0.0743","","","","","","0.996","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016003","8.628","0.001","13.516","0.001","13.695","0.001","90","","99.978","0.006","90","","1572.9","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Diaquabis(imidazole)(orotate)cobalt(II)","mer-diaquabis(1H-imidazole-κN^3^)[1,2,3,6-tetrahydro-2,6-dioxopyrimidine- 4-carboxylato(2-)]cobalt(II)","","- C11 H14 Co N6 O6 -","- C11 H14 Co N6 O6 -","- C44 H56 Co4 N24 O24 -","4","1","SF3031","Yeşilel, Okan Zafer; Ölmez, Halis; Arıcı, Cengiz","<i>mer</i>-Diaquabis(1<i>H</i>-imidazole-κ<i>N</i>^3^)[orotato(2‒)]cobalt(II)","Acta Crystallographica Section C","2007","63","6","m240","m242","10.1107/S0108270107018021","","","0.71073","MoKα","","0.0426","0.0377","","","0.1025","0.1054","","","","","","1.109","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016004","7.862","0.005","8.869","0.005","9.479","0.005","90","","100.25","0.03","90","","650.4","0.7","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","violuric acid monohydrate","pyrimidine-2,4,5,6(1H,3H)-tetrone monohydrate","","- C4 H5 N3 O5 -","- C4 H5 N3 O5 -","- C16 H20 N12 O20 -","4","1","SF3032","Guille, Kathy; Harrington, Ross W.; Clegg, William","Violuric acid monohydrate: a second polymorph with more extensive hydrogen bonding","Acta Crystallographica Section C","2007","63","6","o327","o329","10.1107/S010827010701743X","","","0.71073","MoKα","","0.0785","0.045","","","0.104","0.1175","","","","","","1.045","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2016005","12.7929","0.0012","13.4006","0.0012","14.4847","0.0014","90","","90","","90","","2483.1","0.4","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Tetraphenylphosphonium copper(I) dicyanamide","Poly[tetraphenylphosphonium copper(I)-di-μ~2~-dicyanamido]","","- C28 H20 Cu N6 P -","- C28 H20 Cu N6 P -","- C112 H80 Cu4 N24 P4 -","4","1","SF3036","Schlueter, John A.; Geiser, Urs","Poly[tetraphenylphosphonium copper(I)-di-μ~2~-dicyanamido]","Acta Crystallographica Section C","2007","63","6","m235","m237","10.1107/S0108270107015387","","","0.71073","MoKα","","0.0559","0.0388","","","0.0772","0.0827","","","","","","1.031","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016006","11.5681","0.0003","12.0702","0.0003","13.512","0.002","90","","90","","90","","1886.7","0.3","294","2","294","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3,17-Dioxoandrost-4-en-4-yl acetate","","- C21 H28 O4 -","- C21 H28 O4 -","- C84 H112 O16 -","4","1","SK3116","Andrade, L. C. R.; Paixão, J. A.; de Almeida, M. J. M.; Fernandes Roleira, F. M.; Tavares da Silva, E. J.","3,17-Dioxoandrost-4-en-4-yl acetate","Acta Crystallographica Section C","2007","63","6","o330","o331","10.1107/S0108270107015533","","","1.5418","CuKα","","0.0489","0.0291","","","0.0748","0.0884","","","","","","1.092","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016007","8.2779","0.0003","8.4719","0.0006","15.1413","0.0012","90","","95.534","0.006","90","","1056.9","0.12","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-(3-Oxo-1,3-dihydroisobenzofuran-1-ylidene)pentane-2,4-dione","","- C13 H10 O4 -","- C13 H10 O4 -","- C52 H40 O16 -","4","1","SK3122","Portilla, Jaime; Quiroga, Jairo; Cobo, Justo; Low, John N.; Glidewell, Christopher","3-(3-Oxo-1,3-dihydroisobenzofuran-1-ylidene)pentane-2,4-dione","Acta Crystallographica Section C","2007","63","6","o332","o333","10.1107/S0108270107017866","","","0.71073","MoKα","","0.0713","0.0484","","","0.1194","0.1388","","","","","","1.078","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016008","7.901","0.0009","12.7844","0.0013","12.9683","0.0014","91.895","0.002","102.655","0.003","92.167","0.003","1276","0.2","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","1^9^,14-dioxa-1(2,10)-anthracena-2(1,2)-benzenacyclotetradecaphane- 1^7^,3(5^9^H)-dione","","- C31 H32 O5 -","- C31 H32 O5 -","- C62 H64 O10 -","2","1","SQ3058","Dufresne, Stéphane; Pérez Guarìn, Sergio Andrés; Skene, W. G.","A fluoresceinophane: 1^9^,4,16-trioxa-1(2,10)-anthracena-2(1,2)-benzenacyclohexadecaphane-1^7^,3(1^9^<i>H</i>)-dione","Acta Crystallographica Section C","2007","63","6","o350","o352","10.1107/S0108270107008566","","","1.54178","CuKα","","0.0456","0.0413","","","0.125","0.1291","","","","","","1.069","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016009","9.2104","0.0018","9.4058","0.0019","10.225","0.002","75","0.03","75.5","0.03","75.15","0.03","810.8","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","poly[ethylenediammonium [[aquacopper(II)]-μ~4~-benzene-1,2,4,5-tetracarboxylato] dihydrate]","","- C12 H18 Cu N2 O11 -","- C12 H18 Cu N2 O11 -","- C24 H36 Cu2 N4 O22 -","2","1","SQ3073","Luo, Jian-Hai; Huang, Chang-Cang; Huang, Xi-He; Chen, Xiao-Juan","Two pseudo-polymorphic copper‒benzene-1,2,4,5-tetracarboxylate complexes","Acta Crystallographica Section C","2007","63","6","m273","m276","10.1107/S0108270107019853","","","0.71073","MoKα","","0.0283","0.0262","","","0.0712","0.0722","","","","","","1.048","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016010","11.432","0.002","18.484","0.004","7.4981","0.0015","90","","94.8","0.03","90","","1578.9","0.5","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","poly[ethylenediammonium [copper(II)-μ~4~-benzene-1,2,4,5-tetracarboxylato] 2.5-hydrate]","","- C12 H17 Cu N2 O10.5 -","- C12 H17 Cu N2 O10.5 -","- C48 H68 Cu4 N8 O42 -","4","0.5","SQ3073","Luo, Jian-Hai; Huang, Chang-Cang; Huang, Xi-He; Chen, Xiao-Juan","Two pseudo-polymorphic copper‒benzene-1,2,4,5-tetracarboxylate complexes","Acta Crystallographica Section C","2007","63","6","m273","m276","10.1107/S0108270107019853","","","0.71073","MoKα","","0.0524","0.0326","","","0.075","0.0792","","","","","","0.978","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2016011","4.6982","0.0006","9.9532","0.0013","25.719","0.004","90","","90","","90","","1202.7","0.3","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N-(4-Nitrobenzoyl)-N'-phenylhydrazine","N-anilino-4-nitrobenzamide","","- C13 H11 N3 O3 -","- C13 H11 N3 O3 -","- C52 H44 N12 O12 -","4","1","SQ3075","Wardell, James L.; Low, John N.; Glidewell, Christopher","<i>N</i>-(4-Nitrobenzoyl)-<i>N</i>'-phenylhydrazine: a three-dimensional hydrogen-bonded framework","Acta Crystallographica Section C","2007","63","6","o334","o336","10.1107/S0108270107020628","","","0.71073","MoKα","","0.0643","0.0535","","","0.135","0.1485","","","","","","1.104","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016012","13.0552","0.0018","7.0852","0.001","6.7287","0.0013","90","","98.176","0.014","90","","616.07","0.17","293","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","biphenyl-4,4-diphosphonic acid","biphenyl-4,4'-diphosphonic acid","","- C12 H12 O6 P2 -","- C12 H12 O6 P2 -","- C24 H24 O12 P4 -","2","0.5","AV3089","Próchniak, G.; Zoń, J.; Daszkiewicz, M.; Pietraszko, A.; Videnova-Adrabińska, V.","Hydrogen-bonded network in biphenyl-4,4'-diphosphonic acid","Acta Crystallographica Section C","2007","63","7","o434","o436","10.1107/S0108270107025152","","","0.71073","MoKα","","0.0598","0.0358","","","0.0789","0.0877","","","","","","0.976","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016013","30.516","0.005","10.8142","0.0016","17.35","0.003","90","","111.795","0.002","90","","5316.3","1.5","130","","130","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[pentaaquathulium(III)]-μ-5-sulfonatobenzene-1,3-dicarboxylato]- 4,4'-bipyridyl 1.5-solvate hemihydrate]","","- C23 H26 N3 O12.5 S Tm -","- C23 H26 N3 O12.5 S Tm -","- C184 H208 N24 O100 S8 Tm8 -","8","1","AV3091","Yu-Ling Wang; Qing-Yan Liu; Li Xu","<i>catena</i>-Poly[[[pentaaquathulium(III)]-μ-5-sulfonatobenzene-1,3-dicarboxylato] 4,4'-bipyridyl 1.5-solvate hemihydrate]","Acta Crystallographica Section C","2007","63","7","m304","m307","10.1107/S0108270107022470","","","0.71073","MoKα","","0.0249","0.0226","","","0.05","0.0512","","","","","","1.001","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2016014","8.2566","0.0014","20.542","0.003","8.3351","0.0014","90","","102.85","0.004","90","","1378.3","0.4","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","poly[diazidobis[μ-1,4-bis(1,2,4-triazol-1-ylmethyl)benzene- κ^2^N^4^:N^4'^]nickel(II)]","","- C24 H24 N18 Ni -","- C24 H24 N18 Ni -","- C48 H48 N36 Ni2 -","2","0.5","AV3092","Li-Yan Wang; Yan-Fen Peng; Yu-Ping Zhang; Bao-Long Li; Yong Zhang","A novel two-dimensional nickel(II) coordination polymer with 1,4-bis(1,2,4-triazol-1-ylmethyl)benzene and azide ligands","Acta Crystallographica Section C","2007","63","7","m297","m299","10.1107/S0108270107021932","","","0.71073","MoKα","","0.0464","0.0403","","","0.0985","0.1024","","","","","","1.084","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016015","4.7449","0.0006","8.2814","0.0008","10.8351","0.0013","90","","92.941","0.01","90","","425.2","0.08","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","potassium gallium hydrogen phosphate fluoride","dipotassium gallium {hydrogen bis[hydrogenphosphate(V)]} difluoride","","- F2 Ga H3 K2 O8 P2 -","- F2 Ga H3 K2 O8 P2 -","- F4 Ga2 H6 K4 O16 P4 -","2","0.5","BC3042","Filaretov, Andrey; Schenk, Kurt J.; Rusakov, Dmitriy; Chapuis, Gervais","Potassium gallium hydrogenphosphate fluoride, K~2~Ga[H(HPO~4~)~2~]F~2~","Acta Crystallographica Section C","2007","63","7","i54","i56","10.1107/S0108270107025437","","","0.71073","MoKα","","0.0168","0.0156","","","0.0319","0.0333","","","","","","1.23","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2016016","4.9495","0.0006","5.6949","0.0007","14.1692","0.0017","90","","90","","90","","399.39","0.08","293","","293","","","","","","","","","3","P n a b","-P 2bc 2n","60","cadmium vanadate","cadmium divanadium hexaoxide","","- Cd O6 V2 -","- Cd O6 V2 -","- Cd4 O24 V8 -","4","0.5","BC3043","Belik, Alexei A.; Mironov, Andrei V.; Shpanchenko, Roman V.; Takayama-Muromachi, Eiji","The high-pressure form of cadmium vanadate, CdV~2~O~6~","Acta Crystallographica Section C","2007","63","7","i37","i39","10.1107/S0108270107017623","","","0.71069","MoKα","","0.0162","0.0162","","","0.0282","0.0282","","","","","","1.19","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016017","13.1857","0.0005","13.1857","0.0005","13.1857","0.0005","90","","90","","90","","2292.5","0.15","173","2","173","2","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","lead cadmium vanadate garnet","lead cadmium vanadium oxide","","- Cd2 O12 Pb2.63 V3 -","- Cd2 O12 Pb2.625 V3 -","- Cd16 O96 Pb21 V24 -","8","0.0833333","BC3044","Alexander A. Tsirlin; Evgeny V. Dikarev; Yuri A. Velikodny; Roman V. Shpanchenko; Evgeny V. Antipov","Pb~2.63~Cd~2~V~3~O~12~, a cation-deficient garnet-type vanadate","Acta Crystallographica Section C","2007","63","7","i40","i42","10.1107/S0108270107021233","","","0.71073","MoKα","","0.0304","0.0225","","","0.0554","0.0582","","","","","","1.118","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016018","10.5834","0.0003","11.3803","0.0003","11.6367","0.0003","108.682","0.004","103.775","0.002","111.674","0.003","1128.19","0.08","223","2","223","2","","","","","","","","4","P -1","-P 1","2","sodium decavanadate(V) tetrahydrate","poly[[octa-μ-aqua-dodecaaqua-μ-octacosaoxidodecavanadato-hexasodium] tetrahydrate]","","- H48 Na6 O52 V10 -","- H48 Na6 O52 V10 -","- H48 Na6 O52 V10 -","1","0.5","BC3048","Guo, Hong-Xu; Yao, Zhong-Liang","Na~6~(H~2~O)~20~(V~10~O~28~)·4H~2~O, a novel polyvanadate(V) with a three-dimensional framework","Acta Crystallographica Section C","2007","63","7","i51","i53","10.1107/S0108270107025395","","","0.7107","MoKα","","0.0415","0.0331","","","0.0975","0.1039","","","","","","1.009","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016019","9.066","0.0008","9.3077","0.0009","15.921","0.002","86.731","0.001","83.14","0.001","87.931","0.001","1331.1","0.2","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","poly[[[μ~2~-1,3-bis(1H-benzimidazol-2-yl)benzene- κ^2^<i>N</i>^3^:<i>N</i>^3'^](μ~2~-terephthalato- κ^2^<i>O</i>:<i>O</i>')zinc(II)] ethanol solvate]","","- C30 H24 N4 O5 Zn -","- C30 H24 N4 O5 Zn -","- C60 H48 N8 O10 Zn2 -","2","1","BG3037","Meng, Fa-Yan; Liu, Xu-Qing; Ng, Seik Weng","The honeycomb network structure of poly[[[μ~2~-1,3-bis(1<i>H</i>-benzimidazol-2-yl)benzene-κ^2^<i>N</i>^3^:<i>N</i>^3'^](μ~2~-terephthalato-κ^2^<i>O</i>:<i>O</i>')zinc(II)] ethanol solvate]","Acta Crystallographica Section C","2007","63","7","m341","m342","10.1107/S0108270107027436","","","0.71073","MoKα","","0.045","0.035","","","0.092","0.098","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016020","9.9239","0.0011","16.5696","0.0019","13.9248","0.0016","90","","103.229","0.002","90","","2229","0.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di-μ-hydroxo-bis{[bis(6-methyl-2-pyridylmethyl)(2-phenylethyl)amine- κ^3^N',N'',N''']copper(II)} bis(perchlorate)","","- C44 H52 Cl2 Cu2 N6 O10 -","- C44 H52 Cl2 Cu2 N6 O10 -","- C88 H104 Cl4 Cu4 N12 O20 -","2","0.5","BG3038","García, Ana María; Manzur, Jorge; Vega, Andrés","Di-μ-hydroxido-bis{[bis(6-methyl-2-pyridylmethyl)(2-phenylethyl)amine-κ^3^<i>N</i>',<i>N</i>'',<i>N</i>''']copper(II)} bis(perchlorate)","Acta Crystallographica Section C","2007","63","7","m335","m337","10.1107/S0108270107025929","","","0.71073","MoKα","","0.0734","0.0514","","","0.1227","0.1366","","","","","","1.002","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016021","9.7668","0.0008","10.8005","0.0009","12.0272","0.001","68.417","0.005","68.415","0.005","84.837","0.006","1095.51","0.17","153","2","153","1","","","","","","","","3","P -1","-P 1","2","","(<i>E</i>)-3'-[2-(anthracen-9-yl)ethenyl]-2,2':5',2''-terthiophene","","- C28 H18 S3 -","- C28 H18 S3 -","- C56 H36 S6 -","2","1","DN3048","Wagner, Paweł; Officer, David L.; Kubicki, Maciej","Flip-type disorder in 3-substituted 2,2':5',2''-terthiophenes","Acta Crystallographica Section C","2007","63","7","o400","o404","10.1107/S0108270107024699","","","0.71073","MoKα","","0.084","0.0536","","","0.1262","0.1397","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016022","9.7382","0.0011","11.7143","0.0012","11.8447","0.0012","61.244","0.008","78.532","0.008","72.307","0.007","1126.3","0.2","153","1","153","1","","","","","","","","3","P -1","-P 1","2","","(<i>E</i>)-3'-[2-(1-pyrenyl)ethenyl]-2,2':5',2''-terthiophene","","- C30 H18 S3 -","- C30 H18 S3 -","- C60 H36 S6 -","2","1","DN3048","Wagner, Paweł; Officer, David L.; Kubicki, Maciej","Flip-type disorder in 3-substituted 2,2':5',2''-terthiophenes","Acta Crystallographica Section C","2007","63","7","o400","o404","10.1107/S0108270107024699","","","0.71073","MoKα","","0.0584","0.0434","","","0.0961","0.1033","","","","","","1.034","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016023","18.934","0.001","27.268","0.005","7.5192","0.0007","90","","91.84","0.01","90","","3880.1","0.8","153","1","153","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-3'-[2-(3,4-dimethoxyphenyl)ethenyl]-2,2':5',2''-terthiophene","","- C22 H18 O2 S3 -","- C22 H18 O2 S3 -","- C176 H144 O16 S24 -","8","2","DN3048","Wagner, Paweł; Officer, David L.; Kubicki, Maciej","Flip-type disorder in 3-substituted 2,2':5',2''-terthiophenes","Acta Crystallographica Section C","2007","63","7","o400","o404","10.1107/S0108270107024699","","","0.71073","MoKα","","0.0648","0.0442","","","0.0892","0.096","","","","","","1.082","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016024","9.341","0.001","36.688","0.003","10.097","0.002","90","","115.36","0.01","90","","3126.8","0.8","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>,<i>E</i>)-1,4-bis[2-(2,2':5',2''-terthiophen-3'-yl)ethenyl]-2,5- dimethoxybenzene","","- C36 H26 O2 S6 -","- C36 H26 O2 S6 -","- C144 H104 O8 S24 -","4","1","DN3048","Wagner, Paweł; Officer, David L.; Kubicki, Maciej","Flip-type disorder in 3-substituted 2,2':5',2''-terthiophenes","Acta Crystallographica Section C","2007","63","7","o400","o404","10.1107/S0108270107024699","","","0.71073","MoKα","","0.1433","0.071","","","0.1227","0.1394","","","","","","1.089","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016025","16.726","0.0004","5.1384","0.0001","14.0045","0.0005","90","","93.1793","0.0013","90","","1201.76","0.06","90","0.2","90","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(4-Methoxy-3-nitrobenzylideneamino)guanidinium chloride","","- C9 H12 Cl N5 O3 -","- C9 H12 Cl N5 O3 -","- C36 H48 Cl4 N20 O12 -","4","1","FA3076","Ring, Joshua R.; Parkin, Sean; Crooks, Peter A.","(4-Methoxy-3-nitrobenzylideneamino)guanidinium chloride","Acta Crystallographica Section C","2007","63","7","o392","o394","10.1107/S0108270107023475","","","0.71073","MoKα","","0.055","0.041","","","0.102","0.111","","","","","","1.07","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016026","11.9893","0.0003","17.348","0.0004","8.6266","0.0002","90","","90","","90","","1794.25","0.07","293","2","293","2","","","","","","","","4","C m c 21","C 2c -2","36","","bis[dicyanidomercury(II)] pyrene solvate","","- C20 H10 Hg2 N4 -","- C20 H10 Hg2 N4 -","- C80 H40 Hg8 N16 -","4","0.5","FA3083","Gervasio, Giuliana; Marabello, Domenica","Mercuric cyanide as a receptor of pyrene","Acta Crystallographica Section C","2007","63","7","m318","m320","10.1107/S0108270107023463","","","0.71073","MoKα","","0.0239","0.0211","","","0.0432","0.044","","","","","","1.006","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016027","11.3391","0.0006","11.3391","0.0006","4.6371","0.0002","90","","90","","90","","596.22","0.05","295","2","","","","","","","","","","3","P -4 b 2","P -4 -2ab","117","","dicalcium heptagermanate","","- Ca2 Ge7 O16 -","- Ca2 Ge7 O16 -","- Ca4 Ge14 O32 -","2","0.25","FA3088","Redhammer, Günther J.; Roth, Georg; Amthauer, Georg","Dicalcium heptagermanate Ca~2~Ge~7~O~16~ revised","Acta Crystallographica Section C","2007","63","7","i47","i50","10.1107/S010827010702269X","","","0.71073","MoKα","","","0.0227","","","","0.0568","","","","","","1.148","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016028","9.3231","0.0017","26.611","0.006","18.218","0.004","90","","91.596","0.007","90","","4518.1","1.6","158","2","158","2","","","","","","","","8","P 1 21 1","P 2yb","4","","[1L-3,4-Bis(O-diphenylphosphino)-1,2,5,6-tetra-O-methyl-chiro-inositol- κ^2^P,P'][η^4^-(Z,Z)-cycloocta-1,5-diene]rhodium(I) tetrafluoroborate chloroform solvate","","- C43 H51 B Cl3 F4 O6 P2 Rh -","- C43 H51 B Cl3 F4 O6 P2 Rh -","- C172 H204 B4 Cl12 F16 O24 P8 Rh4 -","4","2","FA3095","Gainsford, Graeme J.; Lensink, Cees; Falshaw, Andrew F.","[1<small>L</small>-3,4-Bis-<i>O</i>-(diphenylphosphino)-1,2,5,6-tetra-<i>O</i>-methyl-<i>chiro</i>-inositol-κ^2^<i>P</i>,<i>P</i>'][η^4^-(<i>Z</i>,<i>Z</i>)-cycloocta-1,5-diene]rhodium(I) tetrafluoridoborate chloroform solvate","Acta Crystallographica Section C","2007","63","7","m331","m334","10.1107/S0108270107026170","","","0.71073","MoKα","","0.0769","0.0635","","","0.1419","0.1502","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016029","14.8424","0.0007","11.6735","0.0005","22.0589","0.001","90","","99.416","0.001","90","","3770.5","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","κ^3^-(^tBu^PCPIrH)-(μ~2~Cl)~2~-η^4^-Ir(COD)","[2,6-bis(di-tert-butylphosphino)phenyl-1κ^3^P,C^1^,P']di-μ-chlorido- 1:2κ^4^Cl:Cl-(2η^4^-cycloocta-2,5-diene)diiridium(I,III) hexane hemisolvate","","- C35 H63 Cl2 Ir2 P2 -","- C35 H63 Cl2 Ir2 P2 -","- C140 H252 Cl8 Ir8 P8 -","4","1","GA3042","Pelczar, Elizabeth M.; Emge, Thomas J.; Goldman, Alan S.","A mixed-valence chloride-bridged (pincer)Ir^III^‒(diene)Ir^I^ complex","Acta Crystallographica Section C","2007","63","7","m323","m326","10.1107/S0108270107022378","","","0.71073","MoKα","","0.0317","0.0263","","","0.0603","0.0622","","","","","","1.003","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016030","9.3064","0.0002","25.5909","0.0009","13.0271","0.0004","90","","90.306","0.002","90","","3102.48","0.16","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>,<i>N</i>-Bis(5-<i>tert</i>-butyl-2-hydroxy-3-methylbenzyl)-<i>N</i>- (6-hydroxyhexyl)ammonium chloride monohydrate","","- C30 H50 Cl N O4 -","- C30 H50 Cl N O4 -","- C120 H200 Cl4 N4 O16 -","4","1","GA3048","Sopo, Harri; Sillanpää, Reijo","Bis(5-<i>tert</i>-butyl-2-hydroxy-3-methylbenzyl)(6-hydroxyhexyl)ammonium chloride monohydrate, an anion receptor complex","Acta Crystallographica Section C","2007","63","7","o386","o388","10.1107/S0108270107023797","","","0.71073","MoKα","","0.0784","0.0495","","","0.1076","0.1204","","","","","","1.034","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016031","12.937","0.005","13.186","0.005","13.815","0.006","87.3","0.005","70.756","0.005","68.719","0.005","2066.2","1.4","168","2","168","2","","","","","","","","4","P -1","-P 1","2","","Octakis(pyrazol-1-ylmethyl)biphenylene ethanol solvate","","- C46 H46 N16 O -","- C46 H46 N16 O -","- C92 H92 N32 O2 -","2","1","GA3053","Steel, Peter J.; McMorran, David A.","Octasubstituted biphenylenes: is there a favoured conformation?","Acta Crystallographica Section C","2007","63","7","o382","o385","10.1107/S0108270107022779","","","0.71073","MoKα","","0.0802","0.0503","","","0.1131","0.1264","","","","","","1.033","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016032","4.7805","0.001","10.303","0.002","21.678","0.005","88.886","0.004","87.595","0.003","83.239","0.004","1059.2","0.4","294","2","294","2","","","","","","","","4","P -1","-P 1","2","Adeninium phenylacetate phenylacetic acid hydrate","adeninium phenylacetate phenylacetic acid monohydrate","","- C21 H23 N5 O5 -","- C21 H23 N5 O5 -","- C42 H46 N10 O10 -","2","1","GA3054","Balasubramanian Sridhar; Krishnan Ravikumar","Supramolecular hydrogen-bonded networks in adeninium phenylacetate phenylacetic acid monohydrate and adeninium 3-carboxypropionate monohydrate","Acta Crystallographica Section C","2007","63","7","o415","o418","10.1107/S0108270107024493","","","0.71073","MoKα","","0.0636","0.0464","","","0.12","0.1307","","","","","","1.047","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016033","9.539","0.003","17.149","0.006","7.45","0.003","90","","100.503","0.005","90","","1198.3","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Adeninium succinate hydrate","adeninium 3-carboxypropionate monohydrate","","- C9 H11 N5 O5 -","- C9 H11 N5 O5 -","- C36 H44 N20 O20 -","4","1","GA3054","Balasubramanian Sridhar; Krishnan Ravikumar","Supramolecular hydrogen-bonded networks in adeninium phenylacetate phenylacetic acid monohydrate and adeninium 3-carboxypropionate monohydrate","Acta Crystallographica Section C","2007","63","7","o415","o418","10.1107/S0108270107024493","","","0.71073","MoKα","","0.0461","0.0438","","","0.1199","0.124","","","","","","1.156","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016034","8.9097","0.0008","11.0904","0.0008","12.7489","0.0014","100.643","0.005","109.694","0.004","94.49","0.003","1152.13","0.19","85","2","85","2","","","","","","","","5","P -1","-P 1","2","","(η^5^-Cyclopentadienyl)(3-hydroxy-3-methylbut-1-ynyl- κC^1^)(triphenylphosphine-κP)nickel(II)","","- C28 H27 Ni O P -","- C28 H27 Ni O P -","- C56 H54 Ni2 O2 P2 -","2","1","GA3055","McAdam, C. John; Robinson, Brian H.; Simpson, Jim","(η^5^-Cyclopentadienyl)(3-hydroxy-3-methylbut-1-ynyl-κ<i>C</i>^1^)(triphenylphosphine-κ<i>P</i>)nickel(II): novel O—H···π bonding in an organometallic molecule","Acta Crystallographica Section C","2007","63","7","m338","m340","10.1107/S0108270107026522","","","0.71073","MoKα","","0.073","0.0601","","","0.1691","0.1855","","","","","","1.055","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016035","4.2629","0.0001","9.5372","0.0005","13.9639","0.0009","102.562","0.005","91.055","0.007","101.331","0.007","542.22","0.05","298","2","298","2","","","","","","","","5","P -1","-P 1","2","cytosine‒5-fluorouracil‒water (1/1/1)","4-amino-2-hydroxypyrimidine‒2,4-dihydroxy-5-fluoropyrimidine‒water (1/1/1)","","- C8 H10 F N5 O4 -","- C8 H8 F N5 O4 -","- C16 H16 F2 N10 O8 -","2","1","GD3108","Gustavo Portalone; Marcello Colapietro","The 1:1 complex of cytosine and 5-fluorouracil monohydrate revisited","Acta Crystallographica Section C","2007","63","7","o423","o425","10.1107/S0108270107026649","","","0.71069","MoKα","","0.1183","0.0467","","","0.1424","0.1485","","","","","","1.032","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016036","31.0164","0.0003","8.5897","0.0011","15.1952","0.0006","90","","90","","90","","4048.3","0.5","110","2","110","2","","","","","","","","4","C m c a","-C 2ac 2","64","porphyrin-5^4^,10^4^,15^4^,20^4^-tetrabenzoic acid","meso-5,10,15,20-tetrakis(4-carboxyphenyl)porphyrin","","- C48 H30 N4 O8 -","- C48 H30 N4 O8 -","- C192 H120 N16 O32 -","4","","GD3109","Sophia Lipstman; Sankar Muniappan; Israel Goldberg","Interwoven hydrogen-bonded network assembly and supramolecular isomerism of <i>meso</i>-5,10,15,20-tetrakis(4-carboxyphenyl)porphyrin as its dimethylformamide solvate","Acta Crystallographica Section C","2007","63","7","o371","o373","10.1107/S0108270107020975","","","0.71073","MoKα","","0.0745","0.0586","","","0.1322","0.1383","","","","","","1.128","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016037","20.0518","0.0013","7.3138","0.0004","15.251","0.001","90","","115.969","0.001","90","","2010.8","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetraethylammonium dihydrogenarsenate bis(arsenic acid) and 1,4-diazoniabicyclo[2.2.2]octane bis(dihydrogenarsenate) arsenic acid. ?","","- C8 H28 As3 N O12 -","- C8 H28 As3 N O12 -","- C32 H112 As12 N4 O48 -","4","0.5","GD3110","Lee, Clare; Harrison, William T. A.","Tetraethylammonium dihydrogenarsenate bis(arsenic acid) and 1,4-diazoniabicyclo[2.2.2]octane bis(dihydrogenarsenate) arsenic acid: hydrogen-bonded networks containing dihydrogenarsenate anions and neutral arsenic acid molecules","Acta Crystallographica Section C","2007","63","7","m308","m311","10.1107/S0108270107023967","","","0.71073","MoKα","","0.0616","0.0308","","","0.0593","0.0657","","","","","","0.861","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016038","8.1285","0.0003","22.2104","0.0009","10.0056","0.0004","90","","107.637","0.001","90","","1721.47","0.12","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,4-diazoniabicyclo[2.2.2]octane bis(dihydrogenarsenate) arsenic acid","","- C6 H21 As3 N2 O12 -","- C6 H21 As3 N2 O12 -","- C24 H84 As12 N8 O48 -","4","1","GD3110","Lee, Clare; Harrison, William T. A.","Tetraethylammonium dihydrogenarsenate bis(arsenic acid) and 1,4-diazoniabicyclo[2.2.2]octane bis(dihydrogenarsenate) arsenic acid: hydrogen-bonded networks containing dihydrogenarsenate anions and neutral arsenic acid molecules","Acta Crystallographica Section C","2007","63","7","m308","m311","10.1107/S0108270107023967","","","0.71073","MoKα","","0.0532","0.028","","","0.052","0.0561","","","","","","0.886","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016039","11.2488","0.0005","14.6091","0.0007","10.6711","0.0005","90","","90","","90","","1753.63","0.14","150","2","150","2","","","","","","","","8","P 21 21 2","P 2 2ab","18","","cis-Dicarbonyl-cis-dichlorido-trans-bis(triphenylphosphine-κP)iridium(III) tetrafluoroborate","","- C38 H30 B Cl2 F4 Ir O2 P2 -","- C38 H30 B Cl2 F4 Ir O2 P2 -","- C76 H60 B2 Cl4 F8 Ir2 O4 P4 -","2","0.5","GD3114","Harding, Duncan A. J.; Hope, Eric G.; Solan, Gregory A.; Fawcett, John","<i>cis</i>-Dicarbonyl-<i>cis</i>-dichlorido-<i>trans</i>-bis(triphenylphosphine-κ<i>P</i>)iridium(III) tetrafluoridoborate, formed by reaction of (cycloocta-1,5-diene)bis(triphenylphosphine)iridium tetrafluoridoborate with carbonyl fluoride in dichloromethane solution","Acta Crystallographica Section C","2007","63","7","m321","m322","10.1107/S0108270107025358","","","0.71073","MoKα","","0.0232","0.0222","","","0.0455","0.0458","","","","","","0.99","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016040","11.882","0.007","15.518","0.005","20.637","0.008","90","","90","","90","","3805","3","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Poly[[aquabis(μ~2~-isonicotinato-κ^3^N:O,O')cadmium(II)] 1,4-di-3-pyridyl-2,3-diaza-1,3-butadiene hemisolvate]","","- C18 H15 Cd N4 O5 -","- C72 H60 Cd4 N16 O20 -","- C144 H120 Cd8 N32 O40 -","2","0.25","GD3116","Juan Granifo; Ricardo Baggio","Poly[[aquabis(μ~2~-isonicotinato-κ^3^<i>N</i>:<i>O</i>,<i>O</i>')cadmium(II)] 1,4-di-3-pyridyl-2,3-diaza-1,3-butadiene hemisolvate]","Acta Crystallographica Section C","2007","63","7","m327","m330","10.1107/S0108270107026698","","","0.71073","MoKα","","0.1573","0.0571","","","0.1446","0.1861","","","","","","0.997","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2016041","7.9749","0.0002","7.9205","0.0002","13.3152","0.0003","90","","90","","90","","841.06","0.04","291","0.3","291","0.3","","","","","","","","5","P n m a","-P 2ac 2n","62","dibromantin","1,3-Dibromo-5,5-dimethyl-2,4-imidazolidinedione","","- C5 H6 Br2 N2 O2 -","- C5 H6 Br2 N2 O2 -","- C20 H24 Br8 N8 O8 -","4","0.5","GG3081","Kruszynski, Rafal","Short intermolecular N—Br···O=C contacts in 1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione","Acta Crystallographica Section C","2007","63","7","o389","o391","10.1107/S0108270107013868","","","0.71073","MoKα","","0.018","0.0162","","","0.039","0.04","","","","","","1.118","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016042","7.9604","0.0001","23.057","0.003","13.227","0.002","90","","90","","90","","2427.7","0.5","120","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Acetato(<i>N</i>-phenylpyridine-2-carboxamidato-κ^2^N,N)(<i>N</i>- phenylpyridine-2-carboxamideκ^2^N^1^,O)copper(II)","","- C26 H22 Cu N4 O4 -","- C26 H22 Cu N4 O4 -","- C104 H88 Cu4 N16 O16 -","4","1","GG3093","Gomes, Ligia; Low, John Nicolson; Valente, Mário A. D. C.; Freire, Cristina; Castro, Baltazar","Acetato(<i>N</i>-phenylpyridine-2-carboxamidato-κ^2^<i>N</i>,<i>N</i>)(<i>N</i>-phenylpyridine-2-carboxamide-κ^2^<i>N</i>^1^,<i>O</i>)copper(II)","Acta Crystallographica Section C","2007","63","7","m293","m296","10.1107/S0108270107023414","","","0.71073","MoKα","","0.0575","0.0349","","","0.0808","0.0883","","","","","","1.03","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016043","24.855","0.004","7.6825","0.0011","19.455","0.003","90","","118.824","0.002","90","","3254.6","0.9","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-(2-hydroxyphenyl)-2-phenyl-2,3-dihydro-1<i>H</i>-1,5-benzodiazepine","","- C21 H18 N2 O -","- C21 H18 N2 O -","- C168 H144 N16 O8 -","8","1","GG3095","Escobar, Carlos A.; Donoso-Tauda, Oscar; Araya-Maturana, Ramiro; Vega, Andrés","4-(2-Hydroxyphenyl)-2-phenyl-2,3-dihydro-1<i>H</i>-1,5-benzodiazepine and the 2-(2,3-dimethoxyphenyl)-, 2-(3,4-dimethoxyphenyl)- and 2-(2,5-dimethoxyphenyl)-substituted derivatives","Acta Crystallographica Section C","2007","63","7","o426","o430","10.1107/S0108270107024420","","","0.71073","MoKα","","0.1064","0.0549","","","0.1207","0.1393","","","","","","1.016","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016044","8.25","0.002","9.889","0.003","12.272","0.003","108.697","0.004","90.973","0.005","90.594","0.005","948.1","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2-(2,3-dimethoxyphenyl)-4-(2-hydroxyphenyl)-2,3-dihydro-1<i>H</i>-1,5- benzodiazepine","","- C23 H22 N2 O3 -","- C23 H22 N2 O3 -","- C46 H44 N4 O6 -","2","1","GG3095","Escobar, Carlos A.; Donoso-Tauda, Oscar; Araya-Maturana, Ramiro; Vega, Andrés","4-(2-Hydroxyphenyl)-2-phenyl-2,3-dihydro-1<i>H</i>-1,5-benzodiazepine and the 2-(2,3-dimethoxyphenyl)-, 2-(3,4-dimethoxyphenyl)- and 2-(2,5-dimethoxyphenyl)-substituted derivatives","Acta Crystallographica Section C","2007","63","7","o426","o430","10.1107/S0108270107024420","","","0.71073","MoKα","","0.1319","0.0619","","","0.144","0.1793","","","","","","0.976","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016045","5.5372","0.0008","23.144","0.003","15.131","0.002","90","","99.52","0.003","90","","1912.4","0.4","300","2","300","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(3,4-dimethoxyphenyl)-4-(2-hydroxyphenyl)-2,3-dihydro-1<i>H</i>-1,5- benzodiazepine","","- C23 H22 N2 O3 -","- C23 H22 N2 O3 -","- C92 H88 N8 O12 -","4","1","GG3095","Escobar, Carlos A.; Donoso-Tauda, Oscar; Araya-Maturana, Ramiro; Vega, Andrés","4-(2-Hydroxyphenyl)-2-phenyl-2,3-dihydro-1<i>H</i>-1,5-benzodiazepine and the 2-(2,3-dimethoxyphenyl)-, 2-(3,4-dimethoxyphenyl)- and 2-(2,5-dimethoxyphenyl)-substituted derivatives","Acta Crystallographica Section C","2007","63","7","o426","o430","10.1107/S0108270107024420","","","0.71073","MoKα","","0.1795","0.0864","","","0.1349","0.1667","","","","","","1.044","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016046","10.5071","0.0003","20.3901","0.0006","8.728","0.0003","90","","102.39","0.002","90","","1826.34","0.1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(2,5-dimethoxyphenyl)-4-(2-hydroxyphenyl)-2,3-dihydro-1<i>H</i>-1,5- benzodiazepine","","- C23 H22 N2 O3 -","- C23 H22 N2 O3 -","- C92 H88 N8 O12 -","4","1","GG3095","Escobar, Carlos A.; Donoso-Tauda, Oscar; Araya-Maturana, Ramiro; Vega, Andrés","4-(2-Hydroxyphenyl)-2-phenyl-2,3-dihydro-1<i>H</i>-1,5-benzodiazepine and the 2-(2,3-dimethoxyphenyl)-, 2-(3,4-dimethoxyphenyl)- and 2-(2,5-dimethoxyphenyl)-substituted derivatives","Acta Crystallographica Section C","2007","63","7","o426","o430","10.1107/S0108270107024420","","","0.71073","MoKα","","0.0506","0.0385","","","0.1108","0.1258","","","","","","1.103","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016047","37.782","0.002","9.2996","0.0004","18.4055","0.0012","90","","93.067","0.005","90","","6457.6","0.6","100","","100","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","4-Amino-3,5-diethyl-4<i>H</i>-1,2,4-triazole","","- C6 H12 N4 -","- C6 H12 N4 -","- C192 H384 N128 -","32","4","GZ3081","Şahin, Onur; Büyükgüngör, Orhan; Şaşmaz, Selami; Gümrükçüoǧlu, Nurhan; Kantar, Cihan","4-Amino-3,5-diethyl-4<i>H</i>-1,2,4-triazole at 100K: chains of edge-fused <i>R</i>~4~^4^(10) and <i>R</i>~4~^4^(20) rings","Acta Crystallographica Section C","2007","63","7","o431","o433","10.1107/S0108270107026339","","","0.71073","MoKα","","0.0508","0.0354","","","0.085","0.0908","","","","","","1.042","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016048","7.8995","0.0008","9.5228","0.001","21.093","0.002","90","","90","","90","","1586.7","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","6,7,9,10,17,18-hexahydro-5H,11H-8,16,19-trioxa-5,11- diazadibenzo[a,g]cyclopentadecene","","- C18 H22 N2 O3 -","- C18 H22 N2 O3 -","- C72 H88 N8 O12 -","4","1","GZ3082","Smith, Gary L. N.; Powell, Douglas R.; Khan, Masood A.; Taylor, Richard W.","Three related benzoannelated diazapolyether macrocycles: effects of macrocycle ring size and position of benzo groups on hydrogen bonding of the amine H atoms","Acta Crystallographica Section C","2007","63","7","o378","o381","10.1107/S0108270107022160","","","0.71073","MoKα","","0.0261","0.0258","","","0.0708","0.071","","","","","","1.069","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016049","11.837","0.002","18.116","0.003","9.2565","0.0018","90","","109.485","0.005","90","","1871.3","0.6","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","6,7,9,10,12,13,20,21-octahydro-5H,14H-8,11,19,22-tetraoxa- 5,14-diazadibenzo[a,g]cyclooctadecene","","- C20 H26 N2 O4 -","- C20 H26 N2 O4 -","- C80 H104 N8 O16 -","4","0.5","GZ3082","Smith, Gary L. N.; Powell, Douglas R.; Khan, Masood A.; Taylor, Richard W.","Three related benzoannelated diazapolyether macrocycles: effects of macrocycle ring size and position of benzo groups on hydrogen bonding of the amine H atoms","Acta Crystallographica Section C","2007","63","7","o378","o381","10.1107/S0108270107022160","","","0.71073","MoKα","","0.035","0.0334","","","0.0889","0.0908","","","","","","1.002","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016050","13.507","0.008","5.133","0.003","14.644","0.008","90","","112.336","0.009","90","","939.1","0.9","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","6,7,9,10,17,18,20,21-octahydro-16H,22H-5,8,11,19-tetraoxa-16,22- diazadibenzo[a,j]cyclooctadecene 0.3-hydrate","","- C20 H26.608 N2 O4.304 -","- C20 H26.608 N2 O4.304 -","- C40 H53.216 N4 O8.608 -","2","1","GZ3082","Smith, Gary L. N.; Powell, Douglas R.; Khan, Masood A.; Taylor, Richard W.","Three related benzoannelated diazapolyether macrocycles: effects of macrocycle ring size and position of benzo groups on hydrogen bonding of the amine H atoms","Acta Crystallographica Section C","2007","63","7","o378","o381","10.1107/S0108270107022160","","","0.71073","MoKα","","0.1141","0.0532","","","0.0804","0.0954","","","","","","1.003","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016051","13.8094","0.0007","7.4331","0.0004","16.1484","0.0009","90","","98.43","0.003","90","","1639.67","0.15","240","2","240","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","α-Tris(pentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III)","","- C15 H21 Co O6 -","- C15 H21 Co O6 -","- C60 H84 Co4 O24 -","4","1","GZ3091","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","α-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III) at 240, 210, 180, 150 and 110K","Acta Crystallographica Section C","2007","63","7","m283","m288","10.1107/S0108270107022950","","","0.71073","MoKα","","0.0785","0.0398","","","0.0786","0.091","","","","","","1.036","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016052","13.7708","0.0008","7.4195","0.0003","16.1242","0.0007","90","","98.455","0.002","90","","1629.54","0.14","210","2","210","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","α-Tris(pentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III)","","- C15 H21 Co O6 -","- C15 H21 Co O6 -","- C60 H84 Co4 O24 -","4","1","GZ3091","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","α-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III) at 240, 210, 180, 150 and 110K","Acta Crystallographica Section C","2007","63","7","m283","m288","10.1107/S0108270107022950","","","0.71073","MoKα","","0.0698","0.0388","","","0.0776","0.0873","","","","","","1.067","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016053","13.7338","0.0006","7.407","0.0003","16.0959","0.0007","90","","98.467","0.001","90","","1619.53","0.12","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","α-Tris(pentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III)","","- C15 H21 Co O6 -","- C15 H21 Co O6 -","- C60 H84 Co4 O24 -","4","1","GZ3091","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","α-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III) at 240, 210, 180, 150 and 110K","Acta Crystallographica Section C","2007","63","7","m283","m288","10.1107/S0108270107022950","","","0.71073","MoKα","","0.0634","0.036","","","0.0708","0.0792","","","","","","1.041","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016054","13.6927","0.0006","7.392","0.0003","16.0641","0.0006","90","","98.499","0.002","90","","1608.1","0.11","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","α-Tris(pentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III)","","- C15 H21 Co O6 -","- C15 H21 Co O6 -","- C60 H84 Co4 O24 -","4","1","GZ3091","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","α-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III) at 240, 210, 180, 150 and 110K","Acta Crystallographica Section C","2007","63","7","m283","m288","10.1107/S0108270107022950","","","0.71073","MoKα","","0.0585","0.0345","","","0.0725","0.08","","","","","","1.026","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016055","13.6376","0.0005","7.3758","0.0003","16.0446","0.0009","90","","98.594","0.002","90","","1595.78","0.13","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","α-Tris(pentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III)","","- C15 H21 Co O6 -","- C15 H21 Co O6 -","- C60 H84 Co4 O24 -","4","1","GZ3091","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","α-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')cobalt(III) at 240, 210, 180, 150 and 110K","Acta Crystallographica Section C","2007","63","7","m283","m288","10.1107/S0108270107022950","","","0.71073","MoKα","","0.0421","0.0288","","","0.0612","0.0654","","","","","","1.064","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016056","9.6834","0.0006","14.296","0.0008","22.297","0.0013","92.389","0.002","99.896","0.003","92.476","0.002","3034.1","0.3","120","0.2","120","0.2","","","","","","","","5","P -1","-P 1","2","","2,12-Dichloro-10,20-diphenyl-5,7,15,17-tetrahydro-6<i>H</i>,16<i>H</i>- dibenzo[d,l][1,9,2,6,10,14]dioxotetraazacyclohexadecine-6,16-dione dioxane solvate","","- C34 H30 Cl2 N4 O6 -","- C34 H30 Cl2 N4 O6 -","- C136 H120 Cl8 N16 O24 -","4","2","LN3049","Khrustalev, Victor N.; Komissarov, Eugene A.; Kulikov, Oleg V.","2,12-Dichloro-10,20-diphenyl-5,7,15,17-tetrahydro-6<i>H</i>,16<i>H</i>-dibenzo[<i>d</i>,<i>l</i>][1,9,2,6,10,14]dioxotetraazacyclohexadecine-6,16-dione dioxane solvate as a potential macrocyclic hexadentate ligand","Acta Crystallographica Section C","2007","63","7","o374","o377","10.1107/S0108270107021415","","","0.71073","MoKα","","0.0725","0.0459","","","0.1065","0.1261","","","","","","1.021","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016057","4.8983","0.0002","22.8232","0.0013","12.5799","0.0009","90","","104.249","0.007","90","","1363.1","0.14","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Naphthalene-1,5-diammonium bis[trifluoridostannate(II)]","","- C10 H12 F6 N2 Sn2 -","- C10 H12 F6 N2 Sn2 -","- C40 H48 F24 N8 Sn8 -","4","1","LN3053","Boufas, Sihem; Merazig, Hocine; Moliterni , Anna Grazia; Altomare, Angela","Naphthalene-1,5-diammonium bis[trifluoridostannate(II)]","Acta Crystallographica Section C","2007","63","7","m315","m317","10.1107/S0108270107023815","","","0.71073","MoKα","","","0.0326","","","","0.0699","","","","","","1.025","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2016058","6.5978","0.0003","29.2458","0.0015","28.663","0.0013","90","","90.521","0.002","90","","5530.5","0.5","110","2","110","2","","","","","","","","5","C 1 c 1","C -2yc","9","","20-(4-pyridyl)porphyrin-5^4^,10^4^,15^4^-tribenzoic acid‒dimethyl sulfoxide (2/5)","","- C51 H44 N5 O8.5 S2.5 -","- C50 H41 N5 O8 S2 -","- C200 H164 N20 O32 S8 -","4","1","LN3055","Sankar Muniappan; Sophia Lipstman; Israel Goldberg","Hydrogen-bonded assemblies of 20-(4-pyridyl)porphyrin-5^4^,10^4^,15^4^-tribenzoic acid with dimethyl sulfoxide and 4-acetylpyridine in their dimethyl sulfoxide and tetrahydrofuran solvates","Acta Crystallographica Section C","2007","63","7","o395","o399","10.1107/S0108270107024936","","","0.71073","MoKα","","0.1522","0.0852","","","0.1905","0.2114","","","","","","1.062","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016059","7.6005","0.0003","15.6609","0.001","18.6149","0.0012","77.718","0.003","89.63","0.004","78.805","0.004","2122.4","0.2","110","2","110","2","","","","","","","","4","P 1","P 1","1","","20-(4-pyridyl)porphyrin-5^4^,10^4^,15^4^-tribenzoic acid‒4-acetylpyridine‒tetrahydrofuran (1/2/10)","","- C100 H123 N7 O18 -","- C60 H43 N7 O8 -","- C60 H43 N7 O8 -","1","1","LN3055","Sankar Muniappan; Sophia Lipstman; Israel Goldberg","Hydrogen-bonded assemblies of 20-(4-pyridyl)porphyrin-5^4^,10^4^,15^4^-tribenzoic acid with dimethyl sulfoxide and 4-acetylpyridine in their dimethyl sulfoxide and tetrahydrofuran solvates","Acta Crystallographica Section C","2007","63","7","o395","o399","10.1107/S0108270107024936","","","0.71073","MoKα","","0.0813","0.0521","","","0.127","0.1352","","","","","","0.798","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016060","33.403","0.01","5.902","0.005","19.97","0.007","90","","114.56","0.02","90","","3581","4","297","2","297","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","4-chloroanilinium 8-hydroxy-7-iodoquinoline-5-sulfonate monohydrate","4-chloroanilinium 8-hydroxy-7-iodoquinoline-5-sulfonate monohydrate","","- C15 H14 Cl I N2 O5 S -","- C15 H14 Cl I N2 O5 S -","- C120 H112 Cl8 I8 N16 O40 S8 -","8","1","SF3040","Graham Smith; Urs D. Wermuth; Peter C. Healy","Proton-transfer compounds of 8-hydroxy-7-iodoquinoline-5-sulfonic acid (ferron) with 4-chloroaniline and 4-bromoaniline","Acta Crystallographica Section C","2007","63","7","o405","o407","10.1107/S0108270107025772","","","0.71073","MoKα","","0.0716","0.0586","","","0.1522","0.1628","","","","","","1.101","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016061","33.494","0.009","5.927","0.004","19.963","0.007","90","","114.29","0.02","90","","3612","3","297","2","297","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","4-bromoanilinium 8-hydroxy-7-iodoquinoline-5-sulfonate monohydrate","4-bromoanilinium 8-hydroxy-7-iodoquinoline-5-sulfonate monohydrate","","- C15 H14 Br I N2 O5 S -","- C15 H14 Br I N2 O5 S -","- C120 H112 Br8 I8 N16 O40 S8 -","8","1","SF3040","Graham Smith; Urs D. Wermuth; Peter C. Healy","Proton-transfer compounds of 8-hydroxy-7-iodoquinoline-5-sulfonic acid (ferron) with 4-chloroaniline and 4-bromoaniline","Acta Crystallographica Section C","2007","63","7","o405","o407","10.1107/S0108270107025772","","","0.71073","MoKα","","0.0504","0.0275","","","0.0882","0.1102","","","","","","0.811","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016062","8.6938","0.0005","12.1331","0.0007","19.5321","0.0012","90","","90","","90","","2060.3","0.2","273","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(<i>S</i>)-4-{3-[2-(dimethylamino)ethyl]-1<i>H</i>-indol-5- ylmethyl}oxazolidin-2-one benzene solvate","","- C22 H27 N3 O2 -","- C22 H27 N3 O2 -","- C88 H108 N12 O8 -","4","1","SF3041","G. Y. S. K. Swamy; B. Sridhar; K. Ravikumar; Harihara Krishnan","The 1:1 inclusion compounds zolmitriptan‒benzene and zolmitriptan‒phenol","Acta Crystallographica Section C","2007","63","7","o437","o440","10.1107/S0108270107026790","","","0.71073","MoKα","","0.041","0.0393","","","0.1113","0.1132","","","","","","1.292","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016063","8.7618","0.0013","19.506","0.003","12.1767","0.0018","90","","91.399","0.002","90","","2080.5","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(<i>S</i>)-4-{3-[2-(dimethylamino)ethyl]-1<i>H</i>-indol-5- ylmethyl}oxazolidin-2-one phenol solvate","","- C22 H27 N3 O3 -","- C22 H27 N3 O3 -","- C88 H108 N12 O12 -","4","2","SF3041","G. Y. S. K. Swamy; B. Sridhar; K. Ravikumar; Harihara Krishnan","The 1:1 inclusion compounds zolmitriptan‒benzene and zolmitriptan‒phenol","Acta Crystallographica Section C","2007","63","7","o437","o440","10.1107/S0108270107026790","","","0.71073","MoKα","","0.0505","0.0472","","","0.1332","0.1366","","","","","","1.187","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016064","11.5109","0.0019","16.882","0.003","7.9362","0.0019","90","","93.034","0.017","90","","1540.1","0.5","290","2","290","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Naphthalene-1,6-diol","","- C10 H8 O2 -","- C10 H8 O2 -","- C80 H64 O16 -","8","2","SK3120","Marciniak, Bernard","Naphthalene-1,6-diol: a three-dimensional framework built from O—H···O, O—H···π and C—H···O hydrogen bonds","Acta Crystallographica Section C","2007","63","7","o419","o422","10.1107/S010827010702642X","","","0.71073","MoKα","","0.0873","0.0579","","","0.1237","0.14","","","","","","1.175","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016065","7.2248","0.0006","8.3273","0.0007","8.3403","0.0008","89.1","0.006","87.002","0.006","65.225","0.005","454.96","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(4-aminopyridinium) hexachloridostannate(IV)","","- C10 H14 Cl6 N4 Sn -","- C10 H14 Cl6 N4 Sn -","- C10 H14 Cl6 N4 Sn -","1","0.5","SK3125","Rademeyer, M.; Lemmerer, A.; Billing, David G.","Bis(4-aminopyridinium) hexachloridostannate(IV) and bis(<i>p</i>-toluidinium) hexachloridostannate(IV)","Acta Crystallographica Section C","2007","63","7","m289","m292","10.1107/S010827010702327X","","","0.71073","MoKα","","0.0213","0.0202","","","0.0508","0.0514","","","","","","1.085","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016066","7.1166","0.0005","25.304","0.002","11.6862","0.0009","90","","90.239","0.004","90","","2104.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(p-toluidinium)hexachloridostannate(IV)","","- C14 H20 Cl6 N2 Sn -","- C14 H20 Cl6 N2 Sn -","- C56 H80 Cl24 N8 Sn4 -","4","1","SK3125","Rademeyer, M.; Lemmerer, A.; Billing, David G.","Bis(4-aminopyridinium) hexachloridostannate(IV) and bis(<i>p</i>-toluidinium) hexachloridostannate(IV)","Acta Crystallographica Section C","2007","63","7","m289","m292","10.1107/S010827010702327X","","","0.71073","MoKα","","","0.0328","","","","0.0822","","","","","","1.034","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016067","11.7604","0.0004","14.9847","0.0007","15.1844","0.0008","90","","90","","90","","2675.9","0.2","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","rac-2-isopropyl-3-(2-nitrobenzyl)-1,3-thiazolidin-4-one","","- C13 H16 N2 O3 S -","- C13 H16 N2 O3 S -","- C104 H128 N16 O24 S8 -","8","2","SK3126","Cunico, Wilson; Gomes, Claudia R. B.; Wardell, Solange M. S. V.; Low, John N.; Glidewell, Christopher","Racemic 2-isopropyl-3-(2-nitrobenzyl)-1,3-thiazolidin-4-one crystallizes in the space group <i>P</i>2~1~2~1~2~1~ with <i>Z</i>' = 2: two different interpenetrating three-dimensional frameworks formed by C—H···O hydrogen bonds","Acta Crystallographica Section C","2007","63","7","o411","o414","10.1107/S0108270107022913","","","0.71073","MoKα","","0.0987","0.0464","","","0.0706","0.0831","","","","","","0.985","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016068","6.536","0.0002","13.4507","0.0003","13.8558","0.0004","117.135","0.001","100.612","0.001","92.7217","0.0019","1053.4","0.05","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","tetrakis(4-iodophenyl)porphyrin chloroform 0.85-solvate","","- C44.85 H26.85 Cl2.55 I4 N4 -","- C44.852 H26.852 Cl2.556 I4 N4 -","- C44.852 H26.852 Cl2.556 I4 N4 -","1","0.5","SK3127","Sophia Lipstman; Sankar Muniappan; Israel Goldberg","The nature of supramolecular interactions in tetrakis(4-iodophenyl)porphyrin and its zinc(II) complex","Acta Crystallographica Section C","2007","63","7","m300","m303","10.1107/S0108270107023104","","","0.71073","MoKα","","0.0702","0.0471","","","0.1194","0.1339","","","","","","1.054","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016069","10.2165","0.0003","9.2289","0.0003","20.5252","0.0005","90","","97.914","0.002","90","","1916.83","0.1","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[tetrakis(4-iodophenyl)porphyrinato]zinc(II)","","- C44 H24 I4 N4 Zn -","- C44 H24 I4 N4 Zn -","- C88 H48 I8 N8 Zn2 -","2","0.5","SK3127","Sophia Lipstman; Sankar Muniappan; Israel Goldberg","The nature of supramolecular interactions in tetrakis(4-iodophenyl)porphyrin and its zinc(II) complex","Acta Crystallographica Section C","2007","63","7","m300","m303","10.1107/S0108270107023104","","","0.71073","MoKα","","0.0677","0.0432","","","0.1058","0.119","","","","","","1.065","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016070","4.6657","0.0002","9.4172","0.0004","11.6841","0.0004","109.752","0.0017","98.598","0.002","90.926","0.002","476.51","0.03","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","2-cyano-4-iodoacetanilide","","- C9 H7 I N2 O -","- C9 H7 I N2 O -","- C18 H14 I2 N4 O2 -","2","1","SK3136","Garden, Simon J.; Custódio, Cíntia de A.; Wardell, James L.; Low, John N.; Glidewell, Christopher","2-Cyano-4-iodoacetanilide: a hydrogen-bonded chain of <i>R</i>~2~^2^(12) and <i>R</i>~2~^2^(14) rings","Acta Crystallographica Section C","2007","63","7","o408","o410","10.1107/S0108270107026492","","","0.71073","MoKα","","0.0285","0.0265","","","0.0564","0.0577","","","","","","1.041","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016071","10.5672","0.0003","14.5838","0.0003","7.3453","0.0003","90","","90","","90","","1131.98","0.06","293","","293","","","","","","","","","3","P 21 n b","P -2bc 2a","33","","triterbium rubidium heptaoxide","","- O7 Ru Tb3 -","- O7 Ru Tb3 -","- O56 Ru8 Tb24 -","8","2","SQ3070","Nobuo Ishizawa; Tsuyoshi Suwa; Kenji Tateishi; James R. Hester","Synchrotron X-ray study of noncentrosymmetric Tb~3~RuO~7~ with partial structural disorder","Acta Crystallographica Section C","2007","63","7","i43","i46","10.1107/S0108270107021993","","","0.6886","synchrotron","","0.022","0.018","","0.035","","0.027","","","1.166","","","0.975","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016072","5.5364","0.0001","10.9918","0.0002","11.8432","0.0002","107.631","0.001","102.397","0.001","93.562","0.001","664.56","0.02","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","Sodium tris(glycinium) bis(hexafluorosilicate) tris(glycine)","","- C12 H33 F12 N6 Na O12 Si2 -","- C12 H33 F12 N6 Na O12 Si2 -","- C12 H33 F12 N6 Na O12 Si2 -","1","0.5","SQ3076","Naranya, Moolya B.; Chitharanjan Raj; Dharmaprakash, S. M.; Harrison, William T. A.","Sodium tris(glycinium) bis(hexafluorosilicate) glycine trisolvate","Acta Crystallographica Section C","2007","63","7","m312","m314","10.1107/S0108270107021774","","","0.71073","MoKα","","0.0261","0.0235","","","0.0592","0.0608","","","","","","1.065","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2016073","11.4361","0.0008","21.5977","0.0016","14.7334","0.0011","90","","101.466","0.001","90","","3566.4","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua-1κO-{μ-1,3-bis[2-(2-oxidobenzylideneamino)ethyl]-2-(2- oxidophenyl)imidazolidine-1κ^4^O,N,N',O';2κ^4^O',N'',N''',O''}- (μ-2-oxidobenzaldehyde-1:2κ^3^O^2^:O^2^,O^1^)dinickel(II) 2.38-hydrate","","- C34 H36 N4 Ni2 O8.38 -","- C34 H38.76 N4 Ni2 O8.38 -","- C136 H155.04 N16 Ni8 O33.52 -","4","1","AV3086","Lu, Li-Ping; Lu, Xiao-Ping; Zhu, Miao-Li","Aqua-1κ<i>O</i>-{μ-1,3-bis[2-(2-oxidobenzylideneamino)ethyl]-2-(2-oxidophenyl)imidazolidine-1κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>';2κ^4^<i>O</i>',<i>N</i>'',<i>N</i>''',<i>O</i>''}(μ-2-formylphenolato-1:2κ^3^<i>O</i>^1^:<i>O</i>^1^,<i>O</i>^2^)dinickel(II) trihydrate: a one-dimensional chain linked by O—H···O hydrogen bonds and C—H···π interactions","Acta Crystallographica Section C","2007","63","8","m374","m376","10.1107/S0108270107023256","","","0.71073","MoKα","","0.0816","0.0586","","","0.1455","0.1682","","","","","","1.069","","","","has coordinates,has disorder","206183","2020-10-21","18:00:00",""
"2016074","11.3274","0.0008","17.809","0.0012","12.9556","0.0009","90","","94.885","0.001","90","","2604","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[1,2-bis(diphenylphosphino)ethane-κ^2^P,P']difluoridoruthenium(II) trichloromethane disolvate","","- C54 H50 Cl6 F2 P4 Ru -","- C54 H50 Cl6 F2 P4 Ru -","- C108 H100 Cl12 F4 P8 Ru2 -","2","0.5","AV3094","Harding, Duncan A. J.; Hope, Eric G.; Solan, Gregory A.; Fawcett, John","Bis[1,2-bis(diphenylphosphino)ethane-κ^2^<i>P</i>,<i>P</i>']difluoridoruthenium(II) trichloromethane disolvate","Acta Crystallographica Section C","2007","63","8","m383","m384","10.1107/S0108270107030466","","","0.71073","MoKα","","0.0601","0.0519","","","0.1387","0.1449","","","","","","1.054","","","","has coordinates,has Fobs","198633","2020-10-21","18:00:00",""
"2016075","10.5281","0.001","7.4585","0.0011","16.341","0.002","90","","90","","90","","1283.2","0.3","100","1","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-Methyl-4-nitro-5-bromo-1H-imidazole","","- C4 H4 Br N3 O2 -","- C4 H4 Br N3 O2 -","- C32 H32 Br8 N24 O16 -","8","1","AV3095","Wagner, Paweł; Świerczek, Krzysztof; Kubicki, Maciej","Crystal packing of two 5-substituted 2-methyl-4-nitro-1<i>H</i>-imidazoles","Acta Crystallographica Section C","2007","63","8","o445","o447","10.1107/S0108270107028922","","","0.71073","MoKα","","0.0611","0.0497","","","0.1289","0.1392","","","","","","1.078","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016076","7.7166","0.0015","8.1716","0.0011","11.715","0.002","74.278","0.014","77.63","0.017","77.15","0.014","683.9","0.2","295","1","293","2","","","","","","","","4","P -1","-P 1","2","","2-methyl-4-nitro-1H-imidazole-5-carbonitrile","","- C5 H4 N4 O2 -","- C5 H4 N4 O2 -","- C20 H16 N16 O8 -","4","2","AV3095","Wagner, Paweł; Świerczek, Krzysztof; Kubicki, Maciej","Crystal packing of two 5-substituted 2-methyl-4-nitro-1<i>H</i>-imidazoles","Acta Crystallographica Section C","2007","63","8","o445","o447","10.1107/S0108270107028922","","","0.71073","MoKα","","0.0856","0.0424","","","0.0974","0.1045","","","","","","0.969","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016077","20.9386","0.0018","8.8654","0.0007","16.056","0.0015","90","","124.559","0.005","90","","2454.5","0.4","293","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","dibarium μ-oxo-bis(pentachlororuthenate(IV)) decahydrate","","- Ba2 Cl10 H20 O11 Ru2 -","- Ba2 Cl10 H20 O11 Ru2 -","- Ba8 Cl40 H80 O44 Ru8 -","4","0.5","BC3046","Boufas, Sihem; Hadjadj, Nasr-Eddine; Merazig, Hocine; Moliterni , Anna Grazia; Altomare, Angela","Hydrogen bonding and structure of Ba~2~Ru~2~Cl~10~O·10H~2~O","Acta Crystallographica Section C","2007","63","8","i60","i62","10.1107/S0108270107029551","","","0.71073","MoKα","","","0.0291","","","","0.0697","","","","","","1.055","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2016078","6.237","0.0004","7.2005","0.0005","10.7066","0.0008","92.868","0.004","92.743","0.005","105.524","0.004","461.77","0.06","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","lithium tris[dioxidovanadium(V)] bis[trioxidotellurium(IV)]","","- Li O12 Te2 V3 -","- Li O12 Te2 V3 -","- Li2 O24 Te4 V6 -","2","1","BC3051","Johnston, Magnus G.; Harrison, William T. A.","Li(VO~2~)~3~(TeO~3~)~2~","Acta Crystallographica Section C","2007","63","8","i57","i59","10.1107/S010827010702954X","","","0.71073","MoKα","","0.0435","0.0359","","","0.0845","0.0885","","","","","","1.021","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016079","9.9885","0.0001","9.9885","0.0001","9.9885","0.0001","90","","90","","90","","996.55","0.02","293","2","293","2","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","tyrrellite","copper cobalt nickel tetraselenide","","- Co1.36 Cu Ni0.64 Se4 -","- Co1.36 Cu Ni0.64 Se4 -","- Co10.88 Cu8 Ni5.12 Se32 -","8","0.0416667","BC3052","Yang, Hexiong; Hubler, David K.; Lavina, Barbara; Downs, Robert T.; Costin, Gelu","Tyrrellite, Cu(Co~0.68~Ni~0.32~2)~2~Se~4~, isostructural with spinel","Acta Crystallographica, Section C","2007","63","8","i73","i74","10.1107/S010827010703048X","","","0.71073","MoKα","","0.0169","0.0139","","","0.027","0.0275","","","","","","1.115","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2016080","9.4053","0.0004","13.8617","0.0007","18.0405","0.0009","107.361","0.005","99.069","0.004","101.086","0.004","2144.1","0.2","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","(2,2'-Bipyridine)bis(tri-<i>tert</i>-butoxysilanethiolato-κS)lead(II)","","- C34 H62 N2 O6 Pb S2 Si2 -","- C34 H62 N2 O6 Pb S2 Si2 -","- C68 H124 N4 O12 Pb2 S4 Si4 -","2","1","BG3039","Chojnacki, Jaroslaw; Kloskowska, Magdalena; Janowska, Urszula; Wojnowski, Wieslaw","(2,2'-Bipyridine)bis(tri-<i>tert</i>-butoxysilanethiolato-κ<i>S</i>)lead(II) and (4,7-diphenyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bis(tri-<i>tert</i>-butoxysilanethiolato-κ<i>S</i>)lead(II) benzene hemisolvate","Acta Crystallographica Section C","2007","63","8","m349","m351","10.1107/S0108270107029629","","","0.71073","MoKα","","0.0489","0.0398","","","0.095","0.0994","","","","","","1.155","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016081","10.204","0.002","13.359","0.003","21.109","0.004","84.57","0.03","83.05","0.03","85.29","0.03","2836.2","1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","(4,7-diphenyl-1,10-phenanthroline-κ^2^N,N')bis(tri-<i>tert</i>- butoxysilanethiolato-κS)lead(II) benzene hemisolvate","","- C51 H73 N2 O6 Pb S2 Si2 -","- C51 H73 N2 O6 Pb S2 Si2 -","- C102 H146 N4 O12 Pb2 S4 Si4 -","2","1","BG3039","Chojnacki, Jaroslaw; Kloskowska, Magdalena; Janowska, Urszula; Wojnowski, Wieslaw","(2,2'-Bipyridine)bis(tri-<i>tert</i>-butoxysilanethiolato-κ<i>S</i>)lead(II) and (4,7-diphenyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bis(tri-<i>tert</i>-butoxysilanethiolato-κ<i>S</i>)lead(II) benzene hemisolvate","Acta Crystallographica Section C","2007","63","8","m349","m351","10.1107/S0108270107029629","","","0.71073","MoKα","","0.0781","0.0372","","","0.0983","0.118","","","","","","1.002","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016082","8.365","0.002","9.795","0.003","20.946","0.005","90","","90","","90","","1716.2","0.8","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Poly[[pentaaquasulfato-μ~4~-(R,R)-tartrato-dicadmium(II)] trihydrate]","","- C4 H20 Cd2 O18 S -","- C4 H20 Cd2 O18 S -","- C16 H80 Cd8 O72 S4 -","4","1","BG3040","Drzewiecka, Aleksandra; Stepniak, Krystyna; Barcicka, Anna; Koziol, Anna E.","Poly[[pentaaquasulfato-μ~4~-(<i>R</i>,<i>R</i>)-tartrato-dicadmium(II)] trihydrate]","Acta Crystallographica Section C","2007","63","8","m346","m348","10.1107/S0108270107027862","","","0.71073","MoKα","","0.0614","0.0371","","","0.0547","0.0589","","","","","","0.903","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016083","25.518","0.003","9.706","0.0012","16.758","0.002","90","","120.045","0.002","90","","3592.9","0.8","297","2","297","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","μ-oxido-bis{bis[2-(dimethylaminomethyl)phenyl]stannol}","","- C36 H50 N4 O3 Sn2 -","- C36 H50 N4 O3 Sn2 -","- C144 H200 N16 O12 Sn8 -","4","0.5","BG3041","Rotar, Adina; Varga, Richard A.; Silvestru, Cristian","Intramolecular interactions in μ-oxido-bis{bis[2-(dimethylaminomethyl)phenyl]stannol}","Acta Crystallographica Section C","2007","63","8","m355","m356","10.1107/S0108270107030156","","","0.71073","MoKα","","0.0573","0.0422","","","0.0846","0.0899","","","","","","1.129","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016084","13.997","0.0008","7.5441","0.0004","16.359","0.0012","90","","99.031","0.002","90","","1706.01","0.18","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","α-Tris(2,4-pentanedionato-κ^2^O,O')chromium(III)","","- C15 H21 Cr O6 -","- C15 H21 Cr O6 -","- C60 H84 Cr4 O24 -","4","1","BG3044","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","α-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')chromium(III) at 290 and 110K: a new δ phase at 110K","Acta Crystallographica Section C","2007","63","8","m377","m382","10.1107/S0108270107033823","","","0.71073","MoKα","","0.0551","0.0424","","","0.1181","0.1271","","","","","","1.037","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016085","27.5823","0.0002","7.4656","0.0001","48.6012","0.0004","90","","99.2731","0.0003","90","","9877.09","0.17","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","α-Tris(2,4-pentanedionato-κ^2^O,O')chromium(III)","","- C15 H21 Cr O6 -","- C15 H21 Cr O6 -","- C360 H504 Cr24 O144 -","24","6","BG3044","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","α-Tris(2,4-pentanedionato-κ^2^<i>O</i>,<i>O</i>')chromium(III) at 290 and 110K: a new δ phase at 110K","Acta Crystallographica Section C","2007","63","8","m377","m382","10.1107/S0108270107033823","","","0.71073","MoKα","","0.0854","0.04","","","0.1146","0.1385","","","","","","1.064","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016086","11.7045","0.0008","10.3432","0.0007","5.7082","0.0004","90","","90","","90","","691.05","0.08","295","2","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","tricalcium monogermanate dichloride","","- Ca3 Cl2 Ge O4 -","- Ca3 Cl2 Ge O4 -","- Ca12 Cl8 Ge4 O16 -","4","0.5","EM3006","Redhammer, Günther J.; Roth, Georg; Amthauer, Georg","Ca~3~GeO~4~Cl~2~ with a norbergite-like structure","Acta Crystallographica Section C","2007","63","8","i69","i72","10.1107/S0108270107030478","","","0.71073","MoKα","","","0.0246","","","","0.057","","","","","","1.148","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016087","3.8205","0.0006","15.986","0.002","11.608","0.0012","90","","90.546","0.011","90","","708.92","0.16","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","trans-3-(3-pyridyl)acrylic acid","","- C8 H7 N O2 -","- C8 H7 N O2 -","- C32 H28 N4 O8 -","4","1","FA3092","Alexander Briceño; Reinaldo Atencio; Raquel Gil; Alejandra Nobrega","Hydrogen-bonded networks in <i>trans</i>-3-(3-pyridyl)acrylic acid and <i>rctt</i>-3,3'-(3,4-dicarboxycyclobutane-1,2-diyl)dipyridinium dichloride","Acta Crystallographica Section C","2007","63","8","o441","o444","10.1107/S0108270107027497","","","0.71073","MoKα","","0.0666","0.0406","","","0.098","0.1122","","","","","","1.027","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016088","7.3938","0.0013","14.829","0.003","15.25","0.003","90","","90","","90","","1672.1","0.6","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","<i>rctt</i>-3,3'-(3,4-dicarboxycyclobutane-1,2-diyl)dipyridinium dichloride","","- C16 H16 Cl2 N2 O4 -","- C16 H16 Cl2 N2 O4 -","- C64 H64 Cl8 N8 O16 -","4","1","FA3092","Alexander Briceño; Reinaldo Atencio; Raquel Gil; Alejandra Nobrega","Hydrogen-bonded networks in <i>trans</i>-3-(3-pyridyl)acrylic acid and <i>rctt</i>-3,3'-(3,4-dicarboxycyclobutane-1,2-diyl)dipyridinium dichloride","Acta Crystallographica Section C","2007","63","8","o441","o444","10.1107/S0108270107027497","","","0.7107","MoKα","","0.0503","0.0381","","","0.0882","0.1031","","","","","","1.149","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016089","7.8862","0.0012","20.501","0.005","7.7119","0.0013","90","","102.633","0.016","90","","1216.6","0.4","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[triaquazinc(II)]-μ-2-nitroterephthalato- κO^1^:κ^2^O^4^:O^4'^] monohydrate]","","- C8 H11 N O10 Zn -","- C8 H11 N O10 Zn -","- C32 H44 N4 O40 Zn4 -","4","1","FA3096","Guo, Ming-Lin; Guo, Chen-Hu","<i>catena</i>-Poly[[[triaquazinc(II)]-μ-2-nitroterephthalato-κ<i>O</i>^1^:κ^2^<i>O</i>^4^,<i>O</i>^4'^] monohydrate]","Acta Crystallographica Section C","2007","63","8","m352","m354","10.1107/S0108270107030946","","","0.71073","MoKα","","0.0409","0.0339","","","0.0781","0.0806","","","","","","1.124","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016090","4.8053","0.0006","11.42","0.001","26.732","0.003","90","","93.181","0.002","90","","1464.7","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,1'-thiobis(2-naphthol)","","- C20 H14 O2 S -","- C20 H14 O2 S -","- C80 H56 O8 S4 -","4","1","FA3098","Mague, Joel T.; Balakrishna, Maravanji S.; Punji, Banudhar; Suresh, Devarajan","Two crystalline modifications of 1,1'-thiobis(2-naphthol)","Acta Crystallographica Section C","2007","63","8","o487","o488","10.1107/S0108270107032738","","","0.71073","MoKα","","0.0708","0.0449","","","0.0958","0.1059","","","","","","1.015","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016091","13.6508","0.0009","5.2192","0.0003","21.265","0.001","90","","105.409","0.001","90","","1460.59","0.15","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,1'-thiobis(2-naphthol)","","- C20 H14 O2 S -","- C20 H14 O2 S -","- C80 H56 O8 S4 -","4","1","FA3098","Mague, Joel T.; Balakrishna, Maravanji S.; Punji, Banudhar; Suresh, Devarajan","Two crystalline modifications of 1,1'-thiobis(2-naphthol)","Acta Crystallographica Section C","2007","63","8","o487","o488","10.1107/S0108270107032738","","","0.71073","MoKα","","0.0556","0.044","","","0.0833","0.0905","","","","","","1.092","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016092","15.178","0.002","7.4496","0.0012","19.751","0.003","90","","112.397","0.003","90","","2064.8","0.5","130","2","130","2","","","","","","","","4","P 1 21 1","P 2yb","4","brucine‒water (1/2)","2,3-dimethoxystrychnidin-10-one‒water (1/2)","","- C23 H30 N2 O6 -","- C23 H30 N2 O6 -","- C92 H120 N8 O24 -","4","2","GA3057","Graham Smith; Urs D. Wermuth; Jonathan M. White","Pseudopolymorphism in brucine: brucine‒water (1/2), the third crystal hydrate of brucine","Acta Crystallographica Section C","2007","63","8","o489","o492","10.1107/S0108270107032295","","","0.71073","MoKα","","0.0606","0.048","","","0.0855","0.0898","","","","","","0.87","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016093","7.6538","0.0014","11.022","0.002","15.056","0.003","90","","99.561","0.016","90","","1252.5","0.4","173","2","173","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","4-Ethynyl[2.2]paracyclophane","","- C18 H16 -","- C18 H16 -","- C72 H64 -","4","1","GD3118","Jones, Peter G.; Dix, Ina; Hopf, Henning","C—H···π interactions in five ethynyl-substituted [2.2]paracyclophanes: further examples of the `7,11' packing pattern","Acta Crystallographica Section C","2007","63","8","o468","o473","10.1107/S0108270107027606","","","0.71073","MoKα","","0.0849","0.0418","","","0.0912","0.103","","","","","","0.864","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016094","7.6316","0.001","7.8177","0.001","12.4446","0.0016","78.125","0.002","72.339","0.002","73.971","0.002","673.9","0.15","143","2","143","2","","","","","","","","2","P -1","-P 1","2","","4,12-Diethynyl[2.2]paracyclophane","","- C20 H16 -","- C20 H16 -","- C40 H32 -","2","1","GD3118","Jones, Peter G.; Dix, Ina; Hopf, Henning","C—H···π interactions in five ethynyl-substituted [2.2]paracyclophanes: further examples of the `7,11' packing pattern","Acta Crystallographica Section C","2007","63","8","o468","o473","10.1107/S0108270107027606","","","0.71073","MoKα","","0.051","0.0449","","","0.1208","0.126","","","","","","1.075","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016095","11.8823","0.0012","11.8823","0.0012","8.4426","0.0012","90","","90","","120","","1032.3","0.2","143","2","143","2","","","","","","","","2","P 31","P 31","144","","4,13-Diethynyl[2.2]paracyclophane","","- C20 H16 -","- C20 H16 -","- C60 H48 -","3","1","GD3118","Jones, Peter G.; Dix, Ina; Hopf, Henning","C—H···π interactions in five ethynyl-substituted [2.2]paracyclophanes: further examples of the `7,11' packing pattern","Acta Crystallographica Section C","2007","63","8","o468","o473","10.1107/S0108270107027606","","","0.71073","MoKα","","0.0407","0.0348","","","0.0857","0.0882","","","","","","1.023","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016096","7.6187","0.001","10.8231","0.0016","8.6293","0.0012","90","","101.23","0.006","90","","697.93","0.17","143","2","143","2","","","","","","","","2","P 1 21 1","P 2yb","4","","4,15-Diethynyl[2.2]paracyclophane","","- C20 H16 -","- C20 H16 -","- C40 H32 -","2","1","GD3118","Jones, Peter G.; Dix, Ina; Hopf, Henning","C—H···π interactions in five ethynyl-substituted [2.2]paracyclophanes: further examples of the `7,11' packing pattern","Acta Crystallographica Section C","2007","63","8","o468","o473","10.1107/S0108270107027606","","","0.71073","MoKα","","0.0384","0.036","","","0.096","0.0977","","","","","","1.074","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016097","12.5475","0.0012","12.5475","0.0012","7.8705","0.001","90","","90","","120","","1073.1","0.2","143","2","143","2","","","","","","","","2","P 31","P 31","144","","4,16-Diethynyl[2.2]paracyclophane","","- C20 H16 -","- C20 H16 -","- C60 H48 -","3","1","GD3118","Jones, Peter G.; Dix, Ina; Hopf, Henning","C—H···π interactions in five ethynyl-substituted [2.2]paracyclophanes: further examples of the `7,11' packing pattern","Acta Crystallographica Section C","2007","63","8","o468","o473","10.1107/S0108270107027606","","","0.71073","MoKα","","0.0439","0.037","","","0.096","0.1005","","","","","","1.045","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016098","14.981","0.003","13.956","0.002","18.309","0.003","90","","105.8","0.01","90","","3683.3","1.1","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aqua(phthalocyaninato-κ^4^N)magnesium(II) 3-chloropyridine disolvate","","- C42 H26 Cl2 Mg N10 O -","- C42 H26 Cl2 Mg N10 O -","- C168 H104 Cl8 Mg4 N40 O4 -","4","1","GG3098","Vasyl Kinzhybalo; Jan Janczak","Aqua(phthalocyaninato-κ^4^<i>N</i>)magnesium(II) 3-chloropyridine disolvate","Acta Crystallographica Section C","2007","63","8","m357","m360","10.1107/S0108270107030089","","","0.71073","MoKα","","0.1045","0.0631","","","0.085","0.1107","","","","","","1.007","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016099","14.7933","0.0003","20.0349","0.0004","14.8243","0.0003","90","","90.282","0.0007","90","","4393.61","0.15","90","0.2","90","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","rac-(Z)-2-(2-Thienylmethylene)-1-azabicyclo[2.2.2]octan-3-ol","","- C12 H15 N O S -","- C12 H15 N O S -","- C192 H240 N16 O16 S16 -","16","4","HJ3044","Sonar, Vijayakumar N.; M. Venkatraj; Parkin, Sean; Crooks, Peter A.","<i>rac</i>-(<i>Z</i>)-2-(2-Thienylmethylene)-1-azabicyclo[2.2.2]octan-3-ol","Acta Crystallographica Section C","2007","63","8","o493","o495","10.1107/S0108270107033690","","","0.71073","MoKα","","0.0763","0.0436","","","0.0995","0.1138","","","","","","1.038","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016100","10.1283","0.0009","10.1283","0.0009","18.948","0.003","90","","90","","120","","1683.3","0.3","86","2","86","2","","","","","","","","3","R -3 :H","-R 3","148","ZnTe6O13","zinc(II) hexatellurium(IV) tridecaoxide","","- O13 Te6 Zn -","- O13 Te6 Zn -","- O78 Te36 Zn6 -","6","0.333333","IZ3022","Nawash, Jalal M.; Twamley, Brendan; Lynn, Kelvin G.","ZnTe~6~O~13~, a new ZnO‒TeO~2~ phase","Acta Crystallographica Section C","2007","63","8","i66","i68","10.1107/S0108270107027412","","","0.71073","MoKα","","0.0213","0.02","","","0.0593","0.0604","","","","","","1.123","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016101","7.7257","0.0003","10.2208","0.0003","13.4225","0.0004","96.879","0.002","96.354","0.002","107.158","0.002","993.44","0.06","120","2","120","2","","","","","","","","5","P -1","-P 1","2","Acemetacin monohydrate","2-{2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetoxy}acetic acid monohydrate","","- C21 H20 Cl N O7 -","- C21 H20 Cl N O7 -","- C42 H40 Cl2 N2 O14 -","2","1","JZ3078","Gelbrich, Thomas; Haddow, Mairi F.; Griesser, Ulrich J.","Acemetacin monohydrate","Acta Crystallographica Section C","2007","63","8","o451","o453","10.1107/S0108270107030065","","","0.71073","MoKα","","0.0633","0.0464","","","0.1187","0.1274","","","","","","1.088","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016102","12.7944","0.0009","9.3494","0.0007","10.0269","0.0007","90","","90","","90","","1199.42","0.15","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","(3,5-dimethyl-1<i>H</i>-pyrazol-4-ylmethyl)isopropylammonium chloride monohydrate","","- C9 H20 Cl N3 O -","- C9 H20 Cl N3 O -","- C36 H80 Cl4 N12 O4 -","4","1","SF3043","Guzei, Ilia A.; Keter, Frankline K.; Spencer, Lara C.; Darkwa, James","Constructor graph description of hydrogen bonding in a supramolecular assembly of (3,5-dimethyl-1<i>H</i>-pyrazol-4-ylmethyl)isopropylammonium chloride monohydrate","Acta Crystallographica Section C","2007","63","8","o481","o483","10.1107/S0108270107031952","","","0.71073","MoKα","","0.0266","0.023","","","0.0564","0.0591","","","","","","1.044","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016103","5.8633","0.0012","9.681","0.002","9.772","0.002","65.336","0.003","75.334","0.003","78.44","0.003","484.82","0.17","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","catena-poly[[aquazinc(II)]-μ~3~-tyrosinato]","","- C9 H9 N O4 Zn -","- C9 H9 N O4 Zn -","- C18 H18 N2 O8 Zn2 -","2","1","SF3044","Dong-Qing Li; Jian Zhou; Xing Liu","The one-dimensional chain polymer of aqua(tyrosinato)zinc(II)","Acta Crystallographica Section C","2007","63","8","m371","m373","10.1107/S010827010703185X","","","0.71073","MoKα","","0.0499","0.0438","","","0.1057","0.1089","","","","","","1.061","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016104","15.848","0.003","10.689","0.002","20.078","0.005","90","","91.38","0.011","90","","3400.2","1.2","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-(dimethylamino)benzaldehyde‒6-phenyl-1,3,5-triazine-2,4-diamine (1/1)","","- C18 H20 N6 O -","- C18 H20 N6 O -","- C144 H160 N48 O8 -","8","1","SF3045","Habibi, Mohammad Hossein; Zendehdel, Mahmoud; Barati, Kazem; Harrington, Ross W.; Clegg, William","A 1:1 cocrystal of 4-(dimethylamino)benzaldehyde and 6-phenyl-1,3,5-triazine-2,4-diamine","Acta Crystallographica Section C","2007","63","8","o474","o476","10.1107/S0108270107031307","","","0.71073","MoKα","","0.0635","0.0446","","","0.1145","0.1285","","","","","","1.052","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016105","6.229","0.002","6.244","0.003","14.475","0.003","90","","99.05","0.03","90","","556","0.3","293","2","297","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-5-benzylhydantoin monohydrate","(S)-5-Benzylimidazolidine-2,4-dione monohydrate","","- C10 H12 N2 O3 -","- C10 H12 N2 O3 -","- C20 H24 N4 O6 -","2","1","SK3128","Delgado, Gerzon E.; Mora, Asiloé J.; Uzcátegui, Jorge; Bahsas, Ali; Briceño, Alexander","(<i>S</i>)-5-Benzylimidazolidine-2,4-dione monohydrate","Acta Crystallographica Section C","2007","63","8","o448","o450","10.1107/S0108270107028090","","","0.71069","MoKα","","0.0526","0.0466","","","0.1346","0.1408","","","","","","1.061","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016106","11.606","0.006","12.155","0.002","22.12","0.004","90","","90","","90","","3120.5","1.8","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","(Dimethylimidazolidine-2-selone-κ<i>Se</i>)bis(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')copper(II) bis(perchlorate)","","- C29 H26 Cl2 Cu N6 O8 Se -","- C29 H26 Cl2 Cu N6 O8 Se -","- C116 H104 Cl8 Cu4 N24 O32 Se4 -","4","1","SK3135","Blake, Alexander J.; Lippolis, Vito; Pivetta, Tiziana; Verani, Gaetano","(1,3-Dimethylimidazolidine-2-selone-κ<i>Se</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) bis(perchlorate) and bis(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')(imidazolidine-2-thione-κ<i>S</i>)copper(II) bis(perchlorate)","Acta Crystallographica Section C","2007","63","8","m364","m367","10.1107/S0108270107026753","","","0.71073","MoKα","","0.118","0.0735","","","0.119","0.144","","","","","","1.23","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016107","11.493","0.007","11.861","0.009","20.166","0.01","90","","90","","90","","2749","3","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","bis(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')(imidazolidine-2-thione- κ<i>S</i>)copper(II) bis(perchlorate)","","- C23 H22 Cl2 Cu N6 O8 S -","- C23 H22 Cl2 Cu N6 O8 S -","- C92 H88 Cl8 Cu4 N24 O32 S4 -","4","1","SK3135","Blake, Alexander J.; Lippolis, Vito; Pivetta, Tiziana; Verani, Gaetano","(1,3-Dimethylimidazolidine-2-selone-κ<i>Se</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) bis(perchlorate) and bis(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')(imidazolidine-2-thione-κ<i>S</i>)copper(II) bis(perchlorate)","Acta Crystallographica Section C","2007","63","8","m364","m367","10.1107/S0108270107026753","","","0.71073","MoKα","","0.0723","0.0611","","","0.15","0.164","","","","","","1.01","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016108","7.943","0.0019","7.966","0.0011","9.943","0.003","87.637","0.013","82.632","0.018","89.941","0.017","623.4","0.3","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","2,5-Dimethyl-6,7-dihydrobenzo[h]pyrazolo[1,5-a]quinazoline","","- C16 H15 N3 -","- C16 H15 N3 -","- C32 H30 N6 -","2","1","SK3137","Portilla, Jaime; Quiroga, Jairo; Cobo, Justo; Low, John N.; Glidewell, Christopher","2,5-Dimethyl-6,7-dihydrobenzo[<i>h</i>]pyrazolo[1,5-<i>a</i>]quinazoline and 2-<i>tert</i>-butyl-5-methyl-6,7-dihydrobenzo[<i>h</i>]pyrazolo[1,5-<i>a</i>]quinazoline","Acta Crystallographica Section C","2007","63","8","o458","o461","10.1107/S0108270107029010","","","0.71073","MoKα","","0.1335","0.0669","","","0.1686","0.2203","","","","","","1.038","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016109","11.2632","0.0005","11.4574","0.0007","12.1317","0.0006","93.449","0.005","90.313","0.004","102.791","0.006","1523.66","0.14","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","2-tert-Butyl-5-methyl-6,7-dihydrobenzo[h]pyrazolo[1,5-a]quinazoline","","- C19 H21 N3 -","- C19 H21 N3 -","- C76 H84 N12 -","4","2","SK3137","Portilla, Jaime; Quiroga, Jairo; Cobo, Justo; Low, John N.; Glidewell, Christopher","2,5-Dimethyl-6,7-dihydrobenzo[<i>h</i>]pyrazolo[1,5-<i>a</i>]quinazoline and 2-<i>tert</i>-butyl-5-methyl-6,7-dihydrobenzo[<i>h</i>]pyrazolo[1,5-<i>a</i>]quinazoline","Acta Crystallographica Section C","2007","63","8","o458","o461","10.1107/S0108270107029010","","","0.71073","MoKα","","0.1255","0.0649","","","0.1615","0.2129","","","","","","1.055","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016110","10.4081","0.0005","24.0202","0.0011","10.2842","0.0005","90","","93.314","0.01","90","","2566.8","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2-(2-methoxyphenylonethylidene)-1,4-di-p-tosyl-1,2,3,4-tetraquinoxaline","(E)-2-(2-methoxybenzylidene)-1,4-di-p-tosyl-1,2,3,4-tetrahydroquinoxaline","","- C30 H28 N2 O5 S2 -","- C30 H28 N2 O5 S2 -","- C120 H112 N8 O20 S8 -","4","1","SK3138","Soumen Ghosh; Rupa Mukhopadhyay; Madeleine Helliwell; Alok K. Mukherjee","Two (<i>E</i>)-2-arylidene-1,4-di-<i>p</i>-tosyl-1,2,3,4-tetrahydroquinoxaline compounds: supramolecular frameworks built with C—H···O and C—H···π(arene) hydrogen bonds and π‒π stacking interactions","Acta Crystallographica Section C","2007","63","8","o496","o500","10.1107/S0108270107032234","","","0.71073","MoKα","","0.0356","0.0321","","","0.0886","0.0904","","","","","","1.065","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016111","10.1431","0.0007","11.7721","0.0004","11.8879","0.0009","101.093","0.001","103.928","0.002","91.248","0.003","1348.55","0.15","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","(E)-methyl 2-[(1,4-di-p-tosyl-1,2,3,4-tetrahydroquinoxalin-2-ylidene)methyl]benzoate","","- C31 H28 N2 O6 S2 -","- C31 H28 N2 O6 S2 -","- C62 H56 N4 O12 S4 -","2","1","SK3138","Soumen Ghosh; Rupa Mukhopadhyay; Madeleine Helliwell; Alok K. Mukherjee","Two (<i>E</i>)-2-arylidene-1,4-di-<i>p</i>-tosyl-1,2,3,4-tetrahydroquinoxaline compounds: supramolecular frameworks built with C—H···O and C—H···π(arene) hydrogen bonds and π‒π stacking interactions","Acta Crystallographica Section C","2007","63","8","o496","o500","10.1107/S0108270107032234","","","0.71073","MoKα","","0.0399","0.0355","","","0.0904","0.0939","","","","","","1.039","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016112","12.1494","0.0004","5.1355","0.0002","18.6969","0.0006","90","","102.079","0.002","90","","1140.73","0.07","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 3-(2-nitrophenylhydrazono)butanoate","","- C11 H13 N3 O4 -","- C11 H13 N3 O4 -","- C44 H52 N12 O16 -","4","1","SK3141","Wardell, James L.; Skakle, Janet M. S.; Low, John N.; Glidewell, Christopher","Cyclic and acyclic products from the reactions between methyl 3-oxobutanoate and arylhydrazines","Acta Crystallographica Section C","2007","63","8","o462","o467","10.1107/S0108270107029447","","","0.71073","MoKα","","0.0686","0.0454","","","0.1046","0.117","","","","","","1.048","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016113","10.61","0.0003","12.1878","0.0004","20.522","0.002","90","","90","","90","","2653.8","0.3","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Methyl 3-(2,4-dinitrophenylhydrazono)butanoate","","- C11 H12 N4 O6 -","- C11 H12 N4 O6 -","- C88 H96 N32 O48 -","8","1","SK3141","Wardell, James L.; Skakle, Janet M. S.; Low, John N.; Glidewell, Christopher","Cyclic and acyclic products from the reactions between methyl 3-oxobutanoate and arylhydrazines","Acta Crystallographica Section C","2007","63","8","o462","o467","10.1107/S0108270107029447","","","0.71073","MoKα","","0.0655","0.0443","","","0.1053","0.1158","","","","","","1.047","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016114","15.0138","0.0009","5.2952","0.0003","10.9469","0.0006","90","","90","","90","","870.29","0.09","120","2","120","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","5-Hydroxy-3-methyl-1-phenyl-1H-pyrazole","","- C10 H10 N2 O -","- C10 H10 N2 O -","- C40 H40 N8 O4 -","4","1","SK3141","Wardell, James L.; Skakle, Janet M. S.; Low, John N.; Glidewell, Christopher","Cyclic and acyclic products from the reactions between methyl 3-oxobutanoate and arylhydrazines","Acta Crystallographica Section C","2007","63","8","o462","o467","10.1107/S0108270107029447","","","0.71073","MoKα","","0.0494","0.0392","","","0.088","0.0925","","","","","","1.123","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016115","8.891","0.0003","10.1699","0.0006","13.4731","0.0007","90","","100.415","0.003","90","","1198.17","0.1","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-isopropylidene-3-methyl-1-(3-nitrophenyl)-1H-pyrazol-5(4H)-one","","- C13 H13 N3 O3 -","- C13 H13 N3 O3 -","- C52 H52 N12 O12 -","4","1","SK3141","Wardell, James L.; Skakle, Janet M. S.; Low, John N.; Glidewell, Christopher","Cyclic and acyclic products from the reactions between methyl 3-oxobutanoate and arylhydrazines","Acta Crystallographica Section C","2007","63","8","o462","o467","10.1107/S0108270107029447","","","0.71073","MoKα","","0.0997","0.0595","","","0.1444","0.1654","","","","","","1.038","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016116","6.8119","0.001","7.0301","0.0012","8.5403","0.0013","66.631","0.016","80.204","0.013","71.305","0.014","355.19","0.11","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","5-chloro-1,2-dimethyl-4-nitro-1H-imidazole","","- C5 H6 Cl N3 O2 -","- C5 H6 Cl N3 O2 -","- C10 H12 Cl2 N6 O4 -","2","1","SK3142","Kubicki, Maciej; Wagner, Paweł","Two different modes of halogen bonding in two 4-nitroimidazole derivatives","Acta Crystallographica Section C","2007","63","8","o454","o457","10.1107/S0108270107029721","","","0.71073","MoKα","","0.0294","0.0253","","","0.0641","0.0656","","","","","","1.077","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016117","11.655","0.0009","6.1372","0.0005","8.6994","0.0006","90","","90","","90","","622.26","0.08","100","1","100","1","","","","","","","","5","P n m a","-P 2ac 2n","62","","2-chloro-1-methyl-4-nitro-1H-imidazole","","- C4 H4 Cl N3 O2 -","- C4 H4 Cl N3 O2 -","- C16 H16 Cl4 N12 O8 -","4","0.5","SK3142","Kubicki, Maciej; Wagner, Paweł","Two different modes of halogen bonding in two 4-nitroimidazole derivatives","Acta Crystallographica Section C","2007","63","8","o454","o457","10.1107/S0108270107029721","","","0.71073","MoKα","","0.0538","0.0298","","","0.0578","0.0646","","","","","","1.011","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016118","8.258","0.0006","9.6225","0.0007","10.7899","0.0007","90","","101.382","0.001","90","","840.53","0.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","poly[caesium(I) [(μ~4~-ethylenediphosphonato)cobalt(II)]],","","- C2 H5 Co Cs O6 P2 -","- C2 H5 Co Cs O6 P2 -","- C8 H20 Co4 Cs4 O24 P8 -","4","1","SQ3080","Fu, Shu-Juan; Cheng, Ching-Yuan; Lin, Kuan-Jiuh","A tetrahedrally coordinated cobalt(II) phosphonate with a three-dimensional framework containing two-dimensional channels","Acta Crystallographica Section C","2007","63","8","m368","m370","10.1107/S0108270107029113","","","0.71073","MoKα","","0.0329","0.0313","","","0.0786","0.0796","","","","","","1.186","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016119","24.493","0.005","12.355","0.003","19.539","0.004","90","","102.43","0.03","90","","5774","2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","mer-Bis(1,4-dibenzoylthiosemicarbazidato-κ^3^O,N,O')cobalt(II)","","- C30 H24 Co N6 O4 S2 -","- C30 H24 Co N6 O4 S2 -","- C240 H192 Co8 N48 O32 S16 -","8","1","SQ3082","Ke, Yuan-Zhen; Zheng, Leng-Feng; Luo, Jian-Hai; Huang, Xi-He; Huang, Chang-Cang","<i>mer</i>-Bis(1,4-dibenzoylthiosemicarbazidato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')cobalt(II)","Acta Crystallographica Section C","2007","63","8","m343","m345","10.1107/S0108270107027631","","","0.71073","MoKα","","0.128","0.0548","","","0.0995","0.1194","","","","","","1.007","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016120","10.7928","0.0002","11.4223","0.0002","12.2417","0.0002","90","","100.619","0.001","90","","1483.29","0.05","295","1","295","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-Dichloridobis(diethyl sulfide-κS)platinum(II)","","- C8 H20 Cl2 Pt S2 -","- C8 H20 Cl2 Pt S2 -","- C32 H80 Cl8 Pt4 S8 -","4","1","SQ3085","Hansson, Christian","<i>cis</i>-Dichloridobis(diethyl sulfide-κ<i>S</i>)platinum(II) at 295 and 150K","Acta Crystallographica Section C","2007","63","8","m361","m363","10.1107/S0108270107030417","","","0.71073","MoKα","","0.0561","0.0272","","","0.0606","0.0764","","","","","","1.002","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016121","10.7598","0.0005","11.1976","0.0005","12.1559","0.0005","90","","101.536","0.004","90","","1435","0.11","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-Dichloridobis(diethyl sulfide-κS)platinum(II)","","- C8 H20 Cl2 Pt S2 -","- C8 H20 Cl2 Pt S2 -","- C32 H80 Cl8 Pt4 S8 -","4","1","SQ3085","Hansson, Christian","<i>cis</i>-Dichloridobis(diethyl sulfide-κ<i>S</i>)platinum(II) at 295 and 150K","Acta Crystallographica Section C","2007","63","8","m361","m363","10.1107/S0108270107030417","","","0.71073","MoKα","","0.0388","0.0267","","","0.0674","0.0797","","","","","","1.015","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016122","8.7451","0.0011","10.0346","0.0013","10.7877","0.0014","95.377","0.001","104.954","0.001","104.047","0.002","874.82","0.19","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","4-[2-(4-pyridyl)ethenyl]pyridinium 2-carboxybenzenesulfonate","","- C19 H16 N2 O5 S -","- C19 H16 N2 O5 S -","- C38 H32 N4 O10 S2 -","2","1","SQ3086","Zhang, Jing; Zhu, Long-Guan","Different supramolecular assemblies in two 1:1 proton-transfer compounds of sulfobenzoic acids with aromatic amines","Acta Crystallographica Section C","2007","63","8","o484","o486","10.1107/S0108270107033008","","","0.71073","MoKα","","0.0492","0.0391","","","0.0995","0.1109","","","","","","0.862","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016123","7.1807","0.0006","7.1807","0.0006","36.171","0.003","90","","90","","90","","1865.1","0.3","295","2","295","2","","","","","","","","5","P 41","P 4w","76","","1,10-phenanthrolin-1-ium 4-carboxybenzenesulfonate dihydrate","","- C19 H18 N2 O7 S -","- C19 H18 N2 O7 S -","- C76 H72 N8 O28 S4 -","4","1","SQ3086","Zhang, Jing; Zhu, Long-Guan","Different supramolecular assemblies in two 1:1 proton-transfer compounds of sulfobenzoic acids with aromatic amines","Acta Crystallographica Section C","2007","63","8","o484","o486","10.1107/S0108270107033008","","","0.71073","MoKα","","0.0392","0.0358","","","0.0952","0.0992","","","","","","0.802","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016124","29.384","0.006","7.146","0.001","21.75","0.004","90","","126.39","0.03","90","","3676.4","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4,6-Dimethyl-2-[(4-phenylpiperidin-1-yl)methyl]isothiazolo[5,4- <i>b</i>]pyridin-3(2<i>H</i>)-one","","- C20 H23 N3 O S -","- C20 H23 N3 O S -","- C160 H184 N24 O8 S8 -","8","1","TR3017","Karczmarzyk, Zbigniew; Malinka, Wiesław","4,6-Dimethyl-2-[(4-phenylpiperidin-1-yl)methyl]isothiazolo[5,4-<i>b</i>]pyridin-3(2<i>H</i>)-one and 4,6-dimethyl-2-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)methyl]isothiazolo[5,4-<i>b</i>]pyridin-3(2<i>H</i>)-one","Acta Crystallographica Section C","2007","63","8","o477","o480","10.1107/S0108270107031071","","","1.54178","CuKα","","0.0477","0.0464","","","0.2004","0.2065","","","","","","0.998","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016125","17.548","0.003","11.007","0.002","9.033","0.002","90","","93.83","0.03","90","","1740.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,6-dimethyl-2-[(4-phenyl-1,2,3,6-tetrahydropyridin-1- yl)methyl]isothiazolo[5,4-<i>b</i>]-3(2<i>H</i>)-one","","- C20 H21 N3 O S -","- C20 H21 N3 O S -","- C80 H84 N12 O4 S4 -","4","1","TR3017","Karczmarzyk, Zbigniew; Malinka, Wiesław","4,6-Dimethyl-2-[(4-phenylpiperidin-1-yl)methyl]isothiazolo[5,4-<i>b</i>]pyridin-3(2<i>H</i>)-one and 4,6-dimethyl-2-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)methyl]isothiazolo[5,4-<i>b</i>]pyridin-3(2<i>H</i>)-one","Acta Crystallographica Section C","2007","63","8","o477","o480","10.1107/S0108270107031071","","","1.54178","CuKα","","0.0395","0.039","","","0.1132","0.114","","","","","","1.046","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016126","6.021","0.004","28.789","0.011","7.426","0.005","90","","107.89","0.04","90","","1225","1.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","p-carboxylphenylammonium (2R,3R)-tartrate","4-Carboxyanilinium (2R,3R)-tartrate","","- C11 H13 N O8 -","- C11 H13 N O8 -","- C44 H52 N4 O32 -","4","2","AV3090","S. Athimoolam; S. Natarajan","4-Carboxyanilinium (2<i>R</i>,3<i>R</i>)-tartrate and a redetermination of the α-polymorph of 4-aminobenzoic acid","Acta Crystallographica Section C","2007","63","9","o514","o517","10.1107/S0108270107022469","","","0.71073","MoKα","","0.0699","0.0391","","","0.0855","0.1059","","","","","","1.079","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016127","18.5712","0.0008","3.8431","0.0003","18.6321","0.0009","90","","93.67","0.011","90","","1327.06","0.14","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","p-aminobenzoic acid","4-Aminobenzoic acid","","- C7 H7 N O2 -","- C7 H7 N O2 -","- C56 H56 N8 O16 -","8","2","AV3090","S. Athimoolam; S. Natarajan","4-Carboxyanilinium (2<i>R</i>,3<i>R</i>)-tartrate and a redetermination of the α-polymorph of 4-aminobenzoic acid","Acta Crystallographica Section C","2007","63","9","o514","o517","10.1107/S0108270107022469","","","0.71073","MoKα","","0.1072","0.0656","","","0.2065","0.2271","","","","","","1.17","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016128","8.9547","0.0013","10.6215","0.0015","11.3899","0.0016","80.393","0.005","86.408","0.003","80.138","0.002","1051.7","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[pyridinecopper(II)]bis(μ~3~-4-(2-\ oxidobenzylideneamino)benzoato)] dimethylformamide disolvate]","","- C22 H21 Cu N3 O4 -","- C22 H21 Cu N3 O4 -","- C44 H42 Cu2 N6 O8 -","2","1","AV3097","Qing-Ling Ni; Fa-Si Li; Xiu-Jian Wang; Xian-Su Bi; Sen Liao","<i>catena</i>-Poly[[[pyridinecopper(II)]bis[μ~3~-4-(2-oxidobenzylideneamino)benzoato]] dimethylformamide disolvate], a polymer composed of dimeric dicopper building units","Acta Crystallographica Section C","2007","63","9","m416","m418","10.1107/S010827010703781X","","","0.71073","MoKα","","0.0712","0.0592","","","0.171","0.1842","","","","","","1.094","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016129","10.6087","0.0016","9.4342","0.001","11.1367","0.0019","90","","118","0.006","90","","984.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[μ~2~-4-aminobenzoato-aqua-μ~2~-nitrato-zinc]","","- C7 H8 N2 O6 Zn -","- C7 H8 N2 O6 Zn -","- C28 H32 N8 O24 Zn4 -","4","1","AV3098","Zhang, Quan-Zheng","Poly[μ~2~-4-aminobenzoato-aqua-μ~2~-nitrato-zinc]","Acta Crystallographica Section C","2007","63","9","m405","m406","10.1107/S0108270107036256","","","0.71073","MoKα","","0.0571","0.0422","","","0.0844","0.0915","","","","","","1.112","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016130","25.711","0.002","6.6934","0.0004","15.007","0.001","90","","103.656","0.006","90","","2509.6","0.3","296","","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hexaaquazinc(II) dipicrate trihydrate","","- C12 H22 N6 O23 Zn -","- C12 H22 N6 O23 Zn -","- C48 H88 N24 O92 Zn4 -","4","1","BG3046","Kazumasa Honda; Hiroshi Yamawaki; Hiroshi Fujihisa; Takehiro Matsunaga; Makoto Matsukawa","Hexaaquazinc(II) dipicrate trihydrate","Acta Crystallographica Section C","2007","63","9","m423","m426","10.1107/S0108270107035111","","","0.7107","MoKα","","","0.0487","","","","0.1339","","","","","","1.312","","","","has coordinates,has Fobs","203832","2020-10-21","18:00:00",""
"2016131","14.4002","0.0007","14.5478","0.0007","21.0119","0.001","90","","133.017","0.003","90","","3218.4","0.3","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Acetonitrile){2,6-bis[1-(2,4,6-trimethylphenylimino)ethyl]pyridine}\ dicholoridoruthenium(II) dichloromethane solvate","","- C30 H36 Cl4 N4 Ru -","- C30 H36 Cl4 N4 Ru -","- C120 H144 Cl16 N16 Ru4 -","4","1","BG3047","Özdemir, Namık; Dinçer, Muharrem; Dayan, Osman; Çetinkaya, Bekir","(Acetonitrile){2,6-bis[1-(2,4,6-trimethylphenylimino)ethyl]pyridine}dichloridoruthenium(II) dichloromethane solvate","Acta Crystallographica Section C","2007","63","9","m407","m409","10.1107/S0108270107036669","","","0.71073","MoKα","","0.1016","0.0589","","","0.1656","0.1795","","","","","","1.077","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016132","5.4957","0.0006","11.6909","0.0014","11.7435","0.0014","103.142","0.01","101.398","0.009","98.332","0.009","705.88","0.15","193","2","193","2","","","","","","","","6","P -1","-P 1","2","trans-Bis(3-aminoflavone-κ^2^<i>N</i>,<i>O</i>)bis(perchlorato-κ<i>O</i>) copper(II)","trans-bis(3-amino-2-phenyl-4H-1-benzopyran-4-one- κ^2^N,O^4^)bis(perchlorato-κO)copper(II)","","- C30 H22 Cl2 Cu N2 O12 -","- C30 H22 Cl2 Cu N2 O12 -","- C30 H22 Cl2 Cu N2 O12 -","1","0.5","BM3030","Rybarczyk-Pirek, Agnieszka J.; Małecka, Magdalena; Glinka, Łukasz; Ochocki, Justyn","<i>trans</i>-Bis(3-aminoflavone-κ^2^<i>N</i>,<i>O</i>)bis(perchlorato-κ<i>O</i>)copper(II), a new potential antitumour agent","Acta Crystallographica Section C","2007","63","9","m410","m412","10.1107/S010827010703747X","","","0.71073","MoKα","","0.0576","0.037","","","0.0795","0.0842","","","","","","0.96","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016133","25.806","0.009","9.546","0.0013","23.577","0.01","90","","106.6","0.04","90","","5566","3","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","1-H-nicotinamidium(1+) decavanadate(V) dihydrate","Hexakis[3-(aminocarbonyl)pyridinium] decavanadate(V) dihydrate","","- C36 H46 N12 O36 V10 -","- C36 H46 N12 O36 V10 -","- C144 H184 N48 O144 V40 -","4","0.5","DN3044","Pacigová, Silvia; Rakovský, Erik; Sivák, Michal; Žák, Zdirad","Hexakis[3-(aminocarbonyl)pyridinium] decavanadate(V) dihydrate","Acta Crystallographica Section C","2007","63","9","m419","m422","10.1107/S0108270107028557","","","0.71073","MoKα","","0.0245","0.0207","","","0.0611","0.0624","","","","","","1.07","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016134","8.2706","0.0016","8.3878","0.0016","30.342","0.006","90","","93.542","0.002","90","","2100.9","0.7","293","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[hexaaquabis[μ~4~-2-hydroxy-4- (4-sulfonatophenyldiazenyl)benzoato]dibarium(II)] 4,4'-bipyridine solvate]","","- C36 H36 Ba2 N6 O18 S2 -","- C36 H36 Ba2 N6 O18 S2 -","- C72 H72 Ba4 N12 O36 S4 -","2","0.5","DN3047","Hong Liu; Zhan-Feng Ju; Wei Li; Jie Zhang","Poly[[hexaaquabis[μ~4~-2-hydroxy-5-(4-sulfonatophenyldiazenyl)benzoato]dibarium(II)] 4,4'-bipyridine solvate]","Acta Crystallographica Section C","2007","63","9","m413","m415","10.1107/S0108270107028235","","","0.71073","MoKα","","0.0264","0.025","","","0.0601","0.0609","","","","","","1.065","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016135","5.3812","0.0003","9.9032","0.0006","20.1882","0.0012","90","","90","","90","","1075.85","0.11","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(E)-Methyl 2-anilinomethylene-3-oxobutanoate","","- C12 H13 N O3 -","- C12 H13 N O3 -","- C48 H52 N4 O12 -","4","1","DN3055","Vratislav Langer; Eva Scholtzová; Viktor Milata; Tomáš Solčan","(<i>E</i>)-Methyl 2-anilinomethylene-3-oxobutanoate: X-ray and density functional theory studies","Acta Crystallographica Section C","2007","63","9","o552","o554","10.1107/S0108270107034397","","","0.71073","MoKα","","0.0459","0.0353","","","0.0929","0.1","","","","","","1","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016136","10.0649","0.0011","11.0187","0.0012","12.0352","0.0013","73.357","0.002","79.305","0.003","85.411","0.004","1256.1","0.2","301","1","301","1","","","","","","","","4","P -1","-P 1","2","Amitriptylinium picrate","3-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ylidene)-N,N-dimethylpropan-1- aminium 2,4,6-trinitrophenolate","","- C26 H26 N4 O7 -","- C26 H26 N4 O7 -","- C52 H52 N8 O14 -","2","1","FA3097","Bindya, S.; Wong, Wing-Tak; Ashok, M. A.; Yathirajan, H. S.; Rathore, R. S.","Amitriptylinium picrate: conformational disorder","Acta Crystallographica Section C","2007","63","9","o546","o548","10.1107/S0108270107037468","","","0.71073","MoKα","","0.0724","0.0575","","","0.162","0.1783","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016137","7.009","0.002","14.148","0.004","6.656","0.002","90","","90","","90","","660","0.3","85","2","85","2","","","","","","","","5","C m c m","-C 2c 2","63","","Calcium chloride rhenate(VII) dihydrate","","- Ca Cl H4 O6 Re -","- Ca Cl H4 O6 Re -","- Ca4 Cl4 H16 O24 Re4 -","4","0.25","FA3099","Jarek, Urszula; Hołyńska, Małgorzata; Ślepokura, Katarzyna; Lis, Tadeusz","Calcium chloride rhenate(VII) dihydrate","Acta Crystallographica Section C","2007","63","9","i77","i79","10.1107/S0108270107037456","","","0.71073","MoKα","","0.0176","0.0155","","","0.0368","0.0373","","","","","","1.094","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016138","12.513","0.009","5.0135","0.0013","4.7628","0.0015","90","","111.854","0.004","90","","277.3","0.2","200","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Barium tetrafluoridoborate","","- B2 Ba F8 -","- B2 Ba F8 -","- B4 Ba2 F16 -","2","0.25","FA3102","Bunic̆, Tina; Tavc̆ar, Gas̆per; Goreshnik, Evgeny; Z̆emva, Boris","Strontium tetrafluoridoborate and barium tetrafluoridoborate","Acta Crystallographica Section C","2007","63","9","i75","i76","10.1107/S0108270107036864","","","0.71069","MoKα","","0.029","0.029","","","0.0699","0.0699","","","","","","1.194","","","","has coordinates,has Fobs","282548","2023-04-10","20:38:56",""
"2016139","9.121","0.007","8.714","0.006","13.18","0.009","90","","90","","90","","1047.6","1.3","200","2","200","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Strontium tetrafluoridoborate","","- B2 F8 Sr -","- B2 F8 Sr -","- B16 F64 Sr8 -","8","1","FA3102","Bunic̆, Tina; Tavc̆ar, Gas̆per; Goreshnik, Evgeny; Z̆emva, Boris","Strontium tetrafluoridoborate and barium tetrafluoridoborate","Acta Crystallographica Section C","2007","63","9","i75","i76","10.1107/S0108270107036864","","","0.71069","MoKα","","0.0498","0.046","","","0.1487","0.153","","","","","","1.086","","","","has coordinates,has Fobs","282533","2023-04-10","15:17:41",""
"2016140","11.854","0.002","7.7308","0.0013","7.6827","0.0013","90","","92.407","0.003","90","","703.4","0.2","174","2","174","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-iodobenzaldehyde azine","","- C14 H10 I2 N2 -","- C14 H10 I2 N2 -","- C28 H20 I4 N4 -","2","0.5","GA3056","Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Cramer, Christopher J.","Three polymorphs of 4-4'-diiodobenzalazine, and 4-chloro-4'-iodobenzalazine","Acta Crystallographica Section C","2007","63","9","o518","o523","10.1107/S0108270107034786","","","0.71073","MoKα","","0.026","0.022","","","0.052","0.054","","","","","","1.11","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016141","8.4303","0.0017","5.6453","0.0012","15.248","0.003","90","","104.346","0.003","90","","703","0.2","174","2","174","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-iodobenzaldehyde azine","","- C14 H10 I2 N2 -","- C14 H10 I2 N2 -","- C28 H20 I4 N4 -","2","0.5","GA3056","Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Cramer, Christopher J.","Three polymorphs of 4-4'-diiodobenzalazine, and 4-chloro-4'-iodobenzalazine","Acta Crystallographica Section C","2007","63","9","o518","o523","10.1107/S0108270107034786","","","0.71073","MoKα","","0.058","0.031","","","0.055","0.061","","","","","","1.02","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016142","7.2077","0.0017","4.1543","0.001","23.317","0.006","90","","90.314","0.004","90","","698.2","0.3","174","2","174","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-iodobenzaldehyde azine","","- C14 H10 I2 N2 -","- C14 H10 I2 N2 -","- C28 H20 I4 N4 -","2","0.5","GA3056","Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Cramer, Christopher J.","Three polymorphs of 4-4'-diiodobenzalazine, and 4-chloro-4'-iodobenzalazine","Acta Crystallographica Section C","2007","63","9","o518","o523","10.1107/S0108270107034786","","","0.71073","MoKα","","0.065","0.047","","","0.115","0.122","","","","","","1.05","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016143","11.499","0.002","4.0006","0.0007","14.717","0.003","90","","90.9","0.003","90","","676.9","0.2","174","2","174","2","","","","","","","","5","P 1 c 1","P -2yc","7","","1-(4-Chlorobenzylidene)-2-(4-iodobenzylidene)diazane","","- C14 H10 Cl I N2 -","- C14 H10 Cl I N2 -","- C28 H20 Cl2 I2 N4 -","2","1","GA3056","Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Cramer, Christopher J.","Three polymorphs of 4-4'-diiodobenzalazine, and 4-chloro-4'-iodobenzalazine","Acta Crystallographica Section C","2007","63","9","o518","o523","10.1107/S0108270107034786","","","0.71073","MoKα","","0.063","0.038","","","0.066","0.072","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016144","6.4968","0.0005","10.2591","0.0011","13.3852","0.001","90","","90","","90","","892.14","0.14","296","2","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","poly[μ~3~-(boric acid)-μ~4~-maleato-dipotassium]","","- C4 H5 B K2 O7 -","- C4 H5 B K2 O7 -","- C16 H20 B4 K8 O28 -","4","1","GA3059","Mustafa Tombul; Kutalmis Guven; Orhan Büyükgüngör; Huseyin Aktas; Tahsin Nuri Durlu","Dipotassium maleate with boric acid","Acta Crystallographica Section C","2007","63","9","m430","m432","10.1107/S0108270107036165","","","0.71073","MoKα","","0.0278","0.0273","","","0.0714","0.0718","","","","","","1.046","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016145","29.067","0.0011","11.256","0.0009","10.148","0.0007","90","","96.58","0.005","90","","3298.3","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1'-Methyl-2'',3''-dihydrocyclooctane-1-spiro-3'-pyrrolidine-2'-spiro-3''- 1H-indole-2,2''-dione","","- C19 H24 N2 O2 -","- C19 H24 N2 O2 -","- C152 H192 N16 O16 -","8","2","GA3060","J. Suresh; R. Suresh Kumar; S. Perumal; S. Natarajan","1'-Methylcyclooctane-1-spiro-3'-pyrrolidine-2'-spiro-3''-indoline-2,2''-dione and 1,1'-dimethylpiperidine-3-spiro-3'-pyrrolidine-2'-spiro-3''-indoline-2'',4-dione","Acta Crystallographica Section C","2007","63","9","o538","o542","10.1107/S0108270107035779","","","0.71069","MoKα","","0.1215","0.0426","","","0.0928","0.1195","","","","","","1.002","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016146","9.5194","0.0007","21.8847","0.0014","15.5413","0.0011","90","","93.86","0.04","90","","3230.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,1'-dimethyl-2'',3''-dihydropiperidine-3-spiro-3'-pyrrolidine-2'-spiro-3''- 1H-indole-4,2''-dione","","- C17 H21 N3 O2 -","- C17 H21 N3 O2 -","- C136 H168 N24 O16 -","8","2","GA3060","J. Suresh; R. Suresh Kumar; S. Perumal; S. Natarajan","1'-Methylcyclooctane-1-spiro-3'-pyrrolidine-2'-spiro-3''-indoline-2,2''-dione and 1,1'-dimethylpiperidine-3-spiro-3'-pyrrolidine-2'-spiro-3''-indoline-2'',4-dione","Acta Crystallographica Section C","2007","63","9","o538","o542","10.1107/S0108270107035779","","","0.71073","MoKα","","0.1755","0.0478","","","0.098","0.1344","","","","","","0.972","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016147","7.051","0.0005","14.5981","0.0011","10.6214","0.0008","90","","108.046","0.001","90","","1039.49","0.13","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[[triaqua(μ~4~-oxydiacetato)lanthanum(III)] nitrate]","","- C4 H10 La N O11 -","- C4 H10 La N O11 -","- C16 H40 La4 N4 O44 -","4","1","GA3062","Griselda Polla; María Teresa Garland; Ricardo Baggio","Structure and thermal decomposition of poly[[triaqua(μ~4~-oxydiacetato)lanthanum(III)] nitrate]","Acta Crystallographica Section C","2007","63","9","m385","m388","10.1107/S0108270107034245","","","0.71073","MoKα","","0.0339","0.028","","","0.0611","0.0631","","","","","","1.059","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016148","6.8284","0.0001","10.6888","0.0002","18.5505","0.0003","90","","94.305","0.001","90","","1350.13","0.04","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-poly[cadmium(II)]-bis(μ-6-methylpicolinato)]","","- C14 H12 Cd N2 O4 -","- C14 H12 Cd N2 O4 -","- C56 H48 Cd4 N8 O16 -","4","1","GD3123","Kukovec, Boris-Marko; Popović, Zora; Pavlović, Gordana","A one-dimensional Cd^II^ coordination polymer: <i>catena</i>-poly[cadmium(II)-bis(μ-6-methylpicolinato)]","Acta Crystallographica Section C","2007","63","9","m389","m391","10.1107/S0108270107034646","","","0.71073","MoKα","","0.0448","0.0272","","","0.0572","0.0615","","","","","","0.947","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016149","12.8718","0.0006","8.0615","0.0003","8.3059","0.0003","90","","100.695","0.002","90","","846.9","0.06","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[(μ~3~-1,1-dioxo-1,2-benzoisothiazole-3-thiolato- κ^3^N:S^3^:S^3^)silver(I)]","","- C7 H4 Ag N O2 S2 -","- C7 H4 Ag N O2 S2 -","- C28 H16 Ag4 N4 O8 S8 -","4","1","GD3125","Dennehy, Mariana; Quinzani, Oscar V.; Burrow, Robert A.","Poly[(μ~3~-1,1-dioxo-1,2-benzoisothiazole-3-thiolato-κ^3^<i>N</i>:<i>S</i>^3^:<i>S</i>^3^)silver(I)]","Acta Crystallographica Section C","2007","63","9","m395","m397","10.1107/S0108270107035597","","","0.71073","MoKα","","0.0356","0.0297","","","0.071","0.0748","","","","","","1.047","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016150","6.1242","0.0004","18.8223","0.0007","11.7466","0.0004","90","","104.962","0.003","90","","1308.14","0.11","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Trinitroethanol","2,2,2-Trinitroethanol","","- C2 H3 N3 O7 -","- C2 H3 N3 O7 -","- C16 H24 N24 O56 -","8","2","GD3132","Göbel, Michael; Klapötke, Thomas M.","2,2,2-Trinitroethanol","Acta Crystallographica Section C","2007","63","9","o562","o564","10.1107/S0108270107037833","","","0.71073","MoKα","","0.0432","0.0371","","","0.0874","0.0919","","","","","","1.127","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016151","7.001","0.006","7.21","0.006","8.102","0.007","91.085","0.007","91.052","0.007","107.764","0.007","389.3","0.6","295","2","295","2","","","","","","","","5","P -1","-P 1","2","N-acetyl-thiohydantoin-alanine","<i>rac</i>-1-acetyl-5-methyl-2-thioxoimidazolidin-4-one","","- C6 H8 N2 O2 S -","- C6 H8 N2 O2 S -","- C12 H16 N4 O4 S2 -","2","1","GD3133","Sulbaran, Maria E; Delgado, Gerzon E.; Mora, Asiloé J.; Bahsas, Ali; Novoa de Armas, Hector; Blaton, Norbert","Hydrogen-bonding patterns in <i>rac</i>-1-acetyl-5-methyl-2-thioxoimidazolidin-4-one","Acta Crystallographica Section C","2007","63","9","o543","o545","10.1107/S0108270107038012","","","0.71069","MoKα","","0.0687","0.0407","","","0.0985","0.1051","","","","","","1.021","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2016152","9.3571","0.0009","7.8717","0.0006","9.8053","0.0008","90","","91.943","0.007","90","","721.81","0.11","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis(2-carboxypyridinium) hexafluorosilicate","","- C12 H12 F6 N2 O4 Si -","- C12 H12 F6 N2 O4 Si -","- C24 H24 F12 N4 O8 Si2 -","2","0.5","GG3102","Gelmboldt, Vladimir O.; Ganin, Eduard V.; Domasevitch, Konstantin V.","Hydrogen-bonded frameworks of bis(2-carboxypyridinium) hexafluorosilicate and bis(2-carboxyquinolinium) hexafluorosilicate dihydrate","Acta Crystallographica Section C","2007","63","9","o530","o534","10.1107/S0108270107035469","","","0.71073","MoKα","","0.0395","0.0325","","","0.0898","0.0923","","","","","","1.044","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016153","6.6382","0.0006","9.4274","0.0009","17.0668","0.0014","90","","91.731","0.008","90","","1067.57","0.17","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis(2-carboxyquinolinium) hexafluorosilicate dihydrate","","- C20 H20 F6 N2 O6 Si -","- C20 H20 F6 N2 O6 Si -","- C40 H40 F12 N4 O12 Si2 -","2","0.5","GG3102","Gelmboldt, Vladimir O.; Ganin, Eduard V.; Domasevitch, Konstantin V.","Hydrogen-bonded frameworks of bis(2-carboxypyridinium) hexafluorosilicate and bis(2-carboxyquinolinium) hexafluorosilicate dihydrate","Acta Crystallographica Section C","2007","63","9","o530","o534","10.1107/S0108270107035469","","","0.71073","MoKα","","0.0413","0.0366","","","0.0992","0.1015","","","","","","1.046","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016154","7.4861","0.0013","17.2008","0.0013","8.0283","0.0019","90","","111.972","0.013","90","","958.7","0.3","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4',6,6'-tetrachloro-2,2'-(piperazin-1,4-diyldimethylene)diphenol","","- C18 H18 Cl4 N2 O2 -","- C18 H18 Cl4 N2 O2 -","- C36 H36 Cl8 N4 O4 -","2","0.5","GG3104","Kubono, Koji; Yokoi, Kunihiko","Monoclinic and orthorhombic polymorphs of 4,4',6,6'-tetrachloro-2,2'-(piperazine-1,4-diyldimethylene)diphenol","Acta Crystallographica Section C","2007","63","9","o535","o537","10.1107/S0108270107035408","","","0.71069","MoKα","","","0.0402","","","","0.1248","","","","","","1.009","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016155","10.36","0.003","12.191","0.0017","15.332","0.005","90","","90","","90","","1936.4","0.9","298","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","4,4',6,6'-tetrachloro-2,2'-(piperazin-1,4-diyldimethylene)diphenol","","- C18 H18 Cl4 N2 O2 -","- C18 H18 Cl4 N2 O2 -","- C72 H72 Cl16 N8 O8 -","4","0.5","GG3104","Kubono, Koji; Yokoi, Kunihiko","Monoclinic and orthorhombic polymorphs of 4,4',6,6'-tetrachloro-2,2'-(piperazine-1,4-diyldimethylene)diphenol","Acta Crystallographica Section C","2007","63","9","o535","o537","10.1107/S0108270107035408","","","0.71069","MoKα","","","0.0366","","","","0.106","","","","","","1.004","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2016156","12.898","0.0012","14.5217","0.0015","19.47","0.002","70.482","0.009","78.89","0.007","77.513","0.009","3327","0.6","120","2","120","2","","","","","","","","7","P -1","-P 1","2","Compound (III)","Tris(dimethylamido)bis(dimethylamine)titanium(IV) chlorido[tris(pentafluorophenyl)boron‒amido]\ [tris(pentafluorophenyl)boron‒nitrido]bis(dimethylamine)titanate(IV) toluene solvate","","- C114 H111 B4 Cl2 F60 N18 Ti4 -","- C107 H103 B4 Cl2 F60 N18 Ti4 -","- C107 H103 B4 Cl2 F60 N18 Ti4 -","1","0.5","GG3107","Mountford, Andrew J.; Lancaster, Simon J.; Coles, Simon J.","Tris(dimethylamido)bis(dimethylamine)titanium(IV) chloridobis(dimethylamine)[tris(pentafluorophenyl)boron‒amido][tris(pentafluorophenyl)boron‒nitrido]titanate(IV) toluene solvate","Acta Crystallographica Section C","2007","63","9","m401","m404","10.1107/S0108270107035238","","","0.71073","MoKα","","0.0956","0.058","","","0.1306","0.1439","","","","","","1.031","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016157","8.1491","0.0005","15.9071","0.001","29.495","0.002","90","","91.379","0.001","90","","3822.3","0.4","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Iodidomesityltellurium(II) iodidotrimesitylditellurium(II)(Te—Te)","","- C36 H44 I2 Te3 -","- C36 H44 I2 Te3 -","- C144 H176 I8 Te12 -","4","1","GG3108","Copolovici, Lucian; Silvestru, Cristian; Lippolis, Vito; Varga, Richard A.","Iodidomesityltellurium(II) iodidotrimesitylditellurium(II)(<i>Te{—</i>Te})","Acta Crystallographica Section C","2007","63","9","o528","o529","10.1107/S0108270107035123","","","0.71073","MoKα","","0.0759","0.0604","","","0.1209","0.1271","","","","","","1.231","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016158","5.2767","0.0008","5.5375","0.0005","10.2809","0.0013","104.598","0.01","90.393","0.012","104.834","0.01","280.2","0.06","120","2","120","2","","","","","","","","4","P 1","P 1","1","","1-deoxy-1-morpholino-D-fructopyranose","","- C10 H19 N O6 -","- C10 H19 N O6 -","- C10 H19 N O6 -","1","1","GG3112","Rodríguez, Ricaurte; Cobo, Justo; Nogueras, Manuel; Low, John N.; Glidewell, Christopher","Hydrogen-bonded sheets of <i>R</i>~2~^2^(10) and <i>R</i>~4~^4^(24) rings in 1-deoxy-1-morpholino-<small>D</small>-fructopyranose","Acta Crystallographica Section C","2007","63","9","o507","o509","10.1107/S0108270107034312","","","0.71073","MoKα","","0.0373","0.0305","","","0.0699","0.0749","","","","","","1.127","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016159","6.1225","0.0007","15.7539","0.0017","15.202","0.0016","90","","95.936","0.001","90","","1458.4","0.3","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(1-(anilino)-2, 2, 2-trichloroethyl)benzenamine","2,2,2-trichloro-<i>N</i>,<i>N</i>'-diphenylethane-1,1-diamine","","- C14 H13 Cl3 N2 -","- C14 H13 Cl3 N2 -","- C56 H52 Cl12 N8 -","4","1","HJ3039","Zhen-Feng Zhang; Dong-Chao Wang; Jian-Ge Wang; Gui-Rong Qu","Two <i>N</i>,<i>N</i>'-diaryl-2,2,2-trichloroethane-1,1-diamines: hydrogen-bonded supramolecular structures in one and two dimensions","Acta Crystallographica Section C","2007","63","9","o524","o527","10.1107/S0108270107034956","","","0.71073","MoKα","","0.0548","0.0373","","","0.0803","0.09","","","","","","1.041","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2016160","5.9238","0.0007","14.6193","0.0016","19.093","0.002","90","","96.992","0.001","90","","1641.2","0.3","291","2","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","N-(1-(p-toluidino)-2,2,2-trichloroethyl)-4-methylbenzenamine","2,2,2-trichloro-<i>N</i>,<i>N</i>'-bis(4-methylphenyl)ethane-1,1-diamine","","- C16 H17 Cl3 N2 -","- C16 H17 Cl3 N2 -","- C64 H68 Cl12 N8 -","4","1","HJ3039","Zhen-Feng Zhang; Dong-Chao Wang; Jian-Ge Wang; Gui-Rong Qu","Two <i>N</i>,<i>N</i>'-diaryl-2,2,2-trichloroethane-1,1-diamines: hydrogen-bonded supramolecular structures in one and two dimensions","Acta Crystallographica Section C","2007","63","9","o524","o527","10.1107/S0108270107034956","","","0.71073","MoKα","","0.0507","0.0378","","","0.0917","0.0992","","","","","","1.03","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2016161","11.5241","0.0016","11.6958","0.0016","12.453","0.002","80.499","0.003","62.449","0.002","75.937","0.002","1440.8","0.4","298","2","298","2","","","","","","","","4","P 1","P 1","1","","2,4(6)-di-O-benzoyl-6(4)-O-{[(1S)-7,7-dimethyl-2- oxobicyclo[2.2.1]heptan-1-ylmethyl]sulfonyl}-myo-inositol 1,3,5-orthoacetate","","- C32 H34 O11 S -","- C32 H34 O11 S -","- C64 H68 O22 S2 -","2","2","HJ3047","K. Manoj; R. G. Gonnade; M. M. Bhadbhade; M. S. Shashidhar","Different interaction motifs of dipolar S=O···C=O contacts that associate diastereomers of 2,4(6)-di-<i>O</i>-benzoyl-6(4)-<i>O</i>-{[(1<i>S</i>)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-ylmethyl]sulfonyl}-<i>myo</i>-inositol 1,3,5-orthoacetate","Acta Crystallographica Section C","2007","63","9","o555","o558","10.1107/S0108270107035858","","","0.71073","MoKα","","0.0543","0.0523","","","0.1338","0.1362","","","","","","1.089","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016162","5.2347","0.001","7.1855","0.0013","8.9972","0.0016","110.756","0.012","96.827","0.013","99.511","0.019","306.28","0.11","293","2","293","2","","","","","","","","5","P 1","P 1","1","2'-deoxyimmunosine","5-amino-3-(2-deoxy-β-D-erythro-pentofuranosyl)thiazolo[4,5-d]pyrimidine- 2,7-(3H,6H)-dione","","- C10 H12 N4 O5 S -","- C10 H12 N4 O5 S -","- C10 H12 N4 O5 S -","1","1","JZ3073","Seela, Frank; Ming, Xin; Budow, Simone; Eickmeier, Henning; Reuter, Hans","2'-Deoxyimmunosine: a thiazolo[4,5-<i>d</i>]pyrimidine nucleoside adopting the <i>syn</i> conformation","Acta Crystallographica Section C","2007","63","9","o549","o551","10.1107/S010827010703750X","","","0.71073","MoKα","","0.0267","0.0266","","","0.0727","0.0728","","","","","","1.068","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016163","9.793","0.002","10.17","0.002","14.374","0.002","82.78","0.02","80.07","0.02","78.35","0.02","1374.9","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","<i>O</i>-phenyl triphenylphosphoniummethylenephosphonate phenol solvate","","- C31 H28 O4 P2 -","- C31 H28 O4 P2 -","- C62 H56 O8 P4 -","2","1","SK3145","Chęcińska, Lilianna; Rybarczyk-Pirek, Agnieszka J.; Kudzin, Zbigniew H.; Okruszek, Andrzej","<i>O</i>-Phenyl (triphenylphosphoniomethyl)phosphonate phenol solvate: supramolecular structure generated by O—H···O, C—H···O and C—H···π(arene) hydrogen bonds","Acta Crystallographica Section C","2007","63","9","o504","o506","10.1107/S0108270107032453","","","0.71069","MoKα","","0.0612","0.0328","","","0.0793","0.082","","","","","","1.023","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016164","12.3516","0.0008","7.5202","0.0004","17.1564","0.0013","90","","100.699","0.005","90","","1565.89","0.18","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","methyl 4-(5-amino-3-phenyl-1<i>H</i>-pyrazol-1-yl)-3-nitrobenzoate","","- C17 H14 N4 O4 -","- C17 H14 N4 O4 -","- C68 H56 N16 O16 -","4","1","SK3149","Portilla, Jaime; Mata, Ernesto G.; Cobo, Justo; Low, John N.; Glidewell, Christopher","Two isomeric reaction products: hydrogen-bonded sheets in methyl 4-(5-amino-3-phenyl-1<i>H</i>-pyrazol-1-yl)-3-nitrobenzoate and hydrogen-bonded chains of edge-fused rings in methyl 3-nitro-4-[(5-phenyl-1<i>H</i>-pyrazol-3-yl)amino]benzoate","Acta Crystallographica Section C","2007","63","9","o510","o513","10.1107/S010827010703346X","","","0.71073","MoKα","","0.103","0.0564","","","0.1403","0.1775","","","","","","1.08","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016165","31.0506","0.0004","5.421","0.0011","20.7251","0.0012","90","","121.071","0.006","90","","2988","0.7","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","methyl 3-nitro-4-[(5-phenyl-1<i>H</i>-pyrazol-3-yl)amino]benzoate","","- C17 H14 N4 O4 -","- C17 H14 N4 O4 -","- C136 H112 N32 O32 -","8","1","SK3149","Portilla, Jaime; Mata, Ernesto G.; Cobo, Justo; Low, John N.; Glidewell, Christopher","Two isomeric reaction products: hydrogen-bonded sheets in methyl 4-(5-amino-3-phenyl-1<i>H</i>-pyrazol-1-yl)-3-nitrobenzoate and hydrogen-bonded chains of edge-fused rings in methyl 3-nitro-4-[(5-phenyl-1<i>H</i>-pyrazol-3-yl)amino]benzoate","Acta Crystallographica Section C","2007","63","9","o510","o513","10.1107/S010827010703346X","","","0.71073","MoKα","","0.0762","0.0479","","","0.1111","0.1336","","","","","","1.107","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016166","10.4339","0.0003","11.1284","0.0003","17.1616","0.0005","90","","96.014","0.0001","90","","1981.71","0.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetrakis(μ-benzoato-κ^2^O:O)bis{[4-(dimethylamino)pyridine-κN^1^]copper(II)}","","- C42 H40 Cu2 N4 O8 -","- C42 H40 Cu2 N4 O8 -","- C84 H80 Cu4 N8 O16 -","2","0.5","SK3150","Bora, Sanchay Jyoti; Sarmah, Purabi; Phukan, Prodeep; Das, Birinchi K.","Tetrakis(μ-benzoato-κ^2^<i>O</i>:<i>O</i>)bis{[4-(dimethylamino)pyridine-κ<i>N</i>^1^]copper(II)}","Acta Crystallographica Section C","2007","63","9","m392","m394","10.1107/S0108270107034944","","","0.71073","MoKα","","0.0335","0.0262","","","0.0681","0.072","","","","","","1.029","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016167","12.715","0.003","5.133","0.001","14.406","0.004","90","","113.63","0.01","90","","861.4","0.4","273","2","179","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,3-dihydrobenzotriazolium hydrogensulfate","","- C6 H7 N3 O4 S -","- C6 H7 N3 O4 S -","- C24 H28 N12 O16 S4 -","4","1","SQ3078","Angel Ramos-Organillo; Rosalinda Contreras","A new sulfate acid polymorph of 1,3-dihydrobenzotriazole","Acta Crystallographica Section C","2007","63","9","o501","o503","10.1107/S0108270107031241","","","0.71073","MoKα","","0.046","0.0352","","","0.0864","0.0947","","","","","","1.065","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016168","5.4455","0.0002","5.44546","","12.2649","0.0009","90","","90","","120","","314.97","0.03","297","","297","","","","","","","","","2","R -3 m :H","-R 3 2""","166","boron subnitride","boron nitride","","- B13 N2 -","- B13 N2 -","- B39 N6 -","3","0.0833333","SQ3084","Kurakevych, Oleksandr O.; Solozhenko, Vladimir L.","Rhombohedral boron subnitride, B~13~N~2~, by X-ray powder diffraction","Acta Crystallographica Section C","2007","63","9","i80","i82","10.1107/S0108270107037353","","","1.5406","CuKα","","","","","","","","","","3.97","","","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2016169","8.7979","0.0018","8.7979","","5.037","0.003","90","","90","","90","","389.9","0.2","297","","297","","","","","","","","","1","P -4 n 2","P -4 -2n","118","boron-rich nitride","boron nitride","","- B -","- B0.96 -","- B48 -","50","6.25","SQ3084","Kurakevych, Oleksandr O.; Solozhenko, Vladimir L.","Rhombohedral boron subnitride, B~13~N~2~, by X-ray powder diffraction","Acta Crystallographica Section C","2007","63","9","i80","i82","10.1107/S0108270107037353","","","1.5406","CuKα","","","","","","","","","","3.97","","","","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016170","2.49824","0.00008","2.49824","","6.6357","0.0002","90","","90","","120","","35.8662","0.0016","297","","297","","","","","","","","","2","P -6 m 2","P -6 2","187","hexagonal boron nitride","boron nitride","","- B N -","- B N -","- B2 N2 -","2","0.166667","SQ3084","Kurakevych, Oleksandr O.; Solozhenko, Vladimir L.","Rhombohedral boron subnitride, B~13~N~2~, by X-ray powder diffraction","Acta Crystallographica Section C","2007","63","9","i80","i82","10.1107/S0108270107037353","","","1.5406","CuKα","","","","","","","","","","3.97","","","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2016171","10.1398","0.0003","10.1398","","10.1398","","65.351","0.003","65.3509","","65.3509","","823.05","0.03","297","","297","","","","","","","","","1","R -3 m :R","-P 3* 2","166","beta-rhombohedral boron","boron","","- B -","- B -","- B105 -","105","8.75","SQ3084","Kurakevych, Oleksandr O.; Solozhenko, Vladimir L.","Rhombohedral boron subnitride, B~13~N~2~, by X-ray powder diffraction","Acta Crystallographica Section C","2007","63","9","i80","i82","10.1107/S0108270107037353","","","1.5406","CuKα","","","","","","","","","","3.97","","","","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2016172","7.0453","","7.0453","","9.6","0.01","90","","90","","120","","412.7","0.4","297","","297","","","","","","","","","3","P 32","P 32","145","boric acid","boric acid","","- B H3 O3 -","- B H3 O3 -","- B6 H18 O18 -","6","2","SQ3084","Kurakevych, Oleksandr O.; Solozhenko, Vladimir L.","Rhombohedral boron subnitride, B~13~N~2~, by X-ray powder diffraction","Acta Crystallographica Section C","2007","63","9","i80","i82","10.1107/S0108270107037353","","","1.5406","CuKα","","","","","","","","","","3.97","","","","","","","has coordinates","201957","2020-10-21","18:00:00",""
"2016173","2.54","","2.54","","6.598","0.003","90","","90","","120","","36.865","0.017","297","","297","","","","","","","","","2","P -6 m 2","P -6 2","187","","boron nitride","","- B N -","- B N -","- B2 N2 -","2","0.166667","SQ3084","Kurakevych, Oleksandr O.; Solozhenko, Vladimir L.","Rhombohedral boron subnitride, B~13~N~2~, by X-ray powder diffraction","Acta Crystallographica Section C","2007","63","9","i80","i82","10.1107/S0108270107037353","","","1.5406","CuKα","","","","","","","","","","3.97","","","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2016174","8.3038","0.0002","10.1267","0.0003","11.2984","0.0003","76.733","0.002","79.565","0.002","86.276","0.002","909.16","0.04","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Tetraaqua-1κO,2κ^3^O-(μ-2,4-dinitrophenolato-1κ^2^O^1^,O^2^:2κO^1^)\ (2,4-dinitrophenolato-1κ^2^O^1^,O^2^)dilithium(I)","","- C12 H14 Li2 N4 O14 -","- C12 H14 Li2 N4 O14 -","- C24 H28 Li4 N8 O28 -","2","1","SQ3089","Kim, Eun-Ju; Kim, Chong-Hyeak; Yun, Sock-Sung","Tetraaqua-1κ<i>O</i>,2κ^3^<i>O</i>-(μ-2,4-dinitrophenolato-1κ^2^<i>O</i>^1^,<i>O</i>^2^:2κ<i>O</i>^1^)(2,4-dinitrophenolato-1κ^2^<i>O</i>^1^,<i>O</i>^2^)dilithium(I): a dinuclear lithium(I) complex","Acta Crystallographica Section C","2007","63","9","m427","m429","10.1107/S0108270107037651","","","0.71073","MoKα","","0.0483","0.037","","","0.1055","0.1152","","","","","","1.041","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016175","16.3631","0.0018","5.6428","0.0005","9.1251","0.0008","90","","101.418","0.01","90","","825.88","0.14","100","1","100","1","","","","","","","","4","P 1 c 1","P -2yc","7","N,N'-Bis(2-hydroxybenzylidene)pentane-1,5-diamine","2,2'-[pentane-1,5-diylbis(nitrilomethylidyne)]diphenol","","- C19 H22 N2 O2 -","- C19 H22 N2 O2 -","- C38 H44 N4 O4 -","2","1","SQ3092","Pospieszna-Markiewicz, Izabela; Kozłowski, Michał; Radecka-Paryzek, Wanda; Kubicki, Maciej","<i>N</i>,<i>N</i>'-Bis(2-hydroxybenzylidene)pentane-1,5-diamine","Acta Crystallographica Section C","2007","63","9","o559","o561","10.1107/S0108270107037900","","","0.71073","MoKα","","0.0753","0.0626","","","0.1067","0.1132","","","","","","1.146","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016176","11.787","0.003","12.554","0.003","3.9242","0.0007","90","","90","","90","","580.7","0.2","293","2","293","2","","","","","","","","5","C m m m","-C 2 2","65","","poly[di-μ~2~-bromido-μ~2~-4,4'-bipyridine-cadmium(II)]","","- C10 H8 Br2 Cd N2 -","- C10 H8 Br2 Cd N2 -","- C20 H16 Br4 Cd2 N4 -","2","0.125","TR3011","Wen-Tong Chen; Xiao-Niu Fang; Qiu-Yan Luo; Ya-Ping Xu; Yan-Ping Duan","Poly[μ~2~-4,4'-bipyridine-di-μ~2~-bromido-cadmium(II)], with novel colour-tunable fluorescence","Acta Crystallographica Section C","2007","63","9","m398","m400","10.1107/S0108270107030028","","","0.71073","MoKα","","0.017","0.0168","","","0.0422","0.0423","","","","","","1.1","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016177","16.144","0.0004","12.7191","0.0003","14.6859","0.0003","90","","90","","90","","3015.56","0.12","293","2","293","2","","","","","","","","6","I b a m","-I 2 2c","72","","tetra-μ~2~-fluorido-tetradecafluoridotrizirconium(IV) hexahydrate","","- Co2 F18 H46 N10 O8 Zr3 -","- Co2 F18 H30 N10 O8 Zr3 -","- Co8 F72 H120 N40 O32 Zr12 -","4","0.25","BC3047","Gubanov, Alexander I.; Kuratieva, Natalia V.","Double complexes [Co(NH~3~)~5~(H~2~O)]~2~[Zr~3~F~18~]·6H~2~O and [Co(NH~3~)~6~]~2~[Zr~3~F~18~]·6H~2~O","Acta Crystallographica Section C","2007","63","10","i83","i85","10.1107/S010827010704108X","","","0.71073","MoKα","","0.0515","0.0473","","","0.107","0.1094","","","","","","1.113","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016178","16.037","0.0003","14.692","0.0002","12.9942","0.0002","90","","90","","90","","3061.64","0.09","293","2","293","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","bis[hexaamminecobalt(III)] tetra-μ~2~-fluorido-tetradecafluoridotrizirconium(IV) hexahydrate","","- Co2 F18 H48 N12 O6 Zr3 -","- Co2 F18 H36 N12 O6 Zr3 -","- Co8 F72 H144 N48 O24 Zr12 -","4","0.5","BC3047","Gubanov, Alexander I.; Kuratieva, Natalia V.","Double complexes [Co(NH~3~)~5~(H~2~O)]~2~[Zr~3~F~18~]·6H~2~O and [Co(NH~3~)~6~]~2~[Zr~3~F~18~]·6H~2~O","Acta Crystallographica Section C","2007","63","10","i83","i85","10.1107/S010827010704108X","","","0.71073","MoKα","","0.0497","0.0408","","","0.1052","0.1096","","","","","","1.187","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016179","11.5536","0.0006","18.4508","0.0009","18.9844","0.001","90","","90","","90","","4047","0.4","84","2","84","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(4,4'-DPyH2)2.(FeBr4)3.Br","bis(4,4'-bipyridinium) tris[tetrabromidoferrate(III)] bromide","","- C20 H20 Br13 Fe3 N4 -","- C20 H20 Br13 Fe3 N4 -","- C80 H80 Br52 Fe12 N16 -","4","1","BG3043","Ali, Basem Fares; Al-Far, Rawhi","A novel framework of N—H···Br hydrogen bonds forming Br(4,4'-bipyridinium)~4~ supramolecular synthons: bis(4,4'-bipyridinium) tris[tetrabromidoferrate(III)] bromide","Acta Crystallographica Section C","2007","63","10","m451","m453","10.1107/S0108270107039856","","","0.71073","MoKα","","0.0425","0.0301","","","0.052","0.0547","","","","","","0.999","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016180","7.2117","0.0001","12.9868","0.0003","14.247","0.0004","90","","90","","90","","1334.33","0.05","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","<i>N</i>-Acetyl-L-tyrosine methyl ester monohydrate","","- C12 H17 N O5 -","- C12 H17 N O5 -","- C48 H68 N4 O20 -","4","1","BM3032","Janik, Alicja; Chyra, Anna; Stadnicka, Katarzyna","<i>N</i>-Acetyl-<small>L</small>-tyrosine methyl ester monohydrate at 293 and 123K","Acta Crystallographica Section C","2007","63","10","o572","o575","10.1107/S0108270107038413","","","0.71073","MoKα","","0.0533","0.0395","","","0.0922","0.1008","","","","","","1.009","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016181","7.1118","0.0002","12.9364","0.0003","14.1538","0.0004","90","","90","","90","","1302.17","0.06","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-Acetyl-L-tyrosine methyl ester monohydrate","","- C12 H17 N O5 -","- C12 H17 N O5 -","- C48 H68 N4 O20 -","4","1","BM3032","Janik, Alicja; Chyra, Anna; Stadnicka, Katarzyna","<i>N</i>-Acetyl-<small>L</small>-tyrosine methyl ester monohydrate at 293 and 123K","Acta Crystallographica Section C","2007","63","10","o572","o575","10.1107/S0108270107038413","","","0.71073","MoKα","","0.0358","0.0317","","","0.081","0.0838","","","","","","1.002","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016182","8.062","0.005","17.955","0.008","11.853","0.006","90","","98.26","0.02","90","","1698","1.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetraaqua-bis(2-methoxybenzaldehyde isonicotinoylhydrazonato)- cadmium(II) dinitrate","","- C28 H34 Cd N8 O14 -","- C28 H34 Cd N8 O14 -","- C56 H68 Cd2 N16 O28 -","2","0.5","BM3034","Fu, Zhongwu; Gao, Shaokang; Liu, Shixiong","Tetraaquabis(2-methoxybenzaldehyde isonicotinoylhydrazone)cadmium(II) dinitrate","Acta Crystallographica Section C","2007","63","10","m459","m461","10.1107/S0108270107044010","","","0.71073","MoKα","","0.0343","0.0278","","","0.0696","0.073","","","","","","1.072","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016183","9.657","0.004","12.969","0.005","12.962","0.006","90","","107.092","0.017","90","","1551.7","1.1","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Chlorido[1,3-di(5-methyl-2-pyridyl)phenyl-κ3N,N',C2]platinum(II)","","- C18 H15 Cl N2 Pt -","- C18 H15 Cl N2 Pt -","- C72 H60 Cl4 N8 Pt4 -","4","1","BM3040","Taichi Abe; Kazuteru Shinozaki; Noriaki Ikeda; Takayoshi Suzuki","[2,6-Bis(5-methyl-2-pyridyl)phenyl-κ^3^<i>N</i>,<i>C</i>^1^,<i>N</i>']chloridoplatinum(II)","Acta Crystallographica Section C","2007","63","10","m456","m458","10.1107/S0108270107044009","","","0.71075","MoKα","","0.0194","0.0177","","","0.0384","0.039","","","","","","1.066","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016184","5.4258","0.0004","10.2027","0.0008","8.9074","0.0007","90","","90.502","0.005","90","","493.08","0.07","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Kolbeckite","scandium phosphate dihydrate","","- H4 O6 P Sc -","- H4 O6 P Sc -","- H16 O24 P4 Sc4 -","4","1","FA3100","Yang, Hexiong; Li, Chen; Jenkins, Robert A.; Downs, Robert T.; Costin, Gelu","Kolbeckite, ScPO~4~·2H~2~O, isomorphous with metavariscite","Acta Crystallographica Section C","2007","63","10","i91","i92","10.1107/S0108270107038036","","","0.71073","MoKα","","0.0636","0.0519","","","0.1462","0.1676","","","","","","1.111","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016186","10.749","0.003","10.749","0.003","6.899","0.004","90","","90","","90","","797.1","0.6","298","2","298","2","","","","","","","","2","I 41/a m d :1","I 4bw 2bw -1bw","141","","strontium undecazinc","","- Sr Zn11 -","- Sr Zn11 -","- Sr4 Zn44 -","4","0.125","FA3104","Kal, Subhadeep; Stoyanov, Emil; Groy, Thomas L.; Häussermann, Ulrich","SrZn~11~: a new binary compound with the BaCd~11~ structure","Acta Crystallographica Section C","2007","63","10","i96","i98","10.1107/S0108270107041972","","","0.71073","MoKα","","0.0481","0.0341","","","0.0724","0.0766","","","","","","1.084","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016187","6.6377","0.0002","10.1397","0.0003","21.9214","0.0006","76.609","0.001","86.563","0.01","90.004","0.001","1432.56","0.07","150","2","150","2","","","","","","","","3","P -1","-P 1","2","2,6-bis(azaindole)pyridine","2,6-bis(1H-pyrrolo[2,3-b]pyridin-1-yl)pyridine","","- C19 H13 N5 -","- C19 H13 N5 -","- C76 H52 N20 -","4","2","GD3124","Collins, Sibrina N.; Taylor, Stephen; Krause, Jeanette A.; Connick, William B.","2,6-Bis(azaindole)pyridine: reactivity with iron(III) and copper(II) salts","Acta Crystallographica Section C","2007","63","10","m436","m439","10.1107/S0108270107039686","","","1.54178","CuKα","","0.054","0.0457","","","0.1149","0.1221","","","","","","1.057","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016188","6.6695","0.0001","23.2657","0.0004","13.3959","0.0002","90","","100.312","0.001","90","","2045.07","0.06","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-[6-(1H-Pyrrolo[2,3-b]pyridin-1-yl)pyridin-2-yl]-1H-pyrrolo[2,3-b]pyridin-7-ium tetrachloridoferrate(III)","","- C19 H14 Cl4 Fe N5 -","- C19 H14 Cl4 Fe N5 -","- C76 H56 Cl16 Fe4 N20 -","4","1","GD3124","Collins, Sibrina N.; Taylor, Stephen; Krause, Jeanette A.; Connick, William B.","2,6-Bis(azaindole)pyridine: reactivity with iron(III) and copper(II) salts","Acta Crystallographica Section C","2007","63","10","m436","m439","10.1107/S0108270107039686","","","1.54178","CuKα","","0.0349","0.0289","","","0.0716","0.0749","","","","","","1.042","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016189","17.3858","0.0012","12.8324","0.0008","8.4011","0.0006","90","","94.726","0.002","90","","1867.9","0.2","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[2,6-bis(1H-pyrrolo[2,3-b]pyridin-1-yl-κN^7^)pyridine-κN]bis(nitrato-\ κO)copper(II)","","- C19 H13 Cu N7 O6 -","- C19 H13 Cu N7 O6 -","- C76 H52 Cu4 N28 O24 -","4","0.5","GD3124","Collins, Sibrina N.; Taylor, Stephen; Krause, Jeanette A.; Connick, William B.","2,6-Bis(azaindole)pyridine: reactivity with iron(III) and copper(II) salts","Acta Crystallographica Section C","2007","63","10","m436","m439","10.1107/S0108270107039686","","","0.7749","synchrotron","","0.0531","0.0516","","","0.1322","0.134","","","","","","1.009","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016190","12.377","0.003","7.562","0.002","7.88","0.002","90","","91.509","0.003","90","","737.3","0.3","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","methyl 2-methyl-5-oxo-2-pyrroline-3-carboxylate","","- C7 H9 N O3 -","- C7 H9 N O3 -","- C28 H36 N4 O12 -","4","1","GD3127","Zhen-Feng Zhang; Jian-Ge Wang; Si-Qian Wang; Gui-Rong Qu","Two substituted 2-pyrrolin-5-ones: chains built from a single N—H···O hydrogen bond","Acta Crystallographica Section C","2007","63","10","o565","o567","10.1107/S0108270107038632","","","0.71073","MoKα","","0.0585","0.0476","","","0.1335","0.1423","","","","","","1.314","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016191","12.1211","0.0018","7.5078","0.0011","7.9542","0.0012","90","","106.74","0.002","90","","693.18","0.18","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-acetyl-2-methyl-2-pyrrolin-5-one","","- C7 H9 N O2 -","- C7 H9 N O2 -","- C28 H36 N4 O8 -","4","1","GD3127","Zhen-Feng Zhang; Jian-Ge Wang; Si-Qian Wang; Gui-Rong Qu","Two substituted 2-pyrrolin-5-ones: chains built from a single N—H···O hydrogen bond","Acta Crystallographica Section C","2007","63","10","o565","o567","10.1107/S0108270107038632","","","0.71073","MoKα","","0.0429","0.039","","","0.1199","0.1243","","","","","","1.079","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016192","7.0875","0.0002","7.2827","0.0002","7.2971","0.0002","114.534","0.001","95.685","0.001","116.754","0.001","286.374","0.015","140","1","140","0.1","","","","","","","","3","P -1","-P 1","2","5,6,11,12-Tetrathiadibenzo[a,e]cyclooctene","2,3,10,11-Tetrathiatricyclo[10.4.0.0^4,9^]hexadeca-4,6,8,12,14,16-hexaene","","- C12 H8 S4 -","- C12 H8 S4 -","- C12 H8 S4 -","1","0.5","GD3134","Yearley, Eric J.; Lippert, Ernest L.; Mitchell, Donald J.; Pinkerton, A. Alan","2,3,10,11-Tetrathiatricyclo[10.4.0.0^4,9^]hexadeca-4,6,8,12,14,16-hexaene (precession camera <i>versus</i> CCD)","Acta Crystallographica Section C","2007","63","10","o576","o577","10.1107/S0108270107040358","","","0.71073","MoKα","","0.0242","0.0231","","","0.0666","0.0674","","","","","","1.07","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016193","8.63","0.003","11.449","0.004","11.629","0.004","116.353","0.017","92.09","0.02","98.82","0.02","1010.3","0.6","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>,<i>N</i>'-bis(2-nitrobenzyl)propane-1,3-diammonium dichloride monohydrate","","- C17 H24 Cl2 N4 O5 -","- C17 H24 Cl2 N4 O5 -","- C34 H48 Cl4 N8 O10 -","2","1","GD3137","Rodríguez de Barbarín, Cecilia; Bernès, Sylvain; Nájera, Blanca; Elizondo, Perla","Acyclic Schiff base salts derived from 1,3-diaminopropane and 1,3-diamino-2-hydroxypropane","Acta Crystallographica Section C","2007","63","10","o597","o599","10.1107/S010827010704156X","","","0.71073","MoKα","","0.0492","0.0386","","","0.1029","0.1126","","","","","","1.053","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016194","7.075","0.002","15.844","0.008","18.554","0.006","90","","90","","90","","2079.8","1.4","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-hydroxy-<i>N</i>,<i>N</i>'-bis(2-nitrobenzyl)propane-1,3-diammonium dichloride","","- C17 H22 Cl2 N4 O5 -","- C17 H22 Cl2 N4 O5 -","- C68 H88 Cl8 N16 O20 -","4","1","GD3137","Rodríguez de Barbarín, Cecilia; Bernès, Sylvain; Nájera, Blanca; Elizondo, Perla","Acyclic Schiff base salts derived from 1,3-diaminopropane and 1,3-diamino-2-hydroxypropane","Acta Crystallographica Section C","2007","63","10","o597","o599","10.1107/S010827010704156X","","","0.71073","MoKα","","0.0811","0.0547","","","0.1294","0.1445","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016195","7.317","0.007","9.604","0.003","12.799","0.005","88.47","0.03","86.06","0.05","87.74","0.05","896.3","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(μ-4-carboxy-2-sulfonatobenzoato)bis[aqua(2,2'-bipyridyl)manganese(II)]","","- C36 H28 Mn2 N4 O16 S2 -","- C36 H28 Mn2 N4 O16 S2 -","- C36 H28 Mn2 N4 O16 S2 -","1","0.5","GD3138","Zhao-Xun Lian; Jia-Min Zhang; Ming-Lu Xu; Guang-Ri Xu; Tian-Jun Lou","Bis(μ-4-carboxy-2-sulfonatobenzoato)bis[aqua(2,2'-bipyridyl)manganese(II)]","Acta Crystallographica Section C","2007","63","10","m445","m447","10.1107/S0108270107040498","","","1.54178","CuKα","","0.0458","0.0376","","","0.102","0.1053","","","","","","1.09","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016196","16.0762","0.0011","9.5937","0.0005","16.1552","0.0011","90","","106.402","0.004","90","","2390.2","0.3","295","1","295","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","cis-Bis(dimethyl sulfide)dinitratoplatinum(II)","","- C4 H12 N2 O6 Pt S2 -","- C4 H12 N2 O6 Pt S2 -","- C32 H96 N16 O48 Pt8 S16 -","8","2","GG3113","Hansson, Christian; Oskarsson, Åke","<i>cis</i>-Bis(dimethyl sulfide)dinitratoplatinum(II) at 295 and 150K","Acta Crystallographica Section C","2007","63","10","m465","m468","10.1107/S0108270107040504","","","0.71073","MoKα","","0.0769","0.0454","","","0.1112","0.1198","","","","","","0.951","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016197","15.9689","0.0007","9.502","0.0003","16.0399","0.0007","90","","105.94","0.003","90","","2340.26","0.17","150","1","150","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","cis-Bis(dimethyl sulfide)dinitratoplatinum(II)","","- C4 H12 N2 O6 Pt S2 -","- C4 H12 N2 O6 Pt S2 -","- C32 H96 N16 O48 Pt8 S16 -","8","2","GG3113","Hansson, Christian; Oskarsson, Åke","<i>cis</i>-Bis(dimethyl sulfide)dinitratoplatinum(II) at 295 and 150K","Acta Crystallographica Section C","2007","63","10","m465","m468","10.1107/S0108270107040504","","","0.71073","MoKα","","0.044","0.0324","","","0.0741","0.0769","","","","","","0.97","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016198","6.3357","0.0009","15.523","0.0002","25.3654","0.0006","90","","90","","90","","2494.7","0.4","120","2","120","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","6-methoxy-3,3-dimethyl-3H-benzo[f]chromene","","- C16 H16 O2 -","- C16 H16 O2 -","- C128 H128 O16 -","8","1","GG3118","Silva, Fernando de C. da; Wardell, James L.; Wardell, Solange M. S. V.; Ferreira, Vitor F.; Low, John N.; Glidewell, Christopher","π-Stacked dimers in 6-methoxy-3,3-dimethyl-3<i>H</i>-benzo[<i>f</i>]chromene, and centrosymmetric dimers containing C—H···π(arene) hydrogen bonds in racemic 3-bromo-2,2,6,6-tetramethyl-3,4-dihydro-2<i>H</i>,6<i>H</i>-1,5-dioxatriphenylene","Acta Crystallographica Section C","2007","63","10","o568","o571","10.1107/S0108270107039194","","","0.71073","MoKα","","0.065","0.0397","","","0.0983","0.1079","","","","","","1.047","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016199","10.735","0.0002","13.7043","0.0003","12.0692","0.0002","90","","106.343","0.001","90","","1703.83","0.06","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","rac-3-bromo-2,2,6,6-tetramethyl-3,4-dihydro-2H,6H-1,5-dioxatriphenylene","","- C20 H21 Br O2 -","- C20 H21 Br O2 -","- C80 H84 Br4 O8 -","4","1","GG3118","Silva, Fernando de C. da; Wardell, James L.; Wardell, Solange M. S. V.; Ferreira, Vitor F.; Low, John N.; Glidewell, Christopher","π-Stacked dimers in 6-methoxy-3,3-dimethyl-3<i>H</i>-benzo[<i>f</i>]chromene, and centrosymmetric dimers containing C—H···π(arene) hydrogen bonds in racemic 3-bromo-2,2,6,6-tetramethyl-3,4-dihydro-2<i>H</i>,6<i>H</i>-1,5-dioxatriphenylene","Acta Crystallographica Section C","2007","63","10","o568","o571","10.1107/S0108270107039194","","","0.71073","MoKα","","0.0385","0.0264","","","0.069","0.0882","","","","","","1.181","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016200","19.8534","0.0006","11.5705","0.0002","14.0258","0.0004","90","","113.393","0.0013","90","","2957.09","0.14","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetraaqua(18-crown-6)cerium(III) hexacyanoferrate(III) dihydrate","","- C18 H36 Ce Fe N6 O12 -","- C18 H36 Ce Fe N6 O12 -","- C72 H144 Ce4 Fe4 N24 O48 -","4","0.5","GG3119","Misra, Phalguni; Koner, Rajesh; Nayak, Malabika; Mohanta, Sasankasekhar; Low, John N.; Ferguson, George; Glidewell, Christopher","Hydrated hexacyanometallate(III) salts of triaqua(18-crown-6)lanthanoid(III) and tetraaqua(18-crown-6)lanthanoid(III) cations containing nine- and ten-coordinate lanthanoids","Acta Crystallographica Section C","2007","63","10","m440","m444","10.1107/S0108270107040449","","","0.71073","MoKα","","0.0278","0.0228","","","0.0473","0.0487","","","","","","1.092","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016201","19.9552","0.0006","11.5063","0.0002","13.9706","0.0003","90","","113.419","0.0011","90","","2943.55","0.12","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetraaqua(18-crown-6)neodymium(III) hexacyanoferrate(III) dihydrate","","- C18 H36 Fe N6 Nd O12 -","- C18 H36 Fe N6 Nd O12 -","- C72 H144 Fe4 N24 Nd4 O48 -","4","0.5","GG3119","Misra, Phalguni; Koner, Rajesh; Nayak, Malabika; Mohanta, Sasankasekhar; Low, John N.; Ferguson, George; Glidewell, Christopher","Hydrated hexacyanometallate(III) salts of triaqua(18-crown-6)lanthanoid(III) and tetraaqua(18-crown-6)lanthanoid(III) cations containing nine- and ten-coordinate lanthanoids","Acta Crystallographica Section C","2007","63","10","m440","m444","10.1107/S0108270107040449","","","0.71073","MoKα","","0.0207","0.0184","","","0.0425","0.0433","","","","","","1.058","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016202","10.9324","0.0002","11.0996","0.0002","14.0119","0.0004","67.9012","0.0013","70.7291","0.0013","65.7231","0.0014","1404.76","0.06","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","Triaqua(18-crown-6)samarium(III) hexacyanoferrate(III) dihydrate","","- C18 H34 Fe N6 O11 Sm -","- C18 H34 Fe N6 O11 Sm -","- C36 H68 Fe2 N12 O22 Sm2 -","2","1","GG3119","Misra, Phalguni; Koner, Rajesh; Nayak, Malabika; Mohanta, Sasankasekhar; Low, John N.; Ferguson, George; Glidewell, Christopher","Hydrated hexacyanometallate(III) salts of triaqua(18-crown-6)lanthanoid(III) and tetraaqua(18-crown-6)lanthanoid(III) cations containing nine- and ten-coordinate lanthanoids","Acta Crystallographica Section C","2007","63","10","m440","m444","10.1107/S0108270107040449","","","0.71073","MoKα","","0.04","0.0301","","","0.0631","0.0671","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2016203","10.9125","0.0003","11.0947","0.0004","14.0119","0.0003","67.8201","0.0018","70.635","0.002","65.743","0.002","1400.57","0.08","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","Triaqua(18-crown-6)europium(III) hexacyanoferrate(III) dihydrate","","- C18 H34 Eu Fe N6 O11 -","- C18 H34 Eu Fe N6 O11 -","- C36 H68 Eu2 Fe2 N12 O22 -","2","1","GG3119","Misra, Phalguni; Koner, Rajesh; Nayak, Malabika; Mohanta, Sasankasekhar; Low, John N.; Ferguson, George; Glidewell, Christopher","Hydrated hexacyanometallate(III) salts of triaqua(18-crown-6)lanthanoid(III) and tetraaqua(18-crown-6)lanthanoid(III) cations containing nine- and ten-coordinate lanthanoids","Acta Crystallographica Section C","2007","63","10","m440","m444","10.1107/S0108270107040449","","","0.71073","MoKα","","0.0808","0.077","","","0.2077","0.2116","","","","","","1.104","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016204","11.0563","0.0002","11.1562","0.0002","14.2127","0.0003","68.3494","0.0011","70.0959","0.0012","66.0299","0.0012","1450.92","0.05","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","triaqua(18-crown-6)gadolinium(III) hexacyanochromate(III) dihydrate","","- C18 H34 Cr Gd N6 O11 -","- C18 H34 Cr Gd N6 O11 -","- C36 H68 Cr2 Gd2 N12 O22 -","2","1","GG3119","Misra, Phalguni; Koner, Rajesh; Nayak, Malabika; Mohanta, Sasankasekhar; Low, John N.; Ferguson, George; Glidewell, Christopher","Hydrated hexacyanometallate(III) salts of triaqua(18-crown-6)lanthanoid(III) and tetraaqua(18-crown-6)lanthanoid(III) cations containing nine- and ten-coordinate lanthanoids","Acta Crystallographica Section C","2007","63","10","m440","m444","10.1107/S0108270107040449","","","0.71073","MoKα","","0.0418","0.0403","","","0.1068","0.1078","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016205","10.8604","0.0002","11.0724","0.0003","13.9909","0.0002","67.5857","0.001","70.587","0.0008","65.5666","0.0009","1385.2","0.05","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","triaqua(18-crown-6)gadolinium(III) hexacyanocobaltate(III) dihydrate","","- C18 H34 Co Gd N6 O11 -","- C18 H34 Co Gd N6 O11 -","- C36 H68 Co2 Gd2 N12 O22 -","2","1","GG3119","Misra, Phalguni; Koner, Rajesh; Nayak, Malabika; Mohanta, Sasankasekhar; Low, John N.; Ferguson, George; Glidewell, Christopher","Hydrated hexacyanometallate(III) salts of triaqua(18-crown-6)lanthanoid(III) and tetraaqua(18-crown-6)lanthanoid(III) cations containing nine- and ten-coordinate lanthanoids","Acta Crystallographica Section C","2007","63","10","m440","m444","10.1107/S0108270107040449","","","0.71073","MoKα","","0.0218","0.0197","","","0.046","0.0466","","","","","","1.092","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016206","13.1084","0.001","5.6177","0.0002","17.6911","0.0013","90","","113.566","0.007","90","","1194.11","0.15","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Benzylmethylammonium hydrogen maleate","","- C12 H15 N O4 -","- C12 H15 N O4 -","- C48 H60 N4 O16 -","4","1","GZ3098","Santacruz, Lynay; Abonia, Rodrigo; Cobo, Justo; Low, John N.; Glidewell, Christopher","Hydrogen-bonded sheets in benzylmethylammonium hydrogen maleate","Acta Crystallographica Section C","2007","63","10","o585","o587","10.1107/S0108270107040450","","","0.71073","Mo-Kα","","0.0925","0.047","","","0.1061","0.133","","","","","","1.07","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016207","5.877","0.004","14.939","0.003","32.128","0.005","90","","95.04","0.02","90","","2810","2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","TACN-3Ts","1,4,7-tris(p-tolylsulfonyl)-1,4,7-triazacyclononane","","- C27 H33 N3 O6 S3 -","- C27 H33 N3 O6 S3 -","- C108 H132 N12 O24 S12 -","4","1","HJ3048","André, Vânia; Barroso, Sónia; Martins, Ana M.; Duarte, M. Teresa","A new conformer of 1,4,7-tris(<i>p</i>-tolylsulfonyl)-1,4,7-triazacyclononane","Acta Crystallographica Section C","2007","63","10","o594","o596","10.1107/S010827010703805X","","","0.71069","MoKα","","0.1188","0.0643","","","0.1229","0.1406","","","","","","1.009","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016208","7.9585","0.0001","16.8134","0.0004","21.622","0.0005","90","","90","","90","","2893.23","0.1","120","2","","","","","","","","","","6","P b c n","-P 2n 2ab","60","","<i>catena</i>-Poly[[bis(nitrato-κ^2^O,O')copper(II)]-μ-propane-1,3- diylbis(diphenylphosphine oxide)-κ<i>O</i>:<i>O'</i>]","","- C27 H26 Cu N2 O8 P2 -","- C27 H26 Cu N2 O8 P2 -","- C108 H104 Cu4 N8 O32 P8 -","4","0.5","HJ3050","Platt, Andrew W. G.; Lees, Anthony M. J.","<i>catena</i>-Poly[[bis(nitrato-κ^2^<i>O</i>,<i>O</i>')copper(II)]-μ-propane-1,3-diylbis(diphenylphosphine oxide)-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section C","2007","63","10","m433","m435","10.1107/S0108270107038711","","","0.71073","MoKα","","","0.0383","","","","0.082","","","","","","1.054","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016209","6.8022","0.0004","6.8022","0.0004","12.3759","0.0007","90","","90","","90","","572.63","0.06","295","2","","","","","","","","","","3","P 43 21 2","P 4nw 2abw","96","yttrium pyrogermanate","diyttrium digermanate","","- Ge2 O7 Y2 -","- Ge2 O7 Y2 -","- Ge8 O28 Y8 -","4","0.5","IZ3026","Redhammer, Günther J.; Roth, Georg; Amthauer, Georg","Yttrium pyrogermanate, Y~2~Ge~2~O~7~","Acta Crystallographica Section C","2007","63","10","i93","i95","10.1107/S0108270107042825","","","0.71073","MoKα","","","0.0203","","","","0.0512","","","","","","1.193","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016210","7.7618","0.0014","9.688","0.002","17.707","0.003","90","","90","","90","","1331.5","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2,4-diamino-7-(2-deoxy-2-fluoro-β-D-arabinofuranosyl)-5-bromo-7H- pyrrolo[2,3-d]pyrimidine","","- C11 H13 Br F N5 O3 -","- C11 H13 Br F N5 O3 -","- C44 H52 Br4 F4 N20 O12 -","4","1","SF3039","Seela, Frank; Ding, Ping; Peng, Xiaohua; Eickmeier, Henning; Reuter, Hans","The 7-bromo derivative of 2-amino-2'-deoxytubercidin fluorinated at the sugar moiety","Acta Crystallographica Section C","2007","63","10","o600","o602","10.1107/S0108270107027138","","","0.71073","MoKα","","0.052","0.0396","","","0.0986","0.1058","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016211","7.4534","0.0007","9.0663","0.0008","10.6966","0.0009","90","","90","","90","","722.82","0.11","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","3-deoxy-β-D-glucopyranose","3-deoxy-β-D-ribo-hexopyranose","","- C6 H12 O5 -","- C6 H12 O5 -","- C24 H48 O20 -","4","1","SF3042","Zhang, Wenhui; Noll, Bruce C.; Serianni, Anthony S.","3-Deoxy-β-<small>D</small>-<i>ribo</i>-hexopyranose (3-deoxy-β-<small>D</small>-glucopyranose)","Acta Crystallographica Section C","2007","63","10","o578","o581","10.1107/S0108270107038553","","","1.54178","CuKα","","0.0259","0.0256","","","0.0681","0.0685","","","","","","1.057","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016212","14.8006","0.001","15.1969","0.001","18.1644","0.0012","79.708","0.002","67.589","0.002","71.879","0.002","3581.3","0.4","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","2,5-Bis(dimethylamino)-2,3,5,6-tetrakis[3,5-bis(trifluoromethyl)phenoxy]-2,3,5,6-tetrabora-1,4-dioxane diethyl ether 0.667-solvate","","- C38.67 H32.67 B4 F24 N2 O6.67 -","- C38.6667 H32.6667 B4 F24 N2 O6.66667 -","- C116 H98 B12 F72 N6 O20 -","3","1.5","SF3048","Clegg, William; Marder, Todd B.; Nlate, Sylvain; Scott, Andrew J.","2,3,5,6-Tetrakis[3,5-bis(trifluoromethyl)phenoxy]-2,5-bis(dimethylamino)2,3,5,6-tetrabora-1,4-dioxane diethyl ether 0.667-solvate","Acta Crystallographica Section C","2007","63","10","o603","o605","10.1107/S010827010703569X","","","0.71073","MoKα","","0.123","0.0692","","","0.1751","0.2036","","","","","","0.925","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016213","12.8094","0.0008","12.8094","0.0008","10.7854","0.0013","90","","90","","120","","1532.6","0.2","100","2","100","2","","","","","","","","4","R -3 :H","-R 3","148","cis,cis-cyclohexane-1,3,5-tricarboxamide","cis,cis-cyclohexane-1,3,5-tricarboxamide","","- C9 H15 N3 O3 -","- C9 H15 N3 O3 -","- C54 H90 N18 O18 -","6","0.333333","SF3051","Binoy K. Saha","Hexagonal packing of <i>cis</i>,<i>cis</i>-cyclohexane-1,3,5-tricarboxamide","Acta Crystallographica Section C","2007","63","10","o591","o593","10.1107/S0108270107040048","","","0.71073","MoKα","","0.0389","0.0345","","","0.0949","0.0983","","","","","","1.1","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016214","7.4161","0.0002","21.674","0.0006","9.0312","0.0003","90","","108.233","0.006","90","","1378.76","0.08","295","2","295","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","5-(5-Nitropyridin-2-yldithio)-1-phenyl-1H-tetrazole","","- C12 H8 N6 O2 S2 -","- C12 H8 N6 O2 S2 -","- C48 H32 N24 O8 S8 -","4","1","SF3052","Brito, Iván; Mundaca, Aldo; Cárdenas, Alejandro; López-Rodríguez, Matías","5-(5-Nitropyridin-2-yldithio)-1-phenyl-1<i>H</i>-tetrazole","Acta Crystallographica Section C","2007","63","10","o606","o608","10.1107/S010827010704142X","","","0.71073","MoKα","","","0.0497","","","","0.1387","","","","","","1.16","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016215","21.347","0.004","14.852","0.003","25.087","0.005","90","","90","","90","","7954","3","298","2","298","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","Aqua-2κO-μ-{N,N'-bis[2-(dimethylamino)ethyl]oxamidato(2-)}- 1κ^2^O,O':2κ^4^N,N',N'',N'''-bis(4,4'-dimethyl-2,2'-bipyridine-1κ^2^N,N')- copper(II)nickel(II) bis(perchlorate) methanol hemisolvate","","- C34.5 H40 Cl2 Cu N8 Ni O11.5 -","- C34.5 H40 Cl2 Cu N8 Ni O11.5 -","- C276 H320 Cl16 Cu8 N64 Ni8 O92 -","8","1","SF3053","Sun, Wei; Li, Yan-Tuan; Wu, Zhi-Yong; Liu, Jin-Liang","Aqua-2κ<i>O</i>-μ-{<i>N</i>,<i>N</i>'-bis[2-(dimethylamino)ethyl]oxamidato(2‒)}-1κ^2^<i>O</i>,<i>O</i>':2κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>'''-bis(4,4'-dimethyl-2,2'-bipyridine-1κ^2^<i>N</i>,<i>N</i>')copper(II)nickel(II) bis(perchlorate) methanol hemisolvate","Acta Crystallographica Section C","2007","63","10","m462","m464","10.1107/S0108270107042643","","","0.71073","MoKα","","0.0991","0.0503","","","0.1345","0.1855","","","","","","1.105","","","","has coordinates,has disorder,has Fobs","194546","2020-10-21","18:00:00",""
"2016216","7.9252","0.0009","9.2783","0.001","9.4118","0.001","62.192","0.002","73.725","0.002","69.787","0.002","568.51","0.11","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Poly[[bis-μ-3, 3'-bis(2-methylimidazol-1-yl)methyl]dinitratocadmium(II)]","","- C18 H24 Cd N10 O6 -","- C18 H24 Cd N10 O6 -","- C18 H24 Cd N10 O6 -","1","0.5","SF3054","Jin, Chuan-Ming; Chen, Cai-Yuan; Wang, Wei-Dong; Wu, Ling-Yan","<i>catena</i>-Poly[[dinitratocadmium(II)]bis[μ-bis(2-methyl-1<i>H</i>-imidazol-1-yl)methane-κ^2^<i>N</i>^3^:<i>N</i>^3'^]]","Acta Crystallographica Section C","2007","63","10","m454","m455","10.1107/S0108270107043454","","","0.71073","MoKα","","0.0357","0.0313","","","0.0667","0.068","","","","","","1.069","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016217","13.117","0.0018","15.948","0.003","17.717","0.002","93.75","0.011","91.803","0.009","101.155","0.013","3624.7","1","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","8-<i>tert</i>-Butyl-7-(4-chlorophenyl)-10-phenyl-5,6-dihydro-10<i>H</i>- benzo[<i>h</i>]pyrazolo[3,4-<i>b</i>]quinoline","","- C30 H26 Cl N3 -","- C30 H26 Cl N3 -","- C180 H156 Cl6 N18 -","6","3","SK3154","Portilla, Jaime; Quiroga, Jairo; Cobo, Justo; Low, John N.; Glidewell, Christopher","8-<i>tert</i>-Butyl-7-(4-chlorophenyl)-10-phenyl-5,6-dihydro-10<i>H</i>-benzo[<i>h</i>]pyrazolo[3,4-<i>b</i>]quinoline","Acta Crystallographica Section C","2007","63","10","o582","o584","10.1107/S0108270107041236","","","0.71073","MoKα","","0.1669","0.0655","","","0.155","0.2106","","","","","","1.052","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016218","12.9514","0.0003","10.49","0.0002","15.2681","0.0005","90","","97.151","0.001","90","","2058.19","0.09","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aqua(dipicolinato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')(1H-imidazole- κN^3^)(1,10-phenanthroline-<i>N</i>,<i>N</i>')manganese(II)","","- C22 H17 Mn N5 O5 -","- C22 H17 Mn N5 O5 -","- C88 H68 Mn4 N20 O20 -","4","1","SK3161","Ma, Cheng-Bing; Chen, Chang-Neng; Liu, Qiu-Tian","Aqua(dipicolinato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')(1<i>H</i>-imidazole-κ<i>N</i>^3^)(1,10-phenanthroline-<i>N</i>,<i>N</i>')manganese(II)","Acta Crystallographica Section C","2007","63","10","m469","m472","10.1107/S0108270107044976","","","0.71073","MoKα","","","0.049","","","0.109","0.1281","","","","","","1","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016219","4.8087","0.0006","7.4678","0.001","9.5748","0.0011","101.734","0.013","93.643","0.014","105.869","0.011","321.22","0.08","120","2","150","2","","","","","","","","4","P -1","-P 1","2","Ammonium violurate","Ammonium violurate","","- C4 H6 N4 O4 -","- C4 H6 N4 O4 -","- C8 H12 N8 O8 -","2","1","SK3165","Nichol, Gary S.; Clegg, William","Ammonium violurate: a compact structure with extensive hydrogen bonding in three dimensions","Acta Crystallographica Section C","2007","63","10","o609","o612","10.1107/S0108270107044241","","","0.71073","MoKα","","0.0794","0.0539","","","0.1189","0.1328","","","","","","1.033","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016220","30.796","0.006","5.2836","0.0011","24.594","0.005","90","","122.87","0.03","90","","3361.1","1.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","lithium bismuth triphosphate","lithium haptabismuth triphosphorus nonadecaoxide","","- Bi58.94 Li8 O152 P24 -","- Bi58.944 Li8 O152 P24 -","- Bi58.944 Li8 O152 P24 -","1","0.125","SQ3091","Arumugam, Nachiappan; Lynch, Vincent; Steinfink, Hugo","A new pillared lithium bismuth phosphate, LiBi~7.37~P~3~O~19~, with elliptical channels","Acta Crystallographica Section C","2007","63","10","i86","i88","10.1107/S0108270107038772","","","0.71073","MoKα","","0.0493","0.0493","","","0.1337","0.1337","","","","","","1.171","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016221","6.458","0.0002","18.0522","0.0005","7.5331","0.0003","90","","95.758","0.002","90","","873.79","0.05","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","diaquatetrakis(urea)nickel(II) nitrate","Diaquatetrakis(urea-κO)nickel(II) dinitrate","","- C4 H20 N10 Ni O12 -","- C4 H20 N10 Ni O12 -","- C8 H40 N20 Ni2 O24 -","2","0.5","SQ3094","Krawczuk, Anna; Stadnicka, Katarzyna","Hydrogen bonding in diaquatetrakis(urea-κ<i>O</i>)<i>M</i>^II^ dinitrates, with <i>M</i> = Ni and Co","Acta Crystallographica Section C","2007","63","10","m448","m450","10.1107/S0108270107040437","","","0.71073","MoKα","","0.0365","0.0289","","0.0716","","0.0766","","","1.036","","","1.036","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016222","6.4655","0.0002","17.9321","0.0005","7.6201","0.0002","90","","94.428","0.001","90","","880.84","0.04","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Diaquatetrakis(urea)cobalt(II) nitrate","Diaquatetrakis(urea-κO)cobalt(II) nitrate","","- C4 H20 Co N10 O12 -","- C4 H20 Co N10 O12 -","- C8 H40 Co2 N20 O24 -","2","0.5","SQ3094","Krawczuk, Anna; Stadnicka, Katarzyna","Hydrogen bonding in diaquatetrakis(urea-κ<i>O</i>)<i>M</i>^II^ dinitrates, with <i>M</i> = Ni and Co","Acta Crystallographica Section C","2007","63","10","m448","m450","10.1107/S0108270107040437","","","0.71073","MoKα","","0.0462","0.0322","","","0.074","0.0815","","","1.038","","","1.038","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016223","10.1489","0.0011","19.2851","0.0016","10.1658","0.0011","90","","100.286","0.008","90","","1957.7","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","tetraphenyldiboroxane","oxybis(diphenylborane)","","- C24 H20 B2 O -","- C24 H20 B2 O -","- C96 H80 B8 O4 -","4","1","SQ3095","Kaufmann, Linda; Lerner, Hans-Wolfram; Bolte, Michael","A new polymorph of tetraphenyldiboroxane","Acta Crystallographica Section C","2007","63","10","o588","o590","10.1107/S0108270107041352","","","0.71073","MoKα","","0.1064","0.0515","","","0.0946","0.1106","","","","","","0.947","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016224","7.1447","0.0004","8.412","0.0005","12.3958","0.0007","80.285","0.001","74.434","0.001","82.718","0.001","704.78","0.07","299","2","298","2","","","","","","","","5","P -1","-P 1","2","","3-aminopyrimidinium 3-carboxy-4-hydroxybenzenesulfonate monohydrate","","- C12 H14 N2 O7 S -","- C12 H14 N2 O7 S -","- C24 H28 N4 O14 S2 -","2","1","AV3101","Meng, Xiang-Gao; Zhou, Chun-Shan; Wang, Li; Liu, Chang-Lin","Two salts of 5-sulfosalicylic acid and 3-aminopyridine","Acta Crystallographica Section C","2007","63","11","o667","o670","10.1107/S0108270107047270","","","0.71073","Mokα","","0.0517","0.0487","","","0.1425","0.1459","","","","","","1.086","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016225","13.9642","0.001","12.8331","0.0009","15.7831","0.0011","90","","114.957","0.002","90","","2564.3","0.3","299","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-aminopyrimidinium 3-carboxy-4-hydroxybenzenesulfonate","","- C12 H12 N2 O6 S -","- C12 H12 N2 O6 S -","- C96 H96 N16 O48 S8 -","8","2","AV3101","Meng, Xiang-Gao; Zhou, Chun-Shan; Wang, Li; Liu, Chang-Lin","Two salts of 5-sulfosalicylic acid and 3-aminopyridine","Acta Crystallographica Section C","2007","63","11","o667","o670","10.1107/S0108270107047270","","","0.71073","Mokα","","0.1065","0.0553","","","0.1365","0.1507","","","","","","1.006","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016226","10.2082","0.0007","10.3481","0.0007","12.4101","0.0008","91.336","0.001","108.426","0.001","107.536","0.001","1175.71","0.14","183","2","183","2","","","","","","","","5","P -1","-P 1","2","","μ-p-phenylenediamine-N,N,N',N'-tetraacetato- bis[aqua(1,10-phenanthroline)nickel(II)]","","- C38 H56 N6 Ni2 O22 -","- C38 H56 N6 Ni2 O22 -","- C38 H56 N6 Ni2 O22 -","1","0.5","AV3107","Zhang, Xiang-Dong; Ge, Chun-Hua; Yu, Fang; Liu, Qi-Tao; Zhu, Miao-Li","Formation of a one-dimensional water chain containing two linking patterns of planar water tetramers","Acta Crystallographica Section C","2007","63","11","m519","m521","10.1107/S0108270107047294","","","0.71073","MoKα","","0.0393","0.0331","","","0.0805","0.0833","","","","","","1.064","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016227","12.603","0.003","18.014","0.003","14.658","0.004","90","","110.392","0.005","90","","3119.3","1.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[diaquabis(2,2-bipyridine N,N'-dioxide-<i>κ</i>^2^O,O')cobalt(II)] ξ-octamolybdate dihydrate","","- C40 H44 Co2 Mo8 N8 O40 -","- C40 H44 Co2 Mo8 N8 O40 -","- C80 H88 Co4 Mo16 N16 O80 -","2","0.5","BG3034","Tan Su; Ya-Qian Lan","Bis[diaquabis(2,2-bipyridine <i>N</i>,<i>N</i>'-dioxide-<i>{κ</i>}^2^<i>O</i>,<i>O</i>')cobalt(II)] {ξi}-octamolybdate dihydrate","Acta Crystallographica Section C","2007","63","11","m522","m524","10.1107/S0108270107018914","","","0.71069","MoKα","","0.0389","0.0275","","","0.0578","0.0619","","","","","","1.037","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016228","7.8868","0.0013","11.106","0.0018","19.05","0.004","104.686","0.004","93.92","0.005","105.202","0.003","1541.3","0.5","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[bis[5-(4-pyridyl-κN)-2-(2-pyridylmethylsulfanyl)-1,3,4-\ oxadiazole]cadmium(II)]-diμ-thiocyanato-κ^2^N:S;κ^2^S:N]","","- C28 H20 Cd N10 O2 S4 -","- C28 H20 Cd N10 O2 S4 -","- C56 H40 Cd2 N20 O4 S8 -","2","1","BG3050","Ye, E; Wu, Ben-Lai; Niu, Yun-Yin; Zhang, Hong-Yun; Hou, Hong-Wei","<i>catena</i>-Poly[[bis[5-(4-pyridyl-κ<i>N</i>)-2-(2-pyridylmethylsulfanyl)-1,3,4-oxadiazole]cadmium(II)]-di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>]","Acta Crystallographica Section C","2007","63","11","m484","m486","10.1107/S0108270107046288","","","0.71073","MoKα","","0.0298","0.0234","","","0.0505","0.0536","","","","","","1.02","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2016229","24.7846","0.0016","13.2694","0.0008","18.9986","0.0013","90","","112.526","0.012","90","","5771.5","0.8","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaqua-bis(2,5-dihydroxybenzoato-κO)bis(1,10-phenanthroline-κ^2^N,N') strontium(II) bis(1,10-phenanthroline) tetrahydrate","","- C62 H54 N8 O14 Sr -","- C62 H54 N8 O14 Sr -","- C248 H216 N32 O56 Sr4 -","4","0.5","BG3052","Duan-Jun Xu; Qian Yang; Li-Jie Ma; Jing-Jing Nie","Diaquabis(2,5-dihydroxybenzoato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')strontium(II) bis(1,10-phenanthroline) tetrahydrate","Acta Crystallographica Section C","2007","63","11","m476","m478","10.1107/S0108270107043430","","","0.71075","MoKα","","0.089","0.043","","","0.094","0.137","","","","","","1.165","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016230","7.2706","0.0005","24.278","0.0004","13.3668","0.0002","90","","100.708","0.004","90","","2318.36","0.17","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[aqua(μ~3~-benzene-1,2-dicarboxylato-κ^4^O,O':O':O'')bis(μ~3~- hydroxido)bis(μ~2~-isonicotinato-κ^2^O:O')dierbium(III) monohydrate","","- C20 H18 Er2 N2 O12 -","- C20 H18 Er2 N2 O12 -","- C80 H72 Er8 N8 O48 -","4","1","BG3054","Guo-Ming Wang; Hai-Lan Huang; Hui Li; Qing-Hua Zheng","Poly[aqua(μ~3~-benzene-1,2-dicarboxylato)bis(μ~3~-hydroxido)bis(μ~2~-isonicotinato)dierbium(III) monohydrate] and the thulium analogue","Acta Crystallographica Section C","2007","63","11","m531","m533","10.1107/S0108270107047403","","","0.71073","MoKα","","0.0315","0.0294","","","0.066","0.0668","","","","","","1.187","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2016231","7.2434","0.0002","24.218","0.0006","13.3606","0.0004","90","","100.7","0.003","90","","2302.97","0.11","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[aqua(μ~3~-benzene-1,2-dicarboxylato-κ^4^O,O':O':O'')bis(μ~3~-\ hydroxido)bis(μ~2~-isonicotinato-κ^2^O:O')thulium(III) monohydrate","","- C20 H18 N2 O12 Tm2 -","- C20 H18 N2 O12 Tm2 -","- C80 H72 N8 O48 Tm8 -","4","1","BG3054","Guo-Ming Wang; Hai-Lan Huang; Hui Li; Qing-Hua Zheng","Poly[aqua(μ~3~-benzene-1,2-dicarboxylato)bis(μ~3~-hydroxido)bis(μ~2~-isonicotinato)dierbium(III) monohydrate] and the thulium analogue","Acta Crystallographica Section C","2007","63","11","m531","m533","10.1107/S0108270107047403","","","0.71073","MoKα","","0.0266","0.0252","","","0.0594","0.06","","","","","","1.173","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2016232","15.693","0.003","7.0491","0.0014","9.752","0.002","90","","98.97","0.03","90","","1065.6","0.4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[μ-aqua-dizinc(II)]-bis(μ~4~-naphthalene-1,8-dicarboxylato)]","","- C12 H8 O5 Zn -","- C12 H8 O5 Zn -","- C48 H32 O20 Zn4 -","4","1","BG3055","Wen, Yi-Hang; Feng, Xia; He, Yin-Hua; Lan, You-Zhao; Sun, Hong","Poly[μ-aqua-μ~4~-naphthalene-1,8-dicarboxylato-zinc(II)]","Acta Crystallographica Section C","2007","63","11","m504","m506","10.1107/S0108270107047130","","","0.71073","MoKα","","","0.0236","","","0.0588","0.0612","","","","","","1.065","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016233","8.192","0.002","9.525","0.002","14.101","0.002","99.538","0.017","100.171","0.017","100.42","0.02","1042.7","0.4","150","","150","","","","","","","","","6","P -1","-P 1","2","Bendroflumethiazide acetone solvate","3-benzyl-6-(trifluoromethyl)-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-\ sulfonamide 1,1-dioxide acetone solvate","","- C18 H20 F3 N3 O5 S2 -","- C18 H20 F3 N3 O5 S2 -","- C36 H40 F6 N6 O10 S4 -","2","1","BM3035","Fabbiani, Francesca P. A.; Leech, Charlotte K.; Shankland, Kenneth; Johnston, Andrea; Fernandes, Philippe; Florence, Alastair J.; Shankland, Norman","Hirshfeld surface analysis of two bendroflumethiazide solvates","Acta Crystallographica Section C","2007","63","11","o659","o663","10.1107/S0108270107044812","","","0.71073","MoKα","","0.0412","0.0328","","0.0788","0.0766","0.0788","","","","","","1.0096","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2016234","8.2527","0.0003","17.8431","0.0007","14.9012","0.0005","90","","103.752","0.004","90","","2131.36","0.14","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Bendroflumethiazide N,N-dimethylformamide solvate","3-benzyl-6-(trifluoromethyl)-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide N,N-dimethylformamide solvate","","- C18 H21 F3 N4 O5 S2 -","- C18 H21 F3 N4 O5 S2 -","- C72 H84 F12 N16 O20 S8 -","4","1","BM3035","Fabbiani, Francesca P. A.; Leech, Charlotte K.; Shankland, Kenneth; Johnston, Andrea; Fernandes, Philippe; Florence, Alastair J.; Shankland, Norman","Hirshfeld surface analysis of two bendroflumethiazide solvates","Acta Crystallographica Section C","2007","63","11","o659","o663","10.1107/S0108270107044812","","","0.71073","MoKα","","0.05","0.0396","","0.091","0.0863","0.091","","","","","","1.0127","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2016235","9.717","0.002","10.575","0.003","33.772","0.008","90","","90","","90","","3470.3","1.5","291","2","291","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2,2,2-trichloro-N,N'-bis(4-methoxyphenyl)ethane-1,1-diamine","","- C16 H17 Cl3 N2 O2 -","- C16 H17 Cl3 N2 O2 -","- C128 H136 Cl24 N16 O16 -","8","1","BM3036","Zhen-Feng Zhang; Jian-Hua Qin; Si-Qian Wang; Gui-Rong Qu","Hydrogen-bonded chains in 2,2,2-trichloro-<i>N</i>,<i>N</i>'-bis(4-methoxyphenyl)ethane-1,1-diamine and a three-dimensional hydrogen-bonded framework in 2,2,2-trichloro-<i>N</i>,<i>N</i>'-bis(4-chlorophenyl)ethane-1,1-diamine","Acta Crystallographica Section C","2007","63","11","o622","o625","10.1107/S0108270107041546","","","0.71073","MoKα","","0.0612","0.0459","","","0.1005","0.1089","","","","","","1.049","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016236","6.0186","0.0006","8.0624","0.0008","33.082","0.003","90","","90","","90","","1605.3","0.3","291","2","291","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,2,2-trichloro-N,N'-bis(4-chlorophenyl)ethane-1,1-diamine","","- C14 H11 Cl5 N2 -","- C14 H11 Cl5 N2 -","- C56 H44 Cl20 N8 -","4","1","BM3036","Zhen-Feng Zhang; Jian-Hua Qin; Si-Qian Wang; Gui-Rong Qu","Hydrogen-bonded chains in 2,2,2-trichloro-<i>N</i>,<i>N</i>'-bis(4-methoxyphenyl)ethane-1,1-diamine and a three-dimensional hydrogen-bonded framework in 2,2,2-trichloro-<i>N</i>,<i>N</i>'-bis(4-chlorophenyl)ethane-1,1-diamine","Acta Crystallographica Section C","2007","63","11","o622","o625","10.1107/S0108270107041546","","","0.71073","MoKα","","0.0254","0.0243","","","0.0623","0.0632","","","","","","1.032","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016237","14.04","0.003","19.903","0.004","17.721","0.004","90","","113.19","0.03","90","","4552","2","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","triaquahemiaquadi-μ~5~-acetato-tri-μ~4~-acetato-tri-μ~3~-acetato-tri-μ~2~- acetato-μ~2~-acetato-hexabarium(II)","","- C24 H43 Ba6 O27.5 -","- C24 H43 Ba6 O27.5 -","- C96 H172 Ba24 O110 -","4","1","BM3038","Gabriela Leyva; Griselda Polla; María Teresa Garland; Ricardo Baggio","[Ba~6~(C~2~H~3~O~2~)~12~(H~2~O)~3.5~], a new hydrate of barium acetate","Acta Crystallographica Section C","2007","63","11","m534","m536","10.1107/S0108270107048433","","","0.71073","MoKα","","0.0499","0.0402","","","0.0828","0.0867","","","","","","1.113","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2016238","13.051","0.003","14.256","0.003","17.1","0.003","90","","112.19","0.03","90","","2945.9","1.2","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Bis(3,5-dimethylpyrazol-1-yl-κN^2^)dithioacetato-κS](triphenylphosphine- κP)copper(I)","","- C30 H30 Cu N4 P S2 -","- C30 H30 Cu N4 P S2 -","- C120 H120 Cu4 N16 P4 S8 -","4","1","BM3041","Liu, Lei-Lei; Tang, Xiao-Yan; Li, Hong-Xi; Zhang, Yong; Lang, Jian-Ping","[Bis(3,5-dimethylpyrazol-1-yl-κ<i>N</i>^2^)dithioacetato-κ<i>S</i>](triphenylphosphine-κ<i>P</i>)copper(I)","Acta Crystallographica Section C","2007","63","11","m513","m515","10.1107/S0108270107046665","","","0.71073","MoKα","","0.0422","0.0317","","","0.0824","0.0893","","","","","","1.067","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016239","19.31","0.008","8.342","0.004","13.16","0.006","90","","125.084","0.005","90","","1734.7","1.4","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(2,2'-Biquinoline-κ^2^N,N')bis(nitrato-κ^2^O,O')copper(II)","","- C18 H12 Cu N4 O6 -","- C18 H12 Cu N4 O6 -","- C72 H48 Cu4 N16 O24 -","4","0.5","DN3060","Yanko Moreno; Yimmy Salgado; María Teresa Garland; Ricardo Baggio","(2,2'-Biquinoline-κ^2^<i>N</i>,<i>N</i>')bis(nitrato-κ^2^<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","2007","63","11","m487","m489","10.1107/S0108270107046513","","","0.71073","MoKα","","0.0977","0.0558","","","0.1349","0.1532","","","","","","1.111","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016240","4.9739","0.0009","8.8459","0.0015","9.1479","0.0016","93.829","0.002","94.93","0.002","103.061","0.001","389.09","0.12","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","poly[bis(μ~5~-pyridine-2,6-dicarboxylato N-oxide)nickel(II)disilver(I)]","","- C14 H6 Ag2 N2 Ni O10 -","- C14 H6 Ag2 N2 Ni O10 -","- C14 H6 Ag2 N2 Ni O10 -","1","0.5","DN3061","Gui-Liang, Wang","A tetrahedrally coordinated Ag^I^ and Ni^II^ complex with a two-dimensional framework containing one-dimensional helical chains","Acta Crystallographica Section C","2007","63","11","m479","m480","10.1107/S0108270107044794","","","0.71073","MoKα","","0.0471","0.0451","","","0.0956","0.0968","","","","","","1.135","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016241","7.896","0.004","14.899","0.004","31.516","0.008","90","","92.26","0.04","90","","3705","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","methoxyethanolato)dimethyl(tetrahydrofuran-κO)aluminium(III)tetramanganese(II)","","- C18 H42 Al I5 Mn4 O9 -","- C18 H42 Al I5 Mn4 O9 -","- C72 H168 Al4 I20 Mn16 O36 -","4","1","DN3065","Lucjan B. Jerzykiewicz; Józef Utko; Piotr Sobota","A pentanuclear bimetallic complex of manganese(II) and aluminium(III) ions: tetra-μ~2~-iodido-iodidobis(μ~3~-2-methoxyethanolato)bis(μ~2~-2-methoxyethanolato)dimethyl(tetrahydrofuran-κ<i>O</i>)aluminium(III)tetramanganese(II)","Acta Crystallographica Section C","2007","63","11","m501","m503","10.1107/S0108270107046896","","","0.71073","MoKα","","0.0545","0.0343","","","0.0755","0.0801","","","","","","1.094","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016242","8.6278","0.0002","6.6525","0.0002","11.3284","0.0003","90","","111.658","0.001","90","","604.31","0.03","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2-(1-chloro-2-methylpropenyl)-8-nitroquinoline","","- C13 H11 Cl N2 O2 -","- C13 H11 Cl N2 O2 -","- C26 H22 Cl2 N4 O4 -","2","1","FA3106","Sopková-de Oliveira Santos, Jana; Verhaeghe, Pierre; Lohier, Jean-François; Rathelot, Pascal; Vanelle, Patrice; Rault, Sylvain","Quinoline derivatives: potential antiparasitic and antiviral agents","Acta Crystallographica Section C","2007","63","11","o643","o645","10.1107/S0108270107046550","","","0.71073","MoKα","","0.035","0.0287","","","0.078","0.0823","","","","","","1.064","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016243","11.5578","0.0005","6.8987","0.0003","13.99","0.0006","90","","90","","90","","1115.48","0.08","150","2","150","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","2-(2-methylprop-1-enyl)-8-nitroquinoline","","- C13 H12 N2 O2 -","- C13 H12 N2 O2 -","- C52 H48 N8 O8 -","4","0.5","FA3106","Sopková-de Oliveira Santos, Jana; Verhaeghe, Pierre; Lohier, Jean-François; Rathelot, Pascal; Vanelle, Patrice; Rault, Sylvain","Quinoline derivatives: potential antiparasitic and antiviral agents","Acta Crystallographica Section C","2007","63","11","o643","o645","10.1107/S0108270107046550","","","0.71073","MoKα","","0.0462","0.0395","","","0.1173","0.1288","","","","","","1.093","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016244","7.45","0.0001","7.546","0.0001","10.6766","0.0002","90","","90","","90","","600.214","0.016","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Trisamarium molybdenum heptaoxide","","- Mo O7 Sm3 -","- Mo O7 Sm3 -","- Mo4 O28 Sm12 -","4","1","FA3110","Barrier, N.; Gall, P.; Gougeon, P.","Rare-earth site splitting in Sm~3~MoO~7~","Acta Crystallographica Section C","2007","63","11","i102","i104","10.1107/S0108270107045416","","","0.71069","MoKα","","0.0264","0.0216","","","0.0401","0.0419","","","","","","1.053","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016245","9.3495","0.001","12.016","0.0013","12.8534","0.0014","84.498","0.002","70.535","0.002","68.632","0.002","1267.3","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","catena-poly[[[di-μ-but-2-enoato-κ^3^O:O,O';κ^3^O,O':O'-bis[diaquadibut-2-\ enoato-κO;κ^2^O,O'-neodymium(III)]]-μ-4,4'-bipyridyl dioxide-κ^2^O:O'] 4,4'-bipyridyl dioxide solvate]","","- C44 H54 N4 Nd2 O20 -","- C44 H54 N4 Nd2 O20 -","- C44 H54 N4 Nd2 O20 -","1","0.5","FA3117","Ana María Atria; María Teresa Garland; Ricardo Baggio","Three isomorphous Ln complexes: {[Ln~2~(bt)~6~(bno)(H~2~O)~4~]·bno}~<i>n~</i> (bt is but-2-enoate and bno is 4,4'-bipyridyl <i>N</i>,<i>N</i>'-dioxide), with Ln = Nd, Er and Y","Acta Crystallographica Section C","2007","63","11","m490","m493","10.1107/S0108270107045404","","","0.71073","MoKα","","0.04","0.0337","","","0.0766","0.0805","","","","","","0.856","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016246","9.1731","0.0009","12.0358","0.0012","12.7221","0.0013","85.728","0.002","71.181","0.001","69.099","0.001","1240.7","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","catena-poly[[[di-μ-but-2-enoato-κ^3^O:O,O';κ^3^O,O':O'-bis[diaquadibut-2-\ enoato-κO;κ^2^O,O'-erbium(III)]]-μ-4,4'-bipyridyl dioxide-κ^2^O:O'] 4,4'-bipyridyl dioxide solvate]","","- C44 H54 Er2 N4 O20 -","- C44 H54 Er2 N4 O20 -","- C44 H54 Er2 N4 O20 -","1","0.5","FA3117","Ana María Atria; María Teresa Garland; Ricardo Baggio","Three isomorphous Ln complexes: {[Ln~2~(bt)~6~(bno)(H~2~O)~4~]·bno}~<i>n~</i> (bt is but-2-enoate and bno is 4,4'-bipyridyl <i>N</i>,<i>N</i>'-dioxide), with Ln = Nd, Er and Y","Acta Crystallographica Section C","2007","63","11","m490","m493","10.1107/S0108270107045404","","","0.71073","MoKα","","0.0437","0.038","","","0.0907","0.0948","","","","","","1.058","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016247","9.1865","0.0013","12.0293","0.0017","12.7275","0.0018","85.71","0.002","71.079","0.002","69.175","0.002","1242.3","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","catena-poly[[[di-μ-but-2-enoato-κ^3^O:O,O';κ^3^O,O':O'-bis[diaquadibut-2-\ enoato-κO;κ^2^O,O'-yttrium(III)]]-μ-4,4'-bipyridyl dioxide-κ^2^O:O'] 4,4'-bipyridyl dioxide solvate]","","- C44 H54 N4 O20 Y2 -","- C44 H54 N4 O20 Y2 -","- C44 H54 N4 O20 Y2 -","1","0.5","FA3117","Ana María Atria; María Teresa Garland; Ricardo Baggio","Three isomorphous Ln complexes: {[Ln~2~(bt)~6~(bno)(H~2~O)~4~]·bno}~<i>n~</i> (bt is but-2-enoate and bno is 4,4'-bipyridyl <i>N</i>,<i>N</i>'-dioxide), with Ln = Nd, Er and Y","Acta Crystallographica Section C","2007","63","11","m490","m493","10.1107/S0108270107045404","","","0.71073","MoKα","","0.0641","0.0483","","","0.1096","0.117","","","","","","1.027","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016248","9.7351","0.0008","14.3655","0.0014","17.9804","0.0012","90","","97.648","0.006","90","","2492.2","0.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[<i>N</i>-(4-nitrophenyl)thiobenzamidato]mercury(II)","","- C26 H18 Hg N4 O4 S2 -","- C26 H18 Hg N4 O4 S2 -","- C104 H72 Hg4 N16 O16 S8 -","4","1","FA3119","Habibi, Mohammad Hossein; Fallah Shojaie, Abdollah; Mokhtari, Reza; Brooks, Neil R.; Clegg, William","Bis[<i>N</i>-(4-nitrophenyl)thiobenzamidato]mercury(II)","Acta Crystallographica Section C","2007","63","11","m494","m495","10.1107/S010827010704694X","","","0.71073","MoKα","","0.0337","0.0238","","","0.0499","0.054","","","","","","1.105","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016249","7.2667","0.0007","17.802","0.0014","10.8166","0.001","90","","113.706","0.007","90","","1281.2","0.2","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-Diaquabis(3-hydroxybenzoato-κO^1^)bis(nicotinamide-κN^1^)copper(II)","","- C26 H26 Cu N4 O10 -","- C26 H26 Cu N4 O10 -","- C52 H52 Cu2 N8 O20 -","2","0.5","FA3124","Şahin, Onur; Büyükgüngör, Orhan; Köse, Dursun Ali; Necefoglu, Hacali","<i>trans</i>-Diaquabis(3-hydroxybenzoato-κ<i>O</i>^1^)bis(nicotinamide-κ<i>N</i>^1^)copper(II)","Acta Crystallographica Section C","2007","63","11","m510","m512","10.1107/S0108270107047142","","","0.71073","MoKα","","0.0328","0.0286","","","0.079","0.0809","","","","","","1.03","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016250","10.6016","0.0002","12.2791","0.0003","19.6827","0.0005","105.222","0.001","92.632","0.001","103.886","0.001","2383.82","0.1","263","2","263","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[aqua(1,10-phenanthroline-κ^2^N,N')zinc(II)]- μ-5-[4-(hydroxymethyl)benzyloxy]isophthalato-κ^3^O^1^,O^1'^:O^3^- [aqua(1,10-phenanthroline-κ^2^N,N')zinc(II)]- μ-5-[4-(hydroxymethyl)benzyloxy]isophthalato-κ^2^O^1^:O^3^]","","- C56 H44 N4 O14 Zn2 -","- C56 H44 N4 O14 Zn2 -","- C112 H88 N8 O28 Zn4 -","2","1","FG3050","E Yang; Xu-Chun Song; Li-Hua Wang; You-Dan Lin","<i>catena</i>-Poly[[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II)]-μ-5-[4-(hydroxymethyl)benzyloxy]isophthalato-κ^3^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^3^-[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II)]-μ-5-[4-(hydroxymethyl)benzyloxy]isophthalato-κ^2^<i>O</i>^1^:<i>O</i>^3^]","Acta Crystallographica Section C","2007","63","11","m481","m483","10.1107/S0108270107046240","","","0.71073","MoKα","","0.1099","0.0798","","","0.1758","0.2002","","","","","","1.084","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016251","6.8227","0.0002","13.4226","0.0004","17.5317","0.0005","90","","90","","90","","1605.52","0.08","153","2","153","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","2,2-Dichloro-1,3-bis(trimethylsilyl)-1,3-diaza-2-silacyclopentane","","- C8 H22 Cl2 N2 Si3 -","- C8 H22 Cl2 N2 Si3 -","- C32 H88 Cl8 N8 Si12 -","4","0.5","GA3074","Böhme, Uwe; Bendrath, Franziska; Günther, Betty","2,2-Dichloro-1,3-bis(trimethylsilyl)-1,3-diaza-2-silacyclopentane","Acta Crystallographica Section C","2007","63","11","o631","o632","10.1107/S0108270107045969","","","0.71073","MoKα","","0.0314","0.0253","","","0.0644","0.0683","","","","","","0.968","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016252","7.4716","0.00011","8.7226","0.00012","30.2407","0.0005","90","","90","","90","","1970.84","0.05","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(5<i>R</i>,8<i>R</i>,9<i>S</i>,10<i>S</i>,13<i>R</i>,14<i>S</i>, 17<i>R</i>,20<i>R</i>)-3-oxo-5β-24-norcholanic acid","","- C23 H36 O3 -","- C23 H36 O3 -","- C92 H144 O12 -","4","1","GA3075","Dufort, Marisa DeVita; Davison, Mark; Lalancette, Roger A.; Thompson, Hugh W.","3-Oxo-5β-24-norcholanic acid: acid-to-acid hydrogen-bonding catemers employing the rare <i>anti</i> carboxyl conformation in the aggregation of a steroid keto acid","Acta Crystallographica Section C","2007","63","11","o646","o649","10.1107/S0108270107047014","","","1.54178","CuKα","","0.056","0.04","","","0.095","0.101","","","","","","1.04","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016253","20.59","0.002","9.5109","0.0008","10.64","0.002","90","","97.518","0.015","90","","2065.7","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Aminopyrimidine‒3,3,3-triphenylpropanoic acid (1/1)","","- C25 H23 N3 O2 -","- C25 H23 N3 O2 -","- C100 H92 N12 O8 -","4","1","GD3144","Serafin, Mateusz F.; Wheeler, Kraig A.","2-Aminopyrimidine‒3,3,3-triphenylpropanoic acid (1/1)","Acta Crystallographica Section C","2007","63","11","o620","o621","10.1107/S0108270107045799","","","1.54178","CuKα","","0.0965","0.0566","","","0.1264","0.1485","","","","","","1.036","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016254","16.2739","0.0005","9.6403","0.0003","13.5513","0.0004","90","","113.069","0.002","90","","1955.99","0.11","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Pyridoxal-2-hydroxyethylimine","5-Hydroxymethyl-4-[(2-hydroxyethyl)iminomethyl]-2-methylpyridin-3-ol","","- C10 H14 N2 O3 -","- C10 H14 N2 O3 -","- C80 H112 N16 O24 -","8","1","GD3146","Böhme, Uwe; Günther, Betty","4-[(2-Hydroxyethyl)iminomethyl]-5-hydroxymethyl-2-methylpyridin-3-ol","Acta Crystallographica Section C","2007","63","11","o641","o642","10.1107/S0108270107046574","","","0.71073","MoKα","","0.051","0.0378","","","0.1016","0.1086","","","","","","1.048","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016255","10.695","0.002","22.718","0.004","13.516","0.002","90","","109.5","0.01","90","","3095.6","0.9","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Tetrakis(1-naphthylamino)silane","","- C40 H32 N4 Si -","- C40 H32 N4 Si -","- C160 H128 N16 Si4 -","4","1","GD3147","Balakrishna, Maravanji S.; Chivers, Tristram; Parvez, Masood","Tetrakis(1-naphthylamino)silane and its tetrahydrofuran trisolvate","Acta Crystallographica Section C","2007","63","11","o617","o619","10.1107/S010827010704468X","","","0.71073","MoKα","","0.0702","0.045","","","0.1069","0.1216","","","","","","1.014","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016256","21.048","0.007","14.672","0.007","15.16","0.009","90","","104.46","0.02","90","","4533","4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetrakis(1-naphthylamino)silane tetrahydrofuran trisolvate","","- C52 H56 N4 O3 Si -","- C52 H56 N4 O3 Si -","- C208 H224 N16 O12 Si4 -","4","1","GD3147","Balakrishna, Maravanji S.; Chivers, Tristram; Parvez, Masood","Tetrakis(1-naphthylamino)silane and its tetrahydrofuran trisolvate","Acta Crystallographica Section C","2007","63","11","o617","o619","10.1107/S010827010704468X","","","0.71073","MoKα","","0.2468","0.0782","","","0.1666","0.2303","","","","","","0.977","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016257","11.029","0.0019","12.817","0.002","11.2083","0.0018","90","","90.173","0.013","90","","1584.4","0.4","290","2","290","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(4-chlorophenyl)-4-methylchromenium perchlorate","","- C16 H12 Cl2 O5 -","- C16 H12 Cl2 O5 -","- C64 H48 Cl8 O20 -","4","1","GZ3073","Alexander D. Roshal; Artur Sikorski; Vyacheslav N. Baumer; Alexander I. Novikov; Jerzy Błażejowski","Two polymorphs of 2-(4-chlorophenyl)-4-methylchromenium perchlorate","Acta Crystallographica Section C","2007","63","11","o626","o630","10.1107/S0108270107039558","","","0.71073","MoKα","","0.0422","0.0418","","","0.1255","0.1258","","","","","","0.915","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016258","8.0631","0.0015","11.873","0.003","16.487","0.002","90","","93.292","0.014","90","","1575.7","0.5","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-chlorophenyl)-4-methylchromenium perchlorate","","- C16 H12 Cl2 O5 -","- C16 H12 Cl2 O5 -","- C64 H48 Cl8 O20 -","4","1","GZ3073","Alexander D. Roshal; Artur Sikorski; Vyacheslav N. Baumer; Alexander I. Novikov; Jerzy Błażejowski","Two polymorphs of 2-(4-chlorophenyl)-4-methylchromenium perchlorate","Acta Crystallographica Section C","2007","63","11","o626","o630","10.1107/S0108270107039558","","","0.71073","MoKα","","0.056","0.049","","","0.1209","0.1234","","","","","","0.847","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016259","7.3808","0.0009","9.4538","0.001","10.3942","0.0009","90.971","0.012","101.554","0.014","104.252","0.016","687.03","0.14","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","2,4-diamino-6-methyl-1,3,5-triazin-1-ium chloride 2,4-diamino-6-methyl-1,3,5-triazine monohydrate","","- C8 H17 Cl N10 O -","- C8 H17 Cl N10 O -","- C16 H34 Cl2 N20 O2 -","2","1","GZ3095","Gustavo Portalone; Marcello Colapietro","Hydrogen-bonded supramolecular motifs in the 1:1 monohydrated molecular adduct of acetoguanaminium chloride with acetoguanamine and in 2,4,6-triaminopyrimidinediium dichloride dihydrate","Acta Crystallographica Section C","2007","63","11","o655","o658","10.1107/S0108270107046689","","","0.710689","MoKα","","0.0327","0.0319","","","0.0917","0.0923","","","","","","1.093","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016260","9.4045","0.001","8.6089","0.0009","13.742","0.0012","90","","107.742","0.01","90","","1059.67","0.19","298","2","298","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","triaminopyrimidinediium dichloride dihydrate","","- C4 H13 Cl2 N5 O2 -","- C4 H13 Cl2 N5 O2 -","- C16 H52 Cl8 N20 O8 -","4","0.5","GZ3095","Gustavo Portalone; Marcello Colapietro","Hydrogen-bonded supramolecular motifs in the 1:1 monohydrated molecular adduct of acetoguanaminium chloride with acetoguanamine and in 2,4,6-triaminopyrimidinediium dichloride dihydrate","Acta Crystallographica Section C","2007","63","11","o655","o658","10.1107/S0108270107046689","","","0.710689","MoKα","","0.0238","0.0229","","","0.0697","0.0702","","","","","","1.104","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016261","20.646","0.003","9.3893","0.0013","13.4869","0.0019","90","","128.152","0.003","90","","2055.9","0.5","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[[dichloridoiron(II)]-μ-N,N'-bis(2-pyridylmethylene)benzene-\ 1,4-diamine] methanol solvate]","","- C20 H22 Cl2 Fe N4 O2 -","- C20 H22 Cl2 Fe N4 O2 -","- C80 H88 Cl8 Fe4 N16 O8 -","4","0.5","GZ3097","Collins, Sibrina N.; Krause, Jeanette A.; Regis, Morrisa; Ball, P. J.; Connick, William B.","Self-assembly of a one-dimensional iron(II) coordination polymer with <i>p</i>-phenylenebis(picolinaldimine)","Acta Crystallographica Section C","2007","63","11","m528","m530","10.1107/S0108270107040796","","","0.775","synchrotron","","0.0569","0.0448","","","0.1189","0.126","","","","","","1.048","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016262","6.284","0.0005","6.705","0.0006","12.8302","0.0009","90","","90","","90","","540.59","0.08","298","2","298","2","","","","","","","","4","C m c 21","C 2c -2","36","5-Formyluracil","2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde","","- C5 H4 N2 O3 -","- C5 H4 N2 O3 -","- C20 H16 N8 O12 -","4","0.5","HJ3051","Gustavo Portalone; Marcello Colapietro","An unusual <i>syn</i> conformation of 5-formyluracil stabilized by supramolecular interactions","Acta Crystallographica Section C","2007","63","11","o650","o654","10.1107/S0108270107045659","","","0.71069","MoKα","","0.0436","0.0425","","","0.11","0.1117","","","","","","1.081","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016263","17.2363","0.0005","8.5726","0.0002","8.8689","0.0002","90","","90","","90","","1310.47","0.06","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","catena-Poly[bis(ethane-1,2-diammonium) [manganese(II)-di-μ-phosphato-κ^4^O:O']]","","- C4 H20 Mn N4 O8 P2 -","- C4 H20 Mn N4 O8 P2 -","- C16 H80 Mn4 N16 O32 P8 -","4","0.5","HJ3053","Gaslain, Fabrice O. M.; Chippindale, Ann M.","<i>catena</i>-Poly[bis(ethane-1,2-diammonium) [manganese(II)-di-μ-phosphato-κ^4^<i>O</i>:<i>O</i>']]: a one-dimensional manganese phosphate","Acta Crystallographica Section C","2007","63","11","m537","m540","10.1107/S0108270107048111","","","0.71073","MoKα","","0.0404","0.0262","","0.03","0.0261","0.0261","","","","","","1.0934","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016264","24.615","0.003","6.0114","0.0011","17.1066","0.0019","90","","106.702","0.01","90","","2424.5","0.6","293","2","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","N,N,N',N'-tetrakis(2-pyridylmethyl)propane-1,3-diamine","","- C27 H30 N6 -","- C27 H30 N6 -","- C108 H120 N24 -","4","0.5","HJ3054","Mambanda, Allen; Jaganyi, Deogratius; Munro, Orde Q.","One-dimensional C—H···N hydrogen-bonded polymers in flexible tetrapyridyl systems","Acta Crystallographica Section C","2007","63","11","o676","o680","10.1107/S0108270107049293","","","0.71073","MoKα","","","0.041","","","","0.1114","","","","","","0.987","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016265","6.1942","0.0003","9.2425","0.0003","11.6798","0.0005","101.756","0.003","96.953","0.004","106.289","0.004","616.96","0.05","100","2","","","","","","","","","","3","P -1","-P 1","2","","N,N,N',N'-tetrakis(2-pyridylmethyl)butane-1,4-diamine","","- C28 H32 N6 -","- C28 H32 N6 -","- C28 H32 N6 -","1","0.5","HJ3054","Mambanda, Allen; Jaganyi, Deogratius; Munro, Orde Q.","One-dimensional C—H···N hydrogen-bonded polymers in flexible tetrapyridyl systems","Acta Crystallographica Section C","2007","63","11","o676","o680","10.1107/S0108270107049293","","","0.71073","MoKα","","","0.0451","","","","0.1385","","","","","","1.015","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016266","5.9055","0.0002","9.5369","0.0003","11.014","0.0003","90","","99.262","0.001","90","","612.22","0.03","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","calcium hexafluoroiridate (IV)","calcium hexafluoroiridate(IV) dihydrate","","- Ca F6 H4 Ir O2 -","- Ca F6 H4 Ir O2 -","- Ca4 F24 H16 Ir4 O8 -","4","1","IZ3025","Smolentsev, Anton I.; Gubanov, Alexander I.; Danilenko, Andrey M.","Three hexafluoridoiridates(IV), Ca[IrF~6~]·2H~2~O, Sr[IrF~6~]·2H~2~O and Ba[IrF~6~]","Acta Crystallographica Section C","2007","63","11","i99","i101","10.1107/S0108270107044046","","","0.71073","MoKα","","0.0226","0.0209","","","0.0553","0.0559","","","","","","1.245","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016267","6.0328","0.0002","9.8264","0.0004","11.2123","0.0005","90","","99.363","0.001","90","","655.82","0.05","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","strontium hexafluoroiridate (IV)","strontium hexafluoroiridate(IV) dihydrate","","- F6 H4 Ir O2 Sr -","- F6 H4 Ir O2 Sr -","- F24 H16 Ir4 O8 Sr4 -","4","1","IZ3025","Smolentsev, Anton I.; Gubanov, Alexander I.; Danilenko, Andrey M.","Three hexafluoridoiridates(IV), Ca[IrF~6~]·2H~2~O, Sr[IrF~6~]·2H~2~O and Ba[IrF~6~]","Acta Crystallographica Section C","2007","63","11","i99","i101","10.1107/S0108270107044046","","","0.71073","MoKα","","0.0212","0.0188","","","0.0524","0.0532","","","","","","1.122","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016268","7.3965","0.0005","7.3965","0.0005","7.2826","0.0007","90","","90","","120","","345.04","0.05","293","2","293","2","","","","","","","","3","R -3 :H","-R 3","148","barium hexafluoroiridate (IV)","barium hexafluoroiridate(IV)","","- Ba F6 Ir -","- Ba F6 Ir -","- Ba3 F18 Ir3 -","3","0.166667","IZ3025","Smolentsev, Anton I.; Gubanov, Alexander I.; Danilenko, Andrey M.","Three hexafluoridoiridates(IV), Ca[IrF~6~]·2H~2~O, Sr[IrF~6~]·2H~2~O and Ba[IrF~6~]","Acta Crystallographica Section C","2007","63","11","i99","i101","10.1107/S0108270107044046","","","0.71073","MoKα","","0.0236","0.0236","","","0.0659","0.0659","","","","","","1.219","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016269","17.5731","0.0014","9.651","0.0008","22.7965","0.0019","90","","90","","90","","3866.2","0.5","105","2","105","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","2-[4-(4-acetanilido-trans-1,3-butadienyl)-3-cyano-5,5-dimethyl-2,5-\ dihydrofuranylidene]propanedinitrile","2-{4-[4-(N-Formylanilino)-trans-1,3-butadienyl]-3-cyano-5,5-dimethyl-2,5-\ dihydrofuranylidene}propanedinitrile","","- C22 H18 N4 O2 -","- C22 H18 N4 O2 -","- C176 H144 N32 O16 -","8","1","JZ3086","Gainsford, Graeme J.; Bhuiyan, M. Delower H.; Kay, Andrew J.","Geometry and bond-length alternation in nonlinear optical materials. I. Standard parameters in two precursors","Acta Crystallographica Section C","2007","63","11","o633","o637","10.1107/S0108270107046033","","","0.71073","MoKα","","0.1147","0.0471","","","0.0882","0.1133","","","","","","1.004","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016270","12.704","0.0015","15.154","0.002","11.7651","0.0014","90","","107.44","0.007","90","","2160.9","0.5","95","2","95","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-[4-(6-acetanilido-trans,trans-1,3,5-hexatrienyl)-3-cyano-5,5-dimethyl-\ 2,5-dihydrofuranylidene]propanedinitrile","2,5-dihydrofuranylidene}propanedinitrile","","- C24 H20 N4 O2 -","- C24 H20 N4 O2 -","- C96 H80 N16 O8 -","4","1","JZ3086","Gainsford, Graeme J.; Bhuiyan, M. Delower H.; Kay, Andrew J.","Geometry and bond-length alternation in nonlinear optical materials. I. Standard parameters in two precursors","Acta Crystallographica Section C","2007","63","11","o633","o637","10.1107/S0108270107046033","","","0.71073","MoKα","","0.2852","0.0667","","","0.1092","0.1694","","","","","","0.916","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016271","8.278","0.0017","10.694","0.002","15.155","0.003","90","","99.86","0.03","90","","1321.8","0.5","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","TBPY-5-34-[2-oxy-κO-acetophenone-N-(2-oxy-κO-ethyl) iminato-κN]silacyclopentane","(Ethane-1,2-diyl)(2-{[1-(2-oxidophenyl)ethylidene-κO]amino-κN}ethanolato-\ κO)silicon","","- C14 H19 N O2 Si -","- C14 H19 N O2 Si -","- C56 H76 N4 O8 Si4 -","4","1","JZ3090","Böhme, Uwe; Foehn, Ines C.","Two modifications of a five-coordinate silicon complex","Acta Crystallographica Section C","2007","63","11","o613","o616","10.1107/S0108270107045465","","","0.71073","MoKα","","0.0408","0.0354","","","0.0986","0.1021","","","","","","1.073","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016272","9.5798","0.0004","9.9284","0.0005","13.7788","0.0006","90","","90","","90","","1310.53","0.1","93","2","93","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","TBPY-5-34-[2-oxy-κO-acetophenone-N-(2-oxy-κO-ethyl) iminato-κN]silacyclopentane","(Ethane-1,2-diyl)(2-{[1-(2-oxidophenyl)ethylidene-κO]amino-κN}ethanolato-\ κO)silicon","","- C14 H19 N O2 Si -","- C14 H19 N O2 Si -","- C56 H76 N4 O8 Si4 -","4","1","JZ3090","Böhme, Uwe; Foehn, Ines C.","Two modifications of a five-coordinate silicon complex","Acta Crystallographica Section C","2007","63","11","o613","o616","10.1107/S0108270107045465","","","0.71073","MoKα","","0.0382","0.0336","","","0.084","0.0867","","","","","","1.044","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016273","7.2946","0.001","8.2775","0.0013","22.4","0.003","95.949","0.006","99.41","0.008","90.099","0.006","1326.9","0.3","160","2","160","2","","","","","","","","3","P -1","-P 1","2","","2-Hydroxy-4,6-dimethoxy-3-(3-methylbutanoyl)benzaldehyde","","- C14 H18 O5 -","- C14 H18 O5 -","- C56 H72 O20 -","4","2","JZ3095","Bats, Jan W.; Gerlach, Matthias; Reggelin, Michael; Köck, Matthias","2-Hydroxy-4,6-dimethoxy-3-(3-methylbutanoyl)benzaldehyde","Acta Crystallographica Section C","2007","63","11","o664","o666","10.1107/S0108270107048044","","","0.71073","MoKα","","0.1193","0.0507","","","0.1067","0.1314","","","","","","0.97","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016274","9.816","0.002","10.026","0.003","11.09","0.002","87.53","0.03","75.49","0.02","76.41","0.03","1026.9","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","Poly[tetrakis(2,2'-bipyridyl)di-μ~2~-oxido-hexaoxido-di-μ~3~-selenito- tetravanadium]","catena-Poly[[(2,2'-bipyridyl)oxidovanadium]-di-μ~2~-oxido-[(2,2'- bipyridyl)oxidovanadium]-μ~3~-selenito-bis[(2,2'-bipyridyl)dioxidovanadium]- μ~3~-selenito]","","- C20 H16 N4 O7 Se V2 -","- C20 H16 N4 O7 Se V2 -","- C40 H32 N8 O14 Se2 V4 -","2","1","LN3059","Zhao-Xun Lian; Ping Liu; Jia-Min Zhang; Tian-Xi Wang; Tian-Jun Lou","<i>catena</i>-Poly[[(2,2'-bipyridyl)oxidovanadium]-di-μ~2~-oxido-[(2,2'-bipyridyl)oxidovanadium]-μ~3~-selenito-bis[(2,2'-bipyridyl)dioxidovanadium]-μ~3~-selenito]","Acta Crystallographica Section C","2007","63","11","m525","m527","10.1107/S0108270107047683","","","0.71069","MoKα","","0.0274","0.0264","","","0.0853","0.0865","","","","","","1.043","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016275","15.5815","0.0004","7.4458","0.0004","16.8575","0.0008","90","","116.408","0.004","90","","1751.67","0.15","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","6-amino-5-formyl-1,3-dimethyluracil monohydrate","6-amino-5-formyl-1,3-dimethyl-2,4(1H,3H)-pyrimidinedione monohydrate","","- C7 H11 N3 O4 -","- C7 H11 N3 O4 -","- C56 H88 N24 O32 -","8","1","LN3062","de la Torre, José M.; Nogueras, Manuel; Cobo, Justo; Low, John N.; Glidewell, Christopher","Redetermination of 6-amino-5-formyl-1,3-dimethyluracil monohydrate at 120K: a polarized molecular structure and two interwoven hydrogen-bonded frameworks","Acta Crystallographica Section C","2007","63","11","o638","o640","10.1107/S0108270107044563","","","0.71073","MoKα","","0.0779","0.0483","","","0.1183","0.1415","","","","","","1.061","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016276","9.251","0.003","14.972","0.005","27.35","0.01","90","","98.791","0.006","90","","3744","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","9,9'-Biacridine N,N'-dioxide","","- C26 H16 N2 O2 -","- C26 H16 N2 O2 -","- C208 H128 N16 O16 -","8","1","LN3064","Chun-Sen Liu","9,9'-Biacridine <i>N</i>,<i>N</i>'-dioxide: a novel potential bridging ligand bearing the bulky acridine <i>N</i>-oxide skeleton","Acta Crystallographica Section C","2007","63","11","o673","o675","10.1107/S0108270107048019","","","0.71073","MoKα","","0.1624","0.061","","","0.1309","0.1831","","","","","","1","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016277","7.6237","0.0001","11.9574","0.0002","9.5112","0.0003","90","","116.767","0.002","90","","774.13","0.03","183","","183","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>trans</i>-Bis(azido-κN)bis(pyridine-2-carboxamide-κ^2^N^1^,O^2^)nickel(II)","","- C12 H12 N10 Ni O2 -","- C12 H12 N10 Ni O2 -","- C24 H24 N20 Ni2 O4 -","2","0.5","LN3065","Đaković, Marijana; Popović, Zora","<i>trans</i>-Bis(azido-κ<i>N</i>)bis(pyridine-2-carboxamide-κ^2^<i>N</i>^1^,<i>O</i>^2^)nickel(II)","Acta Crystallographica Section C","2007","63","11","m507","m509","10.1107/S0108270107047312","","","0.71073","MoKα","","0.0314","0.0272","","","0.0686","0.0727","","","","","","1.08","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016278","11.09","0.002","13.293","0.002","18.989","0.003","90","","90.488","0.003","90","","2799.2","0.8","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[disilver(I)(Ag—Ag)]-bis[μ-1,1'-(butane-1,4-diyl)diimidazole- κ^2^<i>N</i>:<i>N</i>'] bis(perchlorate)]","","- C10 H14 Ag Cl N4 O4 -","- C10 H14 Ag Cl N4 O4 -","- C80 H112 Ag8 Cl8 N32 O32 -","8","1","LN3066","Yong-Fang Li; Zi-Hong Pan; Tian-Jun Lou","<i>catena</i>-Poly[[disilver(I)(<i>Ag{—</i>Ag})-bis[μ-1,1'-(butane-1,4-diyl)diimidazole-κ^2^<i>N</i>^3^:<i>N</i>^3'^]] bis(perchlorate)]: a double helix stabilized by ligand-unsupported argentophilic interactions","Acta Crystallographica Section C","2007","63","11","m516","m518","10.1107/S0108270107048251","","","0.71073","MoKα","","0.0771","0.0486","","","0.1202","0.141","","","","","","1.034","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016279","6.6739","0.0011","7.5697","0.0016","10.899","0.002","85.036","0.018","75.039","0.015","66.596","0.011","488.1","0.17","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","(4Z)-4-Amino-2-(4-hydroxyphenyl)-1H-imidazol-5(2H)-one oxime 3-oxide","","- C9 H10 N4 O3 -","- C9 H10 N4 O3 -","- C18 H20 N8 O6 -","2","1","SF3047","Xue-Qin Cao; Zhan-Xiong Li; Guo-Qiang Chen; De-Chun Zhang","(5<i>Z</i>)-4-Amino-2-(4-hydroxyphenyl)-1<i>H</i>-imidazol-5(2<i>H</i>)-one oxime 3-oxide","Acta Crystallographica Section C","2007","63","11","o671","o672","10.1107/S0108270107040978","","","0.7107","MoKα","","0.0583","0.0456","","","0.0996","0.1076","","","","","","1.086","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016280","6.8792","0.0004","7.6203","0.0005","8.0401","0.0005","102.281","0.002","104.125","0.001","101.422","0.001","385.23","0.04","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","Poly[bis[aquaneodymium(III)]-μ~2~-oxalato-di-μ~4~-succinato]","","- C5 H6 Nd O7 -","- C5 H6 Nd O7 -","- C10 H12 Nd2 O14 -","2","1","SK3164","Chun-Xiang Wang; Zhi-Feng Li; Ping Wang","Poly[bis[aquaneodymium(III)]-μ~2~-oxalato-di-μ~4~-succinato]","Acta Crystallographica Section C","2007","63","11","m473","m475","10.1107/S0108270107045143","","","0.71073","MoKα","","0.0459","0.0448","","","0.1124","0.1129","","","","","","1.095","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016281","8.6844","0.0006","10.7807","0.0019","10.8903","0.001","69.998","0.014","88.918","0.007","76.822","0.013","930.9","0.2","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","2-amino-4,6-bis[N-methyl-N-(4-methylphenyl)amino]pyrimidine-5-carbaldehyde","","- C21 H23 N5 O -","- C21 H23 N5 O -","- C42 H46 N10 O2 -","2","1","SK3170","Low, John N.; Trilleras, Jorge; Cobo, Justo; Marchal, Antonio; Glidewell, Christopher","A three-dimensional hydrogen-bonded framework in 2-amino-4,6-bis[<i>N</i>-methyl-<i>N</i>-(4-methylphenyl)amino]pyrimidine-5-carbaldehyde and hydrogen-bonded sheets in 2-amino-4-(indolin-1-yl)-6-methoxypyrimidine-5-carbaldehyde","Acta Crystallographica Section C","2007","63","11","o681","o684","10.1107/S0108270107048809","","","0.71073","MoKα","","0.0956","0.0604","","","0.1338","0.1526","","","","","","1.084","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016282","8.2846","0.0004","11.271","0.0004","15.0024","0.0007","108.983","0.004","95.403","0.004","101.908","0.003","1276.33","0.11","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","2-amino-4-(indolin-1-yl)-6-methoxypyrimidine-5-carbaldehyde","","- C14 H14 N4 O2 -","- C14 H14 N4 O2 -","- C56 H56 N16 O8 -","4","2","SK3170","Low, John N.; Trilleras, Jorge; Cobo, Justo; Marchal, Antonio; Glidewell, Christopher","A three-dimensional hydrogen-bonded framework in 2-amino-4,6-bis[<i>N</i>-methyl-<i>N</i>-(4-methylphenyl)amino]pyrimidine-5-carbaldehyde and hydrogen-bonded sheets in 2-amino-4-(indolin-1-yl)-6-methoxypyrimidine-5-carbaldehyde","Acta Crystallographica Section C","2007","63","11","o681","o684","10.1107/S0108270107048809","","","0.71073","MoKα","","0.1012","0.0553","","","0.1318","0.1641","","","","","","1.084","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016283","7.765","0.004","9.712","0.005","11.036","0.006","82.445","0.017","74.035","0.017","69.718","0.016","750","0.7","295","","295","","","","","","","","","5","P -1","-P 1","2","","Bis(μ~4~-butane-1,4-dithiolato)bis[hexacarbonyldiiron(II)(Fe—Fe)]","","- C20 H16 Fe4 O12 S4 -","- C20 H16 Fe4 O12 S4 -","- C20 H16 Fe4 O12 S4 -","1","0.5","SQ3090","Zhang, Yue; Si, You-Tao; Hu, Ming-Qiang; Chen, Chang-Neng; Liu, Qiu-Tian","Bis(μ~4~-butane-1,4-dithiolato)bis[hexacarbonyldiiron(II)(<i>Fe</i>—<i>Fe</i>)]","Acta Crystallographica Section C","2007","63","11","m499","m500","10.1107/S0108270107041674","","","0.71073","MoKα","","0.054","0.0371","","","0.0935","0.1061","","","","","","0.997","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2016284","9.3326","0.0009","10.098","0.0009","10.3272","0.0009","75.343","0.007","72.571","0.006","81.242","0.007","895.25","0.15","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","bis[2,3-bis(aminocarbonyl)-8,9-bis(methylsulfanyl)tetrathiafulvalenium] di-μ-bromido-bis[bromidocopper(II)]","","- C20 H20 Br4 Cu2 N4 O4 S12 -","- C20 H20 Br4 Cu2 N4 O4 S12 -","- C20 H20 Br4 Cu2 N4 O4 S12 -","1","0.5","SQ3096","Lu, Wen; Zhu, Qin-Yu; Zhang, Yong; Lin, Xiao-Min; Dai, Jie","A new tetrathiafulvalene‒diamide cation salt with [Cu~2~Br~4~]^2{-^} anions","Acta Crystallographica Section C","2007","63","11","m496","m498","10.1107/S0108270107042035","","","0.71073","MoKα","","0.0343","0.0275","","","0.0659","0.0698","","","","","","1.052","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016285","9.3091","0.0003","9.3091","0.0003","10.9744","0.0004","90","","90","","90","","951.03","0.06","293","2","","","","","","","","","","5","P 41","P 4w","76","","Potassium indium niobium oxide phosphate","","- In0.459 K0.917 Nb0.541 O5 P -","- In0.45835 K0.9165 Nb0.54165 O5 P -","- In3.6668 K7.332 Nb4.3332 O40 P8 -","8","2","SQ3098","Artem A. Babaryk; Igor V. Zatovsky; Vyacheslav N. Baumer; Nikolay S. Slobodyanik; Domasevitch, Konstantin V.","The complex phosphate K~0.92~In~0.46~Nb~0.54~OPO~4~: a new representative of the KTiOPO~4~ family","Acta Crystallographica Section C","2007","63","11","i105","i108","10.1107/S0108270107047129","","","0.71073","MoKα","","","0.0199","","","","0.0528","","","","","","1.062","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2016286","5.6636","0.0003","18.9255","0.0009","10.05","0.0005","90","","94.136","0.001","90","","1074.42","0.09","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2Z)-1-(4-Bromophenyl)-2-(pyrrolidin-2-ylidene)ethanone","","- C12 H12 Br N O -","- C12 H12 Br N O -","- C48 H48 Br4 N4 O4 -","4","1","AV3112","Balderson, James L.; Fernandes, Manuel A.; Michael, Joseph P.; Perry, Christopher B.","Hydrogen-bonding patterns in enaminones: (2<i>Z</i>)-1-(4-bromophenyl)-2-(pyrrolidin-2-ylidene)ethanone and its piperidin-2-ylidene and azepan-2-ylidene analogues","Acta Crystallographica Section C","2007","63","12","o734","o738","10.1107/S0108270107053206","","","0.71073","MoKα","","0.0285","0.0239","","","0.0658","0.0682","","","","","","1.055","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016287","6.9303","0.0002","7.628","0.0002","12.106","0.0003","99.844","0.002","99.545","0.001","102.189","0.002","602.64","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","(2Z)-1-(4-Bromophenyl)-2-(piperidin-2-ylidene)ethanone","","- C13 H14 Br N O -","- C13 H14 Br N O -","- C26 H28 Br2 N2 O2 -","2","1","AV3112","Balderson, James L.; Fernandes, Manuel A.; Michael, Joseph P.; Perry, Christopher B.","Hydrogen-bonding patterns in enaminones: (2<i>Z</i>)-1-(4-bromophenyl)-2-(pyrrolidin-2-ylidene)ethanone and its piperidin-2-ylidene and azepan-2-ylidene analogues","Acta Crystallographica Section C","2007","63","12","o734","o738","10.1107/S0108270107053206","","","0.71073","MoKα","","0.0369","0.0266","","","0.073","0.1068","","","","","","1.138","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016288","12.2867","0.0003","8.2416","0.0002","12.9404","0.0004","90","","100.702","0.002","90","","1287.58","0.06","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2Z)-2-(Azepan-2-ylidene)-1-(4-bromophenyl)ethanone","","- C14 H16 Br N O -","- C14 H16 Br N O -","- C56 H64 Br4 N4 O4 -","4","1","AV3112","Balderson, James L.; Fernandes, Manuel A.; Michael, Joseph P.; Perry, Christopher B.","Hydrogen-bonding patterns in enaminones: (2<i>Z</i>)-1-(4-bromophenyl)-2-(pyrrolidin-2-ylidene)ethanone and its piperidin-2-ylidene and azepan-2-ylidene analogues","Acta Crystallographica Section C","2007","63","12","o734","o738","10.1107/S0108270107053206","","","0.71073","MoKα","","0.0369","0.0254","","","0.0624","0.0648","","","","","","1.023","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016289","7.1918","0.0014","8.94","0.0018","15.792","0.003","103.81","0.03","94.01","0.03","106.51","0.03","934.9","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","4-(3-carboxy-1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-quinolyl)piperazinium dihydrogen phosphate monohydrate","","- C16 H23 F N3 O8 P -","- C16 H23 F N3 O8 P -","- C32 H46 F2 N6 O16 P2 -","2","1","AV3114","Lou, Benyong; Boström, Dan; Velaga, Sitaram P","Monohydrous dihydrogen phosphate salts of norfloxacin and ciprofloxacin","Acta Crystallographica Section C","2007","63","12","o731","o733","10.1107/S0108270107053218","","","0.71073","MoKα","","0.0662","0.0482","","","0.1261","0.1458","","","","","","1.096","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016290","7.2582","0.0015","8.9979","0.0018","15.712","0.003","100.93","0.03","96","0.03","105.74","0.03","956.4","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","4-(3-carboxy-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-quinolyl)piperazinium dihydrogen phosphate monohydrate","","- C17 H23 F N3 O8 P -","- C17 H23 F N3 O8 P -","- C34 H46 F2 N6 O16 P2 -","2","1","AV3114","Lou, Benyong; Boström, Dan; Velaga, Sitaram P","Monohydrous dihydrogen phosphate salts of norfloxacin and ciprofloxacin","Acta Crystallographica Section C","2007","63","12","o731","o733","10.1107/S0108270107053218","","","0.71073","MoKα","","0.0951","0.0749","","","0.2285","0.2417","","","","","","1.124","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016291","7.2869","0.0017","5.9407","0.0014","36.805","0.008","90","","93.724","0.004","90","","1589.9","0.6","290","2","290","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2E)-3-(2-fluoro-4-phenoxyphenyl)-1-phenylprop-2-en-1-one","","- C21 H15 F O2 -","- C21 H15 F O2 -","- C84 H60 F4 O8 -","4","1","AV3115","Chopra, Deepak; Mohan, T. P.; Vishalakshi, B.; Guru Row, T. N.","A series of substituted (2<i>E</i>)-3-(2-fluoro-4-phenoxyphenyl)-1-phenylprop-2-en-1-ones","Acta Crystallographica Section C","2007","63","12","o704","o710","10.1107/S0108270107049426","","","0.71073","MoKα","","0.055","0.0464","","","0.1217","0.1346","","","","","","1.212","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016292","8.164","0.005","10.036","0.006","11.136","0.007","97.362","0.01","101.898","0.009","108.731","0.009","826.7","0.9","290","2","290","2","","","","","","","","4","P -1","-P 1","2","","(2E)-3-(2-fluoro-4-phenoxyphenyl)-1-(4-fluorophenyl)prop-2-en-1-one","","- C21 H14 F2 O2 -","- C21 H14 F2 O2 -","- C42 H28 F4 O4 -","2","1","AV3115","Chopra, Deepak; Mohan, T. P.; Vishalakshi, B.; Guru Row, T. N.","A series of substituted (2<i>E</i>)-3-(2-fluoro-4-phenoxyphenyl)-1-phenylprop-2-en-1-ones","Acta Crystallographica Section C","2007","63","12","o704","o710","10.1107/S0108270107049426","","","0.71073","MoKα","","0.0696","0.0424","","","0.1047","0.1176","","","","","","1.025","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016293","9.045","0.006","9.833","0.006","11.474","0.007","99.109","0.007","104.8","0.008","113.697","0.009","863.3","0.9","290","2","290","2","","","","","","","","5","P -1","-P 1","2","","(2E)-1-(4-chlorophenyl)-3-(2-fluoro-4-phenoxyphenyl)prop-2-en-1-one","","- C21 H14 Cl F O2 -","- C21 H14 Cl F O2 -","- C42 H28 Cl2 F2 O4 -","2","1","AV3115","Chopra, Deepak; Mohan, T. P.; Vishalakshi, B.; Guru Row, T. N.","A series of substituted (2<i>E</i>)-3-(2-fluoro-4-phenoxyphenyl)-1-phenylprop-2-en-1-ones","Acta Crystallographica Section C","2007","63","12","o704","o710","10.1107/S0108270107049426","","","0.71073","MoKα","","0.0662","0.0453","","","0.1105","0.1341","","","","","","1.057","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016294","9.196","0.005","9.726","0.005","11.554","0.007","98.887","0.009","104.304","0.009","113.754","0.008","878.1","0.9","290","2","290","2","","","","","","","","4","P -1","-P 1","2","","(2E)-3-(2-fluoro-4-phenoxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one","","- C22 H17 F O2 -","- C22 H17 F O2 -","- C44 H34 F2 O4 -","2","1","AV3115","Chopra, Deepak; Mohan, T. P.; Vishalakshi, B.; Guru Row, T. N.","A series of substituted (2<i>E</i>)-3-(2-fluoro-4-phenoxyphenyl)-1-phenylprop-2-en-1-ones","Acta Crystallographica Section C","2007","63","12","o704","o710","10.1107/S0108270107049426","","","0.71073","MoKα","","0.0614","0.0447","","","0.112","0.1242","","","","","","1.029","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016295","9.645","0.004","10.111","0.005","10.537","0.006","66.706","0.007","65.347","0.008","80.949","0.009","857.8","0.7","290","2","290","2","","","","","","","","4","P -1","-P 1","2","","(2E)-3-(2-fluoro-4-phenoxyphenyl)-1-(4-methoxyphenyl)prop-2-en-1-one","","- C22 H17 F O3 -","- C22 H17 F O3 -","- C44 H34 F2 O6 -","2","1","AV3115","Chopra, Deepak; Mohan, T. P.; Vishalakshi, B.; Guru Row, T. N.","A series of substituted (2<i>E</i>)-3-(2-fluoro-4-phenoxyphenyl)-1-phenylprop-2-en-1-ones","Acta Crystallographica Section C","2007","63","12","o704","o710","10.1107/S0108270107049426","","","0.71073","MoKα","","0.0933","0.0519","","","0.0967","0.1111","","","","","","1.02","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016296","7.0758","0.0012","7.2954","0.0012","10.8601","0.0018","97.317","0.002","91.591","0.003","100.621","0.003","545.76","0.16","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Poly[[triaquazinc(II)]-μ~3~-4-nitrophthalato-κ^3^O^1^:O^2^:O^2'^]","","- C8 H9 N O9 Zn -","- C8 H9 N O9 Zn -","- C16 H18 N2 O18 Zn2 -","2","1","AV3117","Guo, Ming-Lin; Guo, Chen-Hu","Poly[[triaquazinc(II)]-μ~3~-4-nitrophthalato-κ^3^<i>O</i>^1^:<i>O</i>^2^:<i>O</i>^2'^]","Acta Crystallographica Section C","2007","63","12","m595","m597","10.1107/S0108270107054509","","","0.71073","MoKα","","0.0265","0.0232","","","0.0588","0.0605","","","","","","1.098","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016297","10.6715","0.0005","5.9502","0.0003","22.987","0.0011","90","","100.953","0.005","90","","1433.03","0.12","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-[(E)-2-(4-fluorophenyl)vinyl]-9<i>H</i>-carbazole","","- C20 H14 F N -","- C20 H14 F N -","- C80 H56 F4 N4 -","4","1","AV3120","Kubicki, Maciej; Prukała, Wiesław; Marciniec, Bogdan","Three 9-[(<i>E</i>)-2-(4-halogenophenyl)vinyl]-9<i>H</i>-carbazoles","Acta Crystallographica Section C","2007","63","12","o754","o757","10.1107/S0108270107054571","","","0.71073","MoKα","","0.0908","0.0379","","","0.0566","0.0603","","","","","","1.007","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016298","14.319","0.0011","5.6943","0.0005","18.6247","0.0018","90","","102.73","0.007","90","","1481.3","0.2","100","1","100","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","9-[(E)-2-(4-chlorophenyl)vinyl]-9<i>H</i>-carbazole","","- C20 H14 Cl N -","- C20 H14 Cl N -","- C80 H56 Cl4 N4 -","4","1","AV3120","Kubicki, Maciej; Prukała, Wiesław; Marciniec, Bogdan","Three 9-[(<i>E</i>)-2-(4-halogenophenyl)vinyl]-9<i>H</i>-carbazoles","Acta Crystallographica Section C","2007","63","12","o754","o757","10.1107/S0108270107054571","","","0.71073","MoKα","","0.0614","0.035","","","0.077","0.0803","","","","","","1.022","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016299","14.5152","0.0005","5.6485","0.0002","18.826","0.0006","90","","103.605","0.003","90","","1500.22","0.09","100","1","100","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","9-[(E)-2-(4-bromophenyl)vinyl]-9<i>H</i>-carbazole","","- C20 H14 Br N -","- C20 H14 Br N -","- C80 H56 Br4 N4 -","4","1","AV3120","Kubicki, Maciej; Prukała, Wiesław; Marciniec, Bogdan","Three 9-[(<i>E</i>)-2-(4-halogenophenyl)vinyl]-9<i>H</i>-carbazoles","Acta Crystallographica Section C","2007","63","12","o754","o757","10.1107/S0108270107054571","","","0.71073","MoKα","","0.0425","0.0287","","","0.0645","0.0663","","","","","","1.076","","","","has coordinates,has Fobs","192309","2020-10-21","18:00:00",""
"2016300","23.411","0.004","10.409","0.002","13.722","0.003","90","","90","","90","","3343.8","1.1","295","3","295","3","","","","","","","","5","P b c n","-P 2n 2ab","60","","diaquabis(2-hydroxybenzoato-κ<i>O</i>)bis(1,10-phenanthroline-\ κ^2^<i>N</i>,<i>N</i>')strontium(II)","","- C38 H30 N4 O8 Sr -","- C38 H30 N4 O8 Sr -","- C152 H120 N16 O32 Sr4 -","4","0.5","BG3058","Duan-Jun Xu; Bing-Yu Zhang; Jian-Rong Su; Jing-Jing Nie","Intramolecular π‒π stacking in diaquabis(2-hydroxybenzoato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')strontium(II)","Acta Crystallographica Section C","2007","63","12","m622","m624","10.1107/S0108270107050597","","","0.71069","MoKα","","0.078","0.054","","","0.104","0.113","","","","","","1.179","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016301","14.43","0.002","9.4424","0.0008","14.725","0.002","90","","118.864","0.011","90","","1757.1","0.4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dibromidotetrakis(1H-pyrazole-κN^3^)manganese(II)","","- C12 H16 Br2 Mn N8 -","- C12 H16 Br2 Mn N8 -","- C48 H64 Br8 Mn4 N32 -","4","0.5","BG3059","Ruth, Kai; Kunz, Kerstin; Lerner, Hans-Wolfram; Bolte, Michael","Setting ambiguity in <i>C</i>2/<i>c</i> with dibromidotetrakis(1<i>H</i>-pyrazole-κ<i>N</i>^2^)manganese(II) as an example","Acta Crystallographica Section C","2007","63","12","m566","m569","10.1107/S0108270107052419","","","0.71073","MoKα","","0.0933","0.0658","","","0.1562","0.1686","","","","","","1.025","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016302","10.885","0.007","7.247","0.004","14.885","0.007","90","","100.913","0.008","90","","1152.9","1.1","273","2","273","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(4-methoxybenzenethiolato-κS)oxido[2,2'-(3- phenylpropylimino)bis(ethanethiolato)-κ^3^S,N,S']technetium(V)","","- C21 H28 N O2 S3 Tc -","- C21 H28 N O2 S3 Tc -","- C42 H56 N2 O4 S6 Tc2 -","2","1","BG3060","Franziska Emmerling; Werner Kraus; Bernhard Noll; Steffi Noll; Hans-Jürgen Pietzsch","Two mononuclear Tc complexes: [2,2'-(3-phenylpropylimino)- and [2,2'-(propylimino)bis(ethanethiolato)](4-methoxybenzenethiolato)oxidotechnate(V)","Acta Crystallographica Section C","2007","63","12","m579","m582","10.1107/S0108270107052870","","","0.71073","MoKα","","0.089","0.0648","","","0.1343","0.1435","","","","","","1.024","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016303","10.61","0.007","10.356","0.007","16.296","0.011","90","","90.574","0.015","90","","1790","2","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(4-methoxybenzenethiolato-κS)oxido[2,2'-(propylimino)bis(ethanethiolato)- κ^3^S,N,S']technetium(V)","","- C14 H22 N O2 S3 Tc -","- C14 H22 N O2 S3 Tc -","- C56 H88 N4 O8 S12 Tc4 -","4","1","BG3060","Franziska Emmerling; Werner Kraus; Bernhard Noll; Steffi Noll; Hans-Jürgen Pietzsch","Two mononuclear Tc complexes: [2,2'-(3-phenylpropylimino)- and [2,2'-(propylimino)bis(ethanethiolato)](4-methoxybenzenethiolato)oxidotechnate(V)","Acta Crystallographica Section C","2007","63","12","m579","m582","10.1107/S0108270107052870","","","0.71073","MoKα","","0.1592","0.0617","","","0.0906","0.0954","","","","","","0.864","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016304","20.8868","0.0006","6.00175","0.00018","17.3531","0.0005","90","","90","","90","","2175.34","0.11","173","2","173","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","1-(4-methoxyphenyl)-2,2-dimethylpropan-1-ol","","- C12 H18 O2 -","- C12 H18 O2 -","- C96 H144 O16 -","8","2","BM3037","Gliński, Marek; Wilczkowska, Ewa; Madura, Izabela D.; Zachara, Janusz","Hydrogen-bonded networks in 1-(4-methoxyphenyl)-2,2-dimethylpropan-1-ol","Acta Crystallographica Section C","2007","63","12","o720","o722","10.1107/S0108270107046975","","","0.71073","MoKα","","0.0315","0.0273","","","0.072","0.0733","","","","","","1.088","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016305","8.245","0.002","10.962","0.003","11.008","0.003","98.391","0.007","100.819","0.008","107.349","0.007","910.9","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","2-methoxyethyl 6-amino-5-cyano-2-methyl-4-(1-naphthyl)-4<i>H</i>-pyran-3-carboxylate","","- C21 H20 N2 O4 -","- C21 H20 N2 O4 -","- C42 H40 N4 O8 -","2","1","BM3039","Vladimir N. Nesterov; David J. Wiedenfeld; Svitlana V. Nesterova; Lucas F. Hastings","Three sterically hindered 6-amino-5-cyano-2-methyl-4-(1-naphthyl)-4<i>H</i>-pyran-3-carboxylate derivatives","Acta Crystallographica Section C","2007","63","12","o685","o689","10.1107/S0108270107049001","","","0.71073","MoKα","","0.0706","0.0427","","","0.0982","0.1109","","","","","","0.997","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016306","8.248","0.003","11.184","0.004","11.394","0.004","63.646","0.007","73.836","0.008","79.069","0.007","901.9","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","isopropyl 6-amino-5-cyano-2-methyl-4-(1-naphthyl)-4<i>H</i>-pyran-3-carboxylate","","- C21 H20 N2 O3 -","- C21 H20 N2 O3 -","- C42 H40 N4 O6 -","2","1","BM3039","Vladimir N. Nesterov; David J. Wiedenfeld; Svitlana V. Nesterova; Lucas F. Hastings","Three sterically hindered 6-amino-5-cyano-2-methyl-4-(1-naphthyl)-4<i>H</i>-pyran-3-carboxylate derivatives","Acta Crystallographica Section C","2007","63","12","o685","o689","10.1107/S0108270107049001","","","0.71073","MoKα","","0.07","0.0525","","","0.1352","0.148","","","","","","1.011","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016307","7.8638","0.0007","19.4628","0.0018","11.0823","0.001","90","","99.963","0.002","90","","1670.6","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","ethyl 6-amino-5-cyano-2-methyl-4-(1-naphthyl)-4<i>H</i>-pyran-3-carboxylate","","- C20 H18 N2 O3 -","- C20 H18 N2 O3 -","- C80 H72 N8 O12 -","4","1","BM3039","Vladimir N. Nesterov; David J. Wiedenfeld; Svitlana V. Nesterova; Lucas F. Hastings","Three sterically hindered 6-amino-5-cyano-2-methyl-4-(1-naphthyl)-4<i>H</i>-pyran-3-carboxylate derivatives","Acta Crystallographica Section C","2007","63","12","o685","o689","10.1107/S0108270107049001","","","0.71073","MoKα","","0.0939","0.0466","","","0.0933","0.1108","","","","","","1.001","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016308","7.3482","0.0011","35.825","0.004","7.8986","0.0012","90","","106.906","0.012","90","","1989.4","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-poly[(dipyrido[3,2-a:2',3'-c]phenazine-κ^2^N,N')nickel(II)]-μ-\ 2,6-dipicolinato-κ^3^O^2^,O^6^:O^2'^]","","- C25 H13 N5 Ni O4 -","- C25 H13 N5 Ni O4 -","- C100 H52 N20 Ni4 O16 -","4","1","DN3067","Ma, Yi; Zhang, Li-Tian; Wang, Xiao-Fang; He, Yong-Ke; Han, Zheng-Bo","A one-dimensional nickel(II) coordination polymer containing 2,6-dipicolinate and dipyrido[3,2-<i>a</i>:2',3'-<i>c</i>]phenazine","Acta Crystallographica Section C","2007","63","12","m573","m575","10.1107/S0108270107053851","","","0.71073","MoKα","","0.0535","0.0401","","","0.1009","0.1111","","","","","","1.08","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016309","8.0149","0.0007","9.2527","0.0008","9.5534","0.0008","103.031","0.001","106.938","0.001","106.303","0.001","612.98","0.09","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","<i>catena</i>-poly[[(2,2-bipyridyl-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-di- μ-chlorido-cadmium(II)-di-μ-thiocyanato-κ^2^N:S;κ^2^S:N]","","- C11 H8 Cd Cl N3 S -","- C11 H8 Cd Cl N3 S -","- C22 H16 Cd2 Cl2 N6 S2 -","2","1","DN3068","Chen, Min; Chen, Xu-Dong; Du, Miao","An unusual chain cadmium(II) coordination polymer: <i>catena</i>-poly[[(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-di-μ-chlorido-[(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>]","Acta Crystallographica Section C","2007","63","12","m570","m572","10.1107/S0108270107052638","","","0.71073","MoKα","","0.0194","0.0178","","","0.0445","0.0451","","","","","","1.044","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016310","12.9325","0.0017","6.7317","0.0009","17.018","0.002","90","","90","","90","","1481.5","0.3","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Poly[[diaquamanganese(II)]-μ~3~-2-oxo-4-oxido-1,2-dihydropyrimidine- 5-carboxylato-κ^4^O^4^,O^5^:O^2^:O^2^]","","- C5 H6 Mn N2 O6 -","- C5 H6 Mn N2 O6 -","- C40 H48 Mn8 N16 O48 -","8","1","DN3069","Chen, Zilu; Xing, Huihui; Liang, Fupei","Poly[[diaquamanganese(II)]-μ~3~-4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylato-κ^4^<i>O</i>^4^,<i>O</i>^5^:<i>O</i>^2^:<i>O</i>^2^]","Acta Crystallographica Section C","2007","63","12","m576","m578","10.1107/S0108270107053875","","","0.71073","MoKα","","0.0301","0.0239","","","0.059","0.0625","","","","","","1.072","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016311","8.6811","0.0004","9.5627","0.0004","12.1914","0.0006","90","","90","","90","","1012.07","0.08","113","2","113","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Trirubidium diyttrium triborate","","- B3 O9 Rb3 Y2 -","- B3 O9 Rb3 Y2 -","- B12 O36 Rb12 Y8 -","4","1","FA3116","Gao, J. H.; Li, R. K.","Rb~3~Y~2~(BO~3~)~3~ with a noncentrosymmetric structure","Acta Crystallographica Section C","2007","63","12","i112","i114","10.1107/S0108270107054078","","","0.7107","MoKα","","0.0547","0.048","","","0.0764","0.0791","","","","","","1.001","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016312","6.987","0.002","8.645","0.002","10.567","0.003","105.48","0.02","97.08","0.02","110.28","0.03","560.3","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","tetraaquabis(3-cyano-4-dicyanomethylene-5-oxo-4,5-dihydro-1H-pyrrol-2-\ olato)cadmium(II) dihydrate","","- C16 H14 Cd N8 O10 -","- C16 H14 Cd N8 O10 -","- C16 H14 Cd N8 O10 -","1","0.5","GA3063","Tafeenko, Viktor A.; Panin, Gennady N.; Baranov, Andrey N.; Bardasov, Ivan N.; Aslanov, Leonid A.","Luminescent properties of three structures built from 3-cyano-4-dicyanomethylene-5-oxo-4,5-dihydro-1<i>H</i>-pyrrol-2-olate and cadmium","Acta Crystallographica Section C","2007","63","12","m541","m547","10.1107/S0108270107045453","","","0.71073","MoKα","","0.0339","0.0299","","","0.0696","0.0713","","","","","","1.054","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016313","6.9511","0.001","8.4052","0.0012","11.3293","0.0016","84.61","0.02","72.523","0.01","88.34","0.01","628.57","0.16","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","tetraaquabis(3-cyano-4-dicyanomethylene-5-oxo-4,5-dihydro-1H-pyrrol-2-\ olato)cadmium(II) 1,4-dioxane solvate","","- C20 H18 Cd N8 O10 -","- C20 H18 Cd N8 O10 -","- C20 H18 Cd N8 O10 -","1","0.5","GA3063","Tafeenko, Viktor A.; Panin, Gennady N.; Baranov, Andrey N.; Bardasov, Ivan N.; Aslanov, Leonid A.","Luminescent properties of three structures built from 3-cyano-4-dicyanomethylene-5-oxo-4,5-dihydro-1<i>H</i>-pyrrol-2-olate and cadmium","Acta Crystallographica Section C","2007","63","12","m541","m547","10.1107/S0108270107045453","","","0.71073","MoKα","","0.0813","0.0525","","","0.1017","0.1141","","","","","","0.977","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016314","18.3348","0.0012","19.964","0.0015","13.5231","0.0011","90","","119.77","0.02","90","","4296.7","1","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","poly[[decaaqua-bis(μ~2~-3-cyano-4-dicyanomethylene-5-oxo-4,5-dihydro-1H- pyrrol-2-olato-κ^2^N:N')bis(μ~2~-3-cyano-4-dicyanomethylene-3H-pyrrole- 2,5-diolate-κ^2^N:N')dicadmium] 0.5-hydrate]","","- C32 H23 Cd3 N16 O18.5 -","- C64 H44 Cd6 N32 O37 -","- C128 H88 Cd12 N64 O74 -","2","0.25","GA3063","Tafeenko, Viktor A.; Panin, Gennady N.; Baranov, Andrey N.; Bardasov, Ivan N.; Aslanov, Leonid A.","Luminescent properties of three structures built from 3-cyano-4-dicyanomethylene-5-oxo-4,5-dihydro-1<i>H</i>-pyrrol-2-olate and cadmium","Acta Crystallographica Section C","2007","63","12","m541","m547","10.1107/S0108270107045453","","","1.54184","CuKα","","0.0524","0.0432","","","0.1129","0.1184","","","","","","1.02","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016315","13.125","0.003","11.332","0.002","10.185","0.002","90","","117.91","0.03","90","","1338.6","0.6","173","2","173","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","bis(μ-tetramethyldistibine)bis(tetracarbonylchromium)","1,1,1,1,4,4,4,4-Octacarbonyl-2,2,3,3,5,5,6,6-octamethyl-cyclo-2,3,5,6- tetraantimony-1,4-dichromium","","- C16 H24 Cr2 O8 Sb4 -","- C16 H24 Cr2 O8 Sb4 -","- C32 H48 Cr4 O16 Sb8 -","2","0.25","GA3072","Breunig, Hans Joachim; Lork, Enno; Moldovan, Ovidiu; Raţ, Ciprian I.","1,1,1,1,4,4,4,4-Octacarbonyl-2,2,3,3,5,5,6,6-octamethyl-<i>cyclo</i>-2,3,5,6-tetraantimony-1,4-dichromium","Acta Crystallographica Section C","2007","63","12","m548","m549","10.1107/S0108270107049943","","","0.71073","MoKα","","0.0313","0.0237","","","0.0534","0.0559","","","","","","0.988","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016316","9.1632","0.0009","9.2131","0.0009","11.5904","0.0011","94.709","0.002","92.486","0.002","102.912","0.002","948.6","0.16","291","2","296","2","","","","","","","","3","P -1","-P 1","2","(1R*,2S*,3S*,8S*)-2,3-di(acetyloxy)-8-[(acetyloxy)methyl]cyclooctyl acetate","(1S*,2R*,3S*,4S*)-2,3,4-triacetoxycyclooctan-1-ylmethyl acetate","","- C17 H26 O8 -","- C17 H26 O8 -","- C34 H52 O16 -","2","1","GA3073","Goverdhan Mehta; Saikat Sen; Kotapalli Pallavi","Packing in three cyclooctitol acetates","Acta Crystallographica Section C","2007","63","12","o726","o728","10.1107/S0108270107048664","","","0.71073","MoKa","","0.0569","0.048","","","0.13","0.1358","","","","","","1.061","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016317","19.206","0.012","26.611","0.017","7.748","0.005","90","","90","","90","","3960","4","291","2","291","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","(3aS*,4S*,5S*,9R*,9aS*)-4-(acetyloxy)-9-[(acetyloxy)methyl]-2,2-dimethyl perhydrocycloocta[d][1,3]dioxol-5-yl acetate","(3aS*,4R*,8S*,9S*,9aS*)-8,9-diacetoxy-2,2-dimethylcyclooctano[d][1,3]dioxan- 4-ylmethyl acetate","","- C18 H28 O8 -","- C18 H28 O8 -","- C144 H224 O64 -","8","1","GA3073","Goverdhan Mehta; Saikat Sen; Kotapalli Pallavi","Packing in three cyclooctitol acetates","Acta Crystallographica Section C","2007","63","12","o726","o728","10.1107/S0108270107048664","","","0.71073","MoKa","","0.0604","0.0424","","","0.1036","0.1109","","","","","","1.037","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016318","7.7179","0.0016","11.486","0.002","11.72","0.002","76.515","0.004","74.547","0.004","85.394","0.004","973.6","0.3","291","2","291","2","","","","","","","","3","P -1","-P 1","2","(3aS,4R,6S,9R,9aS)-4-(acetyloxy)-9-[(acetyloxy)methyl]-2,2-dimethylperhydro cycloocta[d][1,3]dioxol-6-yl acetate","(3aS,4R,7S,9R,9aS)- 7,9-diacetoxy-2,2-dimethylcyclooctano[d][1,3]dioxan-4-ylmethyl acetate","","- C18 H28 O8 -","- C18 H28 O8 -","- C36 H56 O16 -","2","1","GA3073","Goverdhan Mehta; Saikat Sen; Kotapalli Pallavi","Packing in three cyclooctitol acetates","Acta Crystallographica Section C","2007","63","12","o726","o728","10.1107/S0108270107048664","","","0.71073","MoKa","","0.1205","0.0552","","","0.1107","0.1322","","","","","","0.887","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016319","5.9774","0.0014","10.484","0.003","16.896","0.004","90","","90.762","0.004","90","","1058.7","0.5","290","2","290","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(5S)-5-(3-fluoro-4-phenoxyphenyl)-1,3-biphenyl-4,5-dihydro-1H-pyrazole","","- C27 H21 F N2 O -","- C27 H21 F N2 O -","- C54 H42 F2 N4 O2 -","2","1","GA3076","Chopra, Deepak; Mohan, T. P.; Vishalakshi, B; Guru Row, T. N.","Four substituted pyrazolines","Acta Crystallographica Section C","2007","63","12","o746","o750","10.1107/S0108270107052705","","","0.71073","MoKa","","0.0468","0.0382","","","0.0842","0.0874","","","","","","1.263","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016320","17.728","0.003","11.0132","0.0017","11.2709","0.0017","90","","95.729","0.003","90","","2189.6","0.6","290","2","290","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(5S)-3-(4-chlorophenyl)-5-(3-fluoro-4-phenoxyphenyl)-1-phenyl- 4,5-dihydro-1H-pyrazole","","- C27 H20 Cl F N2 O -","- C27 H20 Cl F N2 O -","- C108 H80 Cl4 F4 N8 O4 -","4","1","GA3076","Chopra, Deepak; Mohan, T. P.; Vishalakshi, B; Guru Row, T. N.","Four substituted pyrazolines","Acta Crystallographica Section C","2007","63","12","o746","o750","10.1107/S0108270107052705","","","0.71073","MoKa","","0.1486","0.0708","","","0.112","0.1347","","","","","","1.055","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016321","17.742","0.006","11.099","0.004","11.187","0.004","90","","95.293","0.006","90","","2193.5","1.3","290","2","290","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(5R)-5-(3-fluoro-4-phenoxyphenyl)-3-(4-methylphenyl)-1-phenyl- 4,5-dihydro-1H-pyrazole","","- C28 H23 F N2 O -","- C28 H23 F N2 O -","- C112 H92 F4 N8 O4 -","4","1","GA3076","Chopra, Deepak; Mohan, T. P.; Vishalakshi, B; Guru Row, T. N.","Four substituted pyrazolines","Acta Crystallographica Section C","2007","63","12","o746","o750","10.1107/S0108270107052705","","","0.71073","MoKα","","0.0895","0.0502","","","0.1013","0.1155","","","","","","1.055","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016322","20.274","0.004","5.7588","0.0012","21.241","0.004","90","","116.438","0.004","90","","2220.6","0.8","290","2","290","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(5S)-5-(3-fluoro-4-phenoxyphenyl)-3-(4-methoxyphenyl)-1-phenyl- 4,5-dihydro-1H-pyrazole","","- C28 H23 F N2 O2 -","- C28 H23 F N2 O2 -","- C112 H92 F4 N8 O8 -","4","1","GA3076","Chopra, Deepak; Mohan, T. P.; Vishalakshi, B; Guru Row, T. N.","Four substituted pyrazolines","Acta Crystallographica Section C","2007","63","12","o746","o750","10.1107/S0108270107052705","","","0.71073","MoKα","","0.098","0.076","","","0.1123","0.1348","","","","","","1.175","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016323","10.5303","0.0019","8.0531","0.0013","16.977","0.003","90","","95.435","0.007","90","","1433.2","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","dichloridobis(2-methoxypyridine-κN)copper(II)","","- C12 H14 Cl2 Cu N2 O2 -","- C12 H14 Cl2 Cu N2 O2 -","- C48 H56 Cl8 Cu4 N8 O8 -","4","1","GD3150","Lennartson, Anders; Wiklund, Tove; Håkansson, Mikael","In search of conformationally chiral square-planar complexes: dichloridobis(2-methoxypyridine-κ<i>N</i>)copper(II)","Acta Crystallographica Section C","2007","63","12","m550","m552","10.1107/S0108270107048706","","","0.71073","MoKα","","0.026","0.0228","","","0.0592","0.06","","","","","","1.06","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016324","15.0911","0.0014","8.889","0.0008","16.0727","0.0015","90","","116.536","0.002","90","","1928.9","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[μ~2~-(N-hydroxypyridine-2-carboxamidine)-μ~2~-nitrato-silver(I)]","","- C6 H7 Ag N4 O4 -","- C6 H7 Ag N4 O4 -","- C48 H56 Ag8 N32 O32 -","8","1","GD3152","Ai-Li Cui; Han, Peng; Yang, Hui-Juan; Wang, Ru-Ji; Kou, Hui-Zhong","Poly[μ~2~-(<i>N</i>-hydroxypyridine-2-carboxamidine)-μ~2~-nitrato-silver(I)]","Acta Crystallographica Section C","2007","63","12","m560","m562","10.1107/S0108270107051293","","","0.71073","MoKα","","0.0386","0.0319","","","0.0625","0.0646","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2016325","14.886","0.003","23.19","0.004","7.0638","0.0014","90","","90","","90","","2438.5","0.8","294","2","294","2","","","","","","","","6","P n a 21","P 2c -2n","33","","(E)-N'-[5-Chloro-3-methoxy-2-(4- methylphenylsulfonyloxy)benzylidene]isonicotinohydrazide acetic acid solvate","","- C23 H22 Cl N3 O7 S -","- C23 H22 Cl N3 O7 S -","- C92 H88 Cl4 N12 O28 S4 -","4","1","GD3153","Diao, Chun-Hua; Fan, Zhi; Chen, Xin","(<i>E</i>)-<i>N</i>'-[5-Chloro-3-methoxy-2-(4-methylphenylsulfonyloxy)benzylidene]isonicotinohydrazide acetic acid solvate: hydrogen-bonded network of alternating <i>R</i>^4^~4~(42), <i>R</i>^5^~5~(33) and <i>R</i>^6^~6~(40) rings","Acta Crystallographica Section C","2007","63","12","o717","o719","10.1107/S010827010705281X","","","0.71073","MoKα","","0.1085","0.0476","","","0.0774","0.0924","","","","","","0.974","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016326","9.6438","0.001","9.6656","0.0011","10.3316","0.0011","85.068","0.009","63.887","0.01","77.155","0.009","843.02","0.18","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","trans-(±)-Diethyl N,N'-(1,2-cyclohexane-1,2-diyl)bis(2-thiooxamate)","","- C14 H22 N2 O4 S2 -","- C14 H22 N2 O4 S2 -","- C28 H44 N4 O8 S4 -","2","1","GD3156","Piotrkowska, Barbara; Połoński, Tadeusz; Gdaniec, Maria","Supramolecular structures of bis-thionooxalamic acid esters derived from (±)-cyclohexane-1,2-diamine and (±)-1,2-diphenylethylenediamine","Acta Crystallographica Section C","2007","63","12","o693","o696","10.1107/S0108270107049797","","","0.71073","MoKα","","0.0319","0.0272","","","0.0696","0.0717","","","","","","1.074","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016327","9.2414","0.0004","21.7781","0.001","11.4322","0.0006","90","","100.273","0.004","90","","2263.96","0.19","110","0.2","110","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(±)-<i>N,N'</i>-diethyl (1,2-diphenylethane-1,2-diyl)bis(2-thiooxamate)","","- C22 H24 N2 O4 S2 -","- C22 H24 N2 O4 S2 -","- C88 H96 N8 O16 S8 -","4","1","GD3156","Piotrkowska, Barbara; Połoński, Tadeusz; Gdaniec, Maria","Supramolecular structures of bis-thionooxalamic acid esters derived from (±)-cyclohexane-1,2-diamine and (±)-1,2-diphenylethylenediamine","Acta Crystallographica Section C","2007","63","12","o693","o696","10.1107/S0108270107049797","","","0.71073","MoKα","","0.0439","0.0319","","","0.0799","0.0835","","","","","","1.084","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016328","15.9395","0.0007","6.2397","0.0002","10.6094","0.0006","90","","101.383","0.003","90","","1034.43","0.08","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[aquacopper(II)]-μ-hydroxido-μ-naphthalene-1-carboxylato- κ^2^O:O']","","- C11 H10 Cu O4 -","- C11 H10 Cu O4 -","- C44 H40 Cu4 O16 -","4","1","GD3161","Chun-Sen Liu; Ze Chang; Jun-Jie Wang","<i>catena</i>-Poly[[aquacopper(II)]-μ-hydroxido-μ-naphthalene-1-carboxylato-κ^2^<i>O</i>:<i>O</i>']: effect of a bulky aromatic skeleton in self-assembly","Acta Crystallographica Section C","2007","63","12","m589","m591","10.1107/S0108270107054650","","","0.71073","MoKα","","0.0494","0.0358","","","0.0779","0.0844","","","","","","1.034","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016329","7.0284","0.0002","7.3655","0.0002","11.4912","0.0004","86.829","0.002","78.746","0.003","65.357","0.003","530.07","0.03","296","2","296","2","","","","","","","","5","P -1","-P 1","2","tetraaqua-trans-bis(6-methylnicotinato-O)cobalt(II) tetrahydrate","tetraaqua-trans-bis(6-methylpyridine-3-carboxylato-κO)cobalt(II) tetrahydrate","","- C14 H28 Co N2 O12 -","- C14 H28 Co N2 O12 -","- C14 H28 Co N2 O12 -","1","0.5","GD3165","Kukovec, Boris-Marko; Popović, Zora; Pavlović, Gordana","A new coordination mode of 6-methylnicotinic acid in <i>trans</i>-tetraaquabis(6-methylpyridine-3-carboxylato-κ<i>O</i>)cobalt(II) tetrahydrate","Acta Crystallographica Section C","2007","63","12","m615","m617","10.1107/S0108270107056570","","","0.71073","MoKα","","0.0372","0.0339","","","0.086","0.0892","","","","","","1.117","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016330","13.212","0.003","6.0975","0.0013","29.028","0.006","90","","101.764","0.003","90","","2289.4","0.9","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6,9,16,19-tetraphenyl-5,15-distyryl-3,13,25,26-tetraoxa-2,12- diborapentacyclo[16.2.2.2^8,11^.1^2,5^.1^12,15^]hexacosa-1(20),7,10,17-tetraene","","- C60 H54 B2 O4 -","- C60 H54 B2 O4 -","- C120 H108 B4 O8 -","2","0.5","GG3111","De, Subhasis; Day, Cynthia S.; Welker, Mark E.","An unusual oligomerization/oxidation reaction of a 3-boron-substituted 1-phenylbuta-1,3-diene produces 6,9,16,19-tetraphenyl-5,15-distyryl-3,13,25,26-tetraoxa-2,12-diborapentacyclo[16.2.2.2^8,11^.1^2,5^.1^12,15^]hexacosa-1(20),7,10,17-tetraene","Acta Crystallographica Section C","2007","63","12","o729","o730","10.1107/S0108270107050986","","","0.71073","MoKα","","0.0946","0.0478","","","0.0949","0.1074","","","","","","0.85","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016331","13.5307","0.0012","9.8246","0.0009","16.0701","0.0014","90","","111.013","0.002","90","","1994.2","0.3","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-Bis[2-(Dimethylaminomethyl)phenyl]triselenide","","- C18 H24 N2 Se3 -","- C18 H24 N2 Se3 -","- C72 H96 N8 Se12 -","4","1","GG3121","Kulcsar, Monika; Silvestru, Anca; Cziple, Florentina","1,3-Bis[2-(dimethylaminomethyl)phenyl]triselenide","Acta Crystallographica Section C","2007","63","12","o701","o703","10.1107/S0108270107051591","","","0.71073","MoKα","","0.0519","0.0408","","","0.0803","0.0838","","","","","","1.141","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016332","26.262","0.003","7.1677","0.0007","10.3351","0.0008","90","","108.687","0.003","90","","1842.9","0.3","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Lithium acetysalicylate hemihydrate","catena-Poly[[lithium(I)-μ~3~-acetylsalicylato] hemihydrate]","","- C9 H8 Li O4.5 -","- C9 H8 Li O4.5 -","- C72 H64 Li8 O36 -","8","1","GZ3111","Jean-Baptiste Arlin; Fiona Addison; Alan R. Kennedy","Lithium aspirinate hemihydrate","Acta Crystallographica Section C","2007","63","12","m563","m565","10.1107/S0108270107051104","","","0.71073","MoKα","","0.0752","0.0404","","","0.0836","0.0947","","","","","","1.02","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2016333","9.7644","0.0007","14.8595","0.0015","16.9586","0.0012","90","","90","","90","","2460.6","0.4","180","2","180","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Dichlorido[(<i>S</i>,<i>R</i>~S~)-1-diphenylphosphino-2- (ethylsulfanylmethyl)ferrocene]palladium(II)","","- C25 H25 Cl2 Fe P Pd S -","- C25 H25 Cl2 Fe P Pd S -","- C100 H100 Cl8 Fe4 P4 Pd4 S4 -","4","1","HJ3055","Diab, Lisa; Daran, Jean-Claude; Gouygou, Maryse; Manoury, Eric; Urrutigoïty, Martine","Dichlorido[(<i>S</i>,<i>R</i>~S~)-1-diphenylphosphino-2-(ethylsulfanylmethyl)ferrocene]palladium(II)","Acta Crystallographica Section C","2007","63","12","m586","m588","10.1107/S0108270107052742","","","0.71073","MoKα","","0.0253","0.0236","","","0.0581","0.0587","","","","","","1.035","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016334","7.4136","0.0001","23.4782","0.0003","10.3932","0.0002","90","","110.369","0.0006","90","","1695.9","0.05","90","0.2","90","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-3-(Benzo[<i>b</i>]thiophen-2-yl)-2-(3,4,5- trimethoxyphenyl)acrylonitrile","","- C20 H17 N O3 S -","- C20 H17 N O3 S -","- C80 H68 N4 O12 S4 -","4","1","HJ3056","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","(<i>E</i>)-3-(Benzo[<i>b</i>]thiophen-2-yl)-2-(3,4,5-trimethoxyphenyl)acrylonitrile and (<i>Z</i>)-3-(benzo[<i>b</i>]thiophen-2-yl)-2-(3,4-dimethoxyphenyl)acrylonitrile","Acta Crystallographica Section C","2007","63","12","o743","o745","10.1107/S0108270107054959","","","0.71073","MoKα","","0.0722","0.0449","","","0.1135","0.1273","","","","","","1.067","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016335","9.2958","0.0002","6.083","0.0001","27.2763","0.0007","90","","92.1871","0.001","90","","1541.25","0.06","90","0.2","90","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(<i>Z</i>)-3-(benzo[<i>b</i>]thiophen-2-yl)-2-(3,4- dimethoxyphenyl)acrylonitrile","","- C19 H15 N O2 S -","- C19 H15 N O2 S -","- C76 H60 N4 O8 S4 -","4","1","HJ3056","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","(<i>E</i>)-3-(Benzo[<i>b</i>]thiophen-2-yl)-2-(3,4,5-trimethoxyphenyl)acrylonitrile and (<i>Z</i>)-3-(benzo[<i>b</i>]thiophen-2-yl)-2-(3,4-dimethoxyphenyl)acrylonitrile","Acta Crystallographica Section C","2007","63","12","o743","o745","10.1107/S0108270107054959","","","0.71073","MoKα","","0.0895","0.0471","","","0.1106","0.1272","","","","","","1","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016336","6.7083","0.0012","7.865","0.0014","28.811","0.005","90","","90","","90","","1520.1","0.5","133","2","133","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","benzene-1,2,3-tricarbonitrile","","- C9 H3 N3 -","- C9 H3 N3 -","- C72 H24 N24 -","8","2","HJ3057","Jones, Peter G.; Hopf, Henning; Mlynek, Cornelia; Swaminathan, Vijay Narayanan","Weak C—H···N[tripleC hydrogen bonds in the structures of two poly(cyano)-substituted ring systems","Acta Crystallographica Section C","2007","63","12","o723","o725","10.1107/S0108270107052535","","","0.71073","MoKα","","0.0693","0.0539","","","0.1099","0.1151","","","","","","1.074","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016337","7.0277","0.0006","15.1197","0.0014","14.3219","0.0014","90","","103.603","0.004","90","","1479.1","0.2","133","2","133","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","[2.2]paracyclophane-4,5,12,13-tetracarbonitrile","","- C20 H12 N4 -","- C20 H12 N4 -","- C80 H48 N16 -","4","1","HJ3057","Jones, Peter G.; Hopf, Henning; Mlynek, Cornelia; Swaminathan, Vijay Narayanan","Weak C—H···N[tripleC hydrogen bonds in the structures of two poly(cyano)-substituted ring systems","Acta Crystallographica Section C","2007","63","12","o723","o725","10.1107/S0108270107052535","","","0.71073","MoKα","","0.0608","0.043","","","0.1199","0.1298","","","","","","1.057","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016338","14.4217","0.0015","9.5445","0.0013","15.6198","0.0019","90","","115.647","0.002","90","","1938.2","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","di-μ-chlorido-bis{[N,N'-bis(4-chlorobenzyl)propane-1,2- diamine]chloridocopper(II)}","","- C34 H40 Cl8 Cu2 N4 -","- C34 H40 Cl8 Cu2 N4 -","- C68 H80 Cl16 Cu4 N8 -","2","0.5","HJ3060","Yang, Shu-Ping; Han, Li-Jun; Xia, Hai-Tao; Wang, Da-Qi; Liu, Yu-Fen","The dinuclear copper(II) complexes di-μ-chlorido-bis{[<i>N</i>,<i>N</i>'-bis(4-chlorobenzyl)propane-1,2-diamine]chloridocopper(II)} and di-μ-chlorido-bis{[<i>N</i>,<i>N</i>'-bis(3,4-methylenedioxybenzyl)propane-1,2-diamine]chloridocopper(II)}","Acta Crystallographica Section C","2007","63","12","m610","m614","10.1107/S0108270107058519","","","0.71073","MoKα","","0.0551","0.0312","","","0.0684","0.082","","","","","","1.059","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016339","12.2965","0.0013","11.0554","0.0012","15.822","0.002","90","","98.14","0.002","90","","2129.2","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","di-μ-chlorido-bis{[N,N'-bis(3,4-methylenedioxybenzyl)propane-1,2- diamine]chloridocopper(II)}","","- C19 H22 Cl2 Cu N2 O4 -","- C19 H22 Cl2 Cu N2 O4 -","- C76 H88 Cl8 Cu4 N8 O16 -","4","1","HJ3060","Yang, Shu-Ping; Han, Li-Jun; Xia, Hai-Tao; Wang, Da-Qi; Liu, Yu-Fen","The dinuclear copper(II) complexes di-μ-chlorido-bis{[<i>N</i>,<i>N</i>'-bis(4-chlorobenzyl)propane-1,2-diamine]chloridocopper(II)} and di-μ-chlorido-bis{[<i>N</i>,<i>N</i>'-bis(3,4-methylenedioxybenzyl)propane-1,2-diamine]chloridocopper(II)}","Acta Crystallographica Section C","2007","63","12","m610","m614","10.1107/S0108270107058519","","","0.71073","MoKα","","0.1491","0.0632","","","0.1478","0.2165","","","","","","1.136","","","","has coordinates,has Fobs","197043","2020-10-21","18:00:00",""
"2016340","16.087","0.003","5.2965","0.001","23.022","0.004","90","","90","","90","","1961.6","0.6","293","2","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","Bi5 O7 Br","pentabismuth heptoxide bromide","","- Bi5 Br O7 -","- Bi5 Br O7 -","- Bi40 Br8 O56 -","8","","IZ3029","Keller, E.; Krämer, V.","Bi~5~O~7~Br and its structural relation to α-Bi~5~O~7~I","Acta Crystallographica Section C","2007","63","12","i109","i111","10.1107/S0108270107049025","","","0.71073","MoKα","","0.0884","0.0484","","","0.0858","0.0944","","","","","","1.075","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016341","9.5416","0.0004","11.3992","0.0005","10.7465","0.0004","120.472","0.002","92.47","0.002","55.531","0.002","780.08","0.07","293","2","293","2","","","","","","","Chapacase mine, Sierra Cerillos district, Tocopilla, Chile","6","P -1","-P 1","2","Iranite","copper decalead hexachromate bis(orthosilicate) dihydroxide","Iranite","- Cr6 Cu H2 O34 Pb10 Si2 -","- Cr6 Cu O34 Pb10 Si2 -","- Cr6 Cu O34 Pb10 Si2 -","1","0.5","IZ3032","Yang, Hexiong; Sano, Jennifer L.; Eichler, Carla; Downs, Robert T.; Costin, Gelu","Iranite, CuPb~10~(CrO~4~)~6~(SiO~4~)~2~(OH)~2~, isomorphous with hemihedrite","Acta Crystallographica Section C","2007","63","12","i122","i124","10.1107/S0108270107053449","","","0.71073","MoKα","","0.0496","0.0341","","","0.0621","0.0698","","","","","","1.013","","","","has coordinates,has Fobs","282548","2023-04-10","20:38:56",""
"2016342","12.265","0.001","13.197","0.001","9.7385","0.0009","90","","108.63","0.01","90","","1493.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","Ferrous iron hydroxide phosphate","diiron(II) phosphate hydroxide","","- Fe2 H O5 P -","- Fe2 H O5 P -","- Fe32 H16 O80 P16 -","16","4","IZ3034","Hatert, Frédéric","Fe^II^~2~(PO~4~)(OH), a synthetic analogue of wolfeite","Acta Crystallographica Section C","2007","63","12","i119","i121","10.1107/S0108270107053462","","","0.71073","MoKα","","0.081","0.03","","","0.0573","0.0652","","","","","","0.856","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016343","9.0914","0.0009","12.6225","0.0009","18.5025","0.0017","90","","94.576","0.008","90","","2116.5","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2'-(4-Chlorophenyl)-2,3,4,5,6,7-hexahydro-4',7'-methanospiro[9H-fluorene- 9,3'-1H-indazole]-1'-carbonitrile","","- C27 H22 Cl N3 -","- C27 H22 Cl N3 -","- C108 H88 Cl4 N12 -","4","1","LN3061","Bilewicz, Elżbieta; Małecka, Magdalena; Grabowski, Sławomir J.; Mlostoń, Grzegorz","2'-(4-Chlorophenyl)-2,3,4,5,6,7-hexahydro-4',7'-methanospiro[9<i>H</i>-fluorene-9,3'-1<i>H</i>-indazole]-1'-carbonitrile and methyl 4'-chloro-2'-(4-chlorophenyl)-1'-cyanospiro[9<i>H</i>-fluorene-9,3'-pyrazolidine]-4'-carboxylate","Acta Crystallographica Section C","2007","63","12","o739","o742","10.1107/S0108270107053619","","","0.71073","MoKα","","0.0617","0.036","","","0.0755","0.0814","","","","","","0.852","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016344","11.1818","0.0005","13.2534","0.0004","28.1265","0.0011","90","","96.363","0.003","90","","4142.6","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","methyl 4'-chloro-2'-(4-chlorophenyl)-1'-cyanospiro[9H-fluorene-9,3'-pyrazolidine]- 4'-carboxylate","","- C24 H17 Cl2 N3 O2 -","- C24 H17 Cl2 N3 O2 -","- C192 H136 Cl16 N24 O16 -","8","2","LN3061","Bilewicz, Elżbieta; Małecka, Magdalena; Grabowski, Sławomir J.; Mlostoń, Grzegorz","2'-(4-Chlorophenyl)-2,3,4,5,6,7-hexahydro-4',7'-methanospiro[9<i>H</i>-fluorene-9,3'-1<i>H</i>-indazole]-1'-carbonitrile and methyl 4'-chloro-2'-(4-chlorophenyl)-1'-cyanospiro[9<i>H</i>-fluorene-9,3'-pyrazolidine]-4'-carboxylate","Acta Crystallographica Section C","2007","63","12","o739","o742","10.1107/S0108270107053619","","","0.71073","MoKα","","0.0662","0.0356","","","0.0728","0.0791","","","","","","1.024","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016345","6.6594","0.0001","9.5373","0.0002","13.6949","0.0003","73.832","0.002","86.714","0.002","75.399","0.002","808.34","0.03","183","","183","","","","","","","","","5","P -1","-P 1","2","","(Nitrato-κO)bis(pyridine-2-carboxamide-κ^2^<i>N</i>,<i>O</i>)mercury(II) nitrate","","- C12 H12 Hg N6 O8 -","- C12 H12 Hg N6 O8 -","- C24 H24 Hg2 N12 O16 -","2","1","LN3068","Đaković, Marijana; Popović, Zora","(Nitrato-κ<i>O</i>)bis(pyridine-2-carboxamide-κ^2^<i>N</i>^1^,<i>O</i>)mercury(II) nitrate","Acta Crystallographica Section C","2007","63","12","m557","m559","10.1107/S0108270107051566","","","0.71073","MoKα","","0.0192","0.0155","","","0.034","0.0348","","","","","","1.024","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016346","7.6402","0.0015","11.775","0.002","26.927","0.005","90","","90","","90","","2422.4","0.8","153","2","153","2","","","","","","","","2","P b c a","-P 2ac 2ab","61","","[2.2.2](1,2,4)cyclophan-9-ene","","- C18 H16 -","- C18 H16 -","- C144 H128 -","8","1","LN3070","Broschinski, Klaus; Kannan, Arunachalam; Jones, Peter G.; Dix, Ina; Hopf, Henning","The `cyclophene' [2.2.2](1,2,4)cyclophan-9-ene","Acta Crystallographica Section C","2007","63","12","o711","o713","10.1107/S0108270107050937","","","0.71073","MoKα","","0.091","0.0543","","","0.1282","0.1501","","","","","","1.102","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016347","6.2627","0.0009","8.6572","0.0008","27.943","0.002","90","","92.578","0.01","90","","1513.5","0.3","295","1","295","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","9-[(<i>E</i>)-(4-nitrophenyl)vinyl]-9<i>H</i>-carbazole","","- C20 H14 N2 O2 -","- C20 H14 N2 O2 -","- C80 H56 N8 O8 -","4","1","SF3059","Kubicki, Maciej; Prukała, Wiesław; Marciniec, Bogdan","Two 9-[(<i>E</i>)-nitrophenylvinyl]-9<i>H</i>-carbazoles","Acta Crystallographica Section C","2007","63","12","o690","o692","10.1107/S0108270107049621","","","0.71073","MoKα","","0.092","0.0444","","","0.0989","0.1057","","","","","","1.012","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016348","8.1085","0.0016","7.5179","0.0011","24.122","0.004","90","","90.507","0.014","90","","1470.4","0.4","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-[(<i>E</i>)-(3-nitrophenyl)vinyl]-9<i>H</i>-carbazole","","- C20 H14 N2 O2 -","- C20 H14 N2 O2 -","- C80 H56 N8 O8 -","4","1","SF3059","Kubicki, Maciej; Prukała, Wiesław; Marciniec, Bogdan","Two 9-[(<i>E</i>)-nitrophenylvinyl]-9<i>H</i>-carbazoles","Acta Crystallographica Section C","2007","63","12","o690","o692","10.1107/S0108270107049621","","","0.71073","MoKα","","0.1227","0.0463","","","0.074","0.0922","","","","","","0.992","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016349","7.6382","0.0007","14.9272","0.0015","40.857","0.004","90","","90","","90","","4658.4","0.8","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Benzyl N,N-bis[2-(pentafluoroanilino)ethyl]carbamate","","- C24 H17 F10 N3 O2 -","- C24 H17 F10 N3 O2 -","- C192 H136 F80 N24 O16 -","8","1","SF3060","Churakov, Andrei V.; Karlov, Sergey S.; Lermontova, Elmira Kh.; Zaitseva, Galina S.; Howard, Judith A. K.","Benzyl <i>N</i>,<i>N</i>-bis[2-(pentafluoroanilino)ethyl]carbamate","Acta Crystallographica Section C","2007","63","12","o761","o762","10.1107/S0108270107057939","","","0.71073","MoKα","","0.0722","0.0481","","","0.0947","0.1021","","","","","","1.042","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016350","5.9278","0.0005","22.256","0.002","7.2456","0.0006","90","","113.393","0.002","90","","877.33","0.13","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis(quinoxaline-2-carboxylato-κ^2^N^1^,O)copper(II)","","- C18 H14 Cu N4 O6 -","- C18 H14 Cu N4 O6 -","- C36 H28 Cu2 N8 O12 -","2","0.5","SF3062","Yue Feng; Gang Liu; Xiu-Mei Tian; Ji-De Wang","Diaquabis(quinoxaline-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)copper(II)","Acta Crystallographica Section C","2007","63","12","m598","m600","10.1107/S0108270107053723","","","0.71073","MoKα","","0.0302","0.0288","","","0.0849","0.0862","","","","","","1.082","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016351","7.582","0.002","17.482","0.005","18.731","0.005","90","","100.368","0.004","90","","2442.2","1.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[2-(2-Pyridyl)benzimidazole-κ^2^<i>N</i>^2^,<i>N</i>^3^]bis(p-toluato- κ^2^<i>O</i>,<i>O'</i>)manganese(II)","","- C28 H23 Mn N3 O4 -","- C28 H23 Mn N3 O4 -","- C112 H92 Mn4 N12 O16 -","4","1","SK3169","Ma, Cheng-Bing; Chen, Chang-Neng; Liu, Qiu-Tian","[2-(2-Pyridyl)-1<i>H</i>-benzimidazole-κ^2^<i>N</i>^2^,<i>N</i>^3^]bis(<i>p</i>-toluato-κ^2^<i>O</i>,<i>O</i>')manganese(II)","Acta Crystallographica Section C","2007","63","12","m618","m621","10.1107/S0108270107055023","","","0.71073","MoKα","","","0.0361","","","0.0975","0.1045","","","","","","1","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016352","10.686","0.0012","7.1647","0.0014","14.4911","0.0012","90","","110.024","0.009","90","","1042.4","0.3","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-amino-6-(methylanilino)pyrimidin-4(3H)-one","","- C11 H12 N4 O -","- C11 H12 N4 O -","- C44 H48 N16 O4 -","4","1","SK3172","Rodríguez, Ricaurte; Cobo, Justo; Nogueras, Manuel; Low, John N.; Glidewell, Christopher","A three-dimensional hydrogen-bonded framework in 2-amino-6-(<i>N</i>-methylanilino)pyrimidin-4(3<i>H</i>)-one and a ribbon of fused hydrogen-bonded rings in 2-amino-6-(<i>N</i>-methylanilino)-5-nitropyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section C","2007","63","12","o697","o700","10.1107/S0108270107049931","","","0.71073","MoKα","","0.0952","0.05","","","0.1129","0.1368","","","","","","1.072","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016353","8.955","0.003","11.2165","0.0015","11.567","0.0015","90","","90","","90","","1161.8","0.4","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-amino-6-(methylanilino)-5-nitropyrimidin-4(3H)-one","","- C11 H11 N5 O3 -","- C11 H11 N5 O3 -","- C44 H44 N20 O12 -","4","1","SK3172","Rodríguez, Ricaurte; Cobo, Justo; Nogueras, Manuel; Low, John N.; Glidewell, Christopher","A three-dimensional hydrogen-bonded framework in 2-amino-6-(<i>N</i>-methylanilino)pyrimidin-4(3<i>H</i>)-one and a ribbon of fused hydrogen-bonded rings in 2-amino-6-(<i>N</i>-methylanilino)-5-nitropyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section C","2007","63","12","o697","o700","10.1107/S0108270107049931","","","0.71073","MoKα","","0.1299","0.0544","","","0.1123","0.1378","","","","","","1.048","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016354","8.1157","0.0016","7.8434","0.0016","16.723","0.003","90","","96.9","0.03","90","","1056.8","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","5-aminonaphthalene-1-sulfonic acid monohydrate","5-Ammonionaphthalene-1-sulfonate monohydrate","","- C10 H11 N O4 S -","- C10 H11 N O4 S -","- C40 H44 N4 O16 S4 -","4","1","SK3173","Genther, Dane J.; Squattrito, Philip J.; Kirschbaum, Kristin; Yearley, Eric J.; Pinkerton, A. Alan","5-Aminonaphthalene-1-sulfonic acid and its manganese, nickel and cobalt salts","Acta Crystallographica Section C","2007","63","12","m604","m609","10.1107/S0108270107052286","","","0.71073","MoKα","","0.058","0.0421","","","0.1119","0.1196","","","","","","1.043","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016355","8.3263","0.0003","22.8436","0.0007","7.494","0.0002","90","","90","","90","","1425.38","0.08","140","2","140","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","hexaaquamanganese(II) 5-aminonaphthalene-1-sulfonate trihydrate","hexaaquamanagnese(II) bis(5-aminonaphthalene-1-sulfonate) trihydrate","","- C20 H34 Mn N2 O15 S2 -","- C20 H34 Mn N2 O15 S2 -","- C40 H68 Mn2 N4 O30 S4 -","2","0.5","SK3173","Genther, Dane J.; Squattrito, Philip J.; Kirschbaum, Kristin; Yearley, Eric J.; Pinkerton, A. Alan","5-Aminonaphthalene-1-sulfonic acid and its manganese, nickel and cobalt salts","Acta Crystallographica Section C","2007","63","12","m604","m609","10.1107/S0108270107052286","","","0.71073","MoKα","","0.0284","0.0275","","","0.0736","0.074","","","","","","1.087","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016356","8.1031","0.0006","22.9375","0.0018","7.4607","0.0006","90","","90","","90","","1386.68","0.19","140","2","140","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","hexaaquanickel(II) 5-aminonaphthalene-1-sulfonate trihydrate","hexaaquanickel(II) bis(5-aminonaphthalene-1-sulfonate) trihydrate","","- C20 H34 N2 Ni O15 S2 -","- C20 H34 N2 Ni O15 S2 -","- C40 H68 N4 Ni2 O30 S4 -","2","0.5","SK3173","Genther, Dane J.; Squattrito, Philip J.; Kirschbaum, Kristin; Yearley, Eric J.; Pinkerton, A. Alan","5-Aminonaphthalene-1-sulfonic acid and its manganese, nickel and cobalt salts","Acta Crystallographica Section C","2007","63","12","m604","m609","10.1107/S0108270107052286","","","0.71073","MoKα","","0.0267","0.0252","","","0.0585","0.0589","","","","","","1.097","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016357","7.013","0.002","8.71","0.003","22.385","0.007","89.394","0.008","83.909","0.008","88.271","0.008","1359","0.7","150","2","150","2","","","","","","","","6","P -1","-P 1","2","hexaaquacobalt(II) 5-aminonaphthalene-1-sulfonate dihydrate","hexaaquacobalt(II) bis(5-aminonaphthalene-1-sulfonate) dihydrate","","- C20 H32 Co N2 O14 S2 -","- C20 H30 Co N2 O14 S2 -","- C40 H60 Co2 N4 O28 S4 -","2","1","SK3173","Genther, Dane J.; Squattrito, Philip J.; Kirschbaum, Kristin; Yearley, Eric J.; Pinkerton, A. Alan","5-Aminonaphthalene-1-sulfonic acid and its manganese, nickel and cobalt salts","Acta Crystallographica Section C","2007","63","12","m604","m609","10.1107/S0108270107052286","","","0.71073","MoKα","","0.0661","0.0584","","","0.1461","0.1567","","","","","","1.123","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016358","7.845","0.005","16.965","0.01","26.915","0.015","90","","97.896","0.009","90","","3548","4","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[N,N'-(2-chlorobenzylidene)ethylenediamine-κ^2^N,N']copper(I) dichloridocuprate(I) acetonitrile solvate","","- C34 H31 Cl6 Cu2 N5 -","- C34 H31 Cl6 Cu2 N5 -","- C136 H124 Cl24 Cu8 N20 -","4","1","SK3174","Habibi, Mohammad Hossein; Montazerozohori, Morteza; Barati, Kazem; Harrington, Ross W.; Clegg, William","Bis[<i>N</i>,<i>N</i>'-(2-chlorobenzylidene)ethylenediamine-κ^2^<i>N</i>,<i>N</i>']copper(I) dichloridocuprate(I) acetonitrile solvate","Acta Crystallographica Section C","2007","63","12","m592","m594","10.1107/S0108270107054960","","","0.8462","synchrotron","","0.113","0.0559","","","0.1106","0.127","","","","","","0.788","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016359","10.1975","0.0014","10.959","0.002","11.046","0.002","94.079","0.016","109.845","0.011","113.339","0.01","1035.5","0.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","(<i>E</i>)-3-{2-Amino-4-ethoxy-6-[<i>N</i>-(4-methoxyphenyl)-N- methylamino]pyrimidin-5-yl}-1-phenylprop-2-en-1-one","","- C23 H24 N4 O3 -","- C23 H24 N4 O3 -","- C46 H48 N8 O6 -","2","1","SK3178","Trilleras, Jorge; Quiroga, Jairo; Low, John N.; Cobo, Justo; Glidewell, Christopher","(<i>E</i>)-3-{2-Amino-4-ethoxy-6-[<i>N</i>-(4-methoxyphenyl)-<i>N</i>-methylamino]pyrimidin-5-yl}-1-phenylprop-2-en-1-one: a boat-shaped pyrimidine ring and a chain of hydrogen-bonded <i>R</i>^4^~2~(8) and <i>R</i>^2^~2~(20) rings","Acta Crystallographica Section C","2007","63","12","o758","o760","10.1107/S0108270107056569","","","0.71073","MoKα","","0.0836","0.047","","","0.0968","0.113","","","","","","1.047","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016360","6.8534","0.0001","29.6631","0.0007","22.2107","0.0005","90","","94.408","0.001","90","","4501.93","0.16","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Butobarbital","5-butyl-5-ethyl-1,3-diazinane-2,4,6-trione","","- C10 H16 N2 O3 -","- C10 H16 N2 O3 -","- C160 H256 N32 O48 -","16","4","SK3179","Gelbrich, Thomas; Zencirci, Neslihan; Griesser, Ulrich J.","A polymorph of butobarbital with two distinct hydrogen-bonding motifs","Acta Crystallographica Section C","2007","63","12","o751","o753","10.1107/S0108270107057174","","","0.71073","MoKα","","0.1231","0.0772","","","0.1237","0.1379","","","","","","1.069","","","","has coordinates,has Fobs","201957","2020-10-21","18:00:00",""
"2016361","10.392","0.002","10.224","0.002","8.7073","0.0017","90","","109.43","0.03","90","","872.4","0.3","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","poly[triaquabis(dimethylformamide)di-μ~3~-oxalato-μ~2~-oxalato-\ dilanthanum(III)]","","- C9 H13 La2 N O16 -","- C9 H13 La2 N O16 -","- C18 H26 La4 N2 O32 -","2","0.5","SQ3099","Wang, Jingen; Huang, Xihe; Huang, Changcang; Song, Haiyan; Yang, Duoping","A new three-dimensional neutral framework of lanthanum oxalate: [La~2~(C~2~O~4~)~3~(DMF)(H~2~O)~3~]~<i>n~</i>","Acta Crystallographica Section C","2007","63","12","m583","m585","10.1107/S0108270107053292","","","0.71073","MoKα","","0.0303","0.0261","","","0.056","0.0579","","","","","","1.059","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016362","5.7461","0.0002","5.7278","0.0002","4.0409","0.0003","90","","90.155","0.003","90","","132.996","0.012","4","","4","","","","","","","","","5","C 1 m 1","C -2y","8","PZN-8%PT","lead zinc niobium titanium trioxide","","- Nb0.61 O3 Pb Ti0.08 Zn0.31 -","- Nb0.61333 O3 Pb Ti0.08 Zn0.30666 -","- Nb1.22666 O6 Pb2 Ti0.16 Zn0.61332 -","2","0.5","SQ3101","Forrester, Jennifer S.; Kisi, Erich H.","Monoclinic PZN-8%PT [Pb(Zn~0.3066~Nb~0.6133~Ti~0.08~)O~3~] at 4K","Acta Crystallographica Section C","2007","63","12","i115","i118","10.1107/S0108270107050640","","neutron","","neutron","","","","","","","","","","1.28","","","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2016363","28.547","0.006","7.4223","0.0015","23.822","0.005","90","","122.34","0.03","90","","4265","2","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","{3-[4-(aminocarbonylmethyl)phenoxy]-2-hydroxypropyl)isopropylammonium 4-aminobenzoate monohydrate","","- C21 H31 N3 O6 -","- C21 H31 N3 O6 -","- C168 H248 N24 O48 -","8","1","SQ3104","Lou, Benyong; Boström, Dan; Velaga, Sitaram P.","Hydrogen-bonding interactions in the 4-aminobenzoic acid salt of atenolol monohydrate","Acta Crystallographica Section C","2007","63","12","o714","o716","10.1107/S0108270107051049","","","0.71073","MoKα","","0.0638","0.0482","","","0.1282","0.1379","","","","","","1.076","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2016364","7.4255","0.0004","10.1954","0.0009","11.1581","0.0009","77.129","0.003","86.933","0.005","72.384","0.005","784.8","0.11","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","tetrakis(μ-2,3-dihydro-1,3-benzothiazole-2-thiolato)-κ^4^N:S;κ^4^S:N- dipalladium(II)(Pd—Pd) dichloromethane solvate","","- C29 H18 Cl2 N4 Pd2 S8 -","- C28 H16 N4 Pd2 S8 -","- C28 H16 N4 Pd2 S8 -","1","0.5","TR3019","Vuoti, Sauli; Haukka, Matti; Pursiainen, Jouni","Two isomers of Pd~2~(S~2~NC~7~H~4~)~4~","Acta Crystallographica Section C","2007","63","12","m601","m603","10.1107/S0108270107052353","","","0.71073","MoKα","","0.0383","0.0313","","","0.0744","0.077","","","","","","1.067","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2016365","17.2484","0.0002","18.0383","0.0003","18.7816","0.0003","90","","90","","90","","5843.55","0.15","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","tetrakis(μ-2,3-dihydro-1,3-benzothiazole-2-thiolato)-κ^6^N:S;κ^2^S:N- dipalladium(II)(Pd—Pd) dichloromethane solvate","","- C29 H18 Cl2 N4 Pd2 S8 -","- C28 H16 N4 Pd2 S8 -","- C224 H128 N32 Pd16 S64 -","8","1","TR3019","Vuoti, Sauli; Haukka, Matti; Pursiainen, Jouni","Two isomers of Pd~2~(S~2~NC~7~H~4~)~4~","Acta Crystallographica Section C","2007","63","12","m601","m603","10.1107/S0108270107052353","","","0.71073","MoKα","","0.047","0.0363","","","0.0882","0.0952","","","","","","1.105","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2016366","13.132","0.0003","12.2045","0.0003","17.2959","0.0005","90","","91.622","0.0014","90","","2770.89","0.12","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis{μ-3-[2-(dimethylamino)ethylimino]butan-2-one oximato}dinickel(II) bis(perchlorate) acetonitrile solvate","","- C18 H35 Cl2 N7 Ni2 O10 -","- C18 H35 Cl2 N7 Ni2 O10 -","- C72 H140 Cl8 N28 Ni8 O40 -","4","1","TR3024","Bera, Manindranath; Noll, Bruce C.","Two new oximate-bridged square-planar dinuclear nickel(II) complexes","Acta Crystallographica Section C","2007","63","12","m553","m556","10.1107/S0108270107048937","","","0.71073","MoKα","","0.0437","0.0349","","","0.0894","0.0948","","","","","","1.056","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2016367","12.5432","0.0005","8.9714","0.0004","13.7277","0.0005","90","","93.745","0.002","90","","1541.48","0.11","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis{μ-3-[2-(dimethylamino)ethylimino]-1-phenylpropan-2-one oximato}dinickel(II) bis(perchlorate)","","- C26 H36 Cl2 N6 Ni2 O10 -","- C26 H36 Cl2 N6 Ni2 O10 -","- C52 H72 Cl4 N12 Ni4 O20 -","2","0.5","TR3024","Bera, Manindranath; Noll, Bruce C.","Two new oximate-bridged square-planar dinuclear nickel(II) complexes","Acta Crystallographica Section C","2007","63","12","m553","m556","10.1107/S0108270107048937","","","0.71073","MoKα","","0.0291","0.0229","","","0.0599","0.0628","","","","","","1.028","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2019341","3.8604","0.0002","22.22","0.001","7.6932","0.0003","90","","90","","90","","659.91","0.05","298","","298","","","","","","","","","5","I m m m","-I 2 2","71","","potassium strontium diniobium hexaoxide fluoride","","- F K Nb2 O6 Sr -","- F K Nb2 O6 Sr -","- F4 K4 Nb8 O24 Sr4 -","4","0.25","FA3094","Yoo, Chung-Yul; Hong, Kun-Pyo; Kim, Seung-Joo","A new layered perovskite, KSrNb2O6F, by powder neutron diffraction","Acta Crystallographica Section C Crystal Structure Communications","2007","63","8","i63","5","10.1107/S0108270107029563","","neutron","1.8371","neutron","","","","","","","","","","1.97","","","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2019361","41.4764","0.0004","41.4764","0.0004","36.2358","0.0005","90","","90","","120","","53984.7","1","100","0.1","100","0.1","","","","","","","","5","R 3 2 :H","R 3 2""","155","Gramicidine S","","","- C188 H282 F12 N36 O58 -","- C188 H282 F12 N36 O58 -","- C1692 H2538 F108 N324 O522 -","9","0.5","","Llamas-Saiz, Antonio L.; Grotenbreg, Gijsbert M.; Overhand, Mark; van Raaij, Mark J.","Double-stranded helical twisted β-sheet channels in crystals of gramicidin S grown in the presence of trifluoroacetic and hydrochloric acids","Acta Crystallographica Section D Biological Crystallography","2007","63","3","401","407","10.1107/S0907444906056435","","","1.5418","CuKα","","0.1525","0.1461","","","0.3849","0.395","","","","","","1.864","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"2102676","4.9347","0.001","9.4163","0.0019","11.321","0.002","90","","97.39","0.03","90","","521.68","0.18","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","ethyl propionate","","- C5 H10 O2 -","- C5 H10 O2 -","- C20 H40 O8 -","4","1","AV5069","Roman Gajda; Andrzej Katrusiak","<i>In-situ</i> high-pressure study of the ordered phase of ethyl propionate","Acta Crystallographica Section B","2007","63","1","111","117","10.1107/S010876810603477X","","","0.71073","MoKα","","0.1121","0.0994","","","0.2482","0.2704","","","","","","1.249","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102677","4.8917","0.001","9.3649","0.0019","11.318","0.002","90","","97.24","0.03","90","","514.35","0.18","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","ethyl propionate","","- C5 H10 O2 -","- C5 H10 O2 -","- C20 H40 O8 -","4","1","AV5069","Roman Gajda; Andrzej Katrusiak","<i>In-situ</i> high-pressure study of the ordered phase of ethyl propionate","Acta Crystallographica Section B","2007","63","1","111","117","10.1107/S010876810603477X","","","0.71073","MoKα","","0.0573","0.0544","","","0.1047","0.1073","","","","","","1.195","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102678","4.8455","0.001","9.3249","0.0019","11.251","0.002","90","","97.52","0.03","90","","503.99","0.17","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","ethyl propionate","","- C5 H10 O2 -","- C5 H10 O2 -","- C20 H40 O8 -","4","1","AV5069","Roman Gajda; Andrzej Katrusiak","<i>In-situ</i> high-pressure study of the ordered phase of ethyl propionate","Acta Crystallographica Section B","2007","63","1","111","117","10.1107/S010876810603477X","","","0.71073","MoKα","","0.0535","0.0476","","","0.1118","0.1193","","","","","","1.144","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102679","9.646","0.006","7.62","0.004","4.839","0.003","90","","90.14","0.05","90","","355.7","0.4","293","","293","1","","","","","","","datolite-hedenbergite scarn deposit, Tetyche, Sikhote-Alin mountains","5","P 1 21/a 1","-P 2yab","14","","","Datolite","- B Ca H O5 Si -","- B Ca H O5 Si -","- B4 Ca4 H4 O20 Si4 -","4","1","AV5071","Ivanov, Yury; Belokoneva, Elena","Multipole refinement and electron density analysis in natural borosilicate datolite using X-ray diffraction data","Acta Crystallographica Section B","2007","63","1","49","55","10.1107/S0108768106041681","","","0.71069","MoKα","","","0.0138","","","","0.0194","","","","","","1.04","","","","has coordinates","282548","2023-04-10","20:38:56",""
"2102680","10.0273","0.0007","13.3313","0.0009","16.8827","0.0012","90","","90","","90","","2256.8","0.3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C18 H36 Cl Li N2 O10 -","- C18 H36 Cl Li N2 O10 -","- C72 H144 Cl4 Li4 N8 O40 -","4","1","AV5077","Guzei, Ilia A.; Lara C. Spencer","Low-temperature enantiotropic <i>k</i>2 phase transition in the ionic 222-cryptand complex with LiClO~4~","Acta Crystallographica Section B","2007","63","1","93","100","10.1107/S0108768106044831","","","0.71073","Mo-Kα","","0.0273","0.0263","","","0.071","0.0723","","","","","","1.068","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2102681","10.0791","0.0005","13.3799","0.0006","17.0272","0.0008","90","","90","","90","","2296.24","0.19","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C18 H36 Cl Li N2 O10 -","- C18 H36 Cl Li N2 O10 -","- C72 H144 Cl4 Li4 N8 O40 -","4","1","AV5077","Guzei, Ilia A.; Lara C. Spencer","Low-temperature enantiotropic <i>k</i>2 phase transition in the ionic 222-cryptand complex with LiClO~4~","Acta Crystallographica Section B","2007","63","1","93","100","10.1107/S0108768106044831","","","0.71073","Mo-Kα","","0.0318","0.0306","","","0.0871","0.089","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2102682","15.829","0.002","12.381","0.002","12.391","0.002","90","0.1","74.3","0.1","83.1","0.1","2319.5","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","2,2-aziridinedicarboxamide","2,2-aziridinedicarboxamide","","- C4 H7 N3 O2 -","- C4 H7 N3 O2 -","- C64 H112 N48 O32 -","16","8","AV5079","Podsiadło, Marcin; Dziubek, Kamil F.; Katrusiak, Andrzej","Pitfalls of data mining: triclinic polymorph of 2,2-aziridinedicarboxamide revisited","Acta Crystallographica, Section B: Structural Science","2007","63","1","118","123","10.1107/S0108768106045344","","","0.71073","MoKα","","0.0945","0.0945","","","0.2178","0.2178","","","","","","1.211","","","","has coordinates","274691","2022-04-26","14:53:34",""
"2102683","10.2852","0.0003","10.2852","0.0003","22.2862","0.0013","90","","90","","90","","2357.55","0.17","118","2","118","","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","Trans-(di(N,N-diethyl-(2-phenyldiazenyl)thioformamide-κS,κN^2^))nickel","","- C22 H30 N6 Ni S2 -","- C22 H30 N6 Ni S2 -","- C88 H120 N24 Ni4 S8 -","4","0.5","BK5045","Nielsen, Kim T.; Harris, Pernille; Bechgaard, Klaus; Krebs, Frederik C.","Structural study of four complexes of the <i>M</i>-N~2~S~2~ type derived from diethylphenylazothioformamide and the metals palladium, platinum, copper and nickel","Acta Crystallographica Section B","2007","63","1","151","156","10.1107/S0108768106047306","","","0.71073","MoKα","","0.0373","0.0342","","","0.0771","0.0781","","","","","","1.158","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102684","10.2643","0.0004","10.2643","0.0004","22.3519","0.0013","90","","90","","90","","2354.9","0.19","118","","118","","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","Trans-(di(N,N-diethyl-(2-phenyldiazenyl)thioformamide-κS,κN^2^))copper","","- C22 H30 Cu N6 S2 -","- C22 H30 Cu N6 S2 -","- C88 H120 Cu4 N24 S8 -","4","0.5","BK5045","Nielsen, Kim T.; Harris, Pernille; Bechgaard, Klaus; Krebs, Frederik C.","Structural study of four complexes of the <i>M</i>-N~2~S~2~ type derived from diethylphenylazothioformamide and the metals palladium, platinum, copper and nickel","Acta Crystallographica Section B","2007","63","1","151","156","10.1107/S0108768106047306","","","0.71073","MoKα","","0.0242","0.0237","","","0.0699","0.0702","","","","","","1.097","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102685","16.036","0.0016","12.4564","0.0013","12.3311","0.0012","90","","100.952","0.002","90","","2418.3","0.4","118","","118","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Palladium diethylphenylazothioformaide","Trans-(di(N,N-diethyl-(2-phenyldiazenyl)thioformamide-κS,κN^2^))palladium","","- C22 H30 N6 Pd S2 -","- C22 H30 N6 Pd S2 -","- C88 H120 N24 Pd4 S8 -","4","0.5","BK5045","Nielsen, Kim T.; Harris, Pernille; Bechgaard, Klaus; Krebs, Frederik C.","Structural study of four complexes of the <i>M</i>-N~2~S~2~ type derived from diethylphenylazothioformamide and the metals palladium, platinum, copper and nickel","Acta Crystallographica Section B","2007","63","1","151","156","10.1107/S0108768106047306","","","0.71073","MoKα","","0.0604","0.0486","","","0.1008","0.1051","","","","","","1.128","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102686","15.9317","0.0007","12.53","0.0005","12.3798","0.0005","90","","100.755","0.001","90","","2427.9","0.17","118","","118","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Platinum diethylphenylazothioformaide","Trans-(di(N,N-diethyl-(2-phenyldiazenyl)thioformamide-κS,κN^2^))platinum","","- C22 H30 N6 Pt S2 -","- C22 H30 N6 Pt S2 -","- C88 H120 N24 Pt4 S8 -","4","0.5","BK5045","Nielsen, Kim T.; Harris, Pernille; Bechgaard, Klaus; Krebs, Frederik C.","Structural study of four complexes of the <i>M</i>-N~2~S~2~ type derived from diethylphenylazothioformamide and the metals palladium, platinum, copper and nickel","Acta Crystallographica Section B","2007","63","1","151","156","10.1107/S0108768106047306","","","0.71073","MoKα","","0.038","0.0365","","","0.0965","0.0977","","","","","","1.088","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102687","8.24153","0.00004","2.78589","0.00002","5.71687","0.00003","90","","111.97","0.0005","90","","121.727","0.0013","293","","293","","","","","","","","","3","C2/m(0\b0)s0","","","","sodium copper oxide","","- Cu Na1.57664 O2 -","- Cu Na4 O2 -","- Cu2 Na8 O4 -","2","","CK5018","van Smaalen, Sander; Dinnebier, Robert; Sofin, Mikhail; Jansen,Martin","Structures of incommensurate and commensurate composite crystals Na~<i>x~</i>CuO~2~ (<i>x</i> = 1.58, 1.6, 1.62)","Acta Crystallographica Section B","2007","63","1","17","25","10.1107/S0108768106039462","","","0.65046","Synchrotron","","0.0482","0.0468","","","0.0454","0.0455","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102688","8.2417","","2.7859","","5.7167","","90","","111.971","","90","","121.726","","","","293","","","","","","","","","3","C2/m(0\b0)s0","","","","","","- Cu5 Na8 O10 -","- Cu2 Na8 O4 -","- Cu2 Na8 O4 -","1","","CK5018","van Smaalen, Sander; Dinnebier, Robert; Sofin, Mikhail; Jansen,Martin","Structures of incommensurate and commensurate composite crystals Na~<i>x~</i>CuO~2~ (<i>x</i> = 1.58, 1.6, 1.62)","Acta Crystallographica Section B","2007","63","1","17","25","10.1107/S0108768106039462","","","0.70926","X-ray","","0.0418","0.0347","","","0.0332","0.0334","","","","","","2.95","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102689","8.23682","0.00015","2.79269","0.00004","5.71224","0.0001","90","","111.67","0.0009","90","","122.112","0.004","","","293","","","","","","","","","3","C2/m(0\b0)s0","","","","","","- Cu Na1.61689 O2 -","- Cu Na4 O2 -","- Cu2 Na8 O4 -","2","","CK5018","van Smaalen, Sander; Dinnebier, Robert; Sofin, Mikhail; Jansen,Martin","Structures of incommensurate and commensurate composite crystals Na~<i>x~</i>CuO~2~ (<i>x</i> = 1.58, 1.6, 1.62)","Acta Crystallographica Section B","2007","63","1","17","25","10.1107/S0108768106039462","","","1.54059","X-ray","","0.0556","0.0546","","","0.0589","0.0589","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102690","15.156","0.002","17.772","0.004","13.106","0.006","90","","96.67","0.02","90","","3506.2","1.9","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H24 Co I11 S6 -","- C12 H24 Co I11 S6 -","- C48 H96 Co4 I44 S24 -","4","0.5","GP5013","Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin","Extended structures of polyiodide salts of transition metal macrocyclic complexes","Acta Crystallographica Section B","2007","63","1","81","92","10.1107/S0108768106041668","","","0.71073","MoKα","","0.0417","0.0381","","","0.103","0.108","","","","","","1.13","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102691","9.445","0.0018","9.042","0.002","16.449","0.003","90","","97.83","0.03","90","","1391.7","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H24 I6 Ni S6 -","- C12 H24 I6 Ni S6 -","- C24 H48 I12 Ni2 S12 -","2","0.5","GP5013","Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin","Extended structures of polyiodide salts of transition metal macrocyclic complexes","Acta Crystallographica Section B","2007","63","1","81","92","10.1107/S0108768106041668","","","0.71073","MoKα","","0.0353","0.0332","","","0.0852","0.0876","","","","","","1.17","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102692","12.317","0.003","15.602","0.006","18.302","0.007","90","","90","","90","","3517","2","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H24 I10 Ni S6 -","- C12 H24 I10 Ni S6 -","- C48 H96 I40 Ni4 S24 -","4","0.5","GP5013","Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin","Extended structures of polyiodide salts of transition metal macrocyclic complexes","Acta Crystallographica Section B","2007","63","1","81","92","10.1107/S0108768106041668","","","0.71073","MoKα","","0.0461","0.0382","","","0.0946","0.1","","","","","","1.31","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102693","18.062","0.008","23.602","0.014","11.166","0.005","90","","109.81","0.06","90","","4478","4","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H16 I6 Pd S4 -","- C8 H16 I6 Pd S4 -","- C64 H128 I48 Pd8 S32 -","8","1","GP5013","Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin","Extended structures of polyiodide salts of transition metal macrocyclic complexes","Acta Crystallographica Section B","2007","63","1","81","92","10.1107/S0108768106041668","","","0.71073","MoKα","","0.049","0.0404","","","0.0888","0.0931","","","","","","1.23","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102694","9.336","0.004","11.504","0.004","16.431","0.003","85.49","0.03","81.2","0.03","86.93","0.03","1737","1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H23 I10 N Pd S4 -","- C12 H23 I10 N Pd S4 -","- C24 H46 I20 N2 Pd2 S8 -","2","1","GP5013","Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin","Extended structures of polyiodide salts of transition metal macrocyclic complexes","Acta Crystallographica Section B","2007","63","1","81","92","10.1107/S0108768106041668","","","0.71073","MoKα","","0.0415","0.036","","","0.0798","0.0832","","","","","","1.29","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102695","6.0817","0.0012","5.2501","0.0004","8.4646","0.0014","90","","108.207","0.014","90","","256.74","0.07","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","piperazine","","- C4 H10 N2 -","- C4 H10 N2 -","- C8 H20 N4 -","2","0.5","GP5014","Loehlin, James H.; Okasako, Elizabeth L. N.","Analysis of structures with saturated hydrogen bonding","Acta Crystallographica Section B","2007","63","1","132","141","10.1107/S0108768106045046","","","1.5418","CuKα","","0.0478","0.0462","","0.1127","0.1109","0.1109","","","","","","1.0373","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2102696","6.6521","0.0003","10.4682","0.0008","10.259","0.0004","90","","98.703","0.004","90","","706.17","0.07","294","","294","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","morpholinium iodide","","- C4 H10 I N O -","- C4 H10 I N O -","- C16 H40 I4 N4 O4 -","4","1","GP5014","Loehlin, James H.; Okasako, Elizabeth L. N.","Analysis of structures with saturated hydrogen bonding","Acta Crystallographica Section B","2007","63","1","132","141","10.1107/S0108768106045046","","","0.71073","MoKα","","0.0204","0.0179","","0.0216","0.0192","0.0192","","","","","","1.1072","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102697","36.19","0.006","5.1258","0.0008","8.2222","0.0013","90","","101.773","0.005","90","","1493.2","0.4","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,4-phenylenediamine.1,8-octanediol (1/1)","","- C14 H26 N2 O2 -","- C14 H26 N2 O2 -","- C56 H104 N8 O8 -","4","0.5","GP5014","Loehlin, James H.; Okasako, Elizabeth L. N.","Analysis of structures with saturated hydrogen bonding","Acta Crystallographica Section B","2007","63","1","132","141","10.1107/S0108768106045046","","","0.71073","MoKα","","0.0538","0.0379","","0.0967","0.094","0.094","","","","","","1.0326","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2102698","19.453","0.002","5.1589","0.0006","8.18","0.001","90","","98.398","0.003","90","","812.11","0.16","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-phenylenediamine.1,10-decanediol (1/1)","","- C16 H30 N2 O2 -","- C16 H30 N2 O2 -","- C32 H60 N4 O4 -","2","0.5","GP5014","Loehlin, James H.; Okasako, Elizabeth L. N.","Analysis of structures with saturated hydrogen bonding","Acta Crystallographica Section B","2007","63","1","132","141","10.1107/S0108768106045046","","","0.71073","MoKα","","0.0604","0.0351","","0.1039","0.0901","0.0901","","","","","","0.9379","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2102699","22.2081","0.0014","5.1843","0.0009","8.217","0.004","90","","96.818","0.003","90","","939.4","0.5","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-phenylenediamine.1,12-dodecanediol (1/1)","","- C18 H34 N2 O2 -","- C18 H34 N2 O2 -","- C36 H68 N4 O4 -","2","0.5","GP5014","Loehlin, James H.; Okasako, Elizabeth L. N.","Analysis of structures with saturated hydrogen bonding","Acta Crystallographica Section B","2007","63","1","132","141","10.1107/S0108768106045046","","","0.71073","MoKα","","0.0792","0.0366","","0.0997","0.0895","0.0895","","","","","","0.96","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2102700","15.4577","0.0012","17.5074","0.0012","10.997","0.0007","90","","90","","90","","2976.1","0.4","293","","293","","","","","","","","","4","F d d 2","F 2 -2d","43","","6-amino-1-hexanol","","- C6 H15 N O -","- C6 H15 N O -","- C96 H240 N16 O16 -","16","1","GP5014","Loehlin, James H.; Okasako, Elizabeth L. N.","Analysis of structures with saturated hydrogen bonding","Acta Crystallographica Section B","2007","63","1","132","141","10.1107/S0108768106045046","","","0.71073","MoKα","","0.0962","0.0853","","0.231","0.2256","0.2256","","","","","","1.065","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102701","5.736","0.0016","10.618","0.003","10.142","0.003","90","","101.197","0.005","90","","605.9","0.3","213","","213","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Morpholinium Chloride","","- C4 H10 Cl N O -","- C4 H10 Cl N O -","- C16 H40 Cl4 N4 O4 -","4","1","GP5014","Loehlin, James H.; Okasako, Elizabeth L. N.","Analysis of structures with saturated hydrogen bonding","Acta Crystallographica Section B","2007","63","1","132","141","10.1107/S0108768106045046","","","0.71073","MoKα","","0.0557","0.0358","","0.0848","0.083","0.083","","","","","","0.9627","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102702","9.377","0.011","9.377318","","6.888","0.004","90","","90","","120","","524.5","0.7","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P6 -","- Ca10 F2 O24 P6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1{-~<i>x</i>}O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102703","9.37834","0.00007","9.37834","0.00007","6.88877","0.00007","90","","90","","120","","524.716","0.01","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P6 -","- Ca10 F2 O24 P6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102704","9.37834","0.00007","9.37834","0.00007","6.88877","0.00007","90","","90","","120","","524.716","0.01","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P6 -","- Ca10 F2 O24 P6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102705","9.38","0.03","9.378214","","6.888","0.007","90","","90","","120","","524.7","1.8","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P5.4 V0.6 -","- Ca10 F2 O24 P5.4 V0.6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1{-~<i>x</i>}O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102706","9.3801","0.0003","9.3801","0.0003","6.8889","0.0002","90","","90","","120","","524.92","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P5.4 V0.6 -","- Ca10 F2 O24 P5.4 V0.6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102707","9.3801","0.0003","9.3801","0.0003","6.8889","0.0002","90","","90","","120","","524.92","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P5.4 V0.6 -","- Ca10 F2 O24 P5.4 V0.6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102708","9.437","0.015","9.436671","","6.909","0.004","90","","90","","120","","532.8","0.9","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P4.8 V1.2 -","- Ca10 F2 O24 P4.8 V1.2 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1{-~<i>x</i>}O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102709","9.4379","0.0002","9.4379","0.0002","6.90967","0.00017","90","","90","","120","","533.02","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P4.8 V1.2 -","- Ca10 F2 O24 P4.8 V1.2 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102710","9.4379","0.0002","9.4379","0.0002","6.90968","0.00017","90","","90","","120","","533.02","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P4.8 V1.2 -","- Ca10 F2 O24 P4.8 V1.2 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102711","9.472","0.016","9.472342","","6.922","0.005","90","","90","","120","","537.9","1","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P4.2 V1.8 -","- Ca10 F2 O24 P4.2 V1.8 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1{-~<i>x</i>}O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102712","9.4733","0.0002","9.4733","0.0002","6.92272","0.00017","90","","90","","120","","538.04","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P4.2 V1.8 -","- Ca10 F2 O24 P4.2 V1.8 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102713","9.4733","0.0002","9.4733","0.0002","6.92276","0.00017","90","","90","","120","","538.04","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P4.2 V1.8 -","- Ca10 F2 O24 P4.2 V1.8 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102714","9.51","0.02","9.509835","","6.937","0.006","90","","90","","120","","543.3","1.8","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P3.6 V2.4 -","- Ca10 F2 O24 P3.6 V2.4 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102715","9.5103","0.0002","9.5103","0.0002","6.93674","0.00018","90","","90","","120","","543.35","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P3.6 V2.4 -","- Ca10 F2 O24 P3.6 V2.4 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102716","9.5103","0.0002","9.5103","0.0002","6.93677","0.00018","90","","90","","120","","543.35","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P3.6 V2.4 -","- Ca10 F2 O24 P3.6 V2.4 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102717","9.57","0.02","9.565158","","6.947","0.006","90","","90","","120","","550.5","1.8","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P3 V3 -","- Ca10 F2 O24 P3 V3 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102718","9.56534","0.00019","9.56534","0.00019","6.94712","0.00016","90","","90","","120","","550.47","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P3 V3 -","- Ca10 F2 O24 P3 V3 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102719","9.5654","0.0002","9.5654","0.0002","6.94713","0.00016","90","","90","","120","","550.48","0.03","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P3 V3 -","- Ca10 F2 O24 P3 V3 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102720","9.58","0.03","9.581942","","6.963","0.008","90","","90","","120","","554","2","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P2.4 V3.6 -","- Ca10 F2 O24 P2.4 V3.6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102721","9.582","0.0003","9.582","0.0003","6.9628","0.0002","90","","90","","120","","553.64","0.04","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P2.4 V3.6 -","- Ca10 F2 O24 P2.4 V3.6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102722","9.5821","0.0003","9.5821","0.0003","6.9628","0.0002","90","","90","","120","","553.65","0.04","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P2.4 V3.6 -","- Ca10 F2 O24 P2.4 V3.6 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102723","9.6","0.03","9.598996","","6.969","0.01","90","","90","","120","","556.2","1.9","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P1.8 V4.2 -","- Ca10 F2 O24 P1.8 V4.2 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1{-~<i>x</i>}O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102724","9.6029","0.0005","9.6029","0.0005","6.9712","0.0004","90","","90","","120","","556.73","0.06","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P1.8 V4.2 -","- Ca10 F2 O24 P1.8 V4.2 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102725","9.6029","0.0005","9.6029","0.0005","6.9713","0.0004","90","","90","","120","","556.74","0.07","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P1.8 V4.2 -","- Ca10 F2 O24 P1.8 V4.2 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102726","9.65","0.05","9.646212","","6.981","0.014","90","","90","","120","","563","4","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P1.2 V4.8 -","- Ca10 F2 O24 P1.2 V4.8 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102727","9.6454","0.0007","9.6454","0.0007","6.9855","0.0006","90","","90","","120","","562.81","0.1","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P1.2 V4.8 -","- Ca10 F2 O24 P1.2 V4.8 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102728","9.6452","0.0007","9.6452","0.0007","6.9855","0.0006","90","","90","","120","","562.8","0.1","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P1.2 V4.8 -","- Ca10 F2 O24 P1.2 V4.8 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102729","9.68","0.04","9.680008","","6.999","0.012","90","","90","","120","","568","3","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P0.6 V5.4 -","- Ca10 F2 O24 P0.6 V5.4 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1{-~<i>x</i>}O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102730","9.6819","0.0005","9.6819","0.0005","7.0015","0.0004","90","","90","","120","","568.39","0.06","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P0.6 V5.4 -","- Ca10 F2 O24 P0.6 V5.4 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102731","9.6817","0.0005","9.6817","0.0005","7.0014","0.0004","90","","90","","120","","568.36","0.07","","","","","","","","","","","","5","P 63/m","-P 6c","176","","","","?","- Ca10 F2 O24 P0.6 V5.4 -","- Ca10 F2 O24 P0.6 V5.4 -","","","KD5006","Mercier, Patrick H. J.; Dong, Zhili; Baikie, Thomas; Le Page, Yvon; White, T. J.; Whitfield, Pamela S.; Mitchel, Lyndon D.","<i>Ab initio</i> constrained crystal-chemical Rietveld refinement of Ca~10~(V~<i>x~</i>P~1 - <i>x~</i>O~4~)~6~F~2~ apatites","Acta Crystallographica Section B","2007","63","1","37","48","10.1107/S0108768106045538","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102732","13.818","0.001","5.755","0.001","9.901","0.001","90","","90","","90","","787.35","0.17","293","2","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Cr Li O11 Sr Ti4 -","- Cr0.99 Li O11 Sr Ti4.01 -","- Cr3.96 Li4 O44 Sr4 Ti16.04 -","4","0.5","LC5052","Imaz, Inhar; Pechev, Stanislav; Gravereau, Pierre; Chaminade, Jean-Pierre; Kosseva, Iovka; Peshev, Pavel; Bouree, Francoise","Structural filiations in the new complex titanates SrLi<i>M</i>Ti~4~O~11~ (<i>M</i> = Cr, Fe)","Acta Crystallographica Section B","2007","63","1","26","36","10.1107/S0108768106041929","","","0.71073","MoKα","","","0.023","","","","0.056","","","","","","1.2","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2102733","13.798","0.002","5.763","0.001","9.89","0.002","90","","90","","90","","786.4","0.2","293","2","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Cr Li O11 Sr Ti4 -","- Cr Li O11 Sr Ti4 -","- Cr4 Li4 O44 Sr4 Ti16 -","4","0.5","LC5052","Imaz, Inhar; Pechev, Stanislav; Gravereau, Pierre; Chaminade, Jean-Pierre; Kosseva, Iovka; Peshev, Pavel; Bouree, Francoise","Structural filiations in the new complex titanates SrLi<i>M</i>Ti~4~O~11~ (<i>M</i> = Cr, Fe)","Acta Crystallographica Section B","2007","63","1","26","36","10.1107/S0108768106041929","","","0.71073","MoKα","","","0.04","","","","0.073","","","","","","1.18","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2102734","13.875","0.006","11.492","0.003","19.887","0.003","90","","90","","90","","3171","1.7","293","2","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- Fe Li O11 Sr Ti4 -","- Fe Li O11 Sr Ti4 -","- Fe16 Li16 O176 Sr16 Ti64 -","16","2","LC5052","Imaz, Inhar; Pechev, Stanislav; Gravereau, Pierre; Chaminade, Jean-Pierre; Kosseva, Iovka; Peshev, Pavel; Bouree, Francoise","Structural filiations in the new complex titanates SrLi<i>M</i>Ti~4~O~11~ (<i>M</i> = Cr, Fe)","Acta Crystallographica Section B","2007","63","1","26","36","10.1107/S0108768106041929","","","0.71073","MoKα","","","0.053","","","","0.085","","","","","","1.21","","","","has coordinates","204122","2020-10-21","18:00:00",""
"2102735","15.9574","0.001","16.1807","0.001","10.9808","0.0007","90","","92.115","0.003","90","","2833.3","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(mu2-hydroxo)-(2-pyridininphenyl)-C,N)palladium","","- C22 H18 N2 O2 Pd2 -","- C22 H16 N2 O2 Pd2 -","- C132 H96 N12 O12 Pd12 -","6","1.5","RY5007","Perez Perez, Jose; Serrano, Jose Luis; Galiana Garcia, Jose Miguel; Cumbrera, Francisco Luis; Ortiz, Angel L.; Sanchez, G.; Garcia, J.","Structure determination of di-μ-hydroxo-bis[(2-(2-pyridyl)phenyl-κ^2^<i>N</i>,<i>C</i>^1^)palladium(II)] by X-ray powder diffractometry","Acta Crystallographica Section B","2007","63","1","75","80","10.1107/S0108768106044843","","","1.54183","CuKα","","","","","","","","","","2.0435","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102736","3.9274","0.0004","10.5678","0.001","15.199","0.009","90","","96.7","0.02","90","","626.5","0.4","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","1,2-dichlorobenzene ortho-dichlorobenzene","1,2-dichlorobenzene ortho-dichlorobenzene","","- C6 H4 Cl2 -","- C6 H4 Cl2 -","- C24 H16 Cl8 -","4","1","SO5006","Bujak, Maciej; Dziubek, Kamil; Katrusiak, Andrzej","Halogen···halogen interactions in pressure-frozen <i>ortho</i>- and <i>meta</i>-dichlorobenzene isomers","Acta Crystallographica Section B","2007","63","1","124","131","10.1107/S0108768106046684","","","0.71073","MoKα","","0.2098","0.0309","","","0.0325","0.0372","","","","","","0.632","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102737","3.9163","0.0006","12.532","0.005","25.849","0.005","90","","93.098","0.014","90","","1266.8","0.6","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,3-dichlorobenzene meta-dichlorobenzene","1,3-dichlorobenzene meta-dichlorobenzene","","- C6 H4 Cl2 -","- C6 H4 Cl2 -","- C48 H32 Cl16 -","8","2","SO5006","Bujak, Maciej; Dziubek, Kamil; Katrusiak, Andrzej","Halogen···halogen interactions in pressure-frozen <i>ortho</i>- and <i>meta</i>-dichlorobenzene isomers","Acta Crystallographica Section B","2007","63","1","124","131","10.1107/S0108768106046684","","","0.71073","MoKα","","0.1726","0.1091","","","0.1134","0.1288","","","","","","1.468","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102738","6.2733","0.0004","6.2733","0.0004","5.7472","0.0005","90","","90","","120","","195.88","0.02","293","","293","","","","","","","","","5","P -3 m 1","-P 3 2""","164","","","","- Cl2 Cu3 H6 Mg O6 -","- Cl2 Cu3 H6 Mg O6 -","- Cl2 Cu3 H6 Mg O6 -","1","0.0833333","SO5007","Malcherek, Thomas; Schlüter, Jochen","Cu~3~MgCl~2~(OH)~6~ and a redetermination of bond valence parameters for the OH—Cl bond","Acta Crystallographica, Section B","2007","63","1","157","160","10.1107/S0108768106053870","","","0.71073","MoKα","","0.0225","0.02","","","0.0819","0.0848","","","","","","1.14","","","","has coordinates","208238","2020-10-21","18:00:00",""
"2102739","12.09","0.002","8.4901","0.0009","4.8626","0.0008","90","","96.13","0.02","90","","496.27","0.13","90","2","90","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0319","","","","0.0578","","","","","","1.015","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102740","12.0881","0.0009","8.4914","0.0005","4.8644","0.0004","90","","96.137","0.009","90","","496.44","0.06","130","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.031","","","","0.0547","","","","","","1.002","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102741","12.0087","0.0009","8.4931","0.0005","4.8657","0.0004","90","","96.139","0.009","90","","493.41","0.06","170","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0306","","","","0.0623","","","","","","0.975","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102742","12.0859","0.0009","8.4947","0.0005","4.8667","0.0004","90","","96.143","0.009","90","","496.78","0.06","200","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0305","","","","0.0551","","","","","","0.969","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102743","12.0858","0.0009","8.4979","0.0005","4.8691","0.0004","90","","96.161","0.009","90","","497.19","0.06","250","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0326","","","","0.0594","","","","","","0.997","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102744","12.0861","0.0012","8.5008","0.0008","4.8704","0.0005","90","","96.167","0.009","90","","497.5","0.09","290","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0257","","","","0.054","","","","","","1.023","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102745","12.088","0.002","8.5019","0.0009","4.8703","0.0008","90","","96.17","0.02","90","","497.63","0.13","298","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0206","","","","0.0484","","","","","","1.016","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102746","12.0876","0.0008","8.5043","0.0007","4.8715","0.0005","90","","96.19","0.02","90","","497.85","0.08","320","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0249","","","","0.0508","","","","","","1.005","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102747","12.0883","0.0008","8.5076","0.0007","4.8727","0.0005","90","","96.18","0.02","90","","498.21","0.08","362","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0269","","","","0.0533","","","","","","0.974","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102748","12.0943","0.0008","8.5142","0.0007","4.8763","0.0005","90","","96.21","0.02","90","","499.18","0.08","445","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0275","","","","0.062","","","","","","0.974","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102749","12.0971","0.0008","8.5205","0.0007","4.8803","0.0005","90","","96.22","0.02","90","","500.07","0.08","528","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0255","","","","0.0544","","","","","","0.975","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102750","12.1011","0.0008","8.529","0.0007","4.8841","0.0005","90","","96.24","0.02","90","","501.1","0.08","611","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0284","","","","0.0621","","","","","","0.994","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102751","12.1039","0.0008","8.5353","0.0007","4.8886","0.0005","90","","96.28","0.02","90","","502.01","0.08","695","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0285","","","","0.0608","","","","","","1.014","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102752","12.1073","0.0008","8.538","0.0007","4.8899","0.0005","90","","96.28","0.02","90","","502.45","0.08","736","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0265","","","","0.0536","","","","","","0.97","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102753","12.1083","0.0008","8.5422","0.0007","4.8916","0.0005","90","","96.295","0.011","90","","502.9","0.07","778","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.032","","","","0.0604","","","","","","0.981","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102754","12.149","0.005","8.577","0.003","4.9048","0.0019","90","","96.25","0.03","90","","508.1","0.3","819","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0391","","","","0.0723","","","","","","0.969","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102755","12.1165","0.0008","8.5535","0.0007","4.8974","0.0005","90","","96.326","0.011","90","","504.47","0.07","903","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cu2 Fe2 Ge4 O13 -","- Cu2 Fe2 Ge4 O13 -","- Cu4 Fe4 Ge8 O26 -","2","0.5","WS5044","Redhammer, Günther J.","Temperature-dependent crystal structure refinement and ^57^Fe Mössbauer spectroscopy of Cu~2~Fe~2~Ge~4~O~13~","Acta Crystallographica Section B","2007","63","1","4","16","10.1107/S0108768106051652","","","0.71073","MoKα","","","0.0582","","","","0.1359","","","","","","0.965","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102756","4.8443","0.0002","22.7344","0.0016","11.4216","0.0008","90","","97.636","0.004","90","","1246.73","0.13","120","2","120","2","","","","","","","","5","C 1 c 1","C -2yc","9","","1-(2-chloronicotinoyl)-2-(2-nitrophenyl)hydrazine, Cc polymorph","","- C12 H9 Cl N4 O3 -","- C12 H9 Cl N4 O3 -","- C48 H36 Cl4 N16 O12 -","4","1","WS5049","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Three isomeric 1-(2-chloronicotinoyl)-2-(nitrophenyl)hydrazines, including three polymorphs of 1-(2-chloronicotinoyl)-2-(2-nitrophenyl)hydrazine: hydrogen-bonded supramolecular structures in two and three dimensions","Acta Crystallographica Section B","2007","63","1","101","110","10.1107/S0108768106041358","","","0.71073","MoKα","","0.0443","0.0337","","","0.0706","0.0753","","","","","","1.062","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102757","6.1515","0.0009","4.7875","0.0005","20.748","0.003","90","","97.54","0.007","90","","605.75","0.14","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-(2-chloronicotinoyl)-2-(2-nitrophenyl)hydrazine, P2~1~ polymorph","","- C12 H9 Cl N4 O3 -","- C12 H9 Cl N4 O3 -","- C24 H18 Cl2 N8 O6 -","2","1","WS5049","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Three isomeric 1-(2-chloronicotinoyl)-2-(nitrophenyl)hydrazines, including three polymorphs of 1-(2-chloronicotinoyl)-2-(2-nitrophenyl)hydrazine: hydrogen-bonded supramolecular structures in two and three dimensions","Acta Crystallographica Section B","2007","63","1","101","110","10.1107/S0108768106041358","","","0.71073","MoKα","","0.1772","0.0739","","","0.1357","0.1644","","","","","","0.957","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102758","22.2727","0.0003","8.2207","0.0004","13.5916","0.0007","90","","90","","90","","2488.58","0.18","120","2","120","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","1-(2-chloronicotinoyl)-2-(2-nitrophenyl)hydrazine, Pbcn polymorph","","- C12 H9 Cl N4 O3 -","- C12 H9 Cl N4 O3 -","- C96 H72 Cl8 N32 O24 -","8","1","WS5049","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Three isomeric 1-(2-chloronicotinoyl)-2-(nitrophenyl)hydrazines, including three polymorphs of 1-(2-chloronicotinoyl)-2-(2-nitrophenyl)hydrazine: hydrogen-bonded supramolecular structures in two and three dimensions","Acta Crystallographica Section B","2007","63","1","101","110","10.1107/S0108768106041358","","","0.71073","MoKα","","0.0464","0.0323","","","0.0808","0.087","","","","","","1.042","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102759","9.0691","0.0003","19.6472","0.0005","7.4302","0.0003","90","","110.424","0.002","90","","1240.7","0.07","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2-chloronicotinoyl)-2-(3-nitrophenyl)hydrazine","","- C12 H9 Cl N4 O3 -","- C12 H9 Cl N4 O3 -","- C48 H36 Cl4 N16 O12 -","4","1","WS5049","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Three isomeric 1-(2-chloronicotinoyl)-2-(nitrophenyl)hydrazines, including three polymorphs of 1-(2-chloronicotinoyl)-2-(2-nitrophenyl)hydrazine: hydrogen-bonded supramolecular structures in two and three dimensions","Acta Crystallographica Section B","2007","63","1","101","110","10.1107/S0108768106041358","","","0.71073","MoKα","","0.0598","0.0383","","","0.087","0.0972","","","","","","1.035","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102760","4.5811","0.0001","24.8913","0.0013","11.2782","0.0006","90","","94.095","0.003","90","","1282.76","0.1","120","2","120","2","","","","","","","","5","C 1 c 1","C -2yc","9","","1-(2-chloronicotinoyl)-2-(4-nitrophenyl)hydrazine","","- C12 H9 Cl N4 O3 -","- C12 H9 Cl N4 O3 -","- C48 H36 Cl4 N16 O12 -","4","1","WS5049","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Three isomeric 1-(2-chloronicotinoyl)-2-(nitrophenyl)hydrazines, including three polymorphs of 1-(2-chloronicotinoyl)-2-(2-nitrophenyl)hydrazine: hydrogen-bonded supramolecular structures in two and three dimensions","Acta Crystallographica Section B","2007","63","1","101","110","10.1107/S0108768106041358","","","0.71073","MoKα","","0.0408","0.0357","","","0.0811","0.0838","","","","","","1.052","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102761","22.5541","0.0003","13.7357","0.0002","14.0756","0.0002","90","","98.6174","0.0018","90","","4311.34","0.11","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","EMM-8","aluminophosphate","","- Al O4 P -","- Al O4 P -","- Al32 O128 P32 -","32","4","WS5052","Cao, Guang; Afeworki, Mobae; Kennedy, Gordon J.; Strohmaier, Karl G.; Dorset, Douglas L.","Structure of an aluminophosphate EMM-8: a multi-technique approach","Acta Crystallographica Section B","2007","63","1","56","62","10.1107/S0108768106040109","","","0.8678","synchrotron","","","","","","","","","","1.68","","","","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102762","11.9099","0.0007","3.76253","0.00016","4.1754","0.0002","90","","90","","90","","187.105","0.016","","","","","","","","","","","","3","C m m m","-C 2 2","65","","","","- D0.46 Li2 Si -","- D0.4635 Li2 Si -","- D1.854 Li8 Si4 -","4","0.25","WS5053","Wu, Hui; Hartman, Michael R.; Udovic, Terrence J.; Rush, John J.; Zhou, Wei; Bowman Jr, Robert C.; Vajo, John J.","Structure of the novel ternary hydrides Li~4~<i>Tt</i>~2~D (<i>Tt</i> = Si and Ge)","Acta Crystallographica Section B","2007","63","1","63","68","10.1107/S0108768106046465","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102763","5.42712","0.00009","5.42712","","5.42712","","90","","90","","90","","159.848","0.003","","","","","","","","","","","","1","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Si -","- Si -","- Si8 -","8","0.0416667","WS5053","Wu, Hui; Hartman, Michael R.; Udovic, Terrence J.; Rush, John J.; Zhou, Wei; Bowman Jr, Robert C.; Vajo, John J.","Structure of the novel ternary hydrides Li~4~<i>Tt</i>~2~D (<i>Tt</i> = Si and Ge)","Acta Crystallographica Section B","2007","63","1","63","68","10.1107/S0108768106046465","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102764","4.0735","0.001","4.0735","","4.0735","","90","","90","","90","","67.593","0.017","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- D Li -","- D Li -","- D4 Li4 -","4","0.0208333","WS5053","Wu, Hui; Hartman, Michael R.; Udovic, Terrence J.; Rush, John J.; Zhou, Wei; Bowman Jr, Robert C.; Vajo, John J.","Structure of the novel ternary hydrides Li~4~<i>Tt</i>~2~D (<i>Tt</i> = Si and Ge)","Acta Crystallographica Section B","2007","63","1","63","68","10.1107/S0108768106046465","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102765","8.59576","0.00004","19.77464","0.00011","14.3189","0.00007","90","","90","","90","","2433.9","0.02","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Li12 Si7 -","- Li12 Si7 -","- Li96 Si56 -","8","1","WS5053","Wu, Hui; Hartman, Michael R.; Udovic, Terrence J.; Rush, John J.; Zhou, Wei; Bowman Jr, Robert C.; Vajo, John J.","Structure of the novel ternary hydrides Li~4~<i>Tt</i>~2~D (<i>Tt</i> = Si and Ge)","Acta Crystallographica Section B","2007","63","1","63","68","10.1107/S0108768106046465","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102766","11.9836","0.0007","7.382","0.0012","21.67","0.002","90","","90","","90","","1917","0.4","190","2","190","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C12 H8 Cl F -","- C12 H8 Cl F -","- C96 H64 Cl8 F8 -","8","1","BK5043","Luthe, G.; Swenson, D. C.; Robertson, L. W.","Influence of fluoro-substitution on the planarity of 4-chlorobiphenyl (PCB 3)","Acta Crystallographica Section B","2007","63","2","319","327","10.1107/S0108768106054255","","","0.71073","MoKα","","0.062","0.0486","","","0.1364","0.1441","","","","","","1.057","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102767","17.4184","0.0017","5.8649","0.0006","19.44","0.0019","90","","104.981","0.005","90","","1918.4","0.3","190","2","190","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H8 Cl F -","- C12 H8 Cl F -","- C96 H64 Cl8 F8 -","8","1","BK5043","Luthe, G.; Swenson, D. C.; Robertson, L. W.","Influence of fluoro-substitution on the planarity of 4-chlorobiphenyl (PCB 3)","Acta Crystallographica Section B","2007","63","2","319","327","10.1107/S0108768106054255","","","0.71069","MoKα","","0.0357","0.0304","","","0.0797","0.0828","","","","","","1.068","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102768","17.9426","0.0018","6.0863","0.0006","18.3206","0.0018","90","","103.701","0.005","90","","1943.8","0.3","190","2","190","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H8 Cl F -","- C12 H8 Cl F -","- C96 H64 Cl8 F8 -","8","1","BK5043","Luthe, G.; Swenson, D. C.; Robertson, L. W.","Influence of fluoro-substitution on the planarity of 4-chlorobiphenyl (PCB 3)","Acta Crystallographica Section B","2007","63","2","319","327","10.1107/S0108768106054255","","","0.71069","MoKα","","0.0497","0.0344","","","0.0876","0.0965","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2102769","11.3527","0.0011","3.9099","0.0004","21.92","0.002","90","","99.966","0.005","90","","958.3","0.16","190","2","190","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H8 Cl F -","- C12 H8 Cl F -","- C48 H32 Cl4 F4 -","4","1","BK5043","Luthe, G.; Swenson, D. C.; Robertson, L. W.","Influence of fluoro-substitution on the planarity of 4-chlorobiphenyl (PCB 3)","Acta Crystallographica Section B","2007","63","2","319","327","10.1107/S0108768106054255","","","0.71069","MoKα","","0.0469","0.0376","","","0.0923","0.0981","","","","","","1.093","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2102770","9.55","0.001","13.1441","0.0013","15.6777","0.0016","90","","96.323","0.005","90","","1956","0.3","190","2","190","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H8 Cl F -","- C12 H8 Cl F -","- C96 H64 Cl8 F8 -","8","2","BK5043","Luthe, G.; Swenson, D. C.; Robertson, L. W.","Influence of fluoro-substitution on the planarity of 4-chlorobiphenyl (PCB 3)","Acta Crystallographica Section B","2007","63","2","319","327","10.1107/S0108768106054255","","","0.71069","MoKα","","0.0662","0.0408","","","0.1005","0.1111","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2102771","5.9588","0.0008","11.8583","0.0016","15.647","0.002","79.036","0.002","80.499","0.003","82.506","0.002","1065","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H54 Cl6 O4 -","- C42 H54 Cl6 O4 -","- C42 H54 Cl6 O4 -","1","0.5","BM5041","Bartalucci, Giuditta; Coppin, Jennifer; Fisher, Stuart; Hall, Gillian; Helliwell, John R.; Helliwell, Madeleine; Liaaen-Jensen, Synnøve","Unravelling the chemical basis of the bathochromic shift in the lobster carapace; new crystal structures of unbound astaxanthin, canthaxanthin and zeaxanthin","Acta Crystallographica Section B","2007","63","2","328","337","10.1107/S0108768106052633","","","0.71073","MoKα","","0.114","0.0477","","","0.081","0.0932","","","","","","0.799","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"2102772","18.568","0.004","6.1926","0.0013","19.803","0.004","90","","107.746","0.004","90","","2168.7","0.8","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C50 H62 N2 O4 -","- C50 H62 N2 O4 -","- C100 H124 N4 O8 -","2","0.5","BM5041","Bartalucci, Giuditta; Coppin, Jennifer; Fisher, Stuart; Hall, Gillian; Helliwell, John R.; Helliwell, Madeleine; Liaaen-Jensen, Synnøve","Unravelling the chemical basis of the bathochromic shift in the lobster carapace; new crystal structures of unbound astaxanthin, canthaxanthin and zeaxanthin","Acta Crystallographica Section B","2007","63","2","328","337","10.1107/S0108768106052633","","","0.71073","MoKα","","0.1204","0.0485","","","0.0994","0.116","","","","","","0.768","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2102773","8.5371","0.001","8.6632","0.0011","13.2984","0.0016","95.145","0.002","107.409","0.002","98.765","0.002","917.93","0.19","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C40 H52 O4 -","- C40 H52 O4 -","- C40 H52 O4 -","1","0.5","BM5041","Bartalucci, Giuditta; Coppin, Jennifer; Fisher, Stuart; Hall, Gillian; Helliwell, John R.; Helliwell, Madeleine; Liaaen-Jensen, Synnøve","Unravelling the chemical basis of the bathochromic shift in the lobster carapace; new crystal structures of unbound astaxanthin, canthaxanthin and zeaxanthin","Acta Crystallographica Section B","2007","63","2","328","337","10.1107/S0108768106052633","","","0.71073","MoKα","","0.0768","0.0518","","","0.1469","0.163","","","","","","0.836","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2102774","8.5068","0.0009","14.2208","0.0016","15.5262","0.0017","105.87","0.002","95.227","0.002","106.512","0.002","1702.9","0.3","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C40 H52 O2 -","- C40 H52 O2 -","- C80 H104 O4 -","2","1","BM5041","Bartalucci, Giuditta; Coppin, Jennifer; Fisher, Stuart; Hall, Gillian; Helliwell, John R.; Helliwell, Madeleine; Liaaen-Jensen, Synnøve","Unravelling the chemical basis of the bathochromic shift in the lobster carapace; new crystal structures of unbound astaxanthin, canthaxanthin and zeaxanthin","Acta Crystallographica Section B","2007","63","2","328","337","10.1107/S0108768106052633","","","0.71073","MoKα","","0.1029","0.0496","","","0.0987","0.1116","","","","","","0.838","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2102775","8.5919","0.0011","14.3168","0.0018","15.9405","0.0019","105.569","0.002","96.118","0.003","107.024","0.002","1769.2","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C40 H52 O2 -","- C40 H52 O2 -","- C80 H104 O4 -","2","1","BM5041","Bartalucci, Giuditta; Coppin, Jennifer; Fisher, Stuart; Hall, Gillian; Helliwell, John R.; Helliwell, Madeleine; Liaaen-Jensen, Synnøve","Unravelling the chemical basis of the bathochromic shift in the lobster carapace; new crystal structures of unbound astaxanthin, canthaxanthin and zeaxanthin","Acta Crystallographica Section B","2007","63","2","328","337","10.1107/S0108768106052633","","","0.71073","MoKα","","0.1186","0.0496","","","0.1187","0.1365","","","","","","0.815","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2102776","49.67","0.015","13.181","0.004","6.0588","0.0019","90","","94.425","0.006","90","","3955","2","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C40 H62 O5 -","- C40 H56 O2 -","- C160 H224 O8 -","4","0.5","BM5041","Bartalucci, Giuditta; Coppin, Jennifer; Fisher, Stuart; Hall, Gillian; Helliwell, John R.; Helliwell, Madeleine; Liaaen-Jensen, Synnøve","Unravelling the chemical basis of the bathochromic shift in the lobster carapace; new crystal structures of unbound astaxanthin, canthaxanthin and zeaxanthin","Acta Crystallographica Section B","2007","63","2","328","337","10.1107/S0108768106052633","","","0.71073","MoKα","","0.0812","0.051","","","0.1274","0.1372","","","","","","1.033","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2102777","7.6396","0.0012","4.9447","0.0007","9.3596","0.0014","90","","111.427","0.011","90","","329.13","0.09","293","1","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ba O9 V4 -","- Ba O9 V4 -","- Ba2 O18 V8 -","2","0.5","BM5044","Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G.","Synthesis and structural characterization of BaV~4~O~9~","Acta Crystallographica Section B","2007","63","2","270","276","10.1107/S0108768107003734","","","0.71073","MoKα","","","0.023","","","","0.0402","","","","","","1.448","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102778","7.6303","0.0012","4.9405","0.0007","9.3547","0.0014","90","","111.395","0.011","90","","328.35","0.09","250","1","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ba O9 V4 -","- Ba O9 V4 -","- Ba2 O18 V8 -","2","0.5","BM5044","Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G.","Synthesis and structural characterization of BaV~4~O~9~","Acta Crystallographica Section B","2007","63","2","270","276","10.1107/S0108768107003734","","","0.71073","MoKα","","","0.0222","","","","0.038","","","","","","1.408","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102779","7.6231","0.0012","4.937","0.0007","9.3528","0.0014","90","","111.386","0.011","90","","327.76","0.09","200","1","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ba O9 V4 -","- Ba O9 V4 -","- Ba2 O18 V8 -","2","0.5","BM5044","Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G.","Synthesis and structural characterization of BaV~4~O~9~","Acta Crystallographica Section B","2007","63","2","270","276","10.1107/S0108768107003734","","","0.71073","MoKα","","","0.0216","","","","0.0383","","","","","","1.46","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102780","7.614","0.0012","4.9319","0.0007","9.347","0.0014","90","","111.371","0.011","90","","326.86","0.09","150","1","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ba O9 V4 -","- Ba O9 V4 -","- Ba2 O18 V8 -","2","0.5","BM5044","Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G.","Synthesis and structural characterization of BaV~4~O~9~","Acta Crystallographica Section B","2007","63","2","270","276","10.1107/S0108768107003734","","","0.71073","MoKα","","","0.0201","","","","0.0355","","","","","","1.384","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102781","7.6084","0.0013","4.9291","0.0007","9.3464","0.0015","90","","111.371","0.012","90","","326.41","0.09","100","1","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Ba O9 V4 -","- Ba O9 V4 -","- Ba2 O18 V8 -","2","0.5","BM5044","Reeswinkel, T.; Prinz, S.; Sparta, K. M.; Roth, G.","Synthesis and structural characterization of BaV~4~O~9~","Acta Crystallographica Section B","2007","63","2","270","276","10.1107/S0108768107003734","","","0.71073","MoKα","","","0.0206","","","","0.0353","","","","","","1.457","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102782","3.6686","0.0005","22.333","0.003","8.0046","0.0011","90","","99.63","0.003","90","","646.58","0.15","90","","90","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,4-dihydroxybenzoic acid","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","BS5037","Parkin, Andrew; Adam, Martin; Cooper, Richard I.; Middlemiss, Derek S.; Wilson, Chick C.","Structure and hydrogen bonding in 2,4-dihydroxybenzoic acid at 90, 100, 110 and 150K; a theoretical and single-crystal X-ray diffraction study","Acta Crystallographica Section B","2007","63","2","303","308","10.1107/S0108768106055212","","","0.71073","MoKα","","0.0976","0.0541","","0.1317","0.1132","0.1317","","","","","","0.9636","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102783","3.6721","0.0005","22.341","0.003","8.007","0.001","90","","99.602","0.003","90","","647.68","0.15","100","","100","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,4-dihydroxybenzoic acid","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","BS5037","Parkin, Andrew; Adam, Martin; Cooper, Richard I.; Middlemiss, Derek S.; Wilson, Chick C.","Structure and hydrogen bonding in 2,4-dihydroxybenzoic acid at 90, 100, 110 and 150K; a theoretical and single-crystal X-ray diffraction study","Acta Crystallographica Section B","2007","63","2","303","308","10.1107/S0108768106055212","","","0.71073","MoKα","","0.1046","0.0509","","0.1228","0.1047","0.1228","","","","","","0.9453","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102784","3.6742","0.0005","22.341","0.003","8.0065","0.001","90","","99.567","0.003","90","","648.08","0.15","110","","110","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,4-dihydroxybenzoic acid","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","BS5037","Parkin, Andrew; Adam, Martin; Cooper, Richard I.; Middlemiss, Derek S.; Wilson, Chick C.","Structure and hydrogen bonding in 2,4-dihydroxybenzoic acid at 90, 100, 110 and 150K; a theoretical and single-crystal X-ray diffraction study","Acta Crystallographica Section B","2007","63","2","303","308","10.1107/S0108768106055212","","","0.71073","MoKα","","0.1044","0.0508","","0.1226","0.1046","0.1226","","","","","","0.9458","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102785","3.6854","0.0005","22.367","0.003","8.0085","0.0011","90","","99.448","0.003","90","","651.2","0.15","150","","150","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,4-dihydroxybenzoic acid","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","BS5037","Parkin, Andrew; Adam, Martin; Cooper, Richard I.; Middlemiss, Derek S.; Wilson, Chick C.","Structure and hydrogen bonding in 2,4-dihydroxybenzoic acid at 90, 100, 110 and 150K; a theoretical and single-crystal X-ray diffraction study","Acta Crystallographica Section B","2007","63","2","303","308","10.1107/S0108768106055212","","","0.71073","MoKα","","0.1132","0.054","","0.1404","0.1162","0.1404","","","","","","0.9797","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102786","13.3229","0.0003","7.0005","0.0001","9.3471","0.0002","90","","90","","90","","871.78","0.03","90","1","","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C6 H3 N5 O6 -","- C6 H3 N5 O6 -","- C24 H12 N20 O24 -","4","1","BS5038","Chen, Yu-Sheng; Stash, Adam I.; Pinkerton, A. Alan","Chemical bonding and intermolecular interactions in energetic materials: 1,3,4-trinitro-7,8-diazapentalene","Acta Crystallographica, Section B: Structural Science","2007","63","2","309","318","10.1107/S010876810700242X","","","0.56083","AgKα","","","0.0256","","","","0.0229","","","","","","1.4356","","","","has coordinates,has Fobs","208984","2020-10-21","18:00:00",""
"2102787","7.6889","0.0003","5.3381","0.0003","5.4763","0.0001","90","","90","","89.921","0.004","224.77","0.016","","","295","","","","","","","","","4","","","","","","","- Ca3.333 Nb2.666 O11.333 Ti0.667 -","","","1","","CK5021","Guevarra, Jonathan; van Smaalen, Sander; Schönleber, Andreas; Lichtenberg, Frank","Superspace description of the crystal structures of Ca~<i>n~</i>(Nb,Ti)~<i>n~</i>O~3<i>n~+2</i> (<i>n</i> = 5 and 6)","Acta Crystallographica Section B","2007","63","2","183","189","10.1107/S0108768107002340","","","0.71069","MoKα","","0.0583","0.0512","","","0.06","0.0614","","","","","","2.63","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102788","7.6805","0.0003","5.3641","0.0003","5.4653","0.0001","90","","90","","90.036","0.004","225.165","0.016","","","295","","","","","","","","","4","","","","","","","- Ca3.429 Nb2.606 O11.429 Ti0.823 -","","","1","","CK5021","Guevarra, Jonathan; van Smaalen, Sander; Schönleber, Andreas; Lichtenberg, Frank","Superspace description of the crystal structures of Ca~<i>n~</i>(Nb,Ti)~<i>n~</i>O~3<i>n~+2</i> (<i>n</i> = 5 and 6)","Acta Crystallographica Section B","2007","63","2","183","189","10.1107/S0108768107002340","","","0.71069","MoKα","","0.0647","0.0581","","","0.0652","0.0666","","","","","","2.59","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102789","4.21616","0.00013","11.023","0.0004","7.2951","0.0003","90","","90","","90","","339.04","0.02","","","358","","","","","","","","","4","C m c m","-C 2c 2","63","Magnesium chloride hydrate","Magnesium chloride tetrahydrate","","- Cl2 H8 Mg O4 -","- Cl2 Mg O4 -","- Cl4 Mg2 O8 -","2","0.125","KD5011","Sugimoto, Kunihisa; E. Dinnebier, Robert; Jonathan C. Hanson","Structures of three dehydration products of bischofite from <i>in situ</i> synchrotron powder diffraction data (MgCl~2~·<i>n</i>H~2~O; <i>n</i> = 1, 2, 4)","Acta Crystallographica Section B","2007","63","2","235","242","10.1107/S0108768107002558","","","0.92187","synchrotron","","","","","","","","","","","","","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2102790","7.4279","0.0004","8.5736","0.0004","3.65065","0.00016","90","","98.58","0.002","90","","229.89","0.02","","","396","","","","","","","","","4","C 1 2/m 1","-C 2y","12","Magnesium chloride hydrate","Magnesium chloride dihydrate","","- Cl2 H4 Mg O2 -","- Cl2 H4 Mg O2 -","- Cl4 H8 Mg2 O4 -","2","0.25","KD5011","Sugimoto, Kunihisa; E. Dinnebier, Robert; Jonathan C. Hanson","Crystal structures of dehydration products of Bischofite, MgCl2 nH2O (n = 1, 2, 4) from in situ synchrotron powder diffraction data","Acta Crystallographica, Section B","2007","63","2","235","242","10.1107/S0108768107002558","","","0.92187","synchrotron","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2102791","8.9171","0.0006","3.63421","0.00018","11.4775","0.0007","90","","90","","90","","371.95","0.04","","","434","","","","","","","","","4","P n m a","-P 2ac 2n","62","Magnesium chloride hydrate","Magnesium chloride monohydrate","","- Cl2 H2 Mg O -","- Cl2 H2 Mg O -","- Cl8 H8 Mg4 O4 -","4","0.5","KD5011","Sugimoto, Kunihisa; E. Dinnebier, Robert; Jonathan C. Hanson","Crystal structures of dehydration products of Bischofite, MgCl2 nH2O (n = 1, 2, 4) from in situ synchrotron powder diffraction data","Acta Crystallographica, Section B","2007","63","2","235","242","10.1107/S0108768107002558","","","0.92187","synchrotron","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2102792","3.04245","0.00002","3.04245","0.00002","22.6641426","0.0000007","90","","90","","120","","181.68","0.04","","","298","","","","","","","","","4","R -3 m :H","-R 3 2""","166","Mg-Al Layered Double Hydroxide","","","?","- C0.49974 Al0.99999 Mg2.00001 O9.168 -","- C0.49974 Al0.99999 Mg2.00001 O9.168 -","","","LM5004","Radha A. V.; Kamath, P. Vishnu; Shivakumara, C.","Order and disorder among the layered double hydroxides: a combined Rietveld and DIFFaX approach","Acta Crystallographica, Section B: Structural Science","2007","63","2","243","250","10.1107/S010876810700122X","","","","CuKα","","","","","","","","","","","","","","","","","has coordinates","288014","2023-12-04","17:32:06",""
"2102793","3.066045","0.000019","3.066045","0.000019","22.5931129","0.0000003","90","","90","","120","","183.93","0.02","","","298","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","?","- C0.46722 Al0.93441 Co2.04471 O8.99286 -","- C0.46722 Al0.93441 Co2.04471 O8.99286 -","","","LM5004","Radha A. V.; Kamath, P. Vishnu; Shivakumara, C.","Order and disorder among the layered double hydroxides: a combined Rietveld and DIFFaX approach","Acta Crystallographica, Section B: Structural Science","2007","63","2","243","250","10.1107/S010876810700122X","","","","CuKα","","","","","","","","","","","","","","","","","has coordinates","288014","2023-12-04","17:32:07",""
"2102794","9.6987","0.0003","9.6933","0.0003","7.017","0.0002","90.637","0.003","89.172","0.003","120.136","0.002","570.46","0.04","","","","","","","","","","","","4","P -1","-P 1","2","","","","- Ca5 V3 O12 F -","- Ca10 F2 O24 V6 -","- Ca10 F2 O24 V6 -","","","LM5005","Baikie, T; Elcombe, M; Kim, J.Y; Mercier, P.H.J; Mitchell, L.D; White, T.J; Whitfield, P.S","Triclinic apatites","Acta Crystallographica, Section B","2007","63","2","251","256","10.1107/S0108768106053316","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2102795","9.6841","0.0005","9.6906","0.0005","6.9815","0.0003","90.623","0.003","88.869","0.003","120.371","0.003","565.15","0.05","","","","","","","","","","","Synthetic","4","P -1","-P 1","2","","","Svabite","- Ca5 As3 O12 F -","- As6 Ca10 F2 O24 -","- As6 Ca10 F2 O24 -","","","LM5005","Baikie, T; Elcombe, M; Kim, J.Y; Mercier, P.H.J; Mitchell, L.D; White, T.J; Whitfield, P.S","Triclinic apatites","Acta Crystallographica, Section B","2007","63","2","251","256","10.1107/S0108768106053316","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2102796","12.124","0.002","14.646","0.003","6.1585","0.0012","90","","97.38","0.03","90","","1084.5","0.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-bromobenzophenone","(4-bromophenyl)(phenyl)methanone","","- C13 H9 Br O -","- C13 H9 Br O -","- C52 H36 Br4 O4 -","4","1","RY5005","Strzhemechny, Mikhail A.; Baumer, Vyacheslav N.; Avdeenko, Anatoli A.; Pyshkin, Oleg S.; Romashkin, Roman V.; Buravtseva, Lyubov M.","Polymorphism of 4-bromobenzophenone","Acta Crystallographica Section B","2007","63","2","296","302","10.1107/S0108768106054334","","","0.71073","MoKα","","0.1091","0.0693","","","0.1875","0.228","","","","","","0.999","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102797","12.092","0.002","14.343","0.003","6.1243","0.0012","90","","97.26","0.03","90","","1053.7","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-bromobenzophenone","(4-bromophenyl)(phenyl)methanone","","- C13 H9 Br O -","- C13 H9 Br O -","- C52 H36 Br4 O4 -","4","1","RY5005","Strzhemechny, Mikhail A.; Baumer, Vyacheslav N.; Avdeenko, Anatoli A.; Pyshkin, Oleg S.; Romashkin, Roman V.; Buravtseva, Lyubov M.","Polymorphism of 4-bromobenzophenone","Acta Crystallographica Section B","2007","63","2","296","302","10.1107/S0108768106054334","","","0.71073","MoKα","","0.1088","0.0853","","","0.2491","0.2941","","","","","","1","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102798","6.1056","0.001","7.2931","0.0016","12.0999","0.0017","98.197","0.015","98.735","0.013","91.111","0.015","526.64","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","4-bromobenzophenone","(4-bromophenyl)(phenyl)methanone","","- C13 H9 Br O -","- C13 H9 Br O -","- C26 H18 Br2 O2 -","2","1","RY5005","Strzhemechny, Mikhail A.; Baumer, Vyacheslav N.; Avdeenko, Anatoli A.; Pyshkin, Oleg S.; Romashkin, Roman V.; Buravtseva, Lyubov M.","Polymorphism of 4-bromobenzophenone","Acta Crystallographica Section B","2007","63","2","296","302","10.1107/S0108768106054334","","","0.71073","MoKα","","0.0982","0.078","","","0.1883","0.2042","","","","","","1","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102799","8.515","0.002","11.69","0.002","7.595","0.002","90","","112.7","0.03","90","","697.4","0.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","cesium arsenate","cesium arsenate(V)","","- As3 Cs O8 -","- As3 Cs O8 -","- As12 Cs4 O32 -","4","0.5","SN5044","Schwendtner, Karolina; Kolitsch, Uwe","Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members","Acta Crystallographica Section B","2007","63","2","205","215","10.1107/S0108768106054942","","","0.71073","MoKα","","0.0225","0.0201","","","0.0526","0.0537","","","","","","1.034","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102800","5.154","0.001","6.967","0.001","7.532","0.002","63.9","0.03","78.61","0.03","84.35","0.03","238.08","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","potassium hydrogen arsenate","","","- As4 H3 K O12 -","- As4 H3 K O12 -","- As4 H3 K O12 -","1","0.5","SN5044","Schwendtner, Karolina; Kolitsch, Uwe","Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members","Acta Crystallographica Section B","2007","63","2","205","215","10.1107/S0108768106054942","","","0.71073","MoKα","","0.0328","0.0243","","","0.0531","0.0557","","","","","","1.117","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102801","6.051","0.001","9.727","0.002","9.054","0.002","90","","94.21","0.03","90","","531.46","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","potassium hydrogen arsenate","","","- As2 H K O6 -","- As2 H K O6 -","- As8 H4 K4 O24 -","4","1","SN5044","Schwendtner, Karolina; Kolitsch, Uwe","Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members","Acta Crystallographica Section B","2007","63","2","205","215","10.1107/S0108768106054942","","","0.71073","MoKα","","0.0191","0.0166","","","0.0419","0.0428","","","","","","1.124","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102802","9.666","0.002","8.553","0.002","9.97","0.002","90","","117.86","0.03","90","","728.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","lithium hydrogen arsenate","","","- As3 H2 Li O9 -","- As3 H2 Li O9 -","- As12 H8 Li4 O36 -","4","1","SN5044","Schwendtner, Karolina; Kolitsch, Uwe","Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members","Acta Crystallographica Section B","2007","63","2","205","215","10.1107/S0108768106054942","","","0.71073","MoKα","","0.0203","0.0169","","","0.0403","0.0413","","","","","","1.135","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102803","11.456","0.002","9.133","0.002","5.63","0.001","90","","115.56","0.03","90","","531.4","0.2","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","lithium hydrogen arsenate","","","- As4 H6 Li2 O14 -","- As4 H6 Li2 O14 -","- As8 H12 Li4 O28 -","2","0.25","SN5044","Schwendtner, Karolina; Kolitsch, Uwe","Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members","Acta Crystallographica Section B","2007","63","2","205","215","10.1107/S0108768106054942","","","0.71073","MoKα","","0.0198","0.0168","","","0.0396","0.0406","","","","","","1.14","","","","has coordinates","218928","2020-10-21","18:00:00",""
"2102804","5.169","0.001","7.036","0.001","7.766","0.002","63.31","0.03","79.87","0.03","84.38","0.03","248.36","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","rubidium hydrogen arsenate","","","- As4 H3 O12 Rb -","- As4 H3 O12 Rb -","- As4 H3 O12 Rb -","1","0.5","SN5044","Schwendtner, Karolina; Kolitsch, Uwe","Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members","Acta Crystallographica Section B","2007","63","2","205","215","10.1107/S0108768106054942","","","0.71073","MoKα","","0.0314","0.028","","","0.0746","0.0771","","","","","","1.044","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102805","7.162","0.001","7.678","0.002","7.88","0.002","110.72","0.03","106.47","0.03","105.43","0.03","354.8","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","silver hydrogen arsenate","","","- Ag As3 H2 O9 -","- Ag As3 H2 O9 -","- Ag2 As6 H4 O18 -","2","1","SN5044","Schwendtner, Karolina; Kolitsch, Uwe","Octahedral As in <i>M</i>^+^ arsenates ‒ architecture and seven new members","Acta Crystallographica Section B","2007","63","2","205","215","10.1107/S0108768106054942","","","0.71073","MoKα","","0.0315","0.0286","","","0.0716","0.0732","","","","","","1.091","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2102806","8.242","0.002","8.3027","0.0018","11.785","0.002","90","","90","","90","","806.5","0.3","299","2","299","2","","","","","","","","3","P b n m","-P 2c 2ab","62","","","","- Br3 Cs Eu -","- Br3 Cs Eu -","- Br12 Cs4 Eu4 -","4","0.5","WS5050","Ehrenberg, Helmut; Fuess, Hartmut; Hesse, Sabine; Zimmermann, Joerg; von Seggern, Heinz; Knapp, Michael","Structures of CsEuBr~3~ and its degradation product Cs~2~EuBr~5~·10H~2~O","Acta Crystallographica Section B","2007","63","2","201","204","10.1107/S0108768106049032","","","0.71073","MoKα","","0.1482","0.0393","","","0.0788","0.0917","","","","","","0.825","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102807","8.047","0.002","13.998","0.003","19.558","0.002","90","","90","","90","","2203.1","0.8","299","2","299","2","","","","","","","","5","P b c m","-P 2c 2b","57","","","","- Br5 Cs2 Eu H20 O10 -","- Br5 Cs2 Eu H20 O10 -","- Br20 Cs8 Eu4 H80 O40 -","4","0.5","WS5050","Ehrenberg, Helmut; Fuess, Hartmut; Hesse, Sabine; Zimmermann, Joerg; von Seggern, Heinz; Knapp, Michael","Structures of CsEuBr~3~ and its degradation product Cs~2~EuBr~5~·10H~2~O","Acta Crystallographica Section B","2007","63","2","201","204","10.1107/S0108768106049032","","","0.71073","MoKα","","0.1504","0.0542","","","0.0795","0.0978","","","","","","0.928","","","","has coordinates","203508","2020-10-21","18:00:00",""
"2102808","10.6031","","11.5968","","5.5032","","97.879","","103.891","","71.457","","621.434","","300","","300","2","","","","","","","","4","P -1","-P 1","2","","5-anilinomethylene-2,2-dimethyl-1,3-dioxane-4,6-dione","","- C13 H13 N O4 -","- C13 H13 N O4 -","- C26 H26 N2 O8 -","2","1","AV5081","Ľubomír Smrčok; Vladimír Jorík; Eva Scholtzovaá; Viktor Milata","<i>Ab initio</i> structure determination of 5-anilinomethylene-2,2-dimethyl-1,3-dioxane-4,6-dione from laboratory powder data ‒ a combined use of X-ray, molecular and solid-state DFT study","Acta Crystallographica Section B","2007","63","3","477","484","10.1107/S0108768107006568","","","1.78892","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102809","4.934","0.003","9.955","0.006","10.854","0.009","90","","97.44","0.01","90","","528.6","0.6","300","","300","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Bis(glycinium) oxalate","","","- C6 H12 N2 O8 -","- C6 H12 N2 O8 -","- C12 H24 N4 O16 -","2","0.5","AV5084","Chitra, R.; Choudhury, R. R","Investigation of hydrogen-bond network in bis(glycinium) oxalate using single-crystal neutron diffraction and spectroscopic studies","Acta Crystallographica Section B","2007","63","3","497","504","10.1107/S0108768107016965","","neutron","0.995","neutron","","0.1016","0.0573","","","0.1392","0.1802","","","","","","1.089","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2102810","5.4876","0.0016","10.021","0.003","13.868","0.004","109.079","0.005","94.378","0.005","94.538","0.005","714.2","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","DL-arginine DL-tartaric acid complex","","- C10 H20 N4 O8 -","- C10 H20 N4 O8 -","- C20 H40 N8 O16 -","2","1","BK5044","Selvaraj, M.; Thamotharan, S.; Roy, Siddhartha; Vijayan, M.","X-ray studies of crystalline complexes involving amino acids and peptides. XLIV. Invariant features of supramolecular association and chiral effects in the complexes of arginine and lysine with tartaric acid","Acta Crystallographica Section B","2007","63","3","459","468","10.1107/S010876810701107X","","","0.71073","MoKα","","0.1123","0.0622","","","0.1124","0.1323","","","","","","1.067","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102811","9.907","0.002","8.7428","0.0018","14.076","0.003","90","","109.412","0.003","90","","1149.9","0.4","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-arginine L-tartaric acid complex","","- C16 H34 N8 O10 -","- C16 H34 N8 O10 -","- C32 H68 N16 O20 -","2","1","BK5044","Selvaraj, M.; Thamotharan, S.; Roy, Siddhartha; Vijayan, M.","X-ray studies of crystalline complexes involving amino acids and peptides. XLIV. Invariant features of supramolecular association and chiral effects in the complexes of arginine and lysine with tartaric acid","Acta Crystallographica Section B","2007","63","3","459","468","10.1107/S010876810701107X","","","0.71073","MoKα","","0.0358","0.0339","","","0.0868","0.0881","","","","","","1.064","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102812","10.087","0.003","23.003","0.008","9.414","0.003","90","","90.82","0.007","90","","2184.1","1.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","DL-lysine DL-tartaric acid monohydrate complex","","- C16 H36 N4 O11 -","- C16 H34 N4 O11 -","- C64 H136 N16 O44 -","4","1","BK5044","Selvaraj, M.; Thamotharan, S.; Roy, Siddhartha; Vijayan, M.","X-ray studies of crystalline complexes involving amino acids and peptides. XLIV. Invariant features of supramolecular association and chiral effects in the complexes of arginine and lysine with tartaric acid","Acta Crystallographica Section B","2007","63","3","459","468","10.1107/S010876810701107X","","","0.71073","MoKα","","0.0947","0.0706","","","0.1991","0.2181","","","","","","1.101","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102813","5.1849","0.0011","16.667","0.004","7.6701","0.0017","90","","96.366","0.004","90","","658.7","0.3","2983","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-lysine D-hydrogen tartrate","","- C10 H20 N2 O8 -","- C10 H20 N2 O8 -","- C20 H40 N4 O16 -","2","1","BK5044","Selvaraj, M.; Thamotharan, S.; Roy, Siddhartha; Vijayan, M.","X-ray studies of crystalline complexes involving amino acids and peptides. XLIV. Invariant features of supramolecular association and chiral effects in the complexes of arginine and lysine with tartaric acid","Acta Crystallographica Section B","2007","63","3","459","468","10.1107/S010876810701107X","","","0.71073","MoKα","","0.0459","0.0401","","","0.0879","0.0902","","","","","","1.126","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102814","5.1022","0.0011","17.444","0.004","7.547","0.002","90","","97.748","0.004","90","","665.6","0.3","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-lysine L-hydrogen tartrate","","- C10 H20 N2 O8 -","- C10 H20 N2 O8 -","- C20 H40 N4 O16 -","2","1","BK5044","Selvaraj, M.; Thamotharan, S.; Roy, Siddhartha; Vijayan, M.","X-ray studies of crystalline complexes involving amino acids and peptides. XLIV. Invariant features of supramolecular association and chiral effects in the complexes of arginine and lysine with tartaric acid","Acta Crystallographica Section B","2007","63","3","459","468","10.1107/S010876810701107X","","","0.71073","MoKα","","0.0508","0.0482","","","0.1144","0.116","","","","","","1.132","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102815","10.0748","0.0005","6.6473","0.0003","11.2997","0.0006","90","","107.189","0.003","90","","722.94","0.06","289","2","289","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C2 H2 Cs2 O5 -","- C2 H2 Cs2 O5 -","- C8 H8 Cs8 O20 -","4","0.5","BK5052","Weller, Mark T.; Henry, Paul F.; Light, Mark E.","Rapid structure determination of the hydrogen-containing compound Cs~2~C~2~O~4~·H~2~O by joint single-crystal X-ray and powder neutron diffraction","Acta Crystallographica Section B","2007","63","3","426","432","10.1107/S0108768107014826","","","0.71073","MoKα","","0.0314","0.0249","","","0.0513","0.0536","","","","","","1.168","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102816","10.1127","0.0005","6.6535","0.0004","11.3257","0.0006","90","","107.19","0.004","90","","728","0.08","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C2 H2 Cs2 O5 -","- C2 H2 Cs2 O5 -","- C8 H8 Cs8 O20 -","4","0.5","BK5052","Weller, Mark T.; Henry, Paul F.; Light, Mark E.","Rapid structure determination of the hydrogen-containing compound Cs~2~C~2~O~4~·H~2~O by joint single-crystal X-ray and powder neutron diffraction","Acta Crystallographica Section B","2007","63","3","426","432","10.1107/S0108768107014826","","","1.36","","","","","","","","","","","1.44","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102817","10.075","0.005","6.6473","0.0003","11.2997","0.0006","90","","107.189","0.003","90","","722.9","0.4","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C2 H2 Cs2 O5 -","- C2 H2 Cs2 O5 -","- C8 H8 Cs8 O20 -","4","0.5","BK5052","Weller, Mark T.; Henry, Paul F.; Light, Mark E.","Rapid structure determination of the hydrogen-containing compound Cs~2~C~2~O~4~·H~2~O by joint single-crystal X-ray and powder neutron diffraction","Acta Crystallographica Section B","2007","63","3","426","432","10.1107/S0108768107014826","","","","","","","","","","","","","","1.82","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102818","10.1125","0.0006","6.6535","0.0004","11.3255","0.0007","90","","107.191","0.004","90","","727.98","0.09","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C2 H2 Cs2 O5 -","- C2 H2 Cs2 O5 -","- C8 H8 Cs8 O20 -","4","0.5","BK5052","Weller, Mark T.; Henry, Paul F.; Light, Mark E.","Rapid structure determination of the hydrogen-containing compound Cs~2~C~2~O~4~·H~2~O by joint single-crystal X-ray and powder neutron diffraction","Acta Crystallographica Section B","2007","63","3","426","432","10.1107/S0108768107014826","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102819","8.1711","0.001","10.9972","0.0012","9.4601","0.0011","90","","91.575","0.005","90","","849.76","0.17","150","1","150","1","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Cyclamic acid","N-Cyclohexylsulfamic acid","","- C6 H13 N O3 S -","- C6 H13 N O3 S -","- C24 H52 N4 O12 S4 -","4","1","BM5046","Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto","Structures of artificial sweeteners ‒ cyclamic acid and sodium cyclamate with other cyclamates","Acta Crystallographica Section B","2007","63","3","418","425","10.1107/S0108768107013961","","","0.71073","MoKα","","0.0439","0.0338","","","0.0812","0.0904","","","","","","1.123","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102820","31.083","0.006","6.2718","0.0014","8.5682","0.0017","90","","94.481","0.01","90","","1665.2","0.6","150","1","150","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Sodium cyclamate","Sodium N-cyclohexylsulfamate","","- C6 H12 N Na O3 S -","- C6 H12 N Na O3 S -","- C48 H96 N8 Na8 O24 S8 -","8","1","BM5046","Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto","Structures of artificial sweeteners ‒ cyclamic acid and sodium cyclamate with other cyclamates","Acta Crystallographica Section B","2007","63","3","418","425","10.1107/S0108768107013961","","","0.71073","MoKα","","0.0741","0.0533","","","0.1189","0.1296","","","","","","1.065","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102821","33.656","0.008","6.274","0.003","8.572","0.004","90","","93.35","0.01","90","","1807","1.3","150","1","150","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Potassium cyclamate","Potassium N-cyclohexylsulfamate","","- C6 H12 K N O3 S -","- C6 H12 K N O3 S -","- C48 H96 K8 N8 O24 S8 -","8","1","BM5046","Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto","Structures of artificial sweeteners ‒ cyclamic acid and sodium cyclamate with other cyclamates","Acta Crystallographica Section B","2007","63","3","418","425","10.1107/S0108768107013961","","","0.71073","MoKα","","0.0535","0.0372","","","0.0828","0.09","","","","","","1.067","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102822","33.6671","0.0019","6.4571","0.0012","8.7572","0.0015","90","","92.961","0.002","90","","1901.2","0.5","150","1","150","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Ammonium cyclamate","Ammonium N-cyclohexylsulfamate","","- C6 H16 N2 O3 S -","- C6 H16 N2 O3 S -","- C48 H128 N16 O24 S8 -","8","1","BM5046","Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto","Structures of artificial sweeteners ‒ cyclamic acid and sodium cyclamate with other cyclamates","Acta Crystallographica Section B","2007","63","3","418","425","10.1107/S0108768107013961","","","0.71073","MoKα","","0.0594","0.0415","","","0.0791","0.091","","","","","","1.203","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102823","34.039","0.005","6.451","0.002","8.811","0.002","90","","92.67","0.01","90","","1932.7","0.8","293","1","293","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Rubidium cyclamate","Rubidium N-cyclohexylsulfamate","","- C6 H12 N O3 Rb S -","- C6 H12 N O3 Rb S -","- C48 H96 N8 O24 Rb8 S8 -","8","1","BM5046","Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto","Structures of artificial sweeteners ‒ cyclamic acid and sodium cyclamate with other cyclamates","Acta Crystallographica Section B","2007","63","3","418","425","10.1107/S0108768107013961","","","0.71073","MoKα","","0.0275","0.0237","","","0.0581","0.0598","","","","","","1.101","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102824","10.951","0.0011","13.5112","0.0012","14.6202","0.0015","90","","99.425","0.005","90","","2134","0.4","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Tetra-n-propylammonium cyclamate","Tetra-n-propylammonium N-cyclohexylsulfamate","","- C18 H40 N2 O3 S -","- C18 H40 N2 O3 S -","- C72 H160 N8 O12 S4 -","4","1","BM5046","Leban, Ivan; Rudan-Tasic, Darja; Lah, Nina; Klofutar, Cveto","Structures of artificial sweeteners ‒ cyclamic acid and sodium cyclamate with other cyclamates","Acta Crystallographica Section B","2007","63","3","418","425","10.1107/S0108768107013961","","","0.71073","MoKα","","0.0615","0.0414","","","0.1152","0.1314","","","","","","1.061","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102825","4.2021","0.0003","21.0409","0.0013","14.3803","0.0009","90","","96.248","0.001","90","","1263.9","0.14","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","(E)-2-bromobenzaldehyde 4-cyanophenylhydrazone","","- C14 H10 Br N3 -","- C14 H10 Br N3 -","- C56 H40 Br4 N12 -","4","1","GP5015","Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.","Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones","Acta Crystallographica Section B","2007","63","3","485","496","10.1107/S0108768107018034","","","0.71073","MoKα","","0.0288","0.0258","","","0.0598","0.0613","","","","","","1.041","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102826","4.4902","0.0004","19.9376","0.0017","14.3182","0.0012","90","","92.884","0.001","90","","1280.2","0.19","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","(E)-4-cyanobenzaldehyde 2-bromophenylhydrazone","","- C14 H10 Br N3 -","- C14 H10 Br N3 -","- C56 H40 Br4 N12 -","4","1","GP5015","Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.","Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones","Acta Crystallographica Section B","2007","63","3","485","496","10.1107/S0108768107018034","","","0.71073","MoKα","","0.0254","0.0237","","","0.0525","0.0533","","","","","","1.062","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102827","9.6046","0.0006","7.7953","0.0005","17.2756","0.0011","90","","104.316","0.001","90","","1253.27","0.14","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(2-trifluoromethylbenzylidene)-2-methylaniline","","- C15 H12 F3 N -","- C15 H12 F3 N -","- C60 H48 F12 N4 -","4","1","GP5015","Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.","Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones","Acta Crystallographica Section B","2007","63","3","485","496","10.1107/S0108768107018034","","","0.71073","MoKα","","0.035","0.0322","","","0.0821","0.084","","","","","","1.047","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102828","9.7556","0.0006","7.8003","0.0005","16.8794","0.0011","90","","102.647","0.001","90","","1253.3","0.14","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(2-methylbenzylidene)-2-trifluoromethylaniline","","- C15 H12 F3 N -","- C15 H12 F3 N -","- C60 H48 F12 N4 -","4","1","GP5015","Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.","Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones","Acta Crystallographica Section B","2007","63","3","485","496","10.1107/S0108768107018034","","","0.71073","MoKα","","0.0335","0.0284","","","0.0722","0.0752","","","","","","1.042","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102829","13.4669","0.001","11.7471","0.0009","14.9271","0.0011","90","","90","","90","","2361.4","0.3","173","2","173","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","N-(2-bromobenzylidene)-2-methylaniline","","- C14 H12 Br N -","- C14 H12 Br N -","- C112 H96 Br8 N8 -","8","1","GP5015","Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.","Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones","Acta Crystallographica Section B","2007","63","3","485","496","10.1107/S0108768107018034","","","0.71073","MoKα","","0.0345","0.0273","","","0.06","0.0625","","","","","","1.102","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102830","13.355","0.0012","11.6667","0.0011","14.9529","0.0014","90","","90","","90","","2329.8","0.4","173","2","173","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","N-(2-methylbenzylidene)-2-bromoaniline","","- C14 H12 Br N -","- C14 H12 Br N -","- C112 H96 Br8 N8 -","8","1","GP5015","Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.","Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones","Acta Crystallographica Section B","2007","63","3","485","496","10.1107/S0108768107018034","","","0.71073","MoKα","","0.0345","0.0292","","","0.0653","0.0673","","","","","","1.129","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102831","6.1535","0.0009","7.199","0.001","26.253","0.004","90","","92.285","0.002","90","","1162.1","0.3","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","N-(4-methylbenzylidene)-4-cyanoaniline","","- C15 H12 N2 -","- C15 H12 N2 -","- C60 H48 N8 -","4","1","GP5015","Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.","Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones","Acta Crystallographica Section B","2007","63","3","485","496","10.1107/S0108768107018034","","","0.71073","MoKα","","0.0467","0.0369","","","0.0884","0.0931","","","","","","1.062","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102832","6.1878","0.0012","7.3785","0.0015","25.895","0.005","90","","94.635","0.003","90","","1178.4","0.4","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","N-(4-cyanobenzylidene)-4-methylaniline","","- C15 H12 N2 -","- C15 H12 N2 -","- C60 H48 N8 -","4","1","GP5015","Ojala, William H.; Smieja, Jonathan M.; Spude, Jill M.; Arola, Trina M.; Kuspa, Marika K.; Herrera, Nell; Ojala, Charles R.","Isostructuralism among `bridge-flipped' isomeric benzylideneanilines and phenylhydrazones","Acta Crystallographica Section B","2007","63","3","485","496","10.1107/S0108768107018034","","","0.71073","MoKα","","0.0766","0.0649","","","0.1781","0.1861","","","","","","1.074","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102833","19.0356","0.0006","17.4332","0.0006","17.418","0.0006","90","","113.824","0.003","90","","5287.7","0.3","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H62 Cu N4 O14 S2 -","- C56 H62 Cu N4 O14 S2 -","- C224 H248 Cu4 N16 O56 S8 -","4","1","KD5008","Dorokhov, Andrey V.; Chernyshov, Dmitrii Yu.; Burlov, Anatolii S.; Garnovskii, Alexandr D.; Ivanova, Irina S.; Pyatova, Elena N.; Tsivadze, Aslan Yu.; Aslanov, Leonid A.; Chernyshev, Vladimir V.","Synchrotron powder diffraction in a systematic study of 4'-[2-(tosylamino)benzylideneamino]-2,3-benzo-15-crown-5 complexes","Acta Crystallographica Section B","2007","63","3","402","410","10.1107/S0108768107003898","","","0.51966","synchrotron","","","","","","","","","","1.304","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102834","9.2918","0.0003","23.0117","0.0007","15.2798","0.0005","90","","108.063","0.002","90","","3106.11","0.17","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H32 Li N3 O7 S2 -","- C29 H32 Li N3 O7 S2 -","- C116 H128 Li4 N12 O28 S8 -","4","1","KD5008","Dorokhov, Andrey V.; Chernyshov, Dmitrii Yu.; Burlov, Anatolii S.; Garnovskii, Alexandr D.; Ivanova, Irina S.; Pyatova, Elena N.; Tsivadze, Aslan Yu.; Aslanov, Leonid A.; Chernyshev, Vladimir V.","Synchrotron powder diffraction in a systematic study of 4'-[2-(tosylamino)benzylideneamino]-2,3-benzo-15-crown-5 complexes","Acta Crystallographica Section B","2007","63","3","402","410","10.1107/S0108768107003898","","","0.52","synchrotron","","","","","","","","","","1.98","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102835","4.97","0.0002","12.7506","0.0007","15.0499","0.0008","90","","92.293","0.004","90","","952.96","0.08","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Guaninium phosphite monohydrate","","","- C5 H10 N5 O5 P -","- C5 H10 N5 O5 P -","- C20 H40 N20 O20 P4 -","4","1","LB5008","Bendeif, El-Eulmi; Dahaoui, Slimane; Benali-Cherif, Nourredine; Lecomte, Claude","Tautomerism and hydrogen bonding in guaninium phosphite and guaninium phosphate salts","Acta Crystallographica Section B","2007","63","3","448","458","10.1107/S0108768107005332","","","0.71073","MoKα","","0.0434","0.043","","","0.1047","0.1052","","","","","","1.147","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102836","4.6812","0.0004","24.0561","0.0015","9.5186","0.0007","90","","99.773","0.007","90","","1056.35","0.14","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Guaninium phosphite bihydrate","","","- C5 H12 N5 O6 P -","- C5 H12 N5 O6 P -","- C20 H48 N20 O24 P4 -","4","1","LB5008","Bendeif, El-Eulmi; Dahaoui, Slimane; Benali-Cherif, Nourredine; Lecomte, Claude","Tautomerism and hydrogen bonding in guaninium phosphite and guaninium phosphate salts","Acta Crystallographica Section B","2007","63","3","448","458","10.1107/S0108768107005332","","","0.71073","MoKα","","0.0428","0.0399","","","0.0957","0.0975","","","","","","1.166","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102837","4.5414","0.0003","12.5774","0.0006","18.1485","0.0009","90","","93.689","0.005","90","","1034.48","0.1","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Guaninium phosphate monohydrate","","","- C5 H10 N5 O6 P -","- C5 H10 N5 O6 P -","- C20 H40 N20 O24 P4 -","4","1","LB5008","Bendeif, El-Eulmi; Dahaoui, Slimane; Benali-Cherif, Nourredine; Lecomte, Claude","Tautomerism and hydrogen bonding in guaninium phosphite and guaninium phosphate salts","Acta Crystallographica Section B","2007","63","3","448","458","10.1107/S0108768107005332","","","0.71073","MoKα","","0.043","0.0422","","","0.1061","0.107","","","","","","1.11","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102838","6.762","0.0001","13.8016","0.0003","7.6878","0.0002","90","","124.089","0.001","90","","594.19","0.02","298","","","","","","","","","","Jadar basin, Serbia","6","P 1 21/c 1","-P 2ybc","14","","","Jadarite","- B3 H Li Na O8 Si -","- B3 H Li Na O8 Si -","- B12 H4 Li4 Na4 O32 Si4 -","4","1","LM5008","Whitfield, Pamela S.; Le Page, Yvon; Grice, Joel D.; Stanley, Chris J.; Jones, Gary C.; Rumsey, Michael S.; Blake, Chris; Roberts, Andrew C.; Stirling, John A. R.; Carpenter, Gordon J. C.","LiNaSiB~3~O~7~(OH) – novel structure of the new borosilicate mineral jadarite determined from laboratory powder diffraction data","Acta Crystallographica Section B","2007","63","3","396","401","10.1107/S0108768107010130","","","1.5418","CuKα","","","","","","","","","","1.27","","","","","","","has coordinates","282548","2023-04-10","20:38:56",""
"2102839","3.7191","0.0002","3.7191","0.0002","5.3057","0.0004","90","","90","","90","","73.387","0.008","296","0.1","296","0.1","","","","","","","","3","P 42/n m c :1","P 4n 2n -1n","137","cerium zirconiuim oxide","cerium zirconiuim oxide","","- Ce0.5 O2 Zr0.5 -","- Ce0.4943 Hf0.0035 O2 Zr0.5022 -","- Ce0.9886 Hf0.007 O4 Zr1.0044 -","2","0.125","OG5020","Wakita, Takahiro; Yashima, Masatomo","<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study","Acta Crystallographica Section B","2007","63","3","384","389","10.1107/S0108768107007720","","neutron","1.8143","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102840","3.7286","0.0002","3.7286","0.0002","5.3215","0.0004","90","","90","","90","","73.982","0.008","507","3","507","3","","","","","","","","3","P 42/n m c :1","P 4n 2n -1n","137","cerium zirconiuim oxide","cerium zirconiuim oxide","","- Ce0.5 O2 Zr0.5 -","- Ce0.4943 Hf0.0035 O2 Zr0.5022 -","- Ce0.9886 Hf0.007 O4 Zr1.0044 -","2","0.125","OG5020","Wakita, Takahiro; Yashima, Masatomo","<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study","Acta Crystallographica Section B","2007","63","3","384","389","10.1107/S0108768107007720","","neutron","1.8143","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102841","3.7386","0.0003","3.7386","0.0003","5.3381","0.0004","90","","90","","90","","74.611","0.01","772","2","772","2","","","","","","","","3","P 42/n m c :1","P 4n 2n -1n","137","cerium zirconiuim oxide","cerium zirconiuim oxide","","- Ce0.5 O2 Zr0.5 -","- Ce0.4943 Hf0.0035 O2 Zr0.5022 -","- Ce0.9886 Hf0.007 O4 Zr1.0044 -","2","0.125","OG5020","Wakita, Takahiro; Yashima, Masatomo","<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study","Acta Crystallographica Section B","2007","63","3","384","389","10.1107/S0108768107007720","","neutron","1.8143","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102842","3.7503","0.0003","3.7503","0.0003","5.3564","0.0005","90","","90","","90","","75.336","0.011","1034","3","1034","3","","","","","","","","3","P 42/n m c :1","P 4n 2n -1n","137","cerium zirconiuim oxide","cerium zirconiuim oxide","","- Ce0.5 O2 Zr0.5 -","- Ce0.4943 Hf0.0035 O2 Zr0.5022 -","- Ce0.9886 Hf0.007 O4 Zr1.0044 -","2","0.125","OG5020","Wakita, Takahiro; Yashima, Masatomo","<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study","Acta Crystallographica Section B","2007","63","3","384","389","10.1107/S0108768107007720","","neutron","1.8143","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102843","3.764","0.0003","3.764","0.0003","5.3745","0.0005","90","","90","","90","","76.144","0.011","1291","3","1291","3","","","","","","","","3","P 42/n m c :1","P 4n 2n -1n","137","cerium zirconiuim oxide","cerium zirconiuim oxide","","- Ce0.5 O2 Zr0.5 -","- Ce0.4943 Hf0.0035 O2 Zr0.5022 -","- Ce0.9886 Hf0.007 O4 Zr1.0044 -","2","0.125","OG5020","Wakita, Takahiro; Yashima, Masatomo","<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study","Acta Crystallographica Section B","2007","63","3","384","389","10.1107/S0108768107007720","","neutron","1.8143","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102844","3.7781","0.0004","3.7781","0.0004","5.3833","0.0007","90","","90","","90","","76.841","0.015","1542","2","1542","2","","","","","","","","3","P 42/n m c :1","P 4n 2n -1n","137","cerium zirconiuim oxide","cerium zirconiuim oxide","","- Ce0.5 O2 Zr0.5 -","- Ce0.4943 Hf0.0035 O2 Zr0.5022 -","- Ce0.9886 Hf0.007 O4 Zr1.0044 -","2","0.125","OG5020","Wakita, Takahiro; Yashima, Masatomo","<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study","Acta Crystallographica Section B","2007","63","3","384","389","10.1107/S0108768107007720","","neutron","1.8143","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102845","5.3848","0.0007","5.3848","0.0007","5.3848","0.0007","90","","90","","90","","156.14","0.04","1831","1","1831","1","","","","","","","","3","F m -3 m","-F 4 2 3","225","cerium zirconiuim oxide","cerium zirconiuim oxide","","- Ce0.5 O2 Zr0.5 -","- Ce0.4943 Hf0.0035 O2 Zr0.5022 -","- Ce1.9772 Hf0.014 O8 Zr2.0088 -","4","0.0208333","OG5020","Wakita, Takahiro; Yashima, Masatomo","<i>In situ</i> observation of the tetragonal‒cubic phase transition in the CeZrO~4~ solid solution ‒ a high-temperature neutron diffraction study","Acta Crystallographica Section B","2007","63","3","384","389","10.1107/S0108768107007720","","neutron","1.8143","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102846","9.948","0.0002","7.9637","0.0002","4.9826","0.0001","90","","83.13","0.01","90","","391.902","0.017","100","","100","","","","","","","","","5","P 1 21 1","P 2yb","4","L-ornithine Hydrochloride","","","- C5 H13 Cl N2 O2 -","- C5 H13 Cl N2 O2 -","- C10 H26 Cl2 N4 O4 -","2","1","SN5050","Dittrich, B.; Munshi, P.; Spackman, M. A.","Redetermination, invariom-model and multipole refinement of <small>L</small>-ornithine hydrochloride","Acta Crystallographica Section B","2007","63","3","505","509","10.1107/S0108768107014838","","","0.7107","MoKα","","0.0157","0.0136","","","","0.0089","","","","","","1.7983","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2102847","6.0932","0.0005","6.0932","","6.0932","","90","","90","","90","","226.22","0.03","87","","87","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Bi1.6 Ge1.6 Te4 -","- Bi1.588 Ge1.588 Te4 -","- Bi1.588 Ge1.588 Te4 -","1","0.00520833","SO5005","Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kifune, Kouichi; Kubota, Yoshiki; Takata, Masaki","Crystal structures of stable and metastable Ge~2~Bi~2~Te~5~, an intermetallic compound in a GeTe-Bi~2~Te~3~ pseudobinary system","Acta Crystallographica, Section B","2007","63","2","346","352","10.1107/S0108768107000778","","","0.42182","synchrotron","","","","","","","","","","0.66","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102848","6.1109","0.0009","6.1109","","6.1109","","90","","90","","90","","228.2","0.06","293","","293","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Bi1.6 Ge1.6 Te4 -","- Bi1.562 Ge1.564 Te4 -","- Bi1.562 Ge1.564 Te4 -","1","0.00520833","SO5005","Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kifune, Kouichi; Kubota, Yoshiki; Takata, Masaki","Crystal structures of stable and metastable Ge~2~Bi~2~Te~5~, an intermetallic compound in a GeTe-Bi~2~Te~3~ pseudobinary system","Acta Crystallographica, Section B","2007","63","2","346","352","10.1107/S0108768107000778","","","0.42182","synchrotron","","","","","","","","","","0.62","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102849","4.28072","0.00012","4.28072","","17.2651","0.0006","90","","90","","120","","273.99","0.01","87","","87","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","","- Bi2 Ge2 Te5 -","- Bi2 Ge2.0002 Te5 -","- Bi2 Ge2.0002 Te5 -","1","0.0833333","SO5005","Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kifune, Kouichi; Kubota, Yoshiki; Takata, Masaki","Crystal structures of stable and metastable Ge~2~Bi~2~Te~5~, an intermetallic compound in a GeTe-Bi~2~Te~3~ pseudobinary system","Acta Crystallographica, Section B","2007","63","2","346","352","10.1107/S0108768107000778","","","0.42182","synchrotron","","","","","","","","","","0.74","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102850","4.3004","0.00013","4.3004","","17.3659","0.0006","90","","90","","120","","278.13","0.02","293","","87","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","","- Bi2 Ge2 Te5 -","- Bi2 Ge2 Te5 -","- Bi2 Ge2 Te5 -","1","0.0833333","SO5005","Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kifune, Kouichi; Kubota, Yoshiki; Takata, Masaki","Crystal structures of stable and metastable Ge~2~Bi~2~Te~5~, an intermetallic compound in a GeTe-Bi~2~Te~3~ pseudobinary system","Acta Crystallographica, Section B","2007","63","2","346","352","10.1107/S0108768107000778","","","0.42206","synchrotron","","","","","","","","","","1.73","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102851","23.2312","0.0013","4.975","0.0004","15.484","0.002","90","","112.53","0.01","90","","1653","0.3","90","2","90","0.2","","","","","","","","3","C 1 2 1","C 2y","5","'cis-2,3-tetralindiol trans-2,3-tetralindiol","cis-1,2,3,4-tetrahydro-2,3-naphthalenediol trans-1,2,3,4-tetrahydro-2,3-naphthalenediol","","- C20 H22 O4 -","- C20 H22 O4 -","- C80 H88 O16 -","4","1","WS5054","Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt","Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol","Acta Crystallographica Section B","2007","63","3","433","447","10.1107/S0108768107010579","","","1.54178","CuKα","","0.0816","0.0793","","","0.2273","0.2292","","","","","","1.179","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102852","8.545","0.002","7.588","0.001","19.717","0.004","90","","90","","90","","1278.4","0.4","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","cis-1,2-cyclohexanediol","","- C6 H12 O2 -","- C6 H12 O2 -","- C48 H96 O16 -","8","1","WS5054","Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt","Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol","Acta Crystallographica Section B","2007","63","3","433","447","10.1107/S0108768107010579","","","0.71073","MoKα","","0.0621","0.0466","","","0.095","0.1005","","","","","","1.137","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102853","5.8751","0.0002","27.9972","0.0008","5.0132","0.0002","90","","94.528","0.001","90","","822.03","0.05","90","2","90","0.2","","","","","","","","3","P 1 21 1","P 2yb","4","(S,S)-2,3-tetralindiol","1,2,3,4-tetrahydro-(S,S)-2,3-naphthalenediol","","- C10 H12 O2 -","- C10 H12 O2 -","- C40 H48 O8 -","4","2","WS5054","Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt","Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol","Acta Crystallographica Section B","2007","63","3","433","447","10.1107/S0108768107010579","","","1.54178","CuKα","","0.036","0.036","","","0.0873","0.0873","","","","","","1.12","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102854","5.877","0.001","28.029","0.004","5.015","0.001","90","","94.51","0.01","90","","823.5","0.2","110","2","110","2","","","","","","","","3","P 1 21 1","P 2yb","4","(S,S)-2,3-tetralindiol","1,2,3,4-tetrahydro-(S,S)-2,3-naphthalenediol","","- C10 H12 O2 -","- C10 H12 O2 -","- C40 H48 O8 -","4","2","WS5054","Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt","Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol","Acta Crystallographica Section B","2007","63","3","433","447","10.1107/S0108768107010579","","","0.71073","MoKα","","0.0456","0.0347","","","0.0673","0.0713","","","","","","1.063","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102855","5.886","0.001","28.108","0.004","5.029","0.001","90","","94.35","0.01","90","","829.6","0.2","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","(S,S)-2,3-tetralindiol","1,2,3,4-tetrahydro-(S,S)-2,3-naphthalenediol","","- C10 H12 O2 -","- C10 H12 O2 -","- C40 H48 O8 -","4","2","WS5054","Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt","Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol","Acta Crystallographica Section B","2007","63","3","433","447","10.1107/S0108768107010579","","","0.71073","MoKα","","0.0549","0.0394","","","0.0725","0.078","","","","","","1.062","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102856","8.617","0.001","7.693","0.001","19.695","0.003","90","","90","","90","","1305.6","0.3","299","2","299","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","cis-1,2-cyclohexanediol","","- C6 H12 O2 -","- C6 H12 O2 -","- C48 H96 O16 -","8","1","WS5054","Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt","Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol","Acta Crystallographica Section B","2007","63","3","433","447","10.1107/S0108768107010579","","","0.71073","MoKα","","0.0711","0.0404","","","0.0789","0.0875","","","","","","1.053","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102857","8.415","0.001","7.799","0.001","19.295","0.002","90","","90","","90","","1266.3","0.3","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","rac-trans-1,2-cyclohexanediol","","- C6 H12 O2 -","- C6 H12 O2 -","- C48 H96 O16 -","8","1","WS5054","Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt","Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol","Acta Crystallographica Section B","2007","63","3","433","447","10.1107/S0108768107010579","","","0.71073","MoKα","","0.0384","0.0341","","","0.083","0.0859","","","","","","1.077","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102858","8.491","0.001","7.893","0.001","19.331","0.002","90","","90","","90","","1295.6","0.3","299","2","299","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","rac-trans-1,2-cyclohexanediol","","- C6 H12 O2 -","- C6 H12 O2 -","- C48 H96 O16 -","8","1","WS5054","Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt","Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol","Acta Crystallographica Section B","2007","63","3","433","447","10.1107/S0108768107010579","","","0.71073","MoKα","","0.0477","0.0362","","","0.0832","0.0895","","","","","","1.05","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102859","18.321","0.003","10.015","0.002","7.201","0.002","90","","95.28","0.02","90","","1315.7","0.5","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","rac-trans-1,2-cyclohexanediol","","- C6 H12 O2 -","- C6 H12 O2 -","- C48 H96 O16 -","8","1","WS5054","Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt","Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol","Acta Crystallographica Section B","2007","63","3","433","447","10.1107/S0108768107010579","","","0.71073","MoKα","","0.0504","0.0389","","","0.0945","0.1018","","","","","","1.054","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102860","18.578","0.005","10.007","0.003","7.272","0.002","90","","96.32","0.02","90","","1343.7","0.7","299","2","299","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","rac-trans-1,2-cyclohexanediol","","- C6 H12 O2 -","- C6 H12 O2 -","- C48 H96 O16 -","8","1","WS5054","Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt","Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol","Acta Crystallographica Section B","2007","63","3","433","447","10.1107/S0108768107010579","","","0.71073","MoKα","","0.0684","0.0474","","","0.1168","0.1276","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102861","10.183","0.001","10.183","0.001","10.796","0.001","90","","90","","120","","969.49","0.16","173","2","173","2","","","","","","","","3","P 32 2 1","P 32 2""","154","","R,R-1,2-cyclohexanediol","","- C6 H12 O2 -","- C6 H12 O2 -","- C36 H72 O12 -","6","1","WS5054","Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt","Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol","Acta Crystallographica Section B","2007","63","3","433","447","10.1107/S0108768107010579","","","0.71073","MoKα","","0.0398","0.0331","","","0.0713","0.0755","","","","","","1.082","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102862","10.229","0.001","10.229","0.001","10.909","0.001","90","","90","","120","","988.51","0.16","293","2","293","2","","","","","","","","3","P 32 2 1","P 32 2""","154","","R,R-1,2-cyclohexanediol","","- C6 H12 O2 -","- C6 H12 O2 -","- C36 H72 O12 -","6","1","WS5054","Lloyd, Michael A.; Patterson, Garth E.; Simpson, Greg H.; Duncan, Laura L.; King, Daniel P.; Fu, Yigang; Patrick, Brian O.; Parkin, Sean; Brock, Carolyn Pratt","Solid-state compounds of stereoisomers: <i>cis</i> and <i>trans</i> isomers of 1,2-cyclohexanediol and 2,3-tetralindiol","Acta Crystallographica Section B","2007","63","3","433","447","10.1107/S0108768107010579","","","0.71073","MoKα","","0.0383","0.0307","","","0.0762","0.0796","","","","","","1.061","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102863","10.1541","0.0011","10.1541","0.0011","2.9735","0.0014","90","","90","","90","","306.58","0.15","298","","298","","","","","","","","","4","I 4/m","-I 4","87","","","","- K1.56 Mg0.78 O16 Ti7.22 -","- K1.556 Mg0.776 O16 Ti7.2232 -","- K1.556 Mg0.776 O16 Ti7.2232 -","1","0.0625","AV5085","Michiue, Yuichi","Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb)","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","0.71069","MoKα","","0.0203","0.0186","","","0.0442","0.0446","","","","","","2.03","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102864","10.1541","0.0011","10.1541","0.0011","2.9735","0.0014","90","","90","","90","","306.58","0.15","298","","298","","","","","","","","","4","I 4/m","-I 4","87","","","","- K1.55 Mg0.77 O16 Ti7.23 -","- K1.548 Mg0.7688 O16 Ti7.2312 -","- K1.548 Mg0.7688 O16 Ti7.2312 -","1","0.0625","AV5085","Michiue, Yuichi","Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb)","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","0.71069","MoKα","","0.0192","0.0174","","","0.0418","0.0423","","","","","","1.92","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102865","10.1541","0.0011","10.1541","0.0011","2.9735","0.0014","90","","90","","90","","306.58","0.15","298","","298","","","","","","","","","4","I 4/m","-I 4","87","","","","- K1.53 Mg0.77 O16 Ti7.23 -","- K1.53 Mg0.7656 O16 Ti7.2344 -","- K1.53 Mg0.7656 O16 Ti7.2344 -","1","0.0625","AV5085","Michiue, Yuichi","Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb)","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","0.71069","MoKα","","0.0206","0.0189","","","0.0448","0.0452","","","","","","2.05","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102866","10.1541","0.0011","10.1541","0.0011","2.9735","0.0014","90","","90","","90","","306.58","0.15","298","","298","","","","","","","","","4","I 4/m","-I 4","87","","","","- K1.54 Mg0.77 O16 Ti7.23 -","- K1.54 Mg0.7696 O16 Ti7.2304 -","- K1.54 Mg0.7696 O16 Ti7.2304 -","1","0.0625","AV5085","Michiue, Yuichi","Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb)","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","0.71069","MoKα","","0.0192","0.0175","","","0.0419","0.0424","","","","","","1.93","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102867","10.2052","0.0007","10.2052","0.0007","2.9717","0.0006","90","","90","","90","","309.49","0.07","298","","298","","","","","","","","","4","I 4/m","-I 4","87","","","","- Mg0.75 O16 Rb1.51 Ti7.25 -","- Mg0.7544 O16 Rb1.508 Ti7.2456 -","- Mg0.7544 O16 Rb1.508 Ti7.2456 -","1","0.0625","AV5085","Michiue, Yuichi","Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb)","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","0.71069","MoKα","","0.0605","0.022","","","0.0418","0.0505","","","","","","1.18","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102868","10.2052","0.0007","10.2052","0.0007","2.9717","0.0006","90","","90","","90","","309.49","0.07","298","","298","","","","","","","","","4","I 4/m","-I 4","87","","","","- Mg0.75 O16 Rb1.51 Ti7.25 -","- Mg0.7544 O16 Rb1.508 Ti7.2456 -","- Mg0.7544 O16 Rb1.508 Ti7.2456 -","1","0.0625","AV5085","Michiue, Yuichi","Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb)","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","0.71069","MoKα","","0.0605","0.0219","","","0.0417","0.0504","","","","","","1.19","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102869","10.2052","0.0007","10.2052","0.0007","2.9717","0.0006","90","","90","","90","","309.49","0.07","298","","298","","","","","","","","","4","I 4/m","-I 4","87","","","","- Mg0.75 O16 Rb1.5 Ti7.25 -","- Mg0.7504 O16 Rb1.502 Ti7.2496 -","- Mg0.7504 O16 Rb1.502 Ti7.2496 -","1","0.0625","AV5085","Michiue, Yuichi","Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb)","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","0.71069","MoKα","","0.0607","0.0223","","","0.0424","0.051","","","","","","1.2","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102870","10.2052","0.0007","10.2052","0.0007","2.9717","0.0006","90","","90","","90","","309.49","0.07","298","","298","","","","","","","","","4","I 4/m","-I 4","87","","","","- Mg0.75 O16 Rb1.5 Ti7.25 -","- Mg0.7512 O16 Rb1.502 Ti7.2488 -","- Mg0.7512 O16 Rb1.502 Ti7.2488 -","1","0.0625","AV5085","Michiue, Yuichi","Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb)","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","0.71069","MoKα","","0.0607","0.0221","","","0.0421","0.0508","","","","","","1.19","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102871","10.2052","0.0007","10.2052","0.0007","2.9717","0.0006","90","","90","","90","","309.49","0.07","298","","298","","","","","","","","","4","I 4/m","-I 4","87","","","","- Mg0.76 O16 Rb1.51 Ti7.24 -","- Mg0.7568 O16 Rb1.512 Ti7.2432 -","- Mg0.7568 O16 Rb1.512 Ti7.2432 -","1","0.0625","AV5085","Michiue, Yuichi","Probability density analyses of guest ions in hollandite A~x~Mg~x/2~Ti~8-x/2~O~16~ (A=K, Rb)","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","0.71069","MoKα","","0.0603","0.0219","","","0.0416","0.0503","","","","","","1.18","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2102872","6.18123","0.00008","6.18123","","15.99","0.0003","90","","90","","120","","529.089","0.012","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ba4 O9 Sb2 -","- Ba4 O9 Sb2 -","- Ba8 O18 Sb4 -","2","0.0833333","AV5086","Ling, Chris D.; Avdeev, Maxim; Aivazian, Karina","Synthesis, structure, and stability of the high-temperature 6H-type perovskite phase Ba~3~BaSb~2~O~9~","Acta Crystallographica Section B","2007","63","4","584","588","10.1107/S0108768107019441","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102873","11.3467","0.0014","14.1629","0.0018","14.81","0.0019","108.886","0.004","109.437","0.004","92.483","0.004","2092.9","0.5","200","2","200","2","","","","","","","","3","P -1","-P 1","2","CECR-HTA-2MeOH-1.5H2O@200k","","","- C43 H59 O13.5 -","- C43 H59 O13.5 -","- C86 H118 O27 -","2","1","BK5051","Shao-Liang Zheng; Marc Messerschmidt; Philip Coppens","Single-Crystal-to-Single-Crystal E->Z Isomerization of Tiglic acid in a Supramolecular Framework","Acta Crystallographica, Section B","2007","63","4","650","655","10.1107/S0108768107018538","","","0.71073","MoKα","","0.1121","0.0718","","","0.1866","0.2188","","","","","","1.06","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2102874","11.2958","0.0002","14.0716","0.0003","14.72","0.0003","108.756","0.0008","108.628","0.0007","93.0151","0.0007","2067.74","0.07","90","2","90","2","","","","","","","","3","P -1","-P 1","2","CECR-HTA-2MeOH-1.5H2O@90k","","","- C43 H59 O13.5 -","- C43 H59 O13.5 -","- C86 H118 O27 -","2","1","BK5051","Shao-Liang Zheng; Marc Messerschmidt; Philip Coppens","Single-Crystal-to-Single-Crystal E->Z Isomerization of Tiglic acid in a Supramolecular Framework","Acta Crystallographica, Section B","2007","63","4","650","655","10.1107/S0108768107018538","","","0.71073","MoKα","","0.043","0.0397","","","0.1097","0.1129","","","","","","1.068","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2102875","11.2954","0.0002","14.0883","0.0003","14.7549","0.0003","108.638","0.0005","108.809","0.0005","92.9259","0.0006","2074.74","0.07","90","2","90","2","","","","","","","","3","P -1","-P 1","2","CECR-HTA-2MeOH-1.5H2O@90k-1h-exposure","","","- C43 H59 O13.5 -","- C43 H59 O13.5 -","- C86 H118 O27 -","2","1","BK5051","Shao-Liang Zheng; Marc Messerschmidt; Philip Coppens","Single-Crystal-to-Single-Crystal E->Z Isomerization of Tiglic acid in a Supramolecular Framework","Acta Crystallographica, Section B","2007","63","4","650","655","10.1107/S0108768107018538","","","0.71073","MoKα","","0.0481","0.0421","","","0.1147","0.1194","","","","","","1.09","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2102876","11.2902","0.0004","14.1299","0.0006","14.7991","0.0006","108.584","0.0013","109.266","0.0012","92.56","0.0013","2082.65","0.14","90","2","90","2","","","","","","","","3","P -1","-P 1","2","CECR-HTA-2MeOH-1.5H2O@90k-3h-exposure","","","- C43 H59 O13.5 -","- C43 H59 O13.5 -","- C86 H118 O27 -","2","1","BK5051","Shao-Liang Zheng; Marc Messerschmidt; Philip Coppens","Single-Crystal-to-Single-Crystal E->Z Isomerization of Tiglic acid in a Supramolecular Framework","Acta Crystallographica, Section B","2007","63","4","650","655","10.1107/S0108768107018538","","","0.71073","MoKα","","0.0885","0.0561","","","0.1418","0.1573","","","","","","1.173","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2102877","11.2988","0.0006","14.1506","0.0008","14.8012","0.0009","108.561","0.0018","109.475","0.0018","92.4244","0.0019","2085.7","0.2","90","2","90","2","","","","","","","","3","P -1","-P 1","2","CECR-HTA-2MeOH-1.5H2O@90k-1h-exposure","","","- C43 H59 O13.5 -","- C43 H59 O13.5 -","- C86 H118 O27 -","2","1","BK5051","Shao-Liang Zheng; Marc Messerschmidt; Philip Coppens","Single-Crystal-to-Single-Crystal E->Z Isomerization of Tiglic acid in a Supramolecular Framework","Acta Crystallographica, Section B","2007","63","4","650","655","10.1107/S0108768107018538","","","0.71073","MoKα","","0.1167","0.0631","","","0.155","0.1757","","","","","","1.208","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2102878","11.3096","0.0012","14.1748","0.0016","14.8116","0.0017","108.57","0.003","109.632","0.004","92.276","0.004","2091.2","0.4","90","2","90","2","","","","","","","","3","P -1","-P 1","2","CECR-HTA-2MeOH-1.5H2O@90k-12h-exposure","","","- C43 H59 O13.5 -","- C43 H59 O13.5 -","- C86 H118 O27 -","2","1","BK5051","Shao-Liang Zheng; Marc Messerschmidt; Philip Coppens","Single-Crystal-to-Single-Crystal E->Z Isomerization of Tiglic acid in a Supramolecular Framework","Acta Crystallographica, Section B","2007","63","4","650","655","10.1107/S0108768107018538","","","0.71073","MoKα","","0.1542","0.0707","","","0.1637","0.1938","","","","","","1.199","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2102879","6.7739","0.001","10.755","0.002","17.312","0.003","90","","93.8","0.02","90","","1258.5","0.4","110","","110","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 Cl2 N2 Pt -","- C12 H12 Cl2 N2 Pt -","- C48 H48 Cl8 N8 Pt4 -","4","1","BK5058","Maheshwari, Vidhi; Carlone, Maria; Fronczek, Frank R.; Marzilli, Luigi G.","Ligand and coordination-plane distortions in platinum(II) complexes of isomers of dimethyl-2,2'-bipyridine","Acta Crystallographica Section B","2007","63","4","603","611","10.1107/S0108768107027024","","","0.71073","MoKα","","0.053","0.037","","","0.079","0.085","","","","","","1.043","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102880","13.162","0.003","9.088","0.002","12.125","0.003","90","","121.11","0.011","90","","1241.8","0.5","105","","105","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichloro-(5,5'-dimethyl-2,2'-bipyridyl-N,N')-platimun(II)","","- C12 H12 Cl2 N2 Pt -","- C12 H12 Cl2 N2 Pt -","- C48 H48 Cl8 N8 Pt4 -","4","0.5","BK5058","Maheshwari, Vidhi; Carlone, Maria; Fronczek, Frank R.; Marzilli, Luigi G.","Ligand and coordination-plane distortions in platinum(II) complexes of isomers of dimethyl-2,2'-bipyridine","Acta Crystallographica Section B","2007","63","4","603","611","10.1107/S0108768107027024","","","0.71073","MoKα","","0.031","0.026","","","0.055","0.056","","","","","","1.056","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102881","8.1049","0.001","8.7028","0.001","12.005","0.002","73.863","0.005","73.919","0.005","77.132","0.006","771.78","0.18","105","","105","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H15 Cl2 N3 Pt -","- C14 H15 Cl2 N3 Pt -","- C28 H30 Cl4 N6 Pt2 -","2","1","BK5058","Maheshwari, Vidhi; Carlone, Maria; Fronczek, Frank R.; Marzilli, Luigi G.","Ligand and coordination-plane distortions in platinum(II) complexes of isomers of dimethyl-2,2'-bipyridine","Acta Crystallographica Section B","2007","63","4","603","611","10.1107/S0108768107027024","","","0.71073","MoKα","","0.027","0.023","","","0.044","0.045","","","","","","1.06","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102882","7.3395","0.001","10.58","0.002","12.093","0.002","70.602","0.009","87.384","0.012","79.978","0.012","872.1","0.3","110","","110","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H36 B2 F8 N6 Pt -","- C36 H36 B2 F8 N6 Pt -","- C36 H36 B2 F8 N6 Pt -","1","0.5","BK5058","Maheshwari, Vidhi; Carlone, Maria; Fronczek, Frank R.; Marzilli, Luigi G.","Ligand and coordination-plane distortions in platinum(II) complexes of isomers of dimethyl-2,2'-bipyridine","Acta Crystallographica Section B","2007","63","4","603","611","10.1107/S0108768107027024","","","0.71073","MoKα","","0.05","0.043","","","0.077","0.082","","","","","","1.059","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102883","27.3197","0.0011","27.3197","0.0011","9.2582","0.0006","90","","90","","120","","5984.2","0.5","120","2","120","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C12 H9 Br2 N O2 S -","- C12 H9 Br2 N O2 S -","- C216 H162 Br36 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.1299","0.0864","","","0.1811","0.2064","","","","","","1.069","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102884","28.022","0.0006","28.022","0.0006","9.5386","0.0003","90","","90","","120","","6486.5","0.3","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C13 H9 Br F3 N O2 S -","- C13 H9 Br F3 N O2 S -","- C234 H162 Br18 F54 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0678","0.0401","","","0.1014","0.1118","","","","","","0.986","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102885","28.134","0.004","28.134","0.004","9.024","0.0018","90","","90","","120","","6185.8","1.8","120","2","120","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C12 H9 Br I N O2 S -","- C12 H9 Br I N O2 S -","- C216 H162 Br18 I18 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0764","0.06","","","0.17","0.1796","","","","","","1.1","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102886","27.045","0.004","27.045","0.004","9.1556","0.001","90","","90","","120","","5799.5","1.4","120","2","120","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C12 H9 Br Cl N O2 S -","- C12 H9 Br Cl N O2 S -","- C216 H162 Br18 Cl18 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0985","0.0494","","","0.1004","0.1134","","","","","","0.937","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102887","27.3848","0.0015","27.3848","0.0015","9.2241","0.0007","90","","90","","120","","5990.6","0.6","120","2","120","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C14 H10 Cl N O2 S -","- C14 H10 Cl N O2 S -","- C252 H180 Cl18 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0932","0.0716","","","0.1598","0.1756","","","","","","0.928","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102888","27.805","0.003","27.805","0.003","9.4583","0.0012","90","","90","","120","","6332.7","1.3","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C13 H9 Cl F3 N O2 S -","- C13 H9 Cl F3 N O2 S -","- C234 H162 Cl18 F54 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.1283","0.0556","","","0.1171","0.139","","","","","","0.902","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102889","26.4119","0.0008","26.4119","0.0008","9.3936","0.0005","90","","90","","120","","5674.9","0.4","120","2","120","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C12 H9 Cl1.8 F0.2 N O2 S -","- C12 H9 Cl1.8 F0.2 N O2 S -","- C216 H162 Cl32.4 F3.6 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0646","0.0481","","","0.118","0.1259","","","","","","1.049","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2102890","27.812","0.004","27.812","0.004","9.0055","0.0018","90","","90","","120","","6032.6","1.7","120","2","120","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C12 H9 Cl I N O2 S -","- C12 H9 Cl I N O2 S -","- C216 H162 Cl18 I18 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0336","0.0255","","","0.0559","0.058","","","","","","1.014","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102891","27.0722","0.0008","27.0722","0.0008","9.4838","0.0008","90","","90","","120","","6019.5","0.6","120","2","120","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C13 H9 Br N2 O2 S -","- C13 H9 Br N2 O2 S -","- C234 H162 Br18 N36 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0713","0.047","","","0.1041","0.1133","","","","","","1.016","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102892","27.6017","0.0008","27.6017","0.0008","9.4505","0.0003","90","","90","","120","","6235.3","0.3","120","2","120","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C14 H9 F3 N2 O2 S -","- C14 H9 F3 N2 O2 S -","- C252 H162 F54 N36 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0785","0.0668","","","0.1639","0.1699","","","","","","1.211","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102893","26.8055","0.0015","26.8055","0.0015","9.5489","0.0006","90","","90","","120","","5942","0.6","120","2","120","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C13 H9 Cl N2 O2 S -","- C13 H9 Cl N2 O2 S -","- C234 H162 Cl18 N36 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0651","0.0435","","","0.1107","0.1205","","","","","","1.049","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102894","27.4867","0.0007","27.4867","0.0007","9.3972","0.0007","90","","90","","120","","6148.6","0.5","120","2","120","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C13 H9 I N2 O2 S -","- C13 H9 I N2 O2 S -","- C234 H162 I18 N36 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0799","0.0488","","","0.1158","0.1292","","","","","","0.939","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102895","26.9964","0.0006","26.9964","0.0006","9.5869","0.0005","90","","90","","120","","6050.9","0.4","120","2","120","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C14 H12 N2 O2 S -","- C14 H12 N2 O2 S -","- C252 H216 N36 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0736","0.0428","","","0.0988","0.1082","","","","","","1.034","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102896","26.5333","0.0004","26.5333","0.0004","9.2014","0.0003","90","","90","","120","","5610.1","0.2","120","2","120","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C12 H9 Br F N O2 S -","- C12 H9 Br F N O2 S -","- C216 H162 Br18 F18 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0407","0.0313","","","0.0771","0.0808","","","","","","1.026","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102897","27.4403","0.0004","27.4403","0.0004","9.5034","0.0003","90","","90","","120","","6197.1","0.2","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C13 H9 F4 N O2 S -","- C13 H9 F4 N O2 S -","- C234 H162 F72 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.08","0.0468","","","0.1273","0.1396","","","","","","1.006","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102898","25.9241","0.0008","25.9241","0.0008","9.3533","0.0005","90","","90","","120","","5443.8","0.4","120","2","120","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C12 H9 Cl F N O2 S -","- C12 H9 Cl F N O2 S -","- C216 H162 Cl18 F18 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0601","0.0559","","","0.1496","0.1541","","","","","","0.997","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102899","24.9922","0.0005","24.9922","0.0005","9.5804","0.0004","90","","90","","120","","5182.3","0.3","120","2","120","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C12 H9 F2 N O2 S -","- C12 H9 F2 N O2 S -","- C216 H162 F36 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0522","0.0395","","","0.0949","0.0992","","","","","","1.032","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102900","27.3131","0.0005","27.3131","0.0005","9.1331","0.0002","90","","90","","120","","5900.5","0.2","120","2","120","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C12 H9 F I N O2 S -","- C12 H9 F I N O2 S -","- C216 H162 F18 I18 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0355","0.0317","","","0.0819","0.0834","","","","","","1.105","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102901","27.1912","0.001","27.1912","0.001","9.4503","0.0007","90","","90","","120","","6051.1","0.5","120","2","120","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C13 H12 Br N O2 S -","- C13 H12 Br N O2 S -","- C234 H216 Br18 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0688","0.0436","","","0.0906","0.0985","","","","","","0.967","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102902","27.7243","0.0007","27.7243","0.0007","9.8101","0.0005","90","","90","","120","","6530.2","0.4","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C14 H12 F3 N O2 S -","- C14 H12 F3 N O2 S -","- C252 H216 F54 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0812","0.0554","","","0.1424","0.1527","","","","","","1.144","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102903","26.7454","0.0004","26.7454","0.0004","9.5265","0.0003","90","","90","","120","","5901.5","0.2","120","2","120","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C13 H12 Cl N O2 S -","- C13 H12 Cl N O2 S -","- C234 H216 Cl18 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0593","0.0372","","","0.0944","0.1027","","","","","","1.088","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102904","27.7443","0.0014","27.7443","0.0014","9.3639","0.0009","90","","90","","120","","6242.2","0.7","120","2","120","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C13 H12 I N O2 S -","- C13 H12 I N O2 S -","- C234 H216 I18 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.068","0.0449","","","0.1081","0.1192","","","","","","1.042","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102905","27.3759","0.0008","27.3759","0.0008","9.9002","0.0004","90","","90","","120","","6425.6","0.4","120","2","120","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C13 H12 I N O3 S -","- C13 H12 I N O3 S -","- C234 H216 I18 N18 O54 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0814","0.0536","","","0.1182","0.1286","","","","","","1.059","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102906","26.5773","0.0011","26.5773","0.0011","9.3206","0.0004","90","","90","","120","","5701.6","0.4","120","2","120","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C12 H9 Cl2 N O2 S -","- C12 H9 Cl2 N O2 S -","- C216 H162 Cl36 N18 O36 S18 -","18","1","BM5045","Gelbrich, Thomas; Hursthouse, Michael B.; Threlfall, Terence L.","Structural systematics of 4,4'-disubstituted benzenesulfonamidobenzenes. 1. Overview and dimer-based isostructures","Acta Crystallographica Section B","2007","63","4","621","632","10.1107/S010876810701395X","","","0.71073","MoKα","","0.0776","0.0565","","","0.1215","0.1292","","","","","","1.078","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102907","5.6611","0.0001","5.6611","","33.5672","0.0008","90","","90","","120","","931.64","0.03","293","","293","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Ba7 Br Co6 O17 -","- Ba6.9998 Br1.004 Co6 O16.9998 -","- Ba13.9996 Br2.008 Co12 O33.9996 -","2","0.0833333","BP5003","Kauffmann, Matthieu; Roussel, Pascal","New oxybromide cobaltites with layered perovskite-related structures: 18<i>R</i>-Ba~6~Co~5~BrO~14~ and 14<i>H</i>-Ba~7~Co~6~BrO~17~","Acta Crystallographica Section B","2007","63","4","589","596","10.1107/S0108768107029394","","","0.71069","MoKα","","0.0534","0.0476","","","0.0653","0.066","","","","","","4.7","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2102908","5.6578","0.0003","5.6578","0.0003","43.166","0.004","90","","90","","120","","1196.65","0.14","293","","293","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- Ba6 Br Co5 O14 -","- Ba5.9998 Br1.01 Co5 O13.9998 -","- Ba17.9994 Br3.03 Co15 O41.9994 -","3","0.0833333","BP5003","Kauffmann, Matthieu; Roussel, Pascal","New oxybromide cobaltites with layered perovskite-related structures: 18<i>R</i>-Ba~6~Co~5~BrO~14~ and 14<i>H</i>-Ba~7~Co~6~BrO~17~","Acta Crystallographica Section B","2007","63","4","589","596","10.1107/S0108768107029394","","","0.71069","MoKα","","0.0342","0.0317","","","0.0468","0.047","","","","","","3.86","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2102909","5.57882","0.00005","5.57882","0.00005","13.86932","0.00016","90","","90","","120","","373.827","0.006","298","","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","Bismuth ferrite","","- Bi Fe O3 -","- Bi Fe O3.00003 -","- Bi6 Fe6 O18.0002 -","6","0.333333","CK5024","Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan","Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study","Acta Crystallographica Section B","2007","63","4","537","544","10.1107/S0108768107023956","","neutron","1.5944","ConstantWavelengthNeutronDiffraction","","","","","","","","","","","","","","","","","has coordinates","199610","2020-10-21","18:00:00",""
"2102910","5.58829","0.00005","5.58829","0.00005","13.904","0.00017","90","","90","","120","","376.035","0.007","473","","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","Bismuth ferrite","","- Bi Fe O3 -","- Bi Fe O3.00003 -","- Bi6 Fe6 O18.0002 -","6","0.333333","CK5024","Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan","Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study","Acta Crystallographica Section B","2007","63","4","537","544","10.1107/S0108768107023956","","neutron","1.5944","ConstantWavelengthNeutronDiffraction","","","","","","","","","","","","","","","","","has coordinates","199610","2020-10-21","18:00:00",""
"2102911","5.58986","0.00005","5.58986","0.00005","13.90943","0.00017","90","","90","","120","","376.393","0.007","503","","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","Bismuth ferrite","","- Bi Fe O3 -","- Bi Fe O3.00003 -","- Bi6 Fe6 O18.0002 -","6","0.333333","CK5024","Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan","Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study","Acta Crystallographica Section B","2007","63","4","537","544","10.1107/S0108768107023956","","neutron","1.5944","ConstantWavelengthNeutronDiffraction","","","","","","","","","","","","","","","","","has coordinates","199610","2020-10-21","18:00:00",""
"2102912","5.59227","0.00005","5.59227","0.00005","13.91782","0.00017","90","","90","","120","","376.945","0.007","543","","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","Bismuth ferrite","","- Bi Fe O3 -","- Bi Fe O3.00003 -","- Bi6 Fe6 O18.0002 -","6","0.333333","CK5024","Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan","Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study","Acta Crystallographica Section B","2007","63","4","537","544","10.1107/S0108768107023956","","neutron","1.5944","ConstantWavelengthNeutronDiffraction","","","","","","","","","","","","","","","","","has coordinates","199610","2020-10-21","18:00:00",""
"2102913","5.59771","0.00006","5.59771","0.00006","13.93538","0.00018","90","","90","","120","","378.155","0.008","623","","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","Bismuth ferrite","","- Bi Fe O3 -","- Bi Fe O3.00003 -","- Bi6 Fe6 O18.0002 -","6","0.333333","CK5024","Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan","Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study","Acta Crystallographica Section B","2007","63","4","537","544","10.1107/S0108768107023956","","neutron","1.5944","ConstantWavelengthNeutronDiffraction","","","","","","","","","","","","","","","","","has coordinates","199610","2020-10-21","18:00:00",""
"2102914","5.59922","0.00006","5.59922","0.00006","13.94046","0.00018","90","","90","","120","","378.497","0.008","643","","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","Bismuth ferrite","","- Bi Fe O3 -","- Bi Fe O3.00003 -","- Bi6 Fe6 O18.0002 -","6","0.333333","CK5024","Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan","Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study","Acta Crystallographica Section B","2007","63","4","537","544","10.1107/S0108768107023956","","neutron","1.5944","ConstantWavelengthNeutronDiffraction","","","","","","","","","","","","","","","","","has coordinates","199610","2020-10-21","18:00:00",""
"2102915","5.60065","0.00006","5.60065","0.00006","13.94476","0.00018","90","","90","","120","","378.807","0.008","663","","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","Bismuth ferrite","","- Bi Fe O3 -","- Bi Fe O3.00003 -","- Bi6 Fe6 O18.0002 -","6","0.333333","CK5024","Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan","Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study","Acta Crystallographica Section B","2007","63","4","537","544","10.1107/S0108768107023956","","neutron","1.5944","ConstantWavelengthNeutronDiffraction","","","","","","","","","","","","","","","","","has coordinates","199610","2020-10-21","18:00:00",""
"2102916","5.60456","0.00006","5.60456","0.00006","13.9557","0.00019","90","","90","","120","","379.634","0.008","723","","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","Bismuth ferrite","","- Bi Fe O3 -","- Bi Fe O3.00003 -","- Bi6 Fe6 O18.0002 -","6","0.333333","CK5024","Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan","Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study","Acta Crystallographica Section B","2007","63","4","537","544","10.1107/S0108768107023956","","neutron","1.5944","ConstantWavelengthNeutronDiffraction","","","","","","","","","","","","","","","","","has coordinates","199610","2020-10-21","18:00:00",""
"2102917","5.61135","0.00006","5.61135","0.00006","13.9708","0.0002","90","","90","","120","","380.966","0.008","823","","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","Bismuth ferrite","","- Bi Fe O3 -","- Bi Fe O3.00003 -","- Bi6 Fe6 O18.0002 -","6","0.333333","CK5024","Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan","Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study","Acta Crystallographica Section B","2007","63","4","537","544","10.1107/S0108768107023956","","neutron","1.5944","ConstantWavelengthNeutronDiffraction","","","","","","","","","","","","","","","","","has coordinates","199610","2020-10-21","18:00:00",""
"2102918","5.61853","0.00007","5.61853","0.00007","13.9824","0.0002","90","","90","","120","","382.259","0.009","923","","","","","","","","","","","3","R 3 c :H","R 3 -2""c","161","","Bismuth ferrite","","- Bi Fe O3 -","- Bi Fe O3.00003 -","- Bi6 Fe6 O18.0002 -","6","0.333333","CK5024","Palewicz, Andrzej; Przenioslo, Radoslaw; Sosnowska, Izabela; Hewat, Alan","Atomic displacements in BiFeO~3~ as a function of temperature: neutron diffraction study","Acta Crystallographica Section B","2007","63","4","537","544","10.1107/S0108768107023956","","neutron","1.5944","ConstantWavelengthNeutronDiffraction","","","","","","","","","","","","","","","","","has coordinates","199610","2020-10-21","18:00:00",""
"2102919","6.838","0.001","8.93","0.001","7.414","0.001","90","","114.8","0.006","90","","410.97","0.1","98","","98","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Ge Na O5 Ta -","- Ge Na O5 Ta -","- Ge4 Na4 O20 Ta4 -","4","1","CK5025","Malcherek, Thomas","A structural phase transition in NaTaOGeO~4~ and its relation to phase transitions in titanite","Acta Crystallographica Section B","2007","63","4","545","550","10.1107/S0108768107026213","","","0.39184","synchrotron","","0.0273","0.023","","","0.0692","0.0728","","","","","","1.06","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2102920","6.854","0.001","8.933","0.001","7.418","0.001","90","","114.858","0.002","90","","412.1","0.09","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ge Na O5 Ta -","- Ge Na O5 Ta -","- Ge4 Na4 O20 Ta4 -","4","0.5","CK5025","Malcherek, Thomas","A structural phase transition in NaTaOGeO~4~ and its relation to phase transitions in titanite","Acta Crystallographica Section B","2007","63","4","545","550","10.1107/S0108768107026213","","","0.39184","synchrotron","","0.0257","0.0199","","","0.061","0.0662","","","","","","1.02","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2102921","10.3414","0.0004","10.3414","0.0004","37.086","0.002","90","","90","","120","","3434.8","0.3","293","","293","","","","","","","","","3","P 61","P 61","169","","Magnesium borohydrides","","- B2 H8 Mg -","- B2 H8 Mg -","- B60 H240 Mg30 -","30","5","LM5009","Jae-Hyuk Her; Peter W. Stephens; Yan Gao; Grigorii L. Soloveichik; Job Rijssenbeek; Matthew Andrus; Ji-Cheng Zhao","Structure of unsolvated magnesium borohydride Mg(BH~4~)~2~","Acta Crystallographica Section B","2007","63","4","561","568","10.1107/S0108768107022665","","","0.700319","synchrotron","","","","","","","","","","1.187","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102922","37.072","0.001","18.6476","0.0006","10.9123","0.0003","90","","90","","90","","7543.7","0.4","293","","293","","","","","","","","","3","F d d d :1","F 2 2 -1d","70","","Magnesium borohydrides","","- B2 H8 Mg -","- B2 H8 Mg -","- B128 H512 Mg64 -","64","2","LM5009","Jae-Hyuk Her; Peter W. Stephens; Yan Gao; Grigorii L. Soloveichik; Job Rijssenbeek; Matthew Andrus; Ji-Cheng Zhao","Structure of unsolvated magnesium borohydride Mg(BH~4~)~2~","Acta Crystallographica Section B","2007","63","4","561","568","10.1107/S0108768107022665","","","0.691246","synchrotron","","","","","","","","","","1.173","","","","","","","has coordinates","264412","2021-04-22","12:19:48",""
"2102923","9.9346","0.0007","9.9132","0.0007","7.3021","0.0005","90.96","0.005","88.079","0.005","120.89","0.004","616.78","0.08","300","","300","","","","","","","","","3","P -1","-P 1","2","","","","- Ge6 La10 O27 -","- Ge6 La10 O27 -","- Ge6 La10 O27 -","1","0.5","LM5010","Pramana, S.S; Klooster, W.T; White, T.J","Framework `interstitial' oxygen in La~10~(GeO~4~)~5~(GeO~5~)O~2~ apatite electrolyte","Acta Crystallographica Section B","2007","63","4","597","602","10.1107/S0108768107024317","","neutron","1.8834","neutron","","","","","","","","","","0.72","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2102924","21.3536","0.0009","4.042","0.0003","7.2723","0.0006","90","","90","","90","","627.68","0.07","295","2","295.15","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Al11 Co6 Si6 -","- Al11 Co6 Si6 -","- Al22 Co12 Si12 -","2","0.25","SN5051","Richter, Klaus W.; Prots, Yurii; Borrmann, Horst; Ramlau, Reiner; Grin, Yuri","Crystal structure and local order in Co~6~Al~11{-~<i>x</i>}Si~6+<i>x~</i>","Acta Crystallographica Section B","2007","63","4","551","560","10.1107/S0108768107029709","","","0.71073","MoKα","","","0.027","","","","0.047","","","","","","1.03","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102925","8.0839","0.0006","14.5445","0.0006","21.3536","0.0009","90","","90","","90","","2510.7","0.2","295","2","295.15","","","","","","","","","3","C m c 21","C 2c -2","36","","","","- Al11 Co6 Si6 -","- Al11 Co6 Si6 -","- Al88 Co48 Si48 -","8","1","SN5051","Richter, Klaus W.; Prots, Yurii; Borrmann, Horst; Ramlau, Reiner; Grin, Yuri","Crystal structure and local order in Co~6~Al~11{-~<i>x</i>}Si~6+<i>x~</i>","Acta Crystallographica Section B","2007","63","4","551","560","10.1107/S0108768107029709","","","0.7107","MoKα","","","0.037","","","","0.108","","","","","","1.01","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102926","8.0839","0.0003","21.3536","0.0009","8.32","0.0003","90","","119.07","0.01","90","","1255.28","0.15","295","2","295.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Al11 Co6 Si6 -","- Al11 Co6 Si6 -","- Al44 Co24 Si24 -","4","1","SN5051","Richter, Klaus W.; Prots, Yurii; Borrmann, Horst; Ramlau, Reiner; Grin, Yuri","Crystal structure and local order in Co~6~Al~11{-~<i>x</i>}Si~6+<i>x~</i>","Acta Crystallographica Section B","2007","63","4","551","560","10.1107/S0108768107029709","","","0.7107","MoKα","","","0.029","","","","0.096","","","","","","1.11","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102927","12.6516","0.0008","4.0373","0.0003","16.3456","0.0011","90","","90","","90","","834.9","0.16","","","200","","","","","","","","","3","P c a 21","P 2c -2ac","29","tetrabromothiophene","","","- C4 Br4 S -","- C4 Br4 S -","- C16 Br16 S4 -","4","1","AV5088","Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René","Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing","Acta Crystallographica Section B","2007","63","5","783","790","10.1107/S010876810703652X","","","1.25011","","","","","","","","","","","2.48","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102928","12.6511","0.0008","4.0371","0.0003","16.3449","0.0011","90","","90","","90","","834.79","0.16","","","200","","","","","","","","","3","P c a 21","P 2c -2ac","29","tetrabromothiophene","","","- C4 Br4 S -","- C4 Br4 S -","- C16 Br16 S4 -","4","1","AV5088","Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René","Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing","Acta Crystallographica Section B","2007","63","5","783","790","10.1107/S010876810703652X","","","1.25011","","","","","","","","","","","2.43","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102929","12.6482","0.0009","4.0362","0.0003","16.3411","0.0011","90","","90","","90","","834.22","0.17","","","","","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C4 Br4 S -","- C4 Br4 S -","- C16 Br16 S4 -","4","1","AV5088","Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René","Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing","Acta Crystallographica Section B","2007","63","5","783","790","10.1107/S010876810703652X","","","1.25011","","","","","","","","","","","2.51","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102930","14.86453","0.00004","4.078983","0.000016","13.90429","0.00007","90","","96.3502","0.0004","90","","837.875","0.006","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C4 Br4 Se -","- C4 Br4 Se -","- C16 Br16 Se4 -","4","1","AV5088","Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René","Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing","Acta Crystallographica Section B","2007","63","5","783","790","10.1107/S010876810703652X","","","1.25007","","","","","","","","","","","1.63","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102931","12.419","0.005","4.0397","0.0017","8.824","0.004","90","","109.181","0.003","90","","418.1","0.3","","","","","","","","","","","","3","P 1 n 1","P -2yac","7","","","","- C4 Br4 S -","- C4 Br4 S -","- C8 Br8 S2 -","2","1","AV5088","Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René","Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing","Acta Crystallographica Section B","2007","63","5","783","790","10.1107/S010876810703652X","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102932","12.643","0.01","4.034","0.003","16.35","0.012","90","","90","","90","","833.8","1.9","","","","","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C4 Br4 S -","- C4 Br4 S -","- C16 Br16 S4 -","4","1","AV5088","Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René","Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing","Acta Crystallographica Section B","2007","63","5","783","790","10.1107/S010876810703652X","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102933","12.5599","0.0012","3.9973","0.0004","16.3267","0.0015","90","","90","","90","","819.69","0.14","","","","","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C4 Br4 S -","- C4 Br4 S -","- C16 Br16 S4 -","4","1","AV5088","Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René","Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing","Acta Crystallographica Section B","2007","63","5","783","790","10.1107/S010876810703652X","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102934","12.376","0.01","4.004","0.003","8.816","0.007","90","","109.452","0.003","90","","411.9","0.6","","","","","","","","","","","","3","P 1 n 1","P -2yac","7","","","","- C4 Br4 S -","- C4 Br4 S -","- C8 Br8 S2 -","2","1","AV5088","Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René","Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing","Acta Crystallographica Section B","2007","63","5","783","790","10.1107/S010876810703652X","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102935","9.6066","0.0008","9.6066","0.0008","9.6066","0.0008","90","","90","","90","","886.56","0.13","300","","300","","100","","","","","","","2","I -4 3 m","I -4 2 3","217","Ag-Li gamma phase","silver-lithium gamma phase","","- Ag18.56 Li33.44 -","- Ag18.5596 Li33.4404 -","- Ag18.5596 Li33.4404 -","1","0.0208333","AV5091","Tatsuo, Noritake; Masakazu, Aoki; Shin-ich, Towata; Tsunehiro, Takeuchi; Uichiro, Mizutani","Structure determination of structurally complex Ag~36~Li~64~ gamma-brass","Acta Crystallographica Section B","2007","63","5","726","734","10.1107/S0108768107039092","","","0.50226","synchrotron","","","","","","","","","","1.666","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102936","5.7568","0.0007","11.5136","0.0013","16.2827","0.0018","90","","90","","90","","1079.2","0.2","298","2","298","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","rubidium iron dioxide","","- Fe O2 Rb -","- Fe O2 Rb -","- Fe16 O32 Rb16 -","16","2","BP5004","Nuss, Jürgen; Ali, Naveed Zafar; Jansen, Martin","Structure of RbFeO~2~, refined from a reticular pseudomerohedrally twinned crystal with six domains","Acta Crystallographica Section B","2007","63","5","719","725","10.1107/S0108768107037147","","","0.71073","MoKα","","0.1156","0.0529","","","0.1074","0.1256","","","","","","1.165","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102937","8.428","0.0019","8.986","0.002","26.233","0.006","90","","90","","90","","1986.7","0.8","223","2","223","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis(butylammonium)tetraiodoplumbate(II)","","- C8 H24 I4 N2 Pb -","- C8 H24 I4 N2 Pb -","- C32 H96 I16 N8 Pb4 -","4","0.5","BS5044","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6","Acta Crystallographica Section B","2007","63","5","735","747","10.1107/S0108768107031758","","","0.71073","MoKα","","0.1121","0.1014","","","0.2653","0.27","","","","","","1.376","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102938","8.8764","0.0001","8.6925","0.0001","27.6014","0.0005","90","","90","","90","","2129.67","0.05","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis(butylammonium)tetraiodoplumbate(II)","","- C8 H24 I4 N2 Pb -","- C8 H24 I4 N2 Pb -","- C32 H96 I16 N8 Pb4 -","4","0.5","BS5044","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6","Acta Crystallographica Section B","2007","63","5","735","747","10.1107/S0108768107031758","","","0.71073","MoKα","","0.0534","0.0372","","","0.073","0.0762","","","","","","1.089","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102939","8.4716","0.0018","9.007","0.002","14.784","0.003","90","","100.881","0.004","90","","1107.8","0.4","173","2","173","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","bis(pentylammonium)tetraiodoplumbate(II)","","- C10 H28 I4 N2 Pb -","- C10 H28 I4 N2 Pb -","- C20 H56 I8 N4 Pb2 -","2","0.5","BS5044","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6","Acta Crystallographica Section B","2007","63","5","735","747","10.1107/S0108768107031758","","","0.71073","MoKα","","0.044","0.0376","","","0.1025","0.1051","","","","","","1.15","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102940","8.6716","0.0007","8.9297","0.0006","14.8805","0.0013","90","","100.212","0.002","90","","1134.01","0.16","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","bis(pentylammonium)tetraiodoplumbate(II)","","- C10 H28 I4 N2 Pb -","- C10 H28 I4 N2 Pb -","- C20 H56 I8 N4 Pb2 -","2","0.5","BS5044","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6","Acta Crystallographica Section B","2007","63","5","735","747","10.1107/S0108768107031758","","","0.71073","MoKα","","0.0562","0.0441","","","0.1111","0.1212","","","","","","1.069","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102941","9.0078","0.001","8.731","0.001","29.956","0.004","90","","90","","90","","2356","0.5","333","2","333","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis(pentylammonium)tetraiodoplumbate(II)","","- C10 H28 I4 N2 Pb -","- C10 H28 I4 N2 Pb -","- C40 H112 I16 N8 Pb4 -","4","0.5","BS5044","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6","Acta Crystallographica Section B","2007","63","5","735","747","10.1107/S0108768107031758","","","0.71073","MoKα","","0.1546","0.124","","","0.2711","0.2835","","","","","","1.318","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102942","8.643","0.004","8.845","0.004","16.052","0.007","90","","91.985","0.008","90","","1226.4","1","173","2","173","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","bis(hexylammonium)tetraiodoplumbate(II)","","- C12 H32 I4 N2 Pb -","- C12 H32 I4 N2 Pb -","- C24 H64 I8 N4 Pb2 -","2","0.5","BS5044","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6","Acta Crystallographica Section B","2007","63","5","735","747","10.1107/S0108768107031758","","","0.71073","MoKα","","0.0695","0.0589","","","0.139","0.1432","","","","","","1.206","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102943","8.9413","0.0002","8.6874","0.0002","32.7027","0.001","90","","90","","90","","2540.24","0.11","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis(hexylammonium)tetraiodoplumbate(II)","","- C12 H32 I4 N2 Pb -","- C12 H32 I4 N2 Pb -","- C48 H128 I16 N8 Pb4 -","4","0.5","BS5044","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6","Acta Crystallographica Section B","2007","63","5","735","747","10.1107/S0108768107031758","","","0.71073","MoKα","","0.0958","0.0814","","","0.1636","0.1682","","","","","","1.335","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102944","6.892","0.001","11.952","0.001","5.744","0.001","90","","90","","90","","473.15","0.11","","","293","","","","","","","","","2","(000 ???","","","","","","- Fe0.91 S -","","","16","","CK5026","Izaola, Zunbeltz; González, Santiago; Elcoro, Luis; Perez-Mato, J. M.; Madariaga, Gotzon; García, Alberto","Revision of pyrrhotite structures within a common superspace model","Acta Crystallographica Section B","2007","63","5","693","702","10.1107/S0108768107037275","","","0.71069","MoKα","","0.1419","0.1152","","","0.0899","0.096","","","","","","4.81","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102945","5.7779174","0.0000009","5.7779174","0.0000009","14.2692051","0.00000015","90","","90","","120","","412.547","0.009","300","","298","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","Lead Zirconium Titanium Oxide","Lead Zirconium Titanium Oxide","","- O3 Pb Ti0.35 Zr0.65 -","- O3 Pb Ti0.65 Zr0.35 -","- O18 Pb6 Ti3.9 Zr2.1 -","6","0.333333","KD5005","Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.","X-ray powder difraction structural characterization of Pb(1-x)Ba(x)Zr(0.65)Ti(0.35)O3 ceramic.","Acta Crystallographica, Section B","2007","63","5","713","718","10.1107/S0108768107022197","","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102946","4.09836","0.00003","4.09836","0.00003","4.09836","0.00003","90","","90","","90","","68.8383","0.0009","650","","298","","","","","","","","","4","P m -3 m","-P 4 2 3","221","Lead Zirconium Titanium Oxide","Lead Zirconium Titanium Oxide","","- O3 Pb Ti0.35 Zr0.65 -","- O3 Pb Ti0.35 Zr0.65 -","- O3 Pb Ti0.35 Zr0.65 -","","","KD5005","Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.","X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic","Acta Crystallographica Section B","2007","63","5","713","718","10.1107/S0108768107022197","","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2102947","5.78826","0.00005","5.78826","0.00007","14.27227","0.00016","90","","90","","120","","414.114","0.008","300","","298","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","Lead Barium Zirconium Titanium Oxide","Lead Barium Zirconium Titanium Oxide","","- Ba0.1 O3 Pb0.9 Ti0.35 Zr0.65 -","- Ba0.6 O18 Pb5.4 Ti2.1 Zr3.9 -","- Ba0.6 O18 Pb5.4 Ti2.1 Zr3.9 -","","","KD5005","Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.","X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic","Acta Crystallographica Section B","2007","63","5","713","718","10.1107/S0108768107022197","","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102948","4.10755","0.00003","4.10755","0.00003","4.10755","0.00003","90","","90","","90","","69.3024","0.0009","750","","298","","","","","","","","","5","P m -3 m","-P 4 2 3","221","Lead Barium Zirconium Titanium Oxide","Lead Barium Zirconium Titanium Oxide","","- Ba0.1 O3 Pb0.9 Ti0.35 Zr0.65 -","- Ba0.1 O3 Pb0.9 Ti0.35 Zr0.65 -","- Ba0.1 O3 Pb0.9 Ti0.35 Zr0.65 -","","","KD5005","Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.","X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic","Acta Crystallographica Section B","2007","63","5","713","718","10.1107/S0108768107022197","","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102949","5.79776","0.00005","5.79776","0.00005","14.26758","0.00015","90","","90","","120","","415.338","0.007","300","","298","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","Lead Barium Zirconium Titanium Oxide","Lead Barium Zirconium Titanium Oxide","","- Ba0.2 O3 Pb0.8 Ti0.35 Zr0.65 -","- Ba1.2 O18 Pb4.8 Ti2.1 Zr3.9 -","- Ba1.2 O18 Pb4.8 Ti2.1 Zr3.9 -","","","KD5005","Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.","X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic","Acta Crystallographica Section B","2007","63","5","713","718","10.1107/S0108768107022197","","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102950","4.11161","0.000017","4.11161","0.000017","4.11161","0.000017","90","","90","","90","","69.5082","0.0005","630","","298","","","","","","","","","5","P m -3 m","-P 4 2 3","221","Lead Barium Zirconium Titanium Oxide","Lead Barium Zirconium Titanium Oxide","","- Ba0.2 O3 Pb0.8 Ti0.35 Zr0.65 -","- Ba0.2 O3 Pb0.8 Ti0.35 Zr0.65 -","- Ba0.2 O3 Pb0.8 Ti0.35 Zr0.65 -","","","KD5005","Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.","X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic","Acta Crystallographica Section B","2007","63","5","713","718","10.1107/S0108768107022197","","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102951","4.11241","0.00006","4.11241","0.00006","4.11241","0.00006","90","","90","","90","","69.5487","0.0018","300","","298","","","","","","","","","5","P m -3 m","-P 4 2 3","221","Lead Barium Zirconium Titanium Oxide","Lead Barium Zirconium Titanium Oxide","","- Ba0.3 O3 Pb0.7 Ti0.35 Zr0.65 -","- Ba0.3 O3 Pb0.7 Ti0.35 Zr0.65 -","- Ba0.3 O3 Pb0.7 Ti0.35 Zr0.65 -","","","KD5005","Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.","X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic","Acta Crystallographica Section B","2007","63","5","713","718","10.1107/S0108768107022197","","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102952","4.11604","0.00002","4.11604","0.00002","4.11604","0.00002","90","","90","","90","","69.7331","0.0006","300","","298","","","","","","","","","5","P m -3 m","-P 4 2 3","221","Lead Barium Zirconium Titanium Oxide","Lead Barium Zirconium Titanium Oxide","","- Ba0.4 O3 Pb0.6 Ti0.35 Zr0.65 -","- Ba0.4 O3 Pb0.6 Ti0.35 Zr0.65 -","- Ba0.4 O3 Pb0.6 Ti0.35 Zr0.65 -","","","KD5005","Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.","X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic","Acta Crystallographica Section B","2007","63","5","713","718","10.1107/S0108768107022197","","","","X-ray","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102953","4.14586","0.00008","4.14586","0.00008","4.14586","0.00008","90","","90","","90","","71.26","0.002","430","0.5","430","","","","","","","","","2","P m -3 m","-P 4 2 3","221","cerium hexaboride","cerium hexaboride","","- B6 Ce -","- B6 Ce -","- B6 Ce -","1","0.0208333","OG5021","Ryoko, Makita; k̄iyoaki, Tanaka; Ōnuki, Yoshichika; H̄iroshi, Tatewaki","Inversion of 4<i>f</i>-states in CeB~6~ thermally excited at 430K","Acta Crystallographica Section B","2007","63","5","683","692","10.1107/S0108768107035021","","","0.71073","MoKα","","","0.0116","","","0.0116","0.015","","","","","","1.1356","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102954","6.825","0.0014","9.042","0.0018","21.728","0.004","90","","90","","90","","1340.9","0.5","100","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","L-alanyl-L-prolyl-L-alanine hydrate","","","- C11 H21 N3 O5 -","- C11 H21 N3 O5 -","- C44 H84 N12 O20 -","4","1","SN5053","Kalinowski, Roman; Dittrich, Birger; Hübschle, Christian; Luger, Peter; Paulmann, Carsten","Experimental charge density of <small>L</small>-alanyl-<small>L</small>-prolyl-<small>L</small>-alanine hydrate: classical multipole and invariom approach, analysis of intra- and intermolecular topological properties","Acta Crystallographica Section B","2007","63","5","753","767","10.1107/S0108768107030388","","","0.56","Synchrotron","","0.0295","0.0208","","","","0.0134","","","","","","1.5428","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102955","11.9794","","11.9794","","11.9794","","90","","90","","90","","1719.12","","298","","293","","","","","","","","Synthetic","3","I -4 3 d","I -4bd 2c 3","220","","","mayenite","- Al14 Ca12 O33 -","- Al14 Ca12 O33.506 -","- Al28 Ca24 O67.012 -","2","0.0416667","WS5057","Boysen, H.; Lerch, M.; Stys, A.; Senyshyn, A.","Structure and oxygen mobility in mayenite (Ca~12~Al~14~O~33~): a high-temperature neutron powder diffraction study","Acta Crystallographica Section B","2007","63","5","675","682","10.1107/S0108768107030005","","neutron","1.548","neutron","","0.0152","0.0149","","","0.012","0.012","","","","","","1.68","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2102956","12.0308","","12.0308","","12.0308","","90","","90","","90","","1741.34","","973","","973","","","","","","","","Synthetic","3","I -4 3 d","I -4bd 2c 3","220","","","mayenite","- Al14 Ca12 O33 -","- Al14 Ca12 O33.086 -","- Al28 Ca24 O66.172 -","2","0.0416667","WS5057","Boysen, H.; Lerch, M.; Stys, A.; Senyshyn, A.","Structure and oxygen mobility in mayenite (Ca~12~Al~14~O~33~): a high-temperature neutron powder diffraction study","Acta Crystallographica Section B","2007","63","5","675","682","10.1107/S0108768107030005","","neutron","1.548","neutron","","0.0238","0.0207","","","0.0148","0.015","","","","","","1.38","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2102957","12.0449","","12.0449","","12.0449","","90","","90","","90","","1747.47","","1223","","1173","","","","","","","","","3","I -4 3 d","I -4bd 2c 3","220","","","mayenite","- Al14 Ca12 O33 -","- Al14 Ca12 O32.696 -","- Al28 Ca24 O65.392 -","2","0.0416667","WS5057","Boysen, H.; Lerch, M.; Stys, A.; Senyshyn, A.","Structure and oxygen mobility in mayenite (Ca~12~Al~14~O~33~): a high-temperature neutron powder diffraction study","Acta Crystallographica Section B","2007","63","5","675","682","10.1107/S0108768107030005","","neutron","1.548","neutron","","0.0297","0.0273","","","0.0172","0.0173","","","","","","1.59","","","","has coordinates","210194","2020-10-21","18:00:00",""
"2102958","12.0585","","12.0585","","12.0585","","90","","90","","90","","1753.4","","1323","","1323","","","","","","","","Synthetic","3","I -4 3 d","I -4bd 2c 3","220","","","mayenite","- Al14 Ca12 O33 -","- Al14 Ca12 O32.9 -","- Al28 Ca24 O65.8 -","2","0.0416667","WS5057","Boysen, H.; Lerch, M.; Stys, A.; Senyshyn, A.","Structure and oxygen mobility in mayenite (Ca~12~Al~14~O~33~): a high-temperature neutron powder diffraction study","Acta Crystallographica Section B","2007","63","5","675","682","10.1107/S0108768107030005","","neutron","1.548","neutron","","0.0404","0.0309","","","0.021","0.0219","","","","","","1.43","","","","has coordinates","282068","2023-03-26","10:12:33",""
"2102959","4.914","0.002","11.384","0.007","8.418","0.005","90","","93.45","0.06","90","","470.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","dichloroacetic acid","","- C2 H2 Cl2 O2 -","- C2 H2 Cl2 O2 -","- C8 H8 Cl8 O8 -","4","1","AV5090","Roman Gajda; Andrzej Katrusiak","Compressed hydrogen-bond effects in the pressure-frozen chloroacetic acid","Acta Crystallographica Section B","2007","63","6","896","902","10.1107/S0108768107037263","","","0.71073","MoKα","","0.1461","0.1167","","","0.1779","0.1905","","","","","","1.368","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102960","4.6404","0.0018","11.134","0.007","8.299","0.005","90","","92.89","0.05","90","","428.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","dichloroacetic acid","","- C2 H2 Cl2 O2 -","- C2 H2 Cl2 O2 -","- C8 H8 Cl8 O8 -","4","1","AV5090","Roman Gajda; Andrzej Katrusiak","Compressed hydrogen-bond effects in the pressure-frozen chloroacetic acid","Acta Crystallographica Section B","2007","63","6","896","902","10.1107/S0108768107037263","","","0.71073","MoKα","","0.0664","0.0534","","","0.088","0.0914","","","","","","1.301","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102961","4.6589","0.0009","11.174","0.002","8.2013","0.0016","90","","92.88","0.03","90","","426.41","0.14","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","dichloroacetic acid","","- C2 H2 Cl2 O2 -","- C2 H2 Cl2 O2 -","- C8 H8 Cl8 O8 -","4","1","AV5090","Roman Gajda; Andrzej Katrusiak","Compressed hydrogen-bond effects in the pressure-frozen chloroacetic acid","Acta Crystallographica Section B","2007","63","6","896","902","10.1107/S0108768107037263","","","0.71073","MoKα","","0.0265","0.0252","","","0.0559","0.0565","","","","","","1.104","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102962","4.563","0.002","10.978","0.008","8.087","0.006","90","","92.6","0.06","90","","404.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C2 H2 Cl2 O2 -","- C2 H2 Cl2 O2 -","- C8 H8 Cl8 O8 -","4","1","AV5090","Roman Gajda; Andrzej Katrusiak","Compressed hydrogen-bond effects in the pressure-frozen chloroacetic acid","Acta Crystallographica Section B","2007","63","6","896","902","10.1107/S0108768107037263","","","0.71073","MoKα","","0.0303","0.0302","","","0.0731","0.0731","","","","","","1.219","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102963","6.6661","0.001","3.868","0.0005","27.386","0.005","90","","100.58","0.02","90","","694.13","0.19","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Quinacridone","","","- C20 H12 N2 O2 -","- C20 H12 D N2 O2 -","- C40 H24 D2 N4 O4 -","2","0.5","AV5092","Buchsbaum, Christian; Schmidt, Martin U.","Rietveld refinement of a wrong crystal structure","Acta Crystallographica Section B","2007","63","6","926","932","10.1107/S0108768107050823","","","1.5406","","","","","","","","","","","9.94","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102964","11.959","0.002","4.4531","0.0009","14.873","0.003","90","","112.96","0.03","90","","729.3","0.3","170","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","bromochloromethane","bromochloromethane","","- C H2 Br Cl -","- C H2 Br Cl -","- C8 H16 Br8 Cl8 -","8","1","AV5094","Podsiadło, Marcin; Katrusiak, Andrzej","Isobaric and isochoric freezing of CH~2~BrCl and isostructural relations between CH~2~Cl~2~, CH~2~Br~2~ and CH~2~BrCl","Acta Crystallographica Section B","2007","63","6","903","911","10.1107/S0108768107044618","","","0.71073","MoKα","","0.0917","0.0656","","","0.1564","0.1715","","","","","","1.149","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102965","11.874","0.002","4.4224","0.0009","14.582","0.003","90","","112.04","0.03","90","","709.8","0.3","100","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","bromochloromethane","bromochloromethane","","- C H2 Br Cl -","- C H2 Br Cl -","- C8 H16 Br8 Cl8 -","8","1","AV5094","Podsiadło, Marcin; Katrusiak, Andrzej","Isobaric and isochoric freezing of CH~2~BrCl and isostructural relations between CH~2~Cl~2~, CH~2~Br~2~ and CH~2~BrCl","Acta Crystallographica Section B","2007","63","6","903","911","10.1107/S0108768107044618","","","0.71073","MoKα","","0.0599","0.0505","","","0.1218","0.128","","","","","","1.123","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102966","4.1126","0.0008","8.0685","0.0016","9.755","0.002","90","","90","","90","","323.7","0.11","295","2","295","2","","","","","","","","4","P b c n","-P 2n 2ab","60","bromochloromethane","bromochloromethane","","- C H2 Br Cl -","- C H2 Br Cl -","- C4 H8 Br4 Cl4 -","4","0.5","AV5094","Podsiadło, Marcin; Katrusiak, Andrzej","Isobaric and isochoric freezing of CH~2~BrCl and isostructural relations between CH~2~Cl~2~, CH~2~Br~2~ and CH~2~BrCl","Acta Crystallographica Section B","2007","63","6","903","911","10.1107/S0108768107044618","","","0.71073","MoKα","","0.0472","0.0295","","","0.0545","0.0579","","","","","","1.051","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102967","3.9929","0.0008","7.9351","0.0016","9.6808","0.0019","90","","90","","90","","306.73","0.11","295","2","295","2","","","","","","","","4","P b c n","-P 2n 2ab","60","bromochloromethane","bromochloromethane","","- C H2 Br Cl -","- C H2 Br Cl -","- C4 H8 Br4 Cl4 -","4","0.5","AV5094","Podsiadło, Marcin; Katrusiak, Andrzej","Isobaric and isochoric freezing of CH~2~BrCl and isostructural relations between CH~2~Cl~2~, CH~2~Br~2~ and CH~2~BrCl","Acta Crystallographica Section B","2007","63","6","903","911","10.1107/S0108768107044618","","","0.71073","MoKα","","0.0342","0.0288","","","0.0622","0.0646","","","","","","1.199","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2102968","6.7448","0.0018","11.849","0.003","26.976","0.006","90","","90","","90","","2155.9","0.9","299","2","299","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H31 N O3 -","- C24 H31 N O3 -","- C96 H124 N4 O12 -","4","1","BK5065","Turowska-Tyrk, Ilona; Bakowicz, Julia; Scheffer, John R.","Monitoring structural transformations in crystals. 11. Yang photocyclizations ‒ one type of reaction, but diversity of structural changes","Acta Crystallographica Section B","2007","63","6","933","940","10.1107/S0108768107051336","","","0.71073","MoKα","","0.0967","0.0624","","","0.1719","0.1941","","","","","","1.004","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102969","6.7891","0.0012","11.852","0.002","26.822","0.005","90","","90","","90","","2158.2","0.7","299","2","299","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H31 N O3 -","- C24 H30.714 N O3 -","- C96 H122.856 N4 O12 -","4","1","BK5065","Turowska-Tyrk, Ilona; Bakowicz, Julia; Scheffer, John R.","Monitoring structural transformations in crystals. 11. Yang photocyclizations ‒ one type of reaction, but diversity of structural changes","Acta Crystallographica Section B","2007","63","6","933","940","10.1107/S0108768107051336","","","0.71073","MoKα","","0.122","0.0588","","","0.1466","0.1752","","","","","","0.906","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102970","6.832","0.0007","11.897","0.0015","26.609","0.003","90","","90","","90","","2162.8","0.4","299","2","299","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H31 N O3 -","- C24 H30.435 N O3 -","- C96 H121.74 N4 O12 -","4","1","BK5065","Turowska-Tyrk, Ilona; Bakowicz, Julia; Scheffer, John R.","Monitoring structural transformations in crystals. 11. Yang photocyclizations ‒ one type of reaction, but diversity of structural changes","Acta Crystallographica Section B","2007","63","6","933","940","10.1107/S0108768107051336","","","0.71073","MoKα","","0.1369","0.0668","","","0.1715","0.2029","","","","","","0.959","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102971","6.8632","0.0008","11.9445","0.0017","26.305","0.004","90","","90","","90","","2156.4","0.5","299","2","299","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H31 N O3 -","- C24 H30.274 N O3 -","- C96 H121.096 N4 O12 -","4","1","BK5065","Turowska-Tyrk, Ilona; Bakowicz, Julia; Scheffer, John R.","Monitoring structural transformations in crystals. 11. Yang photocyclizations ‒ one type of reaction, but diversity of structural changes","Acta Crystallographica Section B","2007","63","6","933","940","10.1107/S0108768107051336","","","0.71073","MoKα","","0.1407","0.0676","","","0.1804","0.212","","","","","","0.958","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2102972","6.8834","0.0007","12.0641","0.0015","25.924","0.003","90","","90","","90","","2152.8","0.4","299","2","299","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H31 N O3 -","- C24 H30 N O3 -","- C96 H120 N4 O12 -","4","1","BK5065","Turowska-Tyrk, Ilona; Bakowicz, Julia; Scheffer, John R.","Monitoring structural transformations in crystals. 11. Yang photocyclizations ‒ one type of reaction, but diversity of structural changes","Acta Crystallographica Section B","2007","63","6","933","940","10.1107/S0108768107051336","","","0.71073","MoKα","","0.1848","0.0609","","","0.1379","0.1808","","","","","","0.838","","","","has coordinates,has Fobs","201972","2020-10-21","18:00:00",""
"2102973","7.1927","0.0002","21.2168","0.0007","28.6771","0.001","90","","90","","90","","4376.3","0.2","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-isonicotinoyl benzaldehydehydrazone","","- C13 H11 N3 O -","- C13 H11 N3 O -","- C208 H176 N48 O16 -","16","2","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.0854","0.0468","","","0.1145","0.1333","","","","","","1.047","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102974","7.4815","0.0002","11.1344","0.0002","14.5365","0.0003","90.663","0.002","104.903","0.003","109.268","0.002","1098.45","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","N-isonicotinoyl 2-fluorobenzaldehydehydrazone","","- C13 H10 F N3 O -","- C13 H10 F N3 O -","- C52 H40 F4 N12 O4 -","4","2","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.0902","0.0533","","","0.1105","0.1246","","","","","","1.026","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102975","13.191","0.0004","18.8057","0.0006","18.2843","0.0004","90","","90","","90","","4535.7","0.2","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-isonicotinoyl 3-fluorobenzaldehydehydrazone","","- C13 H10 F N3 O -","- C13 H10 F N3 O -","- C208 H160 F16 N48 O16 -","16","2","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.0857","0.0632","","","0.1387","0.1509","","","","","","1.104","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2102976","6.4189","0.0003","6.852","0.0003","27.3451","0.0012","90","","90","","90","","1202.7","0.09","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-isonicotinoyl 4-fluorobenzaldehydehydrazone monohydrate","","- C13 H12 F N3 O2 -","- C13 H12 F N3 O2 -","- C52 H48 F4 N12 O8 -","4","1","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.0438","0.034","","","0.0821","0.0877","","","","","","1.032","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102977","7.9977","0.0002","6.7184","0.0002","22.5514","0.0006","90","","98.609","0.003","90","","1198.07","0.06","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-isonicotinoyl 2-chlorobenzaldehydehydrazone","","- C13 H10 Cl N3 O -","- C13 H10 Cl N3 O -","- C52 H40 Cl4 N12 O4 -","4","1","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.0557","0.0368","","","0.0886","0.0976","","","","","","1.034","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102978","7.4524","0.0003","11.2367","0.0004","14.3949","0.0003","90","","102.701","0.002","90","","1175.94","0.07","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-isonicotinoyl 3-chlorobenzaldehydehydrazone","","- C13 H10 Cl N3 O -","- C13 H10 Cl N3 O -","- C52 H40 Cl4 N12 O4 -","4","1","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.0568","0.0381","","","0.1161","0.1425","","","","","","1.084","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102979","8.0268","0.0002","6.7134","0.0003","22.5024","0.001","90","","99.297","0.003","90","","1196.66","0.08","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-isonicotinoyl 2-bromobenzaldehydehydrazone","","- C13 H10 Br N3 O -","- C13 H10 Br N3 O -","- C52 H40 Br4 N12 O4 -","4","1","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.0596","0.041","","","0.0848","0.0926","","","","","","1.061","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102980","7.4578","0.0002","11.3264","0.0003","14.3558","0.0003","90","","101.119","0.002","90","","1189.87","0.05","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-isonicotinoyl 3-bromobenzaldehydehydrazone","","- C13 H10 Br N3 O -","- C13 H10 Br N3 O -","- C52 H40 Br4 N12 O4 -","4","1","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.041","0.0282","","","0.0672","0.0726","","","","","","1.07","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102981","14.257","0.0003","14.6299","0.0004","14.1669","0.0004","90","","119.152","0.002","90","","2580.61","0.13","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-isonicotinoyl 4-bromobenzaldehydehydrazone","","- C13 H12 Br N3 O2 -","- C13 H12 Br N3 O2 -","- C104 H96 Br8 N24 O16 -","8","2","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.0672","0.0575","","","0.152","0.1565","","","","","","1.233","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102982","9.8899","0.0003","15.8189","0.0004","17.038","0.0005","90","","97.236","0.002","90","","2644.32","0.13","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-isonicotinoyl 2-methoxybenzaldehydehydrazone","","- C14 H13 N3 O2 -","- C14 H13 N3 O2 -","- C112 H104 N24 O16 -","8","2","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.0913","0.0523","","","0.095","0.1062","","","","","","1.018","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102983","8.2938","0.0004","11.0771","0.0006","13.846","0.005","90","","103.478","0.003","90","","1237","0.5","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-isonicotinoyl 3-methoxybenzaldehydehydrazone","","- C14 H13 N3 O2 -","- C14 H13 N3 O2 -","- C56 H52 N12 O8 -","4","1","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.1002","0.0474","","","0.114","0.1617","","","","","","1.088","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102984","7.2702","0.0002","12.3085","0.0005","14.7299","0.0006","90","","97.37","0.003","90","","1307.22","0.08","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-isonicotinoyl 4-methoxybenzaldehydehydrazone","","- C14 H15 N3 O3 -","- C14 H15 N3 O3 -","- C56 H60 N12 O12 -","4","1","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.0681","0.0572","","","0.1357","0.1418","","","","","","1.069","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102985","8.3787","0.0003","18.245","0.0007","17.8701","0.0007","90","","90.975","0.002","90","","2731.4","0.18","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-isonicotinoyl 2-ethoxybenzaldehydehydrazone","","- C15 H15 N3 O2 -","- C15 H15 N3 O2 -","- C120 H120 N24 O16 -","8","2","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.1429","0.0559","","","0.1093","0.137","","","","","","1.002","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102986","24.206","0.0017","5.5637","0.0004","9.9571","0.0004","90","","94.965","0.004","90","","1335.94","0.14","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-isonicotinoyl 3-ethoxybenzaldehydehydrazone","","- C15 H15 N3 O2 -","- C15 H15 N3 O2 -","- C60 H60 N12 O8 -","4","1","BM5048","Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers","Acta Crystallographica Section B","2007","63","6","879","895","10.1107/S0108768107036270","","","0.71073","MoKα","","0.0995","0.0686","","","0.1926","0.2209","","","","","","1.087","","","","has coordinates","201972","2020-10-21","18:00:00",""
"2102987","5.2988","0.0009","10.527","0.002","5.3183","0.0009","90","","90","","90","","296.66","0.09","315","1","315","1","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- O7 Sr V3 -","- O7 Sr V3 -","- O14 Sr2 V6 -","2","0.25","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0333","0.0313","","","0.0794","0.0802","","","","","","1.213","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102988","5.2979","0.0008","10.529","0.002","5.3139","0.0009","90","","90","","90","","296.42","0.09","298","1","298","1","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- O7 Sr V3 -","- O7 Sr V3 -","- O14 Sr2 V6 -","2","0.25","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0329","0.0311","","","0.0769","0.0777","","","","","","1.381","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102989","5.2968","0.0008","10.53","0.002","5.3089","0.0009","90","","90","","90","","296.11","0.09","275","1","275","1","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- O7 Sr V3 -","- O7 Sr V3 -","- O14 Sr2 V6 -","2","0.25","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0337","0.0327","","","0.082","0.0824","","","","","","1.215","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102990","5.2956","0.0008","10.532","0.002","5.3055","0.0009","90","","90","","90","","295.91","0.09","262","1","262","1","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- O7 Sr V3 -","- O7 Sr V3 -","- O14 Sr2 V6 -","2","0.25","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0339","0.0322","","","0.0772","0.0779","","","","","","1.239","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102991","5.2959","0.0008","10.534","0.002","5.3014","0.0009","90","","90","","90","","295.75","0.09","250","1","250","1","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- O7 Sr V3 -","- O7 Sr V3 -","- O14 Sr2 V6 -","2","0.25","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0335","0.0314","","","0.0768","0.0776","","","","","","1.243","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102992","5.2954","0.0008","10.534","0.002","5.2952","0.0009","90","","90","","90","","295.38","0.09","225","1","225","1","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- O7 Sr V3 -","- O7 Sr V3 -","- O14 Sr2 V6 -","2","0.25","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0342","0.0328","","","0.0767","0.077","","","","","","1.387","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102993","5.2934","0.0008","10.537","0.002","5.2889","0.0009","90","","90","","90","","295","0.09","200","1","200","1","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- O7 Sr V3 -","- O7 Sr V3 -","- O14 Sr2 V6 -","2","0.25","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0348","0.0329","","","0.0795","0.0803","","","","","","1.227","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102994","5.2923","0.0008","10.539","0.002","5.2864","0.0009","90","","90","","90","","294.85","0.09","187","1","187","1","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- O7 Sr V3 -","- O7 Sr V3 -","- O14 Sr2 V6 -","2","0.25","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0353","0.033","","","0.0779","0.0786","","","","","","1.342","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102995","5.2914","0.0008","10.539","0.002","5.2828","0.0009","90","","90","","90","","294.6","0.09","175","1","175","1","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- O7 Sr V3 -","- O7 Sr V3 -","- O14 Sr2 V6 -","2","0.25","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0355","0.0335","","","0.0811","0.0817","","","","","","1.22","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102996","5.2909","0.0008","10.544","0.002","5.2763","0.0009","90","","90","","90","","294.35","0.09","150","1","150","1","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- O7 Sr V3 -","- O7 Sr V3 -","- O14 Sr2 V6 -","2","0.25","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0362","0.0339","","","0.0789","0.0799","","","","","","1.325","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102997","5.2894","0.0008","10.547","0.002","5.2697","0.0009","90","","90","","90","","293.98","0.09","125","1","125","1","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- O7 Sr V3 -","- O7 Sr V3 -","- O14 Sr2 V6 -","2","0.25","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0366","0.035","","","0.0814","0.0823","","","","","","1.336","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102998","5.2918","0.0012","10.55","0.003","5.2717","0.0014","90","","90","","90","","294.31","0.13","100","1","100","1","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- O7 Sr V3 -","- O7 Sr V3 -","- O14 Sr2 V6 -","2","0.25","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0337","0.032","","","0.0784","0.0793","","","","","","1.242","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2102999","10.446","0.003","10.365","0.002","5.2889","0.0015","90","","90","","90","","572.6","0.3","297","1","297","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0228","0.0202","","","0.0531","0.0536","","","","","","1.277","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103000","10.444","0.003","10.368","0.002","5.2927","0.0015","90","","90","","90","","573.1","0.3","287","1","287","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.023","0.0196","","","0.0516","0.0524","","","","","","0.933","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103001","10.437","0.003","10.367","0.002","5.2947","0.0015","90","","90","","90","","572.9","0.3","275","1","275","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0242","0.0205","","","0.0593","0.0605","","","","","","0.976","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103002","10.442","0.003","10.367","0.002","5.2914","0.0015","90","","90","","90","","572.8","0.3","262","1","262","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0225","0.0191","","","0.0534","0.0548","","","","","","0.938","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103003","10.436","0.003","10.367","0.002","5.2921","0.0015","90","","90","","90","","572.6","0.3","250","1","250","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0222","0.0192","","","0.0541","0.0552","","","","","","0.941","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103004","10.436","0.003","10.368","0.002","5.2911","0.0015","90","","90","","90","","572.5","0.3","237","1","237","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0215","0.0187","","","0.0531","0.0538","","","","","","0.901","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103005","10.431","0.003","10.366","0.002","5.2918","0.0015","90","","90","","90","","572.2","0.3","225","1","225","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0237","0.0201","","","0.0564","0.0578","","","","","","0.931","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103006","10.442","0.003","10.367","0.002","5.286","0.0016","90","","90","","90","","572.2","0.3","219","1","219","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0232","0.0198","","","0.0612","0.0634","","","","","","0.794","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103007","10.423","0.003","10.366","0.003","5.2958","0.0019","90","","90","","90","","572.2","0.3","212","1","212","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0231","0.0195","","","0.0493","0.0502","","","","","","1.091","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103008","10.427","0.003","10.37","0.002","5.2904","0.0015","90","","90","","90","","572","0.3","206","1","206","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0217","0.0192","","","0.0619","0.0634","","","","","","0.804","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103009","10.426","0.003","10.367","0.002","5.2909","0.0015","90","","90","","90","","571.9","0.3","200","1","200","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.022","0.0193","","","0.0559","0.0567","","","","","","0.934","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103010","10.423","0.003","10.367","0.002","5.2902","0.0015","90","","90","","90","","571.6","0.3","187","1","187","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0221","0.019","","","0.0546","0.0557","","","","","","0.937","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103011","10.421","0.003","10.369","0.002","5.2905","0.0015","90","","90","","90","","571.7","0.3","175","1","175","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0221","0.0186","","","0.054","0.0552","","","","","","0.968","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103012","10.418","0.003","10.368","0.002","5.2892","0.0015","90","","90","","90","","571.3","0.3","162","1","162","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0218","0.0185","","","0.052","0.0529","","","","","","0.956","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103013","10.416","0.003","10.37","0.002","5.2893","0.0015","90","","90","","90","","571.3","0.3","150","1","150","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0219","0.0187","","","0.0532","0.0545","","","","","","0.929","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103014","10.413","0.003","10.37","0.002","5.2886","0.0015","90","","90","","90","","571.1","0.3","137","1","137","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.0215","0.0183","","","0.0551","0.056","","","","","","0.954","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103015","10.409","0.003","10.37","0.002","5.2875","0.0015","90","","90","","90","","570.7","0.3","125","1","125","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.71073","MoKα","","0.022","0.019","","","0.0529","0.0543","","","","","","0.97","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103016","10.409","0.003","10.372","0.002","5.2884","0.0015","90","","90","","90","","570.9","0.3","112","1","112","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.7093","MoKα","","0.0218","0.0189","","","0.0545","0.0557","","","","","","0.973","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103017","10.409","0.003","10.374","0.002","5.2876","0.0015","90","","90","","90","","571","0.3","100","1","100","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca O7 V3 -","- Ca O7 V3 -","- Ca4 O28 V12 -","4","0.5","BM5051","Prinz, Sebastian; Sparta, Karine M.; Roth, Georg","Temperature dependence of the <i>A</i>V~3~O~7~ (<i>A</i> = Ca, Sr) structure","Acta Crystallographica Section B","2007","63","6","836","842","10.1107/S0108768107050550","","","0.7093","","","0.0212","0.0185","","","0.0535","0.0545","","","","","","0.945","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103018","10.2203","0.0003","10.2203","0.0003","9.1508","0.0003","90","","90","","90","","955.84","0.05","296","2","296","2","","","","","","","","3","P 4/n :2","-P 4a","85","","","","- O5 Pr9 Sb5 -","- O5 Pr9 Sb5 -","- O10 Pr18 Sb10 -","2","0.25","BP5006","Nuss, Jürgen; Jansen, Martin","Reticular merohedral twinning within the La~9~Sb~5~O~5~ structure family: structure of Pr~9~Sb~5~O~5~, Sm~9~Sb~5~O~5~ and Dy~9~Sb~5~O~5~","Acta Crystallographica Section B","2007","63","6","843","849","10.1107/S0108768107051282","","","0.71073","MoKα","","0.0256","0.0234","","","0.0543","0.0552","","","","","","1.215","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103019","10.0341","0.0004","10.0341","0.0004","8.9839","0.0003","90","","90","","90","","904.53","0.06","296","2","296","2","","","","","","","","3","P 4/n :2","-P 4a","85","","","","- O5 Sb5 Sm9 -","- O5 Sb5 Sm9 -","- O10 Sb10 Sm18 -","2","0.25","BP5006","Nuss, Jürgen; Jansen, Martin","Reticular merohedral twinning within the La~9~Sb~5~O~5~ structure family: structure of Pr~9~Sb~5~O~5~, Sm~9~Sb~5~O~5~ and Dy~9~Sb~5~O~5~","Acta Crystallographica Section B","2007","63","6","843","849","10.1107/S0108768107051282","","","0.71073","MoKα","","0.0436","0.0289","","","0.0531","0.0573","","","","","","1.077","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103020","9.8389","0.0003","9.8389","0.0003","8.7986","0.0003","90","","90","","90","","851.74","0.05","296","2","296","2","","","","","","","","3","P 4/n :2","-P 4a","85","","","","- Dy9 O5 Sb5 -","- Dy9 O5 Sb5 -","- Dy18 O10 Sb10 -","2","0.25","BP5006","Nuss, Jürgen; Jansen, Martin","Reticular merohedral twinning within the La~9~Sb~5~O~5~ structure family: structure of Pr~9~Sb~5~O~5~, Sm~9~Sb~5~O~5~ and Dy~9~Sb~5~O~5~","Acta Crystallographica Section B","2007","63","6","843","849","10.1107/S0108768107051282","","","0.71073","MoKα","","0.0367","0.027","","","0.0547","0.0579","","","","","","1.081","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103021","6.9115","0.0006","10.8895","0.0014","13.8927","0.0014","109.908","0.01","101.551","0.008","93.905","0.009","952.61","0.19","100","1","100","1","","","","","","","","3","P -1","-P 1","2","","bis(η^5^-Pentamethyl-cyclopentadienyl)-di-zinc(i)","","- C20 H30 Zn2 -","- C20 H30 Zn2 -","- C40 H60 Zn4 -","2","1","BS5050","Juan F. Van der Maelen Uria; Enrique Gutierrez Puebla; Angeles Monge; Santiago Garcia-Granda; Irene Resa; Ernesto Carmona; Maria Teresa Fernandez-Diaz; Garry J. McIntyre; Philip Pattison; Hans-Peter Weber","Experimental and theoretical characterization of the Zn—Zn bond in [Zn~2~(η^5^-C~5~Me~5~)~2~]","Acta Crystallographica Section B","2007","63","6","862","868","10.1107/S0108768107045880","","","0.71","synchrotron","","0.043","0.036","","","","0.04","","","","","","1.095","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103022","6.9329","0.0003","10.8831","0.0005","13.8384","0.0007","109.777","0.001","101.603","0.001","94.201","0.001","951.09","0.08","170","2","170","2","","","","","","","","3","P -1","-P 1","2","","bis(η^5^-Pentamethyl-cyclopentadienyl)-di-zinc(i)","","- C20 H30 Zn2 -","- C20 H30 Zn2 -","- C40 H60 Zn4 -","2","1","BS5050","Juan F. Van der Maelen Uria; Enrique Gutierrez Puebla; Angeles Monge; Santiago Garcia-Granda; Irene Resa; Ernesto Carmona; Maria Teresa Fernandez-Diaz; Garry J. McIntyre; Philip Pattison; Hans-Peter Weber","Experimental and theoretical characterization of the Zn—Zn bond in [Zn~2~(η^5^-C~5~Me~5~)~2~]","Acta Crystallographica Section B","2007","63","6","862","868","10.1107/S0108768107045880","","","","white-beam","","0.1779","0.1047","","","0.2289","0.2643","","","","","","1.078","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2103023","9.276","0.001","10.913","0.001","21.256","0.002","100.58","0.01","102.52","0.01","90.51","0.01","2062.2","0.4","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","","1:1 rac-1,2-cyclohexanediol triphenylphosphine oxide","","- C24 H27 O3 P -","- C24 H27 O3 P -","- C96 H108 O12 P4 -","4","2","DE5032","Siegler, Maxime A.; Fu, Yigang; Simpson, Greg H.; King, Daniel P.; Parkin, Sean; Brock, Carolyn Pratt","An unexpected co-crystal with a variable degree of order: 1:1 <i>rac</i>-1,2-cyclohexanediol/triphenylphosphine oxide","Acta Crystallographica Section B","2007","63","6","912","925","10.1107/S0108768107054699","","","0.71073","MoKα","","0.0918","0.0487","","","0.1045","0.1215","","","","","","1.059","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2103024","9.273","0.001","10.919","0.001","21.262","0.002","100.66","0.01","102.56","0.01","90.23","0.01","2062.8","0.4","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","","1:1 rac-1,2-cyclohexanediol triphenylphosphine oxide","","- C24 H27 O3 P -","- C24 H27 O3 P -","- C96 H108 O12 P4 -","4","2","DE5032","Siegler, Maxime A.; Fu, Yigang; Simpson, Greg H.; King, Daniel P.; Parkin, Sean; Brock, Carolyn Pratt","An unexpected co-crystal with a variable degree of order: 1:1 <i>rac</i>-1,2-cyclohexanediol/triphenylphosphine oxide","Acta Crystallographica Section B","2007","63","6","912","925","10.1107/S0108768107054699","","","0.71073","MoKα","","0.1046","0.0486","","","0.0976","0.1164","","","","","","1.004","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2103025","9.271","0.001","10.923","0.001","21.306","0.002","100.77","0.01","102.53","0.01","90.02","0.01","2067.2","0.4","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","","1:1 rac-1,2-cyclohexanediol triphenylphosphine oxide","","- C24 H27 O3 P -","- C24 H27 O3 P -","- C96 H108 O12 P4 -","4","2","DE5032","Siegler, Maxime A.; Fu, Yigang; Simpson, Greg H.; King, Daniel P.; Parkin, Sean; Brock, Carolyn Pratt","An unexpected co-crystal with a variable degree of order: 1:1 <i>rac</i>-1,2-cyclohexanediol/triphenylphosphine oxide","Acta Crystallographica Section B","2007","63","6","912","925","10.1107/S0108768107054699","","","1.54178","CuKα","","0.0479","0.0388","","","0.0928","0.098","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2103026","41.501","0.004","9.276","0.001","10.913","0.001","90","","100.96","0.01","90","","4124.5","0.7","90","0.2","90","0.2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1:1 rac-1,2-cyclohexanediol triphenylphosphine oxide","","- C24 H27 O3 P -","- C24 H27 O3 P -","- C192 H216 O24 P8 -","8","1","DE5032","Siegler, Maxime A.; Fu, Yigang; Simpson, Greg H.; King, Daniel P.; Parkin, Sean; Brock, Carolyn Pratt","An unexpected co-crystal with a variable degree of order: 1:1 <i>rac</i>-1,2-cyclohexanediol/triphenylphosphine oxide","Acta Crystallographica Section B","2007","63","6","912","925","10.1107/S0108768107054699","","","0.71073","MoKα","","0.1016","0.0743","","","0.1122","0.1209","","","","","","1.276","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2103027","41.506","0.004","9.273","0.001","10.919","0.001","90","","100.98","0.01","90","","4125.6","0.7","90","0.2","90","0.2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1:1 rac-1,2-cyclohexanediol triphenylphosphine oxide","","- C24 H27 O3 P -","- C24 H27 O3 P -","- C192 H216 O24 P8 -","8","1","DE5032","Siegler, Maxime A.; Fu, Yigang; Simpson, Greg H.; King, Daniel P.; Parkin, Sean; Brock, Carolyn Pratt","An unexpected co-crystal with a variable degree of order: 1:1 <i>rac</i>-1,2-cyclohexanediol/triphenylphosphine oxide","Acta Crystallographica Section B","2007","63","6","912","925","10.1107/S0108768107054699","","","0.71073","MoKα","","0.0891","0.0527","","","0.0951","0.1066","","","","","","1.111","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2103028","41.597","0.004","9.271","0.001","10.923","0.001","90","","101.04","0.01","90","","4134.5","0.7","90","0.2","90","0.2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1:1 rac-1,2-cyclohexanediol triphenylphosphine oxide","","- C24 H27 O3 P -","- C24 H27 O3 P -","- C192 H216 O24 P8 -","8","1","DE5032","Siegler, Maxime A.; Fu, Yigang; Simpson, Greg H.; King, Daniel P.; Parkin, Sean; Brock, Carolyn Pratt","An unexpected co-crystal with a variable degree of order: 1:1 <i>rac</i>-1,2-cyclohexanediol/triphenylphosphine oxide","Acta Crystallographica Section B","2007","63","6","912","925","10.1107/S0108768107054699","","","1.54178","CuKα","","0.0547","0.0491","","","0.1129","0.1157","","","","","","1.178","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2103029","9.348","0.002","11","0.002","21.55","0.003","100.18","0.01","102.44","0.01","90.5","0.01","2127.3","0.7","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","1:1 rac-1,2-cyclohexanediol triphenylphosphine oxide","","- C24 H27 O3 P -","- C24 H27 O3 P -","- C96 H108 O12 P4 -","4","2","DE5032","Siegler, Maxime A.; Fu, Yigang; Simpson, Greg H.; King, Daniel P.; Parkin, Sean; Brock, Carolyn Pratt","An unexpected co-crystal with a variable degree of order: 1:1 <i>rac</i>-1,2-cyclohexanediol/triphenylphosphine oxide","Acta Crystallographica Section B","2007","63","6","912","925","10.1107/S0108768107054699","","","0.71073","MoKα","","0.0959","0.0465","","","0.0989","0.1169","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2103030","9.348","0.002","10.997","0.002","21.556","0.003","100.21","0.01","102.49","0.01","90.24","0.01","2127.2","0.7","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","1:1 rac-1,2-cyclohexanediol triphenylphosphine oxide","","- C24 H27 O3 P -","- C24 H27 O3 P -","- C96 H108 O12 P4 -","4","2","DE5032","Siegler, Maxime A.; Fu, Yigang; Simpson, Greg H.; King, Daniel P.; Parkin, Sean; Brock, Carolyn Pratt","An unexpected co-crystal with a variable degree of order: 1:1 <i>rac</i>-1,2-cyclohexanediol/triphenylphosphine oxide","Acta Crystallographica Section B","2007","63","6","912","925","10.1107/S0108768107054699","","","0.71073","MoKα","","0.0812","0.0444","","","0.1037","0.1175","","","","","","1.025","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2103031","9.347","0.002","11","0.002","21.563","0.003","100.25","0.01","102.51","0.01","90.1","0.01","2128","0.7","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","1:1 rac-1,2-cyclohexanediol triphenylphosphine oxide","","- C24 H27 O3 P -","- C24 H27 O3 P -","- C96 H108 O12 P4 -","4","2","DE5032","Siegler, Maxime A.; Fu, Yigang; Simpson, Greg H.; King, Daniel P.; Parkin, Sean; Brock, Carolyn Pratt","An unexpected co-crystal with a variable degree of order: 1:1 <i>rac</i>-1,2-cyclohexanediol/triphenylphosphine oxide","Acta Crystallographica Section B","2007","63","6","912","925","10.1107/S0108768107054699","","","0.71073","MoKα","","0.1072","0.0488","","","0.0995","0.1186","","","","","","1.014","","","","has coordinates,has disorder,has Fobs","176768","2020-10-21","18:00:00",""
"2103032","42.088","0.006","9.348","0.002","11","0.002","90","","100.54","0.01","90","","4254.8","1.3","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1:1 rac-1,2-cyclohexanediol triphenylphosphine oxide","","- C24 H27 O3 P -","- C24 H27 O3 P -","- C192 H216 O24 P8 -","8","1","DE5032","Siegler, Maxime A.; Fu, Yigang; Simpson, Greg H.; King, Daniel P.; Parkin, Sean; Brock, Carolyn Pratt","An unexpected co-crystal with a variable degree of order: 1:1 <i>rac</i>-1,2-cyclohexanediol/triphenylphosphine oxide","Acta Crystallographica Section B","2007","63","6","912","925","10.1107/S0108768107054699","","","0.71073","MoKα","","0.1042","0.0728","","","0.1015","0.1108","","","","","","1.213","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2103033","42.092","0.006","9.348","0.002","10.997","0.002","90","","100.51","0.01","90","","4254.5","1.3","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1:1 rac-1,2-cyclohexanediol triphenylphosphine oxide","","- C24 H27 O3 P -","- C24 H27 O3 P -","- C192 H216 O24 P8 -","8","1","DE5032","Siegler, Maxime A.; Fu, Yigang; Simpson, Greg H.; King, Daniel P.; Parkin, Sean; Brock, Carolyn Pratt","An unexpected co-crystal with a variable degree of order: 1:1 <i>rac</i>-1,2-cyclohexanediol/triphenylphosphine oxide","Acta Crystallographica Section B","2007","63","6","912","925","10.1107/S0108768107054699","","","0.71073","MoKα","","0.0796","0.056","","","0.1123","0.1208","","","","","","1.177","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2103034","42.102","0.006","9.347","0.002","11","0.002","90","","100.52","0.01","90","","4256","1.3","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1:1 rac-1,2-cyclohexanediol triphenylphosphine oxide","","- C24 H27 O3 P -","- C24 H27 O3 P -","- C192 H216 O24 P8 -","8","1","DE5032","Siegler, Maxime A.; Fu, Yigang; Simpson, Greg H.; King, Daniel P.; Parkin, Sean; Brock, Carolyn Pratt","An unexpected co-crystal with a variable degree of order: 1:1 <i>rac</i>-1,2-cyclohexanediol/triphenylphosphine oxide","Acta Crystallographica Section B","2007","63","6","912","925","10.1107/S0108768107054699","","","0.71073","MoKα","","0.0864","0.0512","","","0.115","0.1263","","","","","","1.098","","","","has coordinates,has disorder","176768","2020-10-21","18:00:00",""
"2103035","9.6412","0.0005","3.1506","0.0002","8.3035","0.0005","90","","113.986","0.006","90","","230.44","0.03","295","","295","","","","","","","","","4","P 1 2/m 1","-P 2y","10","Magnesium oxychloride","Trimagnesium pentahydroxide triaqua chloride monohydrate","","- Cl H13 Mg3 O9 -","- Cl H13 Mg3 O9 -","- Cl H13 Mg3 O9 -","1","0.25","KD5015","Sugimoto, Kunihisa; E. Dinnebier, Robert; Schlecht, Thomas","Structure determination of Mg~3~(OH)~5~Cl·4H~2~O (F5 phase) from laboratory powder diffraction data and its impact on the analysis of problematic magnesia floors","Acta Crystallographica Section B","2007","63","6","805","811","10.1107/S0108768107046654","","","1.54059","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2103036","10.4969","0.0001","10.4969","0.0001","10.4969","0.0001","90","","90","","90","","1156.6","0.019","293","2","293","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- Cs1.805 Eu0.805 O12 P3 Zr1.195 -","- Cs1.8061 Eu0.806 O12 P3 Zr1.1939 -","- Cs7.2244 Eu3.224 O48 P12 Zr4.7756 -","4","0.333333","SX5073","Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Zatovsky, Igor V.; Slobodyanik, Nikolay S.; Shishkin, Oleg V.; Domasevitch, Konstantin V.","Equilibrium langbeinite-related phosphates Cs~1+<i>x~</i>Ln~<i>x~</i>Zr~2{-~<i>x</i>}(PO~4~)~3~ (Ln = Sm‒Lu) in the melted systems Cs~2~O‒P~2~O~5~‒LnF~3~‒ZrF~4~","Acta Crystallographica Section B","2007","63","6","819","827","10.1107/S0108768107049385","","","0.71073","MoKα","","0.0194","0.0169","","","0.0286","0.029","","","","","","1.167","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2103037","10.4752","0.0005","10.4752","0.0005","10.4752","0.0005","90","","90","","90","","1149.44","0.1","293","2","293","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- Cs1.793 Gd0.793 O12 P3 Zr1.207 -","- Cs1.793 Gd0.7919 O12 P3 Zr1.207 -","- Cs7.172 Gd3.1676 O48 P12 Zr4.828 -","4","0.333333","SX5073","Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Zatovsky, Igor V.; Slobodyanik, Nikolay S.; Shishkin, Oleg V.; Domasevitch, Konstantin V.","Equilibrium langbeinite-related phosphates Cs~1+<i>x~</i>Ln~<i>x~</i>Zr~2{-~<i>x</i>}(PO~4~)~3~ (Ln = Sm‒Lu) in the melted systems Cs~2~O‒P~2~O~5~‒LnF~3~‒ZrF~4~","Acta Crystallographica Section B","2007","63","6","819","827","10.1107/S0108768107049385","","","0.71073","MoKα","","0.0121","0.012","","","0.0292","0.0293","","","","","","1.371","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2103038","10.492","0.0012","10.492","0.0012","10.492","0.0012","90","","90","","90","","1155","0.2","293","2","293","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- Cs1.87 O12 P3 Tb0.87 Zr1.13 -","- Cs1.871 O12 P3 Tb0.8708 Zr1.1292 -","- Cs7.484 O48 P12 Tb3.4832 Zr4.5168 -","4","0.333333","SX5073","Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Zatovsky, Igor V.; Slobodyanik, Nikolay S.; Shishkin, Oleg V.; Domasevitch, Konstantin V.","Equilibrium langbeinite-related phosphates Cs~1+<i>x~</i>Ln~<i>x~</i>Zr~2{-~<i>x</i>}(PO~4~)~3~ (Ln = Sm‒Lu) in the melted systems Cs~2~O‒P~2~O~5~‒LnF~3~‒ZrF~4~","Acta Crystallographica Section B","2007","63","6","819","827","10.1107/S0108768107049385","","","0.71073","MoKα","","0.0181","0.0172","","","0.0472","0.0476","","","","","","1.254","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2103039","10.429","0.0001","10.429","0.0001","10.429","0.0001","90","","90","","90","","1134.3","0.019","293","2","293","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- Cs1.67 Dy0.67 O12 P3 Zr1.33 -","- Cs1.667 Dy0.667 O12 P3 Zr1.3329 -","- Cs6.668 Dy2.668 O48 P12 Zr5.3316 -","4","0.333333","SX5073","Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Zatovsky, Igor V.; Slobodyanik, Nikolay S.; Shishkin, Oleg V.; Domasevitch, Konstantin V.","Equilibrium langbeinite-related phosphates Cs~1+<i>x~</i>Ln~<i>x~</i>Zr~2{-~<i>x</i>}(PO~4~)~3~ (Ln = Sm‒Lu) in the melted systems Cs~2~O‒P~2~O~5~‒LnF~3~‒ZrF~4~","Acta Crystallographica Section B","2007","63","6","819","827","10.1107/S0108768107049385","","","0.71073","MoKα","","0.0331","0.0305","","","0.0686","0.0698","","","","","","1.157","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2103040","10.4372","0.0001","10.4372","0.0001","10.4372","0.0001","90","","90","","90","","1136.98","0.019","293","2","293","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- Cs1.745 Ho0.745 O12 P3 Zr1.255 -","- Cs1.746 Ho0.7457 O12 P3 Zr1.2542 -","- Cs6.984 Ho2.9828 O48 P12 Zr5.0168 -","4","0.333333","SX5073","Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Zatovsky, Igor V.; Slobodyanik, Nikolay S.; Shishkin, Oleg V.; Domasevitch, Konstantin V.","Equilibrium langbeinite-related phosphates Cs~1+<i>x~</i>Ln~<i>x~</i>Zr~2{-~<i>x</i>}(PO~4~)~3~ (Ln = Sm‒Lu) in the melted systems Cs~2~O‒P~2~O~5~‒LnF~3~‒ZrF~4~","Acta Crystallographica Section B","2007","63","6","819","827","10.1107/S0108768107049385","","","0.71073","MoKα","","0.0297","0.0244","","","0.0416","0.0429","","","","","","1.213","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2103041","10.4142","0.0002","10.4142","0.0002","10.4142","0.0002","90","","90","","90","","1129.48","0.04","293","2","293","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- Cs1.775 Er0.775 O12 P3 Zr1.225 -","- Cs1.775 Er0.7741 O12 P3 Zr1.2258 -","- Cs7.1 Er3.0964 O48 P12 Zr4.9032 -","4","0.333333","SX5073","Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Zatovsky, Igor V.; Slobodyanik, Nikolay S.; Shishkin, Oleg V.; Domasevitch, Konstantin V.","Equilibrium langbeinite-related phosphates Cs~1+<i>x~</i>Ln~<i>x~</i>Zr~2{-~<i>x</i>}(PO~4~)~3~ (Ln = Sm‒Lu) in the melted systems Cs~2~O‒P~2~O~5~‒LnF~3~‒ZrF~4~","Acta Crystallographica Section B","2007","63","6","819","827","10.1107/S0108768107049385","","","0.71073","MoKα","","0.0291","0.0259","","","0.0402","0.0418","","","","","","1.294","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2103042","10.3982","0.0001","10.3982","0.0001","10.3982","0.0001","90","","90","","90","","1124.28","0.019","293","2","293","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- Cs1.7 O12 P3 Tm0.7 Zr1.3 -","- Cs1.704 O12 P3 Tm0.7031 Zr1.2969 -","- Cs6.816 O48 P12 Tm2.8124 Zr5.1876 -","4","0.333333","SX5073","Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Zatovsky, Igor V.; Slobodyanik, Nikolay S.; Shishkin, Oleg V.; Domasevitch, Konstantin V.","Equilibrium langbeinite-related phosphates Cs~1+<i>x~</i>Ln~<i>x~</i>Zr~2{-~<i>x</i>}(PO~4~)~3~ (Ln = Sm‒Lu) in the melted systems Cs~2~O‒P~2~O~5~‒LnF~3~‒ZrF~4~","Acta Crystallographica Section B","2007","63","6","819","827","10.1107/S0108768107049385","","","0.71073","MoKα","","0.0282","0.025","","","0.0384","0.0396","","","","","","1.197","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2103043","10.3616","0.0001","10.3616","0.0001","10.3616","0.0001","90","","90","","90","","1112.45","0.019","293","2","293","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- Cs1.515 O12 P3 Yb0.515 Zr1.485 -","- Cs1.5155 O12 P3 Yb0.5146 Zr1.4852 -","- Cs6.062 O48 P12 Yb2.0584 Zr5.9408 -","4","0.333333","SX5073","Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Zatovsky, Igor V.; Slobodyanik, Nikolay S.; Shishkin, Oleg V.; Domasevitch, Konstantin V.","Equilibrium langbeinite-related phosphates Cs~1+<i>x~</i>Ln~<i>x~</i>Zr~2{-~<i>x</i>}(PO~4~)~3~ (Ln = Sm‒Lu) in the melted systems Cs~2~O‒P~2~O~5~‒LnF~3~‒ZrF~4~","Acta Crystallographica Section B","2007","63","6","819","827","10.1107/S0108768107049385","","","0.71073","MoKα","","0.0281","0.0202","","","0.0331","0.0346","","","","","","0.963","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2103044","10.38651","0.00017","10.38651","0.00017","10.38651","0.00017","90","","90","","90","","1120.49","0.03","293","2","293","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- Cs1.625 Lu0.625 O12 P3 Zr1.375 -","- Cs1.6265 Lu0.6257 O12 P3 Zr1.3742 -","- Cs6.506 Lu2.5028 O48 P12 Zr5.4968 -","4","0.333333","SX5073","Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Zatovsky, Igor V.; Slobodyanik, Nikolay S.; Shishkin, Oleg V.; Domasevitch, Konstantin V.","Equilibrium langbeinite-related phosphates Cs~1+<i>x~</i>Ln~<i>x~</i>Zr~2{-~<i>x</i>}(PO~4~)~3~ (Ln = Sm‒Lu) in the melted systems Cs~2~O‒P~2~O~5~‒LnF~3~‒ZrF~4~","Acta Crystallographica Section B","2007","63","6","819","827","10.1107/S0108768107049385","","","0.71073","MoKα","","0.018","0.0161","","","0.0327","0.033","","","","","","1.088","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00",""
"2103045","16.30365","","16.30365","","8.27597","","90","","90","","120","","1905.11","","1.6","","1.6","","","","","","","","","4","P 63/m","-P 6c","176","calcium aluminate deca hydrate","","","- Al2 Ca D16.84 O12.42 -","- Al2 Ca D16.844 O12.422 -","- Al12 Ca6 D101.064 O74.532 -","6","0.5","WS5055","Christensen, Axel Nørlund; Lebech, Bente; Sheptyakov, Denis; Hanson, Jonathan C.","Structure of calcium aluminate decahydrate (CaAl~2~O~4~·10D~2~O) from neutron and X-ray powder diffraction data","Acta Crystallographica, Section B: Structural Science","2007","63","6","850","861","10.1107/S0108768107035136","","neutron","1.8854","neutron","","","","","","","","","","4.3474","","","","","","","has coordinates","209472","2020-10-21","18:00:00",""
"2106582","3.066045","","3.066045","","22.59311","","90","","90","","120","","183.935","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","(Co4 Al2 (O H)12 C O3 (H2 O)3)0.5","","- C0.5 H9 Al Co2 O9 -","- C0.46722 Al0.93441 Co2.04471 O8.99286 -","- C0.46722 Al0.93441 Co2.04471 O8.99286 -","1","0.0277778","","Radha, A.V.; Kamath, P.V.; Shivakumara, C.","Order and disorder among the layered double hydroxides: A combined Rietveld and DIFFaX approach","Acta Crystallographica B (39,1983-)","2007","63","","243","250","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2210880","48.124","0.011","4.1083","0.0002","23.99","0.005","90","","118.76","0.02","90","","4158.2","1.5","292","","292","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Hg3 Pb16 S46 Sb18 -","- Hg3 Pb16 S46 Sb18 -","- Hg6 Pb32 S92 Sb36 -","2","0.25","BI2073","Laufek, František; Sejkora, Jiří; Fejfarová, Karla; Dušek, Michal; Ozdín, Daniel","The mineral marrucciite: monoclinic Hg~3~Pb~16~Sb~18~S~46~","Acta Crystallographica, Section E","2007","63","11","i190","i190","10.1107/S1600536806040980","","","0.71069","MoKα","","0.0493","0.0241","","","0.0427","0.0451","","","","","","0.85","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2211694","11.308","0.002","16.736","0.003","10.325","0.002","90","","90","","90","","1954","0.6","298","2","298","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","N,N'-(2-Hydroxy-3-methoxybenzyl)benzene-1,4-diamine","","- C22 H24 N2 O4 -","- C22 H24 N2 O4 -","- C88 H96 N8 O16 -","4","0.5","AT2160","H.-T. Xia; Y.-F. Liu; S.-P. Yang; D.-Q. Wang","<i>N</i>,<i>N</i>'-(2-Hydroxy-3-methoxybenzyl)benzene-1,4-diamine","Acta Crystallographica Section E","2007","63","1","o40","o41","10.1107/S1600536806049208","","","0.71073","MoKα","","0.1527","0.059","","","0.1415","0.2007","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211695","8.352","0.0017","9.502","0.0019","11.751","0.002","89.57","0.03","80.43","0.03","81.83","0.03","910.1","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5-(2-Chlorophenyl)-3-(4-chlorophenyl)-1-phenyl-2-pyrazoline","","- C21 H16 Cl2 N2 -","- C21 H16 Cl2 N2 -","- C42 H32 Cl4 N4 -","2","1","AT2167","Huan-Mei Guo; Fang-Fang Jian; Pu-Su Zhao; Yun-Chen Zhang; Yu-Feng Li","5-(2-Chlorophenyl)-3-(4-chlorophenyl)-1-phenyl-2-pyrazoline","Acta Crystallographica Section E","2007","63","1","o215","o216","10.1107/S1600536806050008","","","0.71073","MoKα","","0.0541","0.0405","","","0.1045","0.1124","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211696","16.774","0.003","6.5029","0.0013","18.691","0.004","90","","112.24","0.03","90","","1887.1","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3-Bis(1-phenyl-1H-tetrazole-5-ylsulfanyl)propane","","- C17 H16 N8 S2 -","- C17 H16 N8 S2 -","- C68 H64 N32 S8 -","4","1","AT2168","Peng Lei; Wei Wang; Qing-Shan Yang; De-Qian Shi","1,3-Bis(1-phenyl-1<i>H</i>-tetrazole-5-ylsulfanyl)propane","Acta Crystallographica Section E","2007","63","1","o110","o111","10.1107/S1600536806051099","","","0.71073","MoKα","","0.0694","0.0497","","","0.1185","0.1311","","","","","","1.097","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211697","9.1304","0.0018","17.414","0.004","10.964","0.002","90","","97.74","0.03","90","","1727.4","0.6","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Acetylenedicarboxylato)diaqua(1,10-phenanthroline)copper(II) dihydrate","","- C16 H16 Cu N2 O8 -","- C16 H16 Cu N2 O8 -","- C64 H64 Cu4 N8 O32 -","4","1","AT2169","Wang, Huan-Yu; Gao, Shan; Huo, Li-Hua; Zhao, Jing-Gui","(Acetylenedicarboxylato)diaqua(1,10-phenanthroline)copper(II) dihydrate","Acta Crystallographica Section E","2007","63","1","m7","m8","10.1107/S1600536806051087","","","0.71073","MoKα","","0.0344","0.029","","","0.0743","0.0772","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211698","9.456","0.002","15.451","0.003","17.104","0.003","90","","93.687","0.002","90","","2493.8","0.8","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tris(nitrato-κ^2^O,O')bis(1,10-phenanthroline-κ^2^N,N')ytterbium(III)","","- C24 H16 N7 O9 Yb -","- C24 H16 N7 O9 Yb -","- C96 H64 N28 O36 Yb4 -","4","0.5","AT2172","Liu, Y.-F.; Xia, H.-T.; Yang, S.-P.; Wang, D.-Q.","Tris(nitrato-κ^2^<i>O</i>,<i>O</i>')bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')ytterbium(III)","Acta Crystallographica Section E","2007","63","1","m12","m14","10.1107/S1600536806051105","","","0.71073","MoKα","","0.0403","0.0328","","","0.0748","0.0787","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211699","8.04","0.003","8.193","0.003","11.656","0.005","83.246","0.005","85.316","0.005","70.287","0.004","717.1","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","4-Methyl-7-phenylsulfonamido-2H-1-benzopyran-2-one","","- C16 H13 N O4 S -","- C16 H13 N O4 S -","- C32 H26 N2 O8 S2 -","2","1","AT2173","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi","4-Methyl-7-phenylsulfonamido-2<i>H</i>-1-benzopyran-2-one","Acta Crystallographica Section E","2007","63","1","o135","o137","10.1107/S1600536806051117","","","0.71073","MoKα","","0.0655","0.0455","","","0.1068","0.1237","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211700","7.731","0.003","9.301","0.003","11.97","0.003","81.031","0.003","72.354","0.002","82.339","0.003","806.8","0.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","N,N'-Bis(4-chlorobenzylidene)propane-1,2-diamine","","- C17 H16 Cl2 N2 -","- C17 H16 Cl2 N2 -","- C34 H32 Cl4 N4 -","2","1","AT2174","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Xia, Hai-Tao","<i>N</i>,<i>N</i>'-Bis(4-chlorobenzylidene)propane-1,2-diamine","Acta Crystallographica Section E","2007","63","1","o141","o143","10.1107/S160053680605183X","","","0.71073","MoKα","","0.0843","0.0446","","","0.0959","0.1152","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211701","8.7691","0.0012","9.3196","0.0013","14.389","0.002","97.715","0.002","94.826","0.002","92.492","0.002","1159.4","0.3","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","O,O-Diethyl [({1-[(2-chlorothiazol-5-yl)methyl]-5-methyl-1H-1,2,3-triazol-4- yl}carbonyloxy)phenylmethyl]phosphonate","","- C19 H22 Cl N4 O5 P S -","- C19 H22 Cl N4 O5 P S -","- C38 H44 Cl2 N8 O10 P2 S2 -","2","1","AT2175","Xiao-Bao Chen; De-Qing Shi","<i>O</i>,<i>O</i>-Diethyl [({1-[(2-chlorothiazol-5-yl)methyl]-5-methyl-1<i>H</i>-1,2,3-triazol-4-yl}carbonyloxy)phenylmethyl]phosphonate","Acta Crystallographica Section E","2007","63","1","o158","o160","10.1107/S1600536806051841","","","0.71073","MoKα","","0.0757","0.0665","","","0.1805","0.1893","","","","","","1.085","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211702","5.1039","0.0003","6.1761","0.0006","28.5758","0.0018","90","","92.444","0.005","90","","899.95","0.12","296","","296","","","","","","","","","4","P 1 c 1","P -2yc","7","","[2-Methyl-4-(3-oxo-1,3-dihydroisobenzofuran-1-ylamino)phenyl]isobenzofuran- 1(3H)-one","","- C23 H17 N O4 -","- C23 H17 N O4 -","- C46 H34 N2 O8 -","2","1","AT2176","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","[2-Methyl-4-(3-oxo-1,3-dihydroisobenzofuran-1-ylamino)phenyl]isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","1","o22","o24","10.1107/S1600536806051063","","","0.71073","MoKα","","0.0734","0.061","","","0.1757","0.1845","","","","","","1.086","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211703","24.017","0.003","6.9536","0.0006","26.924","0.005","90","","120.207","0.011","90","","3885.9","1","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3-(4-iodoanilino)phthalide","3-(4-Iodoanilino)isobenzofuran-1(3H)-one","","- C14 H10 I N O2 -","- C14 H10 I N O2 -","- C168 H120 I12 N12 O24 -","12","3","AT2177","Büyükgüngör, Orhan; Odabaşoğlu, Mustafa","3-(4-Iodoanilino)isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","1","o25","o27","10.1107/S1600536806051075","","","0.71073","MoKα","","0.1551","0.0634","","","0.1904","0.2446","","","","","","0.986","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211704","8.5297","0.0008","9.6214","0.0009","14.6389","0.0014","95.865","0.002","92.955","0.002","90.536","0.002","1193.4","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","O,O-Diethyl ({1-[(6-chloropyridin-3-yl)methyl]-5-methyl-1H-1,2,3-triazol-4- ylcarbonyloxy}(phenyl)methyl)phosphonate","","- C21 H24 Cl N4 O5 P -","- C21 H24 Cl N4 O5 P -","- C42 H48 Cl2 N8 O10 P2 -","2","1","AT2178","Xiao-Bao Chen; De-Qing Shi","<i>O</i>,<i>O</i>-Diethyl ({1-[(6-chloropyridin-3-yl)methyl]-5-methyl-1<i>H</i>-1,2,3-triazol-4-ylcarbonyloxy}phenylmethyl)phosphonate","Acta Crystallographica Section E","2007","63","1","o172","o174","10.1107/S1600536806052391","","","0.71073","MoKα","","0.0753","0.0656","","","0.172","0.1804","","","","","","1.073","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211705","8.708","0.002","17.649","0.003","9.171","0.002","90","","105.115","0.002","90","","1360.7","0.5","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,3-Diphenyl-6,7-dihydro-5H-1,4-diazepine","","- C17 H16 N2 -","- C17 H16 N2 -","- C68 H64 N8 -","4","1","AT2179","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Ding, Tie-Zhu","2,3-Diphenyl-6,7-dihydro-5<i>H</i>-1,4-diazepine","Acta Crystallographica Section E","2007","63","1","o188","o190","10.1107/S160053680605241X","","","0.71073","MoKα","","0.0689","0.0409","","","0.1083","0.1402","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211706","21.834","0.011","8.42","0.004","11.203","0.006","90","","91.778","0.009","90","","2058.6","1.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6,6'-Dimethoxy-2,2'-(hexane-1,6-diyldinitrilodimethylidyne)diphenol","","- C22 H28 N2 O4 -","- C22 H28 N2 O4 -","- C88 H112 N8 O16 -","4","1","AT2182","Xia, H.-T.; Liu, Y.-F.; Wang, D.-Q.; Yang, S.-P.","6,6'-Dimethoxy-2,2'-(hexane-1,6-diyldinitrilodimethylidyne)diphenol","Acta Crystallographica Section E","2007","63","1","o259","o261","10.1107/S1600536806053062","","","0.71073","MoKα","","0.2259","0.0727","","","0.1789","0.2766","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211707","5.3407","0.0004","10.407","0.0008","12.0223","0.0009","106.953","0.006","101.066","0.006","92.143","0.006","624.18","0.09","295","2","","","","","","","","","","4","P -1","-P 1","2","","3-Ethyl-5-(4-oxochroman-3-ylmethylene)-1,3-imidazolidine-2,4-dione","","- C15 H12 N2 O4 -","- C15 H12 N2 O4 -","- C30 H24 N4 O8 -","2","1","AT2183","Aslantaş, Mehmet; Ceylan‒Ünlüsoy, Meltem; Ertan, Rahmiye; Kendi, Engin; Büyükgüngör, Orhan","3-Ethyl-5-(4-oxochroman-3-ylmethylene)-1,3-imidazolidine-2,4-dione","Acta Crystallographica Section E","2007","63","1","o184","o185","10.1107/S1600536806052378","","","0.71073","MoKα","","","0.0428","","","","0.1144","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211709","11.5316","0.0008","7.599","0.0004","19.2535","0.0014","90","","117.47","0.005","90","","1496.93","0.18","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Triethanolammonium 2-formylbenzoate","","- C14 H21 N O6 -","- C14 H21 N O6 -","- C56 H84 N4 O24 -","4","1","AT2185","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","Triethanolammonium 2-formylbenzoate","Acta Crystallographica Section E","2007","63","1","o186","o187","10.1107/S160053680605238X","","","0.71073","MoKα","","0.0794","0.0657","","","0.2072","0.2205","","","","","","1.102","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211710","38.366","0.014","4.837","0.0018","5.298","0.0019","90","","90","","90","","983.2","0.6","298","2","298","2","","","","","","","","5","P m n 21","P 2ac -2","31","","N,N'-Bis(3,4-methylenedioxybenzyl)propane-1,3-diammonium dichloride","","- C19 H24 Cl2 N2 O4 -","- C19 H24 Cl2 N2 O4 -","- C38 H48 Cl4 N4 O8 -","2","0.5","AT2186","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Ding, Tie-Zhu","<i>N</i>,<i>N</i>'-Bis(3,4-methylenedioxybenzyl)propane-1,3-diammonium dichloride","Acta Crystallographica Section E","2007","63","1","o313","o314","10.1107/S1600536806053554","","","0.71073","MoKα","","0.0514","0.0421","","","0.0948","0.0988","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211711","17.806","0.005","20.6","0.005","11.982","0.003","90","","90.812","0.011","90","","4395","2","298","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Bis(μ-cantharidinato)bis[(1,10-phenanthroline)manganese(II)] hexahydrate","bis(μ-2,3-dimethyl-7-oxobicyclo[2.2.1]heptane-2,3- dicarboxylato)bis[(1,10-phenanthroline)manganese(II)] hexahydrate","","- C44 H52 Mn2 N4 O16 -","- C44 H52 Mn2 N4 O16 -","- C176 H208 Mn8 N16 O64 -","4","0.5","AT2187","Guo-Ding Sheng; Liang Shen; Yin-Zhi Jin; Juan Mei","Bis(μ-cantharidinato)bis[(1,10-phenanthroline)manganese(II)] hexahydrate","Acta Crystallographica Section E","2007","63","1","m241","m243","10.1107/S1600536806053566","","","0.71075","MoKα","","","0.0297","","","","0.0744","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211712","15.2835","0.0002","9.5241","0.0001","22.5045","0.0004","90","","106.618","0.001","90","","3138.97","0.08","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","trans-Bromohydridobis(triphenylphosphine)platinum(II)","","- C36 H31 Br P2 Pt -","- C36 H31 Br P2 Pt -","- C144 H124 Br4 P8 Pt4 -","4","0.5","AT2188","Akella Sivaramakrishna; Hong Su; John R. Moss","<i>trans</i>-Bromohydridobis(triphenylphosphine)platinum(II)","Acta Crystallographica Section E","2007","63","1","m244","m245","10.1107/S160053680605358X","","","0.71073","MoKα","","0.0373","0.0275","","","0.0482","0.051","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211713","10.4669","0.0016","13.256","0.002","14.019","0.002","90","","110.918","0.004","90","","1816.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","61121","Diaquabis(1,2-di-4-pyridylethane-κN)bis(2-nitrobenzoate-κO)manganese(II)","","- C38 H36 Mn N6 O10 -","- C38 H36 Mn N6 O10 -","- C76 H72 Mn2 N12 O20 -","2","0.5","AT2189","Li-Li Zhang; Wei-Guang Zhang; Hui Zhong; Yu Zhang","Diaquabis(1,2-di-4-pyridylethane-κ<i>N</i>)bis(2-nitrobenzoate-κ<i>O</i>)manganese(II)","Acta Crystallographica Section E","2007","63","1","m235","m237","10.1107/S1600536806053591","","","0.71073","MoKα","","0.1096","0.0515","","","0.0632","0.0731","","","","","","0.836","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211714","32.347","0.005","32.347","0.005","4.0784","0.0007","90","","90","","120","","3695.6","1","299","2","299","2","","","","","","","","5","R -3 :H","-R 3","148","","2-Ethyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one","","- C7 H7 N3 O S -","- C7 H7 N3 O S -","- C126 H126 N54 O18 S18 -","18","1","AT2191","da Silva, Luiz Everson; Joussef, Antonio Carlos; Foro, Sabine","2-Ethyl-5<i>H</i>-1,3,4-thiadiazolo[3,2-<i>a</i>]pyrimidin-5-one","Acta Crystallographica Section E","2007","63","1","o412","o413","10.1107/S1600536806054584","","","1.5418","CuKα","","0.0416","0.0358","","","0.0931","0.0957","","","","","","1.114","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211715","12.778","0.003","12.655","0.003","15.926","0.004","90","","90","","90","","2575.3","1.1","292","2","292","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,3-Bis(hydroxymethyl)-6-(isopropyl)perhydro-2,3,4a,6,7a- pentaazacyclopenta[cd]indene-1,4-dione","","- C11 H19 N5 O4 -","- C11 H19 N5 O4 -","- C88 H152 N40 O32 -","8","1","AT2193","Hai-Ling Xi; Meng Gao; Li-Ping Cao; Yi-Tao Li","2,3-Bis(hydroxymethyl)-6-isopropylperhydro-2,3,4a,6,7a-pentaazacyclopenta[<i>cd</i>]indene-1,4-dione","Acta Crystallographica Section E","2007","63","1","o400","o401","10.1107/S1600536806054882","","","0.71073","MoKα","","0.1318","0.0575","","","0.1111","0.1269","","","","","","0.827","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211716","7.9679","0.001","14.4604","0.0018","33.389","0.004","88.809","0.01","85.795","0.009","78.015","0.009","3753","0.8","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","4-n-hexyloxybenzoic acid","","- C13 H18 O3 -","- C13 H18 O3 -","- C156 H216 O36 -","12","6","BH2056","Nazir, Uzma; Zareen, Akhter; Bolte, Michael; Butt, Saeed; Siddiqi, Humaira M.","A new triclinic polymorph of 4-<i>n</i>-hexyloxybenzoic acid","Acta Crystallographica Section E","2007","63","1","o12","o14","10.1107/S1600536806049518","","","0.71073","MoKα","","0.1093","0.0764","","","0.1917","0.2024","","","","","","1.115","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211717","7.8409","0.0002","21.4009","0.0007","13.1791","0.0003","90","","97.195","0.002","90","","2194.07","0.1","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[aqua(2-amino-4,6-dimethylpyrimidine-κN^1^)copper(II)]- μ-benzene-1,3-dicarboxylato-κ^2^O^1^:O^3^] 2-amino-4,6-dimethylpyrimidine solvate]","","- C20 H24 Cu N6 O5 -","- C20 H24 Cu N6 O5 -","- C80 H96 Cu4 N24 O20 -","4","1","BH2061","Li, Na; Wei, Qing","<i>catena</i>-Poly[[[aqua(2-amino-4,6-dimethylpyrimidine-κ<i>N</i>^1^)copper(II)]-μ-benzene-1,3-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^3^] 2-amino-4,6-dimethylpyrimidine solvate]","Acta Crystallographica Section E","2007","63","1","m184","m186","10.1107/S1600536806052688","","","0.71073","MoKα","","0.0601","0.0452","","","0.1419","0.1488","","","","","","1.044","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2211718","7.8287","0.0008","7.8026","0.0008","30.6427","0.0018","90","","90","","90","","1871.8","0.3","113","2","113","2","","","","","","","","4","P n a 21","P 2c -2n","33","","(4S)-4-Benzyl-4-hydroxyisoxazolidin-3-one","","- C10 H11 N O3 -","- C10 H11 N O3 -","- C80 H88 N8 O24 -","8","2","BH2062","Gao, Hao; Sun, Yun","(4<i>SR</i>)-4-Benzyl-4-hydroxyisoxazolidin-3-one","Acta Crystallographica Section E","2007","63","1","o146","o147","10.1107/S1600536806051816","","","0.71073","MoKα","","0.0441","0.0425","","","0.1046","0.1059","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211719","7.1529","0.001","13.5737","0.0018","9.1813","0.0013","90","","107.797","0.002","90","","848.8","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[diaquacopper(II)]-μ-pyridine-2,4-dicarboxylato-κ^3^N,O^2^:O^4^]","","- C7 H7 Cu N O6 -","- C7 H7 Cu N O6 -","- C28 H28 Cu4 N4 O24 -","4","1","BH2064","Wang, Li-Bin; Pan, Ya-Ru; Zhan, Pei-Ying; Niu, Yan-Ling; Zhang, Gao-Quan","<i>catena</i>-Poly[[diaquacopper(II)]-μ-pyridine-2,4-dicarboxylato-κ^3^<i>N</i>,<i>O</i>^2^:<i>O</i>^4^]","Acta Crystallographica Section E","2007","63","1","m204","m206","10.1107/S1600536806052743","","","0.71073","MoKα","","0.0457","0.0367","","","0.0908","0.0969","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211720","24.95","0.0006","10.737","0.0003","19.456","0.0004","90","","96.978","0.0016","90","","5173.4","0.2","150","1","150","2","","","","","","","","7","C 1 2 1","C 2y","5","","[(R)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl-κ^2^P,P']chlorohydrido{(S)- 2-methyl-1-[(4R,5R)-4-methyl-5-phenyl-4,5-dihydrooxazol-2-yl]propan-1- amineκ^2^N,N'}ruthenium(II) benzene solvate","","- C64 H59 Cl N2 O P2 Ru -","- C64 H59 Cl N2 O P2 Ru -","- C256 H236 Cl4 N8 O4 P8 Ru4 -","4","1","BH2065","Abdur-Rashid, Kamaluddin; Lough, Alan J.","[(<i>R</i>)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl-κ^2^<i>P</i>,<i>P</i>']chlorohydrido{(<i>S</i>)-2-methyl-1-[(4<i>R</i>,5<i>R</i>)-4-methyl-5-phenyl-4,5-dihydrooxazol-2-yl]propan-1-amine-κ^2^<i>N</i>,<i>N</i>'}ruthenium(II) benzene solvate: an active ketone hydrogenation catalyst","Acta Crystallographica Section E","2007","63","1","m246","m248","10.1107/S1600536806053815","","","0.71073","MoKα","","0.065","0.0507","","","0.119","0.1286","","","","","","1.042","","","","has coordinates,has Fobs","209451","2020-10-21","18:00:00",""
"2211721","10.518","0.003","6.706","0.002","13.652","0.006","90","","90","","90","","962.9","0.6","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","5,7-Dimethoxy-2H-chromen-2-one","","- C11 H10 O4 -","- C11 H10 O4 -","- C44 H40 O16 -","4","0.5","BH2068","Hu, Zhi-Yan; Fan, Jie-Ping","5,7-Dimethoxy-2<i>H</i>-chromen-2-one","Acta Crystallographica Section E","2007","63","1","o345","o346","10.1107/S1600536806053803","","","0.71073","MoKα","","0.0542","0.0323","","","0.0803","0.0903","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211722","4.9095","0.0012","12.754","0.003","13.072","0.003","85.969","0.004","79.721","0.004","86.585","0.004","802.5","0.3","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","1-Picolinoyl-3-[(2-pyridyl)(2,2,2-trifluoroacetamido)methyl]urea","","- C15 H12 F3 N5 O3 -","- C15 H12 F3 N5 O3 -","- C30 H24 F6 N10 O6 -","2","1","BH2069","Wang, Yu-Zhou; Gao, Meng; Cao, Li-Ping; Xi, Hai-Ling; Wang, Zhi-Guo","1-Picolinoyl-3-[(2-pyridyl)(2,2,2-trifluoroacetamido)methyl]urea","Acta Crystallographica Section E","2007","63","1","o377","o378","10.1107/S1600536806054109","","","0.71073","MoKα","","0.0985","0.0584","","","0.1552","0.177","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211723","10.5498","0.0018","12.464","0.002","19.203","0.003","73.437","0.002","85.872","0.002","77.195","0.002","2360","0.7","203","2","203","2","","","","","","","","3","P -1","-P 1","2","","","","- C30 H26 O4 -","- C30 H26 O4 -","- C120 H104 O16 -","4","2","BI2092","Jinyu Sun; Lianmei Hu; Zhao Zhang","9,9'-Bifluorene-9,9'-diol ethyl acetate solvate","Acta Crystallographica Section E","2007","63","1","o217","o218","10.1107/S1600536806048306","","","0.71073","MoKα","","0.0607","0.0458","","","0.1111","0.1196","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211724","10.5613","0.0018","16.856","0.003","8.1013","0.0014","90","","96.409","0.014","90","","1433.2","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Ethoxycarbonylmethyl 3-(2-chlorobenzylidene)dithiocarbazate","","- C12 H13 Cl N2 O2 S2 -","- C12 H13 Cl N2 O2 S2 -","- C48 H52 Cl4 N8 O8 S8 -","4","1","BI2096","Tabatabaee, Masoumeh; Ghassemzadeh, Mitra; Dehghan, Ali Reza; Khavasi, Hamid Reza; Heravi, Majid M.","Ethoxycarbonylmethyl 3-(2-chlorobenzylidene)dithiocarbazate","Acta Crystallographica Section E","2007","63","1","o42","o43","10.1107/S1600536806051178","","","0.71073","MoKα","","0.033","0.0289","","","0.065","0.0666","","","","","","1.136","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211725","10.08","0.002","10.219","0.002","20.699","0.004","90","","90","","90","","2132.2","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Bis(<i>N</i>-<i>tert</i>-buylsalicylaldiminato)iron(II)","bis[2-(<i>tert</i>-buyliminomethyl)phenolato-κ^2^N,O]iron(II)","","- C22 H28 Fe N2 O2 -","- C22 H28 Fe N2 O2 -","- C88 H112 Fe4 N8 O8 -","4","1","BI2102","Li, Min; Wang, Qi-Bao; Sun, Hong-Jian","Bis(<i>N</i>-<i>tert</i>-butylsalicylaldiminato)iron(II)","Acta Crystallographica Section E","2007","63","1","m57","m58","10.1107/S1600536806051464","","","0.71073","MoKα","","0.0442","0.0397","","","0.1025","0.1046","","","","","","1.101","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211726","7.855","0.006","10.138","0.008","13.949","0.01","90","","94.612","0.014","90","","1107.2","1.5","294","2","294","2","","","","","","","","3","P 1 21 1","P 2yb","4","","1,3,4,6-tetra-O-acetyl-2-O-benzyl-α-D-mannopyranose","","- C21 H26 O10 -","- C21 H26 O10 -","- C42 H52 O20 -","2","1","BI2103","An, Qi; Jiang, Shende","1,3,4,6-Tetra-<i>O</i>-acetyl-2-<i>O</i>-benzyl-α-<small>D</small>-mannopyranose","Acta Crystallographica Section E","2007","63","1","o213","o214","10.1107/S1600536806051476","","","0.71073","MoKα","","0.0852","0.0435","","","0.0872","0.1043","","","","","","1.007","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211727","4.6871","0.0004","6.1419","0.0004","32.047","0.002","90","","90","","90","","922.56","0.11","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Phenylethylammonium bromide","","- C8 H12 Br N -","- C8 H12 Br N -","- C32 H48 Br4 N4 -","4","1","BI2104","Rademeyer, Melanie","2-Phenylethylammonium bromide","Acta Crystallographica Section E","2007","63","1","o221","o223","10.1107/S1600536806051488","","","0.71073","MoKα","","0.054","0.032","","","0.057","0.0593","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211728","14.192","0.007","15.372","0.007","14.515","0.006","90","","92.495","0.009","90","","3164","2","293","2","292","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(μ-4,4'-Bipyridine-κ^2^N:N')bis[(1,10-phenanthroline- κ^2^N,N')(triphenylphosphine-κP)copper(I)] bis(tetrafluoroborate)","","- C70 H54 B2 Cu2 F8 N6 P2 -","- C70 H54 B2 Cu2 F8 N6 P2 -","- C140 H108 B4 Cu4 F16 N12 P4 -","2","0.5","BI2107","Chen, Jian-Hua; Song, Li-Qiang; Wang, De-Hui; Zhang, Jun-Feng; Fu, Wen-Fu","(μ-4,4'-Bipyridine-κ^2^<i>N</i>:<i>N</i>')bis[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(triphenylphosphine-κ<i>P</i>)copper(I)] bis(tetrafluoroborate)","Acta Crystallographica Section E","2007","63","1","m34","m35","10.1107/S160053680605149X","","","0.71073","MoKα","","0.1278","0.0582","","","0.1288","0.1628","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211729","11.481","0.003","11.635","0.003","13.17","0.003","64.764","0.004","88.19","0.005","63.025","0.004","1389.4","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Poly[[[μ~3~1,3,5-tris(imidazol-1-ylmethyl)-2,4,6- trimethylbenzene]manganese(II)] methylbenzenesulfonate dihydrate]","","- C56 H66 Mn N12 O8 S2 -","- C56 H66 Mn N12 O8 S2 -","- C56 H66 Mn N12 O8 S2 -","1","0.5","BI2108","Yang, Pei-Pei; Ma, Zhen-Ping; Zhang, Li-Zhi; Gu, Wen; Liu, Xin","Poly[[[μ~3~-1,3,5-tris(imidazol-1-ylmethyl)-2,4,6-trimethylbenzene]manganese(II)] methylbenzenesulfonate dihydrate]","Acta Crystallographica Section E","2007","63","1","m233","m234","10.1107/S1600536806053712","","","0.71073","MoKα","","0.1072","0.0598","","","0.1422","0.1673","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211730","5.8208","0.0003","8.9966","0.0004","11.0369","0.0005","90","","95.126","0.001","90","","575.66","0.05","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Piperazinium bis(dihydrogenarsenate)","","- C4 H16 As2 N2 O8 -","- C4 H16 As2 N2 O8 -","- C8 H32 As4 N4 O16 -","2","0.5","BI2109","Wilkinson, Hazel S.; Harrison, William T. A.","Piperazinium bis(dihydrogenarsenate)","Acta Crystallographica Section E","2007","63","1","m26","m28","10.1107/S160053680605118X","","","0.71073","MoKα","","0.022","0.0184","","","0.0494","0.0504","","","","","","1.051","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211731","8.648","0.003","12.278","0.004","26.246","0.008","90","","90","","90","","2786.8","1.6","113","2","113","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Benzhydryl 2-(3-benzyl-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)- 3-morpholinobut-2-enoate","","- C32 H31 N3 O4 S -","- C32 H31 N3 O4 S -","- C128 H124 N12 O16 S4 -","4","1","BI2111","Fu, De-Cai; Sun, Feng-Xia; Liu, Qian; Chen, Jin-Ping; Zhang, Jing","Benzhydryl 2-(3-benzyl-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-morpholinobut-2-enoate","Acta Crystallographica Section E","2007","63","1","o264","o265","10.1107/S160053680605286X","","","0.7107","MoKα","","0.0459","0.0398","","","0.0779","0.0808","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211732","13.96","0.003","15.948","0.003","7.3536","0.0014","90","","102.358","0.003","90","","1599.2","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)isoindoline- 1,3-dione","","- C19 H15 N3 O3 -","- C19 H15 N3 O3 -","- C76 H60 N12 O12 -","4","1","BI2112","Li, Jian; Liang, Zu-Pei; Ma, Yong-Sheng","2-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)isoindoline-1,3-dione","Acta Crystallographica Section E","2007","63","1","o28","o29","10.1107/S1600536806051221","","","0.71073","MoKα","","0.0842","0.044","","","0.0989","0.1152","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211733","3.9333","0.0007","10.986","0.002","33.046","0.006","90","","90.956","0.003","90","","1427.8","0.4","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(2-Furyl)-3-hydroxy-3-(2-methoxy-2-naphthyl)prop-2-en-1-one","","- C18 H14 O4 -","- C18 H14 O4 -","- C72 H56 O16 -","4","1","BI2113","Dun-Jia Wang; Chun-Yang Zheng; Ling Fan","1-(2-Furyl)-3-hydroxy-3-(2-methoxy-2-naphthyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","1","o296","o297","10.1107/S1600536806053025","","","0.71073","MoKα","","0.0641","0.0557","","","0.1322","0.1379","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211734","8.0324","0.0002","8.3664","0.0002","10.8658","0.0003","90","","104.008","0.002","90","","708.49","0.03","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dichlorobis(1-methyl-1,4,5,6-tetrahydropyrimidine)palladium(II)","","- C10 H20 Cl2 N4 Pd -","- C10 H20 Cl2 N4 Pd -","- C20 H40 Cl4 N8 Pd2 -","2","0.5","BI2115","Chang, Chiung-Fang; Lee, Hon Man","Dichlorobis(1-methyl-1,4,5,6-tetrahydropyrimidine)palladium(II)","Acta Crystallographica Section E","2007","63","1","m167","m168","10.1107/S1600536806052998","","","0.71073","MoKα","","0.0286","0.0224","","","0.0544","0.0565","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211735","8.2822","0.0002","12.8466","0.0003","14.995","0.0003","90","","91.2825","0.0012","90","","1595.04","0.06","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Parlar 69","2,2,5,5,6-exo,8,8,9,10,10-Decachlorobornane","","- C10 H8 Cl10 -","- C10 H8 Cl10 -","- C40 H32 Cl40 -","4","1","BI2116","Kolehmainen, Erkki; Kryuchkov, Fedor; Nikiforov, Vladimir; Valkonen, Arto","2,2,5,5,6-<i>exo</i>,8,8,9,10,10-Decachlorobornane","Acta Crystallographica Section E","2007","63","1","o327","o328","10.1107/S1600536806053517","","","0.71073","MoKα","","0.0617","0.0451","","","0.074","0.0798","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211736","6.841","0.003","14.021","0.006","17.886","0.008","90","","90","","90","","1715.6","1.3","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-[(2-Methoxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1H-pyrazolidin-3(2H)-one","","- C19 H19 N3 O2 -","- C19 H19 N3 O2 -","- C76 H76 N12 O8 -","4","1","BI2117","Li, Zong-Xiao; Zhang, Xin-Li","4-[(2-Methoxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazolidin-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","1","o357","o358","10.1107/S1600536806054171","","","0.71073","MoKα","","0.0891","0.0392","","","0.0753","0.0959","","","","","","1.006","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211737","7.164","0.006","7.639","0.005","12.011","0.008","102.07","0.02","102.23","0.03","105.32","0.03","594.6","0.8","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","Hexaaquacobalt(II) bis[(4-nitrophenylsulfanyl)acetate]","","- C16 H24 Co N2 O14 S2 -","- C16 H24 Co N2 O14 S2 -","- C16 H24 Co N2 O14 S2 -","1","0.5","BI2120","Shi, Ai-E; Zhang, Shuang; Li, Bai-Yan; Hou, Yan-Jun; Hou, Guang-Feng","Hexaaquacobalt(II) bis[(4-nitrophenylsulfanyl)acetate]","Acta Crystallographica Section E","2007","63","1","m265","m266","10.1107/S1600536806054390","","","0.71073","MoKα","","0.0333","0.0271","","","0.0718","0.0917","","","","","","0.981","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211738","13.385","0.004","11.664","0.004","19.47","0.006","90","","92.071","0.005","90","","3037.7","1.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[[di-μ-acetato-κ^4^O:O'-bis[(acetato-κ^2^O,O')manganese(II)]]- di-μ-4,4'-bipyridine-κ^4^N:N'] monohydrate]","","- C28 H30 Mn2 N4 O9 -","- C28 H30 Mn2 N4 O9 -","- C112 H120 Mn8 N16 O36 -","4","0.5","BI2121","Wang, Guan-Hua; Li, Zhi-Gang; Xu, Jing-Wei; Hu, Ning-Hai","<i>catena</i>-Poly[[[di-μ-acetato-κ^4^<i>O</i>:<i>O</i>'-bis[(acetato-κ^2^<i>O</i>,<i>O</i>')manganese(II)]]-di-μ-4,4'-bipyridine-κ^4^<i>N</i>:<i>N</i>'] monohydrate]","Acta Crystallographica Section E","2007","63","1","m289","m291","10.1107/S1600536806054377","","","0.71073","MoKα","","0.0553","0.041","","","0.1074","0.1179","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211739","5.2654","0.0002","5.2654","0.0002","5.624","0.0008","90","","90","","120","","135.03","0.02","298","2","298","2","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","lithium aluminosilicate","lithium aluminium silicon hexaoxide","","- Al1.44 Li1.44 O6 Si1.56 -","- Al1.44 Li1.44 O6 Si1.56 -","- Al1.44 Li1.44 O6 Si1.56 -","1","0.0833333","BR2020","Graia, Mohsen; Ksiksi, Regaya; Driss, Ahmed","Li~1,44~Al~1,44~Si~1,56~O~6~","Acta Crystallographica Section E","2007","63","1","i3","i4","10.1107/S1600536806051300","","","0.71073","MoKα","","0.0193","0.0171","","","0.0494","0.0509","","","","","","1.264","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2211740","16.358","0.002","7.05","0.002","9.629","0.002","90","","126.15","0.01","90","","896.7","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","lithium terbium polyphosphate","lithium terbium polyphosphate","","- Li O12 P4 Tb -","- Li O12 P4 Tb -","- Li4 O48 P16 Tb4 -","4","0.5","BR2021","Ben Zarkouna, Emna; Horchani-Naifer, Karima; Férid, Mokhtar; Driss, Ahmed","LiTb(PO~3~)~4~","Acta Crystallographica Section E","2007","63","1","i1","i2","10.1107/S1600536806051737","","","0.71069","MoKα","","0.0202","0.0196","","","0.0533","0.0537","","","","","","1.079","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211741","7.8001","0.0002","9.8818","0.0012","14.9112","0.0006","90","","90","","90","","1149.34","0.15","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Poly[aquabis(μ-pyrazine-2-carboxylato)nickel(II)]","","- C10 H8 N4 Ni O5 -","- C10 H8 N4 Ni O5 -","- C40 H32 N16 Ni4 O20 -","4","1","BR2022","Hao, Lu-Jiang; Mu, Chun-Hua; Liu, Tian-Tian","Poly[aquabis(μ-pyrazine-2-carboxylato)nickel(II)]","Acta Crystallographica Section E","2007","63","1","m281","m283","10.1107/S1600536806054225","","","0.71073","MoKα","","0.0397","0.0339","","","0.0804","0.0854","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211742","16.122","0.005","3.7796","0.0011","19.715","0.005","90","","110.006","0.005","90","","1128.8","0.6","130","2","130","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","guanidinium 4-nitroanthranilate monohydrate","guanidinium 2-amino-4-nitrobenzoate monohydrate","","- C8 H13 N5 O5 -","- C8 H13 N5 O5 -","- C32 H52 N20 O20 -","4","1","BT2212","Graham Smith; Urs D. Wermuth; Peter C. Healy; Jonathan M. White","Guanidinium 2-amino-4-nitrobenzoate monohydrate at 130K","Acta Crystallographica Section E","2007","63","1","o7","o9","10.1107/S1600536806050495","","","0.71073","MoKα","","0.0472","0.0396","","","0.1038","0.1083","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211743","7.2299","0.001","10.8186","0.0015","10.8659","0.0015","83.026","0.002","71.732","0.002","71.615","0.002","765.63","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","2-(4-Chloroanilino)carbonylmethyl piperidine-1-carbodithioate","","- C14 H17 Cl N2 O S2 -","- C14 H17 Cl N2 O S2 -","- C28 H34 Cl2 N4 O2 S4 -","2","1","BT2214","Zhou, Fu-Hui; Zhao, Hong-Bin; Li, Zhi-Gang; Hu, Ning-Hai; Xu, Jing-Wei","2-(4-Chloroanilino)carbonylmethyl piperidine-1-carbodithioate","Acta Crystallographica Section E","2007","63","1","o291","o292","10.1107/S1600536806053220","","","0.71073","MoKα","","0.037","0.0332","","","0.0892","0.0928","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211744","9.97","0.004","12.368","0.007","27.273","0.005","92.7","0.03","95.17","0.02","100.48","0.04","3287","2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","2,7-Di-tert-butyl-9,9-dimethyl-4,5-bis(4-tritylanilinocarbonyl)-9H-xanthene methanol trisolvate monohydrate","","- C78 H82 N2 O7 -","- C78 H82 N2 O7 -","- C156 H164 N4 O14 -","2","1","BT2215","Vysotsky, Myroslav O.; Schollmeyer, Dieter","2,7-Di-<i>tert</i>-butyl-9,9-dimethyl-4,5-bis(4-tritylanilinocarbonyl)-9<i>H</i>-xanthene methanol trisolvate monohydrate","Acta Crystallographica Section E","2007","63","1","o169","o171","10.1107/S1600536806051439","","","1.54178","CuKα","","0.2133","0.1433","","","0.3423","0.3906","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211745","10.4733","0.0006","10.8698","0.0006","12.654","0.0007","99.309","0.001","94.465","0.001","99.256","0.001","1395.08","0.14","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Dipotassium heptahydrogenhexamolybdochromate(III) octahydrate","","- Cr H23 K2 Mo6 O32 -","- Cr H19 K2 Mo6 O32 -","- Cr2 H38 K4 Mo12 O64 -","2","1","BT2216","Lee, Uk","Dipotassium heptahydrogenhexamolybdochromate(III) octahydrate, the first heptaprotonated Anderson-type polyoxometalate","Acta Crystallographica Section E","2007","63","1","i5","i7","10.1107/S1600536806052883","","","0.71073","MoKα","","0.0302","0.0289","","","0.0728","0.0735","","","","","","1.19","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2211746","7.0527","0.0004","5.5465","0.0002","14.0317","0.0006","90","","121.544","0.004","90","","467.78","0.04","298","1","298","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Diethylammonium hydrogen oxalate","","- C6 H13 N O4 -","- C6 H13 N O4 -","- C12 H26 N2 O8 -","2","0.5","BT2217","Ejsmont, Krzysztof","Diethylammonium hydrogen oxalate","Acta Crystallographica Section E","2007","63","1","o107","o109","10.1107/S1600536806051932","","","0.71073","MoKα","","0.0448","0.0387","","","0.1103","0.1165","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211747","19.107","0.001","15.9176","0.0007","20.8122","0.0011","90","","101.266","0.005","90","","6207.8","0.5","150","","150","","","","","","","","","6","P 1 21 1","P 2yb","4","","[N,N-Bis(diphenylphosphanyl)-(R)-1,2,3,4-tetrahydro-1- naphthylamine-κ^2^P,P']dichloroplatinum(II)","","- C34 H31 Cl2 N P2 Pt -","- C34 H31 Cl2 N P2 Pt -","- C272 H248 Cl16 N8 P16 Pt8 -","8","4","BT2219","Tooke, Duncan M.; Zijp, Eric J.; Vlugt, Jarl Ivar van der; Vogt, Dieter; Spek, Anthony L.","[<i>N</i>,<i>N</i>-Bis(diphenylphosphanyl)-(<i>R</i>)-1,2,3,4-tetrahydro-1-naphthylamine-κ^2^<i>P</i>,<i>P</i>']dichloroplatinum(II)","Acta Crystallographica Section E","2007","63","1","m86","m88","10.1107/S1600536806052044","","","0.71073","MoKα","","0.0633","0.0341","","","0.0478","0.0539","","","","","","1.015","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211748","7.099","0.003","9.659","0.004","16.195","0.007","76.822","0.005","77.42","0.006","83.658","0.005","1053.1","0.8","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","4-Methyl-7-[2-(4-o-tolylpiperazin-1-yl)ethoxy]-2H-chromen-2-one","","- C24 H28 N2 O3 -","- C24 H28 N2 O3 -","- C48 H56 N4 O6 -","2","1","BT2221","Xiang Zhou; Xiao-Bing Wang; Ling-Yi Kong","4-Methyl-7-[3-(4-<i>o</i>-tolylpiperazin-1-yl)propoxy]-2<i>H</i>-chromen-2-one","Acta Crystallographica Section E","2007","63","1","o266","o267","10.1107/S1600536806052779","","","0.71073","MoKα","","0.1024","0.0482","","","0.1028","0.1308","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211749","9.811","0.002","9.976","0.002","18.482","0.004","98.42","0.03","101.54","0.03","105.9","0.03","1665.2","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis{6-methoxy-2-[(4-methylphenylimino)methyl]phenol-κ^2^O,O'}tri(nitrato- κ^2^O,O')terbium(III) monohydrate","","- C30 H32 N5 O14 Tb -","- C30 H32 N5 O14 Tb -","- C60 H64 N10 O28 Tb2 -","2","1","BT2224","Zhao, Guo-Liang; Shi, Xia; Seik Weng Ng","Bis{6-methoxy-2-[(4-methylphenylimino)methyl]phenol-κ^2^<i>O</i>,<i>O</i>'}tris(nitrato-κ^2^<i>O</i>,<i>O</i>')terbium(III) monohydrate","Acta Crystallographica Section E","2007","63","1","m267","m268","10.1107/S1600536806054328","","","0.71073","MoKα","","0.034","0.03","","","0.077","0.081","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211750","8.891","0.009","13.09","0.013","14.548","0.014","98.347","0.013","97.794","0.012","106.131","0.011","1581","3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","(1,2-Dicyanoethylenedithiolato-κ^2^S,S')(η^5^- pentamethylcyclopentadienyl)iridium(III)","","- C14 H15 Ir N2 S2 -","- C14 H15 Ir N2 S2 -","- C56 H60 Ir4 N8 S8 -","4","2","BV2036","Ren, Chun-Xia; Ding, Yu-Qiang","(1,2-Dicyanoethylenedithiolato-κ^2^<i>S</i>,<i>S</i>')(η^5^-pentamethylcyclopentadienyl)iridium(III)","Acta Crystallographica Section E","2007","63","1","m249","m250","10.1107/S160053680604459X","","","0.71073","MoKα","","0.0568","0.0413","","","0.0916","0.0964","","","","","","0.967","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211751","8.006","0.002","9.441","0.003","15.535","0.004","90","","95.197","0.006","90","","1169.4","0.6","173","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2E)-2-(1-Methylpiperidin-2-ylidene)-1-phenylethanone","","- C14 H17 N O -","- C14 H17 N O -","- C56 H68 N4 O4 -","4","1","BX2042","Lemmerer, Andreas; Michael, Joseph P.; Pienaar, Daniel P.; Sannasy, Desigan","(2<i>E</i>)-2-(1-Methylpiperidin-2-ylidene)-1-phenylethanone","Acta Crystallographica Section E","2007","63","1","o98","o99","10.1107/S160053680605152X","","","0.71073","MoKα","","","0.0512","","","","0.1992","","","","","","1.062","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211752","10.085","0.003","10.288","0.003","10.301","0.003","76.521","0.013","65.832","0.011","88.294","0.016","945.6","0.5","113","2","113","2","","","","","","","","4","P -1","-P 1","2","","1-[(Phenyl)(p-tolylimino)methyl]-3-(o-tolyl)thiourea","","- C22 H21 N3 S -","- C22 H21 N3 S -","- C44 H42 N6 S2 -","2","1","CF2071","Hong-Guang Song; Zhi-Yong Xing; Wen-Qin Zhang","1-[(Phenyl)(<i>p</i>-tolylimino)methyl]-3-(<i>o</i>-tolyl)thiourea","Acta Crystallographica Section E","2007","63","1","o262","o263","10.1107/S1600536806052986","","","0.7107","MoKα","","0.0617","0.043","","","0.1026","0.1123","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211753","6.0019","0.0005","7.123","0.0004","15.37","0.002","95.48","0.02","98.43","0.02","114.26","0.02","583.69","0.15","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(ethylenediamine)copper(II) bis(4-nitrobenzoate)","","- C18 H28 Cu N6 O10 -","- C18 H28 Cu N6 O10 -","- C18 H28 Cu N6 O10 -","1","0.5","CF2072","Harrison, William T. A.; Slawin, Alexandra M. Z.; Sharma, Raj Pal; Sharma, Upendra; Bhama, Shekar","Diaquabis(ethylenediamine)copper(II) bis(4-nitrobenzoate)","Acta Crystallographica Section E","2007","63","1","m178","m180","10.1107/S1600536806052901","","","0.71073","MoKα","","0.036","0.0345","","","0.0753","0.0768","","","","","","1.079","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211754","4.7107","0.0009","8.5491","0.0015","11.229","0.002","90","","93.037","0.004","90","","451.58","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Putrescine dibromide","Butane-1,4-diammonium dibromide","","- C4 H14 Br2 N2 -","- C4 H14 Br2 N2 -","- C8 H28 Br4 N4 -","2","0.5","CF2076","van Blerk, Charmaine; Kruger, Gert J.","Butane-1,4-diammonium dibromide","Acta Crystallographica Section E","2007","63","1","o342","o344","10.1107/S1600536806053736","","","0.71073","MoKα","","0.0523","0.0453","","","0.1247","0.1307","","","","","","0.989","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211755","14.6895","0.0003","5.9301","0.0001","12.4018","0.0004","90","","120.956","0.001","90","","926.44","0.04","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Piperazinium dinitrate","","- C4 H12 N4 O6 -","- C4 H12 N4 O6 -","- C16 H48 N16 O24 -","4","0.5","CF2077","E Yang; Xu-Chun Song; Yue-E Chen; Rong-Qiang Zhuang","Piperazinium dinitrate","Acta Crystallographica Section E","2007","63","1","o340","o341","10.1107/S1600536806053724","","","0.71073","MoKα","","0.0794","0.0338","","","0.0784","0.0895","","","","","","0.768","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211756","6.062","0.0001","16.7794","0.0003","16.8881","0.0004","90","","90","","90","","1717.8","0.06","295","","295","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R)-1-phenylethylammonium (R)-2-phenylbutyrate","","- C18 H23 N O2 -","- C18 H23 N O2 -","- C72 H92 N4 O8 -","4","1","CI2215","Fernandes, Philippe; Florence, Alastair; Shankland, Kenneth; Karamertzanis, Panos; Hulme, Ashley T; Anandamanoharan, Parathay","Powder study of (<i>R</i>)-1-phenylethylammonium (<i>R</i>)-2-phenylbutyrate form 2","Acta Crystallographica Section E","2007","63","1","o247","o249","10.1107/S1600536806052652","","","1.54056","CuKα~1~","","","","","","","","","","2.025","","","","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2211757","9.957","0.0007","11.0361","0.0007","22.9009","0.0016","90.678","0.001","96.295","0.001","115.79","0.001","2247.2","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","Carbonylchloro(5-carboxypyridine-2-carboxylato- κ^2^N,O^2^)bis(triphenylphosphine-κP)ruthenium(II) 0.345-hydrate benzene sesquisolvate","","- C53 H43.68 Cl N O5.345 P2 Ru -","- C53 H43.7 Cl N O5.345 P2 Ru -","- C106 H87.4 Cl2 N2 O10.69 P4 Ru2 -","2","1","CI2218","Sukanya, Duraiswamy; Natarajan, Karuppannan; Dobosh, Brian; Zeller, Matthias","Carbonyl(5-carboxypyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>^2^)chlorobis(triphenylphosphine-κ<i>P</i>)ruthenium(II) 0.345-hydrate benzene sesquisolvate","Acta Crystallographica Section E","2007","63","1","m135","m137","10.1107/S1600536806052251","","","0.71073","MoKα","","0.0437","0.0415","","","0.0998","0.1023","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211758","14.37","0.004","8.5935","0.0016","12.684","0.003","90","","104.928","0.008","90","","1513.5","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Diisopropyl(N,N,N',N'-tetramethylethylenediamine)zinc(II)","","- C12 H30 N2 Zn -","- C12 H30 N2 Zn -","- C48 H120 N8 Zn4 -","4","0.5","CI2220","Lennartson, Anders; Hedström, Anna; Håkansson, Mikael","Diisopropyl(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine)zinc(II), the first crystal structure of a diisopropylzinc complex","Acta Crystallographica Section E","2007","63","1","m123","m125","10.1107/S1600536806052068","","","0.71073","MoKα","","0.0256","0.0242","","","0.0642","0.0646","","","","","","1.087","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211759","8.03","0.003","7.903","0.003","24.074","0.009","90","","100.858","0.012","90","","1500.4","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-Bis[4-(trifluoromethyl)benzylidene]hydrazine","","- C16 H10 F6 N2 -","- C16 H10 F6 N2 -","- C64 H40 F24 N8 -","4","1","CI2222","Feng Xu; Wei-Xiao Hu","1,2-Bis[4-(trifluoromethyl)benzylidene]hydrazine","Acta Crystallographica Section E","2007","63","1","o289","o290","10.1107/S160053680605327X","","","0.71073","MoKα","","0.1118","0.0598","","","0.1468","0.1735","","","","","","0.937","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211761","7.034","0.001","8.484","0.001","15.569","0.002","99.682","0.002","91.695","0.002","101.661","0.002","895","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3,5-Dibromosalicyl alcohol hemihydrate","","- C7 H7 Br2 O2.5 -","- C7 H7 Br2 O2.5 -","- C28 H28 Br8 O10 -","4","2","CI2230","Wu, Mei-Chun; Zeng, Ming-Hua; Ng, Seik Weng","3,5-Dibromosalicyl alcohol hemihydrate","Acta Crystallographica Section E","2007","63","1","o47","o48","10.1107/S1600536806051154","","","0.71073","MoKα","","0.059","0.041","","","0.096","0.117","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211762","8.2287","0.0008","9.6745","0.0009","13.542","0.001","81.506","0.002","80.678","0.002","69.867","0.002","993.89","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis[(1H-benzimidazol-2-yl)methanol-κ^2^N,O](nitrato-κ^2^O,O')zinc(II) nitrate monohydrate","","- C16 H18 N6 O9 Zn -","- C16 H18 N6 O9 Zn -","- C32 H36 N12 O18 Zn2 -","2","1","CI2231","Zhou, Yan-Ling; Zeng, Ming-Hua; Ng, Seik Weng","Bis[(1<i>H</i>-benzimidazol-2-yl)methanol-κ^2^<i>N</i>,<i>O</i>](nitrato-κ^2^<i>O</i>,<i>O</i>')zinc(II) nitrate monohydrate","Acta Crystallographica Section E","2007","63","1","m15","m16","10.1107/S1600536806051166","","","0.71073","MoKα","","0.05","0.042","","","0.101","0.114","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211763","7.7463","0.0002","10.3041","0.0002","11.7022","0.0002","74.585","0.008","78.996","0.008","74.596","0.008","860.81","0.05","293","2","293","2","","","","","","","","6","P 1","P 1","1","","Aqua(2,2'-bipyridine-κ^2^N,N')(L-cysteato-κ^2^N,O)copper(II) dihydrate","","- C13 H19 Cu N3 O8 S -","- C13 H19 Cu N3 O8 S -","- C26 H38 Cu2 N6 O16 S2 -","2","2","CI2232","Li, Hai-Ye; Huang, Fu-Ping; Jiang, Yi-Min; Ng, Seik Weng","Aqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(<small>L</small>-cysteato-κ^2^<i>N</i>,<i>O</i>)copper(II) dihydrate","Acta Crystallographica Section E","2007","63","1","m219","m220","10.1107/S1600536806053529","","","0.71073","MoKα","","0.03","0.028","","","0.076","0.078","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211764","11.4459","0.0019","12.085","0.002","13.612","0.002","69.568","0.003","65.586","0.003","71.038","0.003","1570.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4'-(4-Methoxyphenyl)-1'-methyl-5-diphenyl-5,6,7,8,9,10-hexahydro-1,3- cyclooctapyrimidino[2,3-b]thiazole-2-spiro-3'-pyrrolidine-2'-spiro-3''- 1H-indole-2'',3(2H,3''H)-dione","","- C36 H36 N4 O3 S -","- C36 H36 N4 O3 S -","- C72 H72 N8 O6 S2 -","2","1","CI2233","R. Prakash; D. Gayathri; D. Velmurugan; K. Ravikumar; M. Poornachandran","4'-(4-Methoxyphenyl)-1'-methyl-5-diphenyl-5,6,7,8,9,10-hexahydro-1,3-cyclooctapyrimidino[2,3-<i>b</i>]thiazole-2-spiro-3'-pyrrolidine-2'-spiro-3''-1<i>H</i>-indole-2'',3(2<i>H</i>,3''<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","1","o129","o131","10.1107/S1600536806050859","","","0.71073","MoKα","","0.0875","0.0532","","","0.1198","0.1357","","","","","","0.928","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211765","11.4338","0.0007","11.954","0.0008","13.5843","0.0011","70.3","0.002","65.143","0.001","72.179","0.001","1556.46","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4'-(4-Methoxyphenyl)-1'-methyl-5-diphenyl-5,6,7,8,9,10-hexahydro-1,3- cycloheptapyrimidino[2,3-b]thiazole-2-spiro-3'-pyrrolidine-2'-spiro-3''- 1H-indole-2'',3(2H,3''H)-dione","","- C35 H34 N4 O3 S -","- C35 H34 N4 O3 S -","- C70 H68 N8 O6 S2 -","2","1","CI2234","D. Gayathri; D. Velmurugan; K. Ravikumar; M. Poornachandran; R. Raghunathan","4'-(4-Methoxyphenyl)-1'-methyl-5-diphenyl-5,6,7,8,9,10-hexahydro-1,3-cycloheptapyrimidino[2,3-<i>b</i>]thiazole-2-spiro-3'-pyrrolidine-2'-spiro-3''-1<i>H</i>-indole-2'',3(2<i>H</i>,3''<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","1","o132","o134","10.1107/S1600536806050823","","","0.71073","MoKα","","0.059","0.0484","","","0.1299","0.1389","","","","","","0.991","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211766","6.8786","0.0001","17.2639","0.0002","17.2828","0.0003","90","","110.231","0.001","90","","1925.74","0.05","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-Hydroxystyryl)-1-methylpyridinium 4-methoxybenzenesulfonate","","- C21 H21 N O5 S -","- C21 H21 N O5 S -","- C84 H84 N4 O20 S4 -","4","1","CI2238","Pumsak Ruanwas; Suchada Chantrapromma; Hoong-Kun Fun","2-(4-Hydroxystyryl)-1-methylpyridinium 4-methoxybenzenesulfonate","Acta Crystallographica Section E","2007","63","1","o69","o71","10.1107/S1600536806050902","","","0.71073","MoKα","","0.0938","0.0552","","","0.1396","0.1647","","","","","","1.026","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211767","10.185","0.003","8.633","0.002","10.427","0.003","90","","96.364","0.005","90","","911.2","0.4","294","2","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(DL)-2-[(DL)-2-Acetamido-3-phenylpropanamido]-3-phenylpropanoic acid","","- C20 H22 N2 O4 -","- C20 H22 N2 O4 -","- C40 H44 N4 O8 -","2","1","CI2239","Li, Gao-Ning; Li, Jian; Liang, Zu-Pei","(<i>S</i>)-2-[(<i>S</i>)-2-Acetamido-3-phenylpropanamido]-3-phenylpropanoic acid","Acta Crystallographica Section E","2007","63","1","o372","o373","10.1107/S1600536806053955","","","0.71073","MoKα","","0.0524","0.0351","","","0.0792","0.0883","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211768","5.6728","0.0006","17.9498","0.0018","16.6998","0.0016","90","","92.225","0.002","90","","1699.2","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Z)-1,4-Bis(4-methoxyphenyl)-2-(methylsulfanyl)but-2-ene-1,4-dione","","- C19 H18 O4 S -","- C19 H18 O4 S -","- C76 H72 O16 S4 -","4","1","CI2240","Chen, Ai-Hua; Wang, Zhi-Guo; Gao, Meng","(<i>Z</i>)-1,4-Bis(4-methoxyphenyl)-2-(methylsulfanyl)but-2-ene-1,4-dione","Acta Crystallographica Section E","2007","63","1","o161","o162","10.1107/S1600536806052275","","","0.71073","MoKα","","0.0633","0.0503","","","0.1208","0.1294","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211769","9.59","0.0019","6.586","0.0013","14.751","0.003","90","","106.86","0.03","90","","891.6","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,5-dichloro-2,4-dinitrobenzene","","- C6 H2 Cl2 N2 O4 -","- C6 H2 Cl2 N2 O4 -","- C24 H8 Cl8 N8 O16 -","4","1","CI2241","Zhong-Hua Luo; Hong-Jun Zhu; Shui-Ping Deng; Hong-Sheng Jia; Shan Liu","1,5-Dichloro-2,4-dinitrobenzene","Acta Crystallographica Section E","2007","63","1","o177","o178","10.1107/S1600536806052299","","","0.71073","MoKα","","0.1062","0.0606","","","0.1372","0.1628","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211770","9.451","0.001","10.574","0.001","13.716","0.002","90","","100.869","0.002","90","","1346.1","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(N,N-Diethylethane-1,2-diamine)dithiocyanatozinc(II)","","- C8 H16 N4 S2 Zn -","- C8 H16 N4 S2 Zn -","- C32 H64 N16 S8 Zn4 -","4","1","CI2244","Zhe Hong","(<i>N</i>,<i>N</i>-Diethylethane-1,2-diamine)dithiocyanatozinc(II)","Acta Crystallographica Section E","2007","63","1","m132","m134","10.1107/S1600536806052457","","","0.71073","MoKα","","0.0489","0.0334","","","0.0768","0.0831","","","","","","1.032","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211771","8.8736","0.001","12.3084","0.0014","9.3696","0.001","90","","103.89","0.002","90","","993.42","0.19","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","p-Phenylene bis(4-methylbenzenesulfonate)","","- C20 H18 O6 S2 -","- C20 H18 O6 S2 -","- C40 H36 O12 S4 -","2","0.5","CI2245","Xiao-Lin Zhang; Yong-Ping Yan; Wen-Hong Wu; Qun-Sheng Li; Lai-Tao Luo","<i>p</i>-Phenylene bis(4-methylbenzenesulfonate)","Acta Crystallographica Section E","2007","63","1","o250","o251","10.1107/S1600536806052895","","","0.71073","MoKα","","0.0528","0.0367","","","0.0847","0.0874","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211772","10.6695","0.0018","13.113","0.002","12.488","0.002","90","","90","","90","","1747.2","0.5","294","2","294","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Triphenylphosphonium perchlorate","","- C18 H16 Cl O4 P -","- C18 H16 Cl O4 P -","- C72 H64 Cl4 O16 P4 -","4","0.5","CI2247","Jing Zhu; Ji-Xiang Dai; Qian-Feng Zhang","Triphenylphosphonium perchlorate","Acta Crystallographica Section E","2007","63","1","o363","o364","10.1107/S1600536806054110","","","0.71073","MoKα","","0.0726","0.0529","","","0.134","0.1488","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211773","7.5806","0.0005","10.5128","0.0007","16.237","0.0011","83.162","0.006","89.612","0.006","81.938","0.006","1272.01","0.15","296","","296","","","","","","","","","5","P -1","-P 1","2","","(E)-3-[2-(Trifluoromethyl)phenyliminomethyl]benzene-1,2-diol","","- C14 H10 F3 N O2 -","- C14 H10 F3 N O2 -","- C56 H40 F12 N4 O8 -","4","2","CI2248","Temel, Ersin; Albayrak, Çiĝdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-3-[2-(Trifluoromethyl)phenyliminomethyl]benzene-1,2-diol","Acta Crystallographica Section E","2007","63","1","o374","o376","10.1107/S1600536806053931","","","0.71073","MoKα","","0.118","0.0595","","","0.1411","0.1693","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211774","8.6232","0.0011","10.7019","0.0013","12.7024","0.0016","78.409","0.004","84.1","0.004","85.743","0.004","1140.5","0.2","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","1,1'-Bis(4-fluorobenzyl)-3,3'-ethylenediimidazolium dichloride monohydrate","","- C22 H24 Cl2 F2 N4 O -","- C22 H24 Cl2 F2 N4 O -","- C44 H48 Cl4 F4 N8 O2 -","2","1","CI2250","Lee, Hon Man; Chen, Chih-Yuen; Wen-Ling, Chen; Hung-Ching, Lin","1,1'-Bis(4-fluorobenzyl)-3,3'-ethylenediimidazolium dichloride monohydrate","Acta Crystallographica Section E","2007","63","1","o315","o316","10.1107/S1600536806053402","","","0.71073","MoKα","","0.0937","0.0431","","","0.1063","0.1241","","","","","","0.958","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211775","3.886","0.0008","16.144","0.003","10.959","0.002","90","","97.61","0.03","90","","681.5","0.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3,5-trichloropyridine","","- C5 H2 Cl3 N -","- C5 H2 Cl3 N -","- C20 H8 Cl12 N4 -","4","1","CI2251","Hong-Fei Ma; Hong-Sheng Jia; Yi Qian; Fan Wen; Bin-Lin Chen","2,3,5-Trichloropyridine","Acta Crystallographica Section E","2007","63","1","o311","o312","10.1107/S1600536806053414","","","0.71073","MoKα","","0.0716","0.0464","","","0.1145","0.1314","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211776","13.861","0.002","9.793","0.003","13.372","0.002","90","","90","","90","","1815.1","0.7","298","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Tetrakis(1H-imidazole-κN^3^)nickel(II) dinitrate","","- C12 H16 N10 Ni O6 -","- C12 H16 N10 Ni O6 -","- C48 H64 N40 Ni4 O24 -","4","1","CI2252","Zuo-Mao Wang","Tetrakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II) dinitrate","Acta Crystallographica Section E","2007","63","1","m207","m209","10.1107/S160053680605361X","","","0.71073","MoKα","","0.0752","0.0396","","","0.09","0.106","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211777","40.435","0.003","7.0362","0.0004","17.212","0.002","90","","101.754","0.009","90","","4794.3","0.7","299","2","299","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-Aminoquinolin-8-yl 2,4,6-triisopropylbenzenesulfonate","","- C24 H30 N2 O3 S -","- C24 H30 N2 O3 S -","- C192 H240 N16 O24 S8 -","8","1","CI2253","Silva, Luiz Everson da; Foro, Sabine; Schmidt, Boris","2-Aminoquinolin-8-yl 2,4,6-triisopropylbenzenesulfonate","Acta Crystallographica Section E","2007","63","1","o409","o411","10.1107/S1600536806054195","","","1.5418","CuKα","","0.1146","0.0582","","","0.157","0.1823","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211778","19.875","0.009","7.393","0.003","11.529","0.005","90","","99.622","0.009","90","","1670.2","1.2","150","2","150","2","","","","","","","","4","P 1 c 1","P -2yc","7","","Ethyl 3-[4-(ethoxycarbonyl)phenyl]-3,4-dihydroquinazoline-6-carboxylate","","- C20 H20 N2 O4 -","- C20 H20 N2 O4 -","- C80 H80 N8 O16 -","4","2","CS2024","Bhuiyan, M. Delower H.; Clegg, Jack K.; Try, Andrew C.","Ethyl 3-[4-(ethoxycarbonyl)phenyl]-3,4-dihydroquinazoline-6-carboxylate","Acta Crystallographica Section E","2007","63","1","o308","o310","10.1107/S1600536806052949","","","0.71073","MoKα","","0.0727","0.0449","","","0.0879","0.0948","","","","","","0.94","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211779","8.545","0.004","14.588","0.003","13.916","0.004","90","","116.22","0.02","90","","1556.2","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","10-(4-Hydroxy-3-nitrobenzylidene)anthrone","","- C21 H13 N O4 -","- C21 H13 N O4 -","- C84 H52 N4 O16 -","4","1","CV2149","Wei Zhou; Wei-Xiao Hu; Chun-Nian Xia","10-(4-Hydroxy-3-nitrobenzylidene)anthrone","Acta Crystallographica Section E","2007","63","1","o51","o53","10.1107/S1600536806049051","","","0.71073","MoKα","","0.1075","0.0453","","","0.1124","0.1372","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211780","10.076","0.005","12.99","0.005","17.937","0.005","90","","90.576","0.005","90","","2347.6","1.6","100","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H34 O3 P Rh -","- C24 H34 O3 P Rh -","- C96 H136 O12 P4 Rh4 -","4","1","CV2150","Brink, Alice; Roodt, Andreas; Visser, Hendrik G.","(Acetylacetonato)carbonyl(dicyclohexylphenylphosphine)rhodium(I)","Acta Crystallographica Section E","2007","63","1","m48","m50","10.1107/S160053680604966X","","","0.71069","MoKα","","","0.0273","","","","0.0698","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211781","8.8457","0.001","12.4789","0.0014","16.673","0.002","105.894","0.004","105.091","0.004","91.836","0.005","1698.4","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Aquabis(1,10-phenanthroline)(4,4'-sulfonyldibenzoato)nickel(II) dihydrate","","- C38 H30 N4 Ni O9 S -","- C38 H30 N4 Ni O9 S -","- C76 H60 N8 Ni2 O18 S2 -","2","1","CV2154","Wu, Hao-Han; Lian, Fen-Yan; Yuan, Da-Qiang; Hong, Mao-Chun","Aquabis(1,10-phenanthroline)(4,4'-sulfonyldibenzoato)nickel(II) dihydrate","Acta Crystallographica Section E","2007","63","1","m67","m69","10.1107/S1600536806051701","","","0.71073","MoKα","","0.0841","0.0562","","","0.107","0.1222","","","","","","1.091","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211782","7.2503","0.0015","15.952","0.003","10.371","0.002","90","","90","","90","","1199.5","0.4","295","2","295","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","Disodium diaquabis(malonato-κ^2^O,O')cobalt(II) monohydrate","","- C6 H10 Co Na2 O11 -","- C6 H10 Co Na2 O11 -","- C24 H40 Co4 Na8 O44 -","4","0.5","CV2155","Ye, Ling; Li, Bao; Yang, Guang-Di; Wu, Li-Xin","Disodium diaquabis(malonato-κ^2^<i>O</i>,<i>O</i>')cobalt(II) monohydrate","Acta Crystallographica Section E","2007","63","1","m146","m147","10.1107/S1600536806049762","","","0.71073","MoKα","","0.042","0.0411","","","0.1133","0.1142","","","","","","1.248","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211783","8.823","0.005","17.662","0.005","15.563","0.005","90","","106.45","0.005","90","","2325.9","1.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Carbonyl(3,7-dichlorotropolonato)(triphenylphosphine)rhodium(I)","","- C26 H18 Cl2 O3 P Rh -","- C26 H18 Cl2 O3 P Rh -","- C104 H72 Cl8 O12 P4 Rh4 -","4","1","CV2156","Steyl, Gideon","Carbonyl(3,7-dichlorotropolonato)(triphenylphosphine)rhodium(I)","Acta Crystallographica Section E","2007","63","1","m23","m25","10.1107/S1600536806050392","","","0.71073","MoKα","","0.0347","0.0268","","","0.0575","0.061","","","","","","1.037","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2211784","6.605","0.004","7.618","0.005","10.497","0.007","70.778","0.008","78.696","0.009","89.888","0.009","487.9","0.5","298","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-Methoxyphenylguanidinium chloride","","- C8 H12 Cl N3 O -","- C8 H12 Cl N3 O -","- C16 H24 Cl2 N6 O2 -","2","1","CV2157","Hong Ren; Chao Cai; Jun-Zhi Liu; Jian-Wu Wang","4-Methoxyphenylguanidinium chloride","Acta Crystallographica Section E","2007","63","1","o306","o307","10.1107/S1600536806053219","","","0.71073","MoKα","","0.0468","0.0393","","","0.0969","0.1014","","","","","","1.084","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211785","19.361","0.0003","12.5103","0.0002","17.7128","0.0002","90","","90","","90","","4290.25","0.11","100","0.1","297","2","","","","","","","","4","P n a 21","P 2c -2n","33","","N,N'-Bis(2-hydroxy-1-naphthaldimine)-o-phenylenediamine methanol hemisolvate","","- C28.5 H22 N2 O2.5 -","- C28.5 H22 N2 O2.5 -","- C228 H176 N16 O20 -","8","2","CV2159","Naser Eltaher Eltayeb; Siang Guan Teoh; Jeannie Bee-Jan Teh; Hoong-Kun Fun; Kamarulazizi Ibrahim","1-{2-[(2-Hydroxy-1-naphthyl)methyleneamino]phenyliminiomethyl}-2-naphtholate methanol hemisolvate","Acta Crystallographica Section E","2007","63","1","o117","o119","10.1107/S1600536806050707","","","0.71073","MoKα","","0.0536","0.0438","","","0.1018","0.1075","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211786","22.112","0.005","5.7505","0.0012","16.555","0.004","90","","90","","90","","2105.1","0.8","294","2","294","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Ethyl 4-benzoyl-3,5-diphenylpyrrolidine-2-carboxylate","","- C26 H25 N O3 -","- C26 H25 N O3 -","- C104 H100 N4 O12 -","4","1","CV2160","Zhi-Fang Yu; Juan Li; Jian-Wei Sun; Liang Yu","Ethyl 4-benzoyl-3,5-diphenylpyrrolidine-2-carboxylate","Acta Crystallographica Section E","2007","63","1","o17","o18","10.1107/S1600536806050744","","","0.71073","MoKα","","0.0744","0.036","","","0.0803","0.0955","","","","","","1.002","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2211787","6.761","0.004","11.928","0.006","15.575","0.008","82.263","0.008","85.777","0.008","73.743","0.008","1194","1.1","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","N,N,N',N'-Tetrakis{3-[1-(2-hydroxy-4- methoxyphenyl)ethenylamino]propyl}ethylenediamine","","- C50 H68 N6 O8 -","- C50 H68 N6 O8 -","- C50 H68 N6 O8 -","1","0.5","CV2161","Xing-You Xu; Tong-Tao Xu; Da-Qi Wang; Jian Gao; Dao-Nian Li","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrakis{3-[1-(2-hydroxy-4-methoxyphenyl)ethenylamino]propyl}ethylenediamine","Acta Crystallographica Section E","2007","63","1","o103","o104","10.1107/S1600536806051713","","","0.71073","MoKα","","0.1554","0.0575","","","0.1296","0.1753","","","","","","0.992","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211788","10.63","0.003","9.95","0.003","13.662","0.004","90","","104.577","0.004","90","","1398.5","0.7","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(4-Methylphenylsulfonyl)-5-nitro-1H-benzimidazole","","- C14 H11 N3 O4 S -","- C14 H11 N3 O4 S -","- C56 H44 N12 O16 S4 -","4","1","CV2162","Rashid, Naghmana; Hasan, Mashooda; Tahir, Muhammad K.; Yusof, Nurdiyana M.; Yamin, Bohari M.","1-(4-Methylphenylsulfonyl)-5-nitro-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","1","o323","o324","10.1107/S1600536806053542","","","0.71073","MoKα","","0.076","0.059","","","0.143","0.158","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211789","7.5036","0.0017","9.666","0.002","12.509","0.003","106.806","0.002","93.68","0.003","95.967","0.003","859.6","0.3","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","3-Hydroxy-4-oxo-2-phenyl-4H-chromene-6-carboxylic acid dimethylformamide solvate","","- C19 H17 N O6 -","- C19 H17 N O6 -","- C38 H34 N2 O12 -","2","1","DN2096","Liu, Chong-Bo; Chen, Yun-Hua; Zhou, Xiao-Ying; Ding, Liang; Wen, Hui-Liang","3-Hydroxy-4-oxo-2-phenyl-4<i>H</i>-chromene-6-carboxylic acid dimethylformamide solvate","Acta Crystallographica Section E","2007","63","1","o90","o91","10.1107/S1600536806050987","","","0.71073","MoKα","","0.0841","0.0457","","","0.1108","0.1313","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211790","11.9895","0.0004","16.2079","0.0003","21.2475","0.0006","90","","105.441","0.002","90","","3979.88","0.19","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","diethylenetriamine(2+) (<i>p</i>-methyldihomooxacalix[4]arene)dioxouranium methanol disolvate monohydrate","","- C39 H55 N3 O10 U -","- C39 H55 N3 O10 U -","- C156 H220 N12 O40 U4 -","4","1","DN2099","Masci, Bernardo; Thuéry, Pierre","2,2'-Iminobis(ethanaminium) (<i>p</i>-methyldihomooxacalix[4]arene)dioxouranium methanol disolvate monohydrate","Acta Crystallographica Section E","2007","63","1","m59","m61","10.1107/S1600536806051580","","","0.71073","MoKα","","0.0363","0.0238","","","0.0553","0.0586","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211791","6.2244","0.0006","17.3662","0.0015","7.1342","0.0008","90","","109.585","0.008","90","","726.55","0.13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Pyridin-4-ol‒hydroquinone (2/1)","","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","- C32 H32 N4 O8 -","2","0.5","DN2101","Kartal, Aslı; Albayrak, Çig̃dem; Ocak Ískeleli, Nazan; Ag̃ar, Erbil; Erdönmez, Ahmet","Pyridin-4-ol‒hydroquinone (1/1)","Acta Crystallographica Section E","2007","63","1","o193","o194","10.1107/S1600536806052366","","","0.71073","MoKα","","0.0592","0.0475","","","0.1338","0.1422","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211792","5.984","0.0003","11.7421","0.0005","10.8646","0.0005","90","","104.731","0.002","90","","738.31","0.06","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis[5-(pyrazin-2-yl)tetrazolato]manganese(II)","","- C10 H10 Mn N12 O2 -","- C10 H10 Mn N12 O2 -","- C20 H20 Mn2 N24 O4 -","2","0.5","DN2102","Shao-Wei, Peng; Yan-Li, Miao; Wen-Dong,Song","Diaquabis[5-(pyrazin-2-yl)tetrazolato]manganese(II)","Acta Crystallographica Section E","2007","63","1","m253","m254","10.1107/S1600536806054006","","","0.71073","MoKα","","0.0272","0.0254","","","0.068","0.0691","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211793","7.8099","0.0011","19.18","0.003","13.4279","0.0018","90","","90","","90","","2011.4","0.5","294","2","294","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","poly[[[bis[methanolcadmium(II)]-μ~2~-aqua]-bis(μ~3~- pyridine-2,6-dicarboxylato-κ^5^O:O,N,O':O')]","","- C16 H16 Cd2 N2 O11 -","- C16 H16 Cd2 N2 O11 -","- C64 H64 Cd8 N8 O44 -","4","0.5","DN2103","Wu, Hui-Fang; Chen, Xu-Dong; Du, Miao","A one-dimensional Cd^II^ coordination polymer: poly[[[bis[methanolcadmium(II)]-μ~2~-aqua]-bis(μ~3~-pyridine-2,6-dicarboxylato-κ^5^<i>O</i>:<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>')]","Acta Crystallographica Section E","2007","63","1","m126","m128","10.1107/S1600536806052354","","","0.71073","MoKα","","0.0246","0.0187","","","0.046","0.0479","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211794","6.1357","0.0019","8.568","0.003","22.758","0.007","90","","90","","90","","1196.4","0.7","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(4S)-3-Benzyloxycarbonyl-4-methyl-1,3-oxazolidin-5-one","(4S)-Benzyl 4-methyl-5-oxo-1,3-oxazolidine-3-carboxylate","","- C12 H13 N O4 -","- C12 H13 N O4 -","- C48 H52 N4 O16 -","4","1","DN2104","Lin, Kan; Fang, Mei-Juan; Tang, Guo; Wei, Zan-Bin; Zhao, Yu-Fen","(4<i>S</i>)-Benzyl 4-methyl-5-oxo-1,3-oxazolidine-3-carboxylate","Acta Crystallographica Section E","2007","63","1","o347","o348","10.1107/S1600536806052846","","","0.71073","MoKα","","0.0576","0.0556","","","0.1378","0.1391","","","","","","1.204","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211795","14.3048","0.0007","10.1746","0.0005","29.7259","0.0015","90","","90","","90","","4326.5","0.4","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis(acetylacetonato-κ^2^O,O')(4-Hydroxybenzaldehyde thiosemicarbazone-κS)zinc(II)","","- C18 H23 N3 O5 S Zn -","- C18 H23 N3 O5 S Zn -","- C144 H184 N24 O40 S8 Zn8 -","8","1","DN2105","Yang, Xue-Mei","Bis(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')(4-hydroxybenzaldehyde thiosemicarbazone-κ<i>S</i>)zinc(II)","Acta Crystallographica Section E","2007","63","1","m284","m285","10.1107/S1600536806054183","","","0.71073","MoKα","","0.0714","0.0363","","","0.0797","0.095","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211796","20.0447","0.0007","7.6833","0.0002","4.91966","0.00017","90","","90","","90","","757.67","0.04","173","","173","","","","","","","","","7","P n m a","-P 2ac 2n","62","","Sodium trifluoromethanesulfonate acetonitrile solvate","","- C3 H3 F3 N Na O3 S -","- C3 H3 F3 N Na O3 S -","- C12 H12 F12 N4 Na4 O12 S4 -","4","0.5","DN2106","A. Meffre; M. Barboiu; A. van der Lee","Sodium trifluoromethanesulfonate acetonitrile solvate","Acta Crystallographica Section E","2007","63","1","m255","m257","10.1107/S1600536806053918","","","0.71073","MoKα","","0.0798","0.0353","","0.084","0.0802","0.084","","","","","","0.7114","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211797","10.4097","0.0002","7.9541","0.0001","22.226","0.0004","90","","99.749","0.001","90","","1813.73","0.05","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Diisopropyl anthracene-1,8-dicarboxylate","","- C22 H22 O4 -","- C22 H22 O4 -","- C88 H88 O16 -","4","1","ER2019","Huan-Xia Zhang; Da-Bin Qin; Lin-Hai Jing; Shao-Jin Gu","Diisopropyl anthracene-1,8-dicarboxylate","Acta Crystallographica Section E","2007","63","1","o175","o176","10.1107/S1600536806052330","","","0.71073","MoKα","","0.0365","0.0333","","","0.0984","0.1011","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211798","5.7832","0.001","16.204","0.003","12.7389","0.0016","90","","100.044","0.012","90","","1175.5","0.3","294","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-Nitrophenyl tetra-O-acetyl-β-D-glucopyranoside","","- C20 H23 N O12 -","- C20 H23 N O12 -","- C40 H46 N2 O24 -","2","1","ER2020","Brito-Arias, Marco; Cruz-Salazar, Diana; Molins, Elies","4-Nitrophenyl tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section E","2007","63","1","o359","o360","10.1107/S1600536806052317","","","0.71073","MoKα","","0.0616","0.0397","","","0.0984","0.1082","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211799","15.8575","0.0009","12.3884","0.0007","9.0359","0.0005","90","","102.889","0.001","90","","1730.37","0.17","294","2","294","2","","","","","","","","5","C 1 c 1","C -2yc","9","","(Cyclobutane-1,1-dicarboxylato)(2-morpholinoethylamine)platinum(II) trihydrate","","- C12 H26 N2 O8 Pt -","- C12 H26 N2 O8 Pt -","- C48 H104 N8 O32 Pt4 -","4","1","ER2022","Ming-Jin Xie; Xi-Zhu Chen; Wei-Ping Liu; Yao Yu; Qing-Shong Ye","(Cyclobutane-1,1-dicarboxylato)(2-morpholinoethylamine)platinum(II) trihydrate","Acta Crystallographica Section E","2007","63","1","m117","m119","10.1107/S1600536806052329","","","0.71073","MoKα","","0.017","0.0148","","","0.0332","0.0341","","","","","","0.867","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211800","8.4387","0.0013","36.87","0.005","13.3937","0.0016","90","","127.155","0.007","90","","3321.3","0.8","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[(1E)-(2-Hydroxy-5-nitrophenyl)methyleneamino]-1,5-dimethyl-2-phenyl- 1H-pyrazol-3(2H)-one","","- C18 H16 N4 O4 -","- C18 H16 N4 O4 -","- C144 H128 N32 O32 -","8","2","ER2023","Ding-Ben Chen; Ling Huang","4-[(1<i>E</i>)-(2-Hydroxy-5-nitrophenyl)methyleneamino]-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","1","o36","o37","10.1107/S1600536806051014","","","0.71073","MoKα","","0.1073","0.0838","","","0.1812","0.197","","","","","","1.232","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211801","12.5265","0.0015","10.7003","0.0013","13.9454","0.0013","90","","90","","90","","1869.2","0.4","150","2","150","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","(1R,2S,3R,6S,7R,8S)-Tricyclo[6.2.1.0^2,7^]undeca-4,9-diene-3,6-diol","","- C11 H14 O2 -","- C11 H14 O2 -","- C88 H112 O16 -","8","2","ER2024","Banister, Samuel D.; Clegg, Jack K.; Coster, Mark J.; Jolliffe, Katrina A.; Kassiou, Michael","(1<i>R</i>,2<i>S</i>,3<i>R</i>,6<i>S</i>,7<i>R</i>,8<i>S</i>)-Tricyclo[6.2.1.0^2,7^]undeca-4,9-diene-3,6-diol","Acta Crystallographica Section E","2007","63","1","o92","o93","10.1107/S1600536806051002","","","0.71073","MoKα","","0.0736","0.0516","","","0.1089","0.1182","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211802","5.6035","0.0007","9.1716","0.0011","23.579","0.003","90","","96.752","0.012","90","","1203.4","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","cyheptamide","10,11-dihydro-5H-dibenz[a,d]cycloheptene-5-carboxamide","","- C16 H15 N O -","- C16 H15 N O -","- C64 H60 N4 O4 -","4","1","EZ2051","Leech, Charlotte K.; Florence, Alastair J.; Shankland, Kenneth; Shankland, Norman; Johnston, Andrea","A low-temperature redetermination of cyheptamide","Acta Crystallographica Section E","2007","63","1","o205","o206","10.1107/S160053680604983X","","","0.71073","MoKα","","0.047","0.035","","","0.083","0.086","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211803","11.332","0.007","13.225","0.008","14.667","0.008","90","","90","","90","","2198","2","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","10,13,17-Trimethyl-3-oxoperhydro-1H-cyclopenta[a]phenanthren-17-yl chloroacetate","","- C22 H33 Cl O3 -","- C22 H33 Cl O3 -","- C88 H132 Cl4 O12 -","4","1","EZ2052","Liu-Qing Sheng; Ren-Hua Zheng","10,13,17-Trimethyl-3-oxoperhydro-1<i>H</i>-cyclopenta[<i>a</i>]phenanthren-17-yl chloroacetate","Acta Crystallographica Section E","2007","63","1","o86","o87","10.1107/S1600536806050963","","","0.71073","MoKα","","0.082","0.06","","","0.138","0.15","","","","","","0.96","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211804","12.6019","0.0006","7.178","0.0004","17.6949","0.0009","90","","94.783","0.003","90","","1595.04","0.14","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","N-(2-Pyridylmethyl)adamantane-1-ammonium chloride monohydrate","","- C16 H25 Cl N2 O -","- C16 H25 Cl N2 O -","- C64 H100 Cl4 N8 O4 -","4","1","EZ2053","Yun-Qian Zhang; Xin Xiao; Qian-Jiang Zhu; Sai-Feng Xue; Zhu Tao","<i>N</i>-(2-Pyridylmethyl)adamantane-1-ammonium chloride monohydrate","Acta Crystallographica Section E","2007","63","1","o256","o258","10.1107/S1600536806051907","","","0.71073","MoKα","","0.057","0.041","","","0.113","0.131","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211805","11.989","0.002","19.699","0.003","13.297","0.003","90","","91.175","0.003","90","","3139.7","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Poly[[dicopper(II)-μ-4,4'-bipyridyl-bis[μ-N-(hydroxylpropyl)propane-1,3- diamine]] bis(perchlorate)]","","- C22 H38 Cl2 Cu2 N6 O10 -","- C22 H38 Cl2 Cu2 N6 O10 -","- C88 H152 Cl8 Cu8 N24 O40 -","4","0.5","EZ2054","Zhen-Ming Zhang; Da-Qi Wang; Gao Jian; Shuan Li","Poly[[dicopper(II)-μ-4,4'-bipyridyl-bis[μ-<i>N</i>-(hydroxypropyl)propane-1,3-diamine]] bis(perchlorate)]","Acta Crystallographica Section E","2007","63","1","m172","m174","10.1107/S1600536806053165","","","0.71073","MoKα","","0.151","0.066","","","0.16","0.21","","","","","","1","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211806","11.227","0.002","10.382","0.002","18.246","0.004","90","","90.06","0.03","90","","2126.7","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,3'-(4-Bromophenylmethanediyl)bis(5-methoxy-1H-indole)","","- C25 H21 Br N2 O2 -","- C25 H21 Br N2 O2 -","- C100 H84 Br4 N8 O8 -","4","1","EZ2055","Zhang, Dong-Mei; Tang, Qing-Gang; Ji, Chun-Xiang; Guo, Cheng","3,3'-(4-Bromophenylmethanediyl)bis(5-methoxy-1<i>H</i>-indole)","Acta Crystallographica Section E","2007","63","1","o81","o82","10.1107/S1600536806051294","","","0.71073","MoKα","","0.144","0.058","","","0.11","0.135","","","","","","0.94","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211807","9.3961","0.0016","9.4512","0.0016","9.4846","0.0016","117.452","0.002","109.115","0.002","101.278","0.003","643.08","0.19","173","2","173","2","","","","","","","","3","P -1","-P 1","2","PMOC2","2,4,6-Tris(bromomethyl)-1,3,5-trimethylbenzene","","- C12 H15 Br3 -","- C12 H15 Br3 -","- C24 H30 Br6 -","2","1","EZ2056","Murray, Pieter; Willans, Charlotte; Bredenkamp, Martin W.; Gertenbach, Jan-André","2,4,6-Tris(bromomethyl)-1,3,5-trimethylbenzene","Acta Crystallographica Section E","2007","63","1","o224","o225","10.1107/S1600536806052160","","","0.71073","MoKα","","0.036","0.028","","","0.065","0.069","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211808","14.325","0.003","5.058","0.002","12.25","0.002","90","","105.968","0.002","90","","853.3","0.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E,E)-N,N'-Bis(3,4-methylenedioxybenzylidene)propane-1,2-diamine","","- C19 H18 N2 O4 -","- C19 H18 N2 O4 -","- C38 H36 N4 O8 -","2","0.5","EZ2057","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Ding, Tie-Zhu","(<i>E</i>,<i>E</i>)-<i>N</i>,<i>N</i>'-Bis(3,4-methylenedioxybenzylidene)propane-1,2-diamine","Acta Crystallographica Section E","2007","63","1","o361","o362","10.1107/S1600536806053773","","","0.71073","MoKα","","0.079","0.053","","","0.131","0.159","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211809","18.754","0.003","6.294","0.002","18.522","0.003","90","","111.973","0.003","90","","2027.5","0.8","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-[4-(Dimethylamino)phenyl]-1-{[4-(Dimethylamino)phenyl]methyl}- 1H-benzimidazole","","- C24 H26 N4 -","- C24 H26 N4 -","- C96 H104 N16 -","4","1","EZ2059","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Ding, Tie-Zhu","2-[4-(Dimethylamino)phenyl]-1-{[4-(dimethylamino)phenyl]methyl}-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","1","o365","o367","10.1107/S160053680605389X","","","0.71073","MoKα","","0.123","0.045","","","0.065","0.073","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211810","10.221","0.004","10.912","0.004","10.221","0.004","90","","108","0.001","90","","1084.2","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[bis(μ~3~-pyridine-2-carboxylato)iron(II)]","","- C12 H8 Fe N2 O4 -","- C12 H8 Fe N2 O4 -","- C48 H32 Fe4 N8 O16 -","4","1","FI2015","Hao, Lu-Jiang; Liu, Tian-Tian","Poly[bis(μ~3~-pyridine-2-carboxylato)iron(II)]","Acta Crystallographica Section E","2007","63","1","m263","m264","10.1107/S1600536806053888","","","0.71073","MoKα","","0.039","0.036","","","0.118","0.122","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211811","15.1438","0.0018","11.1858","0.0013","4.9018","0.0006","90","","108.137","0.002","90","","789.09","0.16","298","","295","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","tristrontium decaaluminum silicon icosaoxide","","- Al10 O20 Si Sr3 -","- Al10 O20 Si Sr3 -","- Al20 O40 Si2 Sr6 -","2","0.25","FI2023","Rief, Andreas; Kubel, Frank","Sr~3~Al~10~SiO~20~ from single-crystal data","Acta Crystallographica Section E","2007","63","1","i19","i21","10.1107/S1600536806054936","","","0.71073","MoKα","","0","0.036","","","","0.032","","","1.702","","","1.752","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2211812","10.4922","0.0006","9.9679","0.0005","22.4589","0.0012","90","","96.58","0.0014","90","","2333.4","0.2","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,4-Bis(4-bromophenyl)-2,3-diphenylbenzene","","- C30 H20 Br2 -","- C30 H20 Br2 -","- C120 H80 Br8 -","4","1","FL2059","Grossie, David A.; Eynden, Matthew van den; Postel, David; Feld, William A.","1,4-Bis(4-bromophenyl)-2,3-diphenylbenzene","Acta Crystallographica Section E","2007","63","1","o284","o286","10.1107/S1600536806052548","","","0.71073","MoKα","","0.0493","0.0436","","","0.1054","0.1074","","","","","","1.184","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211813","8.412","0.003","9.885","0.003","12.812","0.004","87.047","0.009","76.819","0.007","84.039","0.008","1031.2","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","diaquachlorozinc(II)‒18-crown-6‒water (1/1/1)","","- C12 H30 Cl2 O9 Zn -","- C12 H30 Cl2 O9 Zn -","- C24 H60 Cl4 O18 Zn2 -","2","1","GG3062","Liu, Xi; Guo, Guo-Cong; Sun, Yu-Yang","Diaquachlorozinc(II)‒18-crown-6‒water (1/1/1)","Acta Crystallographica Section E","2007","63","1","m275","m277","10.1107/S1600536806054353","","","0.71073","MoKα","","0.0335","0.027","","","0.0616","0.0648","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211814","9.57","0.003","15.142","0.003","9.245","0.003","90","","113.14","0.006","90","","1231.9","0.6","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,3,8-Trihydroxy-6-methylanthraquinone monohydrate","","- C15 H12 O6 -","- C15 H12 O6 -","- C60 H48 O24 -","4","1","GH2013","Jin-Chan Zhu; Ying Liang; Heng-Shan Wang; Ying-Ming Pan; Yong Zhang","1,3,8-Trihydroxy-6-methylanthraquinone monohydrate","Acta Crystallographica Section E","2007","63","1","o233","o235","10.1107/S1600536806049178","","","0.7107","MoKα","","0.108","0.0804","","","0.1549","0.1678","","","","","","1.165","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211815","5.7403","0.0009","9.0806","0.0011","30.836","0.004","90","","92.98","0.011","90","","1605.2","0.4","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(1SR,3RS,5SR)-3-Hydroxy-3-(2-hydroxyethyl)-N-phenyl-5-tolylpyrrolidin-2-one","","- C19 H21 N O3 -","- C19 H21 N O3 -","- C76 H84 N4 O12 -","4","1","GK2037","Naoual Laghrib; Mohamed Azrour; Jean-Claude Daran; Rachid Fihi; Lhou Majidi","(1<i>SR</i>,3<i>RS</i>,5<i>SR</i>)-3-Hydroxy-3-(2-hydroxyethyl)-<i>N</i>-phenyl-5-(<i>p</i>-tolyl)pyrrolidin-2-one","Acta Crystallographica Section E","2007","63","1","o402","o404","10.1107/S1600536806054961","","","0.71073","MoKα","","0.1013","0.0551","","","0.1466","0.1704","","","","","","1.114","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2211816","10.2636","0.0005","11.5179","0.0006","10.4182","0.0005","90","","102.944","0.001","90","","1200.29","0.1","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-methyloxirane-2-carboxamide","","- C12 H9 F3 N2 O2 -","- C12 H9 F3 N2 O2 -","- C48 H36 F12 N8 O8 -","4","1","GK2038","Ray J. Butcher; Narasegowda, R. S.; Yathirajan, H. S.; Anilkumar, H. G.; Mohan, B. M.","<i>N</i>-[4-Cyano-3-(trifluoromethyl)phenyl]-2-methyloxirane-2-carboxamide: a bicalutamide intermediate","Acta Crystallographica Section E","2007","63","1","o33","o35","10.1107/S1600536806050574","","","0.71073","MoKα","","0.0435","0.0379","","","0.1016","0.1068","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211817","8.4954","0.0008","15.0557","0.0013","17.2379","0.0016","90","","91.541","0.002","90","","2204","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diethyl 2,13-dioxo-16,18-dioxa-1,3,12,14- tetraazapentacyclo[10.7.2.0^3,21^.0^5,10^.0^14,20^]undeca-5,7,9-triene- 20,21-dicarboxylate","","- C21 H24 N4 O8 -","- C21 H24 N4 O8 -","- C84 H96 N16 O32 -","4","1","GK2039","Bao-Han Zhou; Li-Ping Cao; Yu-Zhou Wang; Meng Gao","Diethyl 2,13-dioxo-16,18-dioxa-1,3,12,14-tetraazapentacyclo[10.7.2.0^3,21^.0^5,10^.0^14,20^]undeca-5,7,9-triene-20,21-dicarboxylate","Acta Crystallographica Section E","2007","63","1","o65","o66","10.1107/S1600536806050926","","","0.71073","MoKα","","0.0843","0.0643","","","0.1796","0.196","","","","","","1.006","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211818","8.3","0.001","9.485","0.001","13.993","0.001","90","","96.396","0.004","90","","1094.75","0.19","106","2","106","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","NDSB-221","3-(1-Methylpiperidinio)-1-propanesulfonate","","- C9 H19 N O3 S -","- C9 H19 N O3 S -","- C36 H76 N4 O12 S4 -","4","1","GK2044","Katarzyna D. Koclega; Maksymilian Chruszcz; Wladek Minor","3-(1-Methylpiperidinio)-1-propanesulfonate","Acta Crystallographica Section E","2007","63","1","o282","o283","10.1107/S1600536806052950","","","1.54179","CuKα","","0.0324","0.0315","","","0.0843","0.0848","","","","","","1.095","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211819","5.1464","0.001","6.4218","0.0013","12.142","0.002","104.38","0.03","90.6","0.03","109.44","0.03","364.64","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(5-methylpyrazine-2-carboxylato-k^2^N^1^,O)nickel(II)","","- C12 H14 N4 Ni O6 -","- C12 H14 N4 Ni O6 -","- C12 H14 N4 Ni O6 -","1","0.5","GK2045","Shang, Run-Ling; Liu, Fu-Ying; Du, Lin; Li, Xiu-Bing; Sun, Bai-Wang","Diaquabis(5-methylpyrazine-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)nickel(II)","Acta Crystallographica Section E","2007","63","1","m190","m192","10.1107/S1600536806053116","","","0.71073","MoKα","","0.0388","0.0354","","","0.0878","0.0909","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211820","10.104","0.002","12.214","0.002","12.419","0.002","68.72","0.01","69.33","0.02","83.634","0.008","1335.9","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Hemiheptapotassiumheminonahydrogen α-hexamolybdoplatinate(IV) 5.5-hydrate","","- H15.5 K3.5 Mo6 O29.5 Pt -","- H14.5 K3.5 Mo6 O29.5 Pt -","- H29 K7 Mo12 O59 Pt2 -","2","1","HB2204","Lee, Uk; Joo, Hea-Chung","Hemiheptapotassium heminonahydrogen α-hexamolybdoplatinate(IV) 5.5-hydrate","Acta Crystallographica Section E","2007","63","1","i11","i13","10.1107/S1600536806054055","","","0.71069","MoKα","","0.0596","0.0435","","","0.1022","0.116","","","","","","1.11","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2211821","16.0942","0.0014","15.7871","0.0014","7.795","0.0007","90","","97.217","0.001","90","","1964.9","0.3","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Dimethylpyridinium 2,4-dihydroxybenzoate 2,6-dimethylpyridine solvate","","- C21 H24 N2 O4 -","- C21 H24 N2 O4 -","- C84 H96 N8 O16 -","4","1","HB2207","Wei, Lin-Heng","2,6-Dimethylpyridinium 2,4-dihydroxybenzoate 2,6-dimethylpyridine solvate","Acta Crystallographica Section E","2007","63","1","o368","o369","10.1107/S160053680605375X","","","0.71073","MoKα","","0.0705","0.0485","","","0.1407","0.152","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211822","12.7597","0.0011","9.2615","0.0008","13.2195","0.0011","90","","93.62","0.002","90","","1559.1","0.2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetraaqua(2,2'-bipyridine-5,5'-dicarboxylato)iron(II) dihydrate","","- C12 H18 Fe N2 O10 -","- C12 H18 Fe N2 O10 -","- C48 H72 Fe4 N8 O40 -","4","0.5","HB2212","Ock Keum Kawk; Kil Sik Min; Bong Gon Kim","Tetraaqua(2,2'-bipyridine-5,5'-dicarboxylato)iron(II) dihydrate","Acta Crystallographica Section E","2007","63","1","m17","m19","10.1107/S1600536806050914","","","0.71073","MoKα","","0.0446","0.0386","","","0.0818","0.0847","","","","","","1.19","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211823","11.7386","0.0007","13.2135","0.0011","14.4602","0.0009","90","","91.216","0.005","90","","2242.4","0.3","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Lithium tetrakis(diphenylphosphino)borate diethyl ether solvate","","- C52 H50 B Li O P4 -","- C52 H50 B Li O P4 -","- C104 H100 B2 Li2 O2 P8 -","2","1","HB2216","Dornhaus, Franz; Bolte, Michael","Lithium tetrakis(diphenylphosphino)borate diethyl ether solvate","Acta Crystallographica Section E","2007","63","1","m39","m40","10.1107/S1600536806051130","","","0.71073","MoKα","","0.0404","0.0377","","","0.0957","0.0968","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211824","10.2918","0.0012","14.5424","0.0014","14.8057","0.0013","116.79","0.007","105.314","0.008","94.85","0.009","1853.7","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Bis(12-crown-4)lithium(I) bis[(N,N-diisopropylamino)borohydride(1-)]lithium(I)","","- C28 H66 B2 Li2 N2 O8 -","- C28 H66 B2 Li2 N2 O8 -","- C56 H132 B4 Li4 N4 O16 -","2","1","HB2217","Dornhaus, Franz; Bolte, Michael","Bis(12-crown-4)lithium(I) bis[(<i>N</i>,<i>N</i>-diisopropylamino)borohydride(1‒)]lithium(I)","Acta Crystallographica Section E","2007","63","1","m41","m42","10.1107/S1600536806051142","","","0.71073","MoKα","","0.1968","0.0837","","","0.1409","0.1764","","","","","","0.95","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211825","18.474","0.002","28.718","0.004","19.019","0.002","90","","116.092","0.002","90","","9062","1.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[(dipyrido[3,2-a:2',3'-c]phenazine)zinc(II)]-μ-benzene-1,4- dicarboxylato] dipyrido[3,2-a:2',3'-c]phenazine 0.67-solvate]","","- C114 H62 N20 O12 Zn3 -","- C114 H62 N20 O12 Zn3 -","- C456 H248 N80 O48 Zn12 -","4","1","HB2218","Chuan-Bi Li; Wei Fang; En-Jie Dong; Bo Liu; Yan-Wei Li","<i>catena</i>-Poly[[[(dipyrido[3,2-<i>a</i>:2',3'-<i>c</i>]phenazine)zinc(II)]-μ-benzene-1,4-dicarboxylato] dipyrido[3,2-<i>a</i>:2',3'-<i>c</i>]phenazine 0.67-solvate]","Acta Crystallographica Section E","2007","63","1","m150","m152","10.1107/S1600536806052536","","","0.71073","MoKα","","0.1654","0.0449","","","0.0661","0.0876","","","","","","0.708","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211826","13.177","0.003","16.289","0.003","8.428","0.0017","90","","90","","90","","1809","0.6","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2-(2H-1,2,3-Benzotriazol-2-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol","","- C20 H25 N3 O -","- C20 H25 N3 O -","- C80 H100 N12 O4 -","4","1","HB2219","Xing, Zhi-Tao; Ding, Wei-Lin; Wang, Pin-Liang; Han, Feng; Wang, Hai-Bo","2-(2<i>H</i>-1,2,3-Benzotriazol-2-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol","Acta Crystallographica Section E","2007","63","1","o49","o50","10.1107/S1600536806051191","","","0.71073","MoKα","","0.1268","0.0631","","","0.1149","0.137","","","","","","0.951","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211827","15.715","0.003","10.25","0.002","9.819","0.003","90","","91.862","0.018","90","","1580.8","0.6","295","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-{2-[4-(aminosulfonyl)phenyl]ethyl}-2-(4-hydroxyphenyl)acetamide","","- C16 H18 N2 O4 S -","- C16 H18 N2 O4 S -","- C64 H72 N8 O16 S4 -","4","1","HB2220","Rohan A. Davis; Peter C. Healy; Sally-Ann Poulsen","<i>N</i>-{2-[4-(Aminosulfonyl)phenyl]ethyl}-2-(4-hydroxyphenyl)acetamide","Acta Crystallographica Section E","2007","63","1","o96","o97","10.1107/S1600536806051348","","","0.71069","MoKα","","0.0606","0.0393","","","0.1008","0.1111","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211828","14.494","0.003","10.616","0.002","15.573","0.003","90","","107.91","0.004","90","","2280.1","0.8","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(S)-5-(2,6-Dichlorophenyl)-3-(2-naphthyl)-1-phenyl-2-pyrazoline trichloromethane hemisolvate","","- C25.5 H18.5 Cl3.5 N2 -","- C51 H37 Cl7 N4 -","- C102 H74 Cl14 N8 -","2","0.5","HB2221","Lu, Zhi-Ke; Xie, Bi-Xia; Huang, Peng-Mian","(<i>SR</i>)-5-(2,6-Dichlorophenyl)-3-(2-naphthyl)-1-phenyl-2-pyrazoline trichloromethane hemisolvate","Acta Crystallographica Section E","2007","63","1","o75","o76","10.1107/S1600536806051452","","","0.71073","MoKα","","0.105","0.0513","","","0.1127","0.1381","","","","","","1.016","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211829","7.0488","0.0015","12.15","0.003","28.649","0.006","90","","90","","90","","2453.6","1","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2'-(4-Hydroxybenzylidene)isonicotinohydrazide monohydrate","","- C13 H13 N3 O3 -","- C13 H13 N3 O3 -","- C104 H104 N24 O24 -","8","1","HB2222","Xi-Shi Tai; Fan-Yuan Kong; Jie Yin","2'-(4-Hydroxybenzylidene)isonicotinohydrazide monohydrate","Acta Crystallographica Section E","2007","63","1","o79","o80","10.1107/S1600536806051919","","","0.71073","MoKα","","0.1173","0.0414","","","0.084","0.1083","","","","","","0.96","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211830","7.213","0.002","7.487","0.002","15.452","0.004","80.92","0.004","80.634","0.004","89.247","0.004","813","0.4","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","1-(4-(Dimethylamino)benzylidene)-4-(4-nitrophenyl)thiosemicarbazide","","- C16 H17 N5 O2 S -","- C16 H17 N5 O2 S -","- C32 H34 N10 O4 S2 -","2","1","HB2223","Fang, Wei; Lin, Li-Rong; Huang, Rong-Bin; Zheng, Lan-Sun","1-[4-(Dimethylamino)benzylidene]-4-(4-nitrophenyl)thiosemicarbazide","Acta Crystallographica Section E","2007","63","1","o112","o113","10.1107/S160053680605166X","","","0.71073","MoKα","","0.0531","0.0493","","","0.1376","0.1412","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211831","10.9824","0.0005","12.1782","0.0007","15.0405","0.0008","71.064","0.005","88.199","0.004","85.024","0.004","1895.56","0.18","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Tris(N,N,N',N'-tetramethylguanidinium) nonabromodiantimonate(III)","","- C15 H42 Br9 N9 Sb2 -","- C15 H42 Br9 N9 Sb2 -","- C30 H84 Br18 N18 Sb4 -","2","1","HB2224","Bujak, Maciej; Zaleski, Jacek","Tris(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylguanidinium) nonabromodiantimonate(III)","Acta Crystallographica Section E","2007","63","1","m102","m104","10.1107/S1600536806051920","","","0.71073","MoKα","","0.0526","0.0328","","","0.0616","0.0665","","","","","","0.903","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211832","4.9306","0.001","9.7622","0.0014","29.912","0.006","90","","90.861","0.008","90","","1439.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(4-Benzyloxyphenyl)-2-bromopropan-1-one","","- C16 H15 Br O2 -","- C16 H15 Br O2 -","- C64 H60 Br4 O8 -","4","1","HB2226","Song-Qing Wang; Hong-Mei Zhao; Xiu-Jie Liu","1-(4-Benzyloxyphenyl)-2-bromopropan-1-one","Acta Crystallographica Section E","2007","63","1","o151","o152","10.1107/S1600536806051968","","","0.7107","MoKα","","0.0875","0.0566","","","0.1254","0.1402","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211833","12.24","0.005","6.618","0.003","18.471","0.008","90","","95.879","0.007","90","","1488.4","1.1","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 7-(4-chlorobenzoyloxy)-1,3-benzodioxole-5-carboxylate","","- C16 H11 Cl O6 -","- C16 H11 Cl O6 -","- C64 H44 Cl4 O24 -","4","1","HB2227","Hu, Zhi-Qiang; Zheng, Lei; Li, Chang-Jin; Chang, Jun-Biao","Methyl 7-(4-chlorobenzoyloxy)-1,3-benzodioxole-5-carboxylate","Acta Crystallographica Section E","2007","63","1","o156","o157","10.1107/S160053680605197X","","","0.71073","MoKα","","0.0955","0.0432","","","0.0956","0.1185","","","","","","1.004","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211834","8.5463","0.0007","10.5588","0.0009","13.2894","0.0011","90","","95.15","0.007","90","","1194.38","0.17","130","","130","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-Amidinio-3,5,5-trimethyl-2-pyrazoline-1-carboxamidine chloride","","- C8 H17 Cl N6 -","- C8 H17 Cl N6 -","- C32 H68 Cl4 N24 -","4","1","HB2228","Maria Gdaniec; Franciszek Saczewski; Zbigniew Brzozowski","<i>N</i>-Amidinio-3,5,5-trimethyl-2-pyrazoline-1-carboxamidine chloride (BPC-151), an oral hypoglycaemic agent","Acta Crystallographica Section E","2007","63","1","o124","o125","10.1107/S1600536806051695","","","0.71073","MoKα","","0.0367","0.0298","","","0.0753","0.079","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211835","5.9422","0.0004","21.4433","0.0016","13.147","0.001","90","","100.29","0.002","90","","1648.3","0.2","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[bis(μ-1-ethyl-6-fluoro-4-oxo-7-(1-piperazinyl)- 1,4-dihydro-1,8-naphtyridine-3-carboxylato)cobalt(II)] dihydrate]","","- C30 H32 Co F2 N8 O8 -","- C30 H32 Co F2 N8 O8 -","- C60 H64 Co2 F4 N16 O16 -","2","0.5","HB2230","Zhe An; Rong-Shun Wang","Poly[[bis[μ-1-ethyl-6-fluoro-4-oxo-7-(1-piperazinyl)-1,4-dihydro-1,8-naphthyridine-3-carboxylato]cobalt(II)] dihydrate]","Acta Crystallographica Section E","2007","63","1","m148","m149","10.1107/S1600536806052640","","","0.71073","MoKα","","0.0666","0.0485","","","0.1266","0.1396","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211836","21.3111","0.001","9.3462","0.0005","22.3385","0.0016","90","","90","","90","","4449.3","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1,5-Bis(4-bromophenyl)-3-(3-nitrophenyl)pentane-1,5-dione","","- C23 H17 Br2 N O4 -","- C23 H17 Br2 N O4 -","- C184 H136 Br16 N8 O32 -","8","1","HB2231","Yathirajan, H. S.; Malte, K.; Narayana, B.; Sreevidya, T.V.; Bolte, Michael","1,5-Bis(4-bromophenyl)-3-(3-nitrophenyl)pentane-1,5-dione","Acta Crystallographica Section E","2007","63","1","o228","o229","10.1107/S1600536806052585","","","0.71073","MoKα","","0.0897","0.0674","","","0.1203","0.1294","","","","","","1.175","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211837","11.7792","0.001","10.9353","0.0009","11.7793","0.001","90","","116.223","0.004","90","","1361.1","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[diammonium hexahydroxyoctadecaoxodisodiohexamolybdonickelate dihydrate]","","- H26 Mo6 N2 Na2 Ni O30 -","- H26 Mo6 N2 Na2 Ni O30 -","- H52 Mo12 N4 Na4 Ni2 O60 -","2","0.5","HB2232","Bo Liu; Li Feng; Shi Zhou; Chuan-Bi Li; Wei Zhou","Poly[diammonium diaquahexahydroxyoctadecaoxodisodiohexamolybdonickelate(II)]","Acta Crystallographica Section E","2007","63","1","i14","i15","10.1107/S1600536806053761","","","0.71073","MoKα","","0.0763","0.0558","","","0.0918","0.0978","","","","","","0.948","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2211838","4.7361","0.0004","12.8179","0.0013","24.853","0.002","90","","96.852","0.008","90","","1498","0.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,4-Dichlorobenzyl alcohol","(2,4-Dichlorophenyl)methanol","","- C7 H6 Cl2 O -","- C7 H6 Cl2 O -","- C56 H48 Cl16 O8 -","8","2","HB2233","Bambagiotti-Alberti, Massimo; Bruni, Bruno; Di Vaira, Massimo; Giannellini, Valerio","(2,4-Dichlorophenyl)methanol","Acta Crystallographica Section E","2007","63","1","o275","o276","10.1107/S1600536806053086","","","1.5418","CuKα","","0.0361","0.027","","","0.0717","0.074","","","","","","0.952","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211839","17.002","0.003","10.6323","0.0018","17.92","0.003","90","","99.521","0.002","90","","3194.8","0.9","292","2","292","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diacetatobis[2-(2-furyl)-1H-imidazo[4,5-f](1,10-phenanthroline)cadmium(II)]","","- C38 H26 Cd N8 O6 -","- C38 H26 Cd N8 O6 -","- C152 H104 Cd4 N32 O24 -","4","0.5","HB2235","Chuan-Bi Li; Yan-Wei Li; De-Qian Li","Diacetatobis[2-(2-furyl)-1<i>H</i>-imidazo[4,5-<i>f</i>][1,10]phenanthroline]cadmium(II)","Acta Crystallographica Section E","2007","63","1","m286","m288","10.1107/S1600536806054298","","","0.71073","MoKα","","0.0318","0.0274","","","0.0683","0.0704","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211840","7.1855","0.0005","24.4898","0.0019","37.352","0.003","90","","90","","90","","6572.9","0.9","193","","193","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-(3-Hydroxyanilino)-1,3-diphenylprop-2-en-1-one","","- C21 H17 N O2 -","- C21 H17 N O2 -","- C336 H272 N16 O32 -","16","2","HG2125","Yao-Cheng Shi; Su-Hua Zhang","3-(3-Hydroxyanilino)-1,3-diphenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","1","o138","o140","10.1107/S1600536806051798","","","0.7107","MoKα","","0.1064","0.0865","","","0.156","0.1631","","","","","","1.297","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211841","10.131","0.003","5.7977","0.0014","20.957","0.005","90","","101.562","0.004","90","","1206","0.5","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3-[(6-Chloropyridin-3-yl)methyl]-2-thioxo-2,3,5,6-tetrahydropyrimidin-4(1H)-one","","- C10 H10 Cl N3 O S -","- C10 H10 Cl N3 O S -","- C40 H40 Cl4 N12 O4 S4 -","4","1","HG2131","Hong Jiang; Chen-Xia Yu; Shu-Jiang Tu; Xiang-Shan Wang; Chang-sheng Yao","3-[(6-Chloropyridin-3-yl)methyl]-2-thioxo-2,3,5,6-tetrahydropyrimidin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","1","o298","o299","10.1107/S1600536806049439","","","0.71073","MoKα","","0.1092","0.0489","","","0.1199","0.1459","","","","","","1.006","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211842","13.756","0.003","8.069","0.0016","19.835","0.004","90","","90","","90","","2201.6","0.8","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1-[1-(3-Nitrophenyl)ethylidene]thiosemicarbazide","","- C9 H10 N4 O2 S -","- C9 H10 N4 O2 S -","- C72 H80 N32 O16 S8 -","8","1","HG2138","Jian-Gang Wang; Fang-Fang Jian; Yong-Qi Qin; Yan Wang","1-[1-(3-Nitrophenyl)ethylidene]thiosemicarbazide","Acta Crystallographica Section E","2007","63","1","o10","o11","10.1107/S1600536806049440","","","0.71073","MoKα","","0.1646","0.0794","","","0.2075","0.2567","","","","","","0.978","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211843","11.0426","0.0013","11.5665","0.0014","23.243","0.003","99.292","0.003","92.174","0.002","106.196","0.002","2802.7","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Iodotris(tri-p-tolylphosphine)silver(I)","","- C63 H63 Ag I P3 -","- C63 H63 Ag I P3 -","- C126 H126 Ag2 I2 P6 -","2","1","HG2143","Meijboom, Reinout","Iodotris(tri-<i>p</i>-tolylphosphine)silver(I)","Acta Crystallographica Section E","2007","63","1","m78","m79","10.1107/S1600536806050884","","","0.71073","MoKα","","","0.0396","","","","0.094","","","","","","1.014","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211844","14.2255","0.0014","4.9257","0.0016","12.7837","0.0018","90","","101.624","0.003","90","","877.4","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis[(3,4-methylenedioxyphenyl)methylene]phenylene-1,4-diamine","","- C22 H20 N2 O4 -","- C22 H20 N2 O4 -","- C44 H40 N4 O8 -","2","0.5","HG2148","Yang, Shu-Ping; Li-Jun, Han; Da-Qi, Wang; Tie-Zhu, Ding","<i>N</i>,<i>N</i>'-Bis[(3,4-methylenedioxyphenyl)methylene]phenylene-1,4-diamine","Acta Crystallographica Section E","2007","63","1","o244","o246","10.1107/S1600536806052755","","","0.71073","MoKα","","0.0743","0.0468","","","0.1143","0.1356","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211845","15.366","0.003","9.2799","0.0019","22.879","0.005","90","","90","","90","","3262.4","1.2","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Diethanolbis[4-(2-furoyl)-3-methyl-1-phenyl-1H-pyrazol-5-onato]zinc(II)","","- C34 H34 N4 O8 Zn -","- C34 H34 N4 O8 Zn -","- C136 H136 N16 O32 Zn4 -","4","0.5","HG2149","Zhang, Heng-Qiang; Li, Jin-Zhou; Gao, Shan; Zhang, Yong","Diethanolbis[4-(2-furoyl)-3-methyl-1-phenyl-1<i>H</i>-pyrazol-5-onato]zinc(II)","Acta Crystallographica Section E","2007","63","1","m165","m166","10.1107/S1600536806052718","","","0.71073","MoKα","","0.0422","0.0309","","","0.0885","0.0951","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211846","8.456","0.003","9.902","0.011","12.316","0.003","71.61","0.05","82.94","0.03","74.33","0.07","941.4","1.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Methyl 4-chloro-3,5-di-p-tolyl-1H-pyrrole-2-carboxylate dichloromethane hemisolvate","","- C20.5 H19 Cl2 N O2 -","- C20.5 H19 Cl2 N O2 -","- C41 H38 Cl4 N2 O4 -","2","1","HG2150","Michael G. Gardiner; Roderick C. Jones; Sarah Ng; Jason A. Smith","Methyl 4-chloro-3,5-di-<i>p</i>-tolyl-1<i>H</i>-pyrrole-2-carboxylate dichloromethane hemisolvate","Acta Crystallographica Section E","2007","63","1","o197","o199","10.1107/S1600536806052202","","","0.71073","MoKα","","0.0639","0.0508","","","0.1458","0.1556","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211847","7.9796","0.0009","9.9882","0.0011","11.0724","0.0013","78.696","0.002","88.823","0.002","77.216","0.002","843.68","0.17","298","2","293","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 1-[(6-chloropyridin-3-yl)methyl]-3-phenyl-1H-pyrazole-5-carboxylate","","- C18 H16 Cl N3 O2 -","- C18 H16 Cl N3 O2 -","- C36 H32 Cl2 N6 O4 -","2","1","HG2151","Yong Xia; Xiao-Ling Ding; Yan-Qing Ge; Lian-Dong Liu; Bao-Xiang Zhao","Ethyl 1-[(6-chloropyridin-3-yl)methyl]-3-phenyl-1<i>H</i>-pyrazole-5-carboxylate","Acta Crystallographica Section E","2007","63","1","o394","o395","10.1107/S1600536806054262","","","0.71073","MoKα","","0.0502","0.0446","","","0.1114","0.1153","","","","","","1.074","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211848","9.278","0.003","10.013","0.004","10.816","0.004","92.144","0.004","98.55","0.004","109.215","0.004","934.3","0.6","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","6,6'-Dimethoxy-2,2'-(propane-1,3-diyldiiminodimethylene)diphenol","","- C19 H26 N2 O4 -","- C19 H26 N2 O4 -","- C38 H52 N4 O8 -","2","1","HG2152","Xia, H.-T.; Liu, Y.-F.; Yang, S.-P.; Wang, D.-Q.","6,6'-Dimethoxy-2,2'-(propane-1,3-diyldiiminodimethylene)diphenol","Acta Crystallographica Section E","2007","63","1","o239","o240","10.1107/S1600536806052767","","","0.71073","MoKα","","0.0901","0.0536","","","0.1304","0.1523","","","","","","1.018","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211849","11.213","0.002","8.1919","0.0016","33.739","0.006","90","","90","","90","","3099.1","1","297","2","297","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","3-Hydroxy-3-(6-methoxynaphthalen-2-yl)-1-phenylprop-2-en-1-one","","- C20 H16 O3 -","- C20 H16 O3 -","- C160 H128 O24 -","8","1","HG2153","Chun-Yang Zheng; Ling Fan; Dun-Jia Wang","3-Hydroxy-3-(6-methoxynaphthalen-2-yl)-1-phenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","1","o396","o397","10.1107/S1600536806053797","","","0.71073","MoKα","","0.1006","0.0675","","","0.1251","0.1383","","","","","","1.157","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211850","12.957","0.003","3.892","0.0008","14.135","0.003","90","","97.736","0.002","90","","706.3","0.3","103","2","103","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(2E)-1-(2,4-Dichlorophenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-en-1-one","","- C16 H12 Cl2 O S -","- C16 H12 Cl2 O S -","- C32 H24 Cl4 O2 S2 -","2","1","HK2154","Ray J. Butcher; Yathirajan, H. S.; Narayana, B.; Mithun, A.; Sarojini, B. K.","(2<i>E</i>)-1-(2,4-Dichlorophenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-en-1-one","Acta Crystallographica Section E","2007","63","1","o30","o32","10.1107/S1600536806050069","","","0.71073","MoKα","","0.0294","0.0284","","","0.0702","0.0708","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211851","11.284","0.002","5.327","0.0011","13.184","0.003","90","","109.91","0.03","90","","745.1","0.3","294","2","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2'-Deoxy-3',5'-di-O-acetyluridine","","- C13 H16 N2 O7 -","- C13 H16 N2 O7 -","- C26 H32 N4 O14 -","2","1","HK2164","Luo, Qun; Tang, Dai-Hua; Zhen, Zhen; Liu, Xin-Hou","2'-Deoxy-3',5'-di-<i>O</i>-acetyluridine","Acta Crystallographica Section E","2007","63","1","o4","o6","10.1107/S1600536806050264","","","0.71073","MoKα","","0.053","0.0377","","","0.0851","0.0881","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211852","8.761","0.003","17.363","0.005","17.752","0.005","90","","109.73","0.02","90","","2541.9","1.4","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2-Benzoylbenzoato)triphenyltin(IV)","","- C32 H24 O3 Sn -","- C32 H24 O3 Sn -","- C128 H96 O12 Sn4 -","4","1","HK2167","Diop, Cheikh Abdoul Khadir; Touré, Assane; Diop, Libasse; Tinant, Bernard; Mahieu, Bernard","(2-Benzoylbenzoato)triphenyltin(IV)","Acta Crystallographica Section E","2007","63","1","m91","m93","10.1107/S1600536806051853","","","0.71069","MoKα","","0.0345","0.0338","","","0.0942","0.0949","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211853","8.0207","0.0017","8.1947","0.0018","12.536","0.003","93.926","0.004","91.031","0.004","108.05","0.004","780.9","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","5-(4-Methoxyphenyl)-3-(4-nitrobenzylsulfanyl)-4,5-dihydro-3H-1,2,4-triazole","","- C16 H14 N4 O3 S -","- C16 H14 N4 O3 S -","- C32 H28 N8 O6 S2 -","2","1","HK2168","Ghulam Qadeer; Nasim Hasan Rama; Muhammad Zareef; Xin-Hua Li","5-(4-Methoxyphenyl)-3-(4-nitrobenzylsulfanyl)-4,5-dihydro-3<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2007","63","1","o88","o89","10.1107/S1600536806051543","","","0.71073","MoKα","","0.1038","0.0916","","","0.2185","0.2269","","","","","","1.173","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211854","9.726","0.0019","10.071","0.002","18.285","0.004","90","","91.15","0.03","90","","1790.7","0.6","294","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,5-Bis(2,4-diethylbenzoyl)terephthalic acid pyridine disolvate","","- C40 H40 N2 O6 -","- C40 H40 N2 O6 -","- C80 H80 N4 O12 -","2","0.5","HK2169","Shui-Ping Deng; Guang-Liang Song; Shan Liu; Hong-Jun Zhu","2,5-Bis(2,4-diethylbenzoyl)terephthalic acid pyridine disolvate","Acta Crystallographica Section E","2007","63","1","o268","o270","10.1107/S1600536806052962","","","0.71073","MoKα","","0.1733","0.0985","","","0.1955","0.222","","","","","","0.828","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211855","8.367","0.0017","8.773","0.0018","10.35","0.002","90","","90","","90","","759.7","0.3","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-acryloyl-L-alanine","","- C6 H9 N O3 -","- C6 H9 N O3 -","- C24 H36 N4 O12 -","4","1","HK2170","Lv, Zhi-Fang; Wu, Wen-Yuan; Zhang, Rong; Wang, Jin-Tang","<i>N</i>-Acryloyl-<small>L</small>-alanine","Acta Crystallographica Section E","2007","63","1","o191","o192","10.1107/S1600536806051828","","","0.71073","MoKα","","0.0384","0.0338","","","0.0796","0.0818","","","","","","1.078","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211856","8.156","0.0016","10.079","0.002","11.084","0.002","90.16","0.03","94.17","0.03","104.99","0.03","877.6","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","N-acryoylaspartic acid","N-acryoylaspartic acid","","- C7 H9 N O5 -","- C7 H9 N O5 -","- C28 H36 N4 O20 -","4","2","HK2172","Lv, Zhi-Fang; Gao, Xu-Sheng; Gao, Xiao-Feng; Wang, Jin-tang","<i>N</i>-Acryloylaspartic acid","Acta Crystallographica Section E","2007","63","1","o207","o209","10.1107/S1600536806052032","","","0.71073","MoKα","","0.0763","0.0538","","","0.1447","0.1573","","","","","","0.996","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211857","10.572","0.002","9.789","0.002","16.009","0.003","90","","90","","90","","1656.8","0.6","294","2","294","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Benzyldiphenylphosphine selenide","","- C19 H17 P Se -","- C19 H17 P Se -","- C76 H68 P4 Se4 -","4","1","HK2174","Muller, Alfred","Benzyldiphenylphosphine selenide","Acta Crystallographica Section E","2007","63","1","o317","o318","10.1107/S1600536806053190","","","0.71073","MoKα","","","0.03","","","","0.0629","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211858","9.488","0.004","10.894","0.005","17.871","0.007","90","","96.03","0.02","90","","1837","1.4","110","2","110","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","(2,2-Dicyclohexylacetato)trimethyltin(IV)","","- C17 H32 O2 Sn -","- C17 H32 O2 Sn -","- C68 H128 O8 Sn4 -","4","1","HK2175","Cheikh Abdoul Khadir, Diop; Assane, Touré; Libasse, Diop; Tinant, Bernard; Mahieu, Bernard","<i>catena</i>-Poly[[trimethyltin(IV)]-μ-2,2-dicyclohexylacetato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","1","m258","m260","10.1107/S1600536806053967","","","0.71069","MoKα","","0.0377","0.0368","","","0.1022","0.1027","","","","","","1.253","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211859","7.9058","0.001","21.191","0.003","8.8305","0.0013","90","","111.989","0.004","90","","1371.8","0.3","110","2","110","2","","","","","","","","3","C 1 c 1","C -2yc","9","","1,3-Dipropionyl-2,4,6-trimethylbenzene","","- C15 H20 O2 -","- C15 H20 O2 -","- C60 H80 O8 -","4","1","HK2176","Pinkus, A.G.; Klausmeyer, Kevin K.; Kalyanam, Nagabushanam","1,3-Dipropionyl-2,4,6-trimethylbenzene","Acta Crystallographica Section E","2007","63","1","o277","o278","10.1107/S1600536806053256","","","0.71073","MoKα","","0.0347","0.0327","","","0.0915","0.0933","","","","","","1.068","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211860","11.9014","0.0009","12.122","0.001","29.07","0.002","99.171","0.002","91.623","0.002","109.922","0.002","3877.1","0.5","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H60 F16 O10 Sn4 -","- C84 H60 F16 O10 Sn4 -","- C168 H120 F32 O20 Sn8 -","2","1","HY2028","Junshan Sun; Linlin Qiu; Rufen Zhang; Chunlin Ma","Octabenzyldi-μ~3~-oxo-bis(μ-2,3,4,5-tetrafluorobenzoato-κ^2^<i>O</i>:<i>O</i>')bis(2,3,4,5-tetrafluorobenzoato-κ<i>O</i>)tetratin(IV)","Acta Crystallographica Section E","2007","63","1","m62","m63","10.1107/S1600536806051397","","","0.71073","MoKα","","0.0657","0.0398","","","0.083","0.096","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211861","10.9385","0.0008","15.6425","0.0012","11.81","0.0009","90","","109.04","0.001","90","","1910.2","0.2","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Propane-1,3-diylbis(triphenylphosphonium) (oxalato)oxodiperoxomolybdate(VI) monohydrate","","- C41 H38 Mo O10 P2 -","- C41 H38 Mo O10 P2 -","- C82 H76 Mo2 O20 P4 -","2","1","HY2033","Xian-Ying Shi; Jun-Fa Wei; Xi-Ru Zhang; Jing Cao","Propane-1,3-diylbis(triphenylphosphonium) (oxalato)oxodiperoxomolybdate(VI) monohydrate","Acta Crystallographica Section E","2007","63","1","m227","m229","10.1107/S160053680605272X","","","0.71073","MoKα","","0.0714","0.0571","","","0.134","0.1509","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211862","9.118","0.005","12.013","0.005","17.319","0.005","90","","94.837","0.005","90","","1890.3","1.4","100","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Caesium bis(nitrilotriacetato)chromium(III) dihydrate","","- C12 H18 Cr Cs N2 O14 -","- C12 H18 Cr Cs N2 O14 -","- C48 H72 Cr4 Cs4 N8 O56 -","4","1","HY2036","Visser, Hendrik G.","Caesium bis[<i>N</i>-(carboxymethyl)iminodiacetato]chromate(III) dihydrate","Acta Crystallographica Section E","2007","63","1","m162","m164","10.1107/S160053680605255X","","","0.71073","MoKα","","","0.0221","","","","0.0905","","","","","","1.297","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211863","9.643","0.005","10.852","0.005","11.421","0.005","105.47","0.005","97.976","0.005","99.295","0.005","1115.8","0.9","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","8-(Tolyl-4-sulfonyloxy)quinolinium toluene-4-sulfonate","","- C23 H21 N O6 S2 -","- C23 H21 N O6 S2 -","- C46 H42 N2 O12 S4 -","2","1","IS2108","Xiao-Lin Zhang; Yong-Ping Yan; Wen-Hong Wu; Lai-Tao Luo","8-(Tolyl-4-sulfonyloxy)quinolinium toluene-4-sulfonate","Acta Crystallographica Section E","2007","63","1","o167","o168","10.1107/S1600536806052433","","","0.71073","MoKα","","0.0564","0.0418","","","0.1093","0.1202","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211864","8.112","0.004","13.631","0.007","14.267","0.007","72.84","0.008","73.6","0.008","87.145","0.009","1445","1.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","N-Hexanoyl-N'-(6-methyl-2-pyridyl)thiourea","","- C13 H19 N3 O S -","- C13 H19 N3 O S -","- C52 H76 N12 O4 S4 -","4","2","IS2119","Yusof, M. Sukeri M.; Yaakob, Wan Nur Aishah; Kadir, Maisara A.; Yamin, Bohari M.","<i>N</i>-Hexanoyl-<i>N</i>'-(6-methyl-2-pyridyl)thiourea","Acta Crystallographica Section E","2007","63","1","o241","o243","10.1107/S1600536806052214","","","0.71073","MoKα","","0.067","0.046","","","0.124","0.136","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211865","20.0313","0.0006","12.0577","0.0004","20.0379","0.0007","90","","107.382","0.002","90","","4618.8","0.3","100","0.1","100","0.1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","2-(benzimidazol-2-yl)-6-methoxyphenol","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C224 H192 N32 O32 -","16","4","IS2122","Naser Eltaher Eltayeb; Siang Guan Teoh; Jeannie Bee-Jan Teh; Hoong-Kun Fun; Kamarulazizi Ibrahim","Second monoclinic polymorph of 2-(benzimidazol-2-yl)-6-methoxyphenol","Acta Crystallographica Section E","2007","63","1","o300","o302","10.1107/S1600536806052792","","","0.71073","MoKα","","0.1311","0.091","","","0.2056","0.223","","","","","","1.163","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211866","8.3523","0.0012","9.1835","0.0013","11.4241","0.0016","92.954","0.002","99.926","0.003","105.329","0.002","828.1","0.2","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","3-(4,6-Dimethylpyrimidin-2-ylsulfanyl)-2,2-dimethylchroman-4-one","","- C17 H18 N2 O2 S -","- C17 H18 N2 O2 S -","- C34 H36 N4 O4 S2 -","2","1","IS2126","Pei-Liang Zhao","3-(4,6-Dimethylpyrimidin-2-ylsulfanyl)-2,2-dimethylchroman-4-one","Acta Crystallographica Section E","2007","63","1","o370","o371","10.1107/S1600536806054316","","","0.71073","MoKα","","0.0872","0.0552","","","0.1544","0.1813","","","","","","0.965","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211867","8.727","0.006","24.836","0.018","6.902","0.005","90","","98.932","0.013","90","","1477.8","1.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E)-1,5-Dimethyl-2-phenyl-4-(2-thienylmethyleneamino)-1H-pyrazol-3(2H)-one","","- C16 H15 N3 O S -","- C16 H15 N3 O S -","- C64 H60 N12 O4 S4 -","4","1","IS2127","Ming-Hua Yang; Chun-Niu Zhang; Guo-Bing Yan; Yun-Fa Zheng; Xi-Beng Liu","(<i>E</i>)-1,5-Dimethyl-2-phenyl-4-(2-thienylmethyleneamino)-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","1","o382","o383","10.1107/S1600536806054468","","","0.71073","MoKα","","0.092","0.046","","","0.11","0.123","","","","","","0.865","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211868","5.7455","0.0007","12.8894","0.0016","11.6696","0.0014","90","","94.317","0.002","90","","861.75","0.18","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(4R)-5,5-Dimethyl-4-phenyl-3-[(E)-3-phenylacryloyl]-1,3-oxazolidin-2-one","","- C20 H19 N O3 -","- C20 H19 N O3 -","- C40 H38 N2 O6 -","2","1","KJ2030","Yang, Rui; Zhang, Mei-Su; Nie, Lei; Chen, Jing; Lin, Jun","(4<i>R</i>)-5,5-Dimethyl-4-phenyl-3-[(<i>E</i>)-3-phenylacryloyl]-1,3-oxazolidin-2-one","Acta Crystallographica Section E","2007","63","1","o182","o183","10.1107/S160053680605224X","","","0.71073","MoKα","","0.0508","0.034","","","0.0752","0.0838","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211869","7.9134","0.0017","9.986","0.002","11.494","0.003","90.194","0.003","94.07","0.003","111.031","0.003","845.2","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","catena-Poly[[[diaquazinc(II)]-bis[μ-2-(2,4-difluorophenyl)-1,3- bis(1,2,4-triazol-1-yl)propan-2-ol)-κ^2^N^4^:N^4^]] perchlorate]","","- C26 H28 Cl2 F4 N12 O12 Zn -","- C26 H28 Cl2 F4 N12 O12 Zn -","- C26 H28 Cl2 F4 N12 O12 Zn -","1","0.5","KJ2034","Yun Ling; Lei Zhang","<i>catena</i>-Poly[[[diaquazinc(II)]-bis[μ-2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol-κ^2^<i>N</i>^4^:<i>N</i>^4^]] bis(perchlorate)]","Acta Crystallographica Section E","2007","63","1","m4","m6","10.1107/S1600536806049506","","","0.71073","MoKα","","0.0303","0.0269","","","0.0732","0.0748","","","","","","1.089","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211870","5.1051","0.001","6.3653","0.0013","12.281","0.003","103.53","0.03","91.06","0.03","108.28","0.03","366.59","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(2-methylpyrazine-5-carboxylato)cobalt(II)","","- C12 H14 Co N4 O6 -","- C12 H14 Co N4 O6 -","- C12 H14 Co N4 O6 -","1","0.5","KJ2039","Liu, Fu-Ying; Shang, Rui-Ling; Du, Lin; Zhao, Qi-Hua; Fang, Rui-Bing","Diaquabis(2-methylpyrazine-5-carboxylato)cobalt(II)","Acta Crystallographica Section E","2007","63","1","m120","m122","10.1107/S1600536806052263","","","0.71073","MoKα","","0.0309","0.0297","","","0.0829","0.084","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211871","13.477","0.004","12.062","0.004","14.049","0.004","90","","109.223","0.006","90","","2156.5","1.1","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Methyl 2,2',7'-trihydroxy-1,1'-binaphthalene-3-carboxylate acetone solvate","","- C25 H22 O6 -","- C25 H22 O6 -","- C100 H88 O24 -","4","1","KP2056","Xiu-Zhen Wang; Zhao-Xuen Lian; Zun-Le Xu","Methyl 2,2',7'-trihydroxy-1,1'-binaphthalene-3-carboxylate acetone solvate","Acta Crystallographica Section E","2007","63","1","m392","m393","10.1107/S1600536806051889","","","0.71073","MoKα","","0.0713","0.0402","","","0.1006","0.1192","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211872","9.4345","0.0013","8.607","0.003","28.973","0.005","90","","90","","90","","2352.7","1","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Tryptaminium dihydrogenphospate","","- C10 H15 N2 O4 P -","- C10 H15 N2 O4 P -","- C80 H120 N16 O32 P8 -","8","1","KP2063","T. Kolev; M. Spiteller; T. van Almsick; H. Mayer-Figge; W.S. Sheldrick","2-(Indol-3-yl)ethylammonium dihydrogenphosphate","Acta Crystallographica Section E","2007","63","1","o179","o181","10.1107/S1600536806051749","","","0.71073","MoKα","","0.0541","0.0388","","","0.097","0.1035","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211873","14.1539","0.0003","11.044","0.0002","17.8517","0.0001","90","","104.24","0.0004","90","","2704.76","0.08","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetrakis(μ-2-anilinobenzoato-κ^2^O:O')bis[(N,N'-dimethylformamide- κO)copper(II)]","","- C58 H54 Cu2 N6 O10 -","- C58 H54 Cu2 N6 O10 -","- C116 H108 Cu4 N12 O20 -","2","0.5","KP2064","Wu, Ming-Yan; Huang, You-Gui; Wei, Wei; Gao, Qiang; Hong, Mao-Chun","Tetrakis(μ-2-anilinobenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)copper(II)]","Acta Crystallographica Section E","2007","63","1","m94","m96","10.1107/S1600536806051890","","","0.71073","MoKα","","","0.0445","","","0.0928","0.1077","","","","","","1.113","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211874","11.272","0.003","3.8023","0.0011","17.016","0.005","90","","97.051","0.008","90","","723.8","0.4","293","2","293","2","","","","","","","","5","P 1 c 1","P -2yc","7","4-Chloro-2-nitroaniline","4-Chloro-2-nitroaniline","","- C6 H5 Cl N2 O2 -","- C6 H5 Cl N2 O2 -","- C24 H20 Cl4 N8 O8 -","4","2","KP2069","Yang, Yuan; Englert, Ulli; Li, Qi","4-Chloro-2-nitroaniline","Acta Crystallographica Section E","2007","63","1","o114","o116","10.1107/S1600536806051233","","","0.71073","MoKα","","0.0761","0.046","","","0.0968","0.1089","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211875","7.2259","0.0012","13.521","0.002","22.655","0.004","90","","90.322","0.004","90","","2213.4","0.6","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[bis(2-pyridone-κO)sodium]-di-μ-2-pyridone-κ^4^O:O] tetrafluoroborate]","","- C20 H20 B F4 N4 Na O4 -","- C20 H20 B F4 N4 Na O4 -","- C80 H80 B4 F16 N16 Na4 O16 -","4","1","KP2072","Gareth R. Owen; Mairi F. Haddow","<i>catena</i>-Poly[[[bis(2-pyridone-κ<i>O</i>)sodium]-di-μ-2-pyridone-κ^4^<i>O</i>:<i>O</i>] tetrafluoroborate]","Acta Crystallographica Section E","2007","63","1","m83","m85","10.1107/S1600536806051567","","","0.71073","MoKα","","0.117","0.0652","","","0.1289","0.1468","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211876","13.4586","0.0019","6.723","0.003","16.158","0.004","90","","94.912","0.019","90","","1456.6","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Indole‒picric acid (1/1)","","- C14 H10 N4 O7 -","- C14 H10 N4 O7 -","- C56 H40 N16 O28 -","4","1","LH2191","Kolandaivelu Saminathan; Kandasamy Sivakumar","Indole‒picric acid (1/1)","Acta Crystallographica Section E","2007","63","1","o236","o238","10.1107/S1600536806052512","","","0.71073","MoKα","","0.1928","0.0692","","","0.2123","0.2711","","","","","","0.909","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211877","7.284","0.001","9.131","0.002","25.199","0.005","90","","90","","90","","1676","0.5","299","2","299","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Aquabis(2-methylquinolin-8-olato-κ^2^N,O)zinc(II)","","- C20 H18 N2 O3 Zn -","- C20 H18 N2 O3 Zn -","- C80 H72 N8 O12 Zn4 -","4","0.5","LH2214","Silva, Luiz Everson da; Joussef, Antonio Carlos; Rebelo, Ricardo Andrade; Foro, Sabine; Schmidt, Boris","Aquabis(2-methylquinolin-8-olato-κ^2^<i>N</i>,<i>O</i>)zinc(II)","Acta Crystallographica Section E","2007","63","1","m129","m131","10.1107/S1600536806045818","","","1.5418","CuKα","","0.186","0.0621","","","0.1168","0.1536","","","","","","0.926","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211878","13.9915","0.0015","11.2079","0.0012","12.8282","0.0014","90","","102.439","0.002","90","","1964.4","0.4","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-poly[[[diaqua(6-carboxypyridine-2-carboxylato-κ^3^O,N,O')erbium(III)]- μ-pyridine-2,6-dicarboxylato-κ^4^O,N,O':O] tetrahydrate]","","- C14 H19 Er N2 O14 -","- C14 H19 Er N2 O14 -","- C56 H76 Er4 N8 O56 -","4","1","LH2219","Cui-Xia Cheng; Hao-Wen Liu; Zong-Qiu Hu; Fei-Hua Luo; Min-Na Cao","<i>catena</i>-Poly[[[diaqua(6-carboxypyridine-2-carboxylato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')erbium(III)]-μ-pyridine-2,6-dicarboxylato-κ^4^<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>] tetrahydrate]","Acta Crystallographica Section E","2007","63","1","m1","m3","10.1107/S1600536806048665","","","0.71073","MoKα","","0.035","0.0312","","","0.0844","0.0863","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211879","9.552","0.002","14.008","0.003","24.214","0.005","90","","90","","90","","3239.9","1.2","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-[tert-butoxycarbonyl-glycyl-(E)-α,β-dehydrophenylalanylglycylglycyl- (E)-α,β-dehydrophenylalanyl]glycine","","- C31 H36 N6 O9 -","- C31 H36 N6 O9 -","- C124 H144 N24 O36 -","4","1","LH2225","Makowski, Maciej; Lisowski, Marek; Iwona Mikołajczyk; Lis, Tadeusz","<i>N</i>-[<i>tert</i>-Butoxycarbonylglycyl-(<i>E</i>)-α,β-dehydrophenylalanylglycylglycyl-(<i>E</i>)-α,β-dehydrophenylalanyl]glycine","Acta Crystallographica Section E","2007","63","1","o19","o21","10.1107/S1600536806049841","","","1.5418","CuKα","","0.0657","0.0573","","","0.1429","0.1526","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211880","8.9266","0.0002","9.3595","0.0001","14.722","0.003","97.781","0.001","95.518","0.001","104.819","0.001","1167.1","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","Poly[triaquatris(μ-4-pyridine-3,5-dicarboxylato)didysprosium(III)]","","- C21 H15 Dy2 N3 O15 -","- C21 H9 Dy2 N3 O15 -","- C42 H18 Dy4 N6 O30 -","2","1","LH2235","Li, Feng","Poly[triaquatris(μ-4-pyridine-3,5-dicarboxylato)didysprosium(III)]","Acta Crystallographica Section E","2007","63","1","m73","m74","10.1107/S1600536806051622","","","0.71073","MoKα","","0.0386","0.0358","","","0.1033","0.1099","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211881","11.12","0.002","5.3808","0.0011","18.393","0.004","90","","93.47","0.03","90","","1098.5","0.4","293","2","293","2","","","","","","","","6","P 1 n 1","P -2yac","7","","{3-[(E)-(5-Bromo-2-oxidophenyl)methyleneamino]propanoato-k^3^O,N,O'}(1,10- phenanthroline-k^2^N,N')copper(II) dihydrate","","- C22 H22 Br Cu N3 O5 -","- C22 H22 Br Cu N3 O5 -","- C44 H44 Br2 Cu2 N6 O10 -","2","1","LH2236","Liu, Zheng; Zhang, Shu-Hua; Feng, Xiao-Zhen; Li, Guang-Zhao; Lin, Yuan-Bin","{3-[(<i>E</i>)-(5-Bromo-2-oxidophenyl)methylamino]propanoato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) dihydrate","Acta Crystallographica Section E","2007","63","1","m156","m158","10.1107/S1600536806052500","","","0.71073","MoKα","","0.0837","0.057","","","0.1089","0.1221","","","","","","0.972","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211882","14.105","0.004","12.53","0.003","16.644","0.004","90","","107.429","0.002","90","","2806.5","1.2","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","cis-dichlorobis(4-metylpyridine-κN)platinum(II)","","- C12 H14 Cl2 N2 Pt -","- C12 H14 Cl2 N2 Pt -","- C96 H112 Cl16 N16 Pt8 -","8","1","LH2248","Sakai, Ken; Yokoyama, Yuki; Masaoka, Shigeyuki","<i>cis</i>-Dichlorobis(4-methylpyridine-κ<i>N</i>)platinum(II)","Acta Crystallographica Section E","2007","63","1","m97","m99","10.1107/S1600536806051610","","","0.7107","MoKα","","0.0347","0.0313","","","0.0825","0.0874","","","","","","1.16","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211883","7.9456","0.0018","18.831","0.004","17.57","0.004","90","","93.624","0.005","90","","2623.6","1","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","μ-1,4-Diazabicyclo[2.2.2]octane-κ^2^N:N'- bis[bis(O,O'-diisopropyl dithiophosphato-κ^2^S,S')zinc(II)]","","- C30 H68 N2 O8 P4 S8 Zn2 -","- C30 H68 N2 O8 P4 S8 Zn2 -","- C60 H136 N4 O16 P8 S16 Zn4 -","2","0.5","LH2254","Ellis, Carol A.; Ng, Seik Weng; Tiekink, Edward R. T.","μ-1,4-Diazabicyclo[2.2.2]octane-κ^2^<i>N</i>:<i>N</i>'-bis[bis(<i>O</i>,<i>O</i>'-diisopropyl dithiophosphato-κ^2^<i>S</i>,<i>S</i>')zinc(II)]","Acta Crystallographica Section E","2007","63","1","m108","m110","10.1107/S1600536806052007","","","0.7107","MoKα","","0.081","0.08","","","0.175","0.175","","","","","","1.23","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211884","11.88215","0.00015","5.97647","0.00008","13.07499","0.00015","90","","113.51","0.001","90","","851.42","0.02","298","","295","","","","","","","","","4","P 1 21 1","P 2yb","4","","(R)-1-phenylethylammonium (R)-2-phenylbutyrate","","- C18 H23 N O2 -","- C18 H23 N O2 -","- C36 H46 N2 O4 -","2","1","LH2256","Fernandes, Philippe; Florence, Alastair J.; Shankland, Kenneth; Karamertzanis, G. Panagiotis; Hulme, Ashley T.; Anandamanoharan, R. Parathy","Powder study of (<i>R</i>)-1-phenylethylammonium (<i>R</i>)-2-phenylbutyrate form 3","Acta Crystallographica Section E","2007","63","1","o202","o204","10.1107/S1600536806052093","","","1.54056","CuKα~1~","","","","","","","","","","1.958","","","","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2211885","4.9438","0.0016","20.655","0.006","9.858","0.003","90","","90","","90","","1006.6","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-ethyl-5-nitroisoindoline-1,3-dione","","- C10 H8 N2 O4 -","- C10 H8 N2 O4 -","- C40 H32 N8 O16 -","4","1","LH2258","Liang, Zu-Pei; Li, Jian; Zhang, Yun-Chen","2-Ethyl-5-nitroisoindoline-1,3-dione","Acta Crystallographica Section E","2007","63","1","o63","o64","10.1107/S1600536806051312","","","0.71073","MoKα","","0.0949","0.0458","","","0.1109","0.1363","","","","","","0.994","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211886","12.9515","0.0017","7.696","0.001","10.3232","0.0014","90","","95.548","0.002","90","","1024.1","0.2","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(dicyanamido-κN^1^)bis[4-(1,2,4-triazol-1-yl)phenol-κN^4^]copper(II)","","- C20 H14 Cu N12 O2 -","- C20 H14 Cu N12 O2 -","- C40 H28 Cu2 N24 O4 -","2","0.5","LH2259","Fang Jia; Jian Li; Xiu-Guang Wang; Xiao-Jun Zhao","Bis(dicyanamido-κ<i>N</i>^1^)bis[4-(1,2,4-triazol-1-yl)phenol-κ<i>N</i>^4^]copper(II)","Acta Crystallographica Section E","2007","63","1","m31","m33","10.1107/S1600536806051336","","","0.71073","MoKα","","0.0323","0.0266","","","0.0717","0.0738","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211887","14.66","0.001","16.845","0.001","17.887","0.001","90","","93.298","0.002","90","","4409.8","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Pentakis(ethane-1,2-diammonium) aquapentasulfato-κ^3^O,κ^4^O,O')zirconate(IV) diaquatetrasulfato-κ^2^O,κ^4^O,O')zirconate(IV)","","- C10 H56 N10 O39 S9 Zr2 -","- C10 H56 N10 O39 S9 Zr2 -","- C40 H224 N40 O156 S36 Zr8 -","4","1","LH2260","Xu, Zhi-Wei; Fu, Yun-Long; Teng, Song-Qing; Ng, Seik Weng","Pentakis(ethane-1,2-diammonium) aquapentasulfato-κ^3^<i>O</i>;κ^4^<i>O</i>,<i>O</i>'-zirconate(IV) diaquatetrasulfato-κ^2^<i>O</i>;κ^4^<i>O</i>,<i>O</i>'-zirconate(IV)","Acta Crystallographica Section E","2007","63","1","m140","m142","10.1107/S1600536806051750","","","0.71073","MoKα","","0.127","0.066","","","0.136","0.177","","","","","","0.99","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211888","15.324","0.007","7.936","0.004","10.079","0.005","90","","90","","90","","1225.7","1","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","catena-Poly[[bis(N,N'-dimethylformamide)manganese(II)]-di-μ~2~-oxalato]","","- C8 H14 Mn N2 O6 -","- C8 H14 Mn N2 O6 -","- C32 H56 Mn4 N8 O24 -","4","0.5","LH2261","Ya-Nan Chan; Hong-Kun Zhao; Xiu-Guang Wang; Xiao-Jun Zhao","<i>catena</i>-Poly[[bis(<i>N</i>,<i>N</i>-dimethylformamide)manganese(II)]-di-μ~2~-oxalato]","Acta Crystallographica Section E","2007","63","1","m70","m72","10.1107/S1600536806051609","","","0.71073","MoKα","","0.0375","0.0262","","","0.0714","0.0765","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211889","15.5571","0.0012","10.2136","0.0007","15.8883","0.0011","90","","90","","90","","2524.6","0.3","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","5-Phenyl-1-(2-thienyl)penta-2,4-dien-1-one","","- C15 H12 O S -","- C15 H12 O S -","- C120 H96 O8 S8 -","8","1","LH2263","Yathirajan, H. S.; Bindya, S.; Mithun, A.; Narayana, B.; Bolte, Michael","5-Phenyl-1-(2-thienyl)penta-2,4-dien-1-one","Acta Crystallographica Section E","2007","63","1","o61","o62","10.1107/S1600536806050860","","","0.71073","MoKα","","0.0429","0.0376","","","0.1","0.1039","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211890","11.4494","0.0006","11.4494","0.0006","6.1727","0.0002","90","","90","","120","","700.76","0.06","190","","190","","","","","","","","","4","P 31","P 31","144","(6S)-Methyl-L-swainsonine","(1R,2S,6S,8S,8aS)-6-methyloctahydroindolizine-1,2,8-triol","","- C9 H17 N O3 -","- C9 H17 N O3 -","- C27 H51 N3 O9 -","3","1","LH2265","Håkansson, Anders E.; Horne, Graeme; Fleet, George W.J.; Watkin, David J.","(6<i>S</i>)-Methyl-<small>L</small>-swainsonine [(1<i>R</i>,2<i>S</i>,6<i>S</i>,8<i>S</i>,8a<i>S</i>)-6-methyloctahydroindolizine-1,2,8-triol]","Acta Crystallographica Section E","2007","63","1","o210","o212","10.1107/S1600536806052111","","","0.71073","MoKα","","0.0298","0.0282","","0.069","0.0681","0.069","","","","","","0.972","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211891","21.1322","0.0009","28.9229","0.001","11.4019","0.0004","90","","99.212","0.003","90","","6879","0.5","220","2","220","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans,trans-Bis[μ-1,5-bis(diisopropylphosphino)pentane- κ^2^P:P']bis[dichloronickel(II)]","","- C34 H76 Cl4 Ni2 P4 -","- C34 H76 Cl4 Ni2 P4 -","- C204 H456 Cl24 Ni12 P24 -","6","1.5","LH2268","Castonguay, Annie; Beauchamp, André L.; Zargarian, Davit","<i>trans</i>,<i>trans</i>-Bis[μ-1,5-bis(diisopropylphosphino)pentane-κ^2^<i>P</i>:<i>P</i>']bis[dichloronickel(II)]","Acta Crystallographica Section E","2007","63","1","m196","m197","10.1107/S1600536806052913","","","1.54178","CuKα","","0.0642","0.0435","","","0.1024","0.1097","","","","","","0.906","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211892","67.786","0.004","34.613","0.002","4.6486","0.0002","90","","90","","90","","10906.9","1","120","2","120","2","","","","","","","","5","F d d 2","F 2 -2d","43","","N-(5-Chloro-2-nitrobenzoyl)-N'-isonicotinoylhydrazine","","- C13 H9 Cl N4 O4 -","- C13 H9 Cl N4 O4 -","- C416 H288 Cl32 N128 O128 -","32","2","LH2269","Souza, M. V. N. de; Wardell, Solange M. S. V.; Wardell, James L.; Low, John N.; Glidewell, Christopher","<i>N</i>-(5-Chloro-2-nitrobenzoyl)-<i>N</i>'-isonicotinoylhydrazine: a three-dimensional framework containing four types of hydrogen bond","Acta Crystallographica Section E","2007","63","1","o230","o232","10.1107/S1600536806052524","","","0.71073","MoKα","","0.0773","0.0507","","","0.092","0.1017","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211893","8.9","0.0005","13.9649","0.0008","23.6361","0.0013","90","","95.111","0.001","90","","2926","0.3","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis[2,6-bis(1,2,4-triazol-2-yl)pyridine-κN^4^]trinatratolathanum(III) monohydrate","","- C18 H20 La N17 O12 -","- C18 H20 La N17 O12 -","- C72 H80 La4 N68 O48 -","4","1","LH2270","Kwak, Han; Park, Byeong Kwon; Kim, Cheal; Kim, Sung-Jin; Kim, Youngmee","Diaquabis[2,6-bis(1,2,4-triazol-2-yl)pyridine-κ<i>N</i>^4^]trinitratolathanum(III) monohydrate","Acta Crystallographica Section E","2007","63","1","m269","m271","10.1107/S1600536806054031","","","0.71073","MoKα","","0.0488","0.0319","","","0.0651","0.0691","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211894","15.3427","0.0008","6.8703","0.0002","21.7329","0.0011","90","","111.355","0.004","90","","2133.56","0.18","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(4-Chlorobenzyl)-3-[2-(pyrrolidinium-1-yl)ethyl]benzimidazolium dichloride monohydrate","","- C20 H26 Cl3 N3 O -","- C20 H26 Cl3 N3 O -","- C80 H104 Cl12 N12 O4 -","4","1","LH2272","Mehmet Akkurt; Şerife Pınar; Ülkü Yılmaz; Hasan Küçükbay; Orhan Büyükgüngör","1-(4-Chlorobenzyl)-3-[2-(pyrrolidinium-1-yl)ethyl]benzimidazolium dichloride monohydrate","Acta Crystallographica Section E","2007","63","1","o379","o381","10.1107/S1600536806054420","","","0.71073","MoKα","","0.0585","0.0383","","","0.0973","0.1053","","","","","","0.976","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211895","5.6662","0.0003","10.1801","0.0006","24.2927","0.0015","90","","90","","90","","1401.26","0.14","94","2","94","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena[[(4,7-phenanthrolin-4-ium-κN^7^)(thiocyanato-κ<i>S</i>)copper(I)]- μ-thiocyanato-κ^2^N:S]","","- C14 H9 Cu N4 S2 -","- C14 H9 Cu N4 S2 -","- C56 H36 Cu4 N16 S8 -","4","1","LH2274","LaDuca, Robert L.; Schottenfeld, Jodi; Rarig, Randy S.; Zubieta, Jon A.","A non-centrosymmetric one-dimensional coordination polymer: <i>catena</i>[[(4,7-phenanthrolin-4-ium-κ<i>N</i>^7^)(thiocyanato-κ<i>S</i>)copper(I)]-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>]","Acta Crystallographica Section E","2007","63","1","m278","m280","10.1107/S1600536806054249","","","0.71073","MoKα","","0.043","0.0332","","","0.0612","0.0641","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211896","16.429","0.002","16.035","0.002","10.6255","0.0014","90","","90","","90","","2799.2","0.6","193","2","","","","","","","","","","6","A m a 2","A 2 -2a","40","","Chloro[hydridotris(3-tert-butyl-5-methylpyrazolyl)borato]cobalt(II)","","- C24 H40 B Cl Co N6 -","- C24 H40 B Cl Co N6 -","- C96 H160 B4 Cl4 Co4 N24 -","4","0.5","NG2128","Gregory M. Ferrence; Adam D. Beitelman","Chloro[hydridotris(3-<i>tert</i>-butyl-5-methylpyrazolyl)borato]cobalt(II)","Acta Crystallographica Section E","2007","63","1","m153","m155","10.1107/S1600536806048914","","","0.71073","MoKα","","","0.0303","","","","0.07","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211897","15.817","0.005","10.363","0.003","16.321","0.005","90","","118.561","0.003","90","","2349.7","1.2","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(7,12-Diphenyl-5,6:13,14-dibenzo-8,11-diazonia-1,4-diazacyclopentadeca- 7,12-diene-2,3-dione)nickel(II)","","- C30 H22 N4 Ni O2 -","- C30 H22 N4 Ni O2 -","- C120 H88 N16 Ni4 O8 -","4","1","NG2132","Gui-Ru Deng; Yan-Hong Zhang; Guang-Ming Yang","(7,12-Diphenyl-5,6:13,14-dibenzo-8,11-diazonia-1,4-diazacyclopentadeca-7,12-diene-2,3-dione)nickel(II)","Acta Crystallographica Section E","2007","63","1","m29","m30","10.1107/S1600536806051038","","","0.7107","MoKα","","0.0501","0.0388","","","0.0844","0.0912","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211898","10.2298","0.0002","10.9739","0.0002","17.5785","0.0004","90","","94.737","0.001","90","","1966.64","0.07","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Copper(II) benzoate 4-ethylpyridine adduct","Tetrakis(μ-benzoato-κ^2^O:O')bis(4-ethylpyridine-κN)dicopper(II)","","- C42 H38 Cu2 N2 O8 -","- C42 H38 Cu2 N2 O8 -","- C84 H76 Cu4 N4 O16 -","2","0.5","NG2147","Das, Birinchi K.; Bora, Sanchay J.; Sarmah, Purabi","Tetrakis(μ-benzoato-κ^2^<i>O</i>:<i>O</i>')bis(4-ethylpyridine-κ<i>N</i>)dicopper(II)","Acta Crystallographica Section E","2007","63","1","m251","m252","10.1107/S160053680605135X","","","0.71073","MoKα","","0.0595","0.0446","","","0.1305","0.1454","","","","","","1.048","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211899","8.3029","0.0017","9.4201","0.0019","9.5979","0.0019","84.32","0.03","80.47","0.03","82.01","0.03","730.9","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Bis[2-(4-methylanilinomethyl)-6-methoxyphenolato- κ^2^O,O']bis(nitrato-κO)cobalt(II)","","- C30 H30 Co N4 O10 -","- C30 H30 Co N4 O10 -","- C30 H30 Co N4 O10 -","1","0.5","NG2153","Ying-Hua Zhou; Guo-Liang Zhao","Bis[2-(4-methylanilinomethyl)-6-methoxyphenolato-κ^2^<i>O</i>,<i>O</i>']bis(nitrato-κ<i>O</i>)cobalt(II)","Acta Crystallographica Section E","2007","63","1","m43","m44","10.1107/S1600536806051415","","","0.71073","MoKα","","0.0461","0.0365","","","0.091","0.0967","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211900","8.818","0.005","10.672","0.005","10.749","0.005","95.501","0.005","91.029","0.005","98.58","0.005","995.1","0.9","101","2","101","2","","","","","","","","7","P -1","-P 1","2","","mer-Trichloro(2,2',2''-terpyridine)chromium(III) dimethyl sulfoxide solvate","","- C17 H17 Cl3 Cr N3 O S -","- C17 H17 Cl3 Cr N3 O S -","- C34 H34 Cl6 Cr2 N6 O2 S2 -","2","1","NG2161","Cloete, Nicoline; Visser, Hendrik G.; Roodt, Andreas","<i>mer</i>-Trichloro(2,2',2''-terpyridine)chromium(III) dimethyl sulfoxide solvate","Acta Crystallographica Section E","2007","63","1","m45","m47","10.1107/S1600536806050045","","","0.71069","MoKα","","","0.0285","","","","0.0721","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211901","15.1335","0.0009","19.7216","0.0009","16.7754","0.0009","90","","101.576","0.002","90","","4904.9","0.5","100","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tetraphenylphosphonium aquatetracyanonitridorhenate(V) pentahydrate","","- C52 H52 N5 O6 P2 Re -","- C52 H52 N5 O6 P2 Re -","- C208 H208 N20 O24 P8 Re4 -","4","1","NG2165","Mtshali, Thato N.; Purcell, Walter; Visser, Hendrik G.","Tetraphenylphosphonium aquatetracyanonitridorhenate(V) pentahydrate","Acta Crystallographica Section E","2007","63","1","m80","m82","10.1107/S1600536806051403","","","0.71073","MoKα","","","0.0227","","","","0.0514","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211902","11.7","0.0003","16.993","0.0004","14.578","0.0004","90","","93.519","0.001","90","","2892.91","0.13","293","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(2-methylquinolin-8-olato-κ^2^N,O)(6-phenyl-2-naphtholato-κO)aluminium(III)","","- C36 H27 Al N2 O3 -","- C36 H27 Al N2 O3 -","- C144 H108 Al4 N8 O12 -","4","1","NG2167","Rajeswaran, Manju; Place, David W.; Bakos, Vincent W.; Deaton, Joseph C.; Brown, Christopher T.; Lenhart, William C.","Bis(2-methylquinolin-8-olato-κ^2^<i>N</i>,<i>O</i>)(6-phenyl-2-naphtholato-κ<i>O</i>)aluminium(III)","Acta Crystallographica Section E","2007","63","1","m54","m56","10.1107/S160053680605104X","","","0.71073","MoKα","","0.1253","0.053","","","0.1214","0.1497","","","","","","0.993","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211903","8.148","0.003","12.217","0.004","10.935","0.004","90","","94.973","0.007","90","","1084.4","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(diethylenetriamine)cobalt(III) hexacyanocobaltate(III) monohydrate","","- C14 H30 Co2 N12 O2 -","- C14 H30 Co2 N12 O2 -","- C28 H60 Co4 N24 O4 -","2","0.5","NG2168","Ou, Guang-Chuan; Chen, Hai-Yan","Bis(diethylenetriamine)cobalt(III) hexacyanocobaltate(III) dihydrate","Acta Crystallographica Section E","2007","63","1","m36","m38","10.1107/S1600536806051051","","","0.71073","MoKα","","0.0617","0.0321","","","0.0828","0.0947","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211904","8.194","0.004","12.1398","0.0012","13.2421","0.0019","112.061","0.007","101.245","0.017","90.47","0.015","1192.5","0.6","292","2","292","2","","","","","","","","7","P -1","-P 1","2","","Carbonyl(diethyldithiocarbamato)(η^5^-pentamethylcyclopentadienyl)iridium(III) trifluoromethanesulfonate","","- C17 H25 F3 Ir N O4 S3 -","- C17 H25 F3 Ir N O4 S3 -","- C34 H50 F6 Ir2 N2 O8 S6 -","2","1","NG2169","Michael Scharwitz; Tobias van Almsick; William S. Sheldrick","Carbonyl(diethyldithiocarbamato)(η^5^-pentamethylcyclopentadienyl)iridium(III) trifluoromethanesulfonate","Acta Crystallographica Section E","2007","63","1","m105","m107","10.1107/S1600536806052019","","","0.71073","MoKα","","0.0277","0.0249","","","0.0617","0.0632","","","","","","1.086","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211905","6.8462","0.0003","11.4379","0.0007","19.2654","0.0007","90","","90","","90","","1508.6","0.13","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","p-Phenylenediammonium tetrabromoaurate(III) bromide monohydrate","","- C6 H12 Au Br5 N2 O -","- C6 H12 Au Br5 N2 O -","- C24 H48 Au4 Br20 N8 O4 -","4","0.5","NG2170","Rajeswaran, Manju; Bringley, Joseph F.; Cleary, Brian","<i>p</i>-Phenylenediammonium tetrabromoaurate(III) bromide monohydrate","Acta Crystallographica Section E","2007","63","1","m181","m183","10.1107/S1600536806052810","","","0.71073","MoKα","","0.1253","0.0823","","","0.1827","0.2107","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211906","9.7151","0.0007","14.978","0.001","16.152","0.001","76.553","0.001","88.464","0.001","87.508","0.001","2283.4","0.3","100","1","100","1","","","","","","","","7","P -1","-P 1","2","","Dibutylchloro[4-(4-nitrophenyl)piperazine-1-carbodithioato-κ^2^S,S']tin(IV)","","- C19 H30 Cl N3 O2 S2 Sn -","- C19 H30 Cl N3 O2 S2 Sn -","- C76 H120 Cl4 N12 O8 S8 Sn4 -","4","2","NG2171","Zia-ur-Rahman; Saqib Ali; Niaz Muhammed; Meetsma, Auke","Dibutylchloro[4-(4-nitrophenyl)piperazine-1-carbodithioato-κ^2^<i>S</i>,<i>S</i>']tin(IV)","Acta Crystallographica Section E","2007","63","1","m89","m90","10.1107/S160053680605207X","","","0.71073","MoKα","","0.03","0.0255","","","0.0575","0.0593","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211907","9.4881","0.0009","11.0779","0.001","12.1896","0.0012","106.457","0.011","104.555","0.011","96.053","0.011","1167.6","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","[2-(Butylamino)cyclopent-1-ene-1-carbodithioato)chlorodiphenyltin(IV)","","- C22 H26 Cl N S2 Sn -","- C22 H26 Cl N S2 Sn -","- C44 H52 Cl2 N2 S4 Sn2 -","2","1","NG2173","Hanif, Muhammad; Ali, Saqib; Hussain, Mukhtiar; Bhatti, Hussain Moazam; Karmazin Brelot, Lydia; Stoeckli-Evans, Helen","[2-(Butylamino)cyclopent-1-ene-1-carbodithioato]chlorodiphenyltin(IV)","Acta Crystallographica Section E","2007","63","1","m143","m145","10.1107/S1600536806052123","","","0.71073","MoKα","","0.0331","0.0275","","","0.0719","0.0893","","","","","","1.159","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211908","14.6463","0.0006","17.1089","0.0007","10.1294","0.0004","90","","98.042","0.001","90","","2513.28","0.18","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(μ-acetylacetonato-κ^2^O:O')bis[aqua(acetylacetonato-κ^2^O,O')nickel(II)] hemihydrate","","- C20 H34 Ni2 O11 -","- C20 H34 Ni2 O11 -","- C80 H136 Ni8 O44 -","4","1","NG2174","Tahir, Asif A.; Hamid, Mazhar; Zeller, Matthias; Mazhar, Muhammad; Hunter, Allen D.","Bis(μ-acetylacetonato-κ^2^<i>O</i>:<i>O</i>')bis[(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')aquanickel(II)] hemihydrate","Acta Crystallographica Section E","2007","63","1","m272","m274","10.1107/S1600536806054080","","","0.71073","MoKα","","0.0349","0.0308","","","0.0843","0.0867","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211909","26.5","0.003","6.884","0.002","17.124","0.003","90","","125.609","0.003","90","","2539.7","0.9","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[copper(II)-μ-aqua-di-μ-benzotriazole]","","- C12 H10 Cu N6 O -","- C12 H10 Cu N6 O -","- C96 H80 Cu8 N48 O8 -","8","1","NG2175","Yun Gong; Xiao-Hong Huang; Zhi-Ning Xia; Mai-Xia Gao; Huai-Li Zheng","<i>catena</i>-Poly[copper(II)-μ-aqua-di-μ-benzotriazole]","Acta Crystallographica Section E","2007","63","1","m216","m218","10.1107/S1600536806052822","","","0.71073","MoKα","","0.0719","0.0448","","","0.0916","0.1035","","","","","","1.006","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211910","12.1534","0.0006","16.4121","0.0008","16.7053","0.0008","90","","94.394","0.003","90","","3322.3","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[1,1'-Bis(diphenylphosphine)ferrocene-κ^2^P,P']dichloroplatinum(II) chloroform solvate","","- C35 H29 Cl5 Fe P2 Pt -","- C35 H29 Cl5 Fe P2 Pt -","- C140 H116 Cl20 Fe4 P8 Pt4 -","4","1","NG2176","Muller, Alfred","[1,1'-Bis(diphenylphosphino)ferrocene-κ^2^<i>P</i>,<i>P</i>']dichloroplatinum(II) chloroform solvate","Acta Crystallographica Section E","2007","63","1","m210","m212","10.1107/S1600536806052834","","","0.71073","MoKα","","","0.022","","","","0.0518","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211911","11.426","0.0013","11.292","0.0013","9.3237","0.001","90","","91.239","0.001","90","","1202.7","0.2","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[μ-azido-κ^4^N^1^:N^3^-μ-2-(2-pyridylmethylamino)ethanesulfonato- κ^4^N,N',O:O'-copper(II)]","","- C8 H11 Cu N5 O3 S -","- C8 H11 Cu N5 O3 S -","- C32 H44 Cu4 N20 O12 S4 -","4","1","NG2178","Jun-Xia Li; Yi-Min Jiang; Jian-Ge Wang","Poly[μ-azido-κ^2^<i>N</i>^1^:<i>N</i>^3^-μ-2-(2-pyridylmethylamino)ethanesulfonato-κ^4^<i>N</i>,<i>N</i>',<i>O</i>:<i>O</i>'-copper(II)]","Acta Crystallographica Section E","2007","63","1","m213","m215","10.1107/S1600536806053475","","","0.71073","MoKα","","0.0428","0.0297","","","0.073","0.0798","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211912","7.622","0.005","8.714","0.005","11.082","0.005","94.12","0.005","103.502","0.005","111.32","0.005","656.7","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H28 Cd N4 O8 -","- C26 H28 Cd N4 O8 -","- C26 H28 Cd N4 O8 -","1","0.5","NG2179","Long-Fei Zu; Yong Wang; Zhong-Min Su; Kui-Zhan Shao; Ya-Hui Zhao","<i>catena</i>-Poly[[diaquabis(2-methoxymethyl-1<i>H</i>-benzimidazole-κ<i>N</i>^3^)cadmium(II)]-μ-terephthalato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","1","m292","m293","10.1107/S1600536806054274","","","0.71069","MoKα","","0.0296","0.0283","","","0.0628","0.0641","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211913","12.1789","0.0009","13.9579","0.001","20.8363","0.0015","87.782","0.006","73.031","0.006","65.241","0.005","3062.1","0.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","Tetrakis(tetrahydrofuran)lithium(I) μ~3~-iodo-tri-μ~2~-iodo-bis(triphenylphosphane)tricuprate(I)(2 Cu—Cu) tetrahydrofuran solvate","","- C56 H70 Cu3 I4 Li O5 P2 -","- C56 H70 Cu3 I4 Li O5 P2 -","- C112 H140 Cu6 I8 Li2 O10 P4 -","2","1","NG2181","Morawitz, Thorsten; Lerner, Hans-Wolfram; Bolte, Michael","Tetrakis(tetrahydrofuran)lithium(I) μ~3~-iodo-tri-μ~2~-iodo-bis(triphenylphosphane)tricuprate(I)(2 <i>Cu</i>—<i>Cu</i>) tetrahydrofuran solvate","Acta Crystallographica Section E","2007","63","1","m294","m295","10.1107/S1600536806054638","","","0.71073","MoKα","","0.0807","0.0592","","","0.1534","0.1651","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211914","9.2655","0.0007","9.9754","0.0007","11.298","0.0008","102.125","0.006","93.415","0.006","96.443","0.006","1010.78","0.13","296","","296","","","","","","","","","5","P -1","-P 1","2","","1,1'-(Propane-1,3-diyl)bis[2-(methylsulfanyl)-1H-benzimidazole] dihydrate","","- C19 H24 N4 O2 S2 -","- C19 H24 N4 O2 S2 -","- C38 H48 N8 O4 S4 -","2","1","OB3030","Çiĝdem Yüksektepe; Nezihe Çalıs̨kan; Murat Genç; Süleyman Servi; Orhan Büyükgüngör","1,1'-(Propane-1,3-diyl)bis[2-(methylsulfanyl)-1<i>H</i>-benzimidazole] dihydrate","Acta Crystallographica Section E","2007","63","1","o100","o102","10.1107/S1600536806051646","","","0.71073","MoKα","","0.0618","0.0422","","","0.1101","0.1194","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211915","13.0493","0.0002","7.705","0.0001","12.9115","0.0001","90","","96.439","0.001","90","","1290","0.03","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[chloro(pyridinium-3-carboxylato-κO)zinc(II)]- μ-nicotinato-κ^2^O:N]","","- C12 H9 Cl N2 O4 Zn -","- C12 H9 Cl N2 O4 Zn -","- C48 H36 Cl4 N8 O16 Zn4 -","4","0.5","OM2066","Ghazzali, Mohamed; Abu-Youssef, Morsy A. M.; Langer, Vratislav","<i>catena</i>-Poly[[chloro(pyridinium-3-carboxylato-κ<i>O</i>)zinc(II)]-μ-nicotinato-κ^2^<i>O</i>:<i>N</i>]","Acta Crystallographica Section E","2007","63","1","m114","m116","10.1107/S1600536806051282","","","0.71073","MoKα","","0.0628","0.0496","","","0.1245","0.1343","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211916","9.3964","0.0002","19.445","0.004","9.8521","0.0002","90","","105.307","0.003","90","","1736.2","0.4","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-6-Methoxy-4-(2-methoxyimino-2-phenylethoxy)-7-methylisobenzofuran-3(1H)-one","","- C19 H19 N O5 -","- C19 H19 N O5 -","- C76 H76 N4 O20 -","4","1","OM2068","Pei-Yuan, Yao; Jian-Gong, Wang","(<i>Z</i>)-6-Methoxy-4-(2-methoxyimino-2-phenylethoxy)-7-methylisobenzofuran-3(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","1","o398","o399","10.1107/S1600536806054481","","","0.71073","MoKα","","0.085","0.0452","","","0.1177","0.1442","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211917","8.3545","0.0005","10.3696","0.0007","10.637","0.0007","95.208","0.001","110.924","0.001","99.762","0.001","836.74","0.09","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","3-Phenyl-1,5-di-2-pyridylpentane-1,5-dione","","- C21 H18 N2 O2 -","- C21 H18 N2 O2 -","- C42 H36 N4 O4 -","2","1","OM2073","James, Leanne; Maguire, Glenn E. .M.; Martincigh, Bice S.; McKee, Vickie; Ndlovu, Nombuso","3-Phenyl-1,5-di-2-pyridylpentane-1,5-dione","Acta Crystallographica Section E","2007","63","1","o153","o155","10.1107/S1600536806052172","","","0.71073","MoKα","","0.0505","0.0415","","","0.1054","0.1112","","","","","","1.085","","","","has coordinates,has disorder,has Fobs","201974","2020-10-21","18:00:00",""
"2211918","7.5538","0.0015","13.511","0.003","28.994","0.006","90","","90","","90","","2959.1","1.1","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Ethoxy-4-formylphenyl benzenesulfonate","","- C15 H14 O5 S -","- C15 H14 O5 S -","- C120 H112 O40 S8 -","8","1","OM2075","Ren, Xiao-Liang; Wang, Yan; Qi, Ai-Di","2-Ethoxy-4-formylphenyl benzenesulfonate","Acta Crystallographica Section E","2007","63","1","o219","o220","10.1107/S1600536806052184","","","0.71073","MoKα","","0.0883","0.0429","","","0.0961","0.118","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211919","10.8011","0.0006","11.6051","0.0006","12.8489","0.0008","63.3951","0.0016","76.8282","0.0016","89.5278","0.0019","1394","0.14","250","2","250","2","","","","","","","","4","P -1","-P 1","2","","N-[5-(1-Naphthyl)pyrimidin-4-yl]acetamide oxime","","- C16 H14 N4 O -","- C16 H14 N4 O -","- C64 H56 N16 O4 -","4","2","OM2077","Okuda, Kensuke; Watanabe, Hiromi; Hirota, Takashi; Ishida, Hiroyuki","<i>N</i>-[5-(1-Naphthyl)pyrimidin-4-yl]acetamide oxime","Acta Crystallographica Section E","2007","63","1","o195","o196","10.1107/S1600536806052226","","","0.71075","MoKα","","0.1004","0.0591","","","0.1578","0.1821","","","","","","0.977","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211920","8.161","0.002","15.746","0.004","7.1509","0.0018","90","","110.826","0.004","90","","858.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-Quinoline-4-carbaldehyde oxime","","- C10 H8 N2 O -","- C10 H8 N2 O -","- C40 H32 N8 O4 -","4","1","OM2079","Zhou, Fu-Hui; Zhao, Hong-Bin; Gu, Xiao-Dan; Li, Zhi-Gang; Xu, Jing-Wei","(<i>E</i>)-Quinoline-4-carbaldehyde oxime","Acta Crystallographica Section E","2007","63","1","o329","o330","10.1107/S1600536806053426","","","0.71073","MoKα","","0.0521","0.0469","","","0.1282","0.1343","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211921","7.8513","0.0009","8.0764","0.0009","11.68","0.001","89.482","0.009","79.07","0.009","77.738","0.009","710.23","0.13","299","2","299","2","","","","","","","","6","P -1","-P 1","2","","2-Aminoquinolin-8-yl 4-fluorobenzenesulfonate","","- C15 H11 F N2 O3 S -","- C15 H11 F N2 O3 S -","- C30 H22 F2 N4 O6 S2 -","2","1","OM2080","Silva, Luiz Everson da; Joussef, Antonio Carlos; Foro, Sabine; Schmidt, Boris","2-Aminoquinolin-8-yl 4-fluorobenzenesulfonate","Acta Crystallographica Section E","2007","63","1","o407","o408","10.1107/S160053680605447X","","","1.5418","CuKα","","0.0545","0.0426","","","0.1158","0.1247","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211922","12.406","0.003","12.406","0.003","12.211","0.007","90","","90","","120","","1627.6","1.1","293","2","293","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","bis[bis(triazol-1-yl)acetato]nickel(II) monohydrate","","- C12 H12 N12 Ni O5 -","- C12 H10 N12 Ni O5 -","- C36 H30 N36 Ni3 O15 -","3","0.5","RN2016","Yun Ling; Hong-Yan Gao; Lei Zhang","[Bis(triazol-1-yl)acetato]nickel(II) monohydrate","Acta Crystallographica Section E","2007","63","1","m193","m195","10.1107/S1600536806052858","","","0.71073","MoKα","","0.0532","0.0499","","","0.1568","0.16","","","","","","1.116","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211923","14.915","0.002","8.4187","0.0014","25.277","0.004","90","","90","","90","","3173.9","0.8","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-Benzyl-4,5-dimethoxy-2-nitrobenzamide","","- C16 H16 N2 O5 -","- C16 H16 N2 O5 -","- C128 H128 N16 O40 -","8","1","RZ2095","Ghulam Qadeer; Nasim Hasan Rama; Wai-Yeung Wong","<i>N</i>-Benzyl-4,5-dimethoxy-2-nitrobenzamide","Acta Crystallographica Section E","2007","63","1","o335","o336","10.1107/S1600536806053463","","","0.71073","MoKα","","0.1362","0.0664","","","0.1526","0.1829","","","","","","0.996","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211924","8.51","0.005","10.728","0.003","23.664","0.004","90","","90","","90","","2160.4","1.5","292","2","292","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","(S-Methylcysteinato)(η^5^-pentamethylcyclopentadienyl)iridium(III) trifluoromethanesulfonate hemihydrate","","- C15 H24 F3 Ir N O5.5 S2 -","- C15 H24 F3 Ir N O5.5 S2 -","- C60 H96 F12 Ir4 N4 O22 S8 -","4","1","SA2020","Michael Scharwitz; Tobias van Almsick; William S. Sheldrick","(<i>S</i>-Methylcysteinato)(η^5^-pentamethylcyclopentadienyl)iridium(III) trifluoromethanesulfonate hemihydrate","Acta Crystallographica Section E","2007","63","1","m230","m232","10.1107/S1600536806053360","","","0.71073","MoKα","","0.0367","0.0319","","","0.0775","0.0803","","","","","","1.063","","","","has coordinates,has Fobs","199684","2020-10-21","18:00:00",""
"2211925","8.518","0.001","8.518","0.001","38.236","0.005","90","","90","","90","","2774.3","0.6","100","","100","","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","(1S,4R)-1,2,3,4,7,7-Hexachloro-5,6-bis(chloromethyl)bicyclo[2.2.1]hept-2,5-diene","","- C9 H4 Cl8 -","- C9 H4 Cl8 -","- C72 H32 Cl64 -","8","1","SA2026","Wilson, Zakiya S.; Davila, Alfonso; McLaughlin, Mark L.; Watkins, Steven F.; Fronczek, Frank R.","(1<i>S</i>,4<i>R</i>)-1,2,3,4,7,7-Hexachloro-5,6-bis(chloromethyl)bicyclo[2.2.1]hepta-2,5-diene","Acta Crystallographica Section E","2007","63","1","o303","o305","10.1107/S1600536806052676","","","0.71073","MoKα","","0.039","0.025","","","0.044","0.045","","","","","","1.007","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211926","11.41","0.005","7.846","0.003","23.167","0.009","90","","90","","90","","2074","1.5","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-(2-pyridyl)isoindoline-1,3-dione","","- C13 H8 N2 O2 -","- C13 H8 N2 O2 -","- C104 H64 N16 O16 -","8","1","SA2027","Liang, Zu-Pei; Li, Jian","2-(2-Pyridyl)isoindoline-1,3-dione","Acta Crystallographica Section E","2007","63","1","o405","o406","10.1107/S1600536806054766","","","0.71073","MoKα","","0.0576","0.0341","","","0.0825","0.0957","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211927","5.9832","0.0013","9.783","0.002","13.274","0.003","90.045","0.004","100.432","0.004","102.271","0.004","746.1","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","N-(2-Chlorobenzoyl)-N'-(4-nitrophenyl)thiourea","","- C14 H10 Cl N3 O3 S -","- C14 H10 Cl N3 O3 S -","- C28 H20 Cl2 N6 O6 S2 -","2","1","SA2028","Yusof, M. Sukeri M.; Edris, Mustaqim M.; Mardi, A. Sahali; Yamin, Bohari M.","<i>N</i>-(2-Chlorobenzoyl)-<i>N</i>'-(4-nitrophenyl)thiourea","Acta Crystallographica Section E","2007","63","1","o94","o95","10.1107/S1600536806050999","","","0.71073","MoKα","","0.058","0.04","","","0.093","0.1","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211928","3.741","0.001","5.761","0.001","14.737","0.004","90.13","0.01","90.75","0.01","103.17","0.01","309.23","0.13","90","0.2","90","0.2","","","","","","","","5","P -1","-P 1","2","","6-chloronicotinic acid","","- C6 H4 Cl N O2 -","- C6 H4 Cl N O2 -","- C12 H8 Cl2 N2 O4 -","2","1","SF3028","Long, Sihui; Siegler, Maxime; Li, Tonglei","6-Chloronicotinic acid","Acta Crystallographica Section E","2007","63","1","o279","o281","10.1107/S1600536806053177","","","0.71073","MoKα","","0.0287","0.0252","","","0.0644","0.0669","","","","","","1.081","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211929","5.6331","0.0006","8.2283","0.0005","30.259","0.003","90","","91.239","0.008","90","","1402.2","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-3-(1,3-Benzodioxol-4-yl)-2-(4-bromophenyl)acrylic acid","","- C16 H11 Br O4 -","- C16 H11 Br O4 -","- C64 H44 Br4 O16 -","4","1","SG2087","Hussain, Mukhtiar; Siddique, Adnan; Ali, Saqib; Altaf, Muhammad; Stoeckli-Evans, Helen","(<i>E</i>)-3-(1,3-Benzodioxol-4-yl)-2-(4-bromophenyl)acrylic acid","Acta Crystallographica Section E","2007","63","1","o1","o3","10.1107/S1600536806047404","","","0.71073","MoKα","","0.0609","0.0388","","","0.0799","0.0859","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211930","7.7674","0.0002","8.7852","0.0002","8.3555","0.0003","90","","112.093","0.001","90","","528.3","0.03","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-(2,6-Dichlorophenyl)-1,4-dihydroxybutan-2-one","","- C10 H10 Cl2 O3 -","- C10 H10 Cl2 O3 -","- C20 H20 Cl4 O6 -","2","1","SG2102","Long He; Ng, Seik Weng","4-(2,6-Dichlorophenyl)-1,4-dihydroxybutan-2-one","Acta Crystallographica Section E","2007","63","1","o38","o39","10.1107/S1600536806050768","","","0.71073","MoKα","","0.019","0.019","","","0.055","0.055","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211931","8.9875","0.0008","10.022","0.0008","15.2076","0.0012","83.088","0.006","74.144","0.006","82.788","0.006","1301.92","0.19","173","2","173","2","","","","","","","","4","P -1","-P 1","2","Anilic acid dimethylformamide disolvate","2,5-bis(phenylamino)terephthalic acid dimethylformamide disolvate","","- C26 H30 N4 O6 -","- C26 H30 N4 O6 -","- C52 H60 N8 O12 -","2","1","SG2103","Schmidt, Martin U.; Schmiermund, Torsten; Bolte, Michael","Anilic acid dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","1","o293","o295","10.1107/S1600536806050781","","","0.71073","MoKα","","0.0509","0.0468","","","0.1204","0.1238","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211932","13.846","0.011","6.986","0.006","6.176","0.005","90","","96.363","0.01","90","","593.7","0.8","298","2","298","2","","","","","","","","5","P 1 c 1","P -2yc","7","","4-Chloro-2-(p-tolyliminomethyl)phenol","","- C14 H12 Cl N O -","- C14 H12 Cl N O -","- C28 H24 Cl2 N2 O2 -","2","1","SG2106","Zhang, Xin-Li; Li, Zong-Xiao","4-Chloro-2-(<i>p</i>-tolyliminomethyl)phenol","Acta Crystallographica Section E","2007","63","1","o319","o320","10.1107/S1600536806053050","","","0.71073","MoKα","","0.0536","0.0374","","","0.0887","0.0993","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211933","30.741","0.001","8.614","0.001","13.667","0.001","90","","113.9","0.01","90","","3308.7","0.5","183","2","183","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","mer-Trichloro(dimethyl sulfoxide-κS)-cis-bis(1-methylimidazole-κN^3^)iridium(III)","","- C10 H18 Cl3 Ir N4 O S -","- C10 H18 Cl3 Ir N4 O S -","- C80 H144 Cl24 Ir8 N32 O8 S8 -","8","1","SG2108","Ahrens, Sebastian; Strassner, Thomas","<i>mer</i>-Trichloro(dimethyl sulfoxide-κ<i>S</i>)-<i>cis</i>-bis(1-methylimidazole-κ<i>N</i>^3^)iridium(III)","Acta Crystallographica Section E","2007","63","1","m100","m101","10.1107/S1600536806051944","","","0.71073","MoKα","","0.0337","0.0229","","","0.0448","0.0479","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211934","10.8719","0.0005","11.0495","0.0005","14.2621","0.0005","104.781","0.004","97.789","0.004","96.089","0.004","1623.53","0.13","100","2","","","","","","","","","","6","P -1","-P 1","2","","bis(μ-benzene-1,2-dithiolato)bis[(2- mercaptobenzenethiolato)triphenylphosphine)rhodium(III)] dichloromethane tetrasolvate","","- C64 H56 Cl8 P2 Rh2 S8 -","- C64 H56 Cl8 P2 Rh2 S8 -","- C64 H56 Cl8 P2 Rh2 S8 -","1","0.5","SG2110","Hadebe, Siphamandla W.; Robinson, Ross R.; Munro, Orde Q.","A bis(benzenedithiolate)-bridged dinuclear Rh^III^ complex with capping triphenylphosphine ligands and an Rh~2~S~2~ core","Acta Crystallographica Section E","2007","63","1","m175","m177","10.1107/S1600536806053037","","","0.71073","MoKα","","","0.0247","","","","0.06","","","","","","1.082","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211935","5.707","0.003","9.17","0.004","15.453","0.007","90","","96.78","0.005","90","","803","0.7","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2-Thiazol-2-yl)cyclopropanecarboxamide","","- C7 H8 N2 O S -","- C7 H8 N2 O S -","- C28 H32 N8 O4 S4 -","4","1","SG2111","Li Tian; Bin Liu; Jing Wang","<i>N</i>-(2-Thiazol-2-yl)cyclopropanecarboxamide","Acta Crystallographica Section E","2007","63","1","o273","o274","10.1107/S1600536806053049","","","0.71073","MoKα","","0.0364","0.031","","","0.0861","0.0904","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211936","9.586","0.006","17.189","0.011","10.948","0.007","90","","95.133","0.013","90","","1797","2","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-acetyl-3-benzyl-5-hydroxy-6,7-dimethoxy-4-methylbenzofuran-2(3H)-one","","- C20 H20 O6 -","- C20 H20 O6 -","- C80 H80 O24 -","4","1","SJ2159","Li, Changjin; Li, Hui; Hu, Zhiqiang","3-Acetyl-3-benzyl-5-hydroxy-6,7-dimethoxy-4-methylbenzofuran-2(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","1","o120","o121","10.1107/S1600536806047714","","","0.71073","MoKα","","0.1359","0.0517","","","0.1146","0.1444","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211937","10.742","0.002","11.557","0.002","10.568","0.002","90","","93.43","0.03","90","","1309.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,3-Diphenylthiazolidin-5-amine","","- C15 H15 N2 S -","- C15 H15 N2 S -","- C60 H60 N8 S4 -","4","1","SJ2164","Jian-Gang Wang; Fang-Fang Jian; Rui-Rui Zhuang; Guang-Qiang Zhao","<i>N</i>,3-Diphenylthiazolidin-5-amine","Acta Crystallographica Section E","2007","63","1","o226","o227","10.1107/S1600536806051324","","","0.71073","MoKα","","0.0809","0.0767","","","0.1496","0.1516","","","","","","1.328","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211938","5.4642","0.0001","8.3919","0.0001","9.6469","0.0002","105.228","0.001","94.455","0.001","95.321","0.001","422.584","0.013","100","0.1","297","2","","","","","","","","6","P -1","-P 1","2","","N-(3-Chloro-4-fluorophenyl)thiourea","","- C7 H6 Cl F N2 S -","- C7 H6 Cl F N2 S -","- C14 H12 Cl2 F2 N4 S2 -","2","1","SJ2176","Mohd Mustaqim Rosli; Mari Sithambaram Karthikeyan; Hoong-Kun Fun; Ibrahim Abdul Razak; P. S. Patil","<i>N</i>-(3-Chloro-4-fluorophenyl)thiourea","Acta Crystallographica Section E","2007","63","1","o67","o68","10.1107/S1600536806050422","","","0.71073","MoKα","","0.0277","0.0264","","","0.0719","0.0736","","","","","","1.092","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211939","12.805","0.003","10.62","0.002","14.334","0.003","90","","109.803","0.003","90","","1834","0.7","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2-Methoxy-5-methylphenyl)(4-methoxyphenyl)iodonium trifluoroacetate","","- C17 H16 F3 I O4 -","- C17 H16 F3 I O4 -","- C68 H64 F12 I4 O16 -","4","1","SJ2177","Li, Hui; Jiang, Shende","(2-Methoxy-5-methylphenyl)(4-methoxyphenyl)iodonium trifluoroacetate","Acta Crystallographica Section E","2007","63","1","o83","o85","10.1107/S1600536806050872","","","0.71073","MoKα","","0.081","0.0352","","","0.0667","0.0794","","","","","","0.987","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211940","8.5325","0.0002","8.8404","0.0002","10.1468","0.0002","87.048","0.001","73.313","0.001","85.919","0.001","730.9","0.03","100","0.1","297","2","","","","","","","","4","P -1","-P 1","2","","1-(4-Fluorophenyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one","","- C18 H17 F O4 -","- C18 H17 F O4 -","- C36 H34 F2 O8 -","2","1","SJ2180","Jeannie Bee-Jan Teh; P. S. Patil; Hoong-Kun Fun; Ibrahim Abdul Razak; S. M. Dharmaprakash","1-(4-Fluorophenyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","1","o54","o56","10.1107/S160053680605063X","","","0.71073","MoKα","","0.0443","0.0404","","","0.1185","0.1229","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211941","4.2482","0.0001","9.7774","0.0002","10.3407","0.0002","86.825","0.001","83.966","0.001","82.413","0.001","423.02","0.016","100","0.1","297","2","","","","","","","","4","P -1","-P 1","2","","Formaldehyde 2,4-dinitrophenylhydrazone","","- C7 H6 N4 O4 -","- C7 H6 N4 O4 -","- C14 H12 N8 O8 -","2","1","SJ2181","Abdassalam Abdelhafiz Tameem; Abdussalam Salhin; Bahruddin Saad; Ismail Ab. Rahman; Muhammad Idiris Saleh; Shea-Lin Ng; Hoong-Kun Fun","Formaldehyde 2,4-dinitrophenylhydrazone","Acta Crystallographica Section E","2007","63","1","o57","o58","10.1107/S160053680605094X","","","0.71073","MoKα","","0.0484","0.038","","","0.1015","0.1084","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211942","10.1774","0.0002","31.8924","0.0006","3.9078","0.0001","90","","90","","90","","1268.4","0.05","100","0.1","297","2","","","","","","","","5","P n a 21","P 2c -2n","33","","3-(5-Bromo-2-thienyl)-1-(4-methoxyphenyl)prop-2-en-1-one","","- C14 H11 Br O2 S -","- C14 H11 Br O2 S -","- C56 H44 Br4 O8 S4 -","4","1","SJ2182","P. S. Patil; Shea-Lin Ng; Ibrahim Abdul Razak; Hoong-Kun Fun; S. M. Dharmaprakash","3-(5-Bromo-2-thienyl)-1-(4-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","1","o59","o60","10.1107/S1600536806050641","","","0.71073","MoKα","","0.0447","0.0349","","","0.0889","0.0985","","","","","","1.105","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211943","7.401","0.0002","9.3811","0.0003","15.2889","0.0005","101.819","0.002","93.013","0.002","93.547","0.002","1034.69","0.06","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","Bis[(2-amino-4,6-dimethylpyrimidine-κN)(isophthalato-κ^2^O,O')]copper(II) 2-amino-4,6-dimethylpyrimidine disolvate","","- C40 H46 Cu N12 O8 -","- C40 H46 Cu N12 O8 -","- C40 H46 Cu N12 O8 -","1","0.5","SJ2183","Qing Wei; Guang Fan; Sheng-Li Gao","Bis(2-amino-4,6-dimethylpyrimidine-κ<i>N</i>)bis(isophthalato-κ^2^<i>O</i>,<i>O</i>')copper(II) 2-amino-4,6-dimethylpyrimidine disolvate","Acta Crystallographica Section E","2007","63","1","m51","m53","10.1107/S1600536806051385","","","0.71073","MoKα","","0.0534","0.038","","","0.1055","0.1182","","","","","","1.071","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211944","10.2947","0.0011","12.0592","0.0013","13.433","0.0014","90","","106.599","0.002","90","","1598.2","0.3","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Ethylamino-3-phenyl-2-benzothieno[3,2-d]pyrimidin-4(3H)-one","","- C18 H15 N3 O S -","- C18 H15 N3 O S -","- C72 H60 N12 O4 S4 -","4","1","SJ2184","MinHui Cao","2-Ethylamino-3-phenyl-2-benzothieno[3,2-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","1","o77","o78","10.1107/S1600536806051361","","","0.71073","MoKα","","0.083","0.0595","","","0.1489","0.1618","","","","","","1.048","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211945","16.131","0.003","8.2721","0.0018","17.602","0.004","90","","90","","90","","2348.8","0.9","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-Benzhydrylformamide","","- C14 H13 N O -","- C14 H13 N O -","- C112 H104 N8 O8 -","8","1","SJ2185","Hua, Chao; Li, Xin-Gang; Xu, Shi-Min","<i>N</i>-Benzhydrylformamide","Acta Crystallographica Section E","2007","63","1","o144","o145","10.1107/S1600536806051592","","","0.71073","MoKα","","0.1045","0.0444","","","0.107","0.1476","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211946","9.443","0.0007","7.5675","0.0006","12.5714","0.0009","90","","112.06","","90","","832.58","0.11","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2-Amino-4-(4-methoxyphenyl)-6-(piperidin-1-yl)pyridine-3,5-dicarbonitrile","","- C19 H19 N5 O -","- C19 H19 N5 O -","- C38 H38 N10 O2 -","2","1","SJ2186","Jun Shao; Ya-Zhou Wang; Yuan-Xiang Li","2-Amino-4-(4-methoxyphenyl)-6-(piperidin-1-yl)pyridine-3,5-dicarbonitrile","Acta Crystallographica Section E","2007","63","1","o163","o164","10.1107/S1600536806051981","","","0.71073","MoKα","","0.0702","0.0502","","","0.0897","0.0947","","","","","","0.94","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211947","27.291","0.006","5.5688","0.0013","21.132","0.005","90","","109.879","0.004","90","","3020.2","1.2","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","9-(2,6-Dichlorobenzyl)-9H-carbazole","","- C19 H13 Cl2 N -","- C19 H13 Cl2 N -","- C152 H104 Cl16 N8 -","8","1","SJ2189","Ming-Wang Shi; Xi-Ling Chen; Jian-Feng Lang; Jian-Hua Wang","9-(2,6-Dichlorobenzyl)-9<i>H</i>-carbazole","Acta Crystallographica Section E","2007","63","1","o122","o123","10.1107/S1600536806051762","","","0.71073","MoKα","","0.0678","0.0378","","","0.0839","0.0964","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211948","7.9731","0.0006","15.2456","0.0009","12.7314","0.0007","90","","95.784","0.012","90","","1539.68","0.17","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N,N,N',N'-Tetramethylbutane-1,4-diammonium tetrachlorocuprate","N,N,N',N'-Tetramethylbutane-1,4-diammonium tetrachlorocuprate","","- C8 H22 Cl4 Cu N2 -","- C8 H22 Cl4 Cu N2 -","- C32 H88 Cl16 Cu4 N8 -","4","1","SJ2190","A. Elangovan; A. Thamaraichelvan; A. Ramu; S. Athimoolam; S. Natarajan","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylbutane-1,4-diammonium tetrachlorocuprate(II)","Acta Crystallographica Section E","2007","63","1","m201","m203","10.1107/S1600536806053153","","","0.71069","MoKα","","0.049","0.0419","","","0.1138","0.1197","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211949","5.7578","0.0012","26.192","0.006","7.7338","0.0016","90","","90.159","0.004","90","","1166.3","0.4","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Benzyloxy-2-nitroaniline","","- C13 H12 N2 O3 -","- C13 H12 N2 O3 -","- C52 H48 N8 O12 -","4","1","SJ2191","Wei Huang; Hong-Bin Zhou","4-Benzyloxy-2-nitroaniline","Acta Crystallographica Section E","2007","63","1","o105","o106","10.1107/S1600536806051786","","","0.71073","MoKα","","0.0666","0.0538","","","0.1245","0.1317","","","","","","1.143","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211950","8.379","0.003","17.33","0.006","9.506","0.003","90","","105.431","0.006","90","","1330.6","0.8","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","diaqua-1κO,2κO-[μ-11,23-dichloro-3,7,15,19- tetraazatricyclo[19.3.1.1^19,13^]hexacosa-1(25),2,7,9,11,13(26),14,19,21,23- decaene-25,26-diolato- 1κ^4^N^3^,N^7^,O^25^,<i>O</i>^26^:2κ^4^N^15^,N^19^,O^25^,O^26^]dizinc(II) dinitrate","","- C22 H24 Cl2 N6 O10 Zn2 -","- C22 H24 Cl2 N6 O10 Zn2 -","- C44 H48 Cl4 N12 O20 Zn4 -","2","0.5","SJ2193","Chu, Zhao-Lian; Huang, Wei","Diaqua-1κ<i>O</i>,2κ<i>O</i>-[μ-11,23-dichloro-3,7,15,19-tetraazatricyclo[19.3.1.1^19,13^]hexacosa-1(25),2,7,9,11,13(26),14,19,21,23-decaene-25,26-diolato-1κ^4^<i>N</i>^3^,<i>N</i>^7^,<i>O</i>^25^,<i>O</i>^26^:2κ^4^<i>N</i>^15^,<i>N</i>^19^,<i>O</i>^25^,<i>O</i>^26^]dizinc(II) dinitrate","Acta Crystallographica Section E","2007","63","1","m198","m200","10.1107/S1600536806053141","","","0.71073","MoKα","","0.0457","0.0386","","","0.0996","0.1025","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211951","19.7316","0.0011","15.3962","0.0009","13.8017","0.0008","90","","90","","90","","4192.8","0.4","293","2","293","2","","","","","","","","6","C m c a","-C 2ac 2","64","","Bis(4-acetylanilinium) tetrachlorocuprate(II)","","- C16 H20 Cl4 Cu N2 O2 -","- C16 H20 Cl4 Cu N2 O2 -","- C128 H160 Cl32 Cu8 N16 O16 -","8","","SJ2195","A. Elangovan; A. Thamaraichelvan; A. Ramu; S. Athimoolam; S. Natarajan","Bis(4-acetylanilinium) tetrachlorocuprate(II)","Acta Crystallographica Section E","2007","63","1","m224","m226","10.1107/S1600536806053323","","","0.71069","MoKα","","0.0566","0.0402","","","0.1024","0.1105","","","","","","1.035","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2211952","10.3644","0.0017","15.1394","0.0019","14.1042","0.0015","90","","106.943","0.011","90","","2117","0.5","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","2-nitroaniline‒picric acid (2/1)","","- C18 H15 N7 O11 -","- C18 H15 N7 O11 -","- C72 H60 N28 O44 -","4","1","SJ2197","Kolandaivelu Saminathan; Kandasamy Sivakumar","A 2:1 complex of 2-nitroaniline and picric acid","Acta Crystallographica Section E","2007","63","1","o354","o356","10.1107/S1600536806053785","","","1.54184","CuKα","","0.067","0.0558","","","0.165","0.179","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211953","14.3695","0.0018","13.151","0.0017","8.3524","0.0011","90","","93.392","0.002","90","","1575.6","0.4","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(6-Chloropyridin-3-ylmethyl)-7-imino-6-isobutyl-6,7-dihydro-3H-1,2,3- triazolo[4,5-d]pyrimidine","","- C14 H16 Cl N7 -","- C14 H16 Cl N7 -","- C56 H64 Cl4 N28 -","4","1","SJ2198","Xiao-Bao Chen; De-Qing Shi","3-(6-Chloropyridin-3-ylmethyl)-7-imino-6-isobutyl-6,7-dihydro-3<i>H</i>-1,2,3-triazolo[4,5-<i>d</i>]pyrimidine","Acta Crystallographica Section E","2007","63","1","o337","o339","10.1107/S1600536806053839","","","0.71073","MoKα","","0.0802","0.0592","","","0.1425","0.1546","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211954","7.157","0.003","8.44","0.004","10.193","0.005","90","","95.631","0.008","90","","612.7","0.5","294","2","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S,S)-2,2'-(1,2-Ethanediyldiimino)bis-1-butanol","","- C10 H24 N2 O2 -","- C10 H24 N2 O2 -","- C20 H48 N4 O4 -","2","1","SJ9043","Bai, Guo-Yi; Zhang, Chen-Fang; Zhang, Yue-Cheng; Zeng, Tao; Li, Jiang-Sheng","(<i>S</i>,<i>S</i>)-2,2'-(1,2-Ethanediyldiimino)dibutan-1-ol. Corrigendum","Acta Crystallographica Section E","2007","63","1","e2","e3","10.1107/S1600536806054389","","","0.71073","MoKα","","0.0606","0.0406","","","0.0917","0.1027","","","","","","1.066","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2211955","6.69","0.001","8.833","0.002","11.044","0.002","83.11","0.03","81.19","0.03","75.69","0.03","622.6","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Bis[ethyl 2-cyano-2-(oxidoimino)acetate]bis(ethylenediamine)nickel(II) hexahydrate","","- C14 H38 N8 Ni O12 -","- C14 H38 N8 Ni O12 -","- C14 H38 N8 Ni O12 -","1","0.5","TK2098","Mikhail P. Azarkh; Nikolay M. Dudarenko; Igor O. Fritsky; Turganbay S. Iskenderov; Jolanta Świątek-Kozłowska","Bis[ethyl 2-cyano-2-(oxidoimino)acetate]bis(ethylenediamine)nickel(II) hexahydrate","Acta Crystallographica Section E","2007","63","1","m9","m11","10.1107/S1600536806048331","","","0.71073","MoKα","","0.056","0.046","","","0.109","0.114","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211956","10.1894","0.0004","11.0993","0.0004","9.694","0.0004","91.974","0.002","108.693","0.002","80.501","0.003","1024.07","0.07","293","","293","","","","","","","","","5","P -1","-P 1","2","","Dichloro[(η^5^-cyclopentadienyl)dimethyl(η^5^-3- phenylindenyl)silane]hafnium(IV)","","- C22 H20 Cl2 Hf Si -","- C22 H20 Cl2 Hf Si -","- C44 H40 Cl4 Hf2 Si2 -","2","1","TK2099","Burley, Jonathan C.; Motherwell, W. D. Sam; Maaranen, Janne; Ringwald, Markus","Dichloro[(η^5^-cyclopentadienyl)dimethyl(η^5^-3-phenylindenyl)silane]hafnium(IV): a powder study","Acta Crystallographica Section E","2007","63","1","m238","m240","10.1107/S1600536806051269","","","1.78892","CoKα","","","","","","","","","","1.04","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2211957","8.0828","0.0006","8.2286","0.0007","9.4515","0.0008","92.442","0.003","114.897","0.002","115.694","0.002","493.95","0.07","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","1,4-Phenylenediammonium bis(hydrogen phthalate)","","- C22 H20 N2 O8 -","- C22 H20 N2 O8 -","- C22 H20 N2 O8 -","1","0.5","TK2101","Kui-Wu Wang; Hong Zhang; Lian-Qing Shen","1,4-Phenylenediammonium bis(hydrogen phthalate)","Acta Crystallographica Section E","2007","63","1","o126","o128","10.1107/S1600536806051245","","","0.71073","MoKα","","0.035","0.032","","","0.094","0.096","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211958","8.178","0.005","9.483","0.004","12.79","0.006","89.19","0.04","80.73","0.04","78.05","0.04","957.5","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Poly[[diaqua(μ~4~-3-sulfonatobenzoato)lead(II)] 4,4'-bipyridine]","","- C17 H16 N2 O7 Pb S -","- C17 H16 N2 O7 Pb S -","- C34 H32 N4 O14 Pb2 S2 -","2","1","TK2103","Wagner, Christoph; Merzweiler, Kurt","Poly[[diaqua(μ~4~-3-sulfonatobenzoato)lead(II)] 4,4'-bipyridine]","Acta Crystallographica Section E","2007","63","1","m111","m113","10.1107/S1600536806051270","","","0.71073","MoKα","","0.0218","0.0194","","","0.048","0.0556","","","","","","1.19","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211959","9.979","0.002","17.899","0.003","8.2712","0.0014","90","","90","","90","","1477.4","0.5","295","","295","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-Cinnamoyl-L-valine methyl ester","","- C15 H19 N O3 -","- C15 H19 N O3 -","- C60 H76 N4 O12 -","4","1","TK2109","Laurent F. Bornaghi; Sally-Ann Poulsen; Peter C. Healy; Alan R. White","<i>N</i>-Cinnamoyl-<small>L</small>-valine methyl ester","Acta Crystallographica Section E","2007","63","1","o44","o46","10.1107/S1600536806050355","","","0.71069","MoKα","","0.117","0.048","","","0.126","0.16","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211960","8.008","0.002","17.862","0.004","8.888","0.003","90","","94.53","0.03","90","","1267.4","0.6","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Methyl-5bβ,6,7,8,9,11aα-hexahydro-5H-indolizino[1,2-b]indol-11(5aαH)-one","","- C15 H18 N2 O -","- C15 H18 N2 O -","- C60 H72 N8 O4 -","4","1","TK2112","Badenock, Jeanese C.; Fraser, Heidi L.; Gribble, Gordon W.; Jasinski, Jerry P.","5-Methyl-5bβ,6,7,8,9,11aα-hexahydro-5<i>H</i>-indolizino[1,2-<i>b</i>]indol-11(5aα<i>H</i>)-one","Acta Crystallographica Section E","2007","63","1","o349","o350","10.1107/S1600536806053669","","","0.71069","MoKα","","0.25","0.056","","","0.171","0.239","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211961","7.0644","0.0006","7.577","0.0007","23.8053","0.001","90","","90","","90","","1274.23","0.17","100","","100","","","","","","","","","4","P b n 21","P 2c -2ab","33","","1,2-bis(2-aminophenoxy)ethane","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C56 H64 N8 O8 -","4","1","TK2118","Sema Öztürk Yıldırım; Mehmet Akkurt; Talat Özpozan; Frank W. Heinemann","Orthorhombic polymorph of 1,2-bis(2-aminophenoxy)ethane","Acta Crystallographica Section E","2007","63","1","o331","o332","10.1107/S1600536806053657","","","0.71073","MoKα","","0.035","0.033","","","0.083","0.084","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211962","8.39","0.002","8.594","0.003","18.36","0.05","76.888","0.008","80.4","0.008","89.34","0.009","1271","4","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","3-Hydroxy-4-nitrophenyl benzenesulfonate","","- C12 H9 N O6 S -","- C12 H9 N O6 S -","- C48 H36 N4 O24 S4 -","4","2","WK2037","Ning Gao","3-Hydroxy-4-nitrophenyl benzenesulfonate","Acta Crystallographica Section E","2007","63","1","o414","o415","10.1107/S160053680605402X","","","0.7107","MoKα","","0.0731","0.0441","","","0.1039","0.1223","","","","","","0.967","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211963","7.7905","0.0015","9.8787","0.0019","14.909","0.003","90","","90","","90","","1147.4","0.4","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[aqua(pyrazine-2-carboxylato)iron(II)]-μ-pyrazine-2-carboxylato]","","- C10 H8 Fe N4 O5 -","- C10 H8 Fe N4 O5 -","- C40 H32 Fe4 N16 O20 -","4","1","WM2076","Hao, Lu-Jiang; Liu, Tian-Tian","<i>catena</i>-Poly[[aqua(pyrazine-2-carboxylato)iron(II)]-μ-pyrazine-2-carboxylato]","Acta Crystallographica Section E","2007","63","1","m169","m171","10.1107/S1600536806053207","","","0.71073","MoKα","","0.0318","0.0276","","","0.0642","0.0672","","","","","","1.106","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211964","9.8076","0.0001","9.8076","0.0001","19.6036","0.0003","90","","90","","120","","1633.02","0.03","293","","293","2","","","","","","","","4","P 63/m","-P 6c","176","","indium dipotassium pentadecamolybdate nonadecaselenide","","- In0.875 K2 Mo15 Se19 -","- In0.873 K2 Mo15 Se19 -","- In1.746 K4 Mo30 Se38 -","2","0.166667","WM2077","Salloum, D.; Gougeon, P.; Potel, M.","In~0.87~K~2~Mo~15~Se~19~: a quaternary selenide containing Mo~6~ and Mo~9~ clusters","Acta Crystallographica Section E","2007","63","1","i8","i10","10.1107/S1600536806052974","","","0.71069","MoKα","","0.0374","0.0374","","","0.0401","0.0401","","","","","","1.15","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2211965","10.271","0.004","10.271","0.004","10.271","0.004","90","","90","","90","","1083.5","0.7","200","2","200","2","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Dicaesium hexachlorotantalate(IV)","","- Cl6 Cs2 Ta -","- Cl6 Cs2 Ta -","- Cl24 Cs8 Ta4 -","4","0.0208333","WM2079","Hoseop Yun; Gyung-Joo Jang","Dicaesium hexachlorotantalate(IV), Cs~2~TaCl~6~","Acta Crystallographica Section E","2007","63","1","i22","i23","10.1107/S1600536806054754","","","0.71073","MoKα","","","0.0279","","","","0.056","","","","","","1.184","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211966","11.1936","0.0002","11.1936","0.0002","8.9393","0.0003","90","","90","","120","","970","0.04","295","","295","","","","","","","","","5","P 3 1 c","P 3 -2c","159","","Barium tetraammonium poly{hexakis[phosphate(V)]}","","- Ba H16 N4 O18 P6 -","- Ba H16 N4 O18 P6 -","- Ba2 H32 N8 O36 P12 -","2","0.333333","WM2082","Ivashkevich, Ludmila S.; Selevich, Anatoly F.; Lesnikovich, Anatoly I.; Lyakhov, Alexander S.","Powder diffraction study of Ba(NH~4~)~4~(PO~3~)~6~","Acta Crystallographica, Section E","2007","63","1","m16","m18","10.1107/S1600536806053864","","","1.5418","CuKα","","","","","","","","","","0.6","","","","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2211967","16.5539","0.0014","11.1125","0.0008","9.165","0.0005","90","","100.098","0.006","90","","1659.8","0.2","300","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(8RS,9SR)-ethyl 4-(3-bromothien-2-yl)-6-(2-furyl)-2-oxocyclohex-3-ene-1-carboxylate","","- C17 H15 Br O4 S -","- C17 H15 Br O4 S -","- C68 H60 Br4 O16 S4 -","4","1","WN2095","Fischer, Andreas; Yathirajan, H. S.; Ashalatha, B. V.; Naranaya, B.; Sarojini, B.K.","(8<i>RS</i>,9<i>SR</i>)-Ethyl 4-(3-bromothien-2-yl)-6-(2-furyl)-2-oxocyclohex-3-ene-1-carboxylate","Acta Crystallographica Section E","2007","63","1","o254","o255","10.1107/S1600536806052603","","","0.71073","MoKα","","0.0598","0.0373","","","0.0772","0.09","","","","","","1.165","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211968","10.1348","0.0011","11.5389","0.0013","13.6575","0.0015","113.048","0.002","95.896","0.002","105.972","0.002","1372.4","0.3","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","5-(4-Chlorophenoxy)-3,6-diphenyl-2-thioxo-2,3-dihydrothiazolo[4,5-d]pyrimidin- 7(6H)-one 4-chlorophenol solvate","","- C29 H19 Cl2 N3 O3 S2 -","- C29 H19 Cl2 N3 O3 S2 -","- C58 H38 Cl4 N6 O6 S4 -","2","1","WN2100","Liang, Ying; He, Hong-Wu","5-(4-Chlorophenoxy)-3,6-diphenyl-2-thioxo-2,3-dihydrothiazolo[4,5-<i>d</i>]pyrimidin-7(6<i>H</i>)-one 4-chlorophenol solvate","Acta Crystallographica Section E","2007","63","1","o252","o253","10.1107/S1600536806052615","","","0.71073","MoKα","","0.0583","0.0477","","","0.1332","0.1401","","","","","","1.077","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211969","11.126","0.002","8.0199","0.0016","12.414","0.003","90","","101.15","0.03","90","","1086.8","0.4","183","2","183","2","","","","","","","","3","P 1 21 1","P 2yb","4","","3-Formylphenyl-2,3,4,6-tetra-O-acetyl-β-D-glucopyranoside","","- C21 H24 O11 -","- C21 H24 O11 -","- C42 H48 O22 -","2","1","WN2105","Burkhardt, Anja; Buchholz, Axel; Görls, Helmar; Plass, Winfried","3-Formylphenyl-2,3,4,6-tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section E","2007","63","1","o387","o388","10.1107/S1600536806053980","","","0.71073","MoKα","","0.0581","0.038","","","0.0808","0.0893","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211970","5.5451","0.0002","14.5307","0.0005","26.7501","0.0007","90","","90","","90","","2155.37","0.12","183","2","183","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","3-Formylphenyl-2,3,4,6-tetra-<i>O</i>-acetyl-α-D-glucopyranoside","3-Formylphenyl-2,3,4,6-tetra-O-acetyl-α-D-glucopyranoside","","- C21 H24 O11 -","- C21 H24 O11 -","- C84 H96 O44 -","4","1","WN2106","Burkhardt, Anja; Buchholz, Axel; Görls, Helmar; Plass, Winfried","3-Formylphenyl-2,3,4,6-tetra-<i>O</i>-acetyl-α-<small>D</small>-glucopyranoside","Acta Crystallographica Section E","2007","63","1","o384","o386","10.1107/S1600536806053979","","","0.71073","MoKα","","0.0654","0.0433","","","0.0935","0.1036","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211971","14.1699","0.0013","4.2915","0.0004","16.1565","0.0013","90","","96.801","0.007","90","","975.57","0.15","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","5,7-Diiodoquinolin-8-ol","","- C9 H5 I2 N O -","- C9 H5 I2 N O -","- C36 H20 I8 N4 O4 -","4","1","WW2049","Butt, M. Saeed; Akhter, Zareen; Bolte, Michael; Siddiqi, Humaira M.","5,7-Diiodoquinolin-8-ol","Acta Crystallographica Section E","2007","63","1","o15","o16","10.1107/S1600536806050690","","","0.71073","MoKα","","0.0324","0.0308","","","0.0761","0.0771","","","","","","1.174","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211972","12.7444","0.0006","20.2909","0.0008","12.195","0.0005","90","","106.732","0.002","90","","3020.1","0.2","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(cucurbit[6]uril) bis(hexane-1,6-diyldipyridinium) tetrabromide tridecahydrate","","- C104 H142 Br4 N52 O37 -","- C104 H142 Br4 N52 O37 -","- C104 H142 Br4 N52 O37 -","1","0.25","WW2051","Xiao, Xin; Zhang, Yun-Qian; Tao, Zhu; Xue, Sai-Feng; Zhu, Qian-Jiang","Bis(cucurbit[6]uril) bis(hexane-1,6-diyldipyridinium) tetrabromide tridecahydrate","Acta Crystallographica Section E","2007","63","1","o389","o391","10.1107/S1600536806054134","","","0.71073","MoKα","","0.0424","0.0327","","","0.0808","0.0848","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211973","12.9275","0.0017","24.35","0.003","18.267","0.002","90","","110.154","0.003","90","","5398.1","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tetrabutylammonium bis[N,N'-bis(4-chlorophenyl)pyridine-2,6-dicarboxamide(1-)]cobalt(III) monohydrate","","- C54 H60 Cl4 Co N7 O5 -","- C54 H60 Cl4 Co N7 O5 -","- C216 H240 Cl16 Co4 N28 O20 -","4","1","WW2055","Qi, Jian Ying; Yang, Qi Yun; Zhou, Zhong Yuan; Chan, Albert S. C.","Tetrabutylammonium bis[<i>N</i>,<i>N</i>'-bis(4-chlorophenyl)pyridine-2,6-dicarboxamide(1‒)]cobaltate(III) monohydrate","Acta Crystallographica Section E","2007","63","1","m159","m161","10.1107/S1600536806052627","","","0.71073","MoKα","","0.0979","0.0481","","","0.1059","0.1206","","","","","","1.002","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211974","12.413","0.004","18.573","0.005","12.555","0.004","90","","93.97","0.014","90","","2887.6","1.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[bis(1,10-phenanthroline)cadmium(II)]- μ-naphthalene-2,6-dicarboxylato] monohydrate]","","- C36 H24 Cd N4 O5 -","- C36 H24 Cd N4 O5 -","- C144 H96 Cd4 N16 O20 -","4","1","WW2063","Ye, Ling; Ye, Jun-Wei; Ye, Kai-Qi; Wang, Yue","<i>catena</i>-Poly[[[bis(1,10-phenanthroline)cadmium(II)]-μ-naphthalene-2,6-dicarboxylato] monohydrate]","Acta Crystallographica Section E","2007","63","1","m75","m77","10.1107/S1600536806051427","","","0.71073","MoKα","","0.0308","0.0266","","","0.0677","0.0694","","","","","","1.163","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211975","5.727","0.009","18.48","0.03","8.673","0.011","90","","114.07","0.08","90","","838","2","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis(6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxylato)cobalt(II) dihydrate","","- C10 H18 Co N4 O10 -","- C10 H18 Co N4 O10 -","- C20 H36 Co2 N8 O20 -","2","0.5","XU2142","Yu, Qing; Bao, Xiao-Ge; Zhang, Xiu-Qing; Bian, He-Dong; Liang, Hong","Diaquabis(6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxylato)cobalt(II) dihydrate","Acta Crystallographica Section E","2007","63","1","m138","m139","10.1107/S1600536806049427","","","0.71073","MoKα","","0.108","0.083","","","0.192","0.201","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211976","7.781","0.003","9.979","0.004","22.41","0.009","90","","90","","90","","1740.1","1.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","17α-Hydroxypregna-1,4-diene-3,20-dione","","- C21 H28 O3 -","- C21 H28 O3 -","- C84 H112 O12 -","4","1","XU2160","Liu-Qing Sheng; Han-Min Pan; Chao-Tian Chen; Gang Chen","17α-Hydroxypregna-1,4-diene-3,20-dione","Acta Crystallographica Section E","2007","63","1","o325","o326","10.1107/S1600536806053633","","","0.71073","MoKα","","0.061","0.053","","","0.122","0.127","","","","","","1.016","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211977","6.3643","0.0001","9.4441","0.0002","14.0709","0.0005","102.332","0.002","96.38","0.002","107.483","0.002","773.98","0.04","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","Cyclohexyl 2-(piperidin-1-ylthiocarbonylsulfanyl)acetate","","- C14 H23 N O2 S2 -","- C14 H23 N O2 S2 -","- C28 H46 N2 O4 S4 -","2","1","XU2170","Cao, Hua; Zhao, Hong-Bin; Liu, Yan-Li; Zhou, Fu-Hui; Liu, Jie-Pin","Cyclohexyl 2-(piperidin-1-ylthiocarbonylsulfanyl)acetate","Acta Crystallographica Section E","2007","63","1","o200","o201","10.1107/S1600536806052081","","","0.71073","MoKα","","0.041","0.033","","","0.09","0.096","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211978","7.4114","0.0007","10.6122","0.001","10.9137","0.001","90","","103.692","0.002","90","","833.98","0.14","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","5-methoxyindanone","5-Methoxyindan-1-one","","- C10 H10 O2 -","- C10 H10 O2 -","- C40 H40 O8 -","4","1","XU2176","Obaid-ur-Rahman Abid; Ghulam Qadeer; Nasim Hasan Rama; Wai-Yeung Wong","5-Methoxyindan-1-one","Acta Crystallographica Section E","2007","63","1","o165","o166","10.1107/S1600536806052135","","","0.71073","MoKα","","0.044","0.039","","","0.117","0.124","","","","","","1.007","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211979","7.906","0.002","12.437","0.003","12.68","0.004","78.337","0.004","84.922","0.004","84.13","0.004","1211.7","0.6","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","(E)-2-(Thiosemicarbazonomethyl)pyridinium trichloro[(E)-1-(2-pyridylmethylene)thiosemicarbazonato-κ^3^N,N',S]indium(III) ethanol solvate","","- C16 H22 Cl3 In N8 O S2 -","- C16 H22 Cl3 In N8 O S2 -","- C32 H44 Cl6 In2 N16 O2 S4 -","2","1","XU2177","Fan, Ying-Ju; Wang, Le; Ma, Jian-Ping","(<i>E</i>)-2-(Thiosemicarbazonomethyl)pyridinium trichloro[(<i>E</i>)-1-(2-pyridylmethylene)thiosemicarbazonato-κ^3^<i>N</i>,<i>N</i>',<i>S</i>]indate(III) ethanol solvate","Acta Crystallographica Section E","2007","63","1","m261","m262","10.1107/S1600536806054079","","","0.71073","MoKα","","0.061","0.048","","","0.104","0.11","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211980","17.867","0.004","11.871","0.002","8.8912","0.0017","90","","115.793","0.003","90","","1697.9","0.6","292","2","292","2","","","","","","","","4","C 1 c 1","C -2yc","9","","Diethyl 6-(2-hydroxyethyl)-1,4-dioxo-2,2a,3,4,6,7-hexahydro-1H,5H- 2,3,4a,6,7a-pentaazacyclopenta[cd]indene-2a,7b-dicarboxylate","","- C14 H21 N5 O7 -","- C14 H21 N5 O7 -","- C56 H84 N20 O28 -","4","1","XU2178","Li, Yi-Tao; Li, Juan; Wen, Li-Li","Diethyl 6-(2-hydroxyethyl)-1,4-dioxo-2,2a,3,4,6,7-hexahydro-1<i>H</i>,5<i>H</i>-2,3,4a,6,7a-pentaazacyclopenta[<i>cd</i>]indene-2a,7b-dicarboxylate","Acta Crystallographica Section E","2007","63","1","o287","o288","10.1107/S1600536806053244","","","0.71073","MoKα","","0.072","0.05","","","0.115","0.152","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211981","5.0521","0.0001","6.9787","0.0002","31.151","0.0006","90","","90","","90","","1098.29","0.04","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,5-Dihydroxy-1-(3-nitrophenyl)pentan-3-one","","- C11 H13 N O5 -","- C11 H13 N O5 -","- C44 H52 N4 O20 -","4","1","XU2180","Long He","1,5-Dihydroxy-1-(3-nitrophenyl)pentan-3-one","Acta Crystallographica Section E","2007","63","1","o271","o272","10.1107/S1600536806053074","","","0.71073","MoKα","","0.027","0.027","","","0.073","0.073","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211982","8.0288","0.0002","17.3757","0.0003","11.1899","0.0003","90","","104.422","0.0014","90","","1511.86","0.06","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-Methyl-2-phenyl-3-(thiadiazol-2-yldiazenyl)-1H-indole","","- C17 H13 N5 S -","- C17 H13 N5 S -","- C68 H52 N20 S4 -","4","1","XU2181","Seferoğlu, Zeynel; Hökelek, Tuncer; Şahin, Ertan; Ertan , Nermin","1-Methyl-2-phenyl-3-(1,3,4-thiadiazol-2-yldiazenyl)-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","1","o148","o150","10.1107/S160053680605210X","","","0.71073","MoKα","","0.075","0.053","","","0.129","0.146","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211983","12.818","0.003","27.883","0.007","7.921","0.002","90","","90","","90","","2831","1.2","293","2","293","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","schisantherin A sesquihydrate","5,6-Dihydroxy-1,2,3,13-tetramethoxy-6,7-dimethyl-5,6,7,8- tetrahydrobenzo[3,4]cycloocta[1,2-f][1,3]benzodioxol-5-yl benzoate sesquihydrate","","- C30 H35 O10.5 -","- C30 H35 O10.5 -","- C120 H140 O42 -","4","1","XU2184","Ying Xiong; Wen-Yuan Gao; Ke-Zhong Deng; Hai-Xia Chen; Shu-Jun Wang","5,6-Dihydroxy-1,2,3,13-tetramethoxy-6,7-dimethyl-5,6,7,8-tetrahydrobenzo[3,4]cycloocta[1,2-<i>f</i>][1,3]benzodioxol-5-yl benzoate sesquihydrate","Acta Crystallographica Section E","2007","63","1","o333","o334","10.1107/S1600536806053359","","","0.71073","MoKα","","0.102","0.048","","","0.109","0.131","","","","","","0.998","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211984","8.7257","0.0002","10.307","0.0002","14.4948","0.0006","83.828","0.006","88.489","0.006","79.757","0.005","1275.35","0.07","294","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,2-Dimethyl-3-(thiazol-2-yldiazenyl)-1H-indole","","- C13 H12 N4 S -","- C13 H12 N4 S -","- C52 H48 N16 S4 -","4","2","XU2185","Seferoğlu, Zeynel; Hökelek, Tuncer; Şahin, Ertan; Ertan , Nermin","1,2-Dimethyl-3-(thiazol-2-yldiazenyl)-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","1","o351","o353","10.1107/S1600536806053943","","","0.71073","MoKα","","0.125","0.066","","","0.16","0.202","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211985","8.334","0.001","8.636","0.001","11.805","0.001","96.35","0.01","110.23","0.01","106.9","0.01","741.4","0.16","299","2","299","2","","","","","","","","5","P -1","-P 1","2","","2-Aminoquinolin-8-yl 4-p-toluenesulfonate","","- C16 H14 N2 O3 S -","- C16 H14 N2 O3 S -","- C32 H28 N4 O6 S2 -","2","1","YA2030","Silva, Luiz Everson da; Joussef, Antonio Carlos; Foro, Sabine; Schmidt, Boris","2-Aminoquinolin-8-yl <i>p</i>-toluenesulfonate","Acta Crystallographica Section E","2007","63","1","o72","o74","10.1107/S1600536806050896","","","1.5418","CuKα","","0.054","0.042","","","0.111","0.119","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211986","9.5409","0.0018","12.257","0.003","13.477","0.004","115.68","0.02","97.3","0.02","106.18","0.02","1307","0.7","303.1","","","","","","","","","","","5","P -1","-P 1","2","","Bis{2-[2-(hydroxymethyl)phenyliminomethyl]phenolato}cobalt(III) nitrate monohydrate","","- C28 H26 Co N3 O8 -","- C28 H26 Co N3 O8 -","- C56 H52 Co2 N6 O16 -","2","1","YA2034","Muto, Masahiro; Nakagawa, Natsumi; Koikawa, Masayuki; Tokii, Tadashi","Bis{2-[2-(hydroxymethyl)phenyliminomethyl]phenolato}cobalt(III) nitrate monohydrate","Acta Crystallographica Section E","2007","63","1","m64","m66","10.1107/S1600536806050938","","","0.71069","MoKα","","","0.036","","","","0.096","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211987","8.563","0.0017","9.91","0.002","28.694","0.006","90","","90","","90","","2435","0.9","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-(2,4-Dichlorophenyl)-1H-benzimidazole","","- C13 H8 Cl2 N2 -","- C13 H8 Cl2 N2 -","- C104 H64 Cl16 N16 -","8","1","YM2021","Fang-Fang Jian; Huan-Qing Yu; Yuan-Biao Qiao; Tong-Ling Liang; Pu-Su Zhao","2-(2,4-Dichlorophenyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","1","o321","o322","10.1107/S1600536806053384","","","0.71073","MoKα","","0.1346","0.0501","","","0.1243","0.1563","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211988","9.4304","0.0005","10.2266","0.0006","11.0438","0.001","109.246","0.002","107.972","0.002","99.024","0.002","915.99","0.11","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","trans-Carbonylchlorobis[(2-naphthyloxy)diphenylphosphine-κP]rhodium(I)","","- C45 H68 Cl O3 P2 Rh -","- C45 H34 Cl O3 P2 Rh -","- C45 H34 Cl O3 P2 Rh -","1","0.5","YM2041","Kirsten, Leo; Steyl, Elizabeth; Van der Westhuizen, Jan H.; Steyl, Gideon","<i>trans</i>-Carbonylchlorobis[(2-naphthyloxy)diphenylphosphine-κ<i>P</i>]rhodium(I)","Acta Crystallographica Section E","2007","63","1","m20","m22","10.1107/S1600536806050951","","","0.71073","MoKα","","0.029","0.025","","","0.0589","0.06","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211989","9.849","0.002","17.665","0.004","18.044","0.004","90","","90","","90","","3139.3","1.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Diisothiocyanatobis(1-vinyl-1<i>H</i>-imidazole-κN^3^)copper(II)","","- C12 H12 Cu N6 S2 -","- C12 H12 Cu N6 S2 -","- C96 H96 Cu8 N48 S16 -","8","1","AC2053","Wei-Hua Li; Hong-Na Chen; Guo-Hua Li; Fa-Qian Liu","Diisothiocyanatobis(1-vinyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II)","Acta Crystallographica Section E","2007","63","2","m519","m520","10.1107/S1600536807001274","","","0.71073","MoKα","","0.1002","0.0629","","","0.1529","0.1791","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211990","5.9765","0.0005","13.1069","0.001","7.276","0.0006","90","","99.829","0.007","90","","561.59","0.08","293","2","293","2","","","","","","","","6","P 1 c 1","P -2yc","7","","2,2'-Bipyridinium fluorotrioxochromate(VI)","","- C10 H9 Cr F N2 O3 -","- C10 H9 Cr F N2 O3 -","- C20 H18 Cr2 F2 N4 O6 -","2","1","AT2140","Özyürek, Cengiz; Şendil, Kıvılcım; Dilek, Nefise; Ocak Iskeleli, Nazan","2,2'-Bipyridinium fluorotrioxochromate(VI)","Acta Crystallographica Section E","2007","63","2","m613","m614","10.1107/S1600536806045648","","","0.71073","MoKα","","0.0331","0.0329","","","0.0861","0.0864","","","","","","1.058","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211991","9.6402","0.0011","5.5377","0.0006","12.5743","0.0015","90","","101.163","0.002","90","","658.57","0.13","90","1","90","1","","","","","","","","4","P 1 21 1","P 2yb","4","","(2R,3aS,8aR)-2-(4-Methoxyphenyl)-3,3a,8,8a-tetrahydro-2H-indeno[1,2-d]oxazole","","- C17 H17 N O2 -","- C17 H17 N O2 -","- C34 H34 N2 O4 -","2","1","AT2190","Uchida, Akira; Hattori, Tetsutaro; Yamaura, Masanori","(2<i>R</i>,3a<i>S</i>,8a<i>R</i>)-2-(4-Methoxyphenyl)-3,3a,8,8a-tetrahydro-2<i>H</i>-indeno[1,2-<i>d</i>]oxazole","Acta Crystallographica Section E","2007","63","2","o420","o421","10.1107/S1600536806054572","","","0.71073","MoKα","","0.0399","0.0324","","","0.0739","0.0778","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211992","10.76","0.003","16.179","0.004","10.261","0.003","90","","98.783","0.003","90","","1765.4","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichloro(N,N'-dibenzylethane-1,2-diamine-κ^2^N,N)zinc(II)","","- C16 H20 Cl2 N2 Zn -","- C16 H20 Cl2 N2 Zn -","- C64 H80 Cl8 N8 Zn4 -","4","1","AT2192","Liu, Y.-F.; Xia, H.-T.; Yang, S.-P.; Wang, D.-Q.","Dichloro(<i>N</i>,<i>N</i>'-dibenzylethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>)zinc(II)","Acta Crystallographica Section E","2007","63","2","m332","m334","10.1107/S1600536806054602","","","0.71073","MoKα","","0.0508","0.029","","","0.0607","0.0706","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211993","8.634","0.0017","10.343","0.002","9.16","0.0018","90","","115.04","0.03","90","","741.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(methylacryloyl)glycine","","- C6 H9 N O3 -","- C6 H9 N O3 -","- C24 H36 N4 O12 -","4","1","AT2194","Lv, Zhi-Fang; Gao, Xu-Sheng; Wu, Wen-Yuan; Gao, Xiao-Feng; Wang, Jin-Tang","<i>N</i>-(Methylacryloyl)glycine","Acta Crystallographica Section E","2007","63","2","o485","o486","10.1107/S1600536806054900","","","0.71073","MoKα","","0.0752","0.0526","","","0.1549","0.1696","","","","","","0.879","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211994","9.445","0.002","11.164","0.002","12.0678","0.0018","90","","124.877","0.011","90","","1043.9","0.4","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(μ-azido-κ^2^N:N)bis[azido(N,N-dimethyl-1,3-propylenediamine- κ^2^N,N)copper(II)]","","- C10 H28 Cu2 N16 -","- C10 H28 Cu2 N16 -","- C20 H56 Cu4 N32 -","2","0.5","AT2195","Wen-Xuan Cai; Hong Su; Yun-Long Feng","Bis(μ-azido-κ^2^<i>N</i>:<i>N</i>)bis[azido(<i>N</i>,<i>N</i>-dimethyl-1,3-propylenediamine-κ^2^<i>N</i>,<i>N</i>)copper(II)]","Acta Crystallographica Section E","2007","63","2","m501","m503","10.1107/S1600536807000980","","","0.71073","MoKα","","0.0366","0.025","","","0.0622","0.0659","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2211995","23.166","0.003","17.803","0.002","27.883","0.004","90","","110.116","0.003","90","","10798","2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[6,6'-dimethoxy-2,2'-(ethane-1,2-diyldiiminodimethylene)diphenol- κ^2^N,N',O,O']cerium(IV)","","- C36 H44 Ce N4 O8 -","- C36 H44 Ce N4 O8 -","- C432 H528 Ce12 N48 O96 -","12","3","AT2196","Liu, Y.-F.; Xia, H.-T.; Wang, D.-Q.; Yang, S.-P.","Bis[6,6'-dimethoxy-2,2'-(ethane-1,2-diyldiiminodimethylene)diphenolato-κ^2^<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>']cerium(IV)","Acta Crystallographica Section E","2007","63","2","m484","m486","10.1107/S1600536807000992","","","0.71073","MoKα","","0.1376","0.0409","","","0.068","0.0899","","","","","","0.936","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211996","9.879","0.002","10.443","0.002","10.941","0.003","68.26","0.003","85.659","0.003","84.541","0.004","1042.7","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","6,6'-Dimethoxy-2,2'-(2,2,4-trimethylimidazolidine-1,3- dimethyldimethylene)diphenol","","- C22 H30 N2 O4 -","- C22 H30 N2 O4 -","- C44 H60 N4 O8 -","2","1","AT2197","Xia, H.-T.; Liu, Y.-F.; Yang, S.-P.; Wang, D.-Q.","6,6'-Dimethoxy-2,2'-(2,2,4-trimethylimidazolidine-1,3-diyldimethylene)diphenol","Acta Crystallographica Section E","2007","63","2","o680","o682","10.1107/S1600536807001018","","","0.71073","MoKα","","0.1375","0.0549","","","0.108","0.1375","","","","","","0.95","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2211997","7.3142","0.0004","7.317","0.0003","13.5485","0.0006","80.791","0.007","82.639","0.007","86.33","0.007","709.14","0.06","113","2","113","2","","","","","","","","4","P -1","-P 1","2","","1,5-Dimethyl-2-phenyl-4-[(1H-pyrrol-2-ylmethylene)amino]pyrazol-3(2H)-one","","- C16 H16 N4 O -","- C16 H16 N4 O -","- C32 H32 N8 O2 -","2","1","AT2199","Jing, Zuo-Liang; Chen, Xin","1,5-Dimethyl-2-phenyl-4-[(1<i>H</i>-pyrrol-2-ylmethylene)amino]pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","2","o687","o688","10.1107/S1600536807001031","","","0.7107","MoKα","","0.0646","0.0444","","","0.1028","0.1206","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2211999","7.521","0.0015","9.456","0.0019","12.411","0.003","99.33","0.03","98.15","0.03","108.13","0.03","810.2","0.4","293","2","288","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 7-oxo-7H-indeno[2',1':3,4]pyrrolo[2,1-a]quinoline-12-carboxylate","","- C22 H15 N O3 -","- C22 H15 N O3 -","- C44 H30 N2 O6 -","2","1","AT2201","Yun Liu; Zhe Li; Yong-Miao Shen; Ye Zhang; Jian-Hua Xu","Ethyl 7-oxo-7<i>H</i>-indeno[2',1':3,4]pyrrolo[2,1-<i>a</i>]quinoline-12-carboxylate","Acta Crystallographica Section E","2007","63","2","o759","o760","10.1107/S1600536807001183","","","0.71073","MoKα","","0.087","0.052","","","0.1163","0.1285","","","","","","0.998","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212000","16.5921","0.0018","7.448","0.0007","25.297","0.002","90","","103.57","0.02","90","","3038.9","0.6","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Phenazine‒2,6-dihydroxybenzoic acid (1/1)","","- C19 H14 N2 O4 -","- C19 H14 N2 O4 -","- C152 H112 N16 O32 -","8","1","AT2202","Maria Gdaniec; Tadeusz Połoński","Phenazine‒2,6-dihydroxybenzoic acid (1/1)","Acta Crystallographica Section E","2007","63","2","o707","o709","10.1107/S1600536807001195","","","0.71073","MoKα","","0.0765","0.0484","","","0.104","0.1125","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212001","13.7432","0.0009","9.3259","0.0005","21.0744","0.0015","90","","94.476","0.006","90","","2692.8","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-(2,3-dimethylphenoxy)phthalonitrile","","- C16 H12 N2 O -","- C16 H12 N2 O -","- C128 H96 N16 O8 -","8","1","AT2203","Ağar, Ayşen","4-(2,3-Dimethylphenoxy)phthalonitrile","Acta Crystallographica Section E","2007","63","2","o883","o884","10.1107/S1600536807002255","","","0.71073","MoKα","","0.0473","0.0351","","","0.1051","0.1112","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212002","5.821","0.002","8.96","0.003","26.909","0.003","96.397","0.003","92.116","0.003","98.07","0.003","1378.9","0.7","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","N-Benzyl-2-(4-nitrophenoxy)acetamide","","- C15 H14 N2 O4 -","- C15 H14 N2 O4 -","- C60 H56 N8 O16 -","4","2","AT2204","Yu-Liang Zhang; Xiao-Hui Li","<i>N</i>-Benzyl-2-(4-nitrophenoxy)acetamide","Acta Crystallographica Section E","2007","63","2","o752","o753","10.1107/S1600536807001341","","","0.71073","MoKα","","0.1093","0.0481","","","0.102","0.13","","","","","","0.991","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212003","9.1342","0.0007","15.726","0.001","11.1749","0.0008","90","","103.055","0.003","90","","1563.72","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Piperidone","1-Acetyl-r-2,c-6-di-2-furyl-3,5-dimethylpiperidin-4-one","","- C17 H19 N O4 -","- C17 H19 N O4 -","- C68 H76 N4 O16 -","4","1","AT2205","Balamurugan, S; Thiruvalluvar, A; Manimekalai, A; Selvaraju, K; Maruthavanan, T","1-Acetyl-<i>r</i>-2,<i>c</i>-6-di-2-furyl-3,5-dimethylpiperidin-4-one","Acta Crystallographica Section E","2007","63","2","o789","o791","10.1107/S1600536807001936","","","0.71073","MoKα","","0.0813","0.0523","","","0.143","0.1643","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212004","7.71","0.001","21.608","0.002","9.075","0.001","90","","95.434","0.002","90","","1505.1","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis{4-nitro-2-[2-(isopropylamino)ethyliminomethyl]phenolato}copper(II) dinitrate","","- C24 H34 Cu N8 O12 -","- C24 H34 Cu N8 O12 -","- C48 H68 Cu2 N16 O24 -","2","0.5","AT2206","Chen-Yi Wang","Bis{2-[2-(isopropylamino)ethyliminomethyl]-4-nitrophenolato}copper(II) dinitrate","Acta Crystallographica Section E","2007","63","2","m489","m491","10.1107/S1600536807001353","","","0.71073","MoKα","","0.0654","0.048","","","0.1138","0.1232","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212005","9.2279","0.0006","21.9358","0.0013","12.7618","0.0008","90","","103.163","0.001","90","","2515.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1'-Methylacenapthylene-1(2H)-spiro-2'-pyrrolidine-3'-spiro-2''(3''H)- carbazole-2,1''(4''H)-dione","","- C33 H26 N2 O2 -","- C33 H26 N2 O2 -","- C132 H104 N8 O8 -","4","1","AT2208","B. K. Satis Kumar; D. Gayathri; D. Velmurugan; K. Ravikumar; G. Periyasami","1'-Methylacenapthylene-1(2<i>H</i>)-spiro-2'-pyrrolidine-3'-spiro-2''(3''<i>H</i>)-carbazole-2,1''(4''<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","2","o843","o845","10.1107/S1600536807002589","","","0.71073","MoKα","","0.0592","0.0505","","","0.1375","0.1459","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212006","9.4557","0.0008","11.75","0.001","12.3946","0.001","116.168","0.001","93.005","0.001","111.925","0.001","1106.9","0.16","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-(3-Methoxybenzoyl)-1',6,6-trimethyl-4,5,6,7- tetrahydrospiro[benzo[b]furan-2(3H),3'(2'H)-1H-indole]-4,2'-dione","","- C26 H25 N O5 -","- C26 H25 N O5 -","- C52 H50 N2 O10 -","2","1","AT2209","D. Gayathri; D. Velmurugan; K. Ravikumar; G. Savitha; P. T. Perumal","3-(3-Methoxybenzoyl)-1',6,6-trimethyl-4,5,6,7-tetrahydrospiro[benzo[<i>b</i>]furan-2(3<i>H</i>),3'(2'<i>H</i>)-1<i>H</i>-indole]-4,2'-dione","Acta Crystallographica Section E","2007","63","2","o846","o848","10.1107/S1600536807002590","","","0.71073","MoKα","","0.0498","0.0441","","","0.1183","0.1235","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212007","7.933","0.002","9.615","0.003","17.514","0.003","90","","97.973","0.005","90","","1323","0.6","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Benzyl-2H-1,4-benzoxazin-3(4H)-one","","- C15 H12 N2 O4 -","- C15 H12 N2 O4 -","- C60 H48 N8 O16 -","4","1","AT2210","Yu-Liang Zhang; Xiao-Hui Li","4-Benzyl-2<i>H</i>-1,4-benzoxazin-3(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","2","o987","o988","10.1107/S1600536807003613","","","0.71073","MoKα","","0.1036","0.0429","","","0.088","0.1182","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212008","9.6866","0.0003","12.6923","0.0004","12.8555","0.0005","94.444","0.001","101.673","0.001","107.322","0.001","1461.51","0.09","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","1-(3-Bromo-2-thienyl)-3-[4-(dimethylamino)phenyl]prop-2-en-1-one","","- C15 H14 Br N O S -","- C15 H14 Br N O S -","- C60 H56 Br4 N4 O4 S4 -","4","2","AT2215","Ray J. Butcher; Yathirajan, H. S.; Ashalatha, B. V.; Narayana, B.; Sarojini, B. K.","1-(3-Bromo-2-thienyl)-3-[4-(dimethylamino)phenyl]prop-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o1005","o1007","10.1107/S1600536807003789","","","0.71073","MoKα","","0.0507","0.0331","","","0.0791","0.0859","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212009","6.5756","0.0004","11.0565","0.0007","11.6622","0.0009","90","","90","","90","","847.88","0.1","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","L-(+)-bornesito","","- C7 H14 O6 -","- C7 H14 O6 -","- C28 H56 O24 -","4","1","AV3033","Denise C. Endringer; John M. Pezzuto; Cristiane M. Soares; Fernão C. Braga","<small>L</small>-(+)-Bornesitol","Acta Crystallographica Section E","2007","63","2","o1067","o1068","10.1107/S1600536806037019","","","0.71073","MoKα","","0.043","0.034","","","0.081","0.085","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212010","17.2299","0.0019","7.0635","0.0012","13.5311","0.0015","90","","109.629","0.008","90","","1551.1","0.4","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[(2,4-Dinitrophenyl)hydrozono](phenyl)acetaldehyde oxime monohydrate","","- C14 H13 N5 O6 -","- C14 H13 N5 O6 -","- C56 H52 N20 O24 -","4","1","AV3062","Ayşin Zülfikaroğlu; Hümeyra Batı; Nezihe Çalışkan; Çiğdem Yüksektepe; Orhan Büyükgüngör","[(2,4-Dinitrophenyl)hydrazono](phenyl)acetaldehyde oxime monohydrate","Acta Crystallographica Section E","2007","63","2","o582","o584","10.1107/S1600536806056327","","","0.71073","MoKα","","0.1653","0.0698","","","0.1076","0.134","","","","","","0.966","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212011","11.868","0.003","14.931","0.003","17.741","0.004","90","","90","","90","","3143.7","1.2","90","1","","","","","","","","","","6","P b c n","-P 2n 2ab","60","copper(II) octacyanomolybdate(IV) tetrahydrate","poly[triaquaocta-μ-cyano-dicopper(II)molybdate(IV) monohydrate]","","- C8 H8 Cu2 Mo N8 O4 -","- C8 Cu2 Mo N8 O4 -","- C64 Cu16 Mo8 N64 O32 -","8","1","BC3026","Zhang, Yue; Hozumi, Toshiya; Hashimoto, Kazuhito; Ohkoshi, Shin-ichi","Poly[triaquaocta-μ-cyano-dicopper(II)molybdate(IV) monohydrate]","Acta Crystallographica Section E","2007","63","2","i30","i32","10.1107/S1600536806056194","","","0.71075","MoKα","","","0.0366","","","","0.0987","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212012","8.78516","0.00015","9.09283","0.00017","7.2442","0.00012","90","","105.872","0.0009","90","","556.617","0.017","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","thallium(III) hydrogen diphosphate","","- H O7 P2 Tl -","- H O7 P2 Tl -","- H4 O28 P8 Tl4 -","4","1","BC3027","Ivashkevich, Ludmila S.; Selevich, Kirill A.; Lyakhov, Alexander S.; Selevich, Anatoly F.","TlHP~2~O~7~: structure determination from X-ray powder diffraction data","Acta Crystallographica Section E","2007","63","2","m38","m40","10.1107/S1600536806054778","","","1.5418","CuKα","","","","","","","","","","0.79","","","","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212013","5.968","0.001","4.786","0.001","9.012","0.002","90","","90","","90","","257.41","0.09","290","","290","","","","","","","","","3","P n n m","-P 2 2n","58","cadmium orthoborate","Tricadmium bis(borate)","","- B2 Cd3 O6 -","- B2 Cd3 O6 -","- B4 Cd6 O12 -","2","0.25","BC3031","Zhao, Ying-Hua; Chen, Xue-An; Chang, Xin-An; Zuo, Jian-Long; Li, Ming","Tricadmium bis(borate), Cd~3~(BO~3~)~2~","Acta Crystallographica Section E","2007","63","2","i50","i52","10.1107/S160053680700267X","","","0.71073","MoKα","","0.0386","0.0342","","","0.119","0.123","","","","","","1.189","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212014","31.9347","0.0014","6.4537","0.0003","22.7534","0.0011","90","","126.278","0.005","90","","3780.4","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[[aqua(2,2'-bipyridine-N,N')nickel(II)]-μ-3,5- dinitrosalicylate-κ^3^O,O':O''] 0.2-hydrate]","","- C17 H12.4 N4 Ni O8.2 -","- C17 H12 N4 Ni O8.2 -","- C136 H96 N32 Ni8 O65.6 -","8","1","BG2016","Wen-Dong Song; Xian-Xia Guo; Hong He","<i>catena</i>-Poly[[[aqua(2,2'-bipyridine-<i>N</i>,<i>N</i>')nickel(II)]-μ-3,5-dinitrosalicylato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>''] 0.2-hydrate]","Acta Crystallographica Section E","2007","63","2","m610","m612","10.1107/S1600536807003121","","","0.71073","MoKα","","0.0488","0.0353","","","0.0913","0.0986","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212015","22.582","0.005","12.222","0.002","6.9793","0.0014","90","","90","","90","","1926.3","0.7","100","2","100","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","6-Amino-2-naphthoic acid monohydrate","","- C11 H11 N O3 -","- C11 H11 N O3 -","- C88 H88 N8 O24 -","8","1","BH2066","Liu, Xiao-Gang; Chen, Tao","6-Amino-2-naphthoic acid monohydrate","Acta Crystallographica Section E","2007","63","2","o597","o598","10.1107/S1600536807000116","","","0.71073","MoKα","","0.0722","0.0512","","","0.1319","0.1411","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212016","6.638","0.0013","7.911","0.01","13.498","0.005","81.24","0.05","80.21","0.02","82.05","0.04","685.7","0.9","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","(RS)-2-(3,4-Methylenedioxyphenyl)-5-phenyl-3,6-dihydro-2H-pyran","","- C18 H16 O3 -","- C18 H16 O3 -","- C36 H32 O6 -","2","1","BH2073","Gardiner, Michael G.; Jones, Roderick C.; Mason, Celina M.; Smith, Jason A.","(<i>RS</i>)-2-(3,4-Methylenedioxyphenyl)-5-phenyl-3,6-dihydro-2<i>H</i>-pyran","Acta Crystallographica Section E","2007","63","2","o955","o957","10.1107/S1600536807003194","","","0.71073","MoKα","","0.0611","0.0442","","","0.1149","0.1253","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212017","7.768","0.0005","11.9121","0.0009","12.9065","0.0008","90","","107.129","0.004","90","","1141.31","0.14","173","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(2-Chlorophenyl)cyclohexanecarbonitrile","","- C13 H14 Cl N -","- C13 H14 Cl N -","- C52 H56 Cl4 N4 -","4","1","BH2074","Lemmerer, Andreas; Michael, Joseph P.","1-(2-Chlorophenyl)cyclohexanecarbonitrile","Acta Crystallographica Section E","2007","63","2","o916","o917","10.1107/S1600536807002917","","","0.71073","MoKα","","","0.0354","","","","0.0978","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212018","8.7424","0.0007","4.6275","0.0004","10.8189","0.0009","90","","98.885","0.001","90","","432.43","0.06","297","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(bromomethyl)benzene","","- C8 H8 Br2 -","- C8 H8 Br2 -","- C16 H16 Br4 -","2","0.5","BH2075","Zhang, Min; Su, Ping; Xu, Xing-Man","1,4-Bis(bromomethyl)benzene","Acta Crystallographica Section E","2007","63","2","o951","o952","10.1107/S1600536807002954","","","0.71073","Mokα","","0.0524","0.0475","","","0.1458","0.1486","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212019","7.865","0.0009","11.7892","0.0014","13.1101","0.0013","90","","106.531","0.005","90","","1165.3","0.2","173","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(2-Bromophenyl)cyclohexanecarbonitrile","","- C13 H14 Br N -","- C13 H14 Br N -","- C52 H56 Br4 N4 -","4","1","BH2080","Lemmerer, Andreas; Michael, Joseph P.","1-(2-Bromophenyl)cyclohexanecarbonitrile","Acta Crystallographica Section E","2007","63","2","o918","o919","10.1107/S1600536807002929","","","0.71073","MoKα","","","0.0293","","","","0.0716","","","","","","0.978","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212020","18.3264","0.0005","16.3163","0.0004","10.9066","0.0002","90","","90","","90","","3261.28","0.13","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Methanol{tris[2-(2-pyridylmethyleneamino)ethyl]amino-κ^7^N}calcium(II) bis(perchlorate) methanol solvate","","- C26 H35 Ca Cl2 N7 O10 -","- C26 H35 Ca Cl2 N7 O10 -","- C104 H140 Ca4 Cl8 N28 O40 -","4","1","BI2110","He, Hong-Shan","Methanol{tris[2-(2-pyridylmethyleneamino)ethyl]amino-κ^7^<i>N</i>}calcium(II) bis(perchlorate) methanol solvate","Acta Crystallographica Section E","2007","63","2","m521","m522","10.1107/S1600536807001626","","","0.71073","MoKα","","0.0602","0.054","","","0.1425","0.149","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212021","23.085","0.005","7.4913","0.0015","12.941","0.003","90","","99.286","0.003","90","","2208.6","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[potassium aquadi-μ-oxalato-neodymium(III) dihydrate]","","- C4 H6 K Nd O11 -","- C4 H6 K Nd O11 -","- C32 H48 K8 Nd8 O88 -","8","1","BI2114","Liu, Ying-Hong; Li, Su-Zhi","Poly[potassium aquadi-μ-oxalato-neodymium(III) dihydrate]","Acta Crystallographica Section E","2007","63","2","m312","m313","10.1107/S1600536806055231","","","0.71073","MoKα","","0.0701","0.0537","","","0.1147","0.1197","","","","","","1.281","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212022","7.9948","0.001","9.6751","0.001","15.8301","0.0008","90","","90","","90","","1224.5","0.2","299","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","trans-(1R,3S)-Methyl 1-methyl-1,2,3,4-tetrahydro-β-carboline-3-carboxylate","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C56 H64 N8 O8 -","4","1","BI2118","Alam, Samina; Hasan, Mashood; Saeed, Sadaf; Fischer, Andreas; Khan, Naeema","<i>trans</i>-(1<i>R</i>,3<i>S</i>)-Methyl 1-methyl-1,2,3,4-tetrahydro-β-carboline-3-carboxylate","Acta Crystallographica Section E","2007","63","2","o871","o872","10.1107/S1600536807002577","","","0.71073","MoKα","","0.0479","0.0355","","","0.0772","0.0833","","","","","","1.102","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212023","11.199","0.003","18.962","0.002","26.932","0.003","90","","90","","90","","5719.2","1.8","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","[2-(3,5-Dibromo-2-oxidobenzylamino)-3-phenylpropionato-κ^3^O,N,O'](1,10- phenanthroline-κ^2^N,N')manganese(II) dihydrate","","- C28 H25 Br2 Mn N3 O5 -","- C28 H25 Br2 Mn N3 O5 -","- C224 H200 Br16 Mn8 N24 O40 -","8","1","BI2119","Xia, Jin Hong; Feng, Xiao-Zhen; Jin, Li-Xia; Zhang, Shu-Hua; Zheng, Liu","[2-(3,5-Dibromo-2-oxidobenzylamino)-3-phenylpropionato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'](1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II) dihydrate","Acta Crystallographica Section E","2007","63","2","m353","m355","10.1107/S1600536806055619","","","0.71073","MoKα","","0.1455","0.0625","","","0.156","0.2119","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212024","8.6474","0.0011","13.5964","0.0018","21.632","0.003","90","","94.549","0.002","90","","2535.3","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(dicyanamidato-κN)(di-2-pyridylamine-κ^2^N,N')zinc(II)","","- C24 H18 N12 Zn -","- C24 H18 N12 Zn -","- C96 H72 N48 Zn4 -","4","0.5","BI2122","Xiao-Li Yu; Yong Fang; Cui-Ying Huang; Yuan-Peng Gu; Wan-Sheng You","Bis(dicyanamido-κ<i>N</i>)(di-2-pyridylamine-κ^2^<i>N</i>,<i>N</i>')zinc(II)","Acta Crystallographica Section E","2007","63","2","m358","m359","10.1107/S1600536806055747","","","0.71073","MoKα","","0.0797","0.0441","","","0.0941","0.108","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212025","19.3188","0.0002","9.5893","0.0001","14.2096","0.0002","90","","99.795","0.001","90","","2594.01","0.05","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[μ-2-Methyl-5-(methylsulfanylmethyl)azaferrocene]bis(pentacarbonyltungsten)","","- C22 H15 Fe N O10 S W2 -","- C22 H15 Fe N O10 S W2 -","- C88 H60 Fe4 N4 O40 S4 W8 -","4","1","BI2123","Kowalski, Konrad; White, Andrew J. P.","[μ-2-Methyl-5-(methylsulfanylmethyl)azaferrocene]bis(pentacarbonyltungsten)","Acta Crystallographica Section E","2007","63","2","m392","m393","10.1107/S1600536806056121","","","0.71073","MoKα","","0.0295","0.0249","","","0.0606","0.0629","","","","","","1.078","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212026","9.0005","0.0005","15.8848","0.0008","16.7023","0.001","61.286","0.004","78.137","0.005","83.419","0.005","2049.2","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","[μ-1,1'-Bis(2,4,6-trimethylbenzyl)-3,3'-(2,3,5,6-tetramethyl-p- phenylenedibenzimidazole)-2,2'-diylidene]di-μ-bromo-disilver(I)","","- C46 H50 Ag2 Br2 N4 -","- C46 H50 Ag2 Br2 N4 -","- C92 H100 Ag4 Br4 N8 -","2","1","BI2124","Koşar, Başak; Türkmen, Hayati; Çetinkaya, Bekir; Büyükgüngör, Orhan","[μ-1,1'-Bis(2,4,6-trimethylbenzyl)-3,3'-(2,3,5,6-tetramethyl-<i>p</i>-phenylenedibenzimidazole)-2,2'-diylidene]di-μ-bromo-disilver(I)","Acta Crystallographica Section E","2007","63","2","m619","m620","10.1107/S1600536806056273","","","0.71073","MoKα","","0.0568","0.0367","","","0.0821","0.0891","","","","","","1.015","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212027","7.4","0.0005","15.777","0.001","11.3155","0.0008","90","","101.196","0.001","90","","1295.94","0.15","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5,6-Methylenedioxy-3-methylsulfinyl-2-phenyl-1-benzofuran","","- C16 H12 O4 S -","- C16 H12 O4 S -","- C64 H48 O16 S4 -","4","1","BI2125","Choi, Hong Dae; Seo, Pil Ja; Lee, Hee Kyung; Son, Byeng Wha; Lee, Uk","5,6-Methylenedioxy-3-methylsulfinyl-2-phenylbenzofuran","Acta Crystallographica Section E","2007","63","2","o519","o520","10.1107/S1600536806055784","","","0.71073","MoKα","","0.0516","0.0486","","","0.116","0.1178","","","","","","1.098","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212028","10.5747","0.0003","8.0382","0.0001","15.0377","0.0004","90","","109.298","0.001","90","","1206.41","0.05","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H18 Br N O3 -","- C9 H18 Br N O3 -","- C36 H72 Br4 N4 O12 -","4","1","BI2126","Seethalakshmi, T.; Manivannan, S.; Lynch, Daniel E.; Dhanuskodi, S.; Kaliannan, P.","1-Ethyl-4-hydroxy-2,6-dimethylpyridinium bromide dihydrate","Acta Crystallographica Section E","2007","63","2","o599","o601","10.1107/S1600536807000232","","","0.71073","MoKα","","0.0277","0.0214","","","0.0477","0.052","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212029","7.886","0.003","22.445","0.009","8.268","0.003","90","","97.019","0.007","90","","1452.5","1","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Bromo-2-formyl-6-methoxyphenyl benzenesulfonate","","- C14 H11 Br O5 S -","- C14 H11 Br O5 S -","- C56 H44 Br4 O20 S4 -","4","1","BI2128","Chen, Xin; Yu, Ming","4-Bromo-2-formyl-6-methoxyphenyl benzenesulfonate","Acta Crystallographica Section E","2007","63","2","o646","o647","10.1107/S1600536807000517","","","0.71073","MoKα","","0.0518","0.0335","","","0.0781","0.0863","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212030","6.685","0.0008","9.7739","0.0012","13.2657","0.0018","90","","93.136","0.007","90","","865.46","0.19","123","1","123","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Cu(2-CO2-3-CO2H-py)].2MeOH","Poly[[copper(II)-bis(μ-3-carboxypyridine-2-carboxylato- κ^3^N,O^2^:O^3^)copper(II)] methanol disolvate]","","- C16 H16 Cu N2 O10 -","- C16 H16 Cu N2 O10 -","- C32 H32 Cu2 N4 O20 -","2","0.5","BI2129","Turner, David R.; Batten, Stuart R.","<i>catena</i>-Poly[[copper(II)-bis(μ-3-carboxypyridine-2-carboxylato)-κ^3^<i>N</i>,<i>O</i>^2^:<i>O</i>^3^;κ^3^<i>O</i>^3^:<i>N</i>,<i>O</i>^2^] methanol disolvate]","Acta Crystallographica Section E","2007","63","2","m452","m454","10.1107/S1600536807000499","","","0.71073","MoKα","","0.0396","0.0338","","","0.0785","0.0814","","","","","","1.103","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212031","14.8754","0.0007","12.3883","0.0006","18.4518","0.0009","90","","107.875","0.001","90","","3236.2","0.3","120","","120","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","CoBPABTA diperchlorate hydrate","{2,6-Bis[bis(2-pyridylmethyl)amino]methylpyridine}cobalt(II) bis(perchlorate) 0.365-hydrate","","- C31 H31.73 Cl2 Co N7 O8.365 -","- C31 H31.73 Cl2 Co N7 O8.365 -","- C124 H126.92 Cl8 Co4 N28 O33.46 -","4","1","BI2131","Alan Hazell; Hans Toftlund","{2,6-Bis[bis(2-pyridylmethyl)aminomethyl]pyridine}cobalt(II) bis(perchlorate) 0.365-hydrate","Acta Crystallographica Section E","2007","63","2","m326","m327","10.1107/S1600536806056157","","","0.71073","MoKα","","","0.031","","","","0.034","","","","","","1.016","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212032","14.9038","0.0009","12.3825","0.0008","18.647","0.001","90","","108.733","0.001","90","","3258.9","0.3","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","MnBPABTA diperchlorate hydrate","{2,6-Bis[bis(2-pyridylmethyl)amino]methylpyridine}manganese(II) bis(perchlorate) 0.435-hydrate","","- C31 H31.87 Cl2 Mn N7 O8.435 -","- C31 H31.87 Cl2 Mn N7 O8.435 -","- C124 H127.48 Cl8 Mn4 N28 O33.74 -","4","1","BI2132","Alan Hazell; Hans Toftlund","{2,6-Bis[bis(2-pyridylmethyl)aminomethyl]pyridine}manganese(II) bis(perchlorate) 0.435-hydrate","Acta Crystallographica Section E","2007","63","2","m328","m329","10.1107/S1600536806056169","","","0.71073","MoKα","","","0.035","","","","0.037","","","","","","1.038","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212033","8.4973","0.0002","10.1959","0.0004","12.0545","0.0004","92.132","0.002","101.54","0.002","95.55","0.002","1016.75","0.06","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","N-[2-(Aminocarbonyl)phenyl]-4-hydroxy-2-methyl-2H-1,2-benzothiazine- 3-carboxamide-1,1-dioxide dimethyl sulfoxide solvate","","- C19 H21 N3 O6 S2 -","- C19 H21 N3 O6 S2 -","- C38 H42 N6 O12 S4 -","2","1","BI2133","Zia-ur-Rehman, Muhammad; Choudary, Jamil Anwar; Elsegood, Mark R. J.; Siddiqui, Hamid Latif; Ahmad, Saeed","<i>N</i>-[2-(Aminocarbonyl)phenyl]-4-hydroxy-2-methyl-2<i>H</i>-1,2-benzothiazine-3-carboxamide 1,1-dioxide dimethyl sulfoxide solvate","Acta Crystallographica Section E","2007","63","2","o900","o901","10.1107/S1600536807002309","","","0.71073","MoKα","","0.0709","0.0412","","","0.0927","0.1053","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212034","19.463","0.003","6.391","0.002","20.302","0.002","90","","91.522","0.003","90","","2524.4","0.9","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Aqua(2,2'-bipyridyl-κ^2^N,N'){2-[(3,5-dichloro-2-oxidobenzylidene)amino]- 3-methylpentanoato-κ^3^N,O,O'}copper(II) 2.5-hydrate","","- C23 H26 Cl2 Cu N3 O5.5 -","- C46 H52 Cl4 Cu2 N6 O11 -","- C92 H104 Cl8 Cu4 N12 O22 -","2","1","BI2135","Feng, Xiao-Zhen; Zhang, Shu-Hua; Liu, Zheng; Li, Guang-Zhao; Jin, Li-Xia","Aqua(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>'){2-[(3,5-dichloro-2-oxidobenzylidene)amino]-3-methylpentanoato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>'}copper(II) 2.5-hydrate","Acta Crystallographica Section E","2007","63","2","m529","m531","10.1107/S1600536807001882","","","0.71073","MoKα","","0.1114","0.0664","","","0.1287","0.1465","","","","","","0.991","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212035","12.6197","0.0006","12.8711","0.0006","23.497","0.001","82.079","0.001","79.725","0.001","88.113","0.001","3719.4","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","catena-Poly[[μ-bis(diphenylphosphino)amine- κ^2^P:P']bis[acetonitrilecopper(I)]]-μ-(1,2-dicyanoethylene-1,2-dithiolato)- [(1,2-dicyanoethylene-1,2-dithiolato)molybdenate(IV)]-μ-1,2-dicyanoethylene- 1,2-dithiolato] acetonitrile disolvate","","- C68 H48 Cu2 Mo N12 P4 S6 -","- C68 H48 Cu2 Mo N12 P4 S6 -","- C136 H96 Cu4 Mo2 N24 P8 S12 -","2","1","BI2137","Wei-Wei Fu; Zai-Lai Xie; Zhong-Ning Chen","<i>catena</i>-Poly[[[[μ-bis(diphenylphosphino)amine-κ^2^<i>P</i>:<i>P</i>']bis[acetonitrilecopper(I)]]-μ-(1,2-dicyanoethylene-1,2-dithiolato)-[(1,2-dicyanoethylene-1,2-dithiolato)molybdenate(IV)]-μ-1,2-dicyanoethylene-1,2-dithiolato] acetonitrile disolvate]","Acta Crystallographica Section E","2007","63","2","m509","m511","10.1107/S1600536807001894","","","0.71073","MoKα","","0.0965","0.062","","","0.1113","0.1309","","","","","","1.233","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212036","7.5137","0.0005","7.9384","0.0005","14.3761","0.001","75.422","0.003","87.976","0.004","70.805","0.004","782.69","0.09","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","Bis{μ-2-[bis(2-hydroxyethyl)amino]ethanolato}bis(4-methylbenzoato)dicopper(II) dihydrate","","- C28 H46 Cu2 N2 O12 -","- C28 H46 Cu2 N2 O12 -","- C28 H46 Cu2 N2 O12 -","1","0.5","BI2138","Kirillov, Alexander M.; Haukka, Matti; Kopylovich, Maximilian N.; Pombeiro, Armando J. L.","Bis{μ-2-[bis(2-hydroxyethyl)amino]ethanolato}bis(4-methylbenzoato)dicopper(II) dihydrate","Acta Crystallographica Section E","2007","63","2","m526","m528","10.1107/S1600536807001687","","","0.71073","MoKα","","0.0588","0.0398","","","0.0797","0.086","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212037","11.44","0.003","10.362","0.003","12.14","0.004","90","","113.697","0.004","90","","1317.8","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(tetramethylammonium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)copper(II)","","- C14 H24 Cu N2 S10 -","- C14 H24 Cu N2 S10 -","- C28 H48 Cu2 N4 S20 -","2","0.5","BI2139","Wang, Yan-Ling; Yu, Wen-Tao; Xu, Dong","Bis(tetramethylammonium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)cuprate(II)","Acta Crystallographica Section E","2007","63","2","m591","m592","10.1107/S1600536807003297","","","0.71073","MoKα","","0.0628","0.0496","","","0.1285","0.1406","","","","","","0.927","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212038","10.4454","0.0006","22.8701","0.0013","10.7218","0.0006","90","","108.501","0.001","90","","2428.9","0.2","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(η5-methylcyclopentadienyl)[η5-2-(diphenylphosphino) methylcyclopentadienyl]cobalt(III) hexafluorophosphate","","- C24 H23 Co F6 P2 -","- C24 H23 Co F6 P2 -","- C96 H92 Co4 F24 P8 -","4","1","BI2141","Chen, Yan; Yu, Guang-Ao; Meng, Xiang-Gao; Liu, Sheng-Hua","[η^5^-2-(Diphenylphosphino)-1-methylcyclopentadienyl](η^5^-methylcyclopentadienyl)cobalt(III) hexafluorophosphate","Acta Crystallographica Section E","2007","63","2","m572","m573","10.1107/S1600536807002759","","","0.71073","MoKα","","0.0695","0.0531","","","0.134","0.1443","","","","","","1.052","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212039","7.4863","0.0016","12.825","0.002","10.846","0.002","90","","97.418","0.016","90","","1032.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Bis(creatininium) 2,5-dicarboxybenzene-1,4-dicarboxylate","Bis(creatininium) 2,5-dicarboxybenzene-1,4-dicarboxylate","","- C18 H20 N6 O10 -","- C18 H20 N6 O10 -","- C36 H40 N12 O20 -","2","0.5","BI2143","Tabatabaee, Masoumeh; Ghassemzadeh, Mitra; Jafari, Padideh; Khavasi, Hamid Reza","Bis(creatininium) 2,5-dicarboxybenzene-1,4-dicarboxylate","Acta Crystallographica Section E","2007","63","2","o1001","o1002","10.1107/S160053680700325X","","","0.71073","MoKα","","0.0524","0.0449","","","0.1087","0.1129","","","","","","1.114","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212040","9.4025","0.0003","13.6395","0.0005","10.5395","0.0004","90","","91.956","0.002","90","","1350.85","0.08","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","butylammonium 1,3,5,7,9,11-hexaoxa-2,4,8,10-tetrabora-6-boroniaspiro[5.5]undecane- 2,4,8,10-tetraol","","- C4 H16 B5 N O10 -","- C4 H16 B5 N O10 -","- C16 H64 B20 N4 O40 -","4","1","BI2144","Chun-Yang Pan; Guo-Ming Wang; Shou-Tian Zheng; Guo-Yu Yang","Butylammonium tetrahydroxopentaborate","Acta Crystallographica, Section E","2007","63","2","i45","i47","10.1107/S1600536807001961","","","0.71073","MoKα","","0.0645","0.0545","","","0.1368","0.1446","","","","","","1.065","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2212041","4.6955","0.0015","20.383","0.003","18.439","0.002","90","","97.105","0.002","90","","1751.2","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(3,5-Dichloro-2-oxidobenzoato-κ^2^O,O')(1,10-phenanthroline- κ^2^N,N')copper(II) monohydrate","","- C19 H12 Cl2 Cu N2 O4 -","- C19 H12 Cl2 Cu N2 O4 -","- C76 H48 Cl8 Cu4 N8 O16 -","4","1","BI2145","Zhang, Shu-Hua; Feng, Xiao-Zhen; Li, Guang-Zhao; Jing, Li-Xia; Liu, Zheng","(3,5-Dichloro-2-oxidobenzoato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) monohydrate","Acta Crystallographica Section E","2007","63","2","m535","m536","10.1107/S160053680700195X","","","0.71073","MoKα","","0.0783","0.0458","","","0.0953","0.1107","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212042","12.707","0.003","7.2186","0.0014","19.88","0.004","90","","95.348","0.004","90","","1815.6","0.7","290","2","290","","","","","","","","","3","P 1 2/n 1","-P 2yac","13","curcumin","(1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-one","","- C21 H20 O6 -","- C21 H20 O6 -","- C84 H80 O24 -","4","1","BI2146","Sahoo Prangya Parimita; Yadav Vivek Ramshankar; Sarasija Suresh; Guru Row, T. N.","Redetermination of curcumin: (1<i>E</i>,4<i>Z</i>,6<i>E</i>)-5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-one","Acta Crystallographica Section E","2007","63","2","o860","o862","10.1107/S160053680700222X","","","0.71073","MoKα","","0.1441","0.0618","","","0.1126","0.1433","","","","","","0.994","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212043","8.81","0.0012","4.2247","0.0006","16.191","0.002","90","","93.235","0.002","90","","601.66","0.14","100","2","100","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","Hexaiodobenzene","Hexaiodobenzene","","- C6 I6 -","- C6 I6 -","- C12 I12 -","2","0.5","BI2147","Sandip Ghosh; C. Malla Reddy; Gautam R. Desiraju","Hexaiodobenzene: a redetermination at 100K","Acta Crystallographica Section E","2007","63","2","o910","o911","10.1107/S1600536807002279","","","0.71073","MoKα","","0.0222","0.0215","","","0.0515","0.0519","","","","","","1.235","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212044","22.1421","0.0002","7.0559","0.0013","19.5604","0.0011","90","","90","","90","","3056","0.6","120","2","120","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","Ethyl 3,5-bis(allyloxy)-4-bromobenzoate","","- C15 H17 Br O4 -","- C15 H17 Br O4 -","- C120 H136 Br8 O32 -","8","1","BI2149","Kirsop, Peter; Storey, John M. D.; Harrison, William T. A.","Ethyl 3,5-bis(allyloxy)-4-bromobenzoate","Acta Crystallographica Section E","2007","63","2","o833","o835","10.1107/S1600536807002383","","","0.71073","MoKα","","0.0848","0.0515","","","0.0764","0.0843","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212045","18.372","0.004","6.7816","0.0014","16.833","0.003","90","","90","","90","","2097.2","0.7","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","2,6-Di-tert-butyl-4-[(1-methyl-1H-benzimidazol-2-yl)imino]cyclohexa- 2,5-dien-1-one","","- C22 H27 N3 O -","- C22 H27 N3 O -","- C88 H108 N12 O4 -","4","0.5","BI2151","Oleg Ya. Borbulevych","2,6-Di-<i>tert</i>-butyl-4-[(1-methyl-1<i>H</i>-benzimidazol-2-yl)imino]cyclohexa-2,5-dien-1-one","Acta Crystallographica Section E","2007","63","2","o976","o977","10.1107/S1600536807003315","","","0.71073","MoKα","","0.149","0.0638","","","0.1715","0.2144","","","","","","0.996","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212046","5.3306","0.0003","5.8205","0.0003","7.3835","0.0004","92.034","0.003","103.313","0.003","99.237","0.003","219.41","0.02","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- Fe H10 N4 O8 S2 -","- Fe H10 N4 O8 S2 -","- Fe H10 N4 O8 S2 -","1","0.5","BR2024","Srinivasan, Krishnan; Govindarajan, Subbaiah; Harrison, William T. A.","Iron(II) hydrazinium sulfate","Acta Crystallographica Section E","2007","63","2","i41","i42","10.1107/S1600536806056509","","","0.71073","MoKα","","0.0373","0.032","","","0.0721","0.0756","","","","","","1.115","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212047","9.1922","0.0012","7.4198","0.0009","5.5002","0.0007","90","","90","","90","","375.14","0.08","167","1","167","2","","","","","","","","3","C m c m","-C 2c 2","63","disodium zinc germanide","disodium zinc germanide","","- Ge Na2 Zn -","- Ge Na2 Zn -","- Ge4 Na8 Zn4 -","4","0.25","BR2027","Cheviré, François; DiSalvo, Francis J.","Na~2~ZnGe","Acta Crystallographica, Section E","2007","63","2","m62","m63","10.1107/S1600536807003972","","","0.71073","MoKα","","0.0188","0.0157","","","0.0329","0.0334","","","","","","1.122","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2212048","11.3299","0.0002","19.1104","0.0003","19.7235","0.0004","90","","102.039","0.001","90","","4176.58","0.13","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5,5-Dimethyl-2,2-bis(pentafluorophenyl)-4,4,6,6-tetrakis(trimethylsilyl)- 1,3-dioxa-4,5,6-trisila-2-titanacyclohexane","","- C26 H42 F10 O2 Si7 Ti -","- C26 H42 F10 O2 Si7 Ti -","- C104 H168 F40 O8 Si28 Ti4 -","4","1","BT2222","Krempner, Clemens; Weichert, Katja; Reinke, Helmut","5,5-Dimethyl-2,2-bis(pentafluorophenyl)-4,4,6,6-tetrakis(trimethylsilyl)-1,3-dioxa-4,5,6-trisila-2-titanacyclohexane","Acta Crystallographica Section E","2007","63","2","m356","m357","10.1107/S1600536806054547","","","0.71073","MoKα","","0.043","0.0364","","","0.0881","0.0985","","","","","","1.082","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212049","7.8378","0.0006","11.647","0.001","11.938","0.001","90","","101.03","0.001","90","","1069.65","0.15","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquatetrasodium(I) pentaoxalatodicerate(III)","","- C10 H4 Ce2 Na4 O22 -","- C10 H4 Ce2 Na4 O22 -","- C20 H8 Ce4 Na8 O44 -","2","0.5","BT2223","Lu, Hui; Fu, Yun-Long; Yang, Jun-Ying; Ng, Seik Weng","Tetrasodium(I) pentaoxalatodicerate(III) dihydrate","Acta Crystallographica Section E","2007","63","2","m319","m320","10.1107/S1600536806054560","","","0.71073","MoKα","","0.031","0.026","","","0.064","0.083","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212050","7.841","0.0004","11.699","0.0007","12.0084","0.0007","90","","100.943","0.001","90","","1081.52","0.11","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquatetrasodium(I) pentaoxalatodilanthanate(III)","","- C10 H4 La2 Na4 O22 -","- C10 H4 La2 Na4 O22 -","- C20 H8 La4 Na8 O44 -","2","0.5","BT2225","Lu, Hui; Fu, Yun-Long; Yang, Jun-Ying; Ng, Seik Weng","Tetrasodium(I) pentaoxalatodilanthanate(III) dihydrate","Acta Crystallographica Section E","2007","63","2","m316","m318","10.1107/S1600536806054559","","","0.71073","MoKα","","0.029","0.025","","","0.06","0.08","","","","","","1.23","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212051","12.9869","0.0007","7.9512","0.0004","17.0466","0.0009","90","","99.07","0.001","90","","1738.25","0.16","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-tert-Butyl-5-(2,4,5-trimethoxybenzyl)thiazol-2-amine","","- C17 H24 N2 O3 S -","- C17 H24 N2 O3 S -","- C68 H96 N8 O12 S4 -","4","1","BT2227","Juan-Juan Xu; Ai-Xi Hu; Gao Cao","4-<i>tert</i>-Butyl-5-(2,4,5-trimethoxybenzyl)thiazol-2-amine","Acta Crystallographica Section E","2007","63","2","o533","o534","10.1107/S1600536806055589","","","0.71073","MoKα","","0.0589","0.0419","","","0.1069","0.1186","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212052","9.9905","0.0008","14.9348","0.0013","14.1194","0.001","90","","104.052","0.009","90","","2043.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N',N''-Triphenylguanidinium trifluoroacetate","","- C21 H18 F3 N3 O2 -","- C21 H18 F2.997 N3 O2 -","- C84 H72 F11.988 N12 O8 -","4","1","BT2230","Pereira Silva, P. S.; Cardoso, C.; Ramos Silva, M.; Paixão, J. A.","<i>N</i>,<i>N</i>',<i>N</i>''-Triphenylguanidinium trifluoroacetate","Acta Crystallographica Section E","2007","63","2","o501","o503","10.1107/S1600536806055899","","","0.71073","MoKα","","0.1981","0.0728","","","0.1849","0.2466","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212053","3.6392","0.0005","14.446","0.002","8.859","0.001","90","","98.876","0.001","90","","460.16","0.1","295","2","295","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Sodium 3,5-dinitropyridin-4-olate dihydrate","","- C5 H6 N3 Na O7 -","- C5 H6 N3 Na O7 -","- C10 H12 N6 Na2 O14 -","2","0.5","BT2232","Fan, Rong; Li, Dong-Dong; She, Jiang-Bo; Zhang, Guo-Fang; Ng, Seik Weng","Sodium 3,5-dinitropyridin-4-olate dihydrate","Acta Crystallographica Section E","2007","63","2","m321","m322","10.1107/S1600536806055590","","","0.71073","MoKα","","0.049","0.044","","","0.127","0.132","","","","","","1.1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212054","23.6451","0.0011","32.1149","0.0015","18.3528","0.0009","90","","116.586","0.001","90","","12462.8","1","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","tetrabutylammonium chloroheptaisobutyldodeca-μ-oxo-heptasiliconferrate","","- C44 H99 Cl Fe N O12 Si7 -","- C44 H99 Cl Fe N O12 Si7 -","- C352 H792 Cl8 Fe8 N8 O96 Si56 -","8","1","BT2233","Hay, Michael T.; Geib, Steven J.","Tetrabutylammonium isobutyl silsesquioxane monochloroferrate(III)","Acta Crystallographica Section E","2007","63","2","m445","m446","10.1107/S1600536807000360","","","0.71073","MoKα","","0.0928","0.0667","","","0.162","0.1702","","","","","","1.288","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212055","7.5332","0.0019","8.349","0.002","12.989","0.003","90","","100.062","0.004","90","","804.4","0.3","294","2","294","2","","","","","","","","5","P 1 21 1","P 2yb","4","Voriconazole","2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1H-1,2,4-triazol-1-yl) butan-2-ol","","- C16 H14 F3 N5 O -","- C16 H14 F3 N5 O -","- C32 H28 F6 N10 O2 -","2","1","BT2234","K. Ravikumar; B. Sridhar; K. Durga Prasad; A. K. S. Bhujanga Rao","Voriconazole, an antifungal drug","Acta Crystallographica Section E","2007","63","2","o565","o567","10.1107/S1600536807000074","","","0.71073","MoKα","","0.0635","0.0594","","","0.154","0.1607","","","","","","1.199","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212056","7.864","0.005","7.97","0.004","9.116","0.005","94.095","0.007","107.198","0.008","112.263","0.008","494.1","0.5","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","1,1'-ethane-1,2-diylbis(pentabromobenzene)","","- C14 H4 Br10 -","- C14 H4 Br10 -","- C14 H4 Br10 -","1","0.5","BT2235","Köppen, Robert; Emmerling, Franziska; Becker, Roland","Decabromodiphenylethane","Acta Crystallographica Section E","2007","63","2","o585","o586","10.1107/S1600536807000219","","","0.71073","MoKα","","0.0787","0.0435","","","0.1045","0.1212","","","","","","1.022","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212057","7.5183","0.0004","19.5789","0.0009","10.522","0.0005","90","","108.556","0.001","90","","1468.32","0.12","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 Cl4 N2 Sn -","- C12 H8 Cl4 N2 Sn -","- C48 H32 Cl16 N8 Sn4 -","4","1","BT2236","Su, Zhan-Hua; Zhou, Bai-Bin; Zhao, Zhi-Feng; Ng, Seik Weng","Tetrachloro(1,10-phenanthroline-<i>{κ</i>}^2^<i>N</i>,<i>N</i>')tin(IV)","Acta Crystallographica Section E","2007","63","2","m394","m395","10.1107/S1600536807000190","","","0.71073","MoKα","","0.029","0.024","","","0.062","0.066","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212058","7.743","0.002","8.133","0.002","13.718","0.004","74.57","0.02","85.06","0.02","68.06","0.02","772.3","0.4","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","2-Ethyl-4-hydroxy-3a,4,9,9a-tetrahydro-4,9-[1',2']benzeno-1H-benz[f]isoindole- 1,3(2H)-dione","","- C20 H17 N O3 -","- C20 H17 N O3 -","- C40 H34 N2 O6 -","2","1","BT2237","He, Long; Ng, Seik Weng","2-Ethyl-4-hydroxy-3a,4,9,9a-tetrahydro-4,9-[1',2']benzeno-1<i>H</i>-benz[<i>f</i>]isoindole-1,3(2<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","2","o602","o603","10.1107/S1600536807000384","","","0.71073","MoKα","","0.083","0.042","","","0.107","0.118","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212059","17.353","0.0003","21.8357","0.0004","21.2915","0.0003","90","","96.502","0.001","90","","8015.8","0.2","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","Bis[μ-bis(diphenylphosphino)methane-κ^2^P:P']acetonitriledicopper(I) tris(1,2-dicyanoethylene-1,2-dithiolato)tungsten(IV)‒diethyl ether‒acetonitile (1/2/1)","","- C74 H70 Cu2 N8 O2 P4 S6 W -","- C74 H70 Cu2 N8 O2 P4 S6 W -","- C296 H280 Cu8 N32 O8 P16 S24 W4 -","4","1","BT2238","Wei-Wei Fu; Zhong-Ning Chen","<i>catena</i>-Poly[[[acetonitrilebis[μ-bis(diphenylphosphino)methane-κ^2^<i>P</i>:<i>P</i>']dicopper(I)]-μ-(1,2-dicyanoethylene-1,2-dithiolato)-[(1,2-dicyanoethylene-1,2-dithiolato)tungstate(IV)]-μ-(1,2-dicyanoethylene-1,2-dithiolato)] diethyl ether disolvate acetonitrile solvate]","Acta Crystallographica Section E","2007","63","2","m482","m483","10.1107/S1600536807000979","","","0.71073","MoKα","","0.0996","0.0542","","","0.1015","0.1243","","","","","","1.2","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212060","7.0898","0.0006","17.204","0.002","9.9894","0.0009","90","","110.072","0.002","90","","1144.43","0.19","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H24 Cl2 N4 O12 -","- C16 H24 Cl2 N4 O12 -","- C32 H48 Cl4 N8 O24 -","2","0.5","BT2239","Yu, Qiong-Yan; Cai, Yue-Peng; Ng, Seik Weng","2,2'-(Ethane-1,2-diyl)dibenzimidazolium bis(perchlorate) tetrahydrate","Acta Crystallographica Section E","2007","63","2","o881","o882","10.1107/S1600536807000761","","","0.71073","MoKα","","0.086","0.069","","","0.201","0.218","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212061","7.2186","0.0008","8.318","0.001","11.5374","0.0013","103.142","0.01","99.418","0.009","101.976","0.009","643.57","0.14","296","","293","2","","","","","","","","5","P -1","-P 1","2","","N-[4-Methoxyphenyl)sulfanyl]phthalimide","","- C15 H11 N O2 S -","- C15 H11 N O2 S -","- C30 H22 N2 O4 S2 -","2","1","BT2241","Yazıcı, Serap; Nalan, Türköz; Kütük, Halil; Şenel, İsmet; Büyükgüngör, Orhan","<i>N</i>-[(4-Methylphenyl)sulfanyl]phthalimide","Acta Crystallographica Section E","2007","63","2","o804","o805","10.1107/S1600536807001948","","","0.71073","MoKα","","0.0498","0.0406","","","0.1028","0.1088","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212062","22.5716","0.0015","7.1742","0.0004","15.4336","0.0009","90","","97.093","0.002","90","","2480.1","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-(2-Hydroxy-5-methylbenzylideneammonio)benzoate","","- C15 H13 N O3 -","- C15 H13 N O3 -","- C120 H104 N8 O24 -","8","1","BT2242","D. Gayathri; D. Velmurugan; K. Ravikumar; S. Devaraj; M. Kandaswamy","2-(2-Hydroxy-5-methylbenzylideneammonio)benzoate","Acta Crystallographica Section E","2007","63","2","o849","o851","10.1107/S1600536807001869","","","0.71073","MoKα","","0.0613","0.0529","","","0.1495","0.1575","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212063","5.5815","0.0018","7.352","0.002","12.579","0.004","90","","90","","90","","516.2","0.3","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","3,4-diaminopyridine","3,4-diaminopyridine","","- C5 H7 N3 -","- C5 H7 N3 -","- C20 H28 N12 -","4","1","BT2244","Rubin-Preminger, Janice M.; Englert, Ulli","3,4-Diaminopyridine","Acta Crystallographica Section E","2007","63","2","o757","o758","10.1107/S1600536807001444","","","0.71073","MoKα","","0.0416","0.0363","","","0.0786","0.0806","","","","","","1.089","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212064","12.01","0.006","9.58","0.005","17.098","0.007","90","","121.2","0.03","90","","1682.7","1.5","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(η^4^-Norbornadiene)bis(tetrahydrofuran-κO)rhodium(I) tetrafluoroborate","","- C15 H24 B F4 O2 Rh -","- C15 H24 B F4 O2 Rh -","- C60 H96 B4 F16 O8 Rh4 -","4","1","BT2245","Braun, Wolfgang; Calmuschi-Cula, Beatrice; Salzer, Albrecht","(η^4^-Norbornadiene)bis(tetrahydrofuran-κ<i>O</i>)rhodium(I) tetrafluoroborate","Acta Crystallographica Section E","2007","63","2","m517","m518","10.1107/S1600536807001845","","","0.71073","MoKα","","0.0404","0.0324","","","0.0851","0.0904","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212065","8.642","0.0017","9.098","0.0018","10.924","0.002","84.08","0.03","72.59","0.03","79.42","0.03","804.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3,5-Dimethyl-N-[5-(3-tolyl)-1,3,4-thiadiazol-2-yl]benzamide","","- C18 H17 N3 O S -","- C18 H17 N3 O S -","- C36 H34 N6 O2 S2 -","2","1","BT2247","Wan, Rong; Han, Feng; Zhang, Jin-Jun; Cao, Lin; Wang, Jin-Tang","3,5-Dimethyl-<i>N</i>-(5-<i>m</i>-tolyl-1,3,4-thiadiazol-2-yl)benzamide","Acta Crystallographica Section E","2007","63","2","o885","o886","10.1107/S1600536807002735","","","0.71073","MoKα","","0.0641","0.0483","","","0.1282","0.1366","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212066","8.26","0.0009","8.4479","0.001","11.4776","0.0013","109.586","0.009","93.093","0.009","112.998","0.009","678.61","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-(p-Methoxyphenylsulfanyl)phthalimide","","- C15 H11 N O3 S -","- C15 H11 N O3 S -","- C30 H22 N2 O6 S2 -","2","1","BT2248","Yazıcı, Serap; Türköz, Nalan; Kütük, Halil; Şenel, İsmet; Büyükgüngör, Orhan","<i>N</i>-(<i>p</i>-Methoxyphenylsulfanyl)phthalimide","Acta Crystallographica Section E","2007","63","2","o813","o814","10.1107/S1600536807002541","","","0.71073","MoKα","","0.0614","0.0427","","","0.0968","0.1051","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212067","9.222","0.003","12.179","0.003","11.249","0.004","90","","96.54","0.02","90","","1255.2","0.7","292","2","292","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(1,4,7-triazacyclononane)manganese(II) di-μ~2~-diselenido-bis[selenidoarsenate(III)]","","- C12 H30 As2 Mn N6 Se6 -","- C12 H30 As2 Mn N6 Se6 -","- C24 H60 As4 Mn2 N12 Se12 -","2","0.5","BT2249","Anna Kromm; William S. Sheldrick","Bis(1,4,7-triazacyclononane-κ^3^<i>N</i>)manganese(II) di-μ-diselenido-bis[selenidoarsenate(III)]","Acta Crystallographica Section E","2007","63","2","m581","m583","10.1107/S1600536807002760","","","0.71073","MoKα","","0.0594","0.043","","","0.1013","0.11","","","","","","1.037","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212068","12.259","0.003","10.067","0.002","8.0578","0.0016","90","","91.28","0.03","90","","994.2","0.4","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Benzamidinium dihydrogenphosphate","","- C7 H11 N2 O4 P -","- C7 H11 N2 O4 P -","- C28 H44 N8 O16 P4 -","4","1","BT2254","T. Kolev; M. Spiteller; T. van Almsick; H. Mayer-Figge; W. S. Sheldrick","Benzamidinium dihydrogenphosphate","Acta Crystallographica Section E","2007","63","2","o1016","o1018","10.1107/S1600536807003856","","","0.71073","MoKα","","0.1173","0.0673","","","0.1543","0.1722","","","","","","1.065","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212069","6.2697","0.0013","16.168","0.003","18.26","0.004","90","","94.6","0.03","90","","1845","0.7","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","{(1R,3S)-3-[(Dimethylamino)methyl]-2,2-dimethylcyclopropyl}diphenylmethanol","","- C21 H27 N O -","- C21 H27 N O -","- C84 H108 N4 O4 -","4","2","BT2256","Zhong, Jiang-Chun; Wang, Min-Gan; Wang, Min","{(1<i>R</i>,3S)-3-[(Dimethylamino)methyl]-2,2-dimethylcyclopropyl}diphenylmethanol","Acta Crystallographica Section E","2007","63","2","o1058","o1059","10.1107/S160053680700428X","","","0.71073","MoKα","","0.0678","0.0374","","","0.0714","0.0761","","","","","","0.993","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212070","9.9611","0.0007","14.5346","0.001","12.5321","0.0008","90","","110.109","0.001","90","","1703.8","0.2","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis[(E)-2-(4-oxopentan-2-ylideneamino)benzoato-κO]dipyridinemanganese(II)","","- C34 H36 Mn N4 O8 -","- C34 H36 Mn N4 O8 -","- C68 H72 Mn2 N8 O16 -","2","0.5","BV2039","Shao-Min Shi; Zong-Qiu Hu","Diaquabis[(<i>E</i>)-2-(4-oxopentan-2-ylideneamino)benzoato-κ<i>O</i>]dipyridinemanganese(II)","Acta Crystallographica Section E","2007","63","2","m426","m428","10.1107/S1600536806056212","","","0.71073","MoKα","","0.0643","0.0452","","","0.1066","0.1158","","","","","","0.972","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212071","9.829","0.003","10.15","0.003","10.826","0.003","88.111","0.004","74.483","0.004","85.562","0.005","1037.5","0.5","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis[4-(3-pyridyl)-1H-1,2,4-triazole]dithiocyanatomanganese(II)","","- C16 H16 Mn N10 O2 S2 -","- C16 H16 Mn N10 O2 S2 -","- C32 H32 Mn2 N20 O4 S4 -","2","1","BV2042","Li, Hui; Li, Chang-Jin; Hu, Zhi-Qiang","Diaquabis[4-(3-pyridyl)-1<i>H</i>-1,2,4-triazole]dithiocyanatomanganese(II)","Acta Crystallographica Section E","2007","63","2","m407","m408","10.1107/S1600536806056224","","","0.71073","MoKα","","0.0817","0.0448","","","0.1011","0.1205","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212072","9.8937","0.0006","11.4658","0.0007","14.2179","0.0008","99.811","0.001","108.859","0.001","96.158","0.001","1480.99","0.15","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","Bis(4-benzylpiperidine-1-carbodithioato-κ^2^S,S')dimethyltin(IV)","","- C28 H38 N2 S4 Sn -","- C28 H38 N2 S4 Sn -","- C56 H76 N4 S8 Sn2 -","2","1","BV2043","Zia-ur-Rahman; Saqib Ali; Niaz Muhammed; Meetsma, Auke","Bis(4-benzylpiperidine-1-carbodithioato-κ^2^<i>S</i>,<i>S</i>')dimethyltin(IV)","Acta Crystallographica Section E","2007","63","2","m431","m432","10.1107/S1600536806056236","","","0.71073","MoKα","","0.0217","0.0202","","","0.0503","0.051","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212073","16.029","0.013","8.709","0.007","29.04","0.02","90","","90","","90","","4054","5","294","2","294","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2-(1-Naphthyl)isoindoline-1,3-dione","","- C18 H11 N O2 -","- C18 H11 N O2 -","- C216 H132 N12 O24 -","12","3","BV2044","Li, Jian; Liang, Zu-Pei; Sun, Xiao-Zheng","2-(1-Naphthyl)isoindoline-1,3-dione","Acta Crystallographica Section E","2007","63","2","o1003","o1004","10.1107/S1600536807003741","","","0.71073","MoKα","","0.1324","0.0587","","","0.1465","0.1846","","","","","","1.151","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212074","5.4849","0.0009","9.152","0.0013","19.867","0.004","90","","90","","90","","997.3","0.3","296","1","296","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(S)-(p-Tolyl)ethylammonium chloride","(S)-(-)-1-(4-Methylphenyl)ethylammonium chloride","","- C9 H14 Cl N -","- C9 H14 Cl N -","- C36 H56 Cl4 N4 -","4","1","BV2046","Hernández, Guadalupe; Bernès, Sylvain; Portillo, Roberto; Gutiérrez, René","(<i>S</i>)-(‒)-1-(4-Methylphenyl)ethylammonium chloride","Acta Crystallographica Section E","2007","63","2","o1053","o1055","10.1107/S1600536807003753","","","0.71073","MoKα","","0.0526","0.0425","","","0.1088","0.1161","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212075","5.8561","0.0004","19.6347","0.0014","8.2554","0.0006","90","","105.792","0.001","90","","913.4","0.11","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Bis(dimethylphosphorylmethylene)durene","tetramethyl (2,3,5,6-tetramethyl-p-phenylenedimethylene)bisphosphonate","","- C16 H28 O6 P2 -","- C16 H28 O6 P2 -","- C32 H56 O12 P4 -","2","0.5","BX2035","Zeller, Matthias; Hunter, Allen D.","Bis(dimethylphosphorylmethyl)durene","Acta Crystallographica Section E","2007","63","2","o802","o803","10.1107/S160053680700236X","","","0.71073","MoKα","","0.0499","0.0412","","","0.1051","0.1102","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212076","5.5743","0.0011","5.3123","0.0011","29.086","0.006","90","","90.6","0.03","90","","861.3","0.3","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(4-Chlorophenyl)thioglycolic acid","","- C8 H7 Cl O2 S -","- C8 H7 Cl O2 S -","- C32 H28 Cl4 O8 S4 -","4","1","BX2049","Ma, Dong-Sheng","(4-Chlorophenyl)thioglycolic acid","Acta Crystallographica Section E","2007","63","2","o902","o903","10.1107/S160053680700284X","","","0.71073","MoKα","","0.073","0.0487","","","0.1068","0.1175","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212077","23.2639","0.0002","8.6792","0.0001","16.067","0.0002","90","","128.71","0.001","90","","2531.46","0.06","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(2,3-Dimethyl-7,7-dioxo-7H-4-oxa-7λ^6^-thia-1,6,7a-triazainden-5- yl)dimethyamine","","- C10 H16 N4 O3 S -","- C10 H16 N4 O3 S -","- C80 H128 N32 O24 S8 -","8","1","BX2052","Liepa, Andris J.; Jahangiri, Saba; Fallon, Gary D.; Forsyth, Craig M.","(2,3-Dimethyl-7,7-dioxo-7<i>H</i>-4-oxa-7λ^6^-thia-1,6,7a-triazainden-5-yl)diethyamine","Acta Crystallographica Section E","2007","63","2","o887","o888","10.1107/S1600536807002814","","","0.71073","MoKα","","0.045","0.0344","","","0.086","0.0901","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212078","5.6444","0.0017","12.085","0.004","7.356","0.002","90","","102.026","0.004","90","","490.8","0.3","103","2","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Amino-2-cyclopent-2-en-1-one","","- C5 H7 N O -","- C5 H7 N O -","- C20 H28 N4 O4 -","4","1","BX2055","Butcher, Ray J.; Hijji, Yousef M.; Benjamin, Ellis","3-Aminocyclopent-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o610","o612","10.1107/S1600536807000529","","","0.71073","MoKα","","0.0563","0.0535","","","0.1416","0.1451","","","","","","1.097","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212079","28.064","0.002","8.7216","0.0007","10.7416","0.0009","90","","100.932","0.001","90","","2581.4","0.4","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","2-(2-bromothiophene-5-sulfonamido)benzoic acid.","","- C11 H8 Br N O4 S2 -","- C11 H8 Br N O4 S2 -","- C88 H64 Br8 N8 O32 S16 -","8","1","BX2058","Xiao-Wei Yan; Mao-Lin Hu; Jing Xiong","2-(5-Bromothiophene-2-sulfonamido)benzoic acid","Acta Crystallographica Section E","2007","63","2","o678","o679","10.1107/S1600536807000852","","","0.71073","MoKα","","0.0415","0.0311","","","0.0746","0.0808","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212080","13.4442","0.0007","10.6556","0.0005","17.8305","0.0009","90","","110.909","0.001","90","","2386.1","0.2","273","2","273","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Chlorobis(1,10-phenanthroline)copper(II) hexafluoroantimonate","","- C24 H16 Cl Cu F6 N4 Sb -","- C24 H16 Cl Cu F6 N4 Sb -","- C96 H64 Cl4 Cu4 F24 N16 Sb4 -","4","1","BX2059","Yu-Nan Zhang; Bai-Bin Zhou; Zhan-Hua Su; Zhi-Feng Zhao; Li-Xin Liu","Chlorobis(1,10-phenanthroline)copper(II) hexafluoroantimonate(V)","Acta Crystallographica Section E","2007","63","2","m512","m513","10.1107/S1600536807001675","","","0.71073","MoKα","","0.0276","0.0233","","","0.0595","0.0617","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212081","8.102","0.002","7.1317","0.0019","33.558","0.009","90","","90.761","0.004","90","","1938.8","0.9","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-4-(6-Methoxy-2-naphthylmethylideneamino)-1,5-dimethyl-2-phenyl- 1H-pyrazol-3(2H)-one","","- C23 H21 N3 O2 -","- C23 H21 N3 O2 -","- C92 H84 N12 O8 -","4","1","CF2080","Zhang, Chun-Niu; Zheng, Yun-Fa; Wang, Liang-Gui; Gu, Yong-Bing; Yang, Ming-Hua","(<i>E</i>)-4-(6-Methoxy-2-naphthylmethylideneamino)-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","2","o1043","o1044","10.1107/S1600536807003959","","","0.71073","MoKα","","0.0641","0.0358","","","0.0739","0.076","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212082","9.715","0.003","10.92","0.003","14.268","0.005","90.218","0.004","106.435","0.003","102.776","0.004","1412.3","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Tetraphenylphosphonium 2,4,5-tricarboxybenzoate","","- C34 H25 O8 P -","- C34 H25 O8 P -","- C68 H50 O16 P2 -","2","1","CF2083","Guo-Dong Yang; Jing-Cao Dai; Wen-Shi Wu; Hai-Ping Li; Guo-Xiang Liu","Tetraphenylphosphonium 2,4,5-tricarboxybenzoate","Acta Crystallographica Section E","2007","63","2","o1010","o1011","10.1107/S1600536807004163","","","0.71073","MoKα","","0.0493","0.0407","","","0.1026","0.1091","","","","","","1.006","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212083","7.3583","0.0006","16.1779","0.0008","9.1962","0.0006","90","","111.621","0.003","90","","1017.71","0.12","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(μ-2,2'-bipyridin-6-olato)-κ^3^N,N':O;κ^3^O:N,N'-dicopper(I) dichlorocopper(II)","","- C20 H14 Cl2 Cu3 N4 O2 -","- C20 H14 Cl2 Cu3 N4 O2 -","- C40 H28 Cl4 Cu6 N8 O4 -","2","0.5","CI2210","Guo, Hong-Xu; Rao, Zhi-Ming; Wang, Qing-Hua","Bis(μ-2,2'-bipyridin-6-olato)-κ^3^<i>N</i>,<i>N</i>':<i>O</i>;κ^3^<i>O</i>:<i>N</i>,<i>N</i>'-dicopper(I,II) dichlorocuprate(II)","Acta Crystallographica Section E","2007","63","2","m637","m638","10.1107/S1600536806050720","","","0.71073","MoKα","","0.0608","0.0447","","","0.1295","0.1439","","","","","","1.004","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212084","9.5929","0.0011","25.969","0.003","11.943","0.0013","90","","107.101","0.002","90","","2843.7","0.6","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{2-[(3,5-Dibromo-2-oxidophenyl)methylamino]-3-phenylpropanoato-k^3^N,O,O'} (1,10-phenanthroline-k^2^N,N')zinc(II) dihydrate","","- C28 H25 Br2 N3 O5 Zn -","- C28 H25 Br2 N3 O5 Zn -","- C112 H100 Br8 N12 O20 Zn4 -","4","1","CI2225","Zhang, Shu Hua; Feng, Xiao-Zhen; Li, Guang Zhao; Jing, Li Xia; Liu, Zheng","[2-(3,5-Dibromo-2-oxidobenzylamino)-3-phenylpropanoato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>'](1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II) dihydrate","Acta Crystallographica Section E","2007","63","2","m396","m398","10.1107/S1600536807000177","","","0.71073","MoKα","","0.1604","0.0543","","","0.1192","0.165","","","","","","0.97","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212085","10.7047","0.0012","11.7544","0.0014","13.4577","0.0015","82.238","0.003","72.346","0.002","71.824","0.002","1531.6","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","1,10-Phenanthrolin-1-ium pamoate N,N-dimethylformamide solvate","1,10-Phenanthrolin-1-ium 4-(3-carboxy-2-hydroxynaphthylmethyl)-3-hydroxy-2-naphthoate N,N-dimethylformamide solvate","","- C38 H31 N3 O7 -","- C38 H31 N3 O7 -","- C76 H62 N6 O14 -","2","1","CI2243","Tong-Ming Shang; Quan-Fa Zhou; Jian-Hua Sun","1,10-Phenanthrolin-1-ium pamoate <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2007","63","2","o506","o508","10.1107/S1600536806056285","","","0.71073","MoKα","","0.1271","0.0887","","","0.1766","0.1979","","","","","","1.124","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212086","8.4461","0.0015","8.5053","0.0017","14.26","0.003","91.86","0.016","103.587","0.014","113.006","0.014","907.6","0.3","297","2","297","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H20 N2 O2 -","- C18.936 H19.872 N2 O2 -","- C37.872 H39.744 N4 O4 -","2","1","CI2246","Ibrahim Uçar; Kocaokutgen, Hasan; Özki̇nali̇, Sevil; Gür, Mahmut; Orhan Büyükgüngör","(<i>E</i>)-4-(4-Ethylphenyldiazenyl)-2,6-dimethylphenyl acrylate","Acta Crystallographica Section E","2007","63","2","o587","o588","10.1107/S1600536806056534","","","0.71073","MoKα","","0.2038","0.0761","","","0.1675","0.2305","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2212087","19.338","0.001","6.994","0.001","11.288","0.002","90","","90","","90","","1526.7","0.4","298","2","298","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","{2-Bromo-4-chloro-6-[2- (dimethylamino)ethyliminomethyl]phenolato)thiocyanatonickel(II)","","- C12 H13 Br Cl N3 Ni O S -","- C12 H13 Br Cl N3 Ni O S -","- C48 H52 Br4 Cl4 N12 Ni4 O4 S4 -","4","0.5","CI2254","Xiao-Fan Zhao","{2-Bromo-4-chloro-6-[2-(dimethylamino)ethyliminomethyl]phenolato}thiocyanatonickel(II)","Acta Crystallographica Section E","2007","63","2","m433","m434","10.1107/S1600536807000451","","","0.71073","MoKα","","0.0523","0.0428","","","0.1033","0.1095","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212088","14.5873","0.0015","16.8272","0.0017","17.574","0.0018","90","","90","","90","","4313.8","0.8","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","3,3'-diphenylbi-1H-indene-1,1'-dione","","- C30 H18 O2 -","- C30 H18 O2 -","- C240 H144 O16 -","8","1","CI2255","Xu Li; Jing-Jun Liu; Min Zhao; Yong-Ming Wang; Chun-Feng Xia","3,3'-Diphenylbi-1<i>H</i>-indene-1,1'-dione","Acta Crystallographica Section E","2007","63","2","o436","o437","10.1107/S160053680605495X","","","0.71073","MoKα","","0.0583","0.0367","","","0.0857","0.0987","","","","","","1.018","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212089","7.834","0.003","7.922","0.003","19.867","0.007","89.999","0.004","79.003","0.004","68.763","0.004","1124.9","0.7","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","(E)-5-[(4-bromophenyl)diazenyl]-2-hydroxybenzoic dimethyltitanocene","","- C25 H21 Br N2 O3 Ti -","- C25 H21 Br N2 O3 Ti -","- C50 H42 Br2 N4 O6 Ti2 -","2","1","CI2256","Li, Jin-Ling; Gao, Zi-Wei; Gao, Ling-Xiang; Xu, Fang","{(<i>E</i>)-5-[(4-Bromophenyl)diazenyl]-2-oxidobenzoato-κ^2^<i>O</i>^1^,<i>O</i>^2^}bis(η^5^-methylcyclopentadienyl)titanium(IV)","Acta Crystallographica Section E","2007","63","2","m460","m461","10.1107/S1600536807000827","","","0.71073","MoKα","","0.0714","0.0455","","","0.1114","0.1256","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212090","10.004","0.001","12.086","0.001","17.434","0.002","90","","90","","90","","2107.9","0.4","295","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-3,3'-Dibromo-5,5',6,6',7,7',8,8'-octahydro-2,2'-dimethoxy-1,1'- binaphthalene","","- C22 H24 Br2 O2 -","- C22 H24 Br2 O2 -","- C88 H96 Br8 O8 -","4","1","CI2257","He, Long; Ng, Seik Weng","(<i>S</i>)-3,3'-Dibromo-5,5',6,6',7,7',8,8'-octahydro-2,2'-dimethoxy-1,1'-binaphthalene","Acta Crystallographica Section E","2007","63","2","o455","o456","10.1107/S160053680605536X","","","0.71073","MoKα","","0.082","0.045","","","0.099","0.114","","","","","","0.96","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212091","6.043","0.0012","8.595","0.0017","13.211","0.003","95.57","0.03","101.64","0.03","93.47","0.03","666.6","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2,5-Dibenzoylterephthalic acid N,N-dimethylformamide disolvate","","- C28 H28 N2 O8 -","- C28 H28 N2 O8 -","- C28 H28 N2 O8 -","1","0.5","CI2258","Shan Liu; Wen-Yuan Wu; Fan Wen; Rui Liu; Hong-Jun Zhu","2,5-Dibenzoylterephthalic acid <i>N</i>,<i>N</i>-dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","2","o515","o516","10.1107/S1600536806055607","","","0.71073","MoKα","","0.0643","0.0487","","","0.1201","0.1308","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212092","13.2642","0.0011","7.7971","0.0007","14.2757","0.0012","90","","96.88","0.03","90","","1465.8","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(E)-Methyl 2-[2-(6-chloropyrimidin-4-yloxy)phenyl]-3-methoxyacrylate","","- C15 H13 Cl N2 O4 -","- C15 H13 Cl N2 O4 -","- C60 H52 Cl4 N8 O16 -","4","1","CI2259","Hong-Fei Ma; Hong-Sheng Jia; Shan Liu; Fan Wen; Bin-Lin Chen","(<i>E</i>)-Methyl 2-[2-(6-chloropyrimidin-4-yloxy)phenyl]-3-methoxyacrylate","Acta Crystallographica Section E","2007","63","2","o526","o527","10.1107/S1600536806055516","","","0.71073","MoKα","","0.0757","0.0498","","","0.1233","0.1363","","","","","","0.996","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212093","6.7851","0.0007","15.6234","0.0015","8.0308","0.0008","90","","92.59","0.03","90","","850.45","0.15","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(3,5-dimethoxyphenyl)oxamide","","- C18 H20 N2 O6 -","- C18 H20 N2 O6 -","- C36 H40 N4 O12 -","2","0.5","CI2260","Gu, Wen; Tang, Qing-Gang","<i>N</i>,<i>N</i>'-Bis(3,5-dimethoxyphenyl)oxamide","Acta Crystallographica Section E","2007","63","2","o513","o514","10.1107/S1600536806056030","","","0.71073","MoKα","","0.177","0.0686","","","0.1152","0.152","","","","","","0.981","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212094","8.1883","0.0016","24.938","0.005","7.5896","0.0015","90","","93.56","0.03","90","","1546.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 N8 O3 S -","- C12 H12 N8 O3 S -","- C48 H48 N32 O12 S4 -","4","1","CI2263","Yang, Xiu-ying; Zhang, Pu-yong; Xu, Zhong-jie","4-(4-Nitrobenzylideneamino)-3-(1<i>H</i>-1,2,4-triazol-1-ylmethyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione monohydrate","Acta Crystallographica Section E","2007","63","2","o511","o512","10.1107/S1600536807000037","","","0.71073","MoKα","","0.0701","0.0435","","","0.1065","0.1248","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212095","7.9913","0.0005","12.5941","0.0007","14.1263","0.001","90","","102.231","0.003","90","","1389.45","0.15","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2'-(1,3-Benzodioxol-5-ylmethylene)-2-methoxybenzohydrazide","","- C16 H14 N2 O4 -","- C16 H14 N2 O4 -","- C64 H56 N8 O16 -","4","1","CI2264","Jing, Zuo-Liang; Yu, Ming","2'-(1,3-Benzodioxol-5-ylmethylene)-2-methoxybenzohydrazide","Acta Crystallographica Section E","2007","63","2","o509","o510","10.1107/S1600536806056297","","","0.7107","MoKα","","0.0546","0.0424","","","0.0956","0.1023","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212096","7.4277","0.001","13.003","0.002","9.548","0.002","90","","107.787","0.007","90","","878.1","0.3","90","","90","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-Diaquabis(N,N'-dimethylethane-1,2-diamine-κ^2^N,N')nickel(II) dichloride dihydrate","","- C8 H32 Cl2 N4 Ni O4 -","- C8 H32 Cl2 N4 Ni O4 -","- C16 H64 Cl4 N8 Ni2 O8 -","2","0.5","CI2265","Daniela M. M. Ide; Richard E. Norman","<i>trans</i>-Diaquabis(<i>N</i>,<i>N</i>-dimethylethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')nickel(II) dichloride dihydrate: a redetermination at 90 K","Acta Crystallographica Section E","2007","63","2","m558","m560","10.1107/S1600536807002140","","","0.71073","MoKα","","0.0431","0.042","","0.0975","","0.0906","","","1.026","","","1.0467","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212097","8.4442","0.0002","6.813","0.0002","20.5332","0.0005","90","","91.497","0.001","90","","1180.88","0.05","100","0.1","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(4-Chlorophenyl)-1-(2-hydroxyphenyl)prop-2-en-1-one","","- C15 H11 Cl O2 -","- C15 H11 Cl O2 -","- C60 H44 Cl4 O8 -","4","1","CI2266","Hoong-Kun Fun; P. S. Patil; S. M. Dharmaprakash; Suchada Chantrapromma","3-(4-Chlorophenyl)-1-(2-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o561","o562","10.1107/S1600536806056303","","","0.71073","MoKα","","0.0408","0.0361","","","0.0998","0.1033","","","","","","1.099","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212098","10.1657","0.0003","10.3602","0.0003","26.6975","0.0007","90","","92.115","0.002","90","","2809.83","0.14","100","0.1","100","0.1","","","","","","","","4","C 1 c 1","C -2yc","9","(E,E)-N,N'-Bis(4-chlorophenyl)ethylenediamine","(E,E)-N,N'-Bis(4-chlorophenyl)ethylenediamine","","- C16 H14 Cl2 N2 -","- C16 H14 Cl2 N2 -","- C128 H112 Cl16 N16 -","8","2","CI2267","Hadariah Bahron; Karimah Kassim; Sharifah Rohaiza Syed Omar; Shadatul Hanum Rashid; Hoong-Kun Fun; Suchada Chantrapromma","(<i>E</i>,<i>E</i>)-<i>N</i>,<i>N</i>'-Bis(4-chlorophenyl)ethylenediamine","Acta Crystallographica Section E","2007","63","2","o558","o560","10.1107/S1600536807000025","","","0.71073","MoKα","","0.0294","0.0282","","","0.0735","0.0744","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212099","18.8708","0.0004","5.7702","0.0002","22.4409","0.0006","90","","95.135","0.008","90","","2433.74","0.12","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Ethyl 2,6-bis(4-chlorophenyl)-4-hydroxy-5-phenyl-1,2,5,6-tetrahydropyridine- 3-carboxylate","","- C26 H23 Cl2 N O3 S -","- C26 H23 Cl2 N O3 S -","- C104 H92 Cl8 N4 O12 S4 -","4","1","CI2268","J. Suresh; R. Suresh Kumar; S. Perumal; S. Natarajan","Ethyl 2,6-bis(4-chlorophenyl)-4-hydroxy-5-phenyl-1,2,5,6-tetrahydropyridine-3-carboxylate: supramolecular aggregation through N—H···Cl, C—H···Cl, C—H···S and C—H···π interactions","Acta Crystallographica Section E","2007","63","2","o777","o779","10.1107/S1600536807001237","","","0.71073","MoKα","","0.1919","0.0822","","","0.2136","0.2807","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212100","13.248","0.0003","8.1877","0.0002","15.1674","0.0004","90","","103.965","0.001","90","","1596.59","0.07","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Chloro-3-[1-chloro-2-(2-ethynylphenyl)ethenyl]naphthalene-1,4-dione","","- C20 H10 Cl2 O2 -","- C20 H10 Cl2 O2 -","- C80 H40 Cl8 O8 -","4","1","CI2271","Hui-Ying An; Jian-Hua Xu; Shea-Lin Ng; Hoong-Kun Fun","2-Chloro-3-[1-chloro-2-(2-ethynylphenyl)ethenyl]naphthalene-1,4-dione","Acta Crystallographica Section E","2007","63","2","o697","o698","10.1107/S1600536807000797","","","0.71073","MoKα","","0.0914","0.0513","","","0.1248","0.1508","","","","","","1.073","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212101","6.0782","0.0002","16.5573","0.0006","17.4989","0.0006","90","","90.348","0.002","90","","1761.03","0.11","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-[1,2-Phenylenebis(nitrilomethylylidene)]bis(5-methylphenol)","","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","- C88 H80 N8 O8 -","4","1","CI2274","Naser Eltaher Eltayeb; Siang Guan Teoh; Jeannie Bee-Jan Teh; Hoong-Kun Fun; Kamarulazizi Ibrahim","2,2'-[1,2-Phenylenebis(nitrilomethylidyne)]bis(5-methylphenol)","Acta Crystallographica Section E","2007","63","2","o695","o696","10.1107/S1600536807000955","","","0.71073","MoKα","","0.0729","0.0493","","","0.1063","0.1174","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212102","15.576","0.006","9.611","0.004","16.139","0.006","90","","90","","90","","2416","1.6","294","2","294","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","3,3'-Dibenzyl-3,3'-dihydroxy-[2,2'-bi-1H-indene]-1,1'-dione","","- C32 H24 O4 -","- C32 H24 O4 -","- C128 H96 O16 -","4","0.5","CI2275","Hong-Min Zhao; Jing-Jun Liu; Jian Zhang; Shu-Ying Zhang; Xu Li","3,3'-Dibenzyl-3,3'-dihydroxy-[2,2'-bi-1<i>H</i>-indene]-1,1'-dione","Acta Crystallographica Section E","2007","63","2","o750","o751","10.1107/S1600536807001535","","","0.71073","MoKα","","0.0846","0.0426","","","0.1","0.1209","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212103","13.9638","0.0008","13.849","0.0008","22.1754","0.0013","90","","100.851","0.001","90","","4211.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(4-Methoxyphenyl)-1',6,6-trimethyl-4,5,6,7-tetrahydrospiro[1-benzofuran- 2,3'(3H,2'H)-1H-indole]-2',4-dione","","- C24 H22 Cl N O3 -","- C24 H22 Cl N O3 -","- C192 H176 Cl8 N8 O24 -","8","2","CI2276","D. Gayathri; D. Velmurugan; K. Ravikumar; G. Savitha; P. T. Perumal","3-(4-Methoxyphenyl)-1',6,6-trimethyl-4,5,6,7-tetrahydrospiro[1-benzofuran-2,3'(3<i>H</i>,2'<i>H</i>)-1<i>H</i>-indole]-2',4-dione","Acta Crystallographica Section E","2007","63","2","o1034","o1036","10.1107/S1600536807003261","","","0.71073","MoKα","","0.0594","0.0468","","","0.128","0.138","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212104","9.0901","0.0006","10.5013","0.0007","12.7508","0.0008","79.865","0.001","71.504","0.001","68.568","0.001","1071.99","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Spiro[4.3']oxindole-spiro[5.2""]cyclooctanone-6-phenyl- thiapyrrolizidine","7-Phenyl-cyclooctane-1-spiro-6'-2-thiapyrrolizidine-5'-spiro-3''-indole- 2,2''(3H)-dione","","- C26 H28 N2 O2 S -","- C26 H28 N2 O2 S -","- C52 H56 N4 O4 S2 -","2","1","CI2277","D. Gayathri; S. Kalyani; D. Velmurugan; K. Ravikumar; M. Poornachandran","7-Phenylcyclooctane-1-spiro-6'-2-thiapyrrolizidine-5'-spiro-3''-indole-2,2''(3<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","2","o852","o854","10.1107/S1600536807001778","","","0.71073","MoKα","","0.0499","0.0465","","","0.1318","0.1358","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212105","8.977","0.002","9.114","0.003","11.387","0.003","92.099","0.002","111.455","0.003","95.638","0.002","860.2","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","2'-(2-Hydroxy-3,5-diiodobenzylidene)isonicotinohydrazide methanol solvate","","- C14 H13 I2 N3 O3 -","- C14 H13 I2 N3 O3 -","- C28 H26 I4 N6 O6 -","2","1","CI2278","He-Bing Li","2'-(2-Hydroxy-3,5-diiodobenzylidene)isonicotinohydrazide methanol solvate","Acta Crystallographica Section E","2007","63","2","o972","o973","10.1107/S1600536807002449","","","0.71073","MoKα","","0.0553","0.038","","","0.0831","0.093","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212106","9.8351","0.0007","11.3996","0.0008","10.426","0.0007","90","","95.079","0.003","90","","1164.33","0.14","113","2","113","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","2'-(1,3-Benzodioxol-5-ylmethylene)furan-2-carbohydrazide","","- C13 H10 N2 O4 -","- C13 H10 N2 O4 -","- C52 H40 N8 O16 -","4","1","CI2279","Zhou, Qing-Li; Wang, Chang-Lu; Jing, Zuo-Liang","2'-(1,3-Benzodioxol-5-ylmethylene)furan-2-carbohydrazide","Acta Crystallographica Section E","2007","63","2","o898","o899","10.1107/S160053680700308X","","","0.7107","MoKα","","0.0729","0.0439","","","0.106","0.1596","","","","","","1.072","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212107","12.2779","0.0002","14.035","0.0002","19.9624","0.0003","90","","124.834","0.001","90","","2823.53","0.08","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4,5,6,7-Tetrachloro-2-(2-hydroxyphenyl)-1H-isoindole-1,3(2H)-dione","4,5,6,7-Tetrachloro-2-(2-hydroxyphenyl)-1H-isoindole-1,3(2H)-dione","","- C14 H5 Cl4 N O3 -","- C14 H5 Cl4 N O3 -","- C112 H40 Cl32 N8 O24 -","8","2","CI2280","Hoong-Kun Fun; Suchada Chantrapromma; Zhe Li; Yong-Miao Shen; Jian-Hua Xu","4,5,6,7-Tetrachloro-2-(2-hydroxyphenyl)-1<i>H</i>-isoindole-1,3(2<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","2","o946","o947","10.1107/S1600536807003273","","","0.71073","MoKα","","0.0298","0.0262","","","0.0647","0.0668","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212108","16.0627","0.0002","8.0482","0.0001","24.0821","0.0003","90","","90","","90","","3113.23","0.07","100","0.1","100","0.1","","","","","","","","4","P n a 21","P 2c -2n","33","","2a,8a-Dichloro-1-(2-ethynylphenyl)-2a,8a-dihydrocyclobuta[b]naphthalene- 3,8-dione","","- C20 H10 Cl2 O2 -","- C20 H10 Cl2 O2 -","- C160 H80 Cl16 O16 -","8","2","CI2281","Hui-Ying An; Jian-Hua Xu; Shea-Lin Ng; Hoong-Kun Fun","2a,8a-Dichloro-1-(2-ethynylphenyl)-2a,8a-dihydrocyclobuta[<i>b</i>]naphthalene-3,8-dione","Acta Crystallographica Section E","2007","63","2","o948","o950","10.1107/S160053680700342X","","","0.71073","MoKα","","0.0363","0.0323","","","0.0831","0.0856","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212109","8.1289","0.0012","5.9814","0.0009","14.6","0.002","90","","93.326","0.003","90","","708.69","0.18","173","2","173","2","","","","","","","","4","P 1 n 1","P -2yac","7","","Butyldiphenylphosphine oxide","","- C16 H19 O P -","- C16 H19 O P -","- C32 H38 O2 P2 -","2","1","CI2282","Caddy, Judy; Coyanis, E. Mabel; Lemmerer, Andreas; Khanye, Setshaba D.; Omondi, Bernard","Butyldiphenylphosphine oxide","Acta Crystallographica Section E","2007","63","2","o1032","o1033","10.1107/S160053680700414X","","","0.71073","MoKα","","0.0313","0.0305","","","0.0831","0.0837","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212110","11.449","0.003","6.1417","0.0015","23.624","0.006","90","","94.409","0.005","90","","1656.2","0.7","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Diphenylphosphoryl)(4-nitrophenyl)methanol","","- C19 H16 N O4 P -","- C19 H16 N O4 P -","- C76 H64 N4 O16 P4 -","4","1","CI2283","Liu, Wan-Yun; Huo, Ping; Gao, Yu-Xing; Liu, Peng; Zhao, Yu-Fen","(Diphenylphosphoryl)(4-nitrophenyl)methanol","Acta Crystallographica Section E","2007","63","2","o1008","o1009","10.1107/S1600536807003868","","","0.71073","MoKα","","0.048","0.042","","","0.123","0.128","","","","","","1.011","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212111","16.0264","0.0004","6.3621","0.0001","7.1476","0.0001","90","","90","","90","","728.78","0.02","100","0.1","100","0.1","","","","","","","","4","P n m a","-P 2ac 2n","62","4-Methoxy-2-nitroaniline","4-Methoxy-2-nitroaniline","","- C7 H8 N2 O3 -","- C7 H8 N2 O3 -","- C28 H32 N8 O12 -","4","0.5","CI2285","Mohd Mustaqim Rosli; P. S. Patil; Hoong-Kun Fun; Ibrahim Abdul Razak; S. M. Dharmaprakash","4-Methoxy-2-nitroaniline","Acta Crystallographica Section E","2007","63","2","o1039","o1040","10.1107/S1600536807004266","","","0.71073","MoKα","","0.0367","0.0332","","","0.1005","0.104","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212112","10.328","0.003","9.593","0.003","8.48","0.002","90","","110.08","0.02","90","","789.1","0.4","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Potassium 2-(1H-tetrazol-1-yl)ethanesulfonate","","- C3 H5 K N4 O3 S -","- C3 H5 K N4 O3 S -","- C12 H20 K4 N16 O12 S4 -","4","1","CS2027","Lyakhov, Alexander S.; Grigoriev, Yuri V.; Ivashkevich, Ludmila S.; Gaponik, Pavel N.","Potassium 2-(1<i>H</i>-tetrazol-1-yl)ethanesulfonate","Acta Crystallographica Section E","2007","63","2","m495","m497","10.1107/S1600536807001201","","","0.71073","MoKα","","0.0394","0.0348","","","0.0989","0.1036","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212113","9.1346","0.0014","12.926","0.002","17.772","0.003","90","","102.004","0.002","90","","2052.5","0.6","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,7-dibromo-9,9-bis(4-hydroxyphenyl)-9H-fluorene","","- C25 H16 Br2 O2 -","- C25 H16 Br2 O2 -","- C100 H64 Br8 O8 -","4","1","CS2028","Nadeau, Nathalie; McFarlane, Shaune; McDonald, Robert; Veinot, Jonathan G. C.","2,7-Dibromo-9,9-bis(4-hydroxyphenyl)-9<i>H</i>-fluorene","Acta Crystallographica Section E","2007","63","2","o748","o749","10.1107/S1600536807001080","","","0.71073","MoKα","","0.0554","0.0366","","","0.0827","0.0907","","","","","","1.016","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212114","6.613","0.003","9.979","0.004","10.582","0.005","90","","105.748","0.015","90","","672.1","0.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[[aquazinc(II)]-μ~3~-imidazole-4,5-dicarboxylato]","","- C5 H4 N2 O5 Zn -","- C5 H4 N2 O5 Zn -","- C20 H16 N8 O20 Zn4 -","4","1","CV2153","Zhang, Xian-Fa; Gao, Shan; Huo, Li-Hua; Zhao, Hui","Poly[[aquazinc(II)]-μ~3~-imidazole-4,5-dicarboxylato]","Acta Crystallographica Section E","2007","63","2","m299","m301","10.1107/S1600536806055012","","","0.71073","MoKα","","0.0579","0.0562","","","0.1982","0.2002","","","","","","1.089","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212115","11.741","0.005","6.911","0.003","12.457","0.005","90","","90.958","0.005","90","","1010.6","0.7","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3β-Acetoxy-7α-chloro-5,6β-epoxy-15β,16β-methylene-5β-androstan-17-one","","- C22 H29 Cl O4 -","- C22 H29 Cl O4 -","- C44 H58 Cl2 O8 -","2","1","CV2163","Wei Zhou; Wei-Xiao Hu; Chun-Nian Xia","3β-Acetoxy-7α-chloro-5,6β-epoxy-15β,16β-methylene-5β-androstan-17-one","Acta Crystallographica Section E","2007","63","2","o615","o616","10.1107/S1600536806056145","","","0.71073","MoKα","","0.0618","0.0533","","","0.1227","0.1277","","","","","","0.983","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212116","7.958","0.0011","7.958","0.0011","29.249","0.006","90","","90","","90","","1852.3","0.5","293","2","293","2","","","","","","","","6","P 43","P 4cw","78","","N-(2,4-Dichlorophenoxyacetyl)-N'-(2,4,6-trichlorophenyl)thiourea","","- C15 H9 Cl5 N2 O2 S -","- C15 H9 Cl5 N2 O2 S -","- C60 H36 Cl20 N8 O8 S4 -","4","1","CV2164","Qian-Jin Li; Chun-Long Yang; Xue-Qun Xie","<i>N</i>-(2,4-Dichlorophenoxyacetyl)-<i>N</i>'-(2,4,6-trichlorophenyl)thiourea","Acta Crystallographica Section E","2007","63","2","o773","o774","10.1107/S1600536806054201","","","0.71073","MoKα","","0.0937","0.0574","","","0.1263","0.1447","","","","","","0.985","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212117","7.818","0.002","15.019","0.004","28.156","0.007","90","","90","","90","","3306","1.5","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","Triaqua[2-(2-pyridylmethylene)aminoethanesulfonato-κ^3^N,N',O]nickel(II) perchlorate monohydrate","","- C8 H17 Cl N2 Ni O11 S -","- C8 H17 Cl N2 Ni O11 S -","- C64 H136 Cl8 N16 Ni8 O88 S8 -","8","1","CV2165","Jia-Ming Li; Yi-Min Jiang; Chao-Zhu Li; Shu-Hua Zhang","Triaqua[2-(2-pyridylmethyleneamino)ethanesulfonato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]nickel(II) perchlorate monohydrate","Acta Crystallographica Section E","2007","63","2","m447","m449","10.1107/S1600536806055929","","","0.71073","MoKα","","0.0571","0.0441","","","0.1042","0.1095","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212118","9.545","0.002","13.733","0.004","14.15","0.004","61.742","0.002","82.225","0.003","89.823","0.003","1614.8","0.7","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Aqua[(benzothiazol-2-ylsulfanyl)acetato-κO]bis(1,10-phenanthroline- κ^2^N,N')cadmium(II) nitrate monohydrate","","- C33 H26 Cd N6 O7 S2 -","- C33 H26 Cd N6 O7 S2 -","- C66 H52 Cd2 N12 O14 S4 -","2","1","CV2166","Bian, He-Dong; Huang, Fu-Ping; Yu, Qing; Liang, Hong","Aqua[(benzothiazol-2-ylsulfanyl)acetato-κ<i>O</i>]bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II) nitrate monohydrate","Acta Crystallographica Section E","2007","63","2","m369","m371","10.1107/S1600536806055565","","","0.71073","MoKα","","0.0526","0.0361","","","0.0816","0.0939","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212119","10.1507","0.0003","11.1701","0.0003","14.3299","0.0003","91.3388","0.0016","100.069","0.0017","115.445","0.0011","1435.69","0.07","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","1-[2-(Dimethylaminomethyl)phenyl]-2,3,4,5-tetraphenylcyclopentadien-1-ol","","- C38 H33 N O -","- C38 H33 N O -","- C76 H66 N2 O2 -","2","1","CV2168","Erben, Milan; Císařová, Ivana; Dušek, Michal; Vinklárek, Jaromír","1-[2-(Dimethylaminomethyl)phenyl]-2,3,4,5-tetraphenylcyclopentadien-1-ol","Acta Crystallographica Section E","2007","63","2","o577","o579","10.1107/S1600536806056170","","","0.71073","MoKα","","0.0649","0.0449","","","0.1063","0.1193","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212120","7.1094","0.0009","12.0945","0.0015","19.731","0.003","90","","90","","90","","1696.6","0.4","273","2","273","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1H-Imidazole-κN^3^)[N-(2-oxidobenzyl)-L-leucinato-κ^3^O,N,O']copper(II)","","- C16 H21 Cu N3 O3 -","- C16 H21 Cu N3 O3 -","- C64 H84 Cu4 N12 O12 -","4","1","CV2169","Zhao, Gan-Qing; Xie, Ji-Min; Shao, Min; Sun, Lu; Song, Yuan-Zhi","(1<i>H</i>-Imidazole-κ<i>N</i>^3^)[<i>N</i>-(2-oxidobenzyl)-<small>L</small>-leucinato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']copper(II)","Acta Crystallographica Section E","2007","63","2","m532","m534","10.1107/S1600536807001456","","","0.71073","MoKα","","0.0547","0.0436","","","0.1029","0.1107","","","","","","1.081","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212121","7.287","0.003","10.07","0.005","17.646","0.01","90","","90","","90","","1294.9","1.1","291","2","291","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Disodium diaquabis(malonato-κ^2^O,O')nickel(II) dihydrate","","- C6 H12 Na2 Ni O12 -","- C6 H12 Na2 Ni O12 -","- C24 H48 Na8 Ni4 O48 -","4","1","CV2171","Zhu Tao; Li Bao; Yang Guang-Di; Wu Li-Xin","Disodium diaquabis(malonato-κ^2^<i>O</i>,<i>O</i>')nickelate(II) dihydrate","Acta Crystallographica Section E","2007","63","2","m409","m410","10.1107/S1600536806055632","","","0.71073","MoKα","","0.038","0.0351","","","0.0808","0.0823","","","","","","1.015","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212122","5.673","0.003","24.014","0.014","15.059","0.009","90","","94.028","0.009","90","","2046","2","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,5-Bis(4-methoxyphenyl)-3-phenylpentane-1,5-dione","","- C25 H24 O4 -","- C25 H24 O4 -","- C100 H96 O16 -","4","1","CV2172","Xian-Qiang Huang; Chun-Shui Zhang; Jian-Min Dou; Da-Cheng Li; Da-Qi Wang","1,5-Bis(4-methoxyphenyl)-3-phenylpentane-1,5-dione","Acta Crystallographica Section E","2007","63","2","o493","o494","10.1107/S1600536806056315","","","0.71073","MoKα","","0.1465","0.0508","","","0.112","0.1638","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212123","13.809","0.003","7.7892","0.0016","8.7858","0.0018","90","","97.47","0.03","90","","937","0.3","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[(2-Nitrophenyl)sulfinyl]acetic acid","","- C8 H7 N O5 S -","- C8 H7 N O5 S -","- C32 H28 N4 O20 S4 -","4","1","CV2173","Ma, Dong-Sheng","[(2-Nitrophenyl)sulfinyl]acetic acid","Acta Crystallographica Section E","2007","63","2","o658","o659","10.1107/S1600536806056418","","","0.71073","MoKα","","0.041","0.0321","","","0.0826","0.086","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212124","5.2752","0.0011","7.1294","0.0014","17.425","0.004","90","","90.45","0.03","90","","655.3","0.2","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-(3'-Deoxy-2,3,5,6-tetrahydro-1,4-oxathiine-1,1-dioxido-β-D-ribofuranosyl)uracil","","- C11 H14 N2 O7 S -","- C11 H14 N2 O7 S -","- C22 H28 N4 O14 S2 -","2","1","CV2174","Sun, Jing-Bo; Yang, Hua; Wu, Jin-Chang","1-(1,1-Dioxo-3'-deoxy-2,3,5,6-tetrahydro-1,4-oxathiine-β-<small>D</small>-ribofuranosyl)uracil: a bicyclic nucleoside analogue","Acta Crystallographica Section E","2007","63","2","o724","o725","10.1107/S1600536807000931","","","0.71073","MoKα","","0.0545","0.039","","","0.0728","0.0778","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212125","4.4639","0.0002","11.8463","0.0003","15.8514","0.0004","90","","90","","90","","838.23","0.05","173","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(1-Naphthyl)formamide","","- C11 H9 N O -","- C11 H9 N O -","- C44 H36 N4 O4 -","4","1","CV2175","Omondi, Bernard; Levendis, Demetrius C.; Naidoo, Nerona","<i>N</i>-(1-Naphthyl)formamide","Acta Crystallographica Section E","2007","63","2","o714","o716","10.1107/S1600536807000943","","","0.71073","MoKα","","","0.0303","","","","0.0804","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212126","7.1802","0.0015","16.064","0.003","19.354","0.004","90","","90.123","0.003","90","","2232.3","0.8","290","2","290","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,5-Dimethyl-N-(2-methylphenyl)-2-{[(1E)-(3,4,5- trimethoxyphenyl)methylene]amino}thiophene-3-carboxamide","","- C24 H26 N2 O4 S -","- C24 H26 N2 O4 S -","- C96 H104 N8 O16 S4 -","4","1","CV2177","Vasu; K. A. Nirmala; Deepak Chopra; S. Mohan; J. Saravanan","4,5-Dimethyl-<i>N</i>-(2-methylphenyl)-2-{[(1<i>E</i>)-(3,4,5-trimethoxyphenyl)methylene]amino}thiophene-3-carboxamide","Acta Crystallographica Section E","2007","63","2","o958","o960","10.1107/S1600536807002632","","","0.71073","MoKa","","0.0638","0.0453","","","0.1147","0.1231","","","","","","0.996","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212127","6.9398","0.0011","16.634","0.003","7.8543","0.0012","90","","113.731","0.002","90","","830","0.2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Amino-1-propylammonium perchlorate monohydrate","","- C3 H13 Cl N2 O5 -","- C3 H12.99 Cl N2 O5 -","- C12 H51.96 Cl4 N8 O20 -","4","1","CV2178","Qian, Hui-Fen; Wang, Li; Huang, Wei; Yao, Cheng","3-Amino-1-propylammonium perchlorate monohydrate","Acta Crystallographica Section E","2007","63","2","o817","o818","10.1107/S1600536807001997","","","0.71073","MoKα","","0.0666","0.0523","","","0.1674","0.1767","","","","","","1.133","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212128","9.354","0.003","7.828","0.003","29.122","0.011","90","","95.386","0.005","90","","2123","1.3","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","cis-3,3'-Dimethyldibenzo-18-crown-6","10,26-dimethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.0^9,14^]tetracosa- 9,11,13,22,24,26-hexaene","","- C22 H28 O6 -","- C22 H28 O6 -","- C88 H112 O24 -","4","1","CV2180","Mei-Ju Niu; Jian-Min Dou; Xian-Qiang Huang; Da-Qi Wang","<i>cis</i>-3,3'-Dimethyldibenzo-18-crown-6","Acta Crystallographica Section E","2007","63","2","o1071","o1072","10.1107/S1600536807002243","","","0.71073","MoKα","","0.1275","0.0625","","","0.1537","0.2102","","","","","","1.005","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212129","9.9489","0.001","10.4042","0.0011","16.1706","0.0017","90.113","0.002","100.547","0.003","116.292","0.003","1468.7","0.3","297","2","297","2","","","","","","","","3","P -1","-P 1","2","","1-(2-Furyl)-3-hydroxy-3-(4-phenylphenyl)prop-2-en-1-one","","- C19 H14 O3 -","- C19 H14 O3 -","- C76 H56 O12 -","4","2","CV2181","Chun-Yang Zheng; Ling Fan; Dunjia Wang","1-(2-Furyl)-3-hydroxy-3-(4-phenylphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o966","o967","10.1107/S1600536807003418","","","0.71073","MoKα","","0.0698","0.0578","","","0.1474","0.1578","","","","","","1.072","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212130","10.8345","0.0002","9.9173","0.0002","18.7629","0.0003","90","","113.983","0.001","90","","1842","0.06","100","0.1","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3-Benzyl-4,5,6,7-tetrachloro-3-hydroxy-2-(3-hydroxypropyl)isoindolin-1-one","3-Benzyl-4,5,6,7-tetrachloro-3-hydroxy-2-(3-hydroxypropyl)isoindolin-1-one","","- C18 H15 Cl4 N O3 -","- C18 H15 Cl4 N O3 -","- C72 H60 Cl16 N4 O12 -","4","1","CV2182","Hoong-Kun Fun; Yong-Miao Shen; Jian-Hua Xu; Suchada Chantrapromma","3-Benzyl-4,5,6,7-tetrachloro-3-hydroxy-2-(3-hydroxypropyl)isoindolin-1-one","Acta Crystallographica Section E","2007","63","2","o944","o945","10.1107/S1600536807002838","","","0.71073","MoKα","","0.0387","0.032","","","0.0786","0.0837","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212131","4.3496","0.0008","5.809","0.001","10.197","0.002","101.836","0.003","99.727","0.003","93.8","0.003","247.18","0.08","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","(p-Phenylenedimethylene)diammonium dichloride","","- C8 H14 Cl2 N2 -","- C8 H14 Cl2 N2 -","- C8 H14 Cl2 N2 -","1","0.5","CV2183","Arkenbout, Anne H.; Meetsma, Auke; Palstra, Thomas T. M.","(<i>p</i>-Phenylenedimethylene)diammonium dichloride","Acta Crystallographica Section E","2007","63","2","o869","o870","10.1107/S1600536807002619","","","0.71073","MoKα","","0.0434","0.0376","","","0.0888","0.0924","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212132","8.8627","0.0007","10.4972","0.0009","13.3624","0.0011","79.834","0.001","83.707","0.001","69.936","0.001","1147.75","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","2-{(2-Chlorophenyl)[(2,4-dichlorophenoxy)acetoxy]methyl]-5,5-dimethyl- 1,3,2-dioxaphosphinan-2-one","","- C20 H20 Cl3 O6 P -","- C20 H20 Cl3 O6 P -","- C40 H40 Cl6 O12 P2 -","2","1","CV2184","Zuo, Na; He, Hong-Wu","2-{(2-Chlorophenyl)[(2,4-dichlorophenoxy)acetoxy]methyl}-5,5-dimethyl-1,3,2-dioxaphosphinan-2-one","Acta Crystallographica Section E","2007","63","2","o794","o795","10.1107/S1600536807002334","","","0.71073","MoKα","","0.0578","0.0509","","","0.1337","0.1398","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212133","8.599","0.004","15.255","0.006","11.794","0.004","90","","112.67","0.02","90","","1427.6","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-(4-Methoxyphenyl)-3-phenyl-1,2,4,5-tetrazine","","- C16 H14 N4 O -","- C16 H14 N4 O -","- C64 H56 N16 O4 -","4","1","CV2186","Feng Xu; Wei-Xiao Hu","6-(4-Methoxyphenyl)-3-phenyl-1,2,4,5-tetrazine","Acta Crystallographica Section E","2007","63","2","o914","o915","10.1107/S1600536807003078","","","0.71073","MoKα","","0.0937","0.064","","","0.1441","0.1665","","","","","","1.004","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212134","8.0017","0.0004","9.4888","0.0004","13.6101","0.0006","95.71","0.001","100.762","0.0008","93.253","0.0009","1007.15","0.08","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","cis-Bis(2,2'-bipyridine)difluorochromium(III) perchlorate","","- C20 H16 Cl Cr F2 N4 O4 -","- C20 H16 Cl Cr F2 N4 O4 -","- C40 H32 Cl2 Cr2 F4 N8 O8 -","2","1","CV2188","Yamaguchi-Terasaki, Yukiko; Fujihara, Takashi; Nagasawa, Akira; Kaizaki, Sumio","<i>cis</i>-Bis(2,2'-bipyridine)difluorochromium(III) perchlorate","Acta Crystallographica Section E","2007","63","2","m593","m595","10.1107/S1600536807003157","","","0.71073","MoKα","","0.0351","0.033","","","0.0899","0.0915","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212135","4.9981","0.0019","9.395","0.003","13.279","0.005","90","","96.9657","0.0019","90","","618.9","0.4","153.1","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","3-Hydroxytropolone","2,7-dihydroxycyclohepta-2,4,6-trien-1-one","","- C7 H6 O3 -","- C7 H6 O3 -","- C28 H24 O12 -","4","1","CV2189","Kubo, Kanji; Matsumoto, Taisuke; Mori, Akira","3-Hydroxytropolone (2,7-dihydroxycyclohepta-2,4,6-trien-1-one)","Acta Crystallographica Section E","2007","63","2","o941","o943","10.1107/S1600536807003467","","","0.7107","MoKα","","","0.0357","","","","0.107","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212136","11.533","0.004","16.291","0.005","8.251","0.003","90","","107.66","0.03","90","","1477.2","0.9","293","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-isopropylidenepropanaminium triiodoplumbate","","- C6 H14 I3 N Pb -","- C6 H14 I3 N Pb -","- C24 H56 I12 N4 Pb4 -","4","1","DN2098","Elleuch, S.; Boughzala, H.; Driss, A.; Abid, Y.","A one-dimensional organic‒inorganic hybrid compound [(CH~3~)~2~C=NHCH~2~CH~2~CH~3~][PbI~3~]","Acta Crystallographica Section E","2007","63","2","m306","m308","10.1107/S160053680605392X","","","0.71073","MoKα","","0.0976","0.0554","","","0.1339","0.1521","","","","","","1.036","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212137","10.793","0.002","10.82","0.002","17.607","0.004","73.85","0.03","78.97","0.03","73.51","0.03","1879.6","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5-m-Tolyl-1,3,4-thiadiazol-2-ylamine","","- C9 H9 N3 S -","- C9 H9 N3 S -","- C72 H72 N24 S8 -","8","4","DN2107","Han, Feng; Wan, Rong; Wu, Wen-Yuan; Zhang, Jin-Jun; Wang, Jin-Tang","5-<i>m</i>-Tolyl-1,3,4-thiadiazol-2-ylamine","Acta Crystallographica Section E","2007","63","2","o717","o718","10.1107/S1600536807001596","","","0.71073","MoKα","","0.1271","0.0634","","","0.1234","0.15","","","","","","1.016","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212138","15.3237","0.0006","12.0171","0.0005","20.0773","0.0008","90","","90","","90","","3697.2","0.3","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N'-[(1E)-(5-Chloro-2-hydroxyphenyl)(phenyl)methylene]-2-hydroxybenzohydrazide","","- C20 H15 Cl N2 O3 -","- C20 H15 Cl N2 O3 -","- C160 H120 Cl8 N16 O24 -","8","1","DN2109","Jian-Guo Chang; Ying Cheng; Xi-Tao He","<i>N</i>'-[(1<i>E</i>)-(5-Chloro-2-hydroxyphenyl)(phenyl)methylene]-2-hydroxybenzohydrazide","Acta Crystallographica Section E","2007","63","2","o474","o475","10.1107/S1600536806055115","","","0.71073","MoKα","","0.0647","0.0395","","","0.0967","0.1152","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212139","6.854","0.0005","17.028","0.001","16.37","0.001","90","","96.016","0.001","90","","1900","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(2,2'-bipyridyl)bis(furan-2-carboxylato)zinc(II)","","- C20 H16 N2 O7 Zn -","- C20 H16 N2 O7 Zn -","- C80 H64 N8 O28 Zn4 -","4","1","DN2110","Ai, Chang-Chun; Xiang, Jiang-Feng; Li, Ming; Yuan, Liang-Jie","Aqua(2,2'-bipyridyl)bis(furan-2-carboxylato)zinc(II)","Acta Crystallographica Section E","2007","63","2","m565","m566","10.1107/S1600536807001791","","","0.71073","MoKα","","0.0376","0.0307","","","0.083","0.0872","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212140","25.0809","0.0015","6.7251","0.0004","18.9145","0.001","90","","97.658","0.006","90","","3161.9","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetrakis(1H-imidazole-κN^3^)zinc(II) bis(2-hydroxy-3,5-dinitrobenzoate)","","- C26 H22 N12 O14 Zn -","- C26 H22 N12 O14 Zn -","- C104 H88 N48 O56 Zn4 -","4","0.5","DN2111","Fu Huang; Wen-Dong Song; Si-Dong Li","Tetrakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc(II) bis(2-hydroxy-3,5-dinitrobenzoate)","Acta Crystallographica Section E","2007","63","2","m388","m389","10.1107/S1600536806055723","","","0.71073","MoKα","","0.0761","0.0419","","","0.0885","0.102","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212141","8.4248","0.0016","5.0585","0.0009","18.06","0.003","90","","91.128","0.003","90","","769.5","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-4-(2-Oxo-1,3-oxazolidin-3-ylcarbonyl)prop-2-enoic acid","","- C7 H7 N O5 -","- C7 H7 N O5 -","- C28 H28 N4 O20 -","4","1","DN2112","Shen, Yu-Dong; Wang, Yu; Xiao, Zhi-Li; Lei, Hong-Tao; Sun, Yuan-Ming","(<i>Z</i>)-3-(2-Oxo-1,3-oxazolidin-3-ylcarbonyl)prop-2-enoic acid","Acta Crystallographica Section E","2007","63","2","o710","o711","10.1107/S1600536807001377","","","0.71073","MoKα","","0.0495","0.0365","","","0.1005","0.1092","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212142","7.79","0.006","8.329","0.004","19.575","0.012","90","","90","","90","","1270.1","1.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-(2-methoxyphenoxy)phthalonitrile","","- C15 H10 N2 O2 -","- C15 H10 N2 O2 -","- C60 H40 N8 O8 -","4","1","DN2113","Ag̃ar, Ayşen; Ocak Ískeleli, Nazan","4-(2-Methoxyphenoxy)phthalonitrile","Acta Crystallographica Section E","2007","63","2","o712","o713","10.1107/S1600536807001055","","","0.71073","MoKα","","0.0342","0.0276","","","0.0678","0.0702","","","","","","1.012","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212143","10.347","0.002","10.744","0.002","15.121","0.003","98.99","0.03","109.88","0.03","91.45","0.03","1555.8","0.6","293","","293","","","","","","","","","6","P -1","-P 1","2","","Tetrakis(1H-benzimidazole-κN^3^)(sulfato-κO)copper(II) dimethyl sulfoxide solvate","","- C30 H30 Cu N8 O5 S2 -","- C30 H30 Cu N8 O5 S2 -","- C60 H60 Cu2 N16 O10 S4 -","2","1","DN2114","Sieroń, Lesław","Tetrakis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)(sulfato-κ<i>O</i>)copper(II) dimethyl sulfoxide solvate","Acta Crystallographica Section E","2007","63","2","m579","m580","10.1107/S1600536807001043","","","0.71073","MoKα","","0.0673","0.0409","","","0.0857","0.0917","","","","","","1.021","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212144","9.6183","0.0004","11.7082","0.0005","19.6458","0.0008","90","","90","","90","","2212.37","0.16","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Di-μ-chloro-bis({2-[(2-hydroxyethyl)iminomethyl]phenolato- κ^3^N,O,O'}nickel(II)) methanol solvate","","- C19 H24 Cl2 N2 Ni2 O5 -","- C19 H24 Cl2 N2 Ni2 O5 -","- C76 H96 Cl8 N8 Ni8 O20 -","4","1","DN2115","Van Hecke, Kristof; Nockemann, Peter; Binnemans, Koen; Van Meervelt, Luc","Di-μ-chloro-bis({2-[(2-hydroxyethyl)iminomethyl]phenolato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>'}nickel(II)) methanol solvate","Acta Crystallographica Section E","2007","63","2","m569","m571","10.1107/S1600536807002292","","","1.54178","CuKα","","0.0493","0.0405","","","0.0994","0.1038","","","","","","1.098","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212145","5.365","0.004","7.13","0.005","17.272","0.014","90","","90.39","0.03","90","","660.7","0.9","285","2","285","2","","","","","","","","5","P 1 21 1","P 2yb","4","1-(2',3'-dideoxy-4-H-2,3,5,6-tetradydro-1,4-thiazine-1,1 -dioxides-/b-D-ribo-furanosyl)uracil","1-[(4aS,5R,7R,7aS)-7-Hydroxymethyl-3,4,4a,5,7,7a-hexahydro-2H- furo[3,4-b][1,4]thiazin-5-yl]pyrimidine-2,4(1H,3H)-dione","","- C11 H15 N3 O6 S -","- C11 H15 N3 O6 S -","- C22 H30 N6 O12 S2 -","2","1","DN2116","Sun, Jing-Bo; Yang, Hua; Wu, Jin-Chang","1-[(4a<i>S</i>,5<i>R</i>,7<i>R</i>,7a<i>S</i>)-7-Hydroxymethyl-3,4,4a,5,7,7a-hexahydro-2<i>H</i>-furo[3,4-<i>b</i>][1,4]thiazin-5-yl]pyrimidine-2,4(1<i>H</i>,3<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","2","o978","o979","10.1107/S1600536807003170","","","0.71073","MoKα","","0.0553","0.0412","","","0.1005","0.1084","","","","","","1.082","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212146","4.9176","0.0015","18.048","0.005","17.532","0.005","90","","93.004","0.006","90","","1553.9","0.8","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Methyl 2-(2-carboxy-3-hydroxy-5-methylphenoxy)-5-hydroxy-3-methoxybenzoate","","- C17 H16 O8 -","- C17 H16 O8 -","- C68 H64 O32 -","4","1","DN2117","Fang, Mei-Juan; Fang, Hua; Wei, Zan-Bin; Pei, Dan-Qing; Zhao, Yu-Fen","Methyl 2-(2-carboxy-3-hydroxy-5-methylphenoxy)-5-hydroxy-3-methoxybenzoate","Acta Crystallographica Section E","2007","63","2","o894","o895","10.1107/S1600536807002280","","","0.71073","MoKα","","0.0752","0.0628","","","0.1627","0.1716","","","","","","1.068","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212147","12.0606","0.0001","11.2379","0.0001","12.9254","0.0001","90","","90.0093","0.0007","90","","1751.85","0.03","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[(tetrafluoroborato-κF)silver(I)]-μ-triphenylphosphine- κ^2^P:C^3^]","","- C18 H15 Ag B F4 P -","- C18 H15 Ag B F4 P -","- C72 H60 Ag4 B4 F16 P4 -","4","1","DN3031","Brayshaw, Simon K.; Molinos, Eduardo; Weller, Andrew S.","<i>catena</i>-Poly[[(tetrafluoroborato-κ<i>F</i>)silver(I)]-μ-triphenylphosphine-κ^2^<i>P</i>:<i>C</i>^3^]","Acta Crystallographica Section E","2007","63","2","m302","m303","10.1107/S1600536806054511","","","0.71073","MoKα","","0.0322","0.0284","","","0.0708","0.0725","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212148","21.5559","0.0011","3.6473","0.0001","19.4851","0.0008","90","","115.752","0.004","90","","1379.79","0.11","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","2-Aminopyridinium nitrate","","- C5 H7 N3 O3 -","- C5 H7 N3 O3 -","- C40 H56 N24 O24 -","8","2","ER2017","Rademeyer, Melanie","2-Aminopyridinium nitrate","Acta Crystallographica Section E","2007","63","2","o545","o546","10.1107/S1600536806055693","","","0.71073","MoKα","","0.0647","0.04","","","0.1099","0.1217","","","","","","1.046","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212149","11.516","0.003","7.429","0.002","16.101","0.003","90","","104.878","0.003","90","","1331.3","0.6","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Ethyl 6-methyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate","","- C14 H16 N2 O3 -","- C14 H16 N2 O3 -","- C56 H64 N8 O12 -","4","2","EZ2058","Qing-Fang Cheng; Xing-You Xu; Peng-Fei Shi; Xi-Lan Hu","Ethyl 6-methyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","2","o468","o469","10.1107/S1600536806055413","","","0.71073","MoKα","","0.102","0.062","","","0.156","0.18","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212150","17.814","0.002","6.8175","0.0008","8.7449","0.0011","90","","90","","90","","1062","0.2","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","2,4,6-trimethylanilinium iodide","","- C9 H14 I N -","- C9 H14 I N -","- C36 H56 I4 N4 -","4","0.5","FB2038","Lemmerer, Andreas; Billing, David G.","2,4,6-Trimethylanilinium iodide","Acta Crystallographica Section E","2007","63","2","o929","o931","10.1107/S160053680700253X","","","0.71073","MoKα","","0.0276","0.0228","","","0.0583","0.0598","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212151","9.25625","0.00005","12.36268","0.00006","6.22496","0.00003","90","","105.309","0.0004","90","","687.058","0.006","298","","298","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Dirubidium hexaaquacopper bis(sulfate)","","- Cu H12 O14 Rb2 S2 -","- Cu H12 O14 Rb2 S2 -","- Cu2 H24 O28 Rb4 S4 -","2","0.5","FI2025","Ballirano, Paolo; Belardi, Girolamo","Rietveld refinement of the Tutton's salt Rb~2~[Cu(H~2~O)~6~](SO~4~)~2~ from parallel-beam X-ray powder diffraction data","Acta Crystallographica Section E","2007","63","2","i56","i58","10.1107/S1600536807002656","","","1.54179","CuKα","","","","","","","","","","2.46","","","","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212152","6.3477","0.0002","12.4398","0.0003","14.1469","0.0005","90","","90","","90","","1117.1","0.06","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-C-Hydroxmethyl-2,3-O-isopropylidene-D-mannono-1,5-lactam","","- C10 H17 N O6 -","- C10 H17 N O6 -","- C40 H68 N4 O24 -","4","1","FL2067","Bream, Richard; Hunter, Stuart J.; Fleet, George W.J.; Watkin, David J.","2-<i>C</i>-Hydroxymethyl-2,3-<i>O</i>-isopropylidene-<small>D</small>-mannono-1,5-lactam","Acta Crystallographica Section E","2007","63","2","o621","o623","10.1107/S160053680700027X","","","0.71073","MoKα","","0.0341","0.0297","","0.0746","0.0726","0.0746","","","","","","0.9893","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212153","5.4995","0.0012","18.842","0.005","3.6943","0.0011","90","","94.83","0.02","90","","381.45","0.17","297","2","297","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","guanidinium hydrogen fumarate","guanidinium hydrogen fumarate","","- C5 H9 N3 O4 -","- C5 H9 N3 O4 -","- C10 H18 N6 O8 -","2","0.5","FL2081","Graham Smith; Urs D. Wermuth; David J. Young; Peter C. Healy","Anhydrous guanidinium hydrogen fumarate: a two-dimensional hydrogen-bonded network structure","Acta Crystallographica Section E","2007","63","2","o556","o557","10.1107/S1600536806056042","","","0.71073","MoKα","","0.0655","0.0403","","","0.1228","0.1431","","","","","","0.938","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212154","10.5485","0.0005","6.6177","0.0003","10.3714","0.0005","90","","90","","90","","723.99","0.06","180","2","180","2","","","","","","","","3","P n a 21","P 2c -2n","33","orthorhombic myo-inositol","myo-inositol","","- C6 H12 O6 -","- C6 H12 O6 -","- C24 H48 O24 -","4","1","FL2082","Khan, Uzma; Qureshi, Rizwana A.; Saeed, Sadaf; Bond, Andrew D.","An orthorhombic polymorph of <i>myo</i>-inositol","Acta Crystallographica Section E","2007","63","2","o530","o532","10.1107/S1600536806056339","","","0.71073","MoKα","","0.0319","0.0227","","","0.0469","0.0483","","","","","","0.99","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212155","9.5701","0.0003","17.3004","0.0006","10.9621","0.0004","90","","91.5878","0.0015","90","","1814.26","0.11","120","","120","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,3-Bis(dibromomethyl)-1-(phenylsulfonyl)-1H-indole","","- C16 H11 Br4 N O2 S -","- C16 H11 Br4 N O2 S -","- C64 H44 Br16 N4 O8 S4 -","4","1","FL2083","Rinderspacher, Alison; Gribble, Gordon W.; Jasinski, Jerry P.","2,3-Bis(dibromomethyl)-1-(phenylsulfonyl)-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","2","o666","o668","10.1107/S1600536807000554","","","0.71073","MoKα","","0.0391","0.0229","","0.0422","0.0354","0.0422","","","","","","1.0049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212156","11.383","0.0004","15.6589","0.0006","12.218","0.0005","90","","91.6083","0.0018","90","","2176.94","0.14","120","","120","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,3-(Dibenzyl)-1-(phenylsulfonyl)-1H-indole","","- C28 H23 N O2 S -","- C28 H23 N O2 S -","- C112 H92 N4 O8 S4 -","4","1","FL2084","Rinderspacher, Alison; Gribble, Gordon W.; Jasinski, Jerry P.","2,3-Dibenzyl-1-(phenylsulfonyl)-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","2","o669","o670","10.1107/S1600536807000566","","","0.71073","MoKα","","0.0608","0.0396","","0.1067","0.0989","0.0989","","","","","","1.0453","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212157","8.1279","0.0003","9.4993","0.0004","10.8126","0.0004","90","","90","","90","","834.83","0.06","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1,5-Anhydro-2,3-O-isopropylidene-L-lyxofuranose","(1S,4S,5S,6R)-5,6-O-isopropylidene-2,7-dioxabicyclo[2.2.1]heptane-5,6-diol","","- C8 H12 O4 -","- C8 H12 O4 -","- C32 H48 O16 -","4","1","FL2085","Simone, Michela; Fleet, George W. J.; Watkin, David J.","1,5-Anhydro-2,3-<i>O</i>-isopropylidene-<small>L</small>-lyxofuranose [(1<i>S</i>,4<i>S</i>,5<i>S</i>,6<i>R</i>)-5,6-<i>O</i>-isopropylidene-2,7-dioxabicyclo[2.2.1]heptane-5,6-diol]","Acta Crystallographica Section E","2007","63","2","o896","o897","10.1107/S160053680700311X","","","0.71073","MoKα","","0.0454","0.0307","","0.0492","0.0309","0.0309","","","","","","1.1446","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212158","9.974","0.003","22.729","0.007","6.384","0.002","90","","90","","90","","1447.2","0.8","298","2","298","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","N,N'-Bis(2-aminobenzyl)ethane-1,2-diamine","","- C16 H22 N4 -","- C16 H22 N4 -","- C64 H88 N16 -","4","0.5","FL2086","Rodríguez de Barbarín, Cecilia; Bernès, Sylvain; Nájera, Blanca; Elizondo, Perla; Cerda, Patricia","<i>N</i>,<i>N</i>'-Bis(2-aminobenzyl)ethane-1,2-diamine","Acta Crystallographica Section E","2007","63","2","o549","o550","10.1107/S1600536806056078","","","0.71073","MoKα","","0.0708","0.0523","","","0.1431","0.167","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212159","10.468","0.0015","11.9852","0.0018","12.4945","0.0019","90","","109.55","0.003","90","","1477.2","0.4","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2,3-Diiodo-1-(phenylsulfonyl)-1H-indole","","- C14 H9 I2 N O2 S -","- C14 H9 I2 N O2 S -","- C56 H36 I8 N4 O8 S4 -","4","1","FL2087","Rinderspacher, Alison; Gribble, Gordon W.; Butcher, Ray J.; Jasinski, Jerry P.","2,3-Diiodo-1-(phenylsulfonyl)-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","2","o671","o672","10.1107/S1600536807000578","","","0.71073","MoKα","","0.0509","0.0325","","0.082","0.0815","0.0815","","","","","","0.9451","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212160","6.059","0.0012","11.221","0.002","20.972","0.004","93.88","0.03","97.49","0.03","102.97","0.03","1370.7","0.5","295","2","295","2","","","","","","","","5","P -1","-P 1","2","adefovir dipivoxil","9-{2-[Bis(pivaloyloxymethoxy)phosphinylmethoxy]ethyl}adenine dihydrate","","- C20 H36 N5 O10 P -","- C20 H36 N5 O10 P -","- C40 H72 N10 O20 P2 -","2","1","FL2089","Ying Chang; Qi-Tai Zheng; Yang Lu","9-{2-[Bis(pivaloyloxymethoxy)phosphinylmethoxy]ethyl}adenine dihydrate","Acta Crystallographica Section E","2007","63","2","o1014","o1015","10.1107/S1600536807000736","","","0.71073","MoKα","","0.0895","0.0734","","","0.138","0.1462","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212161","13.112","0.013","8.35","0.008","13.299","0.013","90","","90.721","0.007","90","","1456","2","123.1","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","5-Benzyl-1,3,5-trimethylpyrimidine-2,4,6(1H,3H,5H)-trithione","","- C14 H16 N2 S3 -","- C14 H16 N2 S3 -","- C56 H64 N8 S12 -","4","1","FL2091","Takechi, Haruko; Kubo, Kanji; Takahashi, Hajime; Matsumoto, Taisuke","5-Benzyl-1,3,5-trimethylpyrimidine-2,4,6(1<i>H</i>,3<i>H</i>,5<i>H</i>)-trithione","Acta Crystallographica Section E","2007","63","2","o701","o703","10.1107/S1600536807000888","","","0.7107","MoKα","","","0.0279","","","","0.0892","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212162","12.959","0.0003","13.8003","0.0003","18.8288","0.0005","90","","122.34","0.003","90","","2845","0.15","173","2","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","lidocaine","2-(Diethylamino)-<i>N</i>-(2,6-dimethylphenyl)acetamide","","- C14 H22 N2 O -","- C14 H22 N2 O -","- C112 H176 N16 O8 -","8","2","FL2092","Bambagiotti-Alberti, Massimo; Bruni, Bruno; Di Vaira, Massimo; Giannellini, Valerio; Guerri, Annalisa","2-(Diethylamino)-<i>N</i>-(2,6-dimethylphenyl)acetamide, a low-temperature redetermination","Acta Crystallographica Section E","2007","63","2","o768","o770","10.1107/S1600536807001523","","","1.5418","CuKα","","0.0682","0.0471","","","0.1331","0.1497","","","","","","1.068","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212163","10.7922","0.0004","7.765","0.0003","23.344","0.0008","90","","116.789","0.002","90","","1746.3","0.12","100","0.1","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6,6'-Dimethyl-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenol","","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","- C88 H80 N8 O8 -","4","1","FL2093","Naser Eltaher Eltayeb; Siang Guan Teoh; Jeannie Bee-Jan Teh; Hoong-Kun Fun; Kamarulazizi Ibrahim","6,6'-Dimethyl-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenol","Acta Crystallographica Section E","2007","63","2","o766","o767","10.1107/S1600536807001122","","","0.71073","MoKα","","0.0871","0.0572","","","0.1483","0.1694","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212164","13.7699","0.0013","15.1323","0.0015","10.3635","0.0017","90","","112.105","0.001","90","","2000.7","0.4","299","2","299","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-[(2-Chlorothiazol-5-yl)methyl]-N'-[2-(2,4-dichlorophenoxy)acetyl]- 5-methyl-1H-1,2,3-triazole-4-carbohydrazide","","- C16 H13 Cl3 N6 O3 S -","- C16 H13 Cl3 N6 O3 S -","- C64 H52 Cl12 N24 O12 S4 -","4","1","FL2095","Man Yan; De-Qing Shi","1-[(2-Chlorothiazol-5-yl)methyl]-<i>N</i>'-[2-(2,4-dichlorophenoxy)acetyl]-5-methyl-1<i>H</i>-1,2,3-triazole-4-carbohydrazide","Acta Crystallographica Section E","2007","63","2","o953","o954","10.1107/S1600536807003182","","","0.71073","MoKα","","0.0722","0.053","","","0.1314","0.1485","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212165","5.7813","0.0001","14.6794","0.0002","14.2828","0.0002","90","","102.988","0.001","90","","1181.11","0.03","100","0.1","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-Benzoyl-2,4-bis(3-bromophenyl)cyclobutyl phenyl ketone","[3-Benzoyl-2,4-bis(3-bromophenyl)cyclobutyl](phenyl)methanone","","- C30 H22 Br2 O2 -","- C30 H22 Br2 O2 -","- C60 H44 Br4 O4 -","2","0.5","FL2096","Hoong-Kun Fun; Suchada Chantrapromma; Shyamaprosad Goswami; Subrata Jana","[3-Benzoyl-2,4-bis(3-bromophenyl)cyclobutyl](phenyl)methanone","Acta Crystallographica Section E","2007","63","2","o1069","o1070","10.1107/S1600536807004217","","","0.71073","MoKα","","0.0357","0.0263","","","0.058","0.0615","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212166","11.583","0.0003","11.0381","0.0002","11.955","0.0003","90","","94.127","0.001","90","","1524.53","0.06","100","0.1","297","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5,6-diphenyl-3-(2-pyridyl)-1,2,4-triazine","","- C20 H14 N4 -","- C20 H14 N4 -","- C80 H56 N16 -","4","1","FL2097","Naser Eltaher Eltayeb; Siang Guan Teoh; Shea-Lin Ng; Hoong-Kun Fun; Kamarulazizi Ibrahim","5,6-Diphenyl-3-(2-pyridyl)-1,2,4-triazine","Acta Crystallographica Section E","2007","63","2","o1041","o1042","10.1107/S1600536807004229","","","0.71073","MoKα","","0.0573","0.0468","","","0.123","0.1314","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212167","7.2075","0.0002","9.5645","0.0003","12.9851","0.0005","90","","90","","90","","895.14","0.05","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","2,3-<i>O</i>-Isopropylidene-L-apiono-1,4-lactone","(3<i>S</i>,4<i>S</i>)-3,4-dihydroxy-4-(hydroxymethyl)-3,4-di- <i>O</i>-isopropylidene-dihydrofuran-2(3<i>H</i>)-one","","- C8 H12 O5 -","- C8 H12 O5 -","- C32 H48 O20 -","4","1","FL2098","Best, Daniel; Jenkinson, Sarah F.; David J. Watkin; Kathrine V. Booth; Fleet, George W. J.","2,3-<i>O</i>-Isopropylidene-<small>L</small>-apiono-1,4-lactone [(3<i>S</i>,4<i>S</i>)-3,4-dihydroxy-4-(hydroxymethyl)-3,4-di-<i>O</i>-isopropylidene-4,5-dihydrofuran-2(3<i>H</i>)-one]","Acta Crystallographica Section E","2007","63","2","o1056","o1057","10.1107/S1600536807004230","","","0.71073","MoKα","","0.0321","0.0298","","0.0738","0.0722","0.0738","","","","","","0.9547","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212168","8.235","0.0007","15.4991","0.0013","11.991","0.0012","90","","100.387","0.003","90","","1505.4","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(1-Naphthylimino)-1-acenaphthen-1-one","","- C22 H13 N O -","- C22 H13 N O -","- C88 H52 N4 O4 -","4","1","GG3060","Silvino, Alexandre C.; Ferreira, Leonardo C.; Dias, Marcos L.; Filgueiras, Carlos Alberto L.; Hörner, Manfredo; Visentin, Lorenzo do C.; Bordinhao, Jairo","2-(1-Naphthylimino)-1-acenaphthen-1-one","Acta Crystallographica Section E","2007","63","2","o999","o1000","10.1107/S1600536806055243","","","0.71073","MoKα","","","0.0446","","","","0.1108","","","","","","1.006","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212169","14.699","0.003","3.968","0.0008","24.914","0.005","90","","105.67","0.03","90","","1399.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6-p-Tolyl-2,2'-bipyridinyl-4-carboxylic acid","","- C18 H14 N2 O2 -","- C18 H14 N2 O2 -","- C72 H56 N8 O8 -","4","1","GG3064","Qu, Wen-Shang; Wang, Guo-Yong; Du, Zhi-Ping; Lei, Tao; Cao, Qian-Yong","6-<i>p</i>-Tolyl-2,2'-bipyridinyl-4-carboxylic acid","Acta Crystallographica Section E","2007","63","2","o491","o492","10.1107/S160053680605522X","","","0.71073","MoKα","","0.1696","0.0485","","","0.1104","0.1431","","","","","","0.791","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212170","10.096","0.002","14.934","0.003","10.848","0.002","90","","110.52","0.03","90","","1531.8","0.6","180","2","180","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","decaaquadioxobis[μ~3~-N-(phosphonomethyl)iminodiacetato]dimanganesedivanadium dihydrate, [Mn~2~V~2~(C~5~H~6~NO~7~P)~2~O~2~(H~2~O)~10~].2H~2~O","","- C10 H36 Mn2 N2 O28 P2 V2 -","- C10 H32 Mn2 N2 O28 P2 V2 -","- C20 H64 Mn4 N4 O56 P4 V4 -","2","0.5","GK2046","Cunha-Silva, Luis; Shi, Fa-Nian; Klinowski, Jacek; Trindade, Tito; Rocha, João; Almeida Paz, Filipe A.","Decaaquadioxobis[μ~3~-<i>N</i>-(phosphonomethyl)iminodiacetato]dimanganesedivanadium dihydrate","Acta Crystallographica Section E","2007","63","2","m372","m375","10.1107/S1600536806054675","","","0.71073","MoKα","","0.0544","0.0396","","","0.1015","0.11","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212171","16.4814","0.0008","16.1107","0.0005","20.0624","0.001","90","","98.51","0.004","90","","5268.5","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hydroxonium bromide tetrakis(di-<i>tert</i>-butylmethylsilanol) monohydrate","","- C36 H93 Br O6 Si4 -","- C36 H93 Br O6 Si4 -","- C144 H372 Br4 O24 Si16 -","4","1","GK2047","Kückmann, Theresa I.; Lerner, Hans-Wolfram; Bolte, Michael","Dihydronium bromide tetrakis(di-<i>tert</i>-butylmethylsilanol)","Acta Crystallographica Section E","2007","63","2","o422","o423","10.1107/S1600536806054985","","","0.71073","MoKα","","0.0631","0.0485","","","0.1053","0.1112","","","","","","1.065","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212172","6.71","0.0013","9.738","0.0019","28.383","0.006","90","","90","","90","","1854.6","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Methyl <i>ent</i>-16β,17-epoxykauran-19-oate","","- C21 H32 O3 -","- C21 H32 O3 -","- C84 H128 O12 -","4","1","GK2048","Batista, Ronan; García, Pablo A.; Castro, María A.; del Corral, José M. Miguel; Sanz, Francisca; Speziali, Nivaldo L.; de Oliveira, Alaíde B.","Methyl <i>ent</i>-16β,17-epoxykauran-19-oate","Acta Crystallographica Section E","2007","63","2","o932","o933","10.1107/S1600536807002693","","","1.5418","CuKα","","0.0487","0.0367","","","0.0776","0.0816","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212173","8.1899","0.0002","8.714","0.0002","11.4579","0.0003","91.0513","0.0011","102.635","0.0011","92.0117","0.0012","797.13","0.03","90","0.2","90","0.2","","","","","","","","5","P -1","-P 1","2","","3-carboxy-2-(2,6-dimethylphenylamino)pyridinium 2,2,2-trifluoroacetate","","- C16 H15 F3 N2 O4 -","- C16 H15 F3 N2 O4 -","- C32 H30 F6 N4 O8 -","2","1","GK2049","Long, Sihui; Parkin, Sean; Li, Tonglei","3-Carboxy-2-(2,6-dimethylphenylamino)pyridinium trifluoroacetate","Acta Crystallographica Section E","2007","63","2","o906","o907","10.1107/S1600536807002747","","","0.71073","MoKα","","0.0712","0.0461","","","0.1159","0.1319","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212174","40.462","0.012","4.7732","0.0014","11.719","0.004","90","","90","","90","","2263.3","1.2","120","2","120","2","","","","","","","","4","P n a 21","P 2c -2n","33","4,5-bis(phthalimidomethyl)acridine","N,N'-(acridine-4,5-diyldimethylene)bisphthalimide","","- C31 H19 N3 O4 -","- C31 H19 N3 O4 -","- C124 H76 N12 O16 -","4","1","GK2051","Tapper, Sophia; Fry, Fiona H.; Simpson, Stephen J.; Tucker, James H.R.","4,5-Bis(phthalimidomethyl)acridine","Acta Crystallographica Section E","2007","63","2","o719","o720","10.1107/S1600536807001602","","","0.6905","synchrotron","","0.0455","0.0422","","","0.1074","0.1097","","","","","","1.112","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212175","10.358","0.001","6.183","0.001","20.726","0.001","90","","92.48","0.01","90","","1326.1","0.3","119","2","119","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","N,N,N',N'-Tetrakis(carboxymethyl)-2,2'-(ethylenedioxy)dianilinium dichloride dihydrate","","- C22 H30 Cl2 N2 O12 -","- C22 H30 Cl2 N2 O12 -","- C44 H60 Cl4 N4 O24 -","2","0.5","GK2053","John W. Raynor; Maksymilian Chruszcz; Wladek Minor","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrakis(carboxymethyl)-2,2'-(ethylenedioxy)dianilinium dichloride dihydrate","Acta Crystallographica Section E","2007","63","2","o754","o756","10.1107/S1600536807001559","","","0.71074","MoKα","","0.0437","0.0342","","","0.0929","0.0975","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212176","15.8202","0.0005","7.6963","0.0003","7.4449","0.0003","90","","101.293","0.002","90","","888.92","0.06","293","2","295","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","eakerite","dicalcium tin dialuminosilicate dihydroxide dihydrate","","- Al2 Ca2 H6 O22 Si6 Sn -","- Al2 Ca2 H6 O22 Si6 Sn -","- Al4 Ca4 H12 O44 Si12 Sn2 -","2","0.5","HB2229","Uchida, Hinako; Downs, Robert T.; Thompson, Richard M.","Reinvestigation of eakerite, Ca~2~SnAl~2~Si~6~O~18~(OH)~2~·2H~2~O: H-atom positions by single-crystal X-ray diffraction and correlation with Raman spectroscopic data","Acta Crystallographica Section E","2007","63","2","i47","i49","10.1107/S1600536807002000","","","0.71073","MoKα","","0.0358","0.0267","","","0.0625","0.0656","","","","","","1.05","","","","has coordinates","282541","2023-04-10","17:11:17",""
"2212177","11.835","0.003","7.3428","0.001","18.034","0.003","90","","106.958","0.016","90","","1499","0.5","293","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-[(2-Hydroxynaphthalen-1-yl)(phenyl)methyl]acetamide","","- C19 H17 N O2 -","- C19 H17 N O2 -","- C76 H68 N4 O8 -","4","1","HB2234","Mosslemin, Mohammad Hossein; Arab-Salmanabadi, Samira; Masoudi, Mozhgan","<i>N</i>-[(2-Hydroxynaphthalen-1-yl)(phenyl)methyl]acetamide","Acta Crystallographica Section E","2007","63","2","o444","o445","10.1107/S1600536806053840","","","0.71073","MoKα","","","0.0452","","","","0.1135","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212178","7.4774","0.0002","14.2242","0.0003","6.5726","0.0001","90","","94.284","0.001","90","","697.11","0.03","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dipotassium μ-oxo-bis[aqua(oxalato-κ^2^O,O')dioxomolybdenum(VI)]","","- C4 H4 K2 Mo2 O15 -","- C4 H4 K2 Mo2 O15 -","- C8 H8 K4 Mo4 O30 -","2","0.5","HB2238","Cunha-Silva, Luis; Monteiro, Bernardo; Pillinger, Martyn; Gonçalves, Isabel S.; Rocha, João; Almeida Paz, Filipe A.","Redetermination of dipotassium μ-oxo-bis[aqua(oxalato-κ^2^<i>O</i>,<i>O</i>')dioxomolybdate(VI)] at 150 K","Acta Crystallographica Section E","2007","63","2","m376","m378","10.1107/S1600536806055930","","","0.71073","MoKα","","0.0204","0.0201","","","0.0635","0.0637","","","","","","1.232","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212179","22.4368","0.0011","7.1515","0.0004","28.9753","0.0019","90","","90","","90","","4649.3","0.5","173","2","173","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","di-μ-aqua-κ^4^O^1^:O^1'^-bis(μ-2,5-dianilinoterephthalo- κ^2^O:O')bis[triaquacalcium(I)] tetrahydrate","","- C40 H52 Ca2 N4 O20 -","- C40 H52 Ca2 N4 O20 -","- C160 H208 Ca8 N16 O80 -","4","0.5","HB2239","Schmidt, Martin U.; Schmiermund, Torsten; Bolte, Michael","Calcium anilate hexahydrate","Acta Crystallographica Section E","2007","63","2","m360","m362","10.1107/S160053680605553X","","","0.71073","MoKα","","0.1212","0.0977","","","0.2624","0.2746","","","","","","1.136","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212180","10.5595","0.0003","14.5801","0.0004","11.5436","0.0004","90","","114.128","0.001","90","","1621.97","0.09","120","2","120","2","","","","","","","","6","P 1 21 1","P 2yb","4","","trans-Tetrachloridobis{(E)-1-[(E)(1R,4R)-1,7,7- trimethylbicyclo[2.2.1]hept-2-ylideneaminooxy]propylidenamine}platinum(IV)","","- C26 H44 Cl4 N4 O2 Pt -","- C26 H44 Cl4 N4 O2 Pt -","- C52 H88 Cl8 N8 O4 Pt2 -","2","1","HB2240","Zamaratskikh, Ekaterina S.; Khripun, Anatoly V.; Haukka, Matti; Balova, Irina A.","Tetrachloridobis{(<i>E</i>)-1-[(<i>E</i>)-(1<i>R</i>,4<i>R</i>)-1,7,7-trimethylbicyclo[2.2.1]hept-2-ylideneaminooxy]propylideneamine}platinum(IV)","Acta Crystallographica Section E","2007","63","2","m589","m590","10.1107/S1600536807002395","","","0.71073","MoKα","","0.0397","0.0285","","","0.0606","0.0878","","","","","","1.141","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212181","12.729","0.004","4.1724","0.0007","12.498","0.004","90","","113.1","0.03","90","","610.6","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Cesium terephthalate dihydrate","Poly[di-μ~3~-aqua-μ~4~-terephthalato-dicaesium]","","- C8 H8 Cs2 O6 -","- C8 H8 Cs2 O6 -","- C16 H16 Cs4 O12 -","2","0.5","HB2241","Stein, Irena; Ruschewitz, Uwe","Poly[di-μ~3~-aqua-μ~4~-terephthalato-dicaesium]","Acta Crystallographica Section E","2007","63","2","m382","m384","10.1107/S1600536806055954","","","0.71073","MoKα","","0.0506","0.0326","","","0.0748","0.082","","","","","","0.963","","","","has coordinates,has Fobs","223448","2020-10-21","18:00:00",""
"2212182","22.646","0.007","6.3642","0.0019","13.795","0.004","90","","97.96","0.005","90","","1969","1","294","2","294","2","","","","","","","","4","C 1 2 1","C 2y","5","","1,3-Bis(5,5-dimethyl-2-oxo-1,3,2-dioxaphosphinan-2-yloxy)benzene","","- C16 H24 O8 P2 -","- C16 H24 O8 P2 -","- C64 H96 O32 P8 -","4","1","HB2242","Li, Xiao-Jun; Sun, Shu-Juan; Wang, Jing; Wang, Yan-Fei","1,3-Bis(5,5-dimethyl-2-oxo-1,3,2-dioxaphosphinan-2-yloxy)benzene","Acta Crystallographica Section E","2007","63","2","o619","o620","10.1107/S1600536806055425","","","0.71073","MoKα","","0.0714","0.0406","","","0.0783","0.0895","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212183","3.7973","0.0005","7.1528","0.0009","25.336","0.003","90","","90.386","0.011","90","","688.14","0.15","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(2E)-1-(2,4-Dichlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one","","- C15 H9 Cl2 N O3 -","- C15 H9 Cl2 N O3 -","- C30 H18 Cl4 N2 O6 -","2","1","HB2244","Yathirajan, H. S.; Mayekar, A. N.; Sarojini, B. K.; Narayana, B.; Bolte, Michael","(2<i>E</i>)-1-(2,4-Dichlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o424","o425","10.1107/S1600536806055073","","","0.71073","MoKα","","0.0431","0.0372","","","0.0905","0.0933","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212184","12.181","0.003","6.0387","0.0016","14.606","0.004","90","","90","","90","","1074.4","0.5","294","2","294","2","","","","","","","","3","P n a 21","P 2c -2n","33","","2,2,6,6-Tetrakis(hydroxymethyl)cyclohexanol","","- C10 H20 O5 -","- C10 H20 O5 -","- C40 H80 O20 -","4","1","HB2246","Hua, Chao; Li, Xin-Gang; Xu, Shi-Min","2,2,6,6-Tetrakis(hydroxymethyl)cyclohexanol","Acta Crystallographica Section E","2007","63","2","o547","o548","10.1107/S1600536806055450","","","0.71073","MoKα","","0.0305","0.0274","","","0.0666","0.0687","","","","","","1.12","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212185","8.4127","0.0008","11.727","0.001","8.108","0.0008","90","","90","","90","","799.9","0.13","296","2","296","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Poly[methylammonium tri-μ~2~-formato-κ^6^O:O'-zinc(II)]","","- C4 H9 N O6 Zn -","- C4 H9 N O6 Zn -","- C16 H36 N4 O24 Zn4 -","4","0.5","HB2247","Chun-Xiang Wang; Xiao-Mei Zhou; Wen-Yuan Shi","Poly[methylammonium tri-μ~2~-formato-κ^6^<i>O</i>:<i>O</i>'-zinc(II)]","Acta Crystallographica Section E","2007","63","2","m411","m412","10.1107/S1600536806056248","","","0.71073","MoKα","","0.0549","0.0504","","","0.1101","0.1151","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212186","8.961","0.0006","8.9726","0.0006","14.3248","0.0011","80.455","0.009","84.444","0.009","70.235","0.008","1067.87","0.14","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","Tricarbonyl[tris(pyrazol-1-yl)methanesulfonato-κ^3^N,N',N""]rhenium(I) acetone solvate","","- C16 H15 N6 O7 Re S -","- C16 H15 N6 O7 Re S -","- C32 H30 N12 O14 Re2 S2 -","2","1","HB2248","Kunz, Peter; Kurz, Philipp; Spingler, Bernhard; Alberto, Roger","Tricarbonyl[tris(pyrazol-1-yl)methanesulfonato-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']rhenium(I) acetone solvate","Acta Crystallographica Section E","2007","63","2","m363","m364","10.1107/S1600536806055942","","","0.71073","MoKα","","0.0428","0.0351","","","0.0832","0.0855","","","","","","0.919","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212187","9.751","0.002","7.088","0.0014","11.982","0.002","90","","98.6","0.03","90","","818.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Methylbenzamidoxime","","- C8 H10 N2 O -","- C8 H10 N2 O -","- C32 H40 N8 O4 -","4","1","HB2249","Wang, Hai-Bo; Ding, Wei-Lin; Xing, Zhi-Tao; Wang, Pin-Liang","2-Methylbenzamidoxime","Acta Crystallographica Section E","2007","63","2","o487","o488","10.1107/S160053680605598X","","","0.71073","MoKα","","0.0815","0.0595","","","0.1692","0.1892","","","","","","1.078","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212188","11.32","0.002","7.776","0.0016","18.802","0.004","90","","90","","90","","1655","0.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-Nitrobenzamidoxime","","- C7 H7 N3 O3 -","- C7 H7 N3 O3 -","- C56 H56 N24 O24 -","8","1","HB2250","Xing, Zhi-Tao; Ding, Wei-Lin; Wang, Hai-Bo; Wang, Pin-Liang","4-Nitrobenzamidoxime","Acta Crystallographica Section E","2007","63","2","o489","o490","10.1107/S1600536806056066","","","0.71073","MoKα","","0.1701","0.0733","","","0.1649","0.2003","","","","","","0.977","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212189","9.421","0.002","9.729","0.002","11.65","0.003","76.749","0.004","68.154","0.003","88.666","0.004","962.5","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Tetrakis[3-(pyrazin-2-yloxy)pyridine-κN]dithiocyanatomanganese(II)","","- C38 H28 Mn N14 O4 S2 -","- C38 H28 Mn N14 O4 S2 -","- C38 H28 Mn N14 O4 S2 -","1","0.5","HB2251","Zhao, Hong-Yan; Shi, Jing-Min; Liu, Lian-Dong","Tetrakis[3-(pyrazin-2-yloxy)pyridine-κ<i>N</i>]dithiocyanatomanganese(II)","Acta Crystallographica Section E","2007","63","2","m441","m442","10.1107/S1600536807000487","","","0.71073","MoKα","","0.0693","0.0531","","","0.113","0.1204","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212190","7.029","0.006","9.851","0.007","14.12","0.002","107.125","0.005","94.622","0.005","100.513","0.005","909.2","1","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","(2-Ethoxyphenyl)[4-(6-fluorobenzo[d]isoxazol-3-yl)piperidin-1-yl]methanone","","- C21 H21 F N2 O3 -","- C21 H21 F N2 O3 -","- C42 H42 F2 N4 O6 -","2","1","HB2252","Naveen, S.; Basappa; Sridhar, M. A.; Shashidhara Prasad, J.; Rangappa, K. S.","(2-Ethoxyphenyl)[4-(6-fluorobenzo[<i>d</i>]isoxazol-3-yl)piperidin-1-yl]methanone","Acta Crystallographica Section E","2007","63","2","o642","o643","10.1107/S1600536807000396","","","0.71073","MoKα","","0.0543","0.0463","","","0.1304","0.1419","","","","","","1.147","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2212191","15.5414","0.0014","15.205","0.0012","9.1174","0.0008","90","","100.73","0.007","90","","2116.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","carvedilol","1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol","","- C24 H26 N2 O4 -","- C24 H26 N2 O4 -","- C96 H104 N8 O16 -","4","1","HB2253","Yathirajan, H. S.; Bindya, S.; Sreevidya, T. V.; Narayana, B.; Bolte, Michael","A second polymorph of carvedilol","Acta Crystallographica Section E","2007","63","2","o542","o544","10.1107/S1600536807000414","","","0.71073","MoKα","","0.0576","0.0403","","","0.0986","0.1056","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212192","5.4047","0.0019","6.9777","0.0018","9.678","0.004","90","","96.23","0.03","90","","362.8","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diimidazo[1,5-a;1',5'-d]pyrazine-5,10-dione","","- C8 H4 N4 O2 -","- C8 H4 N4 O2 -","- C16 H8 N8 O4 -","2","0.5","HB2254","Castillejo Merchán, Alejandro; Stoeckli-Evans, Helen","Diimidazo[1,5-<i>a</i>;1',5'-<i>d</i>]pyrazine-5,10-dione","Acta Crystallographica Section E","2007","63","2","o636","o637","10.1107/S160053680700061X","","","0.71073","MoKα","","0.0641","0.0412","","","0.095","0.1037","","","","","","0.968","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212193","13.0411","0.0013","8.9177","0.0009","18.8692","0.0019","90","","98.289","0.002","90","","2171.5","0.4","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tetrakis(guanidinium) butane-1,2,3,4-tetracarboxylate","","- C12 H30 N12 O8 -","- C12 H30 N12 O8 -","- C48 H120 N48 O32 -","4","0.5","HB2255","McKee, Vickie; Najafpour, M. Mahdi","Tetrakis(guanidinium) butane-1,2,3,4-tetracarboxylate","Acta Crystallographica Section E","2007","63","2","o741","o743","10.1107/S1600536807000724","","","0.71073","MoKα","","0.0466","0.0358","","","0.0831","0.0887","","","","","","1.105","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212194","7.5263","0.0008","7.5835","0.001","9.0853","0.001","90","","100.361","0.008","90","","510.09","0.1","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(1H-Imidazol-1-yl)ethanone","","- C5 H6 N2 O -","- C5 H6 N2 O -","- C20 H24 N8 O4 -","4","1","HB2256","Castillejo Merchán, Alejandro; Stoeckli-Evans, Helen","1-(1<i>H</i>-Imidazol-1-yl)ethanone","Acta Crystallographica Section E","2007","63","2","o638","o639","10.1107/S1600536807000608","","","0.71073","MoKα","","0.043","0.0368","","","0.0952","0.0987","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212195","9.753","0.0006","9.3216","0.0008","10.792","0.007","90","","110.462","0.004","90","","919.2","0.6","173","1","173","1","","","","","","","","4","P 1 21 1","P 2yb","4","","tert-Butyl 2,2-dimethyl-4-(3-phenyl-2,5-dihydrofuran-2-yl)oxazolidine-3-carboxylate","","- C20 H27 N O4 -","- C20 H27 N O4 -","- C40 H54 N2 O8 -","2","1","HB2257","Erdsack, Jörg; Schürmann, Markus; Preut, Hans; Krause, Norbert","<i>tert</i>-Butyl 2,2-dimethyl-4-(3-phenyl-2,5-dihydrofuran-2-yl)oxazolidine-3-carboxylate","Acta Crystallographica Section E","2007","63","2","o664","o665","10.1107/S1600536807000839","","","0.71073","MoKα","","0.0547","0.0285","","","0.0539","0.0567","","","","","","0.899","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212196","7.9908","0.0007","8.5918","0.0007","11.5799","0.0009","91.934","0.001","92.149","0.001","104.319","0.001","769.02","0.11","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Triaqua(1,10-phenanthroline)sulfatocopper(II) monohydrate","","- C12 H16 Cu N2 O8 S -","- C12 H16 Cu N2 O8 S -","- C24 H32 Cu2 N4 O16 S2 -","2","1","HB2258","An, Zhe; Wu, Yan-Li; Lin, Feng; Zhu, Ling","Triaqua(1,10-phenanthroline)sulfatocopper(II) monohydrate","Acta Crystallographica Section E","2007","63","2","m477","m478","10.1107/S1600536807000591","","","0.71073","MoKα","","0.0299","0.0295","","","0.0893","0.0895","","","","","","1.115","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212197","22.278","0.006","5.8647","0.0016","8.254","0.002","90","","106.357","0.003","90","","1034.8","0.5","100","2","273","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","daab","2,2'-diaminoazobenzene","","- C12 H12 N4 -","- C12 H12 N4 -","- C48 H48 N16 -","4","0.5","HB2260","Bohle, D. Scott; Dorans, Kirsten S.; Fotie, Jean","<i>trans</i>-Bis(2-aminophenyl)diazene","Acta Crystallographica Section E","2007","63","2","o889","o890","10.1107/S1600536807002413","","","0.71073","MoKα","","0.0355","0.0335","","","0.0953","0.0982","","","","","","1.032","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212198","7.329","0.002","19.023","0.005","12.723","0.003","90","","101.845","0.005","90","","1736.1","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-benzyl-4-chloro-1-(4-nitrobenzyloxy)benzene","","- C20 H16 Cl N O3 -","- C20 H16 Cl N O3 -","- C80 H64 Cl4 N4 O12 -","4","1","HB2261","Song-Qing Wang; Jian Cao; Xiu-Jie Liu","2-Benzyl-4-chloro-1-(4-nitrobenzyloxy)benzene","Acta Crystallographica Section E","2007","63","2","o683","o684","10.1107/S1600536807001067","","","0.71073","MoKα","","0.1001","0.0527","","","0.1266","0.1526","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212199","25.467","0.007","4.3831","0.0013","12.587","0.004","90","","90.238","0.005","90","","1405","0.7","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Bromo-2-(1-naphthyliminomethyl)phenol","","- C17 H12 Br N O -","- C17 H12 Br N O -","- C68 H48 Br4 N4 O4 -","4","1","HB2262","Xi-Shi Tai; Jie Yin; Yi-Min Feng","4-Bromo-2-(1-naphthyliminomethyl)phenol","Acta Crystallographica Section E","2007","63","2","o699","o700","10.1107/S1600536807001158","","","0.71073","MoKα","","0.1064","0.0657","","","0.1517","0.1714","","","","","","1.107","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212200","7.488","0.0008","12.1608","0.0011","30.347","0.002","90","","90","","90","","2763.4","0.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(E)-3-(2-Methoxyphenyl)-1-(4-nitrophenyl)prop-2-en-1-one","","- C16 H13 N O4 -","- C16 H13 N O4 -","- C128 H104 N8 O32 -","8","1","HB2264","Ma, Ji-Long","(<i>E</i>)-3-(2-Methoxyphenyl)-1-(4-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o806","o807","10.1107/S1600536807001420","","","0.71073","MoKα","","0.1895","0.0782","","","0.1632","0.2161","","","","","","0.996","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212201","13.252","0.003","15.431","0.003","13.974","0.003","90","","110.62","0.03","90","","2674.5","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-3-(4-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one","","- C16 H13 N O4 -","- C16 H13 N O4 -","- C128 H104 N8 O32 -","8","2","HB2266","Ma, Ji-Long","(<i>E</i>)-3-(4-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o808","o809","10.1107/S1600536807001432","","","0.71073","MoKα","","0.2547","0.0883","","","0.145","0.2054","","","","","","0.986","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212202","9.551","0.003","6.1213","0.0019","20.847","0.007","90","","90.881","0.006","90","","1218.7","0.7","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Hexamethylenediammonium bis(3,5-dinitrobenzoate)","","- C20 H24 N6 O12 -","- C20 H24 N6 O12 -","- C40 H48 N12 O24 -","2","0.5","HB2267","Wang, Zi-Liang; Wei,Lin-heng","Hexamethylenediammonium bis(3,5-dinitrobenzoate)","Acta Crystallographica Section E","2007","63","2","o995","o996","10.1107/S1600536807003546","","","0.71073","MoKα","","0.0802","0.0527","","","0.1337","0.146","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212203","4.9483","0.0008","9.0841","0.0012","11.7256","0.0016","111.881","0.008","91.747","0.007","95.604","0.008","485.49","0.12","113","2","113","2","","","","","","","","3","P -1","-P 1","2","","2-(1,3-Benzodioxol-5-ylmethyl)acrylic acid","","- C11 H10 O4 -","- C11 H10 O4 -","- C22 H20 O8 -","2","1","HB2268","Song-Qing Wang; Xiao-Ci Yang; Xiu-Jie Liu","2-(1,3-Benzodioxol-5-ylmethyl)acrylic acid","Acta Crystallographica Section E","2007","63","2","o831","o832","10.1107/S1600536807002504","","","0.7107","MoKα","","0.0882","0.0556","","","0.132","0.1511","","","","","","0.936","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212204","18.302","0.004","8.096","0.0016","24.553","0.005","90","","90","","90","","3638.1","1.3","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","6,6'-Bis(2H-1,2,3-benzotriazol-2-yl)-4,4'-bis(2,4,4-trimethylpentan-2-yl)- 2,2'-methylenebiphenol","","- C41 H50 N6 O2 -","- C41 H50 N6 O2 -","- C164 H200 N24 O8 -","4","0.5","HB2269","Xing, Zhi-Tao; Ding, Wei-Lin; Wang, Hai-Bo; Wu, Wen-Yuan; Yin, Jun","6,6'-Bis(2<i>H</i>-1,2,3-benzotriazol-2-yl)-4,4'-bis(2,4,4-trimethylpentan-2-yl)-2,2'-methylenebiphenol","Acta Crystallographica Section E","2007","63","2","o819","o820","10.1107/S1600536807002474","","","0.71073","MoKα","","0.1919","0.0896","","","0.1635","0.1974","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212205","10.4085","0.0009","10.4157","0.0009","12.1694","0.0009","92.565","0.007","99.915","0.007","116.88","0.009","1147.8","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Bis(tetraphenylarsonium) hexabromorhenate(IV)","","- C48 H40 As2 Br6 Re -","- C48 H40 As2 Br6 Re -","- C48 H40 As2 Br6 Re -","1","0.5","HB2271","Kochel, Andrzej","Bis(tetraphenylarsonium) hexabromorhenate(IV)","Acta Crystallographica Section E","2007","63","2","m596","m597","10.1107/S1600536807003662","","","0.71073","MoKα","","0.0624","0.0343","","","0.0636","0.0691","","","","","","0.93","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212206","4.555","0.0009","6.879","0.0014","28.715","0.006","91.37","0.03","90.58","0.03","101.21","0.03","882.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-Chlorobenzamide oxime monohydrate","","- C7 H9 Cl N2 O2 -","- C7 H9 Cl N2 O2 -","- C28 H36 Cl4 N8 O8 -","4","2","HB2276","Xing, Zhi-Tao; Ding, Wei-Lin; Wang, Hai-Bo; Yin, Jun; Han, Feng","2-Chlorobenzamide oxime monohydrate","Acta Crystallographica Section E","2007","63","2","o1019","o1020","10.1107/S1600536807004114","","","0.71073","MoKα","","0.1066","0.0716","","","0.162","0.191","","","","","","1.059","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212207","8.8677","0.0018","21.968","0.004","6.0078","0.0012","90","","107.78","0.03","90","","1114.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,5-dibromo-2,2,6,6-tetramethylpiperidin-4-one","","- C9 H15 Br2 N O -","- C9 H15 Br2 N O -","- C36 H60 Br8 N4 O4 -","4","1","HB2280","Jiong Zhao; Dezhi Luan; Ying Qi; Hao Gao; Ling-Huo Jiang","3,5-Dibromo-2,2,6,6-tetramethylpiperidin-4-one","Acta Crystallographica Section E","2007","63","2","o1023","o1024","10.1107/S1600536807004291","","","0.71073","MoKα","","0.0595","0.0425","","","0.0827","0.09","","","","","","0.994","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212208","5.8894","0.0007","7.6197","0.0011","13.4112","0.0017","91.86","0.007","91.695","0.005","105.246","0.006","579.89","0.13","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","[(+/-)-<i>cis</i>-8a-Hydroxy-2-oxoperhydronaphthalen-4a-yl]propanenitrile","","- C13 H19 N O2 -","- C13 H19 N O2 -","- C26 H38 N2 O4 -","2","1","HG2132","Zewge, Daniel; Malak, Muhammad H.; Thompson, Hugh W.; Lalancette, Roger A.; Brunskill, Andrew P. J.","(±)-(<i>cis</i>-8a-Hydroxy-2-oxoperhydronaphthalen-4a-yl)propanenitrile: hydrogen bonding in a Robinson-annulation intermediate","Acta Crystallographica Section E","2007","63","2","o479","o481","10.1107/S160053680605478X","","","1.54178","CuKα","","0.037","0.037","","","0.096","0.096","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212209","10.01","0.011","14.723","0.017","20.21","0.02","90","","98.716","0.019","90","","2944","6","292","2","292","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","μ-4,4'-Bipyridine-k^2^N:N'-bis[(2,2'-bipyridine-k^2^N,N')(triphenylphosphine- κP)copper(I)] bis(tetrafluoroborate)","","- C66 H54 B2 Cu2 F8 N6 P2 -","- C66 H54 B2 Cu2 F8 N6 P2 -","- C132 H108 B4 Cu4 F16 N12 P4 -","2","0.5","HG2137","Wang, De-Hui; Song, Li-Qiang; Chen, Jian-Hua; Chen, Yong; Fu, Wen-Fu","μ-4,4'-Bipyridine-κ^2^<i>N</i>:<i>N</i>'-bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(triphenylphosphine-κ<i>P</i>)copper(I)] bis(tetrafluoroborate)","Acta Crystallographica Section E","2007","63","2","m474","m476","10.1107/S1600536806049531","","","0.71073","MoKα","","0.1155","0.0602","","","0.1192","0.1379","","","","","","1.032","","","","has coordinates,has disorder","176787","2020-10-21","18:00:00",""
"2212210","11.2208","0.0014","14.8301","0.0015","23.188","0.003","90","","94.284","0.006","90","","3847.8","0.8","120","1","120","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Chlorido(6-diphenylphosphino-2-pyridonato-κ^2^P,N)(6-diphenylphosphino- 2-hydroxypyridine-κ^2^P,N)hydridoiridium(III) chloroform 1.896-solvate","","- C35.896 H29.896 Cl6.688 Ir N2 O2 P2 -","- C35.9 H29.9 Cl6.7 Ir N2 O2 P2 -","- C143.6 H119.6 Cl26.8 Ir4 N8 O8 P8 -","4","1","HG2140","Takayuki Miyabayashi; Takeshi Hara; Tsuneaki Yamagata; Kazushi Mashima","Chlorido(6-diphenylphosphino-2-pyridonato-κ^2^<i>P</i>,<i>N</i>)(6-diphenylphosphino-2-hydroxypyridine-κ^2^<i>P</i>,<i>N</i>)hydridoiridium(III) chloroform 1.896-solvate","Acta Crystallographica Section E","2007","63","2","m576","m578","10.1107/S1600536807002462","","","0.71075","MoKα","","0.0343","0.0303","","","0.0649","0.0664","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212211","9.4309","0.0018","9.6032","0.0019","11.71","0.002","69.963","0.002","83.866","0.002","69.171","0.002","931.1","0.3","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","1,10-Phenanthrolinium 2,4,5-tricarboxybenzoate","","- C22 H14 N2 O8 -","- C22 H14 N2 O8 -","- C44 H28 N4 O16 -","2","1","HG2145","Ping Li; Xiao-Yong Tang; Rong-Hua Zeng; Shan-Tang Yue","1,10-Phenanthrolinium 2,4,5-tricarboxybenzoate","Acta Crystallographica Section E","2007","63","2","o448","o449","10.1107/S1600536806054444","","","0.71073","MoKα","","0.041","0.0378","","","0.1011","0.1044","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212212","8.7213","0.0017","12.53","0.003","15.135","0.003","90","","101.29","0.03","90","","1621.9","0.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[5-Fluoro-2-(4-iodo-2-nitrophenylsulfanyl)phenyl]-N,N-dimethylmethanamine","","- C15 H14 F I N2 O2 S -","- C15 H14 F I N2 O2 S -","- C60 H56 F4 I4 N8 O8 S4 -","4","1","HG2155","Guo, Yun-Hang; Liu, Bo-Li","[5-Fluoro-2-(4-iodo-2-nitrophenylsulfanyl)phenyl]-<i>N</i>,<i>N</i>-dimethylmethanamine","Acta Crystallographica Section E","2007","63","2","o416","o417","10.1107/S1600536806054869","","","0.71073","MoKα","","0.0248","0.0219","","","0.0551","0.0566","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212213","8.5801","0.0007","10.1489","0.0008","11.9189","0.0009","97.5154","0.0012","98.4549","0.0013","92.4718","0.0013","1015.72","0.14","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","2,4,6-Tris(2-pyridylsulfanylmethyl)-1,3,5-triazine","","- C21 H18 N6 S3 -","- C21 H18 N6 S3 -","- C42 H36 N12 S6 -","2","1","HG2156","Amoore, Jarrod J. M.; Kepert, Cameron J.","2,4,6-Tris(2-pyridylsulfanylmethyl)-1,3,5-triazine","Acta Crystallographica Section E","2007","63","2","o482","o484","10.1107/S1600536806054456","","","0.71073","MoKα","","0.0336","0.0298","","","0.0764","0.0801","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212214","12.503","0.0002","13.7366","0.0002","16.7164","0.0004","90","","90","","90","","2871.02","0.09","150","1","150","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3,6-O,O-Diacetylswietenolide 0.25-hydrate","","- C31 H38.5 O10.25 -","- C31 H38.5 O10.25 -","- C124 H154 O41 -","4","1","HG2158","Robert G. Fowles; Baldwin S. Mootoo; Russel Ramsewak; William Reynolds; Alan J. Lough","3,6-Di-<i>O</i>-acetylswietenolide 0.25-hydrate","Acta Crystallographica Section E","2007","63","2","o660","o661","10.1107/S1600536806054432","","","0.71073","MoKα","","0.056","0.0388","","","0.0893","0.0977","","","","","","1.031","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212215","10.196","0.002","12.905","0.003","10.639","0.002","90","","104.882","0.003","90","","1352.9","0.5","446","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(4-Fluoro-3-nitrophenyl)ferrocene","","- C16 H12 F Fe N O2 -","- C16 H12 F Fe N O2 -","- C64 H48 F4 Fe4 N4 O8 -","4","1","HG2159","Quan-Xuan Zhang; Qing-Bin Xue; Liang-Yi Qie","(4-Fluoro-3-nitrophenyl)ferrocene","Acta Crystallographica Section E","2007","63","2","m335","m336","10.1107/S1600536806054912","","","0.71073","MoKα","","0.0443","0.0372","","","0.0947","0.0995","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212216","7.7119","0.0015","5.4554","0.0011","26.385","0.005","90","","94.61","0.03","90","","1106.5","0.4","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 4-p-tolyl-1H-pyrrole-2-carboxylate","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C52 H52 N4 O8 -","4","1","HG2160","Michael G. Gardiner; Roderick C. Jones; Sarah Ng; Jason A. Smith","Methyl 4-<i>p</i>-tolyl-1<i>H</i>-pyrrole-2-carboxylate","Acta Crystallographica Section E","2007","63","2","o470","o471","10.1107/S1600536806055103","","","0.71073","MoKα","","0.0581","0.044","","","0.1163","0.1352","","","","","","1.082","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212217","8.2088","0.0003","8.7386","0.0003","8.9678","0.0003","107.49","0.002","104.69","0.002","107.429","0.002","542.05","0.04","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Bis{2-[(2-hydroxyethyl)iminomethyl]phenolato}gold(III) tetrachloroaurate(III)","","- C18 H20 Au2 Cl4 N2 O4 -","- C18 H20 Au2 Cl4 N2 O4 -","- C18 H20 Au2 Cl4 N2 O4 -","1","0.5","HG2161","Nockemann, Peter; Van Hecke, Kristof; Van Meervelt, Luc; Binnemans, Koen","Bis{2-[(2-hydroxyethyl)iminomethyl]phenolato}gold(III) tetrachloroaurate(III)","Acta Crystallographica Section E","2007","63","2","m402","m404","10.1107/S1600536806055358","","","1.54178","CuKα","","0.0629","0.0591","","","0.1667","0.1711","","","","","","1.114","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212218","6.955","0.0001","10.9089","0.0002","14.5481","0.0003","90","","92.034","0.001","90","","1103.09","0.03","90","0.2","90","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E)-1-[(2-Methoxyphenyl)methyleneamino]guanidinium chloride","","- C9 H13 Cl N4 O -","- C9 H13 Cl N4 O -","- C36 H52 Cl4 N16 O4 -","4","1","HG2162","Sonar, Vijayakumar N.; Neelakantan, Sundar; Siegler, Maxime; Crooks, Peter A.","(<i>E</i>)-1-[(2-Methoxyphenyl)methyleneamino]guanidinium chloride","Acta Crystallographica Section E","2007","63","2","o535","o536","10.1107/S1600536806055383","","","0.71073","MoKα","","0.0702","0.0434","","","0.105","0.1188","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212219","8.5125","0.0012","10.0649","0.0014","12.4028","0.0017","105.305","0.005","95.552","0.009","101.563","0.006","991.5","0.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","2,3,4-Trichloro-6-(diethylamino)-9-oxo-9H-xanthene-1-carboxylic acid methanol solvate","","- C19 H18 Cl3 N O5 -","- C19 H18 Cl3 N O5 -","- C38 H36 Cl6 N2 O10 -","2","1","HG2164","Zhang, Hai-Feng; Sun, Bao-Sheng; Zhao, Xin-Hua; Yan, Fan-Yong","2,3,4-Trichloro-6-(diethylamino)-9-oxo-9<i>H</i>-xanthene-1-carboxylic acid methanol solvate","Acta Crystallographica Section E","2007","63","2","o863","o864","10.1107/S1600536807002437","","","0.7107","MoKα","","0.0966","0.0396","","","0.0762","0.0928","","","","","","0.824","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212220","10.127","0.003","10.036","0.003","14.7","0.004","90","","90.23","0.03","90","","1494","0.7","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","N-[tert-Butoxycarbonylglycyl-(Z)-α,β-dehydrophenylalanylglycyl- (Z)-α,β-dehydrophenylalanyl]glycine methyl ester","","- C30 H35 N5 O8 -","- C30 H35 N5 O8 -","- C60 H70 N10 O16 -","2","1","HG2166","Makowski, Maciej; Lisowski, Marek; Mikołajczyk, Iwona; Lis, Tadeusz","<i>N</i>-[<i>tert</i>-Butoxycarbonylglycyl-(<i>Z</i>)-α,β-dehydrophenylalanylglycyl-(<i>Z</i>)-α,β-dehydrophenylalanyl]glycine methyl ester","Acta Crystallographica Section E","2007","63","2","o989","o991","10.1107/S1600536807002966","","","1.5418","CuKα","","0.0406","0.0378","","","0.0993","0.1019","","","","","","1.123","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212221","8.6406","0.0002","9.3336","0.0002","13.3911","0.0003","90","","102.719","0.002","90","","1053.46","0.04","295","","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[bis(2-amino-1,3-benzothiazole-κN^3^)copper(II)]-μ- adipato-κ^4^O,O':O'',O''']","","- C20 H20 Cu N4 O4 S2 -","- C20 H20 Cu N4 O4 S2 -","- C40 H40 Cu2 N8 O8 S4 -","2","0.5","HG2167","Sieroń, Lesław","<i>catena</i>-Poly[[bis(2-amino-1,3-benzothiazole-κ<i>N</i>^3^)copper(II)]-μ-adipato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section E","2007","63","2","m598","m600","10.1107/S1600536807003534","","","0.71073","MoKα","","0.0264","0.0218","","","0.0564","0.0606","","","","","","1.103","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212222","9.772","0.002","11.104","0.002","12.588","0.003","100.14","0.03","109.8","0.03","111.17","0.03","1127","0.7","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","(R)-Diethyl [(4-chlorophenyl)(5-m-tolyl-1,3,4-thiadiazol-2-ylamino)methyl]phosphonate","","- C20 H23 Cl N3 O3 P S -","- C20 H23 Cl N3 O3 P S -","- C40 H46 Cl2 N6 O6 P2 S2 -","2","1","HG2168","Wan, Rong; Han, Feng; Cao, Lin; Zhang, Jin-Jun; Wang, Jin-Tang","(<i>R</i>)-Diethyl [(4-chlorophenyl)(5-<i>m</i>-tolyl-1,3,4-thiadiazol-2-ylamino)methyl]phosphonate","Acta Crystallographica Section E","2007","63","2","o934","o935","10.1107/S1600536807003212","","","0.71073","MoKα","","0.1299","0.0822","","","0.1805","0.2096","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212223","7.526","0.002","8.057","0.002","13.932","0.003","92.944","0.003","92.93","0.003","115.649","0.002","758","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","2,8-Dimethyl-1,9-dinitro Tröger's base","2,8-Dimethyl-1,9-dinitro-6H,12H-5,11-methanodibenzo[b,f][1,5]diazocine","","- C17 H16 N4 O4 -","- C17 H16 N4 O4 -","- C34 H32 N8 O8 -","2","1","HG2169","Bhuiyan, M. Delower H.; Jensen, Paul; Try, Andrew C.","2,8-Dimethyl-1,9-dinitro-6<i>H</i>,12<i>H</i>-5,11-methanodibenzo[<i>b</i>,<i>f</i>][1,5]diazocine","Acta Crystallographica Section E","2007","63","2","o908","o909","10.1107/S1600536807002991","","","0.71073","MoKα","","0.0405","0.0357","","","0.1005","0.1057","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212224","8.438","0.006","6.048","0.002","8.774","0.005","90","","101.29","0.03","90","","439.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","3-Carboxylpyridinium oxalate","3-carboxypyridinium oxalate","","- C8 H7 N O6 -","- C8 H7 N O6 -","- C16 H14 N2 O12 -","2","0.5","HG2170","S. Athimoolam; S. Natarajan","3-Carboxypyridinium hydrogen oxalate","Acta Crystallographica Section E","2007","63","2","o963","o965","10.1107/S1600536807003200","","","0.71073","MoKα","","0.0463","0.0375","","","0.1007","0.108","","","","","","1.077","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212225","6.2302","0.0013","12.712","0.003","15.65","0.003","111.814","0.004","90.354","0.004","95.088","0.004","1145.1","0.4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Poly[tris[3-(3-pyridyl)acrylato]samarium(III)]","","- C24 H18 N3 O6 Sm -","- C24 H18 N3 O6 Sm -","- C48 H36 N6 O12 Sm2 -","2","1","HK2173","Li, Wen-Ge; Pan, Zhao-Rui; Wang, Zuo-Wei; Li, Yi-Zhi; Zheng, He-Gen","Poly[tris[μ~2~-3-(3-pyridyl)acrylato]samarium(III)]","Acta Crystallographica Section E","2007","63","2","m351","m352","10.1107/S1600536806055127","","","0.71073","MoKα","","0.0641","0.0524","","","0.1136","0.1164","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212226","6.3173","0.0013","10.97","0.002","13.956","0.003","73.277","0.003","80.566","0.003","89.565","0.003","912.9","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 4-(4-methoxyphenyl)-2-methyl-1,4-dihydrobenzo[4,5]imidazo[1,2-a]pyrimidine- 3-carboxylate","","- C21 H21 N3 O3 -","- C21 H21 N3 O3 -","- C42 H42 N6 O6 -","2","1","HK2179","Zi-Qiang Tang; Qing-Qing Shao; Dian-Xiang Zhou","Ethyl 4-(4-methoxyphenyl)-2-methyl-1,4-dihydrobenzo[4,5]imidazo[1,2-<i>a</i>]pyrimidine-3-carboxylate","Acta Crystallographica Section E","2007","63","2","o450","o452","10.1107/S1600536806054614","","","0.71073","MoKα","","0.0791","0.0469","","","0.1144","0.1373","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212227","9.76","0.002","6.6015","0.0016","10.5","0.003","90","","90","","90","","676.5","0.3","294","2","294","2","","","","","","","","4","P c c a","-P 2a 2ac","54","copper oxalate trihydrate","Poly[diaqua-μ-oxalato-copper(II) monohydrate]","","- C2 H6 Cu O7 -","- C2 H6 Cu O7 -","- C8 H24 Cu4 O28 -","4","0.5","HK2180","Wu, Wen-Yuan; Zhai, Li-Xin","Poly[diaqua-μ-oxalato-copper(II) monohydrate]","Acta Crystallographica Section E","2007","63","2","m429","m430","10.1107/S1600536806055437","","","0.71073","MoKα","","0.0796","0.0695","","","0.1803","0.1835","","","","","","1.62","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212228","27.187","0.003","9.01","0.002","19.133","0.003","90","","110.25","0.002","90","","4397","1.3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5-Cyclopropyl-7,7-dimethyl-10-(3-nitrophenyl)-7,8-dihydro-5H- indeno[1,2-b]quinoline-9,11(6H,10H)-dione","","- C27 H24 N2 O4 -","- C27 H24 N2 O4 -","- C216 H192 N16 O32 -","8","1","HK2181","Yan Chen; Shu-Jiang Tu; Bo Jiang","5-Cyclopropyl-7,7-dimethyl-10-(3-nitrophenyl)-7,8-dihydro-5<i>H</i>-indeno[1,2-<i>b</i>]quinoline-9,11(6<i>H</i>,10<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","2","o553","o555","10.1107/S1600536806056340","","","0.71073","MoKα","","0.1918","0.066","","","0.1592","0.245","","","","","","1.005","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212229","7.225","0.0014","8.222","0.0016","8.647","0.0017","74.21","0.03","75.65","0.03","67.96","0.03","452.01","0.19","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","2-(2-Methyl-3-nitrophenyl)acetic acid","","- C9 H9 N O4 -","- C9 H9 N O4 -","- C18 H18 N2 O8 -","2","1","HK2182","Ai-Hua Lu; Jun-Ping Wang; You-Sheng Chen; Hong-Sheng Jia; Hong-Fei Ma","2-(2-Methyl-3-nitrophenyl)acetic acid","Acta Crystallographica Section E","2007","63","2","o528","o529","10.1107/S1600536806055401","","","0.71073","MoKα","","0.0711","0.0472","","","0.1079","0.1174","","","","","","1.075","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212230","9.5476","0.0013","10.8917","0.0014","15.346","0.002","101.203","0.002","94.189","0.002","100.215","0.002","1531","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","1-(4-fluorobenzyl)pyridinium 7,7,8,8-tetracyanoquinodimethanide 7,7,8,8-tetracyanoquinodimethane","","- C37 H21 F N9 -","- C37 H21 F N9 -","- C74 H42 F2 N18 -","2","1","HK2184","Liu, Guang-Xiang","An ion-pair complex composed of one 1-(4-fluorobenzyl)pyridinium cation, one 7,7,8,8-tetracyanoquinodimethanide anion and a neutral 7,7,8,8-tetracyanoquinodimethane molecule","Acta Crystallographica Section E","2007","63","2","o704","o706","10.1107/S1600536807000967","","","0.71073","MoKα","","0.1006","0.0442","","","0.0787","0.0874","","","","","","1.006","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212231","7.2123","0.0012","10.4116","0.0017","18.331","0.003","90","","98.259","0.004","90","","1362.2","0.4","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-(benzoyloxy)benzoate","","- C16 H14 O4 -","- C16 H14 O4 -","- C64 H56 O16 -","4","1","HK2185","Rashid Iqbal; Muhammad Zareef; Saeeda Aziz; Ghulam Qadeer; Muhammad Arfan","Ethyl 2-(benzoyloxy)benzoate","Acta Crystallographica Section E","2007","63","2","o744","o745","10.1107/S1600536807001316","","","0.71073","MoKα","","0.1875","0.1523","","","0.2533","0.2699","","","","","","1.323","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212232","10.8033","0.0013","13.7485","0.0016","13.325","0.0016","90","","108.863","0.002","90","","1872.9","0.4","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Triethylammonium 3,5-dinitrobenzoate 1,4-dihydroxybenzene hemisolvate","","- C32 H44 N6 O14 -","- C32 H44 N6 O14 -","- C64 H88 N12 O28 -","2","0.5","HK2186","Jian-Wen Tian; Yan-Yan Liu","Triethylammonium 3,5-dinitrobenzoate 1,4-dihydroxybenzene hemisolvate","Acta Crystallographica Section E","2007","63","2","o858","o859","10.1107/S1600536807002218","","","0.71073","MoKα","","0.1232","0.0638","","","0.1834","0.2266","","","","","","1.046","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2212233","23.42","0.003","7.9307","0.0011","12.6046","0.0018","90","","103.433","0.002","90","","2277.1","0.5","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(Benzyloxy)-2-fluorobenzonitrile","","- C14 H10 F N O -","- C14 H10 F N O -","- C112 H80 F8 N8 O8 -","8","1","HK2188","Lian-Zhong Yan; Sai Bi; Rui Ren","4-(Benzyloxy)-2-fluorobenzonitrile","Acta Crystallographica Section E","2007","63","2","o775","o776","10.1107/S1600536807001390","","","0.71073","MoKα","","0.0959","0.0737","","","0.2178","0.2436","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212234","7.4807","0.0008","7.7018","0.0008","15.8021","0.0017","86.934","0.002","85.235","0.002","66.91","0.003","834.39","0.15","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","2-(Cyanomethoxy)benzonitrile","","- C9 H6 N2 O -","- C9 H6 N2 O -","- C36 H24 N8 O4 -","4","2","HK2189","Narasimhamurthy, T.; Shashidhar; Shivashankar, S. A.; Vittala Reddy, P.; Rathore, R. S.","2-(Cyanomethoxy)benzonitrile","Acta Crystallographica Section E","2007","63","2","o796","o798","10.1107/S1600536807001912","","","0.71073","MoKα","","0.1315","0.0669","","","0.1429","0.1696","","","","","","1.009","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212235","4.9158","0.0003","10.3166","0.0006","9.8656","0.0006","90","","102.411","0.007","90","","488.64","0.05","291","","291","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2,4-triazolium bromide","","- C2 H4 Br N3 -","- C2 H4 Br N3 -","- C8 H16 Br4 N12 -","4","1","HK2192","Sieroń, Lesław","1,2,4-Triazolium bromide","Acta Crystallographica Section E","2007","63","2","o904","o905","10.1107/S1600536807003108","","","0.71073","MoKα","","0.0173","0.0159","","","0.0411","0.0416","","","","","","1.086","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212238","10.023","0.002","13.941","0.003","11.239","0.002","90","","106.478","0.003","90","","1505.9","0.5","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-4,4'-Bipyridine-κ^2^N:N'-bis[triaqua(pyridine-2,4-dicarboxylato- κ^2^N,O^2^)zinc(II)] dihydrate","","- C24 H30 N4 O16 Zn2 -","- C24 H30 N4 O16 Zn2 -","- C48 H60 N8 O32 Zn4 -","2","0.5","HY2032","Xiu-Mei Li; Yan-Ling Niu; Qing-Wei Wang; Bo Liu","μ-4,4'-Bipyridine-κ^2^<i>N</i>:<i>N</i>'-bis[triaqua(pyridine-2,4-dicarboxylato-κ^2^<i>N</i>,<i>O</i>^2^)zinc(II)] dihydrate","Acta Crystallographica Section E","2007","63","2","m487","m488","10.1107/S1600536807001328","","","0.71073","MoKα","","0.065","0.0364","","","0.055","0.0607","","","","","","0.827","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212239","10.174","0.003","12.312","0.003","12.711","0.004","90","","90","","90","","1592.2","0.8","298","2","298","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Bis(3-aminopyridine-κN)diisothiocyanatozinc(II)","","- C12 H12 N6 S2 Zn -","- C12 H12 N6 S2 Zn -","- C48 H48 N24 S8 Zn4 -","4","0.5","HY2035","Wan-Long Pan; Xue-Li Niu; Wang Tang; Chang-Wen Hu","Bis(3-aminopyridine-κ<i>N</i>)diisothiocyanatozinc(II)","Acta Crystallographica Section E","2007","63","2","m304","m305","10.1107/S1600536806054791","","","0.71073","MoKα","","0.0474","0.0294","","","0.0722","0.0869","","","","","","1.086","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212240","24.399","0.001","11.9075","0.0006","16.8717","0.0008","90","","107.421","0.001","90","","4676.9","0.4","120","","120","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diaquabis{3-methyl-1-phenyl-4-[(E)-phenyl(phenyliminio)methyl]-1H-pyrazol- 5-olato-κ^2^O,N^4^}nickel(II) dimethyl sulfoxide disolvate","","- C50 H52 N6 Ni O6 S2 -","- C50 H52 N6 Ni O6 S2 -","- C200 H208 N24 Ni4 O24 S8 -","4","0.5","HY2038","Agnete la Cour; Alan Hazell","Diaquabis{3-methyl-1-phenyl-4-[(<i>E</i>)-phenyl(phenyliminio)methyl]-1<i>H</i>-pyrazol-5-olato-κ^2^<i>O</i>,<i>N</i>^4^}nickel(II) dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2007","63","2","m330","m331","10.1107/S1600536806055887","","","0.71073","MoKα","","","0.03","","","","0.027","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212241","10.4046","0.0004","18.0223","0.0007","14.0282","0.0005","90","","104.989","0.001","90","","2540.99","0.17","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[2,2'-(butane-1,4-diyl)bis(1H-benzimidazolium)] α-octamolybdate(VI)","","- C36 H40 Mo8 N8 O26 -","- C36 H40 Mo8 N8 O26 -","- C72 H80 Mo16 N16 O52 -","2","0.5","HY2039","Li-Jun Wang; Hong Jiang; Yong Wang; Kui-Zhan Shao; Zhong-Min Su","Bis[2,2'-(butane-1,4-diyl)bis(1<i>H</i>-benzimidazolium)] α-octamolybdate(VI)","Acta Crystallographica Section E","2007","63","2","m584","m586","10.1107/S1600536807003017","","","0.71073","MoKα","","0.0466","0.0281","","","0.0472","0.0489","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212242","5.853","0.0012","21.587","0.004","13.278","0.003","90","","99.48","0.03","90","","1654.7","0.6","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[bis[1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl) -3-quinoline carboxylato-κ^3^O,O':N]cobalt(II) dihydrate]","","- C32 H38 Co F2 N6 O8 -","- C32 H34 Co F2 N6 O8 -","- C64 H68 Co2 F4 N12 O16 -","2","0.5","HY2041","An, Zhe; Xu, Wen; Wang, Rong-Shun","Poly[[bis[μ-1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)quinoline-3-carboxylato-κ^3^<i>O</i>^3^,<i>O</i>^4^:<i>N</i>^7^]cobalt(II)] dihydrate]","Acta Crystallographica Section E","2007","63","2","m507","m508","10.1107/S1600536806056510","","","0.71073","MoKα","","0.0581","0.0428","","","0.1316","0.142","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212243","10.313","0.004","11.462","0.004","11.668","0.004","82.418","0.007","74.33","0.007","64.749","0.007","1200.9","0.8","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","2,2'-(9,10-Dioxo-9,10-dihydroanthracene-1,8-diyldioxy)bis(N,N-diethylacetamide)","","- C26 H30 N2 O6 -","- C26 H30 N2 O6 -","- C52 H60 N4 O12 -","2","1","IS2109","Shao-Jin Gu; Lin-Hai Jing; Huan-Xia Zhang; Da-Bin Qin","2,2'-(9,10-Dioxo-9,10-dihydroanthracene-1,8-diyldioxy)bis(<i>N</i>,<i>N</i>-diethylacetamide)","Acta Crystallographica Section E","2007","63","2","o563","o564","10.1107/S1600536806053347","","","0.71073","MoKα","","0.1133","0.0482","","","0.1161","0.1498","","","","","","1.004","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212244","9.2644","0.0002","10.7251","0.0002","12.9015","0.0002","90","","90","","90","","1281.91","0.04","230","0.1","297","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl 2-(2-methoxycarbonylacetamido)-3-methylbutyrate","","- C10 H17 N O5 -","- C10 H17 N O5 -","- C40 H68 N4 O20 -","4","1","IS2116","Zurina Shaameri; Norlida Kamarulzaman; Ahmad Sazali Hamzah; Shea-Lin Ng; Hoong-Kun Fun","Methyl 2-(2-methoxycarbonylacetamido)-3-methylbutyrate","Acta Crystallographica Section E","2007","63","2","o457","o458","10.1107/S1600536806054304","","","0.71073","MoKα","","0.0672","0.0481","","","0.1313","0.1469","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212245","7.8316","0.0004","21.025","0.0009","32.0885","0.0013","90","","90","","90","","5283.7","0.4","100","0.1","100","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","7-Glycoloyl-2-hydroxy-1,4b,7,10a-tetramethyl-4a,4b,5,6,7,8,8a,9,10,10a- decahydro-3(4H)-phenanthrenone","7-Glycoloyl-2-hydroxy-1,4b,7,10a-tetramethyl-4a,4b,5,6,7,8,8a,9,10,10a- decahydrophenanthren-3(4H)-one","","- C20 H30 O4 -","- C20 H30 O4 -","- C240 H360 O48 -","12","3","IS2118","Suchada Chantrapromma; Hoong-Kun Fun; Charoen Pakhathirathien; Chatchanok Karalai; Kan Chantrapromma","7-Glycoloyl-2-hydroxy-1,4b,7,10a-tetramethyl-4a,4b,5,6,7,8,8a,9,10,10a-decahydrophenanthren-3(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","2","o459","o461","10.1107/S1600536806054717","","","0.71073","MoKα","","0.0591","0.0476","","","0.1174","0.1344","","","","","","1.088","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212246","19.467","0.004","5.063","0.001","12.152","0.002","90","","90.09","0.03","90","","1197.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Phenyl-6-(methylsulfanyl)thiazolo[5,4-b]pyridine","","- C13 H10 N2 S2 -","- C13 H10 N2 S2 -","- C52 H40 N8 S8 -","4","1","IS2120","Yu, Yong-Qiang; Wang, Yue; Ni, Pei-Zhou; Lu, Tao","6-(Methylsulfanyl)-2-phenylthiazolo[5,4-<i>b</i>]pyridine","Acta Crystallographica Section E","2007","63","2","o968","o969","10.1107/S1600536807003030","","","0.71073","MoKα","","0.0919","0.0515","","","0.1528","0.2015","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212247","11.584","0.002","13.704","0.003","7.0359","0.0013","90","","103.877","0.003","90","","1084.3","0.4","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(2-Hydroxyphenyl)isoindoline-1,3-dione","","- C14 H9 N O3 -","- C14 H9 N O3 -","- C56 H36 N4 O12 -","4","1","IS2121","Li, Jian; Liang, Zu-Pei; Wang, Hui-Qin","2-(2-Hydroxyphenyl)isoindoline-1,3-dione","Acta Crystallographica Section E","2007","63","2","o627","o628","10.1107/S1600536807000670","","","0.71073","MoKα","","0.0676","0.0477","","","0.1313","0.1456","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212248","7.2439","0.0005","10.4665","0.0007","11.7952","0.0008","90.45","0.05","96.869","0.005","90.84","0.05","887.74","0.11","223","2","223","2","","","","","","","","3","P -1","-P 1","2","","1,2,3-Triiodobenzene","","- C6 H3 I3 -","- C6 H3 I3 -","- C24 H12 I12 -","4","2","IS2125","Novak, Igor; Li, Dongbo","1,2,3-Triiodobenzene","Acta Crystallographica Section E","2007","63","2","o438","o439","10.1107/S1600536806054535","","","0.71073","MoKα","","0.0397","0.0339","","","0.083","0.0857","","","","","","1.056","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2212249","14.2256","0.0015","6.4531","0.0007","15.0426","0.0016","90","","101.865","0.0014","90","","1351.4","0.3","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","p-Tolyl 2-O-benzyl-3,5-O-(di-tert-butylsilanediyl)-1-thio-α-D-arabinofuranoside","","- C27 H38 O4 S Si -","- C27 H38 O4 S Si -","- C54 H76 O8 S2 Si2 -","2","1","IS2129","Nacario, Ruel C.; Lowary, Todd L.; McDonald, Robert","<i>p</i>-Tolyl 2-<i>O</i>-benzyl-3,5-<i>O</i>-(di-<i>tert</i>-butylsilanediyl)-1-thio-α-<small>D</small>-arabinofuranoside","Acta Crystallographica Section E","2007","63","2","o498","o500","10.1107/S1600536806054729","","","0.71073","MoKα","","0.0442","0.0362","","","0.086","0.0908","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212250","7.992","0.002","18.501","0.008","11.165","0.005","90","","101.34","0.02","90","","1618.6","1.1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethyl 6b,9a-dihydroxyacenaphtho[1,2-c]thiophene-7,9-dicarboxylate","","- C18 H16 O6 S -","- C18 H16 O6 S -","- C72 H64 O24 S4 -","4","1","IS2130","Jimenez, Raphael P.; Parvez, Masood; Sutherland, Todd C.","Dimethyl 6b,9a-dihydroxyacenaphtho[1,2-<i>c</i>]thiophene-7,9-dicarboxylate","Acta Crystallographica Section E","2007","63","2","o504","o505","10.1107/S1600536806055711","","","0.71073","MoKα","","0.0726","0.0434","","","0.0951","0.1091","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212251","10.09","0.005","10.97","0.005","11.678","0.005","115.254","0.005","112.401","0.005","95.258","0.005","1029.7","0.8","294","2","","","","","","","","","","4","P -1","-P 1","2","","trans-N,N'-Bis(3-methoxysalicylidene)-1,2-cyclohexanediamine","","- C22 H26 N2 O4 -","- C22 H26 N2 O4 -","- C44 H52 N4 O8 -","2","1","IS2133","Aslantaş, Mehmet; Tümer, Mehmet; Şahin, Ertan; Tümer, Ferhan","<i>trans</i>-<i>N</i>,<i>N</i>'-Bis(3-methoxysalicylidene)cyclohexane-1,2-diamine","Acta Crystallographica Section E","2007","63","2","o644","o645","10.1107/S1600536807000438","","","0.71073","MoKα","","","0.0611","","","","0.1785","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212252","8.6025","0.001","8.959","0.0011","11.4191","0.0013","83.598","0.001","74.289","0.001","61.744","0.001","746.09","0.15","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[diaquabis(N,N'-dimethylformamide)cobalt(II)]- μ-1,4-benzenedicarboxylato-κ^2^O:O'] N,N'-dimethylformamide solvate monohydrate]","","- C20 H40 Co N4 O12 -","- C20 H40 Co N4 O12 -","- C20 H40 Co N4 O12 -","1","0.5","IS2134","Chun-Xiao Jia","<i>catena</i>-Poly[[[diaquabis(<i>N</i>,<i>N</i>-dimethylformamide)cobalt(II)]-μ-1,4-benzenedicarboxylato-κ^2^<i>O</i>:<i>O</i>'] <i>N</i>,<i>N</i>-dimethylformamide solvate monohydrate]","Acta Crystallographica Section E","2007","63","2","m615","m616","10.1107/S1600536807002942","","","0.71073","MoKα","","0.047","0.0444","","","0.1227","0.1247","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212253","8.1971","0.0009","11.1416","0.0012","16.0917","0.0017","90","","98.538","0.002","90","","1453.3","0.3","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-[1-(4,6-Dimethoxypyrimidin-2-yl)-1H-pyrazol-3-yl]phenol","","- C15 H14 N4 O3 -","- C15 H14 N4 O3 -","- C60 H56 N16 O12 -","4","1","IS2135","Yuan-Xiang Li; Ya-Zhou Wang","2-[1-(4,6-Dimethoxypyrimidin-2-yl)-1<i>H</i>-pyrazol-3-yl]phenol","Acta Crystallographica Section E","2007","63","2","o873","o874","10.1107/S1600536807001821","","","0.71073","MoKα","","0.0555","0.0447","","","0.1199","0.1284","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212254","7.7131","0.0003","19.664","0.0008","12.9518","0.0004","90","","90","","90","","1964.4","0.13","100","0.1","100","0.1","","","","","","","","6","P n a 21","P 2c -2n","33","","cis-1-(4-Bromophenyl)-6-ethyl-5-tosylperhydropyrrolo[3,4-b]pyrrole","","- C21 H25 Br N2 O2 S -","- C21 H25 Br N2 O2 S -","- C84 H100 Br4 N8 O8 S4 -","4","1","IS2137","K. Chinnakali; M. Poornachandran; R. Raghunathan; Hoong-Kun Fun","<i>cis</i>-1-(4-Bromophenyl)-6-ethyl-5-tosylperhydropyrrolo[3,4-<i>b</i>]pyrrole","Acta Crystallographica Section E","2007","63","2","o650","o651","10.1107/S1600536807000645","","","0.71073","MoKα","","0.082","0.0567","","","0.1329","0.1468","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212255","16.0538","0.0002","19.2295","0.0002","9.0482","0.0001","90","","90","","90","","2793.24","0.05","100","0.1","100","0.1","","","","","","","","6","P n n a","-P 2a 2bc","52","","2,2'-(Oxydimethylene)bis[3-bromo-1-(phenylsulfonyl)-1H-indole]","","- C30 H22 Br2 N2 O5 S2 -","- C30 H22 Br2 N2 O5 S2 -","- C120 H88 Br8 N8 O20 S8 -","4","0.5","IS2138","G. Senthil Kumar; K. Chinnakali; R. Balamurugan; A. K. Mohanakrishnan; Hoong-Kun Fun","2,2'-(Oxydimethylene)bis[3-bromo-1-(phenylsulfonyl)-1<i>H</i>-indole]","Acta Crystallographica Section E","2007","63","2","o689","o691","10.1107/S160053680700089X","","","0.71073","MoKα","","0.0834","0.0541","","","0.1377","0.1548","","","","","","1.046","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212256","24.2718","0.0018","7.5477","0.0006","14.3193","0.0011","90","","92.451","0.001","90","","2620.8","0.3","100","1","100","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,1',3,3'-tetramethyl-1,1',2,2',3,3',4,4'-octahydro-6,6-(1,4,7,10- tetraazacyclododecane-1,7-diyl)dipyrimidine-2,2',4,4'-tetraone acetonitrile disolvate","","- C24 H38 N10 O4 -","- C24 H38 N10 O4 -","- C96 H152 N40 O16 -","4","0.5","IS2139","Uchida, Akira; Komori, Ayako; Watanabe, Soichiro","1,7-Bis(1,3-dimethyluracil-6-yl)-1,4,7,10-tetraazacyclododecane acetonitrile disolvate at 100 K","Acta Crystallographica Section E","2007","63","2","o648","o649","10.1107/S1600536807000463","","","0.71073","MoKα","","0.0417","0.0353","","","0.0896","0.0939","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212257","10.3604","0.0002","10.7859","0.0002","21.0024","0.0004","90","","90","","90","","2346.94","0.08","100","0.1","100","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(3aR,6S,6aR)-cis-6-Benzyl-1-(4-chlorophenyl)-5- tosylperhydropyrrolo[3,4-b]pyrrole","","- C26 H27 Cl N2 O2 S -","- C26 H27 Cl N2 O2 S -","- C104 H108 Cl4 N8 O8 S4 -","4","1","IS2140","K. Chinnakali; M. Poornachandran; R. Raghunathan; Hoong-Kun Fun","(3a<i>R</i>,6<i>S</i>,6a<i>R</i>)-<i>cis</i>-6-Benzyl-1-(4-chlorophenyl)-5-tosylperhydropyrrolo[3,4-<i>b</i>]pyrrole","Acta Crystallographica Section E","2007","63","2","o652","o653","10.1107/S1600536807000657","","","0.71073","MoKα","","0.0433","0.0367","","","0.0899","0.0939","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212258","5.8213","0.0001","7.3549","0.0001","16.7023","0.0003","88.199","0.001","84.947","0.001","89.454","0.001","711.96","0.02","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","3-(3-Bromophenyl)-1-(2-naphthyl)prop-2-en-1-one","","- C19 H13 Br O -","- C19 H13 Br O -","- C38 H26 Br2 O2 -","2","1","IS2141","S. Sathiya Moorthi; K. Chinnakali; S. Nanjundan; S. Radhakrishnanan; Hoong-Kun Fun","3-(3-Bromophenyl)-1-(2-naphthyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o692","o694","10.1107/S1600536807000906","","","0.71073","MoKα","","0.0438","0.0347","","","0.0913","0.0964","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212259","12.1187","0.0005","7.0788","0.0003","20.325","0.0009","90","","104.458","0.001","90","","1688.38","0.12","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(E)-4-(5-Bromo-2-hydroxybenzylideneamino)-1,5-dimethyl-2-phenyl- 1H-pyrazol-3(2H)-one","","- C18 H16 Br N3 O2 -","- C18 H16 Br N3 O2 -","- C72 H64 Br4 N12 O8 -","4","1","IS2143","Guo-Bing Yan; Ming-Hua Yang; Liang-Gui Wang","(<i>E</i>)-4-(5-Bromo-2-hydroxybenzylideneamino)-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","2","o780","o781","10.1107/S1600536807001742","","","0.71073","MoKα","","0.0523","0.0355","","","0.0913","0.0955","","","","","","0.942","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212260","7.895","0.003","13.008","0.005","14.498","0.006","90","","104.479","0.007","90","","1441.6","1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6,8-Trimethyl-3,5-bis(methylsulfanyl)benzo[1,2-b:5,4-b']difuran","","- C15 H16 O2 S2 -","- C15 H16 O2 S2 -","- C60 H64 O8 S8 -","4","1","IS2144","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","2,6,8-Trimethyl-3,5-bis(methylsulfanyl)benzo[1,2-<i>b</i>:5,4-<i>b</i>']difuran","Acta Crystallographica Section E","2007","63","2","o662","o663","10.1107/S1600536807000785","","","0.71073","MoKα","","0.0549","0.0461","","","0.1212","0.1349","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212261","8.7439","0.0011","8.7491","0.0012","11.0206","0.0015","83.426","0.002","86.704","0.002","80.736","0.002","825.97","0.19","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","2-[2,3-Bis(bromomethyl)-4-methoxyphenyl]-2,3-dihydro-1H-isoindole-1,3-dione","","- C17 H13 Br2 N O3 -","- C17 H13 Br2 N O3 -","- C34 H26 Br4 N2 O6 -","2","1","IS2145","Neng-Fang She; Yu-Jie Ding; Shuai Wang","2-[2,3-Bis(bromomethyl)-4-methoxyphenyl]-2,3-dihydro-1<i>H</i>-isoindole-1,3-dione","Acta Crystallographica Section E","2007","63","2","o925","o926","10.1107/S1600536807003339","","","0.71073","MoKα","","0.0579","0.0427","","","0.1228","0.128","","","","","","1.106","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212262","11.3414","0.0015","4.6589","0.0016","16.0242","0.0007","90","","103.845","0.005","90","","822.1","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Phenyl-1,3,4-oxadiazole-2(3H)-thione","","- C8 H6 N2 O S -","- C8 H6 N2 O S -","- C32 H24 N8 O4 S4 -","4","1","KJ2029","Singh, N. K.; Butcher, Ray J.; Tripathi, Pratibha; Srivastava, Ajay K.; Bharty, Manoj Kumar","5-Phenyl-1,3,4-oxadiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","2","o782","o784","10.1107/S1600536806052238","","","0.71073","MoKα","","0.049","0.0395","","","0.1006","0.1057","","","","","","1.006","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212263","8.4046","0.0015","16.724","0.003","12.306","0.002","90","","106.737","0.003","90","","1656.4","0.5","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(methanol)bis[(E)-4-methoxy-N-(4- pyridylmethylene)aniline]bis(thiocyanate)manganese(II)","","- C30 H32 Mn N6 O4 S2 -","- C30 H32 Mn N6 O4 S2 -","- C60 H64 Mn2 N12 O8 S4 -","2","0.5","KJ2040","Wei Li; Yun-He Xu; Xue-Yan Song; Li-Cun Li","Bis(methanol)bis[(<i>E</i>)-4-methoxy-<i>N</i>-(4-pyridylmethylene)aniline]dithiocyanatomanganese(II)","Acta Crystallographica Section E","2007","63","2","m314","m315","10.1107/S160053680605481X","","","0.71073","MoKα","","0.1001","0.0417","","","0.0791","0.0973","","","","","","1.004","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212264","6.9539","0.0012","21.661","0.004","14.543","0.002","90","","94.278","0.003","90","","2184.5","0.6","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-[5-(2-Chlorophenyl)-2-methyl-3-thienyl]-2-(2,5-dimethyl-3-thienyl)- 3,3,4,4,5,5-hexafluorocyclopent-1-ene","","- C22 H15 Cl F6 S2 -","- C22 H15 Cl F6 S2 -","- C88 H60 Cl4 F24 S8 -","4","1","KJ2041","Pu, Shou-Zhi; Zhou, Quan-Fa","1-[5-(2-Chlorophenyl)-2-methyl-3-thienyl]-2-(2,5-dimethyl-3-thienyl)-3,3,4,4,5,5-hexafluorocyclopent-1-ene: a new photochromic diarylethene compound","Acta Crystallographica Section E","2007","63","2","o927","o928","10.1107/S1600536807003285","","","0.71073","MoKα","","0.0713","0.0391","","","0.0879","0.1046","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212265","18.1156","0.0009","11.1847","0.0005","9.984","0.0005","90","","100.762","0.004","90","","1987.35","0.17","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(Biphenyl-4-yl)-2,3-dibromo-1-(2,4-dichlorophenyl)propan-1-one","","- C21 H14 Br2 Cl2 O -","- C21 H14 Br2 Cl2 O -","- C84 H56 Br8 Cl8 O4 -","4","1","KJ2043","Yathirajan, H. S.; Mayekar, A. N.; Narayana, B.; Sarojini, B. K.; Bolte, Michael","3-(Biphenyl-4-yl)-2,3-dibromo-1-(2,4-dichlorophenyl)propan-1-one","Acta Crystallographica Section E","2007","63","2","o827","o828","10.1107/S1600536807002644","","","0.71073","MoKα","","0.0424","0.0368","","","0.0879","0.0908","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212266","7.109","0.004","3.732","0.002","14.073","0.007","90","","101.381","0.006","90","","366","0.3","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","Poly[[(isonicotinic acid-κN)copper(I)]-μ~3~-chloro]","","- C6 H5 Cl Cu N O2 -","- C6 H5 Cl Cu N O2 -","- C12 H10 Cl2 Cu2 N2 O4 -","2","0.5","KP2058","Qi Chen; Wenjun Feng; Xuefang Zheng; Yan Xu","Poly[[(isonicotinic acid-κ<i>N</i>)copper(I)]-μ~3~-chloro]","Acta Crystallographica Section E","2007","63","2","m367","m368","10.1107/S1600536806055267","","","0.71073","MoKα","","0.0523","0.038","","","0.1051","0.1119","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212267","8.961","0.0004","21.2905","0.001","13.5969","0.0005","90","","118.222","0.002","90","","2285.69","0.18","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(2-Methoxynaphthalen-1-yl)-1-[(2-methoxynaphthalen-1-yl)methyl]-1H- benzimidazole","","- C30 H24 N2 O2 -","- C30 H24 N2 O2 -","- C120 H96 N8 O8 -","4","1","KP2067","Naser Eltaher Eltayeb; Siang Guan Teoh; Jeannie Bee-Jan Teh; Hoong-Kun Fun; Kamarulazizi Ibrahim","2-(2-Methoxynaphthalen-1-yl)-1-[(2-methoxynaphthalen-1-yl)methyl]-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","2","o465","o467","10.1107/S1600536806055000","","","0.71073","MoKα","","0.0551","0.0415","","","0.1037","0.1143","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212268","6.3535","0.0008","14.024","0.0018","10.884","0.0013","90","","95.207","0.003","90","","965.8","0.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Phenyl 2-oxoimidazolidine-1-carboxylate","","- C10 H10 N2 O3 -","- C10 H10 N2 O3 -","- C40 H40 N8 O12 -","4","1","KP2071","Ping Wang; Xin-Long Hu; Zhen-Hua Li; Wei-Guang Shan","Phenyl 2-oxoimidazolidine-1-carboxylate","Acta Crystallographica Section E","2007","63","2","o517","o518","10.1107/S1600536806055309","","","0.71073","MoKα","","0.1036","0.0636","","","0.1159","0.1305","","","","","","1.074","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212269","7.8657","0.0016","26.14","0.005","9.4918","0.0019","90","","93.01","0.03","90","","1948.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[2-(4,5-dihydro-1H-imidazol-2-yl)phenolato-κ^2^N^3^,O]zinc(II) methanol solvate","","- C19 H22 N4 O3 Zn -","- C19 H22 N4 O3 Zn -","- C76 H88 N16 O12 Zn4 -","4","1","KP2073","He, Hong-Shan","Bis[2-(4,5-dihydro-1<i>H</i>-imidazol-2-yl)phenolato-κ^2^<i>N</i>^3^,<i>O</i>]zinc(II) methanol solvate","Acta Crystallographica Section E","2007","63","2","m344","m345","10.1107/S1600536806055164","","","0.71073","MoKα","","0.0811","0.041","","","0.0905","0.1067","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212270","11.942","0.0009","8.0583","0.0006","21.0592","0.0016","90","","90","","90","","2026.6","0.3","295","2","295","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","2,3-diiodonaphthalene","2,3-Diiodonaphthalene","","- C10 H6 I2 -","- C10 H6 I2 -","- C80 H48 I16 -","8","1","KP2074","Novak, Igor","2,3-Diiodonaphthalene","Acta Crystallographica Section E","2007","63","2","o440","o441","10.1107/S1600536806054973","","","0.71073","MoKα","","0.0751","0.0603","","","0.1383","0.1466","","","","","","1.125","","","","has coordinates,has Fobs","290481","2024-03-13","07:31:55",""
"2212271","7.2245","0.0009","11.447","0.0014","15.5537","0.0019","90","","95.97","0.001","90","","1279.3","0.3","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[(thiocyanato-κN)copper(II)]-μ~3~-[2-(2- pyridylmethylamino)ethanesulfonato-κ^5^N,N',O:O':O'']]","","- C9 H11 Cu N3 O3 S2 -","- C9 H11 Cu N3 O3 S2 -","- C36 H44 Cu4 N12 O12 S8 -","4","1","KP2075","Jun-Xia Li; Yi-Min Jiang; Jian-Ge Wang","<i>catena</i>-Poly[[(thiocyanato-κ<i>N</i>)copper(II)]-μ~3~-[2-(2-pyridylmethylamino)ethanesulfonato-κ^5^<i>N</i>,<i>N</i>',<i>O</i>:<i>O</i>':<i>O</i>'']]","Acta Crystallographica Section E","2007","63","2","m601","m603","10.1107/S1600536807003303","","","0.71073","MoKα","","0.0364","0.0301","","","0.0738","0.0771","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212272","9.0671","0.0007","11.1923","0.0008","14.8312","0.0012","86.037","0.006","75.742","0.006","71.119","0.006","1380.15","0.19","296","","296","","","","","","","","","4","P -1","-P 1","2","","(E)-2-[1-(4-Ethoxyphenylimino)ethyl]phenol","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C64 H68 N4 O8 -","4","2","KP2076","Petek, Hande; Albayrak, Çi̇ğdem; Ağar, Erbi̇l; Nazan Ocak İskeleli̇; Şenel, İsmet","(<i>E</i>)-2-{1-[(4-Ethoxyphenyl)imino]ethyl}phenol","Acta Crystallographica Section E","2007","63","2","o810","o812","10.1107/S1600536807002322","","","0.71073","MoKα","","0.0727","0.0384","","","0.1017","0.1155","","","","","","0.99","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212273","7.7278","0.0012","27.744","0.003","8.6183","0.0015","90","","113.841","0.01","90","","1690.1","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-[3-(Dimethylamino)propyl]-10,11-dihydro-5<i>H</i>-dibenzo[a,d][7]annulen-5-ol","","- C20 H25 N O -","- C20 H25 N O -","- C80 H100 N4 O4 -","4","1","KP2078","Gustavo Portalone; Marcello Colapietro; S. Bindya; M. A. Ashok; H.S. Yathirajan","5-[3-(Dimethylamino)propyl]-10,11-dihydro-5<i>H</i>-dibenz[<i>a</i>,<i>d</i>][7]annulen-5-ol","Acta Crystallographica Section E","2007","63","2","o746","o747","10.1107/S160053680700147X","","","0.710689","MoKα","","0.0617","0.0395","","","0.1005","0.108","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212274","7.3651","0.0006","7.2746","0.0006","17.5576","0.0014","90","","92.204","0.002","90","","940.01","0.13","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","rac-(1S,6S)-methyl 6-methyl-2-oxobicyclo[4.1.0]heptane-1-carboxylate","","- C10 H14 O3 -","- C10 H14 O3 -","- C40 H56 O12 -","4","1","KP2083","Juhl, Martin; Søtofte, Inger","<i>rac</i>-(1<i>S</i>,6<i>S</i>)-Methyl 6-methyl-2-oxobicyclo[4.1.0]heptane-1-carboxylate","Acta Crystallographica, Section E","2007","63","2","o838","o839","10.1107/S1600536807002516","","","0.71073","MoKα","","0.0444","0.04","","","0.1057","0.1094","","","","","","1.087","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212275","9.2439","0.0012","7.3436","0.001","24.218","0.003","90","","101.003","0.004","90","","1613.8","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-(3-Bromothien-2-yl)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one","","- C16 H14 Br N3 O S -","- C16 H14 Br N3 O S -","- C64 H56 Br4 N12 O4 S4 -","4","1","LH2257","Yun-Fa Zheng; Chun-Niu Zhang; Ming-Hua Yang","4-(3-Bromothien-2-yl)-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","2","o685","o686","10.1107/S1600536806051725","","","0.71073","MoKα","","0.0475","0.0358","","","0.0831","0.0881","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212276","5.251","0.002","21.809","0.004","10.025","0.003","90","","93.34","0.03","90","","1146.1","0.6","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","6-hydroxyflavanone","","- C15 H12 O3 -","- C15 H12 O3 -","- C60 H48 O12 -","4","1","LH2266","Agata Białońska; Zbigniew Ciunik; Edyta Kostrzewa-Susłow; Jadwiga Dmochowska-Gładysz","Disordered 6-hydroxyflavanone","Acta Crystallographica Section E","2007","63","2","o430","o431","10.1107/S1600536806054687","","","0.71073","MoKα","","0.0713","0.0405","","","0.0883","0.0946","","","","","","0.912","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212277","5.247","0.002","15.374","0.003","14.87","0.005","90","","102.62","0.03","90","","1170.5","0.7","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4'-hydroxyflavanone","","- C15 H12 O3 -","- C15 H12 O3 -","- C60 H48 O12 -","4","1","LH2267","Agata Białońska; Zbigniew Ciunik; Edyta Kostrzewa-Susłow; Jadwiga Dmochowska-Gładysz","Disordered 4'-hydroxyflavanone","Acta Crystallographica Section E","2007","63","2","o432","o433","10.1107/S1600536806054663","","","0.71073","MoKα","","0.1175","0.0497","","","0.0773","0.0893","","","","","","0.982","","","","has coordinates,has disorder","176787","2020-10-21","18:00:00",""
"2212278","7.9241","0.0002","12.4116","0.0003","16.4595","0.0003","90","","96.5733","0.0013","90","","1608.16","0.06","220","2","220","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Isoderrone","5,7-dihyroxy-3-(2',2'-dimethyl-2H'-chromen-7'-yl)chroman-4-one","","- C20 H16 O5 -","- C20 H16 O5 -","- C80 H64 O20 -","4","1","LH2271","Jean Jules Bankeu Kezetas; Ndjakou Lenta, Bruno; Silvere Ngouela; Tsamo, Etienne; Sewald, Norbert; Neumann, Beate; Stammler, Hans-Georg","Isoderrone","Acta Crystallographica Section E","2007","63","2","o523","o525","10.1107/S1600536806056108","","","0.71073","MoKα","","0.0507","0.04","","","0.1097","0.1169","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212279","16.79","0.008","11.499","0.005","12.524","0.006","90","","110.647","0.007","90","","2262.7","1.8","294","2","294","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Formatobis(phenanthroline-κ^2^N,N')copper(II) tetrafluoroborate","","- C25 H17 B Cu F4 N4 O2 -","- C25 H17 B Cu F4 N4 O2 -","- C100 H68 B4 Cu4 F16 N16 O8 -","4","0.5","LH2275","Cui, Jian-Zhong; Yi, Yu-Juan; Zhang, Hong; Gao, Hong-Ling; Wang, Hai-Tao","Formatobis(phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) tetrafluoroborate","Acta Crystallographica Section E","2007","63","2","m587","m588","10.1107/S1600536807002875","","","0.71073","MoKα","","0.0648","0.0382","","","0.0903","0.1025","","","","","","1.015","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212280","5.6899","0.0002","11.3507","0.0004","18.5291","0.0009","90","","90","","90","","1196.69","0.08","190","","190","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2,5-Anhydro-N-benzyl-2-C-methyl-D-arabinonamide","(2S,3R,4R)-N-benzyl-3,4-dihydroxy-2-methyltetrahydrofuran-2-carboxamide","","- C13 H17 N O4 -","- C13 H17 N O4 -","- C52 H68 N4 O16 -","4","1","LH2277","Cox, Daniel J.; Håkansson, Anders E.; Fleet, George W. J.; Watkin, David J.","2,5-Anhydro-<i>N</i>-benzyl-2-<i>C</i>-methyl-<small>D</small>-arabinonamide [(2<i>S</i>,3<i>R</i>,4<i>R</i>)-<i>N</i>-benzyl-3,4-dihydroxy-2-methyltetrahydrofuran-2-carboxamide]","Acta Crystallographica Section E","2007","63","2","o574","o576","10.1107/S1600536806055322","","","0.71073","MoKα","","0.0525","0.0382","","0.0869","0.082","0.0869","","","","","","0.9254","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212281","8.729","0.002","9.514","0.002","25.796","0.005","90","","90","","90","","2142.3","0.8","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","3-benzoylthymine","3-benzoyl-5-methylpyrimidine-2,4(1H,3H)-dione","","- C12 H10 N2 O3 -","- C12 H10 N2 O3 -","- C96 H80 N16 O24 -","8","1","LH2278","Parvez, Masood; Phillips, Sandra E.; Sutherland, Todd C.","3-Benzoylthymine","Acta Crystallographica Section E","2007","63","2","o733","o734","10.1107/S1600536807001092","","","0.71073","MoKα","","0.0739","0.0485","","","0.1125","0.1228","","","","","","1.143","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212282","14.5702","0.0005","8.8146","0.0004","20.6699","0.0007","90","","90","","90","","2654.65","0.18","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(2E)-1-(2,4-Dichlorophenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one","","- C15 H10 Cl2 O2 -","- C15 H10 Cl2 O2 -","- C120 H80 Cl16 O16 -","8","1","LH2280","Yathirajan, H. S.; Mayekar, A. N.; Sarojini, B. K.; Narayana, B.; Bolte, Michael","(2<i>E</i>)-1-(2,4-Dichlorophenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o426","o427","10.1107/S1600536806055024","","","0.71073","MoKα","","0.0347","0.0319","","","0.082","0.0836","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212283","7.1477","0.0003","16.9604","0.0011","24.2071","0.0013","90","","90","","90","","2934.6","0.3","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(2E)-1-(2,4-Dichlorophenyl)-3-(2-hydroxy-3-methoxyphenyl)prop-2-en-1-one","","- C16 H12 Cl2 O3 -","- C16 H12 Cl2 O3 -","- C128 H96 Cl16 O24 -","8","1","LH2281","Yathirajan, H. S.; Mayekar, A. N.; Narayana, B.; Sarojini; Bolte, Michael","(2<i>E</i>)-1-(2,4-Dichlorophenyl)-3-(2-hydroxy-3-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o428","o429","10.1107/S1600536806055036","","","0.71073","MoKα","","0.0353","0.0293","","","0.0784","0.0807","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212284","16.8724","0.0007","13.461","0.0007","7.4932","0.0003","90","","102.778","0.003","90","","1659.7","0.13","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2E)-1-(2,4-Dichlorophenyl)-3-(6-methoxy-2-naphthyl)prop-2-en-1-one","","- C20 H14 Cl2 O2 -","- C20 H14 Cl2 O2 -","- C80 H56 Cl8 O8 -","4","1","LH2282","Yathirajan, H. S.; Mayekar, A. N.; Narayana, B.; Sarojini; Bolte, Michael","(2<i>E</i>)-1-(2,4-Dichlorophenyl)-3-(6-methoxy-2-naphthyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o540","o541","10.1107/S1600536806055644","","","0.71073","MoKα","","0.0353","0.0337","","","0.089","0.0899","","","","","","1.075","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212285","12.635","0.003","6.8276","0.0014","13.414","0.003","90","","101.62","0.03","90","","1133.5","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-poly[[[diaqua(pyridine-2-carboxamide-κ^2^N^1^,O)copper(II)]-μ- sulfato-κ^2^O:O'] monohydrate]","","- C6 H12 Cu N2 O8 S -","- C6 H12 Cu N2 O8 S -","- C24 H48 Cu4 N8 O32 S4 -","4","1","LH2283","Hong-Zhen Xie; Wei-Juan Pan","A monoclinic polymorph of <i>catena</i>-poly[[[diaqua(pyridine-2-carboxamide-κ^2^<i>N</i>^1^,<i>O</i>)copper(II)]-μ-sulfato-κ^2^<i>O</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2007","63","2","m544","m546","10.1107/S160053680700205X","","","0.71073","MoKα","","0.0272","0.022","","","0.0534","0.0546","","","","","","1.137","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212286","15.2016","0.0005","13.7923","0.0004","22.0003","0.0007","90","","123.274","0.002","90","","3856.5","0.2","100","0.1","297","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","2-(4-Methoxystyryl)-1-methylpyridinium 4-chlorobenzenesulfonate","2-(4-Methoxystyryl)-1-methylpyridinium 4-chlorobenzenesulfonate","","- C21 H20 Cl N O4 S -","- C21 H20 Cl N O4 S -","- C168 H160 Cl8 N8 O32 S8 -","8","2","LH2284","Suchada Chantrapromma; Thitipone Suwanwong; Hoong-Kun Fun","2-(4-Methoxystyryl)-1-methylpyridinium 4-chlorobenzenesulfonate","Acta Crystallographica Section E","2007","63","2","o821","o823","10.1107/S1600536807002048","","","0.71073","MoKα","","0.0855","0.0689","","","0.1818","0.2004","","","","","","1.048","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212287","11.841","0.0008","13.5939","0.0009","12.1693","0.0008","90","","118.318","0.007","90","","1724.4","0.2","105","2","105","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Chloro-6-[(4-hydroxy-3,5-dimethoxybenzyl)amino]-9-isopropylpurine","","- C17 H20 Cl N5 O3 -","- C17 H20 Cl N5 O3 -","- C68 H80 Cl4 N20 O12 -","4","1","LH2285","Trávníček, Zdeněk; Popa, Igor","2-Chloro-6-[(4-hydroxy-3,5-dimethoxybenzyl)amino]-9-isopropylpurine","Acta Crystallographica Section E","2007","63","2","o728","o730","10.1107/S1600536807001511","","","0.71073","MoKα","","0.0539","0.0414","","","0.0855","0.0913","","","","","","1.069","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212288","5.6603","0.0002","8.0045","0.0002","9.3242","0.0003","90","","103.147","0.0013","90","","411.39","0.02","150","","150","","","","","","","","","3","P 1 21 1","P 2yb","4","","3-<i>C</i>-Methyl-D-allono-1,5-lactone","","- C7 H12 O6 -","- C7 H12 O6 -","- C14 H24 O12 -","2","1","LH2287","Jones, Nigel A.; Watkin, David J.; Curran, Louise A.; Jenkinson, Sarah F.; Fleet, George W. J.","3-<i>C</i>-Methyl-<small>D</small>-allono-1,5-lactone","Acta Crystallographica Section E","2007","63","2","o992","o994","10.1107/S1600536807002899","","","0.71073","MoKα","","0.0347","0.0307","","0.0755","0.0741","0.0755","","","","","","1.1588","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212289","10.7622","0.001","12.0925","0.0015","10.9239","0.0011","90","","101.84","0.008","90","","1391.4","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1-Pivaloyl)-3-(2-chlorophenyl)thiourea","1-(2-Chlorophenyl)-3-pivaloylthiourea","","- C12 H15 Cl N2 O S -","- C12 H15 Cl N2 O S -","- C48 H60 Cl4 N8 O4 S4 -","4","1","LH2288","Sultana, Sarwat; Khawar Rauf, M.; Bolte, Michael; Badshah, Amin","1-(2-Chlorophenyl)-3-pivaloylthiourea","Acta Crystallographica Section E","2007","63","2","o920","o922","10.1107/S1600536807002401","","","0.71073","MoKα","","0.0514","0.0387","","","0.1001","0.1049","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212290","19.39","0.003","14.037","0.003","14.266","0.005","90","","96.057","0.008","90","","3861.2","1.7","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-methyl-1-(3,3,5-trimethyl-2-p-tolyl-1,2-oxazolidin-5-yl)-1H-indol-3(2H)-one","","- C22 H26 N2 O2 -","- C22 H26 N2 O2 -","- C176 H208 N16 O16 -","8","2","LH2289","Parvez, Masood; Mehrdad, Morteza; Sureni, Hossein; Heydari, Akbar; Jadidi, Khosrow","An unexpected <i>N</i>-substituted oxindole: 5-methyl-1-(3,3,5-trimethyl-2-<i>p</i>-tolyl-1,2-oxazolidin-5-yl)-1<i>H</i>-indol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","2","o875","o876","10.1107/S1600536807002085","","","0.71073","MoKα","","0.171","0.054","","","0.11","0.145","","","","","","0.99","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212291","16.502","0.0014","7.2234","0.0005","8.5816","0.0006","90","","100.768","0.003","90","","1004.92","0.13","90","0.2","90","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-1-[(2-Chlorophenyl)methyleneamino]guanidinium chloride","","- C8 H10 Cl2 N4 -","- C8 H10 Cl2 N4 -","- C32 H40 Cl8 N16 -","4","1","LH2290","Sonar, Vijayakumar N.; Ring, Joshua R.; Siegler, Maxime; Crooks, Peter A.","(<i>E</i>)-1-[(2-Chlorophenyl)methyleneamino]guanidinium chloride","Acta Crystallographica Section E","2007","63","2","o974","o975","10.1107/S1600536807002887","","","0.71073","MoKα","","0.1018","0.0533","","","0.1192","0.1413","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212292","10.321","0.003","14.446","0.004","11.378","0.004","90","","98.554","0.012","90","","1677.6","0.9","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(3,3,5-trimethyl-2-phenyl-1,2-oxazolidin-5-yl)-1H-indol-3(2H)-one","","- C20 H22 N2 O2 -","- C20 H22 N2 O2 -","- C80 H88 N8 O8 -","4","1","LH2292","Parvez, Masood; Mehrdad, Morteza; Sureni, Hossein; Heydari, Akbar; Jadidi, Khosrow","An unexpected <i>N</i>-substituted oxindole: 1-(3,3,5-trimethyl-2-phenyl-1,2-oxazolidin-5-yl)-1<i>H</i>-indol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","2","o877","o878","10.1107/S1600536807002097","","","0.71073","MoKα","","0.075","0.042","","","0.094","0.108","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212293","15.485","0.001","9.025","0.001","11.042","0.001","90","","96.18","0.01","90","","1534.2","0.2","103","2","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(Biphenyl-4-yl)-2,3-dihydroquinazolin-4(1H)-one","","- C20 H16 N2 O -","- C20 H16 N2 O -","- C80 H64 N8 O4 -","4","1","LH2293","Maksymilian Chruszcz; Gary M. Chinigo; Scott M. Capitosti; Milton L. Brown; Wladek Minor","2-(Biphenyl-4-yl)-2,3-dihydroquinazolin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","2","o891","o893","10.1107/S1600536807002103","","","0.71074","MoKα","","0.0608","0.0549","","","0.1594","0.1653","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212294","9.786","0.003","12.589","0.005","12.475","0.004","90","","104.437","0.019","90","","1488.3","0.9","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-[(E)-(5-Bromo-2-hydroxyphenyl)methylideneaminomethyl]cyclohexanecarboxylic acid","","- C15 H18 Br N O3 -","- C15 H18 Br N O3 -","- C60 H72 Br4 N4 O12 -","4","1","LH2295","Shuja, Shaukat; Ali, Saqib; Khalid, Nasir; Parvez, Masood","3-[(<i>E</i>)-(5-Bromo-2-hydroxyphenyl)methylideneaminomethyl]cyclohexanecarboxylic acid","Acta Crystallographica Section E","2007","63","2","o879","o880","10.1107/S1600536807002681","","","0.71073","MoKα","","0.052","0.032","","","0.075","0.084","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212295","3.8451","0.0002","11.4926","0.0008","21.3214","0.0013","90","","92.208","0.004","90","","941.5","0.1","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Acetone 2-nitrophenylhydrazone","","- C9 H11 N3 O2 -","- C9 H11 N3 O2 -","- C36 H44 N12 O8 -","4","1","LH2298","Wardell, Solange M. S. V.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Acetone 2-nitrophenylhydrazone","Acta Crystallographica Section E","2007","63","2","o970","o971","10.1107/S1600536807003509","","","0.71073","MoKα","","0.0678","0.0538","","","0.1427","0.1531","","","","","","1.057","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212296","7.2966","0.0012","5.0707","0.0009","20.238","0.003","90","","90","","90","","748.8","0.2","298","2","298","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","catena-Poly[silver(I)-μ~3~-2-(pyrimidin-2-ylsulfanyl)acetate]","","- C6 H5 Ag N2 O2 S -","- C6 H5 Ag N2 O2 S -","- C24 H20 Ag4 N8 O8 S4 -","4","1","LN3032","Han, Lei; Zhou, Yan; Huang, Shi-Jie","<i>catena</i>-Poly[silver(I)-μ~3~-2-(pyrimidin-2-ylsulfanyl)acetate]: a one-dimensional chiral coordination polymer","Acta Crystallographica Section E","2007","63","2","m455","m457","10.1107/S1600536807000347","","","0.71073","MoKα","","0.0476","0.0448","","","0.1155","0.118","","","","","","1.109","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212297","7.538","0.003","10.832","0.002","8.537","0.004","90","","106.768","0.007","90","","667.4","0.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","potassium ytterbium diphosphate","potassium ytterbium diphosphate","","- K O7 P2 Yb -","- K O7 P2 Yb -","- K4 O28 P8 Yb4 -","4","1","MG2007","Horchani-Naifer, Karima; Férid, Mokhtar","Potassium ytterbium diphosphate","Acta Crystallographica Section E","2007","63","2","i33","i34","10.1107/S1600536806054845","","","0.71073","MoKα","","0.0375","0.0349","","","0.0945","0.0963","","","","","","1.171","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212298","11.4545","0.0004","11.4545","0.0004","4.5803","0.0004","90","","90","","90","","600.96","0.06","295","2","295","2","","","","","","","","5","I -4","I -4","82","Manganese mercury selenocyanate","Manganese mercury selenocyanate","","- C4 Hg Mn N4 Se4 -","- C4 Hg Mn N4 Se4 -","- C8 Hg2 Mn2 N8 Se8 -","2","0.25","MG2011","Wang, Xin Qiang; Yu, Wen Tao; Xu, Dong; Sun, Haiqing; Liu, Wei Liang","Manganese mercury selenocyanate, MnHg(SeCN)~4~","Acta Crystallographica, Section E","2007","63","2","i48","i49","10.1107/S1600536807001808","","","0.71073","MoKα","","0.0722","0.0521","","","0.1218","0.1337","","","","","","0.984","","","","has coordinates","277834","2022-09-14","16:39:44",""
"2212299","7.207","0.003","18.974","0.008","11.834","0.007","90","","95.6","0.02","90","","1610.5","1.3","150","2","150","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Triniobium decaselenide trichloride","","- Cl3 Nb3 Se10 -","- Cl3 Nb3 Se10 -","- Cl12 Nb12 Se40 -","4","1","MG2013","Jung-Eun Kwak; Song-I Hahn; Hoseop Yun","A new pseudo-two-dimensional niobium chloride selenide, Nb~3~Se~10~Cl~3~","Acta Crystallographica Section E","2007","63","2","i27","i29","10.1107/S1600536806056364","","","0.71073","MoKα","","","0.0546","","","","0.1409","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212300","10.229","0.0018","17.016","0.003","18.874","0.003","86.296","0.002","78.076","0.002","72.52","0.002","3065.8","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(4,4'-bipyridinium) octamolybdate 4,4'-bipyridine solvate sesquihydrate","","- C50 H47 Mo8 N10 O27.5 -","- C50 H43 Mo8 N10 O27.5 -","- C100 H86 Mo16 N20 O55 -","2","1","MG2016","Liu, Ying-Hong; Guo, Gui-Ling","Tetrakis(4,4'-bipyridinium) octamolybdate 4,4'-bipyridine solvate sesquihydrate","Acta Crystallographica Section E","2007","63","2","m604","m606","10.1107/S1600536807003479","","","0.71073","MoKα","","0.0635","0.0451","","","0.0963","0.1017","","","","","","1.071","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212301","9.797","0.0005","12.5007","0.0006","13.9823","0.0007","98.453","0.001","105.171","0.001","110.736","0.001","1490.19","0.13","294","1","294","1","","","","","","","","7","P -1","-P 1","2","","catena-Poly[[bis(α-thenoyltrifluoroacetonato-κ^2^O,O')copper(II)]-μ- 1,4-di-3-pyridyl-2,3-diaza-1,3-butadiene-κ^2^N:N']","","- C28 H18 Cu F6 N4 O4 S2 -","- C28 H18 Cu F6 N4 O4 S2 -","- C56 H36 Cu2 F12 N8 O8 S4 -","2","1","NG2124","Perkins, William J.; Maxwell, Tamara; Williams, Ken B.; Goforth, Andrea M.; Smith, Mark D.; Peterson Jr, LeRoy; zur Loye, Hans-Conrad","<i>catena</i>-Poly[[bis(α-thenoyltrifluoroacetonato-κ^2^<i>O</i>,<i>O</i>')copper(II)]-μ-1,4-di-3-pyridyl-2,3-diaza-1,3-butadiene-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","2","m423","m425","10.1107/S1600536807000311","","","0.71073","MoKα","","0.0545","0.0448","","","0.123","0.1311","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212302","8.0171","0.0016","13.288","0.003","27.352","0.006","90","","95.99","0.03","90","","2897.9","1.1","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis[hexaaquacobalt(II)] tetrakis[2-(4-carboxyphenoxy)propionate] hexahydrate","","- C20 H34 Co O19 -","- C20 H36 Co O19 -","- C80 H144 Co4 O76 -","4","1","NG2186","Deng, Zhao-Peng; Gao, Shan; Chen, Peng-Gang","Hexaaquacobalt(II) bis[2-(4-carboxyphenoxy)propionate] trihydrate","Acta Crystallographica Section E","2007","63","2","m296","m298","10.1107/S1600536806055188","","","0.71073","MoKα","","0.0454","0.0327","","","0.0917","0.0995","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","189124","2020-10-21","18:00:00",""
"2212303","23.296","0.005","5.7045","0.0011","30.675","0.006","90","","123.95","0.03","90","","3381.5","1.7","94","2","94","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","poly[(μ-1,3-di-4-pyridylpropane-κ^2^N:N')bis(μ~3~-thiocyanato- κ^3^N,S:S)dicopper(I)]","","- C30 H28 Cu4 N8 S4 -","- C30 H28 Cu4 N8 S4 -","- C120 H112 Cu16 N32 S16 -","4","1","NG2187","Trovitch, Ryan J.; Rarig, Randy S.; Zubieta, Jon A.; LaDuca, Robert L.","A coordination polymer with conformationally distinct layers: poly[(μ-1,3-di-4-pyridylpropane-κ^2^<i>N</i>:<i>N</i>')bis(μ~3~-thiocyanato-κ^3^<i>N</i>,<i>S</i>:<i>S</i>)dicopper(I)]","Acta Crystallographica Section E","2007","63","2","m339","m341","10.1107/S1600536806055395","","","0.71073","MoKα","","0.1259","0.0561","","","0.0981","0.1268","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212304","38.2597","0.0008","38.2597","","12.3356","0.0006","90","","90","","120","","15637.7","0.8","294","1","294","1","","","","","","","","6","R 3 m :H","R 3 -2""","160","","Bis(μ-3,5-diphenylpyrazolato-κ^2^N:N')bis[(4,4'-dimethyl-2,2'- bipyridine-κ^2^N,N')palladium(II)] bis(hexafluorophosphate)","","- C54 H46 F12 N8 P2 Pd2 -","- C54 H46 F12 N8 P2 Pd2 -","- C486 H414 F108 N72 P18 Pd18 -","9","0.5","NG2188","Hai-Ping Huang; Qiong Wu; Li-Xia Liu; Qing-Fu Song","Bis(μ-3,5-diphenylpyrazolato-κ^2^<i>N</i>:<i>N</i>')-bis[(4,4'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')palladium(II)] bis(hexafluorophosphate)","Acta Crystallographica Section E","2007","63","2","m458","m459","10.1107/S1600536807000803","","","0.71073","MoKα","","0.0722","0.0694","","","0.1904","0.197","","","","","","1.079","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212305","11.0062","0.0004","15.8022","0.0004","26.5645","0.0008","90","","101.415","0.002","90","","4528.8","0.2","100","0.1","297","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(2-Amino-5-nitrobenzoato)triphenyltin(IV)","","- C25 H20 N2 O4 Sn -","- C25 H20 N2 O4 Sn -","- C200 H160 N16 O32 Sn8 -","8","1","NG2189","Foo-Win Yip; Siang-Guan Teoh; Latiffah Zakaria; Shea-Lin Ng; Hoong-Kun Fun","(2-Amino-5-nitrobenzoato)triphenyltin(IV)","Acta Crystallographica Section E","2007","63","2","m348","m350","10.1107/S1600536806055735","","","0.71073","MoKα","","0.0352","0.0326","","","0.0697","0.0707","","","","","","1.242","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212306","8.56","0.0001","12.8018","0.0003","15.551","0.0004","90","","90","","90","","1704.13","0.06","173","","173","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Dioxobis(pentane-2,4-dionato)(dimethylformamide)uranium(VI)","","- C13 H21 N O7 U -","- C13 H21 N O7 U -","- C52 H84 N4 O28 U4 -","4","1","NG2190","Huuskonen, Juhani; Raatikainen, Kari; Rissanen, Kari","(Dimethylformamide)dioxobis(pentane-2,4-dionato)uranium(VI)","Acta Crystallographica Section E","2007","63","2","m413","m414","10.1107/S1600536807000141","","","0.7107","MoKα","","0.0311","0.0282","","0.0603","0.0593","0.0603","","","","","","0.9818","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2212307","10.8876","0.0003","13.0407","0.0003","17.8896","0.0005","84.632","0.001","82.117","0.001","84.26","0.001","2495.16","0.11","100","0.1","297","2","","","","","","","","5","P -1","-P 1","2","","[4-(Diethylamino)benzoato-κO]triphenyltin(IV)","","- C29 H29 N O2 Sn -","- C29 H29 N O2 Sn -","- C116 H116 N4 O8 Sn4 -","4","2","NG2192","Yip Foo Win; Siang Guan Teoh; Jeannie Bee-Jan Teh; Hoong-Kun Fun; Latiffah Zakaria","[4-(Diethylamino)benzoato-κ<i>O</i>]triphenyltin(IV)","Acta Crystallographica Section E","2007","63","2","m323","m325","10.1107/S1600536806055905","","","0.71073","MoKα","","0.0378","0.0274","","","0.0638","0.0719","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212308","8.949","0.009","14.175","0.005","22.128","0.005","90","","90","","90","","2807","3","293","2","293","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","catena-Poly[[bis(imidazole-κN)zinc(II)]-μ-L-(+)-tartrato-κ^4^O,O':O'',O''']","","- C10 H12 N4 O6 Zn -","- C10 H12 N4 O6 Zn -","- C80 H96 N32 O48 Zn8 -","8","1","NG2195","Adama, Sy; Mohamed, Gaye; Abdou Salam, Sall; Aliou Hamady, Barry; Ahmed, Driss","<i>catena</i>-Poly[[bis(imidazole-κ<i>N</i>)zinc(II)]-μ-(2<i>R</i>,3<i>R</i>)-tartrato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section E","2007","63","2","m574","m575","10.1107/S1600536807002127","","","0.71073","MoKα","","0.03","0.027","","","0.0728","0.0759","","","","","","1.126","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212309","13.068","0.006","11.294","0.005","20.158","0.009","90","","90","","90","","2975","2","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H13 N3 S3 Sn -","- C10 H13 N3 S3 Sn -","- C80 H104 N24 S24 Sn8 -","8","1","NG2196","Junshan Sun; Rufen Zhang; Daqi Wang","<i>catena</i>-Poly[[trimethyltin(IV)]-μ-[5-(2-thienylmethyleneamino)-1,3,4-thiadiazole-2-thiolato-κ^2^<i>N</i>^4^:<i>S</i>^2^]]","Acta Crystallographica Section E","2007","63","2","m418","m419","10.1107/S1600536807000128","","","0.71073","MoKα","","0.0669","0.0353","","","0.0934","0.1224","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212310","12.805","0.003","7.085","0.0014","13.893","0.003","90","","96.481","0.003","90","","1252.4","0.5","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{[(5-fluoro-2-trifluoromenthylphenyl) iminomethyl]phenolato-K^2^N,O}copper(II)","","- C28 H16 Cu F8 N2 O2 -","- C28 H16 Cu F8 N2 O2 -","- C56 H32 Cu2 F16 N4 O4 -","2","0.5","NG2198","Wang, Liang-Gui; Zheng, Yun-Fa","Bis(2-{[5-fluoro-2-(trifluoromethyl)phenyl]iminomethyl}phenolato-κ^2^<i>N</i>,<i>O</i>)copper(II)","Acta Crystallographica Section E","2007","63","2","m390","m391","10.1107/S1600536807000153","","","0.71073","MoKα","","0.0579","0.0349","","","0.0849","0.0885","","","","","","0.848","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212311","9.7481","0.0011","29.787","0.005","14.704","0.005","90","","98.793","0.014","90","","4219.4","1.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetramethylammonium bis(2-benzoylbenzoato-κ<i>O</i>)triphenylstannate(IV)","","- C50 H45 N O6 Sn -","- C50 H45 N O6 Sn -","- C200 H180 N4 O24 Sn4 -","4","1","NG2199","Cheikh Abdoul Khadir Diop; Assane Touré; Libasse Diop; Augustin Sanchez-Dias; Alfonso Castineiras; Umberto Russo","Tetramethylammonium bis(2-benzoylbenzoato-κ<i>O</i>)triphenylstannate(IV)","Acta Crystallographica Section E","2007","63","2","m465","m467","10.1107/S160053680700058X","","","0.71073","MoKα","","0.2418","0.0528","","","0.0908","0.1211","","","","","","0.964","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212312","9.1991","0.0004","15.7677","0.0007","10.5419","0.0005","90","","105.656","0.001","90","","1472.36","0.12","94","2","94","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-poly[[aquabis(acetato-κO)copper(II)]-μ-3,3'-bipyridine-κ^2^N:N']","","- C14 H16 Cu N2 O5 -","- C14 H16 Cu N2 O5 -","- C56 H64 Cu4 N8 O20 -","4","1","NG2200","Desciak, Matthew; Rarig Jr, Randy S.; Zubieta, Jon; LaDuca, Robert L.","A one-dimensional coordination polymer incorporating a less common bipyridine isomer: <i>catena</i>-poly[[bis(acetato-κ<i>O</i>)aquacopper(II)]-μ-3,3'-bipyridine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","2","m435","m437","10.1107/S160053680700030X","","","0.71073","MoKα","","0.032","0.0277","","","0.0774","0.0794","","","","","","1.059","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212313","7.9771","0.0016","13.265","0.003","27.308","0.006","90","","96.17","0.03","90","","2872.9","1.1","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Hexaaquanickel(II) bis[2-(4-carboxyphenoxy)propionate] trihydrate","","- C20 H34 Ni O19 -","- C20 H34 Ni O19 -","- C80 H136 Ni4 O76 -","4","1","NG2202","Deng, Zhao-Peng; Gao, Shan; Chen, Peng-Gang","Hexaaquanickel(II) bis[2-(4-carboxyphenoxy)propionate] trihydrate","Acta Crystallographica Section E","2007","63","2","m553","m554","10.1107/S1600536807002498","","","0.71073","MoKα","","0.0537","0.0361","","","0.0946","0.1047","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212314","7.8479","0.0014","20.603","0.003","7.5978","0.0015","90","","98.541","0.019","90","","1214.9","0.4","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","sym-diethyltetraphenyldisiloxane","1,3-diethyl-1,1,3,3-tetraphenyldisiloxane","","- C28 H30 O Si2 -","- C28 H30 O Si2 -","- C56 H60 O2 Si4 -","2","0.5","NG2203","Anna Kropidłowska; Ilona Turowska-Tyrk; Barbara Becker","1,3-Diethyl-1,1,3,3-tetraphenyldisiloxane","Acta Crystallographica Section E","2007","63","2","o855","o857","10.1107/S1600536807002139","","","0.71073","MoKα","","0.0693","0.0519","","","0.137","0.1572","","","","","","1.14","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212315","9.3373","0.0005","10.1342","0.0006","17.507","0.001","90","","97.6551","0.0011","90","","1641.85","0.16","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis(μ-2-fluorobenzoato-κ^2^O:O')di-μ-oxo-bis[(2,2'-bipyridine- κ^2^N,N')oxoneptunium(V)]","","- C34 H24 F2 N4 Np2 O8 -","- C34 H24 F2 N4 Np2 O8 -","- C68 H48 F4 N8 Np4 O16 -","2","0.5","NG2205","Grigoriev, Mikhail S.; Krot, Nikolai N.; Bessonov, Alexei A.; Suponitsky, Kyrill Yu.","Dimeric dioxocations, (NpO~2~^+^)~2~, in the structure of bis(μ-2-fluorobenzoato-κ^2^<i>O</i>:<i>O</i>')di-μ-oxo-bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')oxoneptunium(V)]","Acta Crystallographica Section E","2007","63","2","m561","m562","10.1107/S1600536807002164","","","0.71073","MoKα","","0.036","0.0231","","","0.0405","0.0434","","","","","","0.993","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212316","15.409","0.0002","13.097","0.0002","15.715","0.0002","90","","107.783","0.0007","90","","3019.94","0.07","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2,6-Diphenylphenolato-κO)bis(2-methylquinolin-8-olato-κ^2^N,O)gallium(III)","","- C38 H29 Ga N2 O3 -","- C38 H29 Ga N2 O3 -","- C152 H116 Ga4 N8 O12 -","4","1","NG2206","Rajeswaran, Manju; Place, David W.; Deaton, Joseph C.; Brown, Christopher T.; Lenhart, William C.","(2,6-Diphenylphenolato-κ<i>O</i>)bis(2-methylquinolin-8-olato-κ^2^<i>N</i>,<i>O</i>)gallium(III)","Acta Crystallographica Section E","2007","63","2","m550","m552","10.1107/S1600536807002176","","","0.71073","MoKα","","0.0519","0.0352","","","0.0884","0.0962","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212317","7.9457","0.0009","8.1111","0.0009","28.409","0.003","90","","95.394","0.001","90","","1822.8","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3,5-2NO~2~-salicylato dimethyltitanocene","(3,5-Dinitrosalicylato-κ^2^O^1^,O^2^)bis(η^5^- methylcyclopentadienyl)titanium(IV)","","- C19 H16 N2 O7 Ti -","- C19 H16 N2 O7 Ti -","- C76 H64 N8 O28 Ti4 -","4","1","NG2208","Fang Xu; Zi-Wei Gao; Cai-Yun Zhang; Ling-Xiang Gao; Jin-Ling Li","(3,5-Dinitrosalicylato-κ^2^<i>O</i>^1^,<i>O</i>^2^)bis(η^5^-methylcyclopentadienyl)titanium(IV)","Acta Crystallographica Section E","2007","63","2","m540","m541","10.1107/S1600536807002188","","","0.71073","MoKα","","0.0412","0.0357","","","0.0936","0.0984","","","","","","1.027","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212318","7.825","0.003","7.98","0.003","14.706","0.005","95.731","0.006","99.083","0.005","112.056","0.005","827.6","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","5-nitrosalicylato 1,1'-dimethyltitanocene","Bis(η^5^-methylcyclopentadienyl)(5-nitrosalicylato-κ^2^O^1^,O^2^)titanium(IV)","","- C19 H17 N O5 Ti -","- C19 H17 N O5 Ti -","- C38 H34 N2 O10 Ti2 -","2","1","NG2209","Zi-Wei Gao; Fang Xu; Cai-Yun Zhang; Ling-Xiang Gao","Bis(η^5^-methylcyclopentadienyl)(5-nitrosalicylato-κ^2^<i>O</i>^1^,<i>O</i>^2^)titanium(IV)","Acta Crystallographica Section E","2007","63","2","m542","m543","10.1107/S160053680700219X","","","0.71073","MoKα","","0.0449","0.0342","","","0.0847","0.0915","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212319","10.631","0.002","10.948","0.002","12.701","0.003","99.427","0.003","114.082","0.003","100.871","0.003","1276.7","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","poly[tetrakis(μ-2,4'-bipyridine-κ^2^N:N')(μ~4~-β-octamolybdato- κ^4^-O:O':O'':O''')tetracopper(I)]","","- C40 H32 Cu4 Mo8 N8 O26 -","- C40 H32 Cu4 Mo8 N8 O26 -","- C40 H32 Cu4 Mo8 N8 O26 -","1","0.5","NG2210","Ochalek, Catherine E.; LaDuca, Robert L.","The 3,4-connected layered hybrid oxide poly[tetrakis(μ-2,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>')(μ~4~-β-octamolybdato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>''')tetracopper(I)]","Acta Crystallographica Section E","2007","63","2","m621","m624","10.1107/S1600536807003583","","","0.71073","MoKα","","0.0271","0.0231","","","0.0579","0.0594","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212320","5.4233","0.0012","9.2","0.005","24.189","0.006","87.59","0.03","84.23","0.02","88.93","0.03","1199.6","0.8","150","2","150","2","","","","","","","","4","P -1","-P 1","2","Dihydrocarbamazepine Form III","10,11-Dihydrocarbamazepine","","- C15 H14 N2 O -","- C15 H14 N2 O -","- C60 H56 N8 O4 -","4","2","OB2100","Leech, Charlotte K.; Florence, Alastair J.; Shankland, Kenneth; Shankland, Norman; Johnston, Andrea","10,11-Dihydrocarbamazepine (form III)","Acta Crystallographica Section E","2007","63","2","o675","o677","10.1107/S1600536806053335","","","1.54184","CuKα","","0.0767","0.0408","","","0.0894","0.1013","","","","","","0.837","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212321","14.077","0.001","7.0804","0.0006","14.054","0.001","90","","104.026","0.001","90","","1359.01","0.18","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 Br2 N2 S -","- C13 H10 Br2 N2 S -","- C52 H40 Br8 N8 S4 -","4","1","OM2078","Muhammed, Niaz; Zia-ur-Rehman,; Ali, Saqib; Meetsma, Auke","1,3-Bis(4-bromophenyl)thiourea","Acta Crystallographica Section E","2007","63","2","o632","o633","10.1107/S1600536806056479","","","0.71073","MoKα","","0.0371","0.0282","","","0.0685","0.0723","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212322","8.2123","0.0005","10.2704","0.0006","15.6104","0.0009","84.265","0.001","85.629","0.001","69.425","0.001","1225.29","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-(Quinolin-8-yloxy)benzoic acid","","- C16 H11 N O3 -","- C16 H11 N O3 -","- C64 H44 N4 O12 -","4","2","OM2082","Chen, Qing; Qin, Jiang-Ke; Zeng, Ming-Hua; Ng, Seik Weng","2-(Quinolin-8-yloxy)benzoic acid","Acta Crystallographica Section E","2007","63","2","o453","o454","10.1107/S1600536806054493","","","0.71073","MoKα","","0.07","0.042","","","0.105","0.12","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212323","7.4266","0.0003","14.1636","0.0007","26.676","0.001","90","","95.354","0.003","90","","2793.7","0.2","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Z)-Ethyl 2-[2-(3-bromophenyl)hydrazono]-4-chloro-3-oxobutanoate","","- C12 H12 Br Cl N2 O3 -","- C12 H12 Br Cl N2 O3 -","- C96 H96 Br8 Cl8 N16 O24 -","8","2","OM2083","Alpaslan, Gökhan; Özdamar, Özgür; Odabaşoğlu, Mustafa; Ocak Ískeleli, Nazan; Erdönmez, Ahmet","(<i>Z</i>)-Ethyl 2-[2-(3-bromophenyl)hydrazono]-4-chloro-3-oxobutanoate","Acta Crystallographica Section E","2007","63","2","o446","o447","10.1107/S1600536806054857","","","0.71073","MoKα","","0.048","0.032","","","0.065","0.07","","","","","","1.062","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2212324","11.167","0.003","11.534","0.003","15.799","0.003","86.02","0.02","69.58","0.02","65.19","0.02","1723.9","0.8","100","","100","","","","","","","","","4","P -1","-P 1","2","","1,3,5-Trichloro-2,4,6-tripyrrol-1-ylbenzene","","- C18 H12 Cl3 N3 -","- C18 H12 Cl3 N3 -","- C72 H48 Cl12 N12 -","4","2","OM2085","Zhang, Tao; Davila, Alfonso; McLaughlin, Mark L.; Watkins, Steven F.; Fronczek, Frank R.","1,3,5-Trichloro-2,4,6-tripyrrol-1-ylbenzene","Acta Crystallographica Section E","2007","63","2","o604","o605","10.1107/S1600536806056376","","","0.71073","MoKα","","0.057","0.038","","","0.091","0.099","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212325","16.7989","0.0012","11.2993","0.0014","16.9258","0.0012","90","","110.19","0.005","90","","3015.4","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2,4,6-Tris{[(S)-1-hydroxy-3-methylbutan-2-ylamino]methylene}cyclohexane- 1,3,5-trione","","- C24 H39 N3 O6 -","- C24 H39 N3 O6 -","- C96 H156 N12 O24 -","4","2","OM2086","Suresh, P.; Babu Varghese; Varadarajan, T. K.; Viswanathan, B.","2,4,6-Tris{[(<i>S</i>)-1-hydroxy-3-methylbutan-2-ylamino]methylene}cyclohexane-1,3,5-trione","Acta Crystallographica Section E","2007","63","2","o984","o986","10.1107/S1600536807001754","","","1.5418","CuKα","","0.0918","0.0662","","","0.1862","0.2023","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212326","5.7812","0.0006","7.5573","0.0008","37.412","0.004","90","","90","","90","","1634.5","0.3","297","2","297","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(Z)-2-Methylsulfanyl-1,4-di-p-tolylbut-2-ene-1,4-dione","","- C19 H18 O2 S -","- C19 H18 O2 S -","- C76 H72 O8 S4 -","4","1","OM2088","Gao, Meng; Chen, Ai-Hua; Cao, Li-Ping; Wang, Yu-Zhou","(<i>Z</i>)-2-Methylsulfanyl-1,4-di-<i>p</i>-tolylbut-2-ene-1,4-dione","Acta Crystallographica Section E","2007","63","2","o792","o793","10.1107/S1600536807001717","","","0.71073","MoKα","","0.091","0.0675","","","0.1414","0.1523","","","","","","1.085","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212327","14.958","0.001","11.628","0.002","12.794","0.002","90","","122.248","0.001","90","","1882","0.5","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[2-amino-1-methyl-1H-imidazol-4(5H)-one-κN^3^]dithiocyanatozinc(II)","","- C10 H14 N8 O2 S2 Zn -","- C10 H14 N8 O2 S2 Zn -","- C40 H56 N32 O8 S8 Zn4 -","4","0.5","OM2089","Li-Juan Ye; Zhong-Lu You","Bis[2-amino-1-methyl-1<i>H</i>-imidazol-4(5<i>H</i>)-one-κ<i>N</i>^3^]dithiocyanatozinc(II)","Acta Crystallographica Section E","2007","63","2","m523","m525","10.1107/S1600536807001729","","","0.71073","MoKα","","0.0584","0.0535","","","0.1375","0.1431","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212328","6.3062","0.0002","30.3062","0.0008","13.1854","0.0004","90","","94.549","0.001","90","","2512.02","0.13","100","0.1","297","2","","","","","","","","6","C 1 c 1","C -2yc","9","3-(5-Br-2-thienyl)-1-(4-nitrophenyl)prop-2-en-1-one","3-(5-Bromo-2-thienyl)-1-(4-nitrophenyl)prop-2-en-1-one","","- C13 H8 Br N O3 S -","- C13 H8 Br N O3 S -","- C104 H64 Br8 N8 O24 S8 -","8","2","OM2091","P. S. Patil; Mohd Mustaqim Rosli; Hoong-Kun Fun; Ibrahim Abdul Razak; S. M. Dharmaprakash","3-(5-Bromo-2-thienyl)-1-(4-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o785","o786","10.1107/S1600536807001730","","","0.71073","MoKα","","0.0499","0.0415","","","0.1068","0.1163","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212329","7.7926","0.0007","9.253","0.001","9.795","0.001","90.233","0.009","96.787","0.008","92.516","0.008","700.61","0.12","299","2","299","2","","","","","","","","6","P -1","-P 1","2","","2-Aminoquinolin-8-yl 3,5-difluorobenzenesulfonate","","- C15 H10 F2 N2 O3 S -","- C15 H10 F2 N2 O3 S -","- C30 H20 F4 N4 O6 S2 -","2","1","OM2092","Silva, Luiz Everson da; Foro, Sabine; Schmidt, Boris","2-Aminoquinolin-8-yl 3,5-difluorobenzenesulfonate","Acta Crystallographica Section E","2007","63","2","o829","o830","10.1107/S160053680700181X","","","1.5418","CuKα","","0.0766","0.0617","","","0.1666","0.1865","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212330","13.6756","0.0008","7.371","0.0005","7.42","0.0005","90","","90","","90","","747.96","0.08","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","catena-Poly[[dichlorozinc(II)]-μ-cyanoguanidine]","","- C2 H4 Cl2 N4 Zn -","- C2 H4 Cl2 N4 Zn -","- C8 H16 Cl8 N16 Zn4 -","4","1","PK2001","Ritche, Lyndsey K.; Harrison, William T. A.","<i>catena</i>-Poly[[dichlorozinc(II)]-μ-cyanoguanidine]","Acta Crystallographica Section E","2007","63","2","m617","m618","10.1107/S1600536807003807","","","0.71073","MoKα","","0.0281","0.0264","","","0.0701","0.0711","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212331","14.5275","0.0017","17.093","0.0015","5.995","0.0005","90","","90","","90","","1488.7","0.3","173","2","173","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","(2E)-3-(6-Methoxy-2-naphthyl)-1-phenylprop-2-en-1-one","","- C20 H16 O2 -","- C20 H16 O2 -","- C80 H64 O8 -","4","1","PV2001","Yathirajan, H. S.; Mayekar, Anil N.; Sarojini, B.K.; Narayana, B.; Bolte, Michael","(2<i>E</i>)-3-(6-Methoxy-2-naphthyl)-1-phenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o1012","o1013","10.1107/S1600536807004254","","","0.71073","MoKα","","0.0454","0.0398","","","0.0935","0.0965","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212332","6.857","0.003","15.729","0.008","16.436","0.008","90","","90","","90","","1772.7","1.5","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-(1H-Indol-3-ylmethyleneamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one","","- C20 H18 N4 O -","- C20 H18 N4 O -","- C80 H72 N16 O4 -","4","1","RN2013","Zhou, Qing-Li; Jing, Zuo-Liang; Chen, Xin; Yu Ming","4-(1<i>H</i>-Indol-3-ylmethyleneamino)-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","2","o418","o419","10.1107/S1600536806054213","","","0.71073","MoKα","","0.0336","0.0274","","","0.0714","0.0743","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212333","4.9163","0.0015","20.753","0.006","11.772","0.004","90","","91.063","0.006","90","","1200.9","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-(1,3-Dioxolan-2-ylmethyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione","","- C11 H14 N4 O4 -","- C11 H14 N4 O4 -","- C44 H56 N16 O16 -","4","1","RN2017","Bing Tu; Zhan Shu; Xing-Jü Ma; Zhi-Min Jin","7-(1,3-Dioxolan-2-ylmethyl)-1,3-dimethyl-3,7-dihydro-1<i>H</i>-purine-2,6-dione","Acta Crystallographica Section E","2007","63","2","o726","o727","10.1107/S1600536806053906","","","0.71073","MoKα","","0.082","0.0627","","","0.1554","0.1671","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212334","6.492","0.0013","18.589","0.004","8.6","0.0017","90","","97.03","0.03","90","","1030","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 F N3 S -","- C9 H10 F N3 S -","- C36 H40 F4 N12 S4 -","4","1","RZ2096","Wang, Jian-Gang; Jian, Fang-Fang; Wang, Jing; Liu, Xue-Ying","1-[1-(2-Fluorophenyl)ethylidene]thiosemicarbazide","Acta Crystallographica Section E","2007","63","2","o608","o609","10.1107/S1600536806056480","","","0.71073","MoKα","","0.0698","0.0453","","","0.1283","0.1377","","","","","","1.091","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212335","6.0326","0.0005","11.4804","0.0007","10.8416","0.0007","90","","105.454","0.005","90","","723.71","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis[5-(pyrazin-2-yl)tetrazolato]iron(II)","","- C10 H10 Fe N12 O2 -","- C10 H10 Fe N12 O2 -","- C20 H20 Fe2 N24 O4 -","2","0.5","RZ2099","Hong Deng; Yong-Cai Qiu; Rong-Hua Zeng; Feng Sun","Diaquabis[5-(pyrazin-2-yl)tetrazolato]iron(II)","Acta Crystallographica Section E","2007","63","2","m450","m451","10.1107/S1600536806055486","","","0.71073","MoKα","","0.0514","0.0324","","","0.067","0.0756","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212336","24.389","0.003","12.633","0.0002","24.632","0.0003","90","","115.123","0.002","90","","6871.3","0.9","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","cis-(Diethylenetriamine)bis(5,5-diphenylhydantoinato-κN^3^)acetatocobalt(III)","","- C36 H38 Co N7 O6 -","- C36 H38 Co N7 O6 -","- C288 H304 Co8 N56 O48 -","8","1","RZ2100","Xi-Lan Hu; Xing-You Xu; Da-Qi Wang; Hai-Feng Liu; Fu-Jun Ying","<i>cis</i>-Acetato(diethylenetriamine)bis(5,5-diphenylhydantoinato-κ<i>N</i>^3^)cobalt(III)","Acta Crystallographica Section E","2007","63","2","m405","m406","10.1107/S1600536806055528","","","0.71073","MoKα","","0.1061","0.0502","","","0.0939","0.1219","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212337","11.5777","0.0008","11.5777","0.0008","16.2234","0.0008","90","","90","","90","","2174.6","0.2","291","1","291","1","","","","","","","","3","I 41","I 4bw","80","","(S)-(-)-2,2'-Bis(2-methylallyloxy)-1,1'-binaphthyl","","- C28 H26 O2 -","- C28 H26 O2 -","- C112 H104 O8 -","4","0.5","RZ2101","Ricken, Stefan; Angelovski, Goran; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","(<i>S</i>)-(‒)-2,2'-Bis(2-methylallyloxy)-1,1'-binaphthyl","Acta Crystallographica Section E","2007","63","2","o551","o552","10.1107/S1600536806055498","","","0.71073","MoKα","","0.0677","0.0273","","","0.0536","0.0571","","","","","","0.876","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212338","12.6381","0.0004","6.665","0.0003","12.4126","0.0005","90","","109.391","0.002","90","","986.24","0.07","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[aqua(μ~3~-3,5-dinitrosalicylato)calcium(II)]","","- C7 H4 Ca N2 O8 -","- C7 H4 Ca N2 O8 -","- C28 H16 Ca4 N8 O32 -","4","1","RZ2102","Wen-Dong Song; Xian-Xia Guo; Chao-Hua Zhang","Poly[aqua(μ~3~-3,5-dinitrosalicylato)calcium(II)]","Acta Crystallographica Section E","2007","63","2","m399","m401","10.1107/S1600536806055553","","","0.71073","MoKα","","0.0442","0.0403","","","0.1233","0.1268","","","","","","1.072","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212339","11.485","0.002","21.44","0.004","5.5973","0.0011","90","","109.77","0.03","90","","1297","0.5","298","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","catena-Poly[[di-μ-thiocyanato-κ^4^S:S-argentate(I)]-di-μ-thiocyanato- κ^4^S:N-bis[diamminecopper(II)]-di-μ-thiocyanato-κ^4^N:S]","","- C6 H24 Ag2 Cu2 N14 S6 -","- C6 H24 Ag2 Cu2 N14 S6 -","- C12 H48 Ag4 Cu4 N28 S12 -","2","0.25","RZ2104","Liu, Dong-Sheng; Liu, Su-Fang; Xu, Ya-Ping; Huang, Gan-Sheng; Li, Xin-Fa","<i>catena</i>-Poly[[di-μ-thiocyanato-κ^4^<i>S</i>:<i>S</i>-argentate(I)]-di-μ-thiocyanato-κ^4^<i>S</i>:<i>N</i>-bis[diamminecopper(II)]-di-μ-thiocyanato-κ^4^<i>N</i>:<i>S</i>]","Acta Crystallographica Section E","2007","63","2","m625","m627","10.1107/S1600536807003777","","","0.71073","MoKα","","0.0295","0.0212","","","0.0615","0.0824","","","","","","1.01","","","","has coordinates,has Fobs","197043","2020-10-21","18:00:00",""
"2212340","9.4022","0.0009","10.6065","0.001","10.6577","0.0009","100.694","0.01","101.516","0.008","112.166","0.01","923.75","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","6-Chloro-2-(4-chlorophenoxy)-2-thioxo-4-trichloromethyl-4H-1,3,2- benzodioxaphosphorine","","- C14 H8 Cl5 O3 P S -","- C14 H8 Cl5 O3 P S -","- C28 H16 Cl10 O6 P2 S2 -","2","1","RZ2105","Krishnaiah, M.; Radha Krishna, J.; Jagadeesh Kumar, N.; Devandranath Reddy, C.; Rao, S. N.","6-Chloro-2-(4-chlorophenoxy)-2-thioxo-4-trichloromethyl-4<i>H</i>-1,3,2-benzodioxaphosphorine","Acta Crystallographica Section E","2007","63","2","o731","o732","10.1107/S160053680700092X","","","0.71073","MoKα","","0.0983","0.0489","","","0.0975","0.1183","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212341","8.9896","0.0005","10.3568","0.0006","21.3397","0.0013","90","","90","","90","","1986.8","0.2","291","2","291","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R,R)-4,4'-dimethyl-2,2'-[cyclohexane-1,2-diylbis(nitrilomethylidyne)]diphenol","","- C22 H26 N2 O2 -","- C22 H26 N2 O2 -","- C88 H104 N8 O8 -","4","1","RZ2106","Yang, Ming-Hua; Zheng, Yun-Fa; Yan, Guo-Bin","(<i>R</i>,<i>R</i>)-4,4'-Dimethyl-2,2'-[cyclohexane-1,2-diylbis(nitrilomethylidyne)]diphenol","Acta Crystallographica Section E","2007","63","2","o982","o983","10.1107/S1600536807003571","","","0.71073","MoKα","","0.0532","0.0329","","","0.0693","0.0715","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212342","8.3174","0.0002","20.3109","0.0004","7.4333","0.0001","90","","97.897","0.001","90","","1243.83","0.04","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[N-(Prop-2-ynyl)-N-tosylamino]ethanol","","- C12 H15 N O3 S -","- C12 H15 N O3 S -","- C48 H60 N4 O12 S4 -","4","1","RZ2109","K. Chinnakali; M. Poornachandran; R. Raghunathan; Hoong-Kun Fun","2-[<i>N</i>-(Prop-2-ynyl)-<i>N</i>-tosylamino]ethanol","Acta Crystallographica Section E","2007","63","2","o980","o981","10.1107/S1600536807003698","","","0.71073","MoKα","","0.045","0.0356","","","0.0957","0.1013","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212343","5.6735","0.0001","11.592","0.0002","23.2014","0.0004","90","","90","","90","","1525.89","0.05","100","0.1","100","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(S)-3-phenyl-2-(tosylamino)propan-1-ol","","- C16 H19 N O3 S -","- C16 H19 N O3 S -","- C64 H76 N4 O12 S4 -","4","1","RZ2110","K. Chinnakali; M. Poornachandran; R. Raghunathan; Hoong-Kun Fun","(<i>S</i>)-3-Phenyl-2-(tosylamino)propan-1-ol","Acta Crystallographica Section E","2007","63","2","o1030","o1031","10.1107/S1600536807003704","","","0.71073","MoKα","","0.0545","0.0413","","","0.0957","0.1124","","","","","","1.104","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212344","10.7021","0.0002","11.8115","0.0002","15.7264","0.0003","90","","106.66","0.001","90","","1904.49","0.06","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Ethyl-2-phenylsulfonyl-1,2,3,3a,10,10a,11,11a-octahydro- 5H-pyrrolo[3,4:2',3']pyrrolo[1,5-b]isoquinolin-5-one","","- C22 H24 N2 O3 S -","- C22 H24 N2 O3 S -","- C88 H96 N8 O12 S4 -","4","1","RZ2111","K. Chinnakali; M. Poornachandran; R. Raghunathan; Hoong-Kun Fun","3-Ethyl-2-phenylsulfonyl-1,2,3,3a,10,10a,11,11a-octahydro-5<i>H</i>-pyrrolo[3,4:2',3']pyrrolo[1,5-<i>b</i>]isoquinolin-5-one","Acta Crystallographica Section E","2007","63","2","o1028","o1029","10.1107/S1600536807003728","","","0.71073","MoKα","","0.059","0.0442","","","0.1203","0.1305","","","","","","1.069","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212345","11.5424","0.0008","8.5941","0.0005","14.4206","0.0011","90","","120.223","0.005","90","","1236.03","0.16","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(m-Tolyloxy)phthalonitrile","","- C15 H10 N2 O -","- C15 H10 N2 O -","- C60 H40 N8 O4 -","4","1","RZ2112","Ocak Ískeleli, Nazan","4-(<i>m</i>-Tolyloxy)phthalonitrile","Acta Crystallographica Section E","2007","63","2","o997","o998","10.1107/S1600536807003765","","","0.71073","MoKα","","0.0629","0.0375","","","0.093","0.1021","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212346","11.714","0.002","11.683","0.002","13.07","0.002","90","","115.912","0.003","90","","1608.9","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dibromo{2-[2-(ethylamino)ethyliminomethyl]-4-nitrophenolato}zinc(II)","","- C11 H15 Br2 N3 O3 Zn -","- C11 H15 Br2 N3 O3 Zn -","- C44 H60 Br8 N12 O12 Zn4 -","4","1","RZ2113","Li-Zhong Li; Zhonglu You","Dibromo{2-[2-(ethylamino)ethyliminomethyl]-4-nitrophenolato}zinc(II)","Acta Crystallographica Section E","2007","63","2","m607","m609","10.1107/S1600536807003558","","","0.71073","MoKα","","0.0621","0.036","","","0.0771","0.0875","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212347","13.628","0.003","7.1352","0.0014","14.663","0.003","90","","110.103","0.0011","90","","1338.9","0.5","153.1","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","5-Methyltropolone","2-hydroxy-5-methyl-2,4,6-cycloheptatrien-1-one","","- C8 H8 O2 -","- C8 H8 O2 -","- C64 H64 O16 -","8","2","RZ2114","Kubo, Kanji; Matsumoto, Taisuke; Mori, Akira","5-Methyltropolone","Acta Crystallographica Section E","2007","63","2","o1063","o1064","10.1107/S1600536807004035","","","0.7107","MoKα","","","0.0392","","","","0.1092","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212348","11.696","0.003","14.377","0.004","9.177","0.002","90","","90","","90","","1543.1","0.7","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3S,4S)-tert-Butyl 4-amino-3-hydroxy-5-phenylpentanoate","","- C15 H23 N O3 -","- C15 H23 N O3 -","- C60 H92 N4 O12 -","4","1","RZ2115","Zhang, Yu; Fang, Hua; Jin, Li-Ren; Zheng, Jian-Feng","(3<i>S</i>,4<i>S</i>)-<i>tert</i>-Butyl 4-amino-3-hydroxy-5-phenylpentanoate","Acta Crystallographica Section E","2007","63","2","o1051","o1052","10.1107/S1600536807004278","","","0.71073","MoKα","","0.0425","0.0399","","","0.1114","0.115","","","","","","0.854","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212349","6.298","0.003","8.606","0.002","11.824","0.007","90","","101.84","0.02","90","","627.2","0.5","293","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cyclohexane-1,4-diammonium bis(dihydrogenphosphate)","","- C6 H20 N2 O8 P2 -","- C6 H20 N2 O8 P2 -","- C12 H40 N4 O16 P4 -","2","0.5","SA2023","Amel Dakhlaoui; Khadija Gmigui; Leila Samia Smiri","A new amine phosphate templated by 1,4-diaminocyclohexane","Acta Crystallographica Section E","2007","63","2","o537","o539","10.1107/S160053680605625X","","","0.71073","MoKα","","0.0452","0.038","","","0.0979","0.1041","","","","","","1.088","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212350","28.4372","0.0003","10.8977","0.0001","19.6203","0.0002","90","","101.14","0.001","90","","5965.77","0.11","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","{Tris[2-(2-pyridylmethyleneamino-κ^2^N,N')ethyl]amine}cadmium(II) bis(perchlorate)","","- C24 H27 Cd Cl2 N7 O8 -","- C24 H27 Cd Cl2 N7 O8 -","- C192 H216 Cd8 Cl16 N56 O64 -","8","1","SA2029","He, Hong-Shan","{Tris[2-(2-pyridylmethyleneamino-κ^2^<i>N</i>,<i>N</i>')ethyl]amine}cadmium(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","2","m346","m347","10.1107/S1600536806056261","","","0.71073","MoKα","","0.0449","0.0362","","","0.1059","0.1131","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212351","9.5191","0.0006","9.6282","0.0006","9.6452","0.0006","106.939","0.003","98.292","0.003","110.123","0.002","764.05","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena Poly[diaqua bis(oxalic acid) (tetramethylphosphono-1,4-diaminobutane) digadolinium(III)] tetrahydrate","","- C6 H17 Gd N O13 P2 -","- C6 H17 Gd N O13 P2 -","- C12 H34 Gd2 N2 O26 P4 -","2","1","SA2032","Shao-Ming Ying; Jian-Qiang Liu; Shuang-Lian Cai; Fan Zhong; Guang-Pei Zhou","Poly[[diaqua[μ~6~-(butane-1,4-diyldinitrilotetramethylene)tetraphosphonato]di-μ~2~-oxalato-digadolinium(III)] tetrahydrate]","Acta Crystallographica Section E","2007","63","2","m415","m417","10.1107/S1600536807000049","","","0.71073","MoKα","","0.059","0.0446","","","0.0967","0.1005","","","","","","0.943","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212352","9.3785","0.0006","9.2002","0.0006","11.2501","0.0008","90","","100.422","0.006","90","","954.69","0.11","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichloro(μ~4~-oxalato-1κ^2^O,O':2κ^2^O'',O''')bis{[1-(pyridin-2- yl)ethylidene]hydrazine-κ^2^N,N'}dicopper(II)","","- C16 H18 Cl2 Cu2 N6 O4 -","- C16 H18 Cl2 Cu2 N6 O4 -","- C32 H36 Cl4 Cu4 N12 O8 -","2","0.5","SA2033","Stefaniya V. Tomyn; Elźbieta Gumienna-Kontecka; Igor O. Fritsky; Turganbay S. Iskenderov; Jolanta Światek-Kozłowska","μ-Oxalato-1κ^2^<i>O</i>,<i>O</i>':2κ^2^<i>O</i>'',<i>O</i>'''-bis(chloro{[1-(2-pyridyl-κ<i>N</i>)ethylidene]hydrazine-κ<i>N</i>}copper(II))","Acta Crystallographica Section E","2007","63","2","m438","m440","10.1107/S1600536807000098","","","0.71073","MoKα","","0.0438","0.0369","","","0.0948","0.0986","","","","","","1.092","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212353","6.6713","0.0008","15.3876","0.0018","16.0725","0.0019","90","","101.162","0.002","90","","1618.7","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","5,5'-Dibenzyl barbituric acid monohydrate","5,5'-Dibenzyl barbituric acid monohydrate","","- C18 H18 N2 O4 -","- C18 H18 N2 O4 -","- C72 H72 N8 O16 -","4","1","SA2034","Prashant M. Bhatt; Gautam R. Desiraju","5,5-Dibenzylbarbituric acid monohydrate","Acta Crystallographica Section E","2007","63","2","o771","o772","10.1107/S1600536806056546","","","0.71073","MoKα","","0.0648","0.0543","","","0.1366","0.1426","","","","","","1.102","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212354","14.997","0.003","5.9717","0.0012","15.617","0.003","90","","101.24","0.03","90","","1371.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(4'-(dimethylamino)phenyl)-6-methoxybenzothiazole","","- C16 H16 N2 O S -","- C16 H16 N2 O S -","- C64 H64 N8 O4 S4 -","4","1","SA2035","Chen, Xiang-Ji; Yu, Ping-Rong; Wang, Wu-Shang; Liu, Bo-Li","2-[4-(Dimethylamino)phenyl]-6-methoxy-1,3-benzothiazole","Acta Crystallographica Section E","2007","63","2","o595","o596","10.1107/S1600536806056558","","","0.71073","MoKα","","0.0374","0.0329","","","0.0911","0.0946","","","","","","1.103","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212355","7.4919","0.0009","7.9858","0.001","11.4486","0.0014","92.948","0.002","96.711","0.002","102.841","0.002","661.13","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-(1H-Benzotriazol-1-yl)-1-(3-chlorophenyl)propan-1-one","","- C15 H12 Cl N3 O -","- C15 H12 Cl N3 O -","- C30 H24 Cl2 N6 O2 -","2","1","SA2037","Wu-Lan Zeng; Sai Bi; Na-Na Tian; Jun Wan","3-(1<i>H</i>-Benzotriazol-1-yl)-1-(3-chlorophenyl)propan-1-one","Acta Crystallographica Section E","2007","63","2","o617","o618","10.1107/S1600536807000712","","","0.71073","MoKα","","0.0492","0.0405","","","0.1036","0.1114","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212356","6.6778","0.0013","7.4041","0.0014","8.6654","0.0016","90","","101.666","0.003","90","","419.59","0.14","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","4-methoxypiperidinium chloride","","- C6 H14 Cl N O -","- C6 H14 Cl N O -","- C12 H28 Cl2 N2 O2 -","2","1","SA2038","Yao, Zheng; Gu, Xiao-Dan; Li, Zhi-Gang; Deng, Jian-Cheng; Xu, Jing-Wei","4-Methoxypiperidinium chloride","Acta Crystallographica Section E","2007","63","2","o654","o655","10.1107/S1600536807000700","","","0.71073","MoKα","","0.0314","0.0302","","","0.0777","0.0787","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212357","16.2653","0.0002","7.1079","0.0001","25.4562","0.0005","90","","90.751","0.001","90","","2942.79","0.08","296","2","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H30 Cl7 N3 O6 Sn -","- C18 H30 Cl7 N3 O6 Sn -","- C72 H120 Cl28 N12 O24 Sn4 -","4","1","SA2039","Bouacida, Sofiane; Merazig, Hocine; Benard-Rocherulle, Patricia; Rizzoli, Corrado","Tris(2-hydroxyanilinium) hexachlorostannate(IV) chloride trihydrate","Acta Crystallographica Section E","2007","63","2","m379","m381","10.1107/S160053680605656X","","","0.71073","MoKα","","0.057","0.0408","","","0.1007","0.1057","","","","","","1.127","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212358","10.6836","0.0012","11.8752","0.0014","9.0111","0.0011","90","","109.46","0.002","90","","1077.9","0.2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[(isonicotinato)uranyl(VI)]-μ-oxalato]","","- C8 H5 N O8 U -","- C8 H5 N O8 U -","- C32 H20 N4 O32 U4 -","4","0.5","SF3021","Liu, Dong-Sheng; Shi, Ta-Qing; Liu, Su-Fang; Ying, Shao-Ming; Li, Xin-Fa","<i>catena</i>-Poly[[(isonicotinato)uranyl(VI)]-μ-oxalato]","Acta Crystallographica Section E","2007","63","2","m385","m387","10.1107/S1600536806046538","","","0.71073","MoKα","","0.0348","0.0258","","","0.0563","0.0577","","","","","","0.99","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212359","28.523","0.006","5.2756","0.0011","10.722","0.002","90","","101.67","0.03","90","","1580.1","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Sodium 2-chloro-2-hydroxyethanesulfonate hemihydrate","","- C3 H7 Cl Na O4.5 S -","- C3 H7 Cl Na O4.5 S -","- C24 H56 Cl8 Na8 O36 S8 -","8","1","SG2100","Dan Xu; Bao-Kuan Zhou","Sodium 3-chloro-2-hydroxyethanesulfonate hemihydrate","Acta Crystallographica Section E","2007","63","2","m337","m338","10.1107/S1600536806054924","","","0.71073","MoKα","","0.0454","0.0398","","","0.1017","0.1053","","","","","","1.062","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212360","17.47","0.003","11.36","0.002","17.27","0.003","90","","101.21","0.03","90","","3362","1.1","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","tetrakis-trimethylsilyl-trans-2,6-dichloro-cyklotriphosphazene","trans-2,6-Dichloro-2,4,4,6-tetrakis[methyl(trimethylsilyl)amino]- 1,3,5,2λ^5^,4λ^5^,6λ^5^-triazatriphosphorine","","- C16 H48 Cl2 N7 P3 Si4 -","- C16 H48 Cl2 N7 P3 Si4 -","- C64 H192 Cl8 N28 P12 Si16 -","4","0.5","SG2112","Voznicová, Radka; Taraba, Jan; Alberti, Milan; Příhoda, Jiři","<i>trans</i>-2,6-Dichloro-2,4,4,6-tetrakis[methyl(trimethylsilyl)amino]-1,3,5,2λ^5^,4λ^5^,6λ^5^-triazatriphosphorine","Acta Crystallographica Section E","2007","63","2","o592","o594","10.1107/S1600536806055292","","","0.71069","MoKα","","0.0399","0.0376","","","0.0958","0.0974","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212361","3.9877","0.0008","12.8468","0.0015","12.8408","0.0019","90","","90.872","0.014","90","","657.75","0.18","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Chloro-4-methylpyridin-3-amine","","- C6 H7 Cl N2 -","- C6 H7 Cl N2 -","- C24 H28 Cl4 N8 -","4","1","SG2113","Yathirajan, H.S.; Bindya, S.; Vijesh, A. M.; Narayana, B.; Bolte, Michael","2-Chloro-4-methylpyridin-3-amine","Acta Crystallographica Section E","2007","63","2","o761","o762","10.1107/S1600536807001213","","","0.71073","MoKα","","0.0378","0.0342","","","0.0915","0.0934","","","","","","1.082","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212362","10.3179","0.0011","12.4319","0.001","14.5673","0.0017","90","","95.023","0.009","90","","1861.4","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Chloro-8-(trifluoromethyl)quinoline","","- C10 H5 Cl F3 N -","- C10 H5 Cl F3 N -","- C80 H40 Cl8 F24 N8 -","8","2","SG2114","Yathirajan, H. S.; Sreevidya, T. V.; Prathap, M.; Narayana, B.; Bolte, Michael","4-Chloro-8-(trifluoromethyl)quinoline","Acta Crystallographica Section E","2007","63","2","o763","o765","10.1107/S1600536807001249","","","0.71073","MoKα","","0.0531","0.0369","","","0.0984","0.1054","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212363","8.6711","0.0009","10.7727","0.0012","11.5702","0.0013","95.804","0.001","96.604","0.001","110.547","0.001","993.62","0.19","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","Diaqua(pyridine-2,4,6-tricarboxylato-κ^3^N,O^2^,O^6^)[4-(4- pyridyl)pyridinium-κN^1^]cobalt(II) dihydrate","","- C18 H19 Co N3 O10 -","- C18 H19 Co N3 O10 -","- C36 H38 Co2 N6 O20 -","2","1","SG2115","Xie, Cheng-Zhi; Qin, Jian-Hua; Wang, Jian-Ge; Li, Chang-Bin; Li, Yong-Feng","Diaqua(pyridine-2,4,6-tricarboxylato-κ^3^<i>N</i>,<i>O</i>^2^,<i>O</i>^6^)[4-(4-pyridyl)pyridinium-κ<i>N</i>^1^]cobalt(II) dihydrate","Acta Crystallographica Section E","2007","63","2","m498","m500","10.1107/S1600536807001250","","","0.71073","MoKα","","0.0329","0.0282","","","0.0731","0.0763","","","","","","1.046","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212364","3.9481","0.0006","17.383","0.002","7.7968","0.0011","90","","102.461","0.012","90","","522.49","0.13","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Bromopyrimidin-2(1H)-one","","- C4 H3 Br N2 O -","- C4 H3 Br N2 O -","- C16 H12 Br4 N8 O4 -","4","1","SG2118","Yathirajan, H. S.; Narayana, B.; Ashalatha, B. V.; Sarojini, B. K.; Bolte, Michael","5-Bromopyrimidin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","2","o923","o924","10.1107/S1600536807003054","","","0.71073","MoKα","","0.0421","0.0358","","","0.0896","0.0921","","","","","","1.117","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212365","16.0234","0.0016","7.6225","0.0005","15.0652","0.0016","90","","115.828","0.007","90","","1656.2","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-{[(E)-(4-Diethylamino-2-hydroxyphenyl)methylene]amino}phenyl)ethanone","","- C19 H22 N2 O2 -","- C19 H22 N2 O2 -","- C76 H88 N8 O8 -","4","1","SG2121","Yathirajan, H. S.; Vijesh, A. M.; Narayana, B.; Sarojini, B. K.; Bolte, Michael","1-(4-{[(<i>E</i>)-(4-Diethylamino-2-hydroxyphenyl)methylene]amino}phenyl)ethanone","Acta Crystallographica Section E","2007","63","2","o936","o938","10.1107/S1600536807003091","","","0.71073","MoKα","","0.0473","0.0401","","","0.1044","0.1089","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212366","10.534","0.003","22.884","0.008","6.811","0.002","90","","95.403","0.006","90","","1634.6","0.9","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,10-phenanthroline pyridinium perchlorate","","- C17 H14 Cl N3 O4 -","- C17 H14 Cl N3 O4 -","- C68 H56 Cl4 N12 O16 -","4","0.5","SG2123","Xi-Shi Tai; Jie Yin; Yi-Min Feng","1,10-Phenanthroline pyridinium perchlorate","Acta Crystallographica Section E","2007","63","2","o1037","o1038","10.1107/S160053680700431X","","","0.71073","MoKα","","0.109","0.0528","","","0.1143","0.139","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212367","17.8761","0.0016","8.2053","0.0005","14.57","0.0014","90","","105.863","0.007","90","","2055.7","0.3","296","","296","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","O,O-Bis(2-tert-butylphenyl) chlorothiophosphonate","","- C20 H26 Cl O2 P S -","- C20 H26 Cl O2 P S -","- C80 H104 Cl4 O8 P4 S4 -","4","0.5","SJ2188","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","<i>O</i>,<i>O</i>-Bis(2-<i>tert</i>-butylphenyl) chlorothiophosphonate","Acta Crystallographica Section E","2007","63","2","o580","o581","10.1107/S1600536806055371","","","0.71073","MoKα","","0.037","0.0329","","","0.0844","0.0869","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212368","14.1641","0.0004","14.1641","0.0004","9.2045","0.0003","90","","90","","90","","1846.62","0.1","150","","150","","","","","","","","","3","P 41","P 4w","76","","3,3':5,6-di-O-isopropylidene-3-C-hydroxymethyl-D-allono-1,4-lactone","","- C13 H20 O7 -","- C13 H20 O7 -","- C52 H80 O28 -","4","1","SJ2196","Michela Simone; George W. J. Fleet; David J. Watkin","3,3':5,6-Di-<i>O</i>-isopropylidene-3-<i>C</i>-hydroxymethyl-<small>D</small>-<i>allono</i>-1,4-lactone: an organic structure containing large unoccupied voids","Acta Crystallographica Section E","2007","63","2","o799","o801","10.1107/S1600536807002061","","","0.71073","MoKα","","0.0583","0.0461","","0.049","0.0443","0.0443","","","","","","1.0379","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212369","5.1605","0.0004","15.585","0.001","17.57","0.001","90","","95.085","0.001","90","","1407.53","0.16","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(3-Methylsulfanyl-2-phenyl-1-benzofuran-5-yl)acetic acid","","- C17 H14 O3 S -","- C17 H14 O3 S -","- C68 H56 O12 S4 -","4","1","SJ2199","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","(3-Methylsulfanyl-2-phenyl-1-benzofuran-5-yl)acetic acid","Acta Crystallographica Section E","2007","63","2","o442","o443","10.1107/S1600536806054833","","","0.71073","MoKα","","0.0614","0.0561","","","0.1174","0.1197","","","","","","1.233","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212370","12.396","0.0009","9.5652","0.0007","23.163","0.002","90","","92.266","0.001","90","","2744.3","0.4","100","1","100","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3-Di-o-tolylthiourea","","- C15 H16 N2 S -","- C15 H16 N2 S -","- C120 H128 N16 S8 -","8","2","SJ2200","Niaz Muhammed; Zia-ur-Rahman; Saqib Ali; Meetsma, Auke","1,3-Di-<i>o</i>-tolylthiourea","Acta Crystallographica Section E","2007","63","2","o634","o635","10.1107/S1600536806055048","","","0.71073","MoKα","","0.0588","0.0456","","","0.099","0.1045","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212371","6.1044","0.0001","10.1495","0.0002","20.4177","0.0004","90","","105.691","0.001","90","","1217.87","0.04","100","0.1","297","2","","","","","","","","4","P 1 c 1","P -2yc","7","","3-Amino-5,5-dimethyl-2-phenylcyclohex-2-en-1-one","","- C14 H17 N O -","- C14 H17 N O -","- C56 H68 N4 O4 -","4","2","SJ2203","Hoong-Kun Fun; Yong-Miao Shen; Jian-Hua Xu; Suchada Chantrapromma","3-Amino-5,5-dimethyl-2-phenylcyclohex-2-en-1-one","Acta Crystallographica Section E","2007","63","2","o462","o464","10.1107/S1600536806055097","","","0.71073","MoKα","","0.0644","0.0522","","","0.1374","0.1466","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212372","7.75","0.0015","24.717","0.003","9.605","0.002","90","","94.619","0.007","90","","1833.9","0.6","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","Paxdaphnine B","methyl 5-ethyl-2-methoxy-6-azapentacyclo[9.5.1.0^1,5^.0^2,8^.0^14,17^]heptadec- 11(17)-ene-15-carboxylate","","- C21 H31 N O3 -","- C21 H31 N O3 -","- C84 H124 N4 O12 -","4","2","SJ2204","Yong-Bin Lu; Ning-Chuan Kong; Yuan-Yuan Feng; Xiao-Jiang Hao; Yang Lu","Paxdaphnine B: a 1,19-bisnor-daphniphyllum alkaloid","Acta Crystallographica Section E","2007","63","2","o589","o591","10.1107/S1600536806055826","","","0.71073","MoKα","","0.0584","0.0516","","","0.1295","0.1367","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212373","9.0183","0.0004","12.5563","0.0005","18.3224","0.0007","75.391","0.002","88.559","0.002","88.083","0.002","2006.26","0.14","100","0.1","297","2","","","","","","","","5","P -1","-P 1","2","","9,10,11,12-Tetrachloro-12b-hydroxy-12c-phenyl-1,2,3,3a,5,6,12b,12c-octahydro-8H-cyclopenta[6,7][1,4]oxazepino[5,4-a]isoindol-8-one","","- C21 H17 Cl4 N O3 -","- C21 H17 Cl4 N O3 -","- C84 H68 Cl16 N4 O12 -","4","2","SJ2205","Hoong-Kun Fun; Yong-Miao Shen; Jian-Hua Xu; Suchada Chantrapromma","9,10,11,12-Tetrachloro-12b-hydroxy-12c-phenyl-1,2,3,3a,5,6,12b,12c-octahydro-8<i>H</i>-cyclopenta[6,7][1,4]oxazepino[5,4-<i>a</i>]isoindol-8-one","Acta Crystallographica Section E","2007","63","2","o495","o497","10.1107/S160053680605567X","","","0.71073","MoKα","","0.0778","0.0697","","","0.2138","0.2227","","","","","","1.147","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212374","5.2318","0.0005","16.466","0.002","12.415","0.001","90","","94.846","0.002","90","","1065.69","0.19","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Bromo-2-methyl-3-methylsulfinyl-1-benzofuran","","- C10 H9 Br O2 S -","- C10 H9 Br O2 S -","- C40 H36 Br4 O8 S4 -","4","1","SJ2206","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","5-Bromo-2-methyl-3-methylsulfinylbenzofuran","Acta Crystallographica Section E","2007","63","2","o521","o522","10.1107/S1600536806055668","","","0.71073","MoKα","","0.0589","0.0518","","","0.1456","0.1521","","","","","","1.015","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212375","12.88","0.01","10.49","0.01","13.59","0.01","90","","116.91","0.03","90","","1637","2","123","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Oxalato-κ^2^O:O')(propane-1,3-diamine-κ^2^N:N')palladium(II)","","- C5 H10 N2 O4 Pd -","- C5 H10 N2 O4 Pd -","- C40 H80 N16 O32 Pd8 -","8","2","SJ2209","Odoko, Mamiko; Okabe, Nobuo","(Oxalato-κ^2^<i>O</i>,<i>O</i>')(propane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>')palladium(II)","Acta Crystallographica Section E","2007","63","2","m628","m630","10.1107/S1600536807004187","","","0.7107","MoKα","","","0.018","","","","0.038","","","","","","0.914","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212376","4.43","0.005","8.94","0.01","11.4","0.01","106.93","0.03","90.83","0.04","95.03","0.04","429.9","0.8","123","","","","","","","","","","","5","P -1","-P 1","2","","(Malonato-κ^2^O:O')(propane-1,3-diamine-κ^2^N:N')palladium(II)","","- C6 H12 N2 O4 Pd -","- C6 H12 N2 O4 Pd -","- C12 H24 N4 O8 Pd2 -","2","1","SJ2210","Odoko, Mamiko; Okabe, Nobuo","(Malonato-κ^2^<i>O</i>,<i>O</i>')(propane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>')palladium(II)","Acta Crystallographica Section E","2007","63","2","m631","m633","10.1107/S1600536807004199","","","0.7107","MoKα","","","0.016","","","","0.043","","","","","","1.094","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212377","9.3869","0.0002","10.6666","0.0002","10.7902","0.0003","117.609","0.001","98.685","0.001","98.2172","0.0016","918","0.04","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Hexakis-μ-chloro-dichloro-bis[(3,5-dimethylpyrazol-1-yl)acetic acid-κ^2^N,N']tetracopper(II)","","- C24 H32 Cl8 Cu4 N8 O4 -","- C24 H32 Cl8 Cu4 N8 O4 -","- C24 H32 Cl8 Cu4 N8 O4 -","1","0.5","SK3091","Pevec, Andrej; Kozlevčar, Bojan; Gamez, Patrick; Reedijk, Jan","Hexakis-μ-chlorido-dichloridobis[(3,5-dimethylpyrazol-1-yl)acetic acid-κ^2^<i>N</i>,<i>N</i>']tetracopper(II): an unexpected neutral bis-pyrazolyl ligand in a tetracopper(II) complex","Acta Crystallographica Section E","2007","63","2","m514","m516","10.1107/S1600536807001493","","","0.71073","MoKα","","0.0421","0.031","","","0.0657","0.0711","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212378","7.8267","0.0011","8.532","0.0011","11.7409","0.0016","81.113","0.002","73.696","0.002","66.468","0.002","689.12","0.16","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[diaquadinitratozinc(II)]bis(μ-1,4-di-3-pyridyl-2,3-diaza-1,3- butadiene)]","","- C24 H24 N10 O8 Zn -","- C24 H24 N10 O8 Zn -","- C24 H24 N10 O8 Zn -","1","0.5","TK2102","Paulin, Shakoya; Kelly, Pierre; Williams, Kenneth B.; Goforth, Andrea M.; Smith, Mark D.; Peterson Jr, LeRoy; zur Loye, Hans-Conrad","<i>catena</i>-Poly[[diaquadinitratozinc(II)]bis(μ-1,4-di-3-pyridyl-2,3-diaza-1,3-butadiene)]","Acta Crystallographica Section E","2007","63","2","m420","m422","10.1107/S1600536807000281","","","0.71073","MoKα","","0.03","0.029","","","0.081","0.082","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212379","19.751","0.004","12.534","0.005","17.747","0.004","90","","105.82","0.017","90","","4227","2","296","2","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-Ethyl-8-methyl-6-phenyl-1-(phenylsulfonyl)- 1H,6H-pyrrolo[3,4-f]indole-5,7(1H,6H)-dione","","- C25 H20 N2 O4 S -","- C25 H20 N2 O4 S -","- C200 H160 N16 O32 S8 -","8","1","TK2113","Moskalev, Nikolai V.; Gribble, Gordon W.; Jasinski, Jerry P.","4-Ethyl-8-methyl-6-phenyl-1-(phenylsulfonyl)-1<i>H</i>,6<i>H</i>-pyrrolo[3,4-<i>f</i>]indole-5,7(1<i>H</i>,6<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","2","o673","o674","10.1107/S1600536806053670","","","0.71069","MoKα","","0.266","0.055","","","0.134","0.204","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212380","9.521","0.002","10.775","0.004","12.06","0.004","74.61","0.03","102.14","0.03","103.45","0.02","1145.5","0.6","296","","296","","","","","","","","","5","P -1","-P 1","2","","1-(Phenylsulfonyl)-2,3-di-p-tolyl-1H-indole","","- C28 H23 N O2 S -","- C28 H23 N O2 S -","- C56 H46 N2 O4 S2 -","2","1","TK2114","Liu, Yanbing; Gribble, Gordon W.; Jasinski, Jerry P.","1-(Phenylsulfonyl)-2,3-di-<i>p</i>-tolyl-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","2","o735","o737","10.1107/S1600536806053682","","","0.71069","MoKα","","0.217","0.051","","","0.138","0.211","","","","","","0.97","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212381","11.768","0.006","15.198","0.004","12.223","0.007","90","","111.71","0.03","90","","2031","1.7","296","2","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,3-Diphenyl-1-(phenylsulfonyl)indole","","- C26 H19 N O2 S -","- C26 H19 N O2 S -","- C104 H76 N4 O8 S4 -","4","1","TK2115","Liu, Yanbing; Gribble, Gordon W.; Jasinski, Jerry P.","2,3-Diphenyl-1-(phenylsulfonyl)indole","Acta Crystallographica Section E","2007","63","2","o738","o740","10.1107/S1600536806053694","","","0.71069","MoKα","","0.363","0.051","","","0.126","0.264","","","","","","0.92","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212382","5.4751","0.0009","9.4755","0.0014","17.885","0.004","90","","90","","90","","927.9","0.3","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-(4-bromophenyl)cyclobutanone","","- C10 H9 Br O -","- C10 H9 Br O -","- C40 H36 Br4 O4 -","4","1","TK2116","Jem-Mau Lo; Mei-Hsun Chen; Jack Cheng; Chun-Yu Chen; Tian-Huey Lu","3-(4-Bromophenyl)cyclobutanone","Acta Crystallographica Section E","2007","63","2","o656","o657","10.1107/S1600536807000256","","","0.71073","MoKα","","0.144","0.06","","","0.121","0.146","","","","","","0.89","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212383","27.159","0.005","11.931","0.002","11.785","0.002","90","","112.32","0.03","90","","3532.6","1.3","109","2","109","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-Chloro-6-[(2,6-dimethoxybenzyl)amino]-9-isopropylpurine 0.125-hydrate","","- C17 H20.25 Cl N5 O2.125 -","- C17 H20.25 Cl N5 O2.125 -","- C136 H162 Cl8 N40 O17 -","8","1","TK2117","Trávníček, Zdeněk; Popa, Igor","2-Chloro-6-[(2,6-dimethoxybenzyl)amino]-9-isopropylpurine 0.125-hydrate","Acta Crystallographica Section E","2007","63","2","o629","o631","10.1107/S1600536807000268","","","0.71073","MoKα","","0.042","0.036","","","0.083","0.087","","","","","","1.1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212384","11.4971","0.0016","8.5239","0.0012","14.317","0.002","90","","90","","90","","1403.1","0.3","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","Bis(trimethylphosphine)gold(I) hexafluorophosphate","Bis(trimethylphosphine-κP)gold(I) hexafluorophosphate","","- C6 H18 Au F6 P3 -","- C6 H18 Au F6 P3 -","- C24 H72 Au4 F24 P12 -","4","0.5","TK2119","Horvath, Ulrike E. I.; Raubenheimer, Helgard G.","Bis(trimethylphosphine-κ<i>P</i>)gold(I) hexafluorophosphate","Acta Crystallographica Section E","2007","63","2","m567","m568","10.1107/S1600536807001699","","","0.71073","MoKα","","0.019","0.018","","","0.046","0.046","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212385","8.81","0.009","11.19","0.01","11.203","0.009","70.31","0.03","80.18","0.03","67.11","0.03","957","1.5","123","","","","","","","","","","","5","P -1","-P 1","2","","Aqua(cyclobutane-1,1-dicarboxylato-κ^2^O,O')(di-2-pyridylamine- κ^2^N,N')copper(II) trihydrate","","- C16 H23 Cu N3 O8 -","- C16 H23 Cu N3 O8 -","- C32 H46 Cu2 N6 O16 -","2","1","TK2121","Yodoshi, Masahiro; Mototsuji, Mari; Okabe, Nobuo","Aqua(cyclobutane-1,1-dicarboxylato-κ^2^<i>O</i>,<i>O</i>')(di-2-pyridylamine-κ^2^<i>N</i>,<i>N</i>')copper(II) trihydrate","Acta Crystallographica Section E","2007","63","2","m634","m636","10.1107/S160053680700390X","","","0.7107","MoKα","","","0.021","","","","0.06","","","","","","1.08","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212386","23.583","0.007","5.096","0.002","14.907","0.004","90","","121.921","0.004","90","","1520.6","0.9","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","1,7-dibromo-2,8-dimethyl Tröger's base","1,7-dibromo-2,8-dimethyl-6H,12H-5,11-methanodibenzo[b,f][1,5]diazocine","","- C17 H16 Br2 N2 -","- C17 H16 Br2 N2 -","- C68 H64 Br8 N8 -","4","0.5","TK2122","Faroughi, Masoud; Turner, Peter; Try, Andrew C.","1,7-Dibromo-2,8-dimethyl-6<i>H</i>,12<i>H</i>-5,11-methanodibenzo[<i>b</i>,<i>f</i>][1,5]diazocine","Acta Crystallographica Section E","2007","63","2","o1045","o1047","10.1107/S1600536807004321","","","0.71073","MoKα","","0.023","0.022","","","0.056","0.057","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212387","6.891","0.0001","10.0369","0.0002","12.0624","0.0002","99.826","0.001","95.971","0.001","107.817","0.001","771.69","0.02","293","2","293","2","","","","","","","","4","P -1","-P 1","2","3,9-dibromo-2,8-dimethyl Tröger's base","3,9-dibromo-2,8-dimethyl-6H,12H-5,11-methanodibenzo[b,f][1,5]diazocine","","- C17 H16 Br2 N2 -","- C17 H16 Br2 N2 -","- C34 H32 Br4 N4 -","2","1","TK2123","Faroughi, Masoud; Scudder, Marcia; Turner, Peter; Jensen, Paul; Try, Andrew C.","3,9-Dibromo-2,8-dimethyl-6<i>H</i>,12<i>H</i>-5,11-methanodibenzo[<i>b</i>,<i>f</i>][1,5]diazocine","Acta Crystallographica Section E","2007","63","2","o1048","o1050","10.1107/S1600536807004345","","","0.71073","MoKα","","0.088","0.036","","","0.072","0.085","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212388","11.854","0.003","15.46","0.004","15.279","0.004","90","","90.447","0.004","90","","2800","1.3","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","CB6 diamine diiodine decahydrate","Cucurbit[6]uril p-phenylenediammonium diiodide decahydrate","","- C42 H66 I2 N26 O22 -","- C42 H66 I2 N26 O22 -","- C84 H132 I4 N52 O44 -","2","0.5","TK2125","Huang, Wei-Hao; Zavalij, Peter Y.; Isaacs, Lyle","Cucurbit[6]uril <i>p</i>-phenylenediammonium diiodide decahydrate inclusion complex","Acta Crystallographica Section E","2007","63","2","o1060","o1062","10.1107/S160053680700387X","","","0.71073","MoKα","","0.039","0.035","","","0.083","0.085","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212389","5.6495","0.0004","10.6323","0.0007","12.7814","0.0009","90","","99.042","0.006","90","","758.2","0.09","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1'-Butane-1,4-diylbis(1H-benzimidazole)","","- C18 H18 N4 -","- C18 H18 N4 -","- C36 H36 N8 -","2","0.5","TK2126","Mehmet Akkurt; Selvi Karaca; Hasan Küçükbay; Orhan Büyükgüngör","1,1'-Butane-1,4-diylbis(1<i>H</i>-benzimidazole)","Acta Crystallographica Section E","2007","63","2","o1065","o1066","10.1107/S1600536807003911","","","0.71073","MoKα","","0.043","0.031","","","0.081","0.085","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212390","8.0713","0.0007","10.666","0.0011","10.9429","0.0008","110.393","0.004","96.174","0.003","96.299","0.004","866.87","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(3,5-Dimethyl-1H-pyrazole-κN^2^)(4-oxidopent-3-en-2-one 2-hydroxybenzoylhydrazonatoκ^2^N,O)copper(II)","","- C17 H20 Cu N4 O3 -","- C17 H20 Cu N4 O3 -","- C34 H40 Cu2 N8 O6 -","2","1","WK2036","Du, Kang-Kai; Liu, Shi-Xiong","(3,5-Dimethyl-1<i>H</i>-pyrazole-κ<i>N</i>^2^)(4-oxidopent-3-en-2-one 2-hydroxybenzoylhydrazonato-κ^2^<i>N</i>,<i>O</i>)copper(II)","Acta Crystallographica Section E","2007","63","2","m443","m444","10.1107/S1600536807000372","","","0.71073","MoKα","","0.0373","0.033","","","0.0882","0.0908","","","","","","1.069","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212391","8.554","0.0007","11.1363","0.0008","17.9894","0.0013","92.746","0.006","94.278","0.006","96.246","0.006","1696","0.2","295","2","","","","","","","","","","4","P -1","-P 1","2","","Dimethyl 6,6'-bis(benzyloxy)-5,5'-dimethoxy)-3,3'-(6-methoxy-1,3,5-triazine-2,4- diyldioxy)dibenzoate","","- C36 H33 N3 O11 -","- C36 H33 N3 O11 -","- C72 H66 N6 O22 -","2","1","WK2041","Peter, Xolani K.; Heerden, Fanie R. van; Munro, Orde Q.","A triazine derivative with a triple-decker sandwich conformation","Acta Crystallographica Section E","2007","63","2","o624","o626","10.1107/S1600536806054018","","","0.71073","MoKα","","","0.066","","","","0.2243","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212392","5.151","0.0006","15.0236","0.0016","9.5778","0.0011","90","","117.191","0.002","90","","659.28","0.13","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","poly[(μ~4~-3-pyridylphosphonato-κ^4^-N,O,O',O'')cobalt(II)]","","- C5 H4 Co N O3 P -","- C5 H4 Co N O3 P -","- C20 H16 Co4 N4 O12 P4 -","4","1","WK2043","Wasson, Anna E.; LaDuca, Robert L.","Poly[(μ~4~-3-pyridylphosphonato-κ^4^-<i>N</i>:<i>O</i>:<i>O</i>':<i>O</i>'')cobalt(II)]","Acta Crystallographica Section E","2007","63","2","m462","m464","10.1107/S1600536807000530","","","0.71073","MoKα","","0.0428","0.0332","","","0.0621","0.0651","","","","","","1.127","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212393","5.1413","0.0003","16.589","0.001","12.2756","0.0007","90","","94.689","0.001","90","","1043.47","0.11","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Chloro-2-methyl-3-methylsulfinyl-1-benzofuran","","- C10 H9 Cl O2 S -","- C10 H9 Cl O2 S -","- C40 H36 Cl4 O8 S4 -","4","1","WK2045","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","5-Chloro-2-methyl-3-methylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2007","63","2","o961","o962","10.1107/S1600536807003406","","","0.71073","MoKα","","0.0607","0.0529","","","0.1084","0.1117","","","","","","1.204","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212394","7.7484","0.001","14.746","0.002","17.98","0.003","102.128","0.002","97.981","0.002","90.351","0.002","1987.7","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis[μ-2-(2-oxidobenzoylhydrazono)propanoato]bis{aqua[2-(2- hydroxybenzoylhydrazono)propanoato]yttrium(III)} bis{pentaaqua[2-(2-oxidobenzoylhydrazono)propanoato(3-)]yttrium(III)} hexahydrate","","- C60 H84 N12 O42 Y4 -","- C60 H84 N12 O42 Y4 -","- C60 H84 N12 O42 Y4 -","1","0.5","WM2068","Chen, Feng-Ying; He, Shui-Yang; Liu, Xiang-Rong; Wu, Wang-Ting; Liu, Feng","Bis[μ-2-(2-oxidobenzoylhydrazono)propanoato]bis{aqua[2-(2-hydroxybenzoylhydrazono)propanoato]yttrium(III)} bis{pentaaqua[2-(2-oxidobenzoylhydrazono)propanoato(3‒)]yttrium(III)} hexahydrate","Acta Crystallographica Section E","2007","63","2","m468","m470","10.1107/S1600536806053499","","","0.71073","MoKα","","0.0794","0.0442","","","0.0977","0.1142","","","","","","1.014","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2212395","16.6708","0.0012","22.9245","0.0017","14.7068","0.0013","90","","94.063","0.006","90","","5606.4","0.8","180","2","180","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(1,10-Phenanthroline-κ^2^N,N')(triphenylphosphine-κP)silver(I) perchlorate acetonitrile hemisolvate","","- C31 H24.5 Ag Cl N2.5 O4 P -","- C30 H23 Ag Cl N2 O4 P -","- C240 H184 Ag8 Cl8 N16 O32 P8 -","8","2","WM2075","Aliakbar Dehno Khalaji; Mehdi Amirnasr; Jean-Claude Daran","(1,10-Phenanthroline-κ^2^<i>N</i>,<i>N</i>')(triphenylphosphine-κ<i>P</i>)silver(I) perchlorate acetonitrile hemisolvate","Acta Crystallographica Section E","2007","63","2","m309","m311","10.1107/S1600536806055140","","","0.71073","MoKα","","0.1049","0.0446","","","0.1075","0.1306","","","","","","0.926","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212396","19.7466","0.0009","22.0846","0.001","19.7669","0.0009","90","","106.807","0.001","90","","8252","0.7","291","2","291","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[1,1'-bis(diphenylphosphino)ferrocene-κ^2^P,P']bis(2,3,4,5,6- pentafluorobenzenethiolato)platinum(II)","","- C46 H28 F10 Fe P2 Pt S2 -","- C46 H28 F10 Fe P2 Pt S2 -","- C368 H224 F80 Fe8 P16 Pt8 S16 -","8","2","WM2078","Garcés-Rodríguez, Alejandra; Morales-Morales, David; Hernández-Ortega, Simón","[1,1'-Bis(diphenylphosphino)ferrocene-κ^2^<i>P</i>,<i>P</i>']bis(2,3,4,5,6-pentafluorobenzenethiolato)platinum(II)","Acta Crystallographica Section E","2007","63","2","m479","m481","10.1107/S1600536806054730","","","0.71073","MoKα","","0.0532","0.0373","","","0.0764","0.0822","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212397","6.5567","0.0013","6.8243","0.0014","9.1244","0.0018","90","","104.4","0.03","90","","395.44","0.15","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Nitronium Tetrafluoroborate","Nitronium Tetrafluoroborate","","- B F4 N O2 -","- B F4 N O2 -","- B4 F16 N4 O8 -","4","1","WM2080","Krossing, Ingo; Raabe, Ines; Birtalan, Esther","Nitronium tetrafluoroborate","Acta Crystallographica Section E","2007","63","2","i43","i44","10.1107/S1600536807000207","","","0.71073","MoKα","","0.0229","0.0185","","","0.0597","0.0612","","","","","","1.156","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212398","9.0307","0.0012","7.2636","0.0008","11.4312","0.0013","90","","90","","90","","749.83","0.15","293","2","293","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","cesium diaquatrichloromanganate(II)","","- Cl3 Cs H4 Mn O2 -","- Cl3 Cs H4 Mn O2 -","- Cl12 Cs4 H16 Mn4 O8 -","4","0.5","WM2084","Massa, Werner; Yakubovich, Olga V.; Dimitrova, Olga V.","Redetermination of Cs[MnCl~3~(H~2~O)~2~]","Acta Crystallographica Section E","2007","63","2","i24","i26","10.1107/S1600536806054742","","","0.71073","MoKα","","0.0814","0.0336","","","0.0603","0.0676","","","","","","0.784","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212399","4.7455","0.0014","4.7455","0.0014","10.554","0.006","90","","90","","90","","237.67","0.17","120","2","120","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","barium trigallium tin","","- Ba Ga3.11 Sn0.89 -","- Ba Ga3.11 Sn0.89 -","- Ba2 Ga6.22 Sn1.78 -","2","0.0625","WM2086","Tobash, Paul H.; Yamasaki, Yuki; Bobev, Svilen","Gallium‒tin mixing in BaGa~4{-~<i>x</i>}Sn~<i>x~</i> [<i>x</i> = 0.89(2)] with the BaAl~4~ structure type","Acta Crystallographica Section E","2007","63","2","i35","i37","10.1107/S1600536807000359","","","0.71073","MoKα","","0.0193","0.0175","","","0.0379","0.0386","","","","","","1.213","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212400","8.467","0.004","8.732","0.005","12.921","0.007","80.49","0.02","79.691","0.018","62.36","0.02","828.9","0.8","298","1","","","","","","","","","","5","P -1","-P 1","2","","Bis[N-(1-naphthyl)ethylenediammonium] hexaiodoplumbate(II)","","- C24 H32 I6 N4 Pb -","- C24 H32 I6 N4 Pb -","- C24 H32 I6 N4 Pb -","1","0.5","WM2087","Ying, Ying-Zheng; Gang, Wu; Hong, Zheng-Chen; Mang, Wang","Bis[<i>N</i>-(1-naphthyl)ethylenediammonium] hexaiodoplumbate(II)","Acta Crystallographica Section E","2007","63","2","m504","m506","10.1107/S1600536807001560","","","0.71075","MoKα","","","0.0198","","","","0.0499","","","","","","1.01","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212401","7.4919","0.0009","8.9946","0.0009","5.9158","0.0007","90","","90","","90","","398.65","0.08","273","2","273","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Cobaltaustinite","calcium cobalt arsenate hydroxide","","- As Ca Co H O5 -","- As Ca Co H O5 -","- As4 Ca4 Co4 H4 O20 -","4","1","WM2088","Yang, Hexiong; Costin, Gelu; Keogh, John; Lu, Ren; Downs, Robert T.","Cobaltaustinite, CaCo(AsO~4~)(OH)","Acta Crystallographica Section E","2007","63","2","i53","i55","10.1107/S1600536807003029","","","0.71073","MoKα","","0.087","0.0448","","","0.0663","0.0775","","","","","","0.982","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212402","10.244","0.002","13.733","0.003","17.869","0.004","90","","90","","90","","2513.8","0.9","292","2","292","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","(Diethylenetriamine-κ^3^N)(η^5^-pentamethylcyclopentadienyl)iridium(III) bis(trifluoromethanesulfonate)","","- C16 H28 F6 Ir N3 O6 S2 -","- C16 H28 F6 Ir N3 O6 S2 -","- C64 H112 F24 Ir4 N12 O24 S8 -","4","1","WM2089","Michael Scharwitz; Tobias van Almsick; William S. Sheldrick","(Diethylenetriamine-κ^3^<i>N</i>)(η^5^-pentamethylcyclopentadienyl)iridium(III) bis(trifluoromethanesulfonate)","Acta Crystallographica Section E","2007","63","2","m537","m539","10.1107/S1600536807002036","","","0.71073","MoKα","","0.0318","0.027","","","0.0621","0.0639","","","","","","1.051","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212403","13.448","0.006","10.518","0.005","6.75","0.004","90","","90","","90","","954.8","0.8","295","2","295","3","","","","","","","","4","P n m a","-P 2ac 2n","62","","pentaamminechlorogallium(III) dichloride","","- Cl3 Ga H15 N5 -","- Cl3 Ga H15 N5 -","- Cl12 Ga4 H60 N20 -","4","0.5","WM2091","Hisanori Yamane; Yutaka Mikawa; Chiaki Yokoyama","Pentaamminechlorogallium(III) dichloride","Acta Crystallographica Section E","2007","63","2","i59","i61","10.1107/S1600536807003388","","","0.71073","MoKα","","0.0248","0.0215","","","0.0518","0.0533","","","","","","1.065","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212404","13.1099","0.0011","4.7775","0.0002","15.9655","0.0014","90","","97.556","0.003","90","","991.28","0.13","173","0.1","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","N-(2-Iodoethyl)phthalimide","2-(2-Iodoethyl)-isoindole-1,3-dione","","- C10 H8 I N O2 -","- C10 H8 I N O2 -","- C40 H32 I4 N4 O8 -","4","1","WN2102","Valkonen, Arto; Lahtinen, Tanja; Rissanen, Kari","2-(2-Iodoethyl)isoindole-1,3-dione","Acta Crystallographica Section E","2007","63","2","o472","o473","10.1107/S1600536806054870","","","0.71073","MoKα","","0.0893","0.0676","","","0.147","0.1621","","","","","","1.094","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212405","11.799","0.011","12.417","0.011","16.354","0.015","109.127","0.012","110.774","0.012","90.582","0.013","2095","3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","6,6'-Dimethoxy-2,2'-(ethane-1,2-diyldiiminiodimethylene)diphenol dinitrate","","- C18 H26 N4 O10 -","- C18 H26 N4 O10 -","- C72 H104 N16 O40 -","4","2","WN2103","Liu, Y.-F.; Xia, H.-T.; Yang, S.-P.; Wang, D.-Q.","6,6'-Dimethoxy-2,2'-(ethane-1,2-diyldiammoniodimethylene)diphenol dinitrate","Acta Crystallographica Section E","2007","63","2","o1025","o1027","10.1107/S1600536807004047","","","0.71073","MoKα","","0.2197","0.0988","","","0.2182","0.289","","","","","","0.913","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212406","14.545","0.002","11.2714","0.0016","12.1561","0.0018","90","","98.56","0.003","90","","1970.7","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(5,5-dimethyl-2-thioxo-1,3,2-dioxaphosphinan-2-yl)ethane-1,2-diamine","","- C12 H26 N2 O4 P2 S2 -","- C12 H26 N2 O4 P2 S2 -","- C48 H104 N8 O16 P8 S8 -","4","1","WN2104","Hai-Bing Li; Ya Li; De-Jun Xiong; De-Mei Tian","<i>N</i>,<i>N</i>'-Bis(5,5-dimethyl-2-thioxo-1,3,2-dioxaphosphinan-2-yl)ethane-1,2-diamine","Acta Crystallographica Section E","2007","63","2","o606","o607","10.1107/S1600536807000694","","","0.71073","MoKα","","0.097","0.0559","","","0.1289","0.149","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212407","7.0189","0.0005","10.0329","0.0007","12.2791","0.0008","112.968","0.005","95.782","0.005","95.013","0.005","784.48","0.1","296","","296","","","","","","","","","5","P -1","-P 1","2","","Methyl [6-(2-chlorobenzoyl)-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl]acetate","","- C17 H12 Cl N O5 -","- C17 H12 Cl N O5 -","- C34 H24 Cl2 N2 O10 -","2","1","WN2108","Abdullah Aydın; Yasemin Dündar; Mehmet Akkurt; Orhan Büyükgüngör; M. Fethi Şahin","Methyl [6-(2-chlorobenzoyl)-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl]acetate","Acta Crystallographica Section E","2007","63","2","o787","o788","10.1107/S160053680700178X","","","0.71073","MoKα","","0.0405","0.0342","","","0.0875","0.092","","","","","","1.016","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212408","6.504","0.003","24.123","0.012","9.506","0.005","90","","107.513","0.007","90","","1422.3","1.2","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Butyl 2-(piperidine-1-carbothioylsulfanyl)acetate","","- C12 H21 N O2 S2 -","- C12 H21 N O2 S2 -","- C48 H84 N4 O8 S8 -","4","1","WN2109","Zhao, Hong-Bin; Cao, Hua; Xu, Yong-Jun; Yang, Pan-Long; Liu, Yan-Li","Butyl 2-(piperidine-1-carbothioylsulfanyl)acetate","Acta Crystallographica Section E","2007","63","2","o865","o866","10.1107/S1600536807002486","","","0.71073","MoKα","","0.0731","0.0487","","","0.1214","0.138","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212409","9.8662","0.0003","10.961","0.0004","11.0262","0.0003","63.467","0.002","78.764","0.002","72.876","0.002","1016.73","0.06","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[tetrakis(μ-2,4-dichlorophenoxyacetato-κ^2^O:O')dicopper(II)]- μ-pyrazine-κ^2^N:N']","","- C36 H24 Cl8 Cu2 N2 O12 -","- C36 H24 Cl8 Cu2 N2 O12 -","- C36 H24 Cl8 Cu2 N2 O12 -","1","0.5","WW2070","Huang, Ping-Yun; Wang, Jing-Guo","<i>catena</i>-Poly[[tetrakis(μ-2,4-dichlorophenoxyacetato-κ^2^<i>O</i>:<i>O</i>')dicopper(II)]-μ-pyrazine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","2","m645","m646","10.1107/S1600536807003832","","","0.71073","MoKα","","0.0398","0.0303","","","0.0815","0.085","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212410","10.362","0.007","10.469","0.007","10.935","0.007","96.827","0.011","106.257","0.01","115.898","0.01","983.7","1.1","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Tris(N,N-dimethylethane-1,2-diammonium) decavanadate pentahydrate","","- C12 H52 N6 O33 V10 -","- C12 H46 N6 O33 V10 -","- C12 H46 N6 O33 V10 -","1","0.5","WW2073","Zhu, Chun-Yuan; Li, Yan-Tuan; Wu, Zhi-Yong; Xiao, Ning-Yu","Tris(<i>N</i>,<i>N</i>-dimethylethane-1,2-diammonium) decavanadate(V) pentahydrate","Acta Crystallographica Section E","2007","63","2","m547","m549","10.1107/S1600536807002267","","","0.71073","MoKα","","0.0548","0.0386","","","0.1076","0.1167","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212411","7.5192","0.0006","19.0605","0.0014","7.8416","0.0006","90","","103.566","0.001","90","","1092.5","0.15","130","2","130","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","guanidinium 3,5-dinitrobenzoate","guanidinium 3,5-dinitrobenzoate","","- C8 H9 N5 O6 -","- C8 H9 N5 O6 -","- C32 H36 N20 O24 -","4","1","WW2074","Smith, Graham; Wermuth, Urs D.; White, Jonathan M.","Anhydrous guanidinium 3,5-dinitrobenzoate","Acta Crystallographica Section E","2007","63","2","o867","o868","10.1107/S1600536807002231","","","0.71073","MoKα","","0.0322","0.0296","","","0.0796","0.0815","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212412","16.81","0.003","5.0834","0.0009","21.274","0.004","90","","90","","90","","1817.9","0.6","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Ethyl 2-({5-[2-(benzoylamino)phenyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetate","","- C19 H17 N3 O4 S -","- C19 H17 N3 O4 S -","- C76 H68 N12 O16 S4 -","4","1","WW2075","Iqbal, Rashid; Aziz, Saeeda; Ahmed, Muhammad Naeem; Qadeer, Ghulam; Wong, Wai-Yeung","Ethyl 2-({5-[2-(benzoylamino)phenyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetate","Acta Crystallographica Section E","2007","63","2","o1021","o1022","10.1107/S1600536807004011","","","0.71073","MoKα","","0.0492","0.0445","","","0.1204","0.1246","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212413","9.74","0.002","9.173","0.002","35.354","0.009","90","","90","","90","","3158.7","1.2","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N,N'-bis(2-phenylethyl)thiourea","","- C17 H20 N2 S -","- C17 H20 N2 S -","- C136 H160 N16 S8 -","8","1","WW2076","Sadiq-ur-Rehman; Ali, Saqib; Parvez, Masood","<i>N</i>,<i>N</i>'-Bis(2-phenylethyl)thiourea","Acta Crystallographica Section E","2007","63","2","o640","o641","10.1107/S1600536807000323","","","0.71073","MoKα","","0.078","0.042","","","0.085","0.1","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212414","8.6344","0.0003","17.7484","0.0006","20.5928","0.0007","90","","90","","90","","3155.78","0.19","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis(μ-2-carboxylatoethylphosphonato)bis[aqua(2,2'-bipyridine)zinc(II)]","","- C26 H30 N4 O12 P2 Zn2 -","- C26 H30 N4 O12 P2 Zn2 -","- C104 H120 N16 O48 P8 Zn8 -","4","0.5","WW2077","Shao-Ming Ying; Xin-Fa Li; Wen-Tong Chen; Dong-Sheng Liu; Jiu-Hui Liu","Bis(μ-2-carboxylatoethylphosphonato)bis[aqua(2,2'-bipyridine)zinc(II)]","Acta Crystallographica Section E","2007","63","2","m555","m557","10.1107/S1600536807002206","","","0.71073","MoKα","","0.0398","0.0257","","","0.0618","0.0634","","","","","","0.854","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212415","12.2258","0.0002","12.5046","0.0002","17.3157","0.0003","102.595","0.001","95.362","0.001","93.249","0.001","2564.09","0.07","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","Pentacarbonyl{N,N-dimethyl-N'-[4-(pyridin-4-ylethynyl-κN)benzylidene]benzene- 1,4-diamine}tungsten(0)","","- C27 H19 N3 O5 W -","- C27 H19 N3 O5 W -","- C108 H76 N12 O20 W4 -","4","2","WW2078","Huang, Ping-Hsin; Wen, Yuh-Sheng","Pentacarbonyl{<i>N</i>,<i>N</i>-dimethyl-<i>N</i>'-[4-(pyridin-4-ylethynyl-κ<i>N</i>)benzylidene]benzene-1,4-diamine}tungsten(0)","Acta Crystallographica Section E","2007","63","2","m563","m564","10.1107/S1600536807002152","","","0.71073","MoKα","","0.0303","0.0219","","","0.0466","0.0485","","","","","","0.986","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212416","7.9814","0.0008","11.3775","0.0011","13.1359","0.0012","74.362","0.007","81.933","0.007","77.998","0.007","1119.08","0.19","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2,3,10,11-Tetramethoxy-15,16-diazapentaphene trihydrate","","- C24 H28 N2 O7 -","- C24 H28 N2 O7 -","- C48 H56 N4 O14 -","2","1","XU2173","Ding-Qiao Yang; Yue-Peng Cai; Xing-Fen Chen; Li-Hua Liang","2,3,10,11-Tetramethoxy-15,16-diazapentaphene trihydrate","Acta Crystallographica Section E","2007","63","2","o434","o435","10.1107/S1600536806053098","","","0.71073","MoKα","","0.08","0.049","","","0.125","0.146","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212417","25.161","0.004","9.3806","0.0015","16.702","0.003","90","","109.37","0.003","90","","3719","1.1","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1-Acetyl-3,4-dimethyl-6-phenylacetyl-3a,4,6,6a- tetrahydroimidazo[4,5-d]imidazole-2,5(1H,3H)-dithione","","- C18 H22 N4 O2 S2 -","- C18 H22 N4 O2 S2 -","- C144 H176 N32 O16 S16 -","8","1","XU2175","Mei Chen; Paul H. M. Harrison; Lian-Quan Gu; Hai-Hu Yu","1-Acetyl-3,4-dimethyl-6-phenylacetyl-3a,4,6,6a-tetrahydroimidazo[4,5-<i>d</i>]imidazole-2,5(1<i>H</i>,3<i>H</i>)-dithione","Acta Crystallographica Section E","2007","63","2","o613","o614","10.1107/S1600536807000402","","","0.71073","MoKα","","0.0691","0.0487","","","0.122","0.1352","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212418","12.573","0.003","9.489","0.002","20.546","0.005","90","","101.262","0.003","90","","2404","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Triaqua(18-crown-6)calcium(II) tetrachlorozinc(II)","","- C12 H30 Ca Cl4 O9 Zn -","- C12 H30 Ca Cl4 O9 Zn -","- C48 H120 Ca4 Cl16 O36 Zn4 -","4","1","XU2186","Liu, Xi; Guo, Guo-Cong","Triaqua(18-crown-6)calcium(II) tetrachlorozincate(II)","Acta Crystallographica Section E","2007","63","2","m365","m366","10.1107/S1600536806055280","","","0.71073","MoKα","","0.047","0.04","","","0.103","0.108","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212419","14.4624","0.0012","13.597","0.0011","14.188","0.0011","90","","109.369","0.001","90","","2632.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(N-methylpyridinium) bis(2-thioxo-1,3-dithione-4,5-dithiolato)cadmium(II)","","- C18 H16 Cd N2 S10 -","- C18 H16 Cd N2 S10 -","- C72 H64 Cd4 N8 S40 -","4","1","XU2187","Wang, Yan-Ling; Wang, Yong-Jin; Wang, Rui-He; Yao, Jun; Zhao, Xiu-Tai","Bis(<i>N</i>-methylpyridinium) bis(2-thioxo-1,3-dithione-4,5-dithiolato)cadmate(II)","Acta Crystallographica Section E","2007","63","2","m342","m343","10.1107/S1600536806055346","","","0.71073","MoKα","","0.055","0.035","","","0.078","0.088","","","","","","1.014","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212420","9.1301","0.0019","10.015","0.002","16.003","0.003","90","","98.824","0.004","90","","1446","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","oxypeucedanin hydrate","5-(2,3-Dihydroxy-3-methylbutoxy)-7H-furo[3,2-g]chromen-7-one","","- C16 H16 O6 -","- C16 H16 O6 -","- C64 H64 O24 -","4","1","XU2189","Ke-Zhong Deng; Wen-Yuan Gao; Ying Xiong; Hai-Xia Chen; Shu-Jun Wang","5-(2,3-Dihydroxy-3-methylbutoxy)-7<i>H</i>-furo[3,2-<i>g</i>]chromen-7-one","Acta Crystallographica Section E","2007","63","2","o815","o816","10.1107/S1600536807002358","","","0.71073","MoKα","","0.086","0.043","","","0.094","0.113","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212421","7.5282","0.0015","9.6334","0.0019","10.975","0.002","79.66","0.03","81.89","0.03","71.31","0.03","738.7","0.3","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","N,N'-Bis(4-pyridylmethylene)benzene-1,4-diamine","","- C18 H14 N4 -","- C18 H14 N4 -","- C36 H28 N8 -","2","1","XU2190","Hou, Qiu-Fei; Ye, Ling; Jiang, Shi-Mei","<i>N</i>,<i>N</i>'-Bis(4-pyridylmethylene)benzene-1,4-diamine","Acta Crystallographica Section E","2007","63","2","o939","o940","10.1107/S1600536807002978","","","0.71073","MoKα","","0.0805","0.0459","","","0.1143","0.1388","","","","","","1.082","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212422","10.7629","0.0014","10.0115","0.0008","16.568","0.002","90","","99.664","0.006","90","","1759.9","0.3","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Methyl-2-phenyl-3-(5-ethyl-1,3,4-thiadiazol-2-yldiazenyl)-1H-indole","","- C19 H17 N5 S -","- C19 H17 N5 S -","- C76 H68 N20 S4 -","4","1","XU2194","Seferoğlu, Zeynel; Hökelek, Tuncer; Şahin, Ertan; Ertan, Nermin","3-(5-Ethyl-1,3,4-thiadiazol-2-yldiazenyl)-1-methyl-2-phenyl-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","2","o568","o570","10.1107/S1600536807000165","","","0.71073","MoKα","","0.231","0.102","","","0.169","0.212","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212423","9.1582","0.0005","7.3314","0.0004","24.1175","0.0013","90","","100.746","0.001","90","","1590.91","0.15","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 Cl N3 O S -","- C16 H14 Cl N3 O S -","- C64 H56 Cl4 N12 O4 S4 -","4","1","XU2196","Chun-Niu, Zhang; Guo-Bing, Yan; Yun-Fa, Zheng","(<i>E</i>)-4-[(5-Chloro-2-thienyl)methyleneamino]-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","2","o912","o913","10.1107/S160053680700270X","","","0.71073","MoKα","","0.039","0.033","","","0.1","0.103","","","","","","0.923","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212424","8.276","0.0018","26.636","0.006","12.25","0.003","90","","105.25","0.003","90","","2605.3","1","291","2","291","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S,S)-6,6'-Dimethyl-2,2'-[o-phenylenebis(nitrilomethylidyne)]diphenol benzene solvate","","- C28 H32 N2 O2 -","- C28 H32 N2 O2 -","- C112 H128 N8 O8 -","4","2","YA2032","Yang, Ming-Hua; Yan, Guo-Bing; Zheng, Fun-Fa","(<i>S</i>,<i>S</i>)-6,6'-Dimethyl-2,2'-[<i>o</i>-phenylenebis(nitrilomethylidyne)]diphenol benzene solvate","Acta Crystallographica Section E","2007","63","2","o824","o826","10.1107/S1600536807001766","","","0.71073","MoKα","","0.078","0.057","","","0.144","0.151","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212425","19.1362","0.0005","7.2803","0.0002","11.286","0.0003","90","","95.377","0.001","90","","1565.42","0.07","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(4-Chlorophenyl)-3-[3-(4-chlorophenyl)pyrazol-1-yl]propan-1-one","","- C18 H14 Cl2 N2 O -","- C18 H14 Cl2 N2 O -","- C72 H56 Cl8 N8 O4 -","4","1","YA2037","Sankaranarayanan, Jagadis; Mandel, Sarah M.; Krause, Jeanette A.; Gudmundsdóttir, Anna D.","1-(4-Chlorophenyl)-3-[3-(4-chlorophenyl)pyrazol-1-yl]propan-1-one","Acta Crystallographica Section E","2007","63","2","o721","o723","10.1107/S1600536807000633","","","0.71073","MoKα","","0.07","0.055","","","0.119","0.124","","","","","","1.12","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212426","6.867","0.005","9.203","0.006","11.108","0.008","111.22","0.03","102.55","0.03","96.83","0.03","623.5","0.8","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","trans-Tetraaquabis(2,6-dimethylpyridinium-3,5-dicarboxylato)copper(II) tetrahydrate","","- C18 H32 Cu N2 O16 -","- C18 H32 Cu N2 O16 -","- C18 H32 Cu N2 O16 -","1","0.5","YA2038","Shi, Ai-E; Li, Bai-Yan; Hou, Guang-Feng; Gao, Jin-Sheng","<i>trans</i>-Tetraaquabis(2,6-dimethylpyridinium-3,5-dicarboxylato)copper(II) tetrahydrate","Acta Crystallographica Section E","2007","63","2","m471","m473","10.1107/S1600536807000669","","","0.71073","MoKα","","0.032","0.029","","","0.092","0.102","","","","","","1.2","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212427","9.3604","0.0003","10.3052","0.0003","13.2638","0.0005","90","","93.391","0.002","90","","1277.2","0.07","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Amino-1,3-dimethyl-5-(4-methylthiazol-2-yldiazenyl)uracil","","- C10 H12 N6 O2 S -","- C10 H12 N6 O2 S -","- C40 H48 N24 O8 S4 -","4","1","YM2043","Seferoğlu, Zeynel; Hökelek, Tuncer; Şahin, Ertan; Ertan, Nermin","6-Amino-1,3-dimethyl-5-(4-methylthiazol-2-yldiazenyl)uracil","Acta Crystallographica Section E","2007","63","2","o571","o573","10.1107/S1600536806053451","","","0.71073","MoKα","","0.1396","0.073","","","0.1765","0.2186","","","","","","1.069","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212428","5.0815","0.0002","13.5782","0.0008","24.3279","0.0012","90","","90","","90","","1678.57","0.14","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-Nitro-N-[4-(4-nitrophenoxy)phenyl]benzamide","","- C19 H13 N3 O6 -","- C19 H13 N3 O6 -","- C76 H52 N12 O24 -","4","1","YM2044","Butt, M. Saeed; Akhter, Zareen; Bolte, Michael; Siddiqui, Humaira M.; Ehsan Shamsi","4-Nitro-<i>N</i>-[4-(4-nitrophenoxy)phenyl]benzamide","Acta Crystallographica Section E","2007","63","2","o476","o478","10.1107/S160053680605344X","","","0.71073","MoKα","","0.03","0.029","","","0.078","0.079","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212429","6.9388","0.0006","6.7185","0.0006","12.9422","0.0011","90","","100.563","0.002","90","","593.12","0.09","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(1R,5R,6S)-6-(2-Hydroxyethyl)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-enol","","- C12 H20 O2 -","- C12 H20 O2 -","- C24 H40 O4 -","2","1","YM2046","Juhl, Martin; Tanner, David; Søtofte, Inger","(1<i>R</i>,5<i>R</i>,6<i>S</i>)-6-(2-Hydroxyethyl)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-enol","Acta Crystallographica Section E","2007","63","2","o836","o837","10.1107/S1600536806056443","","","0.71073","MoKα","","0.05","0.049","","","0.133","0.134","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212430","9.894","0.0012","21.637","0.003","9.9734","0.0012","90","","109.671","0.001","90","","2010.5","0.4","273","2","273","2","","","","","","","","4","C 1 c 1","C -2yc","9","","4,4',4''-(1,3,5-Triazine-2,4,6-triyl)tripyridinium trinitrate","","- C18 H15 N9 O9 -","- C18 H15 N9 O9 -","- C72 H60 N36 O36 -","4","1","AC2048","Shou-Rong Zhu; Wan-Dong Chen; Hong-Jian Zhao; Min Shao; Ming-Xing Li","4,4',4''-(1,3,5-Triazine-2,4,6-triyl)tripyridinium trinitrate","Acta Crystallographica Section E","2007","63","3","o1344","o1346","10.1107/S160053680604431X","","","0.71073","MoKα","","0.0371","0.0327","","","0.0793","0.0824","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212431","10.682","0.002","11.154","0.002","15.43","0.003","90","","90","","90","","1838.4","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3-(4-Bromophenyl)-5-(4-chlorophenyl)-1-phenyl-2-pyrazoline","","- C21 H16 Br Cl N2 -","- C21 H16 Br Cl N2 -","- C84 H64 Br4 Cl4 N8 -","4","1","AT2198","Huan-Mei Guo; Fang-Fang Jian; Hai-Lian Xiao; Xiao-Zheng Sun; Yu-Feng Li","3-(4-Bromophenyl)-5-(4-chlorophenyl)-1-phenyl-2-pyrazoline","Acta Crystallographica Section E","2007","63","3","o1435","o1436","10.1107/S160053680700102X","","","0.71073","MoKα","","0.0775","0.0437","","","0.1124","0.1243","","","","","","0.975","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212432","7.54","0.0015","26.5","0.005","8.21","0.0016","90","","114.5","0.03","90","","1492.7","0.6","291","2","291","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Diethyl 2,3-O-benzylidene-D-tartarate","","- C15 H18 O6 -","- C15 H18 O6 -","- C60 H72 O24 -","4","2","AT2211","Jiang, Jian; Pan, Yong; Wang, De-Cai; Ou-yang, Ping-Kai","(2<i>S</i>,3<i>S</i>)-Diethyl 2,3-<i>O</i>-benzylidenetartrate","Acta Crystallographica Section E","2007","63","3","o1093","o1094","10.1107/S1600536807003625","","","0.71073","MoKα","","0.0832","0.0661","","","0.1444","0.1498","","","","","","1.051","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212433","7.3594","0.0015","11.869","0.002","13.612","0.003","110.792","0.007","95.454","0.008","102.249","0.007","1067.2","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1-(4-cyanobenzyl)-4-methylpyridinium 7,7,8,8-tetracyanoquinodimethanide","","- C26 H17 N6 -","- C26 H17 N6 -","- C52 H34 N12 -","2","1","AT2213","Wang, Peng-Fei; Zhou, Hong-Bo; Chen, You-Cun","An anion‒radical salt of 1-(4-cyanobenzyl)-4-methylpyridinium cations and 7,7,8,8-tetracyanoquinodimethane anions","Acta Crystallographica Section E","2007","63","3","o1110","o1112","10.1107/S1600536807003686","","","0.71073","MoKα","","0.0639","0.0434","","","0.1216","0.1338","","","","","","1.069","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212434","11.482","0.002","8.1751","0.0016","13.232","0.006","90","","120.52","0.02","90","","1070","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[1-(2-Chlorophenyl)ethylidene]thiosemicarbazide","","- C9 H10 Cl N3 S -","- C9 H10 Cl N3 S -","- C36 H40 Cl4 N12 S4 -","4","1","AT2214","Jian-Gang Wang; Fang-Fang Jian; Xiao-Yan Ren; Shi-Hong Kan","1-[1-(2-Chlorophenyl)ethylidene]thiosemicarbazide","Acta Crystallographica Section E","2007","63","3","o1160","o1161","10.1107/S1600536807004473","","","0.71073","MoKα","","0.06","0.0585","","","0.1393","0.1403","","","","","","1.3","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212435","6.2461","0.0011","15.66","0.003","18.678","0.003","90","","92.626","0.003","90","","1825","0.6","291","2","291","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-Benzyl-4-(4-tert-butylphenyl)piperazine","","- C21 H28 N2 -","- C21 H28 N2 -","- C84 H112 N8 -","4","1","AT2216","Li-Chao Yang; Li, Yi-Zhi; Sen-Zhi Zhao; Lin Wu","1-Benzyl-4-(4-<i>tert</i>-butylphenyl)piperazine","Acta Crystallographica Section E","2007","63","3","o1097","o1098","10.1107/S1600536807004485","","","0.71073","MoKα","","0.0987","0.057","","","0.1464","0.1632","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212436","8.4779","0.0017","13.446","0.003","20.441","0.004","90","","98.69","0.03","90","","2303.4","0.8","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","{2-[3-(Dimethylammonio)propyliminomethyl]-6- methoxyphenolato}diisothiocyanatozinc(II) chloroform solvate","","- C16 H21 Cl3 N4 O2 S2 Zn -","- C16 H21 Cl3 N4 O2 S2 Zn -","- C64 H84 Cl12 N16 O8 S8 Zn4 -","4","1","AT2218","Zhang, Qi-Wei; Wang, Gui-Xian","{2-[3-(Dimethylammonio)propyliminomethyl]-6-methoxyphenolato}diisothiocyanatozinc(II) chloroform solvate","Acta Crystallographica Section E","2007","63","3","m652","m653","10.1107/S1600536807004497","","","0.71073","MoKα","","0.0574","0.0392","","","0.0974","0.1077","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212437","14.761","0.005","5.794","0.002","31.206","0.009","90","","90","","90","","2668.9","1.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-(Benzotriazol-1-yl)-1-m-tolylpropan-1-one","","- C16 H15 N3 O -","- C16 H15 N3 O -","- C128 H120 N24 O8 -","8","1","AT2219","Wu-Lan Zeng; Sai Bi; Jun Wan","3-(Benzotriazol-1-yl)-1-<i>m</i>-tolylpropan-1-one","Acta Crystallographica Section E","2007","63","3","o1084","o1085","10.1107/S1600536807004503","","","0.71073","MoKα","","0.1207","0.0662","","","0.1268","0.1503","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212438","18.6551","0.0012","11.4489","0.0007","7.8557","0.0005","90","","92.841","0.005","90","","1675.76","0.18","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","catena-Poly[[diaquacalcium(II)]-di-l-2-formylbenzoato]","","- C16 H14 Ca O8 -","- C16 H14 Ca O8 -","- C64 H56 Ca4 O32 -","4","0.5","AT2220","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","<i>catena</i>-Poly[[diaquacalcium(II)]-di-μ-2-formylbenzoato]","Acta Crystallographica Section E","2007","63","3","m712","m714","10.1107/S160053680700565X","","","0.71073","MoKα","","0.0345","0.0298","","","0.075","0.0771","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212439","9.3969","0.0017","9.7876","0.0018","23.982","0.004","90","","90","","90","","2205.7","0.7","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-(4-Bromophenyl)-1H-benzimidazole","","- C13 H9 Br N2 -","- C13 H9 Br N2 -","- C104 H72 Br8 N16 -","8","1","AT2221","Rashid, Naghmana; Tahir, Muhammad K.; Yusof, Nurdiyana M.; Yamin, Bohari M.","2-(4-Bromophenyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","3","o1260","o1261","10.1107/S1600536807005661","","","0.71073","MoKα","","0.046","0.032","","","0.0776","0.083","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212440","14.6895","0.0007","7.3663","0.0002","14.2056","0.0006","90","","100.266","0.005","90","","1512.54","0.11","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-[5-(4-Fluorophenyl)-3-isopropylisoxazol-4-yl]pyridin-2(1H)-one","","","- C17 H15 F N2 O2 -","- C17 H15 F N2 O2 -","- C68 H60 F4 N8 O8 -","4","1","AT2222","Mohammed Abadleh; Christian Peifer; Katrin Kinkel; Schollmeyer, Dieter; Stefan Laufer","4-[5-(4-Fluorophenyl)-3-isopropylisoxazol-4-yl]pyridin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","3","o1423","o1425","10.1107/S1600536807007933","","","1.54178","CuKα","","0.0451","0.0423","","","0.111","0.114","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212441","9.2647","0.0001","11.9701","0.0002","12.9287","0.0002","90","","97.838","0.001","90","","1420.39","0.04","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Benzimidazolium 2,4,6-trinitrophenolate","","- C13 H8 N5 O7 -","- C13 H8 N5 O7 -","- C52 H32 N20 O28 -","4","1","AT2223","Wen-Dong Song; Run-Zhen Fan; Hong-Mian Wu","Benzimidazolium 2,4,6-trinitrophenolate","Acta Crystallographica Section E","2007","63","3","o1385","o1386","10.1107/S1600536807007532","","","0.71073","MoKα","","0.0786","0.0571","","","0.1355","0.157","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212442","11.6895","0.0002","16.9503","0.0004","14.6979","0.0003","90","","103.599","0.001","90","","2830.61","0.1","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[bis(O,O'-diethyl dithiophosphato-κ^2^S,S')zinc(II)]-μ-1,2- di-4-pyridylethane-κ^2^N:N']","","- C20 H32 N2 O4 P2 S4 Zn -","- C20 H32 N2 O4 P2 S4 Zn -","- C80 H128 N8 O16 P8 S16 Zn4 -","4","1","AT2224","Tiekink, Edward R. T.; Wardell, James L.; Welte, William B.","<i>catena</i>-Poly[[bis(<i>O</i>,<i>O</i>'-diethyl dithiophosphato-κ^2^<i>S</i>,<i>S</i>')zinc(II)]-μ-1,2-di-4-pyridylethane-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","3","m818","m820","10.1107/S1600536807007544","","","0.71069","MoKα","","0.063","0.042","","","0.117","0.142","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212443","6.2423","0.0002","12.0919","0.0004","14.1651","0.0006","90","","90","","90","","1069.2","0.07","150","","150","","","","","","","","","4","P 2 21 21","P 2bc 2","18","","2-<i>C</i>-Hydroxymethyl-2,3-<i>O</i>-isopropylidene-L-lyxono-1,5-lactam","","- C9 H15 N O5 -","- C9 H15 N O5 -","- C36 H60 N4 O20 -","4","1","AT2225","Simone, Michela; Fleet, George W. J.; Bream, Richard; Watkin, David J.","5-Amino-5-deoxy-2-<i>C</i>-hydroxymethyl-2,3-<i>O</i>-isopropylidene-<small>L</small>-lyxono-1,5-lactam","Acta Crystallographica Section E","2007","63","3","o1409","o1411","10.1107/S1600536807007568","","","0.71073","MoKα","","0.0329","0.0329","","0.0754","0.0754","0.0754","","","","","","0.8874","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212445","20.688","0.005","6.289","0.005","26.845","0.005","90","0.005","90.799","0.005","90","0.005","3492","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","6-Chloro-3-pyridylmethyl 4-aminobenzoate benzene solvate","","- C19 H17 Cl N2 O2 -","- C19 H17 Cl N2 O2 -","- C152 H136 Cl8 N16 O16 -","8","1","AT2227","Guang-Ju Ping; Jian-Fang Ma; Shun-Li Li","6-Chloro-3-pyridylmethyl 4-aminobenzoate benzene solvate","Acta Crystallographica Section E","2007","63","3","o1450","o1451","10.1107/S1600536807007921","","","0.71069","MoKα","","0.1297","0.0484","","","0.1046","0.1384","","","","","","0.938","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212446","9.726","0.001","13.752","0.002","10.397","0.001","90","","97.887","0.005","90","","1377.5","0.3","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(4-chlorophenyl)-3-phenyl-1,3-thiazolidin-4-one","","- C15 H12 Cl N O S -","- C15 H12 Cl N O S -","- C60 H48 Cl4 N4 O4 S4 -","4","1","AT2228","Doreswamy, S.; Jayalakshmi, K.; Sridhar, M. A.; Rangappa, K. S.; Shashidhara Prasad, J.","2-(4-Chlorophenyl)-3-phenyl-1,3-thiazolidin-4-one","Acta Crystallographica Section E","2007","63","3","o1457","o1458","10.1107/S1600536807008227","","","0.71073","MoKα","","0.0488","0.0394","","","0.1035","0.1099","","","","","","1.134","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212447","16.213","0.004","7.1194","0.0014","17.748","0.004","90","","118.418","0.017","90","","1801.7","0.8","294","2","294","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Tetrakis[(1-phenyltetrazol-5-yl)sulfanylmethyl]methane","","- C33 H28 N16 S4 -","- C33 H28 N16 S4 -","- C66 H56 N32 S8 -","2","0.5","BG2022","Lyakhov, Alexander S.; Zatsepina, Marina V.; Artamonova, Tatiana V.; Gaponik, Pavel N.; Koldobskii, Grigorii I.","Tetrakis[(1-phenyltetrazol-5-yl)sulfanylmethyl]methane","Acta Crystallographica Section E","2007","63","3","o1145","o1147","10.1107/S1600536807004400","","","0.71073","MoKα","","0.0613","0.039","","","0.1051","0.1226","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212448","11.824","0.001","11.8561","0.001","11.913","0.001","115.016","0.0012","92.956","0.0013","114.473","0.0012","1324.3","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Poly[[pentaaquatris(μ~3~,μ~2~-pyridine-3,4-dicarboxylato)bislanthanum(III)] monohydrate]","","- C21 H21 La2 N3 O18 -","- C21 H19 La2 N3 O18 -","- C42 H38 La4 N6 O36 -","2","1","BH2072","Dong, Bao-Xia; Peng, Jun","Poly[[pentaaquatris(μ~3~,μ~2~-pyridine-3,4-dicarboxylato)dilanthanum(III)] monohydrate]","Acta Crystallographica Section E","2007","63","3","m886","m888","10.1107/S1600536807008458","","","0.71073","MoKα","","0.0395","0.0353","","","0.096","0.102","","","","","","1.177","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212449","8.725","0.003","11.422","0.004","11.475","0.004","99.428","0.006","99.354","0.008","95.424","0.006","1104.5","0.7","193","2","193","2","","","","","","","","5","P -1","-P 1","2","ranelic acid tetraethyl ester","5-[bis(ethoxycarbonylmethyl)amino]-4-cyano-2-ethoxycarbonyl- 3-thiophenepropionate","","- C20 H26 N2 O8 S -","- C20 H26 N2 O8 S -","- C40 H52 N4 O16 S2 -","2","1","BH2078","Wei, Hong-Tao; Ji, Min","The ethyl tetraester of ranelic acid","Acta Crystallographica Section E","2007","63","3","o1341","o1343","10.1107/S1600536807006654","","","0.7107","MoKα","","0.0428","0.0374","","","0.0848","0.088","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212450","8.1546","0.0006","8.1745","0.0006","10.8077","0.0008","91.988","0.001","94.726","0.001","112.746","0.001","660.41","0.08","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","5-Bromo-3-methylsulfinyl-2-phenyl-1-benzofuran","","- C15 H11 Br O2 S -","- C15 H11 Br O2 S -","- C30 H22 Br2 O4 S2 -","2","1","BH2081","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","5-Bromo-3-methylsulfinyl-2-phenyl-1-benzofuran","Acta Crystallographica Section E","2007","63","3","o1315","o1316","10.1107/S160053680700685X","","","0.71073","MoKα","","0.0228","0.0212","","","0.0548","0.0555","","","","","","1.057","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212451","7.0421","0.0002","14.3771","0.0003","14.7134","0.0004","90","","90","","90","","1489.66","0.07","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","N-Hydroxyisonicotinamidium chloride","4-(Hydroxyaminocarbonyl)pyridinium chloride","","- C6 H7 Cl N2 O2 -","- C6 H7 Cl N2 O2 -","- C48 H56 Cl8 N16 O16 -","8","1","BH2082","Golenya, Irina A.; Haukka, Matti; Fritsky, Igor O.; Gumienna-Kontecka, Elźbieta","4-(Hydroxyaminocarbonyl)pyridinium chloride","Acta Crystallographica Section E","2007","63","3","o1515","o1517","10.1107/S1600536807008604","","","0.71073","MoKα","","0.0401","0.0304","","","0.0748","0.0795","","","","","","1.112","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212452","12.0557","0.0005","9.0755","0.0004","24.7931","0.001","90","","102.872","0.003","90","","2644.48","0.19","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","quinoxalinium 2,6-dihydroxybenzoate","","- C15 H12 N2 O4 -","- C15 H12 N2 O4 -","- C120 H96 N16 O32 -","8","1","BH2084","Czapik, Agnieszka; Gdaniec, Maria","Quinoxalinium 2,6-dihydroxybenzoate","Acta Crystallographica Section E","2007","63","3","o1480","o1482","10.1107/S1600536807008707","","","0.71073","MoKα","","0.0618","0.0408","","","0.1057","0.1268","","","","","","1.089","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212453","21.017","0.002","11.0917","0.0008","9.214","0.0007","90","","94.002","0.001","90","","2142.7","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Aquabis(1,2-ethanediamine-κ^2^N,N')hydroxidocobalt(III) naphthalene-1,5-disulfonate monohydrate","","- C14 H27 Co N4 O9 S2 -","- C14 H27 Co N4 O9 S2 -","- C56 H108 Co4 N16 O36 S8 -","4","0.5","BI2130","Ou, Guang-Chuan; Zhang, Min; Yuan, Xian-You; Seik Weng Ng","Aquabis(1,2-ethanediamine-κ^2^<i>N,N</i>')hydroxidocobalt(III) naphthalene-1,5-disulfonate monohydrate","Acta Crystallographica Section E","2007","63","3","m803","m805","10.1107/S1600536807007027","","","0.71073","MoKα","","0.065","0.04","","","0.092","0.105","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212454","14.1146","0.0012","11.4794","0.001","16.0864","0.0016","90","","111.765","0.003","90","","2420.6","0.4","113","2","113","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Benzhydryl 2-(3-benzyl-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)- 3-hydroxybut-2-enoate","","- C28 H24 N2 O4 S -","- C28 H24 N2 O4 S -","- C112 H96 N8 O16 S4 -","4","2","BI2134","Fu, De-Cai; Sun, Feng-Xia; Chen, Jin-Ping; Liu, Qian; Zhang, Jing","Benzhydryl 2-(3-benzyl-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-hydroxybut-2-enoate","Acta Crystallographica Section E","2007","63","3","o1220","o1221","10.1107/S1600536807003637","","","0.7107","MoKα","","0.0494","0.039","","","0.0753","0.08","","","","","","0.98","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212455","12.523","0.003","6.4065","0.0014","16.321","0.004","90","","94.063","0.004","90","","1306.1","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(3-Methylbutyryl)-N'-phenylthiourea","","- C12 H16 N2 O S -","- C12 H16 N2 O S -","- C48 H64 N8 O4 S4 -","4","1","BI2136","Yusof, M. Sukeri M.; Asroh, Fatin Salbiah M.; Kadir, Maisara A.; Yamin, Bohari M.","<i>N</i>-(3-Methylbutyryl)-<i>N</i>'-phenylthiourea","Acta Crystallographica Section E","2007","63","3","o1190","o1191","10.1107/S1600536807001900","","","0.71073","MoKα","","0.111","0.079","","","0.166","0.175","","","","","","1.22","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212456","8.018","0.004","8.34","0.004","15.486","0.008","90","","96.831","0.009","90","","1028.2","0.9","294","2","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(E,E)-N,N'-bis(4-methoxybenzylidene)hexane-1,6-diamine","","- C22 H28 N2 O2 -","- C22 H28 N2 O2 -","- C44 H56 N4 O4 -","2","1","BI2140","Li, Jian; Liang, Zu-Pei; Wu, Qian","(<i>E</i>,<i>E</i>)-<i>N</i>,<i>N</i>'-Bis(4-methoxybenzylidene)hexane-1,6-diamine","Acta Crystallographica Section E","2007","63","3","o1086","o1087","10.1107/S160053680700462X","","","0.71073","MoKα","","0.078","0.0394","","","0.0904","0.1093","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212457","16.67","0.003","20.95","0.004","13.996","0.003","90","","90","","90","","4887.9","1.7","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Tetrapyridinium α-dodecamolybdosilicate hemihydrate","","- C20 H25 Mo12 N4 O40.5 Si -","- C20 H25 Mo12 N4 O40.5 Si -","- C80 H100 Mo48 N16 O162 Si4 -","4","0.5","BI2142","Dang, Dong-Bin; Jin, Ya-Nan","Tetrapyridinium α-dodecamolybdosilicate hemihydrate","Acta Crystallographica Section E","2007","63","3","m881","m883","10.1107/S1600536807007040","","","0.71073","MoKα","","0.0589","0.0542","","","0.1465","0.1498","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2212458","6.7156","0.0002","14.84","0.0005","10.8345","0.0003","90","","92.102","0.004","90","","1079.03","0.06","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[propane-1,3-diammonium hydroxydeca-μ~2~-oxo-pentaboron]","","- C3 H13 B5 N2 O9 -","- C3 H13 B5 N2 O9 -","- C12 H52 B20 N8 O36 -","4","1","BI2148","Guo-Ming Wang; Chun-Yang Pan; Shou-Tian Zheng; Guo-Yu Yang","Poly[propane-1,3-diammonium hydroxydeca-μ~2~-oxo-pentaborate]","Acta Crystallographica Section E","2007","63","3","o1104","o1105","10.1107/S1600536807004643","","","0.71073","MoKα","","0.038","0.0334","","","0.0903","0.0934","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212459","6.7092","0.0002","12.3923","0.0003","11.4615","0.0005","90","","90.397","0.003","90","","952.91","0.06","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[ethylenediammonium hydroxydeca-μ~2~-oxo-pentaboron]","","- C2 H11 B5 N2 O9 -","- C2 H11 B5 N2 O9 -","- C8 H44 B20 N8 O36 -","4","1","BI2150","Guo-Ming Wang; Chun-Yang Pan; Shou-Tian Zheng; Guo-Yu Yang","Poly[ethylenediammonium hydroxydeca-μ~2~-oxo-pentaborate]","Acta Crystallographica Section E","2007","63","3","o1101","o1103","10.1107/S1600536807004631","","","0.71073","MoKα","","0.0381","0.0316","","","0.0798","0.0841","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212460","11.8038","0.0014","11.8038","0.0014","6.3881","0.0007","90","","90","","120","","770.81","0.15","140","2","140","2","","","","","","","","6","P -6 2 c","P -6c -2c","190","","catena-poly[[sodium(I)-tri-μ-dimethylformamide-κ^6^O:O] iodide]","","- C9 H21 I N3 Na O3 -","- C9 H21 I N3 Na O3 -","- C18 H42 I2 N6 Na2 O6 -","2","0.166667","BI2152","Chessa, Simona; Wright, Joseph A.","Redetermination of <i>catena</i>-poly[[sodium(I)-tri-μ-dimethylformamide-κ^6^<i>O</i>:<i>O</i>] iodide] at 140 K","Acta Crystallographica Section E","2007","63","3","m787","m789","10.1107/S1600536807007052","","","0.71073","MoKα","","0.0252","0.0205","","","0.0317","0.0324","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212461","9.4713","0.0019","10.085","0.002","17.766","0.004","78.71","0.03","86","0.03","63.05","0.03","1483.1","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dichloro[tris(3-methyl-5-phenylpyrazol-1-yl)methane]copper(II) acetonitrile hemisolvate","","- C32 H29.5 Cl2 Cu N6.5 -","- C32 H29.5 Cl2 Cu N6.5 -","- C64 H59 Cl4 Cu2 N13 -","2","1","BI2154","He, Hong-Shan; Ng, Seik Weng","Dichloro[tris(3-methyl-5-phenylpyrazol-1-yl)methane]copper(II) acetonitrile hemisolvate","Acta Crystallographica Section E","2007","63","3","m685","m686","10.1107/S1600536807005508","","","0.71073","MoKα","","0.0821","0.0387","","","0.0794","0.096","","","","","","1.001","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2212462","14.145","0.003","14.145","0.003","11.165","0.003","90","","90","","90","","2233.9","0.9","294","2","294","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","Aquabis(dichloroacetato-κO)bis(nicotinamide-κN)copper(II)","","- C16 H16 Cl4 Cu N4 O7 -","- C16 H16 Cl4 Cu N4 O7 -","- C64 H64 Cl16 Cu4 N16 O28 -","4","0.5","BI2155","Moncol, Jan; Maroszová, Jaroslava; Múdra, Marcela; Lis, Tadeusz; Koman, Marian","Aquabis(dichloroacetato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>)copper(II)","Acta Crystallographica Section E","2007","63","3","m743","m745","10.1107/S1600536807006423","","","0.71073","MoKα","","0.0902","0.0354","","","0.0702","0.0773","","","","","","1.006","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212463","8.8943","0.0018","9.1784","0.0019","10.963","0.002","74.254","0.002","76.212","0.002","75.797","0.003","820.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","[Mn2(bpea)2(μ2-N3)2(N3)2]","","","- C28 H34 Mn2 N18 -","- C28 H34 Mn2 N18 -","- C28 H34 Mn2 N18 -","1","0.5","BI2156","Jing Qian; Wu Gu; Shi-Ping Yan; Dai-Zheng Liao; Peng Cheng","Di-μ-azido-κ^4^<i>N</i>:<i>N</i>-bis{(azido-κ<i>N</i>)[<i>N</i>,<i>N</i>-bis(2-pyridylmethyl-κ<i>N</i>)ethylamine]manganese(II)}","Acta Crystallographica Section E","2007","63","3","m687","m688","10.1107/S1600536807005405","","","0.71073","MoKα","","0.0288","0.0262","","","0.0682","0.0694","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212464","11.9766","0.0004","13.1942","0.0004","15.1181","0.0005","78.836","0.001","76.83","0.001","79.801","0.001","2259.92","0.13","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Bis(2,9-dimethyl-1,10-phenanthroline)copper(I) tetraphenylborate dichloromethane solvate","","- C53 H46 B Cl2 Cu N4 -","- C53 H46 B Cl2 Cu N4 -","- C106 H92 B2 Cl4 Cu2 N8 -","2","1","BI2157","Eckenhoff, William T.; Pintauer, Tomislav","Bis(2,9-dimethyl-1,10-phenanthroline)copper(I) tetraphenylborate dichloromethane solvate","Acta Crystallographica Section E","2007","63","3","m800","m802","10.1107/S1600536807007337","","","0.71073","MoKα","","0.0921","0.0467","","","0.1298","0.148","","","","","","0.889","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212465","8.6659","0.0006","8.6988","0.0006","14.5841","0.0011","84.389","0.001","85.373","0.001","76.402","0.001","1061.56","0.13","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","Methyl 1'-(2-hydroxy-1,3-dioxo-2,3-dihydro-1H-indan-2-yl)-2-oxo-5',6',7',7a'- tetrahydrospiro[1H-indole-3,3'(2H,2'H)-1'H-pyrrolizine]-1'-carboxylate","","- C25 H22 N2 O6 -","- C25 H22 N2 O6 -","- C50 H44 N4 O12 -","2","1","BI2158","B. K. Satis Kumar; D. Gayathri; D. Velmurugan; K. Ravikumar; E. Ramesh","Methyl 1'-(2-hydroxy-1,3-dioxo-2,3-dihydro-1<i>H</i>-indan-2-yl)-2-oxo-5',6',7',7a'-tetrahydrospiro[1<i>H</i>-indole-3,3'(2<i>H</i>,2'<i>H</i>)-1'<i>H</i>-pyrrolizine]-1'-carboxylate","Acta Crystallographica Section E","2007","63","3","o1492","o1494","10.1107/S1600536807008094","","","0.71073","MoKα","","0.0752","0.0628","","","0.1706","0.1822","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212466","10.255","0.002","12.165","0.002","14.856","0.003","72.58","0.03","87.01","0.03","73.8","0.03","1697.1","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(Barbiturato-κO)[hydridotris(5-methyl-3-phenyl-1-pyrazolyl)borato- κ^3^N^2^,N^2'^,N^2''^]zinc(II) methanol solvate","","- C35 H35 B N8 O4 Zn -","- C35 H35 B N8 O4 Zn -","- C70 H70 B2 N16 O8 Zn2 -","2","1","BI2160","He, Hongshan","(Barbiturato-κ<i>O</i>)[hydridotris(5-methyl-3-phenyl-1-pyrazolyl)borato-κ^3^<i>N</i>^2^,<i>N</i>^2'^,<i>N</i>^2''^]zinc(II) methanol solvate","Acta Crystallographica Section E","2007","63","3","m850","m852","10.1107/S1600536807008185","","","0.71073","MoKα","","0.2087","0.09","","","0.1597","0.2178","","","","","","1.083","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212467","5.9738","0.0011","8.3196","0.0014","11.0372","0.0019","79.231","0.003","78.946","0.003","75.258","0.003","515.11","0.16","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","Bis(ethylenediamine-κ^2^N,N')copper(II) 9,10-dioxoanthracene-2,6-disulfonate","","- C18 H22 Cu N4 O8 S2 -","- C18 H22 Cu N4 O8 S2 -","- C18 H22 Cu N4 O8 S2 -","1","0.5","BI2162","Zhao-Xun Lian; Hao-Hong Li","Bis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')copper(II) 9,10-dioxoanthracene-2,6-disulfonate","Acta Crystallographica Section E","2007","63","3","m853","m855","10.1107/S1600536807008215","","","0.71073","MoKα","","0.0478","0.0331","","","0.0805","0.0873","","","","","","1.085","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212468","28.151","0.006","5.897","0.001","15.261","0.003","90","","122.09","0.03","90","","2146.4","1","295","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","strontium tellurite","","- O3 Sr Te -","- O3 Sr Te -","- O72 Sr24 Te24 -","24","6","BR2023","Zavodnik, Valery E.; Ivanov, Sergey A.; Stash, Adam I.","The α-phase of SrTeO~3~ at 295K","Acta Crystallographica Section E","2007","63","3","i75","i76","10.1107/S160053680700164X","","","0.56086","AgKα","","0.0719","0.028","","","0.0642","0.068","","","","","","0.937","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212469","22.342","0.005","17.134","0.004","11.673","0.003","90","","90.149","0.003","90","","4468.5","1.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(tetraethylammonium) bis(dimethylammonium) dihydrogendecavanadate","","- C20 H58 N4 O28 V10 -","- C20 H58 N4 O28 V10 -","- C80 H232 N16 O112 V40 -","4","1","BR2025","Lian Chen; Cheng-Yang Yue; Da-Qiang Yuan; Fei-Long Jiang; Mao-Chun Hong","Bis(tetraethylammonium) bis(dimethylammonium) dihydrogendecavanadate(V)","Acta Crystallographica Section E","2007","63","3","m675","m677","10.1107/S1600536807004758","","","0.71073","MoKα","","0.0488","0.042","","","0.0869","0.0903","","","","","","1.01","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212470","12.8934","0.0006","12.7756","0.0005","12.4415","0.0005","90","","91.313","0.003","90","","2048.84","0.15","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","dysprosium ultraphosphate","dysprosium ultraphosphate","","- Dy O14 P5 -","- Dy O14 P5 -","- Dy8 O112 P40 -","8","1","BR2028","Chehimi-Moumen, Fathia; Mokhtar, Férid","DyP~5~O~14~","Acta Crystallographica Section E","2007","63","3","i89","i91","10.1107/S1600536807008410","","","0.71073","MoKα","","0.0548","0.0284","","","0.0551","0.0629","","","","","","0.98","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212471","6.0515","0.0006","9.0167","0.0008","4.9402","0.0007","90","","90.737","0.01","90","","269.54","0.05","299","","299","","","","","","","","","6","P 1 n 1","P -2yac","7","","ammonium sodium trioxofluorophosphate monohydrate","","- F H6 N Na O4 P -","- F H6 N Na O4 P -","- F2 H12 N2 Na2 O8 P2 -","2","1","BR2031","Fábry, Jan; Dušek, Michal; Krupková, Radmila","Ammonium sodium fluorotrioxophosphate monohydrate","Acta Crystallographica Section E","2007","63","3","i92","i94","10.1107/S1600536807008859","","","0.71073","MoKα","","0.0235","0.0219","","","0.0506","0.0508","","","","","","1.64","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212472","6.946","0.0005","7.233","0.0005","10.8199","0.0008","103.217","0.001","93.351","0.001","115.066","0.001","471.86","0.06","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Poly[diaqua(μ~4~-3-fluorophthalato-κ^4^O:O:O':O'')cadmium(II)]","","- C8 H7 Cd F O6 -","- C8 H7 Cd F O6 -","- C16 H14 Cd2 F2 O12 -","2","1","BT2228","Rishmawi, Diana; Lewis, Katie; Smith, Mark D.; Peterson Jr, LeRoy; Loye, Hans-Conrad zur","Poly[diaqua(μ~4~-3-fluorophthalato-κ^4^<i>O</i>:<i>O</i>:<i>O</i>':<i>O</i>'')cadmium(II)]","Acta Crystallographica Section E","2007","63","3","m695","m697","10.1107/S1600536807004898","","","0.71073","MoKα","","0.0172","0.0168","","","0.0412","0.0418","","","","","","1.113","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212473","12.7295","0.0006","8.8187","0.0003","17.268","0.0007","90","","107.667","0.004","90","","1847.04","0.14","85","2","85","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","9,9'-Dianthracenyl","","- C28 H18 -","- C28 H18 -","- C112 H72 -","4","1","BT2243","Janusz B. Kyzioł; Zaleski, Jacek","9,9'-Bianthracenyl","Acta Crystallographica Section E","2007","63","3","o1235","o1237","10.1107/S160053680700339X","","","0.71073","MoKα","","0.0642","0.0341","","","0.0763","0.0878","","","","","","0.966","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212474","23.1399","0.0012","20.5858","0.0012","16.073","0.0006","90","","116.951","0.003","90","","6824.9","0.6","123","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","μ-1,4-Diazabicyclo[2.2.2]octane-κ^2^N:N'-bis[bis(O,O'-dicyclohexyl dithiophosphato-κ^2^S,S')cadmium(II)]","","- C54 H100 Cd2 N2 O8 P4 S8 -","- C54 H100 Cd2 N2 O8 P4 S8 -","- C216 H400 Cd8 N8 O32 P16 S32 -","4","0.5","BT2246","Ellis, Carol A.; Ng, Seik Weng; Tiekink, Edward R. T.; Wardell, James L.","μ-1,4-Diazabicyclo[2.2.2]octane-κ^2^<i>N</i>:<i>N</i>'-bis[bis(<i>O</i>,<i>O</i>'-dicyclohexyl dithiophosphato-κ^2^<i>S</i>,<i>S</i>')cadmium(II)]","Acta Crystallographica Section E","2007","63","3","m806","m807","10.1107/S1600536807007155","","","0.71069","MoKα","","0.128","0.065","","","0.18","0.244","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212475","13.343","0.003","6.5277","0.0013","16.005","0.003","90","","98.42","0.004","90","","1379","0.5","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N'-(4-Hydroxy-3-methoxybenzylidene)isonicotinohydazide monohydrate","","- C14 H15 N3 O4 -","- C14 H15 N3 O4 -","- C56 H60 N12 O16 -","4","1","BT2252","Xue-Fang Shi; Lei He; Guo-Zhun Ma; Cui-Cui Yuan","<i>N</i>'-(4-Hydroxy-3-methoxybenzylidene)isonicotinohydrazide monohydrate","Acta Crystallographica Section E","2007","63","3","o1119","o1120","10.1107/S1600536807004874","","","0.7107","MoKα","","0.0709","0.0388","","","0.0916","0.1088","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212476","16.3384","0.0014","11.963","0.0008","16.5346","0.0014","90","","117.346","0.009","90","","2870.6","0.5","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","cis-Dichloro(di-<i>tert</i>-butylphosphine-κP)(triphenylphosphine- κP)platinum(II) tetrahydrofuran hemisolvate","","- C56 H76 Cl4 O P4 Pt2 -","- C56 H76 Cl4 O P4 Pt2 -","- C112 H152 Cl8 O2 P8 Pt4 -","2","0.5","BT2255","Chojnacki, Jaroslaw; Andrzej Robaszkiewicz; Eberhard Matern; Elke Baum; Jerzy Pikies","<i>cis</i>-Dichloro(di-<i>tert</i>-butylphosphine-κ<i>P</i>)(triphenylphosphine-κ<i>P</i>)platinum(II) tetrahydrofuran hemisolvate","Acta Crystallographica Section E","2007","63","3","m680","m682","10.1107/S1600536807005259","","","0.71073","MoKα","","0.024","0.0192","","","0.0462","0.0472","","","","","","0.998","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212477","8.1935","0.0004","13.5699","0.0006","15.5198","0.0015","90","","98.99","0.003","90","","1704.4","0.2","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-Carboxy-4-(hydroxymethyl)pyridinium chloride hemihydrate","","- C7 H9 Cl N O3.5 -","- C7 H9 Cl N O3.5 -","- C56 H72 Cl8 N8 O28 -","8","1","BT2257","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.; McDonald, Aidan R.; Klink, Gerard P. M. van; Koten, Gerard van","2-Carboxy-4-(hydroxymethyl)pyridinium chloride hemihydrate","Acta Crystallographica Section E","2007","63","3","o1121","o1122","10.1107/S1600536807004941","","","0.71073","MoKα","","0.042","0.0353","","","0.0955","0.1008","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212478","7.6022","0.0006","11.9149","0.0014","37.877","0.004","85.413","0.008","85.375","0.006","86.547","0.007","3403.8","0.6","296","","","","","","","","","","","4","P -1","-P 1","2","","(2E)-3-(Biphenyl-4-yl)-1-(2,4-dichlorophenyl)prop-2-en-1-one","","- C21 H14 Cl2 O -","- C21 H14 Cl2 O -","- C168 H112 Cl16 O8 -","8","4","BT2258","Fischer, Andreas; Yathirajan, H. S.; Ashalatha, B. V.; Narayana, B.; Sarojini, B. K.","(2<i>E</i>)-3-(Biphenyl-4-yl)-1-(2,4-dichlorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","3","o1351","o1352","10.1107/S1600536807006897","","","0.71073","MoKα","","0.0963","0.0496","","","0.0886","0.1062","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212479","36.723","0.014","7.303","0.003","6.0172","0.0016","90","","93.06","0.03","90","","1611.4","1","296","","","","","","","","","","","4","C 1 c 1","C -2yc","9","","(2E)-3-(Biphenyl-4-yl)-1-(4-chlorophenyl)prop-2-en-1-one","","- C21 H15 Cl O -","- C21 H15 Cl O -","- C84 H60 Cl4 O4 -","4","1","BT2259","Fischer, Andreas; Yathirajan, H. S.; Ashalatha, B. V.; Narayana, B.; Sarojini, B. K.","(2<i>E</i>)-3-(Biphenyl-4-yl)-1-(4-chlorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","3","o1353","o1354","10.1107/S1600536807006903","","","0.71073","MoKα","","0.1246","0.0666","","","0.1315","0.1603","","","","","","1.12","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212480","37.35","0.03","7.3663","0.0015","6.0978","0.0017","90","","92.63","0.04","90","","1675.9","1.5","296","","","","","","","","","","","4","C 1 c 1","C -2yc","9","","(2E)-3-(Biphenyl-4-yl)-1-(4-bromophenyl)prop-2-en-1-one","","- C21 H15 Br O -","- C21 H15 Br O -","- C84 H60 Br4 O4 -","4","1","BT2260","Fischer, Andreas; Yathirajan, H. S.; Ashalatha, B. V.; Narayana, B.; Sarojini, B. K.","(2<i>E</i>)-3-(Biphenyl-4-yl)-1-(4-bromophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","3","o1355","o1356","10.1107/S1600536807006915","","","0.71073","MoKα","","0.1098","0.0635","","","0.1303","0.1576","","","","","","1.169","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212481","11.7645","0.001","5.8118","0.0003","22.426","0.002","90","","99.304","0.008","90","","1513.2","0.2","296","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(2E)-3-(Biphenyl-4-yl)-1-phenylprop-2-en-1-one","","- C21 H16 O -","- C21 H16 O -","- C84 H64 O4 -","4","1","BT2261","Fischer, Andreas; Yathirajan, H. S.; Ashalatha, B. V.; Narayana, B.; Sarojini, B. K.","(2<i>E</i>)-3-(Biphenyl-4-yl)-1-phenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","3","o1357","o1358","10.1107/S1600536807006927","","","0.71073","MoKα","","0.103","0.0593","","","0.1227","0.1491","","","","","","1.147","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212482","35.232","0.003","7.4972","0.0005","6.2113","0.0003","90","","95.509","0.006","90","","1633.08","0.19","296","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","(2E)-3-(Biphenyl-3-yl)-1-(4-methoxyphenyl)prop-2-en-1-one","","- C22 H18 O2 -","- C22 H18 O2 -","- C88 H72 O8 -","4","1","BT2262","Fischer, Andreas; Yathirajan, H. S.; Ashalatha, B. V.; Narayana, B.; Sarojini, B. K.","(2<i>E</i>)-3-(Biphenyl-4-yl)-1-(4-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","3","o1349","o1350","10.1107/S1600536807006885","","","0.71073","MoKα","","0.0814","0.0572","","","0.1272","0.1451","","","","","","1.122","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212483","10.2072","0.0006","11.28","0.0007","14.5527","0.0009","100.047","0.001","93.162","0.001","101.316","0.001","1610.84","0.17","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","{N,N-bis[(diphenylphosphino)methyl]aniline}tetracarbonylmolybdenum(0)","","- C36 H29 Mo N O4 P2 -","- C36 H29 Mo N O4 P2 -","- C72 H58 Mo2 N2 O8 P4 -","2","1","BT2263","Sanchez Ballester, Noelia M.; Elsegood, Mark R. J.; Smith, Martin B.; Brown, Gavin M.","{<i>N</i>,<i>N</i>-Bis[(diphenylphosphino)methyl]aniline}tetracarbonylmolybdenum(0)","Acta Crystallographica Section E","2007","63","3","m719","m721","10.1107/S1600536807006101","","","0.691","synchrotron","","0.0692","0.0592","","","0.1546","0.1637","","","","","","0.999","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212484","5.837","0.0007","19.992","0.003","6.9779","0.0009","90","","106.391","0.002","90","","781.18","0.18","293","2","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[μ-1,3-thiazoline-2-thione-κ^2^S^2^:S^2^-μ-thiocyanato-κ^2^S:N- copper(I)]","","- C4 H5 Cu N2 S3 -","- C4 H5 Cu N2 S3 -","- C16 H20 Cu4 N8 S12 -","4","1","BT2264","Saithong, Saowanit; Pakawatchai, Chaveng; Charmant, Jonathan P. H.","Poly[μ-1,3-thiazolidine-2-thione-κ^2^<i>S</i>^2^:<i>S</i>^2^-μ-thiocyanato-κ^2^<i>S</i>:<i>N</i>-copper(I)]","Acta Crystallographica Section E","2007","63","3","m857","m858","10.1107/S1600536807007441","","","0.71074","MoKα","","0.0654","0.0512","","","0.1027","0.1082","","","","","","1.149","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212485","6.017","0.002","8.219","0.003","25.475","0.01","90","","90","","90","","1259.8","0.8","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(S)-phencyphos monohydrate","2-Hydroxy-5,5-dimethyl-4-phenyl-1,3,2-dioxaphosphorinan-2-one monohydrate","","- C11 H17 O5 P -","- C11 H17 O5 P -","- C44 H68 O20 P4 -","4","1","BT2265","Samas, Brian; Groendyke, Todd; Blackburn, Anthony C; Godrej, Delara B","2-Hydroxy-5,5-dimethyl-4-phenyl-1,3,2-dioxaphosphorinan-2-one monohydrate","Acta Crystallographica Section E","2007","63","3","o1276","o1278","10.1107/S1600536807006496","","","0.71073","MoKα","","0.0355","0.0336","","","0.0827","0.0846","","","","","","1.108","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212486","8.139","0.002","20.381","0.005","9.476","0.003","90","","103.07","0.004","90","","1531.2","0.7","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-(3,4-Dichlorophenyl)-N'-phenylacetylthiourea","","- C15 H12 Cl2 N2 O S -","- C15 H12 Cl2 N2 O S -","- C60 H48 Cl8 N8 O4 S4 -","4","1","BT2266","Yusof, M. Sukeri M.; Pazil, Aqilah M.; Kadir, Maisara A.; Yamin, Bohari M.","<i>N</i>-(3,4-Dichlorophenyl)-<i>N</i>'-(phenylacetyl)thiourea","Acta Crystallographica Section E","2007","63","3","o1302","o1303","10.1107/S1600536807006137","","","0.71073","MoKα","","0.046","0.035","","","0.089","0.093","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212487","9.0114","0.0013","14.886","0.002","16.023","0.002","87.639","0.004","84.428","0.004","76.011","0.004","2075.4","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","N-{(Z)-2-[1-(Triisopropylsilyl)-1H-indol-3-yl]-2-(triisopropylsilyloxy)vinyl}-2- (3,4,5-trimethoxyphenyl)acetamide","","","- C39 H62 N2 O5 Si2 -","- C39 H62 N2 O5 Si2 -","- C78 H124 N4 O10 Si4 -","2","1","BT2267","Christian Peifer; Roland Selig; Schollmeyer, Dieter; Stefan Laufer","<i>N</i>-{(<i>Z</i>)-2-[1-(Triisopropylsilyl)-1<i>H</i>-indol-3-yl]-2-(triisopropylsilyloxy)vinyl}-2-(3,4,5-trimethoxyphenyl)acetamide","Acta Crystallographica Section E","2007","63","3","o1266","o1268","10.1107/S1600536807006514","","","0.71069","MoKα","","0.1266","0.055","","","0.1263","0.1492","","","","","","0.779","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212488","13.323","0.003","7.1147","0.0014","14.589","0.003","90","","101.42","0.03","90","","1355.5","0.5","293","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Hydroxy-3-methoxybenzaldehyde nicotinoylhydrazone monohydrate","","- C14 H15 N3 O4 -","- C14 H15 N3 O4 -","- C56 H60 N12 O16 -","4","1","BT2268","Xue-Fang Shi; Chang-Liu Liu; Bo Liu; Cui-Cui Yuan","4-Hydroxy-3-methoxybenzaldehyde nicotinoylhydrazone monohydrate","Acta Crystallographica Section E","2007","63","3","o1295","o1296","10.1107/S1600536807006708","","","0.71073","MoKα","","0.0771","0.0588","","","0.1122","0.1206","","","","","","1.13","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212489","4.8759","0.0005","9.511","0.0008","14.1724","0.0011","90","","90","","90","","657.24","0.1","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(1aR,2aS,5aS,5bS)-Perhydro-4H-oxireno[3,4]cyclopenta[1,2-b]furan-4-one","","","- C7 H8 O3 -","- C7 H8 O3 -","- C28 H32 O12 -","4","1","BT2270","Christian Peifer; Melanie Tschertsche; Schollmeyer, Dieter; Stefan Laufer","(1a<i>R</i>,2a<i>S</i>,5a<i>S</i>,5b<i>S</i>)-Perhydro-4<i>H</i>-oxireno[3,4]cyclopenta[1,2-<i>b</i>]furan-4-one","Acta Crystallographica Section E","2007","63","3","o1359","o1360","10.1107/S160053680700743X","","","1.54178","CuKα","","0.0561","0.0418","","","0.1086","0.12","","","","","","0.974","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212490","6.8783","0.0005","21.3163","0.0013","10.0532","0.0007","90","","128.276","0.004","90","","1157.14","0.15","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[cyclohexylammonium [cadmium(II)-tri-μ-bromido]]","","- C6 H14 Br3 Cd N -","- C6 H14 Br3 Cd N -","- C24 H56 Br12 Cd4 N4 -","4","1","BT2271","Rademeyer, Melanie","<i>catena</i>-Poly[cyclohexylammonium [cadmate(II)-tri-μ-bromido]]","Acta Crystallographica Section E","2007","63","3","m829","m831","10.1107/S1600536807007647","","","0.71073","MoKα","","0.0529","0.033","","","0.086","0.0889","","","","","","1.179","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212491","10.199","0.004","19.874","0.004","15.386","0.005","90","","107.589","0.004","90","","2972.9","1.6","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","dipotassium 2,5-bis[(2-{2-[2-(2-{2-[2-(2- hydroxyethoxy)phenoxy]ethoxy}phenoxy)ethoxy]phenoxy}methyl)terephthalate methanol tetrasolvate","","- C62 H72 K2 O22 -","- C62 H72 K2 O22 -","- C124 H144 K4 O44 -","2","0.5","BT2272","Noriko, Kasuga C.; Hiroshi, Kato; Masafumi, Kurihara; Masanori, Yumita; Kazuo, Yamaguchi","Dipotassium salt of a double-armed terephthalic acid derivative: dipotassium 2,5-bis(2-{2-[2-(2-{2-[2-(2-hydroxyethoxy)phenoxy]ethoxy}phenoxy)ethoxy]phenoxy}methyl)terephthalate methanol tetrasolvate","Acta Crystallographica Section E","2007","63","3","m924","m926","10.1107/S1600536807008239","","","0.71073","MoKα","","0.0589","0.0507","","","0.131","0.1375","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212492","4.8119","0.0002","13.8528","0.0006","15.6831","0.0007","90","","90","","90","","1045.41","0.08","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Ethyl 2-(2-formylphenoxy)ethanoate‒ethyl 2-(2-carboxyphenoxy)ethanoate [0.682(7)/0.318(7)]","","- C11 H12 O4.32 -","- C11 H12 O4.318 -","- C44 H48 O17.272 -","4","1","BT2273","Williamson, Craig; Storey, John M. D.; Harrison, William T. A.","Ethyl 2-(2-formylphenoxy)ethanoate‒ethyl 2-(2-carboxyphenoxy)ethanoate [0.682(7)/0.318(7)]","Acta Crystallographica Section E","2007","63","3","o1426","o1427","10.1107/S1600536807007738","","","0.71073","MoKα","","0.057","0.0391","","","0.0887","0.0975","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2212493","7.408","0.003","4.596","0.002","27.805","0.013","90","","96.025","0.008","90","","941.5","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(1,3-dioxoisoindolin-2-yl)urea","","- C9 H7 N3 O3 -","- C9 H7 N3 O3 -","- C36 H28 N12 O12 -","4","1","BT2274","Li, Jian; Liang, Zu-Pei; Guo, Huan-Mei","1-(1,3-Dioxoisoindolin-2-yl)urea","Acta Crystallographica Section E","2007","63","3","o1467","o1468","10.1107/S1600536807008252","","","0.71073","MoKα","","0.1061","0.0663","","","0.1629","0.1888","","","","","","1.068","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212494","7.573","0.0001","9.522","0.0001","10.966","0.0002","102.048","0.002","90.763","0.001","101.462","0.002","756.68","0.02","293","2","293","","","","","","","","","6","P -1","-P 1","2","","3-Bromo-2-bromomethyl-1-phenylsulfonyl-1H-indole","","- C15 H11 Br2 N O2 S -","- C15 H11 Br2 N O2 S -","- C30 H22 Br4 N2 O4 S2 -","2","1","BT2275","P. Sakthivel; K. Sethusankar; P. Jai Sankar; P. S. Joseph","3-Bromo-2-bromomethyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","3","o1521","o1522","10.1107/S160053680700880X","","","0.71073","MoKα","","0.0583","0.0303","","","0.0683","0.0768","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212495","9.5155","0.0007","17.6544","0.0013","12.4242","0.0009","90","","97.464","0.001","90","","2069.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(3Z)-2-Benzyl-3-benzylidene-6-phenyl-2-azabicyclo[2.2.2]octan-5-one","","- C27 H25 N O -","- C27 H25 N O -","- C108 H100 N4 O4 -","4","1","BT2278","B. Sridhar; K. Ravikumar; M. Mahesh; V. V. Narayana Reddy","(3<i>Z</i>)-2-Benzyl-3-benzylidene-6-phenyl-2-azabicyclo[2.2.2]octan-5-one","Acta Crystallographica Section E","2007","63","3","o1500","o1501","10.1107/S1600536807009038","","","0.71073","MoKα","","0.0493","0.0417","","","0.1032","0.1085","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212496","9.412","0.0012","9.7918","0.0012","15.996","0.002","90","","97.254","0.002","90","","1462.4","0.3","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Diphenyl-5,6,7,7a-tetrahydropyrrolo[1,2-c]oxazol-3(1H)-one","","- C18 H17 N O2 -","- C18 H17 N O2 -","- C72 H68 N4 O8 -","4","2","BV2040","Wang, Bing-Tao; Yue, Hua-Dong; Luo, Shu-Ping; Xu, Dan-Qian","Diphenyl-5,6,7,7a-tetrahydropyrrolo[1,2-<i>c</i>]oxazol-3(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","3","o1108","o1109","10.1107/S1600536807004394","","","0.71073","MoKα","","0.0825","0.0761","","","0.1314","0.1338","","","","","","1.351","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212497","10.508","0.003","11.713","0.003","12.25","0.002","92.424","0.019","92.08","0.02","100","0.03","1482","0.6","29","","296","","","","","","","","","5","P 1","P 1","1","","4,6-Diphenyl-1-(phenylsulfonyl)-1H-furo[3,4-b]pyrrole","","- C24 H17 N O3 S -","- C24 H17 N O3 S -","- C72 H51 N3 O9 S3 -","3","3","BV2045","Moskalev, Nikolai V.; Gribble, Gordon W.; Jasinski, Jerry P.","4,6-Diphenyl-1-(phenylsulfonyl)-1<i>H</i>-furo[3,4-<i>b</i>]pyrrole","Acta Crystallographica Section E","2007","63","3","o1279","o1281","10.1107/S1600536807005764","","","0.71069","MoKα","","0.2108","0.0429","","","0.0998","0.151","","","","","","0.993","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212498","7.706","0.0014","17.585","0.003","8.9774","0.0016","90","","111.025","0.003","90","","1135.5","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","poly[bis[μ-1,4-bis(imidazol-1-yl)butane]dicyanatonickel(II)]","","- C22 H28 N10 Ni O2 -","- C22 H28 N10 Ni O2 -","- C44 H56 N20 Ni2 O4 -","2","0.5","BV2047","Xia Zhu; Yu-Mei Zhang; Bao-Long Li; Yong Zhang","Poly[bis[μ-1,4-bis(imidazol-1-yl)butane]dicyanatonickel(II)]","Acta Crystallographica Section E","2007","63","3","m921","m923","10.1107/S1600536807007684","","","0.71073","MoKα","","0.0374","0.0328","","","0.0792","0.0816","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212499","8.3423","0.0002","8.6807","0.0002","13.7985","0.0003","90","","90","","90","","999.25","0.04","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3aR,4R,4aS,9aR)-4-Hydroxyperhydrofuro[2,3-f]indolizin-7(2H)-one","","- C10 H15 N O3 -","- C10 H15 N O3 -","- C40 H60 N4 O12 -","4","1","BV2048","Švorc, Ľubomír; Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan; Žúžiová, Jozefína","(3a<i>R</i>,4<i>R</i>,4a<i>S</i>,9a<i>R</i>)-4-Hydroxyperhydrofuro[2,3-<i>f</i>]indolizin-7(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","3","o1452","o1454","10.1107/S1600536807008537","","","0.71073","MoKα","","0.0691","0.0392","","","0.0855","0.0912","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212500","13.8059","0.0018","9.7744","0.0013","14.1049","0.0018","90","","104.938","0.002","90","","1839.1","0.4","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Hydroxy-1-(4-hydroxybenzyl)-7-methoxy-2,2-dimethyl-1,2,3,4- tetrahydroisoquinolinium thiocyanate","","- C20 H24 N2 O3 S -","- C20 H24 N2 O3 S -","- C80 H96 N8 O12 S4 -","4","1","CF2079","Yang, Jian; Zhao, Wei","6-Hydroxy-1-(4-hydroxybenzyl)-7-methoxy-2,2-dimethyl-1,2,3,4-tetrahydroisoquinolinium thiocyanate","Acta Crystallographica Section E","2007","63","3","o1262","o1263","10.1107/S1600536807005879","","","0.71073","MoKα","","0.0381","0.0329","","","0.0817","0.0853","","","","","","0.954","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212501","7.9488","0.0001","9.5623","0.0001","10.032","0.0001","103.111","0.001","111.146","0.001","100.426","0.001","663.016","0.015","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","Sodium [2-(mercaptomethylcarbonylamino)-N-(2-mercaptophenyl)ethanamide(4-)- κ^4^S,N,N',S']oxorhenate(V) monohydrate","","- C10 H10 N2 Na O4 Re S2 -","- C10 H10 N2 Na O4 Re S2 -","- C20 H20 N4 Na2 O8 Re2 S4 -","2","1","CF2081","Le Gal, Julien; Benoist, Éric; Gressier, Marie; Bélanger-Gariépy, Francine; Beauchamp, André L.","Sodium [2-(mercaptomethylcarbonylamino)-<i>N</i>-(2-mercaptophenyl)ethanamide(4{-})-κ^4^<i>S</i>,<i>N</i>,<i>N</i>',<i>S</i>']oxorhenate(V) monohydrate","Acta Crystallographica Section E","2007","63","3","m647","m649","10.1107/S1600536807003935","","","1.54178","CuKα","","0.0442","0.0439","","","0.1165","0.1168","","","","","","1.077","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212502","12.062","0.001","10.811","0.001","17.887","0.002","90","","90","","90","","2332.5","0.4","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis[2-methoxy-6-(cyclopentyliminomethyl)phenolato]nickel(II)","","- C26 H32 N2 Ni O4 -","- C26 H32 N2 Ni O4 -","- C104 H128 N8 Ni4 O16 -","4","0.5","CF2085","Xiao-Fan Zhao","Bis[6-(cyclopentyliminomethyl)-2-methoxyphenolato]nickel(II)","Acta Crystallographica Section E","2007","63","3","m704","m705","10.1107/S160053680700596X","","","0.71073","MoKα","","0.0407","0.0281","","","0.0679","0.0754","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212503","22.332","0.002","4.7356","0.0005","24.651","0.003","90","","104.929","0.006","90","","2519","0.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl [3-(2-pyridyl)pyrazol-1-yl]acetate monohydrate","","- C12 H15 N3 O3 -","- C12 H15 N3 O3 -","- C96 H120 N24 O24 -","8","2","CF2086","Coelho, Ana C.; Gonçalves, Isabel S.; Almeida Paz, Filipe A.","Ethyl [3-(2-pyridyl)pyrazol-1-yl]acetate monohydrate","Acta Crystallographica Section E","2007","63","3","o1380","o1382","10.1107/S1600536807007015","","","0.71073","MoKα","","0.0874","0.0613","","","0.1538","0.1764","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212504","8.441","0.003","9.596","0.003","10.925","0.004","96.11","0.02","96.49","0.03","106.13","0.02","835.8","0.5","193","2","193","2","","","","","","","","4","P -1","-P 1","2","Ethyl 2,3-dihydro-1H,1'H-2,3'-biindol-1-yl(oxo)acetate","Ethyl (2,3-dihydro-1H,1'H-2,3'-biindol-1-yl)glyoxylate","","- C20 H18 N2 O3 -","- C20 H18 N2 O3 -","- C40 H36 N4 O6 -","2","1","CF2089","Christian Peifer; Dimitri Ott; Schollmeyer, Dieter; Stefan Laufer","Ethyl (2,3-dihydro-1<i>H</i>,1'<i>H</i>-2,3'-biindol-1-yl)glyoxylate","Acta Crystallographica Section E","2007","63","3","o1415","o1417","10.1107/S1600536807007660","","","1.54178","CuKα","","0.0506","0.0499","","","0.1459","0.1466","","","","","","1.073","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212505","11.225","0.002","11.375","0.002","17.283","0.004","76.26","0.03","71.8","0.03","71.5","0.03","1964.4","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methyl 2-amino-4-(3-fluorophenyl)-4H-benzo[h]chromene-3-carboxylate methanol solvate","","- C22 H20 F N O4 -","- C22 H20 F N O4 -","- C88 H80 F4 N4 O16 -","4","2","CI2261","Tang, Qing-Gang; Wu, Wen-Yuan; He, Wei; Sun, Heng-Shun; Guo, Cheng","Methyl 2-amino-4-(3-fluorophenyl)-4<i>H</i>-benzo[<i>h</i>]chromene-3-carboxylate methanol solvate","Acta Crystallographica Section E","2007","63","3","o1437","o1438","10.1107/S1600536807000335","","","0.71073","MoKα","","0.1175","0.0648","","","0.1675","0.1927","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212506","5.0183","0.0001","5.7002","0.0005","13.5102","0.0009","102.178","0.003","94.324","0.001","90.083","0.001","376.63","0.04","299","2","299","2","","","","","","","","3","P -1","-P 1","2","","Diethyl 3,3-dihydroxy-3,3'-(p-phenylene)diprop-2-enoate","","- C16 H18 O6 -","- C16 H18 O6 -","- C16 H18 O6 -","1","0.5","CI2272","Mei, Guang-Quan; Huang Ke-Long","Diethyl 3,3-dihydroxy-3,3'-(<i>p</i>-phenylene)diprop-2-enoate","Acta Crystallographica Section E","2007","63","3","o1439","o1440","10.1107/S1600536807006198","","","0.71073","MoKα","","0.0545","0.049","","","0.1528","0.1598","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212507","17.353","0.0003","21.8357","0.0004","21.2915","0.0003","90","","96.502","0.001","90","","8015.8","0.2","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[acetonitrile\ bis[μ-bis(diphenylphosphino)methane-k^2^P:P']dicopper(I)]-\ μ-(1,2-dicyanoethylene-1,2-dithiolato)-\ [(1,2-dicyanoethylene-1,2-dithiolato)molybdenum(IV)]-μ-\ (1,2-dicyanoethylene-1,2-dithiolato)] diethyl ether disolvate acetonitrile solvate]","","- C74 H70 Cu2 Mo N8 O2 P4 S6 -","- C74 H70 Cu2 Mo N8 O2 P4 S6 -","- C296 H280 Cu8 Mo4 N32 O8 P16 S24 -","4","1","CI2273","Wei-Wei Fu; Zhong-Ning Chen","{[Cu~2~Mo(C~4~N~2~S~2~)~3~(C~2~H~3~N)(C~25~H~22~P~2~)~2~]·2C~4~H~10~O·C~2~H~3~N}~<i>n~</i>","Acta Crystallographica Section E","2007","63","3","m842","m844","10.1107/S1600536807004679","","","0.71073","MoKα","","0.1294","0.0762","","","0.1492","0.1788","","","","","","1.265","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212508","7.81","0.0005","11.97","0.0004","14.7695","0.0003","103.834","0.003","104.393","0.003","90.169","0.003","1295.75","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[(2,2'-bipyridyl-κ^2^N,N')manganese(II)]-di-μ-3,5- dinitrobenzoato-κ^4^O:O']","","- C24 H14 Mn N6 O12 -","- C24 H14 Mn N6 O12 -","- C48 H28 Mn2 N12 O24 -","2","1","CI2284","Guo, Hong-Xu; Chen, Jian-Xin; Wang, Qing-Hua; You, Xiu-Li","<i>catena</i>-Poly[[(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-di-μ-3,5-dinitrobenzoato-κ^4^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","3","m915","m917","10.1107/S1600536807008823","","","0.71073","MoKα","","0.0509","0.0419","","","0.119","0.1243","","","","","","1.001","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212509","7.6148","0.0005","11.3885","0.0007","13.7659","0.0008","90","","101.983","0.002","90","","1167.78","0.13","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(Bromomethyl)benzophenone","","- C14 H11 Br O -","- C14 H11 Br O -","- C56 H44 Br4 O4 -","4","1","CI2286","Xu, Wei-Jian; Zang, Yang-Ling; Wu, Guo-Liang; Su, Sheng-Pei; Qiu, De-Yue","4-(Bromomethyl)benzophenone","Acta Crystallographica Section E","2007","63","3","o1188","o1189","10.1107/S160053680700534X","","","0.71073","MoKα","","0.0467","0.0334","","","0.0887","0.0966","","","","","","1.019","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212510","10.111","0.002","14.812","0.002","17.56","0.003","90","","99.029","0.002","90","","2597.3","0.8","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis{4-bromo-2-[3-(dimethylamino)propyliminomethyl]phenolato}nickel(II)","","- C24 H32 Br2 N4 Ni O2 -","- C24 H32 Br2 N4 Ni O2 -","- C96 H128 Br8 N16 Ni4 O8 -","4","1","CI2291","Li-Zhong Li; Li-Hua Wang","Bis{4-bromo-2-[3-(dimethylamino)propyliminomethyl]phenolato}nickel(II)","Acta Crystallographica Section E","2007","63","3","m749","m750","10.1107/S1600536807006575","","","0.71073","MoKα","","0.0872","0.0475","","","0.0894","0.1044","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212511","11.3626","0.0002","9.6712","0.0002","23.8238","0.0004","90","","93.17","0.001","90","","2613.99","0.08","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ethyl 3-(2-hydroxy-5-methylphenyl)-1H-pyrazole-5-carboxylate","","- C13 H14 N2 O3 -","- C13 H14 N2 O3 -","- C104 H112 N16 O24 -","8","1","CI2292","Ge, Yan-Qing; Dong, Wen-Liang; Xia, Yong; Wei, Fang; Zhao, Bao-Xiang","Ethyl 3-(2-hydroxy-5-methylphenyl)-1<i>H</i>-pyrazole-5-carboxylate","Acta Crystallographica Section E","2007","63","3","o1313","o1314","10.1107/S1600536807006745","","","0.71073","MoKα","","0.0617","0.0431","","","0.1161","0.1314","","","","","","0.938","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212512","4.6555","0.0005","10.6294","0.001","13.0612","0.0013","103.947","0.008","94.907","0.008","100.95","0.008","609.98","0.11","296","","296","","","","","","","","","4","P -1","-P 1","2","","2'-[Ethoxy(p-tolyl)methylene]acetohydrazide","","- C12 H16 N2 O2 -","- C12 H16 N2 O2 -","- C24 H32 N4 O4 -","2","1","CI2297","Şahin, Onur; Büyükgüngör, Orhan; Şaşmaz, Selami; Gümrükçüoğlu, Nurhan; Kantar, Cihan","2'-[Ethoxy(<i>p</i>-tolyl)methylene]acetohydrazide","Acta Crystallographica Section E","2007","63","3","o1485","o1487","10.1107/S1600536807008033","","","0.71073","MoKα","","0.0727","0.0448","","","0.1059","0.1205","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212513","49.228","0.003","11.0095","0.001","8.468","0.0005","90","","99.17","0.005","90","","4530.8","0.6","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2'-[ethoxy(phenyl)methylene]acetohydrazide","","- C11 H14 N2 O2 -","- C11 H14 N2 O2 -","- C176 H224 N32 O32 -","16","2","CI2298","Şahin, Onur; Büyükgüngör, Orhan; Şaşmaz, Selami; Gümrükçüoğlu, Nurhan; Kantar, Cihan","2'-[Ethoxy(phenyl)methylene]acetohydrazide","Acta Crystallographica Section E","2007","63","3","o1488","o1489","10.1107/S1600536807008045","","","0.71073","MoKα","","0.0851","0.0395","","","0.0902","0.1026","","","","","","0.805","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212514","8.221","0.002","6.914","0.001","10.981","0.002","90","","110.83","0.003","90","","583.4","0.2","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","catena-Poly[[(N,N-dimethylpropane-1,3-diamine)thiocyanatocopper(II)]- μ-thiocyanato]","","- C7 H14 Cu N4 S2 -","- C7 H14 Cu N4 S2 -","- C14 H28 Cu2 N8 S4 -","2","1","CI2299","Chen-Yi Wang","<i>catena</i>-Poly[[(<i>N</i>,<i>N</i>-dimethylpropane-1,3-diamine)thiocyanatocopper(II)]-μ-thiocyanato]","Acta Crystallographica Section E","2007","63","3","m832","m834","10.1107/S1600536807007891","","","0.71073","MoKα","","0.0636","0.0504","","","0.1035","0.1114","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212515","20.4571","0.001","7.0328","0.0003","29.4029","0.0013","90","","131.364","0.003","90","","3174.9","0.3","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dibutylbis(3,5-dinitrobenzoato-κO)tin(IV) toluene solvate","","- C29 H32 N4 O12 Sn -","- C29 H32 N4 O12 Sn -","- C116 H128 N16 O48 Sn4 -","4","1","CI2300","Yip Foo Win; Siang-Guan Teoh; Pazilah Ibrahim; Shea-Lin Ng; Hoong-Kun Fun","Dibutylbis(3,5-dinitrobenzoato-κ<i>O</i>)tin(IV) toluene solvate","Acta Crystallographica Section E","2007","63","3","m875","m877","10.1107/S1600536807008100","","","0.71073","MoKα","","0.0461","0.0324","","","0.0646","0.0724","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212516","7.526","0.002","7.554","0.002","10.259","0.003","100.46","0.004","102.539","0.004","94.732","0.004","555.3","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","4-(2-methoxy-4-nitrophenyl)morpholine-3,5-dione","","- C11 H10 N2 O6 -","- C11 H10 N2 O6 -","- C22 H20 N4 O12 -","2","1","CS2029","Bhuiyan, M. Delower H.; Jensen, Paul; Turner, Peter; Try, Andrew C.","4-(2-Methoxy-4-nitrophenyl)morpholine-3,5-dione","Acta Crystallographica Section E","2007","63","3","o1115","o1116","10.1107/S1600536807004692","","","0.71073","MoKα","","0.0369","0.0322","","","0.0881","0.0916","","","","","","1.085","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212517","5.9868","0.0016","15.073","0.004","19.01","0.005","90","","92.557","0.004","90","","1713.7","0.8","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,5-Dimethyl-1-(4-nitrophenyl)-4-[(E)-(2,3,4,5,6-pentafluorophenyl)diazenyl]- 1H-pyrazole","","- C17 H10 F5 N5 O2 -","- C17 H10 F5 N5 O2 -","- C68 H40 F20 N20 O8 -","4","1","CV2167","Bustos, Carlos; Sánchez, Cristian; Schott, Eduardo; Alvarez-Thon, Luis; Fuentealba, Mauricio","3,5-Dimethyl-1-(4-nitrophenyl)-4-[(<i>E</i>)-(2,3,4,5,6-pentafluorophenyl)diazenyl]-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2007","63","3","o1138","o1139","10.1107/S160053680605464X","","","0.71073","MoKα","","0.1267","0.0612","","","0.1289","0.1496","","","","","","0.98","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212518","16.865","0.016","9.363","0.008","11.369","0.009","90","","126.06","0.05","90","","1451","2","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","trans-bis(ethylenediamine)bis(trifluoroacetate)copper(II)","","- C8 H16 Cu F6 N4 O4 -","- C8 H16 Cu F6 N4 O4 -","- C32 H64 Cu4 F24 N16 O16 -","4","0.5","CV2170","Karpova, Elena V.; Zakharov, Maxim A.; Gutnikov, Sergey I.; Boltalin, Alexandr I.","<i>trans</i>-Bis(ethylenediamine)bis(trifluoroacetato)copper(II)","Acta Crystallographica Section E","2007","63","3","m658","m659","10.1107/S1600536806056492","","","0.71073","MoKα","","0.0469","0.0467","","","0.1063","0.1064","","","","","","1.069","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212519","11.2973","0.0016","8.4454","0.0012","16.253","0.002","90","","106.78","0.002","90","","1484.7","0.3","294","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-(3-Nitrobenzylideneamino)-3-(1H-1,2,4-triazol-1-ylmethyl)-1H-1,2,4- triazole-5(4H)-thione","","- C12 H10 N8 O2 S -","- C12 H10 N8 O2 S -","- C48 H40 N32 O8 S4 -","4","1","CV2176","Xin-Yan Shi","4-(3-Nitrobenzylideneamino)-3-(1<i>H</i>-1,2,4-triazol-1-ylmethyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","3","o1151","o1152","10.1107/S1600536807004710","","","0.71073","MoKα","","0.0624","0.0389","","","0.0856","0.0975","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212520","10.8386","0.001","8.4586","0.0008","17.2846","0.0017","90","","94.148","0.002","90","","1580.5","0.3","297","2","297","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","N-[(2,4-Dichlorophenoxy)acetyl]-N'-(dimethoxythiophosphinoyl)hydrazine","","- C10 H13 Cl2 N2 O4 P S -","- C10 H13 Cl2 N2 O4 P S -","- C40 H52 Cl8 N8 O16 P4 S4 -","4","1","CV2185","Zhang, Hui-Rong; Peng, Hao; He, Hong-Wu","<i>N</i>-[(2,4-Dichlorophenoxy)acetyl]-<i>N</i>'-(dimethoxythiophosphinoyl)hydrazine","Acta Crystallographica Section E","2007","63","3","o1080","o1081","10.1107/S1600536807002863","","","0.71073","MoKα","","0.0623","0.0518","","","0.129","0.1372","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212521","6.48","0.003","20.758","0.008","6.697","0.003","90","","107.777","0.005","90","","857.8","0.6","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","17α-Ethynyl-17β-hydroxyandrosta-1,4-diene-3-one","","- C21 H26 O2 -","- C21 H26 O2 -","- C42 H52 O4 -","2","1","CV2190","Liu-Qing Sheng; Wan-Gen Liang; Gang Chen; Hua-Feng Shen","17α-Ethynyl-17β-hydroxyandrosta-1,4-dien-3-one","Acta Crystallographica Section E","2007","63","3","o1182","o1183","10.1107/S1600536807005223","","","0.71073","MoKα","","0.0584","0.0523","","","0.1166","0.1203","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212522","21.1519","0.0014","9.8097","0.0007","11.7381","0.0008","90","","97.915","0.001","90","","2412.4","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-Methylpropan-2-aminium O-methyl {1-[(2,4-dichlorophenoxy)acetoxy]ethyl}phosphonate acetone solvate","","- C18 H30 Cl2 N O7 P -","- C18 H30 Cl2 N O7 P -","- C72 H120 Cl8 N4 O28 P4 -","4","1","CV2191","Peng, Hao; He, Hong-Wu","2-Methylpropan-2-aminium <i>O</i>-methyl {1-[(2,4-dichlorophenoxy)acetoxy]ethyl}phosphonate acetone solvate","Acta Crystallographica Section E","2007","63","3","o1180","o1181","10.1107/S1600536807004953","","","0.71073","MoKα","","0.0709","0.0536","","","0.1386","0.1521","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212523","9.751","0.004","11.841","0.005","17.779","0.007","90","","90","","90","","2052.8","1.5","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3β-Acetoxy-6α-chloro-5β-hydroxyandrostan-17-one","","- C21 H31 Cl O4 -","- C21 H31 Cl O4 -","- C84 H124 Cl4 O16 -","4","1","CV2193","Chun-Nian Xia; Wei-Xiao Hu; Wei Zhou; Bi-Wen Li","3β-Acetoxy-6α-chloro-5β-hydroxyandrostan-17-one","Acta Crystallographica Section E","2007","63","3","o1249","o1250","10.1107/S1600536807005740","","","0.71073","MoKα","","0.0589","0.0488","","","0.1143","0.1196","","","","","","0.984","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212524","11.0909","0.0001","8.1044","0.0001","32.0936","0.0004","90","","90","","90","","2884.74","0.06","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-Benzyl-5-phenyl-1H-pyrazole-3-carboxamide","","- C17 H15 N3 O -","- C17 H15 N3 O -","- C136 H120 N24 O8 -","8","1","CV2194","Yan-Qing Ge; Yong Xia; Fang Wei; Wen-Liang Dong; Bao-Xiang Zhao","<i>N</i>-Benzyl-5-phenyl-1<i>H</i>-pyrazole-3-carboxamide","Acta Crystallographica Section E","2007","63","3","o1186","o1187","10.1107/S1600536807004965","","","0.71073","MoKα","","0.065","0.0419","","","0.1192","0.1429","","","","","","1.094","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212525","14.2816","0.0003","16.8507","0.0004","15.0142","0.0004","90","","101.9","0.01","90","","3535.6","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[2-Carboxy-4-(4-carboxy-3-carboxylatobenzoyl)benzoato]bis(1,10- phenanthroline)cobalt(II) monohydrate","","- C41 H26 Co N4 O10 -","- C41 H26 Co N4 O10 -","- C164 H104 Co4 N16 O40 -","4","1","DN2119","Jin-Feng Huang; Jian-Rong Lin; Yu-Jiao Zhong; Zhen Lin; Yu-Mei Dai","[2-Carboxy-4-(4-carboxy-3-carboxylatobenzoyl)benzoato]bis(1,10-phenanthroline)cobalt(II) monohydrate","Acta Crystallographica Section E","2007","63","3","m656","m657","10.1107/S1600536807004448","","","0.71073","MoKα","","0.068","0.055","","","0.1244","0.1317","","","","","","1.206","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212526","4.8575","0.0007","33.087","0.005","6.2855","0.0009","90","","104.886","0.002","90","","976.3","0.2","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis(5-phenyl-1H-pyrazole-3-carboxylato)cobalt(II)","","- C20 H18 Co N4 O6 -","- C20 H18 Co N4 O6 -","- C40 H36 Co2 N8 O12 -","2","0.5","DN2122","Liang Ding; Jun-Hui Zuo; Chong-Bo Liu; Rui-Hong Deng; Hui-Liang Wen","Diaquabis(5-phenyl-1<i>H</i>-pyrazole-3-carboxylato)cobalt(II)","Acta Crystallographica Section E","2007","63","3","m650","m651","10.1107/S1600536807004126","","","0.71073","MoKα","","0.0411","0.0346","","","0.078","0.081","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212527","16.4365","0.0008","16.4365","0.0008","25.142","0.002","90","","90","","120","","5882.3","0.6","293","2","293","2","","","","","","","","6","R -3 m :H","-R 3 2""","166","","Tris(dimethylammonium) hydrogen a-dodecamolybdosilicate","","- C6 H24 Mo12 N3 O40 Si -","- C6 H24 Mo12 N3 O40 Si -","- C36 H144 Mo72 N18 O240 Si6 -","6","0.166667","DN2123","Zong-Jun Ku; Zhong-Hai Zhang; Ke-Li Zhang","Tris(dimethylammonium) hydrogen α-dodecamolybdosilicate","Acta Crystallographica Section E","2007","63","3","m878","m880","10.1107/S1600536807007192","","","0.71073","MoKα","","0.032","0.0312","","","0.081","0.0814","","","","","","1.341","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212528","14.913","0.002","6.595","0.001","28.081","0.005","90","","91.749","0.01","90","","2760.5","0.7","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aquabis(3-pyridylacrylato)-κ^2^O,O';κO-bis(3-pyridylmethanol-κN)copper(II)","","- C28 H28 Cu N4 O7 -","- C28 H28 Cu N4 O7 -","- C112 H112 Cu4 N16 O28 -","4","1","DN2124","Moncol, Jan; Segľa, Peter; Jašková, Jana; Fischer, Andreas; Melník, Milan","Aquabis(3-pyridylacrylato)-κ^2^<i>O</i>,<i>O</i>';κ<i>O</i>-bis(3-pyridylmethanol-κ<i>N</i>)copper(II)","Acta Crystallographica Section E","2007","63","3","m698","m700","10.1107/S1600536807005454","","","0.56085","AgKα","","0.0751","0.045","","","0.0916","0.1031","","","","","","1.062","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212529","5.669","0.002","9.516","0.003","19.091","0.004","90","","94.49","0.03","90","","1026.7","0.5","293","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","rac-4-Methoxy-6-phenyl-5,6-dihydro-2-pyrone","","- C12 H12 O3 -","- C12 H12 O3 -","- C48 H48 O12 -","4","1","DN2126","De Simone, C. A.; L. C. de Souza; Imbroisi, D. de O.; Oliveira, J. F. T.; Pereira, M. A.","<i>rac</i>-4-Methoxy-6-phenyl-5,6-dihydro-2-pyrone","Acta Crystallographica Section E","2007","63","3","o1274","o1275","10.1107/S1600536807006320","","","0.71073","MoKα","","0.0982","0.0529","","","0.1348","0.1686","","","","","","1.091","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212530","7.2118","0.0006","7.8271","0.0008","20.9993","0.0015","90","","107.283","0.006","90","","1131.84","0.17","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E)-3-[(2-Bromophenyl)iminomethyl]benzene-1,2-diol","","- C13 H10 Br N O2 -","- C13 H10 Br N O2 -","- C52 H40 Br4 N4 O8 -","4","1","DN2127","Temel, Ersin; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-3-[(2-Bromophenyl)iminomethyl]benzene-1,2-diol","Acta Crystallographica Section E","2007","63","3","o1319","o1320","10.1107/S1600536807006046","","","0.71073","MoKα","","0.0497","0.0313","","","0.0676","0.0735","","","","","","1.027","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212531","12.7293","0.0007","10.4916","0.0012","39.6468","0.001","90","","96.99","0.011","90","","5255.5","0.7","293","2","293","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","(2RS,5RS,6RS)-Ethyl 4-hydroxy-2,6-di-p-tolyl-5-p-tolylsulfanyl- 1,2,5,6-tetrahydropyridine-3-carboxylate","","- C29 H31 N O3 S -","- C29 H31 N O3 S -","- C232 H248 N8 O24 S8 -","8","1","DN2129","J. Suresh; R. Suresh Kumar; S. Perumal; S. Natarajan","(2<i>RS</i>,5<i>RS</i>,6<i>RS</i>)-Ethyl 4-hydroxy-2,6-di-<i>p</i>-tolyl-5-<i>p</i>-tolylsulfanyl-1,2,5,6-tetrahydropyridine-3-carboxylate","Acta Crystallographica Section E","2007","63","3","o1375","o1376","10.1107/S1600536807007167","","","0.71073","MoKα","","0.1326","0.0432","","","0.113","0.146","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212532","18.3565","0.0011","5.7293","0.0007","22.1286","0.0013","90","","94.242","0.018","90","","2320.9","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2RS,5SR,6SR)-Ethyl 2,6-bis(4-fluorophenyl)-4-hydroxy-5-phenylsulfanyl- 1,2,5,6-tetrahydropyridine-3-carboxylate","","- C26 H23 F2 N O3 S -","- C26 H23 F2 N O3 S -","- C104 H92 F8 N4 O12 S4 -","4","1","DN2130","J. Suresh; R. Suresh Kumar; S. Perumal; S. Natarajan","(2<i>RS</i>,5<i>SR</i>,6<i>SR</i>)-Ethyl 2,6-bis(4-fluorophenyl)-4-hydroxy-5-phenylsulfanyl-1,2,5,6-tetrahydropyridine-3-carboxylate","Acta Crystallographica Section E","2007","63","3","o1377","o1379","10.1107/S1600536807007179","","","0.71073","MoKα","","0.146","0.0786","","","0.2324","0.2787","","","","","","1.077","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212533","6.718","0.001","11.754","0.002","8.015","0.002","90","","90.649","0.003","90","","632.9","0.2","298","2","298","2","","","","","","","","5","I 1 2/m 1","-I 2y","12","","4,4'-Bipyridinium tetrachloridopalladate(II)","","- C10 H10 Cl4 N2 Pd -","- C10 H10 Cl4 N2 Pd -","- C20 H20 Cl8 N4 Pd2 -","2","0.25","DN2131","Valdés-Martínez, Jesús; Toscano, Rubén A.; Germán-Acacio, Juan Manuel","4,4'-Bipyridinium tetrachloridopalladate(II)","Acta Crystallographica Section E","2007","63","3","m870","m871","10.1107/S1600536807008483","","","0.71073","MoKα","","0.0242","0.0232","","","0.0575","0.0579","","","","","","1.1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212534","20.4798","0.0009","10.5692","0.0007","23.072","0.018","90","","92.79","0.05","90","","4988","4","293","2","293","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","N,N,N',N'-Tetramethylbutane-1,4-diammonium bis(p-aminobenzoate) 2.25-hydrate","","- C22 H38.5 N4 O6.25 -","- C22 H38.5 N4 O6.25 -","- C176 H308 N32 O50 -","8","1","DN3037","A. Elangovan; A. Thamaraichelvan; A. Ramu; S. Athimoolam; S. Natarajan","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylbutane-1,4-diammonium bis(<i>p</i>-aminobenzoate) 2.25-hydrate","Acta Crystallographica Section E","2007","63","3","o1418","o1420","10.1107/S1600536807007325","","","0.71069","MoKα","","0.121","0.0551","","","0.143","0.1778","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212535","5.8222","0.0001","19.126","0.0003","14.3158","0.0002","90","","93.922","0.001","90","","1590.41","0.04","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(4-Chlorphenyl)-4-(2-furoyl)-3-(2-furyl)-1H-pyrazol-5-ol","","- C18 H11 Cl N2 O4 -","- C18 H11 Cl N2 O4 -","- C72 H44 Cl4 N8 O16 -","4","1","DN3038","Li, Jin-Zhou; Zhang, Heng-Qiang; Li, Hong-Xin; Che, Pi-Zhi; Wang, Tian-Chi","1-(4-Chlorophenyl)-4-(2-furoyl)-3-(2-furyl)-1<i>H</i>-pyrazol-5-ol","Acta Crystallographica Section E","2007","63","3","o1289","o1290","10.1107/S1600536807006538","","","0.71073","MoKα","","0.0915","0.045","","","0.1024","0.1214","","","","","","1.009","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212536","4.0881","0.0001","11.0724","0.0002","16.9235","0.0004","90","","91.61","0.001","90","","765.74","0.03","273","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-(3-Bromo-2-thienyl)-3-(6-methoxy-2-naphthyl)prop-2-en-1-one","","- C18 H13 Br O2 S -","- C18 H13 Br O2 S -","- C36 H26 Br2 O4 S2 -","2","1","EZ2062","Ray J. Butcher; Yathirajan, H. S.; Ashalatha, B. V.; Narayana, B.; Sarojini, B. K.","1-(3-Bromo-2-thienyl)-3-(6-methoxy-2-naphthyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","3","o1430","o1431","10.1107/S1600536807008203","","","0.71073","MoKα","","0.054","0.033","","","0.06","0.066","","","","","","0.91","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212537","23.5463","0.0004","5.7654","0.0001","17.4776","0.0003","90","","120.607","0.001","90","","2042.09","0.06","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","cis-Ethylenebis(diphenylphosphine oxide)","","- C26 H22 O2 P2 -","- C26 H22 O2 P2 -","- C104 H88 O8 P8 -","4","0.5","EZ2063","Caddy, Judy; Coyanis, E. Mabel; Fernandes, Manuel A.; Khanye, Setshaba D.; Omondi, Bernard","<i>cis</i>-Ethylenebis(diphenylphosphine oxide)","Acta Crystallographica Section E","2007","63","3","o1387","o1389","10.1107/S1600536807007623","","","0.71073","MoKα","","0.041","0.035","","","0.088","0.092","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212538","10.167","0.0002","10.167","0.0002","16.7997","0.0005","90","","90","","90","","1736.55","0.07","293","2","293","","","","","","","","","4","P 43","P 4cw","","","(1S,2R,2'S,3'aS,5R)-2'-[(1R)-1-Hydroxyethyl]-2-isopropyl-5,5'-dimethyl- 3',3'a-dihydro-2'H-spiro[cyclohexane-1,6'-imidazo[1,5-b]isoxazol]-4'(5'H)-one","","- C17 H30 N2 O3 -","- C17 H30 N2 O3 -","- C68 H120 N8 O12 -","4","1","FB2035","Aouadi, Kaiss; Jeanneau, Erwann; Praly, Jean-Pierre","(1<i>S</i>,2<i>R</i>,2'<i>S</i>,3'a<i>S</i>,5<i>R</i>)-2'-[(1<i>S</i>)-1-Hydroxyethyl]-2-isopropyl-5,5'-dimethyl-3',3'a-dihydro-2'<i>H</i>-spiro[cyclohexane-1,6'-imidazo[1,5-<i>b</i>]isoxazol]-4'(5'<i>H</i>)-one","Acta Crystallographica Section E","2007","63","3","o1324","o1326","10.1107/S1600536807006812","","","0.71073","MoKα","","0.0587","0.0454","","","0.1127","0.1265","","","","","","1.122","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212539","10.7391","0.0009","8.0956","0.0004","11.082","0.001","90","","109.682","0.003","90","","907.17","0.12","293","2","293","","","","","","","","","4","P 1 21 1","P 2yb","","","(1S,2R,2'S,3'aS,5R)-2'-[(1R)-1-Hydroxyethyl]-2-isopropyl-5,5'-dimethyl-3',3'a- dihydro-2'H-spiro[cyclohexane-1,6'-imidazo[1,5-b]isoxazol]-4'(5'H)-one","","- C17 H30 N2 O3 -","- C17 H30 N2 O3 -","- C34 H60 N4 O6 -","2","1","FB2036","Aouadi, Kaiss; Jeanneau, Erwann; Praly, Jean-Pierre","(1<i>S</i>,2<i>R</i>,2'<i>S</i>,3'a<i>S</i>,5<i>R</i>)-2'-[(1<i>R</i>)-1-Hydroxyethyl]-2-isopropyl-5,5'-dimethyl-3',3'a-dihydro-2'<i>H</i>-spiro[cyclohexane-1,6'-imidazo[1,5-<i>b</i>]isoxazol]-4'(5'<i>H</i>)-one","Acta Crystallographica Section E","2007","63","3","o1327","o1329","10.1107/S1600536807006824","","","0.71073","MoKα","","0.0801","0.0451","","","0.1013","0.1152","","","","","","0.962","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212540","8.515","0.0007","6.6964","0.0005","19.2756","0.0018","90","","102.73","0.01","90","","1072.08","0.16","120","2","120","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","4,4'-Di-tert-butyl-2,2'-bipyridine‒hexafluorobenzene (1/1)","","- C24 H24 F6 N2 -","- C24 H24 F6 N2 -","- C48 H48 F12 N4 -","2","0.5","FB2037","Batsanov, Andrei S.; Mkhalid, Ibraheem A. I.; Marder, Todd B.","4,4'-Di-<i>tert</i>-butyl-2,2'-bipyridine‒hexafluorobenzene (1/1)","Acta Crystallographica Section E","2007","63","3","o1196","o1198","10.1107/S160053680700445X","","","0.71073","MoKα","","0.0576","0.0446","","","0.1271","0.1378","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212541","4.3755","0.0011","6.2034","0.0015","26.912","0.006","90","","90","","90","","730.5","0.3","153.1","","153.1","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","7-Iodotropolone","2-Hydroxy-7-iodocyclohepta-2,4,6-trien-1-one","","- C7 H5 I O2 -","- C7 H5 I O2 -","- C28 H20 I4 O8 -","4","1","FB2041","Kubo, Kanji; Matsumoto, Taisuke; Mori, Akira","2-Hydroxy-7-iodocyclohepta-2,4,6-trien-1-one","Acta Crystallographica Section E","2007","63","3","o1297","o1299","10.1107/S1600536807006526","","","0.7107","MoKα","","","0.0194","","","","0.0447","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212542","8.942","0.007","10.075","0.008","10.339","0.008","90","","90","","90","","931.4","1.3","293","2","293","2","","","","","","","Synthetic","4","P b c a","-P 2ac 2ab","61","","iron(III) arsenate dihydrate","Scorodite","- As Fe H4 O6 -","- As Fe H4 O6 -","- As8 Fe8 H32 O48 -","8","1","FI2026","Yan Xu; Guang-Peng Zhou; Xue-Fang Zheng","Redetermination of iron(III) arsenate dihydrate","Acta Crystallographica Section E","2007","63","3","i67","i69","10.1107/S1600536807005302","","","0.71073","MoKα","","0.0296","0.0244","","","0.0572","0.0593","","","","","","1.116","","","","has coordinates,has Fobs","282548","2023-04-10","20:38:56",""
"2212543","10.0871","0.0016","5.8845","0.001","4.682","0.0008","90","","90","","90","","277.91","0.08","150","2","123","2","","","","","","","","5","P n m a","-P 2ac 2n","62","Lithium nickel iron phosphate","Lithium ferrous nickel phosphate","","- Fe0.34 Li Ni0.66 O4 P -","- Fe0.34 Li Ni0.66 O4 P -","- Fe1.36 Li4 Ni2.64 O16 P4 -","4","0.5","FI2029","Liang, Gan; Benson, Ronald E.; Jiying Li; David Vaknin; Daniels, Lee M.","LiNi~0.66~Fe~0.34~PO~4~","Acta Crystallographica Section E","2007","63","3","i73","i74","10.1107/S1600536807007507","","","0.71075","MoKα","","0.022","0.0203","","","0.0429","0.0435","","","","","","1.179","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212544","7.1333","0.001","9.3392","0.0014","13.1127","0.0019","74.543","0.002","88.942","0.003","86.179","0.003","840.1","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Bis(dimethylammonium) 2,5-dicarboxybenzene-1,4-dicarboxylate bis(1,10-phenanthroline)","","- C38 H36 N6 O8 -","- C38 H36 N6 O8 -","- C38 H36 N6 O8 -","1","0.5","FJ2001","Ding-Chu Chen; Xin-Hua Li; Jin-Chang Ding","Bis(dimethylammonium) 2,5-dicarboxybenzene-1,4-dicarboxylate bis(1,10-phenanthroline)","Acta Crystallographica Section E","2007","63","3","o1133","o1135","10.1107/S1600536807004783","","","0.71073","MoKα","","0.0598","0.047","","","0.1123","0.1202","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212545","11.6716","0.0004","7.6043","0.0003","12.04","0.0004","90","","92.776","0.004","90","","1067.35","0.07","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl [(1E)-(4-methoxyphenyl)methyleneamino]acetate","","- C11 H13 N O3 -","- C11 H13 N O3 -","- C44 H52 N4 O12 -","4","1","FJ2002","Hector Novoa de Armas; Enriquez Ruiz Reyes; Esperanza Salfrán Solano; Margarita Suárez Navarro; Norbert Blaton","Methyl [(1<i>E</i>)-(4-methoxyphenyl)methyleneamino]acetate","Acta Crystallographica Section E","2007","63","3","o1459","o1461","10.1107/S1600536807008082","","","1.54178","CuKα","","0.0565","0.0497","","","0.1364","0.1453","","","","","","1.102","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212546","13.323","0.002","11.7226","0.0014","13.438","0.002","90","","113.068","0.006","90","","1930.9","0.5","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-acetyl-D,L-phenylglycine","","- C10 H11 N O3 -","- C10 H11 N O3 -","- C80 H88 N8 O24 -","8","2","FL2094","Rui-Dong Yang; Lin Zhao; Yang Yu","<i>N</i>-Acetyl-<small>DL</small>-phenylglycine","Acta Crystallographica Section E","2007","63","3","o1117","o1118","10.1107/S1600536807004515","","","0.71073","MoKα","","0.1139","0.0512","","","0.1263","0.159","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212547","8.0222","0.001","13.8576","0.0015","14.1496","0.0017","108.539","0.009","91.077","0.01","101.126","0.009","1457.9","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","1-(2,4-Dichlorobenzoyl)-3-phenylthiourea","","- C14 H10 Cl2 N2 O S -","- C14 H10 Cl2 N2 O S -","- C56 H40 Cl8 N8 O4 S4 -","4","2","FL2099","Khawar Rauf, M.; Badshah, Amin; Bolte, Michael; Ahmad, Imtiaz","1-(2,4-Dichlorobenzoyl)-3-phenylthiourea","Acta Crystallographica Section E","2007","63","3","o1155","o1157","10.1107/S1600536807004527","","","0.71073","MoKα","","0.0397","0.0345","","","0.1018","0.1048","","","","","","1.051","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212548","29.259","0.006","7.641","0.0015","14.336","0.003","90","","110.59","0.03","90","","3000.3","1.2","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(Z)-2-(Dimethylamino)-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazolidin-4-one","","- C15 H18 N2 O4 S -","- C15 H18 N2 O4 S -","- C120 H144 N16 O32 S8 -","8","1","FL2100","Low, John N.; Cobo, Justo; Gutiérrez, Alexander; Insuasty, Braulio; Glidewell, Christopher","(<i>Z</i>)-2-(Dimethylamino)-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazolidin-4-one","Acta Crystallographica Section E","2007","63","3","o1123","o1125","10.1107/S1600536807004539","","","0.71073","MoKα","","0.0561","0.0406","","","0.0942","0.1064","","","","","","1.113","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212549","11.3","0.004","5.5286","0.0018","16.141","0.005","90","","106.856","0.018","90","","965.1","0.6","153.1","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","1,4-Bis(1-naphthylmethyl)piperazine","","- C26 H26 N2 -","- C26 H26 N2 -","- C52 H52 N4 -","2","0.5","FL2101","Kubo, Kanji; Yamamoto, Emi; Hayakawa, Akinori; Sakurai, Tadamitsu; Mori, Akira","1,4-Bis(1-naphthylmethyl)piperazine","Acta Crystallographica Section E","2007","63","3","o1347","o1348","10.1107/S1600536807007118","","","1.54187","CuKα","","","0.0742","","","","0.2493","","","","","","1.23","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212550","6.5329","0.0002","11.5432","0.0005","12.3324","0.0005","90","","90","","90","","929.99","0.06","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(-)-cis-1-Acetyl-3-ethynyl-2,2-dimethylcyclobutane","","- C10 H14 O -","- C10 H14 O -","- C40 H56 O4 -","4","1","FL2102","Malak, Muhammad H.; Lalancette, Roger A.; Thompson, Hugh W.","({-})-<i>cis</i>-1-Acetyl-3-ethynyl-2,2-dimethylcyclobutane","Acta Crystallographica Section E","2007","63","3","o1412","o1414","10.1107/S1600536807007386","","","1.54178","CuKα","","0.039","0.035","","","0.092","0.095","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212551","9.2366","0.0009","12.0658","0.001","15.0535","0.0015","88.416","0.003","82.933","0.003","89.663","0.007","1664.3","0.3","200","2","","","","","","","","","","4","P -1","-P 1","2","","4-Nitrobenzyl 5-oxo-2-(2-oxopiperidin-1-yl)tetrahydrofuran-2-carboxylate","","- C17 H18 N2 O7 -","- C17 H18 N2 O7 -","- C68 H72 N8 O28 -","4","2","FL2103","Samantha J. Shanley; Christopher J. Scholfield; Simon J. Coles; David J. Watkin; Delphine S. Fischer","4-Nitrobenzyl 5-oxo-2-(2-oxopiperidin-1-yl)tetrahydrofuran-2-carboxylate","Acta Crystallographica Section E","2007","63","3","o1523","o1525","10.1107/S1600536807008720","","","0.71073","MoKα","","0.1356","0.1355","","0.3105","0.3102","0.3102","","","","","","1.0149","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212552","10.1889","0.0016","8.0102","0.0011","14.8722","0.0017","90","","90","","90","","1213.8","0.3","150","1","150","1","","","","","","","","4","P n a 21","P 2c -2n","33","","1-(4-aminophenyl)-2-(4-nitrophenyl)ethanone","","- C14 H12 N2 O3 -","- C14 H12 N2 O3 -","- C56 H48 N8 O12 -","4","1","GG3072","Li, Zong-Sheng; Chai, Jian-She","1-(4-Aminophenyl)-2-(4-nitrophenyl)ethanone","Acta Crystallographica Section E","2007","63","3","o1082","o1083","10.1107/S1600536807004369","","","0.71073","MoKα","","0.0625","0.0415","","","0.0926","0.0981","","","","","","0.911","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212553","15.7417","0.0013","12.8812","0.0009","16.8598","0.0013","90","","103.064","0.008","90","","3330.2","0.5","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","μ-Trithiocyanurato-κ^4^N^1^,S^2^:N^3^,S^4^-bis[(N,N,N',N'',N''- pentamethyldiethylenetriamine-κ^3^N,N',N'')zinc(II)] perchlorate monohydrate","","- C21 H48 Cl N9 O5 S3 Zn2 -","- C21 H48 Cl N9 O5 S3 Zn2 -","- C84 H192 Cl4 N36 O20 S12 Zn8 -","4","1","GG3074","Trávníček, Zdeněk; Marek, Jaromír; Čermáková, Šárka","μ-Trithiocyanurato-κ^4^<i>N</i>^1^,<i>S</i>^2^:<i>N</i>^3^,<i>S</i>^4^-bis[(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''-pentamethyldiethylenetriamine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')zinc(II)] perchlorate monohydrate","Acta Crystallographica Section E","2007","63","3","m795","m797","10.1107/S1600536807007349","","","0.71073","Mo-Kα","","0.0322","0.0268","","","0.0651","0.0744","","","","","","1.165","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212554","20.331","0.003","10.919","0.0018","21.327","0.004","90","","90","","90","","4734.5","1.4","150","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","3,5-dihydroxy-2-isobutyryl-4,6,6-tris(3-methyl-but-2-enyl)cyclohexa-2,4- dienone","","- C25 H36 O4 -","- C25 H36 O4 -","- C200 H288 O32 -","8","1","GG3075","Archer, Roland Peter; Tyrrell, Elizabeth; Singh, Kuldip","Colupulone","Acta Crystallographica Section E","2007","63","3","o1511","o1512","10.1107/S1600536807008860","","","0.71073","MoKα","","0.0745","0.0549","","","0.1215","0.1306","","","","","","1.089","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212555","7.4972","0.0007","9.0288","0.0008","25.045","0.002","90","","90","","90","","1695.3","0.3","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Palonosetron hydrochloride","2-[(S)-1-azoniabicyclo[2.2.2]oct-3-yl]-2,3,3a,4,5,6-hexahydro-1H- benz[de]isoquinolin-1-one chloride","","- C19 H25 Cl N2 O -","- C19 H25 Cl N2 O -","- C76 H100 Cl4 N8 O4 -","4","1","GK2050","Krishnan Ravikumar; Balasubramanian Sridhar","An orthorhombic polymorph of palonosetron hydrochloride","Acta Crystallographica Section E","2007","63","3","o1404","o1406","10.1107/S1600536807007829","","","0.71073","MoKα","","0.0284","0.0277","","","0.0727","0.0731","","","","","","1.074","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212556","11.4673","0.0012","13.8974","0.0011","6.9421","0.0008","90","","102.705","0.013","90","","1079.2","0.2","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(2-Pyridylcarbonyl)benzamide","","- C13 H10 N2 O2 -","- C13 H10 N2 O2 -","- C52 H40 N8 O8 -","4","1","GK2062","Gilles Gasser; Stoeckli-Evans, Helen","<i>N</i>-(2-Pyridylcarbonyl)benzamide","Acta Crystallographica Section E","2007","63","3","o1455","o1456","10.1107/S1600536807008355","","","0.71073","MoKα","","0.0485","0.0316","","","0.0748","0.0796","","","","","","0.92","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212557","5.3029","0.0005","13.6161","0.0013","13.6902","0.0013","90","","99.621","0.002","90","","974.6","0.16","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(glycinato-κ^2^N,O)cobalt(III)","","- C6 H12 Co N3 O6 -","- C6 H12 Co N3 O6 -","- C24 H48 Co4 N12 O24 -","4","1","GW2001","Gu, Ke-Qiang; Sun, Yu-Xi; Zhang, Ran; Zhang, Nian-Wei; Che, Hong-Wen","Tris(glycinato-κ^2^<i>N</i>,<i>O</i>)cobalt(III)","Acta Crystallographica Section E","2007","63","3","m740","m742","10.1107/S1600536807005636","","","0.71073","MoKα","","0.0653","0.0493","","","0.098","0.1043","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212558","8.1519","0.0005","8.2258","0.0005","10.6247","0.0006","91.195","0.001","95.882","0.001","113.439","0.001","648.74","0.07","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","5-Chloro-3-methylsulfinyl-2-phenyl-1-benzofuran","","- C15 H11 Cl O2 S -","- C15 H11 Cl O2 S -","- C30 H22 Cl2 O4 S2 -","2","1","GW2002","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","5-Chloro-3-methylsulfinyl-2-phenyl-1-benzofuran","Acta Crystallographica Section E","2007","63","3","o1291","o1292","10.1107/S1600536807006502","","","0.71073","MoKα","","0.03","0.0289","","","0.0765","0.0777","","","","","","1.117","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212559","19.8837","0.0002","7.6642","0.0002","13.8194","0.0002","90","","121.5","0.01","90","","1795.6","0.2","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Poly[[diaqua-μ~6~-succinato-di-μ~5~-succinato-dierbium(III)] monohydrate]","","- C12 H18 Er2 O15 -","- C12 H16 Er2 O15 -","- C48 H64 Er8 O60 -","4","0.5","HB2243","Li, Feng","Poly[[diaqua-μ~6~-succinato-di-μ~5~-succinato-dierbium(III)] monohydrate]","Acta Crystallographica Section E","2007","63","3","m840","m841","10.1107/S1600536807007039","","","0.71073","MoKα","","0.0254","0.0245","","","0.065","0.0661","","","","","","1.083","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212560","16.8773","0.0003","21.1322","0.0004","27.4623","0.0004","90","","90","","90","","9794.6","0.3","100","1","100","1","","","","","","","","6","C 2 2 21","C 2c 2","20","","Di-μ-benzenethiolato-μ-chlorido-bis{hydrido[(S)-(-)-2,2'-bis(di-<i>p</i>- tolylphosphanyl)-1,1'-binaphthyl]iridium(III)} chloride 1,2-dichloroethane disolvate","","- C112 H100 Cl6 Ir2 P4 S2 -","- C112 H100 Cl6 Ir2 P4 S2 -","- C448 H400 Cl24 Ir8 P16 S8 -","4","0.5","HB2272","Tsuneaki Yamagata; Kazunori Hoshida; Aika Iseki; Kazuhide Tani","Di-μ-benzenethiolato-μ-chlorido-bis{hydrido[(<i>S</i>)-({-})-2,2'-bis(di-<i>p</i>-tolylphosphanyl)-1,1'-binaphthyl]iridium(III)} chloride 1,2-dichloroethane disolvate","Acta Crystallographica Section E","2007","63","3","m918","m920","10.1107/S1600536807008665","","","0.71073","MoKα","","0.0436","0.04","","","0.0964","0.0981","","","","","","1.099","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212561","19.789","0.005","10.389","0.003","23.081","0.006","90","","98.62","0.03","90","","4692","2","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","Dicyclohexylammonium N-(tert-butoxycarbonyl)-L-threoninate","Dicyclohexylaminium (2S,3R)-2-[(tert-butoxycarbonyl)amino]-3-hydroxybutanoate]","","- C21 H40 N2 O5 -","- C21 H40 N2 O5 -","- C168 H320 N16 O40 -","8","4","HB2273","Bryndal, Iwona; Lis, Tadeusz","Dicyclohexylaminium <i>N</i>-(<i>tert</i>-butoxycarbonyl)-<small>L</small>-threoninate: a monoclinic structure with <i>Z</i>' = 4","Acta Crystallographica Section E","2007","63","3","o1444","o1447","10.1107/S1600536807007489","","","0.71073","MoKα","","0.0857","0.0719","","","0.1538","0.1617","","","","","","1.142","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212562","7.8904","0.0013","16.046","0.003","26.101","0.004","90","","90","","90","","3304.6","1","294","2","294","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","N-[4-(4-Fluorophenyl)-5-methyl-6-isoproylpyrimidin-2-yl]-N- methylmethanesulfonamide","","- C16 H20 F N3 O2 S -","- C16 H20 F N3 O2 S -","- C128 H160 F8 N24 O16 S8 -","8","1","HB2277","Xiao-Li Zhou; Jiang-Sheng Li; Wei Wang; Ying-Ying Zhang; Xiao-Peng Fan","<i>N</i>-[4-(4-Fluorophenyl)-5-methyl-6-isopropylpyrimidin-2-yl]-<i>N</i>-methylmethanesulfonamide","Acta Crystallographica Section E","2007","63","3","o1293","o1294","10.1107/S1600536807003650","","","0.71073","MoKα","","0.0738","0.0411","","","0.1106","0.1318","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212563","8.9411","0.0004","6.3404","0.0003","12.9039","0.0005","90","","113.189","0.003","90","","672.42","0.05","100","2","100","2","","","","","","","","5","P 1 c 1","P -2yc","7","","(2,2'-Bipyridine)tetracarbonylmolybdenum(0)","","- C14 H8 Mo N2 O4 -","- C14 H8 Mo N2 O4 -","- C28 H16 Mo2 N4 O8 -","2","1","HB2279","Braga, Susana S.; Coelho, Ana C.; Gonçalves, Isabel S.; Almeida Paz, Filipe A.","(2,2'-Bipyridine)tetracarbonylmolybdenum(0)","Acta Crystallographica Section E","2007","63","3","m780","m782","10.1107/S1600536807007234","","","0.71073","MoKα","","0.0238","0.0224","","","0.0474","0.0479","","","","","","1.059","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212564","8.5814","0.0017","19.426","0.004","10.118","0.002","90","","96.62","0.03","90","","1675.4","0.6","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[aqua(1H-imidazole-κN^3^)cadmium(II)]-μ-benzene-1,3- dicarboxylato-κ^3^O,O':O'']","","- C14 H14 Cd N4 O5 -","- C14 H14 Cd N4 O5 -","- C56 H56 Cd4 N16 O20 -","4","1","HB2281","Li-Bin Wang; Xiu-Mei Li; Qing-Wei Wang; Bo Liu","<i>catena</i>-Poly[[aqua(1<i>H</i>-imidazole-κ<i>N</i>^3^)cadmium(II)]-μ-benzene-1,3-dicarboxylato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>'']","Acta Crystallographica Section E","2007","63","3","m715","m716","10.1107/S160053680700637X","","","0.71073","MoKα","","0.045","0.0306","","","0.0669","0.0739","","","","","","1.001","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212565","10.3204","0.0003","6.338","0.0002","18.9664","0.0007","90","","96.179","0.001","90","","1233.4","0.07","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","aja0701","2-(Cyclohexylamino)-1,4-naphthoquinone","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C64 H68 N4 O8 -","4","1","HB2282","Knight, James C.; Tatchell, Thomas; Fallis, Ian A.","2-(Cyclohexylamino)-1,4-naphthoquinone","Acta Crystallographica Section E","2007","63","3","o1226","o1227","10.1107/S1600536807005466","","","0.71073","MoKα","","0.0767","0.0494","","","0.1206","0.1359","","","","","","1.048","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2212566","8.4327","0.0006","13.5061","0.0009","11.4613","0.0007","90","","108.134","0.001","90","","1240.52","0.14","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Diaquabis(N,N'-dimethylethylenediamine)zinc(II) naphthalene-2,6-disulfonate","","- C18 H34 N4 O8 S2 Zn -","- C18 H34 N4 O8 S2 Zn -","- C36 H68 N8 O16 S4 Zn2 -","2","0.5","HB2284","Zhao-Xun Lian; Hao-Hong Li","<i>trans</i>-Diaquabis(<i>N</i>,<i>N</i>'-dimethylethylenediamine)zinc(II) naphthalene-2,6-disulfonate","Acta Crystallographica Section E","2007","63","3","m731","m733","10.1107/S1600536807005946","","","0.71073","MoKα","","0.0349","0.0269","","","0.0711","0.0741","","","","","","0.992","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212567","14.5949","0.0003","7.8231","0.0002","15.9672","0.0005","90","","111.065","0.001","90","","1701.26","0.08","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(diethylenetriamine-κ^3^N)copper(II) bis(disulfadiazinate)","","- C28 H44 Cu N14 O4 S2 -","- C28 H44 Cu N14 O4 S2 -","- C56 H88 Cu2 N28 O8 S4 -","2","0.5","HB2285","G. M. Golzar Hossain; A. J. Amoroso","Bis(diethylenetriamine-κ^3^<i>N</i>)copper(II) bis(sulfadiazinate)","Acta Crystallographica Section E","2007","63","3","m759","m760","10.1107/S1600536807006551","","","0.71073","MoKα","","0.072","0.0434","","","0.0919","0.1118","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212568","9.8465","0.0008","11.528","0.0009","12.8997","0.001","77.683","0.001","80.891","0.001","76.669","0.001","1382.8","0.19","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","meso-(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradeca- 1,7-diene)nickel(II) bis[dioxalato(1,10-phenanthroline)chromate(III)] octahydrate","","- C48 H64 Cr2 N8 Ni O24 -","- C48 H62 Cr2 N8 Ni O24 -","- C48 H62 Cr2 N8 Ni O24 -","1","0.5","HB2286","Wang, Wen-Bo; Yang, Li-Xin; Lin, Yang","<i>meso</i>-(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradeca-1,7-diene)nickel(II) bis[dioxalato(1,10-phenanthroline)chromate(III)] octahydrate","Acta Crystallographica Section E","2007","63","3","m815","m817","10.1107/S1600536807007209","","","0.71073","MoKα","","0.0415","0.0366","","","0.0963","0.0999","","","","","","1.054","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212569","21.003","0.003","7.5378","0.0008","21.517","0.003","90","","109.289","0.003","90","","3215.3","0.7","103","2","103","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[bis(O,O'-diisopropyl dithiophosphato-κ^2^S,S')zinc(II)]- μ-1,2-di-4-pyridylethylene-κ^2^N:N']","","- C24 H38 N2 O4 P2 S4 Zn -","- C24 H38 N2 O4 P2 S4 Zn -","- C96 H152 N8 O16 P8 S16 Zn4 -","4","1","HB2287","Welte, William B.; Tiekink, Edward R. T.","<i>catena</i>-Poly[[bis(<i>O</i>,<i>O</i>'-diisopropyl dithiophosphato-κ^2^<i>S</i>,<i>S</i>')zinc(II)]-μ-1,2-di-4-pyridylethylene-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","3","m790","m792","10.1107/S1600536807005995","","","0.7107","MoKα","","0.045","0.04","","","0.085","0.087","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212570","6.4551","0.0005","6.9597","0.0004","9.8253","0.0007","81.621","0.006","80.464","0.006","88.341","0.006","430.66","0.05","294","","294","","","","","","","","","4","P -1","-P 1","2","","terbium hydrogendiphosphate trihydrate","","- H7 O10 P2 Tb -","- H5 O10 P2 Tb -","- H10 O20 P4 Tb2 -","2","1","HB2288","Essehli, Rachid; El Bali, Brahim; Dusek, Michal; Fejfarova, Karla; Lachkar, Mohammed","Terbium hydrogendiphosphate trihydrate: synthesis and non-merohedral twinning","Acta Crystallographica Section E","2007","63","3","i87","i88","10.1107/S160053680700832X","","","0.71069","MoKα","","0.0364","0.0263","","","0.0547","0.0562","","","","","","1.13","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2212571","6.4297","0.0007","6.9042","0.0004","9.8272","0.001","81.612","0.007","80.306","0.009","88.413","0.007","425.42","0.07","294","","294","","","","","","","","","4","P -1","-P 1","2","","yttrium hydrogendiphosphate trihydrate","","- H7 O10 P2 Y -","- H5 O10 P2 Y -","- H10 O20 P4 Y2 -","2","1","HB2289","Essehli, Rachid; El Bali, Brahim; Dusek, Michal; Fejfarova, Karla; Lachkar, Mohammed","Yttrium hydrogendiphosphate trihydrate","Acta Crystallographica Section E","2007","63","3","i80","i82","10.1107/S1600536807008318","","","0.71069","MoKα","","0.0266","0.0207","","","0.0471","0.0482","","","","","","1.21","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2212572","5.2122","0.0008","13.753","0.002","18.594","0.003","90","","90.863","0.002","90","","1332.7","0.4","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2,6-dichlorobenzyl)phthaimide","","- C15 H9 Cl2 N O2 -","- C15 H9 Cl2 N O2 -","- C60 H36 Cl8 N4 O8 -","4","1","HB2290","Huang, Peng-Mian; Yang, Dao-Wu","<i>N</i>-(2,6-Dichlorobenzyl)phthalimide","Acta Crystallographica Section E","2007","63","3","o1251","o1252","10.1107/S1600536807006411","","","0.71073","MoKα","","0.0569","0.0344","","","0.0808","0.0935","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212573","11.225","0.003","11.794","0.003","10.981","0.003","90","","99.189","0.005","90","","1435.1","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-(4-Fluorobenzyl)-9H-carbazole","","- C19 H14 F N -","- C19 H14 F N -","- C76 H56 F4 N4 -","4","1","HB2291","Huang, Peng-Mian; Duan, Xue-Min; Yang, Dao-Wu","9-(4-Fluorobenzyl)-9<i>H</i>-carbazole","Acta Crystallographica Section E","2007","63","3","o1264","o1265","10.1107/S160053680700654X","","","0.71073","MoKα","","0.1201","0.0414","","","0.0885","0.1161","","","","","","0.97","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212574","30.709","0.002","11.4278","0.0008","11.521","0.0004","90","","108.009","0.003","90","","3845.1","0.4","120","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis(O,O'-dicyclohexyl dithiophosphato-κ^2^S,S')nickel(II)]-μ-4,4'-bipyridine-κ^2^N:N']","","- C34 H52 N2 Ni O4 P2 S4 -","- C34 H52 N2 Ni O4 P2 S4 -","- C136 H208 N8 Ni4 O16 P8 S16 -","4","0.5","HB2292","Berdugo, Erick; Tiekink, Edward R. T.; Wardell, James L.; Wardell, Solange M. S. V.","<i>catena</i>-Poly[[bis(<i>O</i>,<i>O</i>'-dicyclohexyl dithiophosphato-κ^2^<i>S</i>,<i>S</i>')nickel(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","3","m764","m766","10.1107/S1600536807006757","","","0.71069","MoKα","","0.124","0.06","","","0.149","0.193","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212575","13.5596","0.0002","20.7303","0.0003","23.8169","0.0004","90","","90","","90","","6694.8","0.18","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Diaquabis(3-hydroxybenzoato-κO)bis(1,10-phenanthroline-κ^2^N,N')barium(II)","","- C38 H30 Ba N4 O8 -","- C38 H30 Ba N4 O8 -","- C304 H240 Ba8 N32 O64 -","8","2","HB2293","Liu, Ji-Wei; Ng, Seik Weng","Diaquabis(3-hydroxybenzoato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')barium(II)","Acta Crystallographica Section E","2007","63","3","m808","m809","10.1107/S1600536807007477","","","0.71073","MoKα","","0.068","0.04","","","0.095","0.117","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212576","10.1018","0.0001","10.1628","0.0001","29.4514","0.0004","90","","90","","90","","3023.56","0.06","173","2","173","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Bis(benzylammonium) sulfate","","- C14 H20 N2 O4 S -","- C14 H20 N2 O4 S -","- C112 H160 N16 O32 S8 -","8","1","HB2294","Amini, Mostafa M.; Nasiri, Samira; Ng, Seik Weng","Bis(benzylammonium) sulfate","Acta Crystallographica Section E","2007","63","3","o1361","o1362","10.1107/S1600536807007465","","","0.71073","MoKα","","0.037","0.032","","","0.098","0.109","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212577","18.5845","0.0018","6.4186","0.0007","8.879","0.001","90","","90","","90","","1059.1","0.2","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","Disilver(I) tetrahydroxodioxotellurate(VI)","","- Ag2 H4 O6 Te -","- Ag2 H4 O6 Te -","- Ag16 H32 O48 Te8 -","8","0.5","HB2295","Weil, Matthias","Redetermination of Ag~2~[TeO~2~(OH)~4~]: a revised hydrogen-bonding scheme","Acta Crystallographica Section E","2007","63","3","i77","i79","10.1107/S1600536807007970","","","0.71073","MoKα","","0.0335","0.0327","","","0.0383","0.0386","","","","","","1.089","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212578","6.7039","0.0008","9.6251","0.0011","19.947","0.002","90","","90","","90","","1287.1","0.2","294","2","294","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","trisodium dicalcium bismuth hexaoxide","","- Bi Ca2 Na3 O6 -","- Bi Ca2 Na3 O6 -","- Bi8 Ca16 Na24 O48 -","8","0.25","HB2296","Puzdrjakova, Irina V.; Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad","Trisodium dicalcium bismuth hexaoxide","Acta Crystallographica Section E","2007","63","3","i95","i96","10.1107/S1600536807008690","","","0.71073","MoKα","","0.0179","0.0126","","","0.0305","0.0319","","","","","","1.084","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212579","6.39","0.0006","6.8324","0.0003","9.8109","0.0008","81.662","0.006","80.07","0.007","88.354","0.005","417.45","0.06","294","","294","","","","","","","","","4","P -1","-P 1","2","","ytterbium hydrogendiphosphate trihydrate","","- H7 O10 P2 Yb -","- H5 O10 P2 Yb -","- H10 O20 P4 Yb2 -","2","1","HB2297","Essehli, Rachid; El Bali, Brahim; Dusek, Michal; Fejfarova, Karla; Lachkar, Mohammed","Ytterbium hydrogendiphosphate trihydrate: synthesis and non-merohedral twinning","Acta Crystallographica Section E","2007","63","3","i83","i84","10.1107/S1600536807008331","","","0.71069","MoKα","","0.0305","0.0261","","","0.0717","0.0729","","","","","","1.27","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2212580","6.4371","0.0003","6.9284","0.0005","9.8164","0.0007","81.593","0.006","80.377","0.005","88.368","0.005","427","0.05","294","","294","","","","","","","","","4","P -1","-P 1","2","","dysprosium hydrogendiphosphate trihydrate","","- Dy H7 O10 P2 -","- Dy H5 O10 P2 -","- Dy2 H10 O20 P4 -","2","1","HB2298","Essehli, Rachid; El Bali, Brahim; Dusek, Michal; Fejfarova, Karla; Lachkar, Mohammed","Dysprosium hydrogendiphosphate trihydrate: synthesis and non-merohedral twinning","Acta Crystallographica Section E","2007","63","3","i85","i86","10.1107/S1600536807008343","","","0.71069","MoKα","","0.0337","0.027","","","0.0662","0.0679","","","","","","1.09","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2212581","10.0611","0.0006","10.2518","0.0007","11.9841","0.0008","85.649","0.006","78.414","0.005","82.04","0.005","1197.77","0.14","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Promazinium picrate","3-(phenothiazin-10-yl)propanaminium 2,4,6-trinitrophenolate","","- C23 H23 N5 O7 S -","- C23 H23 N5 O7 S -","- C46 H46 N10 O14 S2 -","2","1","HB2300","Yathirajan, H. S.; Ashok, M. A.; Narayana Achar, B.; Bolte, Michael","Promazinium picrate","Acta Crystallographica Section E","2007","63","3","o1432","o1434","10.1107/S1600536807008306","","","0.71073","MoKα","","0.0495","0.0461","","","0.1249","0.128","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212582","13.8416","0.0012","7.4582","0.0006","16.9","0.0014","90","","104.481","0.001","90","","1689.2","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","benzimidazolium 2-carboxy-4-hydroxybenzenesulfonate trihydrate","","- C14 H18 N2 O9 S -","- C14 H18 N2 O9 S -","- C56 H72 N8 O36 S4 -","4","1","HB2301","Wang, Zi-Liang; Wei, Lin-Heng","Benzimidazolium 2-carboxy-4-hydroxybenzenesulfonate trihydrate","Acta Crystallographica Section E","2007","63","3","o1448","o1449","10.1107/S1600536807008173","","","0.71073","MoKα","","0.0509","0.0421","","","0.103","0.1074","","","","","","1.005","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212583","10.8105","0.0001","10.8105","","25.8402","0.0003","90","","90","","120","","2615.28","0.04","173","2","173","2","","","","","","","","5","P 61","P 61","169","","catena-poly[[ethyldiphenyltin(IV)]-μ-2-chloroacetato-κ^2^O:O']","","- C16 H17 Cl O2 Sn -","- C16 H17 Cl O2 Sn -","- C96 H102 Cl6 O12 Sn6 -","6","1","HB2303","Amini, Mostafa M.; Alijani, Vajihe; Azadmeher, Amirreza; Ng, Seik Weng","A hexagonal modification of <i>catena</i>-poly[[ethyldiphenyltin(IV)]-μ-2-chloroacetato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","3","m913","m914","10.1107/S1600536807008793","","","0.71073","MoKα","","0.043","0.04","","","0.112","0.114","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212584","10.835","0.002","9.925","0.002","12.304","0.003","90","","94.635","0.002","90","","1318.8","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[trimethyltin(IV)]-2-p-tolylacetato-κ^2^O:O']","","- C12 H18 O2 Sn -","- C12 H18 O2 Sn -","- C48 H72 O8 Sn4 -","4","1","HG2171","Hussain, Mukhtiar; Hanif, Muhammad; Ali, Saqib; Butcher, Ray","<i>catena</i>-Poly[[trimethyltin(IV)]-μ-2-<i>p</i>-tolylacetato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","3","m673","m674","10.1107/S1600536807004667","","","0.71073","MoKα","","0.0273","0.0253","","","0.0642","0.0652","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212585","7.3524","0.0013","13.91","0.003","18.135","0.003","90","","90","","90","","1854.7","0.6","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-Benzyl-2-nitro-N-(4-pyridylmethyl)benzenesulfonamide","","- C19 H17 N3 O4 S -","- C19 H17 N3 O4 S -","- C76 H68 N12 O16 S4 -","4","1","HG2172","Ying-Ying Zhang; Jiang-Sheng Li; Xiao-Li Zhou; Xiao-Peng Fan","<i>N</i>-Benzyl-2-nitro-<i>N</i>-(4-pyridylmethyl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","3","o1285","o1286","10.1107/S1600536807006277","","","0.71073","MoKα","","0.0542","0.0358","","","0.0783","0.0869","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212586","8.542","0.006","9.376","0.007","10.503","0.008","113.452","0.005","103.329","0.004","104.124","0.005","695.8","0.9","123.2","","","","","","","","","","","5","P -1","-P 1","2","","Methyl 2-[2-(2,6-dichloroanilino)phenyl]acetate","","- C15 H13 Cl2 N O2 -","- C15 H13 Cl2 N O2 -","- C30 H26 Cl4 N2 O4 -","2","1","HG2174","Nawaz, Hamid; Khawar Rauf, M.; Fuma, Yasuhiro; Ebihara, Masahiro; Badshah, Amin","Methyl 2-[2-(2,6-dichloroanilino)phenyl]acetate","Acta Crystallographica Section E","2007","63","3","o1228","o1229","10.1107/S1600536807005065","","","0.7107","MoKα","","","0.0398","","","","0.0993","","","","","","1.152","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212587","8.3975","0.0005","13.4757","0.0008","11.418","0.0007","90","","108.246","0.001","90","","1227.12","0.13","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Trans-Diaqua-Bis(N,N'-dimethylethylenediamine) nickel(II)naphthalene-2,6-disulfonate","","- C18 H34 N4 Ni O8 S2 -","- C18 H34 N4 Ni O8 S2 -","- C36 H68 N8 Ni2 O16 S4 -","2","0.5","HG2175","Zhao-Xun Lian; Hao-Hong Li","<i>trans</i>-Diaquabis(<i>N</i>,<i>N</i>'-dimethylethylenediamine)nickel(II) naphthalene-2,6-disulfonate","Acta Crystallographica Section E","2007","63","3","m734","m736","10.1107/S1600536807005843","","","0.71073","MoKα","","0.0309","0.0267","","","0.0774","0.08","","","","","","1.072","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212588","23.2759","0.0002","23.2759","0.0002","16.1785","0.0002","90","","90","","90","","8764.99","0.15","295","2","295","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","2-{5-[N-(4-tert-Butylbenzyl)carbamoyl]-3-phenyl-1H-pyrazol-1-yl}acetic acid","","- C23 H25 N3 O3 -","- C23 H25 N3 O3 -","- C368 H400 N48 O48 -","16","1","HG2176","Yan-Qing Ge; Yong Xia; Wen-Liang Dong; Fang Wei; Bao-Xiang Zhao","2-{5-[<i>N</i>-(4-<i>tert</i>-Butylbenzyl)carbamoyl]-3-phenyl-1<i>H</i>-pyrazol-1-yl}acetic acid","Acta Crystallographica Section E","2007","63","3","o1287","o1288","10.1107/S1600536807005971","","","0.71073","MoKα","","0.076","0.0466","","","0.1183","0.1355","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212589","20.742","0.002","8.5997","0.0012","23.463","0.003","90","","108.969","0.004","90","","3957.9","0.8","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","μ-2,2'-Biphenolato-κ^2^O:O'-μ-oxido-κ^2^O:O- bis[bis(hexafluoroacetylacetonato-κ^2^O,O')titanium(IV)]","","- C32 H12 F24 O11 Ti2 -","- C32 H12 F24 O11 Ti2 -","- C128 H48 F96 O44 Ti8 -","4","0.5","HG2178","Kuhn, Annemarie; Muller, Alfred; Conradie, Jeanet","μ-2,2'-Biphenolato-κ^2^<i>O</i>:<i>O</i>'-μ-oxido-κ^2^<i>O</i>:<i>O</i>-bis[bis(hexafluoroacetylacetonato-κ^2^<i>O</i>,<i>O</i>')titanium(IV)]","Acta Crystallographica Section E","2007","63","3","m664","m666","10.1107/S1600536807004588","","","0.71073","MoKα","","","0.0416","","","","0.1098","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212590","14.921","0.001","8.9624","0.0001","13.092","0.002","90","","92.6","0.001","90","","1749","0.3","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Dibromo{4-chloro-2-[(2-diethylaminoethylimino)methyl]phenolato}zinc(II)","","- C13 H19 Br2 Cl N2 O Zn -","- C13 H19 Br2 Cl N2 O Zn -","- C52 H76 Br8 Cl4 N8 O4 Zn4 -","4","1","HG2179","Yi-Jun Wei; Feng-Wu Wang; Qi-Yong Zhu","Dibromo{4-chloro-2-[(2-diethylaminoethylimino)methyl]phenolato}zinc(II)","Acta Crystallographica Section E","2007","63","3","m654","m655","10.1107/S1600536807004564","","","0.71073","MoKα","","0.0707","0.0426","","","0.0994","0.1129","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212591","6.9265","0.0006","13.3777","0.0011","14.8549","0.0012","90","","100.563","0.001","90","","1353.1","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(2,4-Dimethylphenyl)-N'-(3-pyridyl)urea monohydrate","","- C14 H17 N3 O2 -","- C14 H17 N3 O2 -","- C56 H68 N12 O8 -","4","1","HG2180","Huang, Xiao-Juan; Liang, Jian-Jun; Xia, Yaz-Hao; Wu, Biao; Yang, Xiao-Juan","<i>N</i>-(2,4-Dimethylphenyl)-<i>N</i>'-(3-pyridyl)urea monohydrate","Acta Crystallographica Section E","2007","63","3","o1217","o1219","10.1107/S1600536807005375","","","0.71073","MoKα","","0.0637","0.045","","","0.136","0.1486","","","","","","1.377","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212592","8.4839","0.0006","15.1584","0.0012","18.1998","0.0015","105.659","0.006","95.941","0.006","90.878","0.006","2239.3","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","1-(3-Chlorobenzoyl)-3-methyl-3-phenylthiourea","","- C15 H13 Cl N2 O S -","- C15 H13 Cl N2 O S -","- C90 H78 Cl6 N12 O6 S6 -","6","3","HG2181","Khawar Rauf, M.; Badshah, Amin; Bolte, Michael; Ahmad, Imtiaz","1-(3-Chlorobenzoyl)-3-methyl-3-phenylthiourea","Acta Crystallographica Section E","2007","63","3","o1258","o1259","10.1107/S1600536807005983","","","0.71073","MoKα","","0.0455","0.0367","","","0.0974","0.1021","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212593","7.381","0.0008","9.2105","0.0009","12.9581","0.0013","103.459","0.008","102.892","0.008","101.407","0.008","805.65","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","1-(2,3-Dimethylphenyl)-3-(2-methylbenzoyl)thiourea","","- C17 H18 N2 O S -","- C17 H18 N2 O S -","- C34 H36 N4 O2 S2 -","2","1","HG2182","Khawar Rauf, M.; Badshah, Amin; Bolte, Michael","1-(2,3-Dimethylphenyl)-3-(2-methylbenzoyl)thiourea","Acta Crystallographica Section E","2007","63","3","o1256","o1257","10.1107/S1600536807005582","","","0.71073","MoKα","","0.0358","0.0329","","","0.0907","0.0927","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212594","14.2806","0.0006","14.1864","0.0006","19.5951","0.0007","90","","111.149","0.003","90","","3702.4","0.3","100","1","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tetra-n-butylammonium iodide","","- C16 H36 I N -","- C16 H36 I N -","- C128 H288 I8 N8 -","8","1","HG2184","Prukała, Wiesław; Marciniec, Bogdan; Kubicki, Maciej","Tetra-<i>n</i>-butylammonium iodide: a space-group revision","Acta Crystallographica Section E","2007","63","3","o1464","o1466","10.1107/S1600536807008446","","","0.71073","MoKα","","0.0308","0.0198","","","0.0511","0.0575","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212595","9.6145","0.0009","18.755","0.004","10.887","0.005","90","","119.96","0.02","90","","1700.8","0.9","291","2","291","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-Benzyl-3,5-diphenyl-1<i>H</i>-pyrazole","","- C22 H18 N2 -","- C22 H18 N2 -","- C88 H72 N8 -","4","1","HG2185","Hai-Ping Huang; Qiong Wu; Li-Xia Liu; Qing-Fu Sun","4-Benzyl-3,5-diphenyl-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2007","63","3","o1473","o1474","10.1107/S1600536807008434","","","0.71073","MoKα","","0.0794","0.0505","","","0.1183","0.1283","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212596","8.1955","0.001","10.5805","0.0013","14.6556","0.0015","104.457","0.009","100.951","0.009","102.729","0.009","1159.3","0.3","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","2-Carbamoyl-3-pyridyl benzoate","","- C13 H10 N2 O3 -","- C13 H10 N2 O3 -","- C52 H40 N8 O12 -","4","2","HG2186","Gilles Gasser; Helen Stoeckli-Evans","2-Carbamoyl-3-pyridyl benzoate","Acta Crystallographica Section E","2007","63","3","o1421","o1422","10.1107/S1600536807008112","","","0.71073","MoKα","","0.0577","0.0555","","","0.1563","0.1593","","","","","","1.091","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212597","11.9699","0.0013","12.3375","0.0015","17.8027","0.0018","90","","100.192","0.008","90","","2587.6","0.5","298","2","298","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","1,9'-Dimethyl-2',4'-diphenyl-4',9'-dihydro-2'H-spiro[indoline-3,3'- thiopyrano[2,3-b]indole]-2-thione","","- C32 H26 N2 S2 -","- C32 H26 N2 S2 -","- C128 H104 N8 S8 -","4","1","HJ3029","Hojabri, Leila; Matloubi, Firouz M.; Khavasi, Hamid Reza","1,9'-Dimethyl-2',4'-diphenyl-4',9'-dihydro-2'<i>H</i>-spiro[indoline-3,3'-thiopyrano[2,3-<i>b</i>]indole]-2-thione","Acta Crystallographica Section E","2007","63","3","o1306","o1307","10.1107/S1600536807006174","","","0.71073","MoKα","","0.0528","0.045","","","0.116","0.1212","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212598","8.3581","0.0004","9.9625","0.0005","10.8064","0.0002","110.517","0.003","108.38","0.002","96.47","0.005","774.13","0.06","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Cyclohexane-1,4-diammonium tetrahydroxotetraborate 2.5-hydrate","","- C6 H25 B4 N4 O11.5 -","- C6 H25 B4 N2 O11.5 -","- C12 H50 B8 N4 O23 -","2","1","HK2187","Chun-Yang Pan; Guo-Ming Wang; Shou-Tian Zheng; Guo-Yu Yang","Cyclohexane-1,4-diammonium tetrahydroxotetraborate 2.5-hydrate","Acta Crystallographica Section E","2007","63","3","o1207","o1209","10.1107/S1600536807005478","","","0.71073","MoKα","","0.0628","0.0493","","","0.1254","0.1349","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212599","7.607","0.0015","15.623","0.003","15.306","0.003","90","","90.16","0.03","90","","1819","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-fluorophenoxy)-N-methylacetamide","","- C9 H10 F N O2 -","- C9 H10 F N O2 -","- C72 H80 F8 N8 O16 -","8","2","HK2190","Zhong-Hua Luo; Shan Liu; Shui-Ping Deng; Hong-Jun Zhu; Hong-Sheng Jia","2-(4-Fluorophenoxy)-<i>N</i>-methylacetamide","Acta Crystallographica Section E","2007","63","3","o1099","o1100","10.1107/S1600536807003376","","","0.71073","MoKα","","0.1279","0.0697","","","0.167","0.194","","","","","","1.015","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212600","13.126","0.003","19.136","0.004","8.771","0.002","90","","102.401","0.004","90","","2151.7","0.8","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(Benzotriazol-1-yl)-1-(4-methylbenzoyl)ethyl 4-ethylbenzoate","","- C25 H23 N3 O3 -","- C25 H23 N3 O3 -","- C100 H92 N12 O12 -","4","1","HK2197","Wu-Lan Zeng; Sai Bi; Jun Wan","2-(Benzotriazol-1-yl)-1-(4-methylbenzoyl)ethyl 4-ethylbenzoate","Acta Crystallographica Section E","2007","63","3","o1076","o1077","10.1107/S1600536807004072","","","0.71073","MoKα","","0.0809","0.054","","","0.1248","0.1392","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212601","5.002","0.0006","29.782","0.004","14.1351","0.0018","90","","92.624","0.003","90","","2103.5","0.5","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(Benzotriazol-1-yl)-1-(4-methylbenzoyl)ethyl 2,4-dichlorobenzoate","","- C23 H17 Cl2 N3 O3 -","- C23 H17 Cl2 N3 O3 -","- C92 H68 Cl8 N12 O12 -","4","1","HK2198","Sai Bi; Wu-Lan Zeng; Jun Wan","2-(Benzotriazol-1-yl)-1-(4-methylbenzoyl)ethyl 2,4-dichlorobenzoate","Acta Crystallographica Section E","2007","63","3","o1078","o1079","10.1107/S1600536807004084","","","0.71073","MoKα","","0.1192","0.0634","","","0.117","0.1414","","","","","","0.995","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212602","4.7","0.0009","9.853","0.002","10.898","0.002","79.04","0.03","81.81","0.03","88.15","0.03","490.41","0.18","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","1-(2,4-Difluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanone","","- C10 H7 F2 N3 O -","- C10 H7 F2 N3 O -","- C20 H14 F4 N6 O2 -","2","1","HK2199","Tao, Xiao; Yuan, Lin; Zhang, Xiao-Qing; Jing, Chen; Wang, Jin-Tang","1-(2,4-Difluorophenyl)-2-(1<i>H</i>-1,2,4-triazol-1-yl)ethanone","Acta Crystallographica Section E","2007","63","3","o1330","o1331","10.1107/S1600536807006113","","","0.71073","MoKα","","0.0642","0.0464","","","0.1176","0.1299","","","","","","1.073","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212603","24.566","0.004","24.566","0.004","7.7555","0.0012","90","","90","","90","","4680.4","1.3","294","2","294","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","[2,5-DBrpyH]2.SnBr6","2,5-Dibromopyridinium hexabromidostannate(IV)","","- C10 H8 Br10 N2 Sn -","- C10 H8 Br10 N2 Sn -","- C80 H64 Br80 N16 Sn8 -","8","0.5","HK2204","Ali, Basem Fares; Al-Far, Rawhi","2,5-Dibromopyridinium hexabromidostannate(IV)","Acta Crystallographica Section E","2007","63","3","m892","m894","10.1107/S1600536807008069","","","0.7107","MoKα","","0.0395","0.0394","","","0.0478","0.0479","","","","","","1.213","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212604","8.6551","0.0003","9.0505","0.0002","9.9267","0.0003","100.643","0.001","95.348","0.001","94.581","0.001","757.13","0.04","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[bis(3-pyridylmethanol-κN)copper(II)]-μ-oxalato- 1κ^2^O^1^,O^2^:2κ^2^O^1'^,O^2'^]","","- C14 H14 Cu N2 O6 -","- C14 H14 Cu N2 O6 -","- C28 H28 Cu2 N4 O12 -","2","1","HK2205","Jašková, Jana; Mikloš, Dušan; Segľa, Peter; Sillanpää, Reijo; Moncol, Jan","<i>catena</i>-Poly[[bis(3-pyridylmethanol-κ<i>N</i>)copper(II)]-μ-oxalato-1κ^2^<i>O</i>^1^,<i>O</i>^2^:2κ^2^<i>O</i>^1'^,<i>O</i>^2'^]","Acta Crystallographica Section E","2007","63","3","m910","m912","10.1107/S1600536807008471","","","0.71073","MoKα","","0.0455","0.0351","","","0.0778","0.1001","","","","","","1.147","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212605","14.264","0.003","6.1442","0.0012","21.134","0.005","90","","90","","90","","1852.2","0.7","294","2","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Bis(2-acetyl-1-naphtholato-κ^2^O,O')copper(II)","","- C24 H18 Cu O4 -","- C24 H18 Cu O4 -","- C96 H72 Cu4 O16 -","4","0.5","HK2206","Rayati, Saeed; Yaftian, Mohammad Reza; Khavasi, Hamid Reza","Bis(2-acetyl-1-naphtholato-κ^2^<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2007","63","3","m898","m899","10.1107/S1600536807008161","","","0.71073","MoKα","","","0.0788","","","","0.2181","","","","","","1.101","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212606","13.319","0.004","6.3601","0.0015","17.331","0.006","90","","100.55","0.03","90","","1443.3","0.8","294","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(4-Fluorophenyl)-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazin-3-one","","- C18 H12 F N O2 -","- C18 H12 F N O2 -","- C72 H48 F4 N4 O8 -","4","1","HK2207","Bazgir, Ayoob; Ghorbani, Hosein","1-(4-Fluorophenyl)-2,3-dihydro-1<i>H</i>-naphtho[1,2-<i>e</i>][1,3]oxazin-3-one","Acta Crystallographica Section E","2007","63","3","o1495","o1496","10.1107/S160053680700829X","","","0.71073","MoKα","","","0.05","","","","0.1183","","","","","","1.126","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212607","8.3463","0.0017","12.336","0.003","27.965","0.006","90","","95.13","0.03","90","","2867.7","1.1","292","2","292","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H20 Cl2 N8 Zn -","- C36 H20 Cl2 N8 Zn -","- C144 H80 Cl8 N32 Zn4 -","4","0.5","HY2031","Feng-Chen Zhou; Wei Fang; En-Jie Dong; Chuan-Bi Li","Dichlorobis(dipyrido[3,2-<i>a</i>:2'3'-<i>c</i>]phenazine-κ^2^<i>N</i>,<i>N</i>)zinc(II)","Acta Crystallographica Section E","2007","63","3","m660","m661","10.1107/S1600536807000050","","","0.71073","MoKα","","0.0301","0.0284","","","0.0804","0.0814","","","","","","1.071","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212608","7.1651","0.0012","13.331","0.002","16.269","0.003","90","","101.012","0.002","90","","1525.4","0.4","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Dichloro(ethanol-κO){(E)-1-[1-(2-pyridyl)ethylidene]thiosemicarbazonato- κ^3^N,N',S}indium(III)","","- C10 H15 Cl2 In N4 O S -","- C10 H15 Cl2 In N4 O S -","- C40 H60 Cl8 In4 N16 O4 S4 -","4","1","HY2043","Fan, Ying-Ju; Wang, Le; Ma, Jian-Ping; Sun, Zhong-Xi","Dichloro(ethanol-κ<i>O</i>){(<i>E</i>)-1-[1-(2-pyridyl)ethylidene]thiosemicarbazonato-κ^3^<i>N</i>,<i>N</i>',<i>S</i>}indium(III)","Acta Crystallographica Section E","2007","63","3","m845","m846","10.1107/S1600536807006290","","","0.71073","MoKα","","0.033","0.0294","","","0.068","0.07","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212609","18.472","0.007","5.824","0.002","23.788","0.009","90","","112.612","0.006","90","","2362.4","1.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(acetato-κO)aquabis[3-(pyrazin-2-yloxy)pyridine-κN]copper(II)","","- C22 H22 Cu N6 O7 -","- C22 H22 Cu N6 O7 -","- C88 H88 Cu4 N24 O28 -","4","0.5","HY2044","Zhao, Hong-Yan; Shi, Jing-Min; Liu, Lian-Dong","Bis(acetato-κ<i>O</i>)aquabis[3-(pyrazin-2-yloxy)pyridine-κ<i>N</i>]copper(II)","Acta Crystallographica Section E","2007","63","3","m824","m825","10.1107/S1600536807007416","","","0.71073","MoKα","","0.0863","0.0571","","","0.1113","0.1223","","","","","","0.978","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212610","12.6748","0.001","9.3292","0.0007","16.2528","0.0017","90","","111.694","0.01","90","","1785.7","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(N,N,N',N'',N''-Pentamethyldiethylenetriamine-κ^3^N,N',N'')(trithiocyanurato- κ^2^N,S)zinc(II)","","- C12 H24 N6 S3 Zn -","- C12 H24 N6 S3 Zn -","- C48 H96 N24 S12 Zn4 -","4","1","HY2046","Marek, Jaromír; Trávníček, Zdeněk; Čermáková, Šárka","(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''-Pentamethyldiethylenetriamine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')(trithiocyanurato-κ^2^<i>N</i>,<i>S</i>)zinc(II)","Acta Crystallographica Section E","2007","63","3","m725","m727","10.1107/S1600536807006484","","","0.71073","MoKα","","0.0474","0.0456","","","0.1168","0.1175","","","","","","1.202","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212611","6.3522","0.0001","15.6712","0.0002","17.994","0.0002","90","","90","","90","","1791.24","0.04","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Benzyl 6,6-dibromo-2β-chloromethyl-2α-methylpenicillanate","","- C15 H14 Br2 Cl N O3 S -","- C15 H14 Br2 Cl N O3 S -","- C60 H56 Br8 Cl4 N4 O12 S4 -","4","1","IM2001","Xi-Zhao Wang; Li-Na Pang; Jun-Zhi Liu; Fang-Gang Sun; Jian-Wu Wang","Benzyl 6,6-dibromo-2β-chloromethyl-2α-methylpenicillanate","Acta Crystallographica Section E","2007","63","3","o1184","o1185","10.1107/S1600536807004606","","","0.71073","MoKα","","0.0323","0.0246","","","0.0535","0.0553","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212612","13.092","0.002","7.0989","0.0009","12.913","0.002","90","","116.321","0.007","90","","1075.7","0.3","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-[(5-Methylthiazol-2-yl)diazenyl]pyrimidine-2,4,6(1H,3H,5H)-trione","","- C8 H7 N5 O3 S -","- C8 H7 N5 O3 S -","- C32 H28 N20 O12 S4 -","4","1","IM2004","Hökelek, Tuncer; Seferoğlu, Zeynel; Şahin, Ertan; Ertan, Nermin","5-[(5-Methylthiazol-2-yl)diazenyl]pyrimidine-2,4,6(1<i>H</i>,3<i>H</i>,5<i>H</i>)-trione","Acta Crystallographica Section E","2007","63","3","o1506","o1508","10.1107/S1600536807009051","","","0.71073","MoKα","","0.1478","0.1064","","","0.3017","0.3406","","","","","","1.139","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212613","12.0742","0.001","17.5445","0.0015","17.6675","0.0016","90","","90","","90","","3742.6","0.6","113","2","113","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Quinidine sesquihydrate","(1S,3R,4S,8R,9S)-4-[hydroxy(5-vinyl-1-azabicyclo[2.2.2]oct-2-yl)methyl]- 6-methoxyquinoline sesquihydrate","","- C20 H27 N2 O3.5 -","- C20 H27 N2 O3.5 -","- C160 H216 N16 O28 -","8","2","IS2114","Min-Jie Guo; Shu-Juan Zhang; Dong-Lan Sun; Zhi Fan","Quinidine sesquihydrate","Acta Crystallographica Section E","2007","63","3","o1483","o1484","10.1107/S1600536807006368","","","0.7107","MoKα","","0.0557","0.0484","","","0.1119","0.116","","","","","","1.101","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212614","25.272","0.005","7.5122","0.0016","13.764","0.003","90","","90","","90","","2613.1","0.9","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Triaqua[2-(6-oxido-4-oxo-3,4-dihydropyimidin-2-ylsulfanyl)acetato]nickel(II) 2.5-hydrate","","- C6 H15 N2 Ni O9.5 S -","- C6 H15 N2 Ni O9.5 S -","- C48 H120 N16 Ni8 O76 S8 -","8","1","IS2132","Jiao, Yan; Pan, Zhao-Rui; Fang, Zhi-Jie; Li, Yi-Zhi; Zheng, He-Gen","Triaqua[2-(6-oxido-4-oxo-3,4-dihydropyimidin-2-ylsulfanyl)acetato]nickel(II) 2.5-hydrate","Acta Crystallographica Section E","2007","63","3","m761","m763","10.1107/S1600536807006149","","","0.71073","MoKα","","0.0425","0.0377","","","0.1085","0.1112","","","","","","0.997","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212615","9.0287","0.0013","25.662","0.004","10.8103","0.0015","90","","113.712","0.002","90","","2293.2","0.6","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(4-Bromophenyl)-3-(1H-1,2,4-triazol-1-yl)propan-1-one","","- C11 H10 Br N3 O -","- C11 H10 Br N3 O -","- C88 H80 Br8 N24 O8 -","8","2","IS2148","Wang, Chen-Yi; Xia, Ping; Han, Zhi-Ping; Shen, Rong-Ming; Cui, Nan","1-(4-Bromophenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2007","63","3","o1238","o1239","10.1107/S1600536807005892","","","0.71073","MoKα","","0.0964","0.0475","","","0.1056","0.1239","","","","","","0.998","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212616","9.768","0.004","11.002","0.005","15.026","0.009","73.84","0.04","71.68","0.04","77.04","0.04","1455.7","1.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[1-(Benzylsulfonyl)-3-(4-nitrophenyl)-1,2,3,4-tetrahydroquinoxalin-2-yl](4- bromophenyl)methanone 2-methylpropanol hemisolvate","","- C30 H27 Br N3 O5.5 S -","- C30 H27 Br N3 O5.5 S -","- C60 H54 Br2 N6 O11 S2 -","2","1","IS2149","Oleg Ya. Borbulevych","[1-(Benzylsulfonyl)-3-(4-nitrophenyl)-1,2,3,4-tetrahydroquinoxalin-2-yl](4-bromophenyl)methanone 2-methylpropanol hemisolvate","Acta Crystallographica Section E","2007","63","3","o1372","o1374","10.1107/S1600536807007143","","","0.71073","MoKα","","0.1077","0.0554","","","0.1389","0.1518","","","","","","0.902","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212617","5.1068","0.0007","6.3725","0.0008","12.29","0.002","103.574","0.0001","91.057","0.002","108.309","0.002","367.26","0.09","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","Diaqua(5-methylpyrazine-2-carboxylato-κ^2^N,O)cobalt(II)","","- C12 H14 Co N4 O6 -","- C12 H14 Co N4 O6 -","- C12 H14 Co N4 O6 -","1","0.5","KJ2044","Fan, Guang; Chen, San-Ping; Gao, Sheng-Li","Diaqua(5-methylpyrazine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>)cobalt(II)","Acta Crystallographica Section E","2007","63","3","m772","m773","10.1107/S1600536807003236","","","0.71073","MoKα","","0.0393","0.0368","","","0.0909","0.093","","","","","","1.046","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212618","10.4122","0.0001","29.041","0.0003","10.1031","0.0001","90","","93.151","0.001","90","","3050.36","0.05","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Tetraphenylphosphonium [N-(2-aminophenyl)-2-(mercaptomethylcarbonylamino)ethanamide(4-)- κ^4^S,N,N',N'']oxorhenate(V)","","- C34 H29 N3 O3 P Re S -","- C34 H29 N3 O3 P Re S -","- C136 H116 N12 O12 P4 Re4 S4 -","4","1","KJ2046","Le Gal, Julien; Benoist, Éric; Gressier, Marie; Bélanger-Gariépy, Francine; Beauchamp, André L.","Tetraphenylphosphonium [<i>N</i>-(2-aminophenyl)-2-(mercaptomethylcarbonylamino)ethanamido(4{-})-κ^4^<i>S</i>,<i>N</i>,<i>N</i>',<i>N</i>'']oxorhenate(V)","Acta Crystallographica Section E","2007","63","3","m865","m867","10.1107/S1600536807008057","","","1.54178","CuKα","","0.0293","0.0262","","","0.0667","0.0681","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212619","13.7077","0.0002","12.5262","0.0002","19.4526","0.0003","90","","109.7","0.001","90","","3144.62","0.09","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Tetraphenylphosphonium [2-(mercaptomethylcarbonylamino)-N-(2-methylaminophenyl)ethanamido(4-)- κ^4^S,N,N',N'']oxorhenate(V)","","- C35 H31 N3 O3 P Re S -","- C35 H31 N3 O3 P Re S -","- C140 H124 N12 O12 P4 Re4 S4 -","4","1","KJ2047","Le Gal, Julien; Benoist, Éric; Gressier, Marie; Bélanger-Gariépy, Francine; Beauchamp, André L.","Tetraphenylphosphonium [2-(mercaptomethylcarbonylamino)-<i>N</i>-(2-methylaminophenyl)ethanamido(4{-})-κ^4^<i>S</i>,<i>N</i>,<i>N</i>',<i>N</i>'']oxorhenate(V)","Acta Crystallographica Section E","2007","63","3","m868","m869","10.1107/S1600536807008070","","","1.54178","CuKα","","0.0382","0.0354","","","0.092","0.0936","","","","","","1.071","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212620","30.815","0.006","8.884","0.002","13.305","0.003","90","","90","","90","","3642.4","1.4","296","2","296","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","3-Acetyl-4-aminoquinoline","","- C11 H10 N2 O -","- C11 H10 N2 O -","- C176 H160 N32 O16 -","16","2","KP2057","Lokaj, Jan; Kettmann, Viktor; Černuchová, Petra; Milata, Viktor; Fronc, Marek","3-Acetyl-4-aminoquinoline","Acta Crystallographica Section E","2007","63","3","o1164","o1166","10.1107/S1600536807004746","","","0.71073","MoKα","","0.1113","0.0633","","","0.2023","0.21","","","","","","0.98","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212621","6.6549","0.0018","7.553","0.002","12.105","0.003","90","","105.964","0.003","90","","585","0.3","103","2","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Methoxypyrrolidine-2,5-dione","","- C5 H7 N O3 -","- C5 H7 N O3 -","- C20 H28 N4 O12 -","4","1","KP2077","Ray J. Butcher; Hijji, Yousef M.; Benjamin, Ellis","1-Methoxypyrrolidine-2,5-dione","Acta Crystallographica Section E","2007","63","3","o1502","o1503","10.1107/S1600536807008549","","","0.71073","MoKα","","0.0371","0.0347","","","0.0942","0.096","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212622","9.874","0.002","15.415","0.003","14.412","0.003","90","","104.17","0.03","90","","2126.9","0.8","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","rac-Diethyl {[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-ylamino](phenyl)methyl}phosphonate","","- C19 H21 F N3 O3 P S -","- C19 H21 F N3 O3 P S -","- C76 H84 F4 N12 O12 P4 S4 -","4","1","KP2082","Han, Feng; Wan, Rong; Zhang, Jin-Jun; Wu, Wen-Yuan; Wang, Jin-Tang","<i>rac</i>-Diethyl {[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-ylamino](phenyl)methyl}phosphonate","Acta Crystallographica Section E","2007","63","3","o1304","o1305","10.1107/S1600536807006629","","","0.71073","MoKα","","0.1535","0.0801","","","0.1817","0.2122","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212623","9.847","0.0017","17.733","0.003","11.146","0.002","90","","105.732","0.003","90","","1873.4","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[dibutyltin(IV)]-μ-3,4,5,6-tetrafluorobenzene-1,2-dicarboxylato- κ^4^O^1^,O^1'^:O^2^,O^2'^]","","- C16 H18 F4 O4 Sn -","- C16 H18 F4 O4 Sn -","- C64 H72 F16 O16 Sn4 -","4","1","KP2085","Yawen Han; Rufen Zhang; Daqi Wang","<i>catena</i>-Poly[[dibutyltin(IV)]-μ-3,4,5,6-tetrafluorobenzene-1,2-dicarboxylato-κ^4^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^2^,<i>O</i>^2'^]","Acta Crystallographica Section E","2007","63","3","m776","m777","10.1107/S1600536807006940","","","0.71073","MoKα","","0.0876","0.0554","","","0.1493","0.1838","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212624","12.9585","0.0011","4.9326","0.0005","15.6749","0.0019","90","","119.398","0.009","90","","872.91","0.17","290","2","290","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1-acenaphthenol","1-acenaphthenol","","- C12 H10 O -","- C12 H10 O -","- C48 H40 O4 -","4","1","KP2086","Marciniak, Bernard","Redetermination of 1-acenaphthenol","Acta Crystallographica Section E","2007","63","3","o1311","o1312","10.1107/S1600536807006952","","","0.71073","MoKα","","0.0432","0.0359","","","0.0965","0.1002","","","","","","1.074","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212625","6.4813","0.0006","9.8306","0.0009","21.623","0.002","90","","90","","90","","1377.7","0.2","298","2","298","2","","","","","","","","4","C m c a","-C 2ac 2","64","","1,2,4-Triazolo[1,5-a]pyrimidin-1-ium chloride","","- C5 H5 Cl N4 -","- C5 H5 Cl N4 -","- C40 H40 Cl8 N32 -","8","","KP2087","Carmen R. Maldonado; Miguel Quirós; Juan M. Salas","1,2,4-Triazolo[1,5-<i>a</i>]pyrimidin-3-ium chloride","Acta Crystallographica Section E","2007","63","3","o1509","o1510","10.1107/S1600536807008641","","","0.71073","MoKα","","0.039","0.036","","","0.09","0.092","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212626","11.8418","0.0002","20.0552","0.0004","14.3436","0.0004","90","","106.571","0.001","90","","3264.98","0.13","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[(naphthaleneacetato)(1H-benzimidazole)]cadmium(II) monohydrate","","- C38 H32 Cd N4 O5 -","- C38 H32 Cd N4 O5 -","- C152 H128 Cd4 N16 O20 -","4","0.5","LH2286","Liu, Ji-Wei; Wu, Song; Duan, Ji-Guo","Bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)bis(naphthalene-2-acetato-κ^2^<i>O</i>,<i>O</i>')cadmium(II) monohydrate","Acta Crystallographica Section E","2007","63","3","m692","m694","10.1107/S1600536807005363","","","0.71073","MoKα","","0.0263","0.0231","","","0.0566","0.0586","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212627","8.786","0.001","11.449","0.001","34.306","0.002","90","","90","","90","","3450.9","0.5","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Guttiferone A","(1R,5R,7R,8S)-3-(3,4-Dihydroxybenzoyl)-4-hydroxy-8-methyl-1,5,7-tris(3- methyl-2-butenyl)-8-(4-methyl-3-pentenyl)bicyclo[3.3.1]non-3-ene-2,9-dione","","- C38 H50 O6 -","- C38 H50 O6 -","- C152 H200 O24 -","4","1","LH2291","Ndjakou Lenta, Bruno; Diderot Tchamo Noungoue; Krishna Prasad Devkota; Patrice Aime Fokou; Silvere Ngouela; Etienne Tsamo; Norbert Sewald","(1<i>R</i>*,5<i>R</i>*,7<i>R</i>*,8<i>S</i>*)-3-(3,4-Dihydroxybenzoyl)-4-hydroxy-8-methyl-1,5,7-tris(3-methyl-2-butenyl)-8-(4-methyl-3-pentenyl)bicyclo[3.3.1]non-3-ene-2,9-dione","Acta Crystallographica Section E","2007","63","3","o1282","o1284","10.1107/S1600536807005776","","","0.7107","MoKα","","0.0717","0.0471","","","0.0968","0.1052","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212628","6.6486","0.0006","7.1156","0.0006","10.9252","0.0011","75.88","0.003","86.265","0.003","70.31","0.004","471.85","0.08","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","3-methylenecyclohexane-1,1-dicarboxylic acid","","- C9 H12 O4 -","- C9 H12 O4 -","- C18 H24 O8 -","2","1","LH2294","Foces-Foces, C.; Rodríguez, M. L.; Pérez-Hernández, N.","Hydrogen bonding in 3-methylenecyclohexane-1,1-dicarboxylic acid","Acta Crystallographica Section E","2007","63","3","o1308","o1310","10.1107/S1600536807006617","","","0.71073","MoKα","","0.0642","0.0515","","","0.1271","0.1449","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212629","12.584","0.002","11.475","0.002","12.914","0.003","90","","90","","90","","1864.8","0.6","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(3R,8S)-[4,7-Diazoniadecane-3,8-diylbis(methyleneoxy)]disulfonate dihydrate","","- C10 H28 N2 O10 S2 -","- C10 H28 N2 O10 S2 -","- C40 H112 N8 O40 S8 -","4","0.5","LH2296","Bai, Guo-Yi; Zhang, Chen-Fang; Simpson, Jim; Chen, Yong; Peng, Hong-Wei","(2<i>R</i>,2'<i>S</i>)-2,2'-(Ethane-1,2-diyldiiminio)bis(butane-2,1-diyl) disulfate dihydrate","Acta Crystallographica Section E","2007","63","3","o1095","o1096","10.1107/S1600536807003480","","","0.71073","MoKα","","0.0521","0.0359","","","0.0919","0.1021","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212630","3.7065","0.0001","14.4963","0.0007","15.4548","0.0008","90","","94.209","0.003","90","","828.16","0.06","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Bromo-3,5-dihydroxybenzoic acid monohydrate","","- C7 H7 Br O5 -","- C7 H7 Br O5 -","- C28 H28 Br4 O20 -","4","1","LH2297","Kirsop, Peter; Storey, John M. D.; Harrison, William T. A.","4-Bromo-3,5-dihydroxybenzoic acid monohydrate","Acta Crystallographica Section E","2007","63","3","o1441","o1443","10.1107/S1600536807003492","","","0.71073","MoKα","","0.0757","0.0487","","","0.0692","0.0756","","","","","","1.079","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212631","15.1645","0.0008","13.1277","0.0007","19.6013","0.001","90","","96.034","0.002","90","","3880.5","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(4-Hydroxycinnamato)[tris(N-methylbenzimidazol-2-ylmethyl)amine]copper(II)] perchlorate dimethylformamide hemisolvate","","- C37.5 H37.5 Cl Cu N7.5 O7.5 -","- C37.5 H37.5 Cl Cu N7.5 O7.5 -","- C150 H150 Cl4 Cu4 N30 O30 -","4","1","LH2300","Hui-Lu Wu; Xing-Ke Ma; Wei-Bing Lv; Peng Liu; Ji-Gang Liu","(4-Hydroxycinnamato)[tris(<i>N</i>-methylbenzimidazol-2-ylmethyl)amine]copper(II) perchlorate dimethylformamide hemisolvate","Acta Crystallographica Section E","2007","63","3","m783","m784","10.1107/S1600536807006605","","","0.71073","MoKα","","0.1263","0.0618","","","0.1672","0.2057","","","","","","0.935","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212632","7.4636","0.0002","7.9944","0.0003","8.4817","0.0003","90.852","0.002","106.903","0.001","90.778","0.002","484.08","0.03","100","2","100","2","","","","","","","","3","P -1","-P 1","2","cyclohexanone-4-propionic acid","3-(4-Oxocyclohexyl)propionic acid monohydrate","","- C9 H16 O4 -","- C9 H16 O4 -","- C18 H32 O8 -","2","1","LH2301","Witko, Stephanie M.; Davison, Mark; Thompson, Hugh W.; Lalancette, Roger A.","3-(4-Oxocyclohexyl)propionic acid monohydrate: hydrogen bonding in the hydrate of a ζ-keto acid","Acta Crystallographica Section E","2007","63","3","o1173","o1175","10.1107/S1600536807004795","","","1.54178","CuKα","","0.033","0.031","","","0.083","0.086","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212633","20.8426","0.0013","7.9413","0.0008","13.5838","0.0009","90","","107.246","0.005","90","","2147.3","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-Diethylamino-3-[(2Z)-3-(6-methoxy-2-naphthyl)prop-2-enoyl]-2H-chromen-2-one","","- C27 H25 N O4 -","- C27 H25 N O4 -","- C108 H100 N4 O16 -","4","1","LH2303","Yathirajan, H. S.; Mayekar, Anil N.; Sarojini, B. K.; Narayana, B.; Bolte, Michael","7-Diethylamino-3-[(2<i>Z</i>)-3-(6-methoxy-2-naphthyl)prop-2-enoyl]-2<i>H</i>-chromen-2-one","Acta Crystallographica Section E","2007","63","3","o1140","o1141","10.1107/S1600536807004771","","","0.71073","MoKα","","0.0707","0.0537","","","0.1437","0.1508","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212634","13.01","0.003","17.155","0.003","13.438","0.003","90","","105.24","0.03","90","","2893.7","1.1","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","bis(acetonitrile-κN)octa-μ~3~selenido-tetrakis(triethylphosphine- κP)hexarhenium(III)","","- C28 H66 F12 N2 P4 Re6 Sb2 Se8 -","- C28 H66 F12 N2 P4 Re6 Sb2 Se8 -","- C56 H132 F24 N4 P8 Re12 Sb4 Se16 -","2","0.5","LH2304","Orto, Peter J; Nichol, Gary S; Zheng, Zhiping","Redetermination of bis(acetonitrile-κ<i>N</i>)octa-μ~3~-selenido-tetrakis(triethylphosphine-κ<i>P</i>)hexarhenium(III) at 150K","Acta Crystallographica Section E","2007","63","3","m678","m679","10.1107/S1600536807004989","","","0.71073","MoKα","","0.0374","0.0235","","","0.0413","0.0448","","","","","","1.144","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212635","6.3457","0.0002","12.053","0.0004","14.1034","0.0005","90","","90","","90","","1078.69","0.06","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2,4-Dimethyl-3,4-<i>O</i>-isopropylidene-L-arabinono lactone","","- C10 H16 O5 -","- C10 H16 O5 -","- C40 H64 O20 -","4","1","LH2305","Booth, Kathrine V.; Watkin, David J.; Jenkinson, Sarah F.; Fleet, George W. J.","2,4-Dimethyl-3,4-<i>O</i>-isopropylidene-<small>L</small>-arabinono-1,5-lactone","Acta Crystallographica Section E","2007","63","3","o1128","o1130","10.1107/S160053680700476X","","","0.71073","MoKα","","0.0421","0.0384","","0.1016","0.0993","0.1016","","","","","","0.8603","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212636","8.6169","0.0009","11.8268","0.0013","13.338","0.0011","90","","119.472","0.005","90","","1183.4","0.2","299","2","299","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","μ-Oxalato-κ^4^O,O':O'',O'''-bis[chloro(1,10-phenanthroline- κ^2^N,N')copper(II)]","","- C26 H16 Cl2 Cu2 N4 O4 -","- C26 H16 Cl2 Cu2 N4 O4 -","- C52 H32 Cl4 Cu4 N8 O8 -","2","0.5","LH2306","Wang, Min; Hu, Bo; Deng, Xiao-Tao; Wang, Cheng-Gang","μ-Oxalato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''-bis[chloro(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)]","Acta Crystallographica Section E","2007","63","3","m710","m711","10.1107/S1600536807005806","","","0.71073","MoKα","","0.0548","0.0433","","","0.0995","0.1051","","","","","","1.081","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212637","12.9897","0.001","24.0016","0.0015","15.9688","0.0011","90","","112.322","0.002","90","","4605.6","0.6","113","2","113","2","","","","","","","","3","P 1 21 1","P 2yb","4","","2-[(2R,3S,4S,5S)-3,4-Benzyloxy-2,5-bis-trityloxymethyl-tetrahydrofuran-2- yloxy]-3,4,5-tribenzyloxy-6-(trityloxymethyl)tetrahydropyran‒methanol‒ 2-butanone (1/1/0.75)","","- C108 H104 O12.75 -","- C108.001 H104.004 O12.751 -","- C216.002 H208.008 O25.502 -","2","1","LH2308","Zi-Sheng Wu; Chong-Bo Liu; Zhi-Jie Fang; Yuan-Xing Wang; Hui-Liang Wen","2-[(2<i>R</i>,3<i>S</i>,4<i>S</i>,5<i>S</i>)-3,4-Benzyloxy-2,5-bis(trityloxymethyl)tetrahydrofuran-2-yloxy]-3,4,5-tribenzyloxy-6-(trityloxymethyl)tetrahydropyran‒methanol‒2-butanone (1/1/0.75)","Acta Crystallographica Section E","2007","63","3","o1471","o1472","10.1107/S1600536807007362","","","0.7107","MoKα","","0.0641","0.057","","","0.1624","0.169","","","","","","1.075","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212638","13.2197","0.0007","18.4067","0.001","6.9874","0.0004","90","","90.201","0.001","90","","1700.24","0.16","90","2","90","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aqua[2,6-bis(pyridin-2-yl)pyridin-4-ol]sulfatocopper(II) dihydrate","","- C15 H17 Cu N3 O8 S -","- C15 H17 Cu N3 O8 S -","- C60 H68 Cu4 N12 O32 S4 -","4","1","LH2311","Ouellette, Wayne; Zubieta, Jon","Aqua[2,6-bis(pyridin-2-yl)pyridin-4-ol]sulfatocopper(II) dihydrate","Acta Crystallographica Section E","2007","63","3","m908","m909","10.1107/S1600536807008914","","","0.71073","MoKα","","0.0478","0.0392","","","0.0901","0.0937","","","","","","1.121","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212639","7.1876","0.0001","7.5574","0.0001","9.911","0.0002","90","","103.031","0.001","90","","524.497","0.015","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Rhodanine","","- C3 H3 N O S2 -","- C3 H3 N O S2 -","- C12 H12 N4 O4 S8 -","4","1","LH2312","Ng, Seik Weng","Redetermination of rhodanine at 173 K","Acta Crystallographica Section E","2007","63","3","o1363","o1364","10.1107/S1600536807007374","","","0.71073","MoKα","","0.021","0.02","","","0.057","0.058","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212640","8.1771","0.0015","15.5882","0.0003","10.1816","0.0019","90","","98.526","0.003","90","","1283.5","0.3","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-bromo-2-p-tolylisoindoline-1,3-dione","","- C15 H10 Br N O2 -","- C15 H10 Br N O2 -","- C60 H40 Br4 N4 O8 -","4","1","LH2315","Li, Jian; Liang, Zu-Pei; Sun Xiao-Zheng","5-Bromo-2-<i>p</i>-tolylisoindoline-1,3-dione","Acta Crystallographica Section E","2007","63","3","o1504","o1505","10.1107/S1600536807008975","","","0.71073","MoKα","","0.0856","0.0359","","","0.081","0.101","","","","","","0.998","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212641","14.131","0.002","7.8128","0.0006","12.841","0.002","90","","109.92","0.02","90","","1332.9","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-6-methyl-2-oxo-3-[1-(p-tolyliminio)ethyl]-2H-pyran-4-olate","","- C15 H15 N O3 -","- C15 H15 N O3 -","- C60 H60 N4 O12 -","4","1","LN3035","Djedouani, Amel; Bendaas, Abderrahmen; Boufas, Sihem; Allain, Magali; Bouet, Gilles; Khan, Mustayeen","Zwitterionic (<i>E</i>)-6-methyl-2-oxo-3-[1-(<i>p</i>-tolyliminio)ethyl]-2<i>H</i>-pyran-4-olate","Acta Crystallographica Section E","2007","63","3","o1271","o1273","10.1107/S1600536807006083","","","0.71073","MoKα","","","0.0402","","","","0.1099","","","","","","0.884","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212642","12.469","0.005","16.47","0.007","7.943","0.003","90","","106.691","0.005","90","","1562.5","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,3-Dimethyl-1-[2-(4-pyridyloxy)ethyl]imidazol-1-ium hexafluorophosphate","","- C12 H16 F6 N3 O P -","- C12 H16 F6 N3 O P -","- C48 H64 F24 N12 O4 P4 -","4","1","LW2001","Chen, Feng-Xiang; Kong, Yi; Han, Hui-Jing; Zhang, Yi-Qun; Xie, Mei-Ran","2,3-Dimethyl-1-[2-(4-pyridyloxy)ethyl]imidazol-1-ium hexafluorophosphate","Acta Crystallographica Section E","2007","63","3","o1136","o1137","10.1107/S1600536807004862","","","0.71073","MoKα","","0.0957","0.0747","","","0.1817","0.1984","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212643","12.072","0.0006","8.5169","0.0007","16.7544","0.0018","90","","109.243","0.006","90","","1626.4","0.2","290","2","290","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N-Diisobutyl-N'-(2-thienylcarbonyl)thiourea","","- C14 H22 N2 O S2 -","- C14 H22 N2 O S2 -","- C56 H88 N8 O4 S8 -","4","1","LW2002","Ligia R. Gomes.; Luis M. N. B. F. Santos; Schröder, B.; Wagner, Ch.","<i>N</i>,<i>N</i>-Diisobutyl-<i>N</i>'-(2-thienylcarbonyl)thiourea","Acta Crystallographica Section E","2007","63","3","o1158","o1159","10.1107/S1600536807004850","","","0.71073","MoKα","","0.0626","0.0406","","","0.0945","0.1066","","","","","","1.079","","","","has coordinates,has disorder","176787","2020-10-21","18:00:00",""
"2212644","5.1389","0.0005","8.8515","0.001","20.057","0.002","90","","93.916","0.006","90","","910.2","0.16","150","1","150","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","7-methoxy-2-oxo-2H-chromene-3-carboxylic acid","","- C11 H8 O5 -","- C11 H8 O5 -","- C44 H32 O20 -","4","1","LW2004","Bardajee, Ghasem Rezanejade; Winnik, Mitchell A.; Lough, Alan J.","7-Methoxy-2-oxo-2<i>H</i>-chromene-3-carboxylic acid","Acta Crystallographica Section E","2007","63","3","o1269","o1270","10.1107/S1600536807006241","","","0.71073","MoKα","","0.1238","0.0596","","","0.135","0.1685","","","","","","0.999","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212645","6.859","0.002","14.63","0.003","16.129","0.003","90","","107.372","0.002","90","","1544.7","0.6","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Disodium bis(2-aminopyridinium) hexahydrogen hexamolybdonickelate(II) dihydrate","disodium bis(2-aminopyridinium) hexa-μ~3~-hydroxido-hexa-μ~2~oxido-dodecaoxido-hexamolybdonickelate(II) dihydrate","","- C10 H24 Mo6 N4 Na2 Ni O26 -","- C10 H24 Mo6 N4 Na2 Ni O26 -","- C20 H48 Mo12 N8 Na4 Ni2 O52 -","2","0.5","MG2019","Hong Liu; Lin Xu","Disodium bis(2-aminopyridinium) hexahydrogen hexamolybdonickelate(II) dihydrate","Acta Crystallographica Section E","2007","63","3","m872","m874","10.1107/S1600536807008367","","","0.71069","MoKα","","0.0479","0.0299","","","0.0556","0.0594","","","","","","0.968","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212646","8.166","0.003","10.32","0.004","10.696","0.004","99.04","0.005","108.302","0.005","102.979","0.005","808.3","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-(3-Chlorophenyl)-2-cyano-3-(4-hydroxy-3-methoxy-2-nitrophenyl)prop-2-enamide","","- C17 H12 Cl N3 O5 -","- C17 H12 Cl N3 O5 -","- C34 H24 Cl2 N6 O10 -","2","1","NC2026","Xian-Ming Zheng; Wei-Xiao Hu; Feng Xu","<i>N</i>-(3-Chlorophenyl)-2-cyano-3-(4-hydroxy-3-methoxy-2-nitrophenyl)prop-2-enamide","Acta Crystallographica Section E","2007","63","3","o1317","o1318","10.1107/S1600536807006873","","","0.71073","MoKα","","0.105","0.0912","","","0.2412","0.2564","","","","","","1.007","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212647","15.3016","0.0002","9.6296","0.0001","20.2624","0.0002","90","","112.516","0.0008","90","","2758.05","0.06","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(μ-N-tert-Butyl-2-{N-[2-(dimethylamino)ethyl]-N- methylamino}ethanaminato)dilithium(I)","","- C22 H52 Li2 N6 -","- C22 H52 Li2 N6 -","- C88 H208 Li8 N24 -","4","1","NC2027","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","Bis(μ-<i>N</i>-<i>tert</i>-butyl-2-{<i>N</i>-[2-(dimethylamino)ethyl]-<i>N</i>-methylamino}ethanaminato)dilithium(I)","Acta Crystallographica Section E","2007","63","3","m722","m724","10.1107/S1600536807006587","","","0.71073","MoKα","","0.0577","0.0506","","","0.1391","0.146","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212648","22.7712","0.0003","15.6704","0.0003","21.9311","0.0005","90","","116.054","0.001","90","","7030.5","0.2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetra-μ~3~-iodo-tetrakis[(cyclohexyldiphenylphosphine-κP)copper(I)]","","- C72 H84 Cu4 I4 P4 -","- C72 H84 Cu4 I4 P4 -","- C288 H336 Cu16 I16 P16 -","4","0.5","NG2211","Zaki S. Seddigi; G. M. Golzar Hossain; Afroza Banu","Tetra-μ~3~-iodo-tetrakis[(cyclohexyldiphenylphosphine-κ<i>P</i>)copper(I)]","Acta Crystallographica Section E","2007","63","3","m756","m758","10.1107/S1600536807006204","","","0.71073","MoKα","","0.0841","0.0608","","","0.1185","0.1254","","","","","","1.207","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212649","10.71","0.003","14.041","0.004","16.852","0.005","90","","95.911","0.004","90","","2520.7","1.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chlorobis(2-chlorobenzyl)(4-ethylpiperazine-1-dithiocarbamato-κ^2^S,S')tin(IV)","","- C21 H25 Cl3 N2 S2 Sn -","- C21 H25 Cl3 N2 S2 Sn -","- C84 H100 Cl12 N8 S8 Sn4 -","4","1","NG2212","Jun-Ying Li; Tian-Duo Li","Chlorobis(2-chlorobenzyl)(4-ethylpiperazine-1-dithiocarbamato-κ^2^<i>S</i>,<i>S</i>')tin(IV)","Acta Crystallographica Section E","2007","63","3","m708","m709","10.1107/S1600536807005600","","","0.71073","MoKα","","0.0694","0.0395","","","0.085","0.1032","","","","","","1.005","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212650","5.9785","0.0003","10.1376","0.0005","11.1811","0.0005","104.34","0.0005","99.926","0.0005","105.293","0.0005","612.47","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Poly[[tetraaqua-μ~2~-oxalato-bis(μ~3~-pyridine-3,4-dicarboxylato- κ^4^O,O':O'':O''')diyttrium(III)] trihydrate]","","- C16 H20 N2 O19 Y2 -","- C16 H18 N2 O19 Y2 -","- C16 H18 N2 O19 Y2 -","1","0.5","NG2213","Bao-Xia Dong; Jun Peng","Poly[[tetraaqua-μ~2~-oxalato-bis(μ~3~-pyridine-3,4-dicarboxylato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'':<i>O</i>''')diyttrium(III)] trihydrate]","Acta Crystallographica Section E","2007","63","3","m689","m691","10.1107/S1600536807005594","","","0.71073","MoKα","","0.0373","0.0353","","","0.093","0.0939","","","","","","1.042","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212651","9.7958","0.0009","10.5049","0.0011","14.0597","0.0014","90","","104.499","0.002","90","","1400.7","0.2","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis{μ-N-[(N,N-dimethylamino)dimethylsilyl]-2,6-dimethylanilido}lithium(I)","","- C24 H42 Li2 N4 Si2 -","- C24 H42 Li2 N4 Si2 -","- C48 H84 Li4 N8 Si4 -","2","0.5","NG2214","Guang-Ming Ren; Dong-Lin Shang; Jian-Ping Guo","Bis{μ-<i>N</i>-[(<i>N</i>,<i>N</i>-dimethylamino)dimethylsilyl]-2,6-dimethylanilido}lithium(I)","Acta Crystallographica Section E","2007","63","3","m793","m794","10.1107/S1600536807006460","","","0.71073","MoKα","","0.0875","0.0813","","","0.1667","0.1701","","","","","","1.278","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212652","6.5093","0.0002","12.5329","0.0003","11.2873","0.0003","90","","97.0816","0.0016","90","","913.8","0.04","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Piperazinium hydrogenarsenate monohydrate","","- C4 H15 As N2 O5 -","- C4 H15 As N2 O5 -","- C16 H60 As4 N8 O20 -","4","1","NG2219","Wilkinson, Hazel S.; Harrison, William T. A.","Piperazinium hydrogenarsenate monohydrate","Acta Crystallographica Section E","2007","63","3","m905","m907","10.1107/S1600536807007763","","","0.71073","MoKα","","0.0231","0.0191","","","0.0472","0.0491","","","","","","1.091","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212653","11.217","0.002","22.171","0.004","16.594","0.003","90","","107.27","0.03","90","","3940.7","1.4","193","2","193","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Bis[1,2(η^5^)-pentamethylcyclopentadienyl]dipyridine-3κN,4κN-tetra-μ~3~- sulfido-tetrahedro-dimolybdenum(V)dicopper(I) bis(perchlorate)","","- C30 H40 Cl2 Cu2 Mo2 N2 O8 S4 -","- C30 H40 Cl2 Cu2 Mo2 N2 O8 S4 -","- C120 H160 Cl8 Cu8 Mo8 N8 O32 S16 -","4","1","NG2220","Ren, Zhi-Gang; Lang, Jian-Ping","Bis[1,2(η^5^)-pentamethylcyclopentadienyl]dipyridine-3κ<i>N</i>,4κ<i>N</i>-tetra-μ~3~-sulfido-<i>tetrahedro</i>-dimolybdenum(V)dicopper(I) bis(perchlorate)","Acta Crystallographica Section E","2007","63","3","m837","m839","10.1107/S1600536807007696","","","0.71073","MoKα","","0.0403","0.0361","","","0.0872","0.0896","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212654","13.6125","0.0017","7.5417","0.0009","23.135","0.003","90","","90","","90","","2375.1","0.5","298","","298","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis[2-(2,4-dioxopentan-3-ylidene-κO)-1-(4-methoxyphenyl)hydrazinato- κN^1^]copper(II)","","- C24 H26 Cu N4 O6 -","- C24 H26 Cu N4 O6 -","- C96 H104 Cu4 N16 O24 -","4","0.5","OM2076","Mac-Leod-Carey, Desmond A.; Bustos, Carlos; Schott, Eduardo; Alvarez-Thon, Luis; Fuentealba, Mauricio","Bis[2-(2,4-dioxopentan-3-ylidene-κ<i>O</i>)-1-(4-methoxyphenyl)hydrazinato-κ<i>N</i>^1^]copper(II)","Acta Crystallographica Section E","2007","63","3","m670","m672","10.1107/S1600536806053396","","","0.71073","MoKα","","0.0646","0.0447","","","0.1115","0.1218","","","","","","1.085","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212655","7.5276","0.001","7.6708","0.0009","10.6002","0.0013","83.989","0.001","75.353","0.002","60.918","0.001","517.41","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","[N-(Phosphonomethyl)ethylammonio]methylphosphonate","","- C5 H15 N O6 P2 -","- C5 H15 N O6 P2 -","- C10 H30 N2 O12 P4 -","2","1","OM2087","Shao-Ming Ying; Jun-Yue Lin; Guang-Pei Zhou; Qiu-Yan Luo; Jian-Hong Wu","[<i>N</i>-(Phosphonomethyl)ethylammonio]methylphosphonate","Acta Crystallographica Section E","2007","63","3","o1153","o1154","10.1107/S1600536807004461","","","0.71073","MoKα","","0.0627","0.048","","","0.1158","0.1286","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212656","9.5455","0.0002","9.35","0.0002","15.3899","0.0003","90","","95.617","0.001","90","","1366.96","0.05","100","0.1","297","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5-[(4-Methylphenyl)methyl]benzene-1,2,4-tricarbonitrile","","- C17 H11 N3 -","- C17 H11 N3 -","- C68 H44 N12 -","4","1","OM2090","Zhi-Feng Lu; Jian-Hua Xu; Jeannie Bee-Jan Teh; Hoong-Kun Fun","5-[(4-Methylphenyl)methyl]benzene-1,2,4-tricarbonitrile","Acta Crystallographica Section E","2007","63","3","o1230","o1231","10.1107/S1600536807005387","","","0.71073","MoKα","","0.0612","0.0477","","","0.1353","0.1444","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212657","18.412","0.002","15.396","0.002","9.236","0.001","90","","101.02","0.01","90","","2569.9","0.5","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-[4-(Diethylamino)phenyl]-1-ethylimidazo[4,5-f][1,10]phenanthroline","","- C33 H25 N5 -","- C33 H25 N5 -","- C132 H100 N20 -","4","1","OM2095","Min Sun; Guang Chen; Bao-Ping Ling; Yu-Xia Liu","2-[4-(Diethylamino)phenyl]-1-ethylimidazo[4,5-<i>f</i>][1,10]phenanthroline","Acta Crystallographica Section E","2007","63","3","o1210","o1211","10.1107/S1600536807005533","","","0.71073","MoKα","","0.2602","0.0682","","","0.0604","0.095","","","","","","0.919","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212658","17.21","0.004","11.629","0.003","23.205","0.006","90","","102.507","0.015","90","","4534","2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(3-Amino-4-chlorobenzoato)triphenyltin(IV)","","- C25 H20 Cl N O2 Sn -","- C25 H20 Cl N O2 Sn -","- C200 H160 Cl8 N8 O16 Sn8 -","8","1","OM2096","Aziz-ur-Rehman; Ali, Saqib; Shahzadi, Saira; Parvez, Masood","(3-Amino-4-chlorobenzoato)triphenyltin(IV)","Acta Crystallographica Section E","2007","63","3","m746","m748","10.1107/S1600536807005855","","","0.71073","MoKα","","0.055","0.034","","","0.074","0.082","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212659","7.8425","0.0014","9.3746","0.0017","10.6425","0.0018","86.678","0.004","71.388","0.003","81.038","0.004","732.4","0.2","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","1-(3-Methylbenzoyl)-3-(2-methylphenyl)thiourea","","- C16 H16 N2 O S -","- C16 H16 N2 O S -","- C32 H32 N4 O2 S2 -","2","1","OM2100","Saeed, Aamer; Flörke, Ulrich","1-(3-Methylbenzoyl)-3-(2-methylphenyl)thiourea","Acta Crystallographica Section E","2007","63","3","o1390","o1392","10.1107/S1600536807007519","","","0.71073","MoKα","","0.0899","0.0567","","","0.1401","0.1521","","","","","","0.926","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212660","10.4344","0.0005","10.4344","0.0005","26.324","0.003","90","","90","","120","","2482.1","0.3","291","2","291","2","","","","","","","","6","P 32","P 32","145","","tris(2,2'-bipyridyl-κ^2^N,N')copper(II) hexafluoridophosphate","","- C30 H24 Cu F12 N6 P2 -","- C30 H24 Cu F12 N6 P2 -","- C90 H72 Cu3 F36 N18 P6 -","3","1","OM2101","Wang, Li; Yang, Xue-Yun; Huang, Wei","Tris(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')copper(II) hexafluoridophosphate","Acta Crystallographica Section E","2007","63","3","m835","m836","10.1107/S160053680700757X","","","0.71073","MoKα","","0.0947","0.0636","","","0.1322","0.1446","","","","","","0.935","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212661","11.0611","0.001","12.6061","0.0009","7.8818","0.0006","90","","91.19","0.008","90","","1098.78","0.15","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-Bis(hydrogen maleato-κO)bis(pyridine-2-carboxamide-κ^2^N^1^,O)copper(II)","","- C20 H18 Cu N4 O10 -","- C20 H18 Cu N4 O10 -","- C40 H36 Cu2 N8 O20 -","2","0.5","OM2103","Sieroń, Lesław","<i>trans</i>-Bis(hydrogen maleato-κ<i>O</i>)bis(pyridine-2-carboxamide-κ^2^<i>N</i>^1^,<i>O</i>)copper(II)","Acta Crystallographica Section E","2007","63","3","m862","m864","10.1107/S1600536807008008","","","0.71073","MoKα","","0.0286","0.0233","","","0.0688","0.0721","","","","","","1.139","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212662","16.839","0.004","11.12","0.003","6.693","0.002","90","","101.11","0.03","90","","1229.8","0.6","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","disodium 4-nitrophenyl phosphate trihydrate","Disodium 4-nitrophenyl phosphate trihydrate","","- C6 H10 N Na2 O9 P -","- C6 H10 N Na2 O9 P -","- C24 H40 N4 Na8 O36 P4 -","4","1","OM2104","Marian Kuczek; Bryndal, Iwona; Joannna Malinowska; Lis, Tadeusz","Disodium 4-nitrophenyl phosphate trihydrate","Acta Crystallographica Section E","2007","63","3","m889","m891","10.1107/S160053680700801X","","","1.5418","CuKα","","0.0481","0.0376","","","0.0924","0.0983","","","","","","1.006","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212663","6.0259","0.0004","15.6356","0.0009","16.0117","0.0011","90","","90","","90","","1508.6","0.17","180","2","180","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1S,3R,6S,7R)-3,7-Dichloro-trans-himachalane","","- C15 H26 Cl2 -","- C15 H26 Cl2 -","- C60 H104 Cl8 -","4","1","OM2105","Ourhriss, Najia; Mazoir, Noureddine; Daran, Jean-Claude; Berraho, Moha; Benharref, Ahmed","(1<i>S</i>,3<i>R</i>,6<i>S</i>,7<i>R</i>)-3,7-Dichloro-<i>trans</i>-himachalane","Acta Crystallographica Section E","2007","63","3","o1497","o1499","10.1107/S1600536807008409","","","0.71073","MoKα","","0.0386","0.0314","","","0.0805","0.09","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212664","8.6689","0.0014","17.025","0.002","30.072","0.004","90","","96.779","0.005","90","","4407.2","1.1","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6,7,9,10,17,18,20,21,28,29,31,32,39,40,42,43-hexadecahydro- 16,44:22,38-di(ethanooxyethano)-5,8,11,19,27,30,33,41-octaoxa- 16,22,38,44-tetraazatetrabenzo[h,q,z,i~1~]cyclohexatriacontine","","- C48 H64 N4 O10 -","- C48 H64 N4 O10 -","- C192 H256 N16 O40 -","4","1","PK2002","Smith, Gary L. N.; Rocher, Nathalie M.; Powell, Douglas R.; Taylor, Richard W.","6,7,9,10,17,18,20,21,28,29,31,32,39,40,42,43-Hexadecahydro-16,44:22,38-di(ethanooxyethano)-5,8,11,19,27,30,33,41-octaoxa-16,22,38,44-tetraazatetrabenzo[<i>h</i>,<i>q</i>,<i>z</i>,<i>i</i>~1~]cyclohexatriacontine: a benzoannelated tricyclic cryptand","Acta Crystallographica Section E","2007","63","3","o1253","o1255","10.1107/S160053680700640X","","","0.71073","MoKα","","0.05","0.043","","","0.121","0.127","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212665","9.6728","0.0019","15.004","0.003","14.73","0.003","90","","100.04","0.03","90","","2105","0.8","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichloridobis(1,10-phenanthroline-κ^2^N,N')tungsten(II)","","- C24 H16 Cl2 N4 W -","- C24 H16 Cl2 N4 W -","- C96 H64 Cl8 N16 W4 -","4","1","PK2005","Wei Xu; Jian-Li Lin","Dichloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')tungsten(II)","Acta Crystallographica Section E","2007","63","3","m859","m861","10.1107/S1600536807008148","","","0.71073","MoKα","","0.0394","0.0286","","","0.057","0.06","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212666","8.2647","0.0009","14.085","0.0011","12.115","0.0014","90","","95.573","0.009","90","","1403.6","0.2","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(±)-Methyl 1-oxo-1<i>H</i>-spiro[benzo[c]pyran-3(4H),1'-cyclohexane]-4-carboxylate","","- C16 H18 O4 -","- C16 H18 O4 -","- C64 H72 O16 -","4","1","PR2001","Öztürk Yıldırım, Sema; Akkurt, Mehmet; Bogdanov, Milen G.; Kandinska, Meglena I.; Kazak, Canan","(±)-Methyl 1-oxo-1<i>H</i>-spiro[benzo[<i>c</i>]pyran-3(4<i>H</i>),1'-cyclohexane]-4-carboxylate","Acta Crystallographica Section E","2007","63","3","o1321","o1323","10.1107/S1600536807006861","","","0.71073","MoKα","","0.0943","0.0351","","","0.0592","0.0672","","","","","","0.845","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212667","5.27604","0.0001","8.627","0.00016","15.0058","0.0003","90","","94.8879","0.0019","90","","680.53","0.02","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Pyridazinium perchlorate","","- C4 H5 Cl N2 O4 -","- C4 H5 Cl N2 O4 -","- C16 H20 Cl4 N8 O16 -","4","1","PV2002","Sieroń, Lesław","Pyridazinium perchlorate","Acta Crystallographica Section E","2007","63","3","o1199","o1200","10.1107/S1600536807005569","","","0.71073","MoKα","","0.0323","0.0307","","","0.0827","0.0837","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212668","16.035","0.004","5.0473","0.0014","25.06","0.007","90","","95.558","0.004","90","","2018.7","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[diiodidomercury(II)]-μ-N,N'-p-phenylene-bis(pyridine-3- carboxamide)-k^2^N:N']","","- C18 H14 Hg I2 N4 O2 -","- C18 H14 Hg I2 N4 O2 -","- C72 H56 Hg4 I8 N16 O8 -","4","0.5","PV2003","Zhu, Ying-Gui; Gao, Feng","<i>catena</i>-Poly[[diiodidomercury(II)]-μ-<i>N</i>,<i>N</i>'-<i>p</i>-phenylenebis(pyridine-3-carboxamide)-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","3","m778","m779","10.1107/S160053680700709X","","","0.71073","MoKα","","0.0372","0.0344","","","0.0814","0.0829","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212669","10.304","0.0002","10.97","0.0003","25.673","0.0007","86.0983","0.0011","80.6997","0.0016","81.6392","0.0015","2830.41","0.12","150","1","150","1","","","","","","","","3","P -1","-P 1","2","","7,12-epoxy-6a,6b,7,12,12a,12b-hexahydrodinaphtho[1,2-b;2,3-d]furan","","- C20 H16 O2 -","- C20 H16 O2 -","- C160 H128 O16 -","8","4","PV2004","Lough, Alan J.; Allen, Anna; Tam, William","Cyclodimerization product of benzooxanorbornadiene","Acta Crystallographica Section E","2007","63","3","o1462","o1463","10.1107/S160053680700699X","","","0.71073","MoKα","","0.151","0.0598","","","0.124","0.1623","","","","","","0.973","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212670","8.0092","0.0011","9.7882","0.0013","24.937","0.003","90","","106.069","0.004","90","","1878.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Anilino-4,6-dimethylpyrimidinium p-toluenesulfonate","","- C19 H21 N3 O3 S -","- C19 H21 N3 O3 S -","- C76 H84 N12 O12 S4 -","4","1","RZ2098","Jia-Cheng Li; Yu-Hong Feng; Qiang Lin; De-La Zhang","2-Anilino-4,6-dimethylpyrimidinium <i>p</i>-toluenesulfonate","Acta Crystallographica Section E","2007","63","3","o1162","o1163","10.1107/S1600536807004722","","","0.71073","MoKα","","0.0565","0.0454","","","0.1182","0.1261","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212671","8.3028","0.0008","18.0664","0.0017","13.7999","0.0013","90","","100.954","0.002","90","","2032.3","0.3","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(2,4-Dichloro-6-methylphenoxy)-3-isopropyl-5,6,7,8- tetrahydrobenzothieno[2,3-d]pyrimidin-4(3H)-one","","- C20 H20 Cl2 N2 O2 S -","- C20 H20 Cl2 N2 O2 S -","- C80 H80 Cl8 N8 O8 S4 -","4","1","RZ2107","Zheng, Ai-Hua; Long, Ji-Yin; Zeng, Xiao-Hua; Wang, Hong-Mei","2-(2,4-Dichloro-6-methylphenoxy)-3-isopropyl-5,6,7,8-tetrahydrobenzothieno[2,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","3","o1142","o1144","10.1107/S1600536807004709","","","0.71073","MoKα","","0.061","0.0465","","","0.1316","0.1393","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212672","18.9035","0.0004","5.167","0.0001","17.1558","0.0003","90","","90.069","0.001","90","","1675.68","0.06","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4'-(4-Methoxyphenyl)-2,2':6',2''-terpyridine","","- C22 H17 N3 O -","- C22 H17 N3 O -","- C88 H68 N12 O4 -","4","1","RZ2108","Arockiam Anthonysamy; Sengottuvelan Balasubramanian; K. Chinnakali; Hoong-Kun Fun","4'-(4-Methoxyphenyl)-2,2':6',2''-terpyridine","Acta Crystallographica Section E","2007","63","3","o1148","o1150","10.1107/S1600536807003674","","","0.71073","MoKα","","0.0871","0.056","","","0.1488","0.1728","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212673","10.564","0.0011","7.0698","0.0007","13.3651","0.0014","90","","100.378","0.002","90","","981.85","0.17","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(5,5-dimethyl-2-thioxo-1,3,2-dioxaphosphinan-2-yl)piperazine","","- C14 H28 N2 O4 P2 S2 -","- C14 H28 N2 O4 P2 S2 -","- C28 H56 N4 O8 P4 S4 -","2","0.5","RZ2116","Ming-Liang Chen; De-Jun Xiong; Bo Hu; Hai-Bing Li","<i>N</i>,<i>N</i>'-Bis(5,5-dimethyl-2-thioxo-1,3,2-dioxaphosphinan-2-yl)piperazine","Acta Crystallographica Section E","2007","63","3","o1192","o1193","10.1107/S1600536807005430","","","0.71073","MoKα","","0.036","0.0344","","","0.0922","0.0935","","","","","","1.088","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212674","8.8952","0.0004","23.8304","0.0012","8.5796","0.0004","90","","102.616","0.003","90","","1774.76","0.15","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[2,2'-bipyridine-κ^2^N,N')manganese(II)]-μ-3,5- dinitro-2-oxidobenzoato-κ^4^O,O':O',O^2^]","","- C17 H10 Mn N4 O7 -","- C17 H10 Mn N4 O7 -","- C68 H40 Mn4 N16 O28 -","4","1","RZ2117","Wen-Dong Song; Xian-Xia Guo; Rong-Fa, Guo","<i>catena</i>-Poly[[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-μ-3,5-dinitro-2-oxidobenzoato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>',<i>O</i>^2^]","Acta Crystallographica Section E","2007","63","3","m737","m739","10.1107/S1600536807005739","","","0.71073","MoKα","","0.0536","0.0362","","","0.0879","0.0969","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212675","22.513","0.003","22.513","0.003","15.529","0.004","90","","90","","90","","7871","3","295","2","295","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","N-[1-(Benzylaminocarbonyl)-2-(4-chlorophenyl)ethyl]benzamide","","- C23 H19 Cl N2 O2 -","- C23 H19 Cl N2 O2 -","- C368 H304 Cl16 N32 O32 -","16","1","RZ2118","Li-Rong Wen; Peng Liu; Ming Li","<i>N</i>-[1-(Benzylaminocarbonyl)-2-(4-chlorophenyl)ethyl]benzamide","Acta Crystallographica Section E","2007","63","3","o1212","o1214","10.1107/S1600536807005429","","","0.71073","MoKα","","0.0928","0.0563","","","0.1291","0.1478","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212676","15.0945","0.0003","12.0255","0.0003","25.4724","0.0005","90","","98.463","0.001","90","","4573.38","0.17","294","2","294","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","(1-ferrocenylbutane-1,3-dionato)[tris(2-aminoethyl)amine]cobalt(II) chloride tetraphenylborate acetone solvate,","","- C47 H57 B Cl Co Fe N4 O3 -","- C47 H57 B Cl Co Fe N4 O3 -","- C188 H228 B4 Cl4 Co4 Fe4 N16 O12 -","4","1","SF2006","Yan, Chao-Guo; Liu, Li; Han, Jun","(1-Ferrocenylbutane-1,3-dionato)[tris(2-aminoethyl)amine]cobalt(II) chloride tetraphenylborate acetone solvate","Acta Crystallographica Section E","2007","63","3","m683","m684","10.1107/S1600536806045156","","","0.71073","MoKα","","0.089","0.0476","","","0.1059","0.1259","","","","","","1.021","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2212677","8.7365","0.0018","9.9154","0.0019","10.38","0.002","100.253","0.01","105.349","0.011","107.569","0.01","793.5","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","4,4-bipyridinium oxalate","4,4'-bipyridyl‒oxalic acid (1/1)","","- C12 H10 N2 O4 -","- C12 H10 N2 O4 -","- C36 H30 N6 O12 -","3","1.5","SG2117","Cowan, John A.; Howard, Judith A. K.; Puschmann, Horst; Williams, Ian D.","Short N···O hydrogen bonds in the 1:1 adduct of 4,4'-bipyridyl and oxalic acid","Acta Crystallographica Section E","2007","63","3","o1240","o1242","10.1107/S1600536807005156","","","0.71073","MoKα","","0.106","0.0699","","","0.1722","0.193","","","","","","1.085","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212678","9.902","0.004","9.927","0.004","10.893","0.005","114.158","0.006","96.821","0.006","99.745","0.006","941.6","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(1H-Benzotriazol-1-yl)-1-(4-chlorobenzoyl)ethyl isonicotinate","","- C21 H15 Cl N4 O3 -","- C21 H15 Cl N4 O3 -","- C42 H30 Cl2 N8 O6 -","2","1","SG2122","Xue-Jun Han; Wu-Lan Zeng; Sai Bi; Jun Wan","2-(1<i>H</i>-Benzotriazol-1-yl)-1-(4-chlorobenzoyl)ethyl isonicotinate","Acta Crystallographica Section E","2007","63","3","o1194","o1195","10.1107/S1600536807005132","","","0.71073","MoKα","","0.0599","0.0456","","","0.1051","0.1158","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212679","12.482","0.003","6.0399","0.0014","19.494","0.003","90","","114.72","0.011","90","","1335","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-(2,5-Dichlorophenyl)-N'-isobutyrylthiourea","","- C11 H12 Cl2 N2 O S -","- C11 H12 Cl2 N2 O S -","- C44 H48 Cl8 N8 O4 S4 -","4","1","SG2124","Yusof, M. Sukeri M.; Ariff, Nurfazila M.; Kadir, Maisara A.; Yamin, Bohari M.","<i>N</i>-(2,5-Dichlorophenyl)-<i>N</i>'-isobutyrylthiourea","Acta Crystallographica Section E","2007","63","3","o1215","o1216","10.1107/S160053680700517X","","","0.71073","MoKα","","0.053","0.038","","","0.095","0.102","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212680","9.2564","0.0005","7.7315","0.0004","22.4447","0.0011","90","","90.727","0.001","90","","1606.14","0.14","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(3-Bromo-2-thienyl)-3-(4-butoxyphenyl)prop-2-en-1-one","","- C17 H17 Br O2 S -","- C17 H17 Br O2 S -","- C68 H68 Br4 O8 S4 -","4","1","SG2126","Ray J. Butcher; Yathirajan, H. S.; Ashalatha, B. V.; Narayana, B.; Sarojini, B. K.","1-(3-Bromo-2-thienyl)-3-(4-butoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","3","o1201","o1203","10.1107/S1600536807005144","","","0.71073","MoKα","","0.0468","0.0322","","","0.0726","0.0788","","","","","","0.998","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212681","18.4023","0.0017","8.7063","0.001","9.8475","0.0009","90","","93.894","0.007","90","","1574.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tert-Butyl 3a-chloro-2-methylperhydro-2,6a-epoxyoxireno[e]isoindole-5-carboxylate","","- C14 H20 Cl N O4 -","- C14 H20 Cl N O4 -","- C56 H80 Cl4 N4 O16 -","4","1","SG2127","Koşar, Başak; Karaarslan, Muhsin; Yıldız, Yaşar Kemal; Demircan, Aydın; Büyükgüngör, Orhan","<i>tert</i>-Butyl 3a-chloro-2-methylperhydro-2,6a-epoxyoxireno[<i>e</i>]isoindole-5-carboxylate","Acta Crystallographica Section E","2007","63","3","o1169","o1170","10.1107/S1600536807005168","","","0.71073","MoKα","","0.2137","0.0725","","","0.0683","0.0915","","","","","","0.948","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212682","12.409","0.003","6.7734","0.0016","15.289","0.004","90","","94.895","0.003","90","","1280.4","0.5","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Hexaaquamagnesium(II) 2-methyl-5-nitrobenzenesulfonate dihydrate","","- C14 H28 Mg N2 O18 S2 -","- C14 H28 Mg N2 O18 S2 -","- C28 H56 Mg2 N4 O36 S4 -","2","0.5","SG2129","Yong-Rong Xie; Gen-Wu Ge; Xiao-Yong Yuan; Dong-Bei Wan; Rui-Qing Yang","Hexaaquamagnesium(II) 2-methyl-5-nitrobenzenesulfonate dihydrate","Acta Crystallographica Section E","2007","63","3","m812","m814","10.1107/S1600536807007283","","","0.71073","MoKα","","0.0431","0.0391","","","0.1276","0.1307","","","","","","1.078","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212683","22.7306","0.0003","10.6253","0.0002","17.1579","0.0003","90","","117.028","0.001","90","","3691.38","0.11","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[aquamethylphenyl(μ-pyridine-2,6-dicarboxylato-κ^4^O,N,O':O'')tin(IV)] chloroform disolvate","","- C30 H30 Cl6 N2 O10 Sn2 -","- C30 H28 Cl6 N2 O10 Sn2 -","- C120 H112 Cl24 N8 O40 Sn8 -","4","0.5","SG2130","Amini, Mostafa M.; Azadmeher, Amirreza; Ng, Seik Weng","Bis(μ-pyridine-2,6-dicarboxylato)-κ^4^<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>';κ^4^<i>O</i>:<i>O</i>,<i>N</i>,<i>O</i>'-bis[aquamethylphenyltin(IV)] chloroform disolvate","Acta Crystallographica Section E","2007","63","3","m810","m811","10.1107/S1600536807007295","","","0.71073","MoKα","","0.079","0.046","","","0.107","0.132","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212684","6.4353","0.0004","10.6994","0.0007","34.373","0.002","90","","90","","90","","2366.7","0.3","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-(4-Methylbenzoyloxymethyl)-5-(5-methyl-2,4-dioxo-1,2,3,4- tetrahydropyrimidin-1-yl)tetrahydrofuran-3-yl 4-methylbenzoate","","- C26 H26 N2 O7 -","- C26 H26 N2 O7 -","- C104 H104 N8 O28 -","4","1","SG2131","Yathirajan, H. S.; Mayekar, Anil N.; Sarojini, B. K.; Narayana, B.; Bolte, Michael","2-(4-Methylbenzoyloxymethyl)-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)tetrahydrofuran-3-yl 4-methylbenzoate","Acta Crystallographica Section E","2007","63","3","o1395","o1397","10.1107/S1600536807007246","","","0.71073","MoKα","","0.0447","0.0407","","","0.1065","0.1091","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212685","10.158","0.001","10.373","0.001","19.289","0.002","103.046","0.005","94.822","0.006","92.164","0.006","1969.6","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","fac-Bromidootricarbonylbis(tribenzylphosphine-κP)rhenium(I)","","- C45 H42 Br O3 P2 Re -","- C45 H42 Br O3 P2 Re -","- C90 H84 Br2 O6 P4 Re2 -","2","1","SG2132","Michael A. Beckett; Mark E. Light; David S. Brassington; Mark Thornton-Pett","<i>fac</i>,<i>cis</i>-Bromidotricarbonylbis(tribenzylphosphine)rhenium(I)","Acta Crystallographica Section E","2007","63","3","m785","m786","10.1107/S160053680700726X","","","0.71069","MoKα","","0.0204","0.0196","","","0.0487","0.0491","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212686","4.4481","0.0003","6.186","0.0003","33.048","0.002","90","","90","","90","","909.35","0.09","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl 4-(bromomethyl)benzoate","","- C9 H9 Br O2 -","- C9 H9 Br O2 -","- C36 H36 Br4 O8 -","4","1","SG2133","Yathirajan, H. S.; Bindya, S.; Sarojini, B. K.; Narayana, B.; Bolte, Michael","Methyl 4-(bromomethyl)benzoate","Acta Crystallographica Section E","2007","63","3","o1334","o1335","10.1107/S1600536807007258","","","0.71073","MoKα","","0.0497","0.0479","","","0.1203","0.1227","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212687","10.8879","0.0004","11.8128","0.0004","23.9654","0.0014","90","","90","","90","","3082.3","0.2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(4-Methoxyphenyl)diphenylphosphine","","- C19 H17 O P -","- C19 H17 O P -","- C152 H136 O8 P8 -","8","1","SG2134","Flower, Kevin R.; Miles, Philip J.; Pritchard, Robin G.","(4-Methoxyphenyl)diphenylphosphine","Acta Crystallographica Section E","2007","63","3","o1339","o1340","10.1107/S1600536807007271","","","0.71073","MoKα","","0.0597","0.0418","","","0.0937","0.104","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212688","6.9007","0.0009","7.3551","0.001","11.2501","0.0017","75.288","0.011","86.091","0.012","71.424","0.01","523.46","0.13","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","4-[(1E)-Benzylideneamino]-3-methyl-2,4-dihydro-1H-1,2,4-triazole-5-thione","","- C10 H10 N4 S -","- C10 H10 N4 S -","- C20 H20 N8 S2 -","2","1","SG2135","Yathirajan, H. S.; Sarojini, B. K.; Narayana, B.; Sunil, K.; Bolte, Michael","4-[(1<i>E</i>)-Benzylideneamino]-3-methyl-2,4-dihydro-1<i>H</i>-1,2,4-triazole-5-thione","Acta Crystallographica Section E","2007","63","3","o1398","o1399","10.1107/S1600536807007775","","","0.71073","MoKα","","0.0387","0.0366","","","0.0999","0.1015","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212689","7.8824","0.0006","7.0027","0.0004","30.166","0.002","90","","94.435","0.009","90","","1660.12","0.19","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-Benzoyl-N-(2-pyridylcarbonyl)benzamide","","- C20 H14 N2 O3 -","- C20 H14 N2 O3 -","- C80 H56 N8 O12 -","4","1","SG2137","Gilles Gasser; Stoeckli-Evans, Helen","<i>N</i>-Benzoyl-<i>N</i>-(2-pyridylcarbonyl)benzamide","Acta Crystallographica Section E","2007","63","3","o1518","o1520","10.1107/S1600536807008884","","","0.71073","MoKα","","0.0871","0.0465","","","0.1124","0.1243","","","","","","0.881","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212690","11.0189","0.0019","4.8781","0.0009","21.677","0.004","90","","90","","90","","1165.2","0.4","100","2","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Methylpropionohydrazide","","- C4 H10 N2 O -","- C4 H10 N2 O -","- C32 H80 N16 O8 -","8","1","SG2138","Sharon E. Engel; Gregory M. Ferrence","2-Methylpropionohydrazide","Acta Crystallographica Section E","2007","63","3","o1475","o1477","10.1107/S1600536807008896","","","0.71073","MoKα","","","0.0733","","","","0.1906","","","","","","1.118","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212691","10.297","0.002","13.107","0.003","8.7121","0.0017","90","","90","","90","","1175.8","0.4","295","2","295","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","Tetrakis(dimethylammonium) hexachloridotungsten(III) chloride","","- C8 H32 Cl7 N4 W -","- C8 H32 Cl7 N4 W -","- C16 H64 Cl14 N8 W2 -","2","0.5","SI2001","Wei Xu; Jian-Li Lin","Tetrakis(dimethylammonium) hexachlorotungstate(III) chloride","Acta Crystallographica Section E","2007","63","3","m767","m769","10.1107/S1600536807006769","","","0.71073","MoKα","","0.0195","0.0184","","","0.0482","0.0485","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212692","10.0141","0.0013","6.7478","0.0006","13.4597","0.0017","90","","98.156","0.01","90","","900.31","0.18","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-diiodo-2,5-dimethylthiophene","","- C6 H6 I2 S -","- C6 H6 I2 S -","- C24 H24 I8 S4 -","4","1","SI2002","Cseh, Liliana; Mehl, Georg H.; Clark, Stephen; Archibald, Stephen J.","3,4-Diiodo-2,5-dimethylthiophene","Acta Crystallographica Section E","2007","63","3","o1393","o1394","10.1107/S160053680700760X","","","0.71073","MoKα","","0.0404","0.0365","","","0.092","0.0938","","","","","","1.084","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212693","8.302","0.002","11.452","0.004","16.106","0.005","90","","90","","90","","1531.3","0.8","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","7-phenyl-6-benzoyl-2,3-dihydro-1H-pyrrolizine","","- C20 H17 N O -","- C20 H17 N O -","- C80 H68 N4 O4 -","4","1","SJ2202","Liu, Yu-min; Hu, Yong-qi; Li, Xiao-yun; Chen, Wei","6-Benzoyl-7-phenyl-2,3-dihydro-1<i>H</i>-pyrrolizine","Acta Crystallographica Section E","2007","63","3","o1106","o1107","10.1107/S1600536806056571","","","0.71073","MoKα","","0.1186","0.0445","","","0.0878","0.1081","","","","","","1.077","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212694","15.571","0.002","18.482","0.003","8.3885","0.0012","90","","90","","90","","2414.1","0.6","100","2","100","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","Chloro[2(N,N-dimethylamino)ethanol-κN][2-(N,N-dimethylamino)ethanolato- κ^2^N,O]palladium(II)","","- C8 H21 Cl N2 O2 Pd -","- C8 H21 Cl N2 O2 Pd -","- C64 H168 Cl8 N16 O16 Pd8 -","8","1","SJ2213","Hamid, Mazhar; Tahir, Asif Ali; Mazhar, Muhammad; Zeller, Matthias; Hunter, Allen D.","Chloro[2-(<i>N</i>,<i>N</i>-dimethylamino)ethanol-κ<i>N</i>][2-(<i>N</i>,<i>N</i>-dimethylamino)ethanolato-κ^2^<i>N</i>,<i>O</i>]palladium(II)","Acta Crystallographica Section E","2007","63","3","m728","m730","10.1107/S1600536807005016","","","0.71073","MoKα","","0.0431","0.0355","","","0.0867","0.0915","","","","","","1.188","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212695","15.2076","0.0006","6.9231","0.0002","25.4477","0.0008","90","","99.734","0.002","90","","2640.66","0.15","100","0.1","297","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dibutylbis[3-(dimethylamino)benzoato]tin(IV)","","- C26 H38 N2 O4 Sn -","- C26 H38 N2 O4 Sn -","- C104 H152 N8 O16 Sn4 -","4","0.5","SJ2214","Foo-Win Yip; Siang-Guan Teoh; Pazilah Ibrahim; Shea-Lin Ng; Hoong-Kun Fun","Dibutylbis[3-(dimethylamino)benzoato]tin(IV)","Acta Crystallographica Section E","2007","63","3","m667","m669","10.1107/S1600536807004540","","","0.71073","MoKα","","0.0349","0.0341","","","0.0782","0.0785","","","","","","1.391","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212696","16.779","0.004","7.2732","0.0014","10.636","0.002","90","","104.952","0.004","90","","1254","0.5","294","2","294","2","","","","","","","","4","C 1 2 1","C 2y","5","","thyl 3-(7-bromo-2,3-dihydro-1-benzofuran-5-yl)propanoate","","- C13 H15 Br O3 -","- C13 H15 Br O3 -","- C52 H60 Br4 O12 -","4","1","SJ2216","Wei Wang; Chang-Qing Wang; Xiu-Jie Liu; Song-Qing Wang","Ethyl 3-(7-bromo-2,3-dihydro-1-benzofuran-5-yl)propanoate","Acta Crystallographica Section E","2007","63","3","o1178","o1179","10.1107/S1600536807005077","","","0.71073","MoKα","","0.0245","0.0222","","","0.0526","0.0534","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212697","12.1118","0.0003","15.3821","0.0004","16.6205","0.0004","90","","130.018","0.002","90","","2371.42","0.12","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,6-Bis{2'-hydroxy-2',3'-dihydrospiro[cyclopropane-1,1'(1H)-inden]-3'- yl}isophthalonitrile","","- C30 H24 N2 O2 -","- C30 H24 N2 O2 -","- C120 H96 N8 O8 -","4","1","SJ2217","Zhi-Feng Lu; Jian-Hua Xu; Jeannie Bee-Jan Teh; Hoong-Kun Fun","4,6-Bis{2'-hydroxy-2',3'-dihydrospiro[cyclopropane-1,1'(1<i>H</i>)-inden]-3'-yl}isophthalonitrile","Acta Crystallographica Section E","2007","63","3","o1232","o1234","10.1107/S1600536807005004","","","0.71073","MoKα","","0.096","0.0536","","","0.1165","0.1345","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212698","14.607","0.004","11.904","0.004","9.257","0.003","90","","126.051","0.004","90","","1301.4","0.7","294","2","294","2","","","","","","","","4","C 1 c 1","C -2yc","9","","Pyridinium 4-carboxy-2-nitrobenzoate","","- C13 H10 N2 O6 -","- C13 H10 N2 O6 -","- C52 H40 N8 O24 -","4","1","SJ2218","Chen, Jiao-Jiao; Guo, Ming-Lin","Pyridinium 4-carboxy-2-nitrobenzoate","Acta Crystallographica Section E","2007","63","3","o1400","o1401","10.1107/S1600536807007556","","","0.71073","MoKα","","0.0307","0.0266","","","0.0652","0.0673","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212699","12.054","0.0014","9.2501","0.0012","7.4506","0.001","90","","99.957","0.006","90","","818.23","0.18","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","diaquabis[5-carboxy-2-methyl-1H-imidazole-4-carboxylato- κ^2^N^3^,O^4^]cadmium(II)","","- C12 H14 Cd N4 O10 -","- C12 H14 Cd N4 O10 -","- C24 H28 Cd2 N8 O20 -","2","0.5","SJ2219","Nie, Xu-Liang; Wen, Hui-Liang; Wu, Zi-Sheng; Liu, Da-Bo; Liu, Chong-Bo","Diaquabis(5-carboxy-2-methyl-1<i>H</i>-imidazole-4-carboxylato-κ^2^<i>N</i>^3^,<i>O</i>^4^)cadmium(II)","Acta Crystallographica Section E","2007","63","3","m753","m755","10.1107/S1600536807006472","","","0.7107","MoKα","","0.0247","0.0214","","","0.0576","0.0585","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212700","5.2681","0.0008","12.9203","0.0018","9.2022","0.0014","90","","97.52","0.006","90","","620.96","0.16","298","1","298","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","trans-4,4'-Azopyridine N,N'-dioxide dihydrochloride","trans-1,1'-Dihydroxy-4,4'-diazenediyldipyridinium dichloride","","- C10 H10 Cl2 N4 O2 -","- C10 H10 Cl2 N4 O2 -","- C20 H20 Cl4 N8 O4 -","2","0.5","SJ2220","Song, Hui-Hua; Ma, Bao-Qing","<i>trans</i>-4,4'-Azopyridine <i>N</i>,<i>N</i>'-dioxide dihydrochloride","Acta Crystallographica Section E","2007","63","3","o1332","o1333","10.1107/S1600536807006630","","","0.71073","MoKα","","0.055","0.0507","","","0.1227","0.1258","","","","","","1.103","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212701","7.6115","0.0004","10.3015","0.0006","14.1723","0.0008","90","","90","","90","","1111.25","0.11","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","6,6,7,7-Tetrachloro-5,6,7,8-tetrahydroquinoline-5,8-dione","","- C9 H3 Cl4 N O2 -","- C9 H3 Cl4 N O2 -","- C36 H12 Cl16 N4 O8 -","4","1","SJ2223","Cheng, Yu; An, Lin-Kun; Gu, Lian-Quan; Ng, Seik Weng","6,6,7,7-Tetrachloro-5,6,7,8-tetrahydroquinoline-5,8-dione","Acta Crystallographica Section E","2007","63","3","o1365","o1366","10.1107/S1600536807007398","","","0.71073","MoKα","","0.052","0.047","","","0.134","0.139","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212702","8.174","0.0008","9.8743","0.0008","28.662","0.003","90","","97.977","0.002","90","","2291","0.4","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl) sulfone","","- C26 H14 N4 O6 S -","- C26 H14 N4 O6 S -","- C104 H56 N16 O24 S4 -","4","0.5","SJ2224","Yan, Biao; Lü, Xing-Qiang; Ma, Hai-Xia; Song, Ji-Rong; Ng, Seik Weng","Bis(1,3-dioxo-2,3-dihydro-1<i>H</i>-isoindol-5-yl) sulfone","Acta Crystallographica Section E","2007","63","3","o1367","o1368","10.1107/S1600536807007404","","","0.71073","MoKα","","0.044","0.039","","","0.12","0.125","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212703","30.205","0.007","10.824","0.003","7.2092","0.0016","90","","90","","90","","2357","1","298","2","298","2","","","","","","","","6","P n a 21","P 2c -2n","33","","catena-Poly[[dichloridodimethyltin(IV)]-μ-5-methylpyrazine-2-carboxylato- κ^3^O:O',N-[dimethyltin(IV)]]-μ-5-methylpyrazine-2-carboxylato-κ^3^O,N:O']","","- C16 H22 Cl2 N4 O4 Sn2 -","- C16 H22 Cl2 N4 O4 Sn2 -","- C64 H88 Cl8 N16 O16 Sn8 -","4","1","SJ2225","Jun-Ying Li; Tian-Duo Li","<i>catena</i>-Poly[[dichloridodimethyltin(IV)]-μ-5-methylpyrazine-2-carboxylato-κ^3^<i>O</i>:<i>O</i>',<i>N</i>-[dimethyltin(IV)]]-μ-5-methylpyrazine-2-carboxylato-κ^3^<i>O</i>,<i>N</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","3","m847","m849","10.1107/S1600536807007866","","","0.71073","MoKα","","0.053","0.0448","","","0.1079","0.1146","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212704","9.5237","0.0005","10.1029","0.0005","8.0747","0.0004","90","","108.385","0.001","90","","737.27","0.06","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexane-1,6-diammonium bis(dihydrogenarsenate)","","- C6 H22 As2 N2 O8 -","- C6 H22 As2 N2 O8 -","- C12 H44 As4 N4 O16 -","2","0.5","SJ2226","Wilkinson, Hazel S.; Harrison, William T. A.","Hexane-1,6-diammonium bis(dihydrogenarsenate): infinite anionic layers containing <i>R</i>~6~^6^(24) loops","Acta Crystallographica Section E","2007","63","3","m902","m904","10.1107/S1600536807007672","","","0.71073","MoKα","","0.0302","0.0221","","","0.0547","0.0567","","","","","","0.989","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212705","12.848","0.002","7.262","0.001","14.993","0.002","90","","105.72","0.01","90","","1346.6","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-Amino-N-(2,5-dichlorophenyl)benzenesulfonamide","","- C12 H10 Cl2 N2 O2 S -","- C12 H10 Cl2 N2 O2 S -","- C48 H40 Cl8 N8 O8 S4 -","4","1","SJ2228","Perlovich, German L.; Tkachev, Valery V.; Kazachenko, Vladimir P.; Raevsky, Oleg A.","4-Amino-<i>N</i>-(2,5-dichlorophenyl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","3","o1526","o1528","10.1107/S1600536807008744","","","0.71073","MoKα","","0.0657","0.0402","","","0.0927","0.1054","","","","","","1.024","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2212706","11.721","0.001","11.675","0.001","12.356","0.002","90","","109.191","0.001","90","","1596.9","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichloro{4-nitro-2-[(2-isopropylaminoethylimino)methyl]phenolato}zinc(II)","","- C12 H17 Cl2 N3 O3 Zn -","- C12 H17 Cl2 N3 O3 Zn -","- C48 H68 Cl8 N12 O12 Zn4 -","4","1","SU2002","Shou-Xing Wang","Dichloro{2-[(2-isopropylaminoethylimino)methyl]-4-nitrophenolato}zinc(II)","Acta Crystallographica Section E","2007","63","3","m706","m707","10.1107/S1600536807006010","","","0.71073","MoKα","","0.044","0.0328","","","0.0789","0.0839","","","","","","1.046","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212707","27.8162","0.0015","6.0773","0.0003","24.861","0.0013","90","","97.141","0.003","90","","4170.1","0.4","293","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(1H-imidazole-κN^3^)bis(4-methylbenzoato-κO)zinc(II) 4-methylbenzoic acid disolvate","","- C46 H42 N4 O8 Zn -","- C46 H42 N4 O8 Zn -","- C184 H168 N16 O32 Zn4 -","4","0.5","SU2007","Gu, Chang-Sheng; Hao, Xiao-Min; Song, Wen-Dong; Yan, Jian-Bin","Bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)bis(4-methylbenzoato-κ<i>O</i>)zinc(II) 4-methylbenzoic acid disolvate","Acta Crystallographica Section E","2007","63","3","m895","m897","10.1107/S1600536807005715","","","0.71073","MoKα","","0.128","0.0545","","","0.0956","0.1196","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212708","10.175","0.002","22.289","0.004","13.947","0.003","90","","97.57","0.03","90","","3135.5","1.1","188","2","188","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{1,3-Bis(3,4,5-trimethoxybenzyl)-3,4,5,6-tetrahydropyrimidin-2- ylidene}chloro(η^4^-cycloocta-1,5-diene)rhodium(I)","","- C32 H44 Cl N2 O6 Rh -","- C32 H44 Cl N2 O6 Rh -","- C128 H176 Cl4 N8 O24 Rh4 -","4","1","TK2120","Arslan, Hakan; VanDerveer, Don; Özdemir, İsmail; Demir, Serpil; Çetinkaya, Bekir","{1,3-Bis(3,4,5-trimethoxybenzyl)-3,4,5,6-tetrahydropyrimidin-2-ylidene}chloro(η^4^-cycloocta-1,5-diene)rhodium(I)","Acta Crystallographica Section E","2007","63","3","m770","m771","10.1107/S1600536807006794","","","0.71073","MoKα","","0.127","0.075","","","0.161","0.182","","","","","","1.1","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212709","6.9755","0.0009","11.0363","0.0014","11.0603","0.0015","101.72","0.01","94.826","0.011","106.931","0.01","788.19","0.19","173","2","173","2","","","","","","","","6","P -1","-P 1","2","1-(2,6-Dichlorobenzoyl)-3-(3,4-dichlorophenyl)thiourea","1-(2,6-Dichlorobenzoyl)-3-(3,4-dichlorophenyl)thiourea","","- C14 H8 Cl4 N2 O S -","- C14 H8 Cl4 N2 O S -","- C28 H16 Cl8 N4 O2 S2 -","2","1","TK2124","Khawar Rauf, M.; Badshah, Amin; Bolte, Michael; Ahmad, Imtiaz","1-(2,6-Dichlorobenzoyl)-3-(3,4-dichlorophenyl)thiourea","Acta Crystallographica Section E","2007","63","3","o1073","o1075","10.1107/S1600536807003881","","","0.71073","MoKα","","0.039","0.036","","","0.098","0.1","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212710","8.4164","0.0006","19.4304","0.0013","8.5521","0.0006","90","","94.475","0.004","90","","1394.3","0.17","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Succinimidyl 7-methoxy-2H-chromene-3-carboxylate","","- C15 H11 N O7 -","- C15 H11 N O7 -","- C60 H44 N4 O28 -","4","1","TK2127","Bardajee, Ghasem Rezanejade; Winnik, Mitchell A.; Lough, Alan J.","Succinimidyl 7-methoxy-2<i>H</i>-chromene-3-carboxylate","Acta Crystallographica Section E","2007","63","3","o1513","o1514","10.1107/S1600536807004175","","","0.71073","MoKα","","0.117","0.055","","","0.122","0.149","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212711","11.7433","0.0006","10.745","0.0006","16.6607","0.0009","90","","90.039","0.001","90","","2102.3","0.2","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Acetylacetonato-κ^2^O,O')(oxalato-κ^2^O,O')(1,10-phenanthroline- κ^2^N,N')chromium(III) trihydrate","","- C19 H21 Cr N2 O9 -","- C19 H21 Cr N2 O9 -","- C76 H84 Cr4 N8 O36 -","4","1","TK2128","Wang, Wen-Bo; Yang, Li-Xin; Chen, Fang-Fei","(Acetylacetonato-κ^2^<i>O</i>,<i>O</i>')(oxalato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')chromium(III) trihydrate","Acta Crystallographica Section E","2007","63","3","m701","m703","10.1107/S160053680700503X","","","0.71073","MoKα","","0.033","0.029","","","0.087","0.09","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212712","8.084","0.002","5.484","0.001","17.481","0.005","90","","94.52","0.03","90","","772.6","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,5-Dioxopyrrolidin-1-yl methanesulfonate","","- C5 H7 N O5 S -","- C5 H7 N O5 S -","- C20 H28 N4 O20 S4 -","4","1","TK2130","Stefanowicz, Piotr; Jaremko, Łukasz; Jaremko, Mariusz; Lis, Tadeusz","2,5-Dioxopyrrolidin-1-yl methanesulfonate","Acta Crystallographica Section E","2007","63","3","o1336","o1338","10.1107/S1600536807006782","","","0.71073","MoKα","","0.067","0.039","","","0.088","0.094","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212713","16.9178","0.0006","9.1694","0.0003","7.6303","0.0002","90","","97.329","0.002","90","","1173.99","0.06","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Iodobutyl)pyrimidin-1-ium iodide","","- C8 H12 I2 N2 -","- C8 H12 I2 N2 -","- C32 H48 I8 N8 -","4","1","TK2131","Walji, Dhiran; Storey, John M. D.; Harrison, William T. A.","1-(4-Iodobutyl)pyrimidin-1-ium iodide","Acta Crystallographica Section E","2007","63","3","o1222","o1223","10.1107/S1600536807005028","","","0.71073","MoKα","","0.032","0.023","","","0.04","0.043","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212714","7.8611","0.0002","12.065","0.0003","13.1038","0.0004","90","","90","","90","","1242.82","0.06","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(+)-santonide","(1R,3aS,6aS,9S)-(+)-α,3a,7-trimethyl-5-oxo-1,4-ethanoperhydropentalene- 1,8-carbolactone","","- C15 H18 O3 -","- C15 H18 O3 -","- C60 H72 O12 -","4","1","TK2133","Zinczuk, Juan; Ruveda, Edmundo A.; Thompson, Hugh W.; Lalancette, Roger A.","(+)-Santonide, a sesquiterpenoid enol lactone derived from <i>Artemisia</i>","Acta Crystallographica Section E","2007","63","3","o1490","o1491","10.1107/S1600536807007982","","","1.54178","CuKα","","0.025","0.025","","","0.06","0.06","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212715","30.27","0.03","6.171","0.004","18.776","0.015","90","","124.685","0.009","90","","2884","4","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","1-[3-(Trifluoromethyl)phenyl]-3-pivaloylthiourea","","- C13 H15 F3 N2 O S -","- C13 H15 F2.997 N2 O S -","- C104 H120 F23.976 N16 O8 S8 -","8","1","TK2138","Shoukat, Noreen; Khawar Rauf, M.; Ebihara, Masahiro; Badshah, Amin","1-[3-(Trifluoromethyl)phenyl]-3-pivaloylthiourea","Acta Crystallographica Section E","2007","63","3","o1478","o1479","10.1107/S1600536807008513","","","0.7107","MoKα","","0.074","0.07","","","0.148","0.151","","","","","","1.15","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212716","6.7537","0.0003","8.1753","0.0004","12.7105","0.0005","90","","107.501","0.002","90","","669.31","0.05","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Methylpiperazinium bis(dihydrogenarsenate)","","- C5 H18 As2 N2 O8 -","- C5 H18 As2 N2 O8 -","- C10 H36 As4 N4 O16 -","2","0.5","TK2140","Wilkinson, Hazel S.; Harrison, William T. A.","2-Methylpiperazinium bis(dihydrogenarsenate)","Acta Crystallographica Section E","2007","63","3","m900","m901","10.1107/S1600536807008392","","","0.71073","MoKα","","0.04","0.029","","","0.071","0.074","","","","","","1.06","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212717","5.2511","0.0005","6.4694","0.0006","12.343","0.001","104.418","0.001","91.396","0.002","108.612","0.001","382.39","0.06","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","Diaqua(5-methylpyrazine-2-carboxylato-κ^2^N,O)zinc(II)","","- C12 H14 N4 O6 Zn -","- C12 H14 N4 O6 Zn -","- C12 H14 N4 O6 Zn -","1","0.5","WK2046","Guang Fan; San-Ping Chen; Sheng-Li Gao","Diaqua(5-methylpyrazine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>)zinc(II)","Acta Crystallographica Section E","2007","63","3","m774","m775","10.1107/S1600536807003455","","","0.71073","MoKα","","0.0207","0.0203","","","0.0591","0.0593","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212718","15.867","0.003","4.882","0.001","21.141","0.004","90","","101.46","0.03","90","","1605","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Nitrobenzyl 2-(anilinocarbonyl)propionate","","- C17 H16 N2 O5 -","- C17 H16 N2 O5 -","- C68 H64 N8 O20 -","4","1","WK2047","Cun-Kuan Wang","4-Nitrobenzyl 2-(anilinocarbonyl)propionate","Acta Crystallographica Section E","2007","63","3","o1131","o1132","10.1107/S1600536807004886","","","0.71073","MoKα","","0.077","0.0445","","","0.1281","0.1437","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212719","8.4384","0.0018","9.797","0.002","19.276","0.004","83.705","0.004","81.735","0.004","78.98","0.004","1542.4","0.6","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","5-Carboxybenzene-1,2,3-triyl triacetate hemihydrate","","- C13 H13 O8.5 -","- C13 H13 O8.5 -","- C52 H52 O34 -","4","2","WK2048","Li, Zhen-Huan; Guo, Ming-Lin","3,4,5-Triacetoxybenzoic acid hemihydrate","Acta Crystallographica Section E","2007","63","3","o1167","o1168","10.1107/S1600536807004916","","","0.71073","MoKα","","0.1302","0.0546","","","0.1337","0.1732","","","","","","0.994","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212720","14.322","0.006","13.32","0.005","8.504","0.003","90","","90","","90","","1622.3","1.1","273","2","273","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Dichloridotris(2-methyl-1H-imidazole-κN^3^)copper(II)","","- C12 H18 Cl2 Cu N6 -","- C12 H18 Cl2 Cu N6 -","- C48 H72 Cl8 Cu4 N24 -","4","0.5","WK2050","Xiao-Yong Qiu; Zuo-Xiang Wang; Bu-Gao Zhou; Ping-Feng Wu","Dichloridotris(2-methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II)","Acta Crystallographica Section E","2007","63","3","m884","m885","10.1107/S1600536807007180","","","0.71073","MoKα","","0.0454","0.0357","","","0.0679","0.069","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212721","8.801","0.005","11.141","0.004","14.568","0.007","90","","104.25","0.05","90","","1384.5","1.2","105","2","105","2","","","","","","","","5","P 1 21 1","P 2yb","4","","syn-2,4-Bis(4-methoxybenzylidene)-trans-1,3-dithexyldi- 2,4-azadi-1,3-boracyclobutane","","- C28 H44 B2 N2 O2 -","- C28.006 H44 B2 N2 O2 -","- C56.012 H88 B4 N4 O4 -","2","1","WM2073","Lesley, M. J. G.; Pineau, M. R.; Nelson, D. M.; Crundwell, G.","<i>syn</i>-2,4-Bis(4-methoxybenzylidene)-<i>trans</i>-1,3-dithexyl-2,4-diaza-1,3-diboracyclobutane","Acta Crystallographica Section E","2007","63","3","o1204","o1206","10.1107/S1600536807005417","","","0.71073","MoKα","","0.1156","0.0591","","","0.145","0.1546","","","","","","0.832","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212722","6.7373","0.0005","6.7373","0.0005","6.1048","0.0009","90","","90","","120","","239.98","0.04","298","2","298","2","","","","","","","","4","P -6","P -6","174","Lanthanum Cyclotriphosphate Trihydrate","Lanthanum cyclotriphosphate trihydrate","","- H6 La O12 P3 -","- H6 La O12 P3 -","- H6 La O12 P3 -","1","0.166667","WM2090","Khlissa, Faycel; Férid, Mokhtar","Cyclotriphosphate trihydraté de lanthane","Acta Crystallographica Section E","2007","63","3","i64","i66","10.1107/S1600536807004734","","","0.71073","MoKα","","0.0145","0.0145","","","0.0371","0.0371","","","","","","1.155","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212723","6.9019","0.001","7.9919","0.0011","4.7807","0.0007","90","","109.003","0.004","90","","249.32","0.06","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Lithium chromium(III) diphosphate(V)","","- Cr Li O7 P2 -","- Cr Li O7 P2 -","- Cr2 Li2 O14 P4 -","2","1","WM2094","Ivashkevich, Ludmila S.; Selevich, Kirill A.; Lesnikovich, Anatoly I.; Selevich, Anatoly F.","X-ray powder diffraction study of LiCrP~2~O~7~","Acta Crystallographica, Section E","2007","63","3","m70","m72","10.1107/S1600536807005752","","","1.5418","CuKα","","","","","","","","","","0.35","","","","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212724","12.792","0.002","12.289","0.002","18.564","0.004","90","","107.16","0.009","90","","2788.4","0.9","93","2","93","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis(diphenylmethylphosphine-κP)(disulfurdinitrido-κ^2^N,S)platinum(II) dichloromethane solvate","","- C27 H28 Cl2 N2 P2 Pt S2 -","- C27 H28 Cl2 N2 P2 Pt S2 -","- C108 H112 Cl8 N8 P8 Pt4 S8 -","4","1","WM2095","Read, Benjamin D.; Slawin, Alexandra M. Z.; Woollins, J. Derek","Bis(diphenylmethylphosphine-κ<i>P</i>)(disulfurdinitrido-κ^2^<i>N</i>,<i>S</i>)platinum(II) dichloromethane solvate","Acta Crystallographica Section E","2007","63","3","m751","m752","10.1107/S1600536807006344","","","0.71073","MoKα","","0.0696","0.0508","","","0.1069","0.1151","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212725","13.1832","0.0005","12.2799","0.0005","23.2108","0.001","90","","97.934","0.002","90","","3721.6","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis(2,4-dichlorobenzaldehyde 2-hydroxybenzoylhydrazonato-κ^2^N,O)bis(pyridine-κN)cobalt(II)","","- C38 H28 Cl4 Co N6 O4 -","- C38 H28 Cl4 Co N6 O4 -","- C152 H112 Cl16 Co4 N24 O16 -","4","1","WN2098","Qiu, Xiao-Yang; You, Zhong-Lu; Yang, Sen-Lin; Liu, Wei-Sheng; Zhu, Hai-Liang","Bis{(<i>Z</i>)-<i>N</i>'-(2,4-dichlorobenzylidene)-2-hydroxybenzohydrazide-κ^2^<i>N</i>',<i>O</i>}bis(pyridine-κ<i>N</i>)cobalt(II). Corrigendum","Acta Crystallographica Section E","2007","63","3","e9","e10","10.1107/S1600536807006800","","","0.71073","MoKα","","0.0674","0.0427","","","0.0825","0.0924","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212726","10.0306","0.0009","7.5903","0.0007","22.248","0.002","90","","93.021","0.002","90","","1691.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-4-(2-Hydroxy-4-methoxybenzylideneamino)-1,5-dimethyl-2-phenyl- 1H-pyrazol-3(2H)-one","","- C19 H19 N3 O3 -","- C19 H19 N3 O3 -","- C76 H76 N12 O12 -","4","1","WN2112","Chu-Niu Zhang; Ming-Hua Yang; Guo-Bin Yang","(<i>E</i>)-4-(2-Hydroxy-4-methoxybenzylideneamino)-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","3","o1245","o1246","10.1107/S1600536807005910","","","0.71073","MoKα","","0.0517","0.0397","","","0.1115","0.1175","","","","","","1.165","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212727","7.398","0.003","8.953","0.004","29.282","0.013","90","","90","","90","","1939.5","1.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","gelsevirine","Gelsevirine hydrochloride","","- C21 H25 Cl N2 O3 -","- C21 H25 Cl N2 O3 -","- C84 H100 Cl4 N8 O12 -","4","1","WN2113","Han, Hai-Bin; Yuan, Zhong; Xiao, Kai; Chen, Min-Qin; Zhang, Liming","Gelsevirine hydrochloride","Acta Crystallographica Section E","2007","63","3","o1369","o1371","10.1107/S1600536807006393","","","0.71073","MoKα","","0.0612","0.0489","","","0.1038","0.1086","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212728","7.7889","0.0001","17.0479","0.0003","21.2824","0.0003","90","","90","","90","","2825.97","0.07","150","","150","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","5-O-<i>tert</i>-Butyldiphenylsilyl-2-C-hydroxymethyl- 2,3-O-isopropylidene-2'-O-trifluoromethanesulfonyl-D-ribono-1,4-lactone","","- C26 H31 F3 O8 S Si -","- C26 H31 F3 O8 S Si -","- C104 H124 F12 O32 S4 Si4 -","4","1","WN2114","Simone, Michela; Fleet, George W. J.; Watkin, David J.","5-<i>O</i>-<i>tert</i>-Butyldiphenylsilyl-2-<i>C</i>-hydroxymethyl-2,3-<i>O</i>-isopropylidene-2'-<i>O</i>-trifluoromethanesulfonyl-<small>D</small>-ribono-1,4-lactone","Acta Crystallographica Section E","2007","63","3","o1088","o1090","10.1107/S1600536807004436","","","0.71073","MoKα","","","0.0326","","","","0.0333","","","","","","1.0621","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212729","9.188","0.002","8.218","0.002","16.628","0.004","90","","100.583","0.015","90","","1234.2","0.5","153.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","9-(Bromoacetyl)anthracene","","- C16 H11 Br O -","- C16 H11 Br O -","- C64 H44 Br4 O4 -","4","1","WN2115","Kubo, Kanji; Watanabe, Kenichiro; Sakurai, Tadamitsu","9-(Bromoacetyl)anthracene","Acta Crystallographica Section E","2007","63","3","o1300","o1301","10.1107/S1600536807006770","","","1.54187","CuKα","","","0.0315","","","","0.0842","","","","","","1.109","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212730","13.433","0.003","13.198","0.003","8.275","0.002","90","","95.179","0.005","90","","1461.1","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-{[5-Fluoro-2-(trifluoromethyl)phenyl]iminomethyl}-2-naphthol","","- C18 H11 F4 N O -","- C18 H11 F4 N O -","- C72 H44 F16 N4 O4 -","4","1","WN2116","Yun-Fa Zheng; Liang-Gui Wang; Guo-Bing Yan","1-{[5-Fluoro-2-(trifluoromethyl)phenyl]iminomethyl}-2-naphthol","Acta Crystallographica Section E","2007","63","3","o1407","o1408","10.1107/S1600536807007751","","","0.71073","MoKα","","0.1335","0.1223","","","0.2353","0.2409","","","","","","1.38","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212731","5.8166","0.0016","6.8339","0.0019","12.263","0.003","87.642","0.005","81.726","0.005","73.017","0.005","461.3","0.2","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","trans-Bis(aniline-κN)dichlorobis(ethanol-κO)cobalt(II)","","- C16 H26 Cl2 Co N2 O2 -","- C16 H26 Cl2 Co N2 O2 -","- C16 H26 Cl2 Co N2 O2 -","1","0.5","WN2117","Clegg, William; Martin, Nicola C.","<i>trans</i>-Bis(aniline-κ<i>N</i>)dichlorobis(ethanol-κ<i>O</i>)cobalt(II)","Acta Crystallographica Section E","2007","63","3","m856","m856","10.1107/S1600536807007805","","","0.71073","MoKα","","0.0509","0.0401","","","0.1004","0.105","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212732","9.387","0.0002","14.9382","0.0003","18.2241","0.0004","90","","90","","90","","2555.47","0.09","293","2","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","3,4,4-Trichloro-1-[4-(diphenylmethyl)piperazin-1-yl]-2-nitro- 1-(propylsulfanyl)buta-1,3-diene","","- C24 H26 Cl3 N3 O2 S -","- C24 H26 Cl3 N3 O2 S -","- C96 H104 Cl12 N12 O8 S4 -","4","1","WW2065","Ibis, Cemil; Deniz, N.Gulsah","3,4,4-Trichloro-1-[4-(diphenylmethyl)piperazin-1-yl]-2-nitro-1-(propylsulfanyl)buta-1,3-diene","Acta Crystallographica Section E","2007","63","3","o1091","o1092","10.1107/S1600536807004023","","","0.71073","MoKα","","","0.099","","","","0.1727","","","","","","1.542","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212733","8.574","0.002","9.83","0.003","24.68","0.007","90","","90","","90","","2080.1","1","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-(4-Fluorophenyl)-1H-benzimidazole","","- C13 H9 F N2 -","- C13 H9 F N2 -","- C104 H72 F8 N16 -","8","1","WW2081","Rashid, Naghmana; Tahir, Muhammad K.; Kanwal, Shahnaz; Yusof, Nurdiyana M.; Yamin, Bohari M.","2-(4-Fluorophenyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","3","o1402","o1403","10.1107/S160053680700774X","","","0.71073","MoKα","","0.075","0.061","","","0.114","0.119","","","","","","1.28","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212734","14.078","0.003","8.0546","0.0016","14.887","0.003","90","","115.56","0.03","90","","1522.9","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","hexaaquanickel(II) dinitrate‒bis(pyrimidin-2-ylsulfanyl)methane (1/2)","","- C18 H28 N10 Ni O12 S4 -","- C18 H28 N10 Ni O12 S4 -","- C36 H56 N20 Ni2 O24 S8 -","2","0.5","XU2155","Xie, Chuang; Chang, De-Wu; Mu, Shi-Cheng; Zhou, Li-Na; Chen, Wei","The 1:2 adduct of hexaaquanickel(II) dinitrate and bis(pyrimidin-2-ylsulfanyl)methane","Acta Crystallographica Section E","2007","63","3","m662","m663","10.1107/S1600536806050306","","","0.71073","MoKα","","0.025","0.023","","","0.066","0.068","","","","","","1.085","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212735","12.03","0.005","13.905","0.005","4.371","0.002","90","","90","","90","","731.2","0.5","293","2","293","2","","","","","","","","4","P b a 2","P 2 -2ab","32","","2,2'-(Methylenedithio)bis(4,6-dimethylpyrimidine)","","- C13 H16 N4 S2 -","- C13 H16 N4 S2 -","- C26 H32 N8 S4 -","2","0.5","XU2193","Chen, Shi-Kun; Li, Lin; Tian, Lei; Wu, Jie-Ying","2,2'-(Methylenedithio)bis(4,6-dimethylpyrimidine)","Acta Crystallographica Section E","2007","63","3","o1126","o1127","10.1107/S1600536807004825","","","0.71069","MoKα","","0.039","0.032","","","0.085","0.089","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212736","24.441","0.005","6.0694","0.0012","20.101","0.004","90","","108.46","0.03","90","","2828.4","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","r-1,c-2,t-3,t-4-1,3-bis(N,N-dimethyl-4-benzenamino)-2,4-bis-(2-benzooxzolyl)cyclobutane","","- C34 H32 N4 O2 -","- C34 H32 N4 O2 -","- C136 H128 N16 O8 -","4","0.5","XU2195","Li, Feng-Yu; Wang, Shu-Tao; Zhuang, Jun-Peng; Jiang, Lei; Song, Yan-Lin","<i>c</i>-2,<i>t</i>-4-Bis(2-benzoxazol-2-yl)-<i>r</i>-1,<i>t</i>-3-bis[4-(dimethylamino)phenyl]cyclobutane","Acta Crystallographica Section E","2007","63","3","o1171","o1172","10.1107/S1600536807004813","","","0.71073","MoKα","","0.101","0.0641","","","0.1919","0.2179","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212737","3.8635","0.0004","6.4199","0.0006","29.589","0.003","90","","90","","90","","733.9","0.13","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3,5-Difluorobenzohydrazide","","- C7 H6 F2 N2 O -","- C7 H6 F2 N2 O -","- C28 H24 F8 N8 O4 -","4","1","XU2198","Ghulam Qadeer; Nasim Hasan Rama; Muhammad Zareef; Wai-Yeung Wong","3,5-Difluorobenzohydrazide","Acta Crystallographica Section E","2007","63","3","o1176","o1177","10.1107/S1600536807005053","","","0.71073","MoKα","","0.0317","0.0306","","","0.0832","0.0843","","","","","","1.076","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212738","6.8306","0.0004","13.614","0.0008","17.9391","0.001","90","","90","","90","","1668.19","0.17","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(E)-4-[(2-Bromobenzylidene)amino]-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one","","- C18 H16 Br N3 O -","- C18 H16 Br N3 O -","- C72 H64 Br4 N12 O4 -","4","1","XU2202","Wang, Liang-Gui; Zhang, Chu-Niu; Yan, Guo-Bing; Zheng, Yun-Fa; Yang, Ming-Hua","(<i>E</i>)-4-[(2-Bromobenzylidene)amino]-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","3","o1247","o1248","10.1107/S1600536807006009","","","0.71073","MoKα","","0.072","0.051","","","0.139","0.145","","","","","","1.012","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212739","7.8434","0.0014","9.4373","0.0014","15.989","0.003","90","","99.372","0.005","90","","1167.7","0.3","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di-μ-chloro-bis[trichloro(4-chloroaniline)zirconium(IV)]","","- C12 H12 Cl10 N2 Zr2 -","- C12 H12 Cl10 N2 Zr2 -","- C24 H24 Cl20 N4 Zr4 -","2","0.5","XU2203","Wei, Hua; Li, Ya-Hong; Zhang, Yong","Di-μ-chloro-bis[trichloro(4-chloroaniline)zirconium(IV)]","Acta Crystallographica Section E","2007","63","3","m798","m799","10.1107/S1600536807007003","","","0.7107","MoKα","","0.031","0.028","","","0.064","0.065","","","","","","1.142","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212740","5.3062","0.001","7.9717","0.0014","15.262","0.003","77.94","0.003","88.694","0.003","88.795","0.003","631.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[dichlorozinc(II)]-μ-1,2-di-4-pyridylethylene-κ^2^N:N']","","- C12 H10 Cl2 N2 Zn -","- C12 H10 Cl2 N2 Zn -","- C24 H20 Cl4 N4 Zn2 -","2","1","XU2205","Qin, Chuang-Ye; Xu, Jing-Wei","<i>catena</i>-Poly[[dichlorozinc(II)]-μ-1,2-di-4-pyridylethylene-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","3","m717","m718","10.1107/S1600536807005922","","","0.71073","MoKα","","0.08","0.06","","","0.116","0.127","","","","","","1.103","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212741","10.051","0.002","19.697","0.004","12.75","0.003","90","","90.7","0.03","90","","2524","0.9","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,4:12,13-Dibenzo-5,8,11-trioxo-1,15,18-triazonia-3,12-cycloeicosadiene tribromide","","- C22 H34 Br3 N3 O3 -","- C22 H34 Br3 N3 O3 -","- C88 H136 Br12 N12 O12 -","4","1","XU2206","Yan Wang; Gang Liu; Ling Xie; Ji-De Wang","3,4:12,13-Dibenzo-5,8,11-trioxo-1,15,18-triazonia-3,12-cycloeicosadiene tribromide","Acta Crystallographica Section E","2007","63","3","o1383","o1384","10.1107/S1600536807007313","","","0.71073","MoKα","","0.037","0.033","","","0.086","0.089","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212742","14.844","0.004","11.869","0.006","15.065","0.007","90","","119.11","0.03","90","","2318.9","1.8","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-[4-(tert-Butylsulfanyl)benzyl]-9,9-diethyl-9H-fluorene","","- C27 H30 S -","- C27 H30 S -","- C108 H120 S4 -","4","1","XU2207","Jian-Dong Fan; Wen-Tao Yu","2-[4-(<i>tert</i>-Butylsulfanyl)benzyl]-9,9-diethyl-9<i>H</i>-fluorene","Acta Crystallographica Section E","2007","63","3","o1243","o1244","10.1107/S1600536807006022","","","0.71073","MoKα","","0.177","0.069","","","0.158","0.208","","","","","","0.955","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212743","7.2047","0.0013","26.101","0.004","12.141","0.002","90","","90","","90","","2283.1","0.7","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Tetraaquabis[4-(dimethylamino)benzoato-κO]manganese(II) dihydrate","","- C18 H32 Mn N2 O10 -","- C18 H32 Mn N2 O10 -","- C72 H128 Mn4 N8 O40 -","4","0.5","XU2210","Hökelek, Tuncer; Necefoğlu, Hacali","Tetraaquabis[4-(dimethylamino)benzoato-κ<i>O</i>]manganese(II) dihydrate","Acta Crystallographica Section E","2007","63","3","m821","m823","10.1107/S1600536807007799","","","1.54184","CuKα","","0.1065","0.0568","","","0.1526","0.1763","","","","","","1.094","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212744","23.748","0.0008","7.2686","0.0003","15.871","0.0004","90","","112.24","0.0013","90","","2535.76","0.15","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Ethyl (E)-4-(2-acetylphenoxy)but-2-enoate","","- C14 H16 O4 -","- C14 H16 O4 -","- C112 H128 O32 -","8","1","XU2213","Williamson, Craig; Storey, John M. D.; Harrison, William T. A.","Ethyl (<i>E</i>)-4-(2-acetylphenoxy)but-2-enoate","Acta Crystallographica Section E","2007","63","3","o1428","o1429","10.1107/S1600536807007969","","","0.71073","MoKα","","0.049","0.038","","","0.098","0.105","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212745","5.2458","0.0007","11.1078","0.0015","13.106","0.0018","73.334","0.001","88.622","0.002","79.032","0.002","717.86","0.17","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","","- C12 H14 Cl N5 O4 -","- C12 H14 Cl N5 O4 -","- C24 H28 Cl2 N10 O8 -","2","1","YA2036","Liu, Chong-Bo; Yi, Xiu-Guang; Wu, Zi-Sheng; Chen, Jun-Hui; Wen, Hui-Liang","Dimethyl 2-[2-(2-amino-6-chloropurin-9-yl)ethyl]malonate","Acta Crystallographica Section E","2007","63","3","o1113","o1114","10.1107/S1600536807004552","","","0.71073","MoKα","","0.044","0.034","","","0.08","0.087","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212746","5.2298","0.0004","9.3849","0.0012","14.4858","0.0018","83.853","0.005","88.23","0.007","88.221","0.007","706.28","0.14","123","2","123","2","","","","","","","","4","P -1","-P 1","2","10,11-Dihydrocarbamazepine‒formic acid (1/1)","10,11-dihydro-5H-dibenz[<i>b</i>,<i>f</i>]azepine-5-carboxamide‒methanoic acid (1/1)","","- C16 H16 N2 O3 -","- C16 H16 N2 O3 -","- C32 H32 N4 O6 -","2","1","YA2039","Johnston, Andrea; Florence, Alastair J.; Fernandes, Philippe; Shankland, Norman; Kennedy, Alan R.","10,11-Dihydrocarbamazepine formic acid solvate","Acta Crystallographica Section E","2007","63","3","o1469","o1470","10.1107/S1600536807008124","","","0.71073","MoKα","","0.103","0.049","","","0.086","0.105","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212747","8.771","0.001","12.384","0.002","22.224","0.006","90","","95.47","0.02","90","","2403","0.8","297","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 7-methyl-2-[4-(methylsulfanyl)benzylidene]-5-[4-(methylsulfanyl)phenyl]-3-oxo- 2,3-dihydro-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate","","- C25 H24 N2 O3 S3 -","- C25 H24 N2 O3 S3 -","- C100 H96 N8 O12 S12 -","4","1","ZL2002","Fischer, Andreas; Yathirajan, H. S.; Mithun, A.; Bindya, S.; Naranaya, B.","Ethyl 7-methyl-2-[4-(methylsulfanyl)benzylidene]-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5<i>H</i>-thiazolo[3,2-<i>a</i>]pyrimidine-6-carboxylate","Acta Crystallographica Section E","2007","63","3","o1224","o1225","10.1107/S160053680700551X","","","0.71073","MoKα","","0.0966","0.0549","","","0.1193","0.1419","","","","","","1.051","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212748","8.585","0.0017","7.182","0.0014","23.786","0.005","90","","96.35","0.03","90","","1457.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-3,5-Dimethyl-[1-(4-nitrophenyl)ethylidene]aniline","","- C16 H16 N2 O2 -","- C16 H16 N2 O2 -","- C64 H64 N8 O8 -","4","1","AT2207","Xiu-Ying Yang; Yu-Feng Li; Jian Zheng; Fang-Fang Jian","<i>N</i>-3,5-Dimethyl-[1-(4-nitrophenyl)ethylidene]aniline","Acta Crystallographica Section E","2007","63","4","o1611","o1612","10.1107/S1600536807001365","","","0.71073","MoKα","","0.1594","0.0645","","","0.185","0.2357","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212749","7.2095","0.0005","9.4991","0.0006","10.113","0.0007","112.393","0.001","93.538","0.001","103.585","0.001","613.56","0.07","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","(2-Methyl-3-methylsulfanyl-1-benzofuran-5-yl)propanoic acid","","- C13 H14 O3 S -","- C13 H14 O3 S -","- C26 H28 O6 S2 -","2","1","AT2229","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","3-(2-Methyl-3-methylsulfanyl-1-benzofuran-5-yl)propanoic acid","Acta Crystallographica Section E","2007","63","4","o1588","o1589","10.1107/S1600536807009294","","","0.71073","MoKα","","0.0486","0.043","","","0.0966","0.0993","","","","","","1.087","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212750","11.9618","0.0002","8.5709","0.0008","16.127","0.003","90","","117.741","0.007","90","","1463.4","0.3","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","rac-(3E,3aR,6aR)-3-(Hydroxymethylene)- 3,3a,6,6a-tetrahydro-2H-cyclopenta[b]furan-2-one","","","- C8 H8 O3 -","- C8 H8 O3 -","- C64 H64 O24 -","8","2","AT2230","Christian Peifer; Schollmeyer, Dieter; Melanie Tschertsche; Stefan Laufer","<i>rac</i>-(3<i>E</i>,3a<i>R</i>,6a<i>R</i>)-3-(Hydroxymethylene)-3,3a,6,6a-tetrahydro-2<i>H</i>-cyclopenta[<i>b</i>]furan-2-one","Acta Crystallographica Section E","2007","63","4","o1551","o1553","10.1107/S1600536807009300","","","1.54178","CuKα","","0.0776","0.0563","","","0.1576","0.1746","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212751","10.1984","0.0012","13.4881","0.0016","11.4941","0.0013","90","","97.116","0.002","90","","1568.9","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","theophylline‒2,4-dihydroxybenzoic acid‒water (1/1/1)","","- C14 H16 N4 O7 -","- C14 H16 N4 O7 -","- C56 H64 N16 O28 -","4","1","AT2231","Wang, Zi-Liang; Wei, Lin-Heng","Theophylline‒2,4-dihydroxybenzoic acid‒water (1/1/1)","Acta Crystallographica Section E","2007","63","4","o1681","o1682","10.1107/S1600536807010410","","","0.71073","MoKα","","0.0692","0.0519","","","0.1282","0.1377","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212752","7.6761","0.0015","11.228","0.002","12.236","0.002","103.39","0.03","96.55","0.03","95.57","0.03","1010.9","0.4","183","2","183","2","","","","","","","","5","P -1","-P 1","2","","Dichloro[1-(2-methylbenzyl)-3-(2,4,6-trimethylbenzyl)imidazolidin-2- ylidene]ruthenium","","- C21 H26 Cl2 N2 Ru -","- C21 H26 Cl2 N2 Ru -","- C42 H52 Cl4 N4 Ru2 -","2","1","AT2232","Arslan, Hakan; VanDerveer, Don; Yaşar, Sedat; Özdemir, İsmail; Çetinkaya, Bekir","Dichlorido[1-(2-methylbenzyl)-3-(2,4,6-trimethylbenzyl)imidazolidin-2-ylidene]ruthenium(II)","Acta Crystallographica Section E","2007","63","4","m1001","m1003","10.1107/S160053680701032X","","","0.71073","MoKα","","0.0511","0.0415","","","0.083","0.0863","","","","","","1.108","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212753","16.735","0.0004","9.4399","0.0003","15.0421","0.0006","90","","121.097","0.002","90","","2034.81","0.12","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(2,2'-bipyridine-κ^2^N,N')dibromidocadmium(II)","","- C20 H16 Br2 Cd N4 -","- C20 H16 Br2 Cd N4 -","- C80 H64 Br8 Cd4 N16 -","4","0.5","AT2233","Zhu, Jian-Wei; E Yang; Xu-Chun Song; You-Dan Lin","Bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')dibromidocadmium(II)","Acta Crystallographica Section E","2007","63","4","m1044","m1045","10.1107/S1600536807011063","","","0.71073","MoKα","","0.0562","0.0307","","","0.0555","0.0597","","","","","","0.879","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212754","10.587","0.001","7.27","0.002","12.923","0.002","90","","111.331","0.002","90","","926.5","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","catena-Poly[[(N,N-dimethylethane-1,2-diamine)copper(II)]-di-μ~1,1~-azido- [(N,N-dimethylethane-1,2-diamine)copper(II)]-di-μ~1,3~-azido]","","- C8 H24 Cu2 N16 -","- C8 H24 Cu2 N16 -","- C16 H48 Cu4 N32 -","2","0.5","AT2235","Yun-Peng Diao","<i>catena</i>-Poly[[(<i>N</i>,<i>N</i>-dimethylethane-1,2-diamine)copper(II)]-di-μ~1,1~-azido-[(<i>N</i>,<i>N</i>-dimethylethane-1,2-diamine)copper(II)]-di-μ~1,3~-azido]","Acta Crystallographica Section E","2007","63","4","m1081","m1083","10.1107/S1600536807011816","","","0.71073","MoKα","","0.1363","0.0753","","","0.1394","0.1626","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212755","5.8925","0.0016","7.95","0.002","11.332","0.003","73.332","0.004","86.321","0.004","78.345","0.004","498.1","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","S-Phenyl N,N'-dimethyl-^13^C~2~-thiooxamate","","- C10 H11 N O2 S -","- C10 H11 N O2 S -","- C20 H22 N2 O4 S2 -","2","1","AT2236","Asani, Ernest M.; Khrustalev, Victor N.; Juarez, Ernesto; Martinez, Rodolfo A.; Timofeeva, Tatiana V.","<i>S</i>-Phenyl <i>N</i>,<i>N</i>'-dimethyl-^13^C~2~-thiooxamate: a by-product in the synthesis of ethyl <i>N</i>,<i>N</i>'-dimethyl-^13^C~2~-oxamate","Acta Crystallographica Section E","2007","63","4","o1802","o1804","10.1107/S1600536807011324","","","0.71073","MoKα","","0.037","0.0286","","","0.0687","0.0729","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212756","8.7544","0.0012","4.5159","0.0006","25.794","0.004","90","","96.402","0.003","90","","1013.4","0.2","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(E)-O-Ethyl N-(4-chlorophenyl)thiocarbamate","","- C9 H10 Cl N O S -","- C9 H10 Cl N O S -","- C36 H40 Cl4 N4 O4 S4 -","4","1","AT2237","Primjira P. Tadbuppa; Tiekink, Edward R. T.","(<i>E</i>)-<i>O</i>-Ethyl <i>N</i>-(4-chlorophenyl)thiocarbamate","Acta Crystallographica Section E","2007","63","4","o1779","o1780","10.1107/S1600536807011312","","","0.71069","MoKα","","0.074","0.061","","","0.146","0.153","","","","","","1.15","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212757","7.4305","0.0004","8.2","0.0005","23.0148","0.0009","90","","90","","90","","1402.29","0.13","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3,4-Dimethyl-2-phenyl-1-phosphaferrocene","","- C17 H17 Fe P -","- C17 H17 Fe P -","- C68 H68 Fe4 P4 -","4","1","AT2240","Scheibitz, Mathias; Lerner, Hans-Wolfram; Bolte, Michael","3,4-Dimethyl-2-phenyl-1-phosphaferrocene","Acta Crystallographica Section E","2007","63","4","m1118","m1119","10.1107/S1600536807012214","","","0.71073","MoKα","","0.0245","0.0238","","","0.0632","0.0636","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212758","7.4049","0.0008","4.2957","0.0003","20.154","0.002","90","","108.847","0.008","90","","606.71","0.1","296","","296","","","","","","","","","4","P 1 c 1","P -2yc","7","3-(2-pyridyliminomethyl)-5-methylsalicylaldehyde","(E)-2-Hydroxy-5-methyl-3-[(2-pyridylimino)methyl]benzaldehyde","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C28 H24 N4 O4 -","2","1","AT2241","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan; Narayana, B.; Vijesh, A. M.; Yathirajan, H. S.","(<i>E</i>)-2-Hydroxy-5-methyl-3-[(2-pyridylimino)methyl]benzaldehyde","Acta Crystallographica Section E","2007","63","4","o1916","o1918","10.1107/S1600536807012913","","","0.71073","MoKα","","0.058","0.043","","","0.1059","0.1144","","","","","","0.985","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212759","13.251","0.0009","6.8217","0.0003","16.0257","0.0012","90","","123.391","0.005","90","","1209.51","0.15","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-(p-methyanilino)phthalide","3-(4-methyanilino)isobenzofuran-1(3H)-one","","- C15 H13 N O2 -","- C15 H13 N O2 -","- C60 H52 N4 O8 -","4","1","AT2247","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","3-(4-Methylanilino)isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","4","o1999","o2001","10.1107/S1600536807014080","","","0.71073","MoKα","","0.0502","0.0388","","","0.0966","0.1026","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212760","10.2018","0.0007","16.7019","0.0011","22.1016","0.0014","90","","90","","90","","3765.9","0.4","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","246TPST","2,4,6-tris(pyridin-2-ylsulfanyl)-1,3,5-triazine","","- C18 H12 N6 S3 -","- C18 H12 N6 S3 -","- C144 H96 N48 S24 -","8","2","AV3075","Galicia-López, Oscar; Morales-Morales, David; Hernández-Ortega, Simón","2,4,6-Tris(pyridin-2-ylsulfanyl)-1,3,5-triazine","Acta Crystallographica Section E","2007","63","4","o1635","o1637","10.1107/S1600536807010045","","","0.71073","MoKα","","0.092","0.0451","","","0.0493","0.0553","","","","","","0.808","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212761","8.981","0.002","11.056","0.002","11.676","0.002","92.11","0.03","112.13","0.03","101.39","0.03","1044.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-chloro-bis[(3,4-η)-(2,5-dimethylhex-3-yne-2,5-diol)copper(I)]","","- C16 H28 Cl2 Cu2 O4 -","- C16 H28 Cl2 Cu2 O4 -","- C32 H56 Cl4 Cu4 O8 -","2","1","BG2029","Imhof, Wolfgang; Schmidt, Andreas; Walther, Dirk","Di-μ-chlorido-bis{[(3,4-η)-2,5-dimethylhex-3-yne-2,5-diol]copper(I)}","Acta Crystallographica Section E","2007","63","4","m968","m970","10.1107/S1600536807009580","","","0.71073","MoKα","","0.0616","0.0515","","","0.1309","0.1433","","","","","","1.143","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212762","8.191","0.0001","15.1488","0.0002","12.5623","0.0002","90","","107.885","0.002","90","","1483.45","0.04","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,1'-[4-(5-bromo-2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-diyl]diethanone","","- C15 H16 Br N O3 -","- C15 H16 Br N O3 -","- C60 H64 Br4 N4 O12 -","4","1","BG2031","Švorc, Ľubomír; Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan; Šafář Peter","1,1'-[4-(5-Bromo-2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-diyl]diethanone","Acta Crystallographica Section E","2007","63","4","o1590","o1592","10.1107/S1600536807009737","","","0.71073","MoKα","","0.0608","0.0308","","","0.0811","0.1113","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212763","5.0911","0.0003","26.509","0.0017","7.4671","0.0005","90","","106.103","0.002","90","","968.22","0.11","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Chloro-N-methylacetamide","","- C3 H6 Cl N O -","- C3 H6 Cl N O -","- C24 H48 Cl8 N8 O8 -","8","2","BG2032","Sousa, Alvaro S. de; Marques, Helder M.; Fernandes, Manuel A.","2-Chloro-<i>N</i>-methylacetamide revisited: a low-temperature study","Acta Crystallographica Section E","2007","63","4","o1642","o1644","10.1107/S1600536807009956","","","0.71073","MoKα","","0.0573","0.038","","","0.0847","0.0907","","","","","","0.99","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212764","9.1897","0.0003","12.9937","0.0003","15.0869","0.0005","110.077","0.002","95.308","0.002","94.573","0.002","1672.76","0.09","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","Bis{N-[bis(6-bromopyridin-2-yl)methylene-κN]ethane-1,2-diamine- κ^2^N,N'}nickel(II) bis(perchlorate)","","- C26 H24 Br4 Cl2 N8 Ni O8 -","- C26 H24 Br4 Cl2 N8 Ni O8 -","- C52 H48 Br8 Cl4 N16 Ni2 O16 -","2","1","BG2034","Knight, James C.; Amoroso, Angelo J.; Prabaharan, Ravi; Edwards, Peter G.","Bis{<i>N</i>-[bis(6-bromopyridin-2-yl)methylene-κ<i>N</i>]ethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>'}nickel(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","4","m1046","m1047","10.1107/S1600536807010653","","","0.71073","MoKα","","0.1171","0.0638","","","0.1288","0.1483","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212765","11.288","0.002","8.0129","0.0016","15.702","0.003","90","","92.77","0.03","90","","1418.6","0.5","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","catena-Poly[[[tetraaquanickel(II)]-μ~2~-4,4'-bipyridine-κ^2^N:N'] bis(4-aminobenzensulfonate) dihydrate]","","- C22 H32 N4 Ni O12 S2 -","- C22 H30 N4 Ni O12 S2 -","- C44 H60 N8 Ni2 O24 S4 -","2","1","BG2040","Zhang, Xiao; Yi, Zhi-Hui; Yu, Xiao-Yang; Yang, Qing-Feng; Xu, Ji-Qing","<i>catena</i>-Poly[[[tetraaquanickel(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] bis(4-aminobenzensulfonate) dihydrate]","Acta Crystallographica Section E","2007","63","4","m1142","m1144","10.1107/S1600536807012780","","","0.71073","MoKα","","0.0348","0.0322","","","0.0795","0.0816","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212766","11.447","0.002","9.3143","0.0019","12.78","0.003","90","","97.38","0.03","90","","1351.3","0.5","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-Diaquabis(quinoline-2-carboxylato)nickel(II) dimethylformamide disolvate","","- C26 H30 N4 Ni O8 -","- C26 H30 N4 Ni O8 -","- C52 H60 N8 Ni2 O16 -","2","0.5","BG3031","Zhang, Xiao; Yang, Qing-Feng; Yi, Zhi-Hui; Xu, Ji-Qing","<i>trans</i>-Diaquabis(quinoline-2-carboxylato)nickel(II) dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","4","m1034","m1036","10.1107/S1600536807010987","","","0.71073","MoKα","","0.0551","0.0434","","","0.107","0.1141","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212767","8.3567","0.0017","16.327","0.003","9.0472","0.0018","90","","114.33","0.003","90","","1124.8","0.4","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","poly[bis(nitrato-κO)bis[μ-1-(4-pyridylmethyl)-1H-imidazole- κ^2^N:N']cadmium(II)]","","- C18 H18 Cd N8 O6 -","- C18 H18 Cd N8 O6 -","- C36 H36 Cd2 N16 O12 -","2","0.5","BH2071","Li, Yong-Fang; Lou, Tian-Jun","A two-dimensional cadmium(II) coordination polymer: poly[bis(nitrato-κ<i>O</i>)bis[μ-1-(4-pyridylmethyl)-1<i>H</i>-imidazole-κ^2^<i>N</i>:<i>N</i>']cadmium(II)]","Acta Crystallographica Section E","2007","63","4","m994","m996","10.1107/S1600536807007593","","","0.71073","MoKα","","0.0452","0.0383","","","0.1012","0.1071","","","","","","1.003","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212768","12.421","0.0015","13.864","0.0016","14.4979","0.0017","104.642","0.002","109.256","0.001","93.877","0.002","2249","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Bis[tris(1,10-phenanthroline-κ^2^N,N')manganese(II)] dodecatungstogermanate dihydrate","","- C72 H52 Ge Mn2 N12 O42 W12 -","- C72 H48 Ge Mn2 N12 O42 W12 -","- C72 H48 Ge Mn2 N12 O42 W12 -","1","0.5","BH2076","Zhou, Da-Peng; Guo, Gui-Ling","Bis[tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)] dodecatungstogermanate dihydrate","Acta Crystallographica Section E","2007","63","4","m1122","m1124","10.1107/S1600536807012196","","","0.71073","MoKα","","0.0995","0.0688","","","0.1497","0.1632","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212769","8.897","0.003","11.658","0.003","16.107","0.005","90","","101.038","0.005","90","","1639.7","0.9","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[μ~2~-bis(salicylidene)propane-1,3-diaminato- κ^4^O,N,N',O':κ^2^O,O']bis(μ~2~-nitrato-κO:κO')tricopper(II)","","- C34 H32 Cu3 N6 O10 -","- C34 H32 Cu3 N6 O10 -","- C68 H64 Cu6 N12 O20 -","2","0.5","BH2077","Yun-Feng Feng; Hong-Yan Wu; Bao-Lin Zhu; Shu-Rong Wang; Wei-Ping Huang","Bis[μ~2~-bis(salicylidene)propane-1,3-diaminato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>':κ^2^<i>O</i>,<i>O</i>']bis(μ~2~-nitrato-κ<i>O</i>:κ<i>O</i>')tricopper(II)","Acta Crystallographica Section E","2007","63","4","m1107","m1108","10.1107/S1600536807012172","","","0.7107","MoKα","","0.0585","0.0494","","","0.091","0.0955","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212770","5.8006","0.0007","8.7767","0.0011","13.0427","0.0016","87.922","0.002","84.784","0.002","74.73","0.002","637.86","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-poly[[trans-bis[3-(1H-imidazol-1-yl)-1-phenylpropan-1-one- κN]manganese(II)]-di-μ-thiocyanato-κ^2^N:S,κ^2^S:N]","","- C26 H24 Mn N6 O2 S2 -","- C26 H24 Mn N6 O2 S2 -","- C26 H24 Mn N6 O2 S2 -","1","0.5","BH2079","Cai, Hua; Guo, Ying; Li, Yan; Li, Jian-Gang","<i>catena</i>-poly[[<i>trans</i>-bis[3-(1<i>H</i>-imidazol-1-yl)-1-phenylpropan-1-one-κ<i>N</i>]manganese(II)]-di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>]","Acta Crystallographica Section E","2007","63","4","m936","m938","10.1107/S1600536807009233","","","0.71073","MoKα","","0.0426","0.0312","","","0.0757","0.0799","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212771","10.6245","0.0017","9.0387","0.0014","10.4509","0.0016","90","","97.042","0.013","90","","996","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4'-Bis(4-nitrophenoxy)biphenyl","","- C24 H16 N2 O6 -","- C24 H16 N2 O6 -","- C48 H32 N4 O12 -","2","0.5","BH2083","Sajid, Samia; Akhter, Zareen; Bolte, Michael; Siddiqi, Humaira M.","4,4'-Bis(4-nitrophenoxy)biphenyl","Acta Crystallographica Section E","2007","63","4","o1710","o1711","10.1107/S1600536807007428","","","0.71073","MoKα","","0.0316","0.0244","","","0.0703","0.0729","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212772","11.7788","0.0015","8.5808","0.0011","12.334","0.0016","90","","111.113","0.002","90","","1162.9","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-aminopyridinium 2,4-dihydroxybenzoate","","- C12 H12 N2 O4 -","- C12 H12 N2 O4 -","- C48 H48 N8 O16 -","4","1","BH2086","Wang, Zi-Liang; Xie, Jian-Gang; Wei, Lin-Heng","3-Aminopyridinium 2,4-dihydroxybenzoate: a three-dimensional supramolecular adduct assembled <i>via</i> hydrogen bonds","Acta Crystallographica Section E","2007","63","4","o1579","o1580","10.1107/S1600536807009439","","","0.71073","MoKα","","0.0439","0.0397","","","0.1102","0.1136","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212773","7.8481","0.0011","16.659","0.002","7.8481","0.0011","90","","90.84","0.01","90","","1026","0.2","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(-)-N-[(3R)-3-(4-Fluorophenyl)-pentanoyl]bornane-10,2-sultam","","- C21 H28 F N O3 S -","- C21 H28 F N O3 S -","- C42 H56 F2 N2 O6 S2 -","2","1","BI2159","Xiu-Fang Cao; Guang-Ao Yu; Sheng-Hua Liu; Ming Hu; Min Wang","({-})-<i>N</i>-[(3<i>R</i>)-3-(4-Fluorophenyl)pentanoyl]bornane-10,2-sultam","Acta Crystallographica Section E","2007","63","4","o2034","o2035","10.1107/S1600536807013803","","","0.71073","MoKα","","0.0679","0.0605","","","0.1602","0.1824","","","","","","1.087","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212774","17.148","0.006","18.399","0.006","10.847","0.004","90","","96.606","0.005","90","","3400","2","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,3-Bis(6-methyl-2-pyridylimino)-2,3-dihydro-1H-isoindoline","","- C20 H17 N5 -","- C20 H17 N5 -","- C160 H136 N40 -","8","2","BI2163","Hao, Yao-Zong; Xu, Ying; Wei, Xue-Hong; Tong, Hong-Bo","1,3-Bis(6-methyl-2-pyridylimino)-2,3-dihydro-1<i>H</i>-isoindoline","Acta Crystallographica Section E","2007","63","4","o1549","o1550","10.1107/S1600536807009075","","","0.71073","MoKα","","0.1058","0.0498","","","0.1157","0.1425","","","","","","0.999","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212775","8.0191","0.0001","10.7394","0.0002","20.0764","0.0004","90","","101.11","0.001","90","","1696.58","0.05","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 1-benzyl-3-(4-chlorophenyl)-1<i>H</i>-pyrazole-5-carboxylate","","- C19 H17 Cl N2 O2 -","- C19 H17 Cl N2 O2 -","- C76 H68 Cl4 N8 O8 -","4","1","BI2164","Xia, Yong; Dong, Wen-Liang; Ge, Yang-Qing; Wei, Fang; Zhao, Bao-Xiang","Ethyl 1-benzyl-3-(4-chlorophenyl)-1<i>H</i>-pyrazole-5-carboxylate","Acta Crystallographica Section E","2007","63","4","o1613","o1614","10.1107/S1600536807007064","","","0.71073","MoKα","","0.0587","0.04","","","0.1","0.1118","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212776","11.1991","0.0016","11.1991","0.0016","6.9696","0.0014","90","","90","","120","","757","0.2","293","2","293","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","<i>catena</i>-poly[[silver(I)-μ-1,4-diazabicyclo[2.2.2]octane-κ^2^N:N'] 3,5-dinitro-2-hydroxybenzoate]","","- C13 H15 Ag N4 O7 -","- C13.02 H12 Ag N3.983 O7.08 -","- C26.04 H24 Ag2 N7.966 O14.16 -","2","0.0833333","BQ2001","Yang Qu; Jin Wu","The infinite one-dimensional chain polymer <i>catena</i>-poly[[silver(I)-μ-1,4-diazabicyclo[2.2.2]octane-κ^2^<i>N</i>:<i>N</i>'] 2-hydroxy-3,5-dinitrobenzoate]]","Acta Crystallographica Section E","2007","63","4","m1063","m1065","10.1107/S1600536807010835","","","0.71073","MoKα","","0.0333","0.0321","","","0.0837","0.0872","","","","","","1.002","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212777","9.4775","0.0019","19.873","0.004","11.029","0.002","90","","106.69","0.03","90","","1989.8","0.7","90","0.2","90","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Tetrakis(4-fluorophenyl)stannane","","- C24 H16 F4 Sn -","- C24 H16 F4 Sn -","- C96 H64 F16 Sn4 -","4","1","BQ2002","Shaikh, Nadim S.; Parkin, Sean; Lehmler, Hans-J.","Tetrakis(4-fluorophenyl)stannane","Acta Crystallographica Section E","2007","63","4","m927","m928","10.1107/S1600536807008677","","","1.54178","CuKα","","0.0244","0.0234","","","0.0601","0.0606","","","","","","1.137","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212778","27.643","0.015","5.638","0.003","8.018","0.004","90","","95.1601","0.0018","90","","1244.6","1.1","123.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-Hydroxy-<i>N</i>-phenylnaphthalene-2-carboxamide","","- C17 H13 N O2 -","- C17 H13 N O2 -","- C68 H52 N4 O8 -","4","1","BQ2003","Kubo, Kanji; Matsumoto, Taisuke; Yuhi, Katsutoshi; Kubo, Junko; Sakurai, Tadamitsu","<i>N</i>-Hydroxy-<i>N</i>-phenylnaphthalene-2-carboxamide","Acta Crystallographica Section E","2007","63","4","o1942","o1944","10.1107/S1600536807011798","","","0.7107","MoKα","","","0.0513","","","","0.121","","","","","","1.134","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212779","7.703","0.004","11.452","0.006","15.37","0.009","78.182","0.009","77.17","0.009","89.784","0.009","1292.8","1.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[1,10-phenanthroline-κ^2^N,N')cadmium(II)]- μ-3,5-dimethylbenzoato-κ^2^O:O']","","- C30 H26 Cd N2 O4 -","- C30 H26 Cd N2 O4 -","- C60 H52 Cd2 N4 O8 -","2","1","BR2029","Man-Sheng Chen; Chun-Hua Zhang; Dai-Zhi Kuang; Yong-Lan Feng; Yi-Fang Deng","<i>catena</i>-Poly[[1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ-3,5-dimethylbenzoato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","4","m965","m967","10.1107/S1600536807009579","","","0.71073","MoKα","","0.09","0.0608","","","0.1484","0.1722","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212780","4.2286","0.0003","4.2286","0.0003","7.5566","0.0013","90","","90","","120","","117.02","0.02","167","0.1","167","0.1","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","Trilithium phosphide","","- Li3 P -","- Li3 P -","- Li6 P2 -","2","0.0833333","BR2030","Yongkwan Dong; Francis J. DiSalvo","Reinvestigation of trilithium phosphide, Li~3~P","Acta Crystallographica Section E","2007","63","4","i97","i98","10.1107/S1600536807008422","","","0.71073","MoKα","","0.0182","0.0154","","","0.0337","0.0344","","","","","","1.231","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212781","28.206","0.006","5.921","0.001","28.528","0.006","90","","114.16","0.03","90","","4347.1","1.8","473","2","473","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","strontium tellurite","","- O3 Sr Te -","- O3 Sr Te -","- O144 Sr48 Te48 -","48","6","BR2032","Zavodnik, Valery E.; Ivanov, Sergey A.; Stash, Adam I.","On the thermal evolution of the crystal structure of SrTeO~3~: the β-form at 473K","Acta Crystallographica Section E","2007","63","4","i111","i112","10.1107/S160053680701210X","","","0.56086","AgKα","","0.2295","0.0393","","","0.0744","0.0858","","","","","","0.72","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212782","12.5381","0.0003","11.4983","0.0003","8.0195","0.0002","90","","91.3913","0.0012","90","","1155.81","0.05","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tricaesium dihydroxotetraoxoplutonate(VII) trihydrate","","- Cs3 H8 O9 Pu -","- Cs3 H8 O9 Pu -","- Cs12 H32 O36 Pu4 -","4","0.5","BR2033","Grigoriev, Mikhail S.; Krot, Nikolai N.","Tricaesium dihydroxotetraoxoplutonate(VII) trihydrate","Acta Crystallographica Section E","2007","63","4","i108","i110","10.1107/S1600536807011877","","","0.71073","MoKα","","0.0282","0.0213","","","0.0418","0.0438","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212783","11.582","0.002","5.4948","0.0011","17.171","0.003","90","","91.65","0.03","90","","1092.3","0.3","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","4-(4-Bromophenylsulfonyl)-1-oxa-4-azacyclohexadecan-16-one","","- C20 H30 Br N O4 S -","- C20 H30 Br N O4 S -","- C40 H60 Br2 N2 O8 S2 -","2","1","BT2253","Dong, Yan-Hong; Ma, Yong-Qiang; Wang, Ming-An; Chen, Fu-Heng; Wang, Dao-Quan","4-(4-Bromophenylsulfonyl)-1-oxa-4-azacyclohexadecan-16-one","Acta Crystallographica Section E","2007","63","4","o1928","o1929","10.1107/S1600536807006186","","","0.71073","MoKα","","0.1251","0.0583","","","0.1306","0.1506","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212784","26.146","0.003","4.4189","0.0005","17.2594","0.0019","90","","119.006","0.002","90","","1744","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,6-Dibromobenzene-1,3-diol monohydrate","","- C6 H6 Br2 O3 -","- C6 H6 Br2 O3 -","- C48 H48 Br16 O24 -","8","1","BT2277","Kirsop, Peter; Storey, John M. D.; Harrison, William T. A.","4,6-Dibromobenzene-1,3-diol monohydrate","Acta Crystallographica Section E","2007","63","4","o1577","o1578","10.1107/S1600536807008781","","","0.71073","MoKα","","0.1022","0.0599","","","0.1396","0.1524","","","","","","0.907","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212785","12.9715","0.0008","14.616","0.0008","10.033","0.0005","90","","97.739","0.003","90","","1884.85","0.18","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Allanxanthone A","4-(1,1-dimethyl-2-prop-2-enyl)-1,3,5-trihydroxy-2-(3-methylbut-2-enyl)-\ 9H-xanthen-9-one","","- C23 H24 O5 -","- C23 H24 O5 -","- C92 H96 O20 -","4","1","BT2280","Ndjakou Lenta, Bruno; Krishna Prasad Devkota; Beate Neumann; Etienne Tsamo; Norbert Sewald","4-(1,1-Dimethylprop-2-enyl)-1,3,5-trihydroxy-2-(3-methylbut-2-enyl)-9<i>H</i>-xanthen-9-one","Acta Crystallographica Section E","2007","63","4","o1629","o1631","10.1107/S1600536807009907","","","0.71073","MoKα","","0.0794","0.0476","","","0.1178","0.134","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212786","9.7344","0.0001","12.3295","0.0001","13.3352","0.0002","102.629","0.002","97.849","0.001","112.325","0.002","1401.3","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Indole","2-Methyl-1-phenylsulfonyl-1H-indole-3-carbonitrile","","- C16 H12 N2 O2 S -","- C16 H12 N2 O2 S -","- C64 H48 N8 O8 S4 -","4","2","BT2281","P. Sakthivel; K. Sethusankar; P. Jai shankar; P. S. Joseph","2-Methyl-1-phenylsulfonyl-1<i>H</i>-indole-3-carbonitrile","Acta Crystallographica Section E","2007","63","4","o1947","o1948","10.1107/S1600536807012019","","","0.71073","MoKα","","","0.0567","","","","0.1837","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212787","7.525","0.002","9.219","0.002","8.198","0.002","90","","110.24","0.002","90","","533.6","0.2","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(1H-Tetrazol-4-yl)ethanol","","- C3 H6 N4 O -","- C3 H6 N4 O -","- C12 H24 N16 O4 -","4","1","BT2282","Lyakhov, Alexander S.; Grigoriev, Yuri V.; Ivashkevich, Ludmila S.; Gaponik, Pavel N.","2-(1<i>H</i>-Tetrazol-1-yl)ethanol","Acta Crystallographica Section E","2007","63","4","o1573","o1574","10.1107/S1600536807009567","","","0.71073","MoKα","","0.0446","0.0352","","","0.1021","0.1112","","","","","","1.075","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212788","18.831","0.002","6.961","0.0007","9.6196","0.0004","90","","90","","90","","1260.96","0.19","299","2","299","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","2,2,2-Trimethyl-N-(2,4,5-trichlorophenyl)acetamide","","- C11 H12 Cl3 N O -","- C11 H12 Cl3 N O -","- C44 H48 Cl12 N4 O4 -","4","0.5","BT2283","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","2,2,2-Trimethyl-<i>N</i>-(2,4,5-trichlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","4","o1981","o1982","10.1107/S1600536807013505","","","1.5418","CuKα","","0.0423","0.0378","","","0.1032","0.1071","","","","","","1.097","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212789","13.6001","0.0007","17.1608","0.001","10.8703","0.0005","90","","111.351","0.004","90","","2362.9","0.2","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-(4-Methylbenzoyl)-4-(4-methylphenyl)-1-[(1-phenylethylidene)amino]pyrimidin- 2(1H)-one","","- C27 H23 N3 O2 -","- C27 H23 N3 O2 -","- C108 H92 N12 O8 -","4","1","BT2285","Sema Öztürk Yıldırım; Mehmet Akkurt; Zülbiye Önal; Orhan Büyükgüngör","5-(4-Methylbenzoyl)-4-(4-methylphenyl)-1-[(1-phenylethylidene)amino]pyrimidin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","4","o1712","o1713","10.1107/S1600536807011117","","","0.71073","MoKα","","0.0725","0.0486","","","0.1246","0.1366","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212790","7.806","0.002","15.064","0.003","21.247","0.003","90","","90","","90","","2498.4","0.9","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","13-Oxofumitremorgin B","5a-Hydroxy-9-methoxy-11-(3-methyl-2-butenyl)-12-(2-methyl-1-propenyl)- 2,3,11,12-tetrahydro-1H,5H- pyrrolo[1'',2'':4',5']pyrazino[1',2':1,6]pyrido[3,4-b]indole- 5,6,14(5aH,14aH)-trione","","- C27 H31 N3 O5 -","- C27 H31 N3 O5 -","- C108 H124 N12 O20 -","4","1","BT2286","Fa-Zuo Wang; Min Zhang; Wei Sun; Qian-Qun Gu; Wei-Ming Zhu","5a-Hydroxy-9-methoxy-11-(3-methyl-2-butenyl)-12-(2-methyl-1-propenyl)-2,3,11,12-tetrahydro-1<i>H</i>,5<i>H</i>-pyrrolo[1'',2'':4',5']pyrazino[1',2':1,6]pyrido[3,4-<i>b</i>]indole-5,6,14(5a<i>H</i>,14a<i>H</i>)-trione","Acta Crystallographica Section E","2007","63","4","o1859","o1860","10.1107/S1600536807012056","","","0.71073","MoKα","","0.0768","0.0426","","","0.0997","0.1239","","","","","","1.068","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212791","11.7548","0.0011","14.4443","0.0014","20.946","0.002","90","","90","","90","","3556.4","0.6","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","4-(2,4-Dichlorophenyl)-5-(N,N-diethylcarbamoyl)-6-methyl-3,4-dihydropyrimidine- 2(1H)-thione","","- C16 H19 Cl2 N3 O S -","- C16 H19 Cl2 N3 O S -","- C128 H152 Cl16 N24 O8 S8 -","8","2","BT2288","B. Sridhar; K. Ravikumar; Y. S. Sadanandam","4-(2,4-Dichlorophenyl)-5-(<i>N</i>,<i>N</i>-diethylcarbamoyl)-6-methyl-3,4-dihydropyrimidine-2(1<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","4","o1772","o1773","10.1107/S1600536807011440","","","0.71073","MoKα","","0.0362","0.0337","","","0.0836","0.0854","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212792","16.386","0.002","3.9388","0.0008","28.566","0.003","90","","90.272","0.009","90","","1843.7","0.5","303","2","303","2","","","","","","","","5","P 1 c 1","P -2yc","7","N-(2-nitrophenyl)-2-chloroacetamide","2-Chloro-N-(2-nitrophenyl)acetamide","","- C8 H7 Cl N2 O3 -","- C8 H7 Cl N2 O3 -","- C64 H56 Cl8 N16 O24 -","8","4","BT2290","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","2-Chloro-<i>N</i>-(2-nitrophenyl)acetamide","Acta Crystallographica Section E","2007","63","4","o1975","o1976","10.1107/S1600536807013025","","","0.71073","MoKα","","0.1003","0.0533","","","0.1067","0.1234","","","","","","0.904","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212793","8.266","0.004","12.848","0.007","22.977","0.012","90","","90","","90","","2440","2","292","2","292","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","Chlorido(η^5^-pentamethylcyclopentadienyl)(1,10-phenanthroline- κ^2^N,N')iridium(III) trifluoromethanesulfonate","","- C23 H23 Cl F3 Ir N2 O3 S -","- C23 H23 Cl F3 Ir N2 O3 S -","- C92 H92 Cl4 F12 Ir4 N8 O12 S4 -","4","1","BT2291","Michael Scharwitz; Sven Schäfer; Tobias van Almsick; William S. Sheldrick","Chlorido(η^5^-pentamethylcyclopentadienyl)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')iridium(III) trifluoromethanesulfonate","Acta Crystallographica Section E","2007","63","4","m1111","m1113","10.1107/S1600536807011750","","","0.71073","MoKα","","0.0692","0.0435","","","0.0685","0.0752","","","","","","1.014","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212794","9.5494","0.0007","9.6345","0.0007","26.3629","0.0019","90","","90","","90","","2425.5","0.3","299","2","299","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(-)-<i>N</i>-[(3<i>R</i>)-3-(4-Chlorophenyl)-4-phenylbutananoyl]bornane-10,2- sultam","","- C26 H30 Cl N O3 S -","- C26 H30 Cl N O3 S -","- C104 H120 Cl4 N4 O12 S4 -","4","1","BT2293","Yan Lin; Xiu-Fang Cao; Ming Hu; Guang-Ao Yu; Sheng-Hua Liu","({-})-<i>N</i>-[(3<i>R</i>)-3-(4-Chlorophenyl)-4-phenylbutananoyl]bornane-10,2-sultam","Acta Crystallographica Section E","2007","63","4","o1872","o1873","10.1107/S1600536807012081","","","0.71073","MoKα","","0.0461","0.0419","","","0.1066","0.1104","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212795","20.213","0.0003","11.512","0.0006","9.783","0.0002","90","","115.72","0.005","90","","2050.89","0.15","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[diaqua(isonicotinato-κ^2^O,O')thulium(III)]- μ-di-μ~2~-isonicotinato-κ^4^O:O']","","- C18 H16 N3 O8 Tm -","- C18 H16 N3 O8 Tm -","- C72 H64 N12 O32 Tm4 -","4","0.5","BT2294","Guo-Ming Wang; Zeng-Xin Li; Shu-Yun Xue; Chun-Sheng Duan","<i>catena</i>-Poly[[diaqua(isonicotinato-κ^2^<i>O</i>,<i>O</i>')thulium(III)]-μ-di-μ-isonicotinato-κ^4^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","4","m1125","m1127","10.1107/S1600536807012457","","","0.71073","MoKα","","0.035","0.0305","","","0.0755","0.0773","","","","","","1.084","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212796","9.7835","0.0017","10.6602","0.0018","11.304","0.0019","85.684","0.003","84.1","0.003","64.454","0.003","1057.4","0.3","292","2","292","2","","","","","","","","3","P -1","-P 1","2","","Diethyl 2,5-bis(1,3-benzodioxol-5-yl)furan-3,4-dicarboxylate","","- C24 H20 O9 -","- C24 H20 O9 -","- C48 H40 O18 -","2","1","BT2295","Hu, Sheng-li; Wang, Yu-Zhou; Gao, Meng","Diethyl 2,5-bis(1,3-benzodioxol-5-yl)furan-3,4-dicarboxylate","Acta Crystallographica Section E","2007","63","4","o1855","o1856","10.1107/S1600536807012044","","","0.71073","MoKα","","0.0733","0.0549","","","0.1373","0.1606","","","","","","1.057","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212797","28.574","0.006","10.458","0.002","8.158","0.0016","90","","90.78","0.03","90","","2437.6","0.8","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Dodecyloxy-2-(phenethyliminomethyl)phenol","","- C27 H39 N O2 -","- C27 H39 N O2 -","- C108 H156 N4 O8 -","4","1","BT2296","Räisänen, Minna T.; Leskelä, Markku; Repo, Timo","5-Dodecyloxy-2-(phenethyliminomethyl)phenol","Acta Crystallographica Section E","2007","63","4","o1816","o1817","10.1107/S1600536807012202","","","0.71073","MoKα","","0.1075","0.0523","","","0.1051","0.1265","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212798","6.768","0.0001","12.754","0.0002","30.183","0.0006","90","","90","","90","","2605.37","0.08","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Tirucalla-7,24-dien-3-one","","- C30 H48 O -","- C30 H48 O -","- C120 H192 O4 -","4","1","BT2297","Diderot Tchamo Noungoue; Ndjakou Lenta, Bruno; Annelise Lobstein; Silvere Ngouela; Etienne Tsamo","Tirucalla-7,24-dien-3-one","Acta Crystallographica Section E","2007","63","4","o2038","o2039","10.1107/S1600536807012949","","","0.71073","MoKα","","0.0637","0.0451","","","0.1061","0.1154","","","","","","1.019","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212799","8.12","0.002","8.47","0.002","9.165","0.002","106.33","0.03","105.68","0.03","109.41","0.03","522.4","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","2-Carboxyquinolinium chloride monohydrate","","- C10 H10 Cl N O3 -","- C10 H10 Cl N O3 -","- C20 H20 Cl2 N2 O6 -","2","1","BT2298","Räisänen, Minna T.; Klinga, Martti; Leskelä, Markku; Repo, Timo","2-Carboxyquinolinium chloride monohydrate","Acta Crystallographica Section E","2007","63","4","o1926","o1927","10.1107/S1600536807013062","","","0.71073","MoKα","","0.0695","0.0402","","","0.0849","0.0945","","","","","","0.993","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212800","8.9404","0.0001","12.7563","0.0001","15.0229","0.0002","90","","90.9663","0.0007","90","","1713.06","0.03","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{4-Allyloxy-2,6-bis[(dimethylamino)methyl]phenyl- κ^3^C^1^,N,N'}iodopalladium(II)","","- C15 H23 I N2 O Pd -","- C15 H23 I N2 O Pd -","- C60 H92 I4 N8 O4 Pd4 -","4","1","BT2299","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.; Dijkstra, Harm P.; Koten, Gerard von","{4-Allyloxy-2,6-bis[(dimethylamino)methyl]phenyl-κ^3^<i>C</i>^1^,<i>N</i>,<i>N</i>'}iodidopalladium(II)","Acta Crystallographica Section E","2007","63","4","m1096","m1098","10.1107/S1600536807012433","","","0.71073","MoKα","","0.0212","0.0182","","","0.0402","0.0412","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212801","7.9987","0.0006","12.8279","0.0009","20.2396","0.0014","90","","90","","90","","2076.7","0.3","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","zolmitriptan.chloroform","(S)-4-[3-{2-(dimethylamino)ethyl}-1H-indol-5-yl methyl]-2-oxazolidinone. chloroform solvate","","- C17 H22 Cl3 N3 O2 -","- C17 H22 Cl3 N3 O2 -","- C68 H88 Cl12 N12 O8 -","4","1","BT2300","B. Sridhar; K. Ravikumar; Harihara Krishnan","Zolmitriptan chloroform solvate","Acta Crystallographica Section E","2007","63","4","o1961","o1962","10.1107/S1600536807014092","","","0.71073","MoKα","","0.0917","0.0789","","","0.2269","0.2427","","","","","","1.051","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212802","8.7405","0.0006","21.3242","0.0015","22.2434","0.0016","90","","90","","90","","4145.8","0.5","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Rizatriptan benzoate","N,N-dimethyl-3-[5-(1H-1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl]ethanaminium benzoate","","- C22 H25 N5 O2 -","- C22 H25 N5 O2 -","- C176 H200 N40 O16 -","8","1","BT2302","Krishnan Ravikumar; Balasubramanian Sridhar; Harihara Krishnan","Rizatriptan benzoate, a drug for the treatment of migraine headache","Acta Crystallographica Section E","2007","63","4","o1958","o1960","10.1107/S1600536807013323","","","0.71073","MoKα","","0.0624","0.0468","","","0.1165","0.128","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212803","11.297","0.005","13.012","0.005","13.751","0.005","94.688","0.005","107.801","0.005","91.108","0.005","1916","1.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","1,3-Bis[chlorobis(dimethylphenylsilyl)methyl]triselane","","- C34 H44 Cl2 Se3 Si4 -","- C34 H44 Cl2 Se3 Si4 -","- C68 H88 Cl4 Se6 Si8 -","2","1","BT2303","Klapötke, Thomas M.; Krumm, Burkhard; Scherr, Matthias","1,3-Bis[chlorobis(dimethylphenylsilyl)methyl]triselane","Acta Crystallographica Section E","2007","63","4","o1965","o1966","10.1107/S1600536807013256","","","0.71073","MoKα","","0.1325","0.0645","","","0.126","0.1402","","","","","","0.915","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212804","10.792","0.002","10.6383","0.0019","12.518","0.002","90","","90","","90","","1437.2","0.4","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(1-Oxo-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octan-4-yl)methanol","","- C5 H9 O5 P -","- C5 H9 O5 P -","- C40 H72 O40 P8 -","8","1","BX2068","Guo, Ming-Lin; Zang, Hong-Jun","(1-Oxo-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octan-4-yl)methanol","Acta Crystallographica Section E","2007","63","4","o1967","o1968","10.1107/S1600536807012986","","","0.71073","MoKα","","0.0453","0.0329","","","0.0819","0.0889","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212805","7.3433","0.001","10.1179","0.0013","10.5228","0.0014","89.51","0.002","84.514","0.002","88.697","0.002","778.03","0.18","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","catena-poly[hemi(piperazine-1,4-diium) [boron-di-μ-hydrogenphosphato- κ^4^O:O']]","","- C4 H16 B2 N2 O16 P4 -","- C4 H16 B2 N2 O16 P4 -","- C8 H32 B4 N4 O32 P8 -","2","1","CF2088","Min Li; Hui Xu; Zhen-Ling Wang; Heng-Zhen Shi","A new non-metal borophosphate with a supramolecular network","Acta Crystallographica Section E","2007","63","4","o1696","o1698","10.1107/S160053680701029X","","","0.71073","MoKα","","0.0395","0.0316","","","0.0792","0.0841","","","","","","1.049","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212806","15.2499","0.0006","15.2499","","32.0091","0.0009","90","","90","","90","","7444","0.4","295","2","295","2","","","","","","","","7","I -4 c 2","I -4 -2c","120","","Bis(tetraethylammonium) μ-tetrathiomolybdenio(VI)-κ^4^S,S':S'':S''''- bis[(4-hydroxybenzenethiolato-κS)cuprate(I)]","","- C28 H50 Cu2 Mo N2 O2 S6 -","- C28 H50 Cu2 Mo N2 O2 S6 -","- C224 H400 Cu16 Mo8 N16 O16 S48 -","8","0.5","CF2090","Li, Zhi-Hua; Du, Shao-Wu; Ng, Seik Weng","Bis(tetraethylammonium) μ-tetrathiomolybdenio(VI)-κ^4^<i>S</i>,<i>S</i>':<i>S</i>'':<i>S</i>'''-bis[(4-hydroxybenzenethiolato-κ<i>S</i>)cuprate(I)]","Acta Crystallographica Section E","2007","63","4","m929","m930","10.1107/S1600536807007611","","","0.71073","MoKα","","0.017","0.017","","","0.044","0.044","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212807","8.674","0.0017","16.5","0.003","16.365","0.003","90","","105.09","0.03","90","","2261.4","0.8","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(μ~2~-(3-methylbut-2-enoato-κ^2^O:O)bis{[(2- methoxyphenyl)diphenylphosphine-κP]silver(I)}","","- C48 H48 Ag2 O6 P2 -","- C48 H48 Ag2 O6 P2 -","- C96 H96 Ag4 O12 P4 -","2","0.5","CF2093","Li, Yu-Feng; Wu, Hui; Li, Yi-Zhi; Zhang, Hong; Pan, Yi","Bis(μ-3-methylbut-2-enoato-κ^2^<i>O</i>:<i>O</i>)bis{[(2-methoxyphenyl)diphenylphosphine-κ<i>P</i>]silver(I)}","Acta Crystallographica Section E","2007","63","4","m1068","m1069","10.1107/S1600536807011531","","","0.71073","MoKα","","0.0678","0.0497","","","0.0981","0.1013","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212808","14.581","0.006","6.033","0.003","15.675","0.005","90","","119.37","0.03","90","","1201.7","0.9","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-Methylpiperazin-1-yliminomethyl)phenol","","- C12 H17 N3 O -","- C12 H17 N3 O -","- C48 H68 N12 O4 -","4","1","CF2094","Guo, Ming-Lin","2-[(4-Methylpiperazin-1-yl)iminomethyl]phenol","Acta Crystallographica Section E","2007","63","4","o1788","o1789","10.1107/S1600536807011518","","","0.71073","MoKα","","0.174","0.0872","","","0.1708","0.2345","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212809","9.668","0.0017","11.634","0.002","14.246","0.003","90","","108.696","0.003","90","","1517.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Acetyl-N-[3-(trifluoromethyl)phenyl]perhydropyridazine-1-carboxamide","","- C14 H16 F3 N3 O2 -","- C14 H16 F3 N3 O2 -","- C56 H64 F12 N12 O8 -","4","1","CI2287","Xiao-Qing Li; Zu-Guang Sun; Xiao-Hua Du","2-Acetyl-<i>N</i>-[3-(trifluoromethyl)phenyl]perhydropyridazine-1-carboxamide","Acta Crystallographica Section E","2007","63","4","o1665","o1666","10.1107/S1600536807010288","","","0.71073","MoKα","","0.0842","0.0523","","","0.1294","0.1414","","","","","","0.929","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212810","5.836","0.0009","9.1649","0.0014","12.233","0.0018","91.394","0.003","96.658","0.003","97.337","0.003","644.06","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-[3-(Trifluoromethyl)phenyl]perhydropyridazine-1-carboxamide","","- C12 H14 F3 N3 O -","- C12 H14 F3 N3 O -","- C24 H28 F6 N6 O2 -","2","1","CI2288","Xiao-Qing Li; Zu-Guang Sun; Xiao-Hua Du","<i>N</i>-[3-(Trifluoromethyl)phenyl]perhydropyridazine-1-carboxamide","Acta Crystallographica Section E","2007","63","4","o1663","o1664","10.1107/S1600536807010264","","","0.71073","MoKα","","0.0802","0.0624","","","0.1553","0.1729","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212811","9.0505","0.0002","10.9501","0.0003","18.0232","0.0005","81.763","0.002","80.146","0.002","77.499","0.002","1707.59","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-(2-Chlorophenyl)-4,5-diphenyl-1H-imidazole","","- C21 H15 Cl N2 -","- C21 H15 Cl N2 -","- C84 H60 Cl4 N8 -","4","2","CI2289","Thiruvalluvar, A.; Balamurugan, S.; Puratchikody, A.; Nallu, M.","2-(2-Chlorophenyl)-4,5-diphenyl-1<i>H</i>-imidazole","Acta Crystallographica Section E","2007","63","4","o1650","o1652","10.1107/S1600536807010252","","","0.71073","MoKα","","0.0652","0.0453","","","0.1344","0.1618","","","","","","1.107","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2212812","11.48","0.004","20.913","0.007","7.524","0.003","90","","99.862","0.006","90","","1779.7","1.1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(4-Methoxyphenyl)-3-methyl-1-phenyl-1,7-dihydro-5H- furo[3,4-b]pyrazolo[4,3-e]pyridin-5-one","","- C22 H17 N3 O3 -","- C22 H17 N3 O3 -","- C88 H68 N12 O12 -","4","1","CI2294","Qian Wang; Shu-Jiang Tu","4-(4-Methoxyphenyl)-3-methyl-1-phenyl-1,7-dihydro-5<i>H</i>-furo[3,4-<i>b</i>]pyrazolo[4,3-<i>e</i>]pyridin-5-one","Acta Crystallographica Section E","2007","63","4","o1672","o1673","10.1107/S1600536807010069","","","0.71073","MoKα","","0.1914","0.0589","","","0.1341","0.1979","","","","","","0.913","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212813","7.067","0.004","22.4393","0.0012","10.871","0.005","90","","104.909","0.009","90","","1665.9","1.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Methyl-1,4-diphenyl-1H,5H,7H-furo[3,4-b]pyrazolo[4,3-e]pyridin-5-one","","- C21 H15 N3 O2 -","- C21 H15 N3 O2 -","- C84 H60 N12 O8 -","4","1","CI2295","Dong-Qin Chen; Shu-Jiang Tu","3-Methyl-1,4-diphenyl-1<i>H</i>,5<i>H</i>,7<i>H</i>-furo[3,4-<i>b</i>]pyrazolo[4,3-<i>e</i>]pyridin-5-one","Acta Crystallographica Section E","2007","63","4","o1777","o1778","10.1107/S1600536807008999","","","0.71073","MoKα","","0.1903","0.0687","","","0.1334","0.1562","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212814","17.346","0.004","7.614","0.0015","19.734","0.004","90","","98.22","0.03","90","","2579.5","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N,N'-Bis(4-methyl-2-benzothiazolyl)pyridine-2,6-dicarboxamide N,N-dimethylformamide solvate","","- C26 H24 N6 O3 S2 -","- C26 H24 N6 O3 S2 -","- C104 H96 N24 O12 S8 -","4","1","CI2296","Liu, Sheng-Gui; Ni, Chun-Lin; Li, Yi-Zhi","<i>N</i>,<i>N</i>'-Bis(4-methyl-2-benzothiazolyl)pyridine-2,6-dicarboxamide <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2007","63","4","o1704","o1705","10.1107/S1600536807010355","","","0.71073","MoKα","","0.0837","0.0527","","","0.101","0.106","","","","","","0.932","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212815","7.3424","0.0002","9.8359","0.0002","10.0274","0.0002","88.671","0.001","82.881","0.001","87.385","0.001","717.73","0.03","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ-2,6-difluorobenzoato-κ^2^O:O')bis[aquacopper(II)]","","- C28 H16 Cu2 F8 O10 -","- C28 H16 Cu2 F8 O10 -","- C28 H16 Cu2 F8 O10 -","1","0.5","CI2301","Eng Khoon Lim; Siang Guan Teoh; Jeannie Bee-Jan Teh; Hoong-Kun Fun; Chee Wah Yuen","Tetrakis(μ-2,6-difluorobenzoato-κ^2^<i>O</i>:<i>O</i>')bis[aquacopper(II)]","Acta Crystallographica Section E","2007","63","4","m991","m993","10.1107/S1600536807010057","","","0.71073","MoKα","","0.0316","0.0263","","","0.0666","0.0693","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212816","7.6776","0.0002","8.0431","0.0002","17.8184","0.0005","90","","97.916","0.001","90","","1089.83","0.05","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Ag-succinimde","catena-Poly[[aqua-1κO-μ~2~-succinimidato-1:2κ^2^O:N-disilver(I)]- μ~3~-succinimidato-1:2:1'κ^3^O:N:O']","","- C8 H10 Ag2 N2 O5 -","- C8 H8 Ag2 N2 O5 -","- C32 H32 Ag8 N8 O20 -","4","1","CI2304","Whitcomb, David R.; Rajeswaran, Manju","<i>catena</i>-Poly[[aqua-1κ<i>O</i>-μ~2~-succinimidato-1:2κ^2^<i>O</i>:<i>N</i>-disilver(I)]-μ~3~-succinimidato-1:2:1'κ^3^<i>O</i>:<i>N</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","4","m1179","m1181","10.1107/S1600536807013347","","","0.71073","MoKα","","0.0764","0.0355","","","0.062","0.0697","","","","","","0.95","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212817","10.7076","0.001","10.044","0.001","23.949","0.002","90","","90","","90","","2575.6","0.4","299","2","299","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-(3,5-Dimethylphenyl)-2,2-dimethylpropanamide","","- C13 H19 N O -","- C13 H19 N O -","- C104 H152 N8 O8 -","8","1","CI2305","B. Thimme Gowda; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","<i>N</i>-(3,5-Dimethylphenyl)-2,2-dimethylpropanamide","Acta Crystallographica Section E","2007","63","4","o1945","o1946","10.1107/S1600536807012810","","","0.71073","MoKα","","0.2541","0.053","","","0.1244","0.1664","","","","","","0.933","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212818","9.4489","0.0016","9.9453","0.0018","10.3242","0.0018","63.099","0.003","70.287","0.002","77.467","0.003","812.1","0.2","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","(2-Acetoxy-3,5-dibromophenyl)methylene diacetate","","- C13 H12 Br2 O6 -","- C13 H12 Br2 O6 -","- C26 H24 Br4 O12 -","2","1","CI2306","Li, Zhen-Huan; Guo, Ming-Lin","(2-Acetoxy-3,5-dibromophenyl)methylene diacetate","Acta Crystallographica Section E","2007","63","4","o1971","o1972","10.1107/S1600536807012822","","","0.71073","MoKα","","0.0541","0.0351","","","0.08","0.0896","","","","","","1.044","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212819","7.24","0.0002","8.6841","0.0002","11.7224","0.0003","89.188","0.001","80.329","0.002","66.192","0.001","663.54","0.03","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","(2E)-3-(2,4-Dichlorophenyl)-1-(3-nitrophenyl)prop-2-en-1-one","","- C15 H9 Cl2 N O3 -","- C15 H9 Cl2 N O3 -","- C30 H18 Cl4 N2 O6 -","2","1","CI2307","Shea-Lin Ng; P. S. Patil; Ibrahim Abdul Razak; Hoong-Kun Fun; S. M. Dharmaprakash","(2<i>E</i>)-3-(2,4-Dichlorophenyl)-1-(3-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","4","o1736","o1737","10.1107/S1600536807010896","","","0.71073","MoKα","","0.0481","0.0391","","","0.1003","0.1057","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212820","6.3422","0.0003","7.3709","0.0004","29.5443","0.0016","90.843","0.002","91.334","0.002","115.372","0.002","1247.11","0.11","100","0.1","100","0.1","","","","","","","","3","P 1","P 1","1","A cocrystal of Friedelan-3β-ol and Friedelin","Friedelan-3β-ol‒friedelin co-crystal (0.75/0.25)","","- C30 H51.5 O -","- C30 H51.5 O -","- C60 H103 O2 -","2","2","CI2308","Hoong-Kun Fun; Nawong Boonnak; Suchada Chantrapromma","A cocrystal of friedelan-3β-ol and friedelin (0.75/0.25)","Acta Crystallographica Section E","2007","63","4","o2014","o2016","10.1107/S1600536807013979","","","0.71073","MoKα","","0.056","0.0527","","","0.1385","0.1446","","","","","","1.127","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2212821","17.7893","0.0008","10.9635","0.0008","15.7479","0.0009","90","","105.295","0.002","90","","2962.6","0.3","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","trans-Diaqua(isonicotinamide-κN)(pyridine-2,6-dicarboxylate- κ^3^N,O,O')cobalt(III)","","- C13 H13 Co N3 O7 -","- C13 H13 Co N3 O7 -","- C104 H104 Co8 N24 O56 -","8","1","CI2309","Germán-Acacio, Juan Manuel; Hernández-Ortega, Simón; Valdés-Martínez, Jesús","<i>trans</i>-Diaqua(isonicotinamide-κ<i>N</i>)(pyridine-2,6-dicarboxylato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>')cobalt(III)","Acta Crystallographica Section E","2007","63","4","m1057","m1058","10.1107/S1600536807011245","","","0.71073","MoKα","","0.0363","0.0297","","","0.0711","0.0733","","","","","","0.958","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212822","9.554","0.002","12.193","0.003","13.637","0.003","103.199","0.004","95.814","0.004","111.969","0.004","1403.3","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-Formyl-1-phenylsulfonyl-1H-indole-3-carbonitrile","","- C16 H10 N2 O3 S -","- C16 H10 N2 O3 S -","- C64 H40 N8 O12 S4 -","4","2","CI2310","K. Palani; M. N. Ponnuswamy; P. Jaisankar; P. C. Srinivasan; M. Nethaji","2-Formyl-1-phenylsulfonyl-1<i>H</i>-indole-3-carbonitrile","Acta Crystallographica Section E","2007","63","4","o1906","o1907","10.1107/S1600536807012871","","","0.71073","MoKα","","0.1099","0.0867","","","0.1754","0.1858","","","","","","1.27","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212823","10.6496","0.0004","7.8597","0.0003","20.3159","0.0007","90","","97.907","0.002","90","","1684.33","0.11","100","0.1","100","0.1","","","","","","","","3","P 1 21 1","P 2yb","4","ent-Kaur-16-ene-13,19-diol","ent-Kaur-16-ene-13,19-diol","","- C20 H32 O2 -","- C20 H32 O2 -","- C80 H128 O8 -","4","2","CI2312","Abdul Wahab Salae; Suchada Chantrapromma; Hoong-Kun Fun; Chanita Ponglimanont","<i>ent</i>-Kaur-16-ene-13,19-diol","Acta Crystallographica Section E","2007","63","4","o1899","o1901","10.1107/S1600536807012834","","","0.71073","MoKα","","0.0516","0.0428","","","0.1016","0.1085","","","","","","1.051","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212824","12.8511","0.0001","55.155","0.0006","10.0623","0.0001","90","","90","","90","","7132.18","0.12","100","0.1","100","0.1","","","","","","","","5","F d d 2","F 2 -2d","43","","Dichlorido[5,6-diphenyl-3-(2-pyridyl)-1,2,4-triazine]copper(II)","","- C20 H14 Cl2 Cu N4 -","- C20 H14 Cl2 Cu N4 -","- C320 H224 Cl32 Cu16 N64 -","16","1","CI2313","Naser Eltaher Eltayeb; Siang Guan Teoh; Hoong-Kun Fun; Kamarulazizi Ibrahim; Mohd Mustaqim Rosli","Dichlorido[5,6-diphenyl-3-(2-pyridyl)-1,2,4-triazine]copper(II)","Acta Crystallographica Section E","2007","63","4","m1182","m1184","10.1107/S1600536807013050","","","0.71073","MoKα","","0.0316","0.0253","","","0.0623","0.0697","","","","","","1.1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212825","11.739","0.002","12.107","0.002","12.521","0.002","107.199","0.007","94.809","0.008","107.535","0.007","1591.5","0.5","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","(Z)-1,2-Diphenyl-2-(phenylhydrazono)ethanone","","- C20 H16 N2 O -","- C20 H16 N2 O -","- C80 H64 N8 O4 -","4","2","CI2315","Abdelaziz Bouchama; Abderrahmen Bendaâs; Sofiane Bouacida; Messaoud Yahiaoui; Patricia Benard-Rocherulle; Amel Djedouani","(<i>Z</i>)-1,2-Diphenyl-2-(phenylhydrazono)ethanone","Acta Crystallographica Section E","2007","63","4","o1990","o1992","10.1107/S1600536807012901","","","0.71073","MoKα","","0.0639","0.0391","","","0.0951","0.1074","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212826","7.878","0.001","15.047","0.003","11.866","0.002","90","","90.931","0.002","90","","1406.4","0.4","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Di-μ~1,1~-azido-bis[azido(5,5'-dimethyl-2,2'-bipyridine-κ^2^N,N')zinc(II)]","","- C24 H24 N16 Zn2 -","- C24 H24 N16 Zn2 -","- C48 H48 N32 Zn4 -","2","0.5","CI2321","Sun, Jin-Yu; Wang, Xi-Xi","Di-μ~1,1~-azido-bis[azido(5,5'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')zinc(II)]","Acta Crystallographica Section E","2007","63","4","m1138","m1139","10.1107/S160053680701286X","","","0.71073","MoKα","","0.0716","0.0485","","","0.1014","0.1117","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212827","9.441","0.001","11.152","0.002","10.211","0.001","90","","104.534","0.001","90","","1040.7","0.2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Di-μ~1,1~-azido-bis[azido(N,N-dimethylpropane-1,3-diamine-κ^2^N,N')zinc(II)]","","- C10 H28 N16 Zn2 -","- C10 H28 N16 Zn2 -","- C20 H56 N32 Zn4 -","2","0.5","CI2322","Sun, Jin-Yu; Wang, Xi-Xi","Di-μ~1,1~-azido-bis[azido(<i>N</i>,<i>N</i>-dimethylpropane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>')zinc(II)]","Acta Crystallographica Section E","2007","63","4","m1140","m1141","10.1107/S1600536807012858","","","0.71073","MoKα","","0.0322","0.0284","","","0.0806","0.0824","","","","","","1.072","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212828","13.641","0.003","14.869","0.003","22.476","0.005","90","","100.19","0.03","90","","4486.9","1.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(tetrabutylammonium) di-μ-bromido-bis[dibromidopalladate(II)]","","- C32 H72 Br6 N2 Pd2 -","- C32 H72 Br6 N2 Pd2 -","- C128 H288 Br24 N8 Pd8 -","4","1","CV2197","Yu-Lin Zhu; Long-Sheng Wang; Qiang Li; Yong-Ge Wei","Bis(tetrabutylammonium) di-μ-bromido-bis[dibromidopalladate(II)]","Acta Crystallographica Section E","2007","63","4","m1004","m1005","10.1107/S1600536807009919","","","0.71073","MoKα","","0.0816","0.0414","","","0.0883","0.1008","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212829","10.2694","0.0013","10.2694","0.0013","30.611","0.008","90","","90","","90","","3228.3","1","293","2","293","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","catena-Poly[[tetraaquamanganese(II)]-μ-6,6'-dihydroxy-3,3- diazenediyldibenzoato-κ^2^O:O']","","- C14 H16 Mn N2 O10 -","- C14 H16 Mn N2 O10 -","- C112 H128 Mn8 N16 O80 -","8","1","CV2198","Tang, Yun-Zhi; Tan, Yu-Hui; Cao, Yan-Wen","<i>catena</i>-Poly[[tetraaquamanganese(II)]-μ-6,6'-dihydroxy-3,3-diazenediyldibenzoato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","4","m1175","m1176","10.1107/S1600536807012305","","","0.71073","MoKα","","0.0378","0.0291","","","0.0674","0.0702","","","","","","1.129","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212830","12.148","0.005","10.807","0.005","7.943","0.005","90","0.005","97.045","0.005","90","0.005","1034.9","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraaquabis[4-(imidazol-1-yl)benzoato-κN^3^]nickel(II)","","- C20 H22 N4 Ni O8 -","- C20 H22 N4 Ni O8 -","- C40 H44 N8 Ni2 O16 -","2","0.5","CV2199","Zhang, Ju-Zhou; Pan, Jian-Xin; Cao, Wei-Ran; Chen, Qian-Wang","Tetraaquabis[4-(imidazol-1-yl)benzoato-κ<i>N</i>^3^]nickel(II)","Acta Crystallographica Section E","2007","63","4","m1042","m1043","10.1107/S1600536807010756","","","0.71069","MoKα","","0.0479","0.0397","","","0.1103","0.1279","","","","","","0.928","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212831","4.7704","0.0001","10.502","0.0001","11.2873","0.0001","104.931","0.001","96.33","0.001","100.034","0.001","530.829","0.014","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Dimethyl (2E)-2-(4-nitro-1H-imidazol-1-yl)but-2-enedioate","","- C9 H9 N3 O6 -","- C9 H9 N3 O6 -","- C18 H18 N6 O12 -","2","1","CV2200","Pérez-Mayoral, E.; Soriano, E.; Pacheco-Torres, J.; Ballesteros, P.","Dimethyl (2<i>E</i>)-2-(4-nitro-1<i>H</i>-imidazol-1-yl)but-2-enedioate","Acta Crystallographica Section E","2007","63","4","o1790","o1791","10.1107/S160053680701121X","","","1.54178","CuKα","","0.0294","0.0282","","","0.078","0.0792","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212832","13.598","0.006","12.066","0.006","10.218","0.005","90","","91.264","0.006","90","","1676.1","1.4","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-(2-Furyl)-1,5-diphenylpentane-1,5-dione","","- C21 H18 O3 -","- C21 H18 O3 -","- C84 H72 O12 -","4","1","CV2201","Hui Wang","3-(2-Furyl)-1,5-diphenylpentane-1,5-dione","Acta Crystallographica Section E","2007","63","4","o1584","o1585","10.1107/S1600536807009361","","","0.71073","MoKα","","0.1124","0.0476","","","0.1152","0.1677","","","","","","1.005","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212833","10.479","0.007","7.625","0.005","16.357","0.011","90","","102.119","0.011","90","","1277.8","1.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Aminocarbonothioyl)hydrazinium 3-carboxy-4-hydroxybenzenesulfonate","","- C8 H11 N3 O6 S2 -","- C8 H11 N3 O6 S2 -","- C32 H44 N12 O24 S8 -","4","1","CV2202","Xie, Zhi-Yuan","(Aminocarbonothioyl)hydrazinium 3-carboxy-4-hydroxybenzenesulfonate","Acta Crystallographica Section E","2007","63","4","o1568","o1569","10.1107/S1600536807009324","","","0.71073","Mokα","","0.0359","0.0332","","","0.0851","0.0867","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212834","9.715","0.0006","9.715","0.0006","17.154","0.002","90","","90","","90","","1619","0.2","293","2","293","2","","","","","","","","4","P 42 21 2","P 4n 2n","94","","Bis{2-[6-(1H-benzimidazol-2-yl-κN^3^)-2-pyridyl-κN]benzimidazolido- κN}cobalt(II)","","- C38 H24 Co N10 -","- C38 H24 Co N10 -","- C76 H48 Co2 N20 -","2","0.25","CV2203","Zhang, Shu-Hua; Zeng, Ming-Hua; Liang, Hong","Bis{2-[6-(1<i>H</i>-benzimidazol-2-yl-κ<i>N</i>^3^)-2-pyridyl-κ<i>N</i>]benzimidazolido-κ<i>N</i>}cobalt(II)","Acta Crystallographica Section E","2007","63","4","m1055","m1056","10.1107/S1600536807010471","","","0.71073","MoKα","","0.1101","0.0447","","","0.0504","0.0545","","","","","","0.948","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212835","15.604","0.002","17.189","0.003","17.64","0.003","90","","109.671","0.003","90","","4455.2","1.2","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","cis-Dichloridobis(1,10-phenanthroline-κ^2^N,N')cadmium(II) hemihydrate","","- C24 H17 Cd Cl2 N4 O0.5 -","- C24 H17 Cd Cl2 N4 O0.5 -","- C192 H136 Cd8 Cl16 N32 O4 -","8","2","CV2204","Wei-Hua Li; Fa-Qian Liu; Chang-Ling Pei; Bao-Rong Hou","<i>cis</i>-Dichloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II) hemihydrate","Acta Crystallographica Section E","2007","63","4","m1050","m1051","10.1107/S1600536807010793","","","0.71073","MoKα","","0.0983","0.0364","","","0.0644","0.0854","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212836","7.92","0.0007","11.1507","0.001","11.6802","0.001","111.335","0.002","100.217","0.002","102.314","0.001","901.13","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","4-Chloro-3,5-dinitrobenzoic acid","","- C7 H3 Cl N2 O6 -","- C7 H3 Cl N2 O6 -","- C28 H12 Cl4 N8 O24 -","4","2","CV2206","Aziz-ur-Rehman; Helliwell, Madeleine; Ali, Saqib; Shahzadi, Saira","4-Chloro-3,5-dinitrobenzoic acid","Acta Crystallographica Section E","2007","63","4","o1743","o1744","10.1107/S1600536807011221","","","0.71073","MoKα","","0.0413","0.0336","","","0.0825","0.0856","","","","","","0.968","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212837","8.5574","0.0005","6.2094","0.0004","22.0169","0.0014","90","","99.904","0.001","90","","1152.46","0.12","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Creatininium benzoate","1-Methyl-4-oxotetrahydro-2H-imidazol-2-iminium benzoate","","- C11 H13 N3 O3 -","- C11 H13 N3 O3 -","- C44 H52 N12 O12 -","4","1","CV2207","S. Asath Bahadur; S. Sivapragasam; R. Sayee Kannan; B. Sridhar","Creatininium benzoate","Acta Crystallographica Section E","2007","63","4","o1714","o1716","10.1107/S1600536807010665","","","0.71073","MoKα","","0.04","0.0373","","","0.0995","0.1019","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212838","8.9705","0.0008","13.5961","0.0012","14.3869","0.0012","111.213","0.002","98.877","0.002","108.884","0.002","1472.6","0.2","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","2-Dipropylamino-6-methyl-5-(4-methylphenyl)-3,8-diphenyl-5,8- dihydropyrazolo[4',3':5,6]pyrano[2,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","","- C34 H35 N5 O2 -","- C34 H35 N5 O2 -","- C68 H70 N10 O4 -","2","1","CV2208","Ren, Qing-Yun; He, Hong-Wu","2-Dipropylamino-6-methyl-5-(4-methylphenyl)-3,8-diphenyl-5,8-dihydropyrazolo[4',3':5,6]pyrano[2,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","4","o1921","o1923","10.1107/S1600536807011804","","","0.71073","MoKα","","0.1043","0.0562","","","0.1344","0.1636","","","","","","0.989","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212839","11.7514","0.0016","9.0604","0.0013","29.522","0.004","90","","94.589","0.003","90","","3133.2","0.8","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","N,N-Dibenzylaniline","","- C20 H19 N -","- C20 H19 N -","- C160 H152 N8 -","8","2","CV2209","Bi, Quan-Xi; Tong, Hong-Bo; Zhou, Mei-Su","<i>N</i>,<i>N</i>-Dibenzylaniline","Acta Crystallographica Section E","2007","63","4","o1809","o1810","10.1107/S1600536807011476","","","0.71073","MoKα","","0.109","0.0573","","","0.1228","0.1476","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212840","8.032","0.004","11.146","0.005","12.435","0.006","87.321","0.008","76.633","0.008","78.504","0.008","1061.4","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-[(3-Methyl-1-phenylsulfonyl-1H-indol-2-yl)methyl]-1,1-dioxo- 1-benzo[d]isothiazol-3(2H)-one","","- C23 H18 N2 O5 S2 -","- C23 H18 N2 O5 S2 -","- C46 H36 N4 O10 S4 -","2","1","CV2210","K. Palani; M. N. Ponnuswamy; P. Jaisankar; P. C. Srinivasan; M. Nethaji","<i>N</i>-[(3-Methyl-1-phenylsulfonyl-1<i>H</i>-indol-2-yl)methyl]-1,1-dioxo-1-benzo[<i>d</i>]isothiazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","4","o2026","o2028","10.1107/S1600536807013104","","","0.71073","MoKα","","0.0596","0.0474","","","0.1076","0.1126","","","","","","1.139","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212841","8.958","0.004","14.5062","0.0017","12.515","0.009","90","","109.405","0.019","90","","1533.9","1.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[1-(1-naphthyliminomethyl)2-naphtholato-κ^2^N,O)copper(II)","","- C42 H28 Cu N2 O2 -","- C42 H28 Cu N2 O2 -","- C84 H56 Cu2 N4 O4 -","2","0.5","CV2211","Li Wang; Jian-Fang Dong; Lian-Zhi Li; Lin-Wei Li; Da-Qi Wang","Bis[1-(1-naphthyliminomethyl)-2-naphtholato-κ^2^<i>N</i>,<i>O</i>]copper(II)","Acta Crystallographica Section E","2007","63","4","m1059","m1060","10.1107/S160053680701152X","","","0.71073","MoKα","","0.1545","0.0609","","","0.1548","0.2123","","","","","","0.982","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212842","9.6152","0.0018","10.527","0.002","12.013","0.002","79.297","0.004","87.928","0.004","79.413","0.004","1174.5","0.4","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","2-(Bromophenylimino)-10-oxo-9-oxa-1-thia-3,4-diazaspiro[4.15]-3-eicosa-3-ene","","- C22 H30 Br N3 O2 S -","- C22 H30 Br N3 O2 S -","- C44 H60 Br2 N6 O4 S2 -","2","1","CV2212","Li, Jian-Jun; Jin, Shu-Hui; Liang, Xiao-Mei; Yuan, De-Kai; Wang, Dao-Quan","2-(Bromophenylimino)-10-oxo-9-oxa-1-thia-3,4-diazaspiro[4.15]eicosa-3-ene","Acta Crystallographica Section E","2007","63","4","o1940","o1941","10.1107/S1600536807012330","","","0.71073","MoKα","","0.1044","0.0598","","","0.1306","0.1589","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212843","10.615","0.003","8.233","0.003","14.618","0.005","90","","96.944","0.005","90","","1268.1","0.7","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetra-μ~2~-acetato-κ^8^O:O'-bis[(4-dimethylaminopyridine-κN)copper(II)]","","- C22 H32 Cu2 N4 O8 -","- C22 H32 Cu2 N4 O8 -","- C44 H64 Cu4 N8 O16 -","2","0.5","CV2213","Feng, Xiao-Jun; Dong, Hua-Ze; Huang, Wei","Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis[(4-dimethylaminopyridine-κ<i>N</i>)copper(II)]","Acta Crystallographica Section E","2007","63","4","m1105","m1106","10.1107/S160053680701183X","","","0.71073","MoKα","","0.0361","0.0305","","","0.08","0.0816","","","","","","0.997","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212844","6.2555","0.0004","21.7461","0.0012","7.1786","0.0004","90","","94.527","0.002","90","","973.48","0.1","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","catena-Poly[[[diaqua(isophthalato)]cobalt(II)]-μ-1,4- diazabicyclo[2.2.2]octane] N,N-dimethylformamide solvate]","","- C17 H27 Co N3 O7 -","- C17 H27 Co N3 O7 -","- C34 H54 Co2 N6 O14 -","2","1","CV2215","Ai-Qing Ma","<i>catena</i>-Poly[[[diaqua(isophthalato)]cobalt(II)]-μ-1,4-diazabicyclo[2.2.2]octane] <i>N</i>,<i>N</i>-dimethylformamide solvate]: a chiral one-dimensional coordination polymer","Acta Crystallographica Section E","2007","63","4","m1073","m1075","10.1107/S1600536807011865","","","0.71073","MoKα","","0.0454","0.0442","","","0.1201","0.1211","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212845","19.546","0.003","14.325","0.002","21.958","0.003","90","","115.86","0.002","90","","5532.5","1.4","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(N,N-dibenzylthiocarbamoyl) disulfide","","- C30 H28 N2 S4 -","- C30 H28 N2 S4 -","- C240 H224 N16 S32 -","8","1","CV2217","Jun Zhai; Han-Dong Yin; Feng Li; Shao-Wen chen; Da-Qi Wang","Bis(<i>N</i>,<i>N</i>-dibenzylthiocarbamoyl) disulfide","Acta Crystallographica Section E","2007","63","4","o1969","o1970","10.1107/S1600536807013293","","","0.71073","MoKα","","0.088","0.0408","","","0.0813","0.107","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212846","17.3927","0.0009","9.2018","0.0005","22.846","0.001","90","","107.102","0.005","90","","3494.7","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","rac-Ethyl 7-(4-chlorophenyl)-3a-methyl-3-(4-nitrophenyl)- 4a,5-diphenyl-3a,4a,8,13-tetrahydro-4H- bis[1,2,4-triazolo][4,3-a:3',4'-d][1,5]benzodiazepine-1-carboxylate","","- C39 H32 Cl N7 O4 -","- C39 H32 Cl N7 O4 -","- C156 H128 Cl4 N28 O16 -","4","1","DN2125","Boudina, Aicha; Baouid, Abdesselam; Hasnaoui, Aissa; Aatif, Abdeljalil; Eddike, Driss; Tillard, Monique","<i>rac</i>-Éthyle 7-(4-chlorophényl)-3a-méthyl-3-(4-nitrophényl)-4a,5-diphényl-3a,4a,8,13-tétrahydro-4<i>H</i>-bis[1,2,4-triazolo][4,3-<i>a</i>:3',4'-<i>d</i>][1,5]benzodiazépine-1-carboxylate","Acta Crystallographica Section E","2007","63","4","o1544","o1545","10.1107/S1600536807008628","","","0.71073","MoKα","","0.0881","0.075","","","0.1799","0.19","","","","","","1.123","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212847","19.11","0.009","6.814","0.004","10.319","0.005","90","","109.61","0.01","90","","1265.8","1.1","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H14 N2 Ni O4 -","- C12 H14 N2 Ni O4 -","- C48 H56 N8 Ni4 O16 -","4","0.5","DN2128","Anne Carton; Adel Mesbah; Loïc Perrin; Michel François","Poly[nickel(II)-μ~2~-benzene-1,4-dicarboxylato-μ~2~-piperazine]","Acta Crystallographica Section E","2007","63","4","m948","m949","10.1107/S1600536807009488","","","0.71073","MoKα","","0.0349","0.0271","","","0.0655","0.0753","","","","","","1.104","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212848","8.0675","0.0001","8.8907","0.0001","9.9507","0.0002","110.732","0.003","90.73","0.002","116.218","0.002","586.54","0.03","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","Bis(N,N',N''-diethylenetriamine-κ^3^N)cadmium(II) naphthalene-1,5-disulfonate","","- C18 H32 Cd N6 O6 S2 -","- C18 H32 Cd N6 O6 S2 -","- C18 H32 Cd N6 O6 S2 -","1","0.5","DN2133","Zhao-Xun Lian; Hao-Hong Li","Bis(<i>N</i>,<i>N</i>',<i>N</i>''-diethylenetriamine-κ^3^<i>N</i>)cadmium(II) naphthalene-1,5-disulfonate","Acta Crystallographica Section E","2007","63","4","m939","m941","10.1107/S1600536807009191","","","0.71073","MoKα","","0.0305","0.0284","","","0.0772","0.0787","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212849","16.2812","0.0008","16.7815","0.0006","13.8303","0.0007","90","","106.733","0.004","90","","3618.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Di-μ-chlorido-bis[chlorido(η^5^-pentamethylcyclopentadienyl)rhodium(III)] chloroform trisolvate","","- C23 H33 Cl13 Rh2 -","- C23 H33 Cl13 Rh2 -","- C92 H132 Cl52 Rh8 -","4","1","DN2136","Govindaswamy, Padavattan; Süss-Fink, Georg; Therrien, Bruno","Di-μ-chlorido-bis[chlorido(η^5^-pentamethylcyclopentadienyl)rhodium(III)] chloroform trisolvate","Acta Crystallographica Section E","2007","63","4","m931","m932","10.1107/S1600536807009270","","","0.71073","MoKα","","0.0443","0.0271","","","0.0579","0.061","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212850","7.06","0.004","11.282","0.006","22.982","0.008","90","","90","","90","","1830.5","1.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1S,2S)-2-[(3R,4S)-3-Methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin- 2-yl]cyclohexanol","","- C22 H27 N O -","- C22 H27 N O -","- C88 H108 N4 O4 -","4","1","DN2138","Ben Ali, Karim; Chiaroni, Angèle; Bohe, Luis","(1<i>S</i>,2<i>S</i>)-2-[(3<i>R</i>,4<i>S</i>)-3-Methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-yl]cyclohexanol","Acta Crystallographica Section E","2007","63","4","o1719","o1720","10.1107/S1600536807010811","","","0.71073","MoKα","","0.0652","0.0465","","","0.1101","0.1192","","","","","","1.172","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212851","8.9608","0.001","12.4784","0.0017","15.012","0.002","90","","90","","90","","1678.6","0.4","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","<i>N</i>-(2-Methylphenyl)acetamide","","- C9 H11 N O -","- C9 H11 N O -","- C72 H88 N8 O8 -","8","1","DN2139","B. Thimme Gowda; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","<i>N</i>-(2-Methylphenyl)acetamide","Acta Crystallographica Section E","2007","63","4","o1977","o1978","10.1107/S1600536807012998","","","0.71073","MoKα","","0.1365","0.0697","","","0.1411","0.177","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212852","9.054","0.0005","8.8997","0.0005","15.0991","0.0009","90","","95.129","0.001","90","","1211.78","0.12","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","cis-Bis(thiosemicarbazide-κ^2^N^1^,S)palladium(II) dinitrate","","- C2 H10 N8 O6 Pd S2 -","- C2 H10 N8 O6 Pd S2 -","- C8 H40 N32 O24 Pd4 S8 -","4","1","DN2141","Dorazco-Gonzalez, Alejandro; Hernández-Ortega, Simón; Valdés-Martínez, Jesús","<i>cis</i>-Bis(thiosemicarbazide-κ^2^<i>N</i>^1^,<i>S</i>)palladium(II) dinitrate","Acta Crystallographica Section E","2007","63","4","m1120","m1121","10.1107/S160053680701224X","","","0.71073","MoKα","","0.02","0.0187","","","0.0451","0.0456","","","","","","1.094","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212853","7.478","0.002","14.656","0.004","7.4","0.002","90","","93.872","0.004","90","","809.2","0.4","291","2","291","2","","","","","","","","5","C 1 c 1","C -2yc","9","","2-Nitrobenzenesulfonamide","","- C6 H6 N2 O4 S -","- C6 H6 N2 O4 S -","- C24 H24 N8 O16 S4 -","4","1","DN2143","Hua-Long, Cheng; Chun-Fang, Huang","2-Nitrobenzenesulfonamide","Acta Crystallographica Section E","2007","63","4","o1979","o1980","10.1107/S1600536807012664","","","0.71073","MoKα","","0.0204","0.0202","","","0.0558","0.056","","","","","","1.092","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212854","13.4486","0.0011","12.7471","0.001","7.5183","0.0006","90","","90","","90","","1288.87","0.18","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(E)-2-[(2-methoxyphenylimino)methyl]-4-methylphenol","","- C15 H15 N O2 -","- C15 H15 N O2 -","- C60 H60 N4 O8 -","4","1","DN2145","Kartal, Aslı; Albayrak, Çig̃dem; Ocak Ískeleli, Nazan; Ag̃ar, Erbil; Erdönmez, Ahmet","(<i>E</i>)-2-[(2-Methoxyphenylimino)methyl]-4-methylphenol","Acta Crystallographica Section E","2007","63","4","o1878","o1879","10.1107/S1600536807012652","","","0.71073","MoKα","","0.0376","0.0319","","","0.0871","0.09","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212855","10.138","0.002","10.2597","0.0019","11.0305","0.0019","90","","90","","90","","1147.3","0.4","299","2","299","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(2-methylphenyl)-2,2,2-trimethylacetamide","","- C12 H17 N O -","- C12 H17 N O -","- C48 H68 N4 O4 -","4","1","DN2146","Gowda, B. Thimme; Kozisek, Jozef; Tokarčík, Miroslav; Fuess, Hartmut","2,2,2-Trimethyl-<i>N</i>-(2-methylphenyl)acetamide","Acta Crystallographica Section E","2007","63","4","o1983","o1984","10.1107/S1600536807013918","","","0.71073","MoKα","","0.0839","0.0795","","","0.2157","0.2219","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212856","6.6955","0.0006","15.2156","0.0013","17.7423","0.0015","90","","90","","90","","1807.5","0.3","292","2","292","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2-Benzylamino-5,5-dimethyl-4-phenyl-1,3,2-dioxaphosphinane-2-thione","","- C18 H22 N O2 P S -","- C18 H22 N O2 P S -","- C72 H88 N4 O8 P4 S4 -","4","1","ER2014","Jin-Song Chu; Shi-Guan Wan; Yan Yu; Chang Liu; Xing-Yu Yang","2-Benzylamino-5,5-dimethyl-4-phenyl-1,3,2-dioxaphosphinane-2-thione","Acta Crystallographica Section E","2007","63","4","o1540","o1541","10.1107/S1600536807007076","","","0.71073","MoKα","","0.0856","0.0479","","","0.1014","0.1163","","","","","","0.961","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212857","10.0887","0.0014","11.9737","0.0016","13.9695","0.0019","86.838","0.002","82.515","0.002","86.999","0.002","1668.8","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-chloro-bis{[1,2-bis(diphenylphosphino)-1,2-dicarba-closo-dodecaborane- κ^2^P,P']silver(I)} dichloromethane disolvate","","- C54 H64 Ag2 B20 Cl6 P4 -","- C54 H64 Ag2 B20 Cl6 P4 -","- C54 H64 Ag2 B20 Cl6 P4 -","1","0.5","ER2021","Dao-Peng Zhang; Jian-Min Dou; Da-Cheng Li; Da-Qi Wang","Di-μ-chlorido-bis{[1,2-bis(diphenylphosphino)-1,2-dicarba-<i>closo</i>-dodecaborane-κ^2^<i>P</i>,<i>P</i>']silver(I)} dichloromethane disolvate","Acta Crystallographica Section E","2007","63","4","m1086","m1088","10.1107/S1600536807007088","","","0.71073","MoKα","","0.0501","0.0387","","","0.0957","0.1048","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212858","9.0643","0.0007","11.422","0.0009","14.632","0.0012","90","","90","","90","","1514.9","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","zolmitriptan","(S)-4-{3-[2-(dimethylamino)ethyl]-1H-indol-5-ylmethyl}oxazolidin-2-one","","- C16 H21 N3 O2 -","- C16 H21 N3 O2 -","- C64 H84 N12 O8 -","4","1","ER2030","K. Ravikumar; B. Sridhar; Harihara Krishnan","Zolmitriptan, an antimigraine drug","Acta Crystallographica Section E","2007","63","4","o1774","o1776","10.1107/S1600536807011439","","","0.71073","MoKα","","0.0418","0.0402","","","0.1057","0.1074","","","","","","1.124","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212859","15.283","0.002","5.2277","0.0007","20.398","0.003","90","","107.811","0.002","90","","1551.6","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-(2,4-Dichlorophenyl)-3-[(1H-1,2,4-triazol-1-yl)methyl]-7H-1,2,4- triazolo[3,4-b][1,3,4]thiadiazine","","- C13 H9 Cl2 N7 S -","- C13 H9 Cl2 N7 S -","- C52 H36 Cl8 N28 S4 -","4","1","EZ2060","Zhi-Qiang Hu; Ya-Xun Yang; Yu-Qing Shang; Liang-Zhong Xu","6-(2,4-Dichlorophenyl)-3-[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]-7<i>H</i>-1,2,4-triazolo[3,4-<i>b</i>][1,3,4]thiadiazine","Acta Crystallographica Section E","2007","63","4","o2012","o2013","10.1107/S160053680701313X","","","0.71073","MoKα","","0.056","0.041","","","0.105","0.116","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212860","7.9322","0.0008","8.0513","0.0008","10.148","0.001","88.837","0.004","69.309","0.003","73.169","0.006","577.88","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","5-(Quinolin-8-yloxymethyl)-1,3,4-oxadiazole-2(3H)-thione","","- C12 H9 N3 O2 S -","- C12 H9 N3 O2 S -","- C24 H18 N6 O4 S2 -","2","1","EZ2061","Ze-Bao Zheng; Ren-Tao Wu; Ji-Kun Li; Yi-Feng Sun","5-(Quinolin-8-yloxymethyl)-1,3,4-oxadiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","4","o1586","o1587","10.1107/S1600536807009208","","","0.71073","MoKα","","0.066","0.054","","","0.176","0.186","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212861","5.7108","0.0003","21.8212","0.0011","13.4418","0.0007","90","","101.527","0.001","90","","1641.29","0.15","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[bis[μ~2~-1-cyclopropyl-6-fluoro-4-oxo-7-(1-piperazinyl)-1,4- dihydroquinoline-3-carboxylato]copper(II)] dihydrate]","","- C34 H38 Cu F2 N6 O8 -","- C34 H38 Cu F2 N6 O8 -","- C68 H76 Cu2 F4 N12 O16 -","2","0.5","EZ2065","Zhe An; Rui-Hai Cui; Rong-Shun Wang","Poly[[bis[μ~2~-1-cyclopropyl-6-fluoro-4-oxo-7-(1-piperazinyl)-1,4-dihydroquinoline-3-carboxylato]copper(II)] dihydrate]","Acta Crystallographica Section E","2007","63","4","m1066","m1067","10.1107/S1600536807011580","","","0.71073","MoKα","","0.052","0.038","","","0.096","0.104","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212862","5.5947","0.0003","9.1093","0.0005","10.3306","0.0005","90.988","0.003","92.799","0.003","104.114","0.003","509.75","0.05","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","2,2-Dimethyl-5-(pyrrolidin-2-ylidene)-1,3-dioxane-4,6-dione","","- C10 H13 N O4 -","- C10 H13 N O4 -","- C20 H26 N2 O8 -","2","1","EZ2066","Sabino, Jose R.; Damasceno, Fabiano; Cunha, Silvio","2,2-Dimethyl-5-(pyrrolidin-2-ylidene)-1,3-dioxane-4,6-dione","Acta Crystallographica Section E","2007","63","4","o1913","o1915","10.1107/S1600536807013153","","","0.71073","MoKα","","","0.056","","","","0.185","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212863","7.604","0.001","23.755","0.004","8.935","0.002","90","","96.781","0.003","90","","1602.7","0.5","298","2","298","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Bis{2-bromo-4-chloro-6-[2- (ethylammonio)ethyliminomethyl]phenolato}dithiocyanatonickel(II)","","- C24 H28 Br2 Cl2 N6 Ni O2 S2 -","- C24 H28 Br2 Cl2 N6 Ni O2 S2 -","- C48 H56 Br4 Cl4 N12 Ni2 O4 S4 -","2","0.5","FJ2003","Chen-Yi Wang","Bis{2-bromo-4-chloro-6-[2-(ethylammonio)ethyliminomethyl]phenolato}dithiocyanatonickel(II)","Acta Crystallographica Section E","2007","63","4","m1076","m1077","10.1107/S1600536807010628","","","0.71073","MoKα","","0.1163","0.0574","","","0.1161","0.1374","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212864","8.444","0.0017","9.481","0.0019","11.78","0.002","89.64","0.03","80.73","0.03","81.73","0.03","920.9","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H16 Br Cl N2 -","- C21 H16 Br Cl N2 -","- C42 H32 Br2 Cl2 N4 -","2","1","FL2090","Guo, Huan-Mei; Jian, Fang-Fang; Wang, Lei; Li, Li-Min; Wu, Qian","3-(4-Bromophenyl)-5-(2-chlorophenyl)-1-phenyl-2-pyrazoline","Acta Crystallographica Section E","2007","63","4","o1908","o1909","10.1107/S160053680700013X","","","0.71073","MoKα","","0.0838","0.041","","","0.0916","0.1083","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212865","6.2165","0.0001","9.7821","0.0002","19.388","0.0005","90","","90","","90","","1178.99","0.04","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Azido-2-deoxy-2,4-<i>C</i>-dimethyl-3,4-<i>O</i>-isopropylidene-L-ribono- 1,5-lactone","","- C10 H15 N3 O4 -","- C10 H15 N3 O4 -","- C40 H60 N12 O16 -","4","1","FL2104","Booth, Kathrine V.; Watkin, David J.; Jenkinson, Sarah F.; Fleet, George W. J.","2-Azido-2-deoxy-2,4-<i>C</i>-dimethyl-3,4-<i>O</i>-isopropylidene-<small>L</small>-ribono-1,5-lactone","Acta Crystallographica Section E","2007","63","4","o1759","o1760","10.1107/S1600536807010598","","","0.71073","MoKα","","0.0422","0.0317","","0.0732","0.0698","0.0732","","","","","","0.9148","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212866","7.177","0.003","10.662","0.008","16.238","0.012","90","","90","","90","","1242.6","1.4","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","3-(2-Chloro-4-hydroxyphenyl)-1-thioisocoumarin","","- C15 H9 Cl O2 S -","- C15 H9 Cl O2 S -","- C60 H36 Cl4 O8 S4 -","4","1","FL2105","Saeed, Aamer; Ritch, Jamie S.; Parvez, Masood","3-(2-Chloro-4-hydroxyphenyl)-1-thioisocoumarin","Acta Crystallographica Section E","2007","63","4","o1701","o1703","10.1107/S1600536807010173","","","0.71073","MoKα","","0.045","0.0395","","","0.102","0.107","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212867","6.2912","0.0007","10.3513","0.0012","11.5578","0.0013","94.835","0.009","92.621","0.009","97.322","0.009","742.66","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","3-(3-Methoxyphenyl)-1-(2-methylbenzoyl)thiourea","","- C16 H16 N2 O2 S -","- C16 H16 N2 O2 S -","- C32 H32 N4 O4 S2 -","2","1","FL2106","Khawar Rauf, M.; Badshah, Amin; Bolte, Michael","3-(3-Methoxyphenyl)-1-(2-methylbenzoyl)thiourea","Acta Crystallographica Section E","2007","63","4","o1676","o1678","10.1107/S1600536807010185","","","0.71073","MoKα","","0.0386","0.0343","","","0.0872","0.0896","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212868","7.3342","0.0011","9.7123","0.0014","11.2241","0.0015","110.583","0.011","90.787","0.009","104.671","0.01","719.4","0.19","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","1-Benzyl-3-(2-methylbenzoyl)thiourea","","- C16 H16 N2 O S -","- C16 H16 N2 O S -","- C32 H32 N4 O2 S2 -","2","1","FL2107","Khawar Rauf, M.; Badshah, Amin; Bolte, Michael","1-Benzyl-3-(2-methylbenzoyl)thiourea","Acta Crystallographica Section E","2007","63","4","o1679","o1680","10.1107/S1600536807010197","","","0.71073","MoKα","","0.035","0.0334","","","0.0907","0.0919","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212869","5.285","0.0004","6.9516","0.0006","12.1889","0.0009","92.039","0.005","93.401","0.005","95.967","0.005","444.21","0.06","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","2,6-Dimethyl-4-oxocyclohexanecarboxylic acid","","- C9 H14 O3 -","- C9 H14 O3 -","- C18 H28 O6 -","2","1","FL2108","Xie, Songwen; Kenny, Colin; Robinson, Paul D.","2,6-Dimethyl-4-oxocyclohexanecarboxylic acid: a <i>meso</i> keto acid","Acta Crystallographica Section E","2007","63","4","o1660","o1662","10.1107/S1600536807010203","","","0.71073","MoKα","","0.075","0.047","","","0.097","0.109","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212870","11.5962","0.0004","13.8654","0.0003","24.0393","0.0009","90","","94.9946","0.0018","90","","3850.5","0.2","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","2,2-Dimethyl-N-[3-(3,4,5-trimethoxybenzoyl)pyridin-4-yl]propanamide","","","- C20 H24 N2 O5 -","- C20 H24 N2 O5 -","- C160 H192 N16 O40 -","8","1","FL2109","Katrin Kinkel; Stefan Laufer; Schollmeyer, Dieter; Christian Peifer","2,2-Dimethyl-<i>N</i>-[3-(3,4,5-trimethoxybenzoyl)pyridin-4-yl]propanamide","Acta Crystallographica Section E","2007","63","4","o1887","o1889","10.1107/S1600536807012500","","","1.54178","CuKα","","0.0508","0.0478","","","0.1505","0.1536","","","","","","1.104","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212871","7.2254","0.0019","9.167","0.003","9.3662","0.0019","66.7","0.03","89.88","0.03","76.131","0.019","550.2","0.3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","7-Amino-2,4-dimethylquinolinium formate","","- C12 H14 N2 O2 -","- C12 H14 N2 O2 -","- C24 H28 N4 O4 -","2","1","FL2110","Su, Qing; Ye, Ling; Yang, Guang-Di; Mu, Ying","7-Amino-2,4-dimethylquinolinium formate","Acta Crystallographica Section E","2007","63","4","o1699","o1700","10.1107/S1600536807010318","","","0.71073","MoKα","","0.1034","0.0537","","","0.1368","0.1586","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212872","5.1585","0.0003","16.817","0.001","12.1408","0.0008","90","","94.835","0.001","90","","1049.47","0.11","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,5-Dimethyl-3-methylsulfinyl-1-benzofuran","","- C11 H12 O2 S -","- C11 H12 O2 S -","- C44 H48 O8 S4 -","4","1","FL2111","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","2,5-Dimethyl-3-methylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2007","63","4","o1823","o1824","10.1107/S1600536807011634","","","0.71073","MoKα","","0.0495","0.0433","","","0.1097","0.1135","","","","","","1.134","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212873","28.1492","0.0015","24.1628","0.0013","3.7181","0.0005","90","","90","","90","","2528.9","0.4","120","2","120","2","","","","","","","","4","F d d 2","F 2 -2d","43","","N,N'-Bis(isonicotinoyl)hydrazine dihydrate","","- C12 H14 N4 O4 -","- C12 H14 N4 O4 -","- C96 H112 N32 O32 -","8","0.5","GG3079","Quiroga, Jairo; Portilla, Jaime; Cobo, Justo; Torre, José M. de la; Low, John N.; Glidewell, Christopher","<i>N</i>,<i>N</i>'-Bis(isonicotinoyl)hydrazine dihydrate at 120(2)K: a three-dimensional framework built from N—H···O, O—H···O, O—H···N and C—H···O hydrogen bonds","Acta Crystallographica Section E","2007","63","4","o1687","o1690","10.1107/S1600536807010112","","","0.71073","MoKα","","0.0846","0.0658","","","0.1744","0.2011","","","","","","1.136","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212874","8.165","0.004","10.785","0.006","12.054","0.007","111.573","0.009","109.112","0.009","93.92","0.009","910.9","0.9","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","5-(4-Chlorophenyl)-3-(4-nitrophenyl)-1-phenyl-2-pyrazoline","","- C21 H16 Cl N3 O2 -","- C21 H16 Cl N3 O2 -","- C42 H32 Cl2 N6 O4 -","2","1","GG3080","Huan-Mei Guo; Fang-Fang Jian; Yu-Feng Li; Cui-Hua Lin; Qian Wu","5-(4-Chlorophenyl)-3-(4-nitrophenyl)-1-phenyl-2-pyrazoline","Acta Crystallographica Section E","2007","63","4","o1814","o1815","10.1107/S160053680701077X","","","0.71073","MoKα","","0.0731","0.044","","","0.1176","0.1381","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212875","12.294","0.0002","19.137","0.0003","32.5842","0.0006","90","","90","","90","","7666.1","0.2","153","2","571","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-)-(2R,3R)-O,O'-Dibenzoyl-(2R,3R)-tartaric acid‒hexamethylphosphoramide (1/2)","","- C30 H50 N6 O10 P2 -","- C30 H50 N6 O10 P2 -","- C240 H400 N48 O80 P16 -","8","2","GK2052","Yi-Jian Zhang; Shu Zhan; Wen-Jie Feng; Mei-Chao Li; Zhi-Min Jin","({-})-(2<i>R</i>,3<i>R</i>)-<i>O</i>,<i>O</i>'-Dibenzoyl-(2<i>R</i>,3<i>R</i>)-tartaric acid‒hexamethylphosphoramide (1/2)","Acta Crystallographica Section E","2007","63","4","o1546","o1548","10.1107/S1600536807008380","","","0.71073","MoKα","","0.0361","0.0351","","","0.0976","0.0985","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212876","20.173","0.003","9.058","0.001","24.218","0.004","90","","99.57","0.02","90","","4363.7","1.1","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,1,1,3,3,3-Hexafluoro-2,2-bis(4-hydroxyphenyl)propane‒benzene (2/3)","","- C48 H38 F12 O4 -","- C48 H38 F12 O4 -","- C192 H152 F48 O16 -","4","0.5","GK2056","Csöregh, Ingeborg; Toda, Fumio","1,1,1,3,3,3-Hexafluoro-2,2-bis(4-hydroxyphenyl)propane‒benzene (2/3)","Acta Crystallographica Section E","2007","63","4","o1769","o1771","10.1107/S1600536807010677","","","0.71073","MoKα","","0.0643","0.0398","","","0.0893","0.0961","","","","","","1.095","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212877","9.962","0.0013","10.1592","0.0013","13.7049","0.0017","100.607","0.002","107.197","0.002","102.838","0.002","1244.6","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","poly[(μ-β-octamolybdato-κ^2^O:O)bis[μ-4-(2-pyridyl)pyridinium-3-olato- κ^3^N,O:O]bis[4-(2-pyridyl)pyridinium-3-olato-κ^2^N:O]dicopper(II)]","","- C40 H32 Cu2 Mo8 N8 O30 -","- C40 H32 Cu2 Mo8 N8 O30 -","- C40 H32 Cu2 Mo8 N8 O30 -","1","0.5","GK2058","Springsteen, Caleb H.; Rarig Jr, Randy S.; Zubieta, Jon; LaDuca, Robert L.","A hybrid bimetallic complex from regioselective <i>in situ</i> ligand oxidation: poly[(μ-β-octamolybdato-κ^2^<i>O</i>:<i>O</i>)bis[μ-4-(2-pyridyl)pyridinium-3-olato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>]bis[4-(2-pyridyl)pyridinium-3-olato-κ^2^<i>N</i>,<i>O</i>]dicopper(II)]","Acta Crystallographica Section E","2007","63","4","m933","m935","10.1107/S1600536807009282","","","0.71073","MoKα","","0.1284","0.0467","","","0.1024","0.1323","","","","","","0.954","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212878","11.68","0.002","18.303","0.004","20.716","0.004","90","","102.55","0.03","90","","4322.8","1.5","193","2","193","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","Dianiline-1κN,2κN-bis[3,4-(η^5^)-pentamethylcyclopentadienyl]tetra-μ~3~- sulfido-tetrahedro-dicopper(I)dimolybdenum(V) bis(perchlorate) aniline hemisolvate","","- C35 H47.5 Cl2 Cu2 Mo2 N2.5 O8 S4 -","- C35 H47.5 Cl2 Cu2 Mo2 N2.5 O8 S4 -","- C140 H190 Cl8 Cu8 Mo8 N10 O32 S16 -","4","1","GK2061","Ren, Zhi-Gang; Lang, Jian-Ping; Ng, Seik Weng","Dianiline-1κ<i>N</i>,2κ<i>N</i>-bis[3,4(η^5^)-pentamethylcyclopentadienyl]tetra-μ~3~-sulfido-<i>tetrahedro</i>-dicopper(I)dimolybdenum(V) bis(perchlorate) aniline hemisolvate","Acta Crystallographica Section E","2007","63","4","m1020","m1022","10.1107/S1600536807010847","","","0.71073","MoKα","","0.044","0.037","","","0.082","0.086","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2212879","6.178","0.0004","17.267","0.001","13.8089","0.0008","90","","93.076","0.001","90","","1470.95","0.15","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Methyl-1-(phenylsulfinyl)naphtho[2,1-<i>b</i>]furan","","- C19 H14 O2 S -","- C19 H14 O2 S -","- C76 H56 O8 S4 -","4","1","GK2063","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","2-Methyl-1-(phenylsulfinyl)naphtho[2,1-<i>b</i>]furan","Acta Crystallographica Section E","2007","63","4","o1731","o1732","10.1107/S1600536807010525","","","0.71073","MoKα","","0.0619","0.057","","","0.1132","0.1151","","","","","","1.292","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212880","14.6743","0.0004","15.3957","0.0004","24.0968","0.0007","90","","90","","90","","5444","0.3","180","2","180","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","{2,2'-[1,1'-(4-Azaheptane-1,7- diyldinitrilo)diethylidyne]diphenolato}(pyridine)cobalt(III) hexafluorophosphate","","- C27 H32 Co F6 N4 O2 P -","- C27 H32 Co F6 N4 O2 P -","- C216 H256 Co8 F48 N32 O16 P8 -","8","1","GW2004","Soraia Meghdadi; Daran, Jean-Claude; Amirnasr, Mehdi; Morshedi, Mahbod","{2,2'-[1,1'-(4-Azaheptane-1,7-diyldinitrilo)diethylidyne]diphenolato}(pyridine)cobalt(III) hexafluorophosphate","Acta Crystallographica Section E","2007","63","4","m982","m984","10.1107/S1600536807009464","","","0.71073","MoKα","","0.0899","0.0414","","","0.1019","0.1314","","","","","","1.052","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212881","6.78","0.001","14.253","0.003","15.232","0.004","90","","100.43","0.02","90","","1447.6","0.5","299","2","299","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","4-Bromo-N-8-quinolylbenzenesulfonamide","","- C15 H11 Br N2 O2 S -","- C15 H11 Br N2 O2 S -","- C60 H44 Br4 N8 O8 S4 -","4","1","GW2005","Silva, Luiz Everson da; Joussef, Antonio Carlos; Foro, Sabine","4-Bromo-<i>N</i>-(8-quinolyl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","4","o1648","o1649","10.1107/S1600536807010070","","","1.5418","CuKα","","0.1167","0.1046","","","0.2591","0.273","","","","","","1.174","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212882","8.682","0.001","23.961","0.005","10.939","0.002","90","","106.603","0.013","90","","2180.8","0.7","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-(2-Furyl)-2-phenylpropenoic acid","","- C13 H10 O3 -","- C13 H10 O3 -","- C104 H80 O24 -","8","2","HB2299","Sadiq-ur-Rehman; Shahzadi, Saira; Ali, Saqib; Parvez, Masood","3-(2-Furyl)-2-phenylpropenoic acid","Acta Crystallographica Section E","2007","63","4","o1532","o1533","10.1107/S1600536807008811","","","0.71073","MoKα","","0.081","0.045","","","0.105","0.121","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212883","13.146","0.002","15.0739","0.0008","15.58","0.003","69.55","0.02","86.29","0.03","64.987","0.018","2608.9","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(2,2'-Biquinoline-κ^2^N,N')bis(triphenylphosphine-κP)copper(I) nitrate 2,2'-biquinoline hemisolvate hemihydrate","","- C63 H49 Cu N4 O3.5 P2 -","- C63 H49 Cu N4 O3.5 P2 -","- C126 H98 Cu2 N8 O7 P4 -","2","1","HB2302","Maribel Navarro; Oscar Corona; Teresa González","(2,2'-Biquinoline-κ^2^<i>N</i>,<i>N</i>')bis(triphenylphosphine-κ<i>P</i>)copper(I) nitrate 2,2'-biquinoline hemisolvate hemihydrate","Acta Crystallographica Section E","2007","63","4","m1153","m1155","10.1107/S1600536807011932","","","0.7107","MoKα","","0.1597","0.0854","","","0.144","0.1736","","","","","","1.147","","","","has coordinates,has disorder,has Fobs","199607","2020-10-21","18:00:00",""
"2212884","7.6246","0.0003","10.3422","0.0004","14.5155","0.0005","79.678","0.002","79.451","0.001","70.188","0.002","1050.15","0.07","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","{O-Ethyl (Z)-[4-(methoxycarbonyl)phenyl]thiocarbamato- κS}(triethylphosphine-κP)gold(I)‒ {O-ethyl (Z)-[4-(ethoxycarbonyl)phenyl]thiocarbamato- κS}(triethylphosphine-κP)gold(I) (1/1)","","- C35 H56 Au2 N2 O6 P2 S2 -","- C35 H56 Au2 N2 O6 P2 S2 -","- C35 H56 Au2 N2 O6 P2 S2 -","1","0.5","HB2304","Ho, Soo Yei; Ng, Seik Weng; Tiekink, Edward R. T.","{<i>O</i>-Ethyl (<i>Z</i>)-[4-(methoxycarbonyl)phenyl]thiocarbamato-κ<i>S</i>}(triethylphosphine-κ<i>P</i>)gold(I)‒{<i>O</i>-ethyl (<i>Z</i>)-[4-(ethoxycarbonyl)phenyl]thiocarbamato-κ<i>S</i>}(triethylphosphine-κ<i>P</i>)gold(I) (1/1)","Acta Crystallographica Section E","2007","63","4","m1017","m1019","10.1107/S1600536807010872","","","0.71069","MoKα","","0.036","0.031","","","0.076","0.078","","","","","","1","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212885","8.4929","0.0008","23.8609","0.0013","7.5005","0.0005","90","","120.19","0.007","90","","1313.8","0.19","220","2","220","2","","","","","","","","6","C 1 c 1","C -2yc","9","","2-(5-Bromo-2-methyl-4-nitroimidazol-1-yl)-1-(2-chlorophenyl)ethanone","","- C12 H9 Br Cl N3 O3 -","- C12 H9 Br Cl N3 O3 -","- C48 H36 Br4 Cl4 N12 O12 -","4","1","HB2306","Tykarska, Ewa; Wierzchowski, Marcin; Gdaniec, Maria; Sobiak, Stanisław","2-(5-Bromo-2-methyl-4-nitroimidazol-1-yl)-1-(2-chlorophenyl)ethanone","Acta Crystallographica Section E","2007","63","4","o1669","o1671","10.1107/S1600536807010124","","","0.71073","MoKα","","0.0232","0.0222","","","0.0533","0.0539","","","","","","1.097","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212886","5.1821","0.0001","13.3799","0.0002","19.9277","0.0004","90","","91.973","0.001","90","","1380.89","0.04","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2'-[1-(2-Hydroxyphenyl)ethylidene]benzenesulfonohydrazide","","- C14 H14 N2 O3 S -","- C14 H14 N2 O3 S -","- C56 H56 N8 O12 S4 -","4","1","HB2307","Ali, Hapipah M.; Laila, Musalem; Wan Jefrey, Basirun; Ng, Seik Weng","2'-[1-(2-Hydroxyphenyl)ethylidene]benzenesulfonohydrazide","Acta Crystallographica Section E","2007","63","4","o1617","o1618","10.1107/S160053680700952X","","","0.71073","MoKα","","0.035","0.031","","","0.092","0.106","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212887","10.8711","0.0002","5.7438","0.0001","22.4374","0.0004","90","","92.253","0.001","90","","1399.94","0.04","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2'-(4-Chloro-2-hydroxyphenyl-1-ethylidene)benzenesulfonohydrazide","","- C14 H13 Cl N2 O3 S -","- C14 H13 Cl N2 O3 S -","- C56 H52 Cl4 N8 O12 S4 -","4","1","HB2308","Ali, Hapipah M.; Laila, Musalem; Wan Jefrey, Basirun; Ng, Seik Weng","2'-[1-(4-Chloro-2-hydroxyphenyl)ethylidene]benzenesulfonohydrazide","Acta Crystallographica Section E","2007","63","4","o1619","o1620","10.1107/S1600536807009506","","","0.71073","MoKα","","0.046","0.032","","","0.088","0.112","","","","","","1.13","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212888","15.9617","0.0003","9.5265","0.0002","9.3697","0.0002","90","","90","","90","","1424.75","0.05","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","2'-(1<i>H</i>-Indol-3-ylmethylene)benzenesulfonohydrazide","","- C15 H13 N3 O2 S -","- C15 H13 N3 O2 S -","- C60 H52 N12 O8 S4 -","4","1","HB2309","Ali, Hapipah M.; Yusnita, Juahir; Wan Jefrey, Basirun; Ng, Seik Weng","2'-(1<i>H</i>-Indol-3-ylmethylene)benzenesulfonohydrazide","Acta Crystallographica Section E","2007","63","4","o1621","o1622","10.1107/S1600536807009518","","","0.71073","MoKα","","0.0254","0.0247","","","0.073","0.0737","","","","","","1.072","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212889","12.444","0.002","20.264","0.003","12.874","0.002","90","","101.32","0.01","90","","3183.2","0.9","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","{μ~4~-3,3'-Bi[tricyclo[2.2.1.0^2,6^]heptaphosphane](4-)}tetrakis[bis(1,2- dimethoxyethane)sodium(I)]","","- C32 H80 Na4 O16 P14 -","- C32 H80 Na4 O16 P14 -","- C64 H160 Na8 O32 P28 -","2","0.5","HB2311","Lerner, Hans-Wolfram; Bolte, Michael","{μ~4~-3,3'-Bi[tricyclo[2.2.1.0^2,6^]heptaphosphane](4{-})}tetrakis[bis(1,2-dimethoxyethane)sodium(I)]","Acta Crystallographica Section E","2007","63","4","m1013","m1014","10.1107/S1600536807010100","","","0.71073","MoKα","","0.1679","0.0682","","","0.0964","0.1222","","","","","","0.892","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212890","10.66","0.003","12.588","0.004","21.816","0.006","90","","101.766","0.005","90","","2865.9","1.5","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H34 Br2 N2 O10 Zn -","- C24 H34 Br2 N2 O10 Zn -","- C96 H136 Br8 N8 O40 Zn4 -","4","1","HB2312","Tai, Xi-Shi; Yin, Jie; Hao, Ming-Yang","Bis{4-bromo-2-[tris(hydroxymethyl)methyliminomethyl]phenolato}zinc(II) methanol disolvate","Acta Crystallographica Section E","2007","63","4","m1061","m1062","10.1107/S1600536807009865","","","0.71073","MoKα","","0.0765","0.0405","","","0.0837","0.0992","","","","","","1.018","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212891","8.616","0.0017","9.29","0.0019","15.225","0.003","84.34","0.03","81.45","0.03","66.66","0.03","1105.4","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-(2,6-Dimethylphenyl)-2-(2-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol- 5-yl}phenoxy)acetamide","","- C25 H23 N3 O3 S -","- C25 H23 N3 O3 S -","- C50 H46 N6 O6 S2 -","2","1","HB2313","Yin, Jun; Xing, Zhi-Tao; Wang, Hai-Bo; Ding, Wei-Lin; Wang, Pin-Liang","<i>N</i>-(2,6-Dimethylphenyl)-2-(2-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}phenoxy)acetamide","Acta Crystallographica Section E","2007","63","4","o1683","o1684","10.1107/S1600536807010331","","","0.71073","MoKα","","0.1051","0.0535","","","0.1153","0.1329","","","","","","1.012","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212892","5.9315","0.0013","9.374","0.002","11.721","0.003","107.57","0.003","92.101","0.004","96.389","0.003","615.7","0.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","4,4'-Bis[(2-acetylhydrazino)carbonyl]-1,1'-ethylenedipyridinium dibromide tetrahydrate","","- C18 H30 Br2 N6 O8 -","- C18 H30 Br2 N6 O8 -","- C18 H30 Br2 N6 O8 -","1","0.5","HB2314","Xiao-Peng Fan; Jiang-Sheng Li; Ying-Ying Zhang; Xiao-Li Zhou","4,4'-Bis[(2-acetylhydrazino)carbonyl]-1,1'-ethylenedipyridinium dibromide tetrahydrate","Acta Crystallographica Section E","2007","63","4","o1717","o1718","10.1107/S1600536807011002","","","0.71073","MoKα","","0.0495","0.0421","","","0.1083","0.113","","","","","","1.092","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212893","12.0395","0.0017","22.298","0.003","7.6686","0.0011","90","","90","","90","","2058.7","0.5","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","3,5-bis[4-(dimethylamino)benzylidene]-1-methyl-4-piperidone","","- C24 H29 N3 O -","- C24 H29 N3 O -","- C96 H116 N12 O4 -","4","1","HB2316","Vladimir N. Nesterov; Sergey S. Sarkisov; Michael J. Curley; Augustine Urbas","An orthorhombic polymorph of 3,5-bis[4-(dimethylamino)benzylidene]-1-methyl-4-piperidone","Acta Crystallographica Section E","2007","63","4","o1785","o1787","10.1107/S1600536807011270","","","0.71073","MoKα","","0.1365","0.0518","","","0.0888","0.1116","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212894","7.1098","0.0001","7.7472","0.0001","7.8345","0.0001","90.655","0.001","106.038","0.001","110.69","0.001","385.124","0.01","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","5'-Bromo-2'-hydroxyacetophenone","","- C8 H7 Br O2 -","- C8 H7 Br O2 -","- C16 H14 Br2 O4 -","2","1","HB2317","Ng, Seik Weng","5'-Bromo-2'-hydroxyacetophenone","Acta Crystallographica Section E","2007","63","4","o1805","o1806","10.1107/S1600536807011348","","","0.71073","MoKα","","0.0692","0.0641","","","0.1688","0.1797","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212895","13.7442","0.0002","15.0424","0.0002","8.312","0.0001","90","","103.095","0.001","90","","1673.78","0.04","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","2'-[(5-Chloro-1H-indol-3-yl)methylene]-2-(1H-indol-3-yl)acetohydrazide","","- C19 H15 Cl N4 O -","- C19 H15 Cl N4 O -","- C76 H60 Cl4 N16 O4 -","4","1","HB2318","Ali, Hapipah M.; Nazzatush Shimar, Jamaludin; Wan Jefrey, Basirun; Ng, Seik Weng","2'-[(5-Chloro-1<i>H</i>-indol-3-yl)methylene]-2-(1<i>H</i>-indol-3-yl)acetohydrazide","Acta Crystallographica Section E","2007","63","4","o1807","o1808","10.1107/S160053680701135X","","","0.71073","MoKα","","0.027","0.026","","","0.07","0.084","","","","","","1.15","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212896","16.2463","0.0009","4.7716","0.0003","16.9199","0.0009","90","","112.939","0.001","90","","1207.92","0.12","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-[3-(Trifluoromethyl)phenyliminomethyl]benzene-1,2-diol","","- C14 H10 F3 N O2 -","- C14 H10 F3 N O2 -","- C56 H40 F12 N4 O8 -","4","1","HB2320","Shaukat Shuja; Saqib Ali; Auke Meetsma; Broker, Grant A.; Tiekink, Edward R. T.","3-[3-(Trifluoromethyl)phenyliminomethyl]benzene-1,2-diol","Acta Crystallographica Section E","2007","63","4","o1781","o1782","10.1107/S1600536807011361","","","0.71073","MoKα","","0.05","0.046","","","0.124","0.139","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212897","12.693","0.002","10.6205","0.0019","21.437","0.004","90","","90","","90","","2889.8","0.9","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4,6-dichloro-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazin-2-amine","","- C11 H18 Cl2 N4 -","- C11 H18 Cl2 N4 -","- C88 H144 Cl16 N32 -","8","1","HB2321","Xu, Yan-Jie; Deng, Yi; Wen, Fei; Zhang, Yan","4,6-Dichloro-<i>N</i>-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazin-2-amine","Acta Crystallographica Section E","2007","63","4","o2029","o2030","10.1107/S1600536807012421","","","0.71073","MoKα","","0.0803","0.0438","","","0.1031","0.126","","","","","","1.027","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212898","11.6355","0.0008","11.6433","0.0008","12.1363","0.0008","116.529","0.001","91.982","0.001","118.802","0.001","1221.9","0.15","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Bis[1,3(η^5^)-cyclopentadienyl]hexakis(μ-diethyl phosphito)-1:2κ^6^P:O;2:3κ^6^O:P-tricobalt(II)","","- C34 H70 Co3 O18 P6 -","- C34 H70 Co3 O18 P6 -","- C34 H70 Co3 O18 P6 -","1","0.5","HB2322","Weberski Jr, Michael P.; McLauchlan, Craig C.","Bis[(η^5^-cyclopentadienyl)tris(diethyl phosphito)-κ^3^<i>P</i>,<i>P</i>',<i>P</i>''-cobaltate(III)-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'']cobalt(II)","Acta Crystallographica Section E","2007","63","4","m1171","m1172","10.1107/S1600536807013001","","","0.71073","MoKα","","0.0255","0.024","","","0.0644","0.0653","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212899","10.221","0.002","11.882","0.002","17.12","0.003","74.12","0.03","72.91","0.03","64.94","0.03","1773.4","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-(Methylsulfanyl)benzamide oxime","","- C8 H10 N2 O S -","- C8 H10 N2 O S -","- C64 H80 N16 O8 S8 -","8","4","HB2323","Wang, Hai-Bo; Xing, Zhi-Tao; Ding, Wei-Lin; Yin, Jun; Wang, Pin-Liang","4-(Methylsulfanyl)benzamide oxime","Acta Crystallographica Section E","2007","63","4","o1834","o1835","10.1107/S1600536807012184","","","0.71073","MoKα","","0.085","0.0512","","","0.1167","0.1427","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212900","11.6084","0.0002","14.5141","0.0002","17.3216","0.0002","90","","107.416","0.001","90","","2784.65","0.07","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2'-(5-Bromo-2-hydroxybenzylidene)benzenesulfonohydrazide","","- C13 H11 Br N2 O3 S -","- C13 H11 Br N2 O3 S -","- C104 H88 Br8 N16 O24 S8 -","8","2","HB2325","Ali, Hapipah M.; Laila, Musalem; Wan Jefrey, Basirun; Ng, Seik Weng","2'-(5-Bromo-2-hydroxybenzylidene)benzenesulfonohydrazide","Acta Crystallographica Section E","2007","63","4","o1821","o1822","10.1107/S1600536807011907","","","0.71073","MoKα","","0.0486","0.0319","","","0.0932","0.1114","","","","","","1.124","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212901","7.3648","0.0019","9.3606","0.0019","9.839","0.002","78.656","0.003","79.377","0.003","71.775","0.002","626.2","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","trans-Bis[(2E)-3-(N,N-dimethylamino)-1-(2-pyridyl)prop-2-en-1-one- k^2^N,O]bis(perchlorato-κO)cadmium(II)","","- C20 H24 Cd Cl2 N4 O10 -","- C20 H24 Cd Cl2 N4 O10 -","- C20 H24 Cd Cl2 N4 O10 -","1","0.5","HB2326","Tong-Liang Hu; Jin-Lei Tian","<i>trans</i>-Bis[(2<i>E</i>)-3-(<i>N</i>,<i>N</i>-dimethylamino)-1-(2-pyridyl)prop-2-en-1-one-κ^2^<i>N</i>,<i>O</i>]bis(perchlorato-κ<i>O</i>)cadmium(II)","Acta Crystallographica Section E","2007","63","4","m1092","m1093","10.1107/S1600536807011890","","","0.71073","MoKα","","0.0332","0.0324","","","0.0855","0.0863","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212902","10.3685","0.001","20.924","0.002","14.1957","0.0014","90","","94.064","0.002","90","","3072","0.5","120","","120","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Mn(tptMetame)](ClO4)2","(1,1,1-Tris{[N-(2-pyridylmethyl)-N-methylamino]methyl}ethane- κ^6^N)manganese(II) bis(perchlorate)","","- C26 H36 Cl2 Mn N6 O8 -","- C26 H36 Cl2 Mn N6 O8 -","- C104 H144 Cl8 Mn4 N24 O32 -","4","1","HB2327","Lars Duelund; Alan Hazell; Hans Toftlund","(1,1,1-Tris{[<i>N</i>-(2-pyridylmethyl)-<i>N</i>-methylamino]methyl}ethane-κ^6^<i>N</i>)manganese(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","4","m1177","m1178","10.1107/S1600536807012020","","","0.71073","MoKα","","","0.031","","","","0.036","","","","","","1.005","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212903","8.7548","0.0018","10.03","0.002","12.969","0.003","90","","97.951","0.003","90","","1127.9","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,4'-Bis(propionylamino)-1,1'-ethylenedipyridinium dibromide dihydrate","","- C18 H28 Br2 N4 O4 -","- C18 H28 Br2 N4 O4 -","- C36 H56 Br4 N8 O8 -","2","0.5","HB2328","Xu, Yan-Jie; Li, Jiang-Sheng; Qin, Ling; Wang, Wei","4,4'-Bis(propionylamino)-1,1'-ethylenedipyridinium dibromide dihydrate","Acta Crystallographica Section E","2007","63","4","o1825","o1826","10.1107/S1600536807012032","","","0.71073","MoKα","","0.0515","0.0317","","","0.0749","0.0838","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212904","5.478","0.0017","8.057","0.003","13.642","0.005","90","","90","","90","","602.1","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R)-Tetrahydrofuran-2-carboxamide","","- C5 H9 N O2 -","- C5 H9 N O2 -","- C20 H36 N4 O8 -","4","1","HB2329","Cui Jian-Lan; Cao, Duan-Lin; Cai, Jian-Bo","(<i>S</i>)-Tetrahydrofuran-2-carboxamide","Acta Crystallographica Section E","2007","63","4","o1973","o1974","10.1107/S1600536807012743","","","0.71073","MoKα","","0.0566","0.0377","","","0.0883","0.1","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212905","5.9309","0.0003","5.6529","0.0003","17.2697","0.001","90","","91.762","0.002","90","","578.72","0.05","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Thiophene-2-carbaldehyde 3-nitrophenylhydrazone","","- C11 H9 N3 O2 S -","- C11 H9 N3 O2 S -","- C22 H18 N6 O4 S2 -","2","1","HB2331","Wardell, James L.; Low, John N.; Glidewell, Christopher","Thiophene-2-carbaldehyde 3-nitrophenylhydrazone","Acta Crystallographica Section E","2007","63","4","o1848","o1850","10.1107/S1600536807012238","","","0.71073","MoKα","","0.0415","0.039","","","0.1025","0.1052","","","","","","1.092","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212906","8.3904","0.0004","24.4688","0.0013","10.0555","0.0005","90","","95.178","0.001","90","","2056","0.18","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis(μ-Diphenylphosphino)ethane-κ^2^P:P')-bis[(O-ethyl N-phenylthiocarbamato-κS)gold(I)]","","- C44 H44 Au2 N2 O2 P2 S2 -","- C44 H44 Au2 N2 O2 P2 S2 -","- C88 H88 Au4 N4 O4 P4 S4 -","2","0.5","HB2333","Ho, Soo Yei; Tiekink, Edward R. T.","Bis(μ-Diphenylphosphino)ethane-κ^2^<i>P</i>:<i>P</i>')-bis[(<i>O</i>-ethyl <i>N</i>-phenylthiocarbamato-κ<i>S</i>)gold(I)]","Acta Crystallographica Section E","2007","63","4","m1128","m1129","10.1107/S1600536807012755","","","0.71069","MoKα","","0.039","0.029","","","0.069","0.09","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212907","8.9903","0.0005","9.0639","0.0005","11.8622","0.0007","77.277","0.001","74.324","0.001","68.869","0.001","859.93","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H16 N2 O2 Sn -","- C20 H16 N2 O2 Sn -","- C40 H32 N4 O4 Sn2 -","2","1","HB2334","Shuja, Shaukat; Ali, Saqib; Meetsma, Auke; Broker, Grant A.; Tiekink, Edward R. T.","[<i>N</i>-Formyl-<i>N</i>'-(2-oxidobenzylidene)hydrazine-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']diphenyltin(IV)","Acta Crystallographica Section E","2007","63","4","m1130","m1132","10.1107/S1600536807012767","","","0.71073","MoKα","","0.023","0.022","","","0.058","0.058","","","","","","1.12","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212908","7.7498","0.0012","20.334","0.004","7.7582","0.0013","90","","109.544","0.01","90","","1152.1","0.4","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H14 O3 -","- C13 H14 O3 -","- C52 H56 O12 -","4","1","HB2339","Xiujie Liu; Wei Wang; Guangshan Zhu; Shilun Qiu","Ethyl (<i>E</i>)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enoate","Acta Crystallographica Section E","2007","63","4","o2036","o2037","10.1107/S1600536807013827","","","0.71073","MoKα","","0.0814","0.0434","","","0.0883","0.1085","","","","","","1.027","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2212909","11.2597","0.0013","18.703","0.002","19.849","0.002","90","","90","","90","","4180","0.8","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","(dL-Methioninato-κ^2^N,O)(2,2',2''-triaminotriethylamine- κ^4^N,N',N'',N''')nickel(II) perchlorate dihydrate","","- C11 H32 Cl N5 Ni O8 S -","- C11 H32 Cl N5 Ni O8 S -","- C88 H256 Cl8 N40 Ni8 O64 S8 -","8","1","HG2118","Hai-Qiong Yu,; Ya-Mei Pei; Zhi-Gang Liu","(<small>DL</small>-Methioninato-κ^2^<i>N</i>,<i>O</i>)(2,2',2''-triaminotriethylamine-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')nickel(II) perchlorate dihydrate","Acta Crystallographica Section E","2007","63","4","m1015","m1016","10.1107/S1600536806051804","","","0.71073","MoKα","","0.0755","0.068","","","0.1813","0.1898","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212910","23.589","0.004","7.261","0.0008","20.233","0.003","90","","98.522","0.005","90","","3427.2","0.9","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Methyl 6-methyl-2-thioxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5- carboxylate","","- C16 H20 N2 O5 S -","- C16 H20 N2 O5 S -","- C128 H160 N16 O40 S8 -","8","1","HG2173","Li, Wei; Long, Qiao-Yun; Liu, Hong-Wei","Methyl 6-methyl-2-thioxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","4","o1745","o1746","10.1107/S1600536807010604","","","0.7107","MoKα","","0.0588","0.0466","","","0.11","0.1184","","","","","","1.124","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212911","13.3747","0.0019","13.3747","0.0019","9.7348","0.0019","90","","90","","90","","1741.4","0.5","293","2","293","2","","","","","","","","4","I 4/m","-I 4","87","","(5,10,15,20-tetraphenylporphyrinato)copper(II)","","- C44 H28 Cu N4 -","- C44 H28 Cu N4 -","- C88 H56 Cu2 N8 -","2","0.125","HG2183","He, Hong-Shan","A second polymorph of (5,10,15,20-tetraphenylporphyrinato)copper(II)","Acta Crystallographica Section E","2007","63","4","m976","m977","10.1107/S1600536807008574","","","0.71073","MoKα","","0.0653","0.0353","","","0.0886","0.1035","","","","","","1.095","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212912","9.1421","0.0006","11.5978","0.0007","17.1379","0.0015","90","","90","","90","","1817.1","0.2","296","","296","","","","","","","","","4","P c a 21","P 2c -2ac","29","","Diethyl 2-[morpholin-4-yl(phenyl)methyl]malonate","","- C18 H25 N O5 -","- C18 H25 N O5 -","- C72 H100 N4 O20 -","4","1","HG2187","Mehmet Akkurt; Sema Öztürk Yıldırım; Oumaima T. Benjelloun; Najib Ben Larbi; Taibi Ben Hadda; Orhan Büyükgüngör","Diethyl 2-[(morpholin-4-yl)(phenyl)methyl]malonate","Acta Crystallographica Section E","2007","63","4","o1656","o1657","10.1107/S1600536807010380","","","0.71073","MoKα","","0.0526","0.0408","","","0.1058","0.1118","","","","","","0.997","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212913","13.0486","0.0002","11.2091","0.0002","9.0905","0.0003","90","","121.625","0.002","90","","1132.16","0.05","291","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-picoline N-oxide‒hydroquinone (1/1)","","- C12 H13 N O3 -","- C12 H13 N O3 -","- C48 H52 N4 O12 -","4","0.5","HG2188","Moreno-Fuquen, Rodolfo; Valderrama-N, Jaime; Kennedy, Alan R.","Three-centre hydrogen bonds in 4-picoline <i>N</i>-oxide‒hydroquinone (1/1)","Acta Crystallographica Section E","2007","63","4","o1534","o1536","10.1107/S160053680700877X","","","0.71073","MoKα","","0.08","0.037","","","0.081","0.107","","","","","","1.111","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212914","7.5429","0.0012","13.654","0.002","20.186","0.003","90","","97.395","0.003","90","","2061.7","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Triaqua(benzene-1,2-dicarboxylato-κO)(1,10-phenanthroline-κ^2^N,N')zinc(II) monohydrate","","- C20 H20 N2 O8 Zn -","- C20 H20 N2 O8 Zn -","- C80 H80 N8 O32 Zn4 -","4","1","HG2191","Wei-Hua Li; Fa-Qian Liu; Xue-Hui Pang; Bao-Rong Hou","Triaqua(benzene-1,2-dicarboxylato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II) monohydrate","Acta Crystallographica Section E","2007","63","4","m1114","m1115","10.1107/S1600536807012391","","","0.71073","MoKα","","0.0805","0.0483","","","0.1293","0.1459","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212915","16.024","0.003","11.3","0.002","7.8015","0.0016","90","","114.79","0.03","90","","1282.5","0.5","100","2","100","2","","","","","","","","3","C 1 c 1","C -2yc","9","","4,4'-(ethylenedioxy)dibenzaldehyde","","- C16 H14 O4 -","- C16 H14 O4 -","- C64 H56 O16 -","4","1","HG2194","Ashish Kumar Tewari; Ved Prakash Singh; Carmen Puerta; Pedro Valerga","A new polymorph of 4,4'-(ethylenedioxy)dibenzaldehyde","Acta Crystallographica Section E","2007","63","4","o1930","o1931","10.1107/S1600536807012408","","","0.71073","MoKα","","0.0388","0.0386","","","0.1068","0.107","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212916","9.7239","0.0009","16.7101","0.0016","12.6525","0.0013","90","","105.029","0.005","90","","1985.5","0.3","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(4-Hydroxy-3,5-dimethoxyphenyl)-1H-phenanthro[9,10-d]imidazole methanol solvate","","- C24 H22 N2 O4 -","- C24 H22 N2 O4 -","- C96 H88 N8 O16 -","4","1","HG2195","Yi-Feng Sun; Yi-Ping Cui; Ji-Kui Li; Ze-Bao Zheng","2-(4-Hydroxy-3,5-dimethoxyphenyl)-1<i>H</i>-phenanthro[9,10-<i>d</i>]imidazole methanol solvate","Acta Crystallographica Section E","2007","63","4","o1751","o1752","10.1107/S1600536807010720","","","0.71073","MoKα","","0.0741","0.0453","","","0.1092","0.1254","","","","","","1.065","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212917","7.4559","0.0007","11.226","0.001","11.4173","0.001","93.59","0.002","97.398","0.002","96.247","0.002","939.19","0.15","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","(E)-O-Methyl N-(4-methylphenyl)thiocarbamate","","- C9 H11 N O S -","- C9 H11 N O S -","- C36 H44 N4 O4 S4 -","4","2","HG2200","Ho, Soo Yei; Kuan, Fong Sheen; Tiekink, Edward R. T.","(<i>E</i>)-<i>O</i>-Methyl <i>N</i>-(4-methylphenyl)thiocarbamate","Acta Crystallographica Section E","2007","63","4","o1723","o1724","10.1107/S1600536807010914","","","0.71069","MoKα","","0.057","0.048","","","0.13","0.148","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212918","5.9054","0.0008","7.4497","0.001","11.9638","0.0016","89.321","0.003","82.207","0.003","85.931","0.003","520.15","0.12","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","(E)-O-Ethyl N-(4-methylphenyl)thiocarbamate","","- C10 H13 N O S -","- C10 H13 N O S -","- C20 H26 N2 O2 S2 -","2","1","HG2203","Primjira P. Tadbuppa; Tiekink, Edward R. T.","(<i>E</i>)-<i>O</i>-Ethyl <i>N</i>-(4-methylphenyl)thiocarbamate","Acta Crystallographica Section E","2007","63","4","o1885","o1886","10.1107/S1600536807011671","","","0.71069","MoKα","","0.068","0.056","","","0.15","0.158","","","","","","1.12","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212919","9.0845","0.0002","17.1465","0.0004","9.9094","0.0002","90","","110.972","0.0013","90","","1441.31","0.06","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diisopropyl 1-(methylsulfonyl)hydrazine-1,2-dicarboxylate","","- C9 H18 N2 O6 S -","- C9 H18 N2 O6 S -","- C36 H72 N8 O24 S4 -","4","1","HG2206","Banwell, Martin G.; Dauge, Delphine; Willis, Anthony C.","Diisopropyl 1-(methylsulfonyl)hydrazine-1,2-dicarboxylate","Acta Crystallographica Section E","2007","63","4","o2009","o2011","10.1107/S1600536807011737","","","0.71073","MoKα","","0.0427","0.0298","","0.0887","0.0744","0.0887","","","","","","0.9441","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212920","7.435","0.002","12.168","0.003","35.664","0.004","90","","90","","90","","3226.5","1.2","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Brucinium hydrogen N-(4-nitrobenzoyl)-L-aspartate dihydrate","","- C34 H40 N4 O13 -","- C34 H39 N4 O13 -","- C136 H156 N16 O52 -","4","1","HG2210","Agata Białońska; Zbigniew Ciunik","Brucinium hydrogen <i>N</i>-(4-nitrobenzoyl)-<small>L</small>-aspartate dihydrate","Acta Crystallographica Section E","2007","63","4","o2002","o2004","10.1107/S1600536807013244","","","0.71073","MoKα","","0.1242","0.083","","","0.1702","0.1932","","","","","","1.118","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212921","10.5205","0.0018","11.784","0.002","10.3702","0.0017","90","","111.056","0.003","90","","1199.8","0.4","100","2","100","2","","","","","","","","4","C 1 c 1","C -2yc","9","","N-(3-Phenylpropyl)guanidinium bromide","","- C10 H16 Br N3 -","- C10 H16 Br N3 -","- C40 H64 Br4 N12 -","4","1","HG2211","Stanford, Daniel J.; Fernandez, Richard A.; Zeller, Matthias; Hunter, Allen D.","<i>N</i>-(3-Phenylpropyl)guanidinium bromide","Acta Crystallographica Section E","2007","63","4","o1934","o1936","10.1107/S160053680701238X","","","0.71073","MoKα","","0.063","0.0583","","","0.1394","0.1412","","","","","","1.144","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212922","8.243","0.0005","21.8718","0.0013","12.9224","0.0008","90","","98.533","0.002","90","","2304","0.2","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2'-[(Phenyl)(1-phenyl-3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-4-ylidene)methyl]- 1-naphthohydrazide","","- C28 H22 N4 O2 -","- C28 H22 N4 O2 -","- C112 H88 N16 O8 -","4","1","HG2213","Yi-Feng Sun; Xian-Zhong Sun; Dong-Di Zhang; Yi-Ping Cui","2'-[(Phenyl)(1-phenyl-3-methyl-5-oxo-4,5-dihydro-1<i>H</i>-pyrazole-4-ylidene)methyl]-1-naphthohydrazide","Acta Crystallographica Section E","2007","63","4","o2005","o2006","10.1107/S1600536807012883","","","0.71073","MoKα","","0.0777","0.0464","","","0.1071","0.1232","","","","","","1.015","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212923","10.348","0.005","5.489","0.005","8.218","0.005","90","","125.09","0.05","90","","381.9","0.5","296","2","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Anhydrous Barium strontium oxalate","Anhydrous Barium strontium oxalate","","- C2 Ba0.741 O4 Sr0.259 -","- C2 Ba0.741 O4 Sr0.259 -","- C8 Ba2.964 O16 Sr1.036 -","4","0.5","HK2129","Trifa, Chahrazed; Bouhali, Amira; Boudaren, Chaouki; Bouacida, Sofiane; Bataille, Thierry","Anhydrous barium strontium oxalate","Acta Crystallographica Section E","2007","63","4","i102","i104","10.1107/S1600536806043510","","","0.71073","MoKα","","0.031","0.0263","","","0.0748","0.0766","","","","","","1.308","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212924","12.162","0.002","23.153","0.004","8.5893","0.0014","90","","90","","90","","2418.6","0.7","273","2","273","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","5,5,5-Trifluoro-N-(4-fluorophenyl)-4-hydroxypentanamide","","- C11 H11 F4 N O2 -","- C11 H11 F4 N O2 -","- C88 H88 F32 N8 O16 -","8","1","HK2195","Wan, Wen; Ma, Guo-Bin; Yuan, Zong-Qian; Li, Ming-Xing; Hao, Jian","5,5,5-Trifluoro-<i>N</i>-(4-fluorophenyl)-4-hydroxypentanamide","Acta Crystallographica Section E","2007","63","4","o1685","o1686","10.1107/S1600536807010422","","","0.71073","MoKα","","0.0661","0.0464","","","0.121","0.1381","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212925","8.077","0.0016","10.045","0.002","12.238","0.002","90","","90","","90","","992.9","0.3","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1-(2',4'-Difluorophenyl)-2-(1H-imidazol-1-yl)ethanone","","- C11 H8 F2 N2 O -","- C11 H8 F2 N2 O -","- C44 H32 F8 N8 O4 -","4","1","HK2200","Lin Yuan; Xiao Tao; Bin Xu; Wenyuan Wu; Wang, Jin-tang","1-(2,4-Difluorophenyl)-2-(1<i>H</i>-imidazol-1-yl)ethanone","Acta Crystallographica Section E","2007","63","4","o1640","o1641","10.1107/S1600536807009853","","","0.71073","MoKα","","0.0627","0.0392","","","0.0935","0.1069","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212926","8.711","0.0017","9.655","0.0019","12.668","0.003","93.69","0.03","107.82","0.03","111.1","0.03","927.9","0.5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","2-(2-Chloroacetyl)-6,7-dimethoxy-1-(phenoxymethyl)-1,2,3,4- tetrahydroisoquinoline","","- C20 H22 Cl N O4 -","- C20 H22 Cl N O4 -","- C40 H44 Cl2 N2 O8 -","2","1","HK2202","Zhi-Hong Zou; Yong Ling; Wen-Long Huang","2-(2-Chloroacetyl)-6,7-dimethoxy-1-(phenoxymethyl)-1,2,3,4-tetrahydroisoquinoline","Acta Crystallographica Section E","2007","63","4","o1596","o1597","10.1107/S1600536807009476","","","0.71073","MoKα","","0.0786","0.0539","","","0.1486","0.1674","","","","","","1.078","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212927","10.4254","0.0009","7.9957","0.0007","27.826","0.002","90","","90","","90","","2319.5","0.3","294","2","294","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","phenyl(3-phenyloxiran-2-yl)methanone","phenyl 3-phenyloxiran-2-yl ketone","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","HK2208","Javeed H. Zaidi; Tahir Mehmood; Muhammad Zareef; Ghulam Qadeer; Wai-Yeung Wong","Phenyl 3-phenyloxiran-2-yl ketone","Acta Crystallographica Section E","2007","63","4","o1721","o1722","10.1107/S1600536807010409","","","0.71073","MoKα","","0.107","0.041","","","0.0878","0.1162","","","","","","0.991","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212928","4.6686","0.0005","12.4808","0.0014","13.4147","0.0015","66.185","0.002","86.088","0.002","88.898","0.002","713.4","0.14","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","(4-Oxo-3,4-dihydroquinazolin-3-yl)methyl pyrrolidine-1-carbodithioate","","- C14 H15 N3 O S2 -","- C14 H15 N3 O S2 -","- C28 H30 N6 O2 S4 -","2","1","HK2213","Li-li Jiang","(4-Oxo-3,4-dihydroquinazolin-3-yl)methyl pyrrolidine-1-carbodithioate","Acta Crystallographica Section E","2007","63","4","o1985","o1986","10.1107/S1600536807011099","","","0.71073","MoKα","","0.055","0.0455","","","","0.1349","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212929","8.405","0.0006","9.0451","0.0007","9.0962","0.0009","108.603","0.005","95.617","0.005","116.885","0.003","560.07","0.09","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","6,9-Dichloro-1,2,3,4-tetrahydroacridine","","- C13 H11 Cl2 N -","- C13 H11 Cl2 N -","- C26 H22 Cl4 N2 -","2","1","HK2214","Elsinghorst, Paul Wilhelm; Nieger, Martin; Gütschow, Michael","6,9-Dichloro-1,2,3,4-tetrahydroacridine","Acta Crystallographica Section E","2007","63","4","o1818","o1820","10.1107/S1600536807011701","","","0.71073","MoKα","","0.0481","0.0321","","","0.0747","0.0794","","","","","","0.98","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212930","10.361","0.003","8.321","0.003","28.349","0.009","90","","90","","90","","2444.1","1.4","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Bis[3-(1H-imidazol-1-yl-κN^3)-1-phenylpropan-1-one]silver(I) nitrate monohydrate","","- C24 H26 Ag N5 O6 -","- C24 H26 Ag N5 O6 -","- C96 H104 Ag4 N20 O24 -","4","1","HY2042","Cai, Hua; Guo, Ying; Li, Yan","Bis[3-(1<i>H</i>-imidazol-1-yl-κ<i>N</i>^3^)-1-phenylpropan-1-one]silver(I) nitrate monohydrate","Acta Crystallographica Section E","2007","63","4","m999","m1000","10.1107/S1600536807010008","","","0.71073","MoKα","","0.0779","0.0422","","","0.0978","0.1172","","","","","","0.979","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212931","24.7352","0.0006","14.7677","0.0004","19.621","0.0004","90","","123.532","0.002","90","","5974.4","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(tetraphenylphosphonium) tris(2-thioxo-1,3-dithiole-4,5-dithiolato)stannate(IV)","","- C57 H40 P2 S15 Sn -","- C57 H40 P2 S15 Sn -","- C228 H160 P8 S60 Sn4 -","4","0.5","HY2045","Wang, Yan-Ling; Wang, Yong-Jin; Yao, Jun; Zhao, Xiu-Tai; Wang, Rui-He","Bis(tetraphenylphosphonium) tris(2-thioxo-1,3-dithiole-4,5-dithiolato)stannate(IV) at 293K","Acta Crystallographica Section E","2007","63","4","m1147","m1148","10.1107/S1600536807012469","","","0.71073","MoKα","","0.0306","0.0243","","","0.0607","0.0647","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212932","12.379","0.003","21.425","0.004","8.842","0.0018","90","","107.45","0.03","90","","2237.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[μ-4,4'-methylenebis(3-hydroxy-2-naphthoato- κ^2^O:O')]bis[aqua(ethylenediamine-κ^2^N,N')copper(II)]","","- C50 H48 Cu2 N4 O14 -","- C50 H48 Cu2 N4 O14 -","- C100 H96 Cu4 N8 O28 -","2","0.5","HY2047","Yin, Wei-Rong; Ye, Jun-Wei; Ye, Ling; Zhang, Ping; Xu, Jia-Ning","Bis[μ-4,4'-methylenebis(3-hydroxy-2-naphthoato-κ^2^<i>O</i>:<i>O</i>')]bis[aqua(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')copper(II)]","Acta Crystallographica Section E","2007","63","4","m1165","m1167","10.1107/S1600536807012718","","","0.71073","MoKα","","0.0727","0.0433","","","0.1285","0.1504","","","","","","0.983","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212933","7.1242","0.0001","12.9594","0.0002","16.3909","0.0003","90","","90","","90","","1513.3","0.04","293","2","293","2","","","","","","","","5","C m c a","-C 2ac 2","64","","Tetraamminebis(pyrazine-2-carboxylato-κN^4^)copper(II)","","- C10 H18 Cu N8 O4 -","- C10 H18 Cu N8 O4 -","- C40 H72 Cu4 N32 O16 -","4","","HY2048","Peng, Shao-Wei; Miao, Yan-Li; Song, Wen-Dong","Tetraamminebis(pyrazine-2-carboxylato-κ<i>N</i>^4^)copper(II)","Acta Crystallographica Section E","2007","63","4","m1145","m1146","10.1107/S1600536807013207","","","0.71073","MoKα","","0.0268","0.0255","","","0.0654","0.0663","","","","","","1.147","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212934","13.899","0.002","9.572","0.001","20.738","0.003","90","","101.519","0.002","90","","2703.4","0.6","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aquadithiocyanatobis(2,4,6-tri-2-pyridyl-1,3,5-triazine)manganese(II) dimethylformamide solvate","","- C23 H21 Mn N9 O2 S2 -","- C23 H21 Mn N9 O2 S2 -","- C92 H84 Mn4 N36 O8 S8 -","4","1","IM2002","Xiu-Ping Sun; Wen Gu; Xin Liu","Aquadithiocyanato(2,4,6-tri-2-pyridyl-1,3,5-triazine)manganese(II) dimethylformamide solvate","Acta Crystallographica Section E","2007","63","4","m1027","m1028","10.1107/S1600536807010768","","","0.71073","MoKα","","0.0853","0.0427","","","0.1037","0.1242","","","","","","1.001","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2212935","8.651","0.001","12.32","0.001","16.605","0.002","78.841","0.007","78.02","0.01","81.33","0.01","1687.2","0.3","295","2","","","","","","","","","","5","P -1","-P 1","2","","Ethyl 2-(9-methylsulfonyl-1-oxo-2,3,4,9-tetrahydro-1H-carbazol-2-yl)acetate","","- C17 H19 N O5 S -","- C17 H19 N O5 S -","- C68 H76 N4 O20 S4 -","4","2","IM2003","Özbey, Süheyla; Karayel, Arzu; Yılmaz, Ayhan; Uludağ, Nesi̇mi̇","Ethyl 2-(9-methylsulfonyl-1-oxo-2,3,4,9-tetrahydro-1<i>H</i>-carbazol-2-yl)acetate","Acta Crystallographica Section E","2007","63","4","o1623","o1625","10.1107/S1600536807006939","","","1.54184","CuKα","","","0.0704","","","","0.2232","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212936","8.198","0.002","9.968","0.001","10.2003","0.0009","76.252","0.009","89.1","0.01","78.29","0.01","792.3","0.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis[4-(dimethylamino)benzoato-κO](nicotinamide-κN^1^)cobalt(II) dihydrate","","- C30 H40 Co N6 O10 -","- C30 H40 Co N6 O10 -","- C30 H40 Co N6 O10 -","1","0.5","IM2005","Hökelek, Tuncer; Necefoğlu, Hacali","Diaquabis[4-(dimethylamino)benzoato-κ<i>O</i>](nicotinamide-κ<i>N</i>^1^)cobalt(II) dihydrate","Acta Crystallographica Section E","2007","63","4","m1078","m1080","10.1107/S1600536807012111","","","1.54184","CuKα","","0.1006","0.0752","","","0.1785","0.1963","","","","","","1.084","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212937","19.9757","0.0013","9.4615","0.0006","9.8943","0.0007","90","","99.8","0.001","90","","1842.7","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[triaqua{[2-(2,6-dichloroanilino)phenyl]acetato}potassium(I)]- μ-aqua]","","- C14 H18 Cl2 K N O6 -","- C14 H18 Cl2 K N O6 -","- C56 H72 Cl8 K4 N4 O24 -","4","1","IS2142","Gan-Ghui Chu; Jing Cheng","<i>catena</i>-Poly[[triaqua{[2-(2,6-dichloroanilino)phenyl]acetato}potassium(I)]-μ-aqua]","Acta Crystallographica Section E","2007","63","4","m1008","m1009","10.1107/S1600536807010239","","","0.71073","MoKα","","0.07","0.0563","","","0.1521","0.161","","","","","","1.089","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212938","10.5044","0.0002","25.4158","0.0008","7.2779","0.0002","90","","90","","90","","1943.04","0.09","296.1","","","","","","","","","","","6","P 21 21 2","P 2 2ab","18","(L-Histidinato-κ^3^N,N,O)(L-histidine-κ^2^N,O)oxovanadium(IV) perchlorate monohydrate","(α-amino-4-imidazolepropionato-κ^3^N,N,O)[α-amino-3-(1H-imidazol-3-ium- 5-yl)propionato-κ^2^N,O]oxovanadium(IV) perchlorate monohydrate","","- C12 H19 Cl N6 O10 V -","- C12 H19 Cl N6 O10 V -","- C48 H76 Cl4 N24 O40 V4 -","4","1","IS2151","Mohammad K. Islam; Chieko Tsuboya; Yoshitaro Miyashita; Ken-ichi Okamoto; Kan Kanamori","(<small>L</small>-Histidinato-κ^3^<i>N</i>,<i>N</i>,<i>O</i>)(<small>L</small>-histidine-κ^2^<i>N</i>,<i>O</i>)oxidovanadium(IV) perchlorate monohydrate","Acta Crystallographica Section E","2007","63","4","m1052","m1054","10.1107/S1600536807010744","","","0.7107","MoKα","","","0.0304","","","","0.0882","","","","","","1.011","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212939","24.8142","0.0006","10.1662","0.0002","9.4483","0.0002","90","","90","","90","","2383.49","0.09","110","2","110","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","N,N'-Bis(2-pyridylmethyl)ethane-1,2-diammonium dichloride hexadeuterodimethyl sulfoxide disolvate","","- C18 H20 Cl2 D12 N4 O2 S2 -","- C18 H20 Cl2 D12 N4 O2 S2 -","- C72 H80 Cl8 D48 N16 O8 S8 -","4","0.5","IS2153","Matiková-Maľarová, Miroslava; Marek Šebela; Trávníček, Zdeněk","<i>N</i>,<i>N</i>'-Bis(2-pyridylmethyl)ethane-1,2-diammonium dichloride hexadeuterodimethyl sulfoxide disolvate","Acta Crystallographica Section E","2007","63","4","o1753","o1755","10.1107/S160053680701104X","","","0.71073","MoKα","","0.0298","0.0284","","","0.081","0.0822","","","","","","1.187","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212940","9.467","0.001","10.337","0.001","21.736","0.003","90","","97.177","0.002","90","","2110.4","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Ethyl (2Z)-2-(2-chlorobenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-1,3- thiazolo[3,2-a]pyrimidine-6-carboxylate","","- C23 H19 Cl N2 O3 S -","- C23 H19 Cl N2 O3 S -","- C92 H76 Cl4 N8 O12 S4 -","4","1","KJ2050","Jotani, Mukesh M.; Baldaniya, Bharat B.","Ethyl (2<i>Z</i>)-2-(2-chlorobenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5<i>H</i>-1,3-thiazolo[3,2-<i>a</i>]pyrimidine-6-carboxylate","Acta Crystallographica Section E","2007","63","4","o1937","o1939","10.1107/S1600536807012731","","","0.71069","MoKα","","0.1022","0.0749","","","0.1599","0.1727","","","","","","1.15","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212941","12.6534","0.0014","16.1729","0.0019","4.3244","0.0005","90","","90","","90","","884.95","0.18","223","2","223","2","","","","","","","","3","P b a 2","P 2 -2ab","32","","1,2,4-Triiodobenzene","","- C6 H3 I3 -","- C6 H3 I3 -","- C24 H12 I12 -","4","1","KP2084","Novak, Igor","1,2,4-Triiodobenzene","Acta Crystallographica Section E","2007","63","4","o1542","o1543","10.1107/S1600536807009130","","","0.71073","MoKα","","0.0372","0.0323","","","0.06","0.0621","","","","","","1.007","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212942","7.2682","0.0007","14.319","0.002","14.411","0.002","111.31","0.02","101.49","0.01","100.71","0.01","1313.3","0.4","299","2","299","2","","","","","","","","5","P -1","-P 1","2","","8-(Piperidin-1-ylsulfonyl)quinoline","","- C14 H16 N2 O2 S -","- C14 H16 N2 O2 S -","- C56 H64 N8 O8 S4 -","4","2","KP2088","Andrighetti-Fröhner, Carla Regina; Nunes, Ricardo José; Silva, Luiz Everson da; Simões, Cláudia Maria Oliviera; Foro, Sabine","8-(Piperidin-1-ylsulfonyl)quinoline","Acta Crystallographica Section E","2007","63","4","o1638","o1639","10.1107/S1600536807009774","","","1.5418","CuKα","","0.0466","0.0453","","","0.1293","0.1309","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212943","13.051","0.0014","13.051","0.0014","25.047","0.005","90","","90","","120","","3694.7","0.9","150","","296","2","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","(Acetonitrile){hydridotris[3,5-bis(trifluoromethyl)-1- pyrazolyl]borato}copper(I)","","- C17 H6.97 B Cu F18 N7 -","- C17 H6.97 B Cu F18 N7 -","- C102 H41.82 B6 Cu6 F108 N42 -","6","0.333333","KP2089","Marielle Nicole C. Balili; Tomislav Pintauer","(Acetonitrile){hydridotris[3,5-bis(trifluoromethyl)-1-pyrazolyl]borato}copper(I)","Acta Crystallographica Section E","2007","63","4","m988","m990","10.1107/S1600536807009762","","","0.71073","MoKα","","0.0305","0.0265","","","0.0702","0.0718","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212944","7.7042","0.0007","9.3628","0.0008","14.8665","0.0012","90","","105.536","0.012","90","","1033.18","0.16","293","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-Methyl 3-[1-(thiazol-2-yl)ethylidene]dithiocarbazate","","- C7 H9 N3 S3 -","- C7 H9 N3 S3 -","- C28 H36 N12 S12 -","4","1","KP2093","Zhong-Yuan Chen; Guo-Qiang Wu; Fen-Xiang Jiang; Yu-Liang Tian; Shang Shan","Methyl 3-[(<i>Z</i>)-1-(thiazol-2-yl)ethylidene]dithiocarbazate","Acta Crystallographica Section E","2007","63","4","o1919","o1920","10.1107/S1600536807013049","","","0.71073","MoKα","","0.037","0.029","","","0.078","0.082","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212945","8.4561","0.0017","9.4191","0.0019","12.832","0.003","111.26","0.03","97.23","0.03","96.38","0.03","931.2","0.4","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","Bis(norfloxacin) tetrachloridopalladium dihydrate","","- C32 H42 Cl4 F2 N6 O8 Pd -","- C32 H42 Cl4 F2 N6 O8 Pd -","- C32 H42 Cl4 F2 N6 O8 Pd -","1","0.5","LH2307","Rui-Ding Hu; Qing-Sen Yu","Bis(norfloxacinium) tetrachloridopalladate(II) dihydrate","Acta Crystallographica Section E","2007","63","4","m1070","m1072","10.1107/S1600536807011889","","","0.71073","MoKα","","0.058","0.0399","","","0.0802","0.088","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212946","7.9018","0.0002","9.4463","0.0002","10.2847","0.0006","63.543","0.015","70.24","0.02","84.96","0.03","645.01","0.14","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","Methyl 2-(2,3-dimethylanilino)benzoate","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C32 H34 N2 O4 -","2","1","LH2314","Nawaz, Hamid; Khawar Rauf, M.; Ebihara, Masahiro; Badshah, Amin","Methyl 2-(2,3-dimethylanilino)benzoate","Acta Crystallographica Section E","2007","63","4","o1658","o1659","10.1107/S160053680700997X","","","0.7107","MoKα","","0.0594","0.0554","","","0.133","0.1358","","","","","","1.091","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212947","10.1185","0.0004","11.1077","0.0004","16.4915","0.0007","90","","105.502","0.002","90","","1786.1","0.12","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Benzyl N-benzyl-N-(2-formylphenyl)carbamate‒benzyl N-benzyl-N-(2-carboxyphenyl)carbamate [0.332(4)/0.668(4)]","","- C22 H19 N O3.67 -","- C22 H19 N O3.668 -","- C88 H76 N4 O14.672 -","4","1","LH2316","Walji, Dhiran V. B.; Storey, John M. D.; Harrison, William T. A.","Benzyl <i>N</i>-benzyl-<i>N</i>-(2-formylphenyl)carbamate‒benzyl <i>N</i>-benzyl-<i>N</i>-(2-carboxyphenyl)carbamate [0.332(4)/0.668(4)]","Acta Crystallographica Section E","2007","63","4","o1575","o1576","10.1107/S1600536807009063","","","0.71073","MoKα","","0.0583","0.0414","","","0.0955","0.1039","","","","","","1.033","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2212948","18.789","0.001","5.908","0.001","9.624","0.001","90","","91.04","0.01","90","","1068.1","0.2","109","2","109","2","","","","","","","","5","C 1 2 1","C 2y","5","L-3-iodotyrosine hemihydrate","(S)-2-Ammonio-3-(3-iodo-4-hydroxyphenyl)propanoate hemihydrate","","- C9 H11 I N O3.5 -","- C9 H11 I N O3.5 -","- C36 H44 I4 N4 O14 -","4","1","LH2317","Marcin Cymborowski; Maksymilian Chruszcz; Zbigniew Dauter; Wladek Minor","3-Iodo-<small>L</small>-tyrosine hemihydrate","Acta Crystallographica Section E","2007","63","4","o1557","o1559","10.1107/S1600536807009129","","","0.71074","MoKα","","0.0221","0.0211","","","0.0544","0.0547","","","","","","1.076","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2212949","13.077","0.009","13.077","0.009","20.44","0.02","90","","90","","90","","3495","5","290","2","290","2","","","","","","","","6","I -4","I -4","82","","Bis[N,N-diisobutyl-N'-(2-thienylcarbonyl)thioureato]copper(II)","","- C28 H42 N4 Ni O2 S4 -","- C28 H42 N4 Ni O2 S4 -","- C112 H168 N16 Ni4 O8 S16 -","4","0.5","LH2318","Ligia R. Gomes.; Luis M. N. B. F. Santos; Schröder, B.; Wagner, Ch.; Low, John N.","Bis[<i>N</i>,<i>N</i>-diisobutyl-<i>N</i>'-(2-thienylcarbonyl)thioureato]nickel(II)","Acta Crystallographica Section E","2007","63","4","m953","m955","10.1107/S1600536807009403","","","0.71073","MoKα","","0.0429","0.0382","","","0.0945","0.0992","","","","","","1.075","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2212950","13.1693","0.0006","13.1693","0.0006","20.2499","0.0016","90","","90","","90","","3511.9","0.4","290","2","290","2","","","","","","","","6","I -4","I -4","82","","Bis[N,N-diisobutyl-N'-(2-thienylcarbonyl)thioureato]copper(II)","","- C28 H42 Cu N4 O2 S4 -","- C28 H42 Cu N4 O2 S4 -","- C112 H168 Cu4 N16 O8 S16 -","4","0.5","LH2319","Ligia R. Gomes.; Luis M. N. B. F. Santos; Schröder, B.; Wagner, Ch.; Low, John N.","Bis[<i>N</i>,<i>N</i>-diisobutyl-<i>N</i>'-(2-thienylcarbonyl)thioureato]copper(II)","Acta Crystallographica Section E","2007","63","4","m956","m958","10.1107/S1600536807009397","","","0.71073","MoKα","","0.0321","0.0287","","","0.0699","0.0725","","","","","","1.139","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2212951","11.4382","0.0008","6.7983","0.0005","16.7218","0.0012","90","","98.163","0.002","90","","1287.12","0.16","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Quinal barbitone","5-(1-Methylbutyl)-5-propenylbarbituric acid (quinal barbitone)","","- C12 H18 N2 O3 -","- C12 H18 N2 O3 -","- C48 H72 N8 O12 -","4","1","LH2321","Nichol, Gary S.; Clegg, William","5-(1-Methylbutyl)-5-propenylbarbituric acid (quinal barbitone)","Acta Crystallographica Section E","2007","63","4","o1632","o1634","10.1107/S1600536807009610","","","0.71073","MoKα","","0.0573","0.0447","","","0.1072","0.1184","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212952","7.034","0.001","12.419","0.001","21.788","0.002","90","","92.142","0.002","90","","1902","0.4","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-Bis(2-hydroxy-3-methoxybenzylideneamino)pyridine","","- C21 H19 N3 O4 -","- C21 H19 N3 O4 -","- C84 H76 N12 O16 -","4","1","LH2322","Bi, Wei-Yu; Lü, Xing-Qiang; Cai, Wen-Li; Song, Ji-Rong; Ng, Seik Weng","3,4-Bis(2-hydroxy-3-methoxybenzylideneamino)pyridine","Acta Crystallographica Section E","2007","63","4","o1615","o1616","10.1107/S1600536807009634","","","0.71073","MoKα","","0.1","0.048","","","0.122","0.147","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212953","49.2086","0.0006","5.0292","0.0001","9.8401","0.0001","90","","98.186","0.001","90","","2410.41","0.06","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","1-(2,4-Dihydroxyphenyl)ethanone [(1<i>H</i>-indol-3-yl)acetyl]hydrazone‒ 2-(1<i>H</i>-indol-3-yl)acetohydrazide (1/1)","","- C28 H28 N6 O4 -","- C28 H28 N6 O4 -","- C112 H112 N24 O16 -","4","1","LH2323","Ali, Hapipah M.; Zuraini, Kadir; Wan Jefrey, Basirun; Ng, Seik Weng","1-(2,4-Dihydroxyphenyl)ethanone [(1<i>H</i>-indol-3-yl)acetyl]hydrazone‒2-(1<i>H</i>-indol-3-yl)acetohydrazide (1/1)","Acta Crystallographica Section E","2007","63","4","o1729","o1730","10.1107/S1600536807010860","","","0.71073","MoKα","","0.049","0.047","","","0.138","0.147","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212954","8.9003","0.0002","10.3287","0.0002","11.2288","0.0003","90.151","0.001","108.486","0.001","110.76","0.001","907.69","0.04","100","0.1","297","2","","","","","","","","5","P -1","-P 1","2","","2-[(E)-2-(4-Methoxyphenyl)ethenyl]-1-methylquinolinium iodide hemiiodine","","- C38 H36 I4 N2 O2 -","- C38 H36 I4 N2 O2 -","- C38 H36 I4 N2 O2 -","1","0.5","LH2324","Suchada Chantrapromma; Patcharanan Choto; Pumsak Ruanwas; Mohd Mustaqim Rosli; Hoong-Kun Fun","2-[(<i>E</i>)-2-(4-Methoxyphenyl)ethenyl]-1-methylquinolinium iodide hemiiodine","Acta Crystallographica Section E","2007","63","4","o1733","o1735","10.1107/S1600536807010859","","","0.71073","MoKα","","0.0261","0.0217","","","0.0518","0.0548","","","","","","1.056","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2212955","8.1505","0.0003","9.3471","0.0004","29.5889","0.0013","90","","90","","90","","2254.19","0.16","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-(2-Bromophenyl)pyridine-3-carboxamide","","- C12 H9 Br N2 O -","- C12 H9 Br N2 O -","- C96 H72 Br8 N16 O8 -","8","1","LH2326","Percival, Darryl; Storey, John M. D.; Harrison, William T. A.","<i>N</i>-(2-Bromophenyl)pyridine-3-carboxamide","Acta Crystallographica Section E","2007","63","4","o1851","o1852","10.1107/S1600536807010513","","","0.71073","MoKα","","0.0706","0.0367","","","0.0894","0.0983","","","","","","0.941","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212956","8.31","0.0001","16.1722","0.0002","18.694","0.0003","94.596","0.001","99.104","0.001","97.331","0.001","2447.44","0.06","100","0.1","297","2","","","","","","","","4","P -1","-P 1","2","Artocapin dichoromethane hemisolvate","2-(2,4-dihydroxyphenyl)-5-Hydroxy-7-methoxy-6-(3-methyl-1-butenyl)- 3-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one dichoromethane hemisolvate","","- C26.5 H29 Cl O6 -","- C26.5 H29 Cl O6 -","- C106 H116 Cl4 O24 -","4","2","LH2327","Suchada Chantrapromma; Nawong Boonnak; Hoong-Kun Fun; Chatchanok Karalai","Artocarpin dichloromethane hemisolvate","Acta Crystallographica Section E","2007","63","4","o1864","o1866","10.1107/S1600536807011646","","","0.71073","MoKα","","0.0817","0.0531","","","0.1445","0.1701","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212957","10.7802","0.0002","10.3307","0.0002","13.776","0.0003","90","","111.223","0.001","90","","1430.14","0.05","100","0.1","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(4-Chlorophenyl)-1-(3,4-dimethoxyphenyl) prop-2-en-1-one","","- C17 H15 Cl O3 -","- C17 H15 Cl O3 -","- C68 H60 Cl4 O12 -","4","1","LH2328","Jeannie Bee-Jan Teh; P. S. Patil; Hoong-Kun Fun; Ibrahim Abdul Razak; S. M. Dharmaprakash","3-(4-Chlorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","4","o1783","o1784","10.1107/S1600536807011233","","","0.71073","MoKα","","0.0591","0.045","","","0.1079","0.1156","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212958","31.393","0.018","25.527","0.017","7.8","0.005","90","","90","","90","","6251","7","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1-Methyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridinium perchlorate","","- C14 H12 Cl N3 O6 -","- C14 H12 Cl N3 O6 -","- C224 H192 Cl16 N48 O96 -","16","2","LH2329","Rybakov, Victor B.; Babaev, Eugene V.; Sonneveld, Eduard J.; Zhukov, Sergei G.; Chernyshev, Vladimir V.","1-Methyl-2-(4-nitrophenyl)imidazo[1,2-<i>a</i>]pyridinium perchlorate: a powder study","Acta Crystallographica Section E","2007","63","4","o1861","o1863","10.1107/S1600536807012354","","","1.54059","CuKα~1~","","","","","","","","","","2.105","","","","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212959","13.9829","0.0007","12.0458","0.0007","16.4807","0.0009","90","","125.831","0.003","90","","2250.6","0.2","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[(4-Methylbenzylidene)amino]-5-(4-methylbenzoyl)-4-(p-tolyl)pyrimidin- 2(1H)-one","","- C27 H23 N3 O2 -","- C27 H23 N3 O2 -","- C108 H92 N12 O8 -","4","1","LH2332","Mehmet Akkurt; Sema Öztürk Yıldırım; Zülbiye Önal; Orhan Büyükgüngör","1-[(4-Methylbenzylidene)amino]-5-(4-methylbenzoyl)-4-(<i>p</i>-tolyl)pyrimidin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","4","o1857","o1858","10.1107/S1600536807012342","","","0.71073","MoKα","","0.0793","0.0498","","","0.1292","0.144","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212960","6.8929","0.0016","17.747","0.003","11.848","0.003","90","","101.19","0.02","90","","1421.8","0.6","149","2","149","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tricarbonyl[η^6^-1-methyl-4-(trimethylsilyl)benzene]chromium(0)","","- C13 H16 Cr O3 Si -","- C13 H16 Cr O3 Si -","- C52 H64 Cr4 O12 Si4 -","4","1","LH2336","Haghiri, Alireza; Lerner, Hans-Wolfram; Bats, Jan W.","Tricarbonyl[η^6^-1-methyl-4-(trimethylsilyl)benzene]chromium(0)","Acta Crystallographica Section E","2007","63","4","m1133","m1134","10.1107/S1600536807012159","","","0.71073","MoKα","","0.1142","0.0503","","","0.0843","0.0996","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212961","6.7824","0.0002","9.6297","0.0003","12.0727","0.0005","90","","90","","90","","788.5","0.05","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-Deoxy-β-L-fructopyranose monohydrate","","- C6 H14 O6 -","- C6 H14 O6 -","- C24 H56 O24 -","4","1","LH2338","Izumori, Ken; Jenkinson, Sarah F.; Watkin, David J.; Fleet, George W. J.","1-Deoxy-β-<small>L</small>-fructopyranose monohydrate","Acta Crystallographica Section E","2007","63","4","o1882","o1884","10.1107/S1600536807012512","","","0.71073","MoKα","","0.0458","0.0373","","0.0914","0.0888","0.0914","","","","","","0.9221","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212962","4.3743","0.0007","39.127","0.006","11.897","0.002","90","","98.609","0.003","90","","2013.3","0.6","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-[3-(4-Pyridyl)propyl]pyridinium trihydrogen pyromellitate","","- C23 H20 N2 O8 -","- C23 H20 N2 O8 -","- C92 H80 N8 O32 -","4","1","LH2340","Knapp, Warren R.; LaDuca, Robert L.","4-[3-(4-Pyridyl)propyl]pyridinium trihydrogen pyromellitate","Acta Crystallographica Section E","2007","63","4","o1987","o1989","10.1107/S1600536807013086","","","0.71073","MoKα","","0.0971","0.0492","","","0.1167","0.1411","","","","","","1.092","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212963","7.608","0.0009","30.353","0.003","7.828","0.001","90","","90","","90","","1807.7","0.4","120","2","150","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","catena-poly[[tri-μ-aqua-triaquabarium(II)] bis(6-methylpyridin-2-olate)]","","- C12 H24 Ba N2 O8 -","- C12 H24 Ba N2 O8 -","- C48 H96 Ba4 N8 O32 -","4","0.5","LH2341","Nichol, Gary S.; Clegg, William","A synchrotron study of <i>catena</i>-poly[[tri-μ-aqua-triaquabarium(II)] bis(6-methylpyridin-2-olate)]","Acta Crystallographica Section E","2007","63","4","m1135","m1137","10.1107/S1600536807013037","","","0.6751","synchrotron","","0.0498","0.0439","","","0.1029","0.1048","","","","","","1.215","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212964","13.426","0.002","11.001","0.002","13.933","0.004","90","","97.85","0.01","90","","2038.6","0.8","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 1-tert-butyl-4-(hydroxydiphenylmethyl)-2-oxopyrrolidine-3-carboxylate","","- C23 H27 N O4 -","- C23 H27 N O4 -","- C92 H108 N4 O16 -","4","1","LW2003","Jin-Di Yu; Gao-Yan Lian; Dan-Wei Zhang; Jing-Mei Wang; Min-Qin Chen","Methyl 1-<i>tert</i>-butyl-4-(hydroxydiphenylmethyl)-2-oxopyrrolidine-3-carboxylate","Acta Crystallographica Section E","2007","63","4","o1766","o1768","10.1107/S160053680701063X","","","0.71073","MoKα","","0.1272","0.0428","","","0.0963","0.1233","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212965","13.1585","0.0005","13.1585","0.0005","15.847","0.0013","90","","90","","90","","2743.8","0.3","100","2","100","2","","","","","","","","4","P 43","P 4cw","78","","N-{(Aminocarbonyl)[(S)-4-nitrobenzyl]methyl}-N-{[(R)- cyclohexyl](cyclohexylaminocarbonyl)methyl}propanamide methanol solvate","","- C27 H42 N4 O6 -","- C27 H42 N4 O6 -","- C108 H168 N16 O24 -","4","1","NC2029","Guzei, Ilia A.; Spencer, Lara C.; Lin, Qi; Blackwell, Helen E.","<i>N</i>-{(Aminocarbonyl)[(<i>S</i>)-4-nitrobenzyl]methyl}-<i>N</i>-{[(<i>R</i>)-cyclohexyl](cyclohexylaminocarbonyl)methyl}propanamide methanol solvate","Acta Crystallographica Section E","2007","63","4","o1892","o1894","10.1107/S1600536807012299","","","0.71073","Mo-Kα","","0.0389","0.0355","","","0.0914","0.0958","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212966","8.1957","0.0001","15.8652","0.0003","17.1653","0.0003","90","","90","","90","","2231.94","0.06","294","2","294","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1-Methyl-2-phenyl-1H-indole","","- C15 H13 N -","- C15 H13 N -","- C120 H104 N8 -","8","1","NC2030","Hökelek, Tuncer; Seferoğlu, Zeynel; Şahin, Ertan; Ertan, Nermin","1-Methyl-2-phenyl-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","4","o1963","o1964","10.1107/S1600536807012962","","","0.71073","MoKα","","0.0968","0.0605","","","0.1391","0.1574","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212967","16.4953","0.0019","10.6869","0.001","11.4661","0.001","90","","109.12","0.03","90","","1909.8","0.5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2,9-Dimethyl-4,7-diphenyl-1,10-phenanthroline","","- C26 H20 N2 -","- C26 H20 N2 -","- C104 H80 N8 -","4","0.5","NC2031","Wang, Jia; Ye, Jun-Wei; Wang, Yue","2,9-Dimethyl-4,7-diphenyl-1,10-phenanthroline","Acta Crystallographica Section E","2007","63","4","o2007","o2008","10.1107/S1600536807012974","","","0.71073","MoKα","","0.0828","0.0398","","","0.0863","0.0907","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212968","9.5922","0.0007","15.334","0.0011","15.7451","0.0012","100.539","0.007","94.205","0.007","96.145","0.007","2253.5","0.3","299","2","299","2","","","","","","","","7","P -1","-P 1","2","","μ-trans-1,2-Di-4-pyridylethene-κ^2^N:N'-bis[(dimethylformamide- κO)bis(tri-tert-butoxysilanethiolato-κS)cadmium(II)]","","- C66 H132 Cd2 N4 O14 S4 Si4 -","- C66 H132 Cd2 N4 O14 S4 Si4 -","- C66 H132 Cd2 N4 O14 S4 Si4 -","1","0.5","NG2221","Ba̧kowicz, Julia; Kropidłowska, Anna; Turowska-Tyrk, Ilona; Becker, Barbara","μ-<i>trans</i>-1,2-Di-4-pyridylethene-κ^2^<i>N</i>:<i>N</i>'-bis[(dimethylformamide-κ<i>O</i>)bis(tri-<i>tert</i>-butoxysilanethiolato-κ<i>S</i>)cadmium(II)]","Acta Crystallographica Section E","2007","63","4","m973","m975","10.1107/S1600536807009452","","","0.71073","MoKα","","0.0673","0.0558","","","0.1607","0.174","","","","","","1.069","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212969","6.9515","0.0003","9.0103","0.0004","9.2845","0.0004","91.71","0.003","103.604","0.003","111.72","0.003","520.67","0.04","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","4-Aza-1-azoniabicyclo[2.2.2]octane dihydrogenarsenate monohydrate","","- C6 H17 As N2 O5 -","- C6 H17 As N2 O5 -","- C12 H34 As2 N4 O10 -","2","1","NG2222","Todd, Malcolm J.; Harrison, William T. A.","4-Aza-1-azoniabicyclo[2.2.2]octane dihydrogenarsenate monohydrate","Acta Crystallographica Section E","2007","63","4","m945","m947","10.1107/S1600536807009178","","","0.71073","MoKα","","0.0298","0.0265","","","0.0637","0.0652","","","","","","1.108","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212970","10.8719","0.0007","8.956","0.0006","9.262","0.0006","90","","92.1","0.001","90","","901.22","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[(propane-1,2-diamine-κ^2^N,N')cobalt(II)]-μ-oxalato- κ^2^O^1^,O^2^:κ^2^O^1'^,O^2'^] monohydrate]","","- C5 H12 Co N2 O5 -","- C5 H12 Co N2 O5 -","- C20 H48 Co4 N8 O20 -","4","1","NG2226","Lee, Clare; Harrison, William T. A.","<i>catena</i>-Poly[[[(propane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-μ-oxalato-κ^2^<i>O</i>^1^,<i>O</i>^2^:κ^2^<i>O</i>^1'^,<i>O</i>^2'^] monohydrate]","Acta Crystallographica Section E","2007","63","4","m985","m987","10.1107/S1600536807009816","","","0.71073","MoKα","","0.052","0.0299","","","0.0671","0.073","","","","","","0.969","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212971","13.367","0.004","13.37","0.004","17.083","0.005","72.831","0.005","88.917","0.005","65.473","0.005","2634.8","1.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Bis(tetraphenylarsonium) tricyanidonitrido(quinoline-2-carboxylato-κ^2^N,O)rhenate(V) dihydrate","","- C61 H50 As2 N5 O4 Re -","- C61 H50 As2 N5 O4 Re -","- C122 H100 As4 N10 O8 Re2 -","2","1","NG2227","Mtshali, Thato N.; Purcell, Walter; Visser, Hendrik G.; Basson, Stephen S.","Bis(tetraphenylarsonium) tricyanidonitrido(quinoline-2-carboxylato-κ^2^<i>N</i>,<i>O</i>)rhenate(V) dihydrate","Acta Crystallographica Section E","2007","63","4","m1037","m1038","10.1107/S1600536807011026","","","0.71073","MoKα","","","0.0361","","","","0.0894","","","","","","1.006","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212972","16.173","0.003","9.987","0.002","12.728","0.003","90","","106","0.03","90","","1976.2","0.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[trimethyltin(IV)]-μ-4-[1-(2- hydroxyphenyl)ethylideneaminomethyl]cyclohexanecarboxylato-κ^2^O:O']","","- C19 H29 N O3 Sn -","- C19 H29 N O3 Sn -","- C76 H116 N4 O12 Sn4 -","4","1","NG2228","Shaukat Shuja; Saqib Ali; Nasir Khalid; Broker, Grant A.; Tiekink, Edward R. T.","<i>catena</i>-Poly[[trimethyltin(IV)]-μ-4-[1-(2-hydroxyphenyl)ethylideneaminomethyl]cyclohexanecarboxylato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","4","m1025","m1026","10.1107/S1600536807010902","","","0.7107","MoKα","","0.046","0.042","","","0.091","0.093","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212973","13.862","0.003","16.583","0.003","13.959","0.003","90","","118.27","0.03","90","","2826.1","1.3","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Bis(tetrahydrofuran-κ<i>O</i>)tris(tri-tert-butoxysiloxy)chromium(III)","","- C44 H97 Cr O14 Si3 -","- C44 H97 Cr O14 Si3 -","- C88 H194 Cr2 O28 Si6 -","2","1","NG2229","Ciborska, Anna; Chojnacki, Jaroslaw; Wojnowski, Wieslaw","Bis(tetrahydrofuran-κ<i>O</i>)tris(tri-<i>tert</i>-butoxysiloxy)chromium(III)","Acta Crystallographica Section E","2007","63","4","m1103","m1104","10.1107/S1600536807011038","","","0.71073","MoKα","","0.0481","0.0465","","","0.1185","0.12","","","","","","1.041","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2212974","18.621","0.007","22.772","0.009","14.35","0.006","90","","129.04","0.04","90","","4726","4","293","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(acetamide-κ<i>O</i>)diiodidozinc(II)","","- C4 H10 I2 N2 O2 Zn -","- C4 H10 I2 N2 O2 Zn -","- C64 H160 I32 N32 O32 Zn16 -","16","2","NG2233","Elena V. Savinkina; Eugeny A. Buravlev; Ilia A. Zamilatskov; Dmitry V. Albov","Bis(acetamide-κ<i>O</i>)diiodidozinc(II)","Acta Crystallographica Section E","2007","63","4","m1094","m1095","10.1107/S1600536807011944","","","0.71073","MoKα","","","0.0637","","","","0.1758","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212975","5.6179","0.0011","8.0819","0.0016","12.871","0.003","74.56","0.03","86.29","0.03","86.83","0.03","561.7","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(4-formylbenzoato-κ<i>O</i>)bis(1<i>H</i>-imidazole- κ<i>N</i>^3^)cobalt(II)","","- C22 H22 Co N4 O8 -","- C22 H22 Co N4 O8 -","- C22 H22 Co N4 O8 -","1","0.5","NG2234","Deng, Zhao-Peng; Gao, Shan; Huo, Li-Hua; Zhao, Hui","Diaquabis(4-formylbenzoato-κ<i>O</i>)bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)cobalt(II)","Acta Crystallographica Section E","2007","63","4","m1116","m1117","10.1107/S1600536807012007","","","0.71073","MoKα","","0.0419","0.0404","","","0.1185","0.12","","","","","","1.073","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212976","11.672","0.005","14.273","0.005","14.575","0.005","85.63","0.03","71.9","0.03","74.9","0.03","2228.2","1.5","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","[2,5-Dimethyl-N-(2-pyridylmethyl)aniline-κ^2^N,N']bis(triphenylphosphine- κP)copper(I) perchlorate","","- C50 H44 Cl Cu N2 O4 P2 -","- C50 H44 Cl Cu N2 O4 P2 -","- C100 H88 Cl2 Cu2 N4 O8 P4 -","2","1","NG2237","Dehghanpour, Saeed; Mahmoudi, Ali","[2,5-Dimethyl-<i>N</i>-(2-pyridylmethyl)aniline-κ^2^<i>N</i>,<i>N</i>']bis(triphenylphosphine-κ<i>P</i>)copper(I) perchlorate","Acta Crystallographica Section E","2007","63","4","m1173","m1174","10.1107/S1600536807013190","","","0.71073","MoKα","","0.0318","0.0273","","","0.0707","0.0735","","","","","","1.006","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212977","4.7831","0.0011","20.382","0.003","18.71","0.002","90","","96.795","0.002","90","","1811.2","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(3,5-Dibromo-2-oxidobenzoato-κ^2^O,O')(1,10-phenanthroline- κ^2^N,N')copper(II) monohydrate","","- C19 H12 Br2 Cu N2 O4 -","- C19 H12 Br2 Cu N2 O4 -","- C76 H48 Br8 Cu4 N8 O16 -","4","1","NG2238","Zhang, Shu-Hua; Feng, Xiao-Zhen; Li, Guang-Zhao; Jing, Li-Xia; Liu, Zheng","(3,5-Dibromo-2-oxidobenzoato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) monohydrate","Acta Crystallographica Section E","2007","63","4","m1156","m1157","10.1107/S1600536807012846","","","0.71073","MoKα","","0.1108","0.0502","","","0.0847","0.0947","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212978","12.973","0.003","7.7999","0.0014","13.569","0.002","90","","96.3","0.004","90","","1364.7","0.4","291","2","291","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","1-(Benzimidazol-2-ylmethyl)-1H-benzotriazole hemihydrate","","- C14 H12 N5 O0.5 -","- C14 H12 N5 O0.5 -","- C56 H48 N20 O2 -","4","1","PK2003","Liu, Sheng-Gui; Ni, Chun-Lin; Li, Yi-Zhi","1-(Benzimidazol-2-ylmethyl)-1<i>H</i>-benzotriazole hemihydrate","Acta Crystallographica Section E","2007","63","4","o1827","o1828","10.1107/S1600536807011853","","","0.71073","MoKα","","0.0975","0.0609","","","0.131","0.1401","","","","","","1.006","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212979","11.3901","0.0003","10.0587","0.0003","13.2143","0.0004","90","","108.408","0.002","90","","1436.49","0.07","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","ZnCl2(1-EtIm)2","Dichloridobis(1-ethylimidazole-κN^3^)zinc(II)","","- C10 H16 Cl2 N4 Zn -","- C10 H16 Cl2 N4 Zn -","- C40 H64 Cl8 N16 Zn4 -","4","1","PK2006","Li, Jianfeng; Noll, Bruce C.; Scheidt, W. Robert","Dichloridobis(1-ethylimidazole-κ<i>N</i>^3^)zinc(II)","Acta Crystallographica Section E","2007","63","4","m1048","m1049","10.1107/S1600536807010689","","","0.71073","MoKα","","0.021","0.018","","","0.05","0.051","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212980","17.4348","0.0005","8.7877","0.0004","8.6574","0.001","90","","92.308","0.003","90","","1325.34","0.17","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-Methoxybenzyl)-N'-(5-nitro-1,3-thiazol-2-yl)urea","","- C12 H12 N4 O4 S -","- C12 H12 N4 O4 S -","- C48 H48 N16 O16 S4 -","4","1","PV2005","Vasdev, Neil; Wilson, Alan A.; Houle, Sylvain; Lough, Alan J.","<i>N</i>-(4-Methoxybenzyl)-<i>N</i>'-(5-nitro-1,3-thiazol-2-yl)urea (AR-A014418)","Acta Crystallographica Section E","2007","63","4","o1653","o1655","10.1107/S1600536807010215","","","0.71073","MoKα","","0.082","0.0473","","","0.1106","0.1311","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212981","23.935","0.004","9.992","0.002","9.026","0.003","90","","98.25","0.02","90","","2136.3","0.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","DL-Methioninium dihydrogenphosphate","DL-Methioninium dihydrogenphosphate","","- C5 H14 N O6 P S -","- C5 H14 N O6 P S -","- C40 H112 N8 O48 P8 S8 -","8","2","RK2003","S. Asath Bahadur; S. Athimoolam","<small>DL</small>-Methioninium dihydrogenphosphate","Acta Crystallographica Section E","2007","63","4","o1952","o1954","10.1107/S1600536807012524","","","0.71073","MoKα","","0.0579","0.0442","","","0.1132","0.12","","","","","","1.201","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212982","7.052","0.0016","14.662","0.003","12.121","0.003","90","","90","","90","","1253.3","0.5","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","1,4-Dimethoxyanthracene-9,10-dione","","- C16 H12 O4 -","- C16 H12 O4 -","- C64 H48 O16 -","4","0.5","RK2008","Li-Ping Cao; Yu-Zhou Wang; Meng Gao; Bao-Han Zhou","1,4-Dimethoxyanthracene-9,10-dione","Acta Crystallographica Section E","2007","63","4","o1876","o1877","10.1107/S1600536807012123","","","0.71073","MoKα","","0.0502","0.0458","","","0.1184","0.1219","","","","","","1.071","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212983","9.776","0.002","11.571","0.002","11.956","0.002","65.78","0.03","68.06","0.03","71","0.03","1120.1","0.5","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Chloridobis(1,10-phenanthroline-κ^2^N,N')copper(II) iodide monohydrate","","- C24 H18 Cl Cu I N4 O -","- C24 H18 Cl Cu I N4 O -","- C48 H36 Cl2 Cu2 I2 N8 O2 -","2","1","RZ2119","Shi, Ta-Qing; Liu, Dong-Sheng; Zhou, Guang-Pei","Chloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) iodide monohydrate","Acta Crystallographica Section E","2007","63","4","m950","m952","10.1107/S160053680700949X","","","0.71073","MoKα","","0.0554","0.0392","","","0.1194","0.1323","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212984","9.8735","0.0008","10.587","0.0002","11.538","0.0002","68.421","0.004","85.758","0.004","65.125","0.003","1012.83","0.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Ethyl trans-3-(2-chloro-6,7-dimethylquinolin-3-yl)-1- cyclohexylaziridine-2-carboxylate","","- C22 H27 Cl N2 O2 -","- C22 H27 Cl N2 O2 -","- C44 H54 Cl2 N4 O4 -","2","1","RZ2120","Abdelmalek Bouraiou; Ali Belfaitah; Sofiane Bouacida; Patricia Benard-Rocherulle; Bertrand Carboni","Ethyl <i>trans</i>-3-(2-chloro-6,7-dimethylquinolin-3-yl)-1-cyclohexylaziridine-2-carboxylate","Acta Crystallographica Section E","2007","63","4","o1626","o1628","10.1107/S1600536807009920","","","0.71073","MoKα","","0.0942","0.0489","","","0.1224","0.1677","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212985","8.7211","0.0006","11.4222","0.0008","10.5027","0.0009","90","","94.605","0.014","90","","1042.84","0.14","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H5 N3 O -","- C4 H5 N3 O -","- C32 H40 N24 O8 -","8","2","RZ2123","Gustavo Portalone; Marcello Colapietro","Redetermination of isocytosine","Acta Crystallographica Section E","2007","63","4","o1869","o1871","10.1107/S1600536807012494","","","0.71069","MoKα","","0.0795","0.0536","","","0.1397","0.1872","","","","","","1.164","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212986","13.03","0.004","14.458","0.004","13.484","0.004","90","","100.776","0.004","90","","2495.4","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aqua(6-methoxy-2-{[3-(3-methoxy-2- oxidobenzylamino)propylamino]methyl}phenolato)ethanolnickel(II) nitrate","","- C21 H33 N3 Ni O9 -","- C21 H33 N3 Ni O9 -","- C84 H132 N12 Ni4 O36 -","4","1","SA2030","Xia, H.-T.; Liu, Y.-F.; Wang, D.-Q.; Yang, S.-P.","Aqua(6-methoxy-2-{[3-(3-methoxy-2-oxidobenzylamino)propylamino]methyl}phenolato)ethanolnickel(II) nitrate","Acta Crystallographica Section E","2007","63","4","m1162","m1164","10.1107/S1600536807012627","","","0.71073","MoKα","","0.0867","0.0457","","","0.1086","0.1397","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2212987","11.3533","0.0004","13.5581","0.0005","15.0519","0.0005","90","","93.414","0.001","90","","2312.81","0.14","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,6-Bis(3,4,5-trimethoxybenzylidene)cyclohexanone","","- C26 H30 O7 -","- C26 H30 O7 -","- C104 H120 O28 -","4","1","SA2044","Yi-Feng Sun; Yi-Ping Cui","2,6-Bis(3,4,5-trimethoxybenzylidene)cyclohexanone","Acta Crystallographica Section E","2007","63","4","o1932","o1933","10.1107/S1600536807012640","","","0.71073","MoKα","","0.0445","0.0354","","","0.1079","0.1128","","","","","","1.728","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212988","7.6931","0.0015","9.7197","0.0019","10.492","0.002","113.559","0.003","91.246","0.003","109.417","0.003","667.3","0.2","293","2","","","","","","","","","","5","P -1","-P 1","2","","2-Ethyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazole-5-carbaldehyde","","- C14 H13 N3 O2 S -","- C14 H13 N3 O2 S -","- C28 H26 N6 O4 S2 -","2","1","SA2045","Noor Shahina Begum; D. E. Vasundhara; G. D. Kolavi; I. M. Khazi","2-Ethyl-6-(4-methoxyphenyl)imidazo[2,1-<i>b</i>][1,3,4]thiadiazole-5-carbaldehyde","Acta Crystallographica Section E","2007","63","4","o1955","o1957","10.1107/S1600536807012639","","","0.71073","MoKα","","","0.036","","","","0.0999","","","","","","1.009","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2212989","17.8019","0.0013","9.4929","0.0006","10.3623","0.0007","90","","94.13","0.005","90","","1746.6","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Ethyl 1-(2-bromoethyl)-3-ferrocenyl-1H-pyrazole-5-carboxylate","","- C18 H19 Br Fe N2 O2 -","- C18 H19 Br Fe N2 O2 -","- C72 H76 Br4 Fe4 N8 O8 -","4","1","SG2128","Xie, Yong-Sheng; Dong, Wen-Liang; Zheng, Liang-Wen; Zhang, Jin-Hua; Zhao, Bao-Xiang","Ethyl 1-(2-bromoethyl)-3-ferrocenyl-1<i>H</i>-pyrazole-5-carboxylate","Acta Crystallographica Section E","2007","63","4","m978","m979","10.1107/S1600536807007301","","","0.71073","MoKα","","0.0425","0.0292","","","0.0707","0.0765","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212990","36.876","0.003","8.4622","0.0004","16.5727","0.0011","90","","104.163","0.006","90","","5014.3","0.6","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Ethopropazinium picrate","10-[2-(diethylamino)propyl]phenothiazinium 2,4,6-trinitrophenolate","","- C25 H27 N5 O7 S -","- C25 H27 N5 O7 S -","- C200 H216 N40 O56 S8 -","8","1","SG2139","Yathirajan, H. S.; Ashok, M. A.; Narayana Achar, B.; Bolte, Michael","Ethopropazinium picrate","Acta Crystallographica Section E","2007","63","4","o1792","o1794","10.1107/S1600536807011543","","","0.71073","MoKα","","0.0879","0.0766","","","0.202","0.2116","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212991","8.8859","0.001","9.4092","0.001","10.029","0.0011","88.671","0.001","69.279","0.001","77.182","0.001","763.33","0.14","313","2","293","2","","","","","","","","7","P -1","-P 1","2","","poly[aqua(μ-5'-carboxy-2,2'-bipyridine-5- carboxylato)dichlororubidium(I)platinum(II)]","","- C12 H9 Cl2 N2 O5 Pt Rb -","- C12 H7 Cl2 N2 O5 Pt Rb -","- C24 H14 Cl4 N4 O10 Pt2 Rb2 -","2","1","SG2140","Hafizovic, Jasmina; Olsbye, Unni; Lillerud, Karl Petter","Poly[aqua(μ-5'-carboxy-2,2'-bipyridine-5-carboxylato)dichloridorubidium(I)platinum(II)]","Acta Crystallographica Section E","2007","63","4","m962","m964","10.1107/S1600536807008902","","","0.71073","MoKα","","0.034","0.0318","","","0.0881","0.0895","","","","","","1.087","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212992","8.3584","0.0009","10.7782","0.0009","14.5062","0.0013","93.524","0.007","99.629","0.008","102.419","0.007","1251.8","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Mepazinium picrate","1-methyl-3-(10H-phenothiazin-10-ylmethyl)piperidinium 2,4,6-trinitrophenolate","","- C25 H25 N5 O7 S -","- C25 H25 N5 O7 S -","- C50 H50 N10 O14 S2 -","2","1","SG2141","Yathirajan, H. S.; Ashok, M. A.; Narayana Achar, B.; Bolte, Michael","Mepazinium picrate","Acta Crystallographica Section E","2007","63","4","o1691","o1692","10.1107/S1600536807009877","","","0.71073","MoKα","","0.0471","0.0365","","","0.0929","0.0975","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212993","8.1472","0.0007","12.5927","0.0012","19.6752","0.0018","73.782","0.007","78.833","0.007","73.959","0.007","1847.9","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Trifluoperazinium dipicrate","1-methyl-4-{3-[2-(trifluoromethyl)-10H-phenothiazin-10-yl]propyl}piperazine- 1,4-diium bis(2,4,6-trinitrophenolate)","","- C33 H30 F3 N9 O14 S -","- C33 H30 F3 N9 O14 S -","- C66 H60 F6 N18 O28 S2 -","2","1","SG2142","Yathirajan, H. S.; Ashok, M. A.; Narayana Achar, B.; Bolte, Michael","Trifluoperazinium dipicrate","Acta Crystallographica Section E","2007","63","4","o1693","o1695","10.1107/S1600536807009889","","","0.71073","MoKα","","0.0756","0.0548","","","0.1375","0.1494","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212994","7.0616","0.0008","7.2258","0.0008","13.0949","0.0014","96.211","0.008","104.611","0.009","109.701","0.009","594.87","0.13","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","3-(4-Chlorophenyl)isocoumarin","","- C15 H9 Cl O2 -","- C15 H9 Cl O2 -","- C30 H18 Cl2 O4 -","2","1","SG2143","Saeed, Aamer; Bolte, Michael","3-(4-Chlorophenyl)isocoumarin","Acta Crystallographica Section E","2007","63","4","o1667","o1668","10.1107/S1600536807009890","","","0.71073","MoKα","","0.0415","0.0337","","","0.0862","0.0908","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212995","12.3355","0.0014","14.6631","0.0019","15.534","0.0019","108.758","0.01","104.675","0.01","100.922","0.009","2458.5","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Chlorpromazinium picrate","N-(2-chloro-10H-phenothiazin-10-yl)-N,N-dimethylpropanaminium 2,4,6-trinitrophenolate","","- C23 H22 Cl N5 O7 S -","- C23 H22 Cl N5 O7 S -","- C92 H88 Cl4 N20 O28 S4 -","4","2","SG2144","Yathirajan, H. S.; Ashok, M. A.; Narayana Achar, B.; Bolte, Michael","Chlorpromazinium picrate","Acta Crystallographica Section E","2007","63","4","o1795","o1797","10.1107/S1600536807011555","","","0.71073","MoKα","","0.1773","0.0949","","","0.2352","0.2831","","","","","","0.978","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212996","9.817","0.0012","11.2404","0.0014","11.5762","0.0014","109.371","0.002","95.624","0.002","93.782","0.002","1192.7","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","5,7-diacetyl-13-benzyl-7,8-dihydro-5H,8aH,13H-diindolo[2,3-c;2,3-d]pyrimidin- 8-yl acetate","","- C29 H26 N4 O4 -","- C29 H26 N4 O4 -","- C58 H52 N8 O8 -","2","1","SG2145","Madeleine Helliwell; Steven Corden; John A. Joule","5,7-Diacetyl-13-benzyl-7,8-dihydro-5<i>H</i>,8a<i>H</i>,13<i>H</i>-diindolo[2,3-<i>c</i>;2,3-<i>d</i>]pyrimidin-8-yl acetate, the result of an intramolecular cycloaddition between an <i>N</i>-benzylindole and a 1,2,4,5-tetrazine","Acta Crystallographica Section E","2007","63","4","o1993","o1995","10.1107/S1600536807011166","","","0.71073","MoKα","","0.0604","0.0452","","","0.1065","0.1154","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212997","10.406","0.002","15.8954","0.0017","13.0056","0.0018","90","","97.326","0.013","90","","2133.7","0.6","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,4-Bis(4-methoxyphenyl)-3-phenyl-1,3,2,4-thiazadiphosphetidine 2,4-disulfide","","- C20 H19 N O2 P2 S3 -","- C20 H19 N O2 P2 S3 -","- C80 H76 N4 O8 P8 S12 -","4","1","SG2146","Rothenberger, Alexander; Shi, Weifeng","2,4-Bis(4-methoxyphenyl)-3-phenyl-1,3,2,4-thiazadiphosphetidine 2,4-disulfide","Acta Crystallographica Section E","2007","63","4","o1798","o1799","10.1107/S1600536807011191","","","0.71073","MoKα","","0.1172","0.0547","","","0.1341","0.1728","","","","","","0.902","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2212998","13.9586","0.0005","6.0703","0.0002","33.3498","0.0012","90","","90","","90","","2825.82","0.17","100","0.1","297","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1-(3-Bromophenyl)-3-(4-dimethylamino)prop-2-en-1-one","1-(3-Bromophenyl)-3-(4-dimethylamino)prop-2-en-1-one","","- C17 H16 Br N O -","- C17 H16 Br N O -","- C136 H128 Br8 N8 O8 -","8","1","SG2150","P. S. Patil; Suchada Chantrapromma; Hoong-Kun Fun; S. M. Dharmaprakash","1-(3-Bromophenyl)-3-[4-(dimethylamino)phenyl]prop-2-en-1-one","Acta Crystallographica Section E","2007","63","4","o1738","o1740","10.1107/S160053680701118X","","","0.71073","MoKα","","0.074","0.0456","","","0.1132","0.1341","","","","","","1.15","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2212999","6.978","0.0014","9.584","0.0019","24.478","0.005","90","","90","","90","","1637","0.6","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-(2-Aminophenyl)-1-[(1S,2R)-2-hydroxy-7,7-dimethylbicyclo[2.2.1]hept- 1-yl]methanesulfonamide","","- C16 H24 N2 O3 S -","- C16 H24 N2 O3 S -","- C64 H96 N8 O12 S4 -","4","1","SI2003","Maurin, Jan K.; Krukowski, Andrzej; Czarnocki, Zbigniew","<i>N</i>-(2-Aminophenyl)-1-[(1<i>S</i>,2<i>R</i>)-2-hydroxy-7,7-dimethylbicyclo[2.2.1]hept-1-yl]methanesulfonamide, a new ligand for asymmetric transfer hydrogenation","Acta Crystallographica Section E","2007","63","4","o1593","o1595","10.1107/S1600536807009701","","","0.71073","MoKα","","0.1024","0.0601","","","0.1554","0.1826","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213000","12.4524","0.0004","15.3347","0.0005","8.8832","0.0002","90","","96.991","0.002","90","","1683.67","0.09","293","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-[1,1'-(Propane-1,3-diyl)bis(nitriloethylidyne)diphenol","","- C19 H22 N2 O2 -","- C19 H22 N2 O2 -","- C76 H88 N8 O8 -","4","1","SI2004","Selvakumar, J.; Babu Varghese; Raghunathan, V. S.; Nagaraja, K. S.","2,2'-[1,1'-(Propane-1,3-diyl)bis(nitriloethylidyne)]diphenol","Acta Crystallographica Section E","2007","63","4","o1924","o1925","10.1107/S1600536807012275","","","0.71073","MoKα","","0.082","0.0523","","","0.1565","0.1932","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213001","22.7413","0.001","21.5244","0.0007","28.4239","0.0011","90","","99.411","0.003","90","","13726","0.9","291","2","291","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","cis-Bis(μ-5-phenyl-3-p-tolylpyrazolato-κ^2^N:N')bis[(4,4'-dimethyl-2,2'- bipyridine-κ^2^N,N')palladium(II)] trans-bis(μ-5-phenyl-3-p-tolylpyrazolato-κ^2^N:N')-bis[(4,4'-dimethyl-2,2'- bipyridine-κ^2^N,N')palladium(II)] tetrakis(tetrafluoridoborate) acetonitrile octasolvate monohydrate","","- C128 H126 B4 F16 N24 O Pd4 -","- C128 H126 B4 F16 N24 O Pd4 -","- C512 H504 B16 F64 N96 O4 Pd16 -","4","1","SI2007","Hai-Ping Huang; Hong-Wei Ma; Yi-Zhi Li","<i>cis</i>-Bis(μ-5-phenyl-3-<i>p</i>-tolylpyrazolato-κ^2^<i>N</i>:<i>N</i>')bis[(4,4'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')palladium(II)] <i>trans</i>-bis(μ-5-phenyl-3-<i>p</i>-tolylpyrazolato-κ^2^<i>N</i>:<i>N</i>')bis[(4,4'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')palladium(II)] tetrakis(tetrafluoridoborate) acetonitrile octasolvate monohydrate","Acta Crystallographica Section E","2007","63","4","m1089","m1091","10.1107/S1600536807011841","","","0.71073","MoKα","","0.0812","0.0588","","","0.1512","0.1578","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213002","5.624","0.0006","10.6353","0.0012","17.975","0.002","90","","94.285","0.002","90","","1072.1","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-p-Tolylimidazo[1,2-b]pyridazine","","- C13 H11 N3 -","- C13 H11 N3 -","- C52 H44 N12 -","4","1","SJ2222","Wang, Ling-Ling","3-<i>p</i>-Tolylimidazo[1,2-<i>b</i>]pyridazine","Acta Crystallographica Section E","2007","63","4","o1749","o1750","10.1107/S1600536807009944","","","0.71073","MoKα","","0.059","0.0456","","","0.1215","0.1285","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213003","8.5557","0.0003","25.013","0.0008","12.2675","0.0004","90","","104.415","0.003","90","","2542.64","0.15","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","irbesartan chloride 1.69-hydrate","2-Butyl-4-oxo-3-{[2'-(1H-tetrazol-5-yl)biphenyl-4-yl]methyl}-3-aza-1- azoniaspiro[4.4]non-1-ene chloride 1.69-hydrate","","- C25 H32.38 Cl N6 O2.69 -","- C25 H32.372 Cl N6 O2.686 -","- C100 H129.488 Cl4 N24 O10.744 -","4","1","SJ2227","Bartolucci, Gianluca; Bruni, Bruno; Di Vaira, Massimo; Giannellini, Valerio","2-Butyl-4-oxo-3-{[2'-(1<i>H</i>-tetrazol-5-yl)biphenyl-4-yl]methyl}-3-aza-1-azoniaspiro[4.4]non-1-ene chloride 1.69-hydrate (irbesartan hydrochloride 1.69-hydrate)","Acta Crystallographica Section E","2007","63","4","o1529","o1531","10.1107/S1600536807008951","","","1.5418","CuKα","","0.0605","0.0499","","","0.1338","0.1393","","","","","","1.015","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2213004","8.1452","0.0015","5.3296","0.0009","27.203","0.004","90","","96.268","0.01","90","","1173.8","0.3","173","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N,N',N'-Tetramethylethane-1,2-diamine‒N-hydroxybenzensulfonamide (1/2)","","- C18 H30 N4 O6 S2 -","- C18 H30 N4 O6 S2 -","- C36 H60 N8 O12 S4 -","2","0.5","SJ2229","Arulsamy, Navamoney; Bohle, D. Scott; Hoen, Eric","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylethane-1,2-diamine‒<i>N</i>-hydroxybenzensulfonamide (1/2): an adduct of Piloty's acid","Acta Crystallographica Section E","2007","63","4","o1609","o1610","10.1107/S1600536807009658","","","0.71073","MoKα","","0.0681","0.0412","","","0.0836","0.0935","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213005","7.577","0.001","12.788","0.002","23.542","0.003","90","","99.26","0.01","90","","2251.4","0.5","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-amino-1-(4-fluorobenzyl)pyridinium bis(1,2-dicyanoethane-1,2-dithiolato-κ^2^S,S')nickelate(III)","","- C20 H12 F N6 Ni S4 -","- C20 H12 F N6 Ni S4 -","- C80 H48 F4 N24 Ni4 S16 -","4","1","SJ2230","Chun-Lin Ni; Jia-Rong Zhou","2-Amino-1-(4-fluorobenzyl)pyridinium bis(1,2-dicyanoethane-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(III)","Acta Crystallographica Section E","2007","63","4","m959","m961","10.1107/S1600536807009221","","","0.71073","MoKα","","0.048","0.0377","","","0.0951","0.099","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213006","14.2337","0.0004","10.5627","0.0003","23.4193","0.0006","90","","121.106","0.001","90","","3014.73","0.15","100","0.1","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[4-(4-hydroxystyryl)-1-methylpyridinium] triiodide iodide","","- C28 H28 I4 N2 O2 -","- C28 H28 I4 N2 O2 -","- C112 H112 I16 N8 O8 -","4","1","SJ2231","Suchada Chantrapromma; Kullapa Chanawanno; Hoong-Kun Fun","Bis[4-(4-hydroxystyryl)-1-methylpyridinium] triiodide iodide","Acta Crystallographica Section E","2007","63","4","o1554","o1556","10.1107/S1600536807009154","","","0.71073","MoKα","","0.0435","0.0366","","","0.0756","0.079","","","","","","1.096","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213007","10.668","0.0002","11.0804","0.0003","11.0992","0.0003","79.924","0.001","65.001","0.001","82.157","0.002","1167.86","0.05","150","2","150","2","","","","","","","","3","P -1","-P 1","2","cyclotricatechylene.(acetone)~2~","2,3,7,8,12,13-Hexahydroxy-10,15-dihydro-5H-tribenzo[a,d,g]cyclononene acetone disolvate","","- C27 H30 O8 -","- C27 H30 O8 -","- C54 H60 O16 -","2","1","SJ2233","Christopher J. Sumby; Michaele J. Hardie","2,3,7,8,12,13-Hexahydroxy-10,15-dihydro-5<i>H</i>-tribenzo[<i>a</i>,<i>d</i>,<i>g</i>]cyclononene acetone disolvate","Acta Crystallographica Section E","2007","63","4","o1537","o1539","10.1107/S1600536807008987","","","0.71073","MoKα","","0.1312","0.0541","","","0.1235","0.1539","","","","","","0.964","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213008","7.9522","0.0009","5.898","0.0005","10.5538","0.0012","90","","110.003","0.009","90","","465.13","0.09","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","3-(dimethylamino)isobenzofuran-1(3H)-one","","- C10 H11 N O2 -","- C10 H11 N O2 -","- C20 H22 N2 O4 -","2","1","SJ2234","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","3-(Dimethylamino)isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","4","o1560","o1561","10.1107/S1600536807009415","","","0.71073","MoKα","","0.0306","0.029","","","0.0742","0.0751","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213009","7.8823","0.0006","24.8672","0.0014","7.1265","0.0005","90","","104.261","0.006","90","","1353.82","0.16","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-(4-ethylamino)phthalide","3-(4-ethylanilino)isobenzofuran-1(3H)-one","","- C16 H15 N O2 -","- C16 H15 N O2 -","- C64 H60 N4 O8 -","4","1","SJ2235","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","3-(4-Ethylanilino)isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","4","o1562","o1564","10.1107/S1600536807009440","","","0.71073","MoKα","","0.0605","0.0391","","","0.1051","0.1148","","","","","","1.016","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213010","6.731","0.002","18.652","0.003","15.045","0.003","90","","101.98","0.03","90","","1847.7","0.8","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","3-(3-Chloro-4-fluorophenyl)-2-(2-chlorophenoxy)-3,4-dihydro-2H-1,3,2- benzoxazaphosphorine 2-oxide","","- C19 H13 Cl2 F N O3 P -","- C19 H13 Cl2 F N O3 P -","- C76 H52 Cl8 F4 N4 O12 P4 -","4","1","SJ2237","Krishnaiah, M.; Radha Krishna, J.; Kiran, Y. B.; Devendranath Reddy, C.; Thetmar, Win; Pho Kaung","3-(3-Chloro-4-fluorophenyl)-2-(2-chlorophenoxy)-3,4-dihydro-2<i>H</i>-1,3,2-benzoxazaphosphorine 2-oxide","Acta Crystallographica Section E","2007","63","4","o1756","o1758","10.1107/S1600536807010719","","","0.71073","MoKα","","0.0668","0.0598","","","0.1642","0.1699","","","","","","1.089","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213011","6.8062","0.0002","10.2999","0.0005","10.5095","0.0006","83.965","0.005","73.407","0.004","88.769","0.004","702.13","0.06","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Hexaaquamanganese(II) dichloride 4,4'-bipyridine N,N'-dioxide disolvate dihydrate","","- C20 H32 Cl2 Mn N4 O12 -","- C20 H32 Cl2 Mn N4 O12 -","- C20 H32 Cl2 Mn N4 O12 -","1","0.5","SJ2238","Song, Hui-Hua; Ma, Bao-Qing","Hexaaquamanganese(II) dichloride 4,4'-bipyridine <i>N</i>,<i>N</i>'-dioxide disolvate dihydrate","Acta Crystallographica Section E","2007","63","4","m1010","m1012","10.1107/S160053680701001X","","","0.71073","MoKα","","0.049","0.0406","","","0.1153","0.1197","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213012","16.422","0.007","18.079","0.009","9.631","0.003","90","","96.71","0.02","90","","2840","2","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[[tetraaquabis(μ~4~-fumarato-κ^4^O:O':O'':O''')(μ~2~-fumarato- κ^4^O,O':O'',O'''')diterbium(III)] N,N-dimethylformamide solvate]","","- C15 H21 N O17 Tb2 -","- C15 H21 N O17 Tb2 -","- C60 H84 N4 O68 Tb8 -","4","0.5","SJ2239","Yang, Jin; Ng, Seik Weng","Poly[[tetraaquabis(μ~4~-fumarato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>''')(μ~2~-fumarato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''')diterbium(III)] <i>N</i>,<i>N</i>-dimethylformamide solvate]","Acta Crystallographica Section E","2007","63","4","m1168","m1170","10.1107/S1600536807011282","","","0.71073","MoKα","","0.027","0.024","","","0.075","0.076","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213013","12.418","0.002","10.482","0.001","13.754","0.002","90","","99.5","0.001","90","","1765.7","0.4","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","{2-Bromo-4-chloro-6-[2- (isopropylammonio)ethyliminomethyl]phenolato}dichloridozinc(II)","","- C12 H16 Br Cl3 N2 O Zn -","- C12 H16 Br Cl3 N2 O Zn -","- C48 H64 Br4 Cl12 N8 O4 Zn4 -","4","1","SJ2240","Feng-Wu Wang; Yi-Jun Wei; Qi-Yong Zhu","{2-Bromo-4-chloro-6-[2-(isopropylammonio)ethyliminomethyl]phenolato}dichloridozinc(II)","Acta Crystallographica Section E","2007","63","4","m1084","m1085","10.1107/S1600536807011300","","","0.71073","MoKα","","0.0582","0.0375","","","0.0852","0.0938","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213014","7.654","0.003","15.473","0.009","10.514","0.006","90","","102.489","0.015","90","","1215.7","1.1","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","nicotinamidium tartarate hydrate","Bis(nicotinamidium) bis(tartrate) 1.25-hydrate","","- C20 H26.5 N4 O15.25 -","- C20 H26.5 N4 O15.25 -","- C40 H53 N8 O30.5 -","2","1","SJ2241","S. Athimoolam; S. Natarajan","Bis(nicotinamidium) bis[(2<i>R</i>,3<i>R</i>)-tartrate] 1.25-hydrate: cations incorporated into hydrogen-bonded arrays of anions and water molecules","Acta Crystallographica Section E","2007","63","4","o1811","o1813","10.1107/S1600536807011294","","","0.71069","MoKα","","0.0978","0.0488","","","0.1086","0.1295","","","","","","1.036","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213015","12.2442","0.0007","11.0188","0.0005","20.0428","0.0011","90","","100.963","0.004","90","","2654.8","0.2","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-(4-Methoxyphenyl)-3,3,6,6-tetramethyl-10-p-tolyl-1,2,3,4,5,6,7,8,9,10- decahydroacridine-1,8-dione","","- C31 H35 N O3 -","- C31 H35 N O3 -","- C124 H140 N4 O12 -","4","1","SJ2242","Odabaşoğlu, Mustafa; Kaya, Muharrem; Büyükgüngör, Orhan; Yıldırır, Yılmaz; Türker, Lemi","9-(4-Methoxyphenyl)-3,3,6,6-tetramethyl-10-<i>p</i>-tolyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione","Acta Crystallographica Section E","2007","63","4","o1763","o1765","10.1107/S1600536807010926","","","0.71073","MoKα","","0.0586","0.0396","","","0.1082","0.1159","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213016","15.4932","0.0012","19.406","0.002","27.424","0.002","90","","90","","90","","8245.3","1.2","292","2","292","2","","","","","","","","4","I b c a","-I 2b 2c","73","","Ethyl 6-methyl-2-(3-nitrophenoxy)-4-oxo-3-phenyl-3,4-dihydrofuro[2,3-d]pyrimidine- 5-carboxylate","","- C22 H17 N3 O7 -","- C22 H17 N3 O7 -","- C352 H272 N48 O112 -","16","1","SJ2243","Yang-Gen Hu; Gui-Hua Li; Ming-Hua Zhou","Ethyl 6-methyl-2-(3-nitrophenoxy)-4-oxo-3-phenyl-3,4-dihydrofuro[2,3-<i>d</i>]pyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","4","o1836","o1838","10.1107/S1600536807011658","","","0.71073","MoKα","","0.0936","0.0677","","","0.1629","0.1784","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213017","5.9155","0.0002","7.2642","0.0002","14.6629","0.0005","86.452","0.002","83.241","0.002","87.863","0.002","624.22","0.03","100","0.1","297","2","","","","","","","","5","P -1","-P 1","2","","(2E)-1-(3-bromophenyl)-3-(4-chlorophenyl)prop-2-en-1-one","","- C15 H10 Br Cl O -","- C15 H10 Br Cl O -","- C30 H20 Br2 Cl2 O2 -","2","1","SJ2245","Jeannie Bee-Jan Teh; P. S. Patil; Hoong-Kun Fun; Y. E. Satheesh; Ibrahim Abdul Razak; S. M. Dharmaprakash","(2<i>E</i>)-1-(3-Bromophenyl)-3-(4-chlorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","4","o1844","o1845","10.1107/S160053680701166X","","","0.71073","MoKα","","0.044","0.0321","","","0.0846","0.0963","","","","","","1.107","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213018","5.8468","0.0001","7.4089","0.0002","13.1979","0.0003","100.215","0.001","91.086","0.001","90.174","0.001","562.54","0.02","100","0.1","297","2","","","","","","","","5","P -1","-P 1","2","","(2E)-1-(3-bromophenyl)-3-(2-thienyl)prop-2-en-1-one","","- C13 H9 Br O S -","- C13 H9 Br O S -","- C26 H18 Br2 O2 S2 -","2","1","SJ2246","Shea-Lin Ng; P. S. Patil; Ibrahim Abdul Razak; Hoong-Kun Fun; H. B. Ramesh Babu; S. M. Dharmaprakash","(2<i>E</i>)-1-(3-Bromophenyl)-3-(2-thienyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","4","o1867","o1868","10.1107/S1600536807011683","","","0.71073","MoKα","","0.0287","0.0233","","","0.0652","0.0699","","","","","","1.125","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213019","11.298","0.002","16.34","0.003","12.481","0.003","90","","116.08","0.03","90","","2069.5","0.9","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Trichlorido(η^5^-1,2,4-triphenylcyclopentadienyl)titanium(IV)","","- C23 H15 Cl3 Ti -","- C23 H15 Cl3 Ti -","- C92 H60 Cl12 Ti4 -","4","1","SJ2249","Wu, Qiao-Lin; Su, Qing; Ye, Ling; Mu, Ying","Trichlorido(η^5^-1,2,4-triphenylcyclopentadienyl)titanium(IV)","Acta Crystallographica Section E","2007","63","4","m1160","m1161","10.1107/S160053680701269X","","","0.71073","MoKα","","0.0967","0.0544","","","0.1244","0.1425","","","","","","1.051","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213020","6.805","0.001","8.202","0.002","9.378","0.004","83.699","0.011","77.811","0.009","84.415","0.015","507.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","p-Carboxylphenylammonium trifluoroacetate","4-Carboxyphenylammonium trifluoroacetate","","- C9 H8 F3 N O4 -","- C9 H8 F3 N O4 -","- C18 H16 F6 N2 O8 -","2","1","SJ2250","S. Athimoolam; S. Natarajan","Chain and ring motifs in 4-carboxyphenylammonium trifluoroacetate","Acta Crystallographica Section E","2007","63","4","o1910","o1912","10.1107/S1600536807012688","","","0.71069","MoKα","","0.096","0.0418","","","0.0963","0.1161","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213021","13.194","0.001","13.275","0.001","17.951","0.002","90","","111.33","0.01","90","","2928.8","0.5","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis{2-bromo-4-chloro-6-[(2-pyridylmethylimino)methyl]phenolato}cadmium(II) methanol monohydrate","","- C27 H24 Br2 Cd Cl2 N4 O4 -","- C27 H24 Br2 Cd Cl2 N4 O4 -","- C108 H96 Br8 Cd4 Cl8 N16 O16 -","4","1","SJ2251","Guo-Biao Cao","Bis{2-bromo-4-chloro-6-[(2-pyridylmethylimino)methyl]phenolato}cadmium(II) methanol solvate monohydrate","Acta Crystallographica Section E","2007","63","4","m1149","m1150","10.1107/S1600536807012676","","","0.71073","MoKα","","0.0419","0.0318","","","0.0776","0.0822","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213022","10.8846","0.0003","10.3394","0.0003","15.2387","0.0005","90","","115.997","0.002","90","","1541.44","0.08","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(2,4-Dichlorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one","","- C17 H14 Cl2 O3 -","- C17 H14 Cl2 O3 -","- C68 H56 Cl8 O12 -","4","1","SJ2254","Shea-Lin Ng; P. S. Patil; Ibrahim Abdul Razak; Hoong-Kun Fun; S. M. Dharmaprakash","3-(2,4-Dichlorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","4","o1897","o1898","10.1107/S1600536807012792","","","0.71073","MoKα","","0.0747","0.043","","","0.1077","0.1237","","","","","","1.074","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213023","7.7629","0.0003","5.5537","0.0002","15.745","0.0006","90","","90.828","0.002","90","","678.74","0.04","100","0.1","297","2","","","","","","","","3","P 1 21 1","P 2yb","4","","3-(3-methoxyphenyl)-1-(4-methoxyphenyl)prop-2-en-1-one","","- C17 H16 O3 -","- C17 H16 O3 -","- C34 H32 O6 -","2","1","SJ2255","P. S. Patil; Jeannie Bee-Jan Teh; Hoong-Kun Fun; H. B. Ramesh Babu; Ibrahim Abdul Razak; S. M. Dharmaprakash","3-(3-Methoxyphenyl)-1-(4-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","4","o1895","o1896","10.1107/S160053680701255X","","","0.71073","MoKα","","0.0648","0.0509","","","0.124","0.1327","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213024","7.0913","0.0001","10.5435","0.0001","11.2808","0.0001","79.55","0.001","86.68","0.001","79.737","0.001","815.887","0.016","100","0.1","297","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 8,13-dioxo-8,13-dihydrobenz[5,6]indolo[2,1-a]isoquinoline-14-carboxylate","","- C23 H15 N O4 -","- C23 H15 N O4 -","- C46 H30 N2 O8 -","2","1","SJ2257","Yun Liu; Jian-Hua Xu; Mohd Mustaqim Rosli; Hoong-Kun Fun","Ethyl 8,13-dioxo-8,13-dihydrobenz[5,6]indolo[2,1-<i>a</i>]isoquinoline-14-carboxylate","Acta Crystallographica Section E","2007","63","4","o1902","o1903","10.1107/S1600536807013189","","","0.71073","MoKα","","0.0488","0.0439","","","0.1215","0.1271","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213025","8.1791","0.0001","17.9508","0.0002","10.3967","0.0001","90","","93.32","0.001","90","","1523.9","0.03","100","0.1","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-[(E)-2-(3-Hydroxy-4-methoxyphenyl)ethenyl]-1-methylpyridinium iodide monohydrate","","- C15 H18 I N O3 -","- C15 H18 I N O3 -","- C60 H72 I4 N4 O12 -","4","1","SJ2258","Suchada Chantrapromma; Boonwasana Jindawong; Hoong-Kun Fun","4-[(<i>E</i>)-2-(3-Hydroxy-4-methoxyphenyl)ethenyl]-1-methylpyridinium iodide monohydrate","Acta Crystallographica Section E","2007","63","4","o2020","o2022","10.1107/S1600536807013426","","","0.71073","MoKα","","0.0222","0.0196","","","0.0472","0.0484","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213026","7.4936","0.0007","4.5019","0.0003","20.677","0.002","90","","109.273","0.007","90","","658.45","0.1","296","","296","","","","","","","","","4","P 1 c 1","P -2yc","7","","(E)-2-Hydroxy-5-methyl-3-[(4-methyl-2-pyridyl)iminomethyl]benzaldehyde","","- C15 H14 N2 O2 -","- C15 H14 N2 O2 -","- C30 H28 N4 O4 -","2","1","SJ2259","Büyükgüngör, Orhan; Odabaşoğlu, Mustafa; Narayana, B.; Vijesh, A. M.; Yathirajan, H. S.","(<i>E</i>)-2-Hydroxy-5-methyl-3-[(4-methyl-2-pyridyl)iminomethyl]benzaldehyde","Acta Crystallographica Section E","2007","63","4","o1996","o1998","10.1107/S1600536807013177","","","0.71073","MoKα","","0.0424","0.0319","","","0.0766","0.0805","","","","","","0.947","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213027","8.0816","0.0002","8.6719","0.0002","15.8187","0.0004","90","","91.301","0.001","90","","1108.33","0.05","100","0.1","297","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","8-Methyleugenitin","5-Hydroxy-7-methoxy-2,6,8-trimethyl-4H-chromen-4-one","","- C13 H14 O4 -","- C13 H14 O4 -","- C52 H56 O16 -","4","1","SJ2263","Hoong-Kun Fun; Kan Chantrapromma; Yupparase Pullaput; Nawong Boonnak; Suchada Chantrapromma","5-Hydroxy-7-methoxy-2,6,8-trimethyl-4<i>H</i>-chromen-4-one","Acta Crystallographica Section E","2007","63","4","o2017","o2019","10.1107/S1600536807013402","","","0.71073","MoKα","","0.0421","0.0385","","","0.1072","0.1106","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213028","11.6531","0.0003","9.8856","0.0002","15.1278","0.0004","90","","111.716","0.001","90","","1619.01","0.07","100","0.1","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4,5,6,7-Tetrachloro-3-furan-3-yl-3-hydroxy-2-(3-hydroxypropyl)-2,3- dihydroisoindol-1-one","4,5,6,7-Tetrachloro-3-furan-3-yl-3-hydroxy-2-(3-hydroxypropyl)-2,3- dihydroisoindol-1-one","","- C15 H11 Cl4 N O4 -","- C15 H11 Cl4 N O4 -","- C60 H44 Cl16 N4 O16 -","4","1","SJ2264","Hoong-Kun Fun; Suchada Chantrapromma; Yong-Miao Shen; Jian-Hua Xu","4,5,6,7-Tetrachloro-3-(furan-3-yl)-3-hydroxy-2-(3-hydroxypropyl)-2,3-dihydro-1<i>H</i>-isoindol-1-one","Acta Crystallographica Section E","2007","63","4","o2023","o2025","10.1107/S1600536807013736","","","0.71073","MoKα","","0.0411","0.0331","","","0.0848","0.0892","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213029","9.6954","0.0006","11.0961","0.0006","12.081","0.0007","90","","105.671","0.001","90","","1251.38","0.13","293","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 6-chloro-5-[hydroxy(5-oxocyclopent-1-enyl)methyl]pyridine-2-carboxylate","","- C13 H12 Cl N O4 -","- C13 H12 Cl N O4 -","- C52 H48 Cl4 N4 O16 -","4","1","SK3105","G. Y. S. K. Swamy; K. Ravikumar; P. Narender; V. Jayathirtha Rao","Methyl 6-chloro-5-[hydroxy(5-oxocyclopent-1-enyl)methyl]pyridine-2-carboxylate","Acta Crystallographica Section E","2007","63","4","o1842","o1843","10.1107/S1600536807011919","","","0.71073","MoKα","","0.0405","0.0372","","","0.1014","0.1044","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213030","7.761","0.001","9.659","0.001","20.145","0.001","90","","90","","90","","1510.1","0.3","103","","103","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2-Amino-4-(4-chloro-3-methylphenyl)-5-propyl-1,3-thiazolium iodide","","- C13 H16 Cl I N2 S -","- C13 H16 Cl I N2 S -","- C52 H64 Cl4 I4 N8 S4 -","4","1","SQ3066","Maksymilian Chruszcz; Yali Kong; Zbigniew Dauter; Milton Brown; Wladek Minor","2-Amino-4-(4-chloro-3-methylphenyl)-5-propyl-1,3-thiazolium iodide","Acta Crystallographica Section E","2007","63","4","o1598","o1600","10.1107/S1600536807009427","","","0.71074","MoKα","","0.0323","0.0268","","","0.0699","0.0721","","","","","","1.01","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2213031","11.344","0.004","13.152","0.009","20.863","0.008","77.99","0.07","81.52","0.04","64.67","0.06","2746","3","293","2","293","2","","","","","","","","4","P 1","P 1","1","","Methyl 3,4,6-tri-O-acetyl-2-deoxy-2-azido-α-D-galactopyranosyl- (1\ρightarrow2)-[3,4,6-tri-O-acetyl-2-deoxy-2-phthalimido-β-D- glucopyranosyl-(1\ρightarrow3)]-4-O-benzoyl-α-L- rhamnopyranoside n-hexane 0.1-solvate","","- C51.6 H57.4 N4 O21 -","- C51.6 H57.4 N4 O21 -","- C103.2 H114.8 N8 O42 -","2","2","SU2003","Färnbäck, Magnus; Söderman, Peter; Eriksson, Lars; Widmalm, Göran","Methyl 3,4,6-tri-<i>O</i>-acetyl-2-deoxy-2-azido-α-<small>D</small>-galactopyranosyl-(1\ρightarrow 2)-[3,4,6-tri-<i>O</i>-acetyl-2-deoxy-2-phthalimido-β-<small>D</small>-glucopyranosyl-(1\ρightarrow 3)]-4-<i>O</i>-benzoyl-α-<small>L</small>-rhamnopyranoside <i>n</i>-hexane 0.1-solvate","Acta Crystallographica Section E","2007","63","4","o1581","o1583","10.1107/S1600536807009348","","","0.7107","MoKα","","0.113","0.067","","","0.1669","0.1867","","","","","","0.858","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213032","5.7283","0.0002","9.0412","0.0003","12.4994","0.0004","90","","97.251","0.001","90","","642.18","0.04","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","L-Lysine trichloroacetate","L-Lysinium trichloroacetate","","- C8 H15 Cl3 N2 O4 -","- C8 H15 Cl3 N2 O4 -","- C16 H30 Cl6 N4 O8 -","2","1","SU2004","Thenneti Raghavalu; Karunanithi Suriya Kumar; Gubendiran Ramesh Kumar; Srinivasan Gokul Raj; Rajagopal Mohan","<small>L</small>-Lysinium trichloroacetate","Acta Crystallographica Section E","2007","63","4","o1706","o1707","10.1107/S1600536807010021","","","0.71073","MoKα","","0.0453","0.0419","","","0.1174","0.1249","","","","","","1.018","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213033","6.869","0.002","7.417","0.003","9.879","0.005","72.37","0.04","71.82","0.03","64.29","0.03","422.5","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","3-Methylquinoxaline-2-carbonitrile","","- C10 H7 N3 -","- C10 H7 N3 -","- C20 H14 N6 -","2","1","SU2008","Shyamaprosad Goswami; Annada C. Maity; Santiago García-Granda; Laura Torre-Fernández","3-Methylquinoxaline-2-carbonitrile","Acta Crystallographica Section E","2007","63","4","o1741","o1742","10.1107/S1600536807010537","","","0.71073","MoKα","","0.1412","0.0479","","","0.1044","0.124","","","","","","0.823","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213034","13.623","0.0004","4.8894","0.0001","13.1277","0.0004","90","","94.058","0.002","90","","872.22","0.04","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(5-Bromopyrimidin-4-yl)cyclopropanecarboxamide","","- C8 H8 Br N3 O -","- C8 H8 Br N3 O -","- C32 H32 Br4 N12 O4 -","4","1","SU2009","Walji, Dhiran V. B.; Storey, John M. D.; Harrison, William T. A.","<i>N</i>-(5-Bromopyrimidin-4-yl)cyclopropanecarboxamide","Acta Crystallographica Section E","2007","63","4","o1761","o1762","10.1107/S1600536807010148","","","0.71073","MoKα","","0.0262","0.0224","","","0.0529","0.0549","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213035","10.629","0.001","11.365","0.002","11.44","0.006","94.05","0.03","95.12","0.03","94.61","0.01","1367.7","0.8","123","2","","","","","","","","","","5","P -1","-P 1","2","","Tris[1,2,3(η^5^)-methylcyclopentadienyl]-μ~3~-sulfido-tri-μ~2~-sulfido- tritungsten <i>p</i>-toluenesulfonate","","- C25 H28 O3 S5 W3 -","- C25 H28 O3 S5 W3 -","- C50 H56 O6 S10 W6 -","2","1","SU2012","Herbst, Konrad; Dahlenburg, Lutz","Tris[1,2,3(η^5^)-methylcyclopentadienyl]-μ~3~-sulfido-tri-μ~2~-sulfido-tritungsten <i>p</i>-toluenesulfonate","Acta Crystallographica Section E","2007","63","4","m1099","m1100","10.1107/S1600536807011762","","","0.71073","MoKα","","","0.0401","","","","0.1064","","","","","","1.167","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213036","7.4089","0.0001","11.3743","0.0002","12.9478","0.0002","112.674","0.0006","91.9072","0.0006","90.6949","0.0006","1005.87","0.03","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","(2S*,4aR*,8aS*)-6-Oxoperhydronaphthalene-2-carboxylic acid","","- C11 H16 O3 -","- C11 H16 O3 -","- C44 H64 O12 -","4","2","SU3004","Lalancette, Roger A.; Thompson, Hugh W.; Kikolski, Elizabeth M.; Davison, Mark","(2<i>S</i>*,4a<i>R</i>*,8a<i>S</i>*)-6-Oxoperhydronaphthalene-2-carboxylic acid: dual hydrogen-bonding modes in a bicyclic ζ-keto acid","Acta Crystallographica Section E","2007","63","4","o1949","o1951","10.1107/S1600536807011609","","","1.54178","CuKα","","0.045","0.041","","","0.103","0.106","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213037","13.0367","0.0006","18.1046","0.0008","19.9474","0.0009","90","","98.503","0.001","90","","4656.3","0.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","diphenylphosphinoferrocene","2,6-Bis({rac-1-[2-(diphenylphosphino)ferrocenyl]ethyl}aminocarbonyl)pyridine","","- C55 H49 Fe2 N3 O2 P2 -","- C55 H49 Fe2 N3 O2 P2 -","- C220 H196 Fe8 N12 O8 P8 -","4","1","TK2134","Reddy, Pattubala A. N.; Nasiruzzaman Sk. Md; Kim, Tae-Jeong","2,6-Bis({<i>rac</i>-1-[2-(diphenylphosphino)ferrocenyl]ethyl}aminocarbonyl)pyridine","Acta Crystallographica Section E","2007","63","4","m971","m972","10.1107/S1600536807009543","","","0.71073","MoKα","","0.11","0.055","","","0.116","0.137","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213038","7.7916","0.0016","11.334","0.002","13.023","0.003","72.87","0.03","74.86","0.03","88.98","0.03","1058.7","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Dichlorido[1-(3,5-dimethylbenzyl)-3-(2,4,6-trimethylbenzyl)imidazolidin-2-\ ylidene]ruthenium","","- C22 H28 Cl2 N2 Ru -","- C22 H28 Cl2 N2 Ru -","- C44 H56 Cl4 N4 Ru2 -","2","1","TK2135","Arslan, Hakan; VanDerveer, Don; Yaşar, Sedat; Özdemir, İsmail; Çetinkaya, Bekir","Dichlorido[1-(3,5-dimethylbenzyl)-3-(2,4,6-trimethylbenzyl)imidazolidin-2-ylidene]ruthenium(II)","Acta Crystallographica Section E","2007","63","4","m942","m944","10.1107/S1600536807009555","","","0.71073","MoKα","","0.036","0.03","","","0.065","0.067","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213039","5.9494","0.0009","15.586","0.002","20.255","0.003","90","","90","","90","","1878.2","0.5","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Supermesityltellurenyl bromide","2,4,6-Tri-tert-butylphenyltellurium bromide","","- C18 H29 Br Te -","- C18 H29 Br Te -","- C72 H116 Br4 Te4 -","4","1","TK2139","Beckmann, Jens; Hesse, Malte","Supermesityltellurenyl bromide","Acta Crystallographica Section E","2007","63","4","o1674","o1675","10.1107/S1600536807009749","","","0.71073","MoKα","","0.025","0.02","","","0.044","0.045","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213040","19.0095","0.0003","5.8831","0.0001","20.4443","0.0003","90","","102.313","0.001","90","","2233.79","0.06","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aquabis(1H-imidazole-κN^3^)bis(4-methylbenzoato-κ^2^O,O')cobalt(II)","","- C22 H24 Co N4 O5 -","- C22 H24 Co N4 O5 -","- C88 H96 Co4 N16 O20 -","4","1","TK2141","Song, Wen-Dong; Gu, Chang-Sheng; Hao, Xiao-Min; Liu, Ji-Wei","Aquabis(1<i>H</i>-imidazole-κ<i>N</i>^3^)bis(4-methylbenzoato-κ^2^<i>O</i>,<i>O</i>')cobalt(II)","Acta Crystallographica Section E","2007","63","4","m1023","m1024","10.1107/S160053680701046X","","","0.71073","MoKα","","0.045","0.033","","","0.075","0.081","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213041","14.8141","0.0002","4.8664","0.0001","18.9508","0.0002","90","","110.403","0.005","90","","1280.48","0.05","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Nitro-1-(phenylsulfonyl)-1H-indole","","- C14 H10 N2 O4 S -","- C14 H10 N2 O4 S -","- C56 H40 N8 O16 S4 -","4","1","TK2144","Roy, Sujata; Pelkey, Erin T.; Gribble, Gordon W.; Jasinski, Jerry P.","3-Nitro-1-(phenylsulfonyl)-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","4","o1829","o1831","10.1107/S1600536807011373","","","0.71073","MoKα","","0.042","0.032","","0.093","0.087","0.087","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213042","8.182","0.004","14.7272","0.0015","19.38","0.005","111.227","0.017","99.452","0.018","79.47","0.02","2127.9","1.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Pyrromethene 580","4,4-Difluoro-1,3,5,7,8-pentamethyl-2,6-dibutyl-3a,4a-diaza-4-bora-s-indacene","","- C22 H33 B F2 N2 -","- C22 H33 B F2 N2 -","- C88 H132 B4 F8 N8 -","4","2","TK2145","Jasinski, Jerry P.; Crosby, Daniel J.","4,4-Difluoro-1,3,5,7,8-pentamethyl-2,6-dibutyl-3a,4a-diaza-4-bora-<i>s</i>-indacene","Acta Crystallographica Section E","2007","63","4","o1832","o1833","10.1107/S1600536807011488","","","0.71069","MoKα","","0.261","0.067","","","0.208","0.322","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213043","16.268","0.008","13.459","0.005","15.019","0.007","90","","94.61","0.02","90","","3278","3","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","μ-Oxo-bis{dichlorido[η^5^-2,3,4,5-tetramethyl-1-(4- methylphenyl)cyclopentadienyl]titanium(IV)}","","- C32 H38 Cl4 O Ti2 -","- C32 H38 Cl4 O Ti2 -","- C128 H152 Cl16 O4 Ti8 -","4","0.5","TK2146","Wu, Qiao-Lin; Su, Qing; Ye, Ling; Li, Bao; Mu, Ying","μ-Oxo-bis{dichlorido[η^5^-2,3,4,5-tetramethyl-1-(4-methylphenyl)cyclopentadienyl]titanium(IV)}","Acta Crystallographica Section E","2007","63","4","m1158","m1159","10.1107/S1600536807012585","","","0.71073","MoKα","","0.048","0.036","","","0.092","0.097","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213044","8.106","0.002","20.401","0.006","14.195","0.004","90","","116.641","0.004","90","","2098.2","1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(tetra-n-propylammonium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato-κ^2^S^4^,S^5^)copper(II)","","- C30 H56 Cu N2 S10 -","- C30 H56 Cu N2 S10 -","- C60 H112 Cu2 N4 S20 -","2","0.5","WK2039","Liu, Hua-Shi; Ge, He-Yi","Bis(tetra-<i>n</i>-propylammonium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato-κ^2^<i>S</i>^4^,<i>S</i>^5^)copper(II)","Acta Crystallographica Section E","2007","63","4","m980","m981","10.1107/S1600536807006848","","","0.71069","MoKα","","0.1085","0.0795","","","0.2143","0.2345","","","","","","1.058","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213045","10.094","0.002","13.915","0.003","12.628","0.003","90","","96.96","0.03","90","","1760.6","0.7","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Phenyl 2,3-di-O-acetyl-4-O-(2-chloroacetyl)-6-O-(2,3,4-tri-O-acetyl- β-D-xylopyranosyl)-1-thio-β-D-glucopyranoside","","- C29 H35 Cl O15 S -","- C29 H35 Cl O15 S -","- C58 H70 Cl2 O30 S2 -","2","1","WK2040","Yuan-Long Ren","Phenyl 2,3-di-<i>O</i>-acetyl-4-<i>O</i>-(2-chloroacetyl)-6-<i>O</i>-(2,3,4-tri-<i>O</i>-acetyl-β-<small>D</small>-xylopyranosyl)-1-thio-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section E","2007","63","4","o1601","o1602","10.1107/S1600536807003133","","","0.71073","MoKα","","0.0741","0.0531","","","0.1432","0.1548","","","","","","1.056","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213046","6.0291","0.0006","8.242","0.0008","14.7222","0.0014","90","","91.921","0.002","90","","731.16","0.12","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-Hydroxy-2-methylisothiazolium chloride monohydrate","","- C4 H8 Cl N O2 S -","- C4 H8 Cl N O2 S -","- C16 H32 Cl4 N4 O8 S4 -","4","1","WK2042","Kato, Masaru; Fujihara, Takashi; Yano, Daisaku; Nagasawa, Akira","3-Hydroxy-2-methylisothiazolium chloride monohydrate: an intermolecular three-dimensional network <i>via</i> O—H···O and O—H···Cl hydrogen bonds","Acta Crystallographica Section E","2007","63","4","o1839","o1841","10.1107/S1600536807011129","","","0.71073","MoKα","","0.0485","0.0396","","","0.0933","0.098","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213047","13.478","0.002","19.1167","0.0014","25.2951","0.0017","90","","90","","90","","6517.4","1.2","295","2","","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","1,3-Bi-9-anthrylpropane","","- C31 H24 -","- C31 H24 -","- C372 H288 -","12","3","WK2044","Arslan, Mustafa; Asker, Erol; Masnovi, John; Baker, Ronald J.","1,3-Bi-9-anthrylpropane","Acta Crystallographica Section E","2007","63","4","o1800","o1801","10.1107/S1600536807010781","","","0.71073","MoKα","","","0.0436","","","","0.1033","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213048","13.509","0.002","13.509","0.002","8.379","0.002","90","","90","","120","","1324.2","0.4","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","Cadmium phosphite","Cadmium phosphate(III)","","- Cd H O3 P -","- Cd H O3 P -","- Cd18 H18 O54 P18 -","18","1","WM2081","Wang, Li; Song, Tian-You; Xu, Jia-Ning; Shi, Su-Hua","CdHPO~3~ with a channel structure","Acta Crystallographica Section E","2007","63","4","i105","i107","10.1107/S1600536807010483","","","0.71073","MoKα","","0.0277","0.0266","","","0.0664","0.0672","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213049","4.4001","0.0001","4.4001","0.0001","2.867","0.0001","90","","90","","90","","55.51","0.01","295","","300","","","","","","","","Synthetic","3","P 42/m n m","-P 4n 2n","136","","γ-vanadium germanium oxide","Argutite","- Ge0.74 O2 V0.21 -","- Ge0.74 O2 V0.21 -","- Ge1.48 O4 V0.42 -","2","0.125","WM2097","I. Rosales; E. A. Juarez-Arellano; C. R. Magaña; L. Bucio; E. Orozco","Incorporation of vanadium(V) into the rutile-type phase of GeO~2~: the solid solution Ge~0.74~V~0.21~□~0.05~O~2~","Acta Crystallographica, Section E","2007","63","4","i99","i101","10.1107/S1600536807010276","","","1.54175","CuKα","","","","","","","","","","2","","","","","","","has coordinates","282068","2023-03-26","10:12:40",""
"2213050","24.204","0.007","8.39","0.003","14.104","0.003","90","0.03","103.33","0.02","90","0.03","2787","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(4-Difluoromethoxyphenyl)-1,2,3,4,5,6,7,8-octahydroquinazoline-2,5-dione","","- C15 H14 F2 N2 O3 -","- C15 H14 F2 N2 O3 -","- C120 H112 F16 N16 O24 -","8","1","WN2107","Lin, Hai-Xia; Wang, Xiao-Hong; Xu, Bin; Yuan, Tian-Hai; Chen, Minqin","4-(4-Difluoromethoxyphenyl)-1,2,3,4,5,6,7,8-octahydroquinazoline-2,5-dione","Acta Crystallographica Section E","2007","63","4","o1565","o1567","10.1107/S160053680700935X","","","0.71073","MoKα","","0.1174","0.0533","","","0.148","0.1802","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213051","5.7874","0.0013","8.8352","0.0019","15.125","0.003","90","","96.972","0.003","90","","767.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1'-Dimethyl-4,4'-bipyridinium bis(perchlorate)","","- C12 H14 Cl2 N2 O8 -","- C12 H14 Cl2 N2 O8 -","- C24 H28 Cl4 N4 O16 -","2","0.5","WN2111","Dou, Yan-Li; Li, Zhi-Gang; Xu, Jing-Wei; Zhang, Wan-Xi","1,1'-Dimethyl-4,4'-bipyridinium bis(perchlorate)","Acta Crystallographica Section E","2007","63","4","o1874","o1875","10.1107/S160053680701207X","","","0.71073","MoKα","","0.1189","0.0683","","","0.134","0.1521","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213052","6.967","0.004","7.112","0.004","20.161","0.012","93.934","0.009","94.681","0.01","111.564","0.01","920.7","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(E)-1-(4-Hydroxybenzylidene)semicarbazide hemihydrate","","- C8 H10 N3 O2.5 -","- C8 H10 N3 O2.5 -","- C32 H40 N12 O10 -","4","2","WN2119","Tai, Xi-Shi; Hao, Ming-Yang; Yin, Jie; Liang, Zu-Pei","(<i>E</i>)-1-(4-Hydroxybenzylidene)semicarbazide hemihydrate","Acta Crystallographica Section E","2007","63","4","o1725","o1726","10.1107/S1600536807010458","","","0.71073","MoKα","","0.0968","0.0543","","","0.147","0.179","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213053","13.352","0.005","6.403","0.003","16.506","0.007","90","","111.127","0.007","90","","1316.3","1","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Hydroxy-N-(2-phenoxyethyl)benzamide","","- C15 H15 N O3 -","- C15 H15 N O3 -","- C60 H60 N4 O12 -","4","1","WN2120","Tai, Xi-Shi; Hao, Ming-Yang; Yin, Jie; Liang, Zu-Pei","2-Hydroxy-<i>N</i>-(2-phenoxyethyl)benzamide","Acta Crystallographica Section E","2007","63","4","o1727","o1728","10.1107/S1600536807010641","","","0.71073","MoKα","","0.0882","0.0433","","","0.1002","0.1229","","","","","","0.981","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213054","13.6433","0.0006","4.9505","0.0003","16.2899","0.0008","90","","104.246","0.002","90","","1066.4","0.1","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-(2,3-dioxoindolin-1-yl)acetate","","- C12 H11 N O4 -","- C12 H11 N O4 -","- C48 H44 N4 O16 -","4","1","WN2122","Robeyns, Koen; Rohand, Taoufik; Bouhfid, Rachid; Essassi, EL Mokhtar; Van Meervelt, Luc","Ethyl 2-(2,3-dioxoindolin-1-yl)acetate","Acta Crystallographica Section E","2007","63","4","o1747","o1748","10.1107/S1600536807010951","","","1.54178","CuKα","","0.0459","0.0397","","","0.0991","0.1035","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213055","12.0533","0.0005","13.0595","0.0006","26.0147","0.0011","90","","90","","90","","4095","0.3","160","2","160","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis(triethylammonium) tetrachloridomanganate(II)","","- C12 H32 Cl4 Mn N2 -","- C12 H32 Cl4 Mn N2 -","- C96 H256 Cl32 Mn8 N16 -","8","1","WN2128","Clegg, William; Martin, Nicola C.","Bis(triethylammonium) tetrachloridomanganate(II)","Acta Crystallographica Section E","2007","63","4","m1151","m1151","10.1107/S1600536807012317","","","0.71073","MoKα","","0.0417","0.0381","","","0.0872","0.0895","","","","","","1.097","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213056","17.6308","0.0005","11.2069","0.0003","24.0726","0.0007","90","","111.197","0.002","90","","4434.6","0.2","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetrakis(1,10-phenanthrolinium) hexachloridooeuropate(III) chloride","","- C48 H36 Cl7 Eu N8 -","- C48 H36 Cl7 Eu N8 -","- C192 H144 Cl28 Eu4 N32 -","4","1","WN2129","Clegg, William; Harrington, Ross W.","Tetrakis(1,10-phenanthrolinium) hexachloridoeuropate(III) chloride","Acta Crystallographica Section E","2007","63","4","m1152","m1152","10.1107/S1600536807012329","","","0.71073","MoKα","","0.0619","0.0527","","","0.0895","0.092","","","","","","1.303","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213057","10.8279","0.0004","10.8279","0.0004","44.2504","0.0008","90","","90","","120","","4493","0.2","294","2","294","2","","","","","","","","4","P 31 2 1","P 31 2""","152","Lappaconitine","(1S,4S,5S,7S,8S,9S,10S,11S,13R,14S,16S,17R)-20-ethyl-4,8,9-trihydroxy- 1,14,16-trimethoxyacontin-4-yl 2-(acetylamino)benzoate","","- C32 H44 N2 O8 -","- C32 H44 N2 O8 -","- C192 H264 N12 O48 -","6","1","WW2045","Wang, Yun-Pu; Sun, Wen-Xiu; Zhang, Ji; Liu, Han-Shi; Wen, Hui-Hui","Lappaconitine","Acta Crystallographica Section E","2007","63","4","o1645","o1647","10.1107/S1600536807007131","","","0.71073","MoKα","","0.0502","0.0409","","","0.0939","0.0994","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213058","17.272","0.003","16.718","0.002","17.789","0.004","90","","90","","90","","5136.6","1.6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis[μ~2~-bis(diphenylphosphino)methane]di-μ~3~-bromo-di-μ~2~-bromo- tetrasilver(I)","","- C50 H44 Ag4 Br4 P4 -","- C50 H44 Ag4 Br4 P4 -","- C200 H176 Ag16 Br16 P16 -","4","0.5","XU2135","Xue-Hui Liu; Xi Liu; Bing Liu; Fa-Kun Zheng; Guo-Cong Guo","A centrosymmetric polymorph of bis[μ~2~-bis(diphenylphosphino)methane]di-μ~3~-bromo-di-μ~2~-bromo-tetrasilver(I)","Acta Crystallographica Section E","2007","63","4","m1029","m1030","10.1107/S1600536807005909","","","0.71073","MoKα","","0.164","0.066","","","0.147","0.196","","","","","","1.002","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213059","8.3514","0.0017","9.0308","0.0018","13.794","0.003","85.72","0.03","86.43","0.03","68.46","0.03","964.3","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","μ-Oxalato-κ^2^O^1^,O^2^:κ^2^O^1'^,O^2'^-bis[(3,5-dicarboxybenzoato- κ^2^O^1^,O^1'^)(1,10-phenanthroline-κ^2^N,N')copper(II)]","","- C44 H26 Cu2 N4 O16 -","- C44 H26 Cu2 N4 O16 -","- C44 H26 Cu2 N4 O16 -","1","0.5","XU2200","Chao Qin","μ-Oxalato-κ^2^<i>O</i>^1^,<i>O</i>^2^:κ^2^<i>O</i>^1'^,<i>O</i>^2'^-bis[(3,5-dicarboxybenzoato-κ^2^<i>O</i>^1^,<i>O</i>^1'^)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)]","Acta Crystallographica Section E","2007","63","4","m1006","m1007","10.1107/S1600536807009828","","","0.71073","MoKα","","0.081","0.052","","","0.117","0.133","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213060","9.789","0.007","12.614","0.009","10.961","0.008","90","","97.657","0.011","90","","1341.4","1.7","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis(amantadinium) 5,5'-diazenediylditetrazolate dihydrate","","- C22 H40 N12 O2 -","- C22 H40 N12 O2 -","- C44 H80 N24 O4 -","2","0.5","XU2201","Wan-Long Pan; Xiang-Yu Chen; Chang-Wen Hu","Bis(amantadinium) 5,5'-diazenediylditetrazolate dihydrate","Acta Crystallographica Section E","2007","63","4","o1606","o1608","10.1107/S1600536807006034","","","0.71073","MoKα","","0.118","0.058","","","0.141","0.181","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213061","16.9526","0.0018","13.592","0.0014","12.3297","0.0018","90","","99.087","0.008","90","","2805.4","0.6","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2,2'-[3,3'-Dimethylbiphenyl-4,4'-diylbis(iminomethylene)]dipyridinium dichloride tetrahydrate","","- C26 H36 Cl2 N4 O4 -","- C26 H36 Cl2 N4 O4 -","- C104 H144 Cl8 N16 O16 -","4","0.5","XU2204","Ming-Qiang Wu; Yun-Qian Zhang; Xin Xiao; Sai-Feng Xue; Zhu Tao","2,2'-[3,3'-Dimethylbiphenyl-4,4'-diylbis(iminomethylene)]dipyridinium dichloride tetrahydrate","Acta Crystallographica Section E","2007","63","4","o1846","o1847","10.1107/S1600536807011774","","","0.71073","MoKα","","0.051","0.041","","","0.113","0.12","","","","","","1.077","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213062","7.3611","0.0002","7.8658","0.0002","28.1797","0.0009","90","","90","","90","","1631.63","0.08","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,2'-Bipyridinium 2-carboxy-4,6-dinitrophenolate","","- C17 H12 N4 O7 -","- C17 H12 N4 O7 -","- C68 H48 N16 O28 -","4","1","XU2209","Wen-Dong Song; Xian-Xia Guo; Li Yu","2,2'-Bipyridinium 2-carboxy-4,6-dinitrophenolate","Acta Crystallographica Section E","2007","63","4","o1890","o1891","10.1107/S1600536807011981","","","0.71073","MoKα","","0.096","0.051","","","0.102","0.121","","","","","","0.985","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213063","6.8336","0.0003","11.243","0.0006","13.2527","0.0009","114.235","0.001","92.859","0.002","96.397","0.002","917.54","0.09","153","2","153","2","","","","","","","","3","P -1","-P 1","2","","2-(Quinoxalin-2-yl)-1-[2-(quinoxalin-2-yl)methyl]-1H-benzimidazole","","- C24 H16 N6 -","- C24 H16 N6 -","- C48 H32 N12 -","2","1","XU2211","Ling Xie; Gang Liu; Yan Wang; Ji-De Wang","2-(Quinoxalin-2-yl)-1-[2-(quinoxalin-2-yl)methyl]-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","4","o1708","o1709","10.1107/S1600536807010240","","","0.71073","MoKα","","0.043","0.036","","","0.104","0.114","","","","","","1.005","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213064","10.1838","0.0001","17.8042","0.0002","10.3046","0.0001","90","","119.192","0.001","90","","1631.07","0.03","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-aminothiophene-3-carboxylate","","- C7 H9 N O2 S -","- C7 H9 N O2 S -","- C56 H72 N8 O16 S8 -","8","2","XU2214","Bourgeaux, Marie; Skene, W.G.","Ethyl 2-aminothiophene-3-carboxylate","Acta Crystallographica Section E","2007","63","4","o1603","o1605","10.1107/S1600536807009683","","","1.54178","CuKα","","0.048","0.041","","","0.11","0.115","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213065","9.175","0.002","18.638","0.005","14.482","0.004","90","","102.333","0.003","90","","2419.3","1.1","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","μ-Hydrogenarsenato-κ^2^O:O'-di-μ-oxo-κ^4^O:O-bis[oxo(1,10- phenanthroline-κ^2^N,N')vanadium(V)] monohydrate","","- C24 H19 As N4 O9 V2 -","- C24 H19 As N4 O9 V2 -","- C96 H76 As4 N16 O36 V8 -","4","1","XU2216","Ng, Seik Weng","μ-Hydrogenarsenato-κ^2^<i>O</i>:<i>O</i>'-di-μ-oxo-κ^4^<i>O</i>:<i>O</i>-bis[oxo(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')vanadium(V)] monohydrate","Acta Crystallographica Section E","2007","63","4","m997","m998","10.1107/S1600536807010082","","","0.71073","MoKα","","0.054","0.05","","","0.111","0.113","","","","","","1.24","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213066","23.767","0.015","5.059","0.003","12.423","0.008","90","","118.873","0.007","90","","1308","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(4-bromophenyl) sulfone","","- C12 H8 Br2 O2 S -","- C12 H8 Br2 O2 S -","- C48 H32 Br8 O8 S4 -","4","0.5","XU2218","Gu, Xiao-Dan; Deng, Jian-Cheng; Yao, Zheng","Bis(4-bromophenyl) sulfone","Acta Crystallographica Section E","2007","63","4","o1904","o1905","10.1107/S1600536807012573","","","0.71073","MoKα","","0.07","0.057","","","0.151","0.162","","","","","","1.079","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213067","8.4978","0.0011","8.963","0.0011","9.2599","0.0012","90","","107.676","0.002","90","","671.99","0.15","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,3'-Dimethyl-1,1'-ethylenediimidazolium dibromide","","- C10 H16 Br2 N4 -","- C10 H16 Br2 N4 -","- C20 H32 Br4 N8 -","2","0.5","XU2219","Hua-Shu Jin; Hai-Jing Wang; Ying Wang; Ya-Jie Zuo; Chong-Min Zhong","3,3'-Dimethyl-1,1'-ethylenediimidazolium dibromide","Acta Crystallographica Section E","2007","63","4","o1880","o1881","10.1107/S160053680701197X","","","0.71073","MoKα","","0.027","0.023","","","0.059","0.061","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213068","13.867","0.003","22.351","0.002","9.252","0.005","90","","103.857","0.007","90","","2784.1","1.6","293","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","μ-Hydrogenarsenato-κ^2^O:O'-di-μ-oxo-κ^2^O:O'-bis[(2,2'-bipyridine- κ^2^N,N')vanadium(V)] dihydrate","","- C20 H21 As N4 O10 V2 -","- C20 H21 As N4 O10 V2 -","- C80 H84 As4 N16 O40 V8 -","4","0.5","XU2220","Ng, Seik Weng","μ-Hydrogenarsenato-κ^2^<i>O</i>:<i>O</i>'-di-μ-oxido-κ^4^<i>O</i>:<i>O</i>'-bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')vanadium(V)] dihydrate","Acta Crystallographica Section E","2007","63","4","m1109","m1110","10.1107/S160053680701241X","","","0.71073","MoKα","","0.052","0.047","","","0.149","0.153","","","","","","1.13","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213069","4.1091","0.0016","6","0.002","14.603","0.005","90","","93.1935","0.0019","90","","359.5","0.2","153.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","5-Iodotropolone","2-Hydroxy-5-iodocyclohepta-2,4,6-trien-1-one","","- C7 H5 I O2 -","- C7 H5 I O2 -","- C14 H10 I2 O4 -","2","1","YA2043","Kubo, Kanji; Matsumoto, Taisuke; Kuribayashi, Daiki; Mori, Akira","5-Iodotropolone","Acta Crystallographica Section E","2007","63","4","o1570","o1572","10.1107/S1600536807009257","","","0.7107","MoKα","","","0.019","","","","0.053","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213070","21.5192","0.0009","21.5192","0.0009","7.7834","0.0005","90","","90","","90","","3604.3","0.3","223","2","223","2","","","","","","","","8","P 4/n :2","-P 4a","85","","[O-Methyl N-(4-chlorophenyl)thiocarbamato-κS](triethylphosphine-κP)gold(I)","","- C14 H22 Au Cl N O P S -","- C14 H22 Au Cl N O P S -","- C112 H176 Au8 Cl8 N8 O8 P8 S8 -","8","1","YA2047","Primjira P. Tadbuppa; Tiekink, Edward R. T.","[<i>O</i>-Methyl <i>N</i>-(4-chlorophenyl)thiocarbamato-κ<i>S</i>](triethylphosphine-κ<i>P</i>)gold(I)","Acta Crystallographica Section E","2007","63","4","m1101","m1102","10.1107/S1600536807011713","","","0.71069","MoKα","","0.055","0.036","","","0.08","0.089","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213071","10.1716","0.0001","12.4806","0.0002","14.763","0.0002","109.229","0.001","106.449","0.001","95.7","0.001","1658.33","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Poly[[[diaquabis(1,10-phenanthroline)samarium(III)]-tri-μ~2~-oxalato] tetrahydrate]","","- C30 H28 N4 O18 Sm2 -","- C30 H28 N4 O18 Sm2 -","- C60 H56 N8 O36 Sm4 -","2","1","ZL2003","Fu-Yong Fang; Xian-Xia Guo; Wen-Dong Song","Poly[[[diaquabis(1,10-phenanthroline)samarium(III)]-tri-μ~2~-oxalato] tetrahydrate]","Acta Crystallographica Section E","2007","63","4","m1031","m1033","10.1107/S1600536807010586","","","0.71073","MoKα","","0.0324","0.0274","","","0.072","0.081","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213072","10.007","0.002","15.251","0.004","11.5785","0.0017","90","","99.599","0.014","90","","1742.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-[[(1,10-phenanthroline-κ^2^N,N')copper(II)]-μ-5- hydroxyisophthalato-κ^2^O^1^:O^3^]","","- C20 H12 Cu N2 O5 -","- C20 H12 Cu N2 O5 -","- C80 H48 Cu4 N8 O20 -","4","1","ZL2006","Wang, Ming-Hui; Wu, Jing-Gui; Luan, Guo-You","<i>catena</i>-Poly[[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)]-μ-5-hydroxyisophthalato-κ^2^<i>O</i>^1^:<i>O</i>^3^]","Acta Crystallographica Section E","2007","63","4","m1039","m1041","10.1107/S1600536807010999","","","0.71073","MoKα","","0.039","0.0338","","","0.0927","0.097","","","","","","1.046","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213073","8.9243","0.0005","13.4297","0.0007","20.2129","0.0011","90","","90","","90","","2422.5","0.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-(2-Bromophenyl)-N-methylnicotinamide","","- C13 H11 Br N2 O -","- C13 H11 Br N2 O -","- C104 H88 Br8 N16 O8 -","8","1","ZL2007","Percival, Darryl; Storey, John M. D.; Harrison, William T. A.","<i>N</i>-(2-Bromophenyl)-<i>N</i>-methylnicotinamide","Acta Crystallographica Section E","2007","63","4","o1853","o1854","10.1107/S1600536807010707","","","0.71073","MoKα","","0.1076","0.0319","","","0.0448","0.05","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213074","10.7637","0.0005","11.3489","0.0005","14.0195","0.0006","66.535","0.001","74.514","0.001","68.849","0.001","1449.81","0.11","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","N,N,N',N'-Tetrabenzyl-N''-(2-fluorobenzoyl)phosphoric diamide","","- C35 H33 F N3 O2 P -","- C35 H33 F N3 O2 P -","- C70 H66 F2 N6 O4 P2 -","2","1","ZL2008","Mahmoudi, Ali; Amin, Amir Hossein","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrabenzyl-<i>N</i>''-(2-fluorobenzoyl)phosphoric diamide","Acta Crystallographica Section E","2007","63","4","o2031","o2033","10.1107/S1600536807013128","","","0.71073","MoKα","","0.043","0.0369","","","0.0987","0.1037","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213075","10.9478","0.0018","12.688","0.002","19.479","0.003","90","","90","","90","","2705.7","0.7","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Aqua(5-bromidonicotinato)trimethyltin(IV)","","- C9 H14 Br N O3 Sn -","- C9 H14 Br N O3 Sn -","- C72 H112 Br8 N8 O24 Sn8 -","8","1","AT2242","Hong-Yun Wang; Han-Dong Yin; Da-Qi Wang","Aqua(5-bromidonicotinato)trimethyltin(IV)","Acta Crystallographica Section E","2007","63","5","m1226","m1227","10.1107/S1600536807014043","","","0.71073","MoKα","","0.0389","0.024","","","0.0545","0.062","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213076","11.5745","0.0003","17.5499","0.0005","11.2629","0.0003","90","","90","","90","","2287.85","0.11","160","1","160","1","","","","","","","","4","A b a 2","A 2 -2ab","41","cyclohexanone","3-Cyano-3-methyl-5-phenylcyclohexanone","","- C14 H15 N O -","- C14 H15 N O -","- C112 H120 N8 O8 -","8","","AT2244","M. Subramanyam; A. Thiruvalluvar; R. T. Sabapathy; S. Kamatchi","3-Cyano-3-methyl-5-phenylcyclohexanone","Acta Crystallographica Section E","2007","63","5","o2715","o2716","10.1107/S1600536807014055","","","0.71073","MoKα","","0.0503","0.0393","","","0.0879","0.0949","","","","","","1.051","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213077","13.7847","0.0004","18.774","0.0005","29.8756","0.001","90","","90","","90","","7731.6","0.4","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","2,3-Dibromo-1-(2,4-dichlorophenyl)-3-(4,5-dimethoxy-2-nitrophenyl)propan-1-one","","- C17 H13 Br2 Cl2 N O5 -","- C17 H13 Br2 Cl2 N O5 -","- C272 H208 Br32 Cl32 N16 O80 -","16","2","AT2245","Yathirajan, H. S.; Mayekar, Anil N.; Narayana, B.; Sarojini, B. K.; Bolte, Michael","2,3-Dibromo-1-(2,4-dichlorophenyl)-3-(4,5-dimethoxy-2-nitrophenyl)propan-1-one","Acta Crystallographica Section E","2007","63","5","o2196","o2197","10.1107/S160053680701450X","","","0.71073","MoKα","","0.0534","0.0392","","","0.0869","0.0926","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213078","6.119","0.002","12.696","0.005","19.812","0.007","90","","97.549","0.007","90","","1525.8","0.9","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-Acetyl-5-(4-chlorophenyl)-3-(4-fluorophenyl)-2-pyrazoline","","- C17 H14 Cl F N2 O -","- C17 H14 Cl F N2 O -","- C68 H56 Cl4 F4 N8 O4 -","4","1","AT2246","Huan-Mei Guo; Fang-Fang Jian; Pu-Su Zhao; Li-Min Li; Qian Wu","1-Acetyl-5-(4-chlorophenyl)-3-(4-fluorophenyl)-2-pyrazoline","Acta Crystallographica Section E","2007","63","5","o2620","o2621","10.1107/S1600536807015784","","","0.71073","MoKα","","0.0883","0.0406","","","0.0982","0.1177","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213079","8.0032","0.0012","8.4448","0.0013","9.8464","0.0014","83.926","0.012","87.035","0.012","64.626","0.011","597.88","0.16","296","","296","","","","","","","","","4","P -1","-P 1","2","","3-[2-(Hydroxymethyl)anilino]isobenzofuran-1(3<i>H</i>)-one","","- C15 H13 N O3 -","- C15 H13 N O3 -","- C30 H26 N2 O6 -","2","1","AT2248","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","3-[2-(Hydroxymethyl)anilino]isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2159","o2161","10.1107/S1600536807014481","","","0.71073","MoKα","","0.0415","0.0352","","","0.0882","0.0923","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213080","12.2412","0.0005","10.9837","0.0004","20.1373","0.0009","90","","101.011","0.004","90","","2657.69","0.19","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","10-(4-Bromophenyl)-9-(4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7- tetrahydroacridine-1,8(2<i>H</i>,5<i>H</i>,9<i>H</i>,10<i>H</i>)-dione","","- C30 H32 Br N O3 -","- C30 H32 Br N O3 -","- C120 H128 Br4 N4 O12 -","4","1","AT2249","Odabaşoğlu, Mustafa; Kaya, Muharrem; Büyükgüngör, Orhan; Yıldırır, Yılmaz","10-(4-Bromophenyl)-9-(4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7-tetrahydroacridine-1,8(2<i>H</i>,5<i>H</i>,9<i>H</i>,10<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","5","o2162","o2164","10.1107/S1600536807014729","","","0.71073","MoKα","","0.069","0.0485","","","0.1114","0.121","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213081","11.8008","0.0014","7.5062","0.0008","16.758","0.002","90","","104.01","0.009","90","","1440.3","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2,3-Dibromo-1-(3-bromo-2-thienyl)-3-(4-fluorophenyl)propan-1-one","","- C13 H8 Br3 F O S -","- C13 H8 Br3 F O S -","- C52 H32 Br12 F4 O4 S4 -","4","1","AT2250","Yathirajan, H. S.; Vijesh, A. M.; Narayana, B.; Sarojini, B. K.; Bolte, Michael","2,3-Dibromo-1-(3-bromo-2-thienyl)-3-(4-fluorophenyl)propan-1-one","Acta Crystallographica Section E","2007","63","5","o2198","o2199","10.1107/S1600536807014493","","","0.71073","MoKα","","0.0864","0.0606","","","0.1406","0.1536","","","","","","0.978","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213082","6.811","0.002","8.751","0.002","10.066","0.004","111.84","0.03","100.31","0.03","91.98","0.03","544.5","0.3","203","2","203","2","","","","","","","","4","P -1","-P 1","2","heterofused carbazole","1-Oxo-1,2-dihydro-1,4-oxazino[2,3,4-jk]carbazole-4-carbaldehyde","","- C15 H9 N O3 -","- C15 H9 N O3 -","- C30 H18 N2 O6 -","2","1","AT2252","A. Thomas Gunaseelan; A. Thiruvalluvar; A. Ebenezer Martin; K. J. Rajendra Prasad; R. J. Butcher","1-Oxo-1,2-dihydro-1,4-oxazino[2,3,4-<i>jk</i>]carbazole-4-carbaldehyde","Acta Crystallographica Section E","2007","63","5","o2410","o2412","10.1107/S1600536807016133","","","0.71073","MoKα","","0.1137","0.0445","","","0.0936","0.1033","","","","","","0.816","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213083","24.618","0.011","5.997","0.003","14.136","0.007","90","","106.288","0.006","90","","2003.2","1.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(chloridomercurio)ferrocene","","- C10 H9 Cl Fe Hg -","- C10 H9 Cl Fe Hg -","- C80 H72 Cl8 Fe8 Hg8 -","8","2","AT2253","Romanov, Aleksander S.; Yakovenko, Andrey A.; Antipin, Mikhail Yu.; Lindline, Jennifer; Timofeeva, Tatiana V.","A monoclinic polymorph of 1-(chloridomercurio)ferrocene","Acta Crystallographica Section E","2007","63","5","m1297","m1299","10.1107/S1600536807016169","","","0.71073","MoKα","","0.0516","0.0468","","","0.1055","0.1081","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213084","6.7065","0.0004","13.1295","0.0009","13.6977","0.0009","90","","99.613","0.001","90","","1189.19","0.13","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-Allyl-1,3-dimethyl-2,4-dioxo-2,3,4,7-tetrahydro- 1<i>H</i>-pyrrolo[2,3-<i>d</i>]pyrimidine-6-carbaldehyde","","- C12 H13 N3 O3 -","- C12 H13 N3 O3 -","- C48 H52 N12 O12 -","4","1","AT2254","B. K. Satis Kumar; D. Gayathri; D. Velmurugan; K. Ravikumar; E. Ramesh","7-Allyl-1,3-dimethyl-2,4-dioxo-2,3,4,7-tetrahydro-1<i>H</i>-pyrrolo[2,3-<i>d</i>]pyrimidine-6-carbaldehyde","Acta Crystallographica Section E","2007","63","5","o2303","o2305","10.1107/S1600536807016170","","","0.71073","MoKα","","0.0503","0.0461","","","0.1343","0.1394","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213085","9.4895","0.0005","11.4943","0.0006","12.3633","0.0007","86.978","0.001","71.302","0.001","77.822","0.001","1248.45","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4'-Ferrocenyl-3'-(4-methoxybenzoyl)-1'-methylspiro[1H-indole-3(2H),2'- pyrrolidin]-2-one","","- C30 H28 Fe N2 O3 -","- C30 H28 Fe N2 O3 -","- C60 H56 Fe2 N4 O6 -","2","1","AT2255","B. K. Satis Kumar; D. Gayathri; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu","4'-Ferrocenyl-3'-(4-methoxybenzoyl)-1'-methylspiro[1<i>H</i>-indole-3(2<i>H</i>),2'-pyrrolidin]-2-one","Acta Crystallographica Section E","2007","63","5","m1287","m1289","10.1107/S1600536807016182","","","0.71073","MoKα","","0.043","0.0389","","","0.1088","0.1126","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213086","7.166","0.003","17.156","0.008","10.181","0.005","90","","107.059","0.006","90","","1196.6","1","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(2-Acetyl-3,5-dimethoxyphenyl)acetamide","","- C12 H15 N O4 -","- C12 H15 N O4 -","- C48 H60 N4 O16 -","4","1","AT2256","Liu, Guo-Biao; Li, Yi-Zhi; Shen, Yong-Miao; Xu, Qiang; Li, Jian-Xin","<i>N</i>-(2-Acetyl-3,5-dimethoxyphenyl)acetamide","Acta Crystallographica Section E","2007","63","5","o2420","o2421","10.1107/S160053680701625X","","","0.71073","MoKα","","0.0871","0.0555","","","0.0897","0.0949","","","","","","0.981","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213087","7.6526","0.0006","8.4577","0.0004","13.7386","0.0011","90","","113.185","0.006","90","","817.39","0.11","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,6-Dimethyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile","","- C8 H8 N2 S -","- C8 H8 N2 S -","- C32 H32 N8 S4 -","4","1","AT2257","Eyduran, Fatih; Özyürek, Cengiz; Dilek, Nefise; Ocak Iskeleli, Nazan; Şendil, Kıvılcım","4,6-Dimethyl-2-thioxo-1,2-dihydropyridine-3-carbonitrile","Acta Crystallographica Section E","2007","63","5","o2415","o2417","10.1107/S1600536807016418","","","0.71073","MoKα","","0.0335","0.0296","","","0.0826","0.0847","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213088","8.2649","0.0003","9.73","0.0003","12.0927","0.0003","86.15","0.001","81.821","0.001","67.91","0.001","891.82","0.05","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","Dichlorido(hexamethylphosphamide)(morpholine-κN)copper(II)","","- C10 H27 Cl2 Cu N4 O2 P -","- C10 H27 Cl2 Cu N4 O2 P -","- C20 H54 Cl4 Cu2 N8 O4 P2 -","2","1","AT2258","De-Ming Xie; Xin-Ju Ma; Wen-Jie Feng; Zhan Shu; Zhi-Min Jin","Dichlorido(hexamethylphosphamide)(morpholine-κ<i>N</i>)copper(II) at 153 K","Acta Crystallographica Section E","2007","63","5","m1473","m1475","10.1107/S1600536807016819","","","0.71073","MoKα","","0.0245","0.0236","","","0.0619","0.0627","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213089","5.9282","0.0006","11.9737","0.0012","12.0247","0.0013","104.764","0.007","92.259","0.007","95.778","0.007","819.29","0.15","298","2","293","2","","","","","","","","4","P -1","-P 1","2","","2,3-Bis(4-chlorophenyl)quinoxaline","","- C20 H12 Cl2 N2 -","- C20 H12 Cl2 N2 -","- C40 H24 Cl4 N4 -","2","1","AT2259","Hong-Bin Zhao; Zhi-Zhi Hu; Xing Chen; Cui-Ping Wang; Zhi-Qiang Zhang","2,3-Bis(4-chlorophenyl)quinoxaline","Acta Crystallographica Section E","2007","63","5","o2488","o2489","10.1107/S1600536807016972","","","0.71073","MoKα","","0.0492","0.039","","","0.1306","0.1389","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213090","12.209","0.003","7.3126","0.0017","15.71","0.004","90","","112.133","0.004","90","","1299.2","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-Benzoyl-<i>N</i>'-(3-hydroxyphenyl)thiourea","","- C14 H12 N2 O2 S -","- C14 H12 N2 O2 S -","- C56 H48 N8 O8 S4 -","4","1","AT2260","Abosadiya, Hamza Millad; Yamin, Bohari M.; Ngah, Nurziana","<i>N</i>-Benzoyl-<i>N</i>'-(3-hydroxyphenyl)thiourea","Acta Crystallographica Section E","2007","63","5","o2403","o2404","10.1107/S1600536807016509","","","0.71073","MoKα","","0.045","0.039","","","0.098","0.102","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213091","28.698","0.002","6.0051","0.0005","28.574","0.002","90","","92.318","0.002","90","","4920.3","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-Methyl-2-[(4-nitrophenylimino)methyl]phenol","","- C14 H12 N2 O3 -","- C14 H12 N2 O3 -","- C224 H192 N32 O48 -","16","2","AT2261","D. Gayathri; D. Velmurugan; K. Ravikumar; D. Saravanakumar; M. Kandaswamy","4-Methyl-2-[(4-nitrophenylimino)methyl]phenol","Acta Crystallographica Section E","2007","63","5","o2324","o2326","10.1107/S1600536807016698","","","0.71073","MoKα","","0.1188","0.0859","","","0.1854","0.2018","","","","","","1.201","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213092","24.47","0.02","7.195","0.006","9.097","0.008","90","","91.61","0.03","90","","1601","2","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,2'-(<i>m</i>-Phenylenedimethylenedithio)bis(1,3-thiazoline)","","- C14 H16 N2 S4 -","- C14 H16 N2 S4 -","- C56 H64 N8 S16 -","4","0.5","AT2262","Yong Wang; Wei Wang; Jing Wang; Xi-Fei Zhou; Ling-Ling Mao","2,2'-(<i>m</i>-Phenylenedimethylenedithio)bis(1,3-thiazoline)","Acta Crystallographica Section E","2007","63","5","o2440","o2441","10.1107/S1600536807016716","","","0.71073","MoKα","","0.0588","0.0386","","","0.1146","0.1287","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213093","8.095","0.004","6.318","0.003","23.94","0.01","90","","101.501","0.013","90","","1199.8","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(5<i>R</i>,6<i>R</i>)-Methyl 6-methyl-2-phenyl-5,6-dihydro-4H-1,3-oxazine-5-carboxylate","","- C13 H15 N O3 -","- C13 H15 N O3 -","- C52 H60 N4 O12 -","4","1","AT2263","Le Dai; Fen-Er Chen; Min-Qin Chen","(5<i>R</i>,6<i>R</i>)-Methyl 6-methyl-2-phenyl-5,6-dihydro-4<i>H</i>-1,3-oxazine-5-carboxylate","Acta Crystallographica Section E","2007","63","5","o2365","o2366","10.1107/S1600536807015991","","","0.71073","MoKα","","0.0627","0.0457","","","0.1246","0.1369","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213094","8.2037","0.0003","24.5226","0.0006","10.6443","0.0003","90","","105.231","0.002","90","","2066.16","0.11","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","chlorothiazide N,N-dimethylacetamide solvate","6-chloro-2<i>H</i>-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide N,N-dimethylacetamide disolvate","","- C15 H24 Cl N5 O6 S2 -","- C15 H24 Cl N5 O6 S2 -","- C60 H96 Cl4 N20 O24 S8 -","4","1","AT2264","Johnston, Andrea; Florence, Alastair J.; Fernandes, Philippe; Kennedy, Alan R.","Chlorothiazide <i>N</i>,<i>N</i>-dimethylacetamide disolvate","Acta Crystallographica Section E","2007","63","5","o2422","o2422","10.1107/S1600536807016388","","","0.71073","MoKα","","0.0982","0.0441","","","0.0816","0.0981","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213095","7.2848","0.0003","19.9139","0.0007","20.0634","0.001","90","","90","","90","","2910.6","0.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-Allyl-3-[(5-methyl-2-oxo-1,3-benzoxazol-3-yl)methyl]-1H-1,2,4- triazole-5(4H)-thione","","- C14 H13 N4 O2 S -","- C14 H13 N4 O2 S -","- C112 H104 N32 O16 S8 -","8","1","AT2265","Yavuz Köysal; Şamil Işık; Umut Salgın; Nesrin Gökhan","4-Allyl-3-[(5-methyl-2-oxo-1,3-benzoxazol-3-yl)methyl]-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","5","o2462","o2462","10.1107/S1600536807017163","","","0.71073","MoKα","","0.0568","0.0421","","","0.116","0.1234","","","","","","0.996","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213096","9.0965","0.0003","11.2081","0.0004","15.8916","0.0005","109.009","0.002","103.384","0.002","96.246","0.002","1460.07","0.09","123","2","123","2","","","","","","","","6","P -1","-P 1","2","chlorothiazide DMSO solvate","6-chloro-4H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide dimethyl sulfoxide solvate","","- C9 H12 Cl N3 O5 S3 -","- C9 H12 Cl N3 O5 S3 -","- C36 H48 Cl4 N12 O20 S12 -","4","2","AT2266","Johnston, Andrea; Florence, Alastair J.; Fernandes, Philippe; Kennedy, Alan R.","Chlorothiazide dimethyl sulfoxide solvate","Acta Crystallographica Section E","2007","63","5","o2423","o2423","10.1107/S1600536807016406","","","0.71073","MoKα","","0.0691","0.0432","","","0.1007","0.1123","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213097","12.2347","0.0006","12.8379","0.0007","11.0797","0.0006","90","","112.531","0.004","90","","1607.43","0.15","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-[(5-Methyl-2-oxo-1,3-benzoxazol-3-yl)methyl]-4-phenyl-1<i>H</i>- 1,2,4-triazole-5(4<i>H</i>)-thione","","- C17 H14 N4 O2 S -","- C17 H14 N4 O2 S -","- C68 H56 N16 O8 S4 -","4","1","AT2267","Yavuz Köysal; Şamil Işık; Umut Salgın; Nesrin Gökhan","3-[(5-Methyl-2-oxo-1,3-benzoxazol-3-yl)methyl]-4-phenyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","5","o2463","o2463","10.1107/S1600536807017485","","","0.71073","MoKα","","0.0532","0.0392","","","0.1021","0.109","","","","","","1.027","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213098","10.5646","0.0014","15.605","0.002","17.432","0.002","90","","95.507","0.004","90","","2860.6","0.6","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(N-tert-Butylimido)chlorido[dimethyl(1H-pyrrol-2-ylmethyl)amine- κ^2^N,N']bis(pyridine-κN)titanium(IV) toluene solvate","","- C28 H38 Cl N5 Ti -","- C28 H38 Cl N5 Ti -","- C112 H152 Cl4 N20 Ti4 -","4","1","AT2268","Gong, Dao-Jun; Wei, Hua; Li, Ya-Hong","(<i>N</i>-<i>tert</i>-Butylimido)chlorido[dimethyl(1<i>H</i>-pyrrol-2-ylmethyl)amine-κ^2^<i>N</i>,<i>N</i>']bis(pyridine-κ<i>N</i>)titanium(IV) toluene solvate","Acta Crystallographica Section E","2007","63","5","m1414","m1414","10.1107/S1600536807017497","","","0.7107","MoKα","","0.1032","0.0726","","","0.1265","0.138","","","","","","1.139","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213099","14.069","0.002","5.8636","0.0009","17.112","0.003","90","","103.418","0.007","90","","1373.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-Bis(2-aminophenoxy)-2-propanol","","- C15 H18 N2 O3 -","- C15 H18 N2 O3 -","- C60 H72 N8 O12 -","4","1","AT2269","Zhi-You Xiao; Yun-Qian Zhang; Qi-Long Zhang; Bi-Xue Zhu","1,3-Bis(2-aminophenoxy)propan-2-ol","Acta Crystallographica Section E","2007","63","5","o2469","o2469","10.1107/S1600536807017503","","","0.71073","MoKα","","0.0655","0.0489","","","0.1362","0.1457","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213100","10.156","0.003","10.339","0.004","35.621","0.012","90","","90","","90","","3740","2","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(E)-N,N-Diethyl-3-hydroxy-3,5-diphenylpent-4-enamide","","- C21 H25 N O2 -","- C21 H25 N O2 -","- C168 H200 N8 O16 -","8","1","AT2270","Zhi-Fang Yu; Yan-Gang Li; Juan Li; Zhi-Min Zhao","(<i>E</i>)-<i>N</i>,<i>N</i>-Diethyl-3-hydroxy-3,5-diphenylpent-4-enamide","Acta Crystallographica Section E","2007","63","5","o2490","o2490","10.1107/S1600536807017515","","","0.71073","MoKα","","0.1405","0.0536","","","0.1449","0.2023","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213101","4.6362","0.0006","10.7289","0.0014","13.4557","0.0018","69.665","0.007","88.411","0.009","88.287","0.008","627.2","0.15","160","2","160","1","","","","","","","","4","P -1","-P 1","2","tetrahydrocarbazole","Methyl 6-methyl-1-oxo-2,3,4,9-tetrahydrocarbazole-2-carboxylate","","- C15 H15 N O3 -","- C15 H15 N O3 -","- C30 H30 N2 O6 -","2","1","AT2271","A. Thomas Gunaseelan; A. Thiruvalluvar; A. Ebenezer Martin; K. J. Rajendra Prasad","Methyl 6-methyl-1-oxo-2,3,4,9-tetrahydrocarbazole-2-carboxylate","Acta Crystallographica Section E","2007","63","5","o2413","o2414","10.1107/S1600536807018193","","","0.71073","MoKα","","0.117","0.0588","","","0.1351","0.162","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213102","5.9984","0.0008","11.4923","0.0014","11.535","0.0014","90","","98.413","0.001","90","","786.61","0.17","273","2","273","2","","","","","","","","3","P 1 21 1","P 2yb","4","","3β-Hydroxy-14β-androsta-5,15-dien-17-one","","- C19 H26 O2 -","- C19 H26 O2 -","- C38 H52 O4 -","2","1","AT2272","Zheng, Chun-Fang; Yao, Shang-Qing; Wan, Wen; Hao, Jian","3β-Hydroxy-14β-androsta-5,15-dien-17-one","Acta Crystallographica Section E","2007","63","5","o2651","o2651","10.1107/S1600536807018806","","","0.71073","MoKα","","0.0302","0.0284","","","0.0666","0.0673","","","","","","1.119","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213104","12.587","0.003","8.5349","0.0017","11.897","0.002","90","","114.12","0.03","90","","1166.5","0.5","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>,<i>N</i>'-Bis(4-Hydroxybenzylidene)hydrazine","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C56 H48 N8 O8 -","4","1","AT2274","Gang Liu; Ling Xie; Yan Wang; Ji-De Wang","<i>N</i>,<i>N</i>'-Bis(4-hydroxybenzylidene)hydrazine","Acta Crystallographica Section E","2007","63","5","o2611","o2611","10.1107/S1600536807018855","","","0.71073","MoKα","","0.0586","0.0464","","","0.1353","0.1473","","","","","","1.006","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213105","8.1854","0.0007","11.7492","0.0009","15.1444","0.0011","90","","95.087","0.006","90","","1450.7","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(dimethylammonium) tetrabromidoomanganese(II)","","- C4 H16 Br4 Mn N2 -","- C4 H16 Br4 Mn N2 -","- C16 H64 Br16 Mn4 N8 -","4","1","AT2275","Morawitz, Thorsten; Kern, Beatrice; Lerner, Hans-Wolfram; Bolte, Michael","Bis(dimethylammonium) tetrabromidomanganate(II)","Acta Crystallographica Section E","2007","63","5","m1433","m1433","10.1107/S160053680701882X","","","0.71073","MoKα","","0.0705","0.0504","","","0.1057","0.1126","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213106","6.9121","0.0012","25.854","0.002","7.6626","0.0014","90","","111.406","0.007","90","","1274.9","0.3","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Nitrobenzaldehyde benzoylhydrazone monohydrate","","- C14 H11 N3 O3 -","- C14 H11 N3 O3 -","- C56 H44 N12 O12 -","4","1","AT2278","Huan-Mei Guo","2-Nitrobenzaldehyde benzoylhydrazone monohydrate","Acta Crystallographica Section E","2007","63","5","o2736","o2736","10.1107/S1600536807020387","","","0.7107","MoKα","","0.0752","0.0555","","","0.1372","0.1531","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213107","8.1611","0.0006","9.0279","0.0006","21.3467","0.0015","85.585","0.006","89.441","0.006","75.912","0.005","1520.88","0.19","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","2-Bromo-5-methoxy-N'-[(E)-(2-nitrophenyl)methylene]benzohydrazide","","- C15 H12 Br N3 O4 -","- C15 H12 Br N3 O4 -","- C60 H48 Br4 N12 O16 -","4","2","AT2279","Yathirajan, H. S.; Sarojini, B. K.; Narayana, B.; Sunil, K.; Bolte, Michael","2-Bromo-5-methoxy-<i>N</i>'-[(<i>E</i>)-(2-nitrophenyl)methylene]benzohydrazide","Acta Crystallographica Section E","2007","63","5","o2719","o2719","10.1107/S1600536807020375","","","0.71073","MoKα","","0.0475","0.0369","","","0.0873","0.0914","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213108","12.2284","0.0003","8.0986","0.0003","13.1376","0.0004","90","","91.336","0.002","90","","1300.7","0.07","160","2","160","1","","","","","","","","4","P 1 21/a 1","-P 2yab","14","phenylcyclohexanone","1-Methyl-5-(3-nitrophenyl)-3-oxocyclohexanecarbonitrile","","- C14 H14 N2 O3 -","- C14 H14 N2 O3 -","- C56 H56 N8 O12 -","4","1","AT2280","M. Subramanyam; A. Thiruvalluvar; R. T. Sabapathy Mohan; S. Kamatchi","1-Methyl-5-(3-nitrophenyl)-3-oxocyclohexanecarbonitrile","Acta Crystallographica Section E","2007","63","5","o2717","o2717","10.1107/S1600536807020399","","","0.71073","MoKα","","0.0897","0.056","","","0.1412","0.1628","","","","","","1.049","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213109","6.0359","0.0012","7.5002","0.0015","13.637","0.003","92.8","0.03","96.1","0.03","99.82","0.03","603.4","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-(3,5-Difluorophenyl)-1-phenylprop-2-en-1-one","","- C15 H10 F2 O -","- C15 H10 F2 O -","- C30 H20 F4 O2 -","2","1","AV3072","Farias, Adriano de P.; Visentin, Lorenzo do C.; Bordinhao, Jairo; Sobrinho, Dari C.; Ferreira, Jose C. N.","3-(3,5-Difluorophenyl)-1-phenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2770","o2771","10.1107/S1600536807012950","","","0.71073","MoKα","","0.1757","0.0561","","","0.1001","0.1217","","","","","","0.938","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213110","10.8513","0.0004","6.0019","0.0003","26.7246","0.0007","90","","90.232","0.002","90","","1740.52","0.12","293","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1,2-Dibromo-5-(4-tolylsulfonyl)-2,2a,4a,5,7a,7b-hexahydro-1H-7-oxa-5- azacyclobuta[e]inden-6-one","","- C16 H15 Br2 N O4 S -","- C16 H15 Br2 N O4 S -","- C64 H60 Br8 N4 O16 S4 -","4","1","AV3083","Şahin, Ertan; Kelebekli, Latif; Kara, Yunus; Çelik, Murat; Balci, Metin","1,2-Dibromo-5-(4-tolylsulfonyl)-2,2a,4a,5,7a,7b-hexahydro-1<i>H</i>-7-oxa-5-azacyclobuta[<i>e</i>]inden-6-one","Acta Crystallographica Section E","2007","63","5","o2464","o2464","10.1107/S1600536807017011","","","0.71073","MoKα","","","0.099","","","","0.1435","","","","","","1.387","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213111","6.636","0.003","6.98","0.003","18.98","0.008","90","","90","","90","","879.1","0.7","298","2","298","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Poly[μ~3~-isonicotinato-κ^3^N:O:O')(μ~4~-tetraoxidochromato- κ^5^O:O':O',O'':O'')erbium(III)]","","- C6 H4 Cr Er N O6 -","- C6 H4 Cr Er N O6 -","- C24 H16 Cr4 Er4 N4 O24 -","4","1","BG2036","Liu, Jiu-Hui; Huang, Chun-Fang; Li, Mei","Poly[(μ~3~-isonicotinato-κ^3^<i>N</i>:<i>O</i>:<i>O</i>')(μ~4~-tetraoxidochromato-κ^5^<i>O</i>:<i>O</i>':<i>O</i>',<i>O</i>'':<i>O</i>'')erbium(III)]","Acta Crystallographica Section E","2007","63","5","m1185","m1187","10.1107/S1600536807012536","","","0.71073","MoKα","","0.0283","0.023","","","0.0562","0.0754","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213112","7.4694","0.0019","16.812","0.004","22.514","0.006","90","","90","","90","","2827.2","1.2","174","2","174","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","3,3',5,5'-Tetramethylbiphenyl-4,4'-dicarbonitrile","","- C18 H16 N2 -","- C18 H16 N2 -","- C144 H128 N16 -","8","0.25","BG2037","Britton, Doyle; Silva, Saliya A. de","3,3',5,5'-Tetramethylbiphenyl-4,4'-dicarbonitrile","Acta Crystallographica Section E","2007","63","5","o2252","o2253","10.1107/S1600536807014353","","","0.71073","MoKα","","0.052","0.044","","","0.109","0.113","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213113","8.347","0.002","9.43","0.002","9.493","0.002","108.03","0.004","101.762","0.004","94.381","0.004","687.8","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","2-(o-Tolyloxy)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acetamide","","- C12 H10 F3 N3 O2 S -","- C12 H10 F3 N3 O2 S -","- C24 H20 F6 N6 O4 S2 -","2","1","BG2038","Jun-Yan Zhan; De-Jun Xiong; Yan-Gang Wang; Hai-Bing Li","2-(<i>o</i>-Tolyloxy)-<i>N</i>-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acetamide","Acta Crystallographica Section E","2007","63","5","o2184","o2185","10.1107/S1600536807014389","","","0.71073","MoKα","","0.0693","0.0626","","","0.1645","0.1709","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213114","12.6636","0.0006","15.4927","0.0008","19.297","0.001","108.089","0.001","95.412","0.001","111.242","0.001","3261.7","0.3","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","(2<i>E</i>,5<i>E</i>)-2,5-Bis(2,3,4-trimethoxybenzylidene)cyclopentanone","","- C25 H28 O7 -","- C25 H28 O7 -","- C150 H168 O42 -","6","3","BG2039","Du, Zhi-Yun; Zhang, Kun; Ng, Seik Weng","(2<i>E</i>,5<i>E</i>)-2,5-Bis(2,3,4-trimethoxybenzylidene)cyclopentanone","Acta Crystallographica Section E","2007","63","5","o2595","o2596","10.1107/S1600536807018983","","","0.71073","MoKα","","0.1208","0.0512","","","0.1214","0.1584","","","","","","0.956","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213115","8.807","0.003","5.975","0.001","14.193","0.003","90","","96.17","0.02","90","","742.5","0.3","296","2","296","2","","","","","","","","4","C 1 2 1","C 2y","5","L-α-leucine","2-ammonio-4-methylpentanoate","","- C6 H13 N O2 -","- C6 H13 N O2 -","- C24 H52 N4 O8 -","4","1","BG2041","Yamashita, Motoi; Inomata, Shinsuke; Ishikawa, Kouki; Kashiwagi, Tatsuki; Matsuo, Hiroshi; Sawamura, Seiji; Kato, Minoru","A high-pressure polymorph of <small>L</small>-α-leucine","Acta Crystallographica Section E","2007","63","5","o2762","o2764","10.1107/S1600536807018764","","","1.5418","CuKα","","0.0388","0.0331","","0.1039","","0.1039","","","1.502","","","1.502","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213116","16.804","0.005","7.885","0.004","10.484","0.005","90","","126.161","0.005","90","","1121.5","0.9","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","dimethylammonium terephthalate","Dimethylammonium terephthalate","","- C10 H13 N O4 -","- C10 H13 N O4 -","- C40 H52 N4 O16 -","4","0.5","BG2049","Wen-Xiu Zhao; Yu-Xiang Gao; Shun-Fu Dong; Yan Li; Wei-Ping Zhang","Dimethylammonium terephthalate","Acta Crystallographica Section E","2007","63","5","o2728","o2728","10.1107/S1600536807020351","","","0.71069","MoKα","","0.0677","0.047","","","0.1251","0.1371","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213117","9.685","0.003","16.813","0.004","17.126","0.004","90","","99.156","0.005","90","","2753.2","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(2-benzyliminomethyl-5-methylphenyl-κ^2^C^1^,N)dicarbonylruthenium(II)","","- C32 H28 N2 O2 Ru -","- C32 H28 N2 O2 Ru -","- C128 H112 N8 O8 Ru4 -","4","1","BG3035","Ma, Jing; Xu, Jing; Su, Wei-Ping","Bis(2-benzyliminomethyl-5-methylphenyl-κ^2^<i>C</i>^1^,<i>N</i>)dicarbonylruthenium(II)","Acta Crystallographica Section E","2007","63","5","m1421","m1421","10.1107/S1600536807018673","","","0.71073","MoKα","","0.0425","0.0346","","","0.0788","0.0838","","","","","","1.088","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213118","6.7568","0.0009","15.732","0.002","23.364","0.003","90","","90","","90","","2483.5","0.6","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","N,N-Dimethylguanidinium chloride","","- C3 H10 Cl N3 -","- C3 H10 Cl N3 -","- C48 H160 Cl16 N48 -","16","0.5","BH2085","Weinmann, Markus; Nuss, Jürgen; Jansen, Martin","<i>N</i>,<i>N</i>-Dimethylguanidinium chloride","Acta Crystallographica Section E","2007","63","5","o2767","o2769","10.1107/S1600536807013141","","","0.71073","MoKα","","0.0424","0.0353","","","0.0808","0.0845","","","","","","1.174","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213119","5.6204","0.0011","25.623","0.005","11.256","0.002","90","","96.748","0.004","90","","1609.8","0.5","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Aminopyridinium isonicotinate 2-aminopyridine","","- C16 H17 N5 O2 -","- C16 H17 N5 O2 -","- C64 H68 N20 O8 -","4","1","BH2087","Xie, Zhi-Yuan","2-Aminopyridinium isonicotinate 2-aminopyridine","Acta Crystallographica Section E","2007","63","5","o2192","o2193","10.1107/S160053680701344X","","","0.71073","MoKα","","0.0876","0.055","","","0.1364","0.1629","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213120","9.3217","0.0006","18.1539","0.0011","9.9297","0.0007","90","","105.259","0.004","90","","1621.12","0.19","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(4-Fluorophenyl)-1-methyl-4-(4-pyridyl)quinolin-2(1<i>H</i>)-one","","- C21 H15 F N2 O -","- C21 H15 F N2 O -","- C84 H60 F4 N8 O4 -","4","1","BH2088","Peifer, Christian; Schollmeyer, Dieter; Kinkel, Katrin; Laufer, Stefan","3-(4-Fluorophenyl)-1-methyl-4-(4-pyridyl)quinolin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2457","o2459","10.1107/S1600536807014638","","","0.71073","MoKα","","0.0735","0.0494","","","0.1436","0.1638","","","","","","1.039","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2213121","16.003","0.002","7.08","0.001","13.269","0.002","90","","108.723","0.002","90","","1423.8","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2'-(3,5-Dichloro-2-hydroxybenzylidene)-2-hydroxybenzohydrazide","","- C14 H10 Cl2 N2 O3 -","- C14 H10 Cl2 N2 O3 -","- C56 H40 Cl8 N8 O12 -","4","1","BH2089","Li, Wen-Hui","2'-(3,5-Dichloro-2-hydroxybenzylidene)-2-hydroxybenzohydrazide","Acta Crystallographica Section E","2007","63","5","o2136","o2137","10.1107/S1600536807014195","","","0.71073","MoKα","","0.0684","0.0389","","","0.0889","0.106","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213122","8.235","0.001","14.573","0.002","29.099","0.003","90","","90","","90","","3492.1","0.7","298","2","298","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","Dibromido{2,4-dichloro-6-[3- (dimethylammonio)propyliminomethyl]phenolato}zinc(II)","","- C12 H16 Br2 Cl2 N2 O Zn -","- C12 H16 Br2 Cl2 N2 O Zn -","- C96 H128 Br16 Cl16 N16 O8 Zn8 -","8","1","BH2090","Wang, Li-Hua; Li, Li-Zhong","Dibromido{2,4-dichloro-6-[3-(dimethylammonio)propyliminomethyl]phenolato}zinc(II)","Acta Crystallographica Section E","2007","63","5","m1217","m1219","10.1107/S1600536807014201","","","0.71073","MoKα","","0.0871","0.0503","","","0.0978","0.1114","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213123","12.872","0.002","11.0157","0.0019","7.817","0.0013","90","","100.405","0.002","90","","1090.2","0.3","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,5-Bis(3-pyridyl)-1,3,4-thiadiazole","","- C12 H8 N4 S -","- C12 H8 N4 S -","- C48 H32 N16 S4 -","4","1","BH2091","Niu, Cao-Yuan; Hou, Shi-Cong; Wan, Xin-Sheng; Kou, Chun-Hong; Feng, Cao-Ling","2,5-Bis(3-pyridyl)-1,3,4-thiadiazole","Acta Crystallographica Section E","2007","63","5","o2146","o2147","10.1107/S1600536807014432","","","0.71073","MoKα","","0.0719","0.0418","","","0.0955","0.1114","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213124","18.5808","0.0009","23.6715","0.0014","18.4205","0.0011","90","","90","","90","","8102","0.8","120","2","120","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Tris(1,10-phenanthroline-κ^2^N,N')iron(II) dichloride methanol hexasolvate","","- C42 H48 Cl2 Fe N6 O6 -","- C42 H48 Cl2 Fe N6 O6 -","- C336 H384 Cl16 Fe8 N48 O48 -","8","1","BH2092","Aparici Plaza, Luis; Baranowska, Katarzyna; Becker, Barbara","Tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')iron(II) dichloride methanol hexasolvate","Acta Crystallographica Section E","2007","63","5","m1537","m1539","10.1107/S1600536807019873","","","0.71073","MoKα","","0.087","0.0575","","","0.1485","0.1644","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213125","48.8807","0.0013","9.6542","0.0002","14.2788","0.0004","90","","100.275","0.001","90","","6630.2","0.3","183","2","183","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Methoxyoxobis(quinolin-8-olato-κ^2^N,O)vanadium(V)","","- C19 H15 N2 O4 V -","- C19 H15 N2 O4 V -","- C304 H240 N32 O64 V16 -","16","2","BH2094","Nica, Simona; Buchholz, Axel; Görls, Helmar; Plass, Winfried","Methoxyoxobis(quinolin-8-olato-κ^2^<i>N</i>,<i>O</i>)vanadium(V)","Acta Crystallographica Section E","2007","63","5","m1450","m1452","10.1107/S1600536807016339","","","0.71073","MoKα","","0.079","0.0481","","","0.1045","0.1156","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213126","9.7986","0.0011","10.8084","0.0012","12.403","0.0013","85.631","0.002","87.964","0.002","65.476","0.002","1191.6","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(Tetra-n-butylammonium) bis(1,2-dicyanoethylene-1,2-dithiolato-κ^2^S,S')palladium(II)","","- C40 H72 N6 Pd S4 -","- C40 H72 N6 Pd S4 -","- C40 H72 N6 Pd S4 -","1","0.5","BH2096","Xu, Hong-Wu; Yuan, Wen-Bing; Li, Jin-Xia; Liu, Min","Bis(tetra-<i>n</i>-butylammonium) bis(1,2-dicyanoethylene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')palladate(II)","Acta Crystallographica Section E","2007","63","5","m1237","m1238","10.1107/S1600536807015541","","","0.71073","MoKα","","0.0956","0.0646","","","0.1279","0.1484","","","","","","1.149","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213127","9.2421","0.0018","9.2421","0.0018","14.4928","0.0015","90","","90","","90","","1237.9","0.4","292","","292","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Tricaesium tetrachloridozincate(II) chloride","","- Cl5 Cs3 Zn -","- Cl5 Cs3 Zn -","- Cl20 Cs12 Zn4 -","4","0.125","BI2165","Fejfarova, Karla; Ouarsal, Rachid; El Bali, Brahim; Dušek, Michal; Lachkar, Mohammed","Tricaesium tetrachloridozincate(II) chloride","Acta Crystallographica Section E","2007","63","5","i136","i137","10.1107/S1600536807015899","","","0.71069","MoKα","","0.0121","0.0104","","","0.0332","0.0348","","","","","","1.01","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213128","5.28","0.001","9.374","0.002","14.785","0.003","87.97","0.03","88.26","0.03","74.02","0.03","702.9","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Bis{2-[(E)-(3,5-dibromo-2-oxidophenyl)methyleneamino]ethanesulfonato- κ^3^N,O.O':O''}bis[methanolcopper(II)]","","- C20 H22 Br4 Cu2 N2 O10 S2 -","- C20 H22 Br4 Cu2 N2 O10 S2 -","- C20 H22 Br4 Cu2 N2 O10 S2 -","1","0.5","BI2166","Chen, Xian-Ming; Zhang, Shu-Hua; Yang, Yan","Bis{μ-2-[(<i>E</i>)-(3,5-dibromo-2-oxidophenyl)methyleneamino]ethanesulfonato-κ^3^<i>N</i>,<i>O,O</i>':κ<i>O</i>''}bis[methanolcopper(II)]","Acta Crystallographica Section E","2007","63","5","m1317","m1318","10.1107/S1600536807015905","","","0.71073","MoKα","","0.107","0.0706","","","0.1729","0.2087","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213129","7.222","0.0014","10.35","0.002","16.672","0.003","72.08","0.03","88.06","0.03","70.89","0.03","1117.3","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Heptaaquabis(hydrogen maleato-κ<i>O</i>)europium(III) hydrogen maleate monohydrate","","- C12 H25 Eu O20 -","- C12 H25 Eu O20 -","- C24 H50 Eu2 O40 -","2","1","BI2168","Shen, Qing-Yue; Lu, Chun-Hua; Ji, Qing; Wu, Wen-Yuan; Xu, Zhong-Zi","Heptaaquabis(hydrogen maleato-κ<i>O</i>)europium(III) hydrogen maleate monohydrate","Acta Crystallographica Section E","2007","63","5","m1419","m1420","10.1107/S1600536807017953","","","0.71073","MoKα","","0.0293","0.027","","","0.0692","0.0706","","","","","","1.086","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213130","10.481","0.002","10.916","0.002","11.948","0.003","63.29","0.02","68.99","0.03","73.49","0.03","1127.5","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-Benzoyl-1,2-diphenyl-1H-benzo[f]indole-4,9-dione","","- C31 H19 N O3 -","- C31 H19 N O3 -","- C62 H38 N2 O6 -","2","1","BI2169","Yun Liu; Zhi-Feng Lu; Miao Ye; Yan Zhang; Jian-Hua Xu","3-Benzoyl-1,2-diphenyl-1<i>H</i>-benz[<i>f</i>]indole-4,9-dione","Acta Crystallographica Section E","2007","63","5","o2066","o2067","10.1107/S1600536807013797","","","0.71073","MoKα","","0.0773","0.0503","","","0.1142","0.1509","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213131","3.9479","0.0001","10.1234","0.0003","17.2553","0.0006","90","","91.823","0.002","90","","689.28","0.04","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-(4-Chlorophenyl)-3-(4-ethoxyphenyl)prop-2-en-1-one","","- C17 H15 Cl O2 -","- C17 H15 Cl O2 -","- C34 H30 Cl2 O4 -","2","1","BI2170","P. S. Patil; Hoong-Kun Fun; Suchada Chantrapromma; S. M. Dharmaprakash","1-(4-Chlorophenyl)-3-(4-ethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2497","o2498","10.1107/S1600536807017394","","","0.71073","MoKα","","0.0496","0.0415","","","0.0973","0.1036","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213132","13.153","0.003","10.078","0.002","17.489","0.004","90","","90","","90","","2318.3","0.9","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bis(thiocyanato- κ<i>N</i>)cobalt(II)","","- C26 H16 Co N6 S2 -","- C26 H16 Co N6 S2 -","- C104 H64 Co4 N24 S8 -","4","0.5","BI2171","Gang-Qiang Yin","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bis(thiocyanato-κ<i>N</i>)cobalt(II)","Acta Crystallographica Section E","2007","63","5","m1542","m1543","10.1107/S1600536807019988","","","0.71073","MoKα","","0.0429","0.0376","","","0.1063","0.1114","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213133","16.248","0.002","10.2777","0.0014","16.327","0.002","90","","118.871","0.002","90","","2387.6","0.5","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichlorido[(<i>E</i>)-1-[1-(pyridin-2-yl)ethylidene]thiosemicarbazonato- κ^3^<i>N</i>,<i>N</i>',<i>S</i>]gallium(III)","","- C8 H9 Cl2 Ga N4 S -","- C8 H9 Cl2 Ga N4 S -","- C64 H72 Cl16 Ga8 N32 S8 -","8","1","BI2172","Fan, Ying-Ju; Ma, Jian-Ping; Sun, Zhong-Xi","Dichlorido{(<i>E</i>)-1-[1-(pyridin-2-yl)ethylidene]thiosemicarbazonato-κ^3^<i>N</i>,<i>N</i>',<i>S</i>}gallium(III)","Acta Crystallographica Section E","2007","63","5","m1540","m1541","10.1107/S1600536807017242","","","0.71073","MoKα","","0.0259","0.0229","","","0.0578","0.0596","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213134","12.737","0.004","9.355","0.003","15.992","0.005","90","","111.96","0.005","90","","1767.3","1","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(2-Chloro-4-nitrophenyl)-<i>N</i>'-octanoylthiourea","","- C15 H20 Cl N3 O3 S -","- C15 H20 Cl N3 O3 S -","- C60 H80 Cl4 N12 O12 S4 -","4","1","BI2174","Yusof, M. Sukeri M.; Ramlee, Nurul Ain M.; Kadir, Maisara A.; Yamin, Bohari M.","<i>N</i>-(2-Chloro-4-nitrophenyl)-<i>N</i>'-octanoylthiourea","Acta Crystallographica Section E","2007","63","5","o2552","o2553","10.1107/S1600536807017266","","","0.71073","MoKα","","0.071","0.05","","","0.118","0.128","","","","","","1.027","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213135","12.969","0.002","12.547","0.002","7.764","0.001","90","","95.865","0.001","90","","1256.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(4,6-dibromo-2-formylphenolato-κ^2^<i>O</i>,<i>O</i>')bis(dimethyl sulfoxide-κO)nickel(II)","","- C18 H18 Br4 Ni O6 S2 -","- C18 H18 Br4 Ni O6 S2 -","- C36 H36 Br8 Ni2 O12 S4 -","2","0.5","BI2177","Zhang, Shu-Hua; Li, Guang-Zhao; Feng, Xiao-Zhen; Liu Zheng","Bis(4,6-dibromo-2-formylphenolato-κ^2^<i>O</i>,<i>O</i>')bis(dimethyl sulfoxide-κ<i>O</i>)nickel(II)","Acta Crystallographica Section E","2007","63","5","m1319","m1320","10.1107/S1600536807017540","","","0.71073","MoKα","","0.0594","0.0407","","","0.0968","0.1017","","","","","","0.999","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213136","13.9129","0.0019","16.195","0.005","7.902","0.003","90","","100.1","0.02","90","","1752.9","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N',N''-Triphenylguanidinium bromide","","- C19 H18 Br N3 -","- C19 H18 Br N3 -","- C76 H72 Br4 N12 -","4","1","BI2178","Pereira Silva, P. S.; Ramos Silva, M.; Paixão, J. A.; Matos Beja, A.","<i>N</i>,<i>N</i>',<i>N</i>''-Triphenylguanidinium bromide","Acta Crystallographica Section E","2007","63","5","o2524","o2526","10.1107/S1600536807017370","","","0.71073","MoKα","","0.0774","0.0351","","","0.0813","0.0937","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213137","10.691","0.005","11.963","0.005","12.096","0.006","96.21","0.03","115.51","0.03","113.25","0.03","1208.5","1.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2,6-Di-<i>tert</i>-butyl-4-{[2-(1-methyl-1<i>H</i>-benzimidazol-2- yl)phenyl]imino}cyclohexa-2,5-dien-1-one","","- C28 H31 N3 O -","- C28 H31 N3 O -","- C56 H62 N6 O2 -","2","1","BI2179","Oleg Ya. Borbulevych","2,6-Di-<i>tert</i>-butyl-4-{[2-(1-methyl-1<i>H</i>-benzimidazol-2-yl)phenyl]imino}cyclohexa-2,5-dien-1-one","Acta Crystallographica Section E","2007","63","5","o2547","o2548","10.1107/S1600536807017382","","","0.71073","MoKα","","0.0811","0.0443","","","0.1164","0.1248","","","","","","1.015","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213138","13.879","0.002","10.341","0.002","22.406","0.004","90","","101.8","0.01","90","","3147.8","1","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tris(pyrrolidine-1-carbodithioato-κ^2^<i>S</i>,<i>S</i>')cobalt(III) chloroform disolvate","","- C17 H26 Cl6 Co N3 S6 -","- C17 H26 Cl6 Co N3 S6 -","- C68 H104 Cl24 Co4 N12 S24 -","4","1","BI2180","Kropidłowska, Anna; Janczak, Jan; Gołaszewska, Jolanta; Becker, Barbara","Tris(pyrrolidine-1-carbodithioato-κ^2^<i>S</i>,<i>S</i>')cobalt(III) chloroform disolvate","Acta Crystallographica Section E","2007","63","5","m1391","m1392","10.1107/S1600536807017965","","","0.71073","MoKα","","0.1698","0.0592","","","0.1318","0.1399","","","","","","1.123","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213139","5.0841","0.0017","14.024","0.004","18.836","0.006","90","","92.14","0.03","90","","1342.1","0.7","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[1-(4-Nitrophenyl)-1<i>H</i>-tetrazol-5-yl]-1<i>H</i>-1,2,3-benzotriazole","","- C13 H8 N8 O2 -","- C13 H8 N8 O2 -","- C52 H32 N32 O8 -","4","1","BI2182","Lyakhov, Alexander S.; Egorova, Nataliya G.; Artamonova, Tatiana V.; Gaponik, Pavel N.; Koldobskii, Grigorii I.","1-[1-(4-Nitrophenyl)-1<i>H</i>-tetrazol-5-yl]-1<i>H</i>-1,2,3-benzotriazole","Acta Crystallographica Section E","2007","63","5","o2486","o2487","10.1107/S1600536807017564","","","0.71073","MoKα","","0.0781","0.0506","","","0.1393","0.1699","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213140","10.2887","0.0011","11.1487","0.0012","12.6386","0.0013","104.74","0.002","95.725","0.002","116.332","0.002","1218.1","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","1-{6-(4-Chlorophenyl)-1-[(6-chloropyridin-3-yl)methyl]- 2-[(6-chloropyridin-3-yl)methylsulfanyl]-4-methyl-1,6-dihydropyrimidin- 5-yl}ethanone","","- C25 H21 Cl3 N4 O S -","- C25 H21 Cl3 N4 O S -","- C50 H42 Cl6 N8 O2 S2 -","2","1","BI2183","Xiao-Fei Zhu; De-Qing Shi","1-{6-(4-Chlorophenyl)-1-[(6-chloropyridin-3-yl)methyl]-2-[(6-chloropyridin-3-yl)methylsulfanyl]-4-methyl-1,6-dihydropyrimidin-5-yl}ethanone","Acta Crystallographica Section E","2007","63","5","o2506","o2507","10.1107/S1600536807017539","","","0.71073","MoKα","","0.0692","0.0502","","","0.1236","0.1329","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213141","7.5945","0.0002","9.9333","0.0002","10.0701","0.0003","78.9","0.01","86.84","0.01","71.55","0.02","707.13","0.09","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis(4-chlorobenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>)cobalt(II)","","- C26 H24 Cl2 Co N4 O8 -","- C26 H24 Cl2 Co N4 O8 -","- C26 H24 Cl2 Co N4 O8 -","1","0.5","BI2184","Çaylak, Nagihan; Hökelek, Tuncer; Öztürkkan, F. Elif; Necefoğlu, Hacali","Diaquabis(4-chlorobenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>)cobalt(II)","Acta Crystallographica Section E","2007","63","5","m1344","m1346","10.1107/S1600536807018442","","","0.71073","MoKα","","0.0699","0.0463","","","0.1179","0.1312","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213142","8.6134","0.0003","7.4803","0.0003","8.8106","0.0003","90","","115.072","0.0018","90","","514.19","0.03","150","","150","","","","","","","","","4","P 1 21 1","P 2yb","4","","2,2'-Anhydro-2'-<i>C</i>-methyl-1-(β-D-arabinofuranosyl)uracil","","- C10 H12 N2 O5 -","- C10 H12 N2 O5 -","- C20 H24 N4 O10 -","2","1","BQ2004","Jenkinson, Sarah F.; Jones, Nigel A.; Moussa, Adel; Stewart, Alistair J.; Heinz, Thomas; Fleet, George W. J.; Watkin, David J.","2,2'-Anhydro-2'-<i>C</i>-methyl-1-(β-<i>D</i>-arabinofuranosyl)uracil (2,2'-anhydro-2'-<i>C</i>-methyluridine)","Acta Crystallographica, Section E","2007","63","5","o2071","o2073","10.1107/S1600536807014456","","","0.71073","MoKα","","0.0306","0.0306","","0.065","0.065","0.065","","","","","","0.9805","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2213143","7.698","0.003","15.796","0.006","8.789","0.003","90","","99.771","0.007","90","","1053.2","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Pyridylmethyl 1H-pyrrole-2-carboxylate","","- C11 H10 N2 O2 -","- C11 H10 N2 O2 -","- C44 H40 N8 O8 -","4","1","BQ2005","Wu-Yan Wang; Zhen-Ming Yin","4-Pyridylmethyl 1<i>H</i>-pyrrole-2-carboxylate","Acta Crystallographica Section E","2007","63","5","o2737","o2738","10.1107/S1600536807014444","","","0.71073","MoKα","","0.1367","0.0398","","","0.0894","0.1208","","","","","","0.906","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213144","7.8875","0.0013","7.9125","0.0013","15.029","0.003","96.04","0.003","96.765","0.003","100.71","0.003","907.4","0.3","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","1-(2,4-Dimethylphenyl)-3-methyl-4-(2-nitrophenylsulfonyl)- 1H-1,2,4-triazol-5(4H)-one","","- C17 H16 N4 O5 S -","- C17 H16 N4 O5 S -","- C34 H32 N8 O10 S2 -","2","1","BQ2006","Mi Tang; Lei Wang; Zheng-Ming Li; Hai-Bin Song","1-(2,4-Dimethylphenyl)-3-methyl-4-(2-nitrophenylsulfonyl)-1<i>H</i>-1,2,4-triazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2513","o2514","10.1107/S1600536807018107","","","0.71073","MoKα","","0.0479","0.0381","","","0.1014","0.1098","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213145","14.1946","0.0008","10.1475","0.0007","19.267","0.001","90","","118.117","0.003","90","","2447.7","0.3","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[μ-4,5-dicyano-N,N'-bis(p-tolylsulfonyl)-o- phenylendiaminato]bis[diamminecopper(II)] dihydrate","","- C22 H24 Cu N6 O5 S2 -","- C22 H24 Cu N6 O5 S2 -","- C88 H96 Cu4 N24 O20 S8 -","4","1","BQ2007","Yuksel, Fatma; Tuncel, Sinem; Gurek, Ayse Gul; Jeanneau, Erwann; Luneau, Dominique; Ahsen, Vefa","Bis[μ-4,5-dicyano-<i>N</i>,<i>N</i>'-bis(<i>p</i>-tolylsulfonyl)-<i>o</i>-phenylenediaminato]bis[diamminecopper(II)] dihydrate","Acta Crystallographica Section E","2007","63","5","m1380","m1382","10.1107/S1600536807017643","","","0.71069","MoKα","","","0.0558","","","","0.0593","","","","","","1.0528","","","","has coordinates,has Fobs","197043","2020-10-21","18:00:00",""
"2213146","11.8344","0.0015","5.6974","0.0007","17.651","0.002","90","","91.632","0.002","90","","1189.6","0.2","299","2","299","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(5-Bromo-1-methyl-1H-indol-3-ylcarbonyl)-N-methylacetamide","","- C12 H11 Br N2 O2 -","- C12 H11 Br N2 O2 -","- C48 H44 Br4 N8 O8 -","4","1","BQ2008","Hong-Ming Dong; Yin Huang","2-(5-Bromo-1-methyl-1<i>H</i>-indol-3-ylcarbonyl)-<i>N</i>-methylacetamide","Acta Crystallographica Section E","2007","63","5","o2576","o2577","10.1107/S1600536807018302","","","0.71073","MoKα","","0.0519","0.0355","","","0.0985","0.1037","","","","","","1.108","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213147","7.598","0.002","8.813","0.003","9.169","0.002","90","","91.26","0.02","90","","613.8","0.3","120","","120","","","","","","","","","3","P 1 n 1","P -2yac","7","","1,1',1''-[(5<i>R</i>,6<i>R</i>)-6-Hydroxy-6-methyl-3,4,5,6-tetrahydro- 2<i>H</i>-pyran-3,3,5-triyl]triethanone","","- C12 H18 O5 -","- C12 H18 O5 -","- C24 H36 O10 -","2","1","BQ2009","Burton, Sylvester; Fronczek, Frank R.; Maverick, Andrew W.","1,1',1''-[(5<i>RS</i>,6<i>RS</i>)-6-Hydroxy-6-methyl-3,4,5,6-tetrahydro-2<i>H</i>-pyran-3,3,5-triyl]triethanone","Acta Crystallographica Section E","2007","63","5","o2661","o2662","10.1107/S1600536807018120","","","0.71073","MoKα","","0.058","0.046","","","0.099","0.106","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213148","23.764","0.003","14.298","0.003","19.804","0.002","90","","91.769","0.002","90","","6725.8","1.8","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(13,27-Dimethyl-3,6,9,17,20,23-hexaazatricyclo[23.3.1.1^11,15^]triaconta- 1(29),2,9,11,13,15(30),16,23,25,27-decaene-29,30-diol- N^3^,N^6^,N^9^,O^29^,O^30^)bis(nitrato-κ^2^O,O')gadolinium(III) nitrate hydrate","","- C26 H36 Gd N9 O12 -","- C26 H36 Gd N9 O12 -","- C208 H288 Gd8 N72 O96 -","8","1","BQ2010","Hu, Xue-Lei; Qiu, Li; Yuan, Jun; Pan, Zhi-Quan","[13,27-Dimethyl-3,6,9,17,20,23-hexaazatricyclo[23.3.1.1^11,15^]triaconta-1(29),2,9,11,13,15(30),16,23,25,27-decaene-29,30-diol-κ^5^<i>N</i>^3^,<i>N</i>^6^,<i>N</i>^9^,<i>O</i>^29^,<i>O</i>^30^]bis(nitrato-κ^2^<i>O</i>,<i>O</i>')gadolinium(III) nitrate monohydrate","Acta Crystallographica Section E","2007","63","5","m1438","m1438","10.1107/S1600536807018144","","","0.71073","MoKα","","0.079","0.0486","","","0.1011","0.1067","","","","","","0.977","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2213149","7.1379","0.0002","11.045","0.0004","11.5179","0.0004","117.252","0.001","100.046","0.002","95.486","0.002","778.75","0.05","160","1","160","1","","","","","","","","4","P -1","-P 1","2","pyrazolocarbazole","Methyl 2,4,5,10-tetrahydropyrazolo[3,4-a]carbazole-3-carboxylate acetic acid solvate","","- C17 H17 N3 O4 -","- C17 H17 N3 O4 -","- C34 H34 N6 O8 -","2","1","BQ2014","A. Thomas Gunaseelan; A. Thiruvalluvar; A. Ebenezer Martin; K. J. Rajendra Prasad","Methyl 2,4,5,10-tetrahydropyrazolo[3,4-<i>a</i>]carbazole-3-carboxylate acetic acid solvate at 160 K","Acta Crystallographica Section E","2007","63","5","o2729","o2730","10.1107/S1600536807020491","","","0.71073","MoKα","","0.0652","0.0545","","","0.1435","0.1524","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213150","9.342","0.006","15.701","0.009","14.822","0.009","90","","90","","90","","2174","2","294","2","294","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Aquadithiocyanato(2,4,6-tri-2-pyridyl-1,3,5-triazine)cobalt(II)","","- C20 H14 Co N8 O S2 -","- C20 H14 Co N8 O S2 -","- C80 H56 Co4 N32 O4 S8 -","4","1","BR2034","Sun, Xiu-Ping; Gu, Wen; Liu, Xin","Aquadithiocyanato(2,4,6-tri-2-pyridyl-1,3,5-triazine)cobalt(II)","Acta Crystallographica Section E","2007","63","5","m1339","m1340","10.1107/S1600536807013335","","","0.71073","MoKα","","0.1369","0.0497","","","0.1016","0.1438","","","","","","1.069","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213151","10.3355","0.0005","10.7847","0.0004","8.9142","0.0004","105.048","0.003","96.461","0.003","125.302","0.002","738.37","0.07","296","2","296","2","","","","","","","","4","P -1","-P 1","2","wilkinsonite","disodium hexairon(II,III) hexasilicon icosaoxide","","- Fe6 Na2 O20 Si6 -","- Fe6 Na2 O20 Si6 -","- Fe12 Na4 O40 Si12 -","2","1","BR2035","Burt, Jason B.; Downs, Robert T.; Costin, Gelu","Single-crystal X-ray refinement of wilkinsonite, Na~2~Fe~4~^2+^Fe~2~^3+^Si~6~O~20~","Acta Crystallographica Section E","2007","63","5","i122","i124","10.1107/S1600536807015048","","","0.71073","MoKα","","0.0857","0.0413","","","0.0763","0.0886","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213152","12.2379","0.0017","11.166","0.0015","25.985","0.004","90","","96.571","0.002","90","","3527.5","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di-μ~2~-acetato-tetrakis(4-aminopyridine)diaquabis(μ~3~-biphenyl-2,2'- dicarboxylato)tricobalt(II) N,N'-dimethylformamide tetrasolvate","","- C64 H78 Co3 N12 O18 -","- C64 H78 Co3 N12 O18 -","- C128 H156 Co6 N24 O36 -","2","0.5","BT2269","Zhang, Zheng; Zhou, Yi-Li; He, Hong-Yin; Yu, Xing","Di-μ~2~-acetato-tetrakis(4-aminopyridine)diaquabis(μ~3~-biphenyl-2,2'-dicarboxylato)tricobalt(II) <i>N</i>,<i>N</i>'-dimethylformamide tetrasolvate","Acta Crystallographica Section E","2007","63","5","m1235","m1236","10.1107/S160053680700983X","","","0.71073","MoKα","","0.1135","0.0634","","","0.1364","0.1583","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213153","10.0184","0.0016","10.5814","0.0017","11.9367","0.0019","84.915","0.002","81.776","0.002","68.88","0.002","1167.3","0.3","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","(<i>N</i>-Salicylidene-valinoto-<i>N,O,O'</i>) di(<i>o</i>-fluorobenzyl)tin(IV)","","- C26 H25 F2 N O3 Sn -","- C26 H25 F2 N O3 Sn -","- C52 H50 F4 N2 O6 Sn2 -","2","1","BT2289","Ding, Ruifang; Zhu, Jun; Zhang, Daodong; Ling, Aixia; Yin, Handong","Bis(2-fluorobenzyl)(<i>N</i>-salicylidenevalinato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>')tin(IV)","Acta Crystallographica Section E","2007","63","5","m1242","m1242","10.1107/S1600536807013840","","","0.71073","MoKα","","0.0278","0.0231","","","0.0521","0.0549","","","","","","1.123","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213154","11.631","0.002","5.5969","0.001","13.577","0.002","90","","99.548","0.003","90","","871.6","0.3","291","","291","","","","","","","","","3","P 1 21 1","P 2yb","4","Cubebin","3,4-bis(1,3-benzodioxol-5-ylmethyl)tetrahydrofuran-2-ol","","- C20 H20 O6 -","- C20 H20 O6 -","- C40 H40 O12 -","2","1","BT2304","Bruno-Colmenárez, Julia; Usubillaga, Alfredo; Khouri, Nancy; Díaz de Delgado, Graciela","Cubebin, a lignan isolated from <i>Aristolochia odoratissima</i> L.","Acta Crystallographica Section E","2007","63","5","o2046","o2047","10.1107/S1600536807013487","","","0.71073","MoKα","","0.1732","0.0527","","","0.0912","0.1214","","","","","","0.989","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213155","7.8711","0.0016","11.766","0.002","13.982","0.003","97.88","0.03","102.84","0.03","107.74","0.04","1172.9","0.6","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Aquaoxalato(2,4,6-tri-2-pyridyl-1,3,5-triazine)zinc(II) tetrahydrate","","- C20 H22 N6 O9 Zn -","- C20 H22 N6 O9 Zn -","- C40 H44 N12 O18 Zn2 -","2","1","BT2305","Hong-Zhen Xie; Wei-Juan Pan","Aquaoxalato(2,4,6-tri-2-pyridyl-1,3,5-triazine)zinc(II) tetrahydrate","Acta Crystallographica Section E","2007","63","5","m1231","m1232","10.1107/S1600536807013517","","","0.71073","MoKα","","0.0408","0.0311","","","0.0824","0.088","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213156","16.827","0.003","12.3","0.002","6.9898","0.0014","90","","90","","90","","1446.7","0.5","210","2","210","","","","","","","","","5","C m c 21","C 2c -2","36","","2,4,6-triamino-1,3,5-triazin-1-ium chloride hemihydrate","","- C3 H8 Cl N6 O0.5 -","- C3 H8 Cl N6 O0.5 -","- C24 H64 Cl8 N48 O4 -","8","1","BT2307","Athikomrattanakul, Umporn; Promptmas, Chamras; Katterle, Martin; Schilde, Uwe","An orthorhombic polymorph of melaminium chloride hemihydrate","Acta Crystallographica Section E","2007","63","5","o2154","o2156","10.1107/S1600536807014791","","","0.71073","MoKα","","0.037","0.0299","","","0.0611","0.0632","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213157","6.013","0.001","15.597","0.003","12.347","0.003","90","","103.34","0.03","90","","1126.7","0.4","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(2S)-1-[(2R)-3-(benzylsulfanyl)-2-(tert-butoxycarbonylamino)propanoyl] tetrahydro-1H-pyrrole-2-methylcarboxylate","","- C21 H30 N2 O5 S -","- C21 H30 N2 O5 S -","- C42 H60 N4 O10 S2 -","2","1","BT2308","Räisänen, Minna T.; Klinga, Martti; Leskelä, Markku; Repo, Timo","(2<i>S</i>)-Methyl 1-[(2<i>R</i>)-3-(benzylsulfanyl)-2-(<i>tert</i>-butoxycarbonylamino)propanoyl]pyrrolidine-2-carboxylate","Acta Crystallographica Section E","2007","63","5","o2095","o2096","10.1107/S1600536807014067","","","0.71073","MoKα","","0.0975","0.0483","","","0.0872","0.1042","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213158","14.3752","0.0009","11.3099","0.0007","37.302","0.002","90","","90","","90","","6064.6","0.6","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C15 H7 Br Cl3 F O -","- C15 H7 Br Cl3 F O -","- C240 H112 Br16 Cl48 F16 O16 -","16","2","BT2309","V. Dhanasekaran; D. Gayathri; D. Velmurugan; K. Ravikumar; M. S. Karthikeyan","2-Bromo-3-(4-chlorophenyl)-1-(2,4-dichloro-5-fluorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2060","o2061","10.1107/S1600536807013852","","","0.71073","MoKα","","0.0683","0.0389","","","0.0923","0.1065","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213159","20.9376","0.0011","10.5821","0.0006","11.0154","0.0006","90","","90","","90","","2440.6","0.2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(3aR,6S,6aR)-6-Benzyl-1-(4-bromophenyl)-5-tosyl-cis- perhydropyrrolo[3,4-b]pyrrole","","- C26 H27 Br N2 O2 S -","- C26 H27 Br N2 O2 S -","- C104 H108 Br4 N8 O8 S4 -","4","1","BT2311","K. N. Vennila; D. Gayathri; D. Velmurugan; K. Ravikumar; M. Poornachandran","(3a<i>R</i>,6<i>S</i>,6a<i>R</i>)-6-Benzyl-1-(4-bromophenyl)-5-tosyl-<i>cis</i>-perhydropyrrolo[3,4-<i>b</i>]pyrrole","Acta Crystallographica Section E","2007","63","5","o2228","o2229","10.1107/S1600536807016194","","","0.71073","MoKα","","0.0709","0.0479","","","0.1418","0.1529","","","","","","1.073","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213160","10.8209","0.0005","10.4195","0.0005","11.2937","0.0005","90","","97.845","0.001","90","","1261.43","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-(2-chloro-5-methyl-3-pyridyl)-3-hydroxy-2-methylenepropanoate","","- C12 H14 Cl N O3 -","- C12 H14 Cl N O3 -","- C48 H56 Cl4 N4 O12 -","4","1","BT2312","G. Y. S. K. Swamy; K. Ravikumar; P. Narender; V. Jayathirtha Rao","Ethyl 3-(2-chloro-5-methyl-3-pyridyl)-3-hydroxy-2-methylenepropanoate","Acta Crystallographica Section E","2007","63","5","o2188","o2189","10.1107/S1600536807014535","","","0.71073","MoKα","","0.0423","0.0389","","","0.108","0.1111","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213161","10.117","0.001","11.898","0.001","10.183","0.001","90","","100.89","0.01","90","","1203.7","0.2","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N-(2,6-dimethylphenyl)-2,2,2-trichloroacetamide","2,2,2-Trichloro-N-(2,6-dimethylphenyl)acetamide","","- C10 H10 Cl3 N O -","- C10 H10 Cl3 N O -","- C40 H40 Cl12 N4 O4 -","4","1","BT2313","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","2,2,2-Trichloro-<i>N</i>-(2,6-dimethylphenyl)acetamide","Acta Crystallographica Section E","2007","63","5","o2343","o2344","10.1107/S1600536807016431","","","1.5418","CuKα","","0.0569","0.0448","","","0.1221","0.1307","","","","","","1.077","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213162","6.452","0.002","7.884","0.003","14.128","0.004","80.11","0.03","77.24","0.03","75.9","0.03","674.5","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","2'-(2-Hydroxy-4-methoxybenzylidene)nicotinohydrazide monohydrate","","- C14 H15 N3 O4 -","- C14 H15 N3 O4 -","- C28 H30 N6 O8 -","2","1","BT2315","Nancy Mathew; Mini Kuriakose; Seena, E. B.; Prathapachandra Kurup, M. R.","2'-(2-Hydroxy-4-methoxybenzylidene)nicotinohydrazide monohydrate","Acta Crystallographica Section E","2007","63","5","o2190","o2191","10.1107/S1600536807014808","","","0.71073","MoKα","","0.0651","0.0462","","","0.1294","0.1484","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213163","12.2053","0.0005","9.4116","0.0004","20.2984","0.0007","90","","126.765","0.0015","90","","1867.91","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N',N''-Triphenylguanidinium hydrogensulfate","","- C19 H19 N3 O4 S -","- C19 H19 N3 O4 S -","- C76 H76 N12 O16 S4 -","4","1","BT2317","Pereira Silva, P. S.; Ramos Silva, M.; Paixão, J. A.; Matos Beja, A.","<i>N</i>,<i>N</i>',<i>N</i>''-Triphenylguanidinium hydrogensulfate","Acta Crystallographica Section E","2007","63","5","o2243","o2245","10.1107/S1600536807014870","","","0.71073","MoKα","","0.0509","0.0347","","","0.0923","0.1032","","","","","","1.019","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213164","9.46","0.001","20.194","0.003","9.496","0.001","90","","90","","90","","1814.1","0.4","299","2","299","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-Chloro-N-(4-nitrophenyl)acetamide","","- C8 H7 Cl N2 O3 -","- C8 H7 Cl N2 O3 -","- C64 H56 Cl8 N16 O24 -","8","1","BT2318","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","2-Chloro-<i>N</i>-(4-nitrophenyl)acetamide","Acta Crystallographica Section E","2007","63","5","o2335","o2336","10.1107/S160053680701567X","","","1.5418","CuKα","","0.0467","0.035","","","0.0935","0.101","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213165","7.2705","0.0006","11.0178","0.0009","12.0137","0.0009","84.776","0.001","85.675","0.001","75.405","0.001","926.06","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-{2-[(4-Nitrobenzylidene)amino]phenyl}-3-phenylthiourea","","- C20 H16 N4 O2 S -","- C20 H16 N4 O2 S -","- C40 H32 N8 O4 S2 -","2","1","BT2319","D. Gayathri; D. Velmurugan; K. Ravikumar; S. Devaraj; M. Kandaswamy","1-{2-[(4-Nitrobenzylidene)amino]phenyl}-3-phenylthiourea","Acta Crystallographica Section E","2007","63","5","o2226","o2227","10.1107/S1600536807016157","","","0.71073","MoKα","","0.0708","0.0561","","","0.1444","0.1545","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213166","10.585","0.002","9.262","0.004","18.848","0.009","90","","90","","90","","1847.8","1.2","299","2","299","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","N-(4-methylphenyl)-2-chloroacetamide","2-Chloro-N-(4-methylphenyl)acetamide","","- C9 H10 Cl N O -","- C9 H10 Cl N O -","- C72 H80 Cl8 N8 O8 -","8","1","BT2320","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","2-Chloro-<i>N</i>-(4-methylphenyl)acetamide","Acta Crystallographica Section E","2007","63","5","o2333","o2334","10.1107/S1600536807015164","","","1.5418","CuKα","","0.1167","0.0972","","","0.2634","0.2879","","","","","","1.076","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213167","6.5423","0.0008","14.3317","0.0016","7.804","0.0009","90","","93.284","0.002","90","","730.52","0.15","293","2","293","2","","","","","","","","6","P 1 c 1","P -2yc","7","","2-Bromo-1-(2,4-dichloro-5-fluorophenyl)-3-phenylprop-2-en-1-one","","- C15 H8 Br Cl2 F O -","- C15 H8 Br Cl2 F O -","- C30 H16 Br2 Cl4 F2 O2 -","2","1","BT2321","V. Dhanasekaran; D. Gayathri; D. Velmurugan; K. Ravikumar; M. S. Karthikeyan","2-Bromo-1-(2,4-dichloro-5-fluorophenyl)-3-phenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2309","o2310","10.1107/S1600536807016145","","","0.71073","MoKα","","0.0332","0.0303","","","0.0758","0.0771","","","","","","0.926","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213168","8.712","0.0004","20.5711","0.001","14.9467","0.0007","90","","99.322","0.001","90","","2643.3","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Benzylidene-1-phenyl-2'',3''-dihydropiperidine-3-spiro-2'-pyrrolizidine- 3'-spiro-3''-1H-indole-4,2''-dione","","- C32 H31 N3 O2 -","- C32 H31 N3 O2 -","- C128 H124 N12 O8 -","4","1","BT2322","V. Vinodh Kumar; D. Gayathri; D. Velmurugan; K. Ravikumar; Gowri Sridhar","5-Benzylidene-1-phenyl-2'',3''-dihydropiperidine-3-spiro-2'-pyrrolizidine-3'-spiro-3''-1<i>H</i>-indole-4,2''-dione","Acta Crystallographica Section E","2007","63","5","o2211","o2212","10.1107/S160053680701519X","","","0.71073","MoKα","","0.069","0.052","","","0.1302","0.1419","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213169","13.2463","0.0007","10.0112","0.0006","20.9518","0.0012","90","","101.688","0.001","90","","2720.8","0.3","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-[3-(4-Ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-4-nitro-2,5- diphenylisoxazolidine","","- C32 H28 N4 O4 -","- C32 H28 N4 O4 -","- C128 H112 N16 O16 -","4","1","BT2323","D. Gayathri; D. Velmurugan; K. Ravikumar; K. Karthikeyan; P. T. Perumal","3-[3-(4-Ethoxyphenyl)-1-phenyl-1<i>H</i>-pyrazol-4-yl]-4-nitro-2,5-diphenylisoxazolidine","Acta Crystallographica Section E","2007","63","5","o2216","o2217","10.1107/S160053680701522X","","","0.71073","MoKα","","0.0652","0.0512","","","0.1338","0.1443","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213170","8.2996","0.001","9.0014","0.0011","23.21","0.003","90","","91.474","0.002","90","","1733.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3,7-Trimethylxanthenium 2,4,6-trinitrophenolate","","- C14 H13 N7 O9 -","- C14 H13 N7 O9 -","- C56 H52 N28 O36 -","4","1","BT2324","A. Chandramohan; D. Gayathri; D. Velmurugan; K. Ravikumar; M. A. Kandaswamy","1,3,7-Trimethylxanthenium 2,4,6-trinitrophenolate","Acta Crystallographica Section E","2007","63","5","o2495","o2496","10.1107/S1600536807017825","","","0.71073","MoKα","","0.0581","0.0463","","","0.1287","0.1396","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213171","9.555","0.003","8.512","0.0019","9.906","0.002","90","","94.95","0.02","90","","802.7","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","cis-(Piperidine-2,6-diyl)dimethanol","","- C7 H15 N O2 -","- C7 H15 N O2 -","- C28 H60 N4 O8 -","4","1","BT2325","Hartung, Jens; Stapf, Georg; Bergsträsser, Uwe","<i>cis</i>-(Piperidine-2,6-diyl)dimethanol","Acta Crystallographica Section E","2007","63","5","o2586","o2587","10.1107/S1600536807017771","","","0.71073","MoKα","","","0.0306","","","","0.0832","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213172","12.8167","0.0013","8.2176","0.0008","12.5848","0.0012","90","","113.068","0.002","90","","1219.5","0.2","273","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Nitro-2-[(phenylhydrazono)methyl]phenol","","- C13 H11 N3 O3 -","- C13 H11 N3 O3 -","- C52 H44 N12 O12 -","4","1","BT2326","D. Gayathri; D. Velmurugan; K. Ravikumar; D. Saravanakumar; M. Kandaswamy","4-Nitro-2-[(phenylhydrazono)methyl]phenol","Acta Crystallographica Section E","2007","63","5","o2224","o2225","10.1107/S1600536807015486","","","0.71073","MoKα","","0.0543","0.0482","","","0.1429","0.15","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213173","6.959","0.001","8.207","0.001","8.759","0.001","96.93","0.01","111.05","0.01","99.78","0.01","451.02","0.11","299","2","299","2","","","","","","","","5","P -1","-P 1","2","N-(3-nitrophenyl)-methanesulfonamide","N-(3-nitrophenyl)methanesulfonamide","","- C7 H8 N2 O4 S -","- C7 H8 N2 O4 S -","- C14 H16 N4 O8 S2 -","2","1","BT2328","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(3-Nitrophenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","5","o2337","o2337","10.1107/S1600536807015693","","","1.5418","CuKα","","0.0539","0.0419","","","0.101","0.105","","","","","","1.084","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213174","23.218","0.002","8.4933","0.0007","9.2561","0.0008","90","","90","","90","","1825.3","0.3","299","2","299","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","Methanesulfon-3-methylanilide","N-(3-Methylphenyl)methanesulfonamide","","- C8 H11 N O2 S -","- C8 H11 N O2 S -","- C64 H88 N8 O16 S8 -","8","1","BT2331","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(3-Methylphenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","5","o2338","o2338","10.1107/S1600536807016443","","","1.5418","CuKα","","0.1096","0.0477","","","0.1057","0.124","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213175","14.6795","0.0007","6.2247","0.0003","25.2114","0.0012","90","","99.9052","0.0016","90","","2269.36","0.19","170","2","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","poly[(μ~4~2,5-dichloro-3,6-dihydroxy-1,4-benzoquinonato)bis[1,2- benzisothiazol-3(2H)-one 1,1-dioxide]disodium(I)]","","- C20 H10 Cl2 N2 Na2 O10 S2 -","- C20 H10 Cl2 N2 Na2 O10 S2 -","- C80 H40 Cl8 N8 Na8 O40 S8 -","4","0.5","BT2333","Refat, Moamen S.; Hashem, Hassan A.; Gotoh, Kazuma; Ishida, Hiroyuki","Poly[(μ~4~-chloranilato)bis(saccharin)disodium(I)]","Acta Crystallographica Section E","2007","63","5","m1383","m1384","10.1107/S1600536807016728","","","0.71075","MoKα","","0.0405","0.0349","","","0.0858","0.0894","","","","","","1.047","","","","has coordinates,has Fobs","197043","2020-10-21","18:00:00",""
"2213176","21.379","0.003","8.6247","0.001","17.475","0.002","90","","111.697","0.002","90","","2993.9","0.6","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[N,N'-Bis(pyrrol-2-ylmethylene)cyclohexane-1,2-diaminato-κ^4^N]nickel(II)","","- C16 H18 N4 Ni -","- C16 H18 N4 Ni -","- C128 H144 N32 Ni8 -","8","2","BT2334","Chen, Jia-Mei; Ruan, Wen-Juan; Gao, Feng; Zhang, Ying-Hui; Zhu, Zhi-Ang","[<i>N</i>,<i>N</i>'-Bis(pyrrol-2-ylmethylene)cyclohexane-1,2-diaminato-κ^4^<i>N</i>]nickel(II)","Acta Crystallographica Section E","2007","63","5","m1546","m1546","10.1107/S1600536807020673","","","0.71073","MoKα","","0.0957","0.061","","","0.1247","0.1358","","","","","","1.154","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213177","7.0649","0.0006","21.5994","0.0017","9.552","0.0007","90","","97.925","0.006","90","","1443.7","0.2","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-[(2-furylmethyl)sulfanyl]-1H-3,1-benzimidazol-3-ium chloride dihydrate","","- C12 H15 Cl N2 O3 S -","- C12 H15 Cl N2 O3 S -","- C48 H60 Cl4 N8 O12 S4 -","4","1","BT2335","Sema Öztürk Yıldırım; Mehmet Akkurt; Nihat Şireci; Hasan Küçükbay; Canan Kazak","2-[(2-Furylmethyl)sulfanyl]-1<i>H</i>-3,1-benzimidazol-3-ium chloride dihydrate","Acta Crystallographica Section E","2007","63","5","o2433","o2433","10.1107/S160053680701673X","","","0.71073","MoKα","","0.067","0.0364","","","0.0859","0.0934","","","","","","0.839","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213178","17.133","0.003","17.062","0.003","20.13","0.004","90","","93.02","0.04","90","","5876.3","1.9","296","2","296","2","","","","","","","","4","C 1 c 1","C -2yc","9","","Ethyl [5-(2-hydroxyphenyl)-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]oxoacetate","","- C14 H16 N2 O4 -","- C14 H16 N2 O4 -","- C224 H256 N32 O64 -","16","4","BT2337","Kettmann, Viktor; Světlík Jan; Veizerová Lucia","Ethyl [5-(2-hydroxyphenyl)-3-methyl-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]oxoacetate","Acta Crystallographica Section E","2007","63","5","o2607","o2608","10.1107/S1600536807019083","","","0.71073","MoKα","","0.1497","0.0672","","","0.1489","0.1858","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213179","9.7474","0.0006","5.766","0.0003","16.378","0.001","90","","97.272","0.006","90","","913.1","0.09","299","2","299","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Methanesulfon-4-bromoanilide","<i>N</i>-(4-Bromophenyl)methanesulfonamide","","- C7 H8 Br N O2 S -","- C7 H8 Br N O2 S -","- C28 H32 Br4 N4 O8 S4 -","4","1","BT2338","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(4-Bromophenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","5","o2597","o2597","10.1107/S1600536807019009","","","1.5418","CuKα","","0.0286","0.0258","","","0.0706","0.0723","","","","","","1.081","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213180","18.883","0.003","10.9652","0.0016","12.4783","0.0018","90","","116.948","0.002","90","","2303.2","0.6","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Propyl 3-(3,4-dihydroxyphenyl)prop-2-enoate","","- C12 H14 O4 -","- C12 H14 O4 -","- C96 H112 O32 -","8","1","BT2339","Chun-Nian Xia; Wei-Xiao Hu; Wei Zhou","Propyl 3-(3,4-dihydroxyphenyl)prop-2-enoate","Acta Crystallographica Section E","2007","63","5","o2482","o2482","10.1107/S1600536807017849","","","0.71073","MoKα","","0.0473","0.0345","","","0.0908","0.1005","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213181","8.9104","0.0005","9.9136","0.0005","15.8574","0.0008","87.742","0.001","78.019","0.001","71.805","0.001","1301.24","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","5,5'-(1,3-Phenylenedimethylene)bis(2-amino-4-tert-butylthiazol-3-ium) dibromide monohydrate","","- C22 H34 Br2 N4 O S2 -","- C22 H34 Br2 N4 O S2 -","- C44 H68 Br4 N8 O2 S4 -","2","1","BT2340","Ai-Xi Hu; Jian-Yu Zhang; Gao Cao; Juan-Juan Xu; Lin Xia","5,5'-(1,3-Phenylenedimethylene)bis(2-amino-4-<i>tert</i>-butylthiazol-3-ium) dibromide monohydrate","Acta Crystallographica Section E","2007","63","5","o2533","o2533","10.1107/S1600536807018296","","","0.71073","MoKα","","0.0476","0.0304","","","0.0871","0.1118","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213182","9.4439","0.0005","14.5569","0.0008","12.1926","0.0006","90","","102.988","0.001","90","","1633.28","0.15","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-Amino-4-tert-butyl-5-(2-chlorobenzyl)thiazol-3-ium bromide","","- C14 H18 Br Cl N2 S -","- C14 H18 Br Cl N2 S -","- C56 H72 Br4 Cl4 N8 S4 -","4","1","BT2341","Gao Cao; Ai-Xi Hu; Juan-Juan Xu; Lin Xia","2-Amino-4-<i>tert</i>-butyl-5-(2-chlorobenzyl)thiazol-3-ium bromide","Acta Crystallographica Section E","2007","63","5","o2534","o2534","10.1107/S1600536807018065","","","0.71073","MoKα","","0.0676","0.0532","","","0.1441","0.1578","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213183","10.512","0.002","22.327","0.005","15.734","0.003","90","","91.95","0.03","90","","3690.7","1.3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[2-(1-Acetoxyethyl)-1,1'-bis(diphenylphosphino)ferrocene- κ^2^P,P']dichloridoplatinum(II) dichloromethane solvate","","- C39 H36 Cl4 Fe O2 P2 Pt -","- C39 H36 Cl4 Fe O2 P2 Pt -","- C156 H144 Cl16 Fe4 O8 P8 Pt4 -","4","1","BT2342","Spencer, Lara C.; Bjelosevic, Haris","[2-(1-Acetoxyethyl)-1,1'-bis(diphenylphosphino)ferrocene-κ^2^<i>P</i>,<i>P</i>']dichloridoplatinum(II) dichloromethane solvate","Acta Crystallographica Section E","2007","63","5","m1536","m1536","10.1107/S1600536807020144","","","0.71073","Mo-Kα","","0.0315","0.0251","","","0.0586","0.0615","","","","","","1.035","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213184","23.614","0.011","5.698","0.003","14.232","0.006","90","","96.557","0.008","90","","1902.4","1.6","294","2","294","2","","","","","","","","4","C 1 2 1","C 2y","5","","3-(4-Chlorophenyl)-5-(4-methylphenyl)-1-phenyl-2-pyrazoline","","- C22 H19 Cl N2 -","- C22 H19 Cl N2 -","- C88 H76 Cl4 N8 -","4","1","BT2344","Huan-Mei Guo; Fang-Fang Jian; Pu-Su Zhao; Ben-Yu Huang; Cui-Hua Lin","3-(4-Chlorophenyl)-5-(4-methylphenyl)-1-phenyl-2-pyrazoline","Acta Crystallographica Section E","2007","63","5","o2622","o2622","10.1107/S1600536807018867","","","0.71073","MoKα","","0.11","0.0549","","","0.1185","0.145","","","","","","0.975","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213185","8.1933","0.0007","8.8144","0.0007","35.209","0.003","90","","90","","90","","2542.8","0.4","292","2","292","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","catena-Poly[[[aquacopper(II)]-μ-[(E)-2-(4-oxopentan-2-ylideneamino)benzoato- κ^4^O,N,O':O''] monohydrate]","","- C12 H15 Cu N O5 -","- C12 H15 Cu N O5 -","- C96 H120 Cu8 N8 O40 -","8","1","BT2346","Minna Cao; Shao-Min Shi; Fei-Hua Luo; Cui-Xia Cheng; Zong-Qiu Hu","<i>catena</i>-Poly[[[aquacopper(II)]-μ-[(<i>E</i>)-2-(4-oxopentan-2-ylideneamino)benzoato-κ^4^<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>'']] monohydrate]","Acta Crystallographica Section E","2007","63","5","m1494","m1494","10.1107/S1600536807019514","","","0.71073","MoKα","","0.0655","0.0474","","","0.1064","0.1243","","","","","","0.991","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213186","15.4","0.005","8.5728","0.0016","14.202","0.005","90","","90","","90","","1875","1","292","2","292","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","Chlorido(ethylenediamine-κ^2^N)(η^5^-pentamethylcyclopentadienyl)iridium(III) trifluoromethanesulfonate","","- C13 H23 Cl F3 Ir N2 O3 S -","- C13 H23 Cl F3 Ir N2 O3 S -","- C52 H92 Cl4 F12 Ir4 N8 O12 S4 -","4","0.5","BT2350","Michael Scharwitz; Tobias van Almsick; William S. Sheldrick","Chlorido(ethylenediamine-κ^2^<i>N</i>)(η^5^-pentamethylcyclopentadienyl)iridium(III) trifluoromethanesulfonate","Acta Crystallographica Section E","2007","63","5","m1469","m1470","10.1107/S1600536807019575","","","0.71073","MoKα","","0.0624","0.037","","","0.0731","0.0794","","","","","","0.992","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213187","16.85","0.003","13.656","0.003","21.441","0.004","90","","105.908","0.015","90","","4744.7","1.6","110","2","110","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[tris(<i>p</i>-xylylenediaminium) [tetradeca-μ-oxo- hexadecanonamolybdate(VI)] dihydrate]","","- C24 H46 Mo9 N6 O32 -","- C24 H46 Mo9 N6 O32 -","- C96 H184 Mo36 N24 O128 -","4","0.5","BV2050","Nelson, James H.; Narducci Sarjeant, Amy; Norquist, Alexander J.","Poly[tris(<i>p</i>-xylylenediaminium) [tetradeca-μ-oxo-hexadecanonamolybdate(VI)] dihydrate]","Acta Crystallographica Section E","2007","63","5","m1442","m1444","10.1107/S1600536807018557","","","0.71073","MoKα","","0.04","0.021","","0.0468","0.0468","0.0468","","","","","","0.8603","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213188","12.5862","0.0008","6.795","0.0004","15.8427","0.001","90","","108.386","0.001","90","","1285.75","0.14","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Benzyl (2-formylphenyl)carbamate","","- C15 H13 N O3 -","- C15 H13 N O3 -","- C60 H52 N4 O12 -","4","1","BV2052","Walji, Dhiran V. B.; Storey, John M. D.; Harrison, William T. A.","Benzyl <i>N</i>-(2-formylphenyl)carbamate","Acta Crystallographica Section E","2007","63","5","o2120","o2121","10.1107/S1600536807015516","","","0.71073","MoKα","","0.0805","0.0551","","","0.1477","0.1664","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213189","9.4468","0.001","14.1354","0.0015","17.5228","0.0019","110.147","0.0016","98.3972","0.0017","100.614","0.0016","2102.8","0.4","193","2","","","","","","","","","","5","P -1","-P 1","2","","(2^3^-<i>tert</i>-Butyl-5,10,15,20-tetraphenylazuliporphyrinato)palladium(II) dichloromethane solvate","","- C55 H41 Cl2 N3 Pd -","- C55 H41 Cl2 N3 Pd -","- C110 H82 Cl4 N6 Pd2 -","2","1","BV2053","Gregory M. Ferrence; Timothy D. Lash","(2^3^-<i>tert</i>-Butyl-5,10,15,20-tetraphenylazuliporphyrinato)palladium(II) dichloromethane solvate","Acta Crystallographica Section E","2007","63","5","m1351","m1353","10.1107/S1600536807015528","","","0.71073","MoKα","","","0.0557","","","","0.1664","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213190","10.13","0.001","8.736","0.001","7.657","0.001","90","","98.68","0.01","90","","669.85","0.13","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans 2-hydroxycyclopentan-2-aminium chloride","","- C5 H12 Cl N O -","- C5 H12 Cl N O -","- C20 H48 Cl4 N4 O4 -","4","1","BV2054","Zheng, Heping; Gawlicka-Chruszcz, Anna; Cymborowski, Marcin; Minor, Wladek","<i>trans</i>-1-Hydroxycyclopentan-2-aminium chloride","Acta Crystallographica Section E","2007","63","5","o2697","o2698","10.1107/S1600536807018958","","","0.71074","MoKα","","0.0374","0.0306","","","0.0761","0.0789","","","","","","0.903","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213191","16.7613","0.0016","7.4192","0.0005","20.856","0.002","90","","90","","90","","2593.6","0.4","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-Nitro-1-(phenylsulfonyl)-1H-indole","","- C14 H10 N2 O4 S -","- C14 H10 N2 O4 S -","- C112 H80 N16 O32 S8 -","8","1","BV2055","Roy, Sujata; Gribble, Gordon W.; Jasinski, Jerry P.","2-Nitro-1-(phenylsulfonyl)-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","5","o2628","o2629","10.1107/S160053680701896X","","","0.7107","MoKα","","0.0726","0.0581","","","0.1172","0.1238","","","","","","1.155","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213192","7.444","0.0015","8.546","0.0017","12.257","0.003","77.86","0.03","81.28","0.03","83.18","0.03","750.4","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","3-(2,4-Dichlorophenyl)-3-hydroxy-1-(3-nitrophenyl)propan-1-one","","- C15 H11 Cl2 N O4 -","- C15 H11 Cl2 N O4 -","- C30 H22 Cl4 N2 O8 -","2","1","BX2066","Luo, Zhi-Gang","3-(2,4-Dichlorophenyl)-3-hydroxy-1-(3-nitrophenyl)propan-1-one","Acta Crystallographica Section E","2007","63","5","o2563","o2564","10.1107/S1600536807018338","","","0.71073","MoKα","","0.126","0.0633","","","0.1271","0.1528","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213193","17.32348","0.00016","17.32348","0.00016","17.32348","0.00016","90","","90","","90","","5198.83","0.08","120","2","120","2","","","","","","","","7","P 21 3","P 2ac 2ab 3","198","","μ~3~-Trithiocyanurato-κ^6^N^1^,S^2^:N^3^,S^4^:N^5^,S^6^)tris[(N,N,N',N'',N''- pentamethyldiethylenetriamine-κ^3^N,N',N'')zinc(II)] tris(perchlorate)","","- C30 H69 Cl3 N12 O12 S3 Zn3 -","- C30 H69 Cl3 N12 O12 S3 Zn3 -","- C120 H276 Cl12 N48 O48 S12 Zn12 -","4","0.333333","BX2070","Marek, Jaromír; Trávníček, Zdeněk; Čermáková, Šárka","(μ~3~-Trithiocyanurato-κ^6^<i>N</i>^1^,<i>S</i>^2^:<i>N</i>^3^,<i>S</i>^4^:<i>N</i>^5^,<i>S</i>^6^)tris[(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''-pentamethyldiethylenetriamine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')zinc(II)] tris(perchlorate)","Acta Crystallographica Section E","2007","63","5","m1411","m1413","10.1107/S1600536807016595","","","0.71073","MoKα","","0.0371","0.0233","","","0.0615","0.0763","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213194","5.0453","0.0005","12.642","0.001","16.508","0.002","90","","95.556","0.002","90","","1047.98","0.18","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H10 O4 S -","- C11 H10 O4 S -","- C44 H40 O16 S4 -","4","1","BX2071","Choi, Hong Dae; Seo, Pil Ja; Jong Back Lee; Son, Byeng Wha; Lee, Uk","2-Methyl-5,6-methylenedioxy-3-methylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2007","63","5","o2050","o2051","10.1107/S160053680701375X","","","0.71073","MoKα","","0.1069","0.0949","","","0.1981","0.2023","","","","","","1.35","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213195","12.094","0.005","5.756","0.003","12.503","0.006","90","","118.18","0.02","90","","767.2","0.6","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(<i>R</i>,<i>R</i>)-(+)-2-(2-Methacryloyloxy)-1,2-diphenylethanol","","- C18 H18 O3 -","- C18 H18 O3 -","- C36 H36 O6 -","2","1","BX2072","Rodríguez de Barbarín, Cecilia; Percino, M. Judith; Chapela, Victor M.; Alcantarilla, Tony","(<i>R</i>,<i>R</i>)-(+)-2-(2-Methacryloyloxy)-1,2-diphenylethanol","Acta Crystallographica Section E","2007","63","5","o2684","o2685","10.1107/S1600536807019174","","","0.71073","MoKα","","0.0911","0.0456","","","0.1111","0.1402","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213196","16.74","0.003","11.796","0.002","12.558","0.003","90","","113.3","0.03","90","","2277.5","0.9","295","2","295","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Iodidobis(1,10-phenanthroline)copper(II) perchlorate","","- C24 H16 Cl Cu I N4 O4 -","- C24 H16 Cl Cu I N4 O4 -","- C96 H64 Cl4 Cu4 I4 N16 O16 -","4","0.5","BX2075","Fan Zhang; Xie, Cheng-Zhi; Wang, Xiao-Qing; Shen, Guang-Qiu; Shen, De-Zhong","Iodidobis(1,10-phenanthroline)copper(II) perchlorate","Acta Crystallographica Section E","2007","63","5","m1531","m1531","10.1107/S160053680702048X","","","0.71073","MoKα","","0.0697","0.0611","","","0.1561","0.1645","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213197","13.902","0.011","8.123","0.007","18.021","0.014","90","","98.883","0.014","90","","2011","3","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,4,5-Trimethoxy-1-methylbenzene","","- C10 H14 O3 -","- C10 H14 O3 -","- C80 H112 O24 -","8","2","BX2079","Li, Jian; Liang, Zu-Pei; Wan, Ai-Yu; Zeng, Wu-Lan","3,4,5-Trimethoxy-1-methylbenzene","Acta Crystallographica Section E","2007","63","5","o2765","o2765","10.1107/S1600536807020648","","","0.71073","MoKα","","0.0917","0.0454","","","0.1137","0.1456","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213198","14.381","0.0011","9.8124","0.0007","19.7757","0.0015","90","","92.56","0.005","90","","2787.8","0.4","296.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Benzyltributylammonium 4-hydroxynaphthalene-1-sulfonate","","- C29 H41 N O4 S -","- C29 H41.16 N O4 S -","- C116 H164.64 N4 O16 S4 -","4","1","CF2084","Mizuguchi, Jin; Sato, Yohei; Uta, Kazuya; Sato, Kazuyuki","Benzyltributylammonium 4-hydroxynaphthalene-1-sulfonate","Acta Crystallographica Section E","2007","63","5","o2509","o2510","10.1107/S1600536807017709","","","1.54187","CuKα","","","0.0487","","","","0.1624","","","","","","1.193","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213199","23.735","0.006","7.543","0.002","16.468","0.004","90","","125.137","0.002","90","","2411.1","1.1","298","2","298","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Octamethyl-1κ^2^C,2κ^2^C,3κ^2^C,4κ^2^C- di-μ~2~-2-methylpyrazine-5-carboxylato-1:2κ^2^O:O;3:\ 4κ^2^O:O-bis(2-methylpyrazine-5-carboxylato)-1κO,\ 4κO-di-μ~3~-oxido-1:2:3κ^3^O:O:O;2:3:\ 4κ^3^O:O:O-tetratin(IV) hexahydrate","","- C32 H56 N8 O16 Sn4 -","- C32 H56 N8 O16 Sn4 -","- C64 H112 N16 O32 Sn8 -","2","0.25","CF2092","Junying Li; Harrison, William T. A.; Tianduo Li","Octamethyl-1κ^2^<i>C</i>,2κ^2^<i>C</i>,3κ^2^<i>C</i>,4κ^2^<i>C</i>-bis(μ~2~-2-methylpyrazine-5-carboxylato)-1:2κ^2^<i>O</i>:<i>O</i>;3:4κ^2^<i>O</i>:<i>O</i>-bis(2-methylpyrazine-5-carboxylato)-1κ<i>O</i>,4κ<i>O</i>-di-μ~3~-oxido-1:2:3κ^3^<i>O</i>:<i>O</i>:<i>O</i>;2:3:4κ^3^<i>O</i>:<i>O</i>:<i>O</i>-tetratin(IV) hexahydrate","Acta Crystallographica Section E","2007","63","5","m1246","m1248","10.1107/S1600536807013888","","","0.71073","MoKα","","0.0515","0.0304","","","0.0649","0.0786","","","","","","1.094","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213200","12.4859","0.0003","16.601","0.0005","8.7947","0.0002","90","","109.427","0.001","90","","1719.16","0.08","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","regiolone","(4RS)-4,8-Dihydroxy-3,4-dihydronaphthalen-1(2H)-one","","- C10 H10 O3 -","- C10 H10 O3 -","- C80 H80 O24 -","8","2","CF2098","Liu, Jun-Xi; Di, Duo-Long; Li, Chen; Huang, Xin-Yi","Regiolone from the pericarps of <i>Juglans regia</i> L.","Acta Crystallographica Section E","2007","63","5","o2713","o2714","10.1107/S1600536807019976","","","0.71073","MoKα","","0.078","0.0402","","","0.0578","0.0628","","","","","","1.115","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213201","11.7453","0.0002","14.7704","0.0002","21.1302","0.0003","97.582","0.001","94.641","0.001","105.55","0.001","3474.62","0.09","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","Bis[1,2-bis(diphenylphosphino)ethane-κ^2^P,P']silver(I) bis(chlorodifluoroacetato-κO)(cyclohexyl)diphenylstannate(IV)","","- C74 H69 Ag Cl2 F4 O4 P4 Sn -","- C74 H69 Ag Cl2 F4 O4 P4 Sn -","- C148 H138 Ag2 Cl4 F8 O8 P8 Sn2 -","2","1","CI2314","Teo, Yin Yin; Lo, Kong Mun; Ng, Seik Weng","Bis[1,2-bis(diphenylphosphino)ethane-κ^2^<i>P</i>,<i>P</i>']silver(I) bis(chlorodifluoroacetato-κ<i>O</i>)(cyclohexyl)diphenylstannate(IV)","Acta Crystallographica Section E","2007","63","5","m1365","m1367","10.1107/S1600536807016662","","","0.71073","MoKα","","0.066","0.049","","","0.142","0.168","","","","","","1.3","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213202","6.5915","0.0013","9.95","0.002","10.546","0.002","90","","105.73","0.03","90","","665.8","0.2","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","poly[aqua(μ~3~-1H-imidazole-4,5-dicarboxylato)cadmium(II)]","","- C5 H4 Cd N2 O5 -","- C5 H4 Cd N2 O5 -","- C20 H16 Cd4 N8 O20 -","4","1","CI2316","Zhang, Xian-Fa; Gao, Shan; Huo, Li-Hua; Zhao, Hui","A two-dimensional cadmium(II) coordination polymer with unusual 4.8^2^ topology: poly[aqua(μ~3~-1<i>H</i>-imidazole-4,5-dicarboxylato)cadmium(II)]","Acta Crystallographica Section E","2007","63","5","m1314","m1316","10.1107/S1600536807016091","","","0.71073","MoKα","","0.0187","0.0174","","","0.0421","0.0426","","","","","","1.072","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213203","33.905","0.007","9.6566","0.0019","23.237","0.005","90","","129.5","0.03","90","","5870","3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(5-Carboxy-1H-pyrazole-3-carboxylato-κ^2^N^2^,O^3^)bis(1,10-phenanthroline- κ^2^N,N')cobalt(III) perchlorate 2.5-hydrate","","- C29 H23 Cl Co N6 O10.5 -","- C29 H23 Cl Co N6 O10.5 -","- C232 H184 Cl8 Co8 N48 O84 -","8","1","CI2317","Xie, Hui-Dong; Xie, Cheng-Zhi; Wang, Xiao-Qing; Shen, Guang-Qiu; Shen, De-Zhong","(5-Carboxy-1<i>H</i>-pyrazole-3-carboxylato-κ^2^<i>N</i>^2^,<i>O</i>^3^)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(III) perchlorate 2.5-hydrate","Acta Crystallographica Section E","2007","63","5","m1477","m1479","10.1107/S1600536807018703","","","0.71073","MoKα","","0.0583","0.0441","","","0.1193","0.1288","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213204","11.2689","0.0008","35.612","0.002","8.8848","0.0006","90","","99.785","0.001","90","","3513.7","0.4","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","Ethyl 2-(1H-indol-3-yl)-5-[1-(4-methoxyphenyl)-4-oxo-3-phenylazetidin-2-yl]- 4-nitro-3-(p-tolyl)pyrrolidine-2-carboxylate","","- C39 H38 N4 O6 -","- C39 H38 N4 O6 -","- C156 H152 N16 O24 -","4","1","CI2318","G. T. Sruthi; D. Gayathri; D. Velmurugan; K. Ravikumar; N. Arumugam","Ethyl 2-(1<i>H</i>-indol-3-yl)-5-[1-(4-methoxyphenyl)-4-oxo-3-phenylazetidin-2-yl]-4-nitro-3-(<i>p</i>-tolyl)pyrrolidine-2-carboxylate","Acta Crystallographica Section E","2007","63","5","o2221","o2223","10.1107/S1600536807014274","","","0.71073","MoKα","","0.0572","0.0526","","","0.1394","0.147","","","","","","1.127","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213205","14.7207","0.0008","9.1692","0.0005","20.6819","0.0011","90","","109.461","0.001","90","","2632.1","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2R,3aR,4S,6aR,7aR)-cis-4-Benzyl-2-(4-bromophenyl)-5-(4- methylphenylsulfonyl)perhydrothiazolidino[3,4-a]pyrrolo[4,5-c]pyrrole","","- C28 H29 Br N2 O2 S2 -","- C28 H29 Br N2 O2 S2 -","- C112 H116 Br4 N8 O8 S8 -","4","1","CI2319","Navin V. Narayanan; D. Gayathri; D. Velmurugan; K. Ravikumar; M. Poornachandran","(2<i>R</i>,3a<i>R</i>,4<i>S</i>,6a<i>R</i>,7a<i>R</i>)-<i>cis</i>-4-Benzyl-2-(4-bromophenyl)-5-(4-methylphenylsulfonyl)perhydrothiazolidino[3,4-<i>a</i>]pyrrolo[4,5-<i>c</i>]pyrrole","Acta Crystallographica Section E","2007","63","5","o2213","o2215","10.1107/S1600536807014298","","","0.71073","MoKα","","0.0703","0.046","","","0.1157","0.1296","","","","","","0.971","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213206","26.1766","0.0015","8.1726","0.0005","17.7838","0.001","90","","90","","90","","3804.5","0.4","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","1'-Nitro-2'-(3-nitrophenyl)-2',3',5',6',7',7a'-hexahydroindan-2-spiro- 3'-1'H-pyrrolizine-1,3-dione","","- C21 H17 N3 O6 -","- C21 H17 N3 O6 -","- C168 H136 N24 O48 -","8","1","CI2320","C. Remya; D. Gayathri; D. Velmurugan; K. Ravikumar; M. Poornachandran","1'-Nitro-2'-(3-nitrophenyl)-2',3',5',6',7',7a'-hexahydroindan-2-spiro-3'-1'<i>H</i>-pyrrolizine-1,3-dione","Acta Crystallographica Section E","2007","63","5","o2218","o2220","10.1107/S1600536807014286","","","0.71073","MoKα","","0.086","0.0597","","","0.1701","0.1945","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213207","7.8671","0.0004","13.6413","0.0007","17.42","0.0009","90","","90","","90","","1869.47","0.17","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","6-ethyl-1-(p-flurophenyl)-5-benzene sulfonyloctahydro-cis-\ pyrrolo[3,4-b]pyrrole","","- C20 H23 F N2 O2 S -","- C20 H23 F N2 O2 S -","- C80 H92 F4 N8 O8 S4 -","4","1","CI2323","S. Sundaramoorthy; D. Gayathri; D. Velmurugan; K. Ravikumar; M. Poornachandran","6-Ethyl-1-(4-fluorophenyl)-5-(phenylsulfonyl)perhydro-<i>cis</i>-pyrrolo[3,4-<i>b</i>]pyrrole","Acta Crystallographica Section E","2007","63","5","o2057","o2059","10.1107/S1600536807013943","","","0.71073","MoKα","","0.0681","0.0569","","","0.1406","0.1502","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213208","7.942","0.003","6.751","0.002","21.964","0.008","90","","108.861","0.012","90","","1114.4","0.7","297","2","297","2","","","","","","","","6","P 1 c 1","P -2yc","7","","2-[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]-1-methylquinolinium 4-bromobenzenesulfonate","","- C25 H22 Br N O5 S -","- C25 H22 Br N O5 S -","- C50 H44 Br2 N2 O10 S2 -","2","1","CI2324","Suchada Chantrapromma; Boonwasana Jindawong; Hoong-Kun Fun; P. S. Patil","2-[(<i>E</i>)-2-(3-Hydroxy-4-methoxyphenyl)ethenyl]-1-methylquinolinium 4-bromobenzenesulfonate","Acta Crystallographica Section E","2007","63","5","o2124","o2126","10.1107/S1600536807014213","","","0.71073","MoKα","","0.0418","0.0372","","","0.0878","0.0903","","","","","","0.966","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213209","7.7234","0.0014","7.9089","0.0015","10.479","0.0019","85.374","0.003","74.614","0.003","76.403","0.003","599.74","0.19","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Bis[μ-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide- κ^2^N^1^,N^3^]disilver(I) bis(perchlorate)","","- C16 H12 Ag2 Cl2 N8 O10 S2 -","- C16 H12 Ag2 Cl2 N8 O10 S2 -","- C16 H12 Ag2 Cl2 N8 O10 S2 -","1","0.5","CI2325","Wang, Duo-Zhi; Tong, Xiao-Lan; Li, Jian-Rong","Bis[μ-<i>N</i>-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide-κ^2^<i>N</i>^1^,<i>N</i>^3^]disilver(I) bis(perchlorate)","Acta Crystallographica Section E","2007","63","5","m1294","m1296","10.1107/S1600536807016066","","","0.71073","MoKα","","0.042","0.0299","","","0.066","0.0714","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213210","7.9894","0.0002","18.8355","0.0005","12.9451","0.0004","90","","90","","90","","1948.03","0.09","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","cis-1-(4-Bromophenyl)-6-ethyl-5-(phenylsulfonyl)perhydropyrrolo[3,4-b]pyrrole","","- C20 H23 Br N2 O2 S -","- C20 H23 Br N2 O2 S -","- C80 H92 Br4 N8 O8 S4 -","4","1","CI2326","S. Nirmala; K. Palani; L. Sudha; M. Poornachandran; R. Raghunathan","<i>cis</i>-1-(4-Bromophenyl)-6-ethyl-5-(phenylsulfonyl)perhydropyrrolo[3,4-<i>b</i>]pyrrole","Acta Crystallographica Section E","2007","63","5","o2254","o2255","10.1107/S1600536807014961","","","0.71073","MoKα","","0.057","0.0354","","","0.0805","0.0881","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213211","8.1022","0.0002","9.9925","0.0002","24.8288","0.0005","90","","90","","90","","2010.17","0.08","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1-Benzoyl-6-ethyl-5-(phenylsulfonyl)perhydropyrrolo[3,4-b]pyrrole","","- C21 H26 N2 O2 S -","- C21 H26 N2 O2 S -","- C84 H104 N8 O8 S4 -","4","1","CI2327","E. Theboral Sugi Kamala; K. Palani; L. Sudha; M. Poornachandran; R. Raghunathan","1-Benzoyl-6-ethyl-5-(phenylsulfonyl)perhydropyrrolo[3,4-<i>b</i>]pyrrole","Acta Crystallographica Section E","2007","63","5","o2256","o2257","10.1107/S1600536807014973","","","0.71073","MoKα","","0.0622","0.0453","","","0.1156","0.1274","","","","","","1.051","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213212","7.1615","0.0001","18.6558","0.0003","18.0323","0.0003","90","","98.216","0.001","90","","2384.45","0.06","100","0.1","100","0.1","","","","","","","","3","P 1 21 1","P 2yb","4","3,6,9-trimethyl-2,3-dihydrobenzo[de]chromene-7,8-dione","3,6,9-trimethyl-2,3-dihydrobenzo[de]chromene-7,8-dione","","- C15 H14 O3 -","- C15 H14 O3 -","- C120 H112 O24 -","8","4","CI2328","Hoong-Kun Fun; Sompong Boonsri; Suchada Chantrapromma; Nawong Boonnak; Chatchanok Karalai","3,6,9-Trimethyl-2,3-dihydrobenzo[<i>de</i>]chromene-7,8-dione","Acta Crystallographica Section E","2007","63","5","o2127","o2129","10.1107/S1600536807014547","","","0.71073","MoKα","","0.1133","0.0614","","","0.1321","0.1664","","","","","","1.011","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213213","18.458","0.002","6.5665","0.0007","13.8915","0.0015","90","","91.111","0.002","90","","1683.4","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H21 Cu N3 O5 -","- C15 H21 Cu N3 O5 -","- C60 H84 Cu4 N12 O20 -","4","1","CI2329","Wang, Jia; You, Zhonglu","Acetato{2-[2-(diethylamino)ethyliminomethyl]-4-nitrophenolato}copper(II)","Acta Crystallographica Section E","2007","63","5","m1198","m1199","10.1107/S1600536807013906","","","0.71073","MoKα","","0.0392","0.0319","","","0.0871","0.0914","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213214","7.2839","0.0018","11.939","0.003","17.958","0.004","90","","93.687","0.003","90","","1558.4","0.6","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H17 Cl3 Cu N2 O -","- C13 H17 Cl3 Cu N2 O -","- C52 H68 Cl12 Cu4 N8 O4 -","4","1","CI2330","Wang, Jia; You, Zhonglu","Chlorido{2,4-dichloro-6-[(2-diethylaminoethylimino)methyl]phenolato}copper(II)","Acta Crystallographica Section E","2007","63","5","m1200","m1201","10.1107/S160053680701392X","","","0.71073","MoKα","","0.0672","0.055","","","0.14","0.1449","","","","","","1.16","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213215","12.003","0.002","8.928","0.004","12.4219","0.0018","90","","90.434","0.013","90","","1331.1","0.7","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diaquabis(4-fluorobenzoato-κO)bis(nicotinamide-κN^1^)cobalt(II)","","- C26 H24 Co F2 N4 O8 -","- C26 H24 Co F2 N4 O8 -","- C52 H48 Co2 F4 N8 O16 -","2","0.5","CI2331","Çaylak, Nagihan; Hökelek, Tuncer; Necefoğlu, Hacali","Diaquabis(4-fluorobenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>^1^)cobalt(II)","Acta Crystallographica Section E","2007","63","5","m1341","m1343","10.1107/S1600536807016534","","","0.71073","MoKα","","0.0499","0.0327","","","0.085","0.0925","","","","","","1.032","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213216","10.5292","0.001","10.5897","0.001","30.534","0.003","90","","91.111","0.002","90","","3403.9","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,3-Dibromo-3-(4-chlorophenyl)-1-(2,4-dichloro-5-fluorophenyl)propan-1-one","","- C15 H8 Br2 Cl3 F O -","- C15 H8 Br2 Cl3 F O -","- C120 H64 Br16 Cl24 F8 O8 -","8","2","CI2332","V. Dhanasekaran; D. Gayathri; D. Velmurugan; K. Ravikumar; M. S. Karthikeyan","2,3-Dibromo-3-(4-chlorophenyl)-1-(2,4-dichloro-5-fluorophenyl)propan-1-one","Acta Crystallographica Section E","2007","63","5","o2493","o2494","10.1107/S1600536807017357","","","0.71073","MoKα","","0.0823","0.0414","","","0.1088","0.1331","","","","","","0.933","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213217","10.1341","0.0009","13.829","0.0013","17.9627","0.0015","90","","103.729","0.017","90","","2445.4","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(2SR,5SR,6SR)-Ethyl 5-[(4-chlorophenyl)sulfanyl]-2,6-bis(4-fluorophenyl)- 4-hydroxy-1,2,5,6-tetrahydropyridine-3-carboxylate","","- C26 H22 Cl F2 N O3 S -","- C26 H22 Cl F2 N O3 S -","- C104 H88 Cl4 F8 N4 O12 S4 -","4","1","CI2333","J. Suresh; Kumar, R. Suresh; S. Perumal; S. Natarajan","(2<i>SR</i>,5<i>SR</i>,6<i>SR</i>)-Ethyl 5-[(4-chlorophenyl)sulfanyl]-2,6-bis(4-fluorophenyl)-4-hydroxy-1,2,5,6-tetrahydropyridine-3-carboxylate","Acta Crystallographica Section E","2007","63","5","o2140","o2141","10.1107/S1600536807014316","","","0.71073","MoKα","","0.1251","0.0472","","","0.1117","0.1406","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213218","6.2412","0.0001","8.2854","0.0002","9.1961","0.0002","68.134","0.001","89.424","0.001","87.72","0.001","440.971","0.016","100","0.1","100","0.1","","","","","","","","5","P 1","P 1","1","","2-[(E)-2-(3-Hydroxy-4-methoxyphenyl)ethenyl]-1-methylquinolinium iodide monohydrate","","- C19 H20 I N O3 -","- C19 H20 I N O3 -","- C19 H20 I N O3 -","1","1","CI2334","Suchada Chantrapromma; Boonwasana Jindawong; Hoong-Kun Fun; P. S. Patil","2-[(<i>E</i>)-2-(3-Hydroxy-4-methoxyphenyl)ethenyl]-1-methylquinolinium iodide monohydrate","Acta Crystallographica Section E","2007","63","5","o2321","o2323","10.1107/S1600536807016078","","","0.71073","MoKα","","0.0148","0.0148","","","0.0374","0.0374","","","","","","1.089","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213219","8.584","0.002","7.486","0.0015","15.554","0.004","90","","100.564","0.008","90","","982.6","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,3'-Diethyl-3,3'-dihydroxy-5,5'-dimethyl-2,2'-bi-1H-indanylidene-1,1'-dione","","- C24 H24 O4 -","- C24 H24 O4 -","- C48 H48 O8 -","2","0.5","CI2335","Xu Li; Xing-Yi Zhao; Min Zhao; Jing-Jun Liu; Yong-Ming Wang","3,3'-Diethyl-3,3'-dihydroxy-5,5'-dimethyl-2,2'-bi-1<i>H</i>-indanylidene-1,1'-dione","Acta Crystallographica Section E","2007","63","5","o2182","o2183","10.1107/S1600536807014614","","","0.71073","MoKα","","0.0715","0.0443","","","0.1069","0.119","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213220","12.916","0.003","7.3123","0.0015","17.328","0.004","90","","101.85","0.03","90","","1601.7","0.6","291","2","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,5-Dimethyl-2-phenyl-4-[(1E)-(2,3,4-trihydroxybenzylidene)amino]-1H-pyrazol- 3(2H)-one","","- C18 H17 N3 O4 -","- C18 H17 N3 O4 -","- C72 H68 N12 O16 -","4","1","CI2336","Yi-Feng Sun; Ji-Kun Li; Ze-Bao Zheng; Ren-Tao Wu","1,5-Dimethyl-2-phenyl-4-[(1<i>E</i>)-(2,3,4-trihydroxybenzylidene)amino]-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2522","o2523","10.1107/S1600536807017254","","","0.71073","MoKα","","0.0901","0.0604","","","0.1256","0.1375","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213221","8.486","0.002","8.649","0.002","10.336","0.003","108.598","0.004","103.053","0.004","107.937","0.004","638.3","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","4,5,6-trimethyl-1-phenyl-3,4-dihydropyrimidine-2(1H)-thione","","- C13 H16 N2 S -","- C13 H16 N2 S -","- C26 H32 N4 S2 -","2","1","CI2337","Ismail, Nur Liyana; Othman, Eliyanti; Yamin, Bohari M.","A new triclinic polymorph of 4,5,6-trimethyl-1-phenyl-3,4-dihydropyrimidine-2(1<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","5","o2442","o2443","10.1107/S1600536807016844","","","0.71073","MoKα","","0.058","0.048","","","0.1174","0.12","","","","","","1.2","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213222","10.195","0.002","10.986","0.002","11.409","0.003","82.434","0.004","84.994","0.004","68.39","0.004","1176.6","0.4","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","Ethyl 3-(2-chlorophenyl)-5-(diethoxyphosphinoyl)-1-phenyl-4,5-dihydro-1H-pyrazolyl- 5-carboxylate","","- C22 H26 Cl N2 O5 P -","- C22 H26 Cl N2 O5 P -","- C44 H52 Cl2 N4 O10 P2 -","2","1","CI2338","Wang, Ting-Ting; Gao, Feng; Xue, Mei; Song, Ying-Jun; Wang, Wen-Hu","Ethyl 3-(2-chlorophenyl)-5-(diethoxyphosphinoyl)-1-phenyl-4,5-dihydro-1<i>H</i>-pyrazole-5-carboxylate","Acta Crystallographica Section E","2007","63","5","o2549","o2550","10.1107/S1600536807016327","","","0.71073","MoKα","","0.0812","0.0472","","","0.1147","0.1374","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213223","16.471","0.003","9.879","0.004","22.065","0.008","90","","109.362","0.017","90","","3387","2","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","1-(4-Methoxyphenyl)-3,3-bis(methylsulfanyl)-2-phenylprop-2-en-1-one","","- C18 H18 O2 S2 -","- C18 H18 O2 S2 -","- C144 H144 O16 S16 -","8","2","CI2339","K. Palani; M. N. Ponnuswamy; P. Jaisankar; P. C. Srinivasan","1-(4-Methoxyphenyl)-3,3-bis(methylsulfanyl)-2-phenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2373","o2374","10.1107/S1600536807015590","","","0.71073","MoKα","","0.1327","0.0582","","","0.1406","0.172","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213224","7.327","0.002","9.387","0.003","10.412","0.004","96.14","0.03","100.94","0.03","109.32","0.03","652.3","0.4","296","","296","","","","","","","","","5","P -1","-P 1","2","","1-(2-Bromo-1-methylindol-3-ylcarbonyl)pyrrolidine","","- C14 H15 Br N2 O -","- C14 H15 Br N2 O -","- C28 H30 Br2 N4 O2 -","2","1","CI2340","Badenock, Jeanese C.; Fraser, Heidi L.; Gribble, Gordon W.; Jasinski, Jerry P.","1-(2-Bromo-1-methyl-1<i>H</i>-indol-3-ylcarbonyl)pyrrolidine","Acta Crystallographica Section E","2007","63","5","o2474","o2475","10.1107/S1600536807017898","","","0.71069","MoKα","","0.2985","0.0739","","","0.2021","0.2766","","","","","","1.068","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213225","7.819","0.003","8.218","0.003","11.114","0.005","69.99","0.03","91.21","0.04","111.16","0.03","621.5","0.5","296","","296","","","","","","","","","5","P -1","-P 1","2","","1-(2-Bromo-1-methylindol-3-ylcarbonyl)piperidine","","- C15 H17 Br N2 O -","- C15 H17 Br N2 O -","- C30 H34 Br2 N4 O2 -","2","1","CI2341","Fraser, Heidi L.; Badenock, Jeanese C.; Gribble, Gordon W.; Jasinski, Jerry P.","1-(2-Bromo-1-methyl-1<i>H</i>-indol-3-ylcarbonyl)piperidine","Acta Crystallographica Section E","2007","63","5","o2476","o2477","10.1107/S1600536807017928","","","0.71069","MoKα","","0.2707","0.0606","","","0.1566","0.245","","","","","","0.945","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213226","7.5053","0.0007","22.468","0.002","10.7081","0.0009","90","","106.101","0.001","90","","1734.9","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-(Methoxycarbonyl)-3-phenylprop-2-enyl 3-hydroxynapthalene-2-carboxylate","","- C22 H18 O5 -","- C22 H18 O5 -","- C88 H72 O20 -","4","1","CI2342","D. Gayathri; D. Velmurugan; K. Ravikumar; Y. Zulykama; P. T. Perumal","2-(Methoxycarbonyl)-3-phenylprop-2-enyl-3-hydroxynapthalene-2-carboxylate","Acta Crystallographica Section E","2007","63","5","o2297","o2299","10.1107/S1600536807015644","","","0.71073","MoKα","","0.0469","0.0429","","","0.1174","0.1216","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213227","23.7412","0.0013","8.3846","0.0005","16.1457","0.0009","90","","96.44","0.001","90","","3193.7","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-[2-(Methylamino)-3-nitro-4H-chromen-4-yl]phenyl acetate","","- C18 H16 N2 O5 -","- C18 H16 N2 O5 -","- C144 H128 N16 O40 -","8","1","CI2343","D. Gayathri; D. Velmurugan; K. Ravikumar; K. Geetha; H. Surya Prakash Rao","2-[2-(Methylamino)-3-nitro-4<i>H</i>-chromen-4-yl]phenyl acetate","Acta Crystallographica Section E","2007","63","5","o2300","o2302","10.1107/S1600536807015681","","","0.71073","MoKα","","0.0497","0.043","","","0.1185","0.1254","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213228","9.3282","0.001","19.025","0.002","12.5249","0.0014","90","","105.101","0.002","90","","2146","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4'-(4-Chlorophenyl)-1'-methylcycloheptane-1-spiro-3'-pyrrolidine-2'-spiro- 2''-indan-2,1'',3''-trione","","- C25 H24 Cl N O3 -","- C25 H24 Cl N O3 -","- C100 H96 Cl4 N4 O12 -","4","1","CI2344","C. Mamtha; D. Gayathri; D. Velmurugan; K. Ravikumar; M. Poornachandran","4'-(4-Chlorophenyl)-1'-methylcycloheptane-1-spiro-3'-pyrrolidine-2'-spiro-2''-indan-2,1'',3''-trione","Acta Crystallographica Section E","2007","63","5","o2230","o2232","10.1107/S1600536807015711","","","0.71073","MoKα","","0.0743","0.0609","","","0.1509","0.16","","","","","","1.087","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213229","7.6022","0.0005","9.7346","0.0007","12.6386","0.0009","85.296","0.001","84.2","0.001","86.527","0.001","926.1","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2'-(2-Chlorophenyl)-1'-nitro-2',3',3a',4',5',6'-hexahydroindan-2-spiro- 3'-1'H-pyrrolizine-1,3-dione","","- C21 H17 Cl N2 O4 -","- C21 H17 Cl N2 O4 -","- C42 H34 Cl2 N4 O8 -","2","1","CI2345","B. K. Satis Kumar; D. Gayathri; D. Velmurugan; K. Ravikumar; M. Poornachandran","2'-(2-Chlorophenyl)-1'-nitro-2',3',3a',4',5',6'-hexahydroindan-2-spiro-3'-1'<i>H</i>-pyrrolizine-1,3-dione","Acta Crystallographica Section E","2007","63","5","o2233","o2235","10.1107/S1600536807015772","","","0.71073","MoKα","","0.0671","0.0599","","","0.1777","0.1875","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213230","9.9442","0.0006","13.9545","0.0009","11.0593","0.0007","90","","91.13","0.001","90","","1534.36","0.17","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(1,3-Benzodioxol-5-yl)-2-bromo-1-(2,4-dichloro-5-fluorophenyl)prop-2-en-1-one","","- C16 H8 Br Cl2 F O3 -","- C16 H8 Br Cl2 F O3 -","- C64 H32 Br4 Cl8 F4 O12 -","4","1","CI2347","V. Dhanasekaran; D. Gayathri; D. Velmurugan; K. Ravikumar; M. S. Karthikeyan","3-(1,3-Benzodioxol-5-yl)-2-bromo-1-(2,4-dichloro-5-fluorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2491","o2492","10.1107/S1600536807017606","","","0.71073","MoKα","","0.0387","0.03","","","0.0779","0.0827","","","","","","0.997","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213231","7.373","0.007","21.453","0.007","9.132","0.009","90","","96.06","0.09","90","","1436","2","296","2","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Bromo-N-tert-butyl-N,1-dimethyl-1H-indole-3-carboxamide","","- C15 H19 Br N2 O -","- C15 H19 Br N2 O -","- C60 H76 Br4 N8 O4 -","4","1","CI2348","Badenock, Jeanese C.; Fraser, Heidi L.; Gribble, Gordon W.; Jasinski, Jerry P.","2-Bromo-<i>N</i>-<i>tert</i>-butyl-<i>N</i>,1-dimethyl-1<i>H</i>-indole-3-carboxamide","Acta Crystallographica Section E","2007","63","5","o2478","o2479","10.1107/S1600536807018089","","","0.71069","MoKα","","0.2065","0.0509","","","0.1277","0.1747","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213232","6.9348","0.0009","10.703","0.0019","10.882","0.003","108.384","0.017","97.601","0.016","100.395","0.013","738.2","0.3","296","","296","","","","","","","","","5","P -1","-P 1","2","","Azepinyl 2-bromo-1-methyl-1H-indol-3-yl ketone","","- C16 H19 Br N2 O -","- C16 H19 Br N2 O -","- C32 H38 Br2 N4 O2 -","2","1","CI2349","Fraser, Heidi L.; Badenock, Jeanese C.; Gribble, Gordon W.; Jasinski, Jerry P.","Azepinyl 2-bromo-1-methyl-1<i>H</i>-indol-3-yl ketone","Acta Crystallographica Section E","2007","63","5","o2480","o2481","10.1107/S1600536807018090","","","0.71069","MoKα","","0.1989","0.0727","","","0.1755","0.231","","","","","","0.995","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213233","13.226","0.003","9.182","0.002","18.256","0.004","90","","106.68","0.03","90","","2123.7","0.9","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Hydroxypropanaminium benzenethiolate","","- C9 H15 N O S -","- C9 H15 N O S -","- C72 H120 N8 O8 S8 -","8","2","CI2350","Katarzyna Baranowska","2-Hydroxypropanammonium benzenethiolate","Acta Crystallographica Section E","2007","63","5","o2653","o2655","10.1107/S1600536807019198","","","0.71073","MoKα","","0.0498","0.0327","","","0.0798","0.0845","","","","","","0.967","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213234","9.8693","0.001","11.7844","0.0012","18.0029","0.0018","90","","90","","90","","2093.8","0.4","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Methyl N'-(17β-hydroxyandrost-1-en-3-ylidene)hydrazinedithiocarboxylate","","- C21 H32 N2 O S2 -","- C21 H32 N2 O S2 -","- C84 H128 N8 O4 S8 -","4","1","CI2351","Li-Ming Zhang; Wei-Xiao Hu; Chun-Nian Xia","Methyl <i>N</i>'-(17β-hydroxyandrost-1-en-3-ylidene)hydrazinedithiocarboxylate","Acta Crystallographica Section E","2007","63","5","o2467","o2468","10.1107/S1600536807016868","","","0.71073","MoKα","","0.0479","0.0376","","","0.1009","0.1084","","","","","","1.057","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213235","8.132","0.006","11.739","0.006","11.224","0.006","90","","97.21","0.03","90","","1063","1.1","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(2-Oxo-2<i>H</i>-pyridin-1-yl)phthalonitrile","","- C13 H7 N3 O -","- C13 H7 N3 O -","- C52 H28 N12 O4 -","4","1","CI2353","Zhu, Hua-Li; Chen, Nai-Sheng; Huang, Jin-Ling; Xue, Jin-Ping","3-(2-Oxo-2<i>H</i>-pyridin-1-yl)phthalonitrile","Acta Crystallographica Section E","2007","63","5","o2434","o2434","10.1107/S1600536807017096","","","0.71073","MoKα","","0.0585","0.0396","","","0.0937","0.0999","","","","","","1.087","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213236","8.997","0.003","10.645","0.003","16.293","0.003","90","","95.97","0.02","90","","1552","0.7","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ethyl 3-(1-Phenylethylamino)dithiocrotonate","(<i>Z</i>)-Ethyl 2-cyano-3-(1-phenylethylamino)but-2-enedithioate","","- C15 H18 N2 S2 -","- C15 H18 N2 S2 -","- C60 H72 N8 S8 -","4","1","CI2354","Toumi, Meriem; Ben Amor, Fatma; Raouafi, Nour Eddine; Bordeau, Michel; Driss, Ahmed; Boujlel, Khaled","(<i>Z</i>)-Ethyl 2-cyano-3-(1-phenylethylamino)but-2-enedithioate","Acta Crystallographica Section E","2007","63","5","o2735","o2735","10.1107/S1600536807020429","","","0.71073","MoKα","","0.061","0.0433","","","0.1105","0.122","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213237","9.471","0.003","10.17","0.003","16.911","0.007","101.429","0.006","97.597","0.006","107.012","0.004","1495","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-(4-Chlorophenyl)-6-(4-methoxybenzyl)-1,2,4,5-tetrazine","","- C16 H13 Cl N4 O -","- C16 H13 Cl N4 O -","- C64 H52 Cl4 N16 O4 -","4","2","CI2355","Feng Xu; Wei-Xiao Hu","3-(4-Chlorophenyl)-6-(4-methoxybenzyl)-1,2,4,5-tetrazine","Acta Crystallographica Section E","2007","63","5","o2397","o2397","10.1107/S1600536807017175","","","0.71073","MoKα","","0.1411","0.0764","","","0.2187","0.2861","","","","","","0.951","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213238","6.1806","0.0001","9.2755","0.0002","19.4579","0.0004","90","","90","","90","","1115.49","0.04","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(10aS)-6-Methoxy-1,10a-dihydropyrrolo[1,2-b]isoquinoline-3,10(2H,5H)-dione","","- C13 H13 N O3 -","- C13 H13 N O3 -","- C52 H52 N4 O12 -","4","1","CI2358","Švorc, Ľubomír; Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan; Žúžiová, Jozefína","(10a<i>S</i>)-6-Methoxy-1,10a-dihydropyrrolo[1,2-<i>b</i>]isoquinoline-3,10(2<i>H</i>,5<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","5","o2444","o2444","10.1107/S1600536807017072","","","0.71073","MoKα","","0.0373","0.0311","","","0.0774","0.0866","","","","","","1.051","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213239","7.6486","0.0015","28.095","0.006","8.6716","0.0017","90","","101.25","0.03","90","","1827.6","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis(2,4-dibromo-6-formylphenolato-κ^2^N,N')zinc(II)","","- C14 H10 Br4 O6 Zn -","- C14 H10 Br4 O6 Zn -","- C56 H40 Br16 O24 Zn4 -","4","1","CI2359","Chen, Xian-Ming; Zhang, Shu-Hua; Jin, Li-Xia; Liu, Zheng; Yang Yan","Diaquabis(2,4-dibromo-6-formylphenolato-κ^2^<i>N</i>,<i>N</i>')zinc(II)","Acta Crystallographica Section E","2007","63","5","m1321","m1321","10.1107/S1600536807018259","","","0.71073","MoKα","","0.0907","0.0406","","","0.09","0.127","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213240","7.8992","0.0014","8.0162","0.0015","11.4759","0.0019","96.835","0.002","106.273","0.002","113.143","0.003","619.43","0.19","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","1-(4-Aminophenyl)-2-ethyl-3-hydroxy-1,4-dihydropyridin-4-one monohydrate","","- C13 H16 N2 O3 -","- C13 H16 N2 O3 -","- C26 H32 N4 O6 -","2","1","CI2360","Zai-Sheng Lu; Xiao-Feng Xia; Feng Gao; Chang-Sheng Yao; De-Zhong Niu","1-(4-Aminophenyl)-2-ethyl-3-hydroxy-1,4-dihydropyridin-4-one monohydrate","Acta Crystallographica Section E","2007","63","5","o2614","o2615","10.1107/S1600536807018284","","","0.71073","MoKα","","0.0665","0.043","","","0.1046","0.125","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213241","4.701","0.002","30.81","0.015","10.889","0.005","90","","109.49","0.017","90","","1486.8","1.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Benzyl-3-[4-(trifluoromethyl)phenyl]-1,2,4,5-tetrazine","","- C16 H11 F3 N4 -","- C16 H11 F3 N4 -","- C64 H44 F12 N16 -","4","1","CI2362","Feng Xu; Wei-Xiao Hu","6-Benzyl-3-[4-(trifluoromethyl)phenyl]-1,2,4,5-tetrazine","Acta Crystallographica Section E","2007","63","5","o2573","o2573","10.1107/S160053680701851X","","","0.71073","MoKα","","0.1731","0.0734","","","0.1978","0.2614","","","","","","1.001","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213242","8.6677","0.0001","10.4584","0.0003","14.7861","0.0003","83.362","0.005","73.027","0.004","86.19","0.006","1272.63","0.06","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","<i>catena</i>-Poly[[[triaqua(4,4'-bipyridine N,N'-dioxide-κO)dichloridocerium(III)]-<i>μ</i>~2~-4,4'-bipyridine N,N'-dioxide-κ^2^O:O'] chloride monohydrate]","","- C20 H24 Ce Cl3 N4 O8 -","- C20 H24 Ce Cl3 N4 O8 -","- C40 H48 Ce2 Cl6 N8 O16 -","2","1","CI2363","Yuan, Da-Qiang; Lian, Fen-Yan; Hong, Mao-Chun","<i>catena</i>-Poly[[[triaqua(4,4'-bipyridine <i>N</i>,<i>N</i>'-dioxide-κ<i>O</i>)dichloridocerium(III)]-<i>{μ</i>}~2~-4,4'-bipyridine <i>N</i>,<i>N</i>'-dioxide-κ^2^<i>O</i>:<i>O</i>'] chloride monohydrate]","Acta Crystallographica Section E","2007","63","5","m1430","m1430","10.1107/S1600536807019010","","","0.71073","MoKα","","0.0358","0.0326","","","0.0814","0.0835","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213243","5.8459","0.0001","7.3649","0.0002","31.143","0.0008","83.866","0.001","87.023","0.001","85.297","0.001","1327.42","0.05","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","1-(4-bromophenyl)-3-(3-methoxyphenyl)prop-2-en-1-one","","- C16 H13 Br O2 -","- C16 H13 Br O2 -","- C64 H52 Br4 O8 -","4","2","CI2364","P. S. Patil; Suchada Chantrapromma; Hoong-Kun Fun; S. M. Dharmaprakash; H. B. Ramesh Babu","1-(4-Bromophenyl)-3-(3-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2612","o2612","10.1107/S1600536807018648","","","0.71073","MoKα","","0.0467","0.0337","","","0.0684","0.0748","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213244","9.3543","0.0002","7.9014","0.0002","24.0405","0.0006","90","","106.148","0.002","90","","1706.78","0.07","297","2","297","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,3-Bis(3,4-dimethoxyphenyl)prop-2-en-1-one","","- C19 H20 O5 -","- C19 H20 O5 -","- C76 H80 O20 -","4","1","CI2365","Jeannie Bee-Jan Teh; P. S. Patil; Hoong-Kun Fun; Ibrahim Abdul Razak; S. M. Dharmaprakash","1,3-Bis(3,4-dimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2613","o2613","10.1107/S160053680701865X","","","0.71073","MoKα","","0.1475","0.054","","","0.1273","0.1628","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213245","23.118","0.004","13.926","0.002","14.975","0.003","90","","123.266","0.002","90","","4031.1","1.2","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","2-{4-[(<i>E</i>)-2,3-Diiodoallyl]-7-fluoro-3-oxo-3,4-dihydro-2<i>H</i>- benzo[<i>b</i>][1,4]oxazin-6-yl}-2,3,4,5,6,7-hexahydro-1<i>H</i>-isoindole- 1,3-dione","","- C19 H15 F I2 N2 O4 -","- C19 H15 F I2 N2 O4 -","- C152 H120 F8 I16 N16 O32 -","8","1","CI2366","Huai-Lin Pang; Yin Huang; Du-Lin Yin; Hai Yang; Wen-An Li","2-{4-[(<i>E</i>)-2,3-Diiodoallyl]-7-fluoro-3-oxo-3,4-dihydro-2<i>H</i>-benzo[<i>b</i>][1,4]oxazin-6-yl}-2,3,4,5,6,7-hexahydro-1<i>H</i>-isoindole-1,3-dione","Acta Crystallographica Section E","2007","63","5","o2742","o2742","10.1107/S1600536807020077","","","0.71073","MoKα","","0.0414","0.0301","","","0.0719","0.0787","","","","","","1.011","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213246","15.444","0.003","13.65","0.003","13.627","0.003","90","","90","","90","","2872.7","1.1","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","Bis(2-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')bis[methyl N-(3-pyridyl)carbamato-κ<i>N</i>]zinc(II)","","- C28 H24 Cl2 N4 O8 Zn -","- C28 H24 Cl2 N4 O8 Zn -","- C112 H96 Cl8 N16 O32 Zn4 -","4","0.5","CI2367","Maroszová, Jaroslava; Findoráková, Lenka; Györyvá, Katarína; Moncol, Jan; Melník, Milan","Bis(2-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')bis[methyl <i>N</i>-(3-pyridyl)carbamato-κ<i>N</i>]zinc(II)","Acta Crystallographica Section E","2007","63","5","m1520","m1520","10.1107/S1600536807019836","","","0.71069","MoKα","","0.0566","0.0372","","","0.0894","0.0964","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213247","9.6209","0.0009","11.7064","0.0012","14.5493","0.0016","90","","106.939","0.003","90","","1567.5","0.3","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-Amino-1,3-dimethyl-5-(4-nitrophenyl)-2,4-dioxo-1,2,3,4- tetrahydropyrido[2,3-<i>d</i>]pyrimidine-6-carbonitrile","","- C16 H12 N6 O4 -","- C16 H12 N6 O4 -","- C64 H48 N24 O16 -","4","1","CI2368","Jie-Xing Zhou; Li-Hui Niu; Xiao-Yue Li; Da-Qing Shi","7-Amino-1,3-dimethyl-5-(4-nitrophenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-<i>d</i>]pyrimidine-6-carbonitrile","Acta Crystallographica Section E","2007","63","5","o2667","o2667","10.1107/S1600536807019356","","","0.7107","MoKα","","0.0516","0.0458","","","0.1177","0.1217","","","","","","1.107","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213248","8.6018","0.0005","18.9829","0.0016","9.1035","0.0006","90","","93.591","0.005","90","","1483.57","0.18","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Z)-ethyl 2-(2-(4-acetylphenyl)hydrazono)-4-chloro-3-oxobutanoate","","- C14 H15 Cl N2 O4 -","- C14 H15 Cl N2 O4 -","- C56 H60 Cl4 N8 O16 -","4","1","CI2369","Alpaslan, Gökhan; Özdamar, Özgür; Odabaşoğlu, Mustafa; Ocak Ískeleli, Nazan; Erdönmez, Ahmet","(<i>Z</i>)-Ethyl 2-[2-(4-acetylphenyl)hydrazono]-4-chloro-3-oxobutanoate","Acta Crystallographica Section E","2007","63","5","o2746","o2746","10.1107/S1600536807019617","","","0.71073","MoKα","","0.056","0.044","","","0.13","0.13","","","","","","1.046","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2213249","6.4326","0.0002","7.1724","0.0002","16.5","0.0006","93.989","0.002","96.973","0.002","107.844","0.002","714.68","0.04","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","(2E)-3-[4-(dimethylamino)phenyl]-1-(3-nitrophenyl) prop-2-en-1-one","","- C17 H16 N2 O3 -","- C17 H16 N2 O3 -","- C34 H32 N4 O6 -","2","1","CI2370","Mohd Mustaqim Rosli; P. S. Patil; Hoong-Kun Fun; Ibrahim Abdul Razak; S. M. Dharmaprakash","(2<i>E</i>)-3-[4-(Dimethylamino)phenyl]-1-(3-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2692","o2692","10.1107/S1600536807019745","","","0.71073","MoKα","","0.0835","0.0544","","","0.1365","0.1616","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213250","6.2162","0.0001","26.6985","0.0005","7.0467","0.0002","90","","111.625","0.001","90","","1087.18","0.04","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(2-furyl)-1-(3-nitrophenyl)prop-2-en-1-one","","- C13 H9 N O4 -","- C13 H9 N O4 -","- C52 H36 N4 O16 -","4","1","CI2371","Shea-Lin Ng; P. S. Patil; Ibrahim Abdul Razak; Hoong-Kun Fun; Ramesh Babu; S. M. Dharmaprakash","3-(2-Furyl)-1-(3-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2693","o2693","10.1107/S1600536807019782","","","0.71073","MoKα","","0.0488","0.0442","","","0.1155","0.1194","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213251","5.4191","0.0011","9.0498","0.0018","10.044","0.002","108.16","0.03","99.32","0.03","103.38","0.03","440.5","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Tetraaquabis[(4-oxo-4H-pyridin-1-yl)acetato]manganese(II)","","- C14 H20 Mn N2 O10 -","- C14 H20 Mn N2 O10 -","- C14 H20 Mn N2 O10 -","1","0.5","CI2374","Zhu-Yan Zhang; Shan Gao; Li-Hua Huo; Jing-Gui Zhao","Tetraaquabis[(4-oxo-4<i>H</i>-pyridin-1-yl)acetato]manganese(II)","Acta Crystallographica Section E","2007","63","5","m1514","m1514","10.1107/S1600536807020533","","","0.71073","MoKα","","0.029","0.0268","","","0.0694","0.0705","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213252","7.4329","0.0003","17.3541","0.0007","19.2551","0.0008","90.736","0.002","90.731","0.002","93.942","0.002","2477.43","0.17","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","1-(4-bromophenyl)-3-(3-methyl-2-thienyl)prop-2-en-1-one","1-(4-Bromophenyl)-3-(3-methyl-2-thienyl)prop-2-en-1-one","","- C14 H11 Br O S -","- C14 H11 Br O S -","- C112 H88 Br8 O8 S8 -","8","4","CI2377","Hoong-Kun Fun; Suchada Chantrapromma; P. S. Patil; S. M. Dharmaprakash","1-(4-Bromophenyl)-3-(3-methyl-2-thienyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2724","o2725","10.1107/S1600536807020089","","","0.71073","MoKα","","0.066","0.0383","","","0.0926","0.1082","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213253","6.9074","0.0004","8.3754","0.0004","8.5433","0.0004","92.054","0.003","101.246","0.003","94.013","0.003","482.95","0.04","93","2","93","2","","","","","","","","3","P -1","-P 1","2","","1-Bromo-2-(bromomethyl)naphthalene","","- C11 H8 Br2 -","- C11 H8 Br2 -","- C22 H16 Br4 -","2","1","CS2030","Hauptvogel, Ines Maria; Schwarzer, Anke; Weber, Edwin","1-Bromo-2-(bromomethyl)naphthalene","Acta Crystallographica Section E","2007","63","5","o2106","o2107","10.1107/S1600536807013669","","","0.71073","MoKα","","0.0594","0.0358","","","0.0815","0.0869","","","","","","1.014","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213254","8.3272","0.0002","10.0252","0.0002","19.173","0.0004","90","","90","","90","","1600.6","0.06","295","","295","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Dimethyl 2-[(E)-(hydroxyimino)methyl]-6-methyl-4-(2-thienyl)- 1,4-dihydropyridine-3,5-dicarboxylate","","- C15 H16 N2 O5 S -","- C15 H16 N2 O5 S -","- C60 H64 N8 O20 S4 -","4","1","CS2032","Švorc, Ľubomír; Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan; Šafář Peter","Dimethyl 2-[(<i>E</i>)-(hydroxyimino)methyl]-6-methyl-4-(2-thienyl)-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica Section E","2007","63","5","o2240","o2242","10.1107/S1600536807014122","","","0.71073","MoKα","","0.0571","0.0344","","","0.0795","0.085","","","","","","1.004","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213255","11.578","0.003","6.943","0.002","12.542","0.004","90","","90.018","0.003","90","","1008.2","0.5","130","2","130","2","","","","","","","","6","P 1 21 1","P 2yb","4","","<i>catena</i>-Poly[[[bis(acetonitrile)(1,10-phenanthroline- κ^2^N,N')copper(II)]-μ-perchlorato-κ^2^O:<i>O</i>'] perchlorate]","","- C16 H14 Cl2 Cu N4 O8 -","- C16 H14 Cl2 Cu N4 O8 -","- C32 H28 Cl4 Cu2 N8 O16 -","2","1","CS2035","Şerb, Mihaela-Diana; Calmuschi-Cula, Beatrice; Dumitru, Florina; Englert, Ulli; Guran, Cornelia","<i>catena</i>-Poly[[[bis(acetonitrile)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)]-μ-perchlorato-κ^2^<i>O</i>:<i>O</i>'] perchlorate]","Acta Crystallographica Section E","2007","63","5","m1484","m1486","10.1107/S1600536807019733","","","0.71073","MoKα","","0.0314","0.0311","","","0.0729","0.073","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213256","24.072","0.005","11.905","0.002","11.759","0.002","90","","104.65","0.03","90","","3260.3","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-Acetyl-5-(4-methylphenyl)-3-(4-nitrophenyl)-2-pyrazoline","","- C18 H17 N3 O3 -","- C18 H17 N3 O3 -","- C144 H136 N24 O24 -","8","1","CV2195","Huan-Mei Guo; Fang-Fang Jian; Pu-Su Zhao; Xiao-Zheng Sun; Cui-Hua Lin","1-Acetyl-5-(4-methylphenyl)-3-(4-nitrophenyl)-2-pyrazoline","Acta Crystallographica Section E","2007","63","5","o2618","o2619","10.1107/S1600536807007520","","","0.71073","MoKα","","0.0795","0.052","","","0.141","0.1559","","","","","","1.051","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213257","9.567","0.001","24.116","0.005","3.9552","0.0006","90","","90","","90","","912.5","0.3","299","2","299","2","","","","","","","","5","P n a 21","P 2c -2n","33","","N-(3,5-Dichlorophenyl)acetamide","","- C8 H7 Cl2 N O -","- C8 H7 Cl2 N O -","- C32 H28 Cl8 N4 O4 -","4","1","CV2214","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(3,5-Dichlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","5","o2341","o2342","10.1107/S1600536807015280","","","1.5418","CuKα","","0.1305","0.0551","","","0.1229","0.1521","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213258","6.1578","0.0005","7.839","0.0007","12.0604","0.001","77.58","0.001","88.816","0.001","71.594","0.001","538.76","0.08","300","2","300","2","","","","","","","","4","P -1","-P 1","2","","(E)-methyl 3-(3-(bromomethyl)phenyl)acrylate","","- C11 H11 Br O2 -","- C11 H11 Br O2 -","- C22 H22 Br2 O4 -","2","1","CV2218","Ren, Xin-Lin; Peng, Hao; He, Hong-Wu","(<i>E</i>)-Methyl 3-[3-(bromomethyl)phenyl]acrylate","Acta Crystallographica Section E","2007","63","5","o2080","o2081","10.1107/S1600536807014079","","","0.71073","MoKα","","0.0486","0.0387","","","0.1026","0.1079","","","","","","1.072","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213259","12.935","0.003","7.122","0.0014","20.465","0.004","90","","105.88","0.03","90","","1813.3","0.7","291","2","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,5-Dimethyl-2-phenyl-4-[(1E)-(2-quinolyl)methylideneamino]- 1H-pyrazol-3(2H)-one","","- C21 H18 N4 O -","- C21 H18 N4 O -","- C84 H72 N16 O4 -","4","1","CV2219","Yi-Feng Sun; Xian-Zhong Sun; Dong-Di Zhang; Yi-Ping Cui","1,5-Dimethyl-2-phenyl-4-[(1<i>E</i>)-(2-quinolyl)methylideneamino]-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2178","o2179","10.1107/S1600536807014985","","","0.71073","MoKα","","0.096","0.059","","","0.1463","0.1647","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213260","8.419","0.0006","11.496","0.0008","31.541","0.002","90","","90","","90","","3052.7","0.4","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(6aR)-1-Hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-(methylcarbonyloxy)perhydro- 4-picenylmethyl acetate","","- C34 H56 O5 -","- C34 H56 O5 -","- C136 H224 O20 -","4","1","CV2220","Oxana B. Flekhter; Natalya I. Medvedeva; Kyrill Yu. Suponitsky","(6a<i>R</i>)-1-Hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-(methylcarbonyloxy)perhydro-4-picenylmethyl acetate","Acta Crystallographica Section E","2007","63","5","o2289","o2290","10.1107/S1600536807015231","","","0.71073","MoKα","","0.0827","0.0441","","","0.0665","0.0713","","","","","","0.983","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213261","13.492","0.002","9.5342","0.0014","15.527","0.002","90","","94.8","0.002","90","","1990.3","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl (2E)-2-(4-chlorobenzylidene)hydrazinecarboxylate","","- C9 H9 Cl N2 O2 -","- C9 H9 Cl N2 O2 -","- C72 H72 Cl8 N16 O16 -","8","2","CV2221","Yue Meng; Wei-Xiao Hu; Feng Xu","Methyl (2<i>E</i>)-2-(4-chlorobenzylidene)hydrazinecarboxylate","Acta Crystallographica Section E","2007","63","5","o2395","o2396","10.1107/S1600536807015814","","","0.71073","MoKα","","0.0538","0.0369","","","0.1077","0.1257","","","","","","1.086","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213262","7.633","0.0012","9.927","0.0016","22.766","0.004","90","","90","","90","","1725","0.5","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","17β-Ethynyl-17α-hydroxyandrosta-1,4-dien-3-one","","- C21 H26 O2 -","- C21 H26 O2 -","- C84 H104 O8 -","4","1","CV2222","Qiu-Xia Zhang; Hua-Feng Shen; Ting-Ting Mao","17β-Ethynyl-17α-hydroxyandrosta-1,4-dien-3-one","Acta Crystallographica Section E","2007","63","5","o2353","o2354","10.1107/S1600536807015371","","","0.71073","MoKα","","0.0465","0.0371","","","0.0928","0.0993","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213263","20.757","0.003","9.042","0.002","13.919","0.002","90","","92.313","0.003","90","","2610.3","0.8","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ethyl 4-(2-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","","- C14 H16 N2 O4 -","- C14 H16 N2 O4 -","- C112 H128 N16 O32 -","8","1","CV2225","Qing-Fang, Cheng; Xing-You Xu; Jing-Yan Bao; Chun-Fang Zhang","Ethyl 4-(2-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","5","o2391","o2392","10.1107/S1600536807015826","","","0.71073","MoKα","","0.0965","0.0483","","","0.1078","0.135","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213264","6.4655","0.0015","10.471","0.002","13.394","0.003","110.716","0.003","92.361","0.004","102.869","0.003","819.7","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bromidobis(pyrrolidine-1-dithiocarboxylato-κ^2^S,S')antimony(III)","","- C10 H16 Br N2 S4 Sb -","- C10 H16 Br N2 S4 Sb -","- C20 H32 Br2 N4 S8 Sb2 -","2","1","CV2226","Jun Zhai; Qian-Xiu Pan; Han-Dong Yin; Feng Li; Da-Qi Wang","Bromidobis(pyrrolidine-1-dithiocarboxylato-κ^2^<i>S</i>,<i>S</i>')antimony(III)","Acta Crystallographica Section E","2007","63","5","m1356","m1357","10.1107/S1600536807016364","","","0.71073","MoKα","","0.0358","0.0273","","","0.0684","0.0726","","","","","","1.005","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213265","10.2066","0.0011","10.6427","0.0011","15.587","0.0017","90","","90","","90","","1693.2","0.3","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-Methyl-2-phenyl-1-tosylpiperazine","","- C18 H22 N2 O2 S -","- C18 H22 N2 O2 S -","- C72 H88 N8 O8 S4 -","4","1","CV2229","Yue Meng; Weixiao Hu; Ke Wu","4-Methyl-2-phenyl-1-tosylpiperazine","Acta Crystallographica Section E","2007","63","5","o2630","o2630","10.1107/S160053680701906X","","","0.71073","MoKα","","0.037","0.0316","","","0.0799","0.0834","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213266","14.702","0.008","9.793","0.005","10.505","0.006","90","","104.936","0.008","90","","1461.4","1.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-4-Hydroxy-N'-[(2-hydroxynaphthalen-1-yl)methylene]benzohydrazide","","- C18 H14 N2 O3 -","- C18 H14 N2 O3 -","- C72 H56 N8 O12 -","4","1","CV2232","Ji-Chun Cui; Qian-Xiu Pan; Han-Dong Yin; Yan-Ling Qiao","(<i>E</i>)-4-Hydroxy-<i>N</i>'-[(2-hydroxynaphthalen-1-yl)methylene]benzohydrazide","Acta Crystallographica Section E","2007","63","5","o2633","o2633","10.1107/S1600536807019101","","","0.71073","MoKα","","0.0968","0.045","","","0.0636","0.0729","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213267","12.014","0.007","18.533","0.008","7.411","0.003","90","","90","","90","","1650.1","1.4","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","catena-Poly[[[diaquadinitratocopper(II)]-μ-4,4'-bipyridine] hemihydrate]","","- C10 H13 Cu N4 O8.5 -","- C10 H12 Cu N4 O8.5 -","- C40 H48 Cu4 N16 O34 -","4","0.5","CV2233","Lin, Xu-Cong; Yin, Hua; Lin, Yun","<i>catena</i>-Poly[[[diaquadinitratocopper(II)]-μ-4,4'-bipyridine] hemihydrate]","Acta Crystallographica Section E","2007","63","5","m1467","m1468","10.1107/S1600536807019551","","","0.71073","MoKα","","0.0728","0.0487","","","0.1411","0.1569","","","","","","1.119","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213268","12.9666","0.0008","11.3068","0.0006","19.726","0.0013","90","","100.939","0.002","90","","2839.5","0.3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[N(CH2CH2NH3)3]2.(MoOF5)2.(F)2.H2O","Bis[tris(2-ammonioethyl)amine] bis(pentafluoridooxidomolybdate) difluoride monohydrate","","- C12 H44 F12 Mo2 N8 O3 -","- C12 H44 F12 Mo2 N8 O3 -","- C48 H176 F48 Mo8 N32 O12 -","4","0.5","DN2118","K. Adil; J. Marrot; M. Leblanc; V. Maisonneuve","Bis[tris(2-ammonioethyl)amine] bis(pentafluoridooxidomolybdate) difluoride monohydrate","Acta Crystallographica Section E","2007","63","5","m1511","m1513","10.1107/S1600536807018077","","","0.71073","MoKα","","0.096","0.0477","","","0.0997","0.1111","","","","","","0.997","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213269","19.734","0.003","19.734","0.003","16.293","0.005","90","","90","","90","","6345","2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Poly[bis(μ~3~-3-amino-1,2,4-triazolato)(μ~2~glutarato)dizinc]","","- C9 H12 N8 O4 Zn2 -","- C9 H12 N8 O4 Zn2 -","- C144 H192 N128 O64 Zn32 -","16","1","DN2135","Zhi-Qiang Zheng; Chong-Wu Liu; Bin Lin","Poly[bis(μ~3~-3-amino-1,2,4-triazolato)(μ~2~-glutarato)dizinc(II)]","Acta Crystallographica Section E","2007","63","5","m1252","m1253","10.1107/S1600536807014882","","","0.71073","MoKα","","","0.0353","","","0.0901","0.0912","","","","","","1.072","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213270","10.655","0.002","9.999","0.003","23.275","0.009","90","","90","","90","","2479.7","1.3","299","2","299","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-(3,5-dichlorophenyl)-2,2,2-trimethylacetamide","","- C11 H13 Cl2 N O -","- C11 H13 Cl2 N O -","- C88 H104 Cl16 N8 O8 -","8","1","DN2142","Gowda, B. Thimme; Kožíšek, Jozef; Tokarčík, Miroslav; Fuess, Hartmut","<i>N</i>-(3,5-Dichlorophenyl)-2,2,2-trimethylacetamide","Acta Crystallographica Section E","2007","63","5","o2071","o2072","10.1107/S1600536807013980","","","0.71073","MoKα","","0.174","0.0941","","","0.1741","0.2058","","","","","","1.143","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213271","5.2058","0.0006","7.577","0.0007","11.837","0.002","93.356","0.007","95.187","0.007","92.785","0.006","463.51","0.1","293","","293","","","","","","","","","5","P -1","-P 1","2","p-Carboxyphenylammonium bisulfate","4-Carboxyanilinium hydrogensulfate","","- C7 H9 N O6 S -","- C7 H9 N O6 S -","- C14 H18 N2 O12 S2 -","2","1","DN2144","Nourredine Benali-Cherif; Amani Direm; Fatima Allouche; Lila Boukli-H-Benmenni; Kawther Soudani","4-Carboxyanilinium hydrogensulfate","Acta Crystallographica Section E","2007","63","5","o2054","o2056","10.1107/S160053680701272X","","","0.71073","MoKα","","0.065","0.0481","","","0.1149","0.1231","","","","","","1.078","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213272","6.2637","0.0005","13.8902","0.0011","14.3678","0.0015","90","","90","","90","","1250.06","0.19","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>)-2-[(3-Bromophenylimino)methyl]-6-methylphenol","","- C14 H12 Br N O -","- C14 H12 Br N O -","- C56 H48 Br4 N4 O4 -","4","1","DN2147","Akkaya, Abdullah; Erşahi̇n, Ferda; Şenel, İsmet; Aǧar, Erbi̇l; Büyükgüngör, Orhan","(<i>E</i>)-2-[(3-Bromophenylimino)methyl]-6-methylphenol","Acta Crystallographica Section E","2007","63","5","o2383","o2385","10.1107/S1600536807014602","","","0.71073","MoKα","","0.0535","0.0368","","","0.0752","0.0812","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213273","10.753","0.001","10.8059","0.001","10.0883","0.0011","90","","90","","90","","1172.2","0.2","299","2","299","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","N-(3-methylphenyl)-2,2,2-trimethylacetamide","","- C12 H17 N O -","- C12 H17 N O -","- C48 H68 N4 O4 -","4","1","DN2148","Gowda, B. Thimme; Kozisek, Jozef; Tokarčík, Miroslav; Fuess, Hartmut","2,2,2-Trimethyl-<i>N</i>-(3-methylphenyl)acetamide","Acta Crystallographica Section E","2007","63","5","o2073","o2074","10.1107/S1600536807013992","","","0.71073","MoKα","","0.0749","0.041","","","0.0936","0.1025","","","","","","0.882","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213274","13.1203","0.0012","8.649","0.0008","15.1501","0.0014","90","","108.367","0.001","90","","1631.6","0.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(1-Ammonioethylidenediphosphonato-κ^2^O,O)(2,2'-bipyridyl- κ^2^N,N')chloridocopper(II)","","- C12 H16 Cl Cu N3 O6 P2 -","- C12 H16 Cl Cu N3 O6 P2 -","- C48 H64 Cl4 Cu4 N12 O24 P8 -","4","1","DN2150","Ming Li; Ju-Tang Sun","(1-Ammonioethylidenediphosphonato-κ^2^<i>O</i>,<i>O</i>)(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')chloridocopper(II)","Acta Crystallographica Section E","2007","63","5","m1370","m1372","10.1107/S1600536807014626","","","0.71073","MoKα","","0.033","0.0288","","","0.0806","0.0831","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213275","8.4762","0.0005","7.4377","0.0004","10.3117","0.0006","90","","102.68","0.001","90","","634.23","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diaquabis(malato-κ^2^O^1^,O^2^)copper(II)","","- C8 H14 Cu O12 -","- C8 H14 Cu O12 -","- C16 H28 Cu2 O24 -","2","0.5","DN2151","Xin-Yan Zhang","Diaquabis(malato-κ^2^<i>O</i>^1^,<i>O</i>^2^)copper(II)","Acta Crystallographica Section E","2007","63","5","m1254","m1255","10.1107/S1600536807014754","","","0.71073","MoKα","","0.0257","0.0217","","","0.059","0.0602","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213276","19.525","0.002","7.939","0.0009","11.2702","0.0012","90","","90","","90","","1747","0.3","297","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","[(4RS,7SR)-1-(1H-Benzimidazol-2-ylmethyl-κN^3^)-1,4,7-triazacyclononane- κ^3^N]bromidocopper(II) bromide","","- C14 H21 Br2 Cu N5 -","- C14 H21 Br2 Cu N5 -","- C56 H84 Br8 Cu4 N20 -","4","1","DN2154","Li, Qing-Xiang; Bing-Zhong He; Jun-Yun Shen; Hai-Yan Xiao","[(4<i>RS</i>,7<i>SR</i>)-1-(1<i>H</i>-Benzimidazol-2-ylmethyl-κ<i>N</i>^3^)-1,4,7-triazacyclononane-κ^3^<i>N</i>]bromidocopper(II) bromide","Acta Crystallographica Section E","2007","63","5","m1482","m1483","10.1107/S1600536807019137","","","0.71073","Mokα","","0.0431","0.0348","","","0.0763","0.0797","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213277","9.69","0.0012","10.1287","0.0016","23.923","0.003","90","","90","","90","","2348","0.6","299","2","299","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,2,2-Trimethyl-N-(4-methylphenyl)acetamide","","- C12 H17 N O -","- C12 H17 N O -","- C96 H136 N8 O8 -","8","1","DN2155","B. Thimme Gowda; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","2,2,2-Trimethyl-<i>N</i>-(4-methylphenyl)acetamide","Acta Crystallographica Section E","2007","63","5","o2327","o2328","10.1107/S1600536807015140","","","0.71073","MoKα","","0.0983","0.073","","","0.1828","0.2019","","","","","","1.231","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2213278","9.762","0.002","5.172","0.002","11.731","0.003","90","","90.158","0.005","90","","592.3","0.3","296","1","296","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Methyl 2-pyrrolyl ketone","2-Acetylpyrrole","","- C6 H7 N O -","- C6 H7 N O -","- C24 H28 N4 O4 -","4","1","DN2156","Camarillo, E. Adriana; Flores, Henoc; Amador, Patricia; Bernès, Sylvain","2-Acetylpyrrole","Acta Crystallographica Section E","2007","63","5","o2593","o2594","10.1107/S1600536807015450","","","0.71073","MoKα","","0.0568","0.0393","","","0.0993","0.111","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213279","9.6933","0.0006","10.115","0.001","23.542","0.001","90","","90","","90","","2308.2","0.3","299","2","299","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","N-(4-chlorophenyl)-2,2,2-trimethylacetamide","N-(4-chlorophenyl)-2,2,2-trimethylacetamide","","- C11 H14 Cl N O -","- C11 H14 Cl N O -","- C88 H112 Cl8 N8 O8 -","8","1","DN2157","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(4-Chlorophenyl)-2,2,2-trimethylacetamide","Acta Crystallographica Section E","2007","63","5","o2329","o2330","10.1107/S1600536807015474","","","1.5418","CuKα","","0.0512","0.0419","","","0.1246","0.1326","","","","","","1.077","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213280","10.778","0.001","10.623","0.001","10.117","0.002","90","","90","","90","","1158.3","0.3","299","2","299","2","","","","","","","","5","P c a 21","P 2c -2ac","29","N-(3-chlorophenyl)-2,2,2-trimethylacetamide","<i>N</i>-(3-Chlorophenyl)-2,2,2-trimethylacetamide","","- C11 H14 Cl N O -","- C11 H14 Cl N O -","- C44 H56 Cl4 N4 O4 -","4","1","DN2158","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(3-Chlorophenyl)-2,2,2-trimethylacetamide","Acta Crystallographica Section E","2007","63","5","o2331","o2332","10.1107/S1600536807015462","","","1.5418","CuKα","","0.1883","0.0708","","","0.1111","0.1529","","","","","","0.986","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213281","10.15","0.002","10.216","0.002","10.817","0.002","90","","90","","90","","1121.6","0.4","304","2","304","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","N-(2-Methylphenyl)-2,2,2-Trichloroacetamide","2,2,2-Trichloro-N-(2-methylphenyl)acetamide","","- C9 H8 Cl3 N O -","- C9 H8 Cl3 N O -","- C36 H32 Cl12 N4 O4 -","4","1","DN2159","B. Thimme Gowda; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","2,2,2-Trichloro-<i>N</i>-(2-methylphenyl)acetamide","Acta Crystallographica Section E","2007","63","5","o2571","o2572","10.1107/S1600536807018879","","","0.71073","MoKα","","0.0672","0.0443","","","0.1113","0.1305","","","","","","1.044","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213282","19.7191","0.0012","22.0781","0.0011","19.7875","0.0013","90","","106.665","0.001","90","","8252.9","0.8","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[1,1'-bis(diphenylphosphino)ferrocene-κ^2^P,P']bis(2,3,4,5,6- pentafluorobenzenethiolato-κS)palladium(II)","","- C46 H28 F10 Fe P2 Pd S2 -","- C46 H28 F10 Fe P2 Pd S2 -","- C368 H224 F80 Fe8 P16 Pd8 S16 -","8","2","DN2163","Herrera-Alvarez, Cesar; Hernández-Ortega, Simón; Morales-Morales, David","C—H···F, C—F···π and C—F···F—C interactions in a palladium(II) benzenethiolate complex","Acta Crystallographica Section E","2007","63","5","m1490","m1491","10.1107/S1600536807019605","","","0.71073","MoKα","","0.0808","0.0428","","","0.0574","0.064","","","","","","0.817","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213283","9.5515","0.001","10.9177","0.0011","10.9141","0.0011","90","","107.06","0.1","90","","1088","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-<i>N</i>-[(5-Bromothiophen-2-yl)methylene]-5-methylthiazol-2-amine","","- C9 H7 Br N2 S2 -","- C9 H7 Br N2 S2 -","- C36 H28 Br4 N8 S8 -","4","1","DN2165","Yong-Bing Gu; Chun-Niu Zhang; Ming-Hua Yang","(<i>E</i>)-<i>N</i>-[(5-Bromothiophen-2-yl)methylene]-5-methylthiazol-2-amine","Acta Crystallographica Section E","2007","63","5","o2708","o2708","10.1107/S1600536807020211","","","0.71073","MoKα","","0.0435","0.0338","","","0.0819","0.0839","","","","","","0.938","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213284","8.7925","0.0012","27.69","0.005","7.6525","0.0015","90","","92.65","0.01","90","","1861.1","0.6","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(3,5-dimethylphenyl)acetamide","","- C10 H13 N O -","- C10 H13 N O -","- C80 H104 N8 O8 -","8","2","DN2166","B. Thimme Gowda; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","<i>N</i>-(3,5-Dimethylphenyl)acetamide","Acta Crystallographica Section E","2007","63","5","o2711","o2711","10.1107/S1600536807019812","","","0.71073","MoKα","","0.1682","0.0664","","","0.1383","0.1745","","","","","","0.992","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213285","15.675","0.003","11.791","0.003","11.316","0.004","90","","130.913","0.009","90","","1580.5","0.8","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[copper(I)-μ-1,4-bis(imidazole-1-ylmethyl)benzene-κ^2^N:N'] perchlorate]","","- C14 H14 Cl Cu N4 O4 -","- C14 H14 Cl Cu N4 O4 -","- C56 H56 Cl4 Cu4 N16 O16 -","4","0.5","ER2025","Tao Li; Shao-Wu Du","<i>catena</i>-Poly[[copper(I)-μ-1,4-bis(imidazol-1-ylmethyl)benzene-κ^2^<i>N</i>:<i>N</i>'] perchlorate]","Acta Crystallographica Section E","2007","63","5","m1507","m1509","10.1107/S1600536807018752","","","0.71073","MoKα","","0.0681","0.054","","","0.1015","0.1081","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213286","9.9639","0.0014","14.939","0.002","17.998","0.003","90","","90","","90","","2679","0.7","291","2","291","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N-(Boc-L-alanine)allylamine","tert-butyl N-[1-(allylaminocarbonyl)ethyl]carbamate","","- C11 H20 N2 O3 -","- C11 H20 N2 O3 -","- C88 H160 N16 O24 -","8","2","EZ2064","Min Hong; Liangfei Tian; Yizhi Li; Jin Zhu","<i>N</i>-(Boc-<small>L</small>-alanine)allylamine","Acta Crystallographica Section E","2007","63","5","o2186","o2187","10.1107/S1600536807014250","","","0.71073","MoKα","","0.092","0.064","","","0.136","0.143","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213287","12.1826","0.0008","9.4017","0.0006","17.1789","0.0012","90","","91.059","0.006","90","","1967.3","0.2","290","2","290","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dimethyl 3-(<i>tert</i>-butylamino)-7-phenyl-5-oxo-1<i>H</i>,5<i>H</i>-pyrazolo[1,2-\ <i>a</i>]pyrazole-1,2-dicarboxylate","","- C20 H23 N3 O5 -","- C20 H23 N3 O5 -","- C80 H92 N12 O20 -","4","1","EZ2068","Abbasi, Alireza; Adib, Mehdi; Eriksson, Lars","Dimethyl 3-(<i>tert</i>-butylamino)-5-oxo-7-phenyl-1<i>H</i>,5<i>H</i>-pyrazolo[1,2-<i>a</i>]pyrazole-1,2-dicarboxylate","Acta Crystallographica Section E","2007","63","5","o2115","o2116","10.1107/S1600536807013773","","","0.71073","MoKα","","0.057","0.037","","","0.101","0.105","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213288","7.9044","0.0018","9.1861","0.0017","9.4138","0.0017","66.648","0.009","75.696","0.01","83.656","0.011","608","0.2","153.1","","","","","","","","","","","4","P -1","-P 1","2","","5,6,11,12-Tetrahydro-5,11-bis(bromoacetyl)- 5,12[1',2']:6,11[1'',2'']dibenzenodibenzo[a,e]cyclooctene","","- C32 H22 Br2 O2 -","- C32 H22 Br2 O2 -","- C32 H22 Br2 O2 -","1","0.5","EZ2069","Kubo, Kanji; Matsumoto, Taisuke; Ideta, Keiko; Watanabe, Kenichiro; Sakurai, Tadamitsu","9-(Bromoacetyl)anthracene dimer","Acta Crystallographica Section E","2007","63","5","o2609","o2610","10.1107/S160053680701923X","","","0.7107","MoKα","","","0.036","","","","0.074","","","","","","1.052","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2213289","7.2739","0.0002","13.4818","0.0002","14.7373","0.0004","78.488","0.004","87.707","0.005","85.551","0.005","1411.43","0.06","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","3-(5-Methylsulfanyl-1,3,4-thiadiazol-2-yldiazenyl)-1,2-methyl-1H-indole","","- C13 H13 N5 S2 -","- C13 H13 N5 S2 -","- C52 H52 N20 S8 -","4","2","EZ2070","Hökelek, Tuncer; Seferoğlu, Zeynel; Şahin, Ertan; Ertan, Nermin","1,2-Dimethyl-3-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)diazenyl]-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","5","o2263","o2264","10.1107/S1600536807015723","","","0.71073","MoKα","","0.132","0.074","","","0.168","0.198","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213290","11.9803","0.0009","5.0008","0.0004","16.986","0.001","90","","101.88","0.001","90","","995.85","0.12","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(4-Bromophenyl)-2-ethylacrylic acid","","- C11 H11 Br O2 -","- C11 H11 Br O2 -","- C44 H44 Br4 O8 -","4","1","EZ2071","Niaz Muhammed; Zia-ur-Rehman; Saqib Ali; Meetsma, Auke","3-(4-Bromophenyl)-2-ethylacrylic acid","Acta Crystallographica Section E","2007","63","5","o2557","o2558","10.1107/S1600536807018843","","","0.71073","MoKα","","0.03","0.026","","","0.065","0.067","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213291","9.8474","0.0004","20.4025","0.0008","21.6171","0.0009","90","","101.882","0.004","90","","4250.1","0.3","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(μ~2~-4,4'-Bipyridyl-κ^2^N:N')bis[bis(tri-tert-butoxysilanothiolato- κ^2^S,O)cadmium(II)] tetrahydrofuran disolvate","","- C66 H132 Cd2 N2 O14 S4 Si4 -","- C66 H132 Cd2 N2 O14 S4 Si4 -","- C132 H264 Cd4 N4 O28 S8 Si8 -","2","0.5","EZ2073","Pladzyk, Agnieszka; Dołęga, Anna; Baranowska, Katarzyna","(μ~2~-4,4'-Bipyridyl-κ^2^<i>N</i>:<i>N</i>')bis[bis(tri-<i>tert</i>-butoxysilanothiolato-κ^2^<i>S</i>,<i>O</i>)cadmium(II)] tetrahydrofuran disolvate","Acta Crystallographica Section E","2007","63","5","m1434","m1436","10.1107/S1600536807018430","","","0.71073","MoKα","","0.053","0.043","","","0.112","0.126","","","","","","1.2","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213292","8.6303","0.0003","8.6454","0.0003","10.4231","0.0003","105.245","0.001","106.382","0.001","108.221","0.001","653.98","0.04","120","2","120","2","","","","","","","","3","P -1","-P 1","2","2,2',5,5'-tetraselenafulvalene","2,2'-bi-1,3-diselenole","","- C6 H4 Se4 -","- C6 H4 Se4 -","- C18 H12 Se12 -","3","1.5","EZ2074","Hansen, Karsten; Thorup, Niels; Johannsen, Ib; Bechgaard, Klaus","2,2'-Bi-1,3-diselenole","Acta Crystallographica Section E","2007","63","5","o2702","o2703","10.1107/S1600536807018582","","","0.71073","MoKα","","0.023","0.02","","","0.05","0.051","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213293","17.765","0.004","6.7233","0.0013","19.074","0.004","90","","114.03","0.03","90","","2080.7","0.9","292","2","292","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","<i>trans</i>-N,N'-bis[2-(aminomethyl-κN)benzimidazole-κN^3^)] aquacopper(II) dichloride dihydrate","","- C16 H24 Cl2 Cu N6 O3 -","- C16 H24 Cl2 Cu N6 O3 -","- C64 H96 Cl8 Cu4 N24 O12 -","4","0.5","FB2030","Tlahuext, Hugo; Tlahuextl, Margarita; López-Gómez, Sandra; Tapia-Benavides, Antonio R.","<i>trans</i>-Bis[2-(aminomethyl)-1<i>H</i>-benzimidazole-κ^2^<i>N</i>^2^,<i>N</i>^3^]aquacopper(II) dichloride dihydrate","Acta Crystallographica Section E","2007","63","5","m1263","m1265","10.1107/S1600536807002772","","","0.71073","MoKα","","0.0674","0.0403","","","0.0841","0.1012","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213294","7.2279","0.0007","10.2493","0.001","19.7706","0.0019","90","","90","","90","","1464.6","0.2","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1R*,2S*,3R*,4S*)-N-(1-Naphthyl)-5-norbornene-2,3-dicarboximide","","- C19 H15 N O2 -","- C19 H15 N O2 -","- C76 H60 N4 O8 -","4","1","FB2044","De-Mei Tian; Chuan-Xi Xiong; Li-Jie Dong","(1<i>R</i>*,2<i>S</i>*,3<i>R</i>*,4<i>S</i>*)-<i>N</i>-(1-Naphthyl)-5-norbornene-2,3-dicarboximide","Acta Crystallographica Section E","2007","63","5","o2393","o2394","10.1107/S1600536807015620","","","0.71073","MoKα","","0.0555","0.0445","","","0.0953","0.1016","","","","","","1.096","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213295","8.424","0.0011","10.1388","0.0013","10.822","0.0014","104.146","0.002","94.137","0.002","106.413","0.002","849.78","0.19","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","(RS)-2-[(Furan-2-carbonyl)amino]propionic acid","","- C8 H9 N O4 -","- C8 H9 N O4 -","- C32 H36 N4 O16 -","4","2","FB2046","Xiang-Chao Zeng","(<i>RS</i>)-2-[(Furan-2-carbonyl)amino]propionic acid","Acta Crystallographica Section E","2007","63","5","o2537","o2539","10.1107/S1600536807017205","","","0.71073","MoKα","","0.0501","0.043","","","0.1234","0.1321","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213296","7.4227","0.0002","8.0524","0.0002","8.8973","0.0003","74.023","0.003","74.335","0.003","87.246","0.002","492.07","0.03","298","","298","","","","","","","","","5","P -1","-P 1","2","","Benzotriazolium perchlorate monohydrate","","- C6 H8 Cl N3 O5 -","- C6 H8 Cl N3 O5 -","- C12 H16 Cl2 N6 O10 -","2","1","FB2047","Sieroń, Lesław","Benzotriazolium perchlorate monohydrate","Acta Crystallographica Section E","2007","63","5","o2089","o2090","10.1107/S1600536807013542","","","0.71073","MoKα","","0.0386","0.0373","","","0.1038","0.1049","","","","","","1.091","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213297","15.681","0.002","5.6574","0.0007","9.2758","0.001","90","","104.746","0.009","90","","795.79","0.17","173","2","173","2","","","","","","","","5","P 1 c 1","P -2yc","7","","N'-[(1E)-(4-Fluorophenyl)methylene]-6-methoxy-2-naphthohydrazide","","- C19 H15 F N2 O2 -","- C19 H15 F N2 O2 -","- C38 H30 F2 N4 O4 -","2","1","FB2048","Yathirajan, H. S.; Narayana, B.; Sunil, K.; Sarojini, B. K.; Bolte, Michael","<i>N</i>'-[(1<i>E</i>)-(4-Fluorophenyl)methylene]-6-methoxy-2-naphthohydrazide","Acta Crystallographica Section E","2007","63","5","o2565","o2565","10.1107/S160053680701820X","","","0.71073","MoKα","","0.0752","0.0626","","","0.1239","0.1271","","","","","","1.569","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213298","10.4938","0.0003","9.0744","0.0002","11.2525","0.0005","90","","106.414","0.002","90","","1027.85","0.06","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","caesium praseodymium polyphosphate","caesium praseodymium polyphosphate","","- Cs O12 P4 Pr -","- Cs O12 P4 Pr -","- Cs4 O48 P16 Pr4 -","4","1","FI2030","Horchani-Naifer, Karima; Férid, Mokhtar","A new polymorph of CsPr(PO~3~)~4~","Acta Crystallographica Section E","2007","63","5","i131","i132","10.1107/S1600536807016455","","","0.71073","MoKα","","0.0266","0.0248","","","0.0608","0.0617","","","","","","1.157","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213299","6.9044","0.0001","10.3038","0.0002","15.0875","0.0003","90","","90.847","0.001","90","","1073.23","0.03","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","tetrakis(thylenediammonium) gallium trivanadium octakis(hydrogen sulfate) tetrahydroxide tetrahydrate","","- C8 H52 Ga N8 O40 S8 V3 -","- C8 H52 Ga N8 O40 S8 V3 -","- C8 H52 Ga N8 O40 S8 V3 -","1","0.25","FI2031","Xiao-Chang Sun; Guang-Peng Zhou; Xue-Fang Zheng; Yan Xu","Ethylenediammonium gallic vanadium hydrogen sulfate monohydrate","Acta Crystallographica Section E","2007","63","5","m1388","m1390","10.1107/S1600536807017941","","","0.71073","MoKα","","0.0474","0.036","","","0.0922","0.0982","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213300","22.89","0.003","15.233","0.002","20.552","0.002","90","","119.5","0.01","90","","6237.1","1.4","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","dimesitylborinic acid","","- C18 H23 B O -","- C18 H23 B O -","- C288 H368 B16 O16 -","16","2","FI2032","Entwistle, Christopher D.; Batsanov, Andrei S.; Marder, Todd B.","A new polymorph of dimesitylborinic acid","Acta Crystallographica Section E","2007","63","5","o2639","o2641","10.1107/S1600536807018454","","","0.71073","MoKα","","0.0801","0.0432","","","0.098","0.1088","","","","","","0.9","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213301","14.1287","0.0007","8.6553","0.0003","15.737","0.0008","90","","110.535","0.002","90","","1802.17","0.14","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(N-hydroxynicotinamidium-κ^2^O,O')diperchloratocopper(II)","","- C12 H12 Cl2 Cu N4 O12 -","- C12 H12 Cl2 Cu N4 O12 -","- C48 H48 Cl8 Cu4 N16 O48 -","4","0.5","FJ2004","Irina A. Golenya; Matti Haukka; Igor O. Fritsky; Elźbieta Gumienna-Kontecka","Bis(<i>N</i>-oxidonicotinamidium-κ^2^<i>O</i>,<i>O</i>')diperchloratocopper(II)","Acta Crystallographica Section E","2007","63","5","m1228","m1230","10.1107/S1600536807013724","","","0.71073","MoKα","","0.0404","0.0323","","","0.0857","0.0912","","","","","","1.059","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213302","8.7012","0.0001","15.1862","0.0002","19.8391","0.0004","99.2137","0.0014","90.725","0.0015","103.759","0.0013","2509.91","0.07","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","{2,6-Bis[(dimethylamino-κ^2^N,N')methyl]-4-{[(2,5-dioxo-1-pyrrolidinyl)oxy] carbonyl}phenyl-κC}(diiodine)iodoplatinum(II) dichloromethane hemisolvate","","- C17.5 H23 Cl I3 N3 O4 Pt -","- C17.5 H23 Cl I3 N3 O4 Pt -","- C70 H92 Cl4 I12 N12 O16 Pt4 -","4","2","FJ2006","von Chrzanowski, Lars S.; Lutz, Martin; Spek, Anthony L.; Suijkerbuijk, Bart M. J. M.; Klein Gebbink, Robertus J. M.","{2,6-Bis[(dimethylamino-κ<i>N</i>)methyl]-4-{[(2,5-dioxo-1-pyrrolidinyl)oxy]carbonyl}phenyl-κ<i>C</i>^1^}(diiodine)iodidoplatinum(II) dichloromethane hemisolvate","Acta Crystallographica Section E","2007","63","5","m1223","m1225","10.1107/S1600536807013748","","","0.71073","MoKα","","0.0365","0.0236","","","0.0482","0.0536","","","","","","0.944","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2213303","7.3202","0.0011","8.146","0.0013","9.0526","0.0014","114.431","0.002","107.444","0.002","92.065","0.002","460.85","0.12","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","3-(4-Bromophenyl)-2-methylacrylic acid","","- C10 H9 Br O2 -","- C10 H9 Br O2 -","- C20 H18 Br2 O4 -","2","1","FJ2007","Niaz Muhammad; Zia-ur-Rehman; Saqib Ali; Auke Meetsma","3-(4-Bromophenyl)-2-methylacrylic acid","Acta Crystallographica Section E","2007","63","5","o2174","o2175","10.1107/S1600536807014468","","","0.71073","MoKα","","0.0374","0.0334","","","0.085","0.0874","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213304","12.6384","0.0009","17.2427","0.0012","8.8721","0.0006","90","","90.777","0.001","90","","1933.2","0.2","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","Tris(propane-1,2-diamine-κ^2^N,N')zinc(II) dichloride dihydrate","","- C9 H34 Cl2 N6 O2 Zn -","- C9 H34 Cl2 N6 O2 Zn -","- C36 H136 Cl8 N24 O8 Zn4 -","4","1","FJ2009","Fowkes, Adrian; Harrison, William T. A.","Tris(propane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')zinc(II) dichloride dihydrate","Acta Crystallographica Section E","2007","63","5","m1249","m1251","10.1107/S1600536807014766","","","0.71073","MoKα","","0.0588","0.0416","","","0.0967","0.1017","","","","","","0.966","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213305","10.3142","0.0004","11.9229","0.0004","12.2124","0.0004","90","","107.223","0.002","90","","1434.48","0.09","100","","100","","","","","","","","","3","P 1 21 1","P 2yb","4","","(1R,2S,7R,10S)-5-hydroxy-8-(1-hydroxyisopropyl)-3,11-dimethyl- 7-oxaspiro[5.5]undec-3-en-2-one","","- C15 H24 O4 -","- C15 H24 O4 -","- C60 H96 O16 -","4","2","FJ2010","Macías, Francisco A.; Fronczek, Frank R.","The absolute configuration of heliespirone B, from sunflower <i>Helianthus annuus</i>","Acta Crystallographica Section E","2007","63","5","o2104","o2105","10.1107/S160053680701478X","","","1.54178","CuKα","","0.0329","0.0329","","","0.0873","0.0873","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213306","7.7521","0.0003","11.6202","0.0004","19.0242","0.0011","90","","90","","90","","1713.72","0.13","293","","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-Deoxy-1,2-<i>O</i>-isopropylidene-3-C-methyl-5-<i>O</i>-(<i>p</i>-\ tolylsulfonyl)-D-ribofuranose","","- C16 H22 O6 S -","- C16 H22 O6 S -","- C64 H88 O24 S4 -","4","1","FJ2012","Hector Novoa de Armas; Bogdan Doboszewski; Piet Herdewijn; Norbert Blaton","3-Deoxy-1,2-<i>O</i>-isopropylidene-3-<i>C</i>-methyl-5-<i>O</i>-(<i>p</i>-tolylsulfonyl)-<small>D</small>-ribofuranose","Acta Crystallographica Section E","2007","63","5","o2678","o2680","10.1107/S1600536807018624","","","1.54178","CuKα","","0.0373","0.0363","","","0.1034","0.105","","","","","","1.113","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2213307","9.2908","0.001","16.4731","0.0015","11.0153","0.0013","90","","106.903","0.008","90","","1613","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-[(3-Hydroxy-5-phenyl-1H-pyrazol-4-yl)methyl]-5-phenyl-1H-pyrazol-3(2H)-one","","- C19 H16 N4 O2 -","- C19 H16 N4 O2 -","- C76 H64 N16 O8 -","4","1","FJ2013","Baryala, Yamna; Zerzouf, Abdelfettah; Essassi, El Mokhtar; Reuter, Hans; Eickmeier, Henning","4-[(3-Hydroxy-5-phenyl-1<i>H</i>-pyrazol-4-yl)methyl]-5-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2554","o2556","10.1107/S1600536807018387","","","0.71073","MoKα","","0.0862","0.0483","","","0.1078","0.1239","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213308","13.6262","0.0014","6.1497","0.0004","14.5103","0.0014","90","","117.307","0.007","90","","1080.42","0.18","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E)-3-[(2-Fluorophenylimino)methyl]benzene-1,2-diol","","- C13 H10 F N O2 -","- C13 H10 F N O2 -","- C52 H40 F4 N4 O8 -","4","1","FJ2014","Temel, Ersin; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-3-[(2-Fluorophenylimino)methyl]benzene-1,2-diol","Acta Crystallographica Section E","2007","63","5","o2642","o2642","10.1107/S1600536807018612","","","0.71073","MoKα","","0.1106","0.0401","","","0.0605","0.0717","","","","","","0.803","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213309","10.54","0.002","16.371","0.002","11.9778","0.0017","90","","105.191","0.013","90","","1994.6","0.5","89","2","89","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","trisindenylphosphine","Tris-(1H-inden-1-yl)-phosphane","","- C27 H21 P -","- C27 H21 P -","- C108 H84 P4 -","4","1","FL2112","Cantrell, Timothy; Perrotin, Philippe; Twamley, Brendan; Shapiro, Pamela J.","Tris(1<i>H</i>-inden-1-yl)phosphane","Acta Crystallographica Section E","2007","63","5","o2044","o2045","10.1107/S160053680701389X","","","0.71073","MoKα","","0.0513","0.0432","","","0.1014","0.1052","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213310","6.535","0.002","18.367","0.006","15.674","0.005","90","","91.726","0.006","90","","1880.5","1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-Dimethyl-1,1-bis[4-(trifluoromethyl)phenyl]-2,5-dihydro-1<i>H</i>-germole","","- C20 H18 F6 Ge -","- C20 H18 F6 Ge -","- C80 H72 F24 Ge4 -","4","1","FL2113","Huck, Lawrence A.; Harrington, Laura E.; Britten, James F.; Leigh, William J.","3,4-Dimethyl-1,1-bis[4-(trifluoromethyl)phenyl]-2,5-dihydro-1<i>H</i>-germole","Acta Crystallographica Section E","2007","63","5","m1282","m1283","10.1107/S1600536807015024","","","0.71073","MoKα","","0.0732","0.0396","","","0.0958","0.1089","","","","","","1.027","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213311","7.6672","0.0015","15.324","0.003","29.26","0.006","90","","90","","90","","3437.8","1.2","100","","100","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","podocarpaside E","3β,15α,25-Trihydroxy-6α,19α-epidioxy- 16,23-dione-9,10-seco-9,19-cyclolanost-5(10),9(11)-diene 3-O-α-<i>L</i>-arabinopyranoside","","- C35 H54 O12 -","- C35 H54 O12 -","- C140 H216 O48 -","4","1","FL2114","Ali, Zulfiqar; Khan, Ikhlas A.; Fronczek, Frank R.","Revision of the structure of podocarpaside <i>E</i>, from <i>Actaea podocarpa</i>","Acta Crystallographica Section E","2007","63","5","o2101","o2103","10.1107/S1600536807014018","","","0.71073","MoKα","","0.073","0.044","","","0.073","0.081","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213312","12.5293","0.0013","8.6751","0.0005","14.066","0.0016","90","","112.578","0.012","90","","1411.7","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","5α,6β-Dihydroxycholestan-3β-yl acetate","","- C29 H50 O4 -","- C29 H50 O4 -","- C58 H100 O8 -","2","1","FL2115","Pinto, R. M. A.; Ramos Silva, M.; Matos Beja, A.; Salvador, J. A. R.","5α,6β-Dihydroxycholestan-3β-yl acetate","Acta Crystallographica Section E","2007","63","5","o2138","o2139","10.1107/S1600536807014705","","","1.5418","CuKα","","0.1373","0.0512","","","0.1195","0.1528","","","","","","0.987","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213313","10.1299","0.0004","13.8108","0.0006","14.8758","0.0006","90","","109.598","0.002","90","","1960.59","0.14","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Hydroxy-3,5-dimethoxybenzaldehyde 3,4,5-trimethoxybenzoylhydrazone monohydrate","","- C19 H24 N2 O8 -","- C19 H24 N2 O8 -","- C76 H96 N8 O32 -","4","1","FL2117","Yi-Feng Sun; Xian-Zhong Sun; Ji-Kun Li; Yi-Ping Cui","4-Hydroxy-3,5-dimethoxybenzaldehyde 3,4,5-trimethoxybenzoylhydrazone monohydrate","Acta Crystallographica Section E","2007","63","5","o2180","o2181","10.1107/S1600536807015929","","","0.71073","MoKα","","0.1189","0.0533","","","0.1215","0.1508","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213314","27.324","0.006","8.879","0.004","7.037","0.004","90","","94.98","0.03","90","","1700.8","1.3","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-hydroxynaphthalen-1-aminium 2-carboxy-4,6-dinitrophenolate monohydrate","","- C17 H15 N3 O9 -","- C17 H15 N3 O9 -","- C68 H60 N12 O36 -","4","1","FL2118","Graham Smith; Urs D. Wermuth; David J. Young; Peter C. Healy","The 1:1 proton-transfer monohydrate salt of 3,5-dinitrosalicylic acid with 1-amino-5-hydroxynaphthalene","Acta Crystallographica Section E","2007","63","5","o2517","o2519","10.1107/S1600536807016637","","","0.71073","MoKα","","0.1703","0.0659","","","0.2058","0.2278","","","","","","1.142","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213315","9.7431","0.0002","6.0189","0.0002","9.809","0.0002","90","","105.462","0.001","90","","554.41","0.02","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(2<i>S</i>,4aR,8aS)-6-Oxoperhydronaphthalene-2-acetic acid","","- C12 H18 O3 -","- C12 H18 O3 -","- C24 H36 O6 -","2","1","FL2124","Dufort, Marisa D.; Desai, Janish; Lalancette, Roger A.; Thompson, Hugh W.","(2<i>S</i>,4a<i>R</i>,8a<i>S</i>)-6-Oxoperhydronaphthalene-2-acetic acid: `conglomerate' crystallization and catemeric hydrogen bonding in a bicyclic η-keto acid","Acta Crystallographica Section E","2007","63","5","o2753","o2753","10.1107/S1600536807019666","","","1.54178","CuKα","","0.032","0.032","","","0.091","0.091","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213316","14.876","0.002","25.205","0.003","11.0201","0.0015","90","","95.775","0.003","90","","4111","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","11-thiosemicarbazonoindeno[1,2-b]quinoxaline-8-carboxylic acid dimethyl sulfoxide solvate","","- C19 H17 N5 O3 S2 -","- C19 H17 N5 O3 S2 -","- C152 H136 N40 O24 S16 -","8","2","FL2127","Xi-Quan Che; Li-Bin Wang","The Schiff base 11-thiosemicarbazonoindeno[1,2-<i>b</i>]quinoxaline-8-carboxylic acid dimethyl sulfoxide solvate","Acta Crystallographica Section E","2007","63","5","o2681","o2681","10.1107/S1600536807019678","","","0.71073","MoKα","","0.1149","0.0665","","","0.1653","0.1984","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","199471","2020-10-21","18:00:00",""
"2213317","7.851","0.003","8.215","0.003","14.931","0.005","74.986","0.007","77","0.006","88.773","0.006","905.6","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","1,3-Dichloro-5-(dimethylamino)borazine","","- C2 H9 B3 Cl2 N4 -","- C2 H9 B3 Cl2 N4 -","- C8 H36 B12 Cl8 N16 -","4","2","FL2128","Rodriguez, Mark A.; Borek, Theodore T.","1,3-Dichloro-5-(dimethylamino)borazine","Acta Crystallographica Section E","2007","63","5","o2638","o2638","10.1107/S1600536807018995","","","0.71073","MoKα","","0.0564","0.0445","","","0.1089","0.1184","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213318","7.0181","0.0006","9.3458","0.0009","17.3003","0.0016","90","","90.958","0.002","90","","1134.56","0.18","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Benzylmorpholin-4-ium chloride","","- C11 H16 Cl N O -","- C11 H16 Cl N O -","- C44 H64 Cl4 N4 O4 -","4","1","GG3089","Copolovici, Dana; Silvestru, Cristian; Varga, Richard A.","4-Benzylmorpholin-4-ium chloride","Acta Crystallographica Section E","2007","63","5","o2465","o2465","10.1107/S1600536807017060","","","0.71073","MoKα","","0.052","0.0481","","","0.107","0.1093","","","","","","1.165","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213319","8.158","0.002","5.644","0.001","19.034","0.004","90","","100.07","0.03","90","","862.9","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Naphtho[2,3-<i>c</i>]pyrrole-1,3(2<i>H</i>)-dione","","- C12 H7 N O2 -","- C12 H7 N O2 -","- C48 H28 N4 O8 -","4","1","GK2064","Jan Janczak; Ryszard Kubiak","Naphtho[2,3-<i>c</i>]pyrrole-1,3(2<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","5","o2627","o2627","10.1107/S1600536807019022","","","0.71073","MoKα","","0.0674","0.0443","","","0.115","0.1279","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213320","25.252","0.005","8.2516","0.0017","16.017","0.003","90","","96.34","0.03","90","","3317","1.1","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3-[4,5-Bis(2-cyanoethylsulfanyl)-1,3-dithiol-2-yl]-1,3-thiazolidine-2-thione","","- C12 H13 N3 S6 -","- C12 H13 N3 S6 -","- C96 H104 N24 S48 -","8","1","GK2065","Yang, Wei; Ren, Zhi-Gang; Dai, Jie; Ng, Seik Weng","3-[4,5-Bis(2-cyanoethylsulfanyl)-1,3-dithiol-2-yl]-1,3-thiazolidine-2-thione","Acta Crystallographica Section E","2007","63","5","o2598","o2598","10.1107/S1600536807019034","","","0.71073","MoKα","","0.0348","0.0329","","","0.0795","0.0807","","","","","","1.129","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213321","20.8617","0.0017","8.9036","0.0007","31.734","0.003","90","","91.801","0.01","90","","5891.5","0.9","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,2-Bis[5-(2,2-dicyanovinyl)-2-<i>n</i>-butyl-3-thienyl]-3,3,4,4,5,5- hexafluorocyclopent-1-ene","","- C29 H22 F6 N4 S2 -","- C29 H22 F6 N4 S2 -","- C232 H176 F48 N32 S16 -","8","1","GK2066","Zheng, Chun-Hong; Pu, Shou-Zhi; Le, Zhang-Gao; Luo, Ming-Biao; Huang, De-Chao","1,2-Bis[2-<i>n</i>-butyl-5-(2,2-dicyanovinyl)-3-thienyl]-3,3,4,4,5,5-hexafluorocyclopent-1-ene: a new photochromic diarylethene compound","Acta Crystallographica Section E","2007","63","5","o2578","o2578","10.1107/S1600536807018909","","","0.71073","MoKα","","0.0682","0.0424","","","0.0959","0.1092","","","","","","1.012","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213322","11.2269","0.0006","15.7136","0.0008","19.6142","0.0012","90","","104.034","0.003","90","","3357","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(μ~2~-hydroxydi-2-pyridylmethanolato- κ^4^<i>N</i>,O:O,<i>N'</i>)bis[(pyridine-κ<i>N</i>)copper(II)] bis(perchlorate)","","- C32 H28 Cl2 Cu2 N6 O12 -","- C32 H28 Cl2 Cu2 N6 O12 -","- C128 H112 Cl8 Cu8 N24 O48 -","4","1","GK2068","Li, Ya-Min; Zhang, Jing-Lai; Zhao, Xiao-Wei","Bis(μ~2~-hydroxydi-2-pyridylmethanolato- κ^4^<i>N</i>,<i>O</i>:<i>O</i>,<i>N</i>')bis[(pyridine-κ<i>N</i>)copper(II)] bis(perchlorate)","Acta Crystallographica Section E","2007","63","5","m1510","m1510","10.1107/S1600536807019599","","","0.71073","MoKα","","0.0484","0.0415","","","0.1012","0.106","","","","","","1.077","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213323","7.9787","0.0009","11.8174","0.0013","17.7359","0.0019","90","","102.674","0.002","90","","1631.5","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,6-Dimethyl-2H-1,2,3-triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione‒4,7-phenanthroline (1/1)","","- C18 H15 N7 O2 -","- C18 H15 N7 O2 -","- C72 H60 N28 O8 -","4","1","GK2069","Carmen R. Maldonado; Miguel Quirós; Juan M. Salas","4,6-Dimethyl-2<i>H</i>-1,2,3-triazolo[4,5-<i>d</i>]pyrimidine-5,7(4<i>H</i>,6<i>H</i>)-dione‒4,7-phenanthroline (1/1)","Acta Crystallographica Section E","2007","63","5","o2727","o2727","10.1107/S1600536807020478","","","0.71073","MoKα","","0.0967","0.0529","","","0.0998","0.1126","","","","","","0.944","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213324","26.0085","0.0012","16.4458","0.0008","15.0304","0.0007","90","","105.786","0.001","90","","6186.5","0.5","297","2","297","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","{[N,N'-Bis(4-methoxybenzyl)ethane-1,2-diyldiimino]diacetato}bis(1H-imidazole- κN^3^)nickel(II)","","- C28 H34 N6 Ni O6 -","- C28 H34 N6 Ni O6 -","- C224 H272 N48 Ni8 O48 -","8","1","GW2007","Min Zhang; Hui-Li Weng; Xing-Man Xu","{[<i>N</i>,<i>N</i>'-Bis(4-methoxybenzyl)ethane-1,2-diyldiimino]diacetato}bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II)","Acta Crystallographica Section E","2007","63","5","m1465","m1466","10.1107/S1600536807019228","","","0.71073","MoKα","","0.0767","0.0499","","","0.1228","0.1314","","","","","","0.893","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213325","6.8321","0.0003","6.8321","0.0003","6.7605","0.0005","90","","90","","90","","315.56","0.03","295","2","295","2","","","","","","","","3","P 42/m","-P 4c","84","","tellurium compound strontium ditellurate(IV) tellurate(VI)","","- O8 Sr Te3 -","- O8 Sr Te3 -","- O16 Sr2 Te6 -","2","0.25","GW2008","Weil, Matthias; Stöger, Berthold","Redetermination of SrTe~3~O~8~ from a hydrothermally grown single crystal","Acta Crystallographica Section E","2007","63","5","i116","i118","10.1107/S1600536807015073","","","0.71073","MoKα","","0.0231","0.0229","","","0.0576","0.0577","","","","","","1.201","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213326","15.3299","0.0012","21.584","0.0011","21.3439","0.0016","90","","96.387","0.009","90","","7018.4","0.8","170","2","170","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Chloridobis[1,2-bis(diphenylphosphino)ethane](ethylimido)molybdenum(IV) tetraphenylborate acetonitrile disolvate","","- C82 H79 B Cl Mo N3 P4 -","- C82 H79 B Cl Mo N3 P4 -","- C328 H316 B4 Cl4 Mo4 N12 P16 -","4","1","GW2011","Mersmann, Klaus; Näther, Christian; Tuczek, Felix","Chloridobis[1,2-bis(diphenylphosphino)ethane](ethylimido)molybdenum(IV) tetraphenylborate acetonitrile disolvate","Acta Crystallographica Section E","2007","63","5","m1476","m1476","10.1107/S1600536807019320","","","0.71073","MoKα","","0.0523","0.0373","","","0.0944","0.1008","","","","","","1.014","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213327","8.6744","0.0017","8.7883","0.0018","9.3802","0.0019","92.45","0.03","99.7","0.03","119.56","0.03","606.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","{N-[N,N-Bis(2-aminoethyl)amino]ethanaminium]}nickel(II)] hexacyanidoferrate(II)","","- C18 H38 Fe N14 Ni -","- C18 H38 Fe N14 Ni -","- C18 H38 Fe N14 Ni -","1","0.5","HB2330","Yue-Juan Yao; Hui-Ming Shu; Chuan-Qin Du; Huai-Ming Hu","Bis{2-[<i>N</i>,<i>N</i>-bis(2-aminoethyl)amino]ethanaminium}nickel(II) hexacyanidoferrate(II)","Acta Crystallographica Section E","2007","63","5","m1208","m1210","10.1107/S1600536807013475","","","0.71073","MoKα","","0.0369","0.0319","","","0.0805","0.0829","","","","","","0.972","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213328","8.8679","0.0006","22.2946","0.0015","10.1532","0.0007","90","","90","","90","","2007.4","0.2","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Poly[μ~4~-benzene-1,3-dicarboxylato-di-μ~2~-benzimidazole-dizinc(II)]","","- C11 H7 N2 O2 Zn -","- C22 H14 N4 O4 Zn2 -","- C88 H56 N16 O16 Zn8 -","4","0.5","HB2335","Yun-Cheng Cui; Jia-Jun Wang; Bo Liu; Guang-Gang Gao; Qing-Wei Wang","Poly[μ~4~-benzene-1,3-dicarboxylato-di-μ~2~-benzimidazolato-dizinc(II)]","Acta Crystallographica Section E","2007","63","5","m1204","m1205","10.1107/S1600536807013712","","","0.71073","MoKα","","0.0335","0.0248","","","0.0661","0.0703","","","","","","1.006","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213329","15.2963","0.0008","9.1081","0.0004","22.2657","0.0011","90","","96.837","0.001","90","","3080","0.3","223","2","223","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[(Z)-O-Ethyl N-[4-(methoxycarbonyl)phenyl]thiocarbamato- κS](tricyclohexylphosphine-κP)gold(I)","","- C29 H45 Au N O3 P S -","- C29 H45 Au N O3 P S -","- C116 H180 Au4 N4 O12 P4 S4 -","4","1","HB2336","Ho, Soo Yei; Ng, Seik Weng; Tiekink, Edward R. T.","{(<i>Z</i>)-<i>O</i>-Ethyl <i>N</i>-[4-(methoxycarbonyl)phenyl]thiocarbamato-κ<i>S</i>}(tricyclohexylphosphine-κ<i>P</i>)gold(I)","Acta Crystallographica Section E","2007","63","5","m1211","m1213","10.1107/S1600536807013268","","","0.71069","MoKα","","0.036","0.028","","","0.069","0.071","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213330","14.0437","0.001","14.6038","0.0011","16.0762","0.0012","69.893","0.006","65.769","0.005","76.226","0.006","2805.2","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","25-Decyloxy-26,27,28-trihydroxy-5,11,17-tris(4-nitrophenyldiazenyl)-2,8,14,20- thiacalix[4]arene toluene hemisolvate","","- C55.5 H49 N9 O10 S4 -","- C55.5 H49 N9 O10 S4 -","- C111 H98 N18 O20 S8 -","2","1","HB2337","Kasyan, Oleg; Kalchenko, Vitaly; Böhmer, Volker; Bolte, Michael","25-Decyloxy-26,27,28-trihydroxy-5,11,17-tris(4-nitrophenyldiazenyl)-2,8,14,20-thiacalix[4]arene toluene hemisolvate","Acta Crystallographica Section E","2007","63","5","o2346","o2348","10.1107/S1600536807015012","","","0.71073","MoKα","","0.1321","0.0769","","","0.1854","0.2117","","","","","","1.005","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2213331","4.9957","0.0016","9.34","0.003","11.7","0.004","90","","95.882","0.006","90","","543","0.3","294","2","294","2","","","","","","","","5","P 1 21 1","P 2yb","4","","N-[2-(4-Bromophenoxy)ethyl]acetamide","","- C10 H12 Br N O2 -","- C10 H12 Br N O2 -","- C20 H24 Br2 N2 O4 -","2","1","HB2338","Shang, Zhen-Hua; Zhang, Hui-Li","<i>N</i>-[2-(4-Bromophenoxy)ethyl]acetamide","Acta Crystallographica Section E","2007","63","5","o2282","o2283","10.1107/S160053680701447X","","","0.71073","MoKα","","0.0725","0.039","","","","0.0903","","","","","","0.978","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213332","15.602","0.003","7.7795","0.0014","9.9721","0.0018","90","","90","","90","","1210.4","0.4","291","2","291","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2'-hydroxyacetophenone furan-2-carbohydrazide","","- C13 H12 N2 O3 -","- C13 H12 N2 O3 -","- C52 H48 N8 O12 -","4","1","HB2340","Xi-Shi Tai; Jie Yin; Yi-Min Feng","2'-Hydroxyacetophenone furan-2-carbohydrazide","Acta Crystallographica Section E","2007","63","5","o2267","o2268","10.1107/S160053680701358X","","","0.71073","MoKα","","0.0727","0.0603","","","0.1279","0.1327","","","","","","1.076","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213333","6.7756","0.001","7.4223","0.0011","15.848","0.002","90","","91.901","0.002","90","","796.57","0.19","294","2","294","2","","","","","","","","5","P 1 21 1","P 2yb","4","","<i>N</i>^5^-Ethyl-<i>N</i>^2^-(2-nitrophenylsulfonyl)glutamine","","- C13 H17 N3 O7 S -","- C13 H17 N3 O7 S -","- C26 H34 N6 O14 S2 -","2","1","HB2342","Jian-Guo Wang; Wen-Ming Li; Zheng-Ming Li; Hai-Bin Song","(<i>S</i>)-<i>N</i>^5^-Ethyl-<i>N</i>^2^-(2-nitrophenylsulfonyl)glutamine","Acta Crystallographica Section E","2007","63","5","o2668","o2669","10.1107/S1600536807018818","","","0.71073","MoKα","","0.0285","0.0264","","","0.0669","0.0698","","","","","","1.064","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213334","6.8116","0.0004","10.0669","0.0006","12.8482","0.0008","102.707","0.001","94.123","0.001","97.047","0.001","848.49","0.09","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[(10,11,12,13-tetrahydro-4,5,9,14- tetraazabenzo[b]triphenylene)cadmium(II)]-di-μ-chlorido]","","- C18 H14 Cd Cl2 N4 -","- C18 H14 Cd Cl2 N4 -","- C36 H28 Cd2 Cl4 N8 -","2","1","HB2344","Guang-Bo Che; Jian Wang; Xiu-Ying Li; Lu Lu","<i>catena</i>-Poly[[(10,11,12,13-tetrahydro-4,5,9,14-tetraazabenzo[<i>b</i>]triphenylene)cadmium(II)]-di-μ-chlorido]: a stair-like one-dimensional polymer","Acta Crystallographica Section E","2007","63","5","m1256","m1258","10.1107/S1600536807014730","","","0.71073","MoKα","","0.0241","0.0222","","","0.055","0.0561","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213335","8.947","0.002","10.373","0.003","22.477","0.006","90","","90","","90","","2086","0.9","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,3,4,6-Tetra-O-acetyl-2-O-methylsulfonyl-α-D-mannopyranoside","","- C15 H22 O12 S -","- C15 H22 O12 S -","- C60 H88 O48 S4 -","4","1","HB2345","Liu, Chun-Yan; An, Qi; Li, Hui","(1<i>S</i>,3<i>R</i>,4<i>R</i>)-1,3,4,6-Tetra-<i>O</i>-acetyl-2-<i>O</i>-methylsulfonyl-α-<small>D</small>-mannopyranoside","Acta Crystallographica Section E","2007","63","5","o2293","o2294","10.1107/S1600536807015619","","","0.71073","MoKα","","0.0706","0.0382","","","0.0792","0.0907","","","","","","0.991","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213336","26.379","0.006","9.706","0.002","14.15","0.003","90","","98.327","0.004","90","","3584.7","1.3","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","O-hydroxyethyl-N- (tert-butoxycarbonyl)-tyrosine methyl ester","tert-butyl N-{2-[4-(2-hydroxyethoxy)phenyl]-1-(methoxycarbonyl)ethyl}carbamate","","- C17 H25 N O6 -","- C17 H25 N O6 -","- C136 H200 N8 O48 -","8","1","HB2346","Liu, Chun-Yan; Li, Hui","<i>N</i>-(<i>tert</i>-Butoxycarbonyl)-<i>O</i>-(hydroxyethyl)tyrosine methyl ester","Acta Crystallographica Section E","2007","63","5","o2295","o2296","10.1107/S1600536807016121","","","0.71073","MoKα","","0.1117","0.0597","","","0.1387","0.1681","","","","","","1.024","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213337","10.437","0.002","10.438","0.002","21.004","0.004","90","","97.17","0.03","90","","2270.3","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-Methoxy-4-morpholino-6-(3-morpholinopropoxy)quinazoline trihydrate","","- C20 H34 N4 O7 -","- C20 H34 N4 O7 -","- C80 H136 N16 O28 -","4","1","HB2347","Ming-Dong Li; Min Ji","7-Methoxy-4-morpholino-6-(3-morpholinopropoxy)quinazoline trihydrate","Acta Crystallographica Section E","2007","63","5","o2445","o2446","10.1107/S160053680701639X","","","0.71073","MoKα","","0.1498","0.0801","","","0.1735","0.2049","","","","","","1.01","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213338","9.1469","0.0008","8.7961","0.0007","12.491","0.001","90","","94.965","0.001","90","","1001.22","0.14","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraaquabis[2-(4-pyridyl)ethanesulfonato-κN]cobalt(II)","","- C14 H24 Co N2 O10 S2 -","- C14 H24 Co N2 O10 S2 -","- C28 H48 Co2 N4 O20 S4 -","2","0.5","HB2348","Qi Zhang; Jian Gong","Tetraaquabis[2-(4-pyridyl)ethanesulfonato-κ<i>N</i>]cobalt(II)","Acta Crystallographica Section E","2007","63","5","m1300","m1301","10.1107/S1600536807015292","","","0.71073","MoKα","","0.03","0.024","","","0.0621","0.0662","","","","","","1.115","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213339","7.7156","0.0004","7.7329","0.0004","16.6895","0.0008","102.952","0.003","93.604","0.003","92.362","0.004","966.94","0.09","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","4,4-Difluoro-8-methyl-4-bora-3a,4a-diaza-<i>s</i>-indacene","","- C10 H9 B F2 N2 -","- C10 H9 B F2 N2 -","- C40 H36 B4 F8 N8 -","4","2","HB2349","Dong-Chuan Wang; Hong-Ping Wang; Shang Gao; Tong-Yan Zhang; Xiao-Jun Peng","4,4-Difluoro-8-methyl-4-bora-3a,4a-diaza-<i>s</i>-indacene","Acta Crystallographica Section E","2007","63","5","o2238","o2239","10.1107/S1600536807015243","","","0.71073","MoKα","","0.0472","0.0385","","","0.1077","0.1136","","","","","","1.082","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2213340","17.587","0.004","7.2102","0.0014","28.973","0.006","90","","106","0.03","90","","3531.6","1.4","291","2","291","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,5-Dimethyl-2-phenyl-4-[(2-oxo-2,3-dihydro-1H-indol-3-ylidene)amino]- 1H-pyrazol-3(2H)-one monohydrate","","- C19 H18 N4 O3 -","- C19 H18 N4 O3 -","- C152 H144 N32 O24 -","8","1","HB2350","Yi-Feng Sun; Ji-Kun Li; Zao-Bao Zheng","1,5-Dimethyl-4-[(2-oxo-2,3-dihydro-1<i>H</i>-indol-3-ylidene)amino]-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one monohydrate","Acta Crystallographica Section E","2007","63","5","o2520","o2521","10.1107/S1600536807017527","","","0.71073","MoKα","","0.1216","0.0667","","","0.1319","0.1493","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213341","8.042","0.0007","14.359","0.002","21.2641","0.0015","100.386","0.008","99.594","0.007","104.237","0.01","2283","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","5-[4-Chloro-2-(4-chlorobenzylsulfanyl)thiazol-5-ylmethylene]-3-(2,4- dichlorobenzyl)thiazolidine-2,4-dione","","- C21 H12 Cl4 N2 O2 S3 -","- C21 H12 Cl4 N2 O2 S3 -","- C84 H48 Cl16 N8 O8 S12 -","4","2","HB2351","Özgen, Özen; Bozdag̃‒Dündar, Oya; Ertan, Rahmiye; Kendi, Engin","5-[4-Chloro-2-(4-chlorobenzylsulfanyl)thiazol-5-ylmethylene]-3-(2,4-dichlorobenzyl)thiazolidine-2,4-dione","Acta Crystallographica Section E","2007","63","5","o2355","o2356","10.1107/S1600536807015139","","","1.54184","CuKα","","0.2863","0.0758","","","0.1644","0.2212","","","","","","1.028","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2213342","12.143","0.002","8.185","0.0016","20.942","0.004","90","","90.52","0.03","90","","2081.3","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(2,6-Dimethylphenyl)-2-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol- 5-yl]phenoxy}acetamide","","- C24 H20 F N3 O3 -","- C24 H20 F N3 O3 -","- C96 H80 F4 N12 O12 -","4","1","HB2352","Xing, Zhi-Tao; Wang, Hai-Bo; Yin, Jun; Ding, Wei-Lin; Wang, Pin-Liang","<i>N</i>-(2,6-Dimethylphenyl)-2-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]phenoxy}acetamide","Acta Crystallographica Section E","2007","63","5","o2062","o2063","10.1107/S1600536807014894","","","0.71073","MoKα","","0.115","0.0622","","","0.1457","0.1821","","","","","","1.102","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213343","8.1347","0.0016","12.964","0.003","7.6517","0.0015","90","","90.41","0.03","90","","806.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Bromobenzamide oxime","","- C7 H7 Br N2 O -","- C7 H7 Br N2 O -","- C28 H28 Br4 N8 O4 -","4","1","HB2353","Xing, Zhi-Tao; Wang, Hai-Bo; Yin, Jun; Wu, Wen-Yuan; Han, Feng","4-Bromobenzamide oxime","Acta Crystallographica Section E","2007","63","5","o2236","o2237","10.1107/S1600536807015863","","","0.71073","MoKα","","0.1222","0.0775","","","0.1486","0.1601","","","","","","1.259","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213344","10.873","0.005","5.064","0.002","11.641","0.005","90","","92.414","0.011","90","","640.4","0.5","293.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-hydroxybenzamide","","- C7 H7 N O2 -","- C7 H7 N O2 -","- C28 H28 N4 O8 -","4","1","HB2354","Hansen, Lars Kr.; Perlovich, German L.; Bauer-Brandl, Annette","Redetermination of 3-hydroxybenzamide","Acta Crystallographica Section E","2007","63","5","o2359","o2360","10.1107/S1600536807015577","","","0.7107","MoKα","","","0.0456","","","","0.0328","","","","","","1.802","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213345","6.788","0.002","6.957","0.002","10.849","0.003","76.127","0.002","75.198","0.002","79.483","0.003","476.9","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Bis(4-carboxamidopyridinium) diaquadioxalatocopper(II)","","- C16 H18 Cu N4 O12 -","- C16 H18 Cu N4 O12 -","- C16 H18 Cu N4 O12 -","1","0.5","HB2355","Chuan-Bi Li; Ying-Chun Gao","Bis(4-carboxamidopyridinium) diaquadioxalatocuprate(II)","Acta Crystallographica Section E","2007","63","5","m1337","m1338","10.1107/S1600536807017308","","","0.71073","MoKα","","0.0259","0.025","","","0.0667","0.0673","","","","","","1.001","","","","has coordinates","211332","2020-10-21","18:00:00",""
"2213346","11.288","0.0007","23.3977","0.0015","10.7391","0.0007","90","","113.074","0.001","90","","2609.4","0.3","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[N-(3,5-Dibromo-2-oxidophenylmethylene)phenylalaninato- κ^3^O,N,O']diphenyltin(IV)","","- C28 H21 Br2 N O3 Sn -","- C28 H21 Br2 N O3 Sn -","- C112 H84 Br8 N4 O12 Sn4 -","4","1","HB2356","Yang, Hong-Jun; Tian, Lai-Jin; Zhang, Chang-Fa; Zheng, Xiao-Feng","[<i>N</i>-(3,5-Dibromo-2-oxidobenzylidene)phenylalaninato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']diphenyltin(IV)","Acta Crystallographica Section E","2007","63","5","m1272","m1273","10.1107/S1600536807015152","","","0.71073","MoKα","","0.0395","0.031","","","0.0738","0.0776","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213347","9.5062","0.0007","9.7309","0.0007","19.0769","0.0015","78.704","0.002","87.906","0.001","76.874","0.001","1685.2","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","(4-Acetylphenolato)tris(2-methyl-2-phenylpropyl)tin(IV)","","- C38 H46 O2 Sn -","- C38 H46 O2 Sn -","- C76 H92 O4 Sn2 -","2","1","HB2357","Yang, Hong-Jun; Tian, Lai-Jin; Mao, Wu-Tao; Zheng, Xiao-Feng","(4-Acetylphenolato)tris(2-methyl-2-phenylpropyl)tin(IV)","Acta Crystallographica Section E","2007","63","5","m1271","m1271","10.1107/S1600536807015449","","","0.71073","MoKα","","0.0293","0.0263","","","0.0651","0.0667","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213348","9.3506","0.0004","9.8861","0.0005","21.7179","0.0009","90","","98.298","0.003","90","","1986.61","0.16","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,3-Dibromo-3-(5-bromo-6-methoxy-2-naphthyl)-1-(2,4-dichlorophenyl)propan-1-one","","- C20 H13 Br3 Cl2 O2 -","- C20 H13 Br3 Cl2 O2 -","- C80 H52 Br12 Cl8 O8 -","4","1","HB2359","Yathirajan, H. S.; Mayekar, Anil M.; Narayana, B.; Sarojini, B. K.; Bolte, Michael","2,3-Dibromo-3-(5-bromo-6-methoxy-2-naphthyl)-1-(2,4-dichlorophenyl)propan-1-one","Acta Crystallographica Section E","2007","63","5","o2345","o2345","10.1107/S1600536807015759","","","0.71073","MoKα","","0.0442","0.037","","","0.091","0.095","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213349","5.6027","0.0002","9.8858","0.0004","35.0048","0.0015","90","","92.576","0.002","90","","1936.86","0.13","85","2","85","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","11-Bromo-1-ferrocenylundecan-1-one","","- C21 H29 Br Fe O -","- C21 H29 Br Fe O -","- C84 H116 Br4 Fe4 O4 -","4","1","HB2360","McAdam, C. John; Robinson, Brian H.; Simpson, Jim","11-Bromo-1-ferrocenylundecan-1-one","Acta Crystallographica Section E","2007","63","5","m1362","m1362","10.1107/S1600536807016510","","","0.71073","MoKα","","0.065","0.0497","","","0.1152","0.12","","","","","","1.217","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213350","7.4469","0.0002","20.2814","0.0006","8.3443","0.0003","90","","94.14","0.0017","90","","1256.98","0.07","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl N-[2-(2-hydroxymethyl-1,3-dioxolan-2-yl)phenyl]carbamate","","- C13 H17 N O5 -","- C13 H17 N O5 -","- C52 H68 N4 O20 -","4","1","HB2361","Garden, Simon J.; Corrêa, Marilza B.; Pinto, Angelo C.; Wardell, James L.; Low, John N.; Glidewell, Christopher","Ethyl <i>N</i>-[2-(2-hydroxymethyl-1,3-dioxolan-2-yl)phenyl]carbamate","Acta Crystallographica Section E","2007","63","5","o2453","o2454","10.1107/S1600536807016467","","","0.71073","MoKα","","0.0524","0.04","","","0.1006","0.1077","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213351","13.544","0.002","4.6718","0.0004","12.6416","0.0019","90","","115.437","0.011","90","","722.35","0.18","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,3-Benzodioxol-5-ylmethanol","","- C8 H8 O3 -","- C8 H8 O3 -","- C32 H32 O12 -","4","1","HB2362","Yathirajan, H. S.; Bindya, S.; Ashok, M. A.; Narayana, B.; Bolte, Michael","1,3-Benzodioxol-5-ylmethanol","Acta Crystallographica Section E","2007","63","5","o2349","o2349","10.1107/S1600536807016480","","","0.71073","MoKα","","0.0365","0.0332","","","0.0856","0.0875","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213352","3.9522","0.0015","10.699","0.004","19.831","0.007","90","","93.393","0.008","90","","837.1","0.5","293.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(Acetylamino)benzoic acid","","- C9 H9 N O3 -","- C9 H9 N O3 -","- C36 H36 N4 O12 -","4","1","HB2363","Hansen, Lars Kr.; Perlovich, German L.; Bauer-Brandl, Annette","3-(Acetylamino)benzoic acid","Acta Crystallographica Section E","2007","63","5","o2361","o2361","10.1107/S1600536807017783","","","0.7107","MoKα","","","0.0515","","","","0.037","","","","","","1.496","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213353","7.6838","0.001","7.4659","0.0009","33.322","0.004","90","","90","","90","","1911.6","0.4","292","2","292","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","4a,5-Dihydro-2H-chromeno[4,3-c]pyridazin-3(4H)-one","","- C11 H10 N2 O2 -","- C11 H10 N2 O2 -","- C88 H80 N16 O16 -","8","2","HB2364","Zhong-Zhen Zhou; Hong-Bin Zhou","4a,5-Dihydro-2<i>H</i>-chromeno[4,3-<i>c</i>]pyridazin-3(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2512","o2512","10.1107/S1600536807017837","","","0.71073","MoKα","","0.0977","0.0569","","","0.1462","0.1786","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213354","7.3051","0.0016","11.85","0.002","18.165","0.003","90","","90","","90","","1572.5","0.5","290","2","290","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","4-phenylpyridinium hydrogentartrate dihydrate","4-Phenylpyridinium 3-carboxy-2,3-dihydroxypropanoate dihydrate","","- C15 H19 N O8 -","- C15 H19 N O8 -","- C60 H76 N4 O32 -","4","1","HB2365","Tsonko Kolev; Boris Shivachev; Rosica Petrova","4-Phenylpyridinium 3-carboxy-2,3-dihydroxypropanoate dihydrate","Acta Crystallographica Section E","2007","63","5","o2511","o2511","10.1107/S1600536807017217","","","0.71073","MoKα","","0.0893","0.0454","","","0.1011","0.1192","","","","","","0.94","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213355","5.6583","0.0016","11.268","0.003","11.817","0.003","73.244","0.004","82.518","0.005","80.991","0.005","709.6","0.3","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Tetrachloroisoindoline-1,3-dione N,N-dimethylformamide solvate","","- C11 H8 Cl4 N2 O3 -","- C11 H8 Cl4 N2 O3 -","- C22 H16 Cl8 N4 O6 -","2","1","HB2366","Liang, Zu-Pei; Li, Jian; Zhang, Yun-Chen; Tai, Xi-Shi","Tetrachloroisoindoline-1,3-dione <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2007","63","5","o2460","o2460","10.1107/S1600536807017333","","","0.71073","MoKα","","0.0681","0.0463","","","0.1168","0.1316","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213356","14.7132","0.0009","6.1977","0.0004","25.362","0.002","90","","90","","90","","2312.7","0.3","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Ethyl 6-methoxy-2-naphthoate","","- C14 H14 O3 -","- C14 H14 O3 -","- C112 H112 O24 -","8","1","HB2368","Yathirajan, H. S.; Bindya, S.; Sarojini, B. K.; Narayana, B.; Bolte, Michael","Ethyl 6-methoxy-2-naphthoate","Acta Crystallographica Section E","2007","63","5","o2350","o2350","10.1107/S1600536807017977","","","0.71073","MoKα","","0.0533","0.0388","","","0.097","0.1027","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213357","8.3839","0.0005","8.3839","0.0005","24.1471","0.0019","90","","90","","90","","1697.3","0.2","100","1","100","1","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","Di-μ-bromido-bis[(η^4^-cycloocta-1,5-diene)iridium(I)]","","- C16 H24 Br2 Ir2 -","- C16 H24 Br2 Ir2 -","- C64 H96 Br8 Ir8 -","4","0.5","HB2369","Tsuneaki Yamagata; Mitsuhiro Nagata; Kazushi Mashima; Kazuhide Tani","Di-μ-bromido-bis[(η^4^-cycloocta-1,5-diene)iridium(I)]","Acta Crystallographica Section E","2007","63","5","m1498","m1498","10.1107/S1600536807019769","","","0.71075","MoKα","","0.0408","0.0335","","","0.0621","0.0637","","","","","","1.089","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213358","14.472","0.007","7.083","0.004","14.563","0.008","90","","112.108","0.008","90","","1383","1.3","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Phthalic acid‒4,6-dimethylpyrimidin-2-amine (1/1)","","- C14 H15 N3 O4 -","- C14 H15 N3 O4 -","- C56 H60 N12 O16 -","4","1","HB2370","Li, Jian; Liang, Zu-Pei; Guo, Huan-Mei","Phthalic acid‒4,6-dimethylpyrimidin-2-amine (1/1)","Acta Crystallographica Section E","2007","63","5","o2673","o2673","10.1107/S1600536807019265","","","0.71073","MoKα","","0.1023","0.0469","","","0.1093","0.1354","","","","","","1.005","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213359","6.8628","0.0008","7.6128","0.0009","12.4949","0.0016","87.036","0.01","89.608","0.011","79.973","0.008","641.97","0.14","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","Methyl (4-oxo-1-phenyl-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-5-yl)acetate","","- C14 H12 N4 O3 -","- C14 H12 N4 O3 -","- C28 H24 N8 O6 -","2","1","HB2372","Yathirajan, H. S.; Bindya, S.; Sarojini, B. K.; Narayana, B.; Bolte, Michael","Methyl (4-oxo-1-phenyl-4,5-dihydro-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidin-5-yl)acetate","Acta Crystallographica Section E","2007","63","5","o2566","o2566","10.1107/S1600536807018934","","","0.71073","MoKα","","0.0394","0.0348","","","0.0929","0.0959","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213360","7.9704","0.0005","13.3058","0.0008","15.9084","0.0009","110.257","0.001","96.446","0.001","92.62","0.001","1566.28","0.16","299","2","299","2","","","","","","","","5","P -1","-P 1","2","","2-[(5,6,7-Trimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfanyl)methyl]benzoic acid","","- C16 H16 N4 O2 S -","- C16 H16 N4 O2 S -","- C64 H64 N16 O8 S4 -","4","2","HB2373","Yan-Zhen He","2-[(5,6,7-Trimethyl[1,2,4]triazolo[1,5-<i>a</i>]pyrimidin-2-ylsulfanyl)methyl]benzoic acid","Acta Crystallographica Section E","2007","63","5","o2675","o2675","10.1107/S1600536807019538","","","0.71073","MoKα","","0.0811","0.058","","","0.1431","0.1544","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213361","14.2353","0.0002","16.1402","0.0002","17.1387","0.0003","75.0826","0.0007","73.694","0.0008","73.5679","0.0009","3556.62","0.09","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","3,5-Bis[(dimethylamino)methyl]-1-nitro-4-(trimethylsilyl)benzene","","- C15 H27 N3 O2 Si -","- C15 H27 N3 O2 Si -","- C120 H216 N24 O16 Si8 -","8","4","HB2379","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.; Slagt, Martijn Q.; Koten, Gerard van","3,5-Bis[(dimethylamino)methyl]-1-nitro-4-(trimethylsilyl)benzene","Acta Crystallographica Section E","2007","63","5","o2588","o2589","10.1107/S1600536807019095","","","0.71073","MoKα","","0.0795","0.0535","","","0.1339","0.1478","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213362","10.7231","0.0002","11.7429","0.0002","21.7538","0.0003","90","","100.227","0.001","90","","2695.72","0.08","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[1,3-dihydroxy-2-hydroxymethyl-2-(5-nitro-2-oxidobenzylideneamino)propane- κ^3^<i>N</i>,<i>O</i>,<i>O</i>']zinc(II) trihydrate","","- C22 H32 N4 O15 Zn -","- C22 H32 N4 O15 Zn -","- C88 H128 N16 O60 Zn4 -","4","1","HB2383","Ali, Hapipah M.; Puvaneswary, Subramaniam; Wan Jefrey, Basirun; Ng, Seik Weng","Bis[1,3-dihydroxy-2-hydroxymethyl-2-(5-nitro-2-oxidobenzylideneamino)propane-κ^3^<i>N</i>,<i>O</i>,<i>O</i>']zinc(II) trihydrate","Acta Crystallographica Section E","2007","63","5","m1532","m1532","10.1107/S1600536807020521","","","0.71073","MoKα","","0.026","0.023","","","0.066","0.069","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213363","11.9285","0.0002","12.801","0.0002","15.5177","0.0003","90","","110.665","0.001","90","","2217.05","0.07","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2'-[(5-Bromo-1<i>H</i>-indol-3-yl)methylene]-2-(1<i>H</i>-indol-\ 3-yl)acetohydrazide ethyl acetate solvate","","- C23 H23 Br N4 O3 -","- C23 H23 Br N4 O3 -","- C92 H92 Br4 N16 O12 -","4","1","HB2384","Ali, Hapipah M.; Nazzatush Shimar, Jamaludin; Ng, Seik Weng","2'-[(5-Bromo-1<i>H</i>-indol-3-yl)methylene]-2-(1<i>H</i>-indol-3-yl)acetohydrazide ethyl acetate solvate","Acta Crystallographica Section E","2007","63","5","o2731","o2731","10.1107/S1600536807019824","","","0.71073","MoKα","","0.048","0.031","","","0.078","0.097","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213364","8.9319","0.0007","7.287","0.0005","16.825","0.0012","90","","94.07","0.006","90","","1092.32","0.14","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5,6,7-Trimethoxy-2,3-dihydroinden-1-one","","- C12 H14 O4 -","- C12 H14 O4 -","- C48 H56 O16 -","4","1","HB2386","Saeed, Aamer; Bolte, Michael","5,6,7-Trimethoxy-2,3-dihydroinden-1-one","Acta Crystallographica Section E","2007","63","5","o2757","o2757","10.1107/S1600536807019848","","","0.71073","MoKα","","0.0408","0.0361","","","0.0966","0.0991","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213365","11.21","0.002","12.084","0.002","14.919","0.003","84.64","0.04","68.16","0.04","74.38","0.03","1806.6","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Bis{4-[(2-hydroxybenzylidine)hydrazino]-8-(trifluoromethyl)quinolinium} sulfate tetrahydrate","","- C34 H34 F6 N6 O10 S -","- C34 H34 F6 N6 O10 S -","- C68 H68 F12 N12 O20 S2 -","2","1","HB2387","Yathirajan, H. S.; Sarojini, B. K.; Narayana, B.; Sunil, K.; Bolte, Michael","Bis{4-[(2-hydroxybenzylidine)hydrazino]-8-(trifluoromethyl)quinolinium} sulfate tetrahydrate","Acta Crystallographica Section E","2007","63","5","o2720","o2721","10.1107/S1600536807020430","","","0.71073","MoKα","","0.0609","0.0407","","","0.0953","0.1032","","","","","","0.987","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213366","13.9016","0.0001","5.8655","0.0001","8.5928","0.0001","90","","90","","90","","700.655","0.015","173","2","173","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","1H-indole-3-carbaldehyde","","- C9 H7 N O -","- C9 H7 N O -","- C36 H28 N4 O4 -","4","1","HB2388","Ng, Seik Weng","Low-temperature redetermination of 1<i>H</i>-indole-3-carbaldehyde","Acta Crystallographica Section E","2007","63","5","o2732","o2732","10.1107/S1600536807019915","","","0.71073","MoKα","","0.044","0.036","","","0.091","0.096","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213367","33.1196","0.0004","8.926","0.0001","9.9158","0.0001","90","","90","","90","","2931.36","0.06","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","2'-(5-Bromo-1<i>H</i>-indol-3-ylmethylene)benzenesulfonohydrazine","","- C15 H12 Br N3 O2 S -","- C15 H12 Br N3 O2 S -","- C120 H96 Br8 N24 O16 S8 -","8","1","HB2389","Ali, Hapipah M.; Yusnita, Juahir; Ng, Seik Weng","2'-(5-Bromo-1<i>H</i>-indol-3-ylmethylene)benzenesulfonohydrazine","Acta Crystallographica Section E","2007","63","5","o2733","o2733","10.1107/S1600536807019927","","","0.71073","MoKα","","0.028","0.027","","","0.081","0.082","","","","","","1.07","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213368","13.308","0.0002","10.0043","0.0001","23.7968","0.0003","90","","90","","90","","3168.24","0.07","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2'-(5-Methyl-1<i>H</i>-indol-3-ylmethylene)benzenesulfonohydrazine","","- C16 H15 N3 O2 S -","- C16 H15 N3 O2 S -","- C128 H120 N24 O16 S8 -","8","1","HB2390","Ali, Hapipah M.; Yusnita, Juahir; Ng, Seik Weng","2'-(5-Methyl-1<i>H</i>-indol-3-ylmethylene)benzenesulfonohydrazine","Acta Crystallographica Section E","2007","63","5","o2734","o2734","10.1107/S1600536807020065","","","0.71073","MoKα","","0.035","0.031","","","0.091","0.099","","","","","","1.01","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213369","12.664","0.002","12.664","","63.653","0.006","90","","90","","120","","8840.8","1.6","295","2","295","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","Hexaaquahexakis(μ~2~-3,5-diamino-1,2,4-triazole)trinickel(II) trisulfate octadecahydrate","","- C12 H78 N30 Ni3 O36 S3 -","- C12 H78 N30 Ni3 O36 S3 -","- C72 H468 N180 Ni18 O216 S18 -","6","0.166667","HB2392","Zhang, Guo-Fang; Zhao, Shu-Min; She, Jiang-Bo; Ng, Seik Weng","Hexaaquahexakis(μ~2~-3,5-diamino-1,2,4-triazole)trinickel(II) trisulfate octadecahydrate","Acta Crystallographica Section E","2007","63","5","m1517","m1518","10.1107/S160053680702051X","","","0.71073","MoKα","","0.055","0.047","","","0.17","0.18","","","","","","1.33","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213370","19.287","0.001","6.7697","0.0004","14.2238","0.0004","90","","91.444","0.001","90","","1856.57","0.16","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis(acetato-κO)triaquacadmium dihydrate 2-amino-4,6-dimethylpyrimidine tetrasolvate dihydrate","","- C28 H52 Cd N12 O9 -","- C28 H52 Cd N12 O9 -","- C56 H104 Cd2 N24 O18 -","2","0.5","HB2393","Fang, Hua; Ng, Seik Weng","Bis(acetato-κ<i>O</i>)triaquacadmium 2-amino-4,6-dimethylpyrimidine tetrasolvate dihydrate","Acta Crystallographica Section E","2007","63","5","m1523","m1524","10.1107/S1600536807020545","","","0.71073","MoKα","","0.061","0.052","","","0.133","0.145","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213371","7.103","0.001","14.851","0.002","16.058","0.002","90","","91.886","0.002","90","","1693","0.4","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Dibromido{4-chloro-2-[3-(dimethylamino)propyliminomethyl]phenolato}zinc(II)","","- C12 H17 Br2 Cl N2 O Zn -","- C12 H17 Br2 Cl N2 O Zn -","- C48 H68 Br8 Cl4 N8 O4 Zn4 -","4","1","HG2197","Qi-Yong Zhu; Yi-Jun Wei; Feng-Wu Wang","Dibromido{4-chloro-2-[3-(dimethylamino)propyliminomethyl]phenolato}zinc(II)","Acta Crystallographica Section E","2007","63","5","m1431","m1432","10.1107/S1600536807010379","","","0.71073","MoKα","","0.1061","0.0603","","","0.1539","0.1794","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213372","11.3","0.001","13.654","0.002","10.729","0.001","90","","94.024","0.002","90","","1651.3","0.3","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Dichlorido{2,4-dibromo-6-[2-(ethylammonio)ethyliminomethyl]phenolato}zinc(II)","","- C11 H14 Br2 Cl2 N2 O Zn -","- C11 H14 Br2 Cl2 N2 O Zn -","- C44 H56 Br8 Cl8 N8 O4 Zn4 -","4","1","HG2199","Wen-Hui Li","Dichlorido{2,4-dibromo-6-[2-(ethylammonio)ethyliminomethyl]phenolato}zinc(II)","Acta Crystallographica Section E","2007","63","5","m1446","m1447","10.1107/S1600536807018776","","","0.71073","MoKα","","0.0757","0.0428","","","0.0948","0.1078","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213373","12.2823","0.0004","13.7818","0.0004","21.697","0.0006","90","","90.8703","0.0007","90","","3672.28","0.19","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tris(2,2'-bipyridyl-κ^2^N,N')nickel(II) β-octamolybdate tetrahydrate","","- C60 H56 Mo8 N12 Ni2 O30 -","- C60 H48 Mo8 N12 Ni2 O30 -","- C120 H96 Mo16 N24 Ni4 O60 -","2","0.5","HG2202","Zhan-Hua Su; Bai-Bin Zhou; Zhi-Feng Zhao; Yu-Nan Zhang","Tris(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')nickel(II) β-octamolybdate tetrahydrate","Acta Crystallographica Section E","2007","63","5","m1206","m1207","10.1107/S1600536807013220","","","0.71073","MoKα","","0.0347","0.0245","","","0.0684","0.0721","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213374","8.6327","0.0001","10.6779","0.0002","10.8432","0.0002","79.001","0.001","85.057","0.001","72.838","0.001","936.99","0.03","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2-{[Tris(2-pyridyl)methyl]iminomethyl}phenol","","- C23 H18 N4 O -","- C23 H18 N4 O -","- C46 H36 N8 O2 -","2","1","HG2205","Li, Yin-Huai; Gao, Jun","2-[(Tri-2-pyridylmethyl)iminomethyl]phenol","Acta Crystallographica Section E","2007","63","5","o2291","o2292","10.1107/S1600536807015322","","","0.71073","MoKα","","0.0406","0.0364","","","0.097","0.1017","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213375","9.7712","0.0006","10.0443","0.0003","8.1779","0.0005","90","","112.568","0.003","90","","741.16","0.07","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(2aRS,3RS,4aSR,6aRS,6bSR)-3-Hydroxy-2a,3,4a,6,6a,6b-hexahydro-1,4- dioxacyclopenta[cd]pentalen-2(5H)-one","","","- C8 H10 O4 -","- C8 H10 O4 -","- C32 H40 O16 -","4","1","HG2207","Christian Peifer; Schollmeyer, Dieter; Melanie Tschertsche; Stefan Laufer","(2a<i>RS</i>,3<i>RS</i>,4a<i>SR</i>,6a<i>RS</i>,6b<i>SR</i>)-3-Hydroxy-2a,3,4a,6,6a,6b-hexahydro-1,4-dioxacyclopenta[cd]pentalen-2(5<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2249","o2251","10.1107/S1600536807014717","","","1.54178","CuKα","","0.045","0.0425","","","0.1101","0.1124","","","","","","1.078","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213376","7.949","0.003","10.176","0.003","11.802","0.004","111.237","0.006","101.026","0.006","103.892","0.006","821.9","0.5","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","Methyl 6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine- 5-carboxylate","","- C16 H20 N2 O6 -","- C16 H20 N2 O6 -","- C32 H40 N4 O12 -","2","1","HG2208","Shang, Zhen-Hua; Shang, Qing","Methyl 6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","5","o2280","o2281","10.1107/S1600536807015334","","","0.71073","MoKα","","0.1323","0.0516","","","0.1113","0.1476","","","","","","0.996","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213377","9.3937","0.0019","9.7464","0.0019","12.739","0.003","82.64","0.03","76.39","0.03","71.84","0.03","1075.2","0.5","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","dichloridobis(1,10-phenanthroline-κ^2^N,N')tungsten(II)","","- C24 H16 Cl2 N4 W -","- C24 H16 Cl2 N4 W -","- C48 H32 Cl4 N8 W2 -","2","1","HG2212","Wei Xu; Jian-Li Lin","A second polymorph of dichloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')tungsten(II)","Acta Crystallographica Section E","2007","63","5","m1188","m1190","10.1107/S1600536807013414","","","0.71073","MoKα","","0.0366","0.0294","","","0.063","0.0671","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213378","13.341","0.002","15.34","0.003","15.725","0.003","90","","90","","90","","3218.1","1","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(η^5^-1-n-Butyl-2,3,4,5-tetramethylcyclopentadienyl)trichloridotitanium(IV)","","- C13 H21 Cl3 Ti -","- C13 H21 Cl3 Ti -","- C104 H168 Cl24 Ti8 -","8","1","HG2215","Su, Qing; Wu, Qiao-Lin; Ye, Ling; Mu, Ying","(η^5^-1-<i>n</i>-Butyl-2,3,4,5-tetramethylcyclopentadienyl)trichloridotitanium(IV)","Acta Crystallographica Section E","2007","63","5","m1448","m1449","10.1107/S1600536807016649","","","0.71073","MoKα","","0.0662","0.0457","","","0.1127","0.1204","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213379","7.387","0.001","26.563","0.004","10.736","0.0015","90","","99.937","0.002","90","","2075","0.5","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Methyl-1-phenyl-4-[phenyl(8-quinolylamino)methylene]pyrazol-5(4H)-one","","- C26 H20 N4 O -","- C26 H20 N4 O -","- C104 H80 N16 O4 -","4","1","HG2216","Yi-Feng Sun; Ji-Kun Li; Ren-Tao Wu; Yi-Ping Cui","3-Methyl-1-phenyl-4-[phenyl(8-quinolylamino)methylene]pyrazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2176","o2177","10.1107/S1600536807014857","","","0.71073","MoKα","","0.0417","0.037","","","0.1093","0.1151","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213380","5.5811","0.0013","12.746","0.003","16.886","0.004","90","","90.664","0.004","90","","1201.1","0.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[(Isopropoxycarbonyl)phenylmethyl]ammonium chloride","","- C11 H16 Cl N O2 -","- C11 H16 Cl N O2 -","- C44 H64 Cl4 N4 O8 -","4","1","HG2217","Liu, Xiao-Xia; Fang, Hua; Lin, kan; Liu, Yan; Zhao, Yu-Fen","[(Isopropoxycarbonyl)phenylmethyl]ammonium chloride","Acta Crystallographica Section E","2007","63","5","o2351","o2352","10.1107/S1600536807014869","","","0.71073","MoKα","","0.0377","0.0359","","","0.1121","0.1137","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213381","6.285","0.002","26.91","0.003","4.78","0.002","90","","90","","90","","808.4","0.4","298","2","298","2","","","","","","","","4","P n n 2","P 2 -2n","34","2,2'-[(1,3-propylene)dioxybis(nitrilomethylidyne)]diphenol","2,2'-[(Propane-1,3-diyldioxy)bis(nitrilomethylidyne)]diphenol","","- C17 H18 N2 O4 -","- C17 H18 N2 O4 -","- C34 H36 N4 O8 -","2","0.5","HG2218","Jin-Gui Duan; Chen-Ming Dong; Jun-Yan Shi; Lei Wu; Wen-Kui Dong","2,2'-[(Propane-1,3-diyldioxy)bis(nitrilomethylidyne)]diphenol","Acta Crystallographica Section E","2007","63","5","o2704","o2705","10.1107/S1600536807019277","","","0.71073","MoKα","","0.0522","0.0375","","","0.0953","0.1084","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213382","7.1236","0.0002","18.0103","0.0006","12.5569","0.0004","90","","97.163","0.002","90","","1598.45","0.09","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Benzoylformaldehyde oximato-κ^2^N,O)(benzoylformaldehyde oxime-κN)chloridoplatinum(II)","","- C16 H13 Cl N2 O4 Pt -","- C16 H13 Cl N2 O4 Pt -","- C64 H52 Cl4 N8 O16 Pt4 -","4","1","HG2220","Kukushkin, Nikolay V.; Ketrush, Petru M.; Haukka, Matti","(Benzoylformaldehyde oximato-κ^2^<i>N</i>,<i>O</i>)(benzoylformaldehyde oxime-κ<i>N</i>)chloridoplatinum(II)","Acta Crystallographica Section E","2007","63","5","m1286","m1286","10.1107/S1600536807015747","","","0.71073","MoKα","","0.0308","0.0216","","","0.0407","0.0431","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213383","13.9846","0.0002","17.3102","0.0002","21.9143","0.0001","90","","107.025","0.0012","90","","5072.45","0.1","88","2","88","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(2,3,5,6-tetra-2-pyridylpyrazine-κ^2^N^1^,N^2^,N^6^)iron(II) tetrakis(thiocyanato-κN)iron(II) methanol solvate","","- C53 H36 Fe2 N16 O S4 -","- C53 H36 Fe2 N16 O S4 -","- C212 H144 Fe8 N64 O4 S16 -","4","1","HG2223","Motokawa, Natsuko; Maeda, Yonezo; Hayami, Shinya","Bis(2,3,5,6-tetra-2-pyridylpyrazine-κ^2^<i>N</i>^1^,<i>N</i>^2^,<i>N</i>^6^)iron(II) tetrakis(thiocyanato-κ<i>N</i>)ferrate(II) methanol solvate","Acta Crystallographica Section E","2007","63","5","m1521","m1521","10.1107/S1600536807019903","","","0.71069","MoKα","","0.0573","0.0347","","","0.0708","0.0751","","","","","","0.927","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213384","15.9656","0.0019","9.7566","0.0012","16.1805","0.0019","90","","102.625","0.002","90","","2459.5","0.5","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C8 H7.5 Br1.5 N O1.625 -","- C8 H7.5 Br3 N2 O3.25 -","- C64 H60 Br24 N16 O26 -","8","2","HG2225","Xiang-Chao Zeng; Xue-Ling Xu; Xin Ling; Jing Zeng; Xia Li","Methyl [(3,4,5-tribromo-1<i>H</i>-pyrrolyl-2-carbonyl)amino]acetate 0.25-hydrate","Acta Crystallographica Section E","2007","63","5","o2712","o2712","10.1107/S1600536807019289","","","0.71073","MoKα","","0.1156","0.0426","","","0.0753","0.0993","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213385","14.428","0.003","16.397","0.004","15.798","0.003","90","","108.987","0.003","90","","3534.1","1.3","291","2","291","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[μ-Cucurbit[6]uril]bis[pentaaquacalcium(II)] bis[tetrachloridozinc(II)] septhydrate","","- C36 H70 Ca2 Cl8 N24 O29 Zn2 -","- C36 H70 Ca2 Cl8 N24 O29 Zn2 -","- C72 H140 Ca4 Cl16 N48 O58 Zn4 -","2","0.5","HG2226","Shao, Ying; Li, Yi-Zhi; Shi, Jie-Ping; Lu, Guo-Yuan","[μ-Cucurbit[6]uril(2{-})]bis[pentaaquacalcium(II)] bis[tetrachloridozincate(II)] heptahydrate","Acta Crystallographica Section E","2007","63","5","m1480","m1481","10.1107/S1600536807019435","","","0.71073","MoKα","","0.0903","0.0607","","","0.125","0.1313","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213386","10.0062","0.0007","9.6093","0.0007","15.1933","0.0011","90","","103.371","0.001","90","","1421.28","0.18","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(N,N'-di-2-furylethane-1,2-diamine-κ^2^N,N')bis(perchlorato-κO)copper(II)","","- C24 H32 Cl2 Cu N4 O12 -","- C24 H32 Cl2 Cu N4 O12 -","- C48 H64 Cl4 Cu2 N8 O24 -","2","0.5","HG2227","Xiao-Hui Wang; Zhi-Quan Pan; Yi-Zhi Li; Hong Zhou","Bis(<i>N</i>,<i>N</i>'-di-2-furylethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')bis(perchlorato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2007","63","5","m1545","m1545","10.1107/S1600536807019885","","","0.71073","MoKα","","0.0671","0.0504","","","0.1031","0.1063","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213387","8.9295","0.0006","10.3932","0.0007","24.015","0.002","81.439","0.001","85.35","0.001","70.521","0.001","2076.6","0.3","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","2,2,6,6-Tetra-n-butyl-2,6-dichloro-4,8- bis{[(1E)-4-methoxybenzylidene]hydrazino}- 1,5-diaza-2,6-distanna-3,7-dithiabicyclo[3.3.0]octane 1,5-bis[(1E)-4-methoxybenzylidene]thiocarbonohydrazide ethanol solvate","","- C72 H102 Cl2 N14 O8 S4 Sn2 -","- C72 H102 Cl2 N14 O8 S4 Sn2 -","- C72 H102 Cl2 N14 O8 S4 Sn2 -","1","0.5","HG2228","Fang, Xiao-Niu; Wu, Jian-Hong; Sui, Yan; Hu, Ping; Hu, Rong-Hua","The first example of a dinuclear organotin complex with a C~2~N~2~S~2~Sn~2~ planar dicyclo fragment","Acta Crystallographica Section E","2007","63","5","m1525","m1526","10.1107/S1600536807020090","","","0.71073","MoKα","","0.034","0.0304","","","0.0855","0.0874","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213388","5.652","0.003","11.674","0.008","18.585","0.012","106.915","0.009","92.642","0.006","94.478","0.008","1166.6","1.3","113","2","113","2","","","","","","","","5","P -1","-P 1","2","1-pivaloyl-3-(pyrimidin-2-yl)thiourea","1-Pivaloyl-3-(pyrimidin-2-yl)thiourea","","- C10 H14 N4 O S -","- C10 H14 N4 O S -","- C40 H56 N16 O4 S4 -","4","2","HG2229","Sultana, Sarwat; Khawar Rauf, M.; Ebihara, Masahiro; Badshah, Amin","1-Pivaloyl-3-(pyrimidin-2-yl)thiourea","Acta Crystallographica Section E","2007","63","5","o2674","o2674","10.1107/S1600536807019459","","","0.7107","MoKα","","0.0809","0.0588","","","0.1093","0.1181","","","","","","1.103","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213389","15.5869","0.0006","13.1068","0.0005","9.0349","0.0004","90","","90","","90","","1845.78","0.13","293","2","150","","","","","","","","","7","P n m a","-P 2ac 2n","62","","<i>fac</i>-Aqua(bipyrazine)tricarbonylrhenium(I) hexafluorophosphate dihydrate","","- C11 H12 F6 N4 O6 P Re -","- C11 H12 F6 N4 O6 P Re -","- C44 H48 F24 N16 O24 P4 Re4 -","4","0.5","HK2150","Rillema, D. Paul; Kirgan, Robert A.; Smucker, Bradley; Curtis Moore","<i>fac</i>-Aqua(2,2'-bipyrazine)tricarbonylrhenium(I) hexafluorophosphate dihydrate","Acta Crystallographica Section E","2007","63","5","m1404","m1405","10.1107/S1600536807017734","","","0.71073","MoKα","","0.0161","0.0161","","","0.037","0.037","","","","","","1.169","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213390","8.691","0.002","10.8185","0.0013","12.492","0.004","82.2","0.02","78.2","0.02","73.872","0.015","1100.6","0.5","298","","","","","","","","","","","3","P -1","-P 1","2","","","","- C29 H26 O3 -","- C29 H26 O3 -","- C58 H52 O6 -","2","1","HK2191","Rashidi Ranjbar, Parviz; Abbasi, Alireza; Vafakish, Bahareh; Fischer, Andreas","1-[(2-Hydroxy-1-naphthyl)(phenyl)methyl]-2-naphthol ethanol solvate","Acta Crystallographica Section E","2007","63","5","o2093","o2094","10.1107/S1600536807010033","","","0.71073","MoKα","","0.0762","0.0514","","","0.125","0.1394","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213391","11.8655","0.001","10.9961","0.0009","22.5449","0.0018","90","","90","","90","","2941.5","0.4","294","2","294","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","catena-poly[[[hexa-μ~2~-hydroxido-hexa-μ~3~-oxido-decaoxido- chromium(III)hexamolybdenum(IV)]-μ~2~-oxido-[heptaaquaneodymium(III)]- μ~2~-oxido] tetrahydrate]","","- Cr H22 Mo6 Nd O35 -","- Cr H22 Mo6 Nd O35 -","- Cr4 H88 Mo24 Nd4 O140 -","4","1","HK2201","Da-Peng Zhou; Dong Yang","A new chain-like polyoxometallate based on B-Anderson-type building blocks and rare earth metal ion linkers","Acta Crystallographica Section E","2007","63","5","i113","i115","10.1107/S1600536807007787","","","0.71073","MoKα","","0.0233","0.0223","","","0.0583","0.0588","","","","","","1.078","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213392","13.96","0.003","8.5633","0.0018","12.523","0.003","90","","103.789","0.004","90","","1453.9","0.6","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(4-Flurophenyl)-6-(3-nitrophenyl)-3,4-dihydropyridin-2(1H)-one","","- C17 H13 F N2 O3 -","- C17 H13 F N2 O3 -","- C68 H52 F4 N8 O12 -","4","1","HK2209","Xiao-Tong Zhu; Shu-Jiang Tu","4-(4-Fluorophenyl)-6-(3-nitrophenyl)-3,4-dihydropyridin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2108","o2110","10.1107/S1600536807013633","","","0.71073","MoKα","","0.12","0.0443","","","0.097","0.126","","","","","","0.989","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213393","8.4882","0.0018","9.0617","0.0019","10.7716","0.0019","96.539","0.006","101.032","0.006","111.508","0.005","741.1","0.3","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Bis(benzimidazolium) diaquabis(pyridine-2,4-dicarboxylato-κ^2^N,O)manganese(II) dihydrate","","- C28 H28 Mn N6 O12 -","- C28 H28 Mn N6 O12 -","- C28 H28 Mn N6 O12 -","1","0.5","HK2212","Zhang, Chun-Xia; Ma, Cheng-Bing; Hu, Ming-Qiang; Chen, Chang-Neng; Liu, Qiu-Tian","Bis(benzimidazolium) diaquabis(pyridine-2,4-dicarboxylato-κ^2^<i>N</i>,<i>O</i>)manganese(II) dihydrate","Acta Crystallographica Section E","2007","63","5","m1424","m1426","10.1107/S1600536807016352","","","0.71073","MoKα","","","0.0505","","","0.1141","0.129","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213394","14.4474","0.0015","19.514","0.002","21.771","0.002","90","","97.642","0.002","90","","6083.3","1","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(tetraethylammonium) bis[N,N'-bis(4-methylbenzothiazol-2-yl)pyridine- 2,6-dicarboxamidato(2-)]nickel(II) hemihydrate","","- C62 H71 N12 Ni O4.5 S4 -","- C62 H71 N12 Ni O4.5 S4 -","- C248 H284 N48 Ni4 O18 S16 -","4","1","HK2215","Liu, Sheng-Gui; Ni, Chun-Lin","Bis(tetraethylammonium) bis[<i>N</i>,<i>N</i>'-bis(4-methylbenzothiazol-2-yl)pyridine-2,6-dicarboxamidato(2‒)]nickel(II) hemihydrate","Acta Crystallographica Section E","2007","63","5","m1373","m1374","10.1107/S1600536807016492","","","0.71073","MoKα","","0.0633","0.0524","","","0.1337","0.1399","","","","","","0.939","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213395","8.6363","0.0011","11.066","0.0014","11.8153","0.0015","67.874","0.003","81.656","0.002","70.473","0.002","985.6","0.2","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","N-(4-Fluorophenyl)-2-{[(1E)-(4-methoxyphenyl)methylene]amino}-4,5,6,7- tetrahydro-1-benzothiophene-3-carboxamide","","- C23 H21 F N2 O2 S -","- C23 H21 F N2 O2 S -","- C46 H42 F2 N4 O4 S2 -","2","1","HK2216","Anilkumar, G. N.; Kokila, M. K.; Puttaraja; Mohan, S.; Saravanan, J.","<i>N</i>-(4-Fluorophenyl)-2-{[(1<i>E</i>)-(4-methoxyphenyl)methylene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide","Acta Crystallographica Section E","2007","63","5","o2077","o2079","10.1107/S1600536807012937","","","0.71073","MoKα","","0.1206","0.0704","","","0.1555","0.1821","","","","","","0.993","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213396","13.86","0.002","7.3946","0.0014","21.063","0.002","90","","90.105","0.002","90","","2158.7","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(1-Formyl-2-naphtholato-κ^2^O,O')dioxo(1,10-phenanthroline- κ^2^N,N')vanadium(V) dichloromethane quatersolvate","","- C23.25 H15.5 Cl0.5 N2 O4 V -","- C23.25 H15.5 Cl0.5 N2 O4 V -","- C93 H62 Cl2 N8 O16 V4 -","4","1","HK2217","Jian-Fang Dong; Lian-Zhi Li; Hui Cui; Da-Qi Wang; Tao Xu","(1-Formyl-2-naphtholato-κ^2^<i>O</i>,<i>O</i>')dioxo(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')vanadium(V) dichloromethane 0.25-solvate","Acta Crystallographica Section E","2007","63","5","m1458","m1460","10.1107/S1600536807016741","","","0.71073","MoKα","","0.1679","0.0929","","","0.237","0.3023","","","","","","0.979","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213397","17.792","0.004","7.992","0.0016","8.359","0.0017","90","","100.29","0.03","90","","1169.5","0.4","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(salicylidene-β-alaninato-κ^2^O,O')potassium(I)","","- C10 H11 K N O4 -","- C10 H11 K N O4 -","- C40 H44 K4 N4 O16 -","4","1","HK2219","Xu-Sheng Gao; Yong-Min Wan; Qin Zhou; Yuan-Xiang Shi; Jin-Tang Wang","Aqua(salicylidene-β-alaninato-κ^2^<i>O</i>,<i>O</i>')potassium(I)","Acta Crystallographica Section E","2007","63","5","m1417","m1418","10.1107/S1600536807017199","","","0.71073","MoKα","","0.1001","0.0597","","","0.1274","0.1416","","","","","","1.029","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213398","8.668","0.0017","9.64","0.0019","16.424","0.003","90","","90","","90","","1372.4","0.5","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Bis(2-hydroxy-5-methylphenyl)ethane","2,2'-ethylidenebis(4-methylphenol)","","- C16 H18 O2 -","- C16 H18 O2 -","- C64 H72 O8 -","4","1","HK2220","Dong, Su-Lan; Wu, Wen-Yuan; Tian, Wen-Wen; Xu, Jia-Ying; Wang, Jin-Tang","2,2'-Ethylidenebis(4-methylphenol)","Acta Crystallographica Section E","2007","63","5","o2357","o2358","10.1107/S1600536807015607","","","0.71073","MoKα","","0.0674","0.0467","","","0.1155","0.1257","","","","","","1.081","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213399","7.4253","0.0007","11.5124","0.0011","33.0405","0.0019","90","","93.1","0.03","90","","2820.3","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-benzylidene-5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine","","- C16 H13 N3 O S -","- C16 H13 N3 O S -","- C128 H104 N24 O8 S8 -","8","2","HK2222","Wan, Rong; Ni, Jue-Ping; Han, Feng; Zhang, Jin-Jun; Wang, Jin-Tang","<i>N</i>-Benzylidene-5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-amine","Acta Crystallographica Section E","2007","63","5","o2363","o2364","10.1107/S1600536807015668","","","0.71073","MoKα","","0.132","0.0772","","","0.1514","0.1818","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213400","7.7541","0.0016","17.086","0.003","11.383","0.002","90","","98.72","0.03","90","","1490.7","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[μ-5,5'-di-2-pyridyl-1,1'-(p- phenylenedimethylene)bis(1H-tetrazole)]-[chloridocopper(II)]-di-μ-chlorido- [chloridocopper(II)] acetonitrile solvate]","","- C24 H22 Cl4 Cu2 N12 -","- C24 H22 Cl4 Cu2 N12 -","- C48 H44 Cl8 Cu4 N24 -","2","0.5","HK2223","Lei Li; Tong-Liang Hu; Xian-He Bu","<i>catena</i>-Poly[[[μ-5,5'-di-2-pyridyl-1,1'-(<i>p</i>-phenylenedimethylene)bis(1<i>H</i>-tetrazole)]-[chloridocopper(II)]-di-μ-chlorido-[chloridocopper(II)]] acetonitrile solvate]","Acta Crystallographica Section E","2007","63","5","m1393","m1394","10.1107/S1600536807016704","","","0.71073","MoKα","","0.0439","0.0343","","","0.077","0.0812","","","","","","1.058","","","","has coordinates,has Fobs","249787","2020-10-21","18:00:00",""
"2213401","7.4015","0.0016","22.945","0.005","9.184","0.002","90","","96.145","0.004","90","","1550.7","0.6","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(R)-Methyl 2-(2-chlorophenyl)-2-(phenylsulfonyloxy)acetate","","- C15 H13 Cl O5 S -","- C15 H13 Cl O5 S -","- C60 H52 Cl4 O20 S4 -","4","1","HK2224","Yan Sun; Xue-Yuan Wang; Jie Zhu; Wei Su","(<i>R</i>)-Methyl 2-(2-chlorophenyl)-2-(phenylsulfonyloxy)acetate","Acta Crystallographica Section E","2007","63","5","o2378","o2379","10.1107/S1600536807015632","","","0.71073","MoKα","","0.0518","0.0351","","","0.0878","0.0975","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213402","27.986","0.003","9.6403","0.0012","14.513","0.004","90","","111.746","0.011","90","","3636.9","1.2","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(2-chlorobenzoato-κO)bis(phenazone-κO)zinc(II) 0.612-hydrate","","- C36 H33.22 Cl2 N4 O6.61 Zn -","- C36 H33.224 Cl2 N4 O6.612 Zn -","- C144 H132.896 Cl8 N16 O26.448 Zn4 -","4","0.5","HK2225","Maroszová, Jaroslava; Findoráková, Lenka; Györyvá, Katarína; Koman, Marian; Melník, Milan","Bis(2-chlorobenzoato-κ<i>O</i>)bis(phenazone-κ<i>O</i>)zinc(II) 0.612-hydrate","Acta Crystallographica Section E","2007","63","5","m1406","m1407","10.1107/S1600536807016765","","","0.71073","MoKα","","0.1505","0.0641","","","0.1115","0.1382","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213403","11.068","0.003","7.9037","0.0018","16.677","0.004","90","","95.487","0.004","90","","1452.2","0.6","294","2","294","2","","","","","","","","3","P 1 21 1","P 2yb","4","","2b,24-dihydroxyurs-12-en-27-oic acid methanol solvate","","- C31 H52 O5 -","- C31 H52 O5 -","- C62 H104 O10 -","2","1","HK2226","Jun-Yi Hu; Zhi Yao; Ying-Qian Xu; Pu Liu; Hong-Quan Duan","2β,24-Dihydroxyurs-12-en-27-oic acid methanol solvate from the rhizome of <i>Astilbe chinensis</i>","Acta Crystallographica Section E","2007","63","5","o2375","o2377","10.1107/S1600536807015206","","","0.71073","MoKα","","0.0716","0.0442","","","0.0959","0.1095","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213404","5.9138","0.0001","8.5561","0.0002","9.4413","0.0002","115.246","0.001","96.147","0.001","94.512","0.001","425.481","0.016","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","Poly[Bis(sulfolane-κO)di-μ~2~-thiocyanato-cadmium(II)]","","- C10 H16 Cd N2 O4 S4 -","- C10 H16 Cd N2 O4 S4 -","- C10 H16 Cd N2 O4 S4 -","1","0.5","HK2227","Wang, Xin-Qiang; Fan, Jian-Dong; Yu, Wen-Tao; Xu, Dong; Liu, Wei-Liang","Poly[bis(sulfolane-κ<i>O</i>)di-μ~2~-thiocyanato-cadmium(II)]","Acta Crystallographica Section E","2007","63","5","m1461","m1462","10.1107/S1600536807016984","","","0.71069","MoKα","","0.0202","0.0195","","","0.0553","0.0562","","","","","","1.079","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213405","8.613","0.005","10.321","0.005","11.753","0.005","90","","106.08","0.005","90","","1003.9","0.9","100","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>-Boranyl-<i>N</i>-(trimethylsilyl)pyrrolidine","","- C7 H20 B N Si -","- C7 H20 B N Si -","- C28 H80 B4 N4 Si4 -","4","1","HK2228","Jaganyi, Deogratius; Chathuri, Udhir; Munro, Orde Q.","<i>N</i>-Boranyl-<i>N</i>-(trimethylsilyl)pyrrolidine","Acta Crystallographica Section E","2007","63","5","o2689","o2689","10.1107/S1600536807019344","","","0.71073","MoKα","","","0.0307","","","","0.0896","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213407","12.6184","0.0018","11.0787","0.0016","23.074","0.003","90","","90","","90","","3225.6","0.8","292","2","292","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3-Methyl-1-phenylbenzothieno[3,2-d]imidazo[1,2-a]pyrimidine-2,5(1H,3H)-dione","","- C19 H13 N3 O2 S -","- C19 H13 N3 O2 S -","- C152 H104 N24 O16 S8 -","8","1","HK2230","Min-Hui Cao","3-Methyl-1-phenylbenzothieno[3,2-<i>d</i>]imidazo[1,2-<i>a</i>]pyrimidine-2,5(1<i>H</i>,3<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","5","o2660","o2660","10.1107/S1600536807017576","","","0.71073","MoKα","","0.0768","0.0496","","","0.1069","0.1149","","","","","","0.923","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213408","4.0639","0.0009","15.617","0.003","13.735","0.003","90","","92.212","0.004","90","","871.1","0.3","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-4,4'-(But-2-ene-1,4-diyldioxy)bis(3-methoxybenzaldehyde)","","- C20 H20 O6 -","- C20 H20 O6 -","- C40 H40 O12 -","2","0.5","HK2231","Ustabaş, Reşat; Çoruh, Ufuk; Sancak, Kemal; Er, Mustafa; Vázquez-López, Ezequiel M.","(<i>E</i>)-4,4'-(But-2-ene-1,4-diyldioxy)bis(3-methoxybenzaldehyde)","Acta Crystallographica Section E","2007","63","5","o2452","o2452","10.1107/S1600536807018181","","","0.71073","MoKα","","0.0953","0.0543","","","0.1254","0.1393","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213410","6.3017","0.0018","10.203","0.003","10.685","0.003","83.059","0.005","77.303","0.004","80.297","0.005","658.1","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","2,8-dichloro Tröger's base","2,8-Dichloro-6<i>H</i>,12<i>H</i>-5,11- methanodibenzo[<i>b</i>,<i>f</i>][1,5]diazocine","","- C15 H12 Cl2 N2 -","- C15 H12 Cl2 N2 -","- C30 H24 Cl4 N4 -","2","1","HK2235","Faroughi, Masoud; Try, Andrew C.; Turner, Peter","2,8-Dichloro-6<i>H</i>,12<i>H</i>-5,11-methanodibenzo[<i>b</i>,<i>f</i>][1,5]diazocine","Acta Crystallographica Section E","2007","63","5","o2695","o2695","10.1107/S1600536807019496","","","0.71073","MoKα","","0.0314","0.0296","","","0.0758","0.0773","","","","","","1.065","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213411","10.38","0.0017","9.2743","0.0015","16.588","0.003","90","","94.399","0.003","90","","1592.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(η^3^-2-tert-butyl-3-phenyl-1-trimethylsilyl-1-azaallyl)cobalt(II)","","- C30 H48 Co N2 Si2 -","- C30 H48 Co N2 Si2 -","- C60 H96 Co2 N4 Si4 -","2","0.5","HY2049","Yuan, Hai-Yan; Tong, Hong-Bo; Wei, Xue-Hong","Bis(η^3^-2-<i>tert</i>-butyl-3-phenyl-1-trimethylsilyl-1-azaallyl)cobalt(II)","Acta Crystallographica Section E","2007","63","5","m1325","m1326","10.1107/S160053680701536X","","","0.71073","MoKα","","0.0558","0.045","","","0.1156","0.1234","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213412","20.47","0.001","9.6494","0.0005","14.7843","0.0007","90","","101.783","0.001","90","","2858.7","0.2","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(2,2'-bipyridine-κ^2^N,N')zinc(II)]- μ-imidazole-4,5-dicarboxylato-κ^4^N^1^,O^5^:N^3^,O^4^]","","- C15 H10 N4 O4 Zn -","- C15 H10 N4 O4 Zn -","- C120 H80 N32 O32 Zn8 -","8","2","HY2050","Xiu-Mei Li; Yan-Hui Dong; Qing-Wei Wang; Bo Liu","<i>catena</i>-Poly[[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')zinc(II)]-μ-imidazole-4,5-dicarboxylato-κ^4^<i>N</i>^1^,<i>O</i>^5^:<i>N</i>^3^,<i>O</i>^4^]","Acta Crystallographica Section E","2007","63","5","m1274","m1276","10.1107/S1600536807014420","","","0.71073","MoKα","","0.0342","0.0286","","","0.0717","0.0744","","","","","","1.046","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213413","11.489","0.002","15.054","0.003","12.186","0.002","90","","116.4","0.03","90","","1887.8","0.8","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[aqua(pyrazino[2,3-f][1,10]phenanthroline-κ^2^N,N')copper(II)]-μ- benzene-1,4-dicarboxylato-κ^2^O^1^:O^4^]","","- C22 H14 Cu N4 O5 -","- C22 H14 Cu N4 O5 -","- C88 H56 Cu4 N16 O20 -","4","1","HY2052","Yong-Mei Zhang; Dong-Yan Hou; Guang Xin; Tie-Chun Li","<i>catena</i>-Poly[[aqua(pyrazino[2,3-<i>f</i>][1,10]phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)]-μ-benzene-1,4-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^4^]","Acta Crystallographica Section E","2007","63","5","m1363","m1364","10.1107/S1600536807016753","","","0.71073","MoKα","","0.0533","0.0408","","","0.1149","0.1219","","","","","","1.071","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213414","3.5987","0.0001","9.1257","0.0001","9.2311","0.0001","91.139","0.001","99.159","0.001","91.535","0.001","299.093","0.01","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Sodium isocyanurate monohydrate","","- C3 H4 N3 Na O4 -","- C3 H4 N3 Na O4 -","- C6 H8 N6 Na2 O8 -","2","1","HY2054","Zhu, Bao-Yong; Han, Chun-Lei; Fan, Jian-Dong; Yu, Wen-Tao; Cui, De-Liang; Jing, Hai-Peng","Sodium isocyanurate monohydrate","Acta Crystallographica Section E","2007","63","5","m1463","m1464","10.1107/S1600536807019484","","","0.71073","MoKα","","0.0423","0.0357","","","0.1069","0.1134","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213415","4.7524","0.0005","12.246","0.001","15.14","0.001","90","","98.915","0.007","90","","870.47","0.13","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2,3-dichlorophenyl)acetamide","","- C8 H7 Cl2 N O -","- C8 H7 Cl2 N O -","- C32 H28 Cl8 N4 O4 -","4","1","IM2006","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(2,3-Dichlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","5","o2631","o2632","10.1107/S1600536807019307","","","1.5418","CuKα","","0.0799","0.0409","","","0.0898","0.1024","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213416","8.63","0.001","36.969","0.004","10.605","0.001","90","","104.111","0.001","90","","3281.4","0.6","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","rac-2,2'-Bis(diphenylphosphinoyl)-1,1'-binaphthyl","","- C44 H32 O2 P2 -","- C44 H32 O2 P2 -","- C176 H128 O8 P8 -","4","1","IM2007","Marie-Hélène Thibault; Frédéric-Georges Fontaine","<i>rac</i>-2,2'-Bis(diphenylphosphinoyl)-1,1'-binaphthyl","Acta Crystallographica Section E","2007","63","5","o2087","o2088","10.1107/S1600536807013621","","","0.71073","MoKα","","0.0559","0.0518","","","0.1277","0.1304","","","","","","1.115","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213417","8.584","0.0005","13.274","0.0004","9.908","0.0007","90","","105.789","0.005","90","","1086.36","0.11","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-Chlorophenyl)-N-(4,5-dihydro-1H-imidazol-2-yl)amine formamide solvate","","- C10 H13 Cl N4 O -","- C10 H13 Cl N4 O -","- C40 H52 Cl4 N16 O4 -","4","1","IM2008","Sema Öztürk Yıldırım; Mehmet Akkurt; Süleyman Servi; Memet Şekerci; Frank W. Heinemann","<i>N</i>-(4-Chlorophenyl)-<i>N</i>-(4,5-dihydro-1<i>H</i>-imidazol-2-yl)amine formamide solvate","Acta Crystallographica Section E","2007","63","5","o2130","o2132","10.1107/S1600536807014936","","","0.71073","MoKα","","0.0626","0.0418","","","0.1019","0.1111","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213418","40.837","0.008","7.457","0.002","17.424","0.004","90","","90","","90","","5306","2","298","2","298","2","","","","","","","","6","F d d 2","F 2 -2d","43","","Bis(μ~2~-dihydrogen phosphato-κ^2^O:O')(μ~2~-hydrogen phosphate-κ^2^O:O')bis[(1,10-phenanthroline-κ^2^N,N')manganese(II)]","","- C24 H21 Mn2 N4 O12 P3 -","- C24 H21 Mn2 N4 O12 P3 -","- C192 H168 Mn16 N32 O96 P24 -","8","0.5","IM2010","Huan-Xin Liu; Xiao Jiang; Yun-xiao Liang","Bis(μ~2~-dihydrogen phosphato-κ^2^<i>O</i>:<i>O</i>')(μ~2~-hydrogen phosphato-κ^2^<i>O</i>:<i>O</i>')bis[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)]","Acta Crystallographica Section E","2007","63","5","m1472","m1472","10.1107/S1600536807019332","","","0.71073","MoKα","","0.0215","0.0208","","","0.0497","0.0498","","","","","","1.146","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213419","21.8177","0.0015","16.5383","0.0011","17.799","0.0012","90","","105.171","0.001","90","","6198.5","0.7","297","2","297","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","5,11,17,23-tert-butyl-25,27:26,28-bis[oxy(2,8-dioxo-3,7-diazanonamethy lene)oxy]-2,8,14,20-tetrathiacalix[4]arene chloroform disolvate","","- C56 H70 Cl6 N4 O8 S4 -","- C56 H70 Cl6 N4 O8 S4 -","- C224 H280 Cl24 N16 O32 S16 -","4","0.5","IS2152","Li, Xiong; Gong, Shu-Ling; Liu, Yu-Fang; Zheng, Qin; Chen, Yuan-Yin","1,3-Alternate thiacalix[4]bisazacrown chloroform disolvate","Acta Crystallographica Section E","2007","63","5","o2097","o2098","10.1107/S1600536807013785","","","0.71073","MoKα","","0.067","0.0567","","","0.1697","0.1775","","","","","","1.112","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213420","13.8165","0.0004","13.8623","0.0004","14.1524","0.0005","98.8719","0.001","105.388","0.001","109.064","0.0008","2382.21","0.13","93.1","","","","","","","","","","","7","P -1","-P 1","2","","Poly[bis(acetone)bis[μ-4-[(5-chloro-2-oxidophenyl)diazenyl]-3-oxido-N- phenylnaphthalene-2-carboxamidato]sodium(I)ferrate(III)]","","- C52 H40 Cl2 Fe N6 Na O8 -","- C52 H40 Cl2 Fe N6 Na O8 -","- C104 H80 Cl4 Fe2 N12 Na2 O16 -","2","1","IS2155","Mizuguchi, Jin; Sato, Yohei; Uta, Kazuya","Poly[bis(acetone)bis[μ-4-[(5-chloro-2-oxidophenyl)diazenyl]-3-oxido-<i>N</i>-phenylnaphthalene-2-carboxamidato]sodium(I)ferrate(III)]","Acta Crystallographica Section E","2007","63","5","m1377","m1378","10.1107/S1600536807017369","","","0.71075","MoKα","","","0.0557","","","","0.163","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213421","9.3845","0.0005","14.6825","0.0009","18.8748","0.0011","90","","99.443","0.001","90","","2565.5","0.3","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(benzyltripenylphosphinium) bis(1,2-dicyanoethene-1,2-dithiolato)nickel(II)","","- C58 H44 N4 Ni P2 S4 -","- C58 H44 N4 Ni P2 S4 -","- C116 H88 N8 Ni2 P4 S8 -","2","0.5","KJ2051","Jia-Rong Zhou; Chun-Lin Ni; Lin-Liang Yu","Bis(benzyltriphenylphosphonium) bis(1,2-dicyanoethene-1,2-dithiolato)nickel(II)","Acta Crystallographica Section E","2007","63","5","m1427","m1429","10.1107/S1600536807018715","","","0.71073","MoKα","","0.0434","0.0379","","","0.1031","0.1068","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213422","16.804","0.003","9.2783","0.0013","11.244","0.002","90","","99.39","0.02","90","","1729.6","0.5","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-{(Z)-2-[(E)-1-(2-Hydroxyphenyl)methylidene]hydrazono}-1,2-diphenylethan-1-one","","- C21 H16 N2 O2 -","- C21 H16 N2 O2 -","- C84 H64 N8 O8 -","4","1","KJ2052","Abbasi, Alireza; Mohammadi Ziarani, Ghodsi; Tarighi, Sara","2-{(<i>Z</i>)-2-[(<i>E</i>)-1-(2-Hydroxyphenyl)methylidene]hydrazono}-1,2-diphenylethan-1-one","Acta Crystallographica Section E","2007","63","5","o2579","o2580","10.1107/S1600536807018727","","","0.71073","MoKα","","0.0853","0.0418","","","0.1042","0.1246","","","","","","0.889","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213423","8.1587","0.0018","13.703","0.003","18.66","0.004","90","","99.991","0.003","90","","2054.5","0.8","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-Diphenyl-2-{[1-(quinoxalin-3-yl)propylidene]hydrazono}ethanone","","- C25 H20 N4 O -","- C25 H20 N4 O -","- C100 H80 N16 O4 -","4","1","KJ2053","Liu, Qi-Kui; Ma, Jian-Ping; Huang, Ru-Qi; Dong, Yu-Bin","1,2-Diphenyl-2-{[1-(quinoxalin-3-yl)propylidene]hydrazono}ethanone","Acta Crystallographica Section E","2007","63","5","o2646","o2647","10.1107/S1600536807017710","","","0.71073","MoKα","","0.0683","0.0461","","","0.1122","0.1243","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213424","12.5402","0.0012","8.1958","0.0008","19.3421","0.0019","90","","98.786","0.002","90","","1964.6","0.3","100","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-[3,5-Dimethoxy-2-(trimethylsilyl)phenyl]-4-trimethylsilylsydnone","","- C16 H26 N2 O4 Si2 -","- C16 H26 N2 O4 Si2 -","- C64 H104 N8 O16 Si8 -","4","1","KP2079","Grossie, David A.; Sun, Lihong; Turnbull, Kenneth","3-[3,5-Dimethoxy-2-(trimethylsilyl)phenyl]-4-trimethylsilylsydnone","Acta Crystallographica Section E","2007","63","5","o2042","o2043","10.1107/S160053680701361X","","","0.71073","MoKα","","0.0688","0.0659","","","0.1509","0.1524","","","","","","1.217","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213425","13.712","0.009","8.807","0.005","17.265","0.009","90","","108.74","0.05","90","","1974","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tris(1,3-dimethylurea)diiodidocadmium(II)","","- C9 H24 Cd I2 N6 O3 -","- C9 H24 Cd I2 N6 O3 -","- C36 H96 Cd4 I8 N24 O12 -","4","0.5","KP2091","Ilya A. Zamilatskov; Dmitry V. Albov; Maria G. Zaitseva; Valery V. Kravchenko; Elena V. Savinkina","Tris(1,3-dimethylurea)diiodidocadmium(II)","Acta Crystallographica Section E","2007","63","5","m1335","m1336","10.1107/S160053680701416X","","","0.71073","Mokα","","0.0582","0.0474","","","0.1163","0.1237","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213426","9.714","0.006","8.895","0.006","15.359","0.01","90","","91.688","0.007","90","","1326.5","1.5","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-poly[[bis(pyridine)iron(II)]-μ-oxalato-κ^2^O,O':κ^2^O'',O''']","","- C12 H10 Fe N2 O4 -","- C12 H10 Fe N2 O4 -","- C48 H40 Fe4 N8 O16 -","4","1","KP2094","Hua-Gang Yao; Min Ji; Sou-Hua Ji; Yong-Lin An","<i>catena</i>-Poly[[bis(pyridine-κ<i>N</i>)iron(II)]-μ-oxalato-κ^2^<i>O</i>,<i>O</i>':κ^2^<i>O</i>'',<i>O</i>''']","Acta Crystallographica Section E","2007","63","5","m1349","m1350","10.1107/S1600536807016789","","","0.71073","MoKα","","0.0464","0.0331","","","0.0869","0.0938","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213427","7.4903","0.0005","9.9299","0.0007","10.558","0.0008","76.363","0.001","70.395","0.001","68.972","0.001","684.52","0.08","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","(1,3-Diaminopropan-2-ol-κ^2^N,N')(3-hydroxycyclobutane-1,1-dicarboxylato- κ^2^O,O')platinum(II) monohydrate","","- C9 H14 N2 O7 Pt -","- C9 H14 N2 O7 Pt -","- C18 H28 N4 O14 Pt2 -","2","1","KP2095","Ming-Jin, Xie; Xi-Zhu Chen; Wei-Ping Liu; Yao Yu; Qing-Shong Ye","(1,3-Diaminopropan-2-ol-κ^2^<i>N</i>,<i>N</i>')(3-hydroxycyclobutane-1,1-dicarboxylato-κ^2^<i>O</i>,<i>O</i>')platinum(II) monohydrate","Acta Crystallographica Section E","2007","63","5","m1495","m1497","10.1107/S1600536807018211","","","0.71073","MoKα","","0.0358","0.0327","","","0.0859","0.0877","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213428","15.1483","0.0008","10.8842","0.0005","32.5725","0.0015","90","","90","","90","","5370.5","0.4","180","2","180","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Aqua(2,2'-bipyridine)(2,2':6',2''-terpyridine)ruthenium(II) bis(perchlorate)","","- C25 H21 Cl2 N5 O9 Ru -","- C25 H21 Cl2 N5 O9 Ru -","- C200 H168 Cl16 N40 O72 Ru8 -","8","1","KP2096","Qvortrup, Katrine; McKenzie, Christine J.; Bond, Andrew D.","Aqua(2,2'-bipyridine)(2,2':6',2''-terpyridine)ruthenium(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","5","m1400","m1401","10.1107/S1600536807015504","","","0.71073","MoKα","","0.0896","0.0425","","","0.1006","0.117","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213429","11.31","0.001","8.064","0.001","18.642","0.001","90","","96.09","0.02","90","","1690.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","bis(dibenzoylmethanoato) bis(morpholine)cobalt(II)","Bis(1,3-diphenylpropane-1,3-dionato-κ^2^O,O')bis(morpholine-κN)cobalt(II)","","- C38 H40 Co N2 O6 -","- C38 H40 Co N2 O6 -","- C76 H80 Co2 N4 O12 -","2","0.5","KP2100","Branko Kaitner; Ernest Meštrović","Bis(1,3-diphenylpropane-1,3-dionato-κ^2^<i>O</i>,<i>O</i>')bis(morpholine-κ<i>N</i>)cobalt(II)","Acta Crystallographica Section E","2007","63","5","m1549","m1550","10.1107/S1600536807020557","","","0.71073","MoKα","","0.0944","0.0562","","","0.1427","0.1637","","","","","","0.989","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213430","12.2464","0.0008","18.7781","0.0012","7.4984","0.0005","90","","94.241","0.002","90","","1719.64","0.19","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","8-Bromonaphthalene-1-carbaldehyde (4-methylphenylsulfonyl)hydrazone","","- C18 H15 Br N2 O2 S -","- C18 H15 Br N2 O2 S -","- C72 H60 Br4 N8 O8 S4 -","4","1","KP2101","Novak, Igor; Li, Wei; Harrison, Leslie J.","8-Bromonaphthalene-1-carbaldehyde (4-methylphenylsulfonyl)hydrazone","Acta Crystallographica Section E","2007","63","5","o2599","o2599","10.1107/S1600536807019113","","","0.71073","MoKα","","0.0882","0.055","","","0.1348","0.151","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213431","7.0211","0.0005","11.5366","0.0008","12.1874","0.0008","90","","90","","90","","987.17","0.12","223","2","223","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1,5-diiodonaphthalene","1,5-Diiodonaphthalene","","- C10 H6 I2 -","- C10 H6 I2 -","- C40 H24 I8 -","4","1","KP2102","Novak, Igor","1,5-Diiodonaphthalene","Acta Crystallographica Section E","2007","63","5","o2726","o2726","10.1107/S1600536807020508","","","0.71073","MoKα","","0.0346","0.0326","","","0.0758","0.0768","","","","","","1.094","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213432","16.2228","0.0011","20.1251","0.0014","10.2569","0.0007","90","","105.342","0.001","90","","3229.4","0.4","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[(<i>Z</i>)-5-Ferrocenylvinyl-2-methylthien-3-yl]-2-[(<i>E</i>)-5- ferrocenylvinyl-2-methylthien-3-yl]cyclopentene","","- C39 H36 Fe2 S2 -","- C39 H36 Fe2 S2 -","- C156 H144 Fe8 S8 -","4","1","LH2302","Guan, Jin-Tao; Yu, Guang-Ao; Yin, Jun; Lin, Yan; Liu, Sheng-Hua","1-[(<i>Z</i>)-5-Ferrocenylvinyl-2-methylthien-3-yl]-2-[(<i>E</i>)-5-ferrocenylvinyl-2-methylthien-3-yl]cyclopentene","Acta Crystallographica Section E","2007","63","5","m1499","m1500","10.1107/S1600536807019708","","","0.71073","MoKα","","0.0569","0.0453","","","0.1058","0.1119","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213433","25.665","0.003","7.8952","0.0008","12.1933","0.0013","90","","90.996","0.002","90","","2470.4","0.5","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[(E)-5-Ferrocenylvinyl-2-methylthien-3-yl]-2-(5-formyl-2-methylthien- 3-yl)cyclopentene","","- C28 H26 Fe O S2 -","- C28 H26 Fe O S2 -","- C112 H104 Fe4 O4 S8 -","4","1","LH2310","Guan Jin-Tao; Yu, Guang-Ao; Yin, Jun; Meng, Xiang-Gao; Liu, Sheng-Hua","1-[(<i>E</i>)-5-Ferrocenylvinyl-2-methylthien-3-yl]-2-(5-formyl-2-methylthien-3-yl)cyclopentene","Acta Crystallographica Section E","2007","63","5","m1515","m1516","10.1107/S160053680701968X","","","0.71073","MoKα","","0.0469","0.0398","","","0.1079","0.117","","","","","","1.052","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213434","9.8917","0.0004","12.9205","0.0009","15.5882","0.0009","90","","103.216","0.006","90","","1939.5","0.2","290","2","290","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","trans-rac-2-Hexyl-1-oxo-3-(2-pyridyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid","","- C21 H24 N2 O3 -","- C21 H24 N2 O3 -","- C84 H96 N8 O12 -","4","1","LH2313","Kandinska, Meglena I.; Todorov, Iliya S.; Boris Shivachev; Bogdanov, Milen G.","<i>trans</i>-<i>rac</i>-2-Hexyl-1-oxo-3-(2-pyridyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid","Acta Crystallographica Section E","2007","63","5","o2544","o2546","10.1107/S1600536807010562","","","0.71073","MoKα","","0.1281","0.0894","","","0.2519","0.2918","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213435","4.888","0.0008","12.495","0.002","20.889","0.004","90","","90","","90","","1275.8","0.4","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(E)-N'-(5-bromo-2-hydroxybenzylidene)furan-2-carbohydrazide monohydrate","","- C12 H11 Br N2 O4 -","- C12 H11 Br N2 O4 -","- C48 H44 Br4 N8 O16 -","4","1","LH2320","Tai, Xi-Shi; Yin, Jie; Hao, Ming-Yang; Liang, Zu-Pei","(<i>E</i>)-<i>N</i>'-(5-Bromo-2-hydroxybenzylidene)furan-2-carbohydrazide monohydrate","Acta Crystallographica Section E","2007","63","5","o2144","o2145","10.1107/S1600536807014687","","","0.71073","MoKα","","0.0389","0.0293","","","0.0654","0.0695","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213436","6.348","0.001","24.834","0.003","10.134","0.001","90","","98.442","0.002","90","","1580.3","0.4","298","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Di-μ-thiocyanato-κ^2^S:N;κ^2^N:S-bis{[N,N-dimethyl-N'-(2-pyridylmethylene- κN)ethane-1,2-diamine-κ^2^N,N']nickel(II)} bis(perchlorate)","","- C22 H30 Cl2 N8 Ni2 O8 S2 -","- C22 H30 Cl2 N8 Ni2 O8 S2 -","- C44 H60 Cl4 N16 Ni4 O16 S4 -","2","0.5","LH2325","Yun-Peng Diao","Di-μ-thiocyanato-κ^2^<i>S</i>:<i>N</i>;κ^2^<i>N</i>:<i>S</i>-bis{[<i>N</i>,<i>N</i>-dimethyl-<i>N</i>'-(2-pyridylmethylene-κ<i>N</i>)ethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>']nickel(II)} bis(perchlorate)","Acta Crystallographica Section E","2007","63","5","m1453","m1454","10.1107/S1600536807019149","","","0.71073","MoKα","","0.1018","0.0779","","","0.1932","0.215","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213437","13.857","0.002","12.0094","0.0017","12.0553","0.0017","90","","107.368","0.007","90","","1914.7","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diethyl 4-(4-tert-butylphenyl)pyridine-2,6-dicarboxylate","","- C21 H25 N O4 -","- C21 H25 N O4 -","- C84 H100 N4 O16 -","4","1","LH2330","Santoni, Marie-Pierre C.; Fang, Yuan-Qing; Hanan, Garry S.; Proust, Anna; Hasenknopf, Bernold","Diethyl 4-(4-<i>tert</i>-butylphenyl)pyridine-2,6-dicarboxylate","Acta Crystallographica Section E","2007","63","5","o2560","o2562","10.1107/S160053680701834X","","","1.54178","CuKα","","0.0792","0.0592","","","0.1557","0.1756","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213438","8.6637","0.0017","10.551","0.002","11.63","0.002","78.63","0.03","71.28","0.03","69.52","0.03","938.9","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","μ-Oxido-bis(dichlorido{η^5^-2,3,4,5-tetramethyl-1-[3,5- bis(trifluoromethyl)phenyl]cyclopentadienyl}titanium(IV))","","- C34 H30 Cl4 F12 O Ti2 -","- C34 H30 Cl4 F12 O Ti2 -","- C34 H30 Cl4 F12 O Ti2 -","1","0.5","LH2331","Wu, Qiao-Lin; Ye, Ling; Li, Bao; Mu, Ying","μ-Oxido-bis({η^5^-1-[3,5-bis(trifluoromethyl)phenyl]-2,3,4,5-tetramethylcyclopentadienyl}dichloridotitanium(IV))","Acta Crystallographica Section E","2007","63","5","m1194","m1195","10.1107/S1600536807013360","","","0.71073","MoKα","","0.0578","0.0494","","","0.1314","0.1371","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213439","11.2342","0.0003","5.8141","0.0001","12.3584","0.0003","90","","115.523","0.0008","90","","728.44","0.03","296","1","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H18 O3 S -","- C16 H18 O3 S -","- C32 H36 O6 S2 -","2","1","LH2333","Wen Pei; Yongjiang Wang; Mengzhan Sun; Xiaobo Xiong; Changquan Yu","(5<i>R</i>,6<i>S</i>)-6-Methyl-5-(phenylsulfonylacetyl)bicyclo[2.2.1]hept-2-ene","Acta Crystallographica Section E","2007","63","5","o2142","o2143","10.1107/S1600536807014006","","","0.71069","MoKα","","","0.0449","","","","0.1378","","","","","","1.004","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213440","13.991","0.002","5.0713","0.0008","17.0873","0.0017","90","","119.956","0.008","90","","1050.4","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[(5-Methylthiazol-2-ylimino)methyl]phenol","","- C11 H10 N2 O S -","- C11 H10 N2 O S -","- C44 H40 N8 O4 S4 -","4","1","LH2334","Chun-Niu Zhang; Ming-Hua Yang; Yun-Fa Zheng","2-[(5-Methylthiazol-2-ylimino)methyl]phenol","Acta Crystallographica Section E","2007","63","5","o2040","o2041","10.1107/S1600536807013682","","","0.71073","MoKα","","0.0687","0.0644","","","0.1529","0.1558","","","","","","1.18","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213441","10.8278","0.0019","18.276","0.003","9.4755","0.0017","90","","115.735","0.003","90","","1689.1","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N'-(4-Hydroxy-3-methoxybenzylidene)-3,5-dimethoxybenzohydrazide monohydrate","","- C17 H20 N2 O6 -","- C17 H20 N2 O6 -","- C68 H80 N8 O24 -","4","1","LH2335","Shang, Zhen-Hua; Zhang, Hui-Li; Ding, Yue","<i>N</i>'-(4-Hydroxy-3-methoxybenzylidene)-3,5-dimethoxybenzohydrazide monohydrate","Acta Crystallographica Section E","2007","63","5","o2623","o2624","10.1107/S1600536807018971","","","0.71073","MoKα","","0.0676","0.0373","","","","0.1079","","","","","","1.011","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213442","6.819","0.0016","9.216","0.002","11.619","0.003","68.246","0.002","76.938","0.003","73.881","0.003","645.3","0.3","273","2","373","2","","","","","","","","4","P -1","-P 1","2","","1,1'-Bi-1H-benzimidazole-2,2'-dicarbaldehyde","","- C16 H10 N4 O2 -","- C16 H10 N4 O2 -","- C32 H20 N8 O4 -","2","1","LH2337","Bohle, D. Scott; Fotie, Jean","1,1'-Bi-1<i>H</i>-benzimidazole-2,2'-dicarbaldehyde","Acta Crystallographica Section E","2007","63","5","o2075","o2076","10.1107/S1600536807013670","","","0.71073","MoKα","","0.073","0.0572","","","0.1284","0.134","","","","","","1.098","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213443","15.5198","0.001","14.7573","0.0012","15.6383","0.0014","90","","119.537","0.007","90","","3116.2","0.5","294","1","294","1","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","(2RS)-3-(4-Hydroxyphenyl)-2-(1-oxo-1H-2,3-dihydroisoindol-2-yl)propanoic acid monohydrate","","- C17 H17 N O5 -","- C17 H17 N O5 -","- C136 H136 N8 O40 -","8","2","LH2339","Gallagher, John F.; Brady, Fiona","(2<i>RS</i>)-3-(4-Hydroxyphenyl)-2-(1-oxo-1<i>H</i>-2,3-dihydroisoindol-2-yl)propanoic acid monohydrate","Acta Crystallographica Section E","2007","63","5","o2207","o2210","10.1107/S1600536807014158","","","0.71073","MolybdenumKα","","0.123","0.0492","","","0.1111","0.1269","","","","","","0.96","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213444","7.6026","0.0002","14.7425","0.0004","15.6862","0.0004","90","","90","","90","","1758.13","0.08","296","2","100","2","","","","","","","","4","P n 21 a","P -2ac -2n","33","","(E)-3-(2-Ethoxyquinolin-3-yl)-1-(2-hydroxy-6-methylphenyl)prop-2-en-1-one","","- C21 H19 N O3 -","- C21 H19 N O3 -","- C84 H76 N4 O12 -","4","1","LH2342","Abdelmalek Bouraiou; Ali Belfaitah; Sofiane Bouacida; Patricia Benard-Rocherulle; Bertrand Carboni","(<i>E</i>)-3-(2-Ethoxyquinolin-3-yl)-1-(2-hydroxy-6-methylphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2133","o2135","10.1107/S1600536807014699","","","0.71073","MoKα","","0.0567","0.0326","","","0.0741","0.0852","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213445","9.0837","0.001","12.2016","0.0017","13.702","0.002","88.495","0.008","84.782","0.008","79.05","0.008","1484.8","0.3","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","N-(5-Bromo-2-iodophenyl)-N-methylcyclohexanecarboxamide","","- C14 H17 Br I N O -","- C14 H17 Br I N O -","- C56 H68 Br4 I4 N4 O4 -","4","2","LH2343","Slawin, Alexandra M. Z.; Nicoll, Sarah; Storey, John M. D.; Harrison, William T. A.","<i>N</i>-(5-Bromo-2-iodophenyl)-<i>N</i>-methylcyclohexanecarboxamide","Acta Crystallographica Section E","2007","63","5","o2117","o2119","10.1107/S1600536807014171","","","0.71073","MoKα","","0.0468","0.0403","","","0.1025","0.1075","","","","","","1.068","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213446","14.9634","0.0002","7.1821","0.0001","15.9359","0.0002","90","","90","","90","","1712.61","0.04","100","2","100","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","(E)-(1-Oxoindan-2-ylidene)acetic acid","","- C11 H8 O3 -","- C11 H8 O3 -","- C88 H64 O24 -","8","1","LH2345","Dufort, Marisa D.; Lalancette, Roger A.; Thompson, Hugh W.","(<i>E</i>)-(1-Oxoindan-2-ylidene)acetic acid: catemeric hydrogen bonding in an unsaturated γ-keto acid","Acta Crystallographica Section E","2007","63","5","o2084","o2086","10.1107/S1600536807013700","","","1.54178","CuKα","","0.034","0.033","","","0.089","0.091","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213447","7.568","0.002","8.621","0.003","14.704","0.004","90","","95.652","0.005","90","","954.7","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(5-Methyl-1H-pyrazol-3-yl)pyridine monohydrate","","- C9 H11 N3 O -","- C9 H11 N3 O -","- C36 H44 N12 O4 -","4","1","LH2346","Xin-Hong Chang","4-(5-Methyl-1<i>H</i>-pyrazol-3-yl)pyridine monohydrate","Acta Crystallographica Section E","2007","63","5","o2447","o2448","10.1107/S1600536807016285","","","0.71073","MoKα","","0.085","0.0538","","","0.1205","0.1327","","","","","","0.988","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213448","6.2405","0.0002","10.8088","0.0003","14.9369","0.0006","90","","90","","90","","1007.53","0.06","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1-Deoxy-3,4-<i>O</i>-isopropylidene-4-<i>C</i>-hydroxymethyl-β-L-ribulofuranose","(2R,3S,4S)-4-(hydroxymethyl)-3,4-<i>O</i>-isopropylidene-2- methyltetrahydrofuran-2,3,4-triol","","- C9 H16 O5 -","- C9 H16 O5 -","- C36 H64 O20 -","4","1","LH2347","Best, Daniel; Jenkinson, Sarah F.; Kathrine V. Booth; Fleet, George W. J.; David J. Watkin","1-Deoxy-4-<i>C</i>-hydroxymethyl-3,4-<i>O</i>-isopropylidene-β-<small>L</small>-ribulofuranose [(2<i>R</i>,3<i>S</i>,4<i>S</i>)-4-(hydroxymethyl)-3,4-<i>O</i>-isopropylidene-2-methyltetrahydrofuran-2,3,4-triol]","Acta Crystallographica Section E","2007","63","5","o2165","o2167","10.1107/S1600536807014134","","","0.71073","MoKα","","0.0448","0.0411","","0.1057","0.1031","0.1057","","","","","","0.8429","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213449","9.7507","0.0002","10.4263","0.0002","26.409","0.0005","90","","90","","90","","2684.84","0.09","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","[(2<i>S</i>,4a<i>R</i>,7<i>R</i>,7a<i>R</i>)-7-azido-7-methyl-2- phenyldihydro-4<i>H</i>-furo[3,2-<i>d</i>][1,3]dioxin-6(4a<i>H</i>)-one]","2-Azido-(<i>R</i>)-3,5-<i>O</i>-benzylidene-2-deoxy-2-<i>C</i>-methyl-D-xylono- 1,4-lactone","","- C13 H13 N3 O4 -","- C13 H13 N3 O4 -","- C104 H104 N24 O32 -","8","2","LH2348","Hotchkiss, David J.; Jenkinson, Sarah F.; Booth, Kathrine V.; Fleet, George J. W.; Watkin, David J.","2-Azido-(<i>R</i>)-3,5-<i>O</i>-benzylidene-2-deoxy-2-<i>C</i>-methyl-D-xylono-1,4-lactone [(2<i>S</i>,4a<i>R</i>,7<i>R</i>,7a<i>R</i>)-7-azido-7-methyl-2-phenyldihydro-4<i>H</i>-furo[3,2-<i>d</i>][1,3]dioxin-6(4a<i>H</i>)-one]","Acta Crystallographica Section E","2007","63","5","o2168","o2170","10.1107/S1600536807014560","","","0.71073","MoKα","","0.0654","0.0442","","0.1193","0.0991","0.1193","","","","","","0.8647","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213450","7.6843","0.0007","15.9464","0.0011","26.851","0.003","90","","96.946","0.008","90","","3266.1","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(2E)-1-(2,4-Dichlorophenyl)-3-(4,5-dimethoxy-2-nitrophenyl)prop-2-en-1-one","","- C17 H13 Cl2 N O5 -","- C17 H13 Cl2 N O5 -","- C136 H104 Cl16 N8 O40 -","8","1","LH2349","Yathirajan, H. S.; Mayekar, Anil N.; Narayana B.; Sarojini, B. K.; Bolte, Michael","(2<i>E</i>)-1-(2,4-Dichlorophenyl)-3-(4,5-dimethoxy-2-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2200","o2201","10.1107/S160053680701464X","","","0.71073","MoKα","","0.0645","0.0406","","","0.0838","0.0924","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213451","21.109","0.002","8.271","0.001","23.249","0.003","90","","106.38","0.01","90","","3894.4","0.8","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(Ethanol)(ethanolato){2,6-dinitro-6-[(2- oxidophenyl)iminomethyl]phenolato}oxidovanadium(V)","","- C17 H18 N3 O9 V -","- C17 H18 N3 O9 V -","- C136 H144 N24 O72 V8 -","8","1","LH2350","Hartung, Jens; Ludwig, Arne; Svoboda, Ingrid; Fuess, Hartmut","{2,6-Dinitro-6-[(2-oxidophenyl)iminomethyl]phenolato}(ethanol)(ethanolato)oxidovanadium(V) at 100 K","Acta Crystallographica Section E","2007","63","5","m1422","m1423","10.1107/S1600536807017692","","","0.71073","MoKα","","0.092","0.0554","","","0.1448","0.1595","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213452","15.6104","0.0003","15.6104","0.0003","12.434","0.0003","90","","90","","120","","2624.03","0.1","150","","150","","","","","","","","","3","P 65","P 65","170","","2,3:5,6-Di-<i>O</i>-isopropylidene-3,5-di-<i>C</i>-methyl-L-mannono-1,4- lactone","","- C14 H22 O6 -","- C14 H22 O6 -","- C84 H132 O36 -","6","1","LH2351","Booth, Kathrine V.; Jenkinson, Sarah F.; Fleet, George W. J.; Watkin, David J.","2,3:5,6-Di-<i>O</i>-isopropylidene-3,5-di-<i>C</i>-methyl-<small>L</small>-mannono-1,4-lactone","Acta Crystallographica Section E","2007","63","5","o2204","o2206","10.1107/S1600536807014584","","","0.71073","MoKα","","0.0469","0.0381","","0.1064","0.1024","0.1064","","","","","","0.9668","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213453","8.7635","0.0003","10.6004","0.0003","13.7678","0.0004","90","","99.4044","0.0014","90","","1261.79","0.07","150","","150","","","","","","","","","3","P 1 21 1","P 2yb","4","","3,5-Di-<i>C</i>-methyl-5,6-<i>O</i>-isopropylidene-L-glucono-1,4-lactone","","- C11 H18 O6 -","- C11 H18 O6 -","- C44 H72 O24 -","4","2","LH2352","Booth, Kathrine V.; Jenkinson, Sarah F.; Fleet, George W. J.; Watkin, David J.","3,5-Di-<i>C</i>-methyl-5,6-<i>O</i>-isopropylidene-<small>L</small>-glucono-1,4-lactone","Acta Crystallographica Section E","2007","63","5","o2424","o2426","10.1107/S1600536807018314","","","0.71073","MoKα","","0.0437","0.0334","","0.0704","0.0668","0.0704","","","","","","0.9326","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213454","7.1286","0.0002","9.736","0.0003","17.1314","0.0006","90","","90","","90","","1188.99","0.06","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3,5-Di-<i>C</i>-methyl-5,6-<i>O</i>-isopropylidene-L-mannono-1,4-lactone","","- C11 H18 O6 -","- C11 H18 O6 -","- C44 H72 O24 -","4","1","LH2353","Booth, Kathrine V.; Jenkinson, Sarah F.; Fleet, George J. W.; Watkin, David J.","3,5-Di-<i>C</i>-methyl-5,6-<i>O</i>-isopropylidene-<small>L</small>-mannono-1,4-lactone","Acta Crystallographica Section E","2007","63","5","o2427","o2429","10.1107/S1600536807018326","","","0.71073","MoKα","","0.0435","0.0336","","0.0753","0.0715","0.0753","","","","","","0.9269","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213455","8.66","0.0015","12.19","0.002","12.496","0.002","90","","99.317","0.002","90","","1301.7","0.4","298","2","298","2","","","","","","","","5","P 1 c 1","P -2yc","7","","Bis[2-(1-naphthyliminomethyl)phenolato-κ^2^N,O]copper(II)","","- C34 H24 Cu N2 O2 -","- C34 H24 Cu N2 O2 -","- C68 H48 Cu2 N4 O4 -","2","1","LH2354","Jian-Fang Dong; Lian-Zhi Li; Li-Wei Gao; Tao Xu; Da-Qi Wang","Bis[2-(1-naphthyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]copper(II)","Acta Crystallographica Section E","2007","63","5","m1375","m1376","10.1107/S1600536807016261","","","0.71073","MoKα","","0.0991","0.0672","","","0.1545","0.1756","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213456","5.1405","0.001","6.4312","0.0013","12.234","0.002","104.67","0.03","90.61","0.03","109.44","0.03","366.96","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","zinc methylpyrazinate","trans-Diaquabis(5-methylpyrazine-2-carboxylato-κ^2^O,N)zinc(II)","","- C12 H14 N4 O6 Zn -","- C12 H14 N4 O6 Zn -","- C12 H14 N4 O6 Zn -","1","0.5","LH2355","Michał Gryz; Wojciech Starosta; Janusz Leciejewicz","<i>trans</i>-Diaquabis(5-methylpyrazine-2-carboxylato-κ^2^<i>O</i>,<i>N</i>)zinc(II)","Acta Crystallographica Section E","2007","63","5","m1402","m1403","10.1107/S160053680701690X","","","0.71073","MoKα","","0.0333","0.0314","","","0.0835","0.0847","","","","","","1.096","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213457","9.4191","0.0002","11.7706","0.0002","12.2382","0.0002","90","","90","","90","","1356.83","0.04","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(-)metasantonic acid","(-)-(1R,3aS,4R,5S,7aS,9R)-octahydro-α,3a, 5-trimethyl-6,8-dioxo-1,4-methano-1H-indene-1-acetic acid","","- C15 H20 O4 -","- C15 H20 O4 -","- C60 H80 O16 -","4","1","LH2356","Zinczuk, Juan; Ruveda, Edmundo A.; Lalancette, Roger A.; Thompson, Hugh W.","(‒)-Metasantonic acid: alteration of the hydrogen-bonding mode in a diastereomer of santonic acid","Acta Crystallographica Section E","2007","63","5","o2370","o2372","10.1107/S1600536807015309","","","1.54178","CuKα","","0.027","0.027","","","0.07","0.07","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213458","12.033","0.004","11.816","0.004","15.113","0.004","90","","111.817","0.003","90","","1994.9","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dichlorido(N,N-dimethylpropane-1,3-diamine-κ^2^N,N')zinc(II)","","- C5 H14 Cl2 N2 Zn -","- C5 H14 Cl2 N2 Zn -","- C40 H112 Cl16 N16 Zn8 -","8","2","LH2357","Juan-Lan Huang; Yun-Long Feng","Dichlorido(<i>N</i>,<i>N</i>-dimethylpropane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>')zinc(II)","Acta Crystallographica Section E","2007","63","5","m1395","m1395","10.1107/S1600536807016583","","","0.71073","MoKα","","0.0384","0.026","","","0.0611","0.0639","","","","","","0.994","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213459","9.8918","0.0003","10.3368","0.0004","40.9389","0.0015","90","","90","","90","","4186","0.3","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","","","bis(diphenylphosphino)methane","","- C25 H22 P2 -","- C25 H22 P2 -","- C200 H176 P16 -","8","1","LH2359","Burrow, Robert A.; Wouters, Felipe C.; Borges de Castro, Liérson; Peppe, Clovis","Redetermination of bis(diphenylphosphino)methane at 293(2) K","Acta Crystallographica Section E","2007","63","5","o2559","o2559","10.1107/S1600536807017679","","","0.71073","MoKα","","0.101","0.0489","","","0.1051","0.1202","","","","","","1.16","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213460","6.1794","0.0004","16.8362","0.0012","12.2627","0.0009","90","","98.791","0.001","90","","1260.79","0.15","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(hexamethylenetetraminium) chloranilate tetrahydrate","","- C18 H34 Cl2 N8 O8 -","- C18 H34 Cl2 N8 O8 -","- C36 H68 Cl4 N16 O16 -","2","0.5","LH2362","Yang, De-Jun","Bis(hexamethylenetetraminium) chloranilate tetrahydrate","Acta Crystallographica Section E","2007","63","5","o2600","o2600","10.1107/S1600536807018569","","","0.71073","MoKα","","0.0616","0.0485","","","0.1261","0.1334","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213461","14.4793","0.001","17.8978","0.0013","14.3078","0.001","90","","90","","90","","3707.8","0.5","297","2","297","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","Bis[1,3-bis(benzimidazol-2-yl)propane-κ^2^N,N']copper(II) dinitrate methanol solvate","","- C36 H40 Cu N10 O8 -","- C36 H40 Cu N10 O8 -","- C144 H160 Cu4 N40 O32 -","4","0.5","LH2363","Hu, Bo; Wang, Ming; Wang, Xiao-Yan; Song, Xue-Gang; Wang, Cheng-Gang","Bis[1,3-bis(benzimidazol-2-yl)propane-κ^2^<i>N</i>,<i>N</i>']copper(II) dinitrate methanol disolvate","Acta Crystallographica Section E","2007","63","5","m1416","m1416","10.1107/S1600536807018570","","","0.71073","MoKα","","0.0697","0.0517","","","0.1202","0.1298","","","","","","1.068","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213462","9.516","0.002","10.406","0.003","11.868","0.005","99.52","0.04","100.42","0.02","91.55","0.04","1137.9","0.7","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","8-tert-Butyl-7,10-diphenyl-6,10-dihydro-5H-benzo[h]pyrazolo[3,4-b]quinoline","","- C30 H27 N3 -","- C30 H27 N3 -","- C60 H54 N6 -","2","1","LH2364","Low, John N.; Cobo, Justo; Portilla, Jaime; Quiroga, Jairo; Glidewell, Christopher","8-<i>tert</i>-Butyl-7,10-diphenyl-6,10-dihydro-5<i>H</i>-benzo[<i>h</i>]pyrazolo[3,4-<i>b</i>]quinoline","Acta Crystallographica Section E","2007","63","5","o2690","o2691","10.1107/S1600536807017631","","","0.71073","MoKα","","0.1466","0.0707","","","0.1821","0.2382","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213463","7.9739","0.0007","8.5125","0.0008","9.0215","0.0008","78.031","0.001","85.704","0.001","85.295","0.001","595.97","0.09","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","2',2'-(Ethane-1,2-diylidene)bis(2-hydroxybenzohydrazide) dimethyl sulfoxide disolvate","","- C20 H26 N4 O6 S2 -","- C20 H26 N4 O6 S2 -","- C20 H26 N4 O6 S2 -","1","0.5","LH2367","Fei-Hua Luo; Shao-Min Shi; Cao-Min Na; Cui-Xia Chen; Zong-Qiu Hu","2',2'-(Ethane-1,2-diylidene)bis(2-hydroxybenzhydrazide) dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2007","63","5","o2696","o2696","10.1107/S1600536807019393","","","0.71073","MoKα","","0.0603","0.044","","","0.1136","0.1238","","","","","","1.085","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213464","21.628","0.005","21.628","0.005","9.858","0.005","90","","90","","90","","4611","3","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetrakis{μ~3~-1-[(2-oxidoethyl)iminomethyl]-2-naphtholato}tetracopper(II)","","- C52 H44 Cu4 N4 O8 -","- C52 H44 Cu4 N4 O8 -","- C208 H176 Cu16 N16 O32 -","4","0.25","LH2368","Jian-Fang Dong; Lian-Zhi Li; Tao Xu; Hui Cui; Da-Qi Wang","Tetrakis{μ~3~-1-[(2-oxidoethyl)iminomethyl]-2-naphtholato}tetracopper(II)","Acta Crystallographica Section E","2007","63","5","m1501","m1502","10.1107/S1600536807019654","","","0.71073","MoKα","","0.0824","0.053","","","0.0937","0.1018","","","","","","1.083","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213465","7.3748","0.0009","10.1854","0.0013","11.8404","0.0014","70.055","0.009","82.438","0.011","74.299","0.01","804.1","0.18","173","2","173","2","","","","","","","","6","P -1","-P 1","2","1-(2,6-Dichlorobenzoyl)-3-(2-methoxyphenyl)thiourea","1-(2,6-Dichlorobenzoyl)-3-(2-methoxyphenyl)thiourea","","- C15 H12 Cl2 N2 O2 S -","- C15 H12 Cl2 N2 O2 S -","- C30 H24 Cl4 N4 O4 S2 -","2","1","LH2369","Rauf, M. Khawar; Badshah, Amin; Bolte, Michael","1-(2,6-Dichlorobenzoyl)-3-(2-methoxyphenyl)thiourea","Acta Crystallographica Section E","2007","63","5","o2665","o2666","10.1107/S1600536807019381","","","0.71073","MoKα","","0.0361","0.033","","","0.0857","0.0876","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213466","3.8716","0.0003","15.8019","0.0014","10.8874","0.0009","90","","91.785","0.001","90","","665.75","0.1","296","2","298","2","","","","","","","","4","C 1 c 1","C -2yc","9","","4-(1<i>H</i>-1,2,4-Triazol-3-yl)-4<i>H</i>-1,2,4-triazole monohydrate","","- C4 H6 N6 O -","- C4 H6 N6 O -","- C16 H24 N24 O4 -","4","1","LH2370","Jia, Li-Hui; Liu, Zu-Li; Liu, Wei","4-(1<i>H</i>-1,2,4-Triazol-3-yl)-4<i>H</i>-1,2,4-triazole monohydrate","Acta Crystallographica Section E","2007","63","5","o2766","o2766","10.1107/S1600536807020272","","","0.71073","Mokα","","0.0351","0.0344","","","0.0882","0.089","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213467","20.079","0.004","25.646","0.005","11.485","0.002","90","","90","","90","","5914.2","1.9","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","catena-Poly[[diaquabis[(4-nitrophenylsulfinyl)acetato-κO]zinc(II)]- μ-4,4'-bipyridine-κ^2^N:N']","","- C26 H24 N4 O12 S2 Zn -","- C26 H24 N4 O12 S2 Zn -","- C208 H192 N32 O96 S16 Zn8 -","8","0.5","LH2371","Hou, Yan-Jun; Yu, Ying-Hui; Sun, Zhi-Zhong; Li, Bai-Yan; Hou, Guang-Feng","<i>catena</i>-Poly[[diaquabis[(4-nitrophenylsulfinyl)acetato-κ<i>O</i>]zinc(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","5","m1530","m1530","10.1107/S1600536807020260","","","0.71073","MoKα","","0.0314","0.0293","","","0.0755","0.0772","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213468","7.5794","0.0008","11.1125","0.0009","16.9767","0.0014","90","","99.654","0.008","90","","1409.6","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl (4-oxo-1-phenyl-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetate","","- C15 H14 N4 O3 -","- C15 H14 N4 O3 -","- C60 H56 N16 O12 -","4","1","LH2372","Yathirajan, H. S.; Bindya, S.; Sarojini, B. K.; Narayana, B.; Bolte, Michael","Ethyl (4-oxo-1-phenyl-1,4-dihydro-5<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidin-5-yl)acetate","Acta Crystallographica Section E","2007","63","5","o2718","o2718","10.1107/S1600536807020284","","","0.71073","MoKα","","0.0407","0.0327","","","0.0847","0.0891","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213469","35.6311","0.0007","10.6333","0.0002","19.5551","0.0004","90","","104.063","0.0011","90","","7186.9","0.2","160","1","160","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis{μ-2-hydroxy-5-[(E)-2-(2-methoxyphenyl)diazenyl]benzoato}bis(di-n- butyl{2-hydroxy-5-[(E)-2-(2-methoxyphenyl)diazenyl]benzoato}tin(IV))","","- C72 H80 N8 O16 Sn2 -","- C72 H80 N8 O16 Sn2 -","- C288 H320 N32 O64 Sn8 -","4","0.5","LH2373","Linden, Anthony; Wolstenholme, David; Basu Baul, Tushar S.; Rynjah, Wandondor","Bis{μ-2-hydroxy-5-[(<i>E</i>)-2-(2-methoxyphenyl)diazenyl]benzoato}bis(di-<i>n</i>-butyl{2-hydroxy-5-[(<i>E</i>)-2-(2-methoxyphenyl)diazenyl]benzoato}tin(IV))","Acta Crystallographica Section E","2007","63","5","m1547","m1548","10.1107/S1600536807020302","","","0.71073","MoKα","","0.0873","0.0572","","","0.1327","0.1484","","","","","","1.089","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213470","9.635","0.0009","5.0104","0.0005","21.913","0.002","90","","94.686","0.002","90","","1054.32","0.17","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 4-bromo-3,5-dinitrobenzoate","","- C8 H5 Br N2 O6 -","- C8 H5 Br N2 O6 -","- C32 H20 Br4 N8 O24 -","4","1","LN3050","Meisner, Jeffrey S.; Berryman, Orion B.; Zakharov, Lev N.; Johnson, Darren W.","Methyl 4-bromo-3,5-dinitrobenzoate","Acta Crystallographica Section E","2007","63","5","o2466","o2466","10.1107/S1600536807017874","","","0.71073","MoKα","","0.0576","0.0524","","","0.1737","0.1794","","","","","","1.075","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213471","4.585","0.005","6.412","0.008","33.21","0.04","90","","90.471","0.014","90","","976","2","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(3,4-Dichlorophenoxy)propionic acid","2-(3,4-Dichlorophenoxy)propionic acid","","- C9 H8 Cl2 O3 -","- C9 H8 Cl2 O3 -","- C36 H32 Cl8 O12 -","4","1","LW2005","Akhtar, Tashfeen; Rauf, M. Khawar; Ebihara, Masahiro; Hameed, Shahid","2-(3,4-Dichlorophenoxy)propionic acid","Acta Crystallographica Section E","2007","63","5","o2590","o2592","10.1107/S1600536807014249","","","0.7107","MoKα","","0.0733","0.0672","","","0.1462","0.1489","","","","","","1.282","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213472","10.879","0.002","10.336","0.002","8.715","0.001","90","","110.13","0.01","90","","920.1","0.3","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N-(4-nitrophenyl)methanesulfonamide","<i>N</i>-(4-Nitrophenyl)methanesulfonamide","","- C7 H8 N2 O4 S -","- C7 H8 N2 O4 S -","- C28 H32 N8 O16 S4 -","4","1","LW2006","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(4-Nitrophenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","5","o2339","o2339","10.1107/S160053680701598X","","","1.5418","CuKα","","0.0952","0.0599","","","0.1634","0.1823","","","","","","1.089","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213473","13.267","0.007","16.66","0.008","13.459","0.007","90","","96.93","0.03","90","","2953","3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-[Glycyl-(<i>Z</i>)-α,β-dehydrophenylalanylglycyl- (<i>Z</i>)-α,β-dehydrophenylalanyl]glycine trifluoroacetate methanol solvate","","- C27 H30 F3 N5 O9 -","- C27 H30 F3 N5 O9 -","- C108 H120 F12 N20 O36 -","4","1","LW2007","Makowski, Maciej; Lisowski, Marek; Mikołajczyk, Iwona; Lis, Tadeusz","<i>N</i>-[Glycyl-(<i>Z</i>)-α,β-dehydrophenylalanylglycyl-(<i>Z</i>)-α,β-dehydrophenylalanyl]glycine trifluoroacetate methanol solvate","Acta Crystallographica Section E","2007","63","5","o2709","o2710","10.1107/S1600536807016613","","","1.5418","CuKα","","0.0636","0.048","","","0.1358","0.144","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213474","5.719","0.001","9.041","0.001","9.225","0.002","79.53","0.01","87.36","0.01","74.44","0.01","451.85","0.14","299","2","299","2","","","","","","","","5","P -1","-P 1","2","Methanesulfon-2-methylanilide","N-(2-Methylphenyl)methanesulfonamide","","- C8 H11 N O2 S -","- C8 H11 N O2 S -","- C16 H22 N2 O4 S2 -","2","1","LW2008","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(2-Methylphenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","5","o2340","o2340","10.1107/S1600536807016273","","","1.5418","CuKα","","0.0586","0.0391","","","0.0901","0.0981","","","","","","1.078","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213475","23.488","0.007","8.523","0.002","9.216","0.002","90","","107.05","0.02","90","","1763.8","0.8","299","2","299","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Methanesulfon-3-chloroanilide","<i>N</i>-(3-Chlorophenyl)methanesulfonamide","","- C7 H8 Cl N O2 S -","- C7 H8 Cl N O2 S -","- C56 H64 Cl8 N8 O16 S8 -","8","1","LW2009","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(3-Chlorophenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","5","o2569","o2569","10.1107/S1600536807018466","","","1.5418","CuKα","","0.0648","0.0635","","","0.1743","0.1768","","","","","","1.086","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213476","17.272","0.003","5.059","0.001","10.14","0.002","90","","101.65","0.01","90","","867.8","0.3","293","2","301","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Methanesulfon-4-fluoroanilide","<i>N</i>-(4-Fluorophenyl)methanesulfonamide","","- C7 H8 F N O2 S -","- C7 H8 F N O2 S -","- C28 H32 F4 N4 O8 S4 -","4","1","LW2011","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(4-Fluorophenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","5","o2570","o2570","10.1107/S1600536807018491","","","0.71073","MoKα","","0.1137","0.0975","","","0.2477","0.2618","","","","","","1.197","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213477","14.1248","0.0007","5.5175","0.0003","19.179","0.001","90","","108.408","0.002","90","","1418.21","0.13","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-Benzoyl-N'-(2-{2-[2-(N-benzoylthioureido)phenoxy]ethoxy}phenyl)thiourea","","- C30 H26 N4 O4 S2 -","- C30 H26 N4 O4 S2 -","- C60 H52 N8 O8 S4 -","2","0.5","LX2003","Cao, Cheng; Xiao, Tai; Wei, Tai-Bao; Zhang, You-Ming","<i>N</i>-Benzoyl-<i>N</i>'-(2-{2-[2-(<i>N</i>-benzoylthioureido)phenoxy]ethoxy}phenyl)thiourea","Acta Crystallographica Section E","2007","63","5","o2699","o2701","10.1107/S1600536807018661","","","0.71073","MoKα","","0.0864","0.0691","","","0.1708","0.1881","","","","","","0.95","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213478","10.1099","0.0006","11.8733","0.0006","14.262","0.001","90","","105.722","0.003","90","","1647.93","0.17","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1'-(4-Iodobenzyl)spiro[isobenzofuran-1(3<i>H</i>),4'-piperidine]","","- C19 H20 I N O -","- C19 H20 I N O -","- C76 H80 I4 N4 O4 -","4","1","LX2004","Zhang, Qiu-Yan; Li, Yan; Jia, Hong-Mei; Liu, Bo-Li","1'-(4-Iodobenzyl)spiro[isobenzofuran-1(3<i>H</i>),4'-piperidine]","Acta Crystallographica Section E","2007","63","5","o2418","o2419","10.1107/S1600536807015966","","","0.7107","MoKα","","0.0307","0.0242","","","0.0567","0.0592","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213479","13.112","0.009","9.412","0.005","9.799","0.005","90","","94.3","0.03","90","","1205.9","1.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N^1^,N^3^-Di-2-pyridylmalonamide","","- C13 H12 N4 O2 -","- C13 H12 N4 O2 -","- C52 H48 N16 O8 -","4","1","LX2007","Hai-Yang Yu; Xin Fang; Ming-Lei Cao; Jun-Dong Wang","<i>N</i>^1^,<i>N</i>^3^-Di-2-pyridylmalonamide","Acta Crystallographica Section E","2007","63","5","o2650","o2650","10.1107/S1600536807018375","","","0.71069","MoKα","","0.0602","0.0403","","","0.0955","0.1045","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213480","13.016","0.0006","12.8648","0.0004","15.1056","0.0006","90","","96.767","0.0019","90","","2511.79","0.17","90","1","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Poly[[diaquahexa-μ-cyanido-dicyanido-di-μ-pyrimidine- dimanganese(II)molybdate(IV)] trihydrate]","","- C16 H18 Mn2 Mo N12 O5 -","- C16 H12 Mn2 Mo N12 O5 -","- C64 H48 Mn8 Mo4 N48 O20 -","4","1","NC2028","Kosaka, Wataru; Hashimoto, Kazuhito; Ohkoshi, Shin-ichi","Poly[[diaquahexa-μ-cyanido-dicyanido-di-μ-pyrimidine-dimanganese(II)molybdate(IV)] trihydrate]","Acta Crystallographica Section E","2007","63","5","m1220","m1222","10.1107/S1600536807012263","","","0.71075","MoKα","","","0.0323","","","","0.0877","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213481","17.211","0.006","9.616","0.003","15.654","0.006","90","","111.716","0.0015","90","","2406.9","1.5","123.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Morpholino-8,8-dicyanoheptafulvene","","- C14 H13 N3 O -","- C14 H13 N3 O -","- C112 H104 N24 O8 -","8","2","NC2034","Kubo, Kanji; Matsumoto, Taisuke; Mori, Akira; Takeshita, Hitoshi","3-Morpholino-8,8-dicyanoheptafulvene","Acta Crystallographica Section E","2007","63","5","o2694","o2694","10.1107/S1600536807020156","","","0.7107","MoKα","","","0.0631","","","","0.1631","","","","","","1.183","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213482","25.917","0.005","12.191","0.002","16.116","0.003","90","","122.96","0.03","90","","4272","2","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(μ-3,5-Diphenylpyrazolato-κ^2^N:N')bis(2,2':6',2''-terpyridyl- κ^3^N)palladium(II) trinitrate","","- C45 H33 N11 O9 Pd2 -","- C45 H33 N11 O9 Pd2 -","- C180 H132 N44 O36 Pd8 -","4","0.5","NG2236","Hai-Ping Huang; Hong-Wei Ma","(μ-3,5-Diphenylpyrazolato-κ^2^<i>N</i>:<i>N</i>')bis(2,2':6',2''-terpyridyl-κ^3^<i>N</i>)palladium(II) trinitrate","Acta Crystallographica Section E","2007","63","5","m1202","m1203","10.1107/S1600536807013463","","","0.71073","MoKα","","0.0896","0.0513","","","0.1362","0.1574","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213483","8.7343","0.0003","17.8256","0.0007","25.0266","0.0009","90","","90","","90","","3896.5","0.2","120","2","120","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Tetrahydrofuran-κ<i>O</i>bis(tri-<i>tert</i>-butoxysilanethiolato-κ^2^<i>O,S</i>) chromium(II)","","- C28 H62 Cr O7 S2 Si2 -","- C28 H62 Cr O7 S2 Si2 -","- C112 H248 Cr4 O28 S8 Si8 -","4","0.5","NG2241","Ciborska, Anna; Baranowska, Katarzyna; Wojnowski, Wiesław","(Tetrahydrofuran-κ<i>O)</i>bis(tri-<i>tert</i>-butoxysilanethiolato-κ^2^<i>O,S</i>)chromium(II)","Acta Crystallographica Section E","2007","63","5","m1239","m1241","10.1107/S160053680701402X","","","0.71073","MoKα","","0.0554","0.0512","","","0.1136","0.1163","","","","","","1.078","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213484","16.984","0.003","11.686","0.002","10.0952","0.0017","90","","109.455","0.011","90","","1889.2","0.6","293","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[(μ~2~-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>')(furan-2- carboxylato-κ^2^<i>O</i>:<i>O</i>')cadmium(II)]","","- C20 H14 Cd N2 O6 -","- C20 H14 Cd N2 O6 -","- C80 H56 Cd4 N8 O24 -","4","0.5","NG2245","Man-Sheng Chen; Chun-Hua Zhang; Dai-Zhi Kuang; Yong-Lan Feng; Yi-Fang Deng","Poly[(μ~2~-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>')(μ~2~-furan-2-carboxylato-κ^2^<i>O</i>:<i>O</i>')cadmium(II)]","Acta Crystallographica Section E","2007","63","5","m1290","m1291","10.1107/S1600536807016777","","","0.71073","MoKα","","0.0375","0.0282","","","0.071","0.0755","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213485","20.373","0.003","7.1181","0.0009","17.497","0.003","90","","111.514","0.004","90","","2360.6","0.6","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Hexaaquacobalt(II) bis(5-benzoyl-2-methoxy-4-oxidobenzenesulfonato- κ^2^<i>O</i>,<i>O</i>')bis(pyridine-κ<i>N</i>)cobaltate(II) tetrahydrate","","- C38 H50 Co2 N2 O22 S2 -","- C38 H50 Co2 N2 O22 S2 -","- C76 H100 Co4 N4 O44 S4 -","2","0.5","NG2246","Yan-Cheng Liu; Tao Yuan; Zhen-Feng Chen; Hong Liang; Yong Zhang","Hexaaquacobalt(II) bis(5-benzoyl-2-methoxy-4-oxidobenzenesulfonato-κ^2^<i>O</i>,<i>O</i>')bis(pyridine-κ<i>N</i>)cobaltate(II) tetrahydrate","Acta Crystallographica Section E","2007","63","5","m1397","m1398","10.1107/S1600536807017746","","","0.7107","MoKα","","0.0698","0.0509","","","0.0953","0.1028","","","","","","1.139","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213486","17.8611","0.0003","11.9929","0.0003","9.4946","0.0002","90","","95.54","0.001","90","","2024.3","0.07","100","0.1","297","2","","","","","","","","5","C 1 c 1","C -2yc","9","","[2,2'-{1,2-Phenylenebis(nitrilomethylylidyne)}diphenolato- κ^4^O,N,N',O'](pyridine-κN)zinc(II)","","- C25 H19 N3 O2 Zn -","- C25 H19 N3 O2 Zn -","- C100 H76 N12 O8 Zn4 -","4","1","NG2249","Naser Eltaher Eltayeb; Siang Guan Teoh; Shea-Lin Ng; Hoong-Kun Fun; Kamarulazizi Ibrahim","{2,2'-[1,2-Phenylenebis(nitrilomethylidyne)]diphenolato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}(pyridine-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2007","63","5","m1284","m1285","10.1107/S1600536807017618","","","0.71073","MoKα","","0.0645","0.0452","","","0.095","0.104","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213487","19.55","0.007","8.216","0.003","14.703","0.007","90","","97.35","0.018","90","","2342.2","1.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Triaquabis[(2-nitrophenylsulfanyl)acetato-κ^2^O,O']cadmium(II) dihydrate","","- C16 H22 Cd N2 O13 S2 -","- C16 H22 Cd N2 O13 S2 -","- C64 H88 Cd4 N8 O52 S8 -","4","1","NG2254","Hou, Yan-Jun; Sun, Zhi-Zhong; Yu, Ying-Hui; Li, Bai-Yan; Hou, Guang-Feng","Triaquabis[(2-nitrophenylsulfanyl)acetato-κ^2^<i>O</i>,<i>O</i>']cadmium(II) dihydrate","Acta Crystallographica Section E","2007","63","5","m1506","m1506","10.1107/S1600536807019472","","","0.71073","MoKα","","0.0459","0.0301","","","0.0697","0.0754","","","","","","1.005","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213488","7.0096","0.0014","10.661","0.002","18.313","0.004","87.89","0.03","87.83","0.03","84.17","0.03","1359.7","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Hexaaquanickel(II) bis[(4-nitrophenoxy)acetate] pentahydrate","","- C16 H34 N2 Ni O21 -","- C16 H34 N2 Ni O21 -","- C32 H68 N4 Ni2 O42 -","2","1","NG2257","Hou, Yan-Jun; Sun, Zhi-Zhong; Yu, Ying-Hui; Li, Bai-Yan; Hou, Guang-Feng","Hexaaquanickel(II) bis[(4-nitrophenoxy)acetate] pentahydrate","Acta Crystallographica Section E","2007","63","5","m1519","m1519","10.1107/S1600536807020041","","","0.71073","MoKα","","0.0487","0.0382","","","0.1232","0.1303","","","","","","1.141","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213489","5.266","0.005","9.35","0.008","11.932","0.01","67.439","0.011","84.836","0.012","85.742","0.012","539.8","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Hydroxycyclohexyl 1H-pyrrole-2-carboxylate","","- C11 H15 N O3 -","- C11 H15 N O3 -","- C22 H30 N2 O6 -","2","1","OM2097","Dong, Li; Yin, Zhen-Ming","2-Hydroxycyclohexyl 1<i>H</i>-pyrrole-2-carboxylate","Acta Crystallographica Section E","2007","63","5","o2758","o2760","10.1107/S1600536807005867","","","0.71073","MoKα","","0.0557","0.0403","","","0.1054","0.1117","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213490","5.9691","0.0013","10.245","0.002","13.717","0.003","93.916","0.003","99.948","0.003","105.071","0.003","792.1","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","1-[(N-Benzyl-N-methylamino)methyl]ferrocene","","- C19 H21 Fe N -","- C19 H21 Fe N -","- C38 H42 Fe2 N2 -","2","1","OM2107","Hong-Fei Wu; Hong-Xing Wang; Xiao-Li Yang; Li Wan; Nan Ma","1-[(<i>N</i>-Benzyl-<i>N</i>-methylamino)methyl]ferrocene","Acta Crystallographica Section E","2007","63","5","m1347","m1348","10.1107/S1600536807016054","","","0.71073","MoKα","","0.0402","0.0323","","","0.078","0.0824","","","","","","1.073","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213491","5.861","0.0002","20.2384","0.0006","9.9791","0.0003","90","","104.041","0.003","90","","1148.33","0.06","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,2,2-trichloro-N-(3,4-dichlorophenyl)acetamide","","- C8 H4 Cl5 N O -","- C8 H4 Cl5 N O -","- C32 H16 Cl20 N4 O4 -","4","1","OM2108","B. Thimme Gowda; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","2,2,2-Trichloro-<i>N</i>-(3,4-dichlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","5","o2567","o2568","10.1107/S1600536807016947","","","0.71073","MoKα","","0.0338","0.028","","","0.0639","0.0665","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213492","8.2036","0.0008","10.6875","0.0011","10.8308","0.0011","93.15","0.001","92.219","0.001","96.027","0.001","941.98","0.16","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-3,5-dinitropyridin-2-olato)bis[tetraaqua(3,5-dinitropyridin-2- olato)barium(II)]","","- C20 H24 Ba2 N12 O28 -","- C20 H24 Ba2 N12 O28 -","- C20 H24 Ba2 N12 O28 -","1","0.5","OM2109","Dong-Dong Li; Jiang-Bo She; Guo-Fang Zhang","Bis(μ-3,5-dinitropyridin-2-olato)bis[tetraaqua(3,5-dinitropyridin-2-olato)barium(II)]","Acta Crystallographica Section E","2007","63","5","m1302","m1304","10.1107/S1600536807015875","","","0.71073","MoKα","","0.0168","0.0158","","","0.0381","0.0386","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213493","20.046","0.0002","11.6692","0.0001","7.0866","0.0001","90","","93.815","0.001","90","","1654.03","0.03","100","0.1","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Acetyl-1-(4-chlorophenyl)-2-methylbenzo[f]indole-4,9-dione","","- C21 H14 Cl N O3 -","- C21 H14 Cl N O3 -","- C84 H56 Cl4 N4 O12 -","4","1","OM2110","Hoong-Kun Fun; Suchada Chantrapromma; Yun Liu; Jian-Hua Xu","3-Acetyl-1-(4-chlorophenyl)-2-methylbenzo[<i>f</i>]indole-4,9-dione","Acta Crystallographica Section E","2007","63","5","o2314","o2316","10.1107/S1600536807015930","","","0.71073","MoKα","","0.0515","0.0403","","","0.1015","0.113","","","","","","1.074","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213494","10.713","0.002","10.605","0.002","13.033","0.003","90","","105.33","0.03","90","","1428","0.5","290","2","290","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","9-benzylacridine","","- C20 H15 N -","- C20 H15 N -","- C80 H60 N4 -","4","1","OM2111","Artur Sikorski; Katarzyna Kowalska; Karol Krzymiński; Jerzy Błażejowski","9-Benzylacridine","Acta Crystallographica Section E","2007","63","5","o2670","o2672","10.1107/S1600536807018740","","","0.71073","MoKα","","0.0781","0.0391","","","0.0946","0.1104","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213495","8.6447","0.0007","11.0825","0.0004","21.0332","0.0009","75.974","0.008","88.987","0.009","84.435","0.006","1945.8","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Poly[triaquatri-μ-hippurato-hippuratodibarium]","","- C18 H19 Ba N2 O7.5 -","- C18 H19 Ba N2 O7.5 -","- C72 H76 Ba4 N8 O30 -","4","2","OM2113","S. Natarajan; S. A. Martin Britto Dhas; J. Suresh; R. V. Krishnakumar","Poly[triaquatri-μ-hippurato-hippuratodibarium]","Acta Crystallographica Section E","2007","63","5","m1408","m1410","10.1107/S1600536807017722","","","0.71073","MoKα","","0.0418","0.0367","","","0.0972","0.1009","","","","","","1.072","","","","has coordinates,has Fobs","223448","2020-10-21","18:00:00",""
"2213496","6.8871","0.0014","9.0494","0.0018","15.25","0.004","90","","106.86","0.03","90","","909.6","0.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 6-(hydroxymethyl)picolinate","","- C9 H11 N O3 -","- C9 H11 N O3 -","- C36 H44 N4 O12 -","4","1","OM2115","Jian-Ying Huang; Hong-Ze Liang","Ethyl 6-(hydroxymethyl)picolinate","Acta Crystallographica Section E","2007","63","5","o2584","o2585","10.1107/S1600536807018594","","","0.71073","MoKα","","0.0898","0.0488","","","0.1364","0.1528","","","","","","0.982","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213497","8.2205","0.0002","10.1243","0.0003","18.6848","0.0007","90","","90","","90","","1555.08","0.08","295","2","295","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","{2-Methylidene-3-[(phenylsulfanyl)methyl]but-3-en-1-ylsulfanyl}benzene","","- C18 H18 S2 -","- C18.002 H18 S2 -","- C72.008 H72 S8 -","4","0.5","OM2119","Sathiyanarayanan, K.; George Fernand, A.; Dhanasekaran, V.; Rathore, R. S.","{2-Methylidene-3-[(phenylsulfanyl)methyl]but-3-en-1-ylsulfanyl}benzene: flip-flop disorder","Acta Crystallographica Section E","2007","63","5","o2504","o2505","10.1107/S1600536807017680","","","0.71073","MoKα","","0.0533","0.0392","","","0.0937","0.1023","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213498","9.8609","0.0002","8.4986","0.0002","16.9639","0.0004","90","","90","","90","","1421.64","0.06","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1,2,3,4-Tetrahydroquinoxaline","","- C8 H10 N2 -","- C8 H10 N2 -","- C64 H80 N16 -","8","1","OM2122","Pike, Robert D.; Dugan, Emily C.","1,2,3,4-Tetrahydroquinoxaline","Acta Crystallographica Section E","2007","63","5","o2772","o2773","10.1107/S1600536807020636","","","1.54178","CuKα","","0.0309","0.0299","","","0.086","0.0869","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213499","16.598","0.002","6.4631","0.0005","28.535","0.003","90","","104.25","0.01","90","","2966.9","0.5","120","2","120","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","cis-1,2-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2-bis[4- (trifluoromethyl)phenyl]ethene‒ cis-2-(1,3,2-benzodioxaborolan-2-yl)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan- 2-yl)-1,2-bis[4-(trifluoromethyl)phenyl]ethene‒hexane (1/1/1)","","- C62 H70 B4 F12 O8 -","- C59 H56 B4 F12 O8 -","- C118 H112 B8 F24 O16 -","2","0.5","PK2008","Bramham, George; Batsanov, Andrei S.; Marder, Todd B.; Norman, Nicholas C.","Solid solution of <i>cis</i>-1,2-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2-bis[4-(trifluoromethyl)phenyl]ethene‒<i>cis</i>-2-(1,3,2-benzodioxaborolan-2-yl)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2-bis[4-(trifluoromethyl)phenyl]ethene‒hexane solvate (1/1/1)","Acta Crystallographica Section E","2007","63","5","o2367","o2369","10.1107/S1600536807014110","","","0.71073","MoKα","","0.125","0.0737","","","0.222","0.2575","","","","","","1.066","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213500","8.1879","0.0001","8.2359","0.0002","10.5343","0.0003","92.56","0.01","96.66","0.02","92.31","0.03","704.14","0.04","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","3-(5-Ethyl-1,3,4-thiadiazol-2-yldiazenyl)-1,2-dimethyl-1H-indole","","- C14 H15 N5 S -","- C14 H15 N5 S -","- C28 H30 N10 S2 -","2","1","PK2013","Hökelek, Tuncer; Seferoğlu, Zeynel; Şahin, Ertan; Ertan, Nermin","3-[(5-Ethyl-1,3,4-thiadiazol-2-yl)diazenyl]-1,2-dimethyl-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","5","o2265","o2266","10.1107/S1600536807016546","","","0.71073","MoKα","","0.0987","0.0608","","","0.1346","0.1528","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213501","9.6816","0.0013","9.9493","0.0013","12.5894","0.0017","91.116","0.001","97.55","0.001","106.415","0.001","1151.1","0.3","273","2","291","2","","","","","","","","6","P -1","-P 1","2","","trans-Bis[2-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)phenolato- κ^2^N,O](thiocyanato-κN)manganese(III)","","- C23 H24 Mn N3 O4 S -","- C23 H24 Mn N3 O4 S -","- C46 H48 Mn2 N6 O8 S2 -","2","1","PK2015","Zhang, Yan; Kong, Di; Liu, Tian-Fu; Xu, Wen-Guo","<i>trans</i>-Bis[2-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)phenolato-κ^2^<i>N</i>,<i>O</i>](thiocyanato-κ<i>N</i>)manganese(III)","Acta Crystallographica Section E","2007","63","5","m1396","m1396","10.1107/S1600536807018156","","","0.71073","MoKα","","0.05","0.037","","","0.1","0.111","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213502","19.674","0.003","6.9319","0.0011","5.7038","0.001","90","","90","","90","","777.9","0.2","115","","115","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Bromomethyl)trimethylammonium bromide","","- C4 H11 Br2 N -","- C4 H11 Br2 N -","- C16 H44 Br8 N4 -","4","0.5","PK2016","Fletcher Claville, Michelle O.; Payne, Roosevelt J.; Parker, Brandon C.; Fronczek, Frank R.","(Bromomethyl)trimethylammonium bromide","Acta Crystallographica Section E","2007","63","5","o2601","o2601","10.1107/S1600536807018235","","","0.71073","MoKα","","0.05","0.038","","","0.107","0.114","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213503","15.474","0.004","12.051","0.003","16.592","0.004","90","","94.964","0.005","90","","3082.4","1.3","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetrakis(1-n-hexylpyridinium) octamolybdate","","- C44 H72 Mo8 N4 O26 -","- C44 H72 Mo8 N4 O26 -","- C88 H144 Mo16 N8 O52 -","2","0.5","PK2017","Guo, Ming-Lin; Guo, Chen-Hu; Li, Hui-Zhen; Chang, Hong","Tetrakis(1-<i>n</i>-hexylpyridinium) octamolybdate","Acta Crystallographica Section E","2007","63","5","m1471","m1471","10.1107/S1600536807019423","","","0.71073","MoKα","","0.119","0.044","","","0.086","0.114","","","","","","0.953","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213504","5.8357","0.0008","32.084","0.004","7.4958","0.001","90","","95.087","0.003","90","","1397.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(Acetonyl)-3-(2-thienylmethyl)-4-(4H-1,2,4-triazol-4-yl)-1H- 1,2,4-triazol-5(4H)-one","","- C12 H12 N6 O2 S -","- C12 H12 N6 O2 S -","- C48 H48 N24 O8 S4 -","4","1","PK2019","Ustabaş, Reşat; Çoruh, Ufuk; Sancak, Kemal; Demirkan, Esra; Vázquez-López, Ezequiel M.","1-(Acetonyl)-3-(2-thienylmethyl)-4-(4<i>H</i>-1,2,4-triazol-4-yl)-1<i>H</i>-1,2,4-triazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2774","o2775","10.1107/S1600536807020326","","","0.71073","MoKα","","0.119","0.047","","","0.076","0.089","","","","","","0.815","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213505","3.8265","0.0002","9.6148","0.0006","8.9964","0.0005","90","","97.948","0.004","90","","327.81","0.03","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","","","5-Bromoanthranil","","- C7 H4 Br N O -","- C7 H4 Br N O -","- C14 H8 Br2 N2 O2 -","2","1","PR2002","Farrugia, Louis J.; Hartley, Richard C.; Main, Calver A.; Rahman, Shahzad S.","5-Bromoanthranil","Acta Crystallographica Section E","2007","63","5","o2540","o2541","10.1107/S1600536807017278","","","0.71073","MoKα","","0.0319","0.0271","","","0.0611","0.0772","","","","","","1.179","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213506","8.9229","0.0007","9.9459","0.0008","13.2508","0.001","90","","97.383","0.004","90","","1166.21","0.16","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Triaqua(pyridine-2,6-dicarboxylato)magnesium(II) dihydrate","","- C7 H13 Mg N O9 -","- C7 H13 Mg N O9 -","- C28 H52 Mg4 N4 O36 -","4","1","PR2003","Aghabozorg, Hossein; Ghasemikhah, Pouya; Ghadermazi, Mohammad; Soleimannejad, Janet; Adams, Harry","Triaqua(pyridine-2,6-dicarboxylato)magnesium(II) dihydrate","Acta Crystallographica Section E","2007","63","5","m1487","m1489","10.1107/S160053680701937X","","","0.71073","MoKα","","0.0295","0.0275","","","0.0773","0.0793","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213507","4.6461","0.0002","14.2262","0.0006","23.9227","0.0011","90","","90","","90","","1581.2","0.12","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(3Z,4Z)-3,4-Bis(1,3-benzodioxol-5-ylmethylene)tetrahydrofuran-2,5-dione","","- C20 H12 O7 -","- C20 H12 O7 -","- C80 H48 O28 -","4","1","PR2004","Dong, Wen-Liang; Yao, Wei-Jian; Wei, Fang; Zhao, Bao-Xiang","(3<i>Z</i>,4<i>Z</i>)-3,4-Bis(1,3-benzodioxol-5-ylmethylene)tetrahydrofuran-2,5-dione","Acta Crystallographica Section E","2007","63","5","o2776","o2777","10.1107/S1600536807020223","","","0.71073","MoKα","","0.1262","0.0575","","","0.1266","0.1703","","","","","","0.994","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213508","10.0587","0.0004","6.5923","0.0002","13.4209","0.0005","90","","91.183","0.001","90","","889.75","0.06","100","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,4,5-Trimethyl-1,2,4-triazole trihydrate","","- C5 H15 N3 O3 -","- C5 H15 N3 O3 -","- C20 H60 N12 O12 -","4","1","PR2005","Adam D. Beitelman; Nathan A. Sieracki; Matthias Zeller; Gregory M. Ferrence","3,4,5-Trimethyl-1,2,4-triazole trihydrate","Acta Crystallographica Section E","2007","63","5","o2739","o2741","10.1107/S1600536807020235","","","0.71073","MoKα","","","0.049","","","","0.1493","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213509","11.0107","0.0016","9.8541","0.0014","8.6457","0.0013","90","","97.266","0.002","90","","930.5","0.2","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis[4-(trifluoromethyl)benzylidene]butane-1,4-diamine","","- C20 H18 F6 N2 -","- C20 H18 F6 N2 -","- C40 H36 F12 N4 -","2","0.5","PV2006","Habibi, Mohammad Hossein; Zendehdel, Mahmoud; Barati, Kazem; W. Harrington, Ross; Clegg, William","<i>N</i>,<i>N</i>'-Bis[4-(trifluoromethyl)benzylidene]butane-1,4-diamine","Acta Crystallographica Section E","2007","63","5","o2515","o2516","10.1107/S1600536807017345","","","0.71073","MoKα","","0.0546","0.0476","","","0.1229","0.1298","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213510","8.726","0.0004","14.7521","0.0007","15.7421","0.0007","90","","102.866","0.001","90","","1975.55","0.16","87","2","87","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Si-bridged Magnesocene","[η^2^,η^5^-Dicyclopentadienyldimethylsilane(2-)]bis(tetrahydrofuran- κO)magnesium","","- C20 H30 Mg O2 Si -","- C20 H30 Mg O2 Si -","- C80 H120 Mg4 O8 Si4 -","4","1","PV2007","Perrotin, Philippe; Twamley, Brendan; Shapiro, Pamela J.","[η^2^,η^5^-Dicyclopentadienyldimethylsilane(2‒)]bis(tetrahydrofuran-κ<i>O</i>)magnesium: an Si-bridged magnesocene","Acta Crystallographica Section E","2007","63","5","m1277","m1278","10.1107/S1600536807015942","","","0.71073","MoKα","","0.0377","0.0353","","","0.0869","0.0884","","","","","","1.077","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213511","4.8541","0.0008","9.9845","0.0009","10.4849","0.0002","108.383","0.005","97.816","0.008","96.071","0.006","471.74","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","o-Carboxphenylammonuim Dihydrogenmonophosphate","2-carboxyanilinium dihydrogenphosphate","","- C7 H10 N O6 P -","- C7 H10 N O6 P -","- C14 H20 N2 O12 P2 -","2","1","PV2008","Nourredine Benali-Cherif; Fatim, Allouche; Amani Direm; Lila Boukli-H-Benmenni; Kawther Soudani","Hydrogen bonding in 2-carboxyanilinium dihydrogenphosphate","Acta Crystallographica Section E","2007","63","5","o2643","o2645","10.1107/S1600536807016303","","","0.71073","MoKα","","0.0451","0.0372","","","0.0864","0.0903","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213512","5.1765","0.001","5.7929","0.0012","13.335","0.003","80.92","0.03","83.54","0.03","68.82","0.03","367.52","0.15","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","(RS)-2-Methylglutaric acid","","- C6 H10 O4 -","- C6 H10 O4 -","- C12 H20 O8 -","2","1","RK2001","Fang-Yang Yao; Xian-Wen Wang; Zheng, Yue-Qing","(<i>RS</i>)-2-Methylglutaric acid","Acta Crystallographica Section E","2007","63","5","o2386","o2387","10.1107/S1600536807014997","","","0.71073","MoKα","","0.0818","0.0498","","","0.1287","0.1569","","","","","","1.085","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213513","13.089","0.003","4.9156","0.001","15.196","0.003","90","","114.15","0.03","90","","892.1","0.4","183","2","183","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Benzyl 2-amino-4,6-O-benzylidene-2-deoxy-α-D-glucopyranoside","","- C20 H23 N O5 -","- C20 H23 N O5 -","- C40 H46 N2 O10 -","2","1","RK2002","Burkhardt, Anja; Buchholz, Axel; Görls, Helmar; Plass, Winfried","Benzyl 2-amino-4,6-<i>O</i>-benzylidene-2-deoxy-α-<small>D</small>-glucopyranoside","Acta Crystallographica Section E","2007","63","5","o2527","o2529","10.1107/S1600536807015000","","","0.71073","MoKα","","0.08","0.0451","","","0.0849","0.1038","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213514","7.9025","0.0005","11.8868","0.0008","20.5798","0.0016","90","","97.079","0.004","90","","1918.4","0.2","203","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Carbonyl(η^5^-cyclopentadienyl)(3,5-dimethylpyridine- κN)(triethylsilyl)iron(II)","","- C19 H29 Fe N O Si -","- C19 H29 Fe N O Si -","- C76 H116 Fe4 N4 O4 Si4 -","4","1","RK2004","Masumi Itazaki; Kensuke Ueda; Hiroshi Nakazawa","Carbonyl(η^5^-cyclopentadienyl)(3,5-dimethylpyridine-κ<i>N</i>)(triethylsilyl)iron(II)","Acta Crystallographica Section E","2007","63","5","m1312","m1313","10.1107/S1600536807015401","","","0.71073","MoKα","","0.0619","0.0536","","","0.1411","0.147","","","","","","1","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213515","7.6656","0.0013","13.813","0.002","14.969","0.003","115.085","0.003","101.372","0.003","91.148","0.003","1397.7","0.4","299","2","299","2","","","","","","","","4","P -1","-P 1","2","","Benzimidazolium 2-nitrobenzoate bis(2-nitrobenzoic acid)","","- C28 H21 N5 O12 -","- C28 H21 N5 O12 -","- C56 H42 N10 O24 -","2","1","RK2005","Wang, Zi-Liang; Wei, Lin-Heng","Benzimidazolium 2-nitrobenzoate bis(2-nitrobenzoic acid)","Acta Crystallographica Section E","2007","63","5","o2574","o2575","10.1107/S1600536807018636","","","0.71073","MoKα","","0.084","0.0682","","","0.1647","0.1747","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213516","19.597","0.004","8.82","0.002","14.659","0.003","90","","96.618","0.004","90","","2516.9","0.9","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(Acetonitrile)bis(1,10-phenanthroline)copper(II) bis(perchlorate)","","- C26 H19 Cl2 Cu N5 O8 -","- C26 H19 Cl2 Cu N5 O8 -","- C104 H76 Cl8 Cu4 N20 O32 -","4","0.5","RK2006","Serb, Mihaela-Diana; Calmuschi-Cula, Beatrice; Dumitru, Florina; Dols, Thomas; Englert, Ulli; Guran, Cornelia","(Acetonitrile)bis(1,10-phenanthroline)copper(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","5","m1292","m1293","10.1107/S1600536807015036","","","0.71073","MoKα","","0.0598","0.0487","","","0.104","0.1086","","","","","","1.136","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213517","10.675","0.002","8.8373","0.0018","14.995","0.003","90","","90","","90","","1414.6","0.5","295","2","295","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","4,4'-(p-Phenylenediimino)dipent-3-en-2-one","","- C16 H20 N2 O2 -","- C16 H20 N2 O2 -","- C64 H80 N8 O8 -","4","0.5","RK2007","Su, Qing; Wu, Qiao-Lin; Li, Guang-Hua; Gao, Wei; Mu, Ying","4,4'-(<i>p</i>-Phenylenediimino)dipent-3-en-2-one","Acta Crystallographica Section E","2007","63","5","o2052","o2053","10.1107/S1600536807013384","","","0.71073","MoKα","","0.0458","0.0374","","","0.096","0.1013","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213518","8.8386","0.0001","9.879","0.0002","10.5647","0.0002","89.589","0.005","82.226","0.006","81.737","0.008","904.44","0.04","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","N-(4-Methylbenzyl)-N-(6-methyl-2-pyridyl)benzenesulfonamide","","- C20 H20 N2 O2 S -","- C20 H20 N2 O2 S -","- C40 H40 N4 O4 S2 -","2","1","RK2009","Çaylak, Nagihan; Hökelek, Tuncer; Hasırcı, Serdar; Ergün, Yavuz","<i>N</i>-(4-Methylbenzyl)-<i>N</i>-(6-methyl-2-pyridyl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","5","o2261","o2262","10.1107/S1600536807015395","","","0.71073","MoKα","","0.0831","0.0648","","","0.1507","0.1631","","","","","","1.177","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213519","9.6438","0.0006","8.9672","0.0005","15.0549","0.0009","90","","103.203","0.001","90","","1267.5","0.13","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(9R,15R)-Methyl 3,15-diacetyl-4-(2-cyanoethyl)-4,9,10- trimethylperhydrocyclopenta[a]phenanthrene-13-carboxylate","","- C29 H43 N O4 -","- C29 H43 N O4 -","- C58 H86 N2 O8 -","2","1","RK2010","Oxana B. Flekhter; Natalya I. Medvedeva; Kyrill Yu. Suponitsky","(9<i>R</i>,15<i>R</i>)-Methyl 3,15-diacetyl-4-(2-cyanoethyl)-4,9,10-trimethylperhydrocyclopenta[<i>a</i>]phenanthrene-13-carboxylate","Acta Crystallographica Section E","2007","63","5","o2603","o2603","10.1107/S1600536807018223","","","0.71073","MoKα","","0.0477","0.0355","","","0.0718","0.0746","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213520","9.134","0.002","10.641","0.003","17.696","0.005","90","","98.04","0.02","90","","1703.1","0.8","284","2","284","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-Benzamido-2-(2-furyl)-3-phenylcyclopropanecarboxylic acid","","- C21 H17 N O4 -","- C21 H17 N O4 -","- C84 H68 N4 O16 -","4","1","RZ2121","Wan-Yun Huang; Gui-Fa Su; Cheng-Xue Pan; Jiang-Ke Qin","1-Benzamido-2-(2-furyl)-3-phenylcyclopropanecarboxylic acid","Acta Crystallographica Section E","2007","63","5","o2686","o2687","10.1107/S1600536807019150","","","0.71073","MoKα","","0.0959","0.0471","","","0.0779","0.0848","","","","","","0.991","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213521","5.3411","0.0002","15.8299","0.0007","17.4133","0.0008","90","","98.034","0.001","90","","1457.83","0.11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Methyl-N'-[(E)-4-methylbenzylidene]benzenesulfonohydrazide","","- C15 H16 N2 O2 S -","- C15 H16 N2 O2 S -","- C60 H64 N8 O8 S4 -","4","1","RZ2122","Tabatabaee, Masoumeh; Ghasemzadeh, Mitra; Anari-Abbasnejad, Mohamad; Nozari, Najmeh; Sadegheian, Shirin","4-Methyl-<i>N</i>'-[(<i>E</i>)-4-methylbenzylidene]benzenesulfonohydrazide","Acta Crystallographica Section E","2007","63","5","o2099","o2100","10.1107/S160053680701327X","","","0.71073","MoKα","","0.0472","0.0367","","","0.0998","0.1071","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213522","9.5219","0.0009","9.9083","0.0009","14.1931","0.0013","90","","90","","90","","1339.1","0.2","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[(N,N-diethylethane-1,2-diamine)thiocyanatocopper(II)]- μ-thiocyanato]","","- C8 H16 Cu N4 S2 -","- C8 H16 Cu N4 S2 -","- C32 H64 Cu4 N16 S8 -","4","1","RZ2124","Li-Hua Wang; Li-Zhong Li","<i>catena</i>-Poly[[(<i>N</i>,<i>N</i>-diethylethane-1,2-diamine)thiocyanatocopper(II)]-μ-thiocyanato]","Acta Crystallographica Section E","2007","63","5","m1214","m1216","10.1107/S1600536807013608","","","0.71073","MoKα","","0.0296","0.0253","","","0.0549","0.0566","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213523","16.737","0.0016","7.8191","0.0008","18.3486","0.0018","90","","109.217","0.002","90","","2267.4","0.4","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(2,2';6',2''-Terpyridin-4'-yloxy)propyl toluene-4-sulfonate","","- C25 H23 N3 O4 S -","- C25 H23 N3 O4 S -","- C100 H92 N12 O16 S4 -","4","1","RZ2125","Hoogenboom, Richard; Nakahashi, Akiko; Kickelbick, Guido; Chujo, Yoshiki; Schubert, Ulrich S.","3-(2,2':6',2''-Terpyridin-4'-yloxy)propyl toluene-4-sulfonate","Acta Crystallographica Section E","2007","63","5","o2311","o2313","10.1107/S1600536807017229","","","0.71073","MoKα","","0.0514","0.0421","","","0.1143","0.1248","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213524","6.7144","0.0004","12.6734","0.0007","16.9009","0.001","90","","90","","90","","1438.17","0.14","100","0.1","297","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-Phenyl-aceanthrylene-2,6-dione","","- C22 H12 O2 -","- C22 H12 O2 -","- C88 H48 O8 -","4","1","RZ2126","Zhe Li; Hoong-Kun Fun; Suchada Chantrapromma; Jian-Hua Xu","1-Phenylaceanthrylene-2,6-dione","Acta Crystallographica Section E","2007","63","5","o2499","o2500","10.1107/S160053680701700X","","","0.71073","MoKα","","0.0868","0.0695","","","0.1577","0.1683","","","","","","1.086","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213525","8.9764","0.0017","9.1437","0.0018","9.5321","0.0018","63.838","0.003","78.558","0.003","70.586","0.003","661","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","N,N'-Bis(3-pyridiniomethyl)-4,4'-benzidinediium tetrachloride dihydrate","","- C24 H30 Cl4 N4 O2 -","- C24 H30 Cl4 N4 O2 -","- C24 H30 Cl4 N4 O2 -","1","0.5","RZ2128","Yun-Qian Zhang; Xin Xiao; Sai-Feng Xue; Qian-Jiang Zhu; Zhu Tao","<i>N</i>,<i>N</i>'-Bis(3-pyridiniomethyl)-4,4'-benzidinediium tetrachloride dihydrate","Acta Crystallographica Section E","2007","63","5","o2625","o2626","10.1107/S1600536807017795","","","0.71073","MoKα","","0.0353","0.0338","","","0.1011","0.1022","","","","","","1.081","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213526","23.4037","0.0004","15.5866","0.0003","15.596","0.0003","90","","121.012","0.001","90","","4875.96","0.16","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","μ-Aqua-bis(μ-4-chlorobenzoato)bis[(4-chlorobenzoato)(1,10- phenanthroline)manganese(II)]","","- C52 H34 Cl4 Mn2 N4 O9 -","- C52 H34 Cl4 Mn2 N4 O9 -","- C208 H136 Cl16 Mn8 N16 O36 -","4","0.5","RZ2129","Yu-Li Shen; Sheng-Li Sun; Wen-Dong Song","μ-Aqua-bis(μ-4-chlorobenzoato)bis[(4-chlorobenzoato)(1,10-phenanthroline)manganese(II)]","Acta Crystallographica Section E","2007","63","5","m1309","m1311","10.1107/S1600536807017801","","","0.71073","MoKα","","0.0754","0.0448","","","0.1043","0.1216","","","","","","1.046","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213527","8.7765","0.001","10.1549","0.0012","22.707","0.003","90","","95.885","0.002","90","","2013.1","0.4","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","6-Bromo-3-(4-chlorophenyl)-2-(4-methoxyphenyl)- 3,4-dihydro-1,3,2-benzoxazaphosphinine 2-sulfide","","- C20 H16 Br Cl N O2 P S -","- C20 H16 Br Cl N O2 P S -","- C80 H64 Br4 Cl4 N4 O8 P4 S4 -","4","1","RZ2131","Radha Krishna, J.; Krishnaiah, M.; Syam Prasad, G.; Suresh Reddy, C.; Vedavati G. Puranik.","6-Bromo-3-(4-chlorophenyl)-2-(4-methoxyphenyl)-3,4-dihydro-1,3,2-benzoxazaphosphinine 2-sulfide","Acta Crystallographica Section E","2007","63","5","o2407","o2409","10.1107/S160053680701776X","","","0.71073","MoKα","","0.0618","0.0468","","","0.1211","0.1312","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213528","21.8718","0.0011","6.8726","0.0003","8.8127","0.0004","90","","100.199","0.004","90","","1303.76","0.11","100","1","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[aquadi-μ~3~-dicyanamido-di-μ~2~-dicyanamido-dicopper(II)]","","- C8 H2 Cu2 N12 O -","- C8 H2 Cu2 N12 O -","- C32 H8 Cu8 N48 O4 -","4","0.5","SA2040","Kožíšek, Jozef; Díaz, Jesús García; Albor, Atzimba García","Poly[aquadi-μ~3~-dicyanamido-di-μ~2~-dicyanamido-dicopper(II)]","Acta Crystallographica Section E","2007","63","5","i125","i126","10.1107/S1600536807015917","","","0.71073","MoKα","","0.0172","0.0169","","","0.0473","0.0475","","","","","","1.188","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213529","9.89","0.0003","11.257","0.0004","13.018","0.0003","98.287","0.002","105.042","0.002","108.979","0.001","1281.45","0.07","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","Bis(benzyltriphenylphosphonium) tetrachloridoplatinate(II) trichloromethane disolvate","","- C52 H46 Cl10 P2 Pt -","- C52 H46 Cl10 P2 Pt -","- C52 H46 Cl10 P2 Pt -","1","0.5","SA2042","Bokach, Nadezhda A.; Izotova, Yulia A.; Haukka, Matti","Bis(benzyltriphenylphosphonium) tetrachloridoplatinate(II) trichloromethane disolvate","Acta Crystallographica Section E","2007","63","5","m1261","m1262","10.1107/S1600536807014328","","","0.71073","MoKα","","0.0376","0.0324","","","0.0598","0.0616","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213530","5.3724","0.0011","18.223","0.004","7.6663","0.0016","90","","100.474","0.004","90","","738","0.3","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","7-(1,3-Dioxolan-2-ylmethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione acetic acid solvate","","- C13 H18 N4 O6 -","- C13 H18 N4 O6 -","- C26 H36 N8 O12 -","2","1","SA2043","Bing Tu; Xing-Jü Ma; Zhan Shu; Zhi-Min Jin","7-(1,3-Dioxolan-2-ylmethyl)-1,3-dimethyl-3,7-dihydro-1<i>H</i>-purine-2,6-dione acetic acid solvate","Acta Crystallographica Section E","2007","63","5","o2676","o2677","10.1107/S1600536807014341","","","0.71073","MoKα","","0.0674","0.0668","","","0.1686","0.1691","","","","","","1.292","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213531","10.1107","0.0004","14.1645","0.0006","15.3877","0.0007","103.224","0.0011","102.827","0.0012","94.086","0.0012","2074.39","0.15","93.1","","","","","","","","","","","6","P -1","-P 1","2","","Ammonium bis{3-anilinocarbonyl-1-[(5-chloro-2-oxidophenyl)diazenyl]- 2-naphtholato}ferrate(III) methanol solvate","","- C47 H56 Cl2 Fe N7 O7 -","- C47 H36 Cl2 Fe N7 O7 -","- C94 H72 Cl4 Fe2 N14 O14 -","2","1","SA2046","Mizuguchi, Jin; Sato, Yohei; Uta, Kazuya","Ammonium bis{3-anilinocarbonyl-1-[(5-chloro-2-oxidophenyl)diazenyl]-2-naphtholato}ferrate(III) methanol solvate","Acta Crystallographica Section E","2007","63","5","m1327","m1328","10.1107/S160053680701656X","","","0.71069","MoKα","","","0.0542","","","","0.1574","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213532","11.3199","0.0014","13.7962","0.0017","27.757","0.004","90","","93.747","0.003","90","","4325.6","1","100","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Ammonium bis{3-anilinocarbonyl-1-[(5-chloro-2-oxidophenyl)diazenyl]- 2-naphtholato}ferrate(III) acetone solvate","","- C49 H58 Cl2 Fe N7 O7 -","- C49 H38 Cl2 Fe N7 O7 -","- C196 H152 Cl8 Fe4 N28 O28 -","4","1","SA2047","Mizuguchi, Jin; Uta, Kazuya; Sato, Yohei","Ammonium bis{3-anilinocarbonyl-1-[(5-chloro-2-oxidophenyl)diazenyl]-2-naphtholato}ferrate(III) acetone solvate","Acta Crystallographica Section E","2007","63","5","m1329","m1330","10.1107/S1600536807016571","","","0.71075","MoKα","","","0.089","","","","0.2574","","","","","","0.995","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213533","14.801","0.006","4.8325","0.0019","18.624","0.008","90","","90","","90","","1332.1","0.9","298","2","298","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","3-[3-(3-Methoxybenzoyl)thioureido]propionic acid","","- C12 H14 N2 O4 S -","- C12 H14 N2 O4 S -","- C48 H56 N8 O16 S4 -","4","1","SA2048","Othman, Eliyanti A.; Arif, M. Asyikin M.; Yamin, Bohari M.","3-[3-(3-Methoxybenzoyl)thioureido]propionic acid","Acta Crystallographica Section E","2007","63","5","o2436","o2437","10.1107/S1600536807017667","","","0.71073","MoKα","","0.04","0.035","","","0.083","0.085","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213534","12.4246","0.0015","11.6657","0.0014","10.7149","0.0013","90","","95.692","0.002","90","","1545.4","0.3","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(4-Acetylphenyl)diphenylamine","","- C20 H17 N O -","- C20 H17 N O -","- C80 H68 N4 O4 -","4","1","SG2151","Hong-Li Wang; Bin Zhang; Wen-Yuan Xu; Yi-Qiong Bai; Hong Wu","(4-Acetylphenyl)diphenylamine","Acta Crystallographica Section E","2007","63","5","o2648","o2649","10.1107/S1600536807017904","","","0.71073","MoKα","","0.0828","0.054","","","0.1299","0.1418","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213535","18.8437","0.0014","18.8437","0.0014","23.561","0.002","90","","90","","120","","7245.3","1","173","2","173","2","","","","","","","","5","R -3 :H","-R 3","148","","N-(4-Methyl-3-phenyl-2,3-dihydro-1,3-thiazol-2-ylidene)benzamide","","- C18 H16 N2 O S -","- C18 H16 N2 O S -","- C324 H288 N36 O18 S18 -","18","1","SG2152","Saeed, Aamer; Bolte, Michael","<i>N</i>-(4-Methyl-3-phenyl-2,3-dihydro-1,3-thiazol-2-ylidene)benzamide","Acta Crystallographica Section E","2007","63","5","o2455","o2456","10.1107/S1600536807017138","","","0.71073","MoKα","","0.0596","0.0418","","","0.1051","0.1141","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213536","8.9698","0.0005","9.3913","0.0005","11.1474","0.0006","68.299","0.003","72.618","0.003","68.573","0.003","797.51","0.08","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 5-methyl-4-(2-bromomethyl-5,5-dimethyl-1,3-dioxan-2-yl)isoxazole-3-carboxylate","","- C14 H20 Br N O5 -","- C14 H20 Br N O5 -","- C28 H40 Br2 N2 O10 -","2","1","SG2153","Twamley, Brendan; Szabon-Watola, Monika; Sharma, Shikha; Natale, Nicholas R.","Ethyl 4-(2-bromomethyl-5,5-dimethyl-1,3-dioxan-2-yl)-5-methylisoxazole-3-carboxylate","Acta Crystallographica Section E","2007","63","5","o2258","o2260","10.1107/S1600536807014845","","","0.71073","MoKα","","0.0352","0.0329","","","0.091","0.0923","","","","","","1.106","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213537","16.9055","0.0015","4.0057","0.0002","18.0989","0.0016","90","","111.49","0.007","90","","1140.42","0.16","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(2-Nitro-4-propoxyphenyl)acetamide","","- C11 H14 N2 O4 -","- C11 H14 N2 O4 -","- C44 H56 N8 O16 -","4","1","SG2154","Yathirajan, H. S.; Bindya, S.; Ashok, M. A.; Narayana, B.; Bolte, Michael","<i>N</i>-(2-Nitro-4-propoxyphenyl)acetamide","Acta Crystallographica Section E","2007","63","5","o2202","o2203","10.1107/S1600536807015425","","","0.71073","MoKα","","0.0465","0.0385","","","0.1004","0.1052","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213538","9.8891","0.0009","18.0806","0.0015","13.2945","0.0011","90","","90.905","0.002","90","","2376.8","0.4","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(tetrabutylammonium) μ-oxalato-bis[dibromidodioxidotungstate(VI)]","","- C34 H72 Br4 N2 O8 W2 -","- C34 H72 Br4 N2 O8 W2 -","- C68 H144 Br8 N4 O16 W4 -","2","0.5","SG2155","Clegg, William; Elsegood, Mark R. J.; Errington, R. John; Wingad, Richard L.","Bis(tetrabutylammonium) μ-oxalato-bis[dibromidodioxidotungstate(VI)]","Acta Crystallographica Section E","2007","63","5","m1269","m1270","10.1107/S1600536807017102","","","0.71073","MoKα","","0.0282","0.0256","","","0.061","0.0627","","","","","","1.173","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213539","9.7075","0.0019","10.153","0.002","12.227","0.002","101.34","0.03","97.61","0.04","96.04","0.03","1160.4","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","Hexakis(trimethylsiloxymethyl)benzene methanol disolvate","","- C32 H74 O8 Si6 -","- C32 H74 O8 Si6 -","- C32 H74 O8 Si6 -","1","0.5","SG2156","Rothenberger, Alexander; Ponikiewski, Lukasz","Hexakis(trimethylsiloxymethyl)benzene methanol disolvate","Acta Crystallographica Section E","2007","63","5","o2634","o2635","10.1107/S1600536807017047","","","0.71073","MoKα","","0.1022","0.0569","","","0.1543","0.2133","","","","","","1.065","","","","has coordinates,has disorder","176787","2020-10-21","18:00:00",""
"2213540","4.5946","0.0009","8.9294","0.0018","13.452","0.003","90","","95.5","0.03","90","","549.4","0.2","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Hexakis(hydroxymethyl)benzene","","- C12 H18 O6 -","- C12 H18 O6 -","- C24 H36 O12 -","2","0.5","SG2157","Rothenberger, Alexander; Ponikiewski, Lukasz","Hexakis(hydroxymethyl)benzene","Acta Crystallographica Section E","2007","63","5","o2636","o2637","10.1107/S1600536807017035","","","0.71073","MoKα","","0.0732","0.0558","","","0.1435","0.166","","","","","","0.956","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213541","11.7233","0.0016","9.8849","0.0013","16.216","0.002","90","","100.143","0.002","90","","1849.8","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-chloro-2-methylbenzene-1-sulfonyl chloride","","- C7 H6 Cl2 O2 S -","- C7 H6 Cl2 O2 S -","- C56 H48 Cl16 O16 S8 -","8","1","SG2163","Chan, Luisa; Daniels, Lee","3-Chloro-2-methylbenzene-1-sulfonyl chloride","Acta Crystallographica Section E","2007","63","5","o2435","o2435","10.1107/S1600536807017059","","","0.71075","MoKα","","0.0692","0.0474","","","0.1132","0.1263","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213542","5.7272","0.0002","7.9162","0.0002","18.7857","0.0005","90","","96.514","0.001","90","","846.2","0.04","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 4-tolyl sulfone","","- C8 H10 O2 S -","- C8 H10 O2 S -","- C32 H40 O8 S4 -","4","1","SG2165","Yu-Yuan Ye","Methyl 4-tolyl sulfone","Acta Crystallographica Section E","2007","63","5","o2652","o2652","10.1107/S1600536807018545","","","0.71073","MoKα","","0.0403","0.035","","","0.1046","0.1093","","","","","","1.094","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213543","11.6788","0.0004","20.0635","0.0007","10.4288","0.0004","90","","90","","90","","2443.65","0.15","93","2","93","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Tri-tert-butyl 3,3',3""-(aminomethanetriyl)tripropanoate","","- C22 H41 N O6 -","- C22 H41 N O6 -","- C88 H164 N4 O24 -","4","1","SI2006","Weber, Edwin; Langer, Joachim; Seichter, Wilhelm","Tri-<i>tert</i>-butyl 3,3',3''-(aminomethanetriyl)tripropanoate","Acta Crystallographica Section E","2007","63","5","o2064","o2065","10.1107/S1600536807012615","","","0.71073","MoKα","","0.0404","0.0339","","","0.0917","0.1112","","","","","","1.119","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213544","11.816","0.0002","12.5893","0.0003","18.3033","0.0004","90","","90","","90","","2722.71","0.1","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","7-Isopropyl-5-methyl-1,3,5-triazepane-2,6-dione deuterated chloroform 0.94-solvate","","- C8.9385 H15 Cl2.8155 D0.9385 N3 O2 -","- C8.9385 H15 Cl2.8155 D0.9385 N3 O2 -","- C71.508 H120 Cl22.524 D7.508 N24 O16 -","8","2","SI2008","Aubert, Emmanuel; Lena, Gersande; Gellenoncourt, Martine; Durain, Eric; Guichard, Gilles; Didierjean, Claude","7-Isopropyl-5-methyl-1,3,5-triazepan-2,6-dione deuterated chloroform 0.94-solvate","Acta Crystallographica Section E","2007","63","5","o2306","o2308","10.1107/S1600536807014912","","","0.71073","MoKα","","0.0301","0.0281","","","0.0719","0.0727","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213545","9.8939","0.0016","14.909","0.002","21.963","0.004","90","","93.846","0.004","90","","3232.4","0.9","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Hexakis(pyridine-N-oxide)iron(II) Tetraphenylborate","","- C78 H70 B2 Fe N6 O6 -","- C78 H70 B2 Fe N6 O6 -","- C156 H140 B4 Fe2 N12 O12 -","2","0.5","SI2009","Crossland, Justin L; Zakharov, Lev N; Tyler, David R","Hexakis(pyridine <i>N</i>-oxide-κ<i>O</i>)iron(II) tetraphenylborate","Acta Crystallographica Section E","2007","63","5","m1196","m1197","10.1107/S1600536807013931","","","0.71073","MoKα","","0.1346","0.0651","","","0.0996","0.1219","","","","","","1.052","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213546","15.4391","0.0006","5.9873","0.0002","19.5007","0.0007","90","","90","","90","","1802.62","0.11","110","2","","","","","","","","","","4","P n a 21","P 2c -2n","33","","2-(2-thienyl)-1,3-bis(2-thienylmethyl)perhydropyrimidine","","- C18 H20 N2 S3 -","- C18 H20 N2 S3 -","- C72 H80 N8 S12 -","4","1","SI2010","Jaganyi, Deogratius; Mambanda, Allen; Munro, Orde Q.","A tripodal tris(thiophene) derivative of hexahydropyrimidine and its ladder-like extended structure","Acta Crystallographica Section E","2007","63","5","o2388","o2390","10.1107/S1600536807016017","","","0.71073","MoKα","","","0.0289","","","","0.0821","","","","","","1.119","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213547","9.0672","0.0018","8.6022","0.0017","9.601","0.002","90","","101.335","0.003","90","","734.3","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[<i>trans</i>-diaquabis(μ~2~-3-pyridylacetato)copper(II)]","","- C14 H16 Cu N2 O6 -","- C14 H16 Cu N2 O6 -","- C28 H32 Cu2 N4 O12 -","2","0.5","SI2011","Qin, Su-Ni; Liang, Fu-Pei; Chen, Zi-Lu; Yan, Wei-Hong","Poly[<i>trans</i>-diaquabis(μ~2~-3-pyridylacetato)copper(II)]","Acta Crystallographica Section E","2007","63","5","m1492","m1493","10.1107/S1600536807018417","","","0.71073","MoKα","","0.0871","0.047","","","0.0923","0.1173","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213548","9.26","0.002","8.7283","0.0018","9.671","0.002","90","","106.788","0.003","90","","748.3","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[<i>trans</i>-diaquamanganese(II)]-di-μ-(3-pyridyl)acetato]","","- C14 H16 Mn N2 O6 -","- C14 H16 Mn N2 O6 -","- C28 H32 Mn2 N4 O12 -","2","0.5","SI2014","Qin, Su-Ni; Liang, Fu-Pei; Chen, Zi-Lu; Cai, Yan-Lin","<i>catena</i>-Poly[[<i>trans</i>-diaquamanganese(II)]-di-μ-3-pyridylacetato]","Acta Crystallographica Section E","2007","63","5","m1551","m1551","10.1107/S1600536807020466","","","0.71073","MoKα","","0.1464","0.0718","","","0.1175","0.1379","","","","","","0.991","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213549","8.2263","0.0008","19.3791","0.0019","10.6624","0.001","90","","94.198","0.003","90","","1695.2","0.3","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[(2-Chlorophenyl)(1,2,3,4-tetrahydro-1-oxo-2-naphthyl)methyl]malononitrile","","- C20 H15 Cl N2 O -","- C20 H15 Cl N2 O -","- C80 H60 Cl4 N8 O4 -","4","1","SJ2236","Jie-Xing Zhou; Xiang-Shan Wang; Da-Qing Shi","2-[(2-Chlorophenyl)(1,2,3,4-tetrahydro-1-oxo-2-naphthyl)methyl]malononitrile","Acta Crystallographica Section E","2007","63","5","o2082","o2083","10.1107/S1600536807010367","","","0.7107","MoKα","","0.0716","0.0637","","","0.1588","0.1647","","","","","","1.099","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213550","10.457","0.0001","10.452","0.0001","23.277","0.0004","90","","90","","90","","2544.1","0.06","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis(cinnamato-κO)bis[2-(dimethylamino)ethanol-κ^2^N,O]copper(II)","","- C26 H36 Cu N2 O6 -","- C26 H36 Cu N2 O6 -","- C104 H144 Cu4 N8 O24 -","4","0.5","SJ2247","Tahir, Asif A.; Hamid, Mazhar; Mazhar, Muhammad; Molloy. Kieran C.","Bis(cinnamato-κ<i>O</i>)bis[2-(dimethylamino)ethanol-κ^2^<i>N</i>,<i>O</i>]copper(II)","Acta Crystallographica Section E","2007","63","5","m1243","m1245","10.1107/S1600536807013396","","","0.71073","MoKα","","0.054","0.0385","","","0.0994","0.1084","","","","","","1.145","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213551","5.0746","0.0004","8.0636","0.0006","15.058","0.001","94.711","0.001","93.153","0.001","90.538","0.001","613.1","0.08","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","2-(5-Ethyl-3-methylsulfanyl-1-benzofuran-2-yl)acetic acid","","- C13 H14 O3 S -","- C13 H14 O3 S -","- C26 H28 O6 S2 -","2","1","SJ2260","Seo, Pil Ja; Choi, Hong Dae; Son, Byeng Wha; Lee, Uk","2-(5-Ethyl-3-methylsulfanyl-1-benzofuran-2-yl)acetic acid","Acta Crystallographica Section E","2007","63","5","o2048","o2049","10.1107/S1600536807013165","","","0.71073","MoKα","","0.0389","0.0353","","","0.0936","0.0958","","","","","","1.101","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213552","9.6532","0.0007","12.655","0.0009","10.571","0.0008","90","","105.096","0.001","90","","1246.8","0.16","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","epoxyazadiradione","17-(3-furyl)-4,4,10,13-tetramethyl-3,16-dioxo- 3,4,5,6,7,8,9,10,11,12,13,15,16,17-tetradecahydro-20- oxacyclopropa[14,15]cyclopenta[a]phenathren-7-yl acetate","","- C28 H34 O6 -","- C28 H34 O6 -","- C56 H68 O12 -","2","1","SJ2261","R. Malathi; S. S. Rajan; R. Mohan Kumar; S. Narasimhan; K. Ravikumar","Epoxyazadiradione","Acta Crystallographica Section E","2007","63","5","o2483","o2485","10.1107/S1600536807016923","","","0.71073","MoKα","","0.0545","0.0519","","","0.1483","0.1522","","","","","","1.132","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213553","8.757","0.0011","11.208","0.002","11.302","0.002","89.91","0.003","76.45","0.003","89.53","0.003","1078.4","0.3","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","Aqua[N,N'-bis(4-methyl-1,3-benzothiazol-2-yl)pyridine-2,6- dicarboxamidato(2-)]copper(II)","","- C23 H17 Cu N5 O3 S2 -","- C23 H17 Cu N5 O3 S2 -","- C46 H34 Cu2 N10 O6 S4 -","2","1","SJ2262","Liu, Sheng-Gui; Ni, Chun-Lin; Li, Yi-Zhi","Aqua[<i>N</i>,<i>N</i>'-bis(4-methyl-1,3-benzothiazol-2-yl)pyridine-2,6-dicarboxamidato(2{-})]copper(II)","Acta Crystallographica Section E","2007","63","5","m1259","m1260","10.1107/S1600536807014365","","","0.71073","MoKα","","0.0806","0.0577","","","0.0917","0.0965","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213554","19.093","0.004","19.093","0.004","16.916","0.006","90","","90","","90","","6167","3","150","1","150","1","","","","","","","","5","I 41/a :2","-I 4ad","88","","Dipyridine[5,10,15,20-tetrakis(4-carboxyphenyl)porphyrinato]cobalt(II) pyridine tetrasolvate monohydrate","","- C78 H60 Co N10 O9 -","- C78 H58 Co N10 O9 -","- C312 H232 Co4 N40 O36 -","4","0.25","SJ2266","Li, Zong-Sheng; Chai, Jian-She","Dipyridine[5,10,15,20-tetrakis(4-carboxyphenyl)porphyrinato]cobalt(II) pyridine tetrasolvate monohydrate","Acta Crystallographica Section E","2007","63","5","m1533","m1535","10.1107/S1600536807015061","","","0.71073","MoKα","","0.1517","0.097","","","0.2435","0.3257","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213555","7.0167","0.0001","12.1953","0.0002","16.1081","0.0003","90","","90","","90","","1378.38","0.04","100","0.1","297","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2E,4E)-1-(3-nitrophenyl)-5-phenylpenta-2,4-dien-1-one","","- C17 H13 N O3 -","- C17 H13 N O3 -","- C68 H52 N4 O12 -","4","1","SJ2268","P. S. Patil; Jeannie Bee-Jan Teh; Hoong-Kun Fun; Ibrahim Abdul Razak; S. M. Dharmaprakash","(2<i>E</i>,4<i>E</i>)-1-(3-Nitrophenyl)-5-phenylpenta-2,4-dien-1-one","Acta Crystallographica Section E","2007","63","5","o2122","o2123","10.1107/S1600536807014663","","","0.71073","MoKα","","0.0497","0.0417","","","0.1101","0.1154","","","","","","1.071","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213556","7.42","0.002","7.673","0.003","10.59","0.004","75.534","0.005","74.094","0.005","70.637","0.006","538.6","0.3","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","Ethyl 3-(1,3-benzodioxol-5-yl)acrylate","","- C12 H12 O4 -","- C12 H12 O4 -","- C24 H24 O8 -","2","1","SJ2269","Li Zhang; Song-Qing Wang; Xuan Yu","Ethyl 3-(1,3-benzodioxol-5-yl)acrylate","Acta Crystallographica Section E","2007","63","5","o2278","o2279","10.1107/S1600536807015097","","","0.71073","MoKα","","0.0584","0.0383","","","0.0977","0.1139","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213557","12.2403","0.0006","10.4616","0.0003","20.233","0.0009","90","","100.942","0.004","90","","2543.8","0.19","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","10-(2-Fluorophenyl)-9-(4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7- tetrahydroacridine-1,8(2H,5H,9H,10H)-dione","","- C30 H32 F N O3 -","- C30 H32 F N O3 -","- C120 H128 F4 N4 O12 -","4","1","SJ2271","Büyükgüngör, Orhan; Kaya, Muharrem; Odabaşoğlu, Mustafa; Yıldırır, Yılmaz","10-(2-Fluorophenyl)-9-(4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7-tetrahydroacridine-1,8(2<i>H</i>,5<i>H</i>,9<i>H</i>,10<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","5","o2275","o2277","10.1107/S1600536807014675","","","0.71073","MoKα","","0.0469","0.0369","","","0.0971","0.1015","","","","","","1.057","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213558","7.2134","0.0003","10.2368","0.0005","12.5457","0.0005","101.869","0.003","98.002","0.003","103.406","0.003","864.73","0.07","100","0.1","297","2","","","","","","","","6","P -1","-P 1","2","","4,5,7-Trichloro-6-(2,4-dimethylthiazol-5-yl)-2-(3-hydroxypropyl)isoindole- 1,3-dione","","- C16 H13 Cl3 N2 O3 S -","- C16 H13 Cl3 N2 O3 S -","- C32 H26 Cl6 N4 O6 S2 -","2","1","SJ2272","Hoong-Kun Fun; Shea-Lin Ng; Miao Ye; Jian-Hua Xu","4,5,7-Trichloro-6-(2,4-dimethylthiazol-5-yl)-2-(3-hydroxypropyl)isoindole-1,3-dione","Acta Crystallographica Section E","2007","63","5","o2148","o2150","10.1107/S1600536807015115","","","0.71073","MoKα","","0.0514","0.0386","","","0.0931","0.101","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213559","8.3221","0.0003","8.7849","0.0002","14.9376","0.0004","100.189","0.002","95.084","0.002","117.496","0.002","935.12","0.05","100","0.1","297","2","","","","","","","","5","P -1","-P 1","2","","7,8,9,10-Tetrachloro-10b-(2-hydroxy-1-phenylethyl)-3,4-dihydro-2H-1,3-oxazino[2,3-a]isoindol-6(10bH)-one","","- C19 H15 Cl4 N O3 -","- C19 H15 Cl4 N O3 -","- C38 H30 Cl8 N2 O6 -","2","1","SJ2273","Hoong-Kun Fun; Jia-Jun Yue; Jian-Hua Xu; Suchada Chantrapromma","7,8,9,10-Tetrachloro-10b-(2-hydroxy-1-phenylethyl)-3,4-dihydro-2<i>H</i>-1,3-oxazino[2,3-<i>a</i>]isoindol-6(10b<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2151","o2153","10.1107/S1600536807015085","","","0.71073","MoKα","","0.0764","0.0515","","","0.136","0.1594","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213560","10.045","0.006","10.138","0.008","10.51","0.007","90","","112.42","0.04","90","","989.4","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","nicotinamidium trifluoroacetate","3-(Aminocarbonyl)pyridinium trifluoroacetate","","- C8 H7 F3 N2 O3 -","- C8 H7 F3 N2 O3 -","- C32 H28 F12 N8 O12 -","4","1","SJ2274","S. Athimoolam; S. Natarajan","3-(Aminocarbonyl)pyridinium trifluoroacetate","Acta Crystallographica Section E","2007","63","5","o2430","o2432","10.1107/S1600536807015310","","","0.71073","MoKα","","0.161","0.0663","","","0.1635","0.2123","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213561","8.4385","0.0011","8.4385","0.0011","42.901","0.006","90","","90","","90","","3054.9","0.7","297","2","297","2","","","","","","","","3","P 43 21 2","P 4nw 2abw","96","8-[(7,10-dihydroxy-1,3,6,6-tetramethyl-9-oxo-3,4,6,9-tetrahydro-1H- benzo[g]isochromen-8-yl)methyl]-7,10-dihydroxy-1,3,6,6-tetramethyl-1,3,4,6- tetrahydro-9H-benzo[g]isochromen-9-one","8,8'-Methylenebis(7,10-dihydroxy-1,3,6,6-tetramethyl-3,4-dihydro-1H- benzo[g]isochromen-9-one)","","- C35 H40 O8 -","- C35 H40 O8 -","- C140 H160 O32 -","4","0.5","SJ2275","Hoong-Kun Fun; Nawong Boonnak; Suchada Chantrapromma","8,8'-Methylenebis(7,10-dihydroxy-1,3,6,6-tetramethyl-3,4-dihydro-1<i>H</i>-benzo[<i>g</i>]isochromen-9-one)","Acta Crystallographica Section E","2007","63","5","o2317","o2318","10.1107/S160053680701611X","","","0.71073","MoKα","","0.0505","0.0455","","","0.1058","0.1085","","","","","","1.154","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213562","8.0229","0.0001","9.9314","0.0002","11.8275","0.0002","68.407","0.001","80.964","0.001","81.615","0.001","861.4","0.03","100","0.1","297","2","","","","","","","","6","P -1","-P 1","2","","9,10,11,12-Tetrachloro-12b-hydroxy-2,12c-dimethyl-3a,5,6,12c-tetrahydro Thiazalo[4,5-c][1,4]oxazepino[5,4-a]isoindol-8-one hydrate","","- C15 H14 Cl4 N2 O4 S -","- C15 H14 Cl4 N2 O4 S -","- C30 H28 Cl8 N4 O8 S2 -","2","1","SJ2276","Hoong-Kun Fun; Jeannie Bee-Jan Teh; Da-Qing Chen; Jian-Hua Xu","9,10,11,12-Tetrachloro-12b-hydroxy-2,12c-dimethyl-3a,5,6,12c-tetrahydrothiazalo[4,5-<i>c</i>][1,4]oxazepino[5,4-<i>a</i>]isoindol-8-one monohydrate","Acta Crystallographica Section E","2007","63","5","o2319","o2320","10.1107/S1600536807016674","","","0.71073","MoKα","","0.0247","0.0235","","","0.0637","0.0643","","","","","","1.131","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213563","9.843","0.002","14.707","0.003","15.312","0.003","90","","92.34","0.03","90","","2214.7","0.8","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5-(4-Chlorophenyl)-3-hydroxy-4-methylthiazole-2(3H)-thione:","","- C10 H8 Cl N O S2 -","- C10 H8 Cl N O S2 -","- C80 H64 Cl8 N8 O8 S16 -","8","2","SJ2277","Hartung, Jens; Gross, Andreas; Bergsträsser, Uwe","5-(4-Chlorophenyl)-3-hydroxy-4-methylthiazole-2(3<i>H</i>)-thione: an instance of bifurcated hydrogen bonding","Acta Crystallographica Section E","2007","63","5","o2743","o2745","10.1107/S1600536807018016","","","0.71073","MoKα","","0.0353","0.0299","","","0.0804","0.0824","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213564","9.4405","0.001","15.2017","0.0016","9.7458","0.001","90","","95.782","0.002","90","","1391.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(3-Methylphenoxy)-1,5-dihydro-2,4,3-benzodioxaphosphepin-3-one","","- C15 H15 O4 P -","- C15 H15 O4 P -","- C60 H60 O16 P4 -","4","1","SJ2278","J. Radha Krishna; Krishnaiah, M.; Stephen Babu, M. F.; Suresh Reddy, C.; Vedavati G. Puranik.","3-(3-Methylphenoxy)-1,5-dihydro-2,4,3-benzodioxaphosphepin-3-one","Acta Crystallographica Section E","2007","63","5","o2405","o2406","10.1107/S1600536807015954","","","0.71073","MoKα","","0.0537","0.0495","","","0.1145","0.1169","","","","","","1.181","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213565","7.178","0.001","11.8969","0.0016","14.649","0.002","90","","100.973","0.001","90","","1228.1","0.3","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(4-aminobenzenesulfonato-κN)diaquabis(N,N'-dimethylformamide-κO)copper(II)","","- C18 H30 Cu N4 O10 S2 -","- C18 H30 Cu N4 O10 S2 -","- C36 H60 Cu2 N8 O20 S4 -","2","0.5","SJ2280","Zhong-Xiang Du; Min-Le Han; Hong-Wei Hou","Bis(4-aminobenzenesulfonato-κ<i>N</i>)diaquabis(dimethylformamide-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2007","63","5","m1354","m1355","10.1107/S1600536807016911","","","0.71073","MoKα","","0.0264","0.0247","","","0.0723","0.0743","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213566","6.9797","0.0011","9.0174","0.0014","22.84","0.004","90","","90","","90","","1437.5","0.4","299","2","292","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3-Hydroxy-3,6-dimethyl-2-(3-methylbut-2-enylidene)-3,3a,7,7a- tetrahydrobenzofuran-4(2H)-one","","- C15 H20 O3 -","- C15 H20 O3 -","- C60 H80 O12 -","4","1","SJ2284","Jun-Zhi Wang; Kun Zou; Fang Cheng; Fei-Jun Dan","3-Hydroxy-3,6-dimethyl-2-(3-methylbut-2-enylidene)-3,3a,7,7a-tetrahydrobenzofuran-4(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2706","o2706","10.1107/S1600536807019204","","","0.71073","MoKα","","0.0739","0.0521","","","0.1099","0.1173","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213567","22.608","0.005","18.064","0.004","17.097","0.003","90","","105.54","0.03","90","","6727","3","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetrakis(benzyltriethylammonium) octamolybdate","","- C52 H88 Mo8 N4 O26 -","- C52 H88 Mo8 N4 O26 -","- C208 H352 Mo32 N16 O104 -","4","1","SJ2287","Guo, Ming-Lin; Guo, Chen-Hu; Li, Hui-Zhen; Chang, Hong","Tetrakis(benzyltriethylammonium) octamolybdate","Acta Crystallographica Section E","2007","63","5","m1456","m1457","10.1107/S1600536807018351","","","0.71073","MoKα","","0.1127","0.0818","","","0.1291","0.1406","","","","","","1.216","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213568","7.5812","0.0004","11.6107","0.0007","37.659","0.002","90","","90","","90","","3314.9","0.3","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Methyl 2-(4-methylphenylsulfonamido)-3-phenylpropanoate","","- C17 H19 N O4 S -","- C17 H19 N O4 S -","- C136 H152 N8 O32 S8 -","8","2","SJ2288","Ping Yin; Mao-Lin Hu; Jing Xiong; Xiao-Wei Yan","Methyl 2-(4-methylphenylsulfonamido)-3-phenylpropanoate","Acta Crystallographica Section E","2007","63","5","o2707","o2707","10.1107/S1600536807018600","","","0.71073","MoKα","","0.0824","0.0775","","","0.1656","0.1717","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213569","5.8253","0.0002","7.6325","0.0003","13.3374","0.0004","83.051","0.002","89.919","0.002","87.378","0.002","588.02","0.04","100","0.1","297","2","","","","","","","","4","P -1","-P 1","2","","(2E)-1-(3-bromophenyl)-3-phenylprop-2-en-1-one","","- C15 H11 Br O -","- C15 H11 Br O -","- C30 H22 Br2 O2 -","2","1","SJ2290","Mohd Mustaqim Rosli; P. S. Patil; Hoong-Kun Fun; Ibrahim Abdul Razak; S. M. Dharmaprakash","(2<i>E</i>)-1-(3-Bromophenyl)-3-phenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2501","o2501","10.1107/S1600536807018168","","","0.71073","MoKα","","0.0293","0.0259","","","0.0773","0.079","","","","","","1.172","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213570","12.9019","0.0005","7.9909","0.0003","12.5323","0.0005","90","","113.418","0.002","90","","1185.63","0.08","100","0.1","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-5-nitrobenzaldehyde phenylhydrazone","","- C13 H11 N3 O3 -","- C13 H11 N3 O3 -","- C52 H44 N12 O12 -","4","1","SJ2291","Abdassalam Abdelhafiz Tameem; Abdussalam Salhin; Bahruddin Saad; Shea-Lin Ng; Hoong-Kun Fun","2-Hydroxy-5-nitrobenzaldehyde phenylhydrazone","Acta Crystallographica Section E","2007","63","5","o2502","o2502","10.1107/S160053680701817X","","","0.71073","MoKα","","0.1148","0.0678","","","0.1307","0.1516","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213571","8.1981","0.0007","8.6292","0.0008","8.858","0.0006","62.036","0.011","86.867","0.014","61.818","0.009","476.53","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Nicotinium trifluoroacetate","Nicotinium trifluoroacetate","","- C8 H6 F3 N O4 -","- C8 H6 F3 N O4 -","- C16 H12 F6 N2 O8 -","2","1","SJ2293","S. Athimoolam; S. Natarajan","Nicotinium trifluoroacetate","Acta Crystallographica Section E","2007","63","5","o2656","o2656","10.1107/S1600536807019216","","","0.71073","MoKα","","0.1487","0.0532","","","0.0695","0.0875","","","","","","0.96","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213572","8.6745","0.0002","8.8452","0.0002","11.3132","0.0002","108.314","0.001","102.391","0.001","107.237","0.001","740.35","0.03","100","0.1","297","2","","","","","","","","3","P -1","-P 1","2","","1-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one","","- C18 H18 O4 -","- C18 H18 O4 -","- C36 H36 O8 -","2","1","SJ2294","Shea-Lin Ng; P. S. Patil; Ibrahim Abdul Razak; Hoong-Kun Fun; S. M. Dharmaprakash","1-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","5","o2503","o2503","10.1107/S1600536807018697","","","0.71073","MoKα","","0.0629","0.0495","","","0.1372","0.1571","","","","","","1.073","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213573","8.539","0.0004","10.0913","0.0005","30.3769","0.0014","90","","90","","90","","2617.6","0.2","100","0.1","297","3","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","7-Hydroxy-3,6,9-trimethyl-2,3,5,6-tetrahydronaphtho[1,8-b,c]pyran-4,8-dione","","- C15 H16 O4 -","- C15 H16 O4 -","- C120 H128 O32 -","8","2","SJ2300","Suchada Chantrapromma; Sompong Boonsri; Hoong-Kun Fun; Chatchanok Karalai","7-Hydroxy-3,6,9-trimethyl-2,3,5,6-tetrahydronaphtho[1,8-<i>b</i>,<i>c</i>]pyran-4,8-dione","Acta Crystallographica Section E","2007","63","5","o2749","o2750","10.1107/S1600536807020193","","","0.71073","MoKα","","0.0581","0.0452","","","0.1059","0.1134","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213574","12.2368","0.0007","5.0082","0.0003","14.8395","0.0009","90","","108.27","0.001","90","","863.58","0.09","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-carboxyanilinium nitrate","","- C7 H8 N2 O5 -","- C7 H8 N2 O5 -","- C28 H32 N8 O20 -","4","1","SJ2301","S. Asath Bahadur; R. Sayee Kannan; B. Sridhar","A 1:1 proton transfer compound of 2-aminobenzoic acid with nitric acid","Acta Crystallographica Section E","2007","63","5","o2722","o2723","10.1107/S160053680701999X","","","0.71073","MoKα","","0.0514","0.0495","","","0.1429","0.1456","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213575","8.259","0.003","13.084","0.004","22.228","0.007","90","","90.413","0.006","90","","2401.9","1.4","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Bis(18-crown-6)-1κ^6^O,3κ^6^O-bis(μ-1,1-dicyanoethylene-2,2-dithiolato)- 1:2κ^3^N:S,S';2:3κ^3^S,S':N-dipotassium(I)copper(II) 1,2-dichloroethane solvate","","- C34 H52 Cl2 Cu K2 N4 O12 S4 -","- C34 H52 Cl2 Cu K2 N4 O12 S4 -","- C68 H104 Cl4 Cu2 K4 N8 O24 S8 -","2","0.5","SJ2302","Shi-Zhou Fu; Da-Qi Wang; Jian-Ming Dou","Bis(18-crown-6)-1κ^6^<i>O</i>,3κ^6^<i>O</i>-bis(μ-1,1-dicyanoethylene-2,2-dithiolato)-1:2κ^3^<i>N</i>:<i>S</i>,<i>S</i>';2:3κ^3^<i>S</i>,<i>S</i>':<i>N</i>-dipotassium(I)copper(II) 1,2-dichloroethane solvate","Acta Crystallographica Section E","2007","63","5","m1522","m1522","10.1107/S1600536807020028","","","0.71073","MoKα","","0.15","0.0564","","","0.1101","0.1705","","","","","","0.999","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213576","10.7569","0.0016","11.1985","0.0017","11.2494","0.0017","96.306","0.002","91.127","0.002","91.737","0.002","1345.9","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","Tris(ethylxanthato-κ^2^S,S')(1,10-phenanthroline)bismuth(III)","tris(ethoxymethanedithioato-κ^2^S,S')(1,10-phenanthroline)bismuth(III),","","- C21 H23 Bi N2 O3 S6 -","- C21 H23 Bi N2 O3 S6 -","- C42 H46 Bi2 N4 O6 S12 -","2","1","SJ2303","Feng Li; Han-Dong Yin; Jun Zhai; Da-Qi Wang","Tris(ethylxanthato-κ^2^<i>S</i>,<i>S</i>')(1,10-phenanthroline)bismuth(III)","Acta Crystallographica Section E","2007","63","5","m1544","m1544","10.1107/S1600536807020338","","","0.71073","MoKα","","0.0831","0.0684","","","0.1767","0.191","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213577","7.1102","0.0013","11.054","0.002","27.294","0.005","90","","90","","90","","2145.2","0.7","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Cyclobuxophyllinine M","17-ethylidene-4,4,13,14-tetramethyl-3- methylaminododecahydrocyclopropa[9,10]cyclopenta[<i>a</i>]phenanthren-16-one","","- C25 H39 N O -","- C25 H39 N O -","- C100 H156 N4 O4 -","4","1","SK3099","Hai-Feng Liu; Xiao-Qing Wu; Yan-Bing Duan; Min Ji","Cyclobuxophyllinine M, an alkaloid from <i>Buxus microphylla</i>","Acta Crystallographica Section E","2007","63","5","o2194","o2195","10.1107/S160053680701495X","","","0.7107","MoKα","","0.064","0.0581","","","0.1156","0.1187","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213578","11.024","0.002","11.828","0.002","16.78","0.006","90","","113.94","0.02","90","","1999.7","0.9","298","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[diaqua(μ~2~-1,3-di-4-pyridylpropane-κ^2^N:N')(μ~2~-thiophene- 2,5-dicarboxylato-κ^2^O:O')nickel(II)]","","- C19 H20 N2 Ni O6 S -","- C19 H20 N2 Ni O6 S -","- C76 H80 N8 Ni4 O24 S4 -","4","1","SK3112","Han, Ke-Fei; Wang, Dan; Wang, Zhong-Ming","Poly[diaqua(μ~2~-1,3-di-4-pyridylpropane-κ^2^<i>N</i>:<i>N</i>')(μ~2~-thiophene-2,5-dicarboxylato-κ^2^<i>O</i>:<i>O</i>')nickel(II)]: a two-dimensional bilayered coordination polymer","Acta Crystallographica Section E","2007","63","5","m1333","m1334","10.1107/S1600536807016212","","","0.71073","MoKα","","","0.0424","","","","0.096","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213579","8.705","0.001","16.231","0.001","8.514","0.002","90","","90","","90","","1203","0.3","198","2","198","2","","","","","","","","3","P n a 21","P 2c -2n","33","1,3,5-Tricyclopropyl-1,3,5-triazinane","1,3,5-tricyclopropyl-1,3,5-triazinane","","- C12 H21 N3 -","- C12 H21 N3 -","- C48 H84 N12 -","4","1","SK3113","Poethig, Alexander; Ahrens, Sebastian; Strassner, Thomas","1,3,5-Tricyclopropyl-1,3,5-triazinane","Acta Crystallographica Section E","2007","63","5","o2398","o2399","10.1107/S1600536807015498","","","0.71073","MoKα","","0.0402","0.032","","","0.0739","0.0782","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213580","7.0433","0.0013","7.9116","0.0015","9.5767","0.0018","96.096","0.002","107.865","0.002","103.743","0.002","484.03","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis(2-aminopyridinium) diaquabis(malonato-κ^2^O,O')cuprate(II)","","- C16 H22 Cu N4 O10 -","- C16 H22 Cu N4 O10 -","- C16 H22 Cu N4 O10 -","1","0.5","SK3114","Choudhury, Somnath Ray; Bhattacharyya, Jhimli; Das, Suranjana; Dey, Biswajit; Mukhopadhyay, Subrata; Lu, Li-Ping; Zhu, Miao-Li","Bis(2-aminopyridinium) diaquabis(malonato-κ^2^<i>O</i>,<i>O</i>')cuprate(II)","Acta Crystallographica Section E","2007","63","5","m1331","m1332","10.1107/S1600536807015851","","","0.71073","MoKα","","0.0282","0.0275","","","0.074","0.0745","","","","","","1.143","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213581","9.4822","0.0001","20.6081","0.0003","6.9712","0.0001","90","","109.246","0.001","90","","1286.11","0.03","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(1R*,2R*,2'S*,4S*)-2'-methoxy-3-oxo-2'- phenylspiro(bicyclo[2.2.1]heptane-2,1'-cyclopropane)","","- C16 H18 O2 -","- C16 H18 O2 -","- C64 H72 O8 -","4","1","SU2005","Laura Torre-Fernández; Santiago García-Granda; Hugo Fanlo","(1<i>R</i><i>S</i>,2<i>R</i><i>S</i>,2'<i>S</i><i>R</i>,4<i>S</i><i>R</i>)-2'-Methoxy-2'-phenylspiro[bicyclo[2.2.1]heptane-2,1'-cyclopropan]-3-one","Acta Crystallographica Section E","2007","63","5","o2111","o2112","10.1107/S1600536807013815","","","1.54184","CuKα","","0.0465","0.043","","","0.1168","0.1201","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213582","7.8751","0.0005","9.1651","0.0003","14.1891","0.0006","90","","90","","90","","1024.11","0.09","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","E-7-(2-furyl)heptan-6-ene-2,5-dione","","- C11 H12 O3 -","- C11 H12 O3 -","- C44 H48 O12 -","4","1","SU2006","Laura Torre-Fernández; Santiago García-Granda; Hugo Fanlo","(<i>E</i>)-7-(2-Furyl)-6-heptene-2,5-dione","Acta Crystallographica Section E","2007","63","5","o2113","o2114","10.1107/S1600536807013876","","","1.54184","CuKα","","0.0468","0.0358","","","0.0967","0.1109","","","","","","1.103","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213583","6.3368","0.0002","22.8812","0.0007","7.3843","0.0002","90","","111.101","0.002","90","","998.88","0.05","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","p-Carboxyanilinium Dihydrogenmonophosphate","4-carboxyanilinium dihydrogenphosphate","","- C7 H10 N O6 P -","- C7 H10 N O6 P -","- C28 H40 N4 O24 P4 -","4","1","SU2010","Nourredine Benali-Cherif; Amani Direm; Fatima Allouche; Kawther Soudani","Hydrogen bonding in 4-carboxyanilinium dihydrogenphosphate","Acta Crystallographica Section E","2007","63","5","o2272","o2274","10.1107/S1600536807014948","","","0.71073","MoKα","","0.0551","0.0434","","","0.1129","0.1203","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213584","10.014","0.003","13.167","0.005","20.051","0.006","79.5","0.02","75.92","0.02","86.08","0.02","2520.6","1.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Pentaaqua-1κ^2^O,2κ^3^O-bis(2,2'-bipyridine)-1κ^2^N,N';2κ^2^N,N'-μ- biphenyl-2,2'-dicarboxylato-1:2κ^2^O:O'-biphenyl-2,2'-dicarboxylato-1κO- dimanganese(II) tetrahydrate","","- C48 H50 Mn2 N4 O17 -","- C48 H50 Mn2 N4 O17 -","- C96 H100 Mn4 N8 O34 -","2","1","SU2011","Du, Lin; Fang, Rui-Bing; Zhao, Qi-Hua","Pentaaqua-1κ^2^<i>O</i>,2κ^3^<i>O</i>-bis(2,2'-bipyridine)-1κ^2^<i>N</i>,<i>N</i>';2κ^2^<i>N</i>,<i>N</i>'-μ-biphenyl-2,2'-dicarboxylato-1:2κ^2^<i>O</i>:<i>O</i>'-biphenyl-2,2'-dicarboxylato-1κ<i>O</i>-dimanganese(II) tetrahydrate","Acta Crystallographica Section E","2007","63","5","m1439","m1441","10.1107/S1600536807019058","","","0.71073","MoKα","","0.168","0.0739","","","0.1614","0.2089","","","","","","0.996","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213585","9.92","0.004","6.582","0.003","9.998","0.004","90","","118.929","0.006","90","","571.3","0.4","297","2","297","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","2,3-Dimethylquinoxalinium dibromide","","- C10 H12 Br2 N2 -","- C10 H12 Br2 N2 -","- C20 H24 Br4 N4 -","2","0.5","SU2013","Al-Far, Rawhi; Ali, Basem Fares","2,3-Dimethylquinoxalinium dibromide","Acta Crystallographica Section E","2007","63","5","o2530","o2532","10.1107/S1600536807018247","","","0.71073","MoKα","","0.0838","0.0692","","","0.1852","0.191","","","","","","1.125","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213586","7.5637","0.0003","5.2527","0.0003","25.4713","0.0013","90","","97.554","0.003","90","","1003.19","0.09","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl (2E)-3-oxo-2-(pyrrolidin-2-ylidene)butanoate","","- C10 H15 N O3 -","- C10 H15 N O3 -","- C40 H60 N4 O12 -","4","1","SU2014","Fernandes, Manuel A.; Michael, Joseph P.; Perry, Christopher B.","Ethyl (2<i>E</i>)-3-oxo-2-(pyrrolidin-2-ylidene)butanoate","Acta Crystallographica Section E","2007","63","5","o2380","o2382","10.1107/S1600536807014225","","","0.71073","MoKα","","0.0973","0.0635","","","0.1589","0.1773","","","","","","1.054","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213587","13.9645","0.0011","12.1448","0.0013","16.906","0.003","90","","97.134","0.009","90","","2845","0.6","163","2","163","2","","","","","","","","6","P 1 21 1","P 2yb","4","","3',5'-Bis(tert-butyldimethylsilyl)-5-iodo-2'-deoxycytidine","","- C21 H40 I N3 O4 Si2 -","- C21 H40 I N3 O4 Si2 -","- C84 H160 I4 N12 O16 Si8 -","4","2","SU2015","Wittel, Gerda; Bats, Jan W.; Engels, Joachim W.","3',5'-Bis(<i>tert</i>-butyldimethylsilyl)-5-iodo-2'-deoxycytidine","Acta Crystallographica Section E","2007","63","5","o2657","o2659","10.1107/S1600536807014237","","","0.71073","MoKα","","0.0476","0.0337","","","0.0667","0.0717","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213588","10.2943","0.0017","10.9947","0.0018","10.4059","0.0017","90","","99.963","0.002","90","","1160","0.3","291","2","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Hydroxypyridinium 1-carboxybenzene-3-carboxylate","","- C13 H11 N O5 -","- C13 H11 N O5 -","- C52 H44 N4 O20 -","4","1","TK2142","Cong Liu; Jian-Ge Wang; Li Qu; Di Zhang; Jing-Cai Yao","3-Hydroxypyridinium 1-carboxybenzene-3-carboxylate","Acta Crystallographica Section E","2007","63","5","o2535","o2536","10.1107/S1600536807016856","","","0.71073","MoKα","","0.078","0.042","","","0.102","0.123","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213589","19.718","0.005","15.994","0.004","20.097","0.005","90","","90","","90","","6338","3","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","bis(triphenylphosphoranylidene)imminium di-μ-bromido-dibromidocuprate","","- C72 H60 Br4 Cu2 N2 P4 -","- C72 H60 Br4 Cu2 N2 P4 -","- C288 H240 Br16 Cu8 N8 P16 -","4","0.5","TK2143","Yakovenko, Andrey A.; Timofeeva, Tatiana V.; Antipin, Mikhail Yu.","Thermal disorder in the anion of bis(triphenylphosphoranylidene)iminium di-μ-bromido-bis[bromidocuprate(I)]","Acta Crystallographica Section E","2007","63","5","m1233","m1234","10.1107/S1600536807013578","","","0.71073","MoKα","","0.058","0.033","","","0.067","0.074","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213590","10.889","0.004","11.607","0.004","24.306","0.01","90","","102.477","0.014","90","","2999","2","110","","110","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","fac-tricarbonylchloridobis[3-(4-pyridyl)pentane-2,4-dione-κ<i>N</i>]rhenium(I) chloroform solvate","","- C24 H23 Cl4 N2 O7 Re -","- C24 H23 Cl4 N2 O7 Re -","- C96 H92 Cl16 N8 O28 Re4 -","4","1","TK2147","Kakoullis Jr, James; Maverick, Andrew W.; Fronczek, Frank R.","A molecular corner: <i>fac</i>-tricarbonylchloridobis[3-(4-pyridyl)pentane-2,4-dione-κ<i>N</i>]rhenium(I) chloroform solvate","Acta Crystallographica Section E","2007","63","5","m1360","m1361","10.1107/S1600536807016996","","","0.71073","MoKα","","0.093","0.058","","","0.137","0.151","","","","","","1.373","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213591","23.352","0.006","15.085","0.014","10.952","0.009","90","","90","","90","","3858","5","296","","296","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-Methoxy-4a-nitro-9-(phenylsulfonyl)-4,4a,9,9a-tetrahydro-1H-carbazol-2(3H)-one","","- C19 H18 N2 O6 S -","- C19 H18 N2 O6 S -","- C152 H144 N16 O48 S8 -","8","1","TK2148","Kishbaugh, T. L. S.; Gribble, Gordon W.; Jasinski, Jerry P.","4-Methoxy-4a-nitro-9-(phenylsulfonyl)-4,4a,9,9a-tetrahydro-1<i>H</i>-carbazol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2470","o2471","10.1107/S1600536807017448","","","0.71069","MoKα","","0.34","0.055","","","0.129","0.255","","","","","","0.93","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213592","18.469","0.009","8.392","0.006","19.24","0.012","90","","93.58","0.04","90","","2976","3","296","","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","9-(Phenylsulfonyl)-9H-carbazol-2-ol","","- C18 H13 N O3 S -","- C18 H13 N O3 S -","- C144 H104 N8 O24 S8 -","8","1","TK2149","Kishbaugh, T. L. S.; Gribble, Gordon W.; Jasinski, Jerry P.","9-(Phenylsulfonyl)-9<i>H</i>-carbazol-2-ol","Acta Crystallographica Section E","2007","63","5","o2472","o2473","10.1107/S160053680701745X","","","0.71069","MoKα","","0.208","0.056","","","0.149","0.191","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213593","10.7467","0.0016","14.308","0.002","16.102","0.002","90","","108.785","0.003","90","","2344","0.6","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[1,2-Bis(2-pyridylcarboxamido)-4,5- dichlorobenzene(2-)]chlorido(dimethylformamide)manganese(III)","","- C21 H17 Cl3 Mn N5 O3 -","- C21 H17 Cl3 Mn N5 O3 -","- C84 H68 Cl12 Mn4 N20 O12 -","4","1","TK2151","Lei Liang; Yan-Yang Qu; Li Yang; Xiang-Ge Zhou","Chlorido[4,5-dichloro-1,2-bis(2-pyridylcarboxamido)benzene(2‒)](dimethylformamide)manganese(III)","Acta Crystallographica Section E","2007","63","5","m1503","m1505","10.1107/S1600536807019411","","","0.71073","MoKα","","0.089","0.044","","","0.098","0.118","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213594","14.4455","0.0004","12.7392","0.0005","15.2816","0.0004","90","","108.439","0.002","90","","2667.81","0.15","150","1","150","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(η^5^-Cyclopentadienyl)(2-naphthylethynyl)(triphenylphosphine-κP)nickel(II)","","- C35 H27 Ni P -","- C35 H27 Ni P -","- C140 H108 Ni4 P4 -","4","1","TK2154","Butler, Peter; Gallagher, John F.; Lough, Alan J.; Manning, A. R.","(η^5^-Cyclopentadienyl)(2-naphthylethynyl)(triphenylphosphine-κ<i>P</i>)nickel(II)","Acta Crystallographica Section E","2007","63","5","m1415","m1415","10.1107/S1600536807016832","","","0.71073","MolybdenumKα","","0.1217","0.0482","","","0.096","0.1204","","","","","","0.984","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213595","7.5879","0.0002","9.1041","0.0002","9.9342","0.0002","90","","109.228","0.001","90","","647.98","0.03","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Strontium lanthanum pentamolybdenum octaoxide","","- La0.56 Mo5 O8 Sr0.44 -","- La0.561 Mo5 O8 Sr0.439 -","- La2.244 Mo20 O32 Sr1.756 -","4","1","WM2100","Gougeon, P.; Gall, P.; McCarroll, W. H.","The metallic compound Sr~0.44~La~0.56~Mo~5~O~8~","Acta Crystallographica Section E","2007","63","5","i119","i121","10.1107/S1600536807014651","","","0.71069","MoKα","","0.0546","0.0351","","","0.0694","0.0765","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213596","10.2822","0.0004","8.9006","0.0003","10.9848","0.0004","90","","106.284","0.002","90","","964.98","0.06","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","potassium dysprosium polyphosphate","potassium dysprosium polyphosphate","","- Dy K O12 P4 -","- Dy K O12 P4 -","- Dy4 K4 O48 P16 -","4","1","WM2101","Chehimi-Moumen, Fathia; Férid, Mokhtar","The type IV polymorph of KDy(PO~3~)~4~","Acta Crystallographica Section E","2007","63","5","i129","i130","10.1107/S1600536807016376","","","0.71073","MoKα","","0.0307","0.0266","","","0.0581","0.0594","","","","","","1.105","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213597","5.9787","0.0003","5.9787","0.0003","24.796","0.003","90","","90","","120","","767.58","0.11","150","2","150","2","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Pentabarium ditantalum dichloride nonaoxide","","- Ba5 Cl2 O9 Ta2 -","- Ba5 Cl2 O9 Ta2 -","- Ba10 Cl4 O18 Ta4 -","2","0.0833333","WM2105","Barnes, Andrew D. J.; Francesconi, M. Grazia; Prior, Timothy J.","A synchrotron study of Ba~5~Ta~2~Cl~2~O~9~","Acta Crystallographica Section E","2007","63","5","i127","i128","10.1107/S1600536807016790","","","0.7848","synchrotron","","0.0385","0.0354","","","0.0866","0.0883","","","","","","1.118","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213598","5.2456","0.0004","9.0361","0.0007","9.9312","0.0008","90","","90","","90","","470.74","0.06","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","yttrium orthotellurate","Diyttrium(III) hexaoxotellurate(VI)","","- O6 Te Y2 -","- O6 Te Y2 -","- O24 Te4 Y8 -","4","1","WM2106","Höss, Patrick; Schleid, Thomas","Y~2~TeO~6~ with the La~2~TeO~6~-type structure","Acta Crystallographica Section E","2007","63","5","i133","i135","10.1107/S1600536807018922","","","0.71069","MoKα","","0.0197","0.0194","","","0.0451","0.0453","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213599","6.9666","0.0003","10.6786","0.0007","24.0792","0.0014","90","","95.215","0.004","90","","1783.92","0.17","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","resodiacetophenone","2,4-Diacetylbenzene-1,3-diol","","- C10 H10 O4 -","- C10 H10 O4 -","- C80 H80 O32 -","8","2","WN2118","Aazam, Elham S.","2,4-Diacetylbenzene-1,3-diol","Acta Crystallographica Section E","2007","63","5","o2751","o2752","10.1107/S1600536807016236","","","0.71073","MoKα","","0.1253","0.0643","","","0.1231","0.1486","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","201974","2020-10-21","18:00:00",""
"2213600","9.161","0.002","11.307","0.001","16.318","0.001","80.05","0.02","79.84","0.02","68.49","0.02","1537.1","0.4","295","","295","","","","","","","","","6","P -1","-P 1","2","","(1-2-hydroxyethyl-5-methylpyrazol-3-yl)ferrocenium chloride‒(1-2-hydroxyethyl-5-methylpyrazol-3-yl)ferrocene (1/1)","","- C32 H36 Cl Fe2 N4 O2 -","- C32 H36 Cl Fe2 N4 O2 -","- C64 H72 Cl2 Fe4 N8 O4 -","2","1","WN2124","Shi, Yao-Cheng; Zhu, Bei-Bei; Ng, Seik Weng","[1-(2-Hydroxyethyl)-5-methylpyrazol-3-yl]ferrocenium chloride and [1-(2-hydroxyethyl)-5-methylpyrazol-3-yl]ferrocene cocrystal","Acta Crystallographica Section E","2007","63","5","m1385","m1387","10.1107/S160053680701687X","","","0.71073","MoKα","","0.103","0.068","","","0.165","0.1893","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213601","11.3964","0.0008","7.9","0.001","12.7887","0.0006","90","","94.747","0.005","90","","1147.44","0.17","295","2","","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","1,4-Di-9-anthrylbutane","","- C32 H26 -","- C32 H26 -","- C64 H52 -","2","0.5","WN2126","Arslan, Mustafa; Asker, Erol; Masnovi, John; Baker, Ronald J.","1,4-Di-9-anthrylbutane","Acta Crystallographica Section E","2007","63","5","o2400","o2402","10.1107/S1600536807015796","","","0.71073","MoKα","","0.0678","0.0404","","","0.0907","0.1039","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213602","10.7164","0.0001","8.134","0.0002","17.4336","0.0004","90","","90","","90","","1519.64","0.05","90","0.2","90","0.2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-Bromo-2-chloro-1-methoxy-benzene","","- C7 H6 Br Cl O -","- C7 H6 Br Cl O -","- C56 H48 Br8 Cl8 O8 -","8","1","WN2130","Song, Yang; Parkin, Sean; Lehmler, Hans-Joachim","4-Bromo-2-chloro-1-methoxybenzene","Acta Crystallographica Section E","2007","63","5","o2091","o2092","10.1107/S1600536807013372","","","0.71073","MoKα","","0.0285","0.0186","","","0.0392","0.0408","","","","","","0.956","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213603","9.5277","0.0005","9.8517","0.0005","23.5217","0.0014","90","","90","","90","","2207.8","0.2","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Benzyl 4,6-diacetyl-2-<i>O</i>-benzoyl-β-D-glucopyranoside","","- C24 H26 O9 -","- C24 H26 O9 -","- C96 H104 O36 -","4","1","WN2133","Gervaise, Cédric; Daniellou, Richard; Roisnel, Thierry; Nugier-Chauvin, Caroline; Ferrières, Vincent","Benzyl 4,6-di-<i>O</i>-acetyl-2-<i>O</i>-benzoyl-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section E","2007","63","5","o2286","o2288","10.1107/S1600536807015255","","","0.71073","MoKα","","0.0378","0.037","","","0.0894","0.09","","","","","","1.097","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213604","4.5828","0.0015","8.825","0.003","15.888","0.005","90","","90.77","0.007","90","","642.5","0.4","293.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Hydroxybenzamide","","- C7 H7 N O2 -","- C7 H7 N O2 -","- C28 H28 N4 O8 -","4","1","WN2135","Hansen, Lars Kr.; Perlovich, German L.; Bauer-Brandl, Annette","4-Hydroxybenzamide","Acta Crystallographica Section E","2007","63","5","o2362","o2362","10.1107/S160053680701793X","","","0.7107","MoKα","","","0.0468","","","","0.0441","","","","","","5.41","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213605","12.1859","0.0006","6.6703","0.0003","14.1899","0.0007","90","","113.469","0.002","90","","1057.99","0.09","160","1","160","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","9H-carbazole","1-Hydroxy-3-methyl-9H-carbazole-2-carbaldehyde","","- C14 H11 N O2 -","- C14 H11 N O2 -","- C56 H44 N4 O8 -","4","1","WN2137","A. Thomas Gunaseelan; A. Thiruvalluvar; A. Ebenezer Martin; K. J. Rajendra Prasad","1-Hydroxy-3-methyl-9<i>H</i>-carbazole-2-carbaldehyde","Acta Crystallographica Section E","2007","63","5","o2682","o2683","10.1107/S160053680701954X","","","0.71073","MoKα","","0.0789","0.0533","","","0.131","0.1476","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213606","6.9535","0.0009","12.9078","0.0017","19.8","0.003","90","","90","","90","","1777.1","0.4","273","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1,5-Dimethyl-4-[2-(methylsulfanyl)benzylideneamino]-2-phenyl-1H- pyrazol-3(2H)-one","","- C19 H19 N3 O S -","- C19 H19 N3 O S -","- C76 H76 N12 O4 S4 -","4","1","WW2056","Yan, Guo-Bing; Zhang, Chu-Niu; Yang, Ming-Hua","1,5-Dimethyl-4-[2-(methylsulfanyl)benzylideneamino]-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2663","o2664","10.1107/S1600536807007453","","","0.71073","MoKα","","0.0728","0.0404","","","0.106","0.1112","","","","","","0.908","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213607","12.8522","0.0007","8.3689","0.0005","19.6835","0.0011","90","","106.676","0.001","90","","2028.1","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Diethyl 4,4'-(butane-1,4-diyldioxy)dibenzoate","","- C22 H26 O6 -","- C22 H26 O6 -","- C88 H104 O24 -","4","1","XU2217","Li-Mei Hou; Yu-He Kan","Diethyl 4,4'-(butane-1,4-diyldioxy)dibenzoate","Acta Crystallographica Section E","2007","63","5","o2157","o2158","10.1107/S1600536807014304","","","0.71073","MoKα","","0.099","0.046","","","0.095","0.111","","","","","","0.835","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213608","13.557","0.001","15.284","0.001","33.413","0.003","90","","90","","90","","6923.3","0.9","295","2","295","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","catena-Poly[[silver(I)-μ-1,2-di-4-pyridylethane-κ^2^N:N'] hemifumarate 4.5-hydrate]","","- C28 H44 Ag2 N4 O13 -","- C28 H44 Ag2 N4 O13 -","- C224 H352 Ag16 N32 O104 -","8","0.25","XU2221","Yan, Guo-Bing; Ng, Seik Weng","<i>catena</i>-Poly[bis[silver(I)-μ-1,2-di-4-pyridylethane-κ^2^<i>N</i>:<i>N</i>'] fumarate nonahydrate]","Acta Crystallographica Section E","2007","63","5","m1368","m1369","10.1107/S1600536807017187","","","0.71073","MoKα","","0.05","0.035","","","0.097","0.107","","","","","","1.11","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213609","9.4149","0.0003","14.646","0.0008","14.6985","0.0011","90","","91.005","0.005","90","","2026.5","0.2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Poly[[tetraaquadi-μ~5~-fumarato-μ~4~-fumarato-diholmium(III)] trihydrate]","","- C12 H20 Ho2 O19 -","- C12 H20 Ho2 O19 -","- C48 H80 Ho8 O76 -","4","1","XU2222","Rahahlia, N.; Aliouane, K.; Guehria-Laidoudi, A.; Dahaoui, S.; Lecomte, C.","Poly[[tetraaquadi-μ~5~-fumarato-μ~4~-fumarato-diholmium(III)] trihydrate]","Acta Crystallographica Section E","2007","63","5","m1266","m1268","10.1107/S1600536807016479","","","0.71073","MoKα","","0.032","0.025","","","0.071","0.075","","","","","","1.337","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213610","13.632","0.006","9.587","0.004","10.24","0.005","90","","108.349","0.006","90","","1270.2","1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Isopropyl 2-oxo-3,4-dihydro-1,4-benzoxazine-4-acetate","","- C13 H15 N O4 -","- C13 H15 N O4 -","- C52 H60 N4 O16 -","4","1","XU2224","Hong-Gang Li; Jian-Min Dou; Da-Cheng Li; Da-Qi Wang","Isopropyl 2-oxo-3,4-dihydro-1,4-benzoxazine-4-acetate","Acta Crystallographica Section E","2007","63","5","o2542","o2543","10.1107/S1600536807016935","","","0.71073","MoKα","","0.125","0.057","","","0.171","0.274","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213611","8.1979","0.0002","10.0888","0.0002","10.2559","0.0003","76.465","0.002","88.984","0.003","77.442","0.003","804.46","0.04","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis[4-(dimethylamino)benzoato-κO](nicotinamide-κN^1^)manganese(II) dihydrate","","- C30 H40 Mn N6 O10 -","- C30 H40 Mn N6 O10 -","- C30 H40 Mn N6 O10 -","1","0.5","XU2226","Hökelek, Tuncer; Necefoğlu, Hacali","Diaquabis[4-(dimethylamino)benzoato-κ<i>O</i>](nicotinamide-κ<i>N</i>^1^)manganese(II) dihydrate","Acta Crystallographica Section E","2007","63","5","m1279","m1281","10.1107/S1600536807016029","","","1.54184","CuKα","","0.087","0.072","","","0.177","0.19","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213612","3.754","0.0008","20.152","0.004","13.791","0.003","90","","95.362","0.004","90","","1038.7","0.4","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Phenylimidazolium nitrate hemihydrate","","- C9 H10 N3 O3.5 -","- C9 H10 N3 O3.5 -","- C36 H40 N12 O14 -","4","1","XU2228","Lai-Ping Zhang; Jian-Fang Ma; Guang-Ju Ping","2-Phenylimidazolium nitrate hemihydrate","Acta Crystallographica Section E","2007","63","5","o2438","o2439","10.1107/S1600536807017084","","","0.71069","MoKα","","0.094","0.058","","","0.155","0.182","","","","","","1.014","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213613","8.2974","0.0007","13.1968","0.0011","23.3855","0.0015","90","","90","","90","","2560.7","0.3","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","9α,11-Epoxy-7α-(methoxycarbonyl)-3-oxo-17α-pregn-4-ene-21,17-carbolactone","","- C28 H38 O7 -","- C28 H30 O7 -","- C112 H120 O28 -","4","1","XU2229","Qian Yang; Wei-Dong Ye; Jian-Yong Yuan; Jing-Jing Nie","Eplerenone tetrahydrofuran solvate","Acta Crystallographica Section E","2007","63","5","o2068","o2070","10.1107/S1600536807014031","","","0.71073","MoKα","","0.108","0.07","","","0.187","0.229","","","","","","1.068","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213614","7.887","0.0017","10.473","0.0019","11.753","0.002","107.846","0.003","105.757","0.003","99.499","0.002","856.1","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis[μ-l-pyruvic acid (4-chlorobenzoyl)hydrazonato(2-)]bis[ethanoldimethyltin(IV)]","","- C28 H38 Cl2 N4 O8 Sn2 -","- C28 H38 Cl2 N4 O8 Sn2 -","- C28 H38 Cl2 N4 O8 Sn2 -","1","0.5","XU2230","Ji-Chun Cui; Han-Dong Yin; Yan-Ling Qiao","Bis[μ-1-pyruvic acid (4-chlorobenzoyl)hydrazonato(2{-})]bis[ethanoldimethyltin(IV)]","Acta Crystallographica Section E","2007","63","5","m1358","m1359","10.1107/S160053680701728X","","","0.71073","MoKα","","0.072","0.045","","","0.083","0.093","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213615","11.7446","0.0002","12.441","0.0002","14.733","0.0002","66.381","0.001","76.477","0.001","87.506","0.001","1914.65","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Aqua(3,5-dinitrosalicylato-κO)bis(1,10-phenanthroline-κ^2^N,N')manganese(II) 3,5-dinitrosalicylate","","- C38 H24 Mn N8 O15 -","- C38 H24 Mn N8 O15 -","- C76 H48 Mn2 N16 O30 -","2","1","XU2231","Song, Wen-Dong; Yan, Jian-Bin; Guo, Xian-Xia; Ng, Seik Weng","Aqua(3,5-dinitrosalicylato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II) 3,5-dinitrosalicylate","Acta Crystallographica Section E","2007","63","5","m1307","m1308","10.1107/S160053680701714X","","","0.71073","MoKα","","0.086","0.047","","","0.12","0.143","","","","","","1.043","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213616","7.1378","0.0012","7.4914","0.0014","14.995","0.0019","76.191","0.009","79.469","0.007","83.606","0.006","763.6","0.2","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","(E)-4-Methylbenzaldehyde 2,4,6-trinitrophenylhydrazone","","- C14 H11 N5 O6 -","- C14 H11 N5 O6 -","- C28 H22 N10 O12 -","2","1","XU2232","Gen-Rong Qiang; Zheng Fan; Shang Shan; Yu-Liang Tian; Xu-Chun Fu","(<i>E</i>)-4-Methylbenzaldehyde 2,4,6-trinitrophenylhydrazone","Acta Crystallographica Section E","2007","63","5","o2246","o2248","10.1107/S1600536807014511","","","0.71069","MoKα","","0.098","0.066","","","0.216","0.245","","","","","","1.112","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213617","10.073","0.005","15.594","0.008","17.669","0.009","90","","90","","90","","2775","2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-[3-(1H-Imidazol-1-yl)propyl]-3-phenyl-1H-1,2,4-triazol-5(4H)-one","","- C14 H15 N5 O -","- C14 H15 N5 O -","- C112 H120 N40 O8 -","8","2","XU2235","Kalkan, Hüseyin; Ustabaş, Reşat; Sancak, Kemal; Ünver, Yasemin; Vázquez-López, Ezequiel M.","4-[3-(1<i>H</i>-Imidazol-1-yl)propyl]-3-phenyl-1<i>H</i>-1,2,4-triazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","5","o2449","o2451","10.1107/S1600536807017321","","","0.71073","MoKα","","0.071","0.047","","","0.096","0.105","","","","","","1.004","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213618","7.241","0.001","9.236","0.0014","11.776","0.0019","80.97","0.02","89.382","0.01","74.66","0.03","749.7","0.2","298","2","","","","","","","","","","4","P -1","-P 1","2","","5,5'-Dithiobis(1-phenyl-1H-tetrazole)","","- C14 H10 N8 S2 -","- C14 H10 N8 S2 -","- C28 H20 N16 S4 -","2","1","XU2237","Brito, Iván; Cárdenas, Alejandro; Mundaca, Aldo; Villalobos, Hada; López-Rodríguez, Matías","5,5'-Dithiobis(1-phenyl-1<i>H</i>-tetrazole)","Acta Crystallographica Section E","2007","63","5","o2581","o2583","10.1107/S1600536807017291","","","0.71073","MoKα","","","0.054","","","","0.149","","","","","","1.111","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213619","13.678","0.002","16.164","0.003","12.396","0.002","90","","93.788","0.002","90","","2734.7","0.8","187","2","187","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","meso-Tetrakis(4-pentyloxyphenyl)porphyrinato]silver(II)","","- C64 H68 Ag N4 O4 -","- C64 H68 Ag N4 O4 -","- C128 H136 Ag2 N8 O8 -","2","0.5","XU2238","Xu, Yong-Jun; Yang, Xiao-Xi; Cao, Hua; Zhao, Hong-Bin","[<i>meso</i>-Tetrakis(4-pentyloxyphenyl)porphyrinato]silver(II)","Acta Crystallographica Section E","2007","63","5","m1437","m1437","10.1107/S1600536807018399","","","0.71073","MoKα","","0.03","0.027","","","0.073","0.075","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213620","10.821","0.0017","17.799","0.002","14.187","0.003","90","","100.166","0.005","90","","2689.6","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis(2,2'-bipyridine N-oxide-κ^2^N,O)hexacosaoxocopper(II)molybdenum(IV)","","- C40 H32 Cu2 Mo8 N8 O30 -","- C40 H32 Cu2 Mo8 N8 O30 -","- C80 H64 Cu4 Mo16 N16 O60 -","2","0.5","XU2239","Ji-Hong Yuan; Cheng Wang; Zhi-Yao Sun","Bis(2,2'-bipyridine <i>N</i>-oxide-κ^2^<i>O</i>,<i>N</i>)copper(II) β-octamolybdate","Acta Crystallographica Section E","2007","63","5","m1399","m1399","10.1107/S1600536807018363","","","0.71069","MoKα","","0.08","0.05","","","0.109","0.123","","","","","","0.952","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213621","7.2025","0.0005","7.8494","0.0004","11.1564","0.0008","81.463","0.005","80.539","0.006","74.005","0.005","594.52","0.07","297","","297","","","","","","","","","5","P -1","-P 1","2","","Phenazinium perchlorate","","- C12 H9 Cl N2 O4 -","- C12 H9 Cl N2 O4 -","- C24 H18 Cl2 N4 O8 -","2","1","XU2240","Sieroń, Lesław","Phenazinium perchlorate","Acta Crystallographica Section E","2007","63","5","o2508","o2508","10.1107/S160053680701759X","","","0.71073","MoKα","","0.037","0.034","","","0.098","0.101","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213622","8.524","0.005","13.069","0.007","10.013","0.006","90","","104.037","0.007","90","","1082.1","1.1","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Amantadinium azide","","- C10 H18 N4 -","- C10 H18 N4 -","- C40 H72 N16 -","4","1","XU2241","Qiang Wang; Wan-Long Pan; Wang Tang; Chang-Wen Hu","Amantadinium azide","Acta Crystallographica Section E","2007","63","5","o2688","o2688","10.1107/S1600536807019630","","","0.71073","MoKα","","0.089","0.051","","","0.117","0.152","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213623","12.969","0.007","12.969","0.007","20.7","0.02","90","","90","","120","","3015","4","298","2","298","2","","","","","","","","4","P 32 2 1","P 32 2""","154","","1,3,5-Tris(5-iodothiophen-2-yl)benzene","","- C18 H9 I3 S3 -","- C18 H9 I3 S3 -","- C108 H54 I18 S18 -","6","1","XU2243","Zhu, Chen-Hao; Li, Wei-Jie; Kong, Lin","1,3,5-Tris(5-iodothiophen-2-yl)benzene","Acta Crystallographica Section E","2007","63","5","o2761","o2761","10.1107/S1600536807020004","","","0.71073","MoKα","","0.076","0.054","","","0.119","0.129","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213624","8.616","0.0014","13.093","0.002","9.2584","0.0015","90","","112.499","0.002","90","","964.9","0.3","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","6β-angeloyloxy-3β,8β-dihydroxyeremophil-7(11)-en-12,8α-olide","","- C20 H28 O6 -","- C20 H28 O6 -","- C40 H56 O12 -","2","1","XU2247","Wu, Bing; Zhang, Hong-Jun; Qiu, Feng; Chen, Min-Qin; Lin, Hou-Wen","6β-Angeloyloxy-3β,8β-dihydroxyeremophil-7(11)-en-12,8α-olide","Acta Crystallographica Section E","2007","63","5","o2755","o2756","10.1107/S1600536807019897","","","0.71073","MoKα","","0.04","0.035","","","0.09","0.094","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213625","9.4711","0.0014","13.1959","0.0016","17.773","0.004","90","","90","","90","","2221.3","0.7","295","2","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-(4-Nitrophenyl)pyrrolidine-2-carboxamide","","- C11 H13 N3 O3 -","- C11 H13 N3 O3 -","- C88 H104 N24 O24 -","8","1","YA2040","Liu, Wei; Guo, Yan-Ling; Han, Cong; Cheng, Shao-Ling","1-(4-Nitrophenyl)pyrrolidine-2-carboxamide","Acta Crystallographica Section E","2007","63","5","o2778","o2779","10.1107/S1600536807020120","","","0.71073","MoKα","","0.092","0.048","","","0.091","0.123","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213626","7.5815","0.0005","12.6485","0.0009","11.412","0.0008","90","","102.537","0.001","90","","1068.26","0.13","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Hydroxyethoxyethyl-trimethylammonium iodide","","- C7 H18 I N O2 -","- C7 H18 I N O2 -","- C28 H72 I4 N4 O8 -","4","1","YA2045","Zhang, Lingzhi; Bikzhanova, Galina A.; West, Robert","[2-(Hydroxyethoxy)ethyl]trimethylammonium iodide","Acta Crystallographica Section E","2007","63","5","o2284","o2285","10.1107/S1600536807014377","","","0.71073","Mo-Kα","","0.015","0.014","","","0.037","0.037","","","","","","1.13","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213627","6.442","0.0007","7.0072","0.0008","9.7713","0.0011","105.519","0.001","97.098","0.001","96.589","0.001","416.67","0.08","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[aqua(1-methyl-1H-1,2,3,4-tetrazole-5-thiolato-κS)sodium]di- μ-aqua-κ^4^O:O]","","- C2 H9 N4 Na O3 S -","- C2 H9 N4 Na O3 S -","- C4 H18 N8 Na2 O6 S2 -","2","1","YA2046","Xiu-Hang Wang; Man-Cheng Hu; Zhang-Qin Yang","<i>catena</i>-Poly[[aqua(1-methyl-1<i>H</i>-1,2,3,4-tetrazole-5-thiolato-κ<i>S</i>)sodium]-di-μ-aqua-κ^4^<i>O</i>:<i>O</i>]","Acta Crystallographica Section E","2007","63","5","m1527","m1529","10.1107/S1600536807014419","","","0.71073","MoKα","","0.028","0.027","","","0.072","0.072","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213628","8.609","0.001","9.959","0.002","11.144","0.002","90","","93.79","0.03","90","","953.4","0.3","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(morpholinium-4-yl)ethanesulfonate monohydrate","","- C6 H15 N O5 S -","- C6 H15 N O5 S -","- C24 H60 N4 O20 S4 -","4","1","YA2048","Kubicki, Maciej; Adamiak, Dorota A.; Rypniewski, Wojciech R.; Olejniczak, Agnieszka","A synchrotron redetermination of 2-(morpholinium-4-yl)ethanesulfonate monohydrate, including a disordered water molecule","Acta Crystallographica Section E","2007","63","5","o2604","o2606","10.1107/S1600536807018685","","","0.8156","synchrotron","","0.05","0.045","","","0.122","0.127","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213629","7.1194","0.0005","8.7236","0.0004","9.7519","0.0011","83.838","0.008","88.921","0.008","74.015","0.006","578.84","0.08","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Methyl 2-(2-hydroxy-1,3-dioxoinden-2-yl)acrylate","","- C13 H10 O5 -","- C13 H10 O5 -","- C26 H20 O10 -","2","1","ZL2004","M. NizamMohideen; S. Thenmozhi; A. Subbiahpandi; E. Ramesh; R. Raghunathan","Methyl 2-(2-hydroxy-1,3-dioxoinden-2-yl)acrylate","Acta Crystallographica Section E","2007","63","5","o2747","o2748","10.1107/S1600536807019939","","","1.5418","CuKα","","0.0425","0.0405","","","0.1119","0.1142","","","","","","1.075","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213630","19.384","0.003","11.788","0.005","15.447","0.003","90","","111.23","0.018","90","","3290.1","1.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Hexakis(3,4-dichlorobenzylammonium) cyclohexaphosphate hexahydrate","","- C42 H60 Cl12 N6 O24 P6 -","- C42 H60 Cl12 N6 O24 P6 -","- C84 H120 Cl24 N12 O48 P12 -","2","0.5","ZL2005","Khedhiri, Lamia; Bel Haj Salah Raoudha; Belam, Wahid; Rzaigui, Mohamed","Hexakis(3,4-dichlorobenzylammonium) cyclohexaphosphate hexahydrate","Acta Crystallographica Section E","2007","63","5","o2269","o2271","10.1107/S1600536807012597","","","0.71073","MoKα","","0.0789","0.046","","","0.1092","0.1221","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213631","7.7228","0.0002","9.0264","0.0002","18.071","0.0004","96.427","0.001","94.887","0.001","102.763","0.001","1212.99","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis(4-chlorobenzoato-κO)(1,10-phenanthroline-κ^2^N,N')cobalt(II)","","- C26 H20 Cl2 Co N2 O6 -","- C26 H20 Cl2 Co N2 O6 -","- C52 H40 Cl4 Co2 N4 O12 -","2","1","ZL2010","Yu-Lan Ren; Yu-Jing Liu; Wen-Dong Song","Diaquabis(4-chlorobenzoato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)","Acta Crystallographica Section E","2007","63","5","m1191","m1193","10.1107/S1600536807013438","","","0.71073","MoKα","","0.0547","0.0416","","","0.107","0.1196","","","","","","1.069","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213632","3.8668","0.0002","27.909","0.0011","7.0885","0.0003","90","","94.319","0.002","90","","762.81","0.06","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-Hydroxy-3-methoxybenzoic acid","","- C8 H8 O4 -","- C8 H8 O4 -","- C32 H32 O16 -","4","1","ZL2011","Zhi-Hui Liu; Yong-Cai Qiu; Ying-Hua Li; Rong-Hua Zeng; Hong Deng","2-Hydroxy-3-methoxybenzoic acid","Acta Crystallographica Section E","2007","63","5","o2616","o2617","10.1107/S1600536807018739","","","0.71073","MoKα","","0.0495","0.0383","","","0.1071","0.1164","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213633","9.2603","0.0013","9.2321","0.0013","28.902","0.004","90","","96.798","0.002","90","","2453.5","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichloridobis[3-(1H-imidazol-1-yl)-1-phenylpropan-1-one-κN^3^]cadmium(II)","","- C24 H24 Cd Cl2 N4 O2 -","- C24 H24 Cd Cl2 N4 O2 -","- C96 H96 Cd4 Cl8 N16 O8 -","4","1","ZL2012","Guo, Jian-Hua; Cai, Hua","Dichloridobis[3-(1<i>H</i>-imidazol-1-yl)-1-phenylpropan-1-one-κ<i>N</i>^3^]cadmium(II)","Acta Crystallographica Section E","2007","63","5","m1322","m1324","10.1107/S1600536807016042","","","0.71073","MoKα","","0.0382","0.0276","","","0.0532","0.056","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213634","9.7468","0.0001","10.3997","0.0001","12.3424","0.0001","106.862","0.001","99.363","0.001","96.84","0.001","1162.87","0.02","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(μ-4-chlorobenzoato)bis[(4-chlorobenzoato)bis(1H-imidazole- κN^3^)cadmium(II)] dihydrate","","- C40 H36 Cd2 Cl4 N8 O10 -","- C40 H36 Cd2 Cl4 N8 O10 -","- C40 H36 Cd2 Cl4 N8 O10 -","1","0.5","ZL2013","Xian-Xia Guo; Jian-Bin Yan; Wen-Dong Song","Bis(μ-4-chlorobenzoato)bis[(4-chlorobenzoato)bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)cadmium(II)] dihydrate","Acta Crystallographica Section E","2007","63","5","m1305","m1306","10.1107/S1600536807016224","","","0.71073","MoKα","","0.0439","0.0338","","","0.0735","0.079","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213635","18.3462","0.0014","10.2347","0.0005","12.3661","0.0009","90","","99.049","0.003","90","","2293.1","0.3","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","<i>trans</i>-4-<i>tert</i>-Butyl-1-methylcyclohexanol hemihydrate","","- C11 H23 O1.5 -","- C11 H23 O1.5 -","- C88 H184 O12 -","8","2","ZL2014","Valkonen, Arto; Kauppinen, Reijo; Kolehmainen, Erkki","<i>trans</i>-4-<i>tert</i>-Butyl-1-methylcyclohexanol hemihydrate","Acta Crystallographica Section E","2007","63","5","o2461","o2461","10.1107/S1600536807016650","","","0.71073","MoKα","","0.1158","0.0737","","","0.1312","0.1458","","","","","","1.161","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213636","21.116","0.004","5.1836","0.0009","19.781","0.003","90","","103.44","0.003","90","","2105.9","0.6","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","6-Dichloromethyl-3-propyl-1,2,4-triazolo[3,4-b][1,3,4]thiadiazole","","- C7 H8 Cl2 N4 S -","- C7 H8 Cl2 N4 S -","- C56 H64 Cl16 N32 S8 -","8","1","ZL2015","Min Yu; Kang Zhang; Ke-De Qian; Li-Xue Zhang; Yu-Zhen Liu","6-Dichloromethyl-3-propyl-1,2,4-triazolo[3,4-<i>b</i>][1,3,4]thiadiazole","Acta Crystallographica Section E","2007","63","5","o2551","o2551","10.1107/S1600536807017400","","","0.71073","MoKα","","0.0444","0.0394","","","0.0983","0.1012","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213637","6.188","0.004","10.25","0.007","21.268","0.014","90","","90","","90","","1349","1.5","113","2","113","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","1-(3-Bromophenyl)-3-pivaloylthiourea","1-(3-Bromophenyl)-3-pivaloylthiourea","","- C12 H15 Br N2 O S -","- C12 H15 Br N2 O S -","- C48 H60 Br4 N8 O4 S4 -","4","1","ZL2018","Sultana, Sarwat; Khawar Rauf, M.; Ebihara, Masahiro; Badshah, Amin","1-(3-Bromophenyl)-3-pivaloylthiourea","Acta Crystallographica Section E","2007","63","5","o2602","o2602","10.1107/S1600536807019071","","","0.7107","MoKα","","0.0445","0.0415","","","0.0806","0.0818","","","","","","1.208","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213638","3.769","0.001","13.4","0.001","14.041","0.001","90","","93.78","0.01","90","","707.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,5-difluorobenzoic acid","","- C7 H4 F2 O2 -","- C7 H4 F2 O2 -","- C28 H16 F8 O8 -","4","1","ZL2019","Wojciech Potrzebowski; Maksymilian Chruszcz","3,5-Difluorobenzoic acid","Acta Crystallographica Section E","2007","63","5","o2754","o2754","10.1107/S1600536807019861","","","0.71074","MoKα","","0.0552","0.0396","","","0.1159","0.1276","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213639","8.822","0.007","10.793","0.008","11.029","0.008","90","","98.896","0.013","90","","1037.5","1.4","294","2","294","2","","","","","","","","5","P 1 c 1","P -2yc","7","","(<i>E</i>)-2-[(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4- ylimino)methylene]phenyl benzenesulfonate","","- C24 H21 N3 O4 S -","- C24 H21 N3 O4 S -","- C48 H42 N6 O8 S2 -","2","1","AT2134","Chen, Xin; Yu, Ming","(<i>E</i>)-2-[(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-ylimino)methylene]phenyl benzenesulfonate","Acta Crystallographica Section E","2007","63","6","o2936","o2938","10.1107/S1600536806043546","","","0.71073","MoKα","","0.0704","0.0447","","","0.0941","0.1101","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213640","7.797","0.002","17.456","0.004","13.5","0.003","90","","90","","90","","1837.4","0.8","294","2","294","2","","","","","","","","5","P n a 21","P 2c -2n","33","","(<i>E</i>)-<i>N</i>'-[4-(4-Chlorobenzyloxy)-3-methoxybenzylidene]furan-2-\ carbohydrazide","","- C20 H17 Cl N2 O4 -","- C20 H17 Cl N2 O4 -","- C80 H68 Cl4 N8 O16 -","4","1","AT2139","Zhao, Yan-Li; Zhang, Qiao-Zhen; Chen, Xin; Yu, Ming","(<i>E</i>)-<i>N</i>'-[4-(4-Chlorobenzyloxy)-3-methoxybenzylidene]furan-2-carbohydrazide","Acta Crystallographica Section E","2007","63","6","o2952","o2953","10.1107/S1600536806043807","","","0.71073","MoKα","","0.1008","0.0459","","","0.0939","0.1166","","","","","","0.983","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2213641","12.615","0.003","9.564","0.003","21.792","0.006","90","","90","","90","","2629.2","1.3","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-Methyl-N-phenylpiperazine-1-carbothioamide","","- C12 H17 N3 S -","- C12 H17 N3 S -","- C96 H136 N24 S8 -","8","1","AT2276","Huan-Mei Guo","4-Methyl-<i>N</i>-phenylpiperazine-1-carbothioamide","Acta Crystallographica Section E","2007","63","6","o2781","o2781","10.1107/S1600536807020855","","","0.71073","MoKα","","0.0882","0.0396","","","0.0938","0.1127","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213642","10.8183","0.0005","11.7267","0.0006","16.8837","0.0008","74.312","0.001","87.491","0.001","73.065","0.001","1971.28","0.17","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","[N,N,N',N'-Tetrakis(benzimidazol-2-ylmethyl)ethane-1,2-diamine]nickel(II) dichloride trimethanol solvate","","- C37 H44 Cl2 N10 Ni O3 -","- C37 H44 Cl2 N10 Ni O3 -","- C74 H88 Cl4 N20 Ni2 O6 -","2","1","AT2277","Ya-Mei Pei; Xiang-Gao Meng; Chun-Shan Zhou; Li, Wang","[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrakis(benzimidazol-2-ylmethyl)ethane-1,2-diamine]nickel(II) dichloride trimethanol solvate","Acta Crystallographica Section E","2007","63","6","m1568","m1568","10.1107/S1600536807020879","","","0.71073","MoKα","","0.0649","0.0516","","","0.1311","0.1445","","","","","","1.052","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213643","20.112","0.006","7.813","0.004","17.302","0.009","90","","117.991","0.007","90","","2400.7","1.9","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(4,4'-bipyridine-κN)tetrakis(nitrato-κ^2^<i>O</i>,<i>O</i>')tin(IV)","","- C20 H16 N8 O12 Sn -","- C20 H16 N8 O12 Sn -","- C80 H64 N32 O48 Sn4 -","4","0.5","AT2281","H. Zhong; X.-R. Zeng; X.-M. Yang; Q.-Y. Luo","Bis(4,4'-bipyridine-κ<i>N</i>)tetrakis(nitrato-κ^2^<i>O</i>,<i>O</i>')tin(IV)","Acta Crystallographica Section E","2007","63","6","m1566","m1566","10.1107/S1600536807020880","","","0.71073","MoKα","","0.0349","0.0344","","","0.1192","0.1196","","","","","","1.083","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213644","6.6394","0.0002","14.6658","0.0005","12.6653","0.0003","90","","95.146","0.002","90","","1228.28","0.06","160","1","160","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","cyclohexanone Oxime","3-Hydroxyimino-1-methyl-5-phenylcyclohexane-1-carbonitrile","","- C14 H16 N2 O -","- C14 H16 N2 O -","- C56 H64 N8 O4 -","4","1","AT2282","A. Thiruvalluvar; M. Subramanyam; R. T. Sabapathy Mohan; S. Kamatchi; K. Murugavel","3-Hydroxyimino-1-methyl-5-phenylcyclohexane-1-carbonitrile","Acta Crystallographica Section E","2007","63","6","o2780","o2780","10.1107/S1600536807020892","","","0.71073","MoKα","","0.0898","0.0591","","","0.1458","0.1654","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213645","6.5579","0.0011","9.1687","0.0015","24.328","0.004","90","","90","","90","","1462.8","0.4","113","2","113","2","","","","","","","","3","P m n a","-P 2ac 2","53","","1,6,6-Trimethyl-6,7,8,9-tetrahydrophenanthro[1,2-b]furan-10,11-dione","","- C19 H18 O3 -","- C19 H18 O3 -","- C76 H72 O12 -","4","0.5","AT2283","Xin-Qiao Liu; Wen-Yuan Gao","1,6,6-Trimethyl-6,7,8,9-tetrahydrophenanthro[1,2-<i>b</i>]furan-10,11-dione","Acta Crystallographica Section E","2007","63","6","o2831","o2831","10.1107/S1600536807021320","","","0.7107","MoKα","","0.06","0.0569","","","0.1362","0.1387","","","","","","1.167","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213646","7.2878","0.0015","10.597","0.002","10.61","0.002","90","","102.717","0.003","90","","799.3","0.3","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(3,4-dichlorophenyl)ethanone","","- C8 H6 Cl2 O -","- C8 H6 Cl2 O -","- C32 H24 Cl8 O4 -","4","1","AT2284","Huan-Mei Guo","3,4-Dichlorohypnone","Acta Crystallographica Section E","2007","63","6","o2812","o2812","10.1107/S1600536807021356","","","0.71073","MoKα","","0.0375","0.0326","","","0.0889","0.0938","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213647","11.654","0.006","11.335","0.006","9.711","0.005","90","","90","","90","","1282.8","1.2","294","2","294","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","4-Methyl-N-phenylpiperidine-1-thioamide","","- C13 H18 N2 S -","- C13 H18 N2 S -","- C52 H72 N8 S4 -","4","1","AT2285","Li-You Zhou","4-Methyl-<i>N</i>-phenylpiperidine-1-thioamide","Acta Crystallographica Section E","2007","63","6","o2848","o2848","10.1107/S1600536807021691","","","0.71073","MoKα","","0.0642","0.0383","","","0.0833","0.0964","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213648","15.7947","0.0015","7.8792","0.0005","10.8786","0.0012","90","","91.19","0.009","90","","1353.5","0.2","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenoxy]propanoate","","- C14 H16 N2 O4 -","- C14 H16 N2 O4 -","- C56 H64 N8 O16 -","4","1","AT2286","Rui-Dian Ma; Bao-Lei Wang; Zheng-Ming Li; Hai-Bin Song","Ethyl 2-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenoxy]propanoate","Acta Crystallographica Section E","2007","63","6","o2897","o2897","10.1107/S160053680702168X","","","0.7107","MoKα","","0.0593","0.0485","","","0.1136","0.1207","","","","","","1.104","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213649","17.593","0.004","16.005","0.003","30.446","0.006","90","","90","","90","","8573","3","292","2","292","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","<i>catena</i>-Poly[[[bis(2-methyl-1<i>H</i>-imidazole-κN^3^)cadmium(II)]-μ- cyclohexane-1,4-dicarboxylato] dihydrate]","","- C16 H26 Cd N4 O6 -","- C16 H26 Cd N4 O6 -","- C256 H416 Cd16 N64 O96 -","16","2","AT2287","Yuan-Jing Li","<i>catena</i>-Poly[[[bis(2-methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)cadmium(II)]-μ-cyclohexane-1,4-dicarboxylato] dihydrate]","Acta Crystallographica Section E","2007","63","6","m1654","m1655","10.1107/S1600536807022416","","","0.71073","MoKα","","0.0835","0.0538","","","0.1152","0.1273","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213650","20.5162","0.0005","8.9727","0.0003","19.0466","0.0006","90","","91.395","0.002","90","","3505.17","0.18","160","1","160","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","bis-(2'-furyl)piperidin-4-one","<i>N</i>-Benzoyl-r-2,c-6-di-2-furyl-t-3-methylpiperidin-4-one","","- C21 H19 N O4 -","- C21 H19 N O4 -","- C168 H152 N8 O32 -","8","1","AT2288","Thiruvalluvar, A.; Balamurugan, S.; Manimekalai, A.; Selvaraju, K.; Maruthavanan, T.","<i>N</i>-Benzoyl-<i>r</i>-2,<i>c</i>-6-di-2-furyl-<i>t</i>-3-methylpiperidin-4-one","Acta Crystallographica Section E","2007","63","6","o2909","o2909","10.1107/S1600536807022398","","","0.71073","MoKα","","0.0815","0.0559","","","0.14","0.1556","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213651","8.7032","0.0012","8.6376","0.0012","16.962","0.002","90","","95.341","0.002","90","","1269.6","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 3-(3,4,5-tribromo-1<i>H</i>-pyrrol-2-ylcarboxamido)propionate","","- C9 H9 Br3 N2 O3 -","- C9 H9 Br3 N2 O3 -","- C36 H36 Br12 N8 O12 -","4","1","AT2289","Xiang-Chao Zeng; Xin Ling; Jing Zeng; Xia Li","Methyl 3-(3,4,5-tribromo-1<i>H</i>-pyrrol-2-ylcarboxamido)propionate","Acta Crystallographica Section E","2007","63","6","o2918","o2918","10.1107/S1600536807022404","","","0.71073","MoKα","","0.0458","0.037","","","0.1026","0.1069","","","","","","1.141","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213652","13.5822","0.0017","7.6918","0.0013","16.482","0.003","90","","104.752","0.009","90","","1665.1","0.5","298","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,3-bis(4-bromophenyl)quinoxaline","","- C20 H12 Br2 N2 -","- C20 H12 Br2 N2 -","- C80 H48 Br8 N8 -","4","1","AT2290","Bo Zhang; Xiao-Chun Chen; Xing Chen; Cui-Ping Wang; Zhi-Qiang Zhang","2,3-Bis(4-bromophenyl)quinoxaline","Acta Crystallographica Section E","2007","63","6","o3013","o3013","10.1107/S1600536807023288","","","0.71073","MoKα","","0.0691","0.0467","","","0.1276","0.1394","","","","","","0.959","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213653","9.325","0.002","7.6101","0.0013","12.3466","0.0019","90","","95.365","0.013","90","","872.3","0.3","294","2","292","2","","","","","","","","7","P 1 21 1","P 2yb","4","","Aquapyridinesilver(I) 4-amino-2,5-dichlorobenzenesulfonate dihydrate","","- C11 H15 Ag Cl2 N2 O6 S -","- C11 H15 Ag Cl2 N2 O6 S -","- C22 H30 Ag2 Cl4 N4 O12 S2 -","2","1","AT2291","Shangguan, Shao-Ping; Li, Yu-Jie; Wu, Hua","Aquapyridinesilver(I) 4-amino-2,5-dichlorobenzenesulfonate dihydrate","Acta Crystallographica Section E","2007","63","6","m1680","m1680","10.1107/S160053680702329X","","","0.71073","MoKα","","0.1106","0.0477","","","0.0788","0.0933","","","","","","0.803","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213654","7.2569","0.0014","10.1924","0.0019","12.139","0.002","77.944","0.003","75.044","0.002","69.313","0.002","804.6","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","<i>catena</i>-Poly[1,10-phenanthroline-1,10-diium [[dichloridobismuth(III)]-di-μ-chlorido]]","","- C12 H10 Bi Cl4 N2 -","- C12 H10 Bi Cl4 N2 -","- C24 H20 Bi2 Cl8 N4 -","2","1","AT2292","Feng Li; Handong Yin; Simpson, Jim","<i>catena</i>-Poly[1,10-phenanthroline-1,10-diium [[dichloridobismuthate(III)]-di-μ-chlorido]]","Acta Crystallographica Section E","2007","63","6","m1746","m1746","10.1107/S1600536807023318","","","0.71073","MoKα","","0.0433","0.037","","","0.1001","0.1046","","","","","","1.003","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213655","5.6101","0.0019","9.278","0.003","21.708","0.007","90","","90","","90","","1129.9","0.6","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Methoxy-6-(pyridin-3-yliminomethyl)phenol","","- C13 H12 N2 O2 -","- C13 H12 N2 O2 -","- C52 H48 N8 O8 -","4","1","AT2294","Jing, Zuo-Liang; Li,Rui-Ning; Yang, Nan","2-Methoxy-6-(3-pyridyliminomethyl)phenol","Acta Crystallographica Section E","2007","63","6","o3001","o3001","10.1107/S1600536807023823","","","0.71073","MoKα","","0.0411","0.0322","","","0.0773","0.0842","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213656","5.2903","0.0011","9.788","0.002","17.435","0.004","90","","94.102","0.003","90","","900.5","0.3","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>'-[1-(2-Thienyl)ethylidene]acetohydrazide","","- C8 H10 N2 O S -","- C8 H10 N2 O S -","- C32 H40 N8 O4 S4 -","4","1","AT2295","Huan-Mei Guo","<i>N</i>'-[1-(2-Thienyl)ethylidene]acetohydrazide","Acta Crystallographica Section E","2007","63","6","o2950","o2950","10.1107/S1600536807023665","","","0.71073","MoKα","","0.0587","0.0442","","","0.1203","0.1324","","","","","","1.057","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213657","9.8257","0.0017","9.3118","0.0016","13.416","0.002","90","","105.924","0.003","90","","1180.4","0.3","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Amino-2-thioxothiazolidin-4-one","","- C3 H4 N2 O S2 -","- C3 H4 N2 O S2 -","- C24 H32 N16 O8 S16 -","8","2","AT2296","Zhou, Qing-Li; Zhang, Zhen-Heng; Jing, Zuo-Liang","3-Amino-2-thioxothiazolidin-4-one","Acta Crystallographica Section E","2007","63","6","o3000","o3000","10.1107/S1600536807023690","","","0.71073","MoKα","","0.0422","0.0319","","","0.0784","0.0846","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213658","30.1171","0.0018","8.0187","0.0007","13.4661","0.0008","90","","111.902","0.004","90","","3017.3","0.4","173","2","173","2","","","","","","","","6","C 1 c 1","C -2yc","9","","2-Bromo-N'-[(1E)-(4-fluorophenyl)methylene]-5-methoxybenzohydrazide monohydrate","","- C15 H14 Br F N2 O3 -","- C15 H14 Br F N2 O3 -","- C120 H112 Br8 F8 N16 O24 -","8","2","AT2297","Narayana, B.; Sunil, K.; Yathirajan, H.S.; Sarojini, B.K.; Bolte, Michael","2-Bromo-<i>N</i>'-[(<i>E</i>)-(4-fluorophenyl)methylene]-5-methoxybenzohydrazide monohydrate","Acta Crystallographica Section E","2007","63","6","o2948","o2948","10.1107/S1600536807024348","","","0.71073","MoKα","","0.0851","0.0801","","","0.1956","0.2016","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213659","16.8495","0.0009","7.232","0.0003","23.3405","0.0011","90","","90","","90","","2844.2","0.2","113","2","113","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-(3,5-Dibromo-2-hydroxybenzylideneamino)isoindole-1,3-dione","","- C15 H8 Br2 N2 O3 -","- C15 H8 Br2 N2 O3 -","- C120 H64 Br16 N16 O24 -","8","1","AT2298","Jing, Zuo-Liang; Li, Rui-Ning; Zhai, Jia-Qi","2-(3,5-Dibromo-2-hydroxybenzylideneamino)isoindole-1,3-dione","Acta Crystallographica Section E","2007","63","6","o3002","o3002","10.1107/S1600536807024804","","","0.7107","MoKα","","0.0624","0.0593","","","0.1249","0.1263","","","","","","1.201","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213660","7.413","0.002","8.768","0.003","11.051","0.003","105.33","0.004","92.875","0.005","95.995","0.005","686.7","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Chlorido{4-chloro-1-[2-(methylsulfanyl)phenyldiazenyl]phenyl -κ^3^C,N,S}palladium(II)","","- C13 H10 Cl2 N2 Pd S -","- C13 H10 Cl2 N2 Pd S -","- C26 H20 Cl4 N4 Pd2 S2 -","2","1","AT2299","Bagchi, Vivek; Das, Purak; Bandyopadhyay, Debkumar","Chlorido{4-chloro-1-[2-(methylsulfanyl)phenyldiazenyl]phenyl-κ^3^<i>C</i>,<i>N</i>,<i>S</i>}palladium(II)","Acta Crystallographica Section E","2007","63","6","m1704","m1704","10.1107/S1600536807024853","","","0.71073","MoKα","","0.0319","0.0287","","","0.068","0.0692","","","","","","1.13","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213661","8.2062","0.0016","5.748","0.0011","9.0527","0.0018","90","","111.37","0.03","90","","397.65","0.16","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Acrylamide","","- C3 H5 N O -","- C3 H5 N O -","- C12 H20 N4 O4 -","4","1","AT2300","Zhou, Qing-Li; Zhang, Zhen-Heng; Jing, Zuo-Liang","Acrylamide","Acta Crystallographica Section E","2007","63","6","o3039","o3039","10.1107/S1600536807024816","","","0.71073","MoKα","","0.0484","0.0415","","","0.1029","0.1073","","","","","","1.114","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213662","12.658","0.002","7.4377","0.0015","13.101","0.003","90","","100.812","0.003","90","","1211.5","0.4","294","2","294","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(<i>E</i>)-<i>N</i>'-(4-Chlorobenzylidene)nicotinohydrazide","","- C13 H10 Cl N3 O -","- C13 H10 Cl N3 O -","- C52 H40 Cl4 N12 O4 -","4","2","AT2301","Rui-Xue Deng; Pu Liu; Bing Zhao; Dong-Jie Liu","(<i>E</i>)-<i>N</i>'-(4-Chlorobenzylidene)nicotinohydrazide","Acta Crystallographica Section E","2007","63","6","o3003","o3003","10.1107/S1600536807024828","","","0.71073","MoKα","","0.0726","0.039","","","0.0844","0.1008","","","","","","0.996","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213663","14.186","0.002","8.9579","0.0011","8.9902","0.0013","90","","110.277","0.013","90","","1071.6","0.3","173","2","173","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Decamethylferrocenium hexafluorophosphate","","- C20 H30 F6 Fe P -","- C20 H30 F6 Fe P -","- C40 H60 F12 Fe2 P2 -","2","0.25","AT2302","Sánchez Perucha, Alejandro; Bolte, Michael","Decamethylferrocenium hexafluorophosphate","Acta Crystallographica Section E","2007","63","6","m1703","m1703","10.1107/S1600536807024919","","","0.71073","MoKα","","0.0356","0.0333","","","0.091","0.0922","","","","","","1.113","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213664","13.5727","0.0009","14.9626","0.001","15.7828","0.0011","80.578","0.005","82.201","0.005","64.867","0.004","2854.7","0.3","140","1","140","1","","","","","","","","6","P -1","-P 1","2","","[N,N'-Bis(3-phenylprop-2-enylidene)ethylenediamine- κ^2^N,N']bis(triphenylphosphine-κP)silver(I) nitrate 1.36-acetonitrile 1.64-methanol 0.53-diethyl ether solvate","","- C62.49 H65.97 Ag N4.36 O5.17 P2 -","- C62.494 H50 Ag N4.362 O5.171 P2 -","- C124.988 H100 Ag2 N8.724 O10.342 P4 -","2","1","BG2030","Aliakbar Dehno Khalaji; Mehdi Amirnasr; Schenk, Kurt J.","[<i>N</i>,<i>N</i>'-Bis(3-phenylprop-2-enylidene)ethylenediamine-κ^2^<i>N</i>,<i>N</i>']bis(triphenylphosphine-κ<i>P</i>)silver(I) nitrate 1.36-acetonitrile 1.64-methanol 0.53-diethyl ether solvate","Acta Crystallographica Section E","2007","63","6","m1684","m1686","10.1107/S1600536807022143","","","0.71073","MoKα","","0.0616","0.0547","","","0.1322","0.137","","","","","","1.121","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213665","10.235","0.004","26.654","0.012","9.581","0.004","90","","93.963","0.006","90","","2607.5","1.9","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-[2-(4-Chlorophenyl)-3-methylbutanamido]-3-p-tolyl-1H-1,2,4- triazole-5(4H)-thione dimethylformamide solvate","","- C23 H28 Cl N5 O2 S -","- C23 H28 Cl N5 O2 S -","- C92 H112 Cl4 N20 O8 S4 -","4","1","BG2045","Xue, Si-Jia; Chai, An; Cai, Zhi-Juan; Xiang, Chang-Sheng; Bian, Wang-Dong","4-[2-(4-Chlorophenyl)-3-methylbutanamido]-3-<i>p</i>-tolyl-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione dimethylformamide solvate","Acta Crystallographica Section E","2007","63","6","o2962","o2962","10.1107/S1600536807023094","","","0.71073","MoKα","","0.1068","0.0593","","","0.1586","0.1837","","","","","","0.964","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213666","13.179","0.003","11.897","0.002","12.314","0.003","90","","96.03","0.03","90","","1920","0.7","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","<i>catena</i>-Poly[[[bis(2-methyl-1<i>H</i>-imidazole)copper(II)] -μ-1,4-cyclohexanedicarboxylato-κ^2^<i>O</i>,<i>O</i>'] monohydrate]","","- C16 H24 Cu N4 O5 -","- C16 H24 Cu N4 O5 -","- C64 H96 Cu4 N16 O20 -","4","1","BG2052","Gejihu De","<i>catena</i>-Poly[[[bis(2-methyl-1<i>H</i>-imidazole)copper(II)]-μ-1,4-cyclohexanedicarboxylato-κ^2^<i>O</i>,<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2007","63","6","m1748","m1749","10.1107/S1600536807023628","","","0.71073","MoKα","","0.0265","0.0238","","","0.0576","0.0586","","","","","","1.088","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213667","30.4215","0.0006","6.7394","0.0001","16.6695","0.0003","90","","107.95","0.001","90","","3251.28","0.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[[triaquabarium(II)]-di-μ-2,4,6-trinitrophenolato- κ^3^O,<i>O</i>':<i>O</i>'';κ^3^O:<i>O</i>',<i>O</i>''] benzimidazole disolvate]","","- C26 H21 Ba N10 O17 -","- C26 H21 Ba N10 O17 -","- C104 H84 Ba4 N40 O68 -","4","0.5","BG2054","De-Yun Ma; Guo-Hua Deng","<i>catena</i>-Poly[[[triaquabarium(II)]-di-μ-2,4,6-trinitrophenolato-κ^3^<i>O</i>:<i>O</i>',<i>O</i>'';κ^3^<i>O</i>,<i>O</i>':<i>O</i>''] benzimidazole disolvate]","Acta Crystallographica Section E","2007","63","6","m1722","m1723","10.1107/S1600536807024610","","","0.71073","MoKα","","0.0218","0.0196","","","0.0475","0.0488","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213668","17.3708","0.0011","14.225","0.0009","21.2747","0.0014","90","","94.224","0.001","90","","5242.7","0.6","291","2","291","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","poly[[aquabis{μ~2~-1,1'-bis[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]\ ferrocene-κ^2^<i>N</i>^4^:<i>N</i>^4'^}ethanolcobalt(II)] bis(perchlorate) ethanol trisolvate]","","- C40 H58 Cl2 Co Fe2 N12 O13 -","- C40 H58 Cl2 Co Fe2 N12 O13 -","- C160 H232 Cl8 Co4 Fe8 N48 O52 -","4","1","BH2097","Zhou, Xiao-Li; Meng, Xiang-Ru; Hou, Hong-Wei","A two-dimensional Co^II^ coordination polymer with the ligand 1,1'-bis[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]ferrocene","Acta Crystallographica Section E","2007","63","6","m1717","m1717","10.1107/S1600536807024294","","","0.71073","MoKα","","0.0916","0.0569","","","0.1616","0.1896","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213669","11.525","0.004","11.202","0.006","12.908","0.006","90","","95.68","0.04","90","","1658.3","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","C9H27N5P2Se2","bis(N,N,N',N'-tetramethylselenophosphoramidoyl)methylamine","","- C9 H27 N5 P2 Se2 -","- C9 H27 N5 P2 Se2 -","- C36 H108 N20 P8 Se8 -","4","1","BH2099","Alouani, Khaled; Guesmi, Abderrahmen; Driss, Ahmed","Le ligand neutre bis(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tétraméthylsélénophosphoramidoyl)méthylamine","Acta Crystallographica Section E","2007","63","6","o2972","o2972","10.1107/S1600536807022970","","","0.71073","MoKα","","0.1415","0.0665","","","0.1548","0.193","","","","","","0.991","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213670","8.9535","0.0014","18.607","0.003","15.674","0.002","90","","94.826","0.003","90","","2602","0.7","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,9-Dimethyl-1,10-phenanthrolinium bis(pyridine-2,6-dicarboxylato-κ^3^O,N,O')ferrate(III) dihydrate","","- C28 H23 Fe N4 O10 -","- C28 H23 Fe N4 O10 -","- C112 H92 Fe4 N16 O40 -","4","1","BH2100","Aghabozorg, Hossein; Sadrkhanlou, Elahe; Soleimannejad, Janet; Adams, Harry","2,9-Dimethyl-1,10-phenanthrolinium bis(pyridine-2,6-dicarboxylato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')ferrate(III) dihydrate","Acta Crystallographica Section E","2007","63","6","m1760","m1760","10.1107/S1600536807025081","","","0.71073","MoKα","","0.14","0.0582","","","0.1367","0.1654","","","","","","0.887","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213671","22.481","0.005","10.489","0.002","5.0315","0.001","90","","92.01","0.03","90","","1185.7","0.4","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Tetraaquabis[3-(4-carboxyphenoxy)propionato-κO]copper(II) dihydrate","","- C20 H30 Cu O16 -","- C20 H30 Cu O16 -","- C40 H60 Cu2 O32 -","2","0.5","BH2101","Xiao, Ying-Hui; Kong, Li-Li; Gao, Shan","Tetraaquabis[3-(4-carboxyphenoxy)propionato-<i>{κ</i>O}]copper(II) dihydrate","Acta Crystallographica Section E","2007","63","6","m1750","m1750","10.1107/S1600536807023744","","","0.71073","MoKα","","0.0709","0.046","","","0.1219","0.144","","","","","","1.106","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213672","20.05","0.002","5.588","0.003","16.48","0.002","90","","108.913","0.019","90","","1746.7","1","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(4-Fluorophenyl)-1-phenyl-5-(<i>p</i>-tolyl)-2-pyrazoline","","- C22 H19 F N2 -","- C22 H19 F N2 -","- C88 H76 F4 N8 -","4","1","BH2102","Guo, Huan-Mei; Jian, Fang-Fang; Wang, Jing; Huang, Ben-Yu; Zhang, Yun-chen","3-(4-Fluorophenyl)-1-phenyl-5-(<i>p</i>-tolyl)-2-pyrazoline","Acta Crystallographica Section E","2007","63","6","o2980","o2980","10.1107/S1600536807024634","","","0.71073","MoKα","","0.1395","0.0608","","","0.1573","0.2223","","","","","","0.913","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2213673","11.69","0.0003","6.151","0.0002","22.5184","0.0006","90","","102.369","0.002","90","","1581.61","0.08","293","2","293","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","<i>catena</i>-Poly[[[aquabis(4-chlorobenzoato-\ κ^2^<i>O</i>,<i>O</i>')manganese(II)]-μ-4,4'-bipyridine-\ κ^2^<i>N</i>:<i>N</i>'] 4,4'-bipyridine solvate]","","- C34 H26 Cl2 Mn N4 O5 -","- C34 H26 Cl2 Mn N4 O5 -","- C68 H52 Cl4 Mn2 N8 O10 -","2","0.5","BH2104","De-Yun Ma; Guo-Hua Deng","<i>catena</i>-Poly[[[aquabis(4-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')manganese(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']4,4'-bipyridine solvate]","Acta Crystallographica Section E","2007","63","6","m1772","m1772","10.1107/S1600536807025305","","","0.71073","MoKα","","0.0661","0.0469","","","0.107","0.1181","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213674","5.9709","0.0012","14.377","0.003","14.905","0.003","90","","92.64","0.03","90","","1278.1","0.5","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(3<i>S</i>,4<i>R</i>)-4-[4-(Benzyloxy)phenyl]-3-(4-fluorophenyl)-1-\ [(<i>S</i>)-1-(4-methoxyphenyl)ethyl]azetidin-2-one","","- C31 H28 F N O3 -","- C31 H28 F N O3 -","- C62 H56 F2 N2 O6 -","2","1","BI2173","Wu, Jin-Chang; Sun, Jing-Bo; Xu, Xian-Xiu","(3<i>S</i>,4<i>R</i>)-4-[4-(Benzyloxy)phenyl]-3-(4-fluorophenyl)-1-[(<i>S</i>)-1-(4-methoxyphenyl)ethyl]azetidin-2-one","Acta Crystallographica Section E","2007","63","6","o2844","o2845","10.1107/S160053680702096X","","","0.71073","MoKα","","0.0814","0.0462","","","0.1213","0.1328","","","","","","0.931","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213675","9.3948","0.0019","23.351","0.005","9.95","0.002","90","","111.88","0.03","90","","2025.6","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[2,4,6-triamino-1,3,5-triazin-1-ium [[aqua(pyridine-2,6-dicarboxylato-κ^3^O,N,O')bismuth(III)]-μ-\ μ~2~-pyridine-2,6-dicarboxylato-κ^4^O,N,O':O']]","","- C17 H15 Bi N8 O9 -","- C17 H15 Bi N8 O9 -","- C68 H60 Bi4 N32 O36 -","4","1","BI2175","Sharif, Mahboubeh A.; Aghabozorg, Hossein; Moghim, Abolghasem","<i>catena</i>-Poly[2,4,6-triamino-1,3,5-triazin-1-ium [[aqua(pyridine-2,6-dicarboxylato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')bismuthate(III)]-μ-pyridine-2,6-dicarboxylato-κ^4^<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>']]","Acta Crystallographica Section E","2007","63","6","m1599","m1601","10.1107/S1600536807021010","","","0.71073","MoKα","","0.0558","0.0259","","","0.0593","0.0658","","","","","","1.032","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213676","9.648","0.0002","10.8032","0.0003","15.1157","0.0003","90","","105.26","0.0014","90","","1519.95","0.06","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5-Bromo-6-chloro-<i>N</i>^4^-methylpyrimidine-2,4-diamine","","- C5 H6 Br Cl N4 -","- C5 H6 Br Cl N4 -","- C40 H48 Br8 Cl8 N32 -","8","1","BI2181","Walji, Dhiran V. B.; Storey, John M. D.; Harrison, William T. A.","5-Bromo-6-chloro-<i>N</i>^4^-methylpyrimidine-2,4-diamine","Acta Crystallographica Section E","2007","63","6","o2810","o2811","10.1107/S1600536807017552","","","0.71073","MoKα","","0.0201","0.0177","","","0.0416","0.0425","","","","","","1.076","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213677","13.003","0.003","8.7648","0.0019","13.041","0.003","90","","101.053","0.004","90","","1458.7","0.6","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Triethylammonium 4-aminobenzenesulfonate","","- C12 H22 N2 O3 S -","- C12 H22 N2 O3 S -","- C48 H88 N8 O12 S4 -","4","1","BI2186","Li, Jian; Liang, Zu-Pei; Guo, Huan-Mei","Triethylammonium 4-aminobenzenesulfonate","Acta Crystallographica Section E","2007","63","6","o2884","o2884","10.1107/S1600536807022027","","","0.71073","MoKα","","0.0847","0.0546","","","0.1476","0.1712","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213678","6.5958","0.0006","7.8459","0.0008","21.202","0.002","90","","90","","90","","1097.2","0.18","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","6-chloro-3-hydroxy-3-(2-oxopropyl)indolin-2-one","","- C11 H10 Cl N O3 -","- C11 H10 Cl N O3 -","- C44 H40 Cl4 N4 O12 -","4","1","BQ2011","Xing, Xiao-Ning; Li, Liang; Zhu, Xiao-Yu; Chen, Jia-Rong","6-Chloro-3-hydroxy-3-(2-oxopropyl)indolin-2-one","Acta Crystallographica Section E","2007","63","6","o2969","o2970","10.1107/S1600536807020739","","","0.71073","MoKα","","0.0401","0.0384","","","0.1008","0.1022","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213679","10.199","0.003","10.811","0.003","18.579","0.005","90","","103.427","0.004","90","","1992.6","1","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","3-(methylsulfonyl)phenyl-κ^2^C,N}palladium(II)","","- C17 H20 Cl N3 O3 Pd S -","- C17 H20 Cl N3 O3 Pd S -","- C68 H80 Cl4 N12 O12 Pd4 S4 -","4","1","BQ2012","Bagchi, Vivek; Bandyopadhyay, Debkumar","Chlorido(<i>N,N</i>-dimethylformamide-κ<i>O</i>){2-(4-methylphenyldiazenyl)-3-(methylsulfonyl)phenyl-κ^2^<i>C</i>,<i>N</i>}palladium(II)","Acta Crystallographica Section E","2007","63","6","m1614","m1615","10.1107/S1600536807021526","","","0.71073","MoKα","","0.0616","0.0578","","","0.1224","0.1246","","","","","","1.188","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213680","20.121","0.005","7.8112","0.0012","18.307","0.005","90","","118.823","0.009","90","","2520.8","1","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(4-phenylpyridinium) tetrakis(nitrato-κ^2^O,O')tin(IV)","","- C22 H18 N6 O12 Sn -","- C22 H18 N6 O12 Sn -","- C88 H72 N24 O48 Sn4 -","4","0.5","BQ2015","H. Zhong; X.-R. Zeng; X.-M. Yang; Q.-Y. Luo","Bis(4-phenylpyridinium) tetrakis(nitrato-κ^2^<i>O</i>,<i>O</i>')stannate(IV)","Acta Crystallographica Section E","2007","63","6","m1567","m1567","10.1107/S1600536807021174","","","0.71073","MoKα","","0.0359","0.0354","","","0.1225","0.1229","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213681","9.304","0.003","7.909","0.003","10.276","0.004","90","","95.317","0.006","90","","752.9","0.5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis(3-carboxypyridine-2-carboxylato-κ^2^N,O^2^)zinc(II)","","- C14 H12 N2 O10 Zn -","- C14 H12 N2 O10 Zn -","- C28 H24 N4 O20 Zn2 -","2","0.5","BQ2016","Aghabozorg, Hossein; Sadr-khanlou, Elahe; Soleimannejad, Janet; Adams, Harry","Diaquabis(3-carboxypyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>^2^)zinc(II)","Acta Crystallographica Section E","2007","63","6","m1769","m1769","10.1107/S1600536807025032","","","0.71073","MoKα","","0.0269","0.0247","","","0.0683","0.0693","","","","","","1.117","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213682","15.7347","0.0008","8.1216","0.0004","7.8885","0.0004","90","","90","","90","","1008.08","0.09","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Guanidinium benzoate","","- C8 H11 N3 O2 -","- C8 H11 N3 O2 -","- C32 H44 N12 O8 -","4","0.5","BT2327","Pereira Silva, P. S.; Ramos Silva, M.; Paixão, J. A.; Matos Beja, A.","Guanidinium benzoate","Acta Crystallographica Section E","2007","63","6","o2783","o2783","10.1107/S1600536807015802","","","0.71073","MoKα","","0.0508","0.0354","","","0.0914","0.1014","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213683","8.3042","0.0002","13.2529","0.0004","13.7368","0.0004","90","","97.326","0.002","90","","1499.46","0.07","120","","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Pyrimethamine tetrafluoroborate","2,4-diamino-5-(p-chlorophenyl)-6-ethylpyrimidinium tetrafluoridoborate","","- C12 H14 B Cl F4 N4 -","- C12 H14 B Cl F4 N4 -","- C48 H56 B4 Cl4 F16 N16 -","4","1","BT2329","Kasthuri Balasubramani; Packianathan Thomas Muthiah; Daniel E. Lynch","Hydrogen-bonding patterns in pyrimethamine tetrafluoroborate","Acta Crystallographica Section E","2007","63","6","o2966","o2966","10.1107/S1600536807015656","","","0.71073","MoKα","","0.0657","0.0445","","","0.1149","0.1264","","","","","","1.069","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213684","21.4583","0.0003","13.6698","0.0002","21.6097","0.0001","90","","117.472","0.001","90","","5624","0.13","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(μ-2-hydroxybenzoato-κ^2^O:O')bis[(2,2'-bipyridine-κ^2^N,N')bis(2- hydroxybenzoato-κ^2^O,O')bismuth(III)]","","- C62 H46 Bi2 N4 O18 -","- C62 H46 Bi2 N4 O18 -","- C248 H184 Bi8 N16 O72 -","4","0.5","BT2330","Yong-Jing Wang; Jun Zhao; Zhen-Hua Dang; Li Xu","Bis(μ-2-hydroxybenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(2-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>')bismuth(III)]","Acta Crystallographica Section E","2007","63","6","m1770","m1771","10.1107/S160053680701642X","","","0.71073","MoKα","","0.0344","0.0253","","","0.0583","0.0632","","","","","","1.069","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213685","10.6225","0.0018","5.9284","0.001","18.392","0.003","90","","116.148","0.007","90","","1039.7","0.3","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-Methyl-3-phenylpiperazine","","- C11 H16 N2 -","- C11 H16 N2 -","- C44 H64 N8 -","4","1","BT2345","Yue Meng; Wei-Xiao Hu; Ke Wu","1-Methyl-3-phenylpiperazine","Acta Crystallographica Section E","2007","63","6","o3048","o3048","10.1107/S1600536807019241","","","0.71073","MoKα","","0.0535","0.04","","","0.1101","0.1222","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213686","15.5591","0.0004","10.761","0.0003","11.6784","0.0003","90","","101.616","0.001","90","","1915.28","0.09","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,5-Bis(4-chlorophenyl)-3-phenylpentane-1,5-dione","","- C23 H18 Cl2 O2 -","- C23 H18 Cl2 O2 -","- C92 H72 Cl8 O8 -","4","1","BT2349","Xue-Xia Mo; Zheng-Feng Xie; Fang-Ming Liu","1,5-Bis(4-chlorophenyl)-3-phenylpentane-1,5-dione","Acta Crystallographica Section E","2007","63","6","o2804","o2804","10.1107/S1600536807020405","","","0.71073","MoKα","","0.0381","0.0358","","","0.0941","0.0955","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213687","8.6927","0.0007","18.9137","0.0011","16.0457","0.0013","90","","104.512","0.004","90","","2553.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[(1,10-Phenanthrolin-5-yl)ethynyl](triphenylposphine-κP)gold(I)","","- C32 H22 Au N2 P -","- C32 H22 Au N2 P -","- C128 H88 Au4 N8 P4 -","4","1","BT2351","Ye, Heng-Yun; Dai, Feng-Rong; Chen, Zhong-Ning","[(1,10-Phenanthrolin-5-yl)ethynyl](triphenylposphine-κ<i>P</i>)gold(I)","Acta Crystallographica Section E","2007","63","6","m1576","m1576","10.1107/S1600536807020661","","","0.71073","MoKα","","0.0455","0.0382","","","0.0903","0.0938","","","","","","1.098","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213688","9.1138","0.0016","23.698","0.004","11.027","0.002","90","","91.479","0.004","90","","2380.8","0.7","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Tri-<i>tert</i>-butylgallane‒(<i>tert</i>-butyl)diethylstibine adduct","tri-<i>tert</i>-butyldiethylgalliumantimony(Ga—Sb)","","- C20 H46 Ga Sb -","- C20 H46 Ga Sb -","- C80 H184 Ga4 Sb4 -","4","1","BT2352","Schuchmann, Daniella; Schulz, Stephan; Flörke, Ulrich","Tri-<i>tert</i>-butylgallane‒(<i>tert</i>-butyl)diethylstibine adduct","Acta Crystallographica Section E","2007","63","6","m1606","m1606","10.1107/S1600536807021149","","","0.71073","MoKα","","0.0536","0.0369","","","0.0695","0.074","","","","","","0.948","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213689","11.7027","0.0013","9.5225","0.0011","14.7144","0.0016","90","","109.16","0.001","90","","1548.9","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(2-Chloro-3,5-difluorophenyl)-3-(2,6-dichlorobenzoyl)urea","","- C14 H7 Cl3 F2 N2 O2 -","- C14 H7 Cl3 F2 N2 O2 -","- C56 H28 Cl12 F8 N8 O8 -","4","1","BT2353","Sheng-Jiao Yan; Yu-Yun Yan; Yan-Mei Li; Ming-Jin Xie; Jun Lin","1-(2-Chloro-3,5-difluorophenyl)-3-(2,6-dichlorobenzoyl)urea","Acta Crystallographica Section E","2007","63","6","o2944","o2944","10.1107/S1600536807023069","","","0.71073","MoKα","","0.0773","0.0492","","","0.1902","0.2386","","","","","","0.874","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213690","7.5202","0.0006","11.9267","0.001","17.1484","0.0014","90","","93.217","0.001","90","","1535.6","0.2","130","2","130","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","quinolinium dihydrogen citrate","quinolinium dihydrogen citrate","","- C15 H15 N O7 -","- C15 H15 N O7 -","- C60 H60 N4 O28 -","4","1","BT2355","Graham Smith; Urs D. Wermuth; Jonathan M. White","Anhydrous quinolinium dihydrogen citrate","Acta Crystallographica Section E","2007","63","6","o2890","o2890","10.1107/S1600536807022106","","","0.71073","MoKα","","0.0356","0.0322","","","0.0893","0.0915","","","","","","1.072","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213691","6.7041","0.0004","10.4763","0.0008","30.037","0.002","90","","90","","90","","2109.6","0.2","303","2","303","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Sodium 4,N-dichlorobenzenesulfonamidate sesquihydrate","","- C6 H7 Cl2 N Na O3.5 S -","- C6 H7 Cl2 N Na O3.5 S -","- C48 H56 Cl16 N8 Na8 O28 S8 -","8","2","BT2356","B. Thimme Gowda; K. Jyothi; Sabine Foro; Jozef Kožíšek; Hartmut Fuess","Sodium 4,<i>N</i>-dichlorobenzenesulfonamidate sesquihydrate","Acta Crystallographica Section E","2007","63","6","m1644","m1645","10.1107/S1600536807023033","","","0.71073","MoKα","","0.1106","0.0675","","","0.1247","0.1398","","","","","","1.099","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213692","13.1725","0.0011","25.6651","0.0017","10.1222","0.0009","90","","104.14","0.01","90","","3318.4","0.5","173","2","173","2","","","","","","","","7","C 1 c 1","C -2yc","9","","Chlorido(6,7-dimethyl-2,3-dipyridin-2-ylquinoxaline-κ^2^N,N')(η^6^- 1,2,4,5-tetramethylbenzene)ruthenium(II) hexafluorophosphate acetonitrile solvate","","- C32 H33 Cl F6 N5 P Ru -","- C32 H33 Cl F6 N5 P Ru -","- C128 H132 Cl4 F24 N20 P4 Ru4 -","4","1","BT2357","Therrien, Bruno; Süss-Fink, Georg","Chlorido(6,7-dimethyl-2,3-dipyridin-2-ylquinoxaline-κ^2^<i>N</i>,<i>N</i>')(η^6^-1,2,4,5-tetramethylbenzene)ruthenium(II) hexafluorophosphate acetonitrile solvate","Acta Crystallographica Section E","2007","63","6","m1627","m1627","10.1107/S1600536807021861","","","0.71073","MoKα","","0.0291","0.0257","","","0.0614","0.0635","","","","","","1.014","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213693","15.5925","0.0006","8.8293","0.0003","21.076","0.0006","90","","91.979","0.002","90","","2899.82","0.17","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[1,3-bis(diphenylphosphino)propane]tetracarbonylmolybdenum(0)","","- C31 H26 Mo O4 P2 -","- C31 H26 Mo O4 P2 -","- C124 H104 Mo4 O16 P8 -","4","1","BT2358","Sanchez Ballester, Noelia M.; Elsegood, Mark R.J.; Smith, Martin B.","A second polymorph of [1,3-bis(diphenylphosphino)propane]tetracarbonylmolybdenum(0)","Acta Crystallographica Section E","2007","63","6","m1638","m1638","10.1107/S160053680702185X","","","0.71073","MoKα","","0.0763","0.0611","","","0.1273","0.1351","","","","","","1.171","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213694","11.033","0.002","6.741","0.0013","30.187","0.006","90","","98.51","0.03","90","","2220.4","0.8","294","2","294","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Sodium 2,4,<i>N</i>-trichlorobenzenesulfonamidate sesquihydrate","","- C6 H6 Cl3 N Na O3.5 S -","- C6 H6 Cl3 N Na O3.5 S -","- C48 H48 Cl24 N8 Na8 O28 S8 -","8","1","BT2359","B. Thimme Gowda; M. B. Savitha; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","Sodium 2,4,<i>N</i>-trichlorobenzenesulfonamidate sesquihydrate","Acta Crystallographica Section E","2007","63","6","m1646","m1646","10.1107/S1600536807023045","","","0.71073","MoKα","","0.0452","0.038","","","0.0784","0.0814","","","","","","1.088","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213695","5.8552","0.0005","17.1467","0.0015","14.0988","0.001","90","","97.948","0.017","90","","1401.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Pyridoxinium trichloroacetate","Pyridoxinium trichloroacetate","","- C10 H12 Cl3 N O5 -","- C10 H12 Cl3 N O5 -","- C40 H48 Cl12 N4 O20 -","4","1","BT2360","S. Athimoolam; S. Natarajan","Pyridoxinium trichloroacetate","Acta Crystallographica Section E","2007","63","6","o2916","o2917","10.1107/S1600536807022611","","","0.71073","MoKα","","0.0899","0.0452","","","0.1122","0.1332","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213696","10.349","0.0008","16.2487","0.0012","11.8556","0.0009","90","","90","","90","","1993.6","0.3","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Pyridine-2,6-dicarbaldehyde bis(benzylidenehydrazone) monohydrate","","- C21 H19 N5 O3 -","- C21 H19 N5 O3 -","- C84 H76 N20 O12 -","4","1","BT2363","Cui-Xia Cheng; Hao-Wen Liu; Fei-Hua Luo; Min-Na Cao; Zong-Qiu Hu","Pyridine-2,6-dicarbaldehyde bis(benzylidenehydrazone) monohydrate","Acta Crystallographica Section E","2007","63","6","o2899","o2899","10.1107/S1600536807022635","","","0.71073","MoKα","","0.0688","0.048","","","0.0982","0.1077","","","","","","0.975","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213697","10.214","0.001","6.8111","0.0004","28.336","0.001","90","","90","","90","","1971.3","0.2","303","2","303","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","Potassium N-chlorobenzenesulfonamidate monohydrate","Potassium N-chlorobenzenesulfonamidate monohydrate","","- C6 H7 Cl K N O3 S -","- C6 H7 Cl K N O3 S -","- C48 H56 Cl8 K8 N8 O24 S8 -","8","1","BT2364","B. Thimme Gowda; Sabine Foro; Jozef Kožíšek; Hartmut Fuess","Potassium <i>N</i>-chlorobenzenesulfonamidate monohydrate","Acta Crystallographica Section E","2007","63","6","m1688","m1688","10.1107/S1600536807024178","","","1.5418","CuKα","","0.1024","0.0459","","","0.1071","0.1229","","","","","","0.994","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213698","13.7968","0.0008","17.0524","0.0008","23.848","0.001","90","","92.954","0.001","90","","5603.2","0.5","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(benzimidazole-κ<i>N</i>)bis(4-formylbenzoato-κ<i>O</i>)\ zinc(II) monohydrate","","- C30 H24 N4 O7 Zn -","- C30 H24 N4 O7 Zn -","- C240 H192 N32 O56 Zn8 -","8","1","BT2365","Deng, Zhao-Peng; Gao, Shan; Ng, Seik Weng","Bis(benzimidazole-κ<i>N</i>)bis(4-formylbenzoato-κ<i>O</i>)zinc(II) monohydrate","Acta Crystallographica Section E","2007","63","6","m1712","m1712","10.1107/S1600536807023604","","","0.71073","MoKα","","0.1278","0.0573","","","0.14","0.1941","","","","","","1.093","","","","has coordinates,has disorder,has Fobs","203558","2020-10-21","18:00:00",""
"2213699","8.6273","0.0001","9.0401","0.0001","10.3715","0.0001","80.9701","0.0007","86.0279","0.0007","81.6056","0.0007","789.417","0.015","173","","173","","","","","","","","","6","P -1","-P 1","2","","[μ-Ferrocene-1,1'-diylbis(diphenylphosphine)-κ^2^P:P']bis[chloridogold(I)]","","- C34 H28 Au2 Cl2 Fe P2 -","- C34 H28 Au2 Cl2 Fe P2 -","- C34 H28 Au2 Cl2 Fe P2 -","1","0.5","BT2366","Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Shardlow, Ellen","[μ-Ferrocene-1,1'-diylbis(diphenylphosphine)-κ^2^<i>P</i>:<i>P</i>']bis[chloridogold(I)]","Acta Crystallographica Section E","2007","63","6","m1697","m1697","10.1107/S1600536807023835","","","0.71073","MoKα","","0.0258","0.0233","","0.0604","0.0595","0.0604","","","","","","0.9738","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213700","8.741","0.0017","14.846","0.003","11.775","0.002","90","","102.43","0.03","90","","1492.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(μ-azido-κ^2^<i>N</i>,<i>N</i>)bis({2- [3-(dimethylamino)propyliminomethyl]-4-nitrophenolato- κ^3^<i>O</i>,<i>N</i>,<i>N</i>'}copper(II))","","- C24 H32 Cu2 N12 O6 -","- C24 H32 Cu2 N12 O6 -","- C48 H64 Cu4 N24 O12 -","2","0.5","BT2367","Hou, Hai-Yun","Bis(μ-azido-κ^2^<i>N</i>,<i>N</i>)bis({2-[3-(dimethylamino)propyliminomethyl]-4-nitrophenolato-κ^3^<i>O</i>,<i>N</i>,<i>N</i>'}copper(II))","Acta Crystallographica Section E","2007","63","6","m1767","m1767","10.1107/S1600536807023902","","","0.71073","MoKα","","0.0395","0.0306","","","0.0694","0.0739","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213701","19.239","0.003","7.9613","0.0012","24.105","0.004","90","","102.684","0.005","90","","3602","1","113","2","113","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","6-chloro-2-diethylamino-4-[(1,1,3,3-tetramethylbutyl)amino] -1,3,5-triazine","","- C15 H28 Cl N5 -","- C15 H28 Cl N5 -","- C120 H224 Cl8 N40 -","8","1","BT2369","Jin-peng Wang; Fei Wen; Qing-ming Zang; Shuai Liu","6-Chloro-2-diethylamino-4-[(1,1,3,3-tetramethylbutyl)amino]-1,3,5-triazine","Acta Crystallographica Section E","2007","63","6","o3017","o3017","10.1107/S1600536807024099","","","0.7107","MoKα","","0.0557","0.0451","","","0.101","0.1075","","","","","","1.103","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213702","7.9533","0.0005","10.3853","0.0004","15.2432","0.0008","84.781","0.004","79.645","0.005","85.556","0.004","1231","0.11","291.2","0.3","291.2","0.3","","","","","","","","5","P -1","-P 1","2","","Bis(8-methylquinolinium) tetrabromidoferrate(III) bromide","","- C20 H20 Br5 Fe N2 -","- C20 H20 Br5 Fe N2 -","- C40 H40 Br10 Fe2 N4 -","2","1","BT2370","Kruszynski, Rafal; Wyrzykowski, Dariusz; Chmurzyński, Lech","Bis(8-methylquinolinium) tetrabromidoferrate(III) bromide","Acta Crystallographica Section E","2007","63","6","m1727","m1728","10.1107/S160053680702418X","","","0.71073","MoKα","","0.0413","0.0234","","","0.0522","0.0574","","","","","","0.983","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213703","9.674","0.0001","15.4549","0.0002","18.9003","0.0003","105.987","0.0008","101.593","0.0007","101.67","0.0008","2559.58","0.06","173","","173","","","","","","","","","6","P -1","-P 1","2","","Bis[μ~2~-bis(diphenylphosphino)methane]- 1:2κ^2^<i>P</i>:<i>P</i>';2:3κ^2^<i>P</i>:<i>P</i>'- dichlorido-1κ<i>Cl</i>,3κ<i>Cl</i>-trigold(I) hexafluorophosphate","","- C50 H44 Au3 Cl2 F6 P5 -","- C50 H44 Au3 Cl2 F6 P5 -","- C100 H88 Au6 Cl4 F12 P10 -","2","1","BT2371","Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Shardlow, Ellen J.","Bis[μ~2~-bis(diphenylphosphino)methane]-1:2κ^2^<i>P</i>:<i>P</i>';2:3κ^2^<i>P</i>:<i>P</i>'-dichlorido-1κ<i>Cl</i>,3κ<i>Cl</i>-<i>triangulo</i>-trigold(I) hexafluorophosphate","Acta Crystallographica Section E","2007","63","6","m1698","m1699","10.1107/S160053680702421X","","","0.71073","MoKα","","0.0547","0.036","","0.0577","0.0406","0.0406","","","","","","1.1079","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213704","8.8","0.001","15.201","0.002","7.372","0.001","90","","98.469","0.003","90","","975.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Allyloxy-5-chlorobenzoic acid","","- C10 H9 Cl O3 -","- C10 H9 Cl O3 -","- C40 H36 Cl4 O12 -","4","1","BT2372","Ferreira, Valquiria B. N.; Bortoluzzi, Adailton J.; Kirby, Anthony J.; Nome, Faruk","2-Allyloxy-5-chlorobenzoic acid","Acta Crystallographica Section E","2007","63","6","o2981","o2981","10.1107/S1600536807024762","","","0.71069","MoKα","","0.0585","0.0441","","","0.1164","0.1246","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213705","6.751","0.0007","10.495","0.001","30.286","0.003","90","","90","","90","","2145.8","0.4","300","2","300","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","Sodium N-Bromo-4-Chlorobenzenesulfonamide sesquihydrate","","- C6 H7 Br Cl N Na O3.5 S -","- C6 H7 Br Cl N Na O3.5 S -","- C48 H56 Br8 Cl8 N8 Na8 O28 S8 -","8","2","BT2373","B. Thimme Gowda; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","Sodium <i>N</i>-bromo-4-chlorobenzenesulfonamidate sesquihydrate","Acta Crystallographica Section E","2007","63","6","m1647","m1648","10.1107/S1600536807024531","","","0.71073","MoKα","","0.0494","0.0447","","","0.1001","0.1027","","","","","","1.056","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213706","11.77","0.003","11.765","0.004","16.137","0.003","90","","90.61","0.02","90","","2234.4","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Di-μ~2~-acetato-bis{μ~2~-1,1'-[propane-1,3-diylbis(nitrilomethylidyne)]di- 2-naphtholato}tricobalt(II)","","- C54 H46 Co3 N4 O8 -","- C54 H46 Co3 N4 O8 -","- C108 H92 Co6 N8 O16 -","2","0.5","BT2376","Yun-Peng Diao; Shan-Shan Huang; Hou-Li Zhang; Sa Deng; Ke-Xin Liu","Di-μ~2~-acetato-bis{μ~2~-1,1'-[propane-1,3-diylbis(nitrilomethylidyne)]di-2-naphtholato}tricobalt(II)","Acta Crystallographica Section E","2007","63","6","m1694","m1694","10.1107/S160053680702497X","","","0.71073","MoKα","","0.0651","0.041","","","0.0774","0.0834","","","","","","0.859","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213707","10.932","0.003","8.027","0.002","18.948","0.006","90","","98.001","0.006","90","","1646.5","0.8","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(2-aminopyridine-κN^1^)(nitrato-κO)silver(I)","","- C15 H18 Ag N7 O3 -","- C15 H18 Ag N7 O3 -","- C60 H72 Ag4 N28 O12 -","4","1","BV2049","Samuel Robinson Jebas; Balasubramanian, T.; Alexandra M. Z. Slawin","Tris(2-aminopyridine-κ<i>N</i>^1^)(nitrato-κ<i>O</i>)silver(I)","Acta Crystallographica Section E","2007","63","6","m1624","m1626","10.1107/S1600536807018521","","","0.71073","MoKα","","","0.0282","","","","0.0668","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213708","34.035","0.003","8.4017","0.0009","7.4385","0.0005","90","","90.305","0.006","90","","2127","0.3","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,5-Bis(3,4,5-trimethoxyphenyl)penta-1,4-dien-3-one 1.333-hydrate‒1,5- bis(3-bromo-4,5-dimethoxyphenyl)penta-1,4-dien-3-one 1.333-hydrate 0.919(3):0.081(3) cocrystal","","- C22.84 H28.18 Br0.16 O8.17 -","- C22.838 H25.514 Br0.162 O8.158 -","- C91.352 H102.056 Br0.648 O32.632 -","4","0.5","BV2056","Ravindra, H. J.; Dharmaprakash, S. M.; Harrison, William T. A.","1,5-Bis(3,4,5-trimethoxyphenyl)penta-1,4-dien-3-one 1.333-hydrate‒1,5-bis(3-bromo-4,5-dimethoxyphenyl)penta-1,4-dien-3-one 1.333-hydrate 0.919(3):0.081(3) cocrystal","Acta Crystallographica Section E","2007","63","6","o2877","o2879","10.1107/S1600536807021551","","","0.71073","MoKα","","0.1382","0.0642","","","0.1313","0.1581","","","","","","1.055","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213709","20.8","0.011","6.45","0.003","13.566","0.007","90","","106.593","0.009","90","","1744.2","1.5","293","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(4-aminobenzenesulfonato-κN)tetraaquanickel(II)","","- C12 H20 N2 Ni O10 S2 -","- C12 H20 N2 Ni O10 S2 -","- C48 H80 N8 Ni4 O40 S8 -","4","0.5","BV2057","Jun Zhao; Zhen-Hua Dang; Yong-Jing Wang; Ya-Zhen Ye; Li Xu","Bis(4-aminobenzenesulfonato-κ<i>N</i>)tetraaquanickel(II)","Acta Crystallographica Section E","2007","63","6","m1773","m1773","10.1107/S1600536807025512","","","0.71073","MoKα","","0.0387","0.0304","","","0.0666","0.0912","","","","","","1.004","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213710","12.218","0.002","10.928","0.002","16.757","0.003","90","","90","","90","","2237.4","0.7","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-(3-Pyridylmethyl)salicylamide","","- C13 H12 N2 O2 -","- C13 H12 N2 O2 -","- C104 H96 N16 O16 -","8","1","BX2076","Ke-Wei Lei; Jian-Li Lin; Xiao-hui Wen; Yun-Song Zhou","<i>N</i>-(3-Pyridylmethyl)salicylamide","Acta Crystallographica Section E","2007","63","6","o3007","o3007","10.1107/S1600536807022969","","","0.71073","MoKα","","0.0514","0.0468","","","0.1235","0.1276","","","","","","1.115","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2213711","13.846","0.0004","5.3527","0.0001","15.9052","0.0004","90","","101.31","0.001","90","","1155.9","0.05","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-[(2,5-Dioxopyrrolidin-1-yl)(phenyl)methyl]urea","","- C12 H13 N3 O3 -","- C12 H13 N3 O3 -","- C48 H52 N12 O12 -","4","1","BX2077","Rajeswari, S.; Venkatesa Prabhu, G.; Krishnakumar, K.; Ramkumar, V.; Babu Varghese","1-[(2,5-Dioxopyrrolidin-1-yl)(phenyl)methyl]urea","Acta Crystallographica Section E","2007","63","6","o2929","o2929","10.1107/S1600536807022799","","","0.71073","MoKα","","0.0495","0.0361","","","0.0815","0.089","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213712","9.98","0.0017","15.42","0.003","20.461","0.004","90","","97.021","0.003","90","","3125.2","1","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(μ-trans-1,2-Di-4-pyridylethylene-κ^2^N:N')bis[(bipyridine- κ^2^N,N')(triphenylphosphine-κP)copper(I)] bis(tetrafluoroborate)","","- C68 H56 B2 Cu2 F8 N6 P2 -","- C68 H56 B2 Cu2 F8 N6 P2 -","- C136 H112 B4 Cu4 F16 N12 P4 -","2","0.5","BX2080","Chen, Ji-Shu; Liu, Pin-Hua; Fu, Wen-Fu","(μ-<i>trans</i>-1,2-Di-4-pyridylethylene-κ^2^<i>N</i>:<i>N</i>')bis[(bipyridine-κ^2^<i>N</i>,<i>N</i>')(triphenylphosphine-κ<i>P</i>)copper(I)] bis(tetrafluoroborate)","Acta Crystallographica Section E","2007","63","6","m1689","m1689","10.1107/S1600536807021046","","","0.71073","MoKα","","0.0816","0.0563","","","0.1359","0.1508","","","","","","1.021","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213713","5.443","0.005","21.437","0.005","14.108","0.005","90","","91.037","0.005","90","","1645.9","1.7","160","1","160","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","di-2-furylpiperidin-4-one","t-3-Benzyl-r-2,c-6-di-2-furylpiperidin-4-one","","- C20 H19 N O3 -","- C20 H19 N O3 -","- C80 H76 N4 O12 -","4","1","BX2081","Thiruvalluvar, A.; Balamurugan, S.; Jayabharathi, J.; Manimekalai, A.","<i>t</i>-3-Benzyl-<i>r</i>-2,<i>c</i>-6-di-2-furylpiperidin-4-one","Acta Crystallographica Section E","2007","63","6","o2910","o2910","10.1107/S1600536807023112","","","0.71073","MoKα","","0.1088","0.0708","","","0.1952","0.2264","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213715","7.9776","0.0011","13.2767","0.0019","21.054","0.003","90","","90.502","0.002","90","","2229.9","0.5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Piperazinediium bis(pyridine-2,6-dicarboxylato)nickelate(II) tetrahydrate","","- C18 H26 N4 Ni O12 -","- C18 H26 N4 Ni O12 -","- C72 H104 N16 Ni4 O48 -","4","1","BX2084","Aghabozorg, Hossein; Attar Gharamaleki, Jafar; Ghasemikhah, Pouya; Ghadermazi, Mohammad; Soleimannejad, Janet","Piperazinediium bis(pyridine-2,6-dicarboxylato)nickelate(II) tetrahydrate","Acta Crystallographica Section E","2007","63","6","m1710","m1711","10.1107/S1600536807023367","","","0.71073","MoKα","","0.0635","0.0379","","","0.0861","0.094","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213716","7.5057","0.0002","10.8272","0.0004","14.6167","0.0005","106.782","0.002","97.78","0.002","92.89","0.001","1121.75","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Tris(1-naphthyl) phosphite","","- C30 H21 O3 P -","- C30 H21 O3 P -","- C60 H42 O6 P2 -","2","1","CF2097","Kirsten, Leo; Steyl, Gideon; Roodt, Andreas","Tris(1-naphthyl) phosphite","Acta Crystallographica Section E","2007","63","6","o2828","o2830","10.1107/S1600536807019629","","","0.71073","MoKα","","0.052","0.04","","","0.099","0.106","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213717","10.987","0.0018","7.284","0.0014","12.5885","0.0013","90","","115.591","0.009","90","","908.6","0.3","297","2","297","2","","","","","","","","5","P 1 21 1","P 2yb","4","4-thioxopyrimidine","Ethyl 1-butyl-6-methyl-2-phenyl-4-thioxo-1,4-dihydropyrimidine-5-carboxylate","","- C18 H22 N2 O2 S -","- C18 H22 N2 O2 S -","- C36 H44 N4 O4 S2 -","2","1","CF2100","Sabino, José R.; Vencato, Ivo; Bastos, Rodrigo M.; Cunha, Silvio","Ethyl 1-butyl-6-methyl-2-phenyl-4-thioxo-1,4-dihydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","6","o2852","o2852","10.1107/S1600536807019964","","","1.5418","CuKα","","","0.0521","","","","0.1355","","","","","","1.086","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213718","11.3833","0.0014","10.4303","0.0017","12.8157","0.0014","90","","106.944","0.009","90","","1455.6","0.3","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-thioxopyrimidine","1-[1-(2-Hydroxyethyl)-6-methyl-2-phenyl-4-thioxo-1,4-dihydropyrimidin-5-yl]- 1-ethanone","","- C15 H16 N2 O2 S -","- C15 H16 N2 O2 S -","- C60 H64 N8 O8 S4 -","4","1","CF2101","Sabino, José R.; Lariucci, Carlito; Bastos, Rodrigo M.; Cunha, Silvio","1-[1-(2-Hydroxyethyl)-6-methyl-2-phenyl-4-thioxo-1,4-dihydropyrimidin-5-yl]-1-ethanone","Acta Crystallographica Section E","2007","63","6","o2850","o2850","10.1107/S1600536807019940","","","1.5418","CuKα","","","0.0541","","","","0.2122","","","","","","1.14","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213719","8.2262","0.0015","11.0683","0.0018","11.112","0.002","60.317","0.015","74.555","0.016","69.765","0.016","819.1","0.3","297","2","","","","","","","","","","5","P -1","-P 1","2","","ethyl 1-(2-hydroxyethyl)-6-methyl-2-phenyl-4-thioxo-1,4-dihydropyrimidine- 5-carboxylate","","- C16 H18 N2 O3 S -","- C16 H18 N2 O3 S -","- C32 H36 N4 O6 S2 -","2","1","CF2102","Sabino, José R.; Vencato, Ivo; Bastos, Rodrigo M.; Cunha, Silvio","Ethyl 1-(2-hydroxyethyl)-6-methyl-2-phenyl-4-thioxo-1,4-dihydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","6","o2851","o2851","10.1107/S1600536807019952","","","1.5418","CuKα","","","0.0609","","","","0.1563","","","","","","1.182","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213720","8.783","0.004","9.064","0.004","10.576","0.005","75.156","0.005","83.105","0.006","61.848","0.005","717.6","0.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Hexakis(1H-imidazole-κN^3^)copper(II) dichloride tetrahydrate","","- C18 H32 Cl2 Cu N12 O4 -","- C18 H32 Cl2 Cu N12 O4 -","- C18 H32 Cl2 Cu N12 O4 -","1","0.5","CF2104","Yang, Yu-Min; Zhu, Tao-Tao; Lu, Peng-Cheng; Liu, Chang-Hong","Hexakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II) dichloride tetrahydrate","Acta Crystallographica Section E","2007","63","6","m1657","m1658","10.1107/S1600536807022684","","","0.71073","MoKα","","0.056","0.0498","","","0.1434","0.1504","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213721","7.517","0.004","6.819","0.003","22.574","0.011","90","","98.626","0.007","90","","1144","1","113","2","113","2","","","","","","","","6","P 1 21 1","P 2yb","4","","3-(Dimethoxythiophosphorylamido)-2-(2',3',4'-tri-O-acetyl-β-D- xylopyranos-1'-ylimino)-1,3-thiazolidin-4-one","","- C16 H24 N3 O10 P S2 -","- C16 H24 N3 O10 P S2 -","- C32 H48 N6 O20 P2 S4 -","2","1","CI2346","Cheng, Hai-Ying; Li, Yu-Xin; Wang, Xian-An; Li, Zheng-Ming; Song, Hai-Bin","3-(Dimethoxythiophosphorylamido)-2-(2',3',4'-tri-<i>O</i>-acetyl-β-<small>D</small>-xylopyranos-1'-ylimino)-1,3-thiazolidin-4-one","Acta Crystallographica Section E","2007","63","6","o2861","o2862","10.1107/S1600536807016558","","","0.7107","MoKα","","0.0485","0.0404","","","0.0796","0.0844","","","","","","1.015","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213722","16.332","0.002","16.344","0.002","6.5957","0.0012","90","","90","","90","","1760.6","0.4","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","4-Hydroxy-3-iodo-5-methoxybenzaldehyde","","- C8 H7 I O3 -","- C8 H7 I O3 -","- C64 H56 I8 O24 -","8","1","CI2356","Zhou, Qing-Li; Wang, Chang-Lu; Jing, Zuo-Liang","4-Hydroxy-3-iodo-5-methoxybenzaldehyde","Acta Crystallographica Section E","2007","63","6","o2795","o2795","10.1107/S1600536807020983","","","0.71073","MoKα","","0.0311","0.0221","","","0.0493","0.0529","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213723","16.617","0.002","4.7788","0.0004","21.169","0.003","90","","128.964","0.009","90","","1307.1","0.3","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E)-4-Methyl-2-[3-(trifluoromethyl)phenyliminomethyl]phenol","","- C15 H12 F3 N O -","- C15 H12 F3 N O -","- C60 H48 F12 N4 O4 -","4","1","CI2361","Gül, Zarife Sibel; Erşahi̇n, Ferda; Aǧar, Erbi̇l; Işık, Şamil","(<i>E</i>)-4-Methyl-2-[3-(trifluoromethyl)phenyliminomethyl]phenol","Acta Crystallographica Section E","2007","63","6","o2854","o2854","10.1107/S1600536807017655","","","0.71073","MoKα","","0.1166","0.0489","","","0.1245","0.1442","","","","","","0.825","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213724","12.162","0.001","15.377","0.002","16.132","0.001","90","","90.938","0.002","90","","3016.5","0.5","140.2","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(Bipyridyl-κ^2^N,N')bis(η^5^-pentamethylcyclopentadienyl) (trifluoromethanesulfonato-κO)cerium(III)","","- C31 H38 Ce F3 N2 O3 S -","- C31 H38 Ce F3 N2 O3 S -","- C124 H152 Ce4 F12 N8 O12 S4 -","4","1","CI2372","Daniel Kazhdan; Wayne A. Chomitz; William H. Harman; Trisha M. Hoette; Cheol-Hwan Park","(Bipyridyl-κ^2^<i>N</i>,<i>N</i>')bis(η^5^-pentamethylcyclopentadienyl)(trifluoromethanesulfonato-κ<i>O</i>)cerium(III)","Acta Crystallographica Section E","2007","63","6","m1656","m1656","10.1107/S1600536807022209","","","0.7107","MoKα","","0.0616","0.0348","","0.0471","","0.0406","","","","","","1.375","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213725","15.707","0.006","9.227","0.004","12.198","0.005","90","","101.575","0.006","90","","1731.9","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2-Dimethyl-5-phenyl-4-oxa-1-aza-6,7:8,9-dibenzobicyclo[3.2.2]nonane","","- C23 H21 N O -","- C23 H21 N O -","- C92 H84 N4 O4 -","4","1","CI2373","Wang, Min; Xu, Jing; Su, Wei-Ping","2,2-Dimethyl-5-phenyl-4-oxa-1-aza-6,7:8,9-dibenzobicyclo[3.2.2]nonane","Acta Crystallographica Section E","2007","63","6","o2794","o2794","10.1107/S1600536807021198","","","0.71073","MoKα","","0.0623","0.0481","","","0.1084","0.1166","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213726","9.9667","0.0006","12.6544","0.0008","18.9142","0.0012","90","","90","","90","","2385.5","0.3","223","2","223","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","7,7-Dimethyl-2-phenyl-6,7-dihydro-1,2,4-triazolo[1,5-<i>a</i>][1,3,5]triazin- 5-amine","","- C12 H14 N6 -","- C12 H14 N6 -","- C96 H112 N48 -","8","1","CI2379","Dolzhenko, Anton V.; Tan, Geok Kheng; Koh, Lip Lin; Dolzhenko, Anna V.; Chui, Wai Keung","7,7-Dimethyl-2-phenyl-6,7-dihydro-1,2,4-triazolo[1,5-<i>a</i>][1,3,5]triazin-5-amine","Acta Crystallographica Section E","2007","63","6","o2796","o2796","10.1107/S1600536807021009","","","0.71073","MoKα","","0.0597","0.0506","","","0.1197","0.126","","","","","","1.108","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213727","9.7224","0.0005","11.9752","0.0006","12.4432","0.0006","112.2","0.001","103.737","0.001","104.161","0.001","1209.58","0.11","223","2","223","2","","","","","","","","3","P -1","-P 1","2","","7-amine","","- C12 H14 N6 -","- C12 H14 N6 -","- C48 H56 N24 -","4","2","CI2380","Dolzhenko, Anton V.; Tan, Geok Kheng; Koh, Lip Lin; Dolzhenko, Anna V.; Chui, Wai Keung","5,5-Dimethyl-2-phenyl-4,5-dihydro-1,2,4-triazolo[1,5-<i>a</i>][1,3,5]triazin-7-amine","Acta Crystallographica Section E","2007","63","6","o2797","o2797","10.1107/S1600536807021022","","","0.71073","MoKα","","0.0553","0.046","","","0.1156","0.1214","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213728","13.5978","0.0005","8.0656","0.0003","11.4128","0.0004","90","","109.238","0.002","90","","1181.8","0.08","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Hydroxy-N'-[(E)-(2-hydroxyphenyl)methylidene]benzohydrazide","","- C14 H12 N2 O3 -","- C14 H12 N2 O3 -","- C56 H48 N8 O12 -","4","1","CI2382","Abdussalam Salhin; Abdassalam Abdelhafiz Tameem; Bahruddin Saad; Shea-Lin Ng; Hoong-Kun Fun","4-Hydroxy-<i>N</i>'-[(<i>E</i>)-(2-hydroxyphenyl)methylidene]benzohydrazide","Acta Crystallographica Section E","2007","63","6","o2880","o2880","10.1107/S1600536807021745","","","0.71073","MoKα","","0.0531","0.0436","","","0.1254","0.138","","","","","","1.069","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213729","8.9627","0.0013","20.721","0.003","8.0865","0.0012","90","","103.304","0.002","90","","1461.5","0.4","297","2","297","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 0.58-bromide 0.42-iodide","","- C15 H16 Br0.58 I0.42 N O2 -","- C15 H16 Br0.58 I0.42 N O2 -","- C60 H64 Br2.32 I1.68 N4 O8 -","4","1","CI2384","Suchada Chantrapromma; Hoong-Kun Fun","4-(4'-Hydroxy-3'-methoxystyryl)-1-methylpyridinium 0.58-bromide 0.42-iodide","Acta Crystallographica Section E","2007","63","6","o2882","o2883","10.1107/S1600536807022076","","","0.71073","MoKα","","0.0788","0.072","","","0.2098","0.2159","","","","","","1.076","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213730","8.2054","0.0016","9.1736","0.0018","17.846","0.004","90","","90","","90","","1343.3","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Poly[bis[μ~2~-5-(pyrimidin-2-yl)tetrazolato]nickel(II)]","","- C10 H6 N12 Ni -","- C10 H6 N12 Ni -","- C40 H24 N48 Ni4 -","4","0.5","CI2385","Liu, Ju-Tao; Fan, Sheng-Di","Poly[bis[μ~2~-5-(pyrimidin-2-yl)tetrazolato]nickel(II)]","Acta Crystallographica Section E","2007","63","6","m1632","m1632","10.1107/S1600536807021976","","","0.71073","MoKα","","0.0663","0.0533","","","0.0993","0.1051","","","","","","1.198","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213731","12.0499","0.0009","11.3964","0.0007","16.4446","0.0011","90","","104.579","0.002","90","","2185.5","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Pyridinium aquapyridinebis(salicylato-κ^2^O,O')manganese(III)","","- C24 H21 Mn N2 O7 -","- C24 H21 Mn N2 O7 -","- C96 H84 Mn4 N8 O28 -","4","1","CS2025","Wang, Hui-Sheng; Ma, Cheng-Bing; Wang, Mei; Chen, Chang-Neng; Liu, Qiu-Tian","Pyridinium aquapyridinebis(salicylato-κ^2^<i>O</i>,<i>O</i>')manganese(III)","Acta Crystallographica Section E","2007","63","6","m1616","m1618","10.1107/S1600536807015267","","","0.71073","MoKα","","0.0711","0.0479","","","0.1107","0.1221","","","","","","1.08","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2213732","6.9869","0.0003","18.3967","0.0008","8.2995","0.0004","90","","113.617","0.001","90","","977.43","0.08","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Bis(propane-1,3-diaminium) benzene-1,2,4,5-tetracarboxylate dihydrate","","- C16 H30 N4 O10 -","- C16 H30 N4 O10 -","- C32 H60 N8 O20 -","2","1","CS2033","Aghabozorg, Hossein; Ghadermazi, Mohammad; Sheshmani, Shabnam; Attar Gharamaleki, Jafar","Bis(propane-1,3-diaminium) benzene-1,2,4,5-tetracarboxylate dihydrate","Acta Crystallographica Section E","2007","63","6","o2985","o2986","10.1107/S1600536807023999","","","0.71073","MoKα","","0.026","0.0256","","","0.0674","0.0676","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213733","7.1686","0.0005","9.772","0.0006","10.3293","0.0007","94.904","0.001","104.613","0.001","109.257","0.001","649.63","0.07","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Thiosemicarbazidium picrate monohydrate","","- C7 H10 N6 O8 S -","- C7 H10 N6 O8 S -","- C14 H20 N12 O16 S2 -","2","1","CS2034","Xie, Zhi-Yuan","Thiosemicarbazidium picrate monohydrate","Acta Crystallographica Section E","2007","63","6","o2957","o2958","10.1107/S1600536807024002","","","0.71073","Mokα","","0.0473","0.0444","","","0.1284","0.1372","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213734","7.167","0.003","9.505","0.004","11.647","0.004","90","","90.423","0.005","90","","793.4","0.5","213","2","213","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","6,6-dimethylamino-6-methylfulvene","Dimethyl[1-(pentadienylidene)ethyl]amine","","- C9 H13 N -","- C9 H13 N -","- C36 H52 N4 -","4","1","CV2228","Duan, Xine; Tong, Hong-Bo; Bai, Sheng-Di","Dimethyl[1-(pentadienylidene)ethyl]amine","Acta Crystallographica Section E","2007","63","6","o2855","o2856","10.1107/S1600536807017588","","","0.71073","MoKα","","0.0876","0.0732","","","0.1488","0.1552","","","","","","1.213","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213735","9.905","0.003","10.335","0.003","12.094","0.003","82.701","0.003","70.742","0.003","89.236","0.003","1158.8","0.6","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","[2-(3-Methoxy-2-oxidobenzylideneamino)phenolato-κ^3^O,N,O'](1,10- phenanthroline-κ^2^N,N')copper(II) methanol solvate","","- C27 H23 Cu N3 O4 -","- C27 H23 Cu N3 O4 -","- C54 H46 Cu2 N6 O8 -","2","1","CV2231","Jian-Fang Dong; Lianzhi Li; Zhi-Zhen Ji; Hui Cui; Da-Qi Wang","[2-(3-Methoxy-2-oxidobenzylideneamino)phenolato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'](1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) methanol solvate","Acta Crystallographica Section E","2007","63","6","m1578","m1578","10.1107/S1600536807020867","","","0.71073","MoKα","","0.0582","0.0396","","","0.0877","0.0963","","","","","","1.026","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213736","13.583","0.008","8.237","0.004","11.499","0.008","90","","109.53","0.02","90","","1212.5","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N'-(2-hydroxybenzylidene)-4-hydroxybenzohydrazide","","- C14 H12 N2 O3 -","- C14 H12 N2 O3 -","- C56 H48 N8 O12 -","4","1","CV2237","Lin, Xu-Cong; Yin, Hua; Lin, Yun","4-Hydroxy-<i>N</i>'-(2-hydroxybenzylidene)benzohydrazide","Acta Crystallographica Section E","2007","63","6","o2864","o2864","10.1107/S1600536807021277","","","0.71073","MoKα","","0.143","0.0581","","","0.1036","0.1271","","","","","","0.989","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213737","11.6611","0.0003","12.4948","0.0004","12.0089","0.0003","90","","117.308","0.001","90","","1554.73","0.08","160","1","160","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","diphenylpiperidin-4-ol","3-Ethyl-2,6-diphenylpiperidin-4-ol","","- C19 H23 N O -","- C19 H23 N O -","- C76 H92 N4 O4 -","4","1","CV2239","Thiruvalluvar, A.; Balamurugan, S.; Jayabharathi, J.; Manimekalai, A.; Rajarajan, G.","3-Ethyl-2,6-diphenylpiperidin-4-ol","Acta Crystallographica Section E","2007","63","6","o2886","o2886","10.1107/S1600536807022131","","","0.71073","MoKα","","0.1001","0.0752","","","0.1805","0.1934","","","","","","1.127","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213738","8.0084","0.0016","13.095","0.003","7.2958","0.0015","90","","97.18","0.03","90","","759.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis[5-(pyrimidin-2-yl)tetrazolato]manganese(II)","","- C10 H10 Mn N12 O2 -","- C10 H10 Mn N12 O2 -","- C20 H20 Mn2 N24 O4 -","2","0.5","CV2240","Liu, Ju-Tao; Fan, Sheng-Di","Diaquabis[5-(pyrimidin-2-yl)tetrazolato]manganese(II)","Acta Crystallographica Section E","2007","63","6","m1628","m1628","10.1107/S1600536807021885","","","0.71073","MoKα","","0.0371","0.0288","","","0.0721","0.0763","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213739","10.0302","0.0006","12.4995","0.0008","12.4665","0.0008","90","","111.32","0.001","90","","1455.99","0.16","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Piperazinium aquabis(oxalato)oxidovanadate(IV) dihydrate","","- C8 H18 N2 O12 V -","- C8 H18 N2 O12 V -","- C32 H72 N8 O48 V4 -","4","1","CV2241","Aghabozorg, Hossein; Motyeian, Elham; Aghajani, Zahra; Ghadermazi, Mohammad; Attar Gharamaleki, Jafar","Piperazinium aquabis(oxalato)oxidovanadate(IV) dihydrate","Acta Crystallographica Section E","2007","63","6","m1754","m1755","10.1107/S1600536807023616","","","0.71073","MoKα","","0.0563","0.039","","","0.0927","0.1029","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213740","14.252","0.003","17.312","0.003","8.82","0.004","90","","90","","90","","2176.2","1.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","6α-cinnamoyloxyeudesman15 oic acid","(1R,4aS,7R,8S,E)-8-cinnamoxyloxy-7-isopropyl-4a-methyldecahydronaphthalene- 1-carboxylic acid","","- C24 H32 O4 -","- C24 H32 O4 -","- C96 H128 O16 -","4","1","CV2242","Murillo, Renato; Briceño, Alexander; Mora, Asiloé J.; Delgado, Gerzon E.","6α-Cinnamoyloxyeudesman-15-oic acid","Acta Crystallographica Section E","2007","63","6","o2951","o2951","10.1107/S160053680702301X","","","0.71069","MoKα","","0.0977","0.045","","","0.0799","0.098","","","","","","1.012","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213741","9.0451","0.0012","15.997","0.002","12.1753","0.0016","90","","100.91","0.002","90","","1729.9","0.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di-μ-acetato-bis[triaquabis(thiocyanato-κN)(4-methylpyridine N-oxide-κO)samarium(III)]","","- C20 H32 N6 O12 S4 Sm2 -","- C20 H32 N6 O12 S4 Sm2 -","- C40 H64 N12 O24 S8 Sm4 -","2","0.5","CV2243","Zhang, Shi-Guo; Shi, Jing-Min","Di-μ-acetato-bis[triaquabis(thiocyanato-κ<i>N</i>)(4-methylpyridine <i>N</i>-oxide-κ<i>O</i>)samarium(III)]","Acta Crystallographica Section E","2007","63","6","m1775","m1776","10.1107/S1600536807025561","","","0.71073","MoKα","","0.0306","0.0276","","","0.0662","0.0678","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213742","14.09","0.003","5.2504","0.0011","14.28","0.003","90","","92.6","0.03","90","","1055.3","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(5-methyl-3-phenylisoxazol-4-yl)ethanone","","- C12 H11 N O2 -","- C12 H11 N O2 -","- C48 H44 N4 O8 -","4","1","CV2244","Zheng-Feng Xie; Xue-Xia Mo; Xue-Li Mo; Fang-Ming Liu","1-(5-Methyl-3-phenylisoxazol-4-yl)ethanone","Acta Crystallographica Section E","2007","63","6","o3010","o3010","10.1107/S1600536807024415","","","0.71073","MoKα","","0.0982","0.0613","","","","0.2565","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213743","5.3788","0.0005","8.7492","0.0008","15.12","0.001","78.14","0.002","85.231","0.002","83.248","0.002","690.26","0.1","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","5-Methyl-3-methylsulfinyl-2-phenyl-1-benzofuran","","- C16 H14 O2 S -","- C16 H14 O2 S -","- C32 H28 O4 S2 -","2","1","CV2245","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","5-Methyl-3-methylsulfinyl-2-phenyl-1-benzofuran","Acta Crystallographica Section E","2007","63","6","o2922","o2922","10.1107/S1600536807024269","","","0.71073","MoKα","","0.0464","0.0397","","","0.1085","0.1142","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213744","20.125","0.002","16.7778","0.0018","16.6491","0.0018","90","","105.051","0.002","90","","5428.8","1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>N</i>-Phenyl-2-{2'-[(phenylethylcarbamoyl)methoxy]biphenyl-2-yloxy}- <i>N</i>-ethylacetamide-κ^4^<i>O</i>)(2,4,6-trinitrophenolato-κ<i>O</i>) bis(2,4,6-trinitrophenolato-κ^2^<i>O</i>,<i>O</i>')gadolinium(III)","","- C50 H38 Gd N11 O25 -","- C50 H38 Gd N11 O25 -","- C200 H152 Gd4 N44 O100 -","4","1","DN2162","Yan-Ling Guo; Ya-Wen Wang; Wei Dou; Wei-Sheng Liu; Da-Qi Wang","(<i>N</i>-Phenyl-2-{2'-[(phenylethylcarbamoyl)methoxy]biphenyl-2-yloxy}-<i>N</i>-ethylacetamide-κ^4^<i>O</i>)(2,4,6-trinitrophenolato-κ<i>O</i>)bis(2,4,6-trinitrophenolato-κ^2^<i>O</i>,<i>O</i>')gadolinium(III)","Acta Crystallographica Section E","2007","63","6","m1619","m1620","10.1107/S160053680702137X","","","0.71073","MoKα","","0.0713","0.0361","","","0.0686","0.0865","","","","","","1.083","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213745","10.9563","0.0014","6.4983","0.0008","23.589","0.003","90","","90","","90","","1679.5","0.4","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Dimethyl 1<i>H</i>-pyrazole-3,5-dicarboxylate","","- C7 H8 N2 O4 -","- C7 H8 N2 O4 -","- C56 H64 N16 O32 -","8","1","DN2164","Jun-Ping Xiao; Qing-Xiang Zhou; Jia-Hongwen Tu","Dimethyl 1<i>H</i>-pyrazole-3,5-dicarboxylate","Acta Crystallographica Section E","2007","63","6","o2785","o2785","10.1107/S1600536807019642","","","0.71073","MoKα","","0.0593","0.0443","","","0.0994","0.1063","","","","","","0.966","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213746","9.418","0.0019","28.141","0.006","6.029","0.0012","90","","101.83","0.03","90","","1563.9","0.6","295","","295","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","[2,3-DMeQH2][PbBr4]","<i>catena</i>-poly[bis(2,3-dimethylquinoxalinium) [[di-μ~2~-bromido-bis[dibromoplumbate(II)]]-di-μ~2~-bromido]]","","- C10 H12 Br4 N2 Pb -","- C20 H24 Br8 N4 Pb2 -","- C40 H48 Br16 N8 Pb4 -","2","0.25","DN2167","Ali, Basem Fares; Al-Far, Rawhi; Haddad, Salim","A lead‒halide ladder complex: <i>catena</i>-poly[bis(2,3-dimethylquinoxalinium) [[di-μ~2~-bromido-bis[dibromoplumbate(II)]]-di-μ~2~-bromido]]","Acta Crystallographica Section E","2007","63","6","m1569","m1569","10.1107/S1600536807021186","","","0.71073","MoKα","","0.0732","0.0544","","","0.117","0.1233","","","","","","0.731","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213747","9.565","0.004","10.171","0.004","14.555","0.005","73.634","0.004","76.032","0.004","70.916","0.004","1266.4","0.8","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","(2,2'-Bipyridine-κ^2^N,N')(nitrato-κ^2^O,O')bis(pyrrolidine-1- dithiocarboxylato-κ^2^<i>S</i>,<i>S</i>')bismuth(III)","","- C20 H24 Bi N5 O3 S4 -","- C20 H24 Bi N5 O3 S4 -","- C40 H48 Bi2 N10 O6 S8 -","2","1","DN2168","Feng Li; Han-Dong Yin; Da-Qi Wang","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')(nitrato-κ^2^<i>O</i>,<i>O</i>')bis(pyrrolidine-1-dithiocarboxylato-κ^2^<i>S</i>,<i>S</i>')bismuth(III)","Acta Crystallographica Section E","2007","63","6","m1577","m1577","10.1107/S1600536807021137","","","0.71073","MoKα","","0.0805","0.0633","","","0.1524","0.1632","","","","","","0.993","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213748","25.3638","0.0009","7.1591","0.0002","22.1688","0.0007","90","","91.263","0.001","90","","4024.5","0.2","298","1","298","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>rac</i>-5-Chloromethyl-3-(3-chloro-2-methylphenyl)-2,2-diphenyloxazolidine","","- C23 H21 Cl2 N O -","- C23 H21 Cl2 N O -","- C184 H168 Cl16 N8 O8 -","8","1","DN2169","Chuan-Ming Yu; Xiao-Ping Dai; Zhen-Yuan Xu; Guo-Wu Rao","<i>rac</i>-5-Chloromethyl-3-(3-chloro-2-methylphenyl)-2,2-diphenyloxazolidine","Acta Crystallographica Section E","2007","63","6","o2935","o2935","10.1107/S1600536807022738","","","0.71073","MoKα","","0.0502","0.0435","","","0.1264","0.1308","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213749","8.2608","0.0012","8.3865","0.0012","9.9672","0.0014","90","","91.311","0.002","90","","690.34","0.17","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Hydroxymethyl-3,5-dimethyl-1H-pyrazole","","- C6 H10 N2 O -","- C6 H10 N2 O -","- C24 H40 N8 O4 -","4","1","DN2170","Yan, Guo-Bing","4-Hydroxymethyl-3,5-dimethyl-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2007","63","6","o2889","o2889","10.1107/S1600536807021836","","","0.71073","MoKα","","0.054","0.0479","","","0.1405","0.1482","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213750","8.304","0.002","5.534","0.001","8.237","0.002","90","","111.36","0.03","90","","352.53","0.15","295","2","295","2","","","","","","","","5","P 1 c 1","P -2yc","7","","Benzenesulfonamide","","- C6 H7 N O2 S -","- C6 H7 N O2 S -","- C12 H14 N2 O4 S2 -","2","1","DN2171","B. Thimme Gowda; Roopa Nayak; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","Benzenesulfonamide","Acta Crystallographica Section E","2007","63","6","o2967","o2967","10.1107/S1600536807024221","","","0.71073","MoKα","","0.1037","0.0739","","","0.2301","0.2598","","","","","","1.006","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213751","7.028","0.002","16.059","0.003","10.492","0.003","90","","123.542","0.017","90","","987","0.5","299","2","299","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N,N,4-Trichlorobenzenesulfonamide","","- C6 H4 Cl3 N O2 S -","- C6 H4 Cl3 N O2 S -","- C24 H16 Cl12 N4 O8 S4 -","4","1","DN2172","B. Thimme Gowda; K. Jyothi; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","<i>N</i>,<i>N</i>,4-Trichlorobenzenesulfonamide","Acta Crystallographica Section E","2007","63","6","o2905","o2905","10.1107/S1600536807021848","","","0.71073","MoKα","","0.069","0.0517","","","0.1143","0.1288","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213752","11.2453","0.0011","7.1554","0.0007","17.3387","0.0016","90","","101.106","0.001","90","","1369","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[(di-2-pyridylamine-κ^2^N^2^,N^2'^)nickel(II)]- μ-carbonato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>''] trihydrate]","","- C11 H15 N3 Ni O6 -","- C11 H15 N3 Ni O6 -","- C44 H60 N12 Ni4 O24 -","4","1","DN2174","Xiu-Li You; Li-Hua Wang","<i>catena</i>-Poly[[[(di-2-pyridylamine-κ^2^<i>N</i>^2^,<i>N</i>^2'^)nickel(II)]-μ-carbonato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>''] trihydrate]","Acta Crystallographica Section E","2007","63","6","m1691","m1691","10.1107/S1600536807023185","","","0.71073","MoKα","","0.0379","0.0265","","","0.0607","0.063","","","","","","0.987","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213753","10.9045","0.0013","18.509","0.002","21.228","0.003","90","","90","","90","","4284.5","0.9","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","1-(benzoylmethyl)-4-[(2,4-dichlorobenzylidene)amino]-3-(2-thienylmethyl)- 4,5-dihydro-1<i>H</i>-1,2,4-triazol-5-one","","- C22 H16 Cl2 N4 O2 S -","- C22 H16 Cl2 N4 O2 S -","- C176 H128 Cl16 N32 O16 S8 -","8","1","DN2175","Ustabaş, Reşat; Çoruh, Ufuk; Sancak, Kemal; Ünver, Yasemin; Vázquez-López, Ezequiel M.","1-(Benzoylmethyl)-4-[(2,4-dichlorobenzylidene)amino]-3-(2-thienylmethyl)-4,5-dihydro-1<i>H</i>-1,2,4-triazol-5-one","Acta Crystallographica Section E","2007","63","6","o2982","o2983","10.1107/S1600536807024701","","","0.71073","MoKα","","0.2328","0.0494","","","0.0945","0.131","","","","","","0.836","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213754","5.557","0.001","7.628","0.0014","9.6139","0.0017","95.273","0.002","96.074","0.002","95.853","0.002","400.94","0.13","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","1,1'-(Butane-1,4-diyl)bis(imidazolium) bis(perchlorate)","","- C10 H16 Cl2 N4 O8 -","- C10 H16 Cl2 N4 O8 -","- C10 H16 Cl2 N4 O8 -","1","0.5","DN2176","Jing-Cai Yao; Li Zhang; Li Qu; Cong Liu; Wei Wang","1,1'-(Butane-1,4-diyl)bis(imidazolium) bis(perchlorate)","Acta Crystallographica Section E","2007","63","6","o3029","o3029","10.1107/S1600536807024889","","","0.71073","MoKα","","0.0369","0.0352","","","0.0941","0.0955","","","","","","1.141","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213755","10.521","0.003","6.76","0.002","14.853","0.004","90","","103.97","0.02","90","","1025.1","0.5","293","2","293","2","","","","","","","","7","C 1 2 1","C 2y","5","Bromamine-B","Sodium N-bromobenzenesulfonamidate sesquihydrate","","- C6 H8 Br N Na O3.5 S -","- C6 H8 Br N Na O3.5 S -","- C24 H32 Br4 N4 Na4 O14 S4 -","4","1","DN2177","B. Thimme Gowda; K. M. Usha; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","Sodium <i>N</i>-bromobenzenesulfonamidate sesquihydrate","Acta Crystallographica Section E","2007","63","6","m1739","m1740","10.1107/S1600536807025184","","","0.71073","MoKα","","0.0373","0.034","","","0.0848","0.0877","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213756","20.79","0.005","10.717","0.003","9.47","0.002","90","","102.952","0.004","90","","2056.3","0.9","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(±)-1-{[(4-Methoxybenzylidene)amino](4-methoxyphenyl)methyl}-2-naphthol","","- C26 H23 N O3 -","- C26 H23 N O3 -","- C104 H92 N4 O12 -","4","1","DN2180","Huang, Xian-Tong; Kan, Lin; Ji, Tao; Tang, Guo; Zhao, Yu-Fen","(±)-1-{[(4-Methoxybenzylidene)amino](4-methoxyphenyl)methyl}-2-naphthol","Acta Crystallographica Section E","2007","63","6","o3031","o3031","10.1107/S1600536807025214","","","0.71073","MoKα","","0.0815","0.0714","","","0.151","0.1562","","","","","","1.22","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213757","5.271","0.0001","8.0481","0.0002","9.7942","0.0002","106.155","0.001","97.265","0.001","101.649","0.002","383.422","0.015","293","2","293","2","","","","","","","","4","P 1","P 1","1","","L-Argininium(+) maleate(-) dihydrate","","- C10 H22 N4 O8 -","- C10 H22 N4 O8 -","- C10 H22 N4 O8 -","1","1","ER2026","Sun, Zhi-Hua; Yu, Wen-Tao; Fan, Jian-Dong; Xu, Dong; Wang, Xin-Qiang","<small>L</small>-Argininium(+) maleate({-}) dihydrate","Acta Crystallographica Section E","2007","63","6","o2805","o2807","10.1107/S1600536807020612","","","0.71073","MoKα","","0.0314","0.0303","","","0.0693","0.07","","","","","","1.012","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213758","10.527","0.002","11.611","0.003","11.872","0.003","105.096","0.004","115.367","0.004","93.651","0.004","1240.1","0.5","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","N^2^,N^4^,1-tribenzyl-2,5-dimethyl-3-oxopyrrolidine-2,4-dicarboxamide","","- C29 H29 N3 O3 -","- C29 H29 N3 O3 -","- C58 H58 N6 O6 -","2","1","EZ2072","Liang, Zu-Pei; Li, Jian; Yang, Hua","<i>N</i>^2^,<i>N</i>^4^,1-Tribenzyl-2,5-dimethyl-3-oxopyrrolidine-2,4-dicarboxamide","Acta Crystallographica Section E","2007","63","6","o2817","o2818","10.1107/S1600536807021290","","","0.71073","MoKα","","0.077","0.044","","","0.1","0.119","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213759","6.7897","0.0001","12.037","0.0002","37.8246","0.0006","90","","90","","90","","3091.31","0.08","173","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","β-Amyrin benzoate","","- C37 H54 O2 -","- C37 H54 O2 -","- C148 H216 O8 -","4","1","EZ2076","Perold, Guido W.; Black, Robert S.; Lemmerer, Andreas; Michael, Joseph P.; Otterlo, Willem A. L. van","β-Amyrin benzoate","Acta Crystallographica Section E","2007","63","6","o3032","o3033","10.1107/S1600536807025123","","","0.71073","MoKα","","0.041","0.039","","","0.099","0.101","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213760","9.5264","0.0005","8.6992","0.0004","21.9714","0.0011","90","","93.961","0.001","90","","1816.47","0.16","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3,5-Dimethyl-1-(triphenylmethyl)-1H-pyrazole","","- C24 H22 N2 -","- C24 H22 N2 -","- C96 H88 N8 -","4","1","FB2051","Guzei, Ilia A.; Keter, Frankline; Spencer, Lara C.; Darkwa, James","3,5-Dimethyl-1-(triphenylmethyl)-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2007","63","6","o2997","o2997","10.1107/S1600536807024336","","","0.71073","MoKα","","0.042","0.0349","","","0.0906","0.095","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213761","6.5351","0.0012","8.1108","0.0013","20.222","0.004","90","","98.387","0.004","90","","1060.4","0.3","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(2-Bromo-3-pyridyl)-3-methylbut-2-enamide","","- C10 H11 Br N2 O -","- C10 H11 Br N2 O -","- C40 H44 Br4 N8 O4 -","4","1","FJ2005","Walji, Dhiran V. B.; Storey, John M. D.; Harrison, William T. A.","<i>N</i>-(2-Bromo-3-pyridyl)-3-methylbut-2-enamide","Acta Crystallographica Section E","2007","63","6","o2815","o2816","10.1107/S1600536807012366","","","0.71073","MoKα","","0.0727","0.0451","","","0.1104","0.1254","","","","","","1.06","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213762","10.744","0.004","13.454","0.005","8.806","0.003","90","","97.012","0.006","90","","1263.4","0.8","302","2","302","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(2-aminopyrimidine-κN^1^)dichloridozinc(II)","","- C8 H10 Cl2 N6 Zn -","- C8 H10 Cl2 N6 Zn -","- C32 H40 Cl8 N24 Zn4 -","4","0.5","FJ2016","Lin, Zhi-Dong; Zeng, Wen","Bis(2-aminopyrimidine-κ<i>N</i>^1^)dichloridozinc(II)","Acta Crystallographica Section E","2007","63","6","m1597","m1597","10.1107/S1600536807021575","","","0.71073","MoKα","","0.0768","0.065","","","0.1657","0.1735","","","","","","1.14","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213763","9.8883","0.0003","24.6255","0.0006","10.3494","0.0004","90","","116.388","0.001","90","","2257.54","0.13","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis{N-[2-(2-hydroxyethylamino)ethyl]salicylideneimine-κ^3^O,N,N'} chromium(III) chloride","","- C22 H30 Cl Cr N4 O4 -","- C22 H30 Cl Cr N4 O4 -","- C88 H120 Cl4 Cr4 N16 O16 -","4","1","FJ2018","Yu-Zhou Yuan; Jian Zhou; Xing Liu","Bis{<i>N</i>-[2-(2-hydroxyethylamino)ethyl]salicylideneiminato-κ^3^<i>O</i>,<i>N</i>,<i>N</i>'}chromium(III) chloride","Acta Crystallographica Section E","2007","63","6","m1580","m1581","10.1107/S1600536807021289","","","0.71073","MoKα","","0.0576","0.0384","","","0.0998","0.1494","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213764","7.8841","0.0019","8.48","0.002","9.887","0.003","95.72","0.02","109.85","0.03","113.5","0.02","548.6","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H24 N2 O6 -","- C26 H24 N2 O6 -","- C26 H24 N2 O6 -","1","0.5","FJ2019","Moreno-Fuquen, Rodolfo; Shankland, Kenneth; Fabbiani, Francesa P. A.","6-Methoxyquinoline <i>N</i>-oxide‒hydroquinone (2/1)","Acta Crystallographica Section E","2007","63","6","o2891","o2891","10.1107/S1600536807022040","","","0.71073","MoKα","","0.051","0.033","","","0.083","0.089","","","","","","1.082","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213765","7.5554","0.0003","13.3987","0.0006","16.7825","0.0006","90","","90","","90","","1698.94","0.12","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(4aS,6cS)-8-Hydroxy-9-isopropyl-4,4,6c-trimethyl-1,2,3,4,4a,5,6,6c- octahydrophenanthren-3-one","","- C20 H28 O2 -","- C20 H28 O2 -","- C80 H112 O8 -","4","1","FJ2021","Zeroual, Abdellah; Mazoir, Noureddine; Maya, Celia M.; Berraho, Moha; Auhmani, Aziz; Benharref, Ahmed","(4a<i>S</i>,6c<i>S</i>)-8-Hydroxy-9-isopropyl-4,4,6c-trimethyl-1,2,3,4,4a,5,6,6c-octahydrophenanthren-3-one","Acta Crystallographica Section E","2007","63","6","o2915","o2915","10.1107/S1600536807022258","","","0.71073","MoKα","","0.0422","0.0375","","","0.1005","0.1054","","","","","","1.069","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213766","11.844","0.002","8.3912","0.0017","20.035","0.004","90","","97.56","0.03","90","","1973.9","0.7","298","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>trans</i>-Tetraaquabis(1,3-di-4-pyridylpropane-κ<i>N</i>)cobalt(II) naphthalene-1,5-disulfonate monohydrate","","- C36 H44 Co N4 O11 S2 -","- C36 H46 Co N4 O12 S2 -","- C72 H92 Co2 N8 O24 S4 -","2","0.5","FJ2023","Han, Ke-Fei; Chen, He-Yan; Wang, Zhong-Ming","<i>trans</i>-Tetraaquabis(1,3-di-4-pyridylpropane-κ<i>N</i>)cobalt(II) naphthalene-1,5-disulfonate monohydrate","Acta Crystallographica Section E","2007","63","6","m1695","m1696","10.1107/S1600536807023446","","","0.71073","MoKα","","0.058","0.0383","","","0.1016","0.1079","","","","","","1.018","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213767","38.708","0.017","7.16","0.003","7.407","0.003","90","","90","","90","","2052.8","1.5","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Methyl <i>N</i>-(4-chlorophenyl)-<i>N</i>'-cyanocarbamimidothioate","","- C9 H8 Cl N3 S -","- C9 H8 Cl N3 S -","- C72 H64 Cl8 N24 S8 -","8","1","FJ2024","Lu, Yin-Xiang","Methyl <i>N</i>-(4-chlorophenyl)-<i>N</i>'-cyanocarbamimidothioate","Acta Crystallographica Section E","2007","63","6","o3018","","10.1107/S1600536807024130","","","0.71073","MoKα","","0.0677","0.0578","","","0.1284","0.1315","","","","","","1.245","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213768","7.549","0.0015","9.883","0.002","15.814","0.003","78.34","0.03","82.49","0.02","72.24","0.03","1097.4","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis[2,4-dibromo-6-(cyclopropyliminomethyl)phenolato]zinc(II)","","- C20 H16 Br4 N2 O2 Zn -","- C20 H16 Br4 N2 O2 Zn -","- C40 H32 Br8 N4 O4 Zn2 -","2","1","FJ2029","Yuan, Wen-Bing; Xu, Hong-Wu; Li, Jin-Xia; Liu, Min; Zhang, Qi","Bis[2,4-dibromo-6-(cyclopropyliminomethyl)phenolato]zinc(II)","Acta Crystallographica Section E","2007","63","6","m1702","m1702","10.1107/S1600536807023136","","","0.71073","MoKα","","0.0541","0.0367","","","0.0795","0.0862","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213769","6.0641","0.0005","8.9176","0.0008","16.7851","0.0014","90","","90.727","0.001","90","","907.62","0.13","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2-Nitrobenzyl diphenyl phosphate","","- C19 H16 N O6 P -","- C19 H16 N O6 P -","- C38 H32 N2 O12 P2 -","2","1","FJ2030","Wei-Wei Jin; Cai-Bao Chen; Xin-Yong Li","2-Nitrobenzyl diphenyl phosphate","Acta Crystallographica Section E","2007","63","6","o3016","o3016","10.1107/S1600536807023379","","","0.71073","MoKα","","0.0403","0.0374","","","0.0948","0.097","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213770","8.709","0.002","8.576","0.002","20.306","0.005","90","","90.742","0.004","90","","1516.5","0.6","293","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Amino-N-(2-methoxyphenyl)-4,5,6,7-tetrahydrobenzo-1-thiophene-3-carboxamide","","- C16 H18 N2 O2 S -","- C16 H18 N2 O2 S -","- C64 H72 N8 O8 S4 -","4","1","FJ2031","Chandra Kumar, K.; Kokila, M. K.; Puttaraja; Mohan, S.; Saravanan, J.","2-Amino-<i>N</i>-(2-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide","Acta Crystallographica Section E","2007","63","6","o3009","o3009","10.1107/S1600536807024403","","","0.71073","MoKα","","0.0679","0.0516","","","0.1342","0.1465","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213771","7.2458","0.0002","13.6704","0.0004","14.4757","0.0003","90.718","0.002","92.618","0.002","93.623","0.001","1429.33","0.06","160","1","160","1","","","","","","","","5","P -1","-P 1","2","pyrimidine derivative","3-(4-Chlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-1H-pyrazole-4-carbaldehyde","","- C16 H13 Cl N4 O -","- C16 H13 Cl N4 O -","- C64 H52 Cl4 N16 O4 -","4","2","FJ2033","A. Thiruvalluvar; M. Subramanyam; Balakrishna Kalluraya; B. Lingappa","3-(4-Chlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-1<i>H</i>-pyrazole-4-carbaldehyde","Acta Crystallographica Section E","2007","63","6","o2911","o2911","10.1107/S1600536807024440","","","0.71073","MoKα","","0.0682","0.0575","","","0.1576","0.165","","","","","","1.166","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213772","10.364","0.001","16.157","0.001","23.206","0.001","90","","90","","90","","3885.9","0.5","119","2","119","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Dexamethasone","","- C22 H29 F O5 -","- C22 H29 F O5 -","- C176 H232 F8 O40 -","8","2","FL2123","John W. Raynor; Wladek Minor; Maksymilian Chruszcz","Dexamethasone at 119 K","Acta Crystallographica Section E","2007","63","6","o2791","o2793","10.1107/S1600536807020806","","","0.71074","MoKα","","0.0471","0.0405","","","0.1112","0.1149","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213773","8.5652","0.001","13.1529","0.0016","16.849","0.002","75.936","0.002","89.864","0.002","84.039","0.002","1830.8","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","(E)-{4-Amino-3-[4-(dimethylamino)benzylideneamino]phenyl}(phenyl)methanone","","- C22 H21 N3 O -","- C22 H21 N3 O -","- C88 H84 N12 O4 -","4","2","FL2126","Habibi, Mohammad Hossein; Zendehdel, Mahmoud; Barati, Kazem; W. Harrington, Ross; Clegg, William","(<i>E</i>)-{4-Amino-3-[4-(dimethylamino)benzylideneamino]phenyl}(phenyl)methanone","Acta Crystallographica Section E","2007","63","6","o2924","o2924","10.1107/S1600536807022349","","","0.71073","MoKα","","0.0678","0.0424","","","0.0986","0.1133","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213774","6.813","0.0001","11.134","0.0003","16.278","0.0004","82.557","0.0009","78.106","0.001","76.251","0.001","1169.43","0.05","90","2","90","2","","","","","","","","4","P -1","-P 1","2","6-oxo-1,6-dihydropyridine-3-carboxylic acid","6-Oxo-1,6-dihydropyridine-3-carboxylic acid","","- C6 H5 N O3 -","- C6 H5 N O3 -","- C48 H40 N8 O24 -","8","4","FL2129","Gupta, Salin; Long, Sihui; Li, Tonglei","6-Oxo-1,6-dihydropyridine-3-carboxylic acid","Acta Crystallographica Section E","2007","63","6","o2784","o2784","10.1107/S1600536807020958","","","0.71073","MoKα","","0.1007","0.0524","","","0.1319","0.1563","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213775","7.023","0.0003","14.4933","0.0007","20.8358","0.001","90","","92.707","0.001","90","","2118.44","0.17","103","","103","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,5-Bis(trimethylsilyl)triphenyleno[1,12-bcd]thiophene","","- C24 H26 S Si2 -","- C24 H26 S Si2 -","- C96 H104 S4 Si8 -","4","1","FL2130","Masaichi Saito; Tomoharu Tanikawa; Tomoyuki Tajima","3,5-Bis(trimethylsilyl)triphenyleno[1,12-<i>bcd</i>]thiophene","Acta Crystallographica Section E","2007","63","6","o2923","o2923","10.1107/S1600536807022337","","","0.71073","MoKα","","0.0389","0.0347","","","0.0862","0.0887","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213776","9.0226","0.0001","9.1638","0.0002","9.7919","0.0002","91.6357","0.0007","95.5828","0.0007","115.969","0.0013","722.11","0.02","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","2-[5-(2,2-Dimethylpropanamido)-1H-pyrazol-3-yl]pyridinium chloride","","- C13 H17 Cl N4 O -","- C13 H17 Cl N4 O -","- C26 H34 Cl2 N8 O2 -","2","1","GG3091","Christopher M. Pask; Colin A. Kilner; Malcolm A. Halcrow","2-[5-(2,2-Dimethylpropanamido)-1<i>H</i>-pyrazol-3-yl]pyridinium chloride","Acta Crystallographica Section E","2007","63","6","o2933","o2933","10.1107/S1600536807022866","","","0.71073","MoKα","","0.0682","0.0535","","","0.1433","0.1561","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213777","8.0456","0.0012","9.6829","0.0015","13.202","0.002","76.134","0.002","78.312","0.002","68.834","0.002","923.5","0.2","291","2","","","","","","","","","","5","P -1","-P 1","2","","Bis[1-benzyl-4-(dimethylamino)pyridinium] bis(2,2-dicyanoethylene-1,1-dithiolato-κ^2^S,S')nickelate(II)","","- C36 H34 N8 Ni S4 -","- C36 H34 N8 Ni S4 -","- C36 H34 N8 Ni S4 -","1","0.5","GK2073","Chu-Wen Feng; Xiang-Rong Li; Yong Hou; Chun-Lin Ni","Bis[1-benzyl-4-(dimethylamino)pyridinium] bis(2,2-dicyanoethylene-1,1-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(II)","Acta Crystallographica Section E","2007","63","6","m1762","m1762","10.1107/S1600536807025251","","","0.71073","MoKα","","0.0556","0.0373","","","0.1062","0.1279","","","","","","1.073","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213778","9.6939","0.0004","13.7249","0.0006","16.1266","0.0006","78.605","0.004","88.106","0.003","81.83","0.004","2081.94","0.15","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","Ammine(2-ethylpyridine-κ<i>N</i>)bis(tri-<i>tert</i>-butoxysilanethiolato- κ<i>S</i>)cobalt(II)","","- C31 H66 Co N2 O6 S2 Si2 -","- C31 H66 Co N2 O6 S2 Si2 -","- C62 H132 Co2 N4 O12 S4 Si4 -","2","1","GK2075","Pladzyk, Agnieszka; Baranowska, Katarzyna","Ammine(2-ethylpyridine-κ<i>N</i>)bis(tri-<i>tert</i>-butoxysilanethiolato-κ<i>S</i>)cobalt(II)","Acta Crystallographica Section E","2007","63","6","m1594","m1594","10.1107/S1600536807025421","","","0.71073","MoKα","","0.0451","0.0351","","","0.0869","0.095","","","","","","1.078","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2213779","12.06","0.002","10.8025","0.0018","17.863","0.003","90","","90","","90","","2327.2","0.7","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis{2-[(E)-cyclopentyliminomethyl]-6-methoxyphenolato}copper(II)","","- C26 H32 Cu N2 O4 -","- C26 H32 Cu N2 O4 -","- C104 H128 Cu4 N8 O16 -","4","0.5","GK2077","Hou, Hai-Yun","Bis{2-[(<i>E</i>)-cyclopentyliminomethyl]-6-methoxyphenolato}copper(II)","Acta Crystallographica Section E","2007","63","6","m1766","m1766","10.1107/S1600536807023860","","","0.71073","MoKα","","0.0595","0.0394","","","0.0972","0.1077","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213780","12.965","0.003","10.966","0.002","8.6833","0.0017","90","","107.61","0.03","90","","1176.7","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Glycinium 3-nitrophthalate","","- C10 H10 N2 O8 -","- C10 H10 N2 O8 -","- C40 H40 N8 O32 -","4","1","HB2343","Li, Zong-Sheng; Chai, Jian-She","Glycinium 3-nitrophthalate","Acta Crystallographica Section E","2007","63","6","o2857","o2859","10.1107/S1600536807019253","","","0.71073","MoKα","","0.058","0.0471","","","0.1238","0.1314","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213781","6.3817","0.0006","7.3925","0.0007","11.5034","0.0011","86.765","0.002","80.552","0.002","68.42","0.001","497.8","0.08","296","2","","","","","","","","","","4","P -1","-P 1","2","","meso-1,2-Diphenylethylenediammonium bis(hydrogen squarate)","","- C22 H20 N2 O8 -","- C22 H20 N2 O8 -","- C22 H20 N2 O8 -","1","0.5","HB2358","Ramasubramanian, R.; Kumaresan, S.; Sridhar, B.; David Stephen, A.; Kumaradhas, P.","<i>meso</i>-1,2-Diphenylethylenediammonium bis(hydrogen squarate)","Acta Crystallographica Section E","2007","63","6","o3034","o3035","10.1107/S1600536807023343","","","0.71073","MoKα","","","0.0418","","","","0.1189","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213782","11.964","0.002","7.7882","0.0016","33.893","0.007","90","","90","","90","","3158.1","1.1","292","2","292","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","catena-poly[[diaqua(2,4-dihydroxybenzoato)cadmium(II)]-μ-2,4-dihydroxybenzoato]","","- C14 H14 Cd O10 -","- C14 H14 Cd O10 -","- C112 H112 Cd8 O80 -","8","1","HB2367","Wang, Zi-Liang; Wei, Lin-Heng; Niu, Ying-Peng","A one-dimensional coordination polymer: <i>catena</i>-poly[[diaqua(2,4-dihydroxybenzoato)cadmium(II)]-μ-2,4-dihydroxybenzoato]","Acta Crystallographica Section E","2007","63","6","m1639","m1639","10.1107/S160053680702243X","","","0.71073","MoKα","","0.032","0.0293","","","0.067","0.0685","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213783","7.885","0.002","8.542","0.002","15.629","0.004","99.103","0.004","90.958","0.004","90.271","0.004","1039.2","0.4","293","2","293","2","","","","","","","","5","P 1","P 1","1","","1,3,4,6-Tetra-O-acetyl-2-(trifluoromethylsulfonyl)-β-D-mannopyranose","","- C15 H19 F3 O12 S -","- C15 H19 F3 O12 S -","- C30 H38 F6 O24 S2 -","2","2","HB2374","Zhu, Hong-Yuan; Jiang, Shen-De","1,3,4,6-Tetra-<i>O</i>-acetyl-2-(trifluoromethylsulfonyl)-β-<small>D</small>-mannopyranose","Acta Crystallographica Section E","2007","63","6","o2833","o2833","10.1107/S1600536807019770","","","0.71073","MoKα","","0.0564","0.0407","","","0.0929","0.1023","","","","","","1.054","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213784","8.44","0.0016","16.473","0.003","18.47","0.005","90","","90","","90","","2567.9","1","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","rac-2,7-bis(2-hydroxy-2-propyl)-trans-oxepane","","- C12 H24 O3 -","- C12 H24 O3 -","- C96 H192 O24 -","8","1","HB2377","Roberto Centore; Vincenzo Piccialli; Angela Tuzi","<i>rac</i>-2,7-Bis(2-hydroxy-2-propyl)-<i>trans</i>-oxepane","Acta Crystallographica Section E","2007","63","6","o2907","o2908","10.1107/S1600536807022428","","","0.71073","MoKα","","0.0985","0.0444","","","0.0843","0.1017","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213785","10.5042","0.0009","14.3969","0.0011","11.2404","0.0009","90","","110.645","0.007","90","","1590.7","0.2","85","0.2","85","0.2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","β-(3,6,9-Trimethyl-9-xanthenyl)propionic acid","","- C19 H20 O3 -","- C19 H20 O3 -","- C76 H80 O12 -","4","1","HB2378","Janusz B. Kyzioł; Ewa M. Nowakowska; Zaleski, Jacek","β-(3,6,9-Trimethyl-9-xanthenyl)propionic acid","Acta Crystallographica Section E","2007","63","6","o2834","o2834","10.1107/S1600536807021332","","","0.71073","MoKα","","0.0543","0.0357","","","0.0958","0.1046","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213786","11.526","0.002","6.881","0.001","11.577","0.002","90","","106.06","0.03","90","","882.3","0.3","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-N,N-dimethylhydrazino-2-methylsulfonyl propenenitrile","","- C6 H11 N3 O2 S -","- C6 H11 N3 O2 S -","- C24 H44 N12 O8 S4 -","4","1","HB2380","Gróf Martin; Kožíšek Jozef; Milata Viktor; Gatial Anton","3-(Dimethylhydrazino)-2-(methylsulfonyl)propenenitrile","Acta Crystallographica Section E","2007","63","6","o2820","o2820","10.1107/S1600536807021381","","","0.71073","MoKα","","0.067","0.0571","","","0.1413","0.1519","","","","","","1.141","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213787","6.0676","0.0001","11.4221","0.0002","10.7096","0.0002","90","","105.652","0.001","90","","714.7","0.02","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis[5-(pyrazin-2-yl)tetrazolate]cobalt(II)","","- C10 H10 Co N12 O2 -","- C10 H10 Co N12 O2 -","- C20 H20 Co2 N24 O4 -","2","0.5","HB2381","Rong-Hua Zeng; Yong-Cai Qiu; Zhi-Hui Liu; Ying-Hua Li; Hong Deng","Diaquabis[5-(pyrazin-2-yl)tetrazolato]cobalt(II)","Acta Crystallographica Section E","2007","63","6","m1591","m1591","10.1107/S1600536807021393","","","0.71073","MoKα","","0.0478","0.0337","","","0.0773","0.0826","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213788","11.9874","0.0012","8.2874","0.0007","17.714","0.0015","90","","91.049","0.007","90","","1759.5","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","8-(4-Bromophenyl)-4,4-difluoro-1,3,5,7-tetramethyl- 4-bora-3a,4a-diaza-s-indacene","","- C19 H18 B Br F2 N2 -","- C19 H18 B Br F2 N2 -","- C76 H72 B4 Br4 F8 N8 -","4","1","HB2394","Dong-Chuan Wang; Cheng He; Jiang-Li Fan; Wei-Wei Huang; Xiao-Jun Peng","8-(4-Bromophenyl)-4,4-difluoro-1,3,5,7-tetramethyl-4-bora-3a,4a-diaza-<i>s</i>-indacene","Acta Crystallographica Section E","2007","63","6","o2900","o2900","10.1107/S1600536807022441","","","0.71073","MoKα","","0.0603","0.0418","","","0.108","0.115","","","","","","1.05","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2213789","8.192","0.002","9.078","0.002","10.296","0.002","66.28","0.03","83.74","0.03","68.02","0.02","649.3","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Trichlorido(2-phenylpyridine-κ<i>N</i>)gold(III)","","- C11 H9 Au Cl3 N -","- C11 H9 Au Cl3 N -","- C22 H18 Au2 Cl6 N2 -","2","1","HB2395","Zhang, Xiang-Pei; Yang, Guang; Wang, Lan; Ng, Seik Weng","Trichlorido(2-phenylpyridine-κ<i>N</i>)gold(III)","Acta Crystallographica Section E","2007","63","6","m1582","m1582","10.1107/S1600536807021307","","","0.71073","MoKα","","0.024","0.022","","","0.078","0.079","","","","","","1.3","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213790","9.68","0.003","11.674","0.005","13.565","0.006","88.75","0.03","79.74","0.02","77.13","0.03","1470.2","1","294","","","","","","","","","","","5","P -1","-P 1","2","","Benzyl 2-{(<i>tert</i>-butyldimethylsilyloxy)[1-(4-nitrophenyl)-2,5-dioxo- tetrahydro-1<i>H</i>-furo[3,2-<i>d</i>]oxazol-6a-yl]methyl}acrylate","","- C28 H32 N2 O9 Si -","- C28 H32 N2 O9 Si -","- C56 H64 N4 O18 Si2 -","2","1","HB2397","Patil, S.P.; Craig, D.C.; Liu, F.","Benzyl 2-{(<i>tert</i>-butyldimethylsilyloxy)[1-(4-nitrophenyl)-2,5-dioxotetrahydro-1<i>H</i>-furo[3,2-<i>d</i>]oxazol-6a-yl]methyl}acrylate","Acta Crystallographica Section E","2007","63","6","o3021","o3021","10.1107/S1600536807023549","","","0.71073","MoKα","","","0.049","","","","0.056","","","","","","1.63","","","","has coordinates","278247","2022-09-28","15:09:33",""
"2213791","6.2997","0.0017","35.313","0.009","6.9561","0.0019","90","","90.75","0.01","90","","1547.3","0.7","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Hexaaquamagnesium(II) bis[4-(2-hydroxybenzylideneamino)benzenesulfonate]","","- C26 H32 Mg N2 O14 S2 -","- C26 H32 Mg N2 O14 S2 -","- C52 H64 Mg2 N4 O28 S4 -","2","0.5","HB2398","Li-Hua Wang; Jie Yin; Xi-Shi Tai","Hexaaquamagnesium(II) bis[4-(2-hydroxybenzylideneamino)benzenesulfonate]","Acta Crystallographica Section E","2007","63","6","m1664","m1664","10.1107/S160053680702274X","","","0.71073","MoKα","","0.0906","0.0641","","","0.1386","0.1463","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213792","8.1628","0.0007","8.8981","0.0008","11.0236","0.0009","105.048","0.007","108.266","0.006","97.981","0.007","712.78","0.12","200","","200","","","","","","","","","3","P -1","-P 1","2","","Methyl 2-[(1-oxo-1<i>H</i>-isochromen-3-yl)methyl]benzoate","","- C18 H14 O4 -","- C18 H14 O4 -","- C36 H28 O8 -","2","1","HB2399","Mehmet Akkurt; Sema Öztürk Yıldırım; Bogdanov, Milen G.; Mitrev, Yavor N.; Frank W. Heinemann","Methyl 2-[(1-oxo-1<i>H</i>-isochromen-3-yl)methyl]benzoate","Acta Crystallographica Section E","2007","63","6","o2824","o2824","10.1107/S1600536807021447","","","0.71073","MoKα","","0.0728","0.0421","","","0.0867","0.098","","","","","","1.006","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213793","14.158","0.002","35.39","0.005","7.2215","0.0011","90","","90","","90","","3618.3","0.9","292","1","292","1","","","","","","","","2","P n m a","-P 2ac 2n","62","5,12-bis-(4-tert-butyl-phenyl)-6,12-diphenyl-naphthacene","5,12-Bis(4-tert-butyl-phenyl)-6,11-diphenylnaphthacene","","- C50 H44 -","- C50 H44 -","- C200 H176 -","4","0.5","HB2400","Schuck, Götz; Haas, Simon; Stassen, Arno F.; Kirner, Hans-Jörg; Batlogg, Bertram","5,12-Bis(4-<i>tert</i>-butylphenyl)-6,11-diphenylnaphthacene","Acta Crystallographica Section E","2007","63","6","o2893","o2893","10.1107/S1600536807022489","","","0.71073","MoKα","","0.1167","0.0742","","","0.1806","0.2072","","","","","","1.154","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213794","33.261","0.019","7.951","0.005","7.461","0.005","90","","90","","90","","1973","2","291","2","291","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","bis(1-acetyl-2-naphtholato)diaquamagnesium(II)","","- C24 H22 Mg O6 -","- C24 H22 Mg O6 -","- C96 H88 Mg4 O24 -","4","0.5","HB2401","Li-Hua Wang; Jie Yin; Xi-Shi Tai","Bis(1-acetyl-2-naphtholato)diaquamagnesium(II)","Acta Crystallographica Section E","2007","63","6","m1665","m1665","10.1107/S1600536807023677","","","0.71073","MoKα","","0.07","0.0521","","","0.109","0.1148","","","","","","1.056","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213795","23.527","0.003","9.0277","0.001","17.764","0.002","90","","95.928","0.004","90","","3752.8","0.8","292","1","292","1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","5,11-Bis(4-tert-butyl-phenyl)-6,12-diphenylnaphthacene","","- C50 H44 -","- C50 H44 -","- C200 H176 -","4","1","HB2402","Schuck, Götz; Haas, Simon; Stassen, Arno F.; Berens, Ulrich; Batlogg, Bertram","5,11-Bis(4-<i>tert</i>-butylphenyl)-6,12-diphenylnaphthacene (form A)","Acta Crystallographica Section E","2007","63","6","o2894","o2894","10.1107/S1600536807022490","","","0.71073","MoKα","","0.1913","0.0977","","","0.1393","0.169","","","","","","1.107","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213796","19.866","0.002","19.866","0.002","17.497","0.002","90","","90","","90","","6905.3","1.3","293","2","293","2","","","","","","","","8","P 41","P 4w","76","","Dichlorido- <i>cis</i>-bis[{(<i>S</i>)-(3,5-dioxa-4-phosphacyclohepta[2,1-a;3,4 -a']dinaphthalen-4-yl)dibenz[b,f]azepin}-\κ<i>P</i>]palladium(II) deuterochloroform disolvate","","- C70 H44 Cl8 D2 N2 O4 P2 Pd -","- C70 H46 Cl8 N2 O4 P2 Pd -","- C280 H184 Cl32 N8 O16 P8 Pd4 -","4","1","HB2403","Alexander Briceño; Romano Dorta","<i>cis</i>-Dichloridobis{[(<i>S</i>)-<i>N</i>-(3,5-dioxa-4-phosphacyclohepta[2,1-<i>a</i>;3,4-<i>a</i>']dinaphthalen-4-yl]dibenz[<i>b</i>,<i>f</i>]azepin-κ<i>P</i>}palladium(II) deuterochloroform disolvate","Acta Crystallographica Section E","2007","63","6","m1718","m1719","10.1107/S1600536807023173","","","0.7107","MoKα","","0.128","0.0738","","","0.1922","0.248","","","","","","1.066","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213797","8.6632","0.0017","17.239","0.003","13.789","0.003","90","","93.11","0.03","90","","2056.3","0.7","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(2-amino-3,5-dimethylbenzenesulfonato-κO)silver(I)]- μ-1,1'-(butane-1,4-diyl)diimidazole-κ^2^N^3^:N^3'^]","","- C18 H24 Ag N5 O3 S -","- C18 H24 Ag N5 O3 S -","- C72 H96 Ag4 N20 O12 S4 -","4","1","HB2404","Jia-Jun Han; Ning Li","<i>catena</i>-Poly[[(2-amino-3,5-dimethylbenzenesulfonato-κ<i>O</i>)silver(I)]-μ-1,1'-(butane-1,4-diyl)diimidazole-κ^2^<i>N</i>^3^:<i>N</i>^3'^]","Acta Crystallographica Section E","2007","63","6","m1622","m1623","10.1107/S1600536807021897","","","0.71073","MoKα","","0.0841","0.0383","","","0.0802","0.1004","","","","","","0.977","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213798","15.614","0.002","12.4561","0.0018","16.87","0.003","90","","90","","90","","3281","0.9","292","2","292","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Poly[[aqua(2,2-bipyridyl)(μ~3~pyridine-3,4-dicarboxylato)manganese(II)] monohydrate]","","- C17 H15 Mn N3 O6 -","- C17 H15 Mn N3 O6 -","- C136 H120 Mn8 N24 O48 -","8","1","HB2406","Xiu-Mei Li; Yan-Ling Niu; Qing-Wei Wang; Bo Liu","Poly[[aqua(2,2-bipyridyl)(μ~3~-pyridine-3,4-dicarboxylato)manganese(II)] monohydrate]","Acta Crystallographica Section E","2007","63","6","m1737","m1738","10.1107/S1600536807023586","","","0.71073","MoKα","","0.0465","0.0341","","","0.0874","0.0923","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213799","14.829","0.003","7.2111","0.0014","23.976","0.005","90","","95","0.03","90","","2554.1","0.9","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","catena-Poly[[[aqua(pyrazino[2,3-f][1,10]phenanthroline)copper(II)]-μ- benzene-1,3-dicarboxylato] N,N-dimethylacetamide monohydrate]","","- C26 H25 Cu N5 O7 -","- C26 H25 Cu N5 O7 -","- C104 H100 Cu4 N20 O28 -","4","1","HB2408","Wen-Zhi Zhang","<i>catena</i>-Poly[[[aqua(pyrazino[2,3-<i>f</i>][1,10]phenanthroline)copper(II)]-μ-benzene-1,3-dicarboxylato] <i>N</i>,<i>N</i>-dimethylacetamide monohydrate]","Acta Crystallographica Section E","2007","63","6","m1692","m1693","10.1107/S1600536807023082","","","0.71073","MoKα","","0.0945","0.0675","","","0.1708","0.1838","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213800","13.811","0.011","5.443","0.004","12.912","0.01","90","","97.933","0.013","90","","961.3","1.3","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-1-(4-Methoxybenzylidene)semicarbazide","","- C9 H11 N3 O2 -","- C9 H11 N3 O2 -","- C36 H44 N12 O8 -","4","1","HB2409","Liang, Zu-Pei; Li, Jian; Wang, Hong-Liang; Wang, Hui-Qin","(<i>E</i>)-1-(4-Methoxybenzylidene)semicarbazide","Acta Crystallographica Section E","2007","63","6","o2939","o2939","10.1107/S1600536807023240","","","0.71073","MoKα","","0.0781","0.0428","","","0.1073","0.131","","","","","","1.026","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213801","15.1006","0.0019","5.3082","0.0007","13.0746","0.0017","90","","107.494","0.009","90","","999.5","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(Methylthio)benzaldehyde semicarbazone","","- C9 H11 N3 O S -","- C9 H11 N3 O S -","- C36 H44 N12 O4 S4 -","4","1","HB2410","Sarojini, B. K.; Narayana, B.; Bindya, S.; Yathirajan, H. S.; Bolte, Michael","4-(Methylsulfanyl)benzaldehyde semicarbazone","Acta Crystallographica Section E","2007","63","6","o2946","o2946","10.1107/S1600536807023239","","","0.71073","MoKα","","0.071","0.0544","","","0.1514","0.1679","","","","","","1.091","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213802","7.2931","0.0002","10.7952","0.0008","12.2472","0.0007","71.422","0.017","80.02","0.004","73.947","0.004","874.49","0.12","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","(E)-1-[4-(Dimethylamino)benzylidene]semicarbazide‒acetic acid (1/2)","","- C14 H22 N4 O5 -","- C14 H22 N4 O5 -","- C28 H44 N8 O10 -","2","1","HB2411","Liang, Zu-Pei; Li, Jian; Wang, Hong-Liang; Zhang, Yun-Chen","(<i>E</i>)-1-[4-(Dimethylamino)benzylidene]semicarbazide‒acetic acid (1/2)","Acta Crystallographica Section E","2007","63","6","o2978","o2978","10.1107/S1600536807024956","","","0.71073","MoKα","","0.1733","0.0625","","","0.1428","0.2022","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213803","6.0798","0.0005","16.2655","0.0013","8.3611","0.0008","90","","104.827","0.005","90","","799.31","0.12","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Piperazinium gallium sulfide","<i>catena</i>-Poly[piperazinium di-μ-sulfido-gallium]","","- C4 H11 Ga N2 S2 -","- C4 H11 Ga N2 S2 -","- C16 H44 Ga4 N8 S8 -","4","1","HB2412","Vaqueiro, Paz; Romero, M. Lucia","<i>catena</i>-Poly[piperazinium di-μ-sulfido-gallium]","Acta Crystallographica Section E","2007","63","6","m1700","m1700","10.1107/S1600536807023598","","","0.71073","MoKα","","0.0369","0.0218","","0.0278","0.0256","0.0256","","","","","","1.0362","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213804","4.588","0.0001","8.1255","0.0002","16.124","0.0008","90","","93.074","0.001","90","","600.23","0.04","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2-(1-benzyl-5-methyl-1H-imidazol-4-yl)-1,3,4-oxadiazole","","- C13 H12 N4 O -","- C13 H12 N4 O -","- C26 H24 N8 O2 -","2","1","HB2413","Jing Li","2-(1-Benzyl-5-methyl-1<i>H</i>-imidazol-4-yl)-1,3,4-oxadiazole","Acta Crystallographica Section E","2007","63","6","o2976","o2976","10.1107/S1600536807023483","","","0.71073","MoKα","","0.0715","0.0469","","","0.1174","0.1468","","","","","","1.103","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213805","19.31","0.02","11.77","0.01","6.958","0.006","90","","90","","90","","1581","3","123.1","","","","","","","","","","","6","P n m a","-P 2ac 2n","62","","(Benzoato-κ^2^<i>O</i>,<i>O</i>')chlorido(di-2-pyridylamine- κ^2^<i>N</i>,<i>N</i>')copper(II)","","- C17 H14 Cl Cu N3 O2 -","- C17 H14 Cl Cu N3 O2 -","- C68 H56 Cl4 Cu4 N12 O8 -","4","0.5","HB2414","Okabe, Nobuo; Tsuji, Akio; Yodoshi, Masahiro","(Benzoato-κ^2^<i>O</i>,<i>O</i>')chlorido(di-2-pyridylamine-κ^2^<i>N</i>,<i>N</i>')copper(II)","Acta Crystallographica Section E","2007","63","6","m1756","m1757","10.1107/S1600536807023495","","","0.7107","MoKα","","","0.025","","","","0.072","","","","","","1.124","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2213806","10.3799","0.0015","14.418","0.002","24.862","0.004","90","","96.558","0.002","90","","3696.4","0.9","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","μ-Sulfido-bis[tricyclohexyltin(IV)]","","- C36 H66 S Sn2 -","- C36 H66 S Sn2 -","- C144 H264 S4 Sn8 -","4","1","HB2416","Zheng, Xiao-Feng; Yin, Ling; Liu, Xi-Cheng; Tian, Lai-Jin","μ-Sulfido-bis[tricyclohexyltin(IV)]","Acta Crystallographica Section E","2007","63","6","m1744","m1744","10.1107/S1600536807024117","","","0.71073","MoKα","","0.0578","0.0434","","","0.1031","0.1109","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213807","10.9098","0.0012","8.7854","0.001","13.0367","0.0014","90","","111.031","0.002","90","","1166.3","0.2","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(1-Benzyl-4-methyl-1H-imidazol-5-yl)-1,3,4-oxadiazole","","- C13 H12 N4 O -","- C13 H12 N4 O -","- C52 H48 N16 O4 -","4","1","HB2417","Jing Li; Hong-Bin Zhou","2-(1-Benzyl-4-methyl-1<i>H</i>-imidazol-5-yl)-1,3,4-oxadiazole","Acta Crystallographica Section E","2007","63","6","o2977","o2977","10.1107/S1600536807024129","","","0.71073","MoKα","","0.056","0.0477","","","0.13","0.1361","","","","","","1.057","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213808","6.861","0.002","8.664","0.002","12.363","0.003","82.967","0.003","80.639","0.003","77.706","0.003","705.5","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Triaqua(5-formyl-<i>N</i>-salicylidene-D,L-alaninato-<i>κ</i>^3^<i>N</i>,\ <i>O</i>,<i>O</i>')nickel(II) monohydrate","","- C11 H17 N Ni O8 -","- C11 H17 N Ni O8 -","- C22 H34 N2 Ni2 O16 -","2","1","HB2419","Cai, Jin-Hua; Li, Jia-Ming; Ng, Seik Weng","Triaqua(5-formyl-<i>N</i>-salicylidene-<small>D</small><small>L</small>-alaninato-<i>{κ</i>}^3^<i>N</i>,<i>O</i>,<i>O</i>')nickel(II) monohydrate","Acta Crystallographica Section E","2007","63","6","m1715","m1716","10.1107/S1600536807024518","","","0.71073","MoKα","","0.041","0.036","","","0.094","0.099","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213809","10.4665","0.0007","15.778","0.001","23.439","0.002","90","","90","","90","","3870.7","0.5","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,2-Bis[(2-hydroxy-3-methoxyphenyl)methylamino]benzene","","- C22 H24 N2 O4 -","- C22 H24 N2 O4 -","- C176 H192 N16 O32 -","8","1","HB2420","Chen, Yi-Feng; Ng, Seik Weng","1,2-Bis[(2-hydroxy-3-methoxyphenyl)methylamino]benzene","Acta Crystallographica Section E","2007","63","6","o2988","o2988","10.1107/S160053680702452X","","","0.71073","MoKα","","0.109","0.045","","","0.102","0.132","","","","","","0.99","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213810","5.7616","0.0011","26.912","0.003","16.635","0.002","90","","90.791","0.002","90","","2579.1","0.6","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[2-(2-naphthyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]zinc(II)","","- C34 H24 N2 O2 Zn -","- C34 H24 N2 O2 Zn -","- C136 H96 N8 O8 Zn4 -","4","1","HB2423","Jian-Fang Dong; Lian-Zhi Li; Li-Li Xu; Tao Xu; Da-Qi Wang","Bis[2-(2-naphthyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]zinc(II)","Acta Crystallographica Section E","2007","63","6","m1731","m1731","10.1107/S1600536807024452","","","0.71073","MoKα","","0.1745","0.1231","","","0.2926","0.3228","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213811","9.6017","0.0009","18.6352","0.0018","16.5097","0.0016","90","","91.985","0.001","90","","2952.3","0.5","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","μ-Fumarato-κ^2^O,O'-bis[tris(2-methyl-2-phenylpropyl)tin(IV)]","","- C64 H80 O4 Sn2 -","- C64 H80 O4 Sn2 -","- C128 H160 O8 Sn4 -","2","0.5","HB2424","Liu, Xi-Cheng; Yin, Ling; Sun, Yu-Xi; Tian, Lai-Jin","μ-Fumarato-κ^2^<i>O</i>:<i>O</i>'-bis[tris(2-methyl-2-phenylpropyl)tin(IV)]","Acta Crystallographica Section E","2007","63","6","m1758","m1758","10.1107/S1600536807024543","","","0.71073","MoKα","","0.0581","0.0391","","","0.0927","0.1009","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213812","11.1843","0.0004","12.1788","0.0005","15.0143","0.0005","73.457","0.001","83.292","0.001","74.132","0.002","1884.07","0.12","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","[1-(Diphenylphosphino)-2-(diphenylphosphinoyl)ethane-κP^1^]iodido(1,10- phenanthroline-κ^2^N,N')copper(I) dichloromethane solvate","","- C39 H34 Cl2 Cu I N2 O P2 -","- C39 H34 Cl2 Cu I N2 O P2 -","- C78 H68 Cl4 Cu2 I2 N4 O2 P4 -","2","1","HG2177","Xiao-Lin Zhang; Wen-Hong Wu; Qian-Yong Cao; Yong-Xiu Li; Lai-Tao Luo","[1-(Diphenylphosphino)-2-(diphenylphosphinoyl)ethane-κ<i>P</i>^1^]iodido(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(I) dichloromethane solvate","Acta Crystallographica Section E","2007","63","6","m1602","m1603","10.1107/S1600536807010392","","","0.71073","MoKα","","0.068","0.053","","","0.1599","0.1668","","","","","","1.107","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213813","6.2251","0.0009","7.7283","0.0011","25.061","0.003","90","","90","","90","","1205.7","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Piperidin-4-chloro-phenyl-methanethione","Piperidin-4-chloro-phenyl-methanethione","","- C12 H14 Cl N S -","- C12 H14 Cl N S -","- C48 H56 Cl4 N4 S4 -","4","1","HG2198","V. Muthuraj; A. Ramu; A. Thamaraichelvan; S. Athimoolam; S. Natarajan","1-(4-Chlorothiobenzoyl)piperidine","Acta Crystallographica Section E","2007","63","6","o2873","o2874","10.1107/S1600536807015978","","","0.71069","MoKα","","0.0499","0.0298","","","0.0718","0.0842","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213814","9.7001","0.0016","14.102","0.002","18.244","0.003","82.94","0.011","76.232","0.011","85.571","0.01","2402.5","0.7","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","5,5'-Diamino-2,2'-bipyridin-1,1'-dium bis(5,5'-diamino-2,2'-bipyridin-1-ium) tetrakis(<i>rac</i>-1,1'-binaphthalene-2,2'-diyl phosphate) hexahydrate","","- C110 H94 N12 O22 P4 -","- C110 H94 N12 O22 P4 -","- C110 H94 N12 O22 P4 -","1","0.5","HG2222","Wisser, Barbara; Janiak, Christoph","5,5'-Diamino-2,2'-bipyridin-1,1'-diium bis(5,5'-diamino-2,2'-bipyridin-1-ium) tetrakis(<i>rac</i>-1,1'-binaphthalene-2,2'-diyl phosphate) hexahydrate: a two-dimensional supramolecular hydrogen-bonded network","Acta Crystallographica Section E","2007","63","6","o2871","o2872","10.1107/S1600536807021794","","","0.71073","MoKα","","0.1203","0.0564","","","0.1132","0.1381","","","","","","0.99","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213815","8.374","0.0017","9.187","0.0018","9.889","0.002","107.57","0.03","98.57","0.03","94.42","0.03","711.2","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-(3,5-Dimethylphenyl)-3-phenylthiourea","","- C15 H16 N2 S -","- C15 H16 N2 S -","- C30 H32 N4 S2 -","2","1","HG2224","Fang-Fang Jian; Rui-Rui Zhuang; Hai-Lian Xiao; Pu-Su Zhao","1-(3,5-Dimethylphenyl)-3-phenylthiourea","Acta Crystallographica Section E","2007","63","6","o2825","o2825","10.1107/S1600536807019290","","","0.71073","MoKα","","0.0567","0.0434","","","0.1254","0.1347","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213816","18.3554","0.0009","12.3477","0.0006","8.4209","0.0005","90","","91.0467","0.0017","90","","1908.25","0.17","298","1","","","","","","","","","","5","C 1 c 1","C -2yc","9","","2-(4,6-Dimethoxypyrimidine-2-ylsulfanyl)-N-(3-nitrophenyl)benzamide","","- C19 H16 N4 O5 S -","- C19 H16 N4 O5 S -","- C76 H64 N16 O20 S4 -","4","1","HG2230","Bin Mao; Jing Lv; Jun Wu; Qing-sen Yu","2-(4,6-Dimethoxypyrimidine-2-ylsulfanyl)-<i>N</i>-(3-nitrophenyl)benzamide","Acta Crystallographica Section E","2007","63","6","o2930","o2930","10.1107/S1600536807022842","","","0.71075","MoKα","","","0.0315","","","","0.0808","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213817","12.6974","0.0018","8.8399","0.001","14.3537","0.0012","90","","91.803","0.009","90","","1610.3","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Diazidobis(2,2'-biimidazole)nickel(II)","","- C12 H12 N14 Ni -","- C12 H12 N14 Ni -","- C48 H48 N56 Ni4 -","4","0.5","HG2232","Ni, Zhong-Hai; Cai, Zhi-Nan; Zhong, Wei-Feng; Wei, Shang-Zheng","Diazidobis(2,2'-biimidazole)nickel(II)","Acta Crystallographica Section E","2007","63","6","m1570","m1570","10.1107/S1600536807021113","","","0.71073","MoKα","","0.0382","0.0301","","","0.0648","0.0693","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213818","24.649","0.003","14.0182","0.0011","21.4453","0.0017","90","","102.307","0.002","90","","7239.8","1.2","291","2","291","2","","","","","","","","5","C 1 c 1","C -2yc","9","","[13,27-Dimethyl-3,6,9,17,20,23-hexaazatricyclo[23.3.1.1^11,15^]triaconta- 1(29),2,9,11,13,15(30),16,23,25,27-decaene-29,30-diol- κ^5^N^3^,N^6^,N^9^,O^29^,O^30^]bis(nitrato-κ^2^O,O')lutetium(III)‒ nitrate‒water‒ethyl acetate (1/1/0.5/0.25)","","- C27 H37 Lu N9 O12 -","- C27 H37 Lu N9 O12 -","- C216 H296 Lu8 N72 O96 -","8","2","HG2233","Hu, Xue-Lei; Chen, Zhong; Qiu, Li; Pan, Zhi-Quan","[13,27-Dimethyl-3,6,9,17,20,23-hexaazatricyclo[23.3.1.1^11,15^]triaconta-1(29),2,9,11,13,15(30),16,23,25,27-decaene-29,30-diol-κ^5^<i>N</i>^3^,<i>N</i>^6^,<i>N</i>^9^,<i>O</i>^29^,<i>O</i>^30^]bis(nitrato-κ^2^<i>O</i>,<i>O</i>')lutetium(III)‒nitrate‒water‒ethyl acetate (1/1/0.5/0.25)","Acta Crystallographica Section E","2007","63","6","m1668","m1669","10.1107/S1600536807022350","","","0.71073","MoKα","","0.059","0.0503","","","0.1025","0.1042","","","","","","0.978","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213819","6.1301","0.0012","34.541","0.007","9.4459","0.0019","90","","104.52","0.03","90","","1936.2","0.7","291","2","291","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","4-[(3,5-Diphenyl-1H-pyrazol-4-yl)methyl]benzonitrile ethanol hemisolvate","","- C24 H20 N3 O0.5 -","- C24 H20 N3 O0.5 -","- C96 H80 N12 O2 -","4","1","HG2234","Mei Yu","4-[(3,5-Diphenyl-1<i>H</i>-pyrazol-4-yl)methyl]benzonitrile ethanol hemisolvate","Acta Crystallographica Section E","2007","63","6","o2863","o2863","10.1107/S1600536807021812","","","0.71073","MoKα","","0.0894","0.0788","","","0.2038","0.2135","","","","","","1.075","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213820","7.2648","0.0002","7.276","0.0002","11.9225","0.0004","87.394","0.002","81.907","0.002","72.313","0.002","594.44","0.03","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","poly[triaqua(μ~4~-5-sulfosalicylato)potassium(I)]","","- C7 H11 K O9 S -","- C7 H11 K O9 S -","- C14 H22 K2 O18 S2 -","2","1","HJ3040","Guo, Hong-Xu; Li, Guo-Ping; Liang, Min","Poly[triaqua(μ~4~-5-sulfosalicylato)potassium(I)]","Acta Crystallographica Section E","2007","63","6","m1558","m1559","10.1107/S1600536807020934","","","0.7107","MoKα","","0.0378","0.0348","","","0.1239","0.1293","","","","","","1.011","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213821","9.422","0.0019","10.587","0.002","14.328","0.003","90","","90","","90","","1429.2","0.5","294","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N-acryloyltryptophane","3-(1H-Indol-3-yl)-2-(2-methylacryloyl)propanoic acid","","- C15 H16 N2 O3 -","- C15 H16 N2 O3 -","- C60 H64 N8 O12 -","4","1","HK2221","Lv, Zhi-Fang; Gao, Xiao-Feng; Wang, Jin-Tang","3-(1<i>H</i>-Indol-3-yl)-2-(2-methylacryloyl)propanoic acid","Acta Crystallographica Section E","2007","63","6","o2846","o2847","10.1107/S1600536807015735","","","0.71073","MoKα","","0.0899","0.0692","","","0.1837","0.2003","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213822","9.074","0.002","10.93","0.003","20.091","0.005","75.04","0.02","76.82","0.02","70.93","0.02","1796.8","0.8","294","2","","","","","","","","","","5","P -1","-P 1","2","","5-Fluorophenyl-1,3,7,9-tetramethylpyrido[2,3-d:6,5-d]dipyrimidine- 2,4,6,8(1H,3H,7H,9H)-tetrone","","- C19 H16 F N5 O4 -","- C19 H16 F N5 O4 -","- C76 H64 F4 N20 O16 -","4","2","HK2233","Ghorbani, Hosein; Bazgir, Ayoob","5-(4-Fluorophenyl)-1,3,7,9-tetramethylpyrido[2,3-<i>d</i>:6,5-<i>d</i>]dipyrimidine-2,4,6,8(1<i>H</i>,3<i>H</i>,7<i>H</i>,9<i>H</i>)-tetrone","Acta Crystallographica Section E","2007","63","6","o2790","o2790","10.1107/S1600536807020454","","","0.71073","MoKα","","","0.098","","","","0.1844","","","","","","1.225","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213823","43.862","0.006","7.9026","0.0011","13.4958","0.0019","90","","92.783","0.003","90","","4672.4","1.1","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-Hydroxy-3-methoxybenzaldehyde (pyrazin-2-yl)hydrazone","","- C12 H12 N4 O2 -","- C12 H12 N4 O2 -","- C192 H192 N64 O32 -","16","2","HK2234","Chang-Ying Liu; Jing Hu; Yan-Qiao Zhang; Zhi-Chen Zhu; Ming-Jie Zhang","4-Hydroxy-3-methoxybenzaldehyde (pyrazin-2-yl)hydrazone","Acta Crystallographica Section E","2007","63","6","o2888","o2888","10.1107/S1600536807022039","","","0.71073","MoKα","","0.0849","0.0417","","","0.0975","0.1181","","","","","","0.989","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213824","7.1194","0.0012","10.6843","0.0019","13.48","0.002","81.166","0.003","82.397","0.003","81.959","0.004","996.8","0.3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","2,9-Dimethyl-1,10-phenanthrolinium dioxo(pyridine-2,6-dicarboxylato)vanadate(V) monohydrate","","- C21 H18 N3 O7 V -","- C21 H18 N3 O7 V -","- C42 H36 N6 O14 V2 -","2","1","HK2236","Aghabozorg, Hossein; Sadr-khanlou, Elahe","2,9-Dimethyl-1,10-phenanthrolinium dioxido(pyridine-2,6-dicarboxylato)vanadate(V) monohydrate","Acta Crystallographica Section E","2007","63","6","m1753","m1753","10.1107/S1600536807023987","","","0.71073","MoKα","","0.0434","0.0363","","","0.0958","0.1017","","","","","","0.964","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213825","8.025","0.0016","11.365","0.002","12.85","0.003","90","","101.19","0.03","90","","1149.7","0.4","298","2","298","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","4,4'-bibenzocyclobutene","","- C16 H14 -","- C16 H14 -","- C64 H56 -","4","1","HK2237","Feng, Zhi-Qiang; Cang, Hui; Tian, Wen-Wen; Dong, Su-Lan; Wang, Jin-Tang","4,4'-Bibenzocyclobutene","Acta Crystallographica Section E","2007","63","6","o2808","o2808","10.1107/S1600536807020697","","","0.71073","MoKα","","0.0899","0.0501","","","0.1052","0.1401","","","","","","1.078","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213826","14.122","0.003","8.088","0.0016","25.343","0.005","90","","90","","90","","2894.6","1","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2,10,12-Trimethyl-12H-5,7-dioxa-6-thiadibenzo[a,d]cyclooctene 6-oxide","","- C16 H16 O3 S -","- C16 H16 O3 S -","- C128 H128 O24 S8 -","8","2","HK2239","Dong, Su-Lan; Xu, Bing; Feng, Zhi-Qiang; Wang, Jin-Tang","2,10,12-Trimethyl-12<i>H</i>-5,7-dioxa-6-thiadibenzo[<i>a</i>,<i>d</i>]cyclooctene 6-oxide","Acta Crystallographica Section E","2007","63","6","o2992","","10.1107/S1600536807023859","","","0.71073","MoKα","","0.1121","0.054","","","0.098","0.1156","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213827","7.0673","0.0006","9.9909","0.0009","11.2827","0.001","64.181","0.002","77.479","0.002","69.794","0.002","670.92","0.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Piperazinediium pyridine-2,5-dicarboxylate dihydrate","","- C11 H19 N3 O6 -","- C11 H19 N3 O6 -","- C22 H38 N6 O12 -","2","1","HK2240","Sheshmani, Shabnam; Aghabozorg, Hossein; Ghadermazi, Mohammad","Piperazinediium pyridine-2,5-dicarboxylate dihydrate","Acta Crystallographica Section E","2007","63","6","o2869","o2869","10.1107/S1600536807021538","","","0.71073","MoKα","","0.0448","0.0376","","","0.1061","0.1137","","","","","","0.991","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213828","7.4274","0.0005","8.6176","0.0005","10.7314","0.0007","109.989","0.001","102.225","0.001","100.883","0.001","604.81","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Propane-1,3-diaminium pyridine-2,3-dicarboxylate monohydrate","","- C10 H17 N3 O5 -","- C10 H17 N3 O5 -","- C20 H34 N6 O10 -","2","1","HK2241","Manteghi, Faranak; Ghadermazi, Mohammad; Aghabozorg, Hossein","Propane-1,3-diaminium pyridine-2,3-dicarboxylate monohydrate","Acta Crystallographica Section E","2007","63","6","o2809","o2809","10.1107/S1600536807021368","","","0.71073","MoKα","","0.0437","0.036","","","0.0898","0.0967","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213829","37.867","0.003","8.1682","0.0011","10.9666","0.0014","90","","93.45","0.03","90","","3385.9","0.7","298","2","298","2","","","","","","","","6","C 1 2 1","C 2y","5","","(R)-Prop-2-ynyl 2-(4-(5-chloro-3-fluoropyridin-2-yloxy)phenoxy)propanoate","","- C17 H13 Cl F N O4 -","- C17 H13 Cl F N O4 -","- C136 H104 Cl8 F8 N8 O32 -","8","2","HK2242","Liu, Xiao-Geng; Jia, Hong-Sheng; Chen, You-Sheng; Ma, Hong-Fei","(<i>R</i>)-Prop-2-ynyl 2-[4-(5-chloro-3-fluoropyridin-2-yloxy)phenoxy]propanoate","Acta Crystallographica Section E","2007","63","6","o2860","","10.1107/S1600536807021319","","","0.71073","MoKα","","0.0944","0.06","","","0.1458","0.1696","","","","","","1.012","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213831","42.344","0.003","7.2455","0.0006","32.768","0.002","90","","96.48","0.005","90","","9989.1","1.3","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1-(4-Cyanobenzyl)-4-methylpyridinium bis(benzene-1,2-dithiolato)nickelate(III)","","- C26 H21 N2 Ni S4 -","- C26 H21 N2 Ni S4 -","- C416 H336 N32 Ni16 S64 -","16","2","HK2244","Liu, Guang-Xiang","1-(4-Cyanobenzyl)-4-methylpyridinium bis(benzene-1,2-dithiolato)nickelate(III)","Acta Crystallographica Section E","2007","63","6","m1707","","10.1107/S1600536807023847","","","0.71073","MoKα","","0.1923","0.0604","","","0.063","0.0784","","","","","","0.892","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213833","11.5599","0.0017","8.5424","0.0013","25.389","0.004","90","","103.16","0.03","90","","2441.3","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis{tris[μ-2-(1<i>H</i>-pyrazol-3-yl-κ<i>N</i>^1^:κ<i>N</i>^2^)pyridinato- κ<i>N</i>]trisilver(I)}(2 Ag—Ag)","","- C48 H36 Ag6 N18 -","- C48 H36 Ag6 N18 -","- C96 H72 Ag12 N36 -","2","0.5","HK2246","Rong Li","Bis{tris[μ-2-(1<i>H</i>-pyrazol-3-yl-κ<i>N</i>^1^:κ<i>N</i>^2^)pyridinato-κ<i>N</i>]trisilver(I)}(2<i>Ag</i>—<i>Ag</i>)","Acta Crystallographica Section E","2007","63","6","m1640","m1640","10.1107/S1600536807022581","","","0.71073","MoKα","","0.0489","0.0265","","","0.0487","0.0562","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213834","6.6591","0.0013","14.352","0.003","6.8583","0.0014","90","","90.92","0.03","90","","655.4","0.2","294","2","294","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","[DMepyrazineH2].FeBr4","Dimethylpyrazinium tetrabromidoferrate(II)","","- C6 H10 Br4 Fe N2 -","- C6 H10 Br4 Fe N2 -","- C12 H20 Br8 Fe2 N4 -","2","0.5","HK2247","Al-Far, Rawhi; Ali, Basem Fares","Dimethylpyrazinium tetrabromidoferrate(II): Br···aryl···Br and Br···Br intermolecular interactions","Acta Crystallographica Section E","2007","63","6","m1701","m1701","10.1107/S1600536807023070","","","0.71073","MoKα","","0.0669","0.0435","","","0.1002","0.1127","","","","","","0.967","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213835","13.3357","0.001","6.7749","0.0005","15.0185","0.0011","90","","107.417","0.001","90","","1294.68","0.17","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(1,3-Benzoxazol-2-ylsulfanyl)-4<i>H</i>-chromen-4-one","","- C16 H9 N O3 S -","- C16 H9 N O3 S -","- C64 H36 N4 O12 S4 -","4","1","HK2248","Wei Huang","3-(1,3-Benzoxazol-2-ylsulfanyl)-4<i>H</i>-chromen-4-one","Acta Crystallographica Section E","2007","63","6","o2984","o2984","10.1107/S1600536807023914","","","0.71073","MoKα","","0.0811","0.0595","","","0.1447","0.1593","","","","","","0.99","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213836","10.259","0.006","8.989","0.005","14.29","0.008","90","","96.41","0.007","90","","1309.6","1.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","roridin H","","","- C29 H36 O8 -","- C29 H36 O8 -","- C58 H72 O16 -","2","1","HK2249","Gai, Yue; Zhao, Ling-Ling; Hu, Chang-Qi; Zhang, Hui-Ping","Roridin H","Acta Crystallographica Section E","2007","63","6","o2990","o2991","10.1107/S1600536807024786","","","0.71073","MoKα","","0.0599","0.0509","","","0.1229","0.1283","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213837","8.3845","0.0005","13.2688","0.0009","31.833","0.002","90","","94.615","0.001","90","","3530","0.4","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>'-(4-Fluorobenzoyl)-3,4,5-trimethoxybenzohydrazide monohydrate","","- C17 H19 F N2 O6 -","- C17 H19 F N2 O6 -","- C136 H152 F8 N16 O48 -","8","2","HK2252","Muhammad Zareef; Rashid Iqbal; Ghulam Qadeer; Muhammad Arfan; Wai-Yeung Wong","<i>N</i>'-(4-Fluorobenzoyl)-3,4,5-trimethoxybenzohydrazide monohydrate","Acta Crystallographica Section E","2007","63","6","o3052","o3052","10.1107/S1600536807025524","","","0.71073","MoKα","","0.0697","0.0481","","","0.1303","0.1446","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213838","7.475","0.0015","7.932","0.0016","8.345","0.0017","94.12","0.03","115.64","0.03","105.91","0.03","418.5","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Hexane-1,6-diyldipyridinium dibromide","","- C16 H22 Br2 N2 -","- C16 H22 Br2 N2 -","- C16 H22 Br2 N2 -","1","0.5","HK2253","Ren-Jie Ni; Yu Huang; Cheng Yao","Hexane-1,6-diyldipyridinium dibromide","Acta Crystallographica Section E","2007","63","6","o3047","o3047","10.1107/S1600536807025019","","","0.71073","MoKα","","0.0467","0.0346","","","0.0758","0.0818","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213839","18.661","0.005","4.842","0.005","12.041","0.005","90","","106.774","0.005","90","","1041.7","1.2","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-3-(4-Methoxyphenyl)acrylohydrazide","","- C10 H12 N2 O2 -","- C10 H12 N2 O2 -","- C40 H48 N8 O8 -","4","1","HK2254","Ghulam Qadeer; Nasim Hasan Rama; Zhong-Min Su","(<i>E</i>)-3-(4-Methoxyphenyl)acrylohydrazide","Acta Crystallographica Section E","2007","63","6","o2989","o2989","10.1107/S1600536807024981","","","0.71069","MoKα","","0.0636","0.049","","","0.1315","0.1428","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213840","9.777","0.0014","20.189","0.003","12.73","0.0019","90","","99.618","0.003","90","","2477.4","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(3,4,5-trimethoxyphenyl)propanohydrazide","","- C12 H18 N2 O4 -","- C12 H18 N2 O4 -","- C96 H144 N16 O32 -","8","2","HK2255","Ghulam Qadeer; Nasim Hasan Rama; Muhammad Azaad Malik; James Raftery","3-(3,4,5-Trimethoxyphenyl)propanohydrazide","Acta Crystallographica Section E","2007","63","6","o3025","o3025","10.1107/S1600536807025147","","","0.71073","MoKα","","0.0922","0.043","","","0.0692","0.0769","","","","","","0.783","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213841","13.61","0.003","8.913","0.0019","7.978","0.0017","90","","105.266","0.004","90","","933.6","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-Dimethoxybenzohydrazide","","- C9 H12 N2 O3 -","- C9 H12 N2 O3 -","- C36 H48 N8 O12 -","4","1","HK2256","Ghulam Qadeer; Nasim Hasan Rama; Muhammad Azaad Malik; James Raftery","3,4-Dimethoxybenzohydrazide","Acta Crystallographica Section E","2007","63","6","o3026","o3026","10.1107/S1600536807025160","","","0.71073","MoKα","","0.0872","0.0461","","","0.0859","0.0943","","","","","","0.83","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213842","7.2306","0.0009","14.1058","0.0017","19.403","0.002","90","","90","","90","","1979","0.4","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","methyl 2,6-dimethoxybenzoate","","- C10 H12 O4 -","- C10 H12 O4 -","- C80 H96 O32 -","8","1","HK2257","Ghulam Qadeer; Nasim Hasan Rama; Muhammad Azaad Malik; Madeleine Helliwell","Methyl 2,6-dimethoxybenzoate","Acta Crystallographica Section E","2007","63","6","o3027","o3027","10.1107/S1600536807025238","","","0.71073","MoKα","","0.0655","0.0368","","","0.0695","0.0756","","","","","","0.847","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213843","10.973","0.002","7.556","0.0015","17.067","0.003","90","","90.33","0.03","90","","1415","0.5","296","","296","","","","","","","","","5","C 1 2 1","C 2y","5","","(R)-1-Phenylethylaminium μ-oxalato-κ^4^O,O':O''O'''-bis[diaqua(oxalato-κ^2^O,O')cobalt(II)]","","- C22 H32 Co2 N2 O16 -","- C22 H32 Co2 N2 O16 -","- C44 H64 Co4 N4 O32 -","2","0.5","HY2056","Xin Yang; Jiang Li; Hai-Wen Wang; Xin-Hua Zhao; Yong-Kui Shan","Bis[(<i>R</i>)-1-phenylethylaminium] μ-oxalato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>''<i>O</i>'''-bis[diaqua(oxalato-κ^2^<i>O</i>,<i>O</i>')cobaltate(II)]","Acta Crystallographica Section E","2007","63","6","m1554","m1554","10.1107/S1600536807020016","","","0.71073","MoKα","","0.046","0.033","","","0.0829","0.1023","","","","","","1.128","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213844","16.7781","0.0007","10.7594","0.0007","7.4213","0.0003","90","","108.664","0.004","90","","1269.26","0.11","290","2","290","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[(1,10-phenanthroline-κ^2^N,N')cadmate(II)]-di-μ-bromido]","","- C12 H8 Br2 Cd N2 -","- C12 H8 Br2 Cd N2 -","- C48 H32 Br8 Cd4 N8 -","4","0.5","HY2057","Bi-Song Zhang","<i>catena</i>-Poly[[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmate(II)]-di-μ-bromido]","Acta Crystallographica Section E","2007","63","6","m1562","m1562","10.1107/S1600536807020831","","","0.71073","MoKα","","0.0409","0.0286","","","0.0639","0.0673","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213845","6.8293","0.0002","11.8827","0.0004","12.5673","0.0004","86.136","0.002","81.584","0.002","86.151","0.002","1004.87","0.06","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","Aqua[(pyridine-2,6-dicarboxylato-N-oxide-κ^2^O^1^,O^2^) (2,2'-bipyridine-κ^2^N,N')]copper(II) trihydrate","","- C17 H19 Cu N3 O9 -","- C17 H19 Cu N3 O9 -","- C34 H38 Cu2 N6 O18 -","2","1","HY2059","Zhang, Xin-Yan","Aqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(pyridine-2,6-dicarboxylate <i>N</i>-oxide-κ^2^<i>O</i>^1^,<i>O</i>^2^)copper(II) trihydrate","Acta Crystallographica Section E","2007","63","6","m1690","","10.1107/S160053680702315X","","","0.71073","MoKα","","0.0606","0.045","","","0.1288","0.1403","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213846","19.962","0.003","11.4615","0.0017","3.5291","0.0005","90","","95.136","0.012","90","","804.2","0.2","203","2","203","2","","","","","","","","5","C 1 2 1","C 2y","5","","Sodium 2,4-dinitrophenolate Monohydrate","","- C6 H5 N2 Na O6 -","- C6 H5 N2 Na O6 -","- C24 H20 N8 Na4 O24 -","4","1","HY2061","von Prondzinski, Nina; Winter, Manuela; Merz, Klaus","Sodium 2,4-dinitrophenolate monohydrate","Acta Crystallographica Section E","2007","63","6","m1687","m1687","10.1107/S1600536807023409","","","0.71073","MoKα","","0.0595","0.0319","","","0.0361","0.0398","","","","","","0.9","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213847","14.1685","0.0018","10.3545","0.0013","14.9955","0.0019","90","","100.843","0.002","90","","2160.7","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-chlorido-bis[(2-anilinobenzoato-κ^2^O,O')(1,10-phenanthroline- κ^2^N,N')copper(II)]","","- C50 H36 Cl2 Cu2 N6 O4 -","- C50 H36 Cl2 Cu2 N6 O4 -","- C100 H72 Cl4 Cu4 N12 O8 -","2","0.5","HY2064","Hui Jiang; Jian-Fang Ma; Wen-Li Zhang","Di-μ-chlorido-bis[(2-anilinobenzoato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)]","Acta Crystallographica Section E","2007","63","6","m1681","m1681","10.1107/S1600536807024725","","","0.71073","MoKα","","0.0745","0.0396","","","0.0806","0.0918","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213848","5.704","0.001","6.819","0.001","24.823","0.004","90","","90","","90","","965.5","0.3","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[chlorido[(1S,2S)-cyclohexane-1,2-diamine-κ^2^N,N']copper(II)]- μ~3~-chlorido]","","- C6 H14 Cl2 Cu N2 -","- C6 H14 Cl2 Cu N2 -","- C24 H56 Cl8 Cu4 N8 -","4","1","IM2011","Fu, Dai-Wei; Zhao, Hong","<i>catena</i>-Poly[[chlorido[(1<i>S</i>,2<i>S</i>)-cyclohexane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>']copper(II)]-μ~3~-chlorido]","Acta Crystallographica Section E","2007","63","6","m1630","m1630","10.1107/S1600536807021654","","","0.71073","MoKα","","0.0329","0.0311","","","0.0805","0.0816","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213849","8.596","0.001","9.12","0.001","12.342","0.002","94.894","0.002","104.707","0.002","91.295","0.002","931.5","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Iodido(1,4,7,10-tetraazacyclododecane)zinc(II) triiodide","","- C8 H20 I4 N4 Zn -","- C8 H20 I4 N4 Zn -","- C16 H40 I8 N8 Zn2 -","2","1","IM2013","Du, Jun; Jia, Mo; Li, Yi-Zhi","Iodido(1,4,7,10-tetraazacyclododecane)zinc(II) triiodide","Acta Crystallographica Section E","2007","63","6","m1629","m1629","10.1107/S160053680702171X","","","0.71073","MoKα","","0.0946","0.0634","","","0.1355","0.141","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213850","10.352","0.002","19.028","0.004","9.621","0.002","90","","107.02","0.03","90","","1812.1","0.7","291","2","291","2","","","","","","","","5","C 1 c 1","C -2yc","9","","N-benzyl-3-(4-chlorophenyl)-3-phenylacrylamide","","- C22 H18 Cl N O -","- C22 H18 Cl N O -","- C88 H72 Cl4 N4 O4 -","4","1","IM2014","Hu, Yi-Min; Cheng, Dong; Wu, Feng-Hua; Ren, Dong; Ou-Yang Ying","<i>N</i>-Benzyl-3-(4-chlorophenyl)-3-phenylacrylamide","Acta Crystallographica Section E","2007","63","6","o3038","o3038","10.1107/S1600536807023641","","","0.71073","MoKα","","0.0672","0.0552","","","0.1011","0.1034","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213851","9.4814","0.0008","10.6009","0.0009","13.243","0.001","111.908","0.008","91.044","0.007","110.924","0.008","1135.8","0.2","120","2","120","2","","","","","","","","8","P -1","-P 1","2","","Chlorido(4-morpholinecarbodithioato- κ^2^<i>S</i>,<i>S</i>')(triphenylphosphine)nickel(II)","","- C23 H23 Cl N Ni O P S2 -","- C23 H23 Cl N Ni O P S2 -","- C46 H46 Cl2 N2 Ni2 O2 P2 S4 -","2","1","IM2015","Kropidłowska, Anna; Chojnacki, Jarosław; Gołaszewska, Jolanta; Becker, Barbara","Chlorido(4-morpholinecarbodithioato-κ^2^<i>S</i>,<i>S</i>')(triphenylphosphine)nickel(II)","Acta Crystallographica Section E","2007","63","6","m1643","m1643","10.1107/S160053680702209X","","","0.71073","MoKα","","0.0298","0.0275","","","0.0766","0.079","","","","","","1.127","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213852","9.7939","0.0004","9.5488","0.0005","10.3342","0.0008","90","","109.936","0.005","90","","908.54","0.1","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3,4-Dimethylbenzenesulfonamide","3,4-Dimethylbenzenesulfonamide","","- C8 H11 N O2 S -","- C8 H11 N O2 S -","- C32 H44 N4 O8 S4 -","4","1","IM2016","B. Thimme Gowda; Roopa Nayak; Sabine Foro; Jozef Kožíšek; Hartmut Fuess","3,4-Dimethylbenzenesulfonamide","Acta Crystallographica Section E","2007","63","6","o2968","o2968","10.1107/S160053680702483X","","","1.5418","CuKα","","0.0389","0.0371","","","0.1055","0.107","","","","","","1.106","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213853","12.004","0.002","15.727","0.002","8.077","0.001","90","","107.83","0.01","90","","1451.6","0.4","297","2","297","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(4-MMethoxyphenyl)-5-phenylpenta-2,4-dien-1-one","","- C18 H16 O2 -","- C18 H16 O2 -","- C72 H64 O8 -","4","1","IS2156","Bo Zhao; Yu-Zhi Rong; Wei Huang","1-(4-Methoxyphenyl)-5-phenylpenta-2,4-dien-1-one","Acta Crystallographica Section E","2007","63","6","o2971","o2971","10.1107/S1600536807021253","","","0.71073","MoKα","","0.0754","0.0369","","","0.0829","0.0944","","","","","","0.866","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213854","18.6553","0.0017","12.2229","0.0011","11.7912","0.001","90","","105.62","0.001","90","","2589.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis-Dichlorido(N-cyclohexylpropane-1,3-diamine-κ^2^N,N')platinum(II)","","- C9 H20 Cl2 N2 Pt -","- C9 H20 Cl2 N2 Pt -","- C72 H160 Cl16 N16 Pt8 -","8","2","IS2159","Ming-Jin Xie; Xi-Zhu Chen; Wei-Ping Liu; Shu-Qian Hou; Qing-Shong Ye","<i>cis</i>-Dichlorido(<i>N</i>-cyclohexylpropane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>')platinum(II)","Acta Crystallographica Section E","2007","63","6","m1667","m1667","10.1107/S1600536807022817","","","0.71073","MoKα","","0.0534","0.0354","","","0.0829","0.09","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213855","5.3299","0.0011","11.189","0.002","37.172","0.007","90","","93.31","0.03","90","","2213.1","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(2,4-Dinitrophenyl)-2-(propan-2-ylidene)hydrazine","","- C9 H10 N4 O4 -","- C9 H10 N4 O4 -","- C72 H80 N32 O32 -","8","2","IS2160","Liang, Zu-Pei","1-(2,4-Dinitrophenyl)-2-(propan-2-ylidene)hydrazine","Acta Crystallographica Section E","2007","63","6","o2943","o2943","10.1107/S1600536807024749","","","0.71073","MoKα","","0.0924","0.0584","","","0.1239","0.1406","","","","","","1.115","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213856","11.5672","0.0009","5.7425","0.0004","14.6172","0.001","90","","108.143","0.002","90","","922.67","0.12","200","","200","","","","","","","","","4","P 1 21 1","P 2yb","4","","S-Phenyl 4,6-O-benzylidene-2,3-O-carbonyl-1-thia-α-D-mannopyranoside","","- C20 H18 O6 S -","- C20 H18 O6 S -","- C40 H36 O12 S2 -","2","1","IS2162","Manabe, Shino; Ishii, Kazuyuki; Hashizume, Daisuke; Ito, Yukishige","<i>S</i>-Phenyl 4,6-<i>O</i>-benzylidene-2,3-<i>O</i>-carbonyl-1-thia-α-<small>D</small>-mannopyranoside","Acta Crystallographica Section E","2007","63","6","o3028","o3028","10.1107/S1600536807022210","","","0.71073","MoKα","","0.0768","0.0381","","","0.0764","0.1031","","","","","","1.124","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213857","7.6226","0.0011","11.0708","0.0015","17.748","0.002","90","","90","","90","","1497.7","0.3","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-[4-(Benzyloxy)phenyl]-1,1,1-trifluoro-4-hydroxybut-3-en-2-one","","- C17 H13 F3 O3 -","- C17 H13 F3 O3 -","- C68 H52 F12 O12 -","4","1","IS2164","Dun-Jia Wang; Ling Fan; Jing Zheng","4-[4-(Benzyloxy)phenyl]-1,1,1-trifluoro-4-hydroxybut-3-en-2-one","Acta Crystallographica Section E","2007","63","6","o2979","o2979","10.1107/S1600536807024737","","","0.71073","MoKα","","0.1022","0.0572","","","0.1345","0.1523","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213858","5.3979","0.0017","8.806","0.003","14.018","0.004","87.988","0.005","84.165","0.005","84.475","0.005","659.6","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","<i>catena</i>-Poly[[dichloridonickel(II)]-μ-1,2-di-4-pyridylethane- κ^2^N:N']","","- C12 H12 Cl2 N2 Ni -","- C12 H12 Cl2 N2 Ni -","- C24 H24 Cl4 N4 Ni2 -","2","1","IS2165","Zhang, Ling; Yu, Jian","<i>catena</i>-Poly[[dichloridonickel(II)]-μ-1,2-di-4-pyridylethane-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","6","m1759","m1759","10.1107/S1600536807024324","","","0.71073","MoKα","","0.0569","0.0501","","","0.1395","0.1442","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213859","7.1114","0.001","6.5381","0.0006","10.5106","0.0015","90","","99.527","0.011","90","","481.95","0.11","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(E)-Methyl 2-oxo-4-phenylbut-3-enoate","","- C11 H10 O3 -","- C11 H10 O3 -","- C22 H20 O6 -","2","1","IS2168","Nachtsheim, Boris J.; Bolte, Michael","Pseudosymmetric (<i>E</i>)-methyl 2-oxo-4-phenylbut-3-enoate","Acta Crystallographica Section E","2007","63","6","o2947","o2947","10.1107/S1600536807024142","","","0.71073","MoKα","","0.0486","0.0467","","","0.129","0.1299","","","","","","1.193","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213860","25.583","0.005","9.9377","0.0014","20.207","0.003","90","","127.599","0.012","90","","4070.3","1.3","293","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H15 Cl F N5 S -","- C22 H15 Cl F N5 S -","- C176 H120 Cl8 F8 N40 S8 -","8","1","KJ2045","Kaynak, F. Betül","2-[2-(<i>p</i>-Chlorophenyl)benzimidazol-1-ylmethyl]-5-(2-fluoroanilino)-1,3,4-thiadiazole","Acta Crystallographica Section E","2007","63","6","o2798","o2799","10.1107/S1600536807021265","","","0.71073","MoKα","","","0.0432","","","","0.1205","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213861","8.858","0.002","12.61","0.003","25.008","0.006","90","","90","","90","","2793.4","1.1","273","2","273","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Bis{2-[(2-aminophenyl)iminomethyl]-6-carboxyphenolato-κ^3^O,N,N'}zinc(II)","","- C28 H34 N4 O6 Zn -","- C28 H34 N4 O6 Zn -","- C112 H136 N16 O24 Zn4 -","4","1","KJ2054","Zhao-Wen Yu; Qing-Xia Cui; Wu Zhang; Yun-Ling Hao","Bis{2-[(2-aminophenyl)iminomethyl]-6-carboxyphenolato-κ^3^<i>O</i>,<i>N</i>,<i>N</i>'}zinc(II)","Acta Crystallographica Section E","2007","63","6","m1563","m1565","10.1107/S160053680702079X","","","0.71073","MoKα","","0.139","0.0553","","","0.1026","0.1295","","","","","","0.966","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213862","6.3411","0.0013","10.263","0.002","19.803","0.004","90","","90.157","0.004","90","","1288.7","0.4","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-[(4-Chlorophenyl)iminomethyl]-2-methoxyphenol","","- C14 H12 Cl N O2 -","- C14 H12 Cl N O2 -","- C56 H48 Cl4 N4 O8 -","4","1","KJ2055","Shang, Zhen-Hua; Tan, Sheng","4-[(4-Chlorophenyl)iminomethyl]-2-methoxyphenol","Acta Crystallographica Section E","2007","63","6","o2960","o2961","10.1107/S160053680702106X","","","0.71073","MoKα","","0.0888","0.0453","","","","0.1302","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213863","5.0019","0.0004","23.3653","0.0017","5.7871","0.0005","90","","110.151","0.003","90","","634.94","0.09","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","4,4'-Sulfonyldibenzoic acid","","- C14 H10 O6 S -","- C14 H10 O6 S -","- C28 H20 O12 S2 -","2","0.5","KP2097","Lian, Fen-Yan; Yuan, Da-Qiang; Jiang, Fei-Long; Hong, Mao-Chun","4,4'-Sulfonyldibenzoic acid","Acta Crystallographica Section E","2007","63","6","o2870","o2870","10.1107/S1600536807021216","","","0.71073","MoKα","","0.0488","0.0405","","","0.0984","0.1044","","","","","","1.128","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213864","21.78","0.0018","12.3756","0.001","10.0521","0.0008","90","","110.686","0.003","90","","2534.8","0.4","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5-tert-Butyl-2-methoxy-1,3-dinitrobenzene","","- C11 H14 N2 O5 -","- C11 H14 N2 O5 -","- C88 H112 N16 O40 -","8","1","KP2103","Yu-Yuan Ye","5-<i>tert</i>-Butyl-2-methoxy-1,3-dinitrobenzene","Acta Crystallographica Section E","2007","63","6","o2865","o2865","10.1107/S1600536807021666","","","0.71073","MoKα","","0.0635","0.0513","","","0.1502","0.1622","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213865","5.3654","0.0009","6.4093","0.0011","16.847","0.003","86.848","0.003","83.106","0.003","79.309","0.003","564.85","0.17","100","2","100","2","","","","","","","","3","P -1","-P 1","2","work","4,4'-Oxydibenzoic acid","","- C14 H10 O5 -","- C14 H10 O5 -","- C28 H20 O10 -","2","1","KP2104","Potts, Storm; Bredenkamp, Martin W.; Gertenbach, Jan-André","4,4'-Oxydibenzoic acid","Acta Crystallographica Section E","2007","63","6","o2887","o2887","10.1107/S1600536807020570","","","0.71073","MoKα","","0.0703","0.0449","","","0.1081","0.1231","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213867","8.1122","0.0002","9.3093","0.0002","30.2818","0.0008","90","","90","","90","","2286.85","0.1","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-(2-Chlorophenyl)benzamide","","- C13 H10 Cl N O -","- C13 H10 Cl N O -","- C104 H80 Cl8 N8 O8 -","8","1","KP2106","B. Thimme Gowda; B. P. Sowmya; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","<i>N</i>-(2-Chlorophenyl)benzamide","Acta Crystallographica Section E","2007","63","6","o2906","o2906","10.1107/S1600536807022878","","","0.71073","MoKα","","0.0641","0.051","","","0.1488","0.1708","","","","","","1.106","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213868","8.8191","0.0003","13.4997","0.0002","14.7531","0.0002","70.27","0.003","85.255","0.005","89.696","0.005","1647.17","0.07","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","<i>O</i>-Butyl S-(1,1,3-trioxobenz[<i>d</i>]isothiazol-2-yl)methyl dithiocarbonate","","- C13 H15 N O4 S3 -","- C13 H15 N O4 S3 -","- C52 H60 N4 O16 S12 -","4","2","KP2107","Mehmet Akkurt; Selvi Karaca; Ertan Şahin; Özlen Güzel; Aydın Salman","<i>O</i>-Butyl <i>S</i>-(1,1,3-trioxobenz[<i>d</i>]isothiazol-2-yl)methyl dithiocarbonate","Acta Crystallographica Section E","2007","63","6","o2974","o2974","10.1107/S160053680702363X","","","0.71073","MoKα","","0.1917","0.0757","","","0.149","0.1965","","","","","","1.011","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213869","6.6998","0.0019","9.329","0.003","10.478","0.003","64.77","0.003","82.711","0.003","75.384","0.003","573.1","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Bis{3-[(E)-2-(aminocarbonyl)hydrazonomethyl]pyridine}- diaquadiisothiocyanatomanganese(II)","","- C16 H20 Mn N10 O4 S2 -","- C16 H20 Mn N10 O4 S2 -","- C16 H20 Mn N10 O4 S2 -","1","0.5","KP2108","Zhong, Di-Chang; Guo, Gui-Quan; Deng, Ji-Hua","Bis{3-[(<i>E</i>)-2-(aminocarbonyl)hydrazonomethyl]pyridine}diaquadiisothiocyanatomanganese(II)","Acta Crystallographica Section E","2007","63","6","m1747","","10.1107/S1600536807023707","","","0.71073","MoKα","","0.0612","0.0402","","","0.104","0.1159","","","","","","1.059","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213870","8.8886","0.0001","8.9464","0.0002","8.3255","0.0002","90","","93.868","0.001","90","","660.54","0.02","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","trans-bis(isopropylamine) tetrachloro platimun(IV)","trans-tetrachloridobis(isopropylamine)platinum(IV)","","- C6 H18 Cl4 N2 Pt -","- C6 H18 Cl4 N2 Pt -","- C12 H36 Cl8 N4 Pt2 -","2","0.5","LH2358","Sergei D. Kirik; Aleksandr K. Starkov","Powder study of <i>trans</i>-tetrachloridobis(isopropylamine)platinum(IV)","Acta Crystallographica Section E","2007","63","6","m1705","m1706","10.1107/S1600536807024233","","","1.5418","CuKα","","","","","","","","","","1.46","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2213871","16.53","0.002","15.4906","0.0018","18.657","0.002","90","","116.133","0.002","90","","4288.9","0.9","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(tetra-n-butylammonium) tetrabromozincate(II)","","- C32 H72 Br4 N2 Zn -","- C32 H72 Br4 N2 Zn -","- C128 H288 Br16 N8 Zn4 -","4","1","LH2361","Feng-Xian Gao; Wen Gu; Yong-Sheng Yang; Jing Qian; Shi-Ping Yan","Bis(tetra-<i>n</i>-butylammonium) tetrabromidozincate(II)","Acta Crystallographica Section E","2007","63","6","m1621","m1621","10.1107/S160053680702140X","","","0.71073","MoKα","","0.1806","0.0496","","","0.1142","0.1613","","","","","","0.955","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2213872","14.921","0.007","8.885","0.005","18.954","0.01","90","","90","","90","","2513","2","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","methyl 2-(thiazol-2-ylcarbamoyl)benzoate","","- C12 H10 N2 O3 S -","- C12 H10 N2 O3 S -","- C96 H80 N16 O24 S8 -","8","1","LH2365","Liang, Zu-Pei; Li, Jian; Wan, Ai-Yu; Wang, Hui-Qin","Methyl 2-[<i>N</i>-(thiazol-2-yl)carbamoyl]benzoate","Acta Crystallographica Section E","2007","63","6","o2819","","10.1107/S1600536807021241","","","0.71073","MoKα","","0.0729","0.0402","","","0.0943","0.1127","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213873","9.79","0.002","12.657","0.003","16.039","0.004","76.38","0.004","84.743","0.004","77.753","0.004","1885.8","0.8","299","2","298","2","","","","","","","","6","P -1","-P 1","2","","Chlorido[N,N,N',N'-tetrakis(benzimidazol-2-ylmethyl)ethane-1,2- diamine]manganese(II) chloride monohydrate","","- C34 H34 Cl2 Mn N10 O -","- C34 H34 Cl2 Mn N10 O -","- C68 H68 Cl4 Mn2 N20 O2 -","2","1","LH2366","Ya-Mei Pei; Chun-Shan Zhou; Xiang-Gao Meng; Li Wang; Chang-Lin Liu","Chlorido[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis(benzimidazol-2-ylmethyl)ethane-1,2-diamine]manganese(II) chloride monohydrate","Acta Crystallographica Section E","2007","63","6","m1571","m1572","10.1107/S1600536807021034","","","0.71073","Mokα","","0.0554","0.0452","","","0.1217","0.1266","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213874","10.1328","0.0013","12.3212","0.0017","15.0666","0.0018","108.147","0.01","105.921","0.01","91.638","0.011","1705.5","0.4","95","1","95","1","","","","","","","","7","P -1","-P 1","2","","(Thiocyanato-κ<it>N</it>)(tris{2-[(3-phenylallylidene)amino]ethyl}amine- κ^4^<it>N</it>,<it>N</it>',<it>N</it>'',<it>N</it>''')copper(II) perchlorate","","- C34 H36 Cl Cu N5 O4 S -","- C34 H36 Cl Cu N5 O4 S -","- C68 H72 Cl2 Cu2 N10 O8 S2 -","2","1","LH2374","Aliakbar Dehno Khalaji; Mehdi Amirnasr; Schenk, Kurt J.","(Thiocyanato-κ<i>N</i>)(tris{2-[(3-phenylallylidene)amino]ethyl}amine-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')copper(II) perchlorate","Acta Crystallographica Section E","2007","63","6","m1674","m1675","10.1107/S1600536807023756","","","0.71073","MoKα","","0.0702","0.0595","","","0.1605","0.1679","","","","","","1.178","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213875","8.4296","0.0006","17.6744","0.0012","14.279","0.001","90","","92.421","0.001","90","","2125.5","0.3","294","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2',2'',2'''-[N,N,N',N'-(3,6-Dioxaoctane-1,8- diyldinitrilo)tetramethylene]tetrakis(benzimidazolium) tetranitrate","","- C38 H44 N14 O14 -","- C38 H44 N14 O14 -","- C76 H88 N28 O28 -","2","0.5","LH2376","Zhou, Chun-Shan; Hu, Si; Meng, Xiang-Gao","2,2',2'',2'''-[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-(3,6-Dioxaoctane-1,8-diyldinitrilo)tetramethylene]tetrakis(benzimidazolium) tetranitrate","Acta Crystallographica Section E","2007","63","6","o2800","o2800","10.1107/S1600536807020764","","","0.71073","MoKα","","0.127","0.0647","","","0.1459","0.1686","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213876","9.173","0.0018","10.539","0.002","14.984","0.003","90","","99.43","0.03","90","","1429","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","calcium pyridazinate","Bis(μ-pyridazine-3-carboxylato)-κ^3^N,O:O;κ^3^O:N,O-bis[triaquacalcium(II)]","","- C20 H24 Ca2 N8 O14 -","- C20 H24 Ca2 N8 O14 -","- C40 H48 Ca4 N16 O28 -","2","0.5","LH2377","Wojciech Starosta; Janusz Leciejewicz","Bis(μ-pyridazine-3-carboxylato)-κ^3^<i>N</i>,<i>O</i>:<i>O</i>;κ^3^<i>O</i>:<i>N</i>,<i>O</i>-bis[triaquacalcium(II)]","Acta Crystallographica Section E","2007","63","6","m1662","m1663","10.1107/S1600536807022544","","","0.71073","MoKα","","0.056","0.0328","","","0.0916","0.102","","","","","","0.983","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213877","6.5","0.0004","11.3153","0.0005","16.4559","0.0008","90","","90.716","0.004","90","","1210.23","0.11","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","9α-Chloro-16α-methyl-3,11-dioxoandrosta-1,4,6-triene-17β-carboxylic acid","","- C27 H35 Cl O5 -","- C27 H35 Cl O5 -","- C54 H70 Cl2 O10 -","2","1","LH2378","Azim, Irum; Davison, Mark; Dufort, Marisa DeVita; Lalancette, Roger A.; Thompson, Hugh W.","9α-Chloro-16α-methyl-3,11-dioxoandrosta-1,4,6-triene-17β-carboxylic acid pinacolone solvate: catemeric hydrogen bonding and pinacolone solvation in a steroidal diketo acid derived from a commercial glucocorticoid","Acta Crystallographica Section E","2007","63","6","o2853","o2853","10.1107/S1600536807021435","","","1.54178","CuKα","","0.048","0.046","","","0.119","0.121","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213878","10.8389","0.0009","6.7367","0.0006","12.5802","0.0011","90","","107.546","0.001","90","","875.85","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[triaquamanganese(II)]-μ-1,2,4-triazole-3,5-dicarboxylato- κ^3^O^3^:N^4^,O^5^]","","- C4 H7 Mn N3 O7 -","- C4 H7 Mn N3 O7 -","- C16 H28 Mn4 N12 O28 -","4","1","LH2379","Yuan-Yuan Liu","<i>catena</i>-Poly[[triaquamanganese(II)]-μ-1,2,4-triazole-3,5-dicarboxylato-κ^3^<i>O</i>^3^:<i>N</i>^4^,<i>O</i>^5^]","Acta Crystallographica Section E","2007","63","6","m1605","m1605","10.1107/S1600536807021563","","","0.71073","MoKα","","0.0235","0.0207","","","0.0564","0.0575","","","","","","1.05","","","","has coordinates,has Fobs","209451","2020-10-21","18:00:00",""
"2213879","9.887","0.004","8.177","0.004","17.791","0.007","90","","108.612","0.019","90","","1363.1","1","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","(Acetato-κ^2^O,O')bis(1,10-phenanthroline-κ^2^N,N')cadmium(II) perchlorate dihydrate","","- C26 H23 Cd Cl N4 O8 -","- C26 H23 Cd Cl N4 O8 -","- C52 H46 Cd2 Cl2 N8 O16 -","2","0.5","LH2380","Hu, Bo; Wang, Min; Lan, Shen-Min; Wang, Xiao-Yan; Deng, Xiao-Tao","(Acetato-κ^2^<i>O</i>,<i>O</i>')bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II) perchlorate dihydrate","Acta Crystallographica Section E","2007","63","6","m1676","m1676","10.1107/S1600536807022908","","","0.71073","MoKα","","0.0697","0.0587","","","0.1479","0.1554","","","","","","1.047","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213880","10.012","0.005","26.85","0.005","7.031","0.005","90","","101.245","0.005","90","","1853.8","1.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,17-Dibromo-6,7,9,10,12,13- hexahydrodibenzo[b,e][1,4,7,10,13]pentaoxacyclopentadecin monohydrate","","- C18 H20 Br2 O6 -","- C18 H20 Br2 O6 -","- C72 H80 Br8 O24 -","4","1","LH2381","Kotlyar, Sergei A.; Shishkina, Svetlana V.; Shishkin, Oleg V.; Grygorash, Ruslan Ya.; Pluzhnik-Gladyr, Sergei M.; Kamalov, Gerbert L.","2,17-Dibromo-6,7,9,10,12,13-hexahydrodibenzo[<i>b</i>,<i>e</i>][1,4,7,10,13]pentaoxacyclopentadecin monohydrate","Acta Crystallographica Section E","2007","63","6","o2904","o2904","10.1107/S1600536807022532","","","0.71069","MoKα","","0.0796","0.0529","","","0.1341","0.1562","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213881","6.919","0.003","7.617","0.003","12.06","0.005","93.213","0.007","94.64","0.006","94.614","0.007","630.2","0.5","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","(<i>N</i><i>^9^</i>-adenine-κ<i>N</i>)aqua[glycylglycinato(2-)-\ κ^3^N,N',O]copper(II)","","- C9 H13 Cu N7 O4 -","- C9 H13 Cu N7 O4 -","- C18 H26 Cu2 N14 O8 -","2","1","LH2382","Brandi-Blanco, María Pilar; Dumet-Fernandes, Bruno; González-Pérez, Josefa María; Choquesillo-Lazarte, Duane","A redetermination of (<i>N^9^</i>-adenine-κ<i>N</i>)aqua[glycylglycinato(2{-})-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]copper(II)","Acta Crystallographica Section E","2007","63","6","m1598","m1598","10.1107/S1600536807021605","","","0.71073","MoKα","","0.0921","0.0591","","","0.1459","0.166","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213882","13.045","0.002","7.341","0.001","16.869","0.002","90","","101.757","0.002","90","","1581.5","0.4","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquabis[5-(pyrazin-2-yl)-5H-tetrazolato-κ^2^N,N']copper(II) monohydrate","","- C10 H12 Cu N12 O3 -","- C10 H12 Cu N12 O3 -","- C40 H48 Cu4 N48 O12 -","4","0.5","LH2383","Liu, Ju-Tao; Fan, Sheng-Di; Ng, Seik Weng","Diaquabis[5-(pyrazin-2-yl)-5<i>H</i>-tetrazolato-κ^2^<i>N</i>,<i>N</i>']copper(II) monohydrate","Acta Crystallographica Section E","2007","63","6","m1651","m1651","10.1107/S1600536807022702","","","0.71073","MoKα","","0.033","0.027","","","0.074","0.077","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213883","25.2969","0.0006","5.7523","0.0002","15.7938","0.0004","90","","110.484","0.001","90","","2152.92","0.11","295","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[diaqua-μ~3~-nitrato-[μ~2~-5-(2-pyrazinyl)-5<i>H</i>-tetrazolato]lead(II)]","","- C5 H7 N7 O5 Pb -","- C5 H7 N7 O5 Pb -","- C40 H56 N56 O40 Pb8 -","8","1","LH2384","Liu, Ju-Tao; Fan, Sheng-Di; Ng, Seik Weng","Poly[diaqua-μ~3~-nitrato-[μ~2~-5-(2-pyrazinyl)-5<i>H</i>-tetrazolato]lead(II)]","Acta Crystallographica Section E","2007","63","6","m1652","m1652","10.1107/S1600536807023781","","","0.71073","MoKα","","0.034","0.027","","","0.073","0.078","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213884","6.0861","0.0013","49.81","0.01","7.4043","0.0015","90","","90.386","0.004","90","","2244.6","0.8","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-[2-(4-Methoxyphenoxy)ethyl]acetamide","","- C11 H15 N O3 -","- C11 H15 N O3 -","- C88 H120 N8 O24 -","8","2","LH2385","Shang, Zhen-Hua; Lv, Hai-Jun; Gao, Jin-Long","<i>N</i>-[2-(4-Methoxyphenoxy)ethyl]acetamide","Acta Crystallographica Section E","2007","63","6","o2959","o2959","10.1107/S1600536807022726","","","0.71073","MoKα","","0.1166","0.0562","","","","0.0904","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213885","12.743","0.002","14.399","0.003","14.554","0.003","97.562","0.002","112.766","0.002","114.42","0.002","2102.6","0.7","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Iodido[tris(1-methylbenzimidazol-2-ylmethyl)amine]zinc(II) perchlorate dimethylformamide hemisolvate","","- C28.5 H30.5 Cl I N7.5 O4.5 Zn -","- C28.5 H30.5 Cl I N7.5 O4.5 Zn -","- C57 H61 Cl2 I2 N15 O9 Zn2 -","2","1","LH2386","Huilu Wu; Biao Qi; Weibing Lv; Peng Liu; Jigang Liu","Iodido[tris(1-methylbenzimidazol-2-ylmethyl)amine]zinc(II) perchlorate dimethylformamide hemisolvate","Acta Crystallographica Section E","2007","63","6","m1741","m1741","10.1107/S1600536807024087","","","0.71073","MoKα","","0.1167","0.0685","","","0.1886","0.2445","","","","","","1.091","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2213886","7.0584","0.0016","8.4025","0.0019","9.875","0.002","102.633","0.003","96.05","0.003","103.51","0.003","548.1","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[iodidocadmium(II)]-di-μ-iodido-[iodidocadmium(II)]-bis(μ- 4-methylpyridine N-oxide)]","","- C6 H7 Cd I2 N O -","- C6 H7 Cd I2 N O -","- C12 H14 Cd2 I4 N2 O2 -","2","1","LH2387","Zhang, Shi-Guo; Shi, Jing-Min","<i>catena</i>-Poly[[iodidocadmium(II)]-di-μ-iodido-[iodidocadmium(II)]-bis(μ-4-methylpyridine <i>N</i>-oxide)]","Acta Crystallographica Section E","2007","63","6","m1730","m1730","10.1107/S1600536807022921","","","0.71073","MoKα","","0.0365","0.0299","","","0.0678","0.0696","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213887","10.497","0.003","11.451","0.003","11.863","0.003","65.65","0.02","69.654","0.019","70.18","0.02","1185.6","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","[3-Amino-5-(3,5-dimethylanilino)-4-phenylsulfonyl-2-thienyl]phenylmethanone","","- C25 H22 N2 O3 S2 -","- C25 H22 N2 O3 S2 -","- C50 H44 N4 O6 S4 -","2","1","LH2388","Konovalova, Irina S.; Baumer, Vyacheslav N.; Shishkin, Oleg V.; Vlasenko, Yu. D.; Parkhomenko, O. O.; Kovalenko, S. M.","[3-Amino-5-(3,5-dimethylanilino)-4-phenylsulfonyl-2-thienyl]phenylmethanone","Acta Crystallographica Section E","2007","63","6","o3011","o3011","10.1107/S160053680702377X","","","0.71073","MoKα","","0.0618","0.0426","","","0.1017","0.1084","","","","","","1.019","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213888","13.7628","0.0008","13.0656","0.0008","16.9752","0.001","90","","90","","90","","3052.5","0.3","299","2","299","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-(Hydrazinecarbonyl)pyridinium 3-carboxy-4-hydroxybenzenesulfonate monohydrate","","- C13 H15 N3 O8 S -","- C13 H15 N3 O8 S -","- C104 H120 N24 O64 S8 -","8","1","LH2389","Xie, Zhi-Yuan","4-(Hydrazinecarbonyl)pyridinium 3-carboxy-4-hydroxybenzenesulfonate monohydrate","Acta Crystallographica Section E","2007","63","6","o2956","o2956","10.1107/S1600536807023124","","","0.71073","Mokα","","0.0857","0.0574","","","0.1174","0.1296","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213889","12.425","0.003","9.6851","0.0019","12.305","0.003","90","","90.5","0.03","90","","1480.7","0.6","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Diaquabis(ethylenediamine)zinc(II)] [bis(4-aminonaphthalene-1-sulfonate)] dihydrate","[Diaquabis(ethylenediamine-κ^2^N,N')zinc(II)] [bis(4-aminonaphthalene-1-sulfonate)] dihydrate","","- C24 H40 N6 O10 S2 Zn -","- C24 H40 N6 O10 S2 Zn -","- C48 H80 N12 O20 S4 Zn2 -","2","0.5","LH2390","Ming-Tian Li; Xu-Cheng Fu; Xiao-Yan Wang; Cheng-Gang Wang","Diaquabis(ethylenediamine-κ^2^<i>N</i>,<i>N</i>')zinc(II) bis(4-aminonaphthalene-1-sulfonate) dihydrate","Acta Crystallographica Section E","2007","63","6","m1677","m1677","10.1107/S1600536807024439","","","0.71073","MoKα","","0.0471","0.0384","","","0.0831","0.0863","","","","","","0.981","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213890","8.2095","0.0001","12.9738","0.0002","18.8054","0.0003","90","","93.2975","0.0007","90","","1999.62","0.05","150","","150","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","2,5-Bis(2-naphthylmethylsulfanyl)-1-thia-3,4-diazacyclopenta-2,5-diene","","- C24 H18 N2 S3 -","- C24 H18 N2 S3 -","- C96 H72 N8 S12 -","4","1","LH2391","How, Fiona N.-F.; Watkin, David J.; Crouse, Karen A.; M. Ibrahim M. Tahir","2,5-Bis(2-naphthylmethylsulfanyl)-1-thia-3,4-diazacyclopenta-2,5-diene","Acta Crystallographica Section E","2007","63","6","o2913","o2913","10.1107/S1600536807024257","","","0.71073","MoKα","","0.0344","0.0344","","0.0724","0.0724","0.0724","","","","","","0.9815","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213891","14.5247","0.0008","12.0634","0.0006","15.8698","0.0008","90","","104.157","0.001","90","","2696.2","0.2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Aqua[7,11:19,23-dinitrilo-1,5,13,17-tetraazacyclotetracosa- 1(24),5,7,9,12,17,20,22-octaene]bis(perchlorato- κ^2^<i>O</i>,<i>O</i>')barium(II) monohydrate","","- C20 H26 Ba Cl2 N6 O10 -","- C20 H22 Ba Cl2 N6 O10 -","- C80 H88 Ba4 Cl8 N24 O40 -","4","0.5","LH2395","Dennett, Rebecca; James, Leanne; McKee, Vickie","Aqua[7,11:19,23-dinitrilo-1,5,13,17-tetraazacyclotetracosa-1(24),5,7,9,12,17,20,22-octaene]bis(perchlorato-κ^2^<i>O</i>,<i>O</i>')barium(II) monohydrate","Acta Crystallographica Section E","2007","63","6","m1720","m1721","10.1107/S1600536807024270","","","0.71073","MoKα","","0.0244","0.0227","","","0.0565","0.0572","","","","","","1.194","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213892","7.7423","0.0002","8.2816","0.0002","14.0409","0.0004","81.2501","0.0013","80.5729","0.0013","85.7886","0.0013","876.7","0.04","150","","150","","","","","","","","","4","P -1","-P 1","2","","2-Quinolylmethyl N'-[1-(<i>m</i>-tolyl)ethylidene]hydrazinecarbodithioate","","- C20 H19 N3 S2 -","- C20 H19 N3 S2 -","- C40 H38 N6 S4 -","2","1","LW2012","How, Fiona N.-F.; Watkin, David J.; Crouse, Karen A.; M. Ibrahim M. Tahir","2-Quinolylmethyl <i>N</i>'-[1-(<i>m</i>-tolyl)ethylidene]hydrazinecarbodithioate","Acta Crystallographica Section E","2007","63","6","o2912","o2912","10.1107/S1600536807022313","","","0.71073","MoKα","","0.061","0.061","","0.095","0.095","0.095","","","","","","0.9313","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213893","8.655","0.0002","5.2531","0.0001","16.2401","0.0004","90","","98.983","0.001","90","","729.31","0.03","120","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(4-Hydroxyphenoxy)acetic acid","","- C8 H8 O4 -","- C8 H8 O4 -","- C32 H32 O16 -","4","1","LW2013","Byres, Maureen; Cox, Philip J.","(4-Hydroxyphenoxy)acetic acid","Acta Crystallographica Section E","2007","63","6","o2931","o2931","10.1107/S1600536807022714","","","0.71073","MoKα","","","0.0336","","","","0.0991","","","","","","1.065","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213894","12.4431","0.0018","8.5528","0.0012","15.47","0.002","90","","106.399","0.002","90","","1579.4","0.4","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(4-hydroxyphenyl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one","","- C18 H18 O5 -","- C18 H18 O5 -","- C72 H72 O20 -","4","1","LW2015","Harrison, William T. A.; Vijaya Kumari; H. J. Ravindra; S. M. Dharmaprakash","1-(4-Hydroxyphenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","6","o2928","o2928","10.1107/S1600536807024038","","","0.71073","MoKα","","0.1287","0.0662","","","0.1545","0.1792","","","","","","0.998","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213895","5.2259","0.0006","5.5567","0.0008","34.056","0.001","90","","90","","90","","988.94","0.18","301","2","301","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Methanesulfon-2,3-dimethylanilide","<i>N</i>-(2,3-dimethylphenyl)methanesulfonamide","","- C9 H13 N O2 S -","- C9 H13 N O2 S -","- C36 H52 N4 O8 S4 -","4","1","LW2017","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(2,3-Dimethylphenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","6","o3014","o3014","10.1107/S1600536807025202","","","0.71073","MoKα","","0.0594","0.0542","","","0.1269","0.1299","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213896","12.312","0.001","6.1393","0.0006","13.907","0.001","90","","107.206","0.009","90","","1004.15","0.15","299","2","299","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Methanesulfon-2,4-dimethylanilide","N-(2,4-dimethylphenyl)methanesulfonamide","","- C9 H13 N O2 S -","- C9 H13 N O2 S -","- C36 H52 N4 O8 S4 -","4","1","LW2019","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(2,4-Dimethylphenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","6","o3015","o3015","10.1107/S1600536807025226","","","1.5418","CuKα","","0.0956","0.0546","","","0.1393","0.1606","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213897","12.208","0.002","17.727","0.004","20.295","0.004","106.31","0.03","99.3","0.03","103.14","0.03","3983.7","1.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","{(2-guanidinobenzimidazole-κ^2^<i>N</i>,<i>N</i>')[hydridotris(3,5- methylphenylpyrazolyl)borato-κ^3^N,N',N'']}cobalt(II) perchlorate‒{(2-guanidinobenzimidazolato-κ^2^N,N')[hydridotris(3,5- methylphenylpyrazolyl)borato-κ^3^N,N',N'']cobalt(II)} methanol solvate monohydrate","","- C77 H79 B2 Cl Co2 N22 O6 -","- C77 H77 B2 Cl Co2 N22 O6 -","- C154 H154 B4 Cl2 Co4 N44 O12 -","2","1","LX2001","He, Hong-Shan","Cocrystal of (2-guanidinobenzimidazole-κ^2^<i>N</i>,<i>N</i>')[hydridotris(3,5-methylphenylpyrazolyl)borato-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']cobalt(II) perchlorate and (2-guanidinobenzimidazolato-κ^2^<i>N</i>,<i>N</i>')[hydridotris(3,5-methylphenylpyrazolyl)borato-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']cobalt(II) methanol solvate monohydrate","Acta Crystallographica Section E","2007","63","6","m1573","m1575","10.1107/S1600536807020752","","","0.71073","MoKα","","0.1355","0.0617","","","0.1595","0.1975","","","","","","1.021","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213898","10.0053","0.0001","13.1391","0.0002","25.9006","0.0005","90","","90","","90","","3404.91","0.09","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","","Bis(trimethyltin)glutarate","Poly[bis(trimethyltin)-μ-glutarato]","","- C11 H24 O4 Sn2 -","- C11 H24 O4 Sn2 -","- C88 H192 O32 Sn16 -","8","2","LX2005","Boye, Mouhamadou S.; Diassé-Sarr, Aminata; Molloy, Kieran C.; Gabriele Kociok-Köhn; Mahieu, Bernard","Poly[bis(trimethyltin)-μ-glutarato]","Acta Crystallographica Section E","2007","63","6","m1724","m1726","10.1107/S1600536807023926","","","0.71073","MoKα","","0.0397","0.0312","","","0.0586","0.0617","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213899","16.2219","0.0007","8.5208","0.0002","18.1612","0.0007","90","","90","","90","","2510.31","0.16","120","","120","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","6-Fluoro-4-methyl-2-(3-pyridyl)-1,2,3,4-tetrahydroquinoline","","- C15 H15 F N2 -","- C15 H15 F N2 -","- C120 H120 F8 N16 -","8","1","LX2006","Vizcaya, Luis A.; Mora, Asiloé J.; Vargas, Leonor Y.; Kouznetsov, Vladimir V.; Bahsas, Ali","6-Fluoro-4-methyl-2-(3-pyridyl)-1,2,3,4-tetrahydroquinoline","Acta Crystallographica Section E","2007","63","6","o2914","o2914","10.1107/S1600536807022222","","","0.50915","synchrotron","","0.0674","0.0629","","","0.1755","0.1783","","","","","","1.131","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213900","17.67","0.004","4.8","0.001","11.751","0.002","90","","94.42","0.03","90","","993.7","0.4","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis[(2-phenyl-2H-1,2,3-triazol-4-yl)methylidene]benzene-1,4-diamine","","- C24 H18 N8 -","- C24 H18 N8 -","- C48 H36 N16 -","2","0.5","LX2008","Jun Hu; Zheng-Feng Xie; Fang-Ming Liu","<i>N</i>,<i>N</i>'-Bis[(2-phenyl-2<i>H</i>-1,2,3-triazol-4-yl)methylidene]benzene-1,4-diamine","Acta Crystallographica Section E","2007","63","6","o2934","o2934","10.1107/S1600536807022830","","","0.71073","MoKα","","0.056","0.0413","","","0.1067","0.1196","","","","","","1.016","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2213901","8.3899","0.0009","6.0651","0.0004","28.305","0.003","90","","100.502","0.009","90","","1416.2","0.2","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-2-[4-(Dimethylamino)phenyliminomethyl]-6-methylphenol","","- C16 H18 N2 O -","- C16 H18 N2 O -","- C64 H72 N8 O4 -","4","1","LX2009","Gül, Zarife Sibel; Erşahin, Ferda; Aǧar, Erbil; Işık, Şamil","(<i>E</i>)-2-[4-(Dimethylamino)phenyliminomethyl]-6-methylphenol","Acta Crystallographica Section E","2007","63","6","o2902","o2902","10.1107/S1600536807022556","","","0.71073","MoKα","","0.1221","0.044","","","0.0937","0.1123","","","","","","0.823","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213902","23.553","0.005","11.549","0.002","11.227","0.002","90","","96.06","0.03","90","","3036.8","1","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Sodium barium hexahydrogenhexamolybdoaluminate(II) decahydrate","","- Al Ba H26 Mo6 Na O34 -","- Al Ba H26 Mo6 Na O34 -","- Al4 Ba4 H104 Mo24 Na4 O136 -","4","0.5","MG2022","Pan, Yi-Bing; Cao, Rui-Ge; Liu, Shu-Xia","Sodium barium hexahydrogenhexamolybdoaluminate(III) decahydrate","Acta Crystallographica Section E","2007","63","6","i140","i141","10.1107/S1600536807021733","","","0.71073","MoKα","","0.0408","0.0367","","","0.085","0.0866","","","","","","1.136","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213903","8.4797","0.0005","10.593","0.0005","13.8527","0.001","90","","90","","90","","1244.33","0.13","291","2","291","2","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- H4 Na2 O6 W -","- H4 Na2 O6 W -","- H32 Na16 O48 W8 -","8","1","MG2024","Farrugia, Louis J.","Sodium tungstate dihydrate: a redetermination","Acta Crystallographica Section E","2007","63","6","i142","i142","10.1107/S1600536807023355","","","0.71073","MoKα","","0.023","0.0207","","","","0.0532","","","","","","1.256","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213904","10.0049","0.0007","7.8533","0.0006","21.88","0.002","90","","90.853","0.001","90","","1719","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,5-Dimethyl-3,4-bis(methylsulfanyl)-7-phenylbenzo[1,2-b:4,3-b']difuran","","- C20 H18 O2 S2 -","- C20 H18 O2 S2 -","- C80 H72 O8 S8 -","4","1","NC2024","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","2,5-Dimethyl-3,4-bis(methylsulfanyl)-7-phenylbenzo[1,2-<i>b</i>:4,3-<i>b</i>']difuran","Acta Crystallographica Section E","2007","63","6","o2920","o2921","10.1107/S1600536807022520","","","0.71073","MoKα","","0.0701","0.0605","","","0.1214","0.1263","","","","","","1.076","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213905","15.44","0.002","7.4165","0.001","14.598","0.002","90","","117.347","0.002","90","","1484.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-[3-(2-Nitrophenyl)allylidene]naphthalen-1-amine","","- C19 H14 N2 O2 -","- C19 H14 N2 O2 -","- C76 H56 N8 O8 -","4","1","NC2032","Xiao-Yan Yang; Xiao-Lian He; Ying Li; Sai Bi","<i>N</i>-[3-(2-Nitrophenyl)allylidene]naphthalen-1-amine","Acta Crystallographica Section E","2007","63","6","o2919","o2919","10.1107/S1600536807022453","","","0.71073","MoKα","","0.073","0.0466","","","0.1086","0.1237","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213906","8.3158","0.0001","9.2087","0.0001","16.2114","0.0001","89.7346","0.0005","88.7088","0.0004","83.6367","0.0005","1233.47","0.02","100","2","100","2","","","","","","","","7","P 1","P 1","1","","Bis[4'-(3,5-dibromophenyl)-2,2':6',2''-terpyridine]ruthenium(II) bis(hexafluorophosphate) acetonitrile disolvate","","- C46 H32 Br4 F12 N8 P2 Ru -","- C46 H32 Br4 F12 N8 P2 Ru -","- C46 H32 Br4 F12 N8 P2 Ru -","1","1","NC2035","Chartrand, Daniel; Theobald, Isabelle; Hanan, Garry S.","Bis[4'-(3,5-dibromophenyl)-2,2':6',2''-terpyridine]ruthenium(II) bis(hexafluorophosphate) acetonitrile disolvate","Acta Crystallographica Section E","2007","63","6","m1561","m1561","10.1107/S1600536807020259","","","1.54178","CuKα","","0.0251","0.0249","","","0.0622","0.0623","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213907","9.1653","0.0005","8.9841","0.0006","12.9597","0.0007","90","","107.933","0.003","90","","1015.28","0.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(8-aminoquinoline-κ^2^N,N')diperchloratocadmium(II)","","- C18 H16 Cd Cl2 N4 O8 -","- C18 H16 Cd Cl2 N4 O8 -","- C36 H32 Cd2 Cl4 N8 O16 -","2","0.5","NC2036","L.-M. Guo; H. Xu; X.-M. Ren","Bis(8-aminoquinoline-κ^2^<i>N</i>,<i>N</i>')diperchloratocadmium(II)","Acta Crystallographica Section E","2007","63","6","m1579","m1579","10.1107/S1600536807021125","","","0.71073","MoKα","","0.0315","0.0256","","","0.0707","0.076","","","","","","0.914","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213908","11.634","0.002","12.983","0.002","14.908","0.003","90","","90","","90","","2251.8","0.7","293","2","293","2","","","","","","","","6","I b a 2","I 2 -2c","45","","{Dimethyl [2,2'-(ethane-1,2-diyldioxy)bis(benzylidenehydrazono)]bis(dithioformato)- κ^4^S,N,N',S'}copper(II)","","- C20 H20 Cu N4 O2 S4 -","- C20 H20 Cu N4 O2 S4 -","- C80 H80 Cu4 N16 O8 S16 -","4","0.5","NG2251","Mei, Guang-Quan; Huang, Ke-Long","{Dimethyl [2,2'-(ethane-1,2-diyldioxy)bis(benzylidenehydrazono)]bis(dithioformato)-κ^4^<i>S</i>,<i>N</i>,<i>N</i>',<i>S</i>'}copper(II)","Acta Crystallographica Section E","2007","63","6","m1653","m1653","10.1107/S1600536807022295","","","0.71073","MoKα","","0.0554","0.042","","","0.0587","0.061","","","","","","0.985","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213909","16.542","0.002","9.05","0.002","13.728","0.002","90","","111.507","0.01","90","","1912.1","0.6","296","2","296","2","","","","","","","","8","C 1 2 1","C 2y","5","","Λ~L~Λ~L~-Bis(μ-L-cysteinato)- 1:2κ^3^S:<i>N</i>,<i>S</i>;1:3κ^3^S:<i>N</i>,<i>S</i>- tetrakis(ethylenediamine)-2κ^4^<i>N</i>,<i>N</i>';3κ^4^<i>N</i>,<i>N</i>'- dicobalt(III)silver(I) tris(perchlorate) pentahydrate","","- C14 H52 Ag Cl3 Co2 N10 O21 S2 -","- C14 H52 Ag Cl3 Co2 N10 O21 S2 -","- C28 H104 Ag2 Cl6 Co4 N20 O42 S4 -","2","0.5","NG2256","Tamura, Motoshi; Yoshinari, Nobuto; Igashira-Kamiyama, Asako; Konno, Takumi","Λ~L~Λ~L~-Bis(μ-<small>L</small>-cysteinato)-1:2κ^3^<i>S</i>:<i>N</i>,<i>S</i>;1:3κ^3^<i>S</i>:<i>N</i>,<i>S</i>-tetrakis(ethylenediamine)-2κ^4^<i>N</i>,<i>N</i>';3κ^4^<i>N</i>,<i>N</i>'-dicobalt(III)silver(I) tris(perchlorate) pentahydrate","Acta Crystallographica Section E","2007","63","6","m1641","m1642","10.1107/S1600536807020442","","","0.71069","MoKα","","0.0264","0.023","","","0.0587","0.0601","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213910","13.4603","0.0014","15.8837","0.0019","9.204","0.0013","90","","90","","90","","1967.8","0.4","298","2","298","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","catena-Poly[nickel(II)-bis(μ-3,7-dichloroquinoline-8-carboxylato- κ^3^<i>N</i>,<i>O</i>:<i>O</i>')]","","- C20 H8 Cl4 N2 Ni O4 -","- C20 H8 Cl4 N2 Ni O4 -","- C80 H32 Cl16 N8 Ni4 O16 -","4","0.5","NG2259","Yun-Huai Zhang; Feng-Jing Wu; Xue-Ming Li; Mao-Chuan Zhu; Yun Gong","<i>catena</i>-Poly[nickel(II)-bis(μ-3,7-dichloroquinoline-8-carboxylato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>')]","Acta Crystallographica Section E","2007","63","6","m1557","m1557","10.1107/S160053680702082X","","","0.71073","MoKα","","0.0449","0.0309","","","0.0724","0.0853","","","","","","1.101","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213911","20.129","0.004","25.466","0.005","11.413","0.002","90","","90","","90","","5850.4","1.9","293","2","293","2","","","","","","","","7","F d d 2","F 2 -2d","43","","<i>catena</i>-Poly[[[diaquabis[(4-chlorophenylsulfinyl)acetato-\ κ<i>O</i>]cobalt(II)]-μ-4,4'-bipyridine-κ^2^N:N']","","- C26 H24 Cl2 Co N2 O8 S2 -","- C26 H24 Cl2 Co N2 O8 S2 -","- C208 H192 Cl16 Co8 N16 O64 S16 -","8","0.5","NG2260","Hou, Yan-Jun; Yu, Ying-Hui; Sun, Zhi-Zhong; Li, Bai-Yan; Hou, Guang-Feng","<i>catena</i>-Poly[[diaquabis[(4-chlorophenylsulfinyl)acetato-κ<i>O</i>]cobalt(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","6","m1560","m1560","10.1107/S160053680702065X","","","0.71073","MoKα","","0.0527","0.0403","","","0.0763","0.0809","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213912","7.5457","0.0015","11.073","0.002","15.372","0.003","106.16","0.03","99.53","0.03","103.14","0.03","1164.8","0.5","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Triaqua[2-(4-carboxylatophenoxy)propionato-κ<i>O</i>](1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')manganese(II) monohydrate","","- C22 H24 Mn N2 O9 -","- C22 H24 Mn N2 O9 -","- C44 H48 Mn2 N4 O18 -","2","1","NG2262","Xiao, Ying-Hui; Kong, Li-Li; Gao, Shan","Triaqua[2-(4-carboxylatophenoxy)propionato-κ<i>O</i>](1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II) monohydrate","Acta Crystallographica Section E","2007","63","6","m1587","m1588","10.1107/S1600536807021101","","","0.71073","MoKα","","0.0961","0.0378","","","0.0708","0.1004","","","","","","1.118","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213913","15.722","0.003","9.2364","0.0018","19.256","0.004","90","","94.67","0.03","90","","2787","1","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(amino{[iminio(morpholino)methyl]amino}iminium) bis(amino{[imino(morpholino)methyl]amino}iminium) tetracosaoxidotellurohexamolybdate(6-) tetrahydrate","","- C24 H66 Mo6 N20 O32 Te -","- C24 H66 Mo6 N20 O32 Te -","- C48 H132 Mo12 N40 O64 Te2 -","2","0.5","NG2263","Wang, Feng; Liu, Shu-Xia; Wang, Chun-Ling; Cao, Rui-Ge; Cao, Jian-Fang","Bis(amino{[iminio(morpholino)methyl]amino}iminium) bis(amino{[imino(morpholino)methyl]amino}iminium) tetracosaoxidotellurohexamolybdate(6{-}) tetrahydrate","Acta Crystallographica Section E","2007","63","6","m1708","m1709","10.1107/S1600536807023525","","","0.71073","MoKα","","0.0287","0.0251","","","0.0549","0.0564","","","","","","1.092","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213914","11.208","0.005","7.89","0.003","31.212","0.013","90","","90","","90","","2760","2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Triaqua[2-(carboxylatomethyliminomethyl)-4-formylphenolato- κ^3^O,N,O']manganese(II) monohydrate","","- C10 H15 Mn N O8 -","- C10 H15 Mn N O8 -","- C80 H120 Mn8 N8 O64 -","8","1","NG2264","Jin-Hua Cai","Triaqua[2-(carboxylatomethyliminomethyl)-4-formylphenolato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']manganese(II) monohydrate","Acta Crystallographica Section E","2007","63","6","m1631","m1631","10.1107/S1600536807021824","","","0.71073","MoKα","","0.0569","0.0392","","","0.0956","0.1003","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213915","23.3617","0.0007","4.9121","0.0001","7.9431","0.0002","90","","90","","90","","911.51","0.04","100","0.1","100","0.1","","","","","","","","5","P m n 21","P 2ac -2","31","","Aqua{4,4'-dimethoxy-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenolato-κ^4^O,O',N,N'}zinc(II)","","- C22 H20 N2 O5 Zn -","- C22 H20 N2 O5 Zn -","- C44 H40 N4 O10 Zn2 -","2","0.5","NG2265","Naser Eltaher Eltayeb; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun; Kamarulazizi Ibrahim","Aqua{4,4'-dimethoxy-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenolato-κ^4^<i>O</i>,<i>O</i>',<i>N</i>,<i>N</i>'}zinc(II)","Acta Crystallographica Section E","2007","63","6","m1633","m1634","10.1107/S1600536807022064","","","0.71073","MoKα","","0.0304","0.0271","","","0.0702","0.0817","","","","","","1.164","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213916","12.0636","0.0006","9.8642","0.0005","10.3509","0.0006","90","","93.263","0.001","90","","1229.74","0.11","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2-Amino-4,5-dimethylbenzenesulfonato-κ<i>N</i>)diaquasilver(I)","","- C8 H14 Ag N O5 S -","- C8 H14 Ag N O5 S -","- C32 H56 Ag4 N4 O20 S4 -","4","1","NG2266","Jia-Jun Han; Ning Li","(2-Amino-4,5-dimethylbenzenesulfonato-κ<i>N</i>)diaquasilver(I)","Acta Crystallographica Section E","2007","63","6","m1635","m1635","10.1107/S1600536807022052","","","0.71073","MoKα","","0.0409","0.0358","","","0.0954","0.0971","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213917","7.8999","0.0005","11.2878","0.0009","14.5064","0.0009","90","","95.828","0.005","90","","1286.89","0.15","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(dimethylammonium) tetrachloridoferrate(II)","","- C4 H16 Cl4 Fe N2 -","- C4 H16 Cl4 Fe N2 -","- C16 H64 Cl16 Fe4 N8 -","4","1","NG2267","Morawitz, Thorsten; Lerner, Hans-Wolfram; Bolte, Michael","Bis(dimethylammonium) tetrachloridoferrate(II)","Acta Crystallographica Section E","2007","63","6","m1683","m1683","10.1107/S1600536807022994","","","0.71073","MoKα","","0.046","0.0343","","","0.0675","0.071","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213918","8.0236","0.0002","12.793","0.0003","22.4773","0.0007","91.989","0.002","94.233","0.002","103.566","0.002","2233.49","0.11","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","Pyridine[2,2'-{1,2-phenylenebis(nitrilomethylylidene)} bis(4-bromophenol)]zinc(II)","κ^4^<i>O</i>,<i>O</i>',<i>N</i>,<i>N</i>'}(pyridine-<i>κN</i>)zinc(II)","","- C25 H17 Br2 N3 O2 Zn -","- C25 H17 Br2 N3 O2 Zn -","- C100 H68 Br8 N12 O8 Zn4 -","4","2","NG2268","Naser Eltaher Eltayeb; Siang Guan Teoh; Jeannie Bee-Jan Teh; Hoong-Kun Fun; Kamarulazizi Ibrahim","{4,4'-Dibromo-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenolato-κ^4^<i>O</i>,<i>O</i>',<i>N</i>,<i>N</i>'}(pyridine-<i>{κ</i>N})zinc(II)","Acta Crystallographica Section E","2007","63","6","m1764","m1765","10.1107/S160053680702380X","","","0.71073","MoKα","","0.0321","0.0261","","","0.0626","0.0676","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213919","9.8958","0.0002","25.3673","0.0006","19.804","0.0005","90","","116.064","0.002","90","","4465.82","0.19","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(2-Ethylimidazole-κN)bis(tri-tert-butoxysilanethiolato-κ^2^O,S)zinc(II) propan-2-ol solvate","","- C32 H70 N2 O7 S2 Si2 Zn -","- C32 H70 N2 O7 S2 Si2 Zn -","- C128 H280 N8 O28 S8 Si8 Zn4 -","4","1","NG2271","Dołęga, Anna; Wieczerzak, Monika; Baranowska, Katarzyna","(2-Ethylimidazole-κ<i>N</i>)bis(tri-<i>tert</i>-butoxysilanethiolato-κ^2^<i>O</i>,<i>S</i>)zinc(II) propan-2-ol solvate","Acta Crystallographica Section E","2007","63","6","m1774","m1774","10.1107/S1600536807025500","","","0.71073","MoKα","","0.0392","0.0341","","","0.0898","0.0961","","","","","","1.133","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213920","7.1956","0.0006","16.832","0.0014","33.054","0.003","90","","90","","90","","4003.4","0.6","293","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3,5-Dimethoxyacetanilide","","- C10 H13 N O3 -","- C10 H13 N O3 -","- C160 H208 N16 O48 -","16","2","OM2120","Lai, Qing-Lin; Zhao, Qing-Jie; Liu, Zheng; Shen, Jing-Shan","3,5-Dimethoxyacetanilide","Acta Crystallographica Section E","2007","63","6","o2782","o2782","10.1107/S1600536807020600","","","0.71073","MoKα","","0.0573","0.0421","","","0.1001","0.1082","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213921","11.4887","0.0004","6.8821","0.0002","12.6838","0.0005","90","","91.247","0.005","90","","1002.62","0.06","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-Diazoniabicyclo[2.2.2]octane dinitrate","","- C6 H14 N4 O6 -","- C6 H14 N4 O6 -","- C24 H56 N16 O24 -","4","1","OM2123","Knope, Karah E.; Cahill, Christopher L.","1,4-Diazoniabicyclo[2.2.2]octane dinitrate","Acta Crystallographica Section E","2007","63","6","o2955","o2955","10.1107/S1600536807022805","","","0.71073","MoKα","","0.1023","0.052","","","0.1315","0.1564","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213922","5.231","0.001","9.401","0.0019","15.095","0.003","90","","90","","90","","742.3","0.3","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2,4,6-Trihydroxyanisole","","- C7 H8 O4 -","- C7 H8 O4 -","- C28 H32 O16 -","4","1","OM2124","Xiao, Zhu-Ping; Zheng, Da-Gui; Xie, Guo-Hao; Ye, Hong-De","2,4,6-Trihydroxyanisole","Acta Crystallographica Section E","2007","63","6","o2941","o2941","10.1107/S1600536807022787","","","0.71073","MoKα","","0.0564","0.0469","","","0.1172","0.1249","","","","","","1.078","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213923","13.3","0.003","11.075","0.002","14.334","0.003","90","","116.82","0.03","90","","1884.2","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[bis(2-methyl-1H-imidazole)cobalt(II)] -μ-cyclohexane-1,4-dicarboxylato] monohydrate]","","- C16 H24 Co N4 O5 -","- C16 H24 Co N4 O5 -","- C64 H96 Co4 N16 O20 -","4","1","OM2125","Yong-Mei Zhang; Guang Xin; Dong-Yan Hou,; Tie-Chun Li","<i>catena</i>-Poly[[[bis(2-methyl-1<i>H</i>-imidazole)cobalt(II)]-μ-cyclohexane-1,4-dicarboxylato] monohydrate]","Acta Crystallographica Section E","2007","63","6","m1735","m1736","10.1107/S1600536807024063","","","0.71073","MoKα","","0.0586","0.0407","","","0.0879","0.0941","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213924","22.5161","0.001","22.5161","0.001","6.34","0.0006","90","","90","","90","","3214.2","0.4","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","(2,3-Dihydro-1,4-benzodioxin-2-yl)methanol","","- C9 H10 O3 -","- C9 H10 O3 -","- C144 H160 O48 -","16","1","PK2014","Díaz Gavilán, Mónica; Choquesillo-Lazarte, Duane; Campos, Joaquín M.","(2,3-Dihydro-1,4-benzodioxin-2-yl)methanol","Acta Crystallographica Section E","2007","63","6","o2940","o2940","10.1107/S1600536807016625","","","0.71073","MoKα","","0.045","0.041","","","0.106","0.108","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213925","13.734","0.0002","6.6583","0.0001","11.4582","0.0002","90","","106.827","0.001","90","","1002.93","0.03","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diammonium sulfate-selenate tellurate","","- H14 N2 O10 S0.71 Se0.29 Te -","- H6 N2 O10 S0.7131 Se0.2869 Te -","- H24 N8 O40 S2.8524 Se1.1476 Te4 -","4","1","PK2023","Abdelhedi, Mohamed; Dammak, Mohamed; Cousson, Alain; Jérome, Marrot; Abdelwaheb, Kolsi","(NH~4~)~2~(SO~4~)~0.71~(SeO~4~)~0.29~Te(OH)~6~","Acta Crystallographica Section E","2007","63","6","i148","i148","10.1107/S1600536807024075","","","0.71073","MoKα","","0.0222","0.0159","","0.0267","0.0214","0.0214","","","","","","1.01","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213926","11.7234","0.0002","13.5577","0.0002","9.3637","0.0001","90","","93.2187","0.0007","90","","1485.94","0.04","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Benzyl <i>N</i>'-[1-(3-pyridyl)ethylidene]hydrazinecarbodithioate","","- C15 H15 N3 S2 -","- C15 H15 N3 S2 -","- C60 H60 N12 S8 -","4","1","PK2024","How, Fiona N.-F.; Watkin, David J.; Crouse, Karen A.; M. Ibrahim M. Tahir","Benzyl <i>N</i>'-[1-(3-pyridyl)ethylidene]hydrazinecarbodithioate","Acta Crystallographica Section E","2007","63","6","o3023","o3024","10.1107/S1600536807025056","","","0.71073","MoKα","","0.0338","0.0338","","0.0742","0.0742","0.0742","","","","","","0.98","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213927","9.8124","0.0009","8.3298","0.0008","26.16","0.003","90","","90","","90","","2138.2","0.4","90","2","90","2","","","","","","","","5","P n a 21","P 2c -2n","33","Compound I","diisopropyl (diisopropoxyphosphorylmethylsulfonylmethyl)phosphonate","","- C14 H32 O8 P2 S -","- C14 H32 O8 P2 S -","- C56 H128 O32 P8 S4 -","4","1","PK2025","Wong, Jessica H.; Olmstead, Marilyn M.; Gervay-Hague, Jacquelyn","A diisopropoxyphosphonate monosulfone","Acta Crystallographica Section E","2007","63","6","o3045","o3045","10.1107/S1600536807025068","","","0.71073","MoKα","","0.0421","0.0341","","","0.0887","0.0948","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213928","21.7314","0.0017","10.2307","0.0008","21.815","0.0017","90","","92.922","0.005","90","","4843.8","0.7","180","2","180","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","Compound I","diisopropyl (diisopropoxyphosphorylmethylsulfonylmethylsulfonylmethyl)phosphonate","","- C15 H34 O10 P2 S2 -","- C15 H34 O10 P2 S2 -","- C120 H272 O80 P16 S16 -","8","2","PK2026","Wong, Jessica H.; Olmstead, Marilyn M.; Fettinger, James C.; Gervay-Hague, Jacquelyn","A diisopropoxyphosphonate disulfone","Acta Crystallographica Section E","2007","63","6","o3046","o3046","10.1107/S160053680702507X","","","0.71073","MoKα","","0.0455","0.0406","","","0.112","0.1167","","","","","","1.084","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213929","7.3672","0.0002","17.9326","0.0005","15.0284","0.0003","90","","99.7","0.02","90","","1957.06","0.14","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(6-Methoxybenzothiazol-2-yldiazenyl)-1-methyl-2-phenyl-1<i>H</i>-indole","","- C23 H18 N4 O S -","- C23 H18 N4 O S -","- C92 H72 N16 O4 S4 -","4","1","PR2007","Hökelek, Tuncer; Seferoğlu, Zeynel; Şahin, Ertan; Kaynak, Filiz Betül","3-(6-Methoxybenzothiazol-2-yldiazenyl)-1-methyl-2-phenyl-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","6","o2837","o2839","10.1107/S1600536807021708","","","0.71073","MoKα","","0.0928","0.0614","","","0.1408","0.1579","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213930","10.2028","0.0005","13.428","0.0006","13.9113","0.0007","90","","97.119","0.001","90","","1891.2","0.16","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","cis-[N-(4-Chlorobenzyl)iminodiacetato-κ^3^N,O,O']bis(1H-imidazole- κN^3^)copper(II)","","- C17 H18 Cl Cu N5 O4 -","- C17 H18 Cl Cu N5 O4 -","- C68 H72 Cl4 Cu4 N20 O16 -","4","1","PR2009","Brandi-Blanco, María Pilar; Benavides-Giménez, María Magdalena de; González-Pérez, Josefa María; Choquesillo-Lazarte, Duane","<i>cis</i>-[<i>N</i>-(4-Chlorobenzyl)iminodiacetato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>']bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II)","Acta Crystallographica Section E","2007","63","6","m1678","m1679","10.1107/S160053680702288X","","","0.71073","MoKα","","0.0356","0.032","","","0.0836","0.0858","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213931","7.391","0.002","16.23","0.003","7.504","0.004","90","","97.73","0.03","90","","892","0.6","293","2","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-Amino-2-chloropyridinium dihydrogenphosphate","","- C5 H8 Cl N2 O4 P -","- C5 H8 Cl N2 O4 P -","- C20 H32 Cl4 N8 O16 P4 -","4","1","PV2010","Hamed, Khmiri; Samah, Akriche; Mohamed, Rzaigui","3-Amino-2-chloropyridinium dihydrogenphosphate","Acta Crystallographica Section E","2007","63","6","o2896","o2896","10.1107/S1600536807022325","","","0.71073","Mokα","","0.0328","0.0303","","","0.0837","0.0852","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213932","7.3919","0.0007","7.4823","0.0007","20.4655","0.0017","90","","90","","90","","1131.91","0.18","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4,8-Dihydroxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium chloride monohydrate","","- C10 H16 Cl N O3 -","- C10 H16 Cl N O3 -","- C40 H64 Cl4 N4 O12 -","4","1","PV2011","Yathirajan, H. S.; Mayekar, Anil N.; Sarojini, B. K.; Narayana, B.; Bolte, Michael","4,8-Dihydroxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium chloride monohydrate","Acta Crystallographica Section E","2007","63","6","o2885","o2885","10.1107/S1600536807022003","","","0.71073","MoKα","","0.0309","0.0296","","","0.0784","0.0793","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213933","6.0095","0.0005","35.278","0.003","7.2352","0.0006","90","","90.018","0.007","90","","1533.9","0.2","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3-(biphenyl)-1-(4-fluorophenyl)prop-2-en-1-one","","- C21 H15 F O -","- C21 H15 F O -","- C84 H60 F4 O4 -","4","2","PV2013","Sarojini, B.K.; Yathirajan, H.S.; Sreevidya, T.V.; Narayana, B.; Bolte, Michael","3-(Biphenyl-4-yl)-1-(4-fluorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","6","o2945","o2945","10.1107/S1600536807023434","","","0.71073","MoKα","","0.0625","0.0527","","","0.145","0.1497","","","","","","1.075","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213934","7.8597","0.0011","15.383","0.003","12.781","0.002","90","","105.117","0.01","90","","1491.8","0.4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(3<i>E</i>,4<i>Z</i>)-3-[1,3-Benzodioxol-5-yl)methylene]-4-(2-\ pentylidene)tetrahydrofuran-2,5-dione","","- C17 H16 O5 -","- C17 H16 O5 -","- C68 H64 O20 -","4","1","PV2014","Dong, Wen-Liang; Zhang, Jin-Hua; Zheng, Liang-Wen; Zhao, Bao-Xiang","(3<i>E</i>,4<i>Z</i>)-3-[(1,3-Benzodioxol-5-yl)methylene]-4-(2-pentylidene)tetrahydrofuran-2,5-dione","Acta Crystallographica Section E","2007","63","6","o3040","o3040","10.1107/S1600536807023732","","","0.71073","MoKα","","0.1025","0.0558","","","0.1599","0.2033","","","","","","0.944","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213935","8.5746","0.0004","11.201","0.0006","15.8831","0.0008","78.888","0.005","75.363","0.004","74.078","0.004","1406.81","0.13","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 2-(propionylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate","","- C14 H19 N O3 S -","- C14 H19 N O3 S -","- C56 H76 N4 O12 S4 -","4","2","RK2012","Yathirajan, H.S.; Bindya, S.; Sarojini, B.K.; Narayana, B.; Bolte, Michael","Ethyl 2-(propionylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate","Acta Crystallographica Section E","2007","63","6","o2949","o2949","10.1107/S1600536807024282","","","0.71073","MoKα","","0.0402","0.0344","","","0.091","0.094","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213936","4.5354","0.0006","5.8868","0.0008","31.991","0.004","90","","90","","90","","854.13","0.19","100","1","100","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2-Phenyl)ethylammonium chloride","","- C8 H12 Cl N -","- C8 H12 Cl N -","- C32 H48 Cl4 N4 -","4","1","RK2013","Arkenbout, Anne H.; Meetsma, Auke; Palstra, Thomas T. M.","(2-Phenylethyl)ammonium chloride","Acta Crystallographica Section E","2007","63","6","o2987","o2987","10.1107/S1600536807024245","","","0.71073","MoKα","","0.0284","0.027","","","0.0708","0.0714","","","","","","1.144","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213937","12.6","0.002","12.6","0.002","7.0983","0.0014","90","","90","","90","","1126.9","0.3","295","2","295","2","","","","","","","","6","I -4","I -4","82","","Tetrapyridinecopper(I) hexafluoridophosphate(V)","","- C20 H20 Cu F6 N4 P -","- C20 H20 Cu F6 N4 P -","- C40 H40 Cu2 F12 N8 P2 -","2","0.25","RK2014","Gordan Horvat; Tomislav Portada; Vladimir Stilinović; Vladislav Tomišić","Tetrapyridinecopper(I) hexafluoridophosphate(V)","Acta Crystallographica Section E","2007","63","6","m1734","m1734","10.1107/S1600536807024051","","","0.71073","MoKα","","","0.0443","","","","0.1183","","","","","","1.094","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213938","7.755","0.005","14.757","0.012","6.889","0.005","90","","112.64","0.03","90","","727.6","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Methoxybenzaldehyde azine","","- C16 H16 N2 O2 -","- C16 H16 N2 O2 -","- C32 H32 N4 O4 -","2","0.5","RK2015","Fu, Zhong-Wu","2-Methoxybenzaldehyde azine","Acta Crystallographica Section E","2007","63","6","o2993","o2993","10.1107/S1600536807024865","","","0.71073","MoKα","","0.0572","0.046","","","0.1557","0.1662","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213939","12.326","0.003","10.726","0.002","15.999","0.003","90","","98.43","0.03","90","","2092.4","0.8","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-[(2,3-Diphenylquinoxalin-5-ylamino)methylene]pentane-2,4-dione","","- C26 H21 N3 O2 -","- C26 H21 N3 O2 -","- C104 H84 N12 O8 -","4","1","RN2021","Kettmann, Viktor; Lokaj, Jan; Milata, Viktor; Saloň, Jozef; Kožíšek, Jozef","3-[(2,3-Diphenylquinoxalin-5-ylamino)methylene]pentane-2,4-dione","Acta Crystallographica Section E","2007","63","6","o3005","o3006","10.1107/S1600536807023331","","","0.71073","MoKα","","0.1047","0.0539","","","0.1475","0.1814","","","","","","0.936","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213940","9.26","0.0009","12.8916","0.0013","12.7775","0.0013","90","","107.687","0.002","90","","1453.2","0.3","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-nitrophenyl)-6-phenyl-tetrahydropyran-4-one","","- C17 H15 N O4 -","- C17 H15 N O4 -","- C68 H60 N4 O16 -","4","1","RN2024","Chen, Zhi-Ming; Ming, Zhi-Hui; Li, Xiao-Chao; Yin, Wen-Jing","2-(4-Nitrophenyl)-6-phenyltetrahydropyran-4-one","Acta Crystallographica Section E","2007","63","6","o2998","o2999","10.1107/S1600536807024191","","","0.71073","MoKα","","0.0727","0.0591","","","0.1437","0.152","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213941","12.683","0.004","10.967","0.004","26.53","0.008","90","","99.677","0.007","90","","3638","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-{[2-(Bromomethyl)-2-(4-methoxyphenyl)-1,3-dioxolan-4- yl]methyl}benzo[<i>d</i>]imidazole","","- C19 H19 Br N2 O3 -","- C19 H19 Br N2 O3 -","- C152 H152 Br8 N16 O24 -","8","2","RN2025","Cai-Feng Ding; Sai Bi; Han-Sheng Ning; Yue-Qin Yu","1-{[2-(Bromomethyl)-2-(4-methoxyphenyl)-1,3-dioxolan-4-yl]methyl}benzo[<i>d</i>]imidazole","Acta Crystallographica Section E","2007","63","6","o2942","o2942","10.1107/S1600536807024567","","","0.71073","MoKα","","0.0869","0.0418","","","0.0901","0.1042","","","","","","0.99","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213942","4.8375","0.001","10.691","0.002","19.179","0.004","90","","92.39","0.03","90","","991","0.3","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Dimethyl 2,3-dihydroxyterephthalate","","- C10 H10 O6 -","- C10 H10 O6 -","- C40 H40 O24 -","4","1","RT2003","Jian-Ying Huang; Hong-Ze Liang","Dimethyl 2,3-dihydroxyterephthalate","Acta Crystallographica Section E","2007","63","6","o3019","o3020","10.1107/S1600536807022945","","","0.71073","MoKα","","0.0746","0.0422","","","0.1001","0.1115","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213943","9.3598","0.0005","11.7387","0.0006","12.8062","0.0007","90","","90.923","0.002","90","","1406.86","0.13","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diaquabis(2-benzoylpyridine-κ^2^N,O)cobalt(II) bis(perchlorate)","","- C24 H22 Cl2 Co N2 O12 -","- C24 H22 Cl2 Co N2 O12 -","- C48 H44 Cl4 Co2 N4 O24 -","2","0.5","RZ2130","Li, Ya-Min; Zhao, Xiao-Wei","Diaquabis(2-benzoylpyridine-κ^2^<i>N</i>,<i>O</i>)cobalt(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","6","m1589","m1590","10.1107/S1600536807017758","","","0.71073","MoKα","","","0.0667","","","0.146","0.1604","","","","","","1.16","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213944","6.528","0.002","19.009","0.007","11.493","0.005","90","","92.345","0.016","90","","1425","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Poly[tetraaquabis(μ-hydrogen maleato)barium(II)]","","- C8 H14 Ba O12 -","- C8 H14 Ba O12 -","- C32 H56 Ba4 O48 -","4","1","RZ2132","Zheng, Jiang-Lin; Lin, Shu-Kun","Poly[tetraaquabis(μ-hydrogen maleato)barium(II)]","Acta Crystallographica Section E","2007","63","6","m1607","m1609","10.1107/S1600536807021228","","","0.71073","MoKα","","0.0403","0.0372","","","0.0877","0.0886","","","","","","1.331","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213945","9.1728","0.0007","6.352","0.0005","16.6567","0.0012","90","","90","","90","","970.51","0.13","294","2","294","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Creatininium hydrogen oxalate monohydrate","","- C6 H11 N3 O6 -","- C6 H11 N3 O6 -","- C24 H44 N12 O24 -","4","0.5","RZ2133","S. Asath Bahadur; R. Sayee Kannan; B. Sridhar","Creatininium hydrogen oxalate monohydrate","Acta Crystallographica Section E","2007","63","6","o2387","o2389","10.1107/S1600536807021162","","","0.71073","MoKα","","0.0349","0.0339","","","0.0959","0.0975","","","","","","1.112","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213946","7.7215","0.0012","10.6985","0.0012","17.331","0.003","90","","99.55","0.013","90","","1411.8","0.4","298","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(4-Methylphenyl)-5-phenylpenta-2,4-dien-1-one","","- C18 H16 O -","- C18 H16 O -","- C72 H64 O4 -","4","1","RZ2134","Fischer, Andreas; Yathirajan, H. S.; Sarojini, B. K.; Bindya, S.; Narayana, B.","1-(4-Methylphenyl)-5-phenylpenta-2,4-dien-1-one","Acta Crystallographica Section E","2007","63","6","o2832","o2832","10.1107/S1600536807020582","","","0.71073","MoKα","","0.13","0.0681","","","0.1317","0.1618","","","","","","1.12","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2213947","13.342","0.003","6.7054","0.0013","13.613","0.003","90","","106.93","0.03","90","","1165.1","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Piperazinium tetraaquabis(μ~2~-citrato)dinickelate(II)","","- C16 H30 N2 Ni2 O18 -","- C16 H30 N2 Ni2 O18 -","- C32 H60 N4 Ni4 O36 -","2","0.5","RZ2135","Song, Hai-Yan; Huang, Chang-Cang; Luo, Jian-Hai; Huang, Xi-He; Liu, Dong-Sheng","Piperazinium tetraaquadi-μ-citrato-dinickelate(II)","Acta Crystallographica Section E","2007","63","6","m1552","m1553","10.1107/S1600536807020569","","","0.71073","MoKα","","0.031","0.0285","","","0.0719","0.0732","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213948","25.8379","0.0012","8.0874","0.0006","20.5316","0.001","90","","128.857","0.001","90","","3340.9","0.3","297","2","297","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-Isopropyl-2-morpholino-5,6,7,8-tetrahydrobenzothieno[2,3-d]pyrimidin-4(3H)-one","","- C17 H23 N3 O2 S -","- C17 H23 N3 O2 S -","- C136 H184 N24 O16 S8 -","8","1","RZ2136","Zeng, Xiao-Hua; Zhao, Lan-Hua; Luo, Hong; Long, Ji-Yin","3-Isopropyl-2-morpholino-5,6,7,8-tetrahydrobenzothieno[2,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","6","o3004","o3004","10.1107/S1600536807022672","","","0.71073","MoKα","","0.0722","0.0514","","","0.132","0.1427","","","","","","0.986","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213949","12.1685","0.0003","16.9339","0.0004","8.9299","0.0002","90","","108.956","0.001","90","","1740.31","0.07","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Poly[[diaquatris[μ~4~-(p-phenylenedioxy)diacetato]dipraseodymium(III)] dihydrate]","","- C30 H32 O22 Pr2 -","- C30 H32 O22 Pr2 -","- C60 H64 O44 Pr4 -","2","0.5","RZ2137","Rong-Hua Zeng; Yong-Cai Qiu; Yue-Peng Cai; Jian-Zhong Wu; Hong Deng","Poly[[diaquatris[μ~4~-(<i>p</i>-phenylenedioxy)diacetato]dipraseodymium(III)] dihydrate]","Acta Crystallographica Section E","2007","63","6","m1666","m1666","10.1107/S1600536807022519","","","0.71073","MoKα","","0.0423","0.0296","","","0.0674","0.0728","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213950","5.449","0.0005","6.4489","0.0005","22.2203","0.0014","90","","90","","90","","780.82","0.11","173","1","173","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(3S,4S,5R)-3-Hydroxy-4-methyl-5-vinyltetrahydropyran-2-one","","- C8 H12 O3 -","- C8 H12 O3 -","- C32 H48 O12 -","4","1","RZ2139","Körner, Marleen; Schürmann, Markus; Preut, Hans; Hiersemann, M.","(3<i>S</i>,4S,5<i>R</i>)-3-Hydroxy-4-methyl-5-vinyltetrahydropyran-2-one","Acta Crystallographica Section E","2007","63","6","o3012","o3012","10.1107/S1600536807022854","","","0.71073","MoKα","","0.0546","0.0286","","","0.0545","0.0578","","","","","","0.899","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213951","13.623","0.003","9.6472","0.0019","16.962","0.003","90","","111.98","0.03","90","","2067.2","0.8","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-bromo-2-{α-[1-(2-thienyl)benzimidazol-2-yl]benzyl}phenol","","- C24 H17 Br N2 O S -","- C24 H17 Br N2 O S -","- C96 H68 Br4 N8 O4 S4 -","4","1","RZ2141","Fengke Yang; Fang Chen; Hailian Xiao","4-Bromo-2-{α-[1-(2-thienyl)benzimidazol-2-yl]benzyl}phenol","Acta Crystallographica Section E","2007","63","6","o3041","o3041","10.1107/S1600536807023938","","","0.71073","MoKα","","0.0714","0.0415","","","0.0956","0.1124","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213952","15.371","0.006","14.775","0.006","7.904","0.003","90","","102.835","0.006","90","","1750.2","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(3,5-Dimethoxybenzoyl)-4-(2-methoxyphenyl)thiosemicarbazide","","- C17 H19 N3 O4 S -","- C17 H19 N3 O4 S -","- C68 H76 N12 O16 S4 -","4","1","RZ2142","Ghulam Qadeer; Muhammad Hanif; Nasim Hasan Rama; Wen-Tong Chen","1-(3,5-Dimethoxybenzoyl)-4-(2-methoxyphenyl)thiosemicarbazide","Acta Crystallographica Section E","2007","63","6","o3051","o3051","10.1107/S1600536807025548","","","0.71073","MoKα","","0.0639","0.0438","","","0.1161","0.1265","","","","","","1.099","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213953","9.7224","0.0013","6.0174","0.0008","30.103","0.004","90","","99.019","0.013","90","","1739.4","0.4","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5,7-Di-<i>tert</i>-butyl-2-(2-pyridyl)benzo[<i>d</i>]oxazole","","- C20 H24 N2 O -","- C20 H24 N2 O -","- C80 H96 N8 O4 -","4","1","SG2159","Vinšová, Jarmila; Marek, Jaromír; Vančo, Ján; Csöllei, Jozef","5,7-Di-<i>tert</i>-butyl-2-(2-pyridyl)benzo[<i>d</i>]oxazole","Acta Crystallographica Section E","2007","63","6","o2802","o2803","10.1107/S1600536807020247","","","0.71073","MoKα","","0.059","0.0415","","","0.0972","0.1056","","","","","","1.016","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213954","9.3105","0.0007","14.0233","0.0014","10.2143","0.0008","90","","96.901","0.006","90","","1324","0.2","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5,5'-Dimethyl-4,4'-bis[2-(2-methyl-3-thienyl)cyclopentenyl]-2,2'-bithiophene","","- C30 H30 S4 -","- C30 H30 S4 -","- C60 H60 S8 -","2","0.5","SG2160","Wissler, Jörg; Mulder, Alart; Tampé, Robert; Bolte, Michael","5,5'-Dimethyl-4,4'-bis[2-(2-methyl-3-thienyl)cyclopentenyl]-2,2'-bithiophene","Acta Crystallographica Section E","2007","63","6","o2813","o2814","10.1107/S1600536807017126","","","0.71073","MoKα","","0.0408","0.0371","","","0.0996","0.1019","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213955","10.896","0.005","4.027","0.0017","22.71","0.009","90","","94.304","0.008","90","","993.7","0.7","293.1","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Pyridine-3-carbaldehyde 2-pyridylhydrazone","","- C11 H10 N4 -","- C11 H10 N4 -","- C44 H40 N16 -","4","1","SG2161","Hansen, Lars Kr.; Perlovich, German L.; Schaper, Klaus-Jürgen; Bauer-Brandl, Annette","Pyridine-3-carbaldehyde 2-pyridylhydrazone","Acta Crystallographica Section E","2007","63","6","o3042","o3042","10.1107/S1600536807023203","","","0.7107","MoKα","","","0.0453","","","","0.0475","","","","","","0.967","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213956","6.1326","0.0006","7.3174","0.0007","9.8781","0.001","93.817","0.002","104.335","0.002","114.408","0.001","383.86","0.07","298","2","298","2","","","","","","","","4","P 1","P 1","1","","(<i>S</i>)-2-(Pyrrolidinium-2-ylmethyl)isoquinolinium dibromide","","- C14 H18 Br2 N2 -","- C14 H18 Br2 N2 -","- C14 H18 Br2 N2 -","1","1","SG2162","Bing-Tao Wang; Shu-Ping Luo; Hua-Dong Yue; Li-Ping Wang; Dan-Qian Xu","(<i>S</i>)-2-(Pyrrolidinium-2-ylmethyl)isoquinolinium dibromide","Acta Crystallographica Section E","2007","63","6","o2786","o2786","10.1107/S1600536807020594","","","0.71073","MoKα","","0.0246","0.0233","","","0.0513","0.0517","","","","","","0.962","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213957","10.8866","0.0006","11.5321","0.0006","17.6671","0.0009","90","","90","","90","","2218","0.2","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","13-Methyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro- 1<i>H</i>-cyclopenta[<i>a</i>]phenanthren-17-yl 4-nitrobenzoate","","- C25 H29 N O5 -","- C25 H29 N O5 -","- C100 H116 N4 O20 -","4","1","SG2168","Yu-Yuan Ye","13-Methyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1<i>H</i>-cyclopenta[<i>a</i>]phenanthren-17-yl 4-nitrobenzoate","Acta Crystallographica Section E","2007","63","6","o3022","o3022","10.1107/S1600536807025020","","","0.71073","MoKα","","0.051","0.0374","","","0.0899","0.0992","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213958","7.591","0.002","13.311","0.002","6.4023","0.0014","90","","110.9","0.02","90","","604.3","0.2","100","0.3","100","0.3","","","","","","","","4","C 1 c 1","C -2yc","9","","2,3,4,5,6-Pentafluoroaniline","","- C6 H2 F5 N -","- C6 H2 F5 N -","- C24 H8 F20 N4 -","4","1","SG2169","Maria Gdaniec","2,3,4,5,6-Pentafluoroaniline","Acta Crystallographica Section E","2007","63","6","o2954","o2954","10.1107/S1600536807023197","","","0.71073","MoKα","","0.0252","0.0247","","","0.0645","0.0647","","","","","","1.083","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213959","4.8204","0.0003","6.5447","0.0004","8.7092","0.0006","87.413","0.004","88.565","0.005","74.939","0.005","265.02","0.03","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(2-hydroxyiminopropionato-κ^2^N,O)copper(II)","","- C6 H12 Cu N2 O8 -","- C6 H12 Cu N2 O8 -","- C6 H12 Cu N2 O8 -","1","0.5","SI2012","Kirillova, Marina V.; Haukka, Matti; Kirillov, Alexander M.; Silva, José A. L.; Fraústo da Silva, João J. R.; Pombeiro, Armando J. L.","Diaquabis(2-hydroxyiminopropionato-κ^2^<i>N</i>,<i>O</i>)copper(II)","Acta Crystallographica Section E","2007","63","6","m1670","m1671","10.1107/S160053680702226X","","","0.71073","MoKα","","0.0262","0.0249","","","0.0629","0.064","","","","","","1.097","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213960","17.359","0.0004","17.359","0.0004","17.359","0.0004","90","","90","","90","","5230.9","0.2","120","2","120","2","","","","","","","","7","P 21 3","P 2ac 2ab 3","198","","(μ~3~-Trithiocyanurato-κ^6^<i>N^1^</i>,<i>S^2^</i>:<i>N^3^</i>,<i>S^4^</i>: <i>N^5^</i>,<i>S^6^</i>)tris[(<i>N</i>,<i>N</i>,<i>N'</i>,<i>N''</i>,\ <i>N''</i>- pentamethyldiethylenetriamine-κ^3^<i>N</i>,<i>N'</i>,<i>N''</i>)copper(II)] tris(perchlorate)","","- C30 H69 Cl3 Cu3 N12 O12 S3 -","- C30 H69 Cl3 Cu3 N12 O12 S3 -","- C120 H276 Cl12 Cu12 N48 O48 S12 -","4","0.333333","SI2015","Trávníček, Zdeněk; Marek, Jaromír; Čermáková, Šárka","(μ~3~-Trithiocyanurato-κ^6^<i>N</i>^1^,<i>S</i>^2^:<i>N</i>^3^,<i>S</i>^4^:<i>N</i>^5^,<i>S</i>^6^)tris[(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''-pentamethyldiethylenetriamine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')copper(II)] tris(perchlorate)","Acta Crystallographica Section E","2007","63","6","m1742","m1743","10.1107/S1600536807024026","","","0.71073","MoKα","","0.0539","0.0336","","","0.0631","0.0723","","","","","","1.099","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213961","4.8971","0.0003","8.8054","0.0005","11.4894","0.0006","90","","96.381","0.001","90","","492.36","0.05","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethylenediammonium bis(dihydrogenarsenate)","","- C2 H14 As2 N2 O8 -","- C2 H14 As2 N2 O8 -","- C4 H28 As4 N4 O16 -","2","0.5","SJ2232","Wilkinson, Hazel S.; Harrison, William T. A.","Ethylenediammonium bis(dihydrogenarsenate): <i>R</i>~4~^3^(14) loops built up from O—H···O hydrogen bonds","Acta Crystallographica Section E","2007","63","6","m1610","m1612","10.1107/S1600536807008768","","","0.71073","MoKα","","0.0255","0.0195","","","0.0501","0.0514","","","","","","1.06","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213962","14.8211","0.0007","16.8568","0.0008","17.315","0.0008","90","","90","","90","","4325.9","0.4","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1-[(1R,2R)-2-(1,8-Naphthalimido)cyclohexyl]-3-phenylthiourea","","- C25 H23 N3 O2 S -","- C25 H23 N3 O2 S -","- C200 H184 N24 O16 S8 -","8","2","SJ2253","Yang, Xue-Mei; Fu, En-Qin","1-[(1<i>R</i>,2<i>R</i>)-2-(1,8-Naphthalimido)cyclohexyl]-3-phenylthiourea","Acta Crystallographica Section E","2007","63","6","o2866","o2868","10.1107/S1600536807015565","","","0.71073","MoKα","","0.0746","0.044","","","0.0906","0.1018","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213963","12.207","0.002","15.254","0.003","20.132","0.004","90","","90.73","0.03","90","","3748.4","1.2","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(2,3,5-triphenyltetrazolium) tetrachloridocadmate(II)","","- C38 H30 Cd Cl4 N8 -","- C38 H30 Cd Cl4 N8 -","- C152 H120 Cd4 Cl16 N32 -","4","1","SJ2289","Shu-Fang Zhang; Xiao-Gang Yang; Zhi Liu; Wei-Hua Li; Bao-Rong Hou","Bis(2,3,5-triphenyltetrazolium) tetrachloridocadmate(II)","Acta Crystallographica Section E","2007","63","6","m1583","m1583","10.1107/S160053680702034X","","","0.71073","MoKα","","0.0252","0.0216","","","0.0531","0.0577","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213964","15.5339","0.0002","8.7382","0.0002","18.7931","0.0004","90","","91.3265","0.001","90","","2550.26","0.09","160","2","160","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(methylacetamido)diphenylamine","N-[(Diphenylamino)methyl]acetamide","","- C15 H16 N2 O -","- C15 H16 N2 O -","- C120 H128 N16 O8 -","8","2","SJ2298","Prabhu, Ganesan Venkatesa; Vembu, Nagarajan; Muruganandam, Loganathan; Linden, Anthony","<i>N</i>-[(Diphenylamino)methyl]acetamide","Acta Crystallographica Section E","2007","63","6","o2841","o2842","10.1107/S1600536807021459","","","0.71073","MoKα","","0.0884","0.0558","","","0.1371","0.1558","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213965","9.945","0.002","14.591","0.003","14.428","0.003","90","","101.12","0.02","90","","2054.3","0.7","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetrakis(triethanolammonium) cyclotetraphosphate","","- C24 H64 N4 O24 P4 -","- C24 H64 N4 O24 P4 -","- C48 H128 N8 O48 P8 -","2","0.5","SJ2299","Soumhi, El Hassane; Saadoune, Ismael; Driss, Ahmed","Tetrakis(triethanolammonium) cyclotetraphosphate","Acta Crystallographica Section E","2007","63","6","o2827","o2827","10.1107/S1600536807021083","","","0.71073","MoKα","","0.0623","0.0464","","","0.1343","0.1455","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213966","9.359","0.001","9.487","0.001","9.86","0.001","94.352","0.002","115.271","0.002","105.312","0.002","745.5","0.14","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","2-(4-Bromophenyl)-1-(methylsulfanyl)naphtho[2,1-b]furan","","- C19 H13 Br O S -","- C19 H13 Br O S -","- C38 H26 Br2 O2 S2 -","2","1","SJ2304","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","2-(4-Bromophenyl)-1-(methylsulfanyl)naphtho[2,1-<i>b</i>]furan","Acta Crystallographica Section E","2007","63","6","o2895","o2895","10.1107/S1600536807022180","","","0.71073","MoKα","","0.0299","0.026","","","0.0686","0.0711","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213967","9.6267","0.0003","10.5305","0.0003","11.956","0.0004","63.967","0.002","73.013","0.002","79.712","0.002","1039.75","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-3,5-dinitrosalicylato)hexaimidazoledicadmium(II) dihydrate","","- C32 H32 Cd2 N16 O16 -","- C32 H32 Cd2 N16 O16 -","- C32 H32 Cd2 N16 O16 -","1","0.5","SJ2305","Hong Deng; Yong-Cai Qiu; Ying-Hua Li; Zhi-Hui Liu; Rong-Hua Zeng","Bis(μ-3,5-dinitrosalicylato)hexaimidazoledicadmium(II) dihydrate","Acta Crystallographica Section E","2007","63","6","m1596","m1596","10.1107/S1600536807021460","","","0.71073","MoKα","","0.0295","0.0257","","","0.0608","0.0628","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213968","13.777","0.003","7.6072","0.0014","23.431","0.004","90","","104.167","0.003","90","","2381","0.8","290","2","290","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(5S)-1,4-Bis{[(1E)-4-methylbenzylidene]amino}-5-(thien-2-yl)pyrrolidin-2-one","","- C25 H24 N4 O2 S -","- C25 H24 N4 O2 S -","- C100 H96 N16 O8 S4 -","4","1","SJ2306","Deepak Chopra; K. N. Venugopala; G. K. Rao","(5<i>S</i>)-1,4-Bis{[(1<i>E</i>)-4-methylbenzylidene]amino}-5-(thien-2-yl)pyrrolidin-2-one","Acta Crystallographica Section E","2007","63","6","o2840","o2840","10.1107/S1600536807021587","","","0.71073","MoKα","","0.1195","0.0619","","","0.1193","0.1403","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213969","7.1998","0.0017","8.969","0.002","9.722","0.002","69.094","0.005","85.974","0.006","71.177","0.004","554.4","0.2","2930","2","290","2","","","","","","","","4","P -1","-P 1","2","","3-Dibromoacetyl-2H-chromen-2-one","","- C11 H6 Br2 O3 -","- C11 H6 Br2 O3 -","- C22 H12 Br4 O6 -","2","1","SJ2309","Deepak Chopra; K. N. Venugopala; G. K. Rao; T. N. Guru Row","3-Dibromoacetyl-2<i>H</i>-chromen-2-one","Acta Crystallographica Section E","2007","63","6","o2826","o2826","10.1107/S1600536807021472","","","0.71073","MoKα","","0.0362","0.0292","","","0.0731","0.0764","","","","","","1.051","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213970","8.052","0.002","33.489","0.006","8.881","0.003","90","","107.31","0.005","90","","2286.3","1","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,6-bis(3,5-dichlorosalicylaldimine)-1,1'-spiro[4,4]nonane","","- C23 H22 Cl4 N2 O2 -","- C23 H22 Cl4 N2 O2 -","- C92 H88 Cl16 N8 O8 -","4","1","SJ2310","Man Jiang; Lin-Tao Yu; Hui Ye; Xiang-Ge Zhou","A new salen ligand: 2,2'-[(spiro[4.4]nonane-1,6-diyl)dinitrilomethylidyne]bis(4,6-dichlorophenol)","Acta Crystallographica Section E","2007","63","6","o3049","o3050","10.1107/S1600536807023148","","","0.71073","MoKα","","0.1676","0.0864","","","0.2366","0.2773","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213971","20.0916","0.0018","7.2538","0.0007","28.046","0.002","90","","101.527","0.002","90","","4005","0.6","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","3-[(2-Chlorothiazol-5-yl)methyl]-5-(isobutylamino)-6-phenyl-3H- 1,2,3-triazolo[4,5-d]pyrimidin-7(6H)-one","","- C18 H18 Cl N7 O S -","- C18 H18 Cl N7 O S -","- C144 H144 Cl8 N56 O8 S8 -","8","1","SJ2311","Lin-Xia Xiao; De-Qing Shi","3-[(2-Chlorothiazol-5-yl)methyl]-5-(isobutylamino)-6-phenyl-3<i>H</i>-1,2,3-triazolo[4,5-<i>d</i>]pyrimidin-7(6<i>H</i>)-one","Acta Crystallographica Section E","2007","63","6","o2843","o2843","10.1107/S1600536807021484","","","0.71073","MoKα","","0.145","0.0639","","","0.1214","0.1433","","","","","","0.977","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213972","8.3748","0.0011","8.8057","0.0012","12.5949","0.0017","99.205","0.002","93.504","0.002","117.338","0.002","804.81","0.19","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","Bis(<i>tert</i>-butyl-3-oxobutanoato)dipyridinenickel(II) benzene solvate","","- C32 H42 N2 Ni O6 -","- C32 H42 N2 Ni O6 -","- C32 H42 N2 Ni O6 -","1","0.5","SJ2312","Susanta K. Nayak; Anirudha Jena; Gururaj M. Neelgund; S. A. Shivashankar; T. N. Guru Row","Bis(<i>tert</i>-butyl-3-oxobutanoato)dipyridinenickel(II) benzene solvate","Acta Crystallographica Section E","2007","63","6","m1604","m1604","10.1107/S1600536807021496","","","0.71073","MoKα","","0.0327","0.0314","","","0.0847","0.0859","","","","","","1.098","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213973","9.0609","0.0009","8.6714","0.0012","27.0214","0.0019","90","","90","","90","","2123.1","0.4","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2-(2-Ammonioethylaminocarbonyl)benzoate hemihydrate","","- C10 H13 N2 O3.5 -","- C10 H13 N2 O3.5 -","- C80 H104 N16 O28 -","8","2","SJ2313","D. Chellappa; S. Chitralekha; D. Sakthilatha; S. Athimoolam; S. Natarajan","2-[(2-Ammonioethyl)aminocarbonyl]benzoate hemihydrate","Acta Crystallographica Section E","2007","63","6","o2875","o2876","10.1107/S1600536807021599","","","0.71073","MoKα","","0.0788","0.0503","","","0.1347","0.1525","","","","","","1.154","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213974","10.763","0.002","7.9925","0.0015","23.438","0.005","90","","97.326","0.003","90","","1999.8","0.7","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-Methyl-1,2-diphenylcyclobuteno[3,4-a]naphthalene-2,3-dicarboximide","","- C27 H19 N O2 -","- C27 H19 N O2 -","- C108 H76 N4 O8 -","4","1","SJ2314","Qing-Jian Liu","<i>N</i>-Methyl-1,2-diphenylcyclobuteno[3,4-<i>a</i>]naphthalene-2,3-dicarboximide","Acta Crystallographica Section E","2007","63","6","o2901","o2901","10.1107/S1600536807022568","","","0.71073","MoKα","","0.0971","0.0576","","","0.1086","0.1232","","","","","","1.014","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213975","11.1001","0.0002","21.208","0.0005","21.6944","0.0005","103.568","0.0008","90.1886","0.0007","91.6505","0.0008","4962.25","0.19","293","2","295","2","","","","","","","","6","P -1","-P 1","2","","(Isoquinoline-2κ<i>N</i>)bis[μ-1-(2-oxidobenzylidene)-4- phenylthiosemicarbazonato]-1:2κ^4^S,N,O:O;1:2κ^4^O:O,N,S-(quinoline- 1κ<i>N</i>)dizinc(II) hemiquinoline hemiisoquinoline solvate","","- C55 H43 N9 O2 S2 Zn2 -","- C55 H43 N9 O2 S2 Zn2 -","- C220 H172 N36 O8 S8 Zn8 -","4","2","SJ2316","Deng, Zhao-Peng; Gao, Shan; Ng, Seik Weng","(Isoquinoline-2κ<i>N</i>)bis[μ-1-(2-oxidobenzylidene)-4-phenylthiosemicarbazonato]-1:2κ^4^<i>S</i>,<i>N</i>,<i>O</i>:<i>O</i>;1:2κ^4^<i>O</i>:<i>O</i>,<i>N</i>,<i>S</i>-(quinoline-1κ<i>N</i>)dizinc(II) hemiquinoline hemiisoquinoline solvate","Acta Crystallographica Section E","2007","63","6","m1650","m1650","10.1107/S1600536807022179","","","0.71073","MoKα","","0.086","0.059","","","0.177","0.205","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213976","7.984","0.0004","12.6632","0.0006","22.3163","0.0011","91.574","0.003","94.154","0.003","103.791","0.003","2183.11","0.19","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","{4,4'-Dichloro-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenolato-κ^4^O,N,N',O'}(pyridine-κN)zinc(II)","","- C25 H17 Cl2 N3 O2 Zn -","- C25 H17 Cl2 N3 O2 Zn -","- C100 H68 Cl8 N12 O8 Zn4 -","4","2","SJ2317","Naser Eltaher Eltayeb; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun; Kamarulazizi Ibrahim","{4,4'-Dichloro-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenolato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}(pyridine-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2007","63","6","m1672","m1673","10.1107/S1600536807022829","","","0.71073","MoKα","","0.0574","0.0391","","","0.0932","0.1107","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213977","9.1588","0.0015","16.185","0.003","11.3892","0.0018","90","","102.813","0.002","90","","1646.2","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di-μ-acetato-bis[triaquabis(thiocyanato-κN)(pyridine N-oxide-κO)neodymium(III)]","","- C18 H28 N6 Nd2 O12 S4 -","- C18 H28 N6 Nd2 O12 S4 -","- C36 H56 N12 Nd4 O24 S8 -","2","0.5","SJ2319","Zhang, Shi-Guo; Shi, Jing-Min","Di-μ-acetato-bis[triaquabis(thiocyanato-κ<i>N</i>)(pyridine <i>N</i>-oxide-κ<i>O</i>)neodymium(III)]","Acta Crystallographica Section E","2007","63","6","m1763","m1763","10.1107/S1600536807025457","","","0.71073","MoKα","","0.0365","0.0307","","","0.0678","0.0705","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213978","9.818","0.007","24.895","0.018","10.431","0.007","90","","115.724","0.011","90","","2297","3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis{N-[2-(2-hydroxyethylamino)ethyl]salicylideneimine}chromium(III) chloride","","- C22 H30 Cl Cr N4 O4 -","- C22 H30 Cl Cr N4 O4 -","- C88 H120 Cl4 Cr4 N16 O16 -","4","1","TK2152","Ye, Yong-Hao; Feng, Ming-Qian; Zhang, Ying-Lao; Liu, Chang-Hong","Bis{<i>N</i>-[2-(2-hydroxyethylamino)ethyl]salicylideneimine}chromium(III) chloride","Acta Crystallographica Section E","2007","63","6","m1636","m1637","10.1107/S1600536807022118","","","0.71073","MoKα","","0.096","0.056","","","0.133","0.159","","","","","","0.93","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213979","11.284","0.003","14.918","0.004","4.5942","0.0011","90","","90","","90","","773.4","0.3","93","2","93","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","N,N'-Di-1-naphthylurea","","- C21 H16 N2 O -","- C21 H16 N2 O -","- C42 H32 N4 O2 -","2","0.5","TK2153","Slawin, Alexandra M. Z.; Lawson, Jeffrey; Storey, John M. D.; Harrison, William T. A.","<i>N</i>,<i>N</i>'-Di-1-naphthylurea revisited","Acta Crystallographica Section E","2007","63","6","o2925","o2927","10.1107/S1600536807016820","","","0.71073","MoKα","","0.069","0.059","","","0.144","0.15","","","","","","1.14","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213980","5.994","0.0012","15.342","0.003","29.361","0.006","90","","90","","90","","2700","0.9","183","2","183","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Benzyl 2-deoxy-2-(3,5-ditert-butylsalicylamino)-α-D-glucopyranoside","","- C28 H41 N O6 -","- C28 H41 N O6 -","- C112 H164 N4 O24 -","4","1","WK2049","Burkhardt, Anja; Buchholz, Axel; Görls, Helmar; Plass, Winfried","Benzyl 2-deoxy-2-(3,5-di-<i>tert</i>-butylsalicylamino)-α-<small>D</small>-glucopyranoside","Acta Crystallographica Section E","2007","63","6","o2994","o2996","10.1107/S1600536807023574","","","0.71073","MoKα","","0.0947","0.0456","","","0.1072","0.154","","","","","","1.089","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2213981","6.207","0.003","10.878","0.005","19.99","0.009","90","","96.706","0.006","90","","1340.5","1.1","113","2","113","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1-(4-Nitrophenyl)-3-pivaloylthiourea","1-(2,2-dimethylpropionyl)-3-(4-nitrophenyl)thiourea","","- C12 H15 N3 O3 S -","- C12 H15 N3 O3 S -","- C48 H60 N12 O12 S4 -","4","1","WK2052","Sultana, Sarwat; Khawar Rauf, M.; Ebihara, Masahiro; Badshah, Amin","1-(4-Nitrophenyl)-3-pivaloylthiourea","Acta Crystallographica Section E","2007","63","6","o2801","o2801","10.1107/S1600536807020995","","","0.7107","MoKα","","0.0699","0.0529","","","0.0973","0.1024","","","","","","1.19","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213982","8.131","0.002","10.171","0.003","13.159","0.003","79.992","0.005","73.465","0.004","68.099","0.004","965.2","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","1-[(6-Chloropyridin-3-yl)methyl]-4-[2,6-dinitro-4- (trifluoromethyl)phenyl]piperazine","","- C17 H15 Cl F3 N5 O4 -","- C17 H15 Cl F3 N5 O4 -","- C34 H30 Cl2 F6 N10 O8 -","2","1","WK2055","Ming-Yi Cai; Xiao-Yong Xu; Hou-Ju Li; Zhu-Yan Zou; Lu Li","1-[(6-Chloropyridin-3-yl)methyl]-4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazine","Acta Crystallographica Section E","2007","63","6","o3008","o3008","10.1107/S1600536807024968","","","0.71073","MoKα","","0.0653","0.0489","","","0.1437","0.1533","","","","","","1.094","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213983","8.009","0.003","9.303","0.003","10.192","0.003","87.815","0.004","87.548","0.004","82.267","0.004","751.4","0.4","571","2","571","2","","","","","","","","6","P -1","-P 1","2","","({[2-(1H-Benzimidazol-2-yl)ethyl]iminomethyl}phenolato)chloridocopper(II)","","- C16 H14 Cl Cu N3 O -","- C16 H14 Cl Cu N3 O -","- C32 H28 Cl2 Cu2 N6 O2 -","2","1","WK2057","Xu-Yan Ma; Xin-Dian Dong; Yan-Ping Li; Zhi-Gang Zhang","({[2-(1<i>H</i>-Benzimidazol-2-yl)ethyl]iminomethyl}phenolato)chloridocopper(II)","Acta Crystallographica Section E","2007","63","6","m1729","m1729","10.1107/S1600536807024397","","","0.71073","MoKα","","0.0538","0.0471","","","0.0936","0.0962","","","","","","1.119","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213984","11.236","0.002","8.611","0.0017","7.3458","0.0015","90","","90","","90","","710.7","0.2","180","2","180","2","","","","","","","","3","C 2 2 21","C 2c 2","20","Cerium metaphosphate","Cerium catena-polyphosphate","","- Ce O9 P3 -","- Ce O9 P3 -","- Ce4 O36 P12 -","4","0.5","WM2096","Cole, Jacqueline M.; Ilieva, Dora","<i>C</i>-type CeP~3~O~9~","Acta Crystallographica Section E","2007","63","6","i138","i139","10.1107/S1600536807020703","","","0.71073","MoKα","","0.027","0.0252","","","0.0541","0.0551","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213985","6.673","0.002","18.992","0.0005","8.808","0.002","90","","97.29","0.03","90","","1107.2","0.4","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","ammonium cerium(III) bis(sulfate) tetrahydrate","","- Ce H12 N O12 S2 -","- Ce H12 N O12 S2 -","- Ce4 H48 N4 O48 S8 -","4","1","WM2108","Boujelben, Mohamed; Toumi, Mohamed; Mhiri, Tahar","NH~4~Ce(SO~4~)~2~·4H~2~O","Acta Crystallographica Section E","2007","63","6","i144","i145","10.1107/S1600536807024555","","","0.71073","MoKα","","0.0335","0.0335","","0.0713","0.0713","0.0684","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213986","19.8551","0.0011","5.2584","0.0002","16.4637","0.001","90","","125.361","0.0007","90","","1401.81","0.13","292","","292","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","cobalt magnesium dichloride tetrakis[trioxotellurate(IV)]","","- Cl2 Co3.617 Mg1.383 O12 Te4 -","- Cl2 Co3.618 Mg1.382 O12 Te4 -","- Cl8 Co14.472 Mg5.528 O48 Te16 -","4","0.5","WM2109","Takagi, Rie; Hjelmqvist, Daisy Torino; Johnsson, Mats","The solid solution Co~3.6~Mg~1.4~Cl~2~(TeO~3~)~4~","Acta Crystallographica Section E","2007","63","6","i146","i147","10.1107/S1600536807024014","","","0.71069","MoKα","","0.054","0.0439","","","0.0628","0.064","","","","","","1.48","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213987","41.795","0.009","8.6674","0.0019","13.161","0.003","90","","105.548","0.004","90","","4593.2","1.8","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","trans-Diaquatetramethanolcobalt(II) bis(rac-1,1'-binaphthalene-2,2'-diylphosphate) methanol disolvate monohydrate","","- C46 H54 Co O17 P2 -","- C46 H54 Co O17 P2 -","- C184 H216 Co4 O68 P8 -","4","0.5","WM2111","Wisser, Barbara; Janiak, Christoph","Redetermination of <i>trans</i>-diaquatetramethanolcobalt(II) bis(<i>rac</i>-1,1'-binaphthalene-2,2'-diylphosphate) methanol disolvate monohydrate: a two-dimensional supramolecular hydrogen-bonded network","Acta Crystallographica Section E","2007","63","6","m1732","m1733","10.1107/S1600536807024166","","","0.71073","MoKα","","0.1183","0.0518","","","0.1192","0.1467","","","","","","0.988","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213988","17.5348","0.0015","5.6159","0.0003","10.8542","0.0011","90","","90","","90","","1068.85","0.15","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","trineodymium silicotetramolybdate","","- Mo4 Nd3 O14 Si -","- Mo4 Nd3 O14 Si -","- Mo16 Nd12 O56 Si4 -","4","0.5","WM2113","Gougeon, P.; Gall, P.","Nd~3~Mo~4~SiO~14~","Acta Crystallographica Section E","2007","63","6","i143","i143","10.1107/S1600536807024798","","","0.71069","MoKα","","0.0513","0.0367","","","0.0819","0.0846","","","","","","1.377","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2213989","6.5702","0.0004","5.4749","0.0003","4.455","0.0003","90","","107.419","0.004","90","","152.903","0.017","295","","295","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Strontium trioxoselenate(IV)","","- O3 Se Sr -","- O3 Se Sr -","- O6 Se2 Sr2 -","2","0.5","WM2114","Oleg A. Dityatiev; Philip Lightfoot; Petr S. Berdonosov; Valery A. Dolgikh","SrSeO~3~ from a combined X-ray and neutron powder diffraction study","Acta Crystallographica Section E","2007","63","6","i149","i150","10.1107/S1600536807025135","","neutron","1.59432","neutron","","","","","","","","","","0.65","","","","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2213990","5.8092","0.0013","6.5152","0.0013","7.9189","0.0017","98.595","0.003","106.74","0.003","102.494","0.003","272.93","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","trans-4, 5-dihydroxyimidazolidine-2-thione","trans-4,5-Dihydroxyimidazolidine-2-thione","","- C3 H6 N2 O2 S -","- C3 H6 N2 O2 S -","- C6 H12 N4 O4 S2 -","2","1","WN2125","Zhen-Feng Zhang; Jin-Ming Zhang; Jian-Ping Guo; Gui-Rong Qu","<i>trans</i>-4,5-Dihydroxyimidazolidine-2-thione","Acta Crystallographica Section E","2007","63","6","o2821","o2823","10.1107/S1600536807018429","","","0.71073","MoKα","","0.029","0.028","","","0.073","0.074","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213991","8.558","0.0017","8.9289","0.0018","9.017","0.0018","63.57","0.03","75.43","0.03","77.8","0.03","593.2","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","9-(1,2,4-Triazol-1-yl)anthracene","","- C16 H11 N3 -","- C16 H11 N3 -","- C32 H22 N6 -","2","1","WN2138","Rong Li","9-(1,2,4-Triazol-1-yl)anthracene","Acta Crystallographica Section E","2007","63","6","o2898","o2898","10.1107/S1600536807022271","","","0.71073","MoKα","","0.0833","0.0615","","","0.1255","0.1372","","","","","","1.117","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213992","6.5783","0.0001","12.8191","0.0002","18.4454","0.0003","90","","90","","90","","1555.46","0.04","295","2","295","2","","","","","","","","5","P b c m","-P 2c 2b","57","","Poly[hydronium [μ-(ethylenediaminetetraacetato- κ^8^N,N',O,O',O'',O''':O'''',O''''')erbate(III)] monohydrate]","","- C10 H17 Er N2 O10 -","- C10 H12 Er N2 O10 -","- C40 H48 Er4 N8 O40 -","4","0.5","WN2139","You, Xiu-Li; Wang, Li-Hua; Ng, Seik Weng","Poly[hydronium [μ-(ethylenediaminetetraacetato-κ^8^<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''':<i>O</i>'''',<i>O</i>''''')erbate(III)] monohydrate]","Acta Crystallographica Section E","2007","63","6","m1713","m1713","10.1107/S1600536807024361","","","0.71073","MoKα","","0.028","0.022","","","0.052","0.055","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213993","6.5924","0.0001","12.845","0.0001","18.4246","0.0002","90","","90","","90","","1560.18","0.03","295","2","295","2","","","","","","","","5","P b c m","-P 2c 2b","57","","Poly[hydronium [μ-(ethylenediaminetetraacetato- κ^8^N,N',O,O',O'',O''':O'''',O''''')holmate(III)] monohydrate]","","- C10 H17 Ho N2 O10 -","- C10 H12 Ho N2 O10 -","- C40 H48 Ho4 N8 O40 -","4","0.5","WN2140","You, Xiu-Li; Wang, Li-Hua; Ng, Seik Weng","Poly[hydronium [μ-(ethylenediaminetetraacetato-κ^8^<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''':<i>O</i>'''',<i>O</i>''''')holmate(III)] monohydrate]","Acta Crystallographica Section E","2007","63","6","m1714","m1714","10.1107/S1600536807024373","","","0.71073","MoKα","","0.019","0.017","","","0.045","0.045","","","","","","0.99","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2213994","14.72","0.0009","6.1434","0.0004","24.2503","0.0016","90","","92.262","0.001","90","","2191.3","0.2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,5-Bis(4-dimethylaminobenzylidene)-1-propyl-4-piperidone","","- C26 H33 N3 O -","- C26 H33 N3 O -","- C104 H132 N12 O4 -","4","1","WN2143","Vladimir N. Nesterov; Sergey S. Sarkisov; Michael J. Curley; Augustine Urbas","3,5-Bis[4-(dimethylamino)benzylidene]-1-propyl-4-piperidone: a prospective biophotonic material","Acta Crystallographica Section E","2007","63","6","o3043","o3044","10.1107/S1600536807024385","","","0.71073","MoKα","","0.0853","0.0524","","","0.1179","0.1343","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2213995","8.3586","0.001","9.457","0.002","11.644","0.002","66.137","0.008","77.057","0.01","65.54","0.01","764.4","0.2","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","μ-1,2-Bis(diphenylphosphino)ethane-bis[trichloridogallium(III)]","","- C26 H24 Cl6 Ga2 P2 -","- C26 H24 Cl6 Ga2 P2 -","- C26 H24 Cl6 Ga2 P2 -","1","0.5","WN2145","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","μ-1,2-Bis(diphenylphosphino)ethane-κ^2^<i>P</i>:<i>P</i>-bis[trichloridogallium(III)]","Acta Crystallographica Section E","2007","63","6","m1761","m1761","10.1107/S1600536807024592","","","0.71073","MoKα","","0.0554","0.0319","","","0.0626","0.073","","","","","","1.014","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213996","7.5687","0.0003","11.361","0.0005","12.1481","0.0005","111.318","0.002","92.757","0.002","97.92","0.002","958.36","0.07","160","1","160","1","","","","","","","","3","P -1","-P 1","2","2,6-Diphenyl-piperidine","(2,6-Diphenylpiperidin-4-ylidene)(phenyl)acetonitrile","","- C25 H22 N2 -","- C25 H22 N2 -","- C50 H44 N4 -","2","1","WW2085","Thiruvalluvar, A.; Balamurugan, S.; Manimekalai, A.; Balamurugan, A.","(2,6-Diphenylpiperidin-4-ylidene)(phenyl)acetonitrile","Acta Crystallographica Section E","2007","63","6","o2903","o2903","10.1107/S1600536807022386","","","0.71073","MoKα","","0.0628","0.0517","","","0.1348","0.1441","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213997","14.2931","0.0013","17.4948","0.0013","14.6359","0.0016","90","","107.79","0.004","90","","3484.8","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Dimethyldithiocarbamato-κ^2^S,S')iodido(1,10-phenanthroline- κ^2^N,N')copper(II)","","- C15 H14 Cu I N3 S2 -","- C15 H14 Cu I N3 S2 -","- C120 H112 Cu8 I8 N24 S16 -","8","2","WW2086","Fan, Le-Qing; Wu, Ji-Huai","(Dimethyldithiocarbamato-κ^2^<i>S</i>,<i>S</i>')iodido(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)","Acta Crystallographica Section E","2007","63","6","m1768","m1768","10.1107/S1600536807025093","","","0.71073","MoKα","","0.0627","0.05","","","0.1339","0.1441","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213998","5.43","0.0011","7.043","0.0014","11.216","0.002","86.88","0.03","86.3","0.03","78.08","0.03","418.44","0.15","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","N,N'-[(2,3,5,6-Tetrafluoro-1,4-phenylene)dimethylene]bis(pyridine-2-carboxamide)","","- C20 H14 F4 N4 O2 -","- C20 H14 F4 N4 O2 -","- C20 H14 F4 N4 O2 -","1","0.5","XU2233","Sheng-Chun Chen; Fang-Hua Yin; Ming-Yang He; Kang Yan; Qun Chen","<i>N</i>,<i>N</i>'-[(2,3,5,6-Tetrafluoro-1,4-phenylene)dimethylene]bis(pyridine-2-carboxamide)","Acta Crystallographica Section E","2007","63","6","o2835","o2836","10.1107/S160053680701731X","","","0.71073","MoKα","","0.072","0.067","","","0.136","0.138","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2213999","24.001","0.003","24.001","0.003","13.441","0.003","90","","90","","120","","6705.3","1.9","298","2","298","2","","","","","","","","3","R 3 :H","R 3","146","","1,5-Di-<i>O</i>-acetyl-2,3,4-tri-<i>O</i>-benzyl-α-<i>D</i>-mannopyranoside","","- C31 H34 O8 -","- C31 H34 O8 -","- C279 H306 O72 -","9","1","XU2242","Zi-Jie Liu; Dong Han; Lin-Na Wang; Xiang-Bao Meng; Zhong-Jun Li","1,5-Di-<i>O</i>-acetyl-2,3,4-tri-<i>O</i>-benzyl-α-<small>D</small>-mannopyranoside","Acta Crystallographica Section E","2007","63","6","o2975","o2975","10.1107/S1600536807023501","","","0.71073","MoKα","","0.098","0.053","","","0.085","0.089","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214000","6.9626","0.0002","7.0317","0.0002","22.9019","0.0005","93.372","0.001","91.821","0.001","102.932","0.002","1089.76","0.05","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","Poly[triaquabis(μ-benzene-1,2,4-tricarboxylato)zinc(II)dipotassium(I)]","","- C18 H14 K2 O15 Zn -","- C18 H14 K2 O15 Zn -","- C36 H28 K4 O30 Zn2 -","2","1","XU2244","Liu, Yen-Hsiang; Chung, Huey-Ting","Poly[triaquabis(μ-benzene-1,2,4-tricarboxylato)zinc(II)dipotassium(I)]","Acta Crystallographica Section E","2007","63","6","m1555","m1556","10.1107/S1600536807020818","","","0.71073","MoKα","","","0.032","","","","0.11","","","","","","1.097","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214001","8.2163","0.0015","8.4765","0.0015","12.437","0.002","72.485","0.003","74.209","0.003","61.065","0.003","714.6","0.2","112","2","","","","","","","","","","4","P -1","-P 1","2","","4-(2-Furyl)-1-(4-methoxybenzyl)-1H-pyrazolo[3,4,d]pyrimidine","","- C17 H14 N4 O2 -","- C17 H14 N4 O2 -","- C34 H28 N8 O4 -","2","1","XU2248","Brændvang, Morten; Gundersen, Lise-Lotte","4-(2-Furyl)-1-(4-methoxybenzyl)-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidine","Acta Crystallographica Section E","2007","63","6","o2849","o2849","10.1107/S1600536807021952","","","0.71073","MoKα","","","0.046","","","","0.135","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214002","11.525","0.002","11.743","0.002","18.709","0.004","90.45","0.03","94.21","0.03","117.29","0.03","2241.7","1","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Tris[(3-aminopropyl)dimethylammonium] decavanadate(V) hexahydrate","","- C15 H60 N6 O34 V10 -","- C15 H60 N6 O34 V10 -","- C30 H120 N12 O68 V20 -","2","1","XU2250","Zhu, Chun-Yuan; Li, Yan-Tuan; Wu, Jian-Dong; Wu, Zhi-Yong; Wu, Xia","Tris[(3-aminopropyl)dimethylammonium] decavanadate(V) hexahydrate","Acta Crystallographica Section E","2007","63","6","m1777","m1778","10.1107/S1600536807023306","","","0.71073","MoKα","","0.085","0.045","","","0.109","0.134","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214003","12.994","0.003","35.859","0.012","6.983","0.002","90","","90","","90","","3253.7","1.6","150","2","150","2","","","","","","","","4","F d d 2","F 2 -2d","43","","N,N'-bis(3-nitrobenzylidene)propane-1,3-diamine","","- C17 H16 N4 O4 -","- C17 H16 N4 O4 -","- C136 H128 N32 O32 -","8","0.5","XU2251","Habibi, Mohammad Hossein; Mokhtari, Reza; Harrington, Ross W.; Clegg, William","The Schiff base <i>N</i>,<i>N</i>'-bis(3-nitrobenzylidene)propane-1,3-diamine","Acta Crystallographica Section E","2007","63","6","o2881","o2881","10.1107/S1600536807021940","","","0.71073","MoKα","","0.051","0.039","","","0.096","0.104","","","","","","1.145","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214004","8.0721","0.0008","28.668","0.003","8.3764","0.0009","90","","114.876","0.002","90","","1758.5","0.3","112","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-(2-Benzofuryl)-2-chloro-9-[(4-methoxyphenyl)methyl]-9H-purine","","- C21 H15 Cl N4 O2 -","- C21 H15 Cl N4 O2 -","- C84 H60 Cl4 N16 O8 -","4","1","XU2252","Braendvang, Morten; Gundersen, Lise-Lotte","6-(2-Benzofuryl)-2-chloro-9-[(4-methoxyphenyl)methyl]-9<i>H</i>-purine","Acta Crystallographica Section E","2007","63","6","o3036","o3037","10.1107/S1600536807022647","","","0.71073","MoKα","","","0.0358","","","","0.0938","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214005","5.2115","0.0012","8.4001","0.0018","13.107","0.003","105.13","0.017","95.953","0.018","101.584","0.017","535.2","0.2","298","2","298","","","","","","","","","5","P -1","-P 1","2","","<i>catena</i>-Poly[[[diaquanickel(II)]-μ-pyridine-2,4-dicarboxylato- [tetraaquanickel(II)]-μ-pyridine-2,4-dicarboxylato] dihydrate]","","- C14 H22 N2 Ni2 O16 -","- C14 H22 N2 Ni2 O16 -","- C14 H22 N2 Ni2 O16 -","1","0.5","XU2253","Liu, Yen-Hsiang; Jhang, Pei-Ci","<i>catena</i>-Poly[[[diaquanickel(II)]-μ-pyridine-2,4-dicarboxylato-[tetraaquanickel(II)]-μ-pyridine-2,4-dicarboxylato] dihydrate]","Acta Crystallographica Section E","2007","63","6","m1682","m1682","10.1107/S1600536807023021","","","0.71073","MoKα","","","0.036","","","","0.092","","","","","","1.009","","","","has coordinates,has Fobs","278247","2022-09-28","15:09:33",""
"2214006","6.0174","0.0015","10.452","0.002","28.043","0.005","90","","90.81","0.02","90","","1763.6","0.6","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-1-(Diphenylphosphinyl)-2-(1-hydroxycyclohexyl)ethene","","- C20 H23 O2 P -","- C20 H23 O2 P -","- C80 H92 O8 P4 -","4","1","XU2254","Yu, Bin; Wang, Xiao-Qing; Shen, Guang-Qiu; Shen, De-Zhong","(<i>E</i>)-1-(Diphenylphosphinyl)-2-(1-hydroxycyclohexyl)ethene","Acta Crystallographica Section E","2007","63","6","o2973","o2973","10.1107/S1600536807023422","","","0.71073","MoKα","","0.124","0.05","","","0.079","0.098","","","","","","1.065","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214007","4.212","0.0012","13.359","0.002","19.236","0.002","99.936","0.005","94.326","0.006","96.79","0.006","1053.6","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","dimethyl 4-iodopyridine-2,6-dicarboxylate","dimethyl 4-iodopyridine-2,6-dicarboxylate","","- C9 H8 I N O4 -","- C9 H8 I N O4 -","- C36 H32 I4 N4 O16 -","4","2","YA2042","Abhayawardhana, Anusha D.; Parvez, Masood; Sutherland, Todd C.","Dimethyl 4-iodopyridine-2,6-dicarboxylate","Acta Crystallographica Section E","2007","63","6","o2963","o2965","10.1107/S1600536807012809","","","0.71073","MoKα","","0.108","0.05","","","0.076","0.096","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214008","16.365","0.0006","5.803","0.0002","18.3458","0.0006","90","","90.511","0.003","90","","1742.16","0.1","295","","295","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Aquabis(chloroacetato-κ<i>O</i>)bis(pyridine-κN)copper(II)","","- C14 H16 Cl2 Cu N2 O5 -","- C14 H16 Cl2 Cu N2 O5 -","- C56 H64 Cl8 Cu4 N8 O20 -","4","0.5","YA2049","Sieroń, Lesław","Aquabis(chloroacetato-κ<i>O</i>)bis(pyridine-κ<i>N</i>)copper(II)","Acta Crystallographica Section E","2007","63","6","m1659","m1661","10.1107/S1600536807022301","","","0.71073","MoKα","","0.028","0.028","","","0.069","0.069","","","","","","1.12","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214009","7.9536","0.0004","33.8974","0.0015","11.2442","0.0005","90","","109.584","0.002","90","","2856.1","0.2","90","0.2","90","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Tetrakis-(2,4,5-trichlorophenyl)stannane","Tetrakis(2,4,5-trichlorophenyl)stannane","","- C24 H8 Cl12 Sn -","- C24 H8 Cl12 Sn -","- C96 H32 Cl48 Sn4 -","4","1","YA2050","Shaikh, Nadim S.; Parkin, Sean; Lehmler, Hans-Joachim","Tetrakis(2,4,5-trichlorophenyl)stannane","Acta Crystallographica Section E","2007","63","6","m1584","m1586","10.1107/S1600536807020909","","","1.54178","CuKα","","0.025","0.024","","","0.06","0.059","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214010","8.9232","0.0009","10.6901","0.001","8.8887","0.0009","90","","90.378","0.003","90","","847.87","0.14","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[diaquanickel(II)]-bis[μ-(4-pyridylsulfanyl)acetato- κ<sup>2</sup>N:O;κ<sup>2</sup>O:N]]","","- C14 H16 N2 Ni O6 S2 -","- C14 H16 N2 Ni O6 S2 -","- C28 H32 N4 Ni2 O12 S4 -","2","0.5","YA2052","Xi-Ping Luo; Lei Han","<i>catena</i>-Poly[[diaquanickel(II)]-bis[μ-(4-pyridylsulfanyl)acetato-κ^2^<i>N</i>:<i>O</i>;κ^2^<i>O</i>:<i>N</i>]]","Acta Crystallographica Section E","2007","63","6","m1745","m1745","10.1107/S1600536807023550","","","0.71073","MoKα","","0.112","0.084","","","0.169","0.191","","","","","","1.14","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214011","10.1801","0.0002","35.4768","0.0006","8.1456","0.0002","90","","97.144","0.001","90","","2919.01","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[aqua[(2,4-dichlorophenoxy)acetato]neodymium(III)]-di-μ-\ (2,4-dichlorophenoxy)acetato]","","- C24 H17 Cl6 Nd O10 -","- C24 H17 Cl6 Nd O10 -","- C96 H68 Cl24 Nd4 O40 -","4","1","ZL2021","Jian Guo; Wei-Jun Liang; Wen-Dong Song","<i>catena</i>-Poly[[aqua[(2,4-dichlorophenoxy)acetato]neodymium(III)]-di-μ-(2,4-dichlorophenoxy)acetato]","Acta Crystallographica Section E","2007","63","6","m1595","m1595","10.1107/S160053680702154X","","","0.71073","MoKα","","0.0367","0.031","","","0.0774","0.0875","","","","","","1.234","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214012","19.7872","0.0013","10.8571","0.001","13.5055","0.0008","90","","90","","90","","2901.4","0.4","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","2,2',2''-Nitrilotris(ethylammonium) tetrathioantimonate","","- C6 H21 N4 S4 Sb -","- C6 H21 N4 S4 Sb -","- C48 H168 N32 S32 Sb8 -","8","2","ZL2025","Poisot, Martha; Näther, Christian; Bensch, Wolfgang","2,2',2''-Nitrilotris(ethylammonium) tetrathioantimonate","Acta Crystallographica Section E","2007","63","6","m1751","m1752","10.1107/S160053680702394X","","","0.71073","MoKα","","0.0399","0.0248","","","0.0611","0.065","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214013","5.5052","0.0001","8.0683","0.0003","11.3008","0.0005","70.338","0.002","89.399","0.002","78.706","0.001","462.7","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(5-n-butylpyridine-2-carboxylato)copper(II)","","- C20 H24 Cu N2 O4 -","- C20 H24 Cu N2 O4 -","- C20 H24 Cu N2 O4 -","1","0.5","ZL2030","Lu He; Jian-Bin Yan; Xian-Xia Guo; Wen-Dong Song","Bis(5-<i>n</i>-butylpyridine-2-carboxylato)copper(II)","Acta Crystallographica Section E","2007","63","6","m1649","m1649","10.1107/S1600536807024580","","","0.71073","MoKα","","0.0443","0.0396","","","0.1039","0.1069","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214014","10.169","0.004","11.477","0.005","15.269","0.006","104.259","0.006","106.185","0.006","103.093","0.006","1573.1","1.1","150","2","150","2","","","","","","","","4","P -1","-P 1","2","4,10-dibromo-2,8-dimethyl Tröger's base","4,10-Dibromo-2,8-dimethyl-6<i>H</i>,12<i>H</i>-5,11- methanodibenzo[<i>b</i>,<i>f</i>][1,5]diazocine","","- C17 H16 Br2 N2 -","- C17 H16 Br2 N2 -","- C68 H64 Br8 N8 -","4","2","ZL2032","Faroughi, Masoud; Try, Andrew C.; Turner, Peter","4,10-Dibromo-2,8-dimethyl-6<i>H</i>,12<i>H</i>-5,11-methanodibenzo[<i>b</i>,<i>f</i>][1,5]diazocine","Acta Crystallographica Section E","2007","63","6","o3030","o3030","10.1107/S1600536807025007","","","0.71073","MoKα","","0.0752","0.0424","","","0.1009","0.1164","","","","","","1.009","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214015","8.4895","0.001","8.4895","0.001","7.7355","0.0009","90","","90","","90","","557.51","0.11","173","2","173","2","","","","","","","","5","P 4/n m m :2","-P 4a 2a","129","","bromido(1,4,7,10-tetraoxacyclododecane-κ^4^<i>O</i>)lithium(I)","","- C8 H16 Br Li O4 -","- C8 H16 Br Li O4 -","- C16 H32 Br2 Li2 O8 -","2","0.125","AT2293","Morawitz, Thorsten; Lerner, Hans-Wolfram; Bolte, Michael","Bromido(12-crown-4)lithium","Acta Crystallographica Section E","2007","63","7","m1923","m1923","10.1107/S1600536807023562","","","0.71073","MoKα","","0.0584","0.0565","","","0.1579","0.1589","","","","","","1.289","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214016","9.8877","0.0008","7.9766","0.0006","12.588","0.001","90","","95.506","0.001","90","","988.24","0.13","100","2","100","2","","","","","","","","6","P 1 n 1","P -2yac","7","","Dichloridobis(dimethyl sulfoxide-κO)diphenyltin(IV)","","- C16 H22 Cl2 O2 S2 Sn -","- C16 H22 Cl2 O2 S2 Sn -","- C32 H44 Cl4 O4 S4 Sn2 -","2","1","AT2303","Sadiq-ur-Rehman; Saeed, Sadia; Ali, Saqib; Shahzadi, Saira; Helliwell, Madeleine","Dichloridobis(dimethyl sulfoxide-κ<i>O</i>)diphenyltin(IV)","Acta Crystallographica Section E","2007","63","7","m1788","m1788","10.1107/S1600536807025858","","","0.71073","MoKα","","0.0213","0.0207","","","0.0481","0.0483","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214017","10.0746","0.001","15.1972","0.0016","15.4631","0.0014","90","","101.597","0.006","90","","2319.2","0.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(2-amino-6-methylpyridinium) di-μ-chlorido-μ-oxido-bis[dichloridoantimonate(III)]","","- C12 H18 Cl6 N4 O Sb2 -","- C12 H18 Cl6 N4 O Sb2 -","- C48 H72 Cl24 N16 O4 Sb8 -","4","1","AT2304","Wen-Jie Feng; Hai-Bin Wang; Xin-Jü Ma; Hai-Yan Li; Zhi-Min Jin","Bis(2-amino-6-methylpyridinium) di-μ-chlorido-μ-oxido-bis[dichloridoantimonate(III)]","Acta Crystallographica Section E","2007","63","7","m1786","m1787","10.1107/S160053680702586X","","","0.71073","MoKα","","0.052","0.0475","","","0.0929","0.0948","","","","","","1.243","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214018","6.8296","0.001","7.1403","0.0011","12.3933","0.0019","80.83","0.002","78.724","0.002","75.612","0.002","570.19","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-(3,4-Dichlorophenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","","- C11 H9 Cl2 N3 O -","- C11 H9 Cl2 N3 O -","- C22 H18 Cl4 N6 O2 -","2","1","AT2305","Tong-De Li; Na-Na Tian; Sai Bi; Jun Wan","1-(3,4-Dichlorophenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2007","63","7","o3063","o3063","10.1107/S1600536807026207","","","0.71073","MoKα","","0.0383","0.0346","","","0.0999","0.1079","","","","","","0.664","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214019","15.447","0.002","10.0122","0.0017","23.598","0.003","90","","90","","90","","3649.6","0.9","298","","298","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Bis(4-methoxybenzaldehyde 2-hydroxybenzoylhydrazonato)pyridinezinc(II) pyridine solvate","","- C40 H36 N6 O6 Zn -","- C40 H36 N6 O6 Zn -","- C160 H144 N24 O24 Zn4 -","4","0.5","AT2306","Tai, Xi-Shi; Yin, Jie; Hao, Ming-Yang","Bis(4-methoxybenzaldehyde 2-hydroxybenzoylhydrazonato)pyridinezinc(II) pyridine solvate","Acta Crystallographica Section E","2007","63","7","m1927","m1928","10.1107/S1600536807028917","","","0.71073","MoKα","","0.1036","0.0443","","","0.1036","0.1439","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214021","7.3643","0.001","12.8295","0.0011","13.9452","0.0014","90","","93.898","0.009","90","","1314.5","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2E)-3-(2-Chlorophenyl)-1-(3-nitrophenyl)prop-2-en-1-one","","- C15 H10 Cl N O3 -","- C15 H10 Cl N O3 -","- C60 H40 Cl4 N4 O12 -","4","1","AT2310","Sarojini, B. K.; Yathirajan, H. S.; Lakshmana, K.; Narayana, B.; Bolte, Michael","(2<i>E</i>)-3-(2-Chlorophenyl)-1-(3-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","7","o3211","o3211","10.1107/S1600536807026815","","","0.71073","MoKα","","0.052","0.0406","","","0.1076","0.1121","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214022","7.547","0.002","13.586","0.004","9.642","0.003","90","","103.427","0.005","90","","961.6","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N'-[1-(2-Hydroxyphenyl)ethylidene]acetohydrazide","","- C10 H12 N2 O2 -","- C10 H12 N2 O2 -","- C40 H48 N8 O8 -","4","1","AT2311","Huan-Mei Guo","<i>N</i>'-[1-(2-Hydroxyphenyl)ethylidene]acetohydrazide","Acta Crystallographica Section E","2007","63","7","o3122","o3122","10.1107/S1600536807026578","","","0.71073","MoKα","","0.0607","0.0414","","","0.1121","0.1268","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214023","5.3681","0.0018","9.361","0.003","19.033","0.006","90","","95.496","0.006","90","","952","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N'-(1-Phenylethylidene)acetohydrazide","","- C10 H12 N2 O -","- C10 H12 N2 O -","- C40 H48 N8 O4 -","4","1","AT2312","Huan-Mei Guo","<i>N</i>'-(1-Phenylethylidene)acetohydrazide","Acta Crystallographica Section E","2007","63","7","o3123","o3123","10.1107/S1600536807026748","","","0.71073","MoKα","","0.1389","0.0485","","","0.0924","0.1169","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214024","4.21","0.002","12.682","0.006","19.016","0.009","90","","94.601","0.008","90","","1012","0.8","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N'-[1-(4-Fluorophenyl)ethylidene]acetohydrazide","","- C10 H11 F N2 O -","- C10 H11 F N2 O -","- C40 H44 F4 N8 O4 -","4","1","AT2313","Li-You Zhou","<i>N</i>'-[1-(4-Fluorophenyl)ethylidene]acetohydrazide","Acta Crystallographica Section E","2007","63","7","o3069","o3069","10.1107/S1600536807026542","","","0.71073","MoKα","","0.1094","0.0544","","","0.1518","0.1887","","","","","","1.065","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214025","15.3209","0.0017","7.3171","0.0006","11.1988","0.0014","90","","98.467","0.01","90","","1241.8","0.2","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-Chlorobenzoyl)benzoic acid","","- C14 H9 Cl O3 -","- C14 H9 Cl O3 -","- C56 H36 Cl4 O12 -","4","1","AT2314","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","2-(4-Chlorobenzoyl)benzoic acid","Acta Crystallographica Section E","2007","63","7","o3197","o3197","10.1107/S1600536807026554","","","0.71073","MoKα","","0.0636","0.0409","","","0.1014","0.1099","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214026","11.476","0.005","13.389","0.005","11.774","0.004","90","","111.653","0.006","90","","1681.4","1.1","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-(<i>p</i>-Fluorophenyl)-1,3-diphenyl-2-pyrazoline","","- C21 H17 F N2 -","- C21 H17 F N2 -","- C84 H68 F4 N8 -","4","1","AT2315","Hong Li","5-(<i>p</i>-Fluorophenyl)-1,3-diphenyl-2-pyrazoline","Acta Crystallographica Section E","2007","63","7","o3280","o3280","10.1107/S1600536807026840","","","0.71073","MoKα","","0.1147","0.043","","","0.0817","0.1013","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214027","7.2462","0.0014","25.71","0.005","11.616","0.002","90","","105.159","0.004","90","","2088.8","0.7","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>'-[1-(4-Chlorophenyl)ethylidene]acetohydrazine","","- C11 H14 Cl N2 O -","- C11 H14 N2 O -","- C88 H112 N16 O8 -","8","2","AT2316","Huan-Mei Guo","<i>N</i>'-[1-(4-Chlorophenyl)ethylidene]acetohydrazine","Acta Crystallographica Section E","2007","63","7","o3124","o3124","10.1107/S1600536807026736","","","0.71073","MoKα","","0.125","0.0552","","","0.1482","0.1905","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214028","11.8379","0.0002","8.6159","0.0002","12.5056","0.0002","90","","106.029","0.001","90","","1225.91","0.04","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-4-{[2-(Methylsulfanyl)phenyl]diazenyl}phenol","","- C13 H12 N2 O S -","- C13 H12 N2 O S -","- C52 H48 N8 O4 S4 -","4","1","AT2317","Biswas, Achintesh Narayan; Das, Purak; Agarwalla, Uday Sankar; Saha, Abhisek; Bandyopadhyay, Pinaki","(<i>E</i>)-4-{[2-(Methylsulfanyl)phenyl]diazenyl}phenol","Acta Crystallographica Section E","2007","63","7","o3114","o3114","10.1107/S1600536807026839","","","0.71073","MoKα","","0.046","0.037","","","0.1013","0.1096","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214029","5.9247","0.0014","8.482","0.002","16.284","0.004","101.424","0.003","90.909","0.003","99.468","0.003","790.2","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","3-(4-Chlorophenyl)-5-(2-furyl)-1-phenyl-2-pyrazoline","","- C19 H15 Cl N2 O -","- C19 H15 Cl N2 O -","- C38 H30 Cl2 N4 O2 -","2","1","AT2318","Huan-Mei Guo","3-(4-Chlorophenyl)-5-(2-furyl)-1-phenyl-2-pyrazoline","Acta Crystallographica Section E","2007","63","7","o3147","o3147","10.1107/S1600536807027080","","","0.71073","MoKα","","0.0502","0.0435","","","0.1201","0.1263","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214030","9.364","0.0011","9.364","0.0011","13.3018","0.0019","90","","90","","120","","1010.1","0.2","173","2","173","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","η^5^-Cyclopentadienyl-η^6^-mesitylenyl-iron(III) hexafluoridophosphate chloroform solvate","","- C15 H18 Cl3 F6 Fe P -","- C15.04 H18.04 Cl3 F6 Fe P -","- C30.08 H36.08 Cl6 F12 Fe2 P2 -","2","0.166667","AT2319","Sánchez Perucha, Alejandro; Bolte, Michael","(η^5^-Cyclopentadienyl)(η^6^-mesitylenyl)iron(II) hexafluorophosphate chloroform solvate","Acta Crystallographica Section E","2007","63","7","m1897","m1897","10.1107/S1600536807026827","","","0.71073","MoKα","","0.0363","0.0357","","","0.0987","0.0996","","","","","","1.125","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214031","7.4922","0.0008","7.6532","0.0008","8.8403","0.0009","90.316","0.008","114.148","0.008","118.516","0.007","393.47","0.09","296","","296","","","","","","","","","5","P -1","-P 1","2","","5-Methoxy-1<i>H</i>-benzo[<i>d</i>]imidazole-2(3<i>H</i>)-thione","","- C8 H8 N2 O S -","- C8 H8 N2 O S -","- C16 H16 N4 O2 S2 -","2","1","AT2322","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan; Narayana, B.; Vijeshi, A. M.; Yathirajan, H. S.","5-Methoxy-1<i>H</i>-benzo[<i>d</i>]imidazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","7","o3199","o3200","10.1107/S1600536807027730","","","0.71073","MoKα","","0.0414","0.0386","","","0.1036","0.1064","","","","","","1.083","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214033","10.9182","0.0002","19.6123","0.0003","10.0124","0.0002","90","","92.096","0.001","90","","2142.53","0.07","273","","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(1<i>H</i>-Benzotriazol-1-yl)-1-(3-chlorobenzoyl)ethyl 2,4-dichlorobenzoate","","- C22 H13 Cl3 N3 O3 -","- C22 H13 Cl3 N3 O3 -","- C88 H52 Cl12 N12 O12 -","4","1","AT2324","Zeng, Wu-Lan; Sun, Xiao-Zheng; Wang, Hui-Qin","2-(1<i>H</i>-Benzotriazol-1-yl)-1-(3-chlorobenzoyl)ethyl 2,4-dichlorobenzoate","Acta Crystallographica Section E","2007","63","7","o3218","o3218","10.1107/S160053680702870X","","","0.71073","MoKα","","0.0685","0.0514","","","0.137","0.1506","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214034","14.854","0.003","11.429","0.002","10.833","0.002","90","","109.09","0.003","90","","1737.9","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-(4-Fluorophenyl)-3-(4-methylphenyl)-1-phenyl-2-pyrazoline","","- C22 H19 F N2 -","- C22 H19 F N2 -","- C88 H76 F4 N8 -","4","1","AT2325","Huan-Mei Guo","5-(4-Fluorophenyl)-3-(4-methylphenyl)-1-phenyl-2-pyrazoline","Acta Crystallographica Section E","2007","63","7","o3223","o3223","10.1107/S1600536807028711","","","0.71073","MoKα","","0.0642","0.0441","","","0.1185","0.1331","","","","","","1.015","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214036","12.67","0.002","8.8499","0.0014","15.846","0.003","90","","108.08","0.003","90","","1689.1","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-[(2,4-Dinitrophenyl)hydrazono]-4,4,4-trifluoro-1-phenylbutan-1-one","","- C16 H11 F3 N4 O5 -","- C16 H11 F3 N4 O5 -","- C64 H44 F12 N16 O20 -","4","1","AT2327","Jing, Zuo-Liang; Zhang, Shu-Juan; Yang, Nan; Feng, Shou-Chun","3-[(2,4-Dinitrophenyl)hydrazono]-4,4,4-trifluoro-1-phenylbutan-1-one","Acta Crystallographica Section E","2007","63","7","o3203","o3203","10.1107/S1600536807028747","","","0.71073","MoKα","","0.0825","0.0404","","","0.097","0.118","","","","","","0.983","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214037","9.0972","0.0012","15.799","0.002","10.0741","0.0013","90","","100.523","0.002","90","","1423.6","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-ditriazol-4-ylpyridine‒benzene-1,2,4,5-tetracarboxylic acid (2/1)","","- C28 H20 N14 O8 -","- C28 H20 N14 O8 -","- C56 H40 N28 O16 -","2","0.5","AT2328","Wei Li; Min Shao; Hong-Jiang Liu; Ming-Xing Li","The 2:1 cocrystal of 2,6-ditriazol-4-ylpyridine and benzene-1,2,4,5-tetracarboxylic acid","Acta Crystallographica Section E","2007","63","7","o3224","o3224","10.1107/S1600536807028759","","","0.71073","MoKα","","0.0538","0.0393","","","0.0896","0.0992","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214038","13.4762","0.0019","6.5174","0.0014","16.497","0.002","90","","101.629","0.002","90","","1419.2","0.4","298","","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-Dimethylbenzaldehyde (3-pyridylcarbonyl)hydrazone monohydrate","","- C15 H17 N3 O2 -","- C15 H17 N3 O2 -","- C60 H68 N12 O8 -","4","1","AT2330","Xi-Shi Tai; Ming-Yang Hao; Yi-Min Feng","3,4-Dimethylbenzaldehyde (3-pyridylcarbonyl)hydrazone monohydrate","Acta Crystallographica Section E","2007","63","7","o3252","o3252","10.1107/S1600536807029212","","","0.71073","MoKα","","0.0794","0.045","","","0.1074","0.1322","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214039","6.5352","0.0002","17.858","0.0003","20.4249","0.0003","90","","90","","90","","2383.7","0.09","293","2","293","2","","","","","","","","5","P c 21 b","P -2bc -2c","29","","1,3-bis(2-methylanilino)-1-phenylbutane(1+) hexafluorophosphate","","- C24 H25 F6 N2 P -","- C24 H25 F6 N2 P -","- C96 H100 F24 N8 P4 -","4","1","AV3093","Najoua Belhaj Mbarek Elmkacher; Mohamed Rzaigui; Faouzi Bouachir","The protonated β-iminoamine 1,3-bis(2-methylanilino)-1-phenylbutane(1+) hexafluorophosphate","Acta Crystallographica Section E","2007","63","7","o3075","o3075","10.1107/S1600536807026232","","","0.71073","MoKα","","0.1166","0.0507","","","0.1171","0.1453","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214040","17.7018","0.0018","8.2468","0.0007","16.0601","0.0016","90","","116.334","0.011","90","","2101.2","0.4","263","2","263","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diisopropylammonium perchlorate","","- C6 H16 Cl N O4 -","- C6 H16 Cl N O4 -","- C48 H128 Cl8 N8 O32 -","8","2","BC3050","Bajorat, Sara; Guido J. Reiß","Diisopropylammonium perchlorate at 263 K","Acta Crystallographica Section E","2007","63","7","o3144","o3144","10.1107/S1600536807027894","","","0.71073","MoKα","","0.1004","0.0436","","","0.0834","0.0898","","","","","","0.961","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214041","10.472","0.002","7.6884","0.0015","10.885","0.002","90","","95.26","0.03","90","","872.7","0.3","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,3-bis(2-trifluoromethylphenylimino)butane","2,3-Bis[2-(trifluoromethyl)phenylimino]butane","","- C18 H14 F6 N2 -","- C18 H14 F6 N2 -","- C36 H28 F12 N4 -","2","0.5","BG2033","Bomfim, João A. S.; Dias, Marcos L.; Filgueiras, Carlos A. L.; Visentin, Lorenzo do C.; Bordinhao, Jairo","2,3-Bis[2-(trifluoromethyl)phenylimino]butane","Acta Crystallographica Section E","2007","63","7","o3150","o3151","10.1107/S1600536807018508","","","0.71073","MoKα","","0.1339","0.0521","","","0.1137","0.1351","","","","","","0.993","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214042","5.039","0.001","15.825","0.001","18.33","0.001","90","","90.884","0.001","90","","1461.5","0.3","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(3S,4S)-1-Benzyl-4-(N-octylcarbamoyloxy)pyrrolidin-3-yl N-octylcarbamate","","- C29 H49 N3 O4 -","- C29 H49 N3 O4 -","- C58 H98 N6 O8 -","2","1","BG2057","Cicchi, Stefano; Faggi, Cristina; Ghini, Giacomo; Guerri, Annalisa; Parlanti, Iacopo","(3<i>S</i>,4<i>S</i>)-1-Benzyl-4-(<i>N</i>-octylcarbamoyloxy)pyrrolidin-3-yl <i>N</i>-octylcarbamate: a low-temperature redetermination","Acta Crystallographica Section E","2007","63","7","o3082","o3082","10.1107/S160053680702572X","","","1.54184","CuKα","","0.0503","0.0387","","","0.0904","0.0961","","","","","","1.075","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214043","6.6835","0.0001","12.3218","0.0003","12.6783","0.0003","105.714","0.002","102.714","0.001","96.003","0.002","965.32","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-(4-<i>tert</i>-Butylbenzyl)-3-(4-chlorophenyl)-1<i>H</i>-pyrazole-5-carboxylic acid","","- C21 H21 Cl N2 O2 -","- C21 H21 Cl N2 O2 -","- C42 H42 Cl2 N4 O4 -","2","1","BG2063","Ding, Xiao-Ling; Dong, Wen-Liang; Xia, Yong; Zhao, Bao-Xiang","1-(4-<i>tert</i>-Butylbenzyl)-3-(4-chlorophenyl)-1<i>H</i>-pyrazole-5-carboxylic acid","Acta Crystallographica Section E","2007","63","7","o3125","o3125","10.1107/S1600536807027006","","","0.71073","MoKα","","0.0848","0.0499","","","0.1479","0.1818","","","","","","0.92","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214044","8.432","0.001","8.588","0.001","14.342","0.002","90","","94.07","0.02","90","","1035.9","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Ethyl-1,3-dioxo-2,3,3a,4,7,7a-hexahydro-1<i>H</i>-isoindole-4-carboxylic acid","","- C11 H13 N O4 -","- C11 H13 N O4 -","- C44 H52 N4 O16 -","4","1","BG2064","Mutikainen, Ilpo; Kiriazis, Alexandros; Leikoski, Tuomo; Yli-Kauhaluoma, Jari","2-Ethyl-1,3-dioxo-2,3,3a,4,7,7a-hexahydro-1<i>H</i>-isoindole-4-carboxylic acid","Acta Crystallographica Section E","2007","63","7","o3240","o3240","10.1107/S1600536807027900","","","0.71073","MoKα","","0.1206","0.0558","","","0.1083","0.1301","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214045","11.271","0.001","7.137","0.001","17.513","0.001","90","","91.62","0.001","90","","1408.2","0.2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(3a<i>R</i>,3b<i>S</i>,11a<i>S</i>,R~S~)-3a,3b,4,5,11,11a-hexahydro-10- {[[(1<i>S</i>,2<i>R</i>,4<i>R</i>)-2-hydroxy-7,7-dimethylbicyclo[2.2.1] hept-1-yl]methyl]sulfinyl}-7-methoxy-2-phenyl-1<i>H</i>-naphth[2,1-<i>e</i>] isoindole-1,3(2<i>H</i>)-dione","","- C33 H37 N O5 S -","- C33 H37 N O5 S -","- C66 H74 N2 O10 S2 -","2","1","BG2066","Aversa, Maria Chiara; Barattucci, Anna; Bonaccorsi, Paola; Faggi, Cristina; Giannetto, Placido","An enantiopure azasteroidal derivative bearing an isoborneol sulfinyl residue","Acta Crystallographica Section E","2007","63","7","o3319","o3319","10.1107/S1600536807029613","","","1.54178","CuKα","","0.033","0.0287","","","0.0698","0.0717","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214046","10.7352","0.0002","14.9914","0.0002","20.4561","0.0003","90","","90","","90","","3292.12","0.09","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Ethyl 1-benzyl-3-phenyl-1<i>H</i>-pyrazole-5-carboxylate","","- C19 H18 N2 O2 -","- C19 H18 N2 O2 -","- C152 H144 N16 O16 -","8","1","BG2070","Xia, Yong; Dong, Wen-Liang; Ding, Xiao-Ling; Zhao, Bao-Xiang","Ethyl 1-benzyl-3-phenyl-1<i>H</i>-pyrazole-5-carboxylate","Acta Crystallographica Section E","2007","63","7","o3298","o3298","10.1107/S1600536807030139","","","0.71073","MoKα","","0.0979","0.0437","","","0.0963","0.1196","","","","","","0.984","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214047","18.842","0.005","14.557","0.004","21.343","0.006","90","","90","","90","","5854","3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","catena-Poly[[[tetra-μ~2~-aqua-heptaaqua(μ~2~-benzene-1,3,5-tricarboxylato)- μ~3~-hydroxido-trinickel(II)sodium]-μ~4~-benzene-1,3,5-tricarboxylato] sesquihydrate]","","- C18 H32 Na Ni3 O25.5 -","- C18 H32 Na Ni3 O25.5 -","- C144 H256 Na8 Ni24 O204 -","8","1","BH2098","Yan, Ying; Li, Weihua; Hou, Baorong","catena-Poly[[[tetra-μ~2~-aqua-heptaaqua(μ~2~-benzene-1,3,5-tricarboxylato)-μ~3~-hydroxido-trinickel(II)sodium]-μ~4~-benzene-1,3,5-tricarboxylato] sesquihydrate]","Acta Crystallographica Section E","2007","63","7","m1921","m1922","10.1107/S1600536807026359","","","0.71073","MoKα","","0.1506","0.0566","","","0.0846","0.1266","","","","","","0.889","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214048","7.273","0.001","9.146","0.001","22.975","0.003","90","","90","","90","","1528.3","0.3","299","2","299","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","<i>N</i>-(4-Methoxybenzyl)quinoline-8-sulfonamide","","- C17 H16 N2 O3 S -","- C17 H16 N2 O3 S -","- C68 H64 N8 O12 S4 -","4","1","BH2105","Andrighetti-Fröhner, Carla Regina; Nunes, Ricardo José; Silva, Luiz Everson da; Simões, Cláudia Maria Oliveira; Foro, Sabine","<i>N</i>-(4-Methoxybenzyl)quinoline-8-sulfonamide","Acta Crystallographica Section E","2007","63","7","o3059","o3059","10.1107/S1600536807025706","","","1.5418","CuKα","","0.0449","0.0442","","","0.1194","0.12","","","","","","1.105","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214049","8.0991","0.0008","15.9385","0.0015","15.044","0.0014","90","","104.61","0.001","90","","1879.2","0.3","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Benzoato-κ^2^O,O')chlorido(2,9-dimethyl-1,10-phenanthroline- κ^2^N,N')copper(II)","","- C21 H17 Cl Cu N2 O2 -","- C21 H17 Cl Cu N2 O2 -","- C84 H68 Cl4 Cu4 N8 O8 -","4","1","BH2106","Xuan, Xiao-Peng; Zhao, Pei-Zheng; Zhang, Shu-Xia","(Benzoato-κ^2^<i>O</i>,<i>O</i>')chlorido(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)","Acta Crystallographica Section E","2007","63","7","m1817","m1817","10.1107/S1600536807026773","","","0.71073","MoKα","","0.0561","0.0399","","","0.1052","0.1177","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214050","12.7723","0.0016","10.4489","0.0013","13.7585","0.0017","90","","105.889","0.002","90","","1766","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis[1-(4-iodobenzyl)pyridinium] bis(1,2-dicyanoethane-1,2-dithiolato-κ^2^S,S')nickelate(II)","","- C32 H22 I2 N6 Ni S4 -","- C32 H22 I2 N6 Ni S4 -","- C64 H44 I4 N12 Ni2 S8 -","2","0.5","BH2107","H. Zhou; X.-M. Ren","Bis[1-(4-iodobenzyl)pyridinium] bis(maleonitriledithiolato)nickelate(II)","Acta Crystallographica Section E","2007","63","7","m1932","m1932","10.1107/S1600536807027377","","","0.71073","MoKα","","0.0663","0.0355","","","0.0641","0.072","","","","","","0.822","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214051","10.962","0.007","12.352","0.007","13.879","0.008","90","","101.813","0.011","90","","1839.5","1.9","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 2-(N-cyclohexyl-2-nitrophenylsulfonamido)-2-oxoacetate","","- C16 H20 N2 O7 S -","- C16 H20 N2 O7 S -","- C64 H80 N8 O28 S4 -","4","1","BH2108","Wang, Bao-Lei; He, Feng-Qi; Li, Zheng-Ming; Song, Hai-Bin","Ethyl 2-(<i>N</i>-cyclohexyl-2-nitrophenylsulfonamido)-2-oxoacetate","Acta Crystallographica Section E","2007","63","7","o3264","o3264","10.1107/S1600536807026785","","","0.71073","MoKα","","0.1088","0.0469","","","0.0999","0.1285","","","","","","1.009","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214052","6.1055","0.0005","7.6413","0.0006","11.6547","0.0009","90","","101.22","0.002","90","","533.35","0.07","291","2","291","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","Triaqua(5-methyl-1H-tetrazolato-κN^1^)zinc(II) perchlorate","","- C2 H9 Cl N4 O7 Zn -","- C2 H9 Cl N4 O7 Zn -","- C4 H18 Cl2 N8 O14 Zn2 -","2","0.5","BH2109","Fu, Dai-Wei; Zhao, Hong","Triaqua(5-methyl-1<i>H</i>-tetrazolato-κ<i>N</i>^1^)zinc(II) perchlorate","Acta Crystallographica Section E","2007","63","7","m1955","m1955","10.1107/S1600536807029297","","","0.71073","MoKα","","0.056","0.0486","","","0.1116","0.1139","","","","","","1.097","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214053","10.3671","0.0012","10.375","0.0008","10.7977","0.0014","84.88","0.01","68.79","0.01","65.4","0.01","981.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","5-(2-Benzoylethenyl)-<i>N</i>-benzyl-2-methoxybenzenesulfonamide","","- C23 H21 N O4 S -","- C23 H21 N O4 S -","- C46 H42 N2 O8 S2 -","2","1","BH2110","Andrighetti-Fröhner, Carla R.; Joussef, Antônio C.; Simões, Cláudia M. O.; Nunes, Ricardo J.; Bortoluzzi, Adailton J.","5-(2-Benzoylethenyl)-<i>N</i>-benzyl-2-methoxybenzenesulfonamide","Acta Crystallographica Section E","2007","63","7","o3275","o3276","10.1107/S1600536807029303","","","0.71073","MoKα","","0.0798","0.0472","","","0.1197","0.1348","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214054","10.0259","0.0015","7.0956","0.0011","27.648","0.004","90","","93.528","0.002","90","","1963.1","0.5","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aqua(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')(pyridine- 2,6-dicarboxylato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')cobalt(II) tetrahydrate","","- C13 H19 Co N5 O9 S2 -","- C13 H19 Co N5 O9 S2 -","- C52 H76 Co4 N20 O36 S8 -","4","1","BH2116","Wei, Cui-E; Chen, Guang-Hua; Liu, Bing-Xin","Aqua(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')(pyridine-2,6-dicarboxylato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')cobalt(II) tetrahydrate","Acta Crystallographica Section E","2007","63","7","m1964","m1965","10.1107/S1600536807029595","","","0.71073","MoKα","","0.0899","0.0483","","","0.0955","0.1117","","","","","","1.014","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214055","6.3792","0.0006","10.4941","0.0008","13.7634","0.0012","90","","99.479","0.0014","90","","908.8","0.14","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-Dihydroxybenozic acid acetonitile solvate","","- C9 H9 N O4 -","- C9 H9 N O4 -","- C36 H36 N4 O16 -","4","1","BH2117","Mazurek, Jaroslaw; Dova, Eva; Helmond, Rosaline","3,4-Dihydroxybenzoic acid acetonitrile solvate at 120 K","Acta Crystallographica Section E","2007","63","7","o3289","o3289","10.1107/S160053680702987X","","","0.71073","MoKα","","0.0511","0.0447","","","0.125","0.1308","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214056","10.0998","0.0017","11.465","0.002","16.514","0.003","90","","91.242","0.007","90","","1911.8","0.6","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetra-μ-acetato-κ^8^O:O'-bis[(2-amino-1,3-benzothiazole-κN)copper(II)] butanol disolvate","","- C30 H44 Cu2 N4 O10 S2 -","- C30 H44 Cu2 N4 O10 S2 -","- C60 H88 Cu4 N8 O20 S4 -","2","0.5","BI2187","Yi-Feng Sun; Jing-Rong Lu; Ze-Bao Zheng","Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis[(2-amino-1,3-benzothiazole-κ<i>N</i>)copper(II)] butanol disolvate","Acta Crystallographica Section E","2007","63","7","m1881","m1881","10.1107/S1600536807027948","","","0.71073","MoKα","","0.0889","0.0838","","","0.2465","0.2491","","","","","","1.149","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214057","7.9544","0.0018","8.332","0.0019","11.063","0.003","77.913","0.003","73.384","0.004","77.641","0.004","677.7","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","9-(4-Methoxybenzoyl)-1,2,3,4-tetrahydro-6H-pyrido[1,2-a]pyrimidin-6-one","","- C16 H16 N2 O3 -","- C16 H16 N2 O3 -","- C32 H32 N4 O6 -","2","1","BI2189","Chu-Yi Yu; Xue-Ning Yuan; Zhi-Tang Huang","9-(4-Methoxybenzoyl)-1,2,3,4-tetrahydro-6<i>H</i>-pyrido[1,2-<i>a</i>]pyrimidin-6-one","Acta Crystallographica Section E","2007","63","7","o3186","o3186","10.1107/S1600536807027985","","","0.71073","MoKα","","0.0519","0.0378","","","0.099","0.1105","","","","","","1.004","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214058","7.042","0.004","8.664","0.005","13.988","0.008","106.729","0.007","95.394","0.007","99.568","0.008","796.8","0.8","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","(<i>Z</i>)-1,5-Dimethyl-4-[(5-methylthien-2-yl)methyleneamino]-2-phenyl- 1<i>H</i>-pyrazol-3(2<i>H</i>)-one","","- C17 H17 N3 O S -","- C17 H17 N3 O S -","- C34 H34 N6 O2 S2 -","2","1","BI2191","Wang, Liang-Gui; Zheng, Yun-Fa; Yan, Guo-Bing","(<i>Z</i>)-1,5-Dimethyl-4-[(5-methylthien-2-yl)methyleneamino]-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","7","o3178","o3178","10.1107/S1600536807027997","","","0.71073","MoKα","","0.0671","0.0503","","","0.0962","0.102","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214059","8.447","0.002","10.181","0.002","13.504","0.002","90","","120.901","0.003","90","","996.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[(1,2,5,6-η^4^)-1,3,5,7-Cyclooctatetraene]iodo(methyl)platinum(II)","","- C9 H11 I Pt -","- C9 H11 I Pt -","- C36 H44 I4 Pt4 -","4","1","BI2192","Song, Ah-Ran; Hwang, In-Chul; Ha, Kwang","[(1,2,5,6-η)-1,3,5,7-Cyclooctatetraene]iodido(methyl)platinum(II)","Acta Crystallographica Section E","2007","63","7","m1879","m1879","10.1107/S1600536807028012","","","0.71073","MoKα","","0.0387","0.0347","","","0.0929","0.0949","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214060","14.005","0.003","14.045","0.003","21.896","0.004","96.386","0.003","99.094","0.003","118.217","0.003","3660.8","1.3","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","(13,27-Dimethyl-3,6,9,17,20,23-hexaazatricyclo[23.3.1.1^11,15^]triaconta- 1(29),2,9,11,13,15(30),16,23,25,27-decaene-29,30-diol- κ^5^N^3^,N^6^,N^9^,O^29^,O^30^)bis(nitrato-κ^2^O,<i>O</i>')dysprosium(III) nitrate monohydrate","","- C26 H36 Dy N9 O12 -","- C26 H36 Dy N9 O12 -","- C104 H144 Dy4 N36 O48 -","4","2","BI2193","Sun, Wen-Bing","[13,27-Dimethyl-3,6,9,17,20,23-hexaazatricyclo[23.3.1.1^11,15^]triaconta-1(29),2,9,11,13,15(30),16,23,25,27-decaene-29,30-diol-κ^5^<i>N</i>^3^,<i>N</i>^6^,<i>N</i>^9^,<i>O</i>^29^,<i>O</i>^30^]bis(nitrato-κ^2^<i>O</i>,<i>O</i>')dysprosium(III) nitrate monohydrate","Acta Crystallographica Section E","2007","63","7","m1910","m1910","10.1107/S160053680702795X","","","0.71073","MoKα","","0.0728","0.0514","","","0.1095","0.1149","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214061","8.0121","0.001","9.5327","0.001","15.023","0.002","90","","90","","90","","1147.4","0.2","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[aqua(pyrazine-2-carboxylato)cobalt(II)]-μ-pyrazine-2-carboxylato]","","- C10 H8 Co N4 O5 -","- C10 H8 Co N4 O5 -","- C40 H32 Co4 N16 O20 -","4","1","BI2194","Gao, Yu-Xiang; Wang, Li-Bin; Niu, Yan-Ling; Hao, Lu-Jiang","<i>catena</i>-Poly[[aqua(pyrazine-2-carboxylato)cobalt(II)]-μ-pyrazine-2-carboxylato]","Acta Crystallographica Section E","2007","63","7","m1882","m1882","10.1107/S1600536807027961","","","0.71073","MoKα","","0.0275","0.024","","","0.0528","0.0547","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214062","8.2363","0.0016","12.834","0.003","12.955","0.003","90","","92.78","0.03","90","","1367.8","0.5","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","<i>N</i>'-(2-Nitrobenzoyl)benzohydrazide","","- C14 H11 N3 O4 -","- C14 H11 N3 O4 -","- C56 H44 N12 O16 -","4","1","BI2195","Yang, Sen-Lin; Luo, Zhi-Gang","<i>N</i>'-(2-Nitrobenzoyl)benzohydrazide","Acta Crystallographica Section E","2007","63","7","o3208","o3208","10.1107/S1600536807028024","","","0.71073","MoKα","","0.0862","0.042","","","0.1103","0.1242","","","","","","0.95","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214063","18.201","0.001","6.9","0.001","25.01","0.001","90","","99.4","0.03","90","","3098.8","0.6","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","Tetraaquabis(4,4'-bipyridine)iron(II) pyridine-2,6-dicarboxylate tetrahydrate","","- C27 H35 Fe N5 O12 -","- C27 H35 Fe N5 O12 -","- C108 H140 Fe4 N20 O48 -","4","1","BI2196","Gao, Yu-Xiang; Wang, Li-Bin; Niu, Yan-Ling","Tetraaquabis(4,4'-bipyridine)iron(II) pyridine-2,6-dicarboxylate tetrahydrate","Acta Crystallographica Section E","2007","63","7","m1845","m1846","10.1107/S1600536807027973","","","0.71073","MoKα","","0.0414","0.0367","","","0.1003","0.1052","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214064","14.1267","0.0003","11.2787","0.0002","13.0162","0.0002","90","","101.728","0.001","90","","2030.59","0.06","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[diaqua(6-carboxypyridine-2-carboxylato- κ^3^<i>O</i>,<i>N</i>,<i>O</i>')gadolinium(III)]-μ-pyridine- 2,6-dicarboxylato-κ^4^<i>N</i>,<i>O</i>,<i>O</i>':<i>O</i>''] tetrahydrate]","","- C14 H19 Gd N2 O14 -","- C14 H19 Gd N2 O14 -","- C56 H76 Gd4 N8 O56 -","4","1","BI2197","Hao, Lu-Jiang; Yu, Tong-Li","<i>catena</i>-Poly[[[diaqua(6-carboxypyridine-2-carboxylato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')gadolinium(III)]-μ-pyridine-2,6-dicarboxylato-κ^4^<i>N</i>,<i>O</i>,<i>O</i>':<i>O</i>''] tetrahydrate]","Acta Crystallographica Section E","2007","63","7","m1967","m1967","10.1107/S1600536807029789","","","0.71073","MoKα","","0.0403","0.0371","","","0.1294","0.1339","","","","","","0.999","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214065","10.732","0.002","27.497","0.003","9.789","0.002","90","","94.033","0.003","90","","2881.6","0.9","295","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dibenzylbis(naphthalene-2-thiolato-κS)tin(IV)","","- C34 H28 S2 Sn -","- C34 H28 S2 Sn -","- C136 H112 S8 Sn4 -","4","1","BQ2013","Tahir, M. Nawaz; Muhammad Danish; Saqib Ali; Ülkü, Dinçer; Muhammad Mazhar","Dibenzylbis(naphthalene-2-thiolato-κ<i>S</i>)tin(IV)","Acta Crystallographica Section E","2007","63","7","m1799","m1799","10.1107/S1600536807025378","","","0.71073","MoKα","","0.1114","0.0437","","","","0.0825","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","198601","2020-10-21","18:00:00",""
"2214067","9.1267","0.0003","8.2114","0.0003","17.2304","0.0009","90","","91.151","0.004","90","","1291.04","0.09","203","2","203","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","substituted-carbazole","Methyl 9-methyl-1-oxo-2,3,4,9-tetrahydro-1H-carbazole-2-carboxylate","","- C15 H15 N O3 -","- C15 H15 N O3 -","- C60 H60 N4 O12 -","4","1","BQ2018","A. Thiruvalluvar; A. Thomas Gunaseelan; A. Ebenezer Martin; K. J. Rajendra Prasad; R.J. Butcher","Methyl 9-methyl-1-oxo-2,3,4,9-tetrahydro-1<i>H</i>-carbazole-2-carboxylate","Acta Crystallographica Section E","2007","63","7","o3093","o3093","10.1107/S160053680702644X","","","0.71073","MoKα","","0.0917","0.0669","","","0.1657","0.1772","","","","","","1.138","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214068","14.881","0.012","6.878","0.006","22.409","0.019","90","","90.049","0.015","90","","2294","3","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Triaqua(4-hydroxypyridine-2,6-dicarboxylato)nickel(II) sesquihydrate","","- C7 H12 N Ni O9.5 -","- C7 H12 N Ni O9.5 -","- C56 H96 N8 Ni8 O76 -","8","1","BQ2021","Aghabozorg, Hossein; Ghadermazi, Mohammad; Soleimannejad, Janet; Sheshmani, Shabnam","Triaqua(4-hydroxypyridine-2,6-dicarboxylato)nickel(II) sesquihydrate","Acta Crystallographica Section E","2007","63","7","m1917","m1918","10.1107/S1600536807028115","","","0.71073","MoKα","","0.069","0.0568","","","0.1517","0.1611","","","","","","1.055","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214069","7.81","0.002","8.611","0.002","17.431","0.004","90","","90","","90","","1172.3","0.5","100","","100","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3,5-Diacetylheptane-2,6-dione","","- C11 H16 O4 -","- C11 H16 O4 -","- C44 H64 O16 -","4","1","BQ2022","Burton, Sylvester; Fronczek, Frank R.; Maverick, Andrew W.","3,5-Diacetylheptane-2,6-dione","Acta Crystallographica Section E","2007","63","7","o3108","o3108","10.1107/S1600536807026323","","","0.71073","MoKα","","0.048","0.041","","","0.107","0.113","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214070","7.6265","0.0007","6.1724","0.0006","26.559","0.003","90","","95.571","0.002","90","","1244.3","0.2","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Benzaldehyde O-[(E)-(6-chloropyridin-3-yl)methyl]oxime","","- C13 H11 Cl N2 O -","- C13 H11 Cl N2 O -","- C52 H44 Cl4 N8 O4 -","4","1","BQ2025","Liu Meng; De-Qing Shi","Benzaldehyde <i>O</i>-[(<i>E</i>)-(6-chloropyridin-3-yl)methyl]oxime","Acta Crystallographica Section E","2007","63","7","o3311","o3311","10.1107/S1600536807030127","","","0.71073","MoKα","","0.0875","0.0687","","","0.1624","0.1725","","","","","","1.076","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214071","12.2985","0.0008","6.6003","0.0006","8.7957","0.0006","90","","90","","90","","713.98","0.09","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Thallium strontium tetrathiophosphate","","- P S4 Sr Tl -","- P S4 Sr Tl -","- P4 S16 Sr4 Tl4 -","4","0.5","BR2039","Belkyal, Imane; El Azhari, Mohamed; Näther, Christian; Bensch, Wolfgang; Depmeier, Wulf","TlSrPS~4~, the first strontium quaternary thiophosphate","Acta Crystallographica Section E","2007","63","7","i166","i166","10.1107/S1600536807025445","","","0.71073","MoKα","","0.0443","0.0334","","","0.0794","0.0838","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214072","9.992","0.0007","10.0882","0.0007","11.1708","0.0008","78.38","0.008","76.815","0.009","65.419","0.005","989.75","0.13","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","poly[μ~2~-2,3,5,6-tetra-2-pyridyl-1,4-dihydropyrazine-μ- hexacosaoxidooctamolybdato-dicopper(II)]","","- C12 H8 Cu Mo4 N3 O13 -","- C12 H8 Cu Mo4 N3 O13 -","- C24 H16 Cu2 Mo8 N6 O26 -","2","1","BR2040","Zubieta, Jon; Armatas, N. Gabriel","A two-dimensional copper(II) molybdate, [{Cu~2~(tpyprz)}Mo~8~O~26~] (tpyprz is 2,3,5,6-tetra-2-pyridyl-1,4-dihydropyrazine)","Acta Crystallographica Section E","2007","63","7","m1924","m1924","10.1107/S1600536807027390","","","0.71073","MoKα","","0.0324","0.0273","","","0.0595","0.0621","","","","","","0.936","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214073","6.1455","0.0018","9.764","0.002","8.857","0.002","90","","99.542","0.002","90","","524.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[chlorido-μ~3~-1,2,4-triazolato-nickel(II)]","","- C2 H2 Cl N3 Ni -","- C2 H2 Cl N3 Ni -","- C8 H8 Cl4 N12 Ni4 -","4","1","BR2041","Gao, Yu-Xiang; Wang, Li-Bin; Hao, Xiang-Rong","Poly[chlorido-μ~3~-1,2,4-triazolato-nickel(II)]","Acta Crystallographica Section E","2007","63","7","m1800","m1800","10.1107/S1600536807025962","","","0.71073","MoKα","","0.0251","0.0216","","","0.0623","0.065","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214074","28.262","0.006","5.935","0.001","15.434","0.003","90","","122.21","0.03","90","","2190.4","1","583","2","583","2","","","","","","","","3","C 1 2 1","C 2y","5","","strontium tellurite","","- O3 Sr Te -","- O3 Sr Te -","- O72 Sr24 Te24 -","24","6","BR2042","Zavodnik, Valery E.; Ivanov, Sergey A.; Stash, Adam I.","The γ-phase of SrTeO~3~ at 583K","Acta Crystallographica Section E","2007","63","7","i151","i151","10.1107/S1600536807026098","","","0.56086","AgKα","","0.112","0.0423","","","0.0957","0.1029","","","","","","0.935","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214075","5.0501","0.0009","15.37","0.003","7.0704","0.0013","90","","106.6","0.02","90","","525.93","0.18","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(pyrazine-2-caboxylato-κ^2^N^1^,O)nickel(II)","","- C10 H6 N4 Ni O4 -","- C10 H6 N4 Ni O4 -","- C20 H12 N8 Ni2 O8 -","2","0.5","BR2043","Gao, Yu-Xiang; Wang, Li-Bin; Hao, Xiang-Rong","Bis(pyrazine-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)nickel(II)","Acta Crystallographica Section E","2007","63","7","m1805","m1805","10.1107/S1600536807026268","","","0.71073","MoKα","","0.0414","0.0275","","","0.0507","0.0557","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214076","12.326","0.003","15.089","0.003","16.747","0.003","96.1","0.03","98.01","0.03","101","0.03","2999.3","1.2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","catena-poly[heptakis(N,N'-dimethylacetamide-κO)(methanol-κO)cerium(III) [di-μ~3~-sulfido-octa-μ~2~-sulfido-disulfidotrisilver(I)trimolybdenum(IV)]]","","- C29 H67 Ag3 Ce Mo3 N7 O8 S12 -","- C29 H66 Ag3 Ce Mo3 N7 O8 S12 -","- C58 H132 Ag6 Ce2 Mo6 N14 O16 S24 -","2","1","BR2044","Cao, Yuan; Zhang, Jin-Fang; Zhang, Chi","A new configuration of the one-dimensional anionic Mo/S/Ag polymer, {[Ce(dmac)~7~MeOH][Mo~3~S~12~Ag~3~]}~<i>n~</i> (dmac is <i>N</i>,<i>N</i>-dimethylacetamide)","Acta Crystallographica Section E","2007","63","7","m1987","m1988","10.1107/S1600536807027389","","","0.71073","MoKα","","0.073","0.054","","","0.1266","0.1421","","","","","","1.003","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214077","10.0007","0.0012","14.7062","0.0018","13.5338","0.0017","90","","98.285","0.002","90","","1969.7","0.4","120","2","120","2","","","","","","","","6","P 1 21 1","P 2yb","4","","<i>catena</i>-Poly[[[bis(cyclohexyldiphenylphosphine-κP)silver(I)]-μ-cyano- κ^2^N:C-silver(I)-μ-cyano-κ^2^C:N] dichloromethane solvate]","","- C39 H44 Ag2 Cl2 N2 P2 -","- C39 H44 Ag2 Cl2 N2 P2 -","- C78 H88 Ag4 Cl4 N4 P4 -","2","1","BR2046","Xie, Xiaocong; Saparov, Bayrammurad; Yap, Glenn P. A.","<i>catena</i>-Poly[[[bis(cyclohexyldiphenylphosphine-κ<i>P</i>)silver(I)]-μ-cyano-κ^2^<i>N</i>:<i>C</i>-silver(I)-μ-cyano-κ^2^<i>C</i>:<i>N</i>] dichloromethane solvate]","Acta Crystallographica Section E","2007","63","7","m1902","m1903","10.1107/S1600536807028607","","","0.71073","MoKα","","0.0263","0.025","","","0.057","0.0581","","","","","","1.069","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2214078","27.805","0.004","13.3327","0.0017","17.598","0.004","90","","93.474","0.013","90","","6511.9","1.9","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Di-μ-iodido-bis[bis(cyclohexyldiphenylphosphine-κP)silver(I)]","","- C72 H84 Ag2 I2 P4 -","- C72 H84 Ag2 I2 P4 -","- C288 H336 Ag8 I8 P16 -","4","0.5","BR2047","Young, John F.; Yap, Glenn P. A.","Di-μ-iodido-bis[bis(cyclohexyldiphenylphosphine-κ<i>P</i>)silver(I)]","Acta Crystallographica Section E","2007","63","7","m1943","m1943","10.1107/S1600536807029042","","","0.71073","MoKα","","0.0571","0.0394","","","0.0814","0.0898","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214079","7.1474","0.0005","9.214","0.0006","7.765","0.0005","90","","112.884","0.001","90","","471.12","0.05","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","α-D-glucosamine hydrochloride","","- C6 H14 Cl N O5 -","- C6 H14 Cl N O5 -","- C12 H28 Cl2 N2 O10 -","2","1","BT2375","Harrison, William T. A.; Yathirajan, H. S.; Narayana, B.; Sreevidya, T. V.; Sarojini, B. K.","Redetermination of α-<small>D</small>-glucosamine hydrochloride: elucidation of the hydrogen-bonding scheme","Acta Crystallographica Section E","2007","63","7","o3248","o3248","10.1107/S1600536807024506","","","0.71073","MoKα","","0.0299","0.0286","","","0.074","0.0748","","","","","","1.068","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214080","12.11","0.003","12.695","0.003","13.001","0.003","108.59","0.02","92.84","0.02","108.68","0.02","1768.9","0.8","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","Bis(acetonitrile-κ<i>N</i>)hexakis(μ~2~-4-amino-3,5-dimethyl-1,2,4-\ triazole-κ^2^<i>N</i>^1^:<i>N</i>^2^)tetrasilver(I) tetrakis(trifluoromethanesulfonate) acetonitrile disolvate","","- C36 H60 Ag4 F12 N28 O12 S4 -","- C36 H60 Ag4 F12 N28 O12 S4 -","- C36 H60 Ag4 F12 N28 O12 S4 -","1","0.5","BT2378","Wang, Ying-Li; Yang, Guang; Ng, Seik Weng","Bis(acetonitrile-κ<i>N</i>)hexakis(μ~2~-4-amino-3,5-dimethyl-1,2,4-triazole-κ^2^<i>N</i>^1^:<i>N</i>^2^)tetrasilver(I) tetrakis(trifluoromethanesulfonate) acetonitrile disolvate","Acta Crystallographica Section E","2007","63","7","m1801","m1801","10.1107/S1600536807026360","","","0.71073","MoKα","","0.097","0.074","","","0.217","0.239","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214081","9.0767","0.0018","22.897","0.004","7.2953","0.0014","90","","96.448","0.003","90","","1506.6","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[{2,4-dichloro-6-[2- (ethylamino)ethyliminomethyl]phenolato}copper(II)]-μ-azido]","","- C11 H13 Cl2 Cu N5 O -","- C11 H13 Cl2 Cu N5 O -","- C44 H52 Cl8 Cu4 N20 O4 -","4","1","BT2379","Yun-Peng Diao; Xiao-Hong Shu; Bao-Jing Zhang; Yu-Hong Zhen; Ting-Guo Kang","<i>catena</i>-Poly[[{2,4-dichloro-6-[2-(ethylamino)ethyliminomethyl]phenolato}copper(II)]-μ-azido]","Acta Crystallographica Section E","2007","63","7","m1816","m1816","10.1107/S1600536807026591","","","0.71073","MoKα","","0.0547","0.0381","","","0.0823","0.0893","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214082","12.0733","0.0008","12.0733","0.0008","14.9611","0.0015","90","","90","","90","","2180.8","0.3","133","2","133","2","","","","","","","","4","I -4","I -4","82","","tetra-μ~3~-chlorido-[tetrakis(η^5^-pentamethylcyclopentadienyl)ruthenium(II)]","","- C40 H60 Cl4 Ru4 -","- C40 H60 Cl4 Ru4 -","- C80 H120 Cl8 Ru8 -","2","0.25","BT2380","Jones, Peter G.; Hrib, Cristian G.; Beer, Stephan; Tamm, Matthias","A tetragonal polymorph of tetra-μ~3~-chlorido-tetrakis[(η^5^-pentamethylcyclopentadienyl)ruthenium(II)]","Acta Crystallographica Section E","2007","63","7","m1785","m1785","10.1107/S160053680702627X","","","0.71073","MoKα","","0.0289","0.0236","","","0.0477","0.0494","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214083","7.1025","0.0012","9.984","0.0016","15.552","0.003","100.521","0.002","99.211","0.002","110.47","0.002","985.3","0.3","296","2","296","2","","","","","","","","4","P 1","P 1","1","","3β-Acetoxy-5α-chloro-6β-hydroxyandrostan-17-one","","- C21 H31 Cl O4 -","- C21 H31 Cl O4 -","- C42 H62 Cl2 O8 -","2","2","BT2381","Chun-Nian Xia; Bi-Wen Li; Wei-xiao Hu; Wei Zhou","3β-Acetoxy-5α-chloro-6β-hydroxyandrostan-17-one","Acta Crystallographica Section E","2007","63","7","o3107","o3107","10.1107/S1600536807026803","","","0.71073","MoKα","","0.0381","0.0325","","","0.0811","0.0903","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214084","8.7954","0.0001","8.7954","0.0001","30.0676","0.001","90","","90","","90","","2326","0.09","120","","120","","","","","","","","","3","P 41","P 4w","76","15-crown-5","1,4,7,10,13-pentaoxacylopentadecane","","- C10 H20 O5 -","- C10 H20 O5 -","- C80 H160 O40 -","8","2","BT2383","Simon Parsons","15-Crown-5","Acta Crystallographica Section E","2007","63","7","o3130","o3130","10.1107/S1600536807026190","","","0.71073","MoKα","","0.0553","0.0428","","0.0843","0.0802","0.0843","","","","","","0.95","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214085","13.0715","0.0012","5.8535","0.0006","26.377","0.006","90","","90.339","0.002","90","","2018.2","0.5","295","2","295","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","(2E,2'E)-3,3'-(1,4-Phenylene)bis[1-(4-methoxyphenyl)prop-2-en-1-one]","","- C26 H22 O4 -","- C26 H22 O4 -","- C104 H88 O16 -","4","0.5","BT2384","Harrison, William T. A.; H. J. Ravindra; M. R. Suresh Kumar; S. M. Dharmaprakash","(2<i>E</i>,2'<i>E</i>)-3,3'-(1,4-Phenylene)bis[1-(4-methoxyphenyl)prop-2-en-1-one]","Acta Crystallographica Section E","2007","63","7","o3067","o3067","10.1107/S1600536807026293","","","0.71073","MoKα","","0.0686","0.0503","","","0.1367","0.1498","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214086","5.987","0.002","7.723","0.003","8.716","0.003","71.59","0.03","79.73","0.03","78.25","0.03","371.5","0.2","143","2","143","2","","","","","","","","7","P -1","-P 1","2","","Dichloro(dimethylsulfoximino)phosphane","","- C2 H6 Cl2 N O P S -","- C2 H6 Cl2 N O P S -","- C4 H12 Cl4 N2 O2 P2 S2 -","2","1","BT2385","Steffen Blaurock; Scholz, Mario; Roesky, Herbert W.; Edelmann, Frank T.","Dichloro(dimethylsulfoximino)phosphane","Acta Crystallographica Section E","2007","63","7","o3247","o3247","10.1107/S1600536807028930","","","0.71073","MoKα","","0.0292","0.0248","","","0.0627","0.066","","","","","","1.108","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214087","8.3707","0.0006","11.4278","0.0007","13.2044","0.001","108.957","0.002","100.674","0.002","91.447","0.002","1168.97","0.14","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","Isoquinoline-1-carboxylic acid","","- C10 H7 N O2 -","- C10 H7 N O2 -","- C60 H42 N6 O12 -","6","3","BT2386","Lin-Hai Jing; Yi Feng; Da-Bin Qin; Shao-Jin Gu; Huan-Xia Zhang","Isoquinoline-1-carboxylic acid","Acta Crystallographica Section E","2007","63","7","o3104","o3104","10.1107/S160053680702658X","","","0.71073","MoKα","","0.06","0.05","","","0.1295","0.1345","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214088","9.218","0.006","10.664","0.007","10.807","0.007","116.807","0.008","96.31","0.009","104.703","0.009","885.6","1","294","2","273","2","","","","","","","","3","P -1","-P 1","2","Hexabromocyclododecane","(1R,2S,5R,6S,9S,10R)-Hexabromocyclododecane","","- C12 H18 Br6 -","- C12 H18 Br6 -","- C24 H36 Br12 -","2","1","BT2387","Köppen, Robert; Emmerling, Franziska; Kohl, Anka; Becker, Roland","δ-Hexabromocyclododecane","Acta Crystallographica Section E","2007","63","7","o3105","o3105","10.1107/S1600536807026396","","","0.71073","MoKα","","0.1384","0.0448","","","0.0878","0.1072","","","","","","0.87","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214089","18.7133","0.0015","8.38","0.0008","9.2123","0.0007","90","","90.134","0.007","90","","1444.6","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tert-Butyl 3a-chloroperhydro-2,6a-epoxyoxireno[e]isoindole-5-carboxylate","","- C13 H18 Cl N O4 -","- C13 H18 Cl N O4 -","- C52 H72 Cl4 N4 O16 -","4","1","BT2388","Koşar, Başak; Karaarslan, Muhsin; Demir, Ibrahim; Büyükgüngör, Orhan","<i>tert</i>-Butyl 3a-chloroperhydro-2,6a-epoxyoxireno[<i>e</i>]isoindole-5-carboxylate","Acta Crystallographica Section E","2007","63","7","o3323","o3323","10.1107/S1600536807030346","","","0.71073","MoKα","","0.0971","0.0429","","","0.0934","0.1123","","","","","","0.883","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214090","29.1818","0.0008","5.8972","0.0002","17.8356","0.0006","90","","123.485","0.003","90","","2559.93","0.17","100","0.1","100","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(E)-4,4,4-Trifluoro-2,3-diphenylbut-2-enal","","- C16 H11 F3 O -","- C16 H11 F3 O -","- C128 H88 F24 O8 -","8","1","BT2389","Hoong-Kun Fun; Shea-Lin Ng; Zhe Li; Jian-Hua Xu","(<i>E</i>)-4,4,4-Trifluoro-2,3-diphenylbut-2-enal","Acta Crystallographica Section E","2007","63","7","o3255","o3255","10.1107/S1600536807028966","","","0.71073","MoKα","","0.0932","0.0743","","","0.1835","0.1988","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214091","7.765","0.002","16.858","0.005","12.031","0.003","90","","105.799","0.005","90","","1515.4","0.7","295","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Trichlorido{1-[2-(methylsulfanyl)phenyldiazenyl]phenyl-\ κ^3^<i>C</i>,<i>N</i>,<i>S</i>}platinum(IV)","","- C13 H11 Cl3 N2 Pt S -","- C13 H11 Cl3 N2 Pt S -","- C52 H44 Cl12 N8 Pt4 S4 -","4","1","BT2390","Bagchi, Vivek; Das, Purak; Bandyopadhyay, Debkumar","Trichlorido{1-[2-(methylsulfanyl)phenyldiazenyl]phenyl-κ^3^<i>C</i>,<i>N</i>,<i>S</i>}platinum(IV)","Acta Crystallographica Section E","2007","63","7","m1940","m1940","10.1107/S160053680702898X","","","0.71073","MoKα","","0.069","0.0608","","","0.1126","0.1161","","","","","","1.247","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214092","4.7468","0.0004","11.699","0.001","14.64","0.002","90","","95.74","0.02","90","","808.92","0.15","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","2-Chloroacetanilide","<i>N</i>-(2-Chlorophenyl)acetamide","","- C8 H8 Cl N O -","- C8 H8 Cl N O -","- C32 H32 Cl4 N4 O4 -","4","1","BT2391","B. Thimme Gowda; Ingrid Svoboda; Hartmut Fuess","<i>N</i>-(2-Chlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","7","o3267","o3267","10.1107/S1600536807028991","","","0.71073","MoKα","","0.0537","0.0321","","","0.0732","0.0807","","","","","","1.074","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214093","8.8127","0.0018","14.991","0.003","10.627","0.002","90","","90.738","0.003","90","","1403.8","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(3,3'-Diamino-2,2'-bipyridine-κ^2^N,N')bis(thiocyanato-κN)copper(II)","","- C12 H10 Cu N6 S2 -","- C12 H10 Cu N6 S2 -","- C48 H40 Cu4 N24 S8 -","4","0.5","BT2392","Zhang, Shi-Guo; Chen, Ju-Na; Shi, Jing-Min","(3,3'-Diamino-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(thiocyanato-κ<i>N</i>)copper(II)","Acta Crystallographica Section E","2007","63","7","m1945","m1945","10.1107/S1600536807029030","","","0.71073","MoKα","","0.0375","0.0331","","","0.0866","0.0883","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214094","11.126","0.0007","17.6054","0.001","20.2297","0.0012","108.302","0.001","90.751","0.001","95.536","0.001","3740.6","0.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","Dioxopromethazinium picrate","[1-(9,9-dioxo-10H-phenothiazin-10-yl)-2-propyl]dimethylammonium 2,4,6-trinitrophenolate","","- C23 H23 N5 O9 S -","- C23 H23 N5 O9 S -","- C138 H138 N30 O54 S6 -","6","3","BT2393","Harrison, William T. A.; Ashok, M. A.; Yathirajan, H. S.; Narayana Achar, B.","Dioxopromethazinium picrate","Acta Crystallographica Section E","2007","63","7","o3277","o3277","10.1107/S1600536807029194","","","0.71073","MoKα","","0.111","0.0539","","","0.1316","0.1539","","","","","","0.928","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214095","9.085","0.003","9.799","0.003","9.809","0.004","70.333","0.004","76.301","0.002","87.991","0.005","798","0.5","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzenesulfonamide","","- C17 H17 N3 O3 S -","- C17 H17 N3 O3 S -","- C34 H34 N6 O6 S2 -","2","1","BT2397","Zheng, Yun-Fa; Zhang, Chun-Niu; Yang, Ming-Hua","<i>N</i>-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","7","o3293","o3293","10.1107/S1600536807029881","","","0.71073","MoKα","","0.0581","0.0541","","","0.1375","0.1399","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214096","3.7885","0.0012","13.939","0.004","15.191","0.005","90","","90","","90","","802.2","0.4","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-(Pyrazin-2-yl)pyridin-2(1H)-one","","- C9 H7 N3 O -","- C9 H7 N3 O -","- C36 H28 N12 O4 -","4","1","BT2398","Zhang, Shi-Guo; Xu, Hai-Yan; Shi, Jing-Min","1-(Pyrazin-2-yl)pyridin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","7","o3294","o3294","10.1107/S1600536807029996","","","0.71073","MoKα","","0.0625","0.0464","","","0.1025","0.1085","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214097","8.66","0.003","9.423","0.003","13.973","0.002","90","","104","0.02","90","","1106.4","0.6","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","5α-Acetamido-6β-hydroxy-17-oxoandrostan-3β-yl acetate","","- C23 H35 N O5 -","- C23 H35 N O5 -","- C46 H70 N2 O10 -","2","1","BT2399","Pinto, R. M. A.; Ramos Silva, M.; Matos Beja, A.; Salvador, J. A. R.; Paixão, J. A.","5α-Acetamido-6β-hydroxy-17-oxoandrostan-3β-yl acetate","Acta Crystallographica Section E","2007","63","7","o3321","o3321","10.1107/S1600536807029893","","","0.71073","MoKα","","0.0462","0.0344","","","0.092","0.0977","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214098","5.315","0.003","14.275","0.004","15.106","0.003","72.828","0.003","88.344","0.004","83.314","0.004","1087.6","0.7","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","Bis{4-[(5-methylthien-2-yl)methyleneamino]phenyl} sulfide","","- C24 H20 N2 S3 -","- C24 H20 N2 S3 -","- C48 H40 N4 S6 -","2","1","BT2400","Zheng, Yun-Fa; Wang, Liang-Gui; Zhang, Chun-Niu","Bis{4-[(5-methylthien-2-yl)methyleneamino]phenyl} sulfide","Acta Crystallographica Section E","2007","63","7","o3307","o3307","10.1107/S1600536807029984","","","0.71073","MoKα","","0.079","0.0646","","","0.1281","0.1341","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214099","8.0552","0.0005","11.773","0.001","9.7286","0.0005","90","","102.547","0.006","90","","900.57","0.11","302","2","302","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(2,4-Dichlorophenyl)acetamide","","- C8 H7 Cl2 N O -","- C8 H7 Cl2 N O -","- C32 H28 Cl8 N4 O4 -","4","1","BT2403","B. Thimme Gowda; Ingrid Svoboda; Hartmut Fuess","<i>N</i>-(2,4-Dichlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","7","o3308","o3308","10.1107/S1600536807030292","","","0.71073","MoKα","","0.05","0.0366","","","0.0931","0.105","","","","","","1.083","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214100","24.2968","0.0012","11.3273","0.0005","8.7396","0.0003","90","","90","","90","","2405.29","0.18","295","2","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","N-(2,3-Dichlorophenyl)benzamide","","- C13 H9 Cl2 N O -","- C13 H9 Cl2 N O -","- C104 H72 Cl16 N8 O8 -","8","1","BT2404","B. Thimme Gowda; B. P. Sowmya; Miroslav Tokarčík; Jozef Kožíšek; Hartmut Fuess","<i>N</i>-(2,3-Dichlorophenyl)benzamide","Acta Crystallographica Section E","2007","63","7","o3326","o3326","10.1107/S1600536807030243","","","0.71073","MoKα","","","0.0365","","","","0.0933","","","","","","0.905","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214101","10.799","0.001","15.33","0.001","16.173","0.001","70.004","0.008","89.8","0.007","81.487","0.007","2485.1","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>-(2,6-Dimethylphenyl)-2,2,2-trimethylacetamide","","- C13 H19 N O -","- C13 H19 N O -","- C104 H152 N8 O8 -","8","4","BT2405","B. Thimme Gowda; Ingrid Svoboda; Hartmut Fuess","<i>N</i>-(2,6-Dimethylphenyl)-2,2,2-trimethylacetamide","Acta Crystallographica Section E","2007","63","7","o3324","o3324","10.1107/S1600536807030395","","","0.71073","MoKα","","0.1696","0.0538","","","0.0884","0.119","","","","","","0.967","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214102","16.273","0.002","5.1208","0.0007","12.105","0.001","90","","97.84","0.01","90","","999.3","0.2","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Methanesulfon-3,5-dimethylanilide","<i>N</i>-(3,5-Dimethylphenyl)methanesulfonamide","","- C9 H13 N O2 S -","- C9 H13 N O2 S -","- C36 H52 N4 O8 S4 -","4","1","BT2408","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(3,5-Dimethylphenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","7","o3325","o3325","10.1107/S1600536807030437","","","1.5418","CuKα","","0.0659","0.0615","","","0.1664","0.1716","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214103","13.1933","0.0009","3.7913","0.0003","15.774","0.001","90","","111.546","0.008","90","","733.88","0.1","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2,4,6-Trichloroaniline","","- C6 H4 Cl3 N -","- C6 H4 Cl3 N -","- C24 H16 Cl12 N4 -","4","2","BT2410","B. Thimme Gowda; Ingrid Svoboda; Hartmut Fuess","2,4,6-Trichloroaniline","Acta Crystallographica Section E","2007","63","7","o3347","o3347","10.1107/S1600536807030929","","","0.71073","MoKα","","0.0281","0.0223","","","0.0494","0.0516","","","","","","1.057","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214104","21.0914","0.0003","10.4909","0.0002","14.2684","0.0002","90","","110.656","0.001","90","","2954.18","0.08","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","3-[(1,3-Benzodioxol-6-yl)methylene]-4-(pentan-3-ylidene)tetrahydrofuran- 2,5-dione","","- C17 H17 O5 -","- C17 H17 O5 -","- C136 H136 O40 -","8","1","BV2051","Dong, Wen-Liang; Zhang, Jin-Hua; Zheng, Liang-Wen; Wei, Fang; Zhao, Bao-Xiang","3-[(1,3-Benzodioxol-6-yl)methylene]-4-(pentan-3-ylidene)tetrahydrofuran-2,5-dione","Acta Crystallographica Section E","2007","63","7","o3066","o3066","10.1107/S1600536807025470","","","0.71073","MoKα","","0.0775","0.0493","","","0.1323","0.1497","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214105","13.4833","0.0005","9.5244","0.0003","17.3385","0.0005","90","","90","","90","","2226.62","0.13","173","2","173","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Diiodidobis(1,10-phenanthroline-κ^2^N,N')cadmium(II)","","- C24 H16 Cd I2 N4 -","- C24 H16 Cd I2 N4 -","- C96 H64 Cd4 I8 N16 -","4","0.5","BV2059","Ming-Lei Cao; Xin Fang; Hai-Yang Yu; Jun-Dong Wang","Diiodidobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)","Acta Crystallographica Section E","2007","63","7","m1951","m1951","10.1107/S1600536807029145","","","0.71069","MoKα","","0.0818","0.0455","","","0.1005","0.1436","","","","","","1.153","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214106","5.1575","0.0011","17.43","0.002","35.147","0.004","90","","90","","90","","3159.5","0.8","298","2","298","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Diaquabis[4-methyl-2-(4-methylphenylsulfonamido)pentanoato-κO]calcium(II)","","- C26 H40 Ca N2 O10 S2 -","- C26 H40 Ca N2 O10 S2 -","- C104 H160 Ca4 N8 O40 S8 -","4","1","BV2062","Tai, Xi-Shi; Yin, Jie; Hao, Ming-Yang","Diaquabis[4-methyl-2-(4-methylphenylsulfonamido)pentanoato-κ<i>O</i>]calcium(II)","Acta Crystallographica Section E","2007","63","7","m1935","m1935","10.1107/S1600536807029327","","","0.71073","MoKα","","0.0658","0.051","","","0.1053","0.1117","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214107","8.3998","0.0005","9.4733","0.0005","11.4989","0.0008","76.516","0.002","87.552","0.002","68.564","0.002","827.33","0.09","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 6-methyl-4-(2-phenyltriazol-4-yl)-2-thioxo-1,2,3,6- tetrahydropyrimidine-5-carboxylate","","- C16 H17 N5 O2 S -","- C16 H17 N5 O2 S -","- C32 H34 N10 O4 S2 -","2","1","BX2087","Fang Xie; He Huang; Gang Liu; Chen-Jiang Liu","Ethyl 6-methyl-4-(2-phenyltriazol-4-yl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","7","o3076","o3076","10.1107/S1600536807025639","","","0.71073","MoKα","","0.0459","0.0426","","","","0.1245","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214108","9.145","0.001","13.215","0.001","15.993","0.001","90","","90","","90","","1932.8","0.3","299","2","299","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","<i>N</i>-(2,6-Dimethylphenyl)acetamide","","- C10 H13 N O -","- C10 H13 N O -","- C80 H104 N8 O8 -","8","1","BX2089","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(2,6-Dimethylphenyl)acetamide","Acta Crystallographica Section E","2007","63","7","o3154","o3154","10.1107/S1600536807027031","","","1.5418","CuKα","","0.1036","0.0564","","","0.1569","0.182","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214109","11.339","0.002","9.2995","0.0019","19.395","0.004","90","","97.79","0.03","90","","2026.3","0.7","293","","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","μ-Oxalato-κ^4^O^1^,O^2^:O^1'^,O^2'^-bis{[N,N'-bis(pyridin-2- ylmethylene)propane-1,2-diamine-κ^4^- N,N',N'',N''']copper(II)} bis(perchlorate)","","- C32 H32 Cl2 Cu2 N8 O12 -","- C32 H32 Cl2 Cu2 N8 O12 -","- C64 H64 Cl4 Cu4 N16 O24 -","2","0.5","CF2095","Tian-Fu Liu","μ-Oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^-bis{[<i>N</i>,<i>N</i>'-bis(pyridin-2-ylmethylene)propane-1,2-diamine-κ^4^-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']copper(II)} bis(perchlorate)","Acta Crystallographica Section E","2007","63","7","m1856","m1858","10.1107/S1600536807022659","","","0.71073","MoKα","","0.1081","0.0557","","","0.1331","0.1467","","","","","","0.859","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214110","7.3762","0.001","9.4733","0.0012","20.754","0.003","87.502","0.002","87.584","0.002","67.711","0.002","1340.1","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Triethylaminium‒trimesate‒trimesic acid‒water (1/1/1/2)","","- C24 H31 N O14 -","- C24 H31 N O14 -","- C48 H62 N2 O28 -","2","1","CF2096","Chen, Jia-Min; Sun, Jing-Jia; Huang Wei-Wei; Lao Yan-Ni; Yang, Shi-Ping","Triethylaminium‒trimesate‒trimesic acid‒water (1/1/1/2)","Acta Crystallographica Section E","2007","63","7","o3053","o3053","10.1107/S1600536807025603","","","0.71073","MoKα","","0.0613","0.0452","","","0.1086","0.1166","","","","","","0.926","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214111","7.8705","0.0001","7.8705","0.0001","13.4367","0.0007","90","","90","","90","","832.33","0.05","100","2","100","2","","","","","","","","4","P -4 21 c","P -4 2n","114","","Poly[bis(μ~3~-dihydrogen malonato)calcium(II)]","","- C6 H6 Ca O8 -","- C6 H6 Ca O8 -","- C24 H24 Ca4 O32 -","4","0.5","CF2099","Aliouane, K.; Rahahlia, N.; Guehria-Laidoudi, A.; Dahaoui, S.; Lecomte, C.","Poly[bis(μ~3~-dihydrogen malonato)calcium(II)]","Acta Crystallographica Section E","2007","63","7","m1834","m1836","10.1107/S1600536807027092","","","0.71073","MoKα","","0.03","0.0284","","","0.0693","0.07","","","","","","1.108","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214112","8.5069","0.0013","10.4307","0.0016","16.101","0.003","90","","91.574","0.008","90","","1428.1","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[tris(1-pyrazolyl)methane-κ^3^N,N',N'']copper(II) dichloride methanol disolvate","","- C22 H28 Cl2 Cu N12 O2 -","- C22 H28 Cl2 Cu N12 O2 -","- C44 H56 Cl4 Cu2 N24 O4 -","2","0.5","CF2103","Silva, Telma F. S.; Martins, Luisa M. D. R.; Guedes da Silva, M. Fatima C.; Pombeiro, Armando J. L.","Bis[tris(1-pyrazolyl)methane-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']copper(II) dichloride methanol disolvate","Acta Crystallographica Section E","2007","63","7","m1979","m1979","10.1107/S1600536807024671","","","0.71069","MoKα","","0.0645","0.0403","","","0.0787","0.0853","","","","","","0.971","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214113","10.0514","0.0007","18.3008","0.0012","15.285","0.001","90","","105.726","0.001","90","","2706.4","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-2H-1,2,4-triazole-3-thione‒ triphenylphosphine oxide (1/1)","","- C28 H27 N4 O2 P S -","- C28 H27 N4 O2 P S -","- C112 H108 N16 O8 P4 S4 -","4","1","CF2105","Xi-An Chen; Xiao-Bo Huang; Hua-Yue Wu","4-Amino-5-(2-ethoxyphenyl)-2,4-dihydro-2<i>H</i>-1,2,4-triazole-3-thione‒triphenylphosphine oxide (1/1)","Acta Crystallographica Section E","2007","63","7","o3191","o3191","10.1107/S1600536807024774","","","0.71073","MoKα","","0.0603","0.0533","","","0.1299","0.1349","","","","","","1.081","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214114","8.5147","0.0007","9.3674","0.0007","13.7585","0.0011","103.109","0.001","100.81","0.001","105.155","0.001","995.42","0.14","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","N,N-Bis(5-bromo-2-thienylsulfonyl)-3-nitroaniline","","- C14 H8 Br2 N2 O6 S4 -","- C14 H8 Br2 N2 O6 S4 -","- C28 H16 Br4 N4 O12 S8 -","2","1","CF2106","Shao-Miao Lin; Mei Zheng; Jing Xiong","<i>N</i>,<i>N</i>-Bis(5-bromo-2-thienylsulfonyl)-3-nitroaniline","Acta Crystallographica Section E","2007","63","7","o3177","o3177","10.1107/S1600536807024683","","","0.71073","MoKα","","0.0436","0.0356","","","0.0901","0.0952","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214115","17.952","0.001","14.381","0.001","6.6707","0.0005","90","","90","","90","","1722.2","0.2","298","2","298","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","1,1'-(Ethane-1,2-diyl)dipyridinium dibromidodichloridomercurate(II)","","- C12 H14 Br2 Cl2 Hg N2 -","- C12 H14 Br2 Cl2 Hg N2 -","- C48 H56 Br8 Cl8 Hg4 N8 -","4","0.5","CI2386","Wang, Qing-Li; Yang, Chang-Chun; Niu, Yun-Yin; Liu, Xiu-Cun; Ng, Seik Weng","1,1'-(Ethane-1,2-diyl)dipyridinium dibromidodichloridomercurate(II)","Acta Crystallographica Section E","2007","63","7","m1892","m1892","10.1107/S1600536807027444","","","0.71073","MoKα","","0.041","0.034","","","0.098","0.102","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214116","8.297","0.002","15.431","0.004","15.563","0.004","90","","95.984","0.005","90","","1981.7","0.9","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,1'-(Propane-1,3-diyl)dipyridinium dibromidodiiodidomercurate(II)","","- C13 H16 Br2.25 Hg I1.75 N2 -","- C13 H16 Br2.25 Hg I1.75 N2 -","- C52 H64 Br9 Hg4 I7 N8 -","4","1","CI2387","Liu, Xiu-Cun; Wang, Min-Can; Niu, Yun-Yin; Zhao, Fu-Kai; Ng, Seik Weng","1,1'-(Propane-1,3-diyl)dipyridinium dibromidodiiodidomercurate(II)","Acta Crystallographica Section E","2007","63","7","m1893","m1893","10.1107/S1600536807027456","","","0.71073","MoKα","","0.056","0.039","","","0.092","0.1","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214117","15.9912","0.0008","8.7769","0.0005","14.3189","0.0009","90","","109.76","0.001","90","","1891.37","0.19","295","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,1'-(Butane-1,4-diyl)dipyridinium bromidotrichloridomercurate(II)","","- C14 H18 Br Cl3 Hg N2 -","- C14 H18 Br Cl3 Hg N2 -","- C56 H72 Br4 Cl12 Hg4 N8 -","4","1","CI2388","Niu, Yun-Yin; Liu, Xiu-Cun; Hou, Hong-Wei; Fan, Yao-Ting; Ng, Seik Weng","1,1'-(Butane-1,4-diyl)dipyridinium bromidotrichloridomercurate(II)","Acta Crystallographica Section E","2007","63","7","m1894","m1894","10.1107/S1600536807027468","","","0.71073","MoKα","","0.039","0.031","","","0.077","0.081","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214118","16.0181","0.0008","15.329","0.0007","17.255","0.0008","90","","90","","90","","4236.8","0.3","295","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","1,1'-(Butane-1,4-diyl)dipyridinium dibromidodiiodidomercurate(II)","","- C14 H18 Br2 Hg I2 N2 -","- C14 H18 Br2 Hg I2 N2 -","- C112 H144 Br16 Hg8 I16 N16 -","8","1","CI2389","Jia, Han-Dong; Li, Zhong-Jun; Niu, Yun-Yin; Liu, Xiu-Cun; Ng, Seik Weng","1,1'-(Butane-1,4-diyl)dipyridinium dibromidodiiodidomercurate(II)","Acta Crystallographica Section E","2007","63","7","m1895","m1895","10.1107/S160053680702747X","","","0.71073","MoKα","","0.058","0.035","","","0.082","0.091","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214119","14.2901","0.0009","9.4764","0.0006","16.151","0.001","90","","98.785","0.001","90","","2161.5","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,1'-(p-Phenylenedimethylene)dipyridinium trichloridoiodidomercurate(II)","","- C18 H18 Cl2.75 Hg I1.25 N2 -","- C18 H18 Cl2.75 Hg I1.2501 N2 -","- C72 H72 Cl11 Hg4 I5.0004 N8 -","4","1","CI2390","He, Zhan-Hang; Tang, Ming-Sheng; Niu, Yun-Yin; Lv, Xiao-Rui; Ng, Seik Weng","1,1'-(<i>p</i>-Phenylenedimethylene)dipyridinium trichloridoiodidomercurate(II)","Acta Crystallographica Section E","2007","63","7","m1896","m1896","10.1107/S1600536807027481","","","0.71073","MoKα","","0.055","0.042","","","0.106","0.113","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214120","13.452","0.004","6.393","0.0018","23.466","0.007","90","","90.571","0.005","90","","2017.9","1","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,5-Dimethyl-2-phenyl-4-(4,4,4-trifluoro-3-oxo-1-phenylbut-1-enylamino)- 1H-pyrazol-3(2H)-one","","- C21 H18 F3 N3 O2 -","- C21 H18 F3 N3 O2 -","- C84 H72 F12 N12 O8 -","4","1","CI2393","Jing, Zuo-Liang; Zhang, Shu-Juan; Zhai, Jia-Qi","1,5-Dimethyl-2-phenyl-4-(4,4,4-trifluoro-3-oxo-1-phenylbut-1-enylamino)-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","7","o3250","o3250","10.1107/S1600536807028292","","","0.71073","MoKα","","0.0892","0.0442","","","0.1078","0.1306","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214121","13.171","0.005","9.815","0.002","17.257","0.004","90","","112.31","0.02","90","","2063.9","1.1","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-[5,6-Dimethyl-1,3-benzothiazol-2-yl)diazenyl]-1-methyl-2-phenyl- 1<i>H</i>-indole","","- C24 H20 N4 S -","- C24 H20 N4 S -","- C96 H80 N16 S4 -","4","1","CI2395","Hökelek, Tuncer; Seferoğlu, Zeynel; Şahin, Ertan","3-[5,6-Dimethyl-1,3-benzothiazol-2-yl)diazenyl]-1-methyl-2-phenyl-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","7","o3170","o3170","10.1107/S1600536807028310","","","0.71073","MoKα","","0.0973","0.0599","","","0.1373","0.1585","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214122","12.997","0.003","12.525","0.003","19.386","0.004","90","","90","","90","","3155.8","1.2","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","{2-[2-(Piperidin-1-yl)ethyliminomethyl]phenolato-κ^3^N,N',O}(thiocyanato- κN)nickel(II)","","- C15 H19 N3 Ni O S -","- C15 H19 N3 Ni O S -","- C120 H152 N24 Ni8 O8 S8 -","8","1","CI2396","Shou-Xing Wang","{2-[2-(Piperidin-1-yl)ethyliminomethyl]phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>}(thiocyanato-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2007","63","7","m1946","m1946","10.1107/S1600536807029340","","","0.71073","MoKα","","0.0698","0.0427","","","0.0952","0.107","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214123","7.5227","0.0005","11.4535","0.0007","13.5932","0.0007","90","","102.694","0.004","90","","1142.58","0.12","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4-(Chloromethyl)benzophenone","[4-(chloromethyl)phenyl](phenyl)methanone","","- C14 H11 Cl O -","- C14 H11 Cl O -","- C56 H44 Cl4 O4 -","4","1","CI2397","Yang-Ling Zang; Guo-Liang Wu; Wei-Jian Xu; Chun-Hua Yang","4-(Chloromethyl)benzophenone","Acta Crystallographica Section E","2007","63","7","o3339","o3339","10.1107/S1600536807030814","","","0.71073","MoKα","","0.0609","0.0401","","","0.0931","0.1032","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214124","16.901","0.002","10.091","0.001","12.681","0.001","90","","112.077","0.001","90","","2004.1","0.3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-Methyl-1-(3-pyridylmethylene)thiosemicarbazone hemihydrate","","- C8 H11 N4 O0.5 S -","- C8 H11 N4 O0.5 S -","- C64 H88 N32 O4 S8 -","8","1","CI2398","Castillo-Cruz, Alfredo; Toscano, Rubén A.; Hernández-Ortega, Simón; Valdés-Martínez, Jesús","2-Methyl-1-(3-pyridylmethylene)thiosemicarbazone hemihydrate","Acta Crystallographica Section E","2007","63","7","o3334","o3334","10.1107/S1600536807030760","","","0.71073","MoKα","","0.0465","0.036","","","0.0854","0.0889","","","","","","0.944","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214125","12.4517","0.0018","9.2937","0.0014","23.254","0.004","90","","90","","90","","2691","0.7","298","2","298","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","Bis{2-bromo-4-chloro-6-[(2-dimethylaminoethylimino)methyl]phenolato}cadmium(II) monohydrate","","- C22 H28 Br2 Cd Cl2 N4 O3 -","- C22 H28 Br2 Cd Cl2 N4 O3 -","- C88 H112 Br8 Cd4 Cl8 N16 O12 -","4","0.5","CI2399","Li-Zhong Li; Li-Hua Wang","Bis{2-bromo-4-chloro-6-[(2-dimethylaminoethylimino)methyl]phenolato}cadmium(II) monohydrate","Acta Crystallographica Section E","2007","63","7","m2010","m2011","10.1107/S1600536807030826","","","0.71073","MoKα","","0.0664","0.0393","","","0.0764","0.0868","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214126","13.0909","0.0003","24.8935","0.0006","11.6289","0.0003","90","","92.303","0.001","90","","3786.55","0.16","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Ethanol-κO){4,4',6,6'-tetra-tert-butyl-2,2'-[1,2- phenylenebis(nitrilomethylidyne)]diphenolato- κ^4^O,<i>O</i>',<i>N</i>,<i>N</i>'}zinc(II) ethanol solvate","","- C40 H58 N2 O4 Zn -","- C40 H58 N2 O4 Zn -","- C160 H232 N8 O16 Zn4 -","4","1","CI2400","Naser Eltaher Eltayeb; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun; Kamarulazizi Ibrahim","(Ethanol-κ<i>O</i>){4,4',6,6'-tetra-<i>tert</i>-butyl-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenolato-κ^4^<i>O</i>,<i>O</i>',<i>N</i>,<i>N</i>'}zinc(II) ethanol solvate","Acta Crystallographica Section E","2007","63","7","m2024","m2025","10.1107/S1600536807030863","","","0.71073","MoKα","","0.0642","0.0451","","","0.1145","0.1326","","","","","","1.079","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214127","18.9045","0.0004","9.9101","0.0003","19.176","0.0005","90","","107.044","0.002","90","","3434.75","0.16","150","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tris(1,1,1,3,3,3-hexafluoroisopropyl) phosphate","","- C9 H3 F18 O4 P -","- C9 H3 F18 O4 P -","- C72 H24 F144 O32 P8 -","8","1","CS2040","Saaidi, Pierre-Loïc; Jeanneau, Erwann; Hasserodt, Jens","Tris(1,1,1,3,3,3-hexafluoroisopropyl) phosphate","Acta Crystallographica Section E","2007","63","7","o3241","o3242","10.1107/S160053680702853X","","","0.71069","MoKα","","","0.034","","","","0.0477","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214128","8.502","0.005","20.702","0.012","7.399","0.004","90","","107.492","0.012","90","","1242.1","1.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-7-yl)acetate","","- C11 H14 N4 O4 -","- C11 H14 N4 O4 -","- C44 H56 N16 O16 -","4","1","CV2216","Zhen-Hua Li; Wei-Ke Su","Ethyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-7-yl)acetate","Acta Crystallographica Section E","2007","63","7","o3118","o3119","10.1107/S1600536807012287","","","0.71073","MoKα","","0.1118","0.0879","","","0.1763","0.1883","","","","","","1.166","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214129","9.0015","0.0008","14.3443","0.0013","13.3019","0.0012","90","","90.803","0.002","90","","1717.4","0.3","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","<i>N</i>-Acetyl-<i>N</i>'-{3-cyano-1-[2,6-dichloro-4- (trifluoromethyl)phenyl]pyrazol-5-yl}thiourea","","- C14 H8 Cl2 F3 N5 O S -","- C14 H8 Cl2 F3 N5 O S -","- C56 H32 Cl8 F12 N20 O4 S4 -","4","1","CV2236","Zhang, Xiao-Hong; Zhong, Ping; Lin, Qiao-Ying","<i>N</i>-Acetyl-<i>N</i>'-{3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]pyrazol-5-yl}thiourea","Acta Crystallographica Section E","2007","63","7","o3077","o3077","10.1107/S1600536807020715","","","0.71073","MoKα","","0.0861","0.0781","","","0.1472","0.1507","","","","","","1.276","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214130","19.1646","0.0013","7.7488","0.0005","24.8495","0.0017","90","","100.414","0.001","90","","3629.4","0.4","103","","103","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,5-Bis(3,4-dimethoxyphenyl)penta-1,4-dien-3-one","","- C21 H22 O5 -","- C21 H22 O5 -","- C168 H176 O40 -","8","2","CV2246","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Bindya, S; Narayana, B.; Sarojini, B. K.","1,5-Bis(3,4-dimethoxyphenyl)penta-1,4-dien-3-one","Acta Crystallographica Section E","2007","63","7","o3115","","10.1107/S1600536807026888","","","0.71073","MoKα","","0.0501","0.0414","","","0.1069","0.1136","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214131","18.722","0.004","31.454","0.006","7.2137","0.0014","90","","90","","90","","4248","1.5","298","2","298","2","","","","","","","","5","F d d 2","F 2 -2d","43","","3-(2-Chlorophenyl)-N-methylisoxazole-5-carboxamide","","- C11 H9 Cl N2 O2 -","- C11 H9 Cl N2 O2 -","- C176 H144 Cl16 N32 O32 -","16","1","CV2248","Xin-Hong Chang","3-(2-Chlorophenyl)-<i>N</i>-methylisoxazole-5-carboxamide","Acta Crystallographica Section E","2007","63","7","o3074","o3074","10.1107/S1600536807025895","","","0.71073","MoKα","","0.0331","0.0315","","","0.0808","0.0821","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214132","7.5382","0.0013","14.195","0.003","21.204","0.004","90","","90","","90","","2268.9","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-[(2-Chloroethoxy)ethyl]-2,3,4,6-tetra-O-acetyl-β-D-galactopyranoside","","- C18 H27 Cl O11 -","- C18 H27 Cl O11 -","- C72 H108 Cl4 O44 -","4","1","CV2250","Xiao-Ru Zhang; Hui-Qing Zhang; Xiao-Hui Yang; Sai Bi","2-[(2-Chloroethoxy)ethyl]-2,3,4,6-tetra-<i>O</i>-acetyl-β-<small>D</small>-glucopyranoside","Acta Crystallographica Section E","2007","63","7","o3174","o3174","10.1107/S1600536807028127","","","0.71073","MoKα","","0.0619","0.0479","","","0.1288","0.1404","","","","","","1.035","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214133","6.433","0.003","9.969","0.004","16.43","0.006","90","","94.046","0.017","90","","1051","0.8","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[bromidosodium(I)]-bis(μ-dimethyl sulfoxide-κ^2^O:O)]","","- C4 H12 Br Na O2 S2 -","- C4 H12 Br Na O2 S2 -","- C16 H48 Br4 Na4 O8 S8 -","4","1","CV2251","Bu, Tian-Jia; Li, Bao; Ye, Ling; Wu, Li-Xin","<i>catena</i>-Poly[[bromidosodium(I)]-bis(μ-dimethyl sulfoxide-κ^2^<i>O</i>:<i>O</i>)]","Acta Crystallographica Section E","2007","63","7","m1807","m1807","10.1107/S1600536807026402","","","0.71073","MoKα","","0.0563","0.0337","","","0.0659","0.0723","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214134","10.394","0.0008","10.394","0.0008","8.9094","0.001","90","","90","","90","","962.53","0.15","293","2","293","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","Poly[ethylenediammonium di-μ~4~-phosphatodizincate(II)]","","- C2 H10 N2 O8 P2 Zn2 -","- C2 H10 N2 O8 P2 Zn2 -","- C8 H40 N8 O32 P8 Zn8 -","4","0.5","CV2252","Pan, Jian-Xin; Yang, Guo-Yu","Poly[ethylenediammonium di-μ~4~-phosphatodizincate(II)]","Acta Crystallographica Section E","2007","63","7","m1925","m1925","10.1107/S1600536807028140","","","0.71073","MoKα","","","0.0469","","","0.1097","0.1277","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214135","12.266","0.004","14.908","0.006","16.946","0.006","94.448","0.006","107.027","0.006","92.066","0.007","2948.4","1.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","{(R)-1,1'-Bis(1-naphthylmethyl)-3,3'-[1,1'-binaphthyl-2,2'- diyldi(oxyethylene)]di-1H-imidazol-2-yl}mercury(II) bis(hexafluoridophosphate) acetonitrile 3.5-solvate","","- C59 H52.5 F12 Hg N7.5 O2 P2 -","- C59 H52.5 F12 Hg N7.5 O2 P2 -","- C118 H105 F24 Hg2 N15 O4 P4 -","2","1","CV2254","Jin Lin; Gui-Ying Dong","{(<i>R</i>)-1,1'-Bis(1-naphthylmethyl)-3,3'-[1,1'-binaphthyl-2,2'-diyldi(oxyethylene)]di-1<i>H</i>-imidazol-2-yl}mercury(II) bis(hexafluoridophosphate) acetonitrile 3.5-solvate","Acta Crystallographica Section E","2007","63","7","m1802","m1802","10.1107/S1600536807026682","","","0.71073","MoKα","","0.0806","0.0473","","","0.1059","0.1269","","","","","","1.044","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214136","10.0182","0.0003","8.1082","0.0003","19.2442","0.0006","90","","103.07","0.001","90","","1522.7","0.09","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(anthracen-10-ylmethyl)picolinamide","","- C21 H16 N2 O -","- C21 H16 N2 O -","- C84 H64 N8 O4 -","4","1","CV2255","Gu, Shao-Jin; Lin, Jin; Jing, Lin-Hai; Zhang, Huan-Xia; Qin, Da-Bin","<i>N</i>-(9-Anthrylmethyl)picolinamide","Acta Crystallographica Section E","2007","63","7","o3205","","10.1107/S1600536807026918","","","0.71073","MoKα","","0.0717","0.0469","","","0.1331","0.1509","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214137","7.6881","0.0012","9.0059","0.0014","17.737","0.003","79.953","0.004","78.131","0.003","67.468","0.003","1103.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","bis(2,2'-bipyridine-κ^2^N,N')(dicyanamido-κN)copper(II) perchlorate","","- C22 H16 Cl Cu N7 O4 -","- C22 H16 Cl Cu N7 O4 -","- C44 H32 Cl2 Cu2 N14 O8 -","2","1","CV2256","Jiao, Rui; Wang, Li; Xu, Feng; Huang, Wei","A triclinic polymorph of bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(dicyanamido-κ<i>N</i>)copper(II) perchlorate","Acta Crystallographica Section E","2007","63","7","m1823","m1823","10.1107/S1600536807026876","","","0.71073","MoKα","","0.097","0.0689","","","0.1532","0.1683","","","","","","1.032","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214138","23.603","0.003","7.9486","0.0012","19.659","0.003","90","","95.818","0.013","90","","3669.2","0.9","113","2","113","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-Chloro-6-(piperidin-1-yl)-N^2^-(2,4,4-trimethylpentan-2-yl)- 1,3,5-triazin-2-amine","","- C16 H28 Cl N5 -","- C16 H28 Cl N5 -","- C128 H224 Cl8 N40 -","8","1","CV2257","Xin-Yu Tang; Fei Wen; Ling Qin; Lei Xu; Yue-Guang Yin","4-Chloro-6-(piperidin-1-yl)-<i>N</i>^2^-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazin-2-amine","Acta Crystallographica Section E","2007","63","7","o3288","o3288","10.1107/S1600536807027341","","","0.7107","MoKα","","0.0645","0.0519","","","0.1101","0.1163","","","","","","1.11","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214139","7.4583","0.0003","10.7134","0.0004","10.96","0.0004","107.062","0.002","107.744","0.002","98.22","0.002","770.96","0.05","297","2","100","0.1","","","","","","","","3","P -1","-P 1","2","","1-(3,4-dimethoxyphenyl)-3-(3-methoxyphenyl)prop-2-en-1-one","","- C18 H18 O4 -","- C18 H18 O4 -","- C36 H36 O8 -","2","1","CV2259","Mohd Mustaqim Rosli; P. S. Patil; Hoong-Kun Fun; Ibrahim Abdul Razak; S. M. Dharmaprakash; Y. E. Satheesh","1-(3,4-Dimethoxyphenyl)-3-(3-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","7","o3239","o3239","10.1107/S1600536807027560","","","0.71073","MoKα","","0.0895","0.0603","","","0.1803","0.2112","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214140","17.1005","0.0011","10.6509","0.0006","15.0484","0.0009","90","","98.163","0.0011","90","","2713.1","0.3","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-Bis(4-nitrobenzoyl)-3,4-bis(4-nitrophenyl)cyclobutane","","- C30 H20 N4 O10 -","- C30 H20 N4 O10 -","- C120 H80 N16 O40 -","4","1","CV2260","Xiong, Ren-Gen","1,2-Bis(4-nitrobenzoyl)-3,4-bis(4-nitrophenyl)cyclobutane","Acta Crystallographica Section E","2007","63","7","o3265","o3265","10.1107/S1600536807028954","","","0.71073","MoKα","","0.0861","0.0546","","","0.1269","0.1343","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214141","10.2747","0.0004","4.7218","0.0002","10.1686","0.0004","90","","116.22","0.002","90","","442.57","0.03","100","0.1","100","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-phenylenediacetic acid","","- C10 H10 O4 -","- C10 H10 O4 -","- C20 H20 O8 -","2","0.5","CV2261","Hoong-Kun Fun; Suchada Chantrapromma; Subrata Jana; Anita Hazra; Shyamaprosad Goswami","1,4-Phenylenediacetic acid","Acta Crystallographica Section E","2007","63","7","o3171","o3171","10.1107/S1600536807028000","","","0.71073","MoKα","","0.0513","0.0414","","","0.101","0.1066","","","","","","1.099","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214142","11.06","0.002","10.66","0.002","10.489","0.002","90","","97.91","0.03","90","","1224.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[2-Chloro-4-(4-fluorophenoxy)phenyl]ethanone","","- C14 H10 Cl F O2 -","- C14 H10 Cl F O2 -","- C56 H40 Cl4 F4 O8 -","4","1","CV2262","Liang-Zhong Xu; Wen-Zhao Bi; Zhi-Wei Zhai","1-[2-Chloro-4-(4-fluorophenoxy)phenyl]ethanone","Acta Crystallographica Section E","2007","63","7","o3243","o3243","10.1107/S160053680702836X","","","0.71073","MoKα","","0.0578","0.0462","","","0.1185","0.1242","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214143","16.3724","0.0006","7.1673","0.0004","14.1857","0.0008","90","","90","","90","","1664.63","0.15","100","0.2","100","0.2","","","","","","","","5","I m a 2","I 2 -2a","46","","Poly[propane-1,3-diammonium [diaquatetrakis(μ~4~-benzene-1,2,4,5-tetracarboxylato)nickelate(II)] hemihydrate]","","- C13 H19 N2 Ni O10.5 -","- C13 H19 N2 Ni O10.5 -","- C52 H76 N8 Ni4 O42 -","4","0.5","CV2264","Aghabozorg, Hossein; Bahrami, Zohreh; Tabatabaie, Masoumeh; Ghadermazi, Mohammad; Attar Gharamaleki, Jafar","Poly[propane-1,3-diammonium [diaquatetrakis(μ~4~-benzene-1,2,4,5-tetracarboxylato)nickelate(II)] hemihydrate]","Acta Crystallographica Section E","2007","63","7","m2022","m2023","10.1107/S1600536807030978","","","0.71073","MoKα","","0.0287","0.0278","","","0.0719","0.0729","","","","","","1.002","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214144","13.9214","0.0018","17.238","0.002","7.7751","0.0016","90","","104.294","0.002","90","","1808.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Hydroxy-N'-[phenyl(2-pyridyl)methylene]-2-naphthohydrazide","","- C23 H17 N3 O2 -","- C23 H17 N3 O2 -","- C92 H68 N12 O8 -","4","1","CV2265","Wen-Jun Kang; Jian-Min Dou; Da-Cheng Li; Da-Qi Wang","3-Hydroxy-<i>N</i>'-[phenyl(2-pyridyl)methylene]-2-naphthohydrazide","Acta Crystallographica Section E","2007","63","7","o3328","o3328","10.1107/S160053680703036X","","","0.71073","MoKα","","0.1051","0.0447","","","0.1111","0.1517","","","","","","1.007","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214145","14.768","0.0007","8.4109","0.0005","16.7738","0.0009","90","","104.015","0.005","90","","2021.49","0.19","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,5-Dinitro-N-(tri-2-pyridylmethyl)benzamide","","- C23 H16 N6 O5 -","- C23 H16 N6 O5 -","- C92 H64 N24 O20 -","4","1","CV2269","Marjani, Katayoun; Abbastabar-Ahangar, Hossein; Mohammadi, Leila; Mousavi, Mohsen; Attar Gharamaleki, Jafar","3,5-Dinitro-<i>N</i>-(tri-2-pyridylmethyl)benzamide","Acta Crystallographica Section E","2007","63","7","o3345","o3345","10.1107/S1600536807031017","","","0.71073","MoKα","","0.0437","0.0366","","","0.0933","0.0988","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214146","11.174","0.0017","26.598","0.004","15","0.002","90","","108.38","0.003","90","","4230.7","1.1","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraethylammonium dichlorido[N,N'-(4,5-dichloro-o-phenylene)bis(4-tert- butylpyridine-2-carboxamide)-κ^4^N]iron(III) acetonitrile solvate","","- C35 H47 Cl7 Fe N5 O2 -","- C35 H47 Cl7 Fe N5 O2 -","- C140 H188 Cl28 Fe4 N20 O8 -","4","1","DN2152","Xiao-Bin Xu; Li Yang; Yan-Yang Qu; Li-Xin Li; Xiang-Ge Zhou","Tetraethylammonium dichlorido[<i>N</i>,<i>N</i>'-(4,5-dichloro-<i>o</i>-phenylene)bis(4-<i>tert</i>-butylpyridine-2-carboxamide)-κ^4^<i>N</i>]ferrate(III) acetonitrile solvate","Acta Crystallographica Section E","2007","63","7","m1790","m1790","10.1107/S1600536807021915","","","0.71073","MoKα","","0.1565","0.0642","","","0.1576","0.2019","","","","","","1.006","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214147","14.932","0.001","26.6371","0.0017","13.1937","0.0009","90","","114.032","0.001","90","","4792.8","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[(<i>E</i>)-2-(3-Methoxy-2-oxidobenzylideneamino)ethanesulfonato](1,10- phenanthroline)copper(II)","","- C22 H19 Cu N3 O5 S -","- C22 H19 Cu N3 O5 S -","- C176 H152 Cu8 N24 O40 S8 -","8","2","DN2173","Gui-Liang Wang","[(<i>E</i>)-2-(3-Methoxy-2-oxidobenzylideneamino)ethanesulfonato](1,10-phenanthroline)copper(II)","Acta Crystallographica Section E","2007","63","7","m1779","m1779","10.1107/S160053680702538X","","","0.71073","MoKα","","0.0595","0.0352","","","0.0862","0.0893","","","","","","0.794","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214148","7.3733","0.0015","11.117","0.002","12.954","0.002","104.635","0.01","105.108","0.011","96.7","0.009","972.7","0.3","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","(<i>E</i>)-2-[2-(4-Bromobenzoylmethylene)imidazolidin-1-yl]ethyl 4-bromobenzoate","","- C20 H18 Br2 N2 O3 -","- C20 H18 Br2 N2 O3 -","- C40 H36 Br4 N4 O6 -","2","1","DN2178","Chu-Yi Yu; Xue-Ning Yuan; Li-Ben Wang; Zhi-Tang Huang","(<i>E</i>)-2-[2-(4-Bromobenzoylmethylene)imidazolidin-1-yl]ethyl 4-bromobenzoate","Acta Crystallographica Section E","2007","63","7","o3057","o3057","10.1107/S1600536807025974","","","0.71073","MoKα","","0.0779","0.0501","","","0.1249","0.1368","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214149","18.8279","0.0013","6.1645","0.0004","16.3539","0.001","90","","99.529","0.006","90","","1871.9","0.2","153","2","153","2","","","","","","","","4","C 1 2 1","C 2y","5","","(3<i>S</i>,4S)-1-Benzhydryl-4-(cyclopropylcarbonyl)- 3-[(1<i>R</i>)-1-hydroxyethyl]azetidin-2-one","","- C22 H23 N O3 -","- C22 H23 N O3 -","- C88 H92 N4 O12 -","4","1","DN2179","Chen, Xiao-Fei; Wang, Li-Juan; Gao, Yu-Xing; Jin, Li-Ren; Zheng, Jian-Feng","(3<i>S</i>,4<i>S</i>)-1-Benzhydryl-4-(cyclopropylcarbonyl)-3-[(1<i>R</i>)-1-hydroxyethyl]azetidin-2-one","Acta Crystallographica Section E","2007","63","7","o3220","o3220","10.1107/S1600536807028139","","","0.71073","MoKα","","0.0711","0.0463","","","0.1268","0.1573","","","","","","1.068","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214150","7.891","0.002","8.328","0.003","13.628","0.002","90","","91.47","0.02","90","","895.3","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Xylidinium nitrate","","- C8 H12 N2 O3 -","- C8 H12 N2 O3 -","- C32 H48 N8 O12 -","4","1","DN2181","Abid, Sonia; Hemissi, Hanene; Rzaigui, Mohamed","2,6-Xylidinium nitrate","Acta Crystallographica Section E","2007","63","7","o3117","o3117","10.1107/S1600536807025408","","","0.71073","MoKα","","0.0541","0.0371","","","0.1038","0.1116","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214151","14.588","0.004","4.92","0.002","16.386","0.008","90","","111.49","0.09","90","","1094.3","1","299","2","299","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Methanesulfon-2,4,6-trimethylanilide","<i>N</i>-(2,4,6-Trimethylphenyl)methanesulfonamide","","- C10 H15 N O2 S -","- C10 H15 N O2 S -","- C40 H60 N4 O8 S4 -","4","1","DN2182","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(2,4,6-Trimethylphenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","7","o3084","o3084","10.1107/S1600536807025883","","","1.5418","CuKα","","0.0998","0.0688","","","0.1767","0.1983","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214152","17.838","0.003","9.4102","0.0017","21.309","0.004","90","","92.594","0.003","90","","3573.2","1.1","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-chlorido-bis[(di-2-pyridyl disuldide-κ^2^N,N')copper(I)]","","- C20 H16 Cl2 Cu2 N4 S4 -","- C20 H16 Cl2 Cu2 N4 S4 -","- C120 H96 Cl12 Cu12 N24 S24 -","6","1.5","DN2183","Gui-Liang Wang","Di-μ-chlorido-bis[(di-2-pyridyl disulfide-κ^2^<i>N</i>,<i>N</i>')copper(I)]","Acta Crystallographica Section E","2007","63","7","m1826","m1826","10.1107/S1600536807027304","","","0.71073","MoKα","","0.1272","0.0655","","","0.1571","0.199","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214153","5.192","0.001","8.452","0.001","11.031","0.001","79.72","0.01","89.72","0.01","84.89","0.01","474.38","0.12","299","2","299","2","","","","","","","","6","P -1","-P 1","2","Methanesulfon-3,4-dichloroanilide","<i>N</i>-(3,4-Dichlorophenyl)methanesulfonamide","","- C7 H7 Cl2 N O2 S -","- C7 H7 Cl2 N O2 S -","- C14 H14 Cl4 N2 O4 S2 -","2","1","DN2184","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(3,4-Dichlorophenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","7","o3090","o3090","10.1107/S1600536807026438","","","1.5418","CuKα","","0.0377","0.0337","","","0.0905","0.0941","","","","","","1.075","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214154","4.867","0.003","9.921","0.007","20.076","0.009","92.59","0.04","91.45","0.03","101.33","0.05","948.9","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Poly[bis(hippurato-O)-aqua-potassium(i)]","Poly[aquadi-μ-hippurato-potassium(I)]","","- C18 H18 K N2 O7 -","- C18 H18 K N2 O7 -","- C36 H36 K2 N4 O14 -","2","1","DN2185","S. Natarajan; S. A. Martin Britto Dhas; J. Suresh; S. Athimoolam","Poly[aquadi-μ-hippurato-potassium(I)]","Acta Crystallographica Section E","2007","63","7","m1941","m1941","10.1107/S1600536807028796","","","0.71073","MoKα","","0.1282","0.0737","","","0.2109","0.2477","","","","","","1.079","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214155","16.076","0.003","5.053","0.002","12.148","0.003","90","","96.6","0.02","90","","980.3","0.5","299","2","299","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Methanesulfon-3,5-dichloroanilide","N-(3,5-dichlorophenyl)methanesulfonamide","","- C7 H7 Cl2 N O2 S -","- C7 H7 Cl2 N O2 S -","- C28 H28 Cl8 N4 O8 S4 -","4","1","DN2186","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(3,5-Dichlorophenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","7","o3102","o3102","10.1107/S1600536807026724","","","1.5418","CuKα","","0.1039","0.092","","","0.2365","0.2545","","","","","","1.094","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214156","6.5438","0.0003","11.9938","0.0005","21.4916","0.0009","90","","90.164","0.001","90","","1686.76","0.13","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Hemi(piperazinediium) hexaaquaaluminium(III) bis(sulfate) tetrahydrate","","- C4 H52 Al2 N2 O36 S4 -","- C4 H52 Al2 N2 O36 S4 -","- C8 H104 Al4 N4 O72 S8 -","2","0.5","DN2188","Ghadermazi, Mohammad; Aghabozorg, Hossein; Sheshmani, Shabnam","Hemi(piperazinediium) hexaaquaaluminium(III) bis(sulfate) tetrahydrate: a redetermination at 100 K","Acta Crystallographica Section E","2007","63","7","m1919","m1919","10.1107/S1600536807028152","","","0.71073","MoKα","","0.025","0.0237","","","0.0637","0.0645","","","","","","1.117","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2214157","7.9274","0.0005","10.8456","0.0007","13.3381","0.0009","77.705","0.001","84.094","0.001","69.984","0.001","1052.23","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[(1,10-phenanthroline-κ^2^N,N')(pyridine-3-carboxylato-\ κ^2^O:O')cadmium(II)]-μ-pyridine-3-carboxylato-κ^3^N:O,O']","","- C24 H16 Cd N4 O4 -","- C24 H16 Cd N4 O4 -","- C48 H32 Cd2 N8 O8 -","2","1","DN2189","Hong-Chao Yi; Ping Mei","<i>catena</i>-Poly[[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(pyridine-3-carboxylato-κ^2^<i>O</i>:<i>O</i>')cadmium(II)]-μ-pyridine-3-carboxylato-κ^3^<i>N</i>:<i>O</i>,<i>O</i>']","Acta Crystallographica Section E","2007","63","7","m1920","m1920","10.1107/S1600536807027936","","","0.71073","MoKα","","0.0238","0.0225","","","0.0569","0.0576","","","","","","1.069","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214158","10.159","0.001","10.248","0.001","11.071","0.001","90","","90","","90","","1152.6","0.19","302","2","302","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","<i>N</i>-(2-Chlorophenyl)-2,2,2-trimethylacetamide","","- C11 H14 Cl N O -","- C11 H14 Cl N O -","- C44 H56 Cl4 N4 O4 -","4","1","DN2190","B. Thimme Gowda; Ingrid Svoboda; Hartmut Fuess","<i>N</i>-(2-Chlorophenyl)-2,2,2-trimethylacetamide","Acta Crystallographica Section E","2007","63","7","o3266","o3266","10.1107/S1600536807029005","","","0.71073","MoKα","","0.1099","0.0492","","","0.1126","0.1358","","","","","","1.051","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214159","8.9633","0.0002","8.4904","0.0002","23.1997","0.0005","90","","92.206","0.001","90","","1764.24","0.07","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(Benzylsulfanyl)-4-phenyl-3<i>H</i>-1,5-benzodiazepine","","- C22 H18 N2 S -","- C22 H18 N2 S -","- C88 H72 N8 S4 -","4","1","DN2191","Doubia, Mohamadou Lamine; Bouhfid, Rachid; Ahabchane, Noureddine Hamou; Essassi, El Mokhtar; El Ammari, Lahcen","2-(Benzylsulfanyl)-4-phenyl-3<i>H</i>-1,5-benzodiazepine","Acta Crystallographica Section E","2007","63","7","o3305","o3305","10.1107/S1600536807029364","","","0.71073","MoKα","","0.0972","0.046","","","0.101","0.121","","","","","","1.006","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214160","14.2995","0.0003","8.7004","0.0002","14.3851","0.0004","90","","103.337","0.001","90","","1741.4","0.07","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Phenyl-2-(2-pyridylmethylsulfanyl)-3<i>H</i>-1,5-benzodiazepine","","- C21 H17 N3 S -","- C21 H17 N3 S -","- C84 H68 N12 S4 -","4","1","DN2192","Doubia, Mohamadou Lamine; Bouhfid, Rachid; Ahabchane, Noureddine Hamou; Essassi, El Mokhtar; El Ammari, Lahcen","4-Phenyl-2-(2-pyridylmethylsulfanyl)-3<i>H</i>-1,5-benzodiazepine","Acta Crystallographica Section E","2007","63","7","o3306","o3306","10.1107/S1600536807029376","","","0.71073","MoKα","","0.0688","0.0437","","","0.1159","0.1519","","","","","","1.106","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214161","20.84","0.006","7.141","0.003","9.364","0.003","90","","114.77","0.03","90","","1265.3","0.8","298","2","298","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Ethyl 4-bromo-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxylate","","- C13 H15 Br O3 -","- C13 H15 Br O3 -","- C52 H60 Br4 O12 -","4","0.5","DN2193","Ben Amor, Fatma; Jmour, Asma; Driss, Ahmed; Rezgui, Farhat","Ethyle 4-bromo-3-hydroxy-5,6,7,8-tétrahydronaphtalène-2-carboxylate","Acta Crystallographica Section E","2007","63","7","o3314","o3314","10.1107/S1600536807029777","","","0.71073","MoKα","","0.0751","0.047","","","0.1045","0.1197","","","","","","1.145","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214162","11.055","0.002","6.7804","0.0014","30.727","0.006","90","","98.84","0.03","90","","2275.9","0.8","300","2","300","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","Sodium N-bromo-4-chloro-2-methylbenzenesulfonamidate sesquihydrate","","- C7 H9 Br Cl N Na O3.5 S -","- C7 H9 Br Cl N Na O3.5 S -","- C56 H72 Br8 Cl8 N8 Na8 O28 S8 -","8","1","DN2194","B. Thimme Gowda; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","Sodium <i>N</i>-bromo-4-chloro-2-methylbenzenesulfonamidate sesquihydrate","Acta Crystallographica Section E","2007","63","7","m1957","m1957","10.1107/S1600536807029248","","","0.71073","MoKα","","0.0857","0.0696","","","0.088","0.0909","","","","","","1.21","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214163","11.353","0.002","5.9629","0.0007","13.452","0.002","90","","106.26","0.01","90","","874.2","0.2","302","2","302","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","3,4-Dichlorobenzenesulfonamide","3,4-Dichlorobenzenesulfonamide","","- C6 H5 Cl2 N O2 S -","- C6 H5 Cl2 N O2 S -","- C24 H20 Cl8 N4 O8 S4 -","4","1","DN2195","B. Thimme Gowda; K. S. Babitha; Ingrid Svoboda; Hartmut Fuess","3,4-Dichlorobenzenesulfonamide","Acta Crystallographica Section E","2007","63","7","o3245","o3245","10.1107/S1600536807028802","","","0.71073","MoKα","","0.0526","0.0314","","","0.0748","0.0892","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214164","10.3985","0.0008","6.7027","0.0004","29.892","0.002","90","","96.71","0.008","90","","2069.1","0.2","299","2","299","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","Sodium N-bromo-4-fluorobenzenesulfonamidate sesquihydrate","","- C6 H7 Br F N Na O3.5 S -","- C6 H7 Br F N Na O3.5 S -","- C48 H56 Br8 F8 N8 Na8 O28 S8 -","8","1","DN2196","B. Thimme Gowda; Jozef Kožíšek; Miroslav Tokarčík; Hartmut Fuess","Sodium <i>N</i>-bromo-4-fluorobenzenesulfonamidate sesquihydrate","Acta Crystallographica Section E","2007","63","7","m1958","m1958","10.1107/S1600536807029261","","","0.71073","MoKα","","0.0785","0.0701","","","0.1464","0.1508","","","","","","1.041","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214165","7.3142","0.0003","5.8612","0.0002","9.8969","0.0002","90","","98.829","0.002","90","","419.25","0.02","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","p-Hydroxyanilinium bisulfate","3-Hydroxyanilinium hydrogensulfate","","- C6 H9 N O5 S -","- C6 H9 N O5 S -","- C12 H18 N2 O10 S2 -","2","1","DN2197","Nourredine Benali-Cherif; Alima Kateb; Houda Boussekine; Zina Boutobba; Amel Messai","3-Hydroxyanilinium hydrogensulfate","Acta Crystallographica Section E","2007","63","7","o3251","o3251","10.1107/S1600536807028978","","","0.71073","MoKα","","0.0339","0.0303","","","0.0848","0.0993","","","","","","1.143","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214166","16.5632","0.0002","6.7242","0.0002","7.6849","0.0003","90","","90","","90","","855.9","0.04","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","o-toluidinium nitrate","2-Methylanilinium nitrate","","- C7 H10 N2 O3 -","- C7 H10 N2 O3 -","- C28 H40 N8 O12 -","4","0.5","DN2199","Nourredine Benali-Cherif; Houda Boussekine; Zina Boutobba; Alima Kateb","2-Methylanilinium nitrate","Acta Crystallographica Section E","2007","63","7","o3287","o3287","10.1107/S1600536807029716","","","0.71073","MoKα","","0.0916","0.0498","","","0.1151","0.135","","","","","","1.046","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214167","10.8413","0.0011","13.4524","0.0013","19.761","0.002","90","","98.749","0.002","90","","2848.4","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-Benzyl-2-[3,5-bis(benzyloxy)benzyloxy]benzamide","","- C35 H31 N O4 -","- C35 H31 N O4 -","- C140 H124 N4 O16 -","4","1","DN2200","Tang, Zheng-Hua; Tang, Yu; Cao, Xiao-Ping","<i>N</i>-Benzyl-2-[3,5-bis(benzyloxy)benzyloxy]benzamide","Acta Crystallographica Section E","2007","63","7","o3283","o3283","10.1107/S1600536807029406","","","0.71073","MoKα","","0.0959","0.0489","","","0.1175","0.1411","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214168","9.3706","0.0003","13.9089","0.0004","6.764","0.0002","90","","103.021","0.001","90","","858.92","0.04","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(E,E)-1,4-Diethyl-1,4-Di-(5-chloro-2-hydroxyphenyl)-2,3-diazabutadiene","(<i>E</i>,<i>E</i>)-4,4'-Dichloro-2,2'-(1,1'-azinodiethylene)diphenol","","- C18 H18 Cl2 N2 O2 -","- C18 H18 Cl2 N2 O2 -","- C36 H36 Cl4 N4 O4 -","2","0.5","DN2201","Jian-Guo Chang; Dong-Feng Zhao; Guo-Fang He; Ji-Kun Li","(<i>E</i>,<i>E</i>)-4,4'-Dichloro-2,2'-(1,1'-azinodiethylene)diphenol","Acta Crystallographica Section E","2007","63","7","o3297","o3297","10.1107/S1600536807030140","","","0.71073","MoKα","","0.0354","0.0315","","","0.0849","0.0886","","","","","","1.079","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214169","9.7975","0.0005","25.102","0.001","11.0414","0.0006","90","","108.183","0.001","90","","2579.9","0.2","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(3-Carboxypyridine-2-carboxylato-κ^2^N,O)(4'-phenyl-2,2':6',2''-terpyridine- κ^3^N,N',N'')copper(II) tetrafluoridoborate","","- C28 H19 B Cu F4 N4 O4 -","- C28 H19 B Cu F4.008 N4 O4 -","- C112 H76 B4 Cu4 F16.032 N16 O16 -","4","1","DN2202","Martínez-Vargas, Sergio; Toscano, Rubén A.; Valdés-Martínez, Jesús","(3-Carboxypyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>)(4'-phenyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')copper(II) tetrafluoridoborate","Acta Crystallographica Section E","2007","63","7","m1975","m1976","10.1107/S1600536807030073","","","0.71073","MoKα","","0.066","0.043","","","0.0795","0.0845","","","","","","0.875","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214170","13.847","0.002","7.096","0.0012","12.467","0.002","90","","90","","90","","1225","0.3","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","3-(1,3-Dioxolan-2-yl)-6,7-dimethoxyquinoline","","- C14 H15 N O4 -","- C14 H15 N O4 -","- C56 H60 N4 O16 -","4","0.5","DN2203","Benameur, Ahmed; Rhouati, Salah; Bouacida, Sofiane; Roisnel, Thierry; Touchard, Daniel","3-(1,3-Dioxolan-2-yl)-6,7-dimethoxyquinoline","Acta Crystallographica Section E","2007","63","7","o3315","o3316","10.1107/S160053680703019X","","","0.71073","MoKα","","0.0483","0.045","","","0.1281","0.1309","","","","","","1.065","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214171","12.0793","0.0007","22.6156","0.0014","22.5499","0.0014","90","","90","","90","","6160.2","0.6","173","2","173","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","Di-μ-diphenylphosphido-bis{chlorido[(mesitylmethyl)diphenylphosphine- κP]palladium(II)]}","","- C68 H66 Cl2 P4 Pd2 -","- C68 H66 Cl2 P4 Pd2 -","- C272 H264 Cl8 P16 Pd8 -","4","0.5","DN2205","Chahen, Ludovic; Therrien, Bruno; Süss-Fink, Georg","Di-μ-diphenylphosphido-bis{chlorido[(mesitylmethyl)diphenylphosphine-κ<i>P</i>]palladium(II)}","Acta Crystallographica Section E","2007","63","7","m1989","m1989","10.1107/S1600536807030280","","","0.71073","MoKα","","0.0713","0.0311","","","0.0594","0.0644","","","","","","0.775","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214172","3.9472","0.0004","23.281","0.002","6.0379","0.0006","90","","104.214","0.001","90","","537.86","0.09","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","<i>N</i>-[(5-Chlorothiophen-2-yl)methylene]-5-methylthiazol-2-amine","","- C9 H7 Cl N2 S2 -","- C9 H7 Cl N2 S2 -","- C18 H14 Cl2 N4 S4 -","2","1","DN2206","Chun-Niu Zhang; Yun-Fa Zheng","<i>N</i>-[(5-Chlorothiophen-2-yl)methylene]-5-methylthiazol-2-amine","Acta Crystallographica Section E","2007","63","7","o3310","o3310","10.1107/S1600536807030255","","","0.71073","MoKα","","0.0233","0.0223","","","0.0595","0.06","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214173","8.551","0.0006","15.522","0.004","18.056","0.002","90","","92.784","0.008","90","","2393.7","0.7","295","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(2,2'-bipyridine-1κ^2^N,N')-\-m-bromido-1:2κ^2^Br-tribromido-2κ^3^Br-\ copper(II)mercury(II)","","- C20 H16 Br4 Cu Hg N4 -","- C20 H16 Br4 Cu Hg N4 -","- C80 H64 Br16 Cu4 Hg4 N16 -","4","1","DN3049","Lee, Yong-Min; Ryu, Hae-Wook; Choi, Sung-Nak; Choi, Jae Soo; Kang, Sung Kwon","Bis(2,2'-bipyridine-1κ^2^<i>N</i>,<i>N</i>')-μ-bromido-1:2κ^2^<i>Br</i>-tribromido-2κ^3^<i>Br</i>-copper(II)mercury(II)","Acta Crystallographica Section E","2007","63","7","m1952","m1953","10.1107/S160053680702925X","","","0.71073","MoKα","","0.1609","0.0603","","","0.0875","0.1101","","","","","","0.985","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214174","8.9633","0.0004","9.4284","0.0004","10.5524","0.0005","72.461","0.003","79.15","0.003","75.594","0.003","817.37","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","6-Bromo-2,2-diphenyl-2H-1-benzopyran","6-Bromo-2,2-diphenyl-2<i>H</i>-1-benzopyran","","- C21 H15 Br O -","- C21 H15 Br O -","- C42 H30 Br2 O2 -","2","1","DN3053","Shilova, Ekaterina A.; Bougdid, Lahoussine; Pèpe, Gérard; Moustrou, Corinne","6-Bromo-2,2-diphenyl-2<i>H</i>-1-benzopyran","Acta Crystallographica Section E","2007","63","7","o3340","o3340","10.1107/S1600536807030784","","","0.71073","MoKα","","0.0684","0.0438","","","0.0981","0.1149","","","","","","1.1","","","","has coordinates,has Fobs","206172","2020-10-21","18:00:00",""
"2214175","8.8953","0.0002","22.4365","0.0005","9.2114","0.0001","90","","93.921","0.002","90","","1834.1","0.06","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","6-Bromo-5,8-dimethyl-2,2-diphenyl-2H-1-benzopyran","6-Bromo-5,8-dimethyl-2,2-diphenyl-2<i>H</i>-1-benzopyran","","- C23 H19 Br O -","- C23 H19 Br O -","- C92 H76 Br4 O4 -","4","1","DN3054","Shilova, Ekaterina A.; Bougdid, Lahoussine; Pèpe, Gérard; Moustrou, Corinne","6-Bromo-5,8-dimethyl-2,2-diphenyl-2<i>H</i>-1-benzopyran","Acta Crystallographica Section E","2007","63","7","o3341","o3341","10.1107/S1600536807030796","","","0.71073","MoKα","","0.0678","0.0462","","","0.1033","0.1146","","","","","","1.029","","","","has coordinates,has Fobs","209311","2020-10-21","18:00:00",""
"2214176","9.1219","0.0018","19.005","0.004","28.251","0.006","90","","95.28","0.03","90","","4876.9","1.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","{Tris[2-(1H-imidazol-2-ylmethyleneamino-κ^2^N,N')ethyl]amine}cobalt(II) bis(perchlorate) hemihydrate","","- C18 H24 Cl2 Co N10 O8.5 -","- C18 H24 Cl2 Co N10 O8.5 -","- C144 H192 Cl16 Co8 N80 O68 -","8","2","ER2032","He, Hongshan","{Tris[2-(1<i>H</i>-imidazol-2-ylmethyleneamino-κ^2^<i>N</i>,<i>N</i>')ethyl]amine}cobalt(II) bis(perchlorate) hemihydrate","Acta Crystallographica Section E","2007","63","7","m1933","m1934","10.1107/S1600536807028851","","","0.71073","MoKα","","0.1875","0.0768","","","0.136","0.1951","","","","","","1.051","","","","has coordinates,has Fobs","189124","2020-10-21","18:00:00",""
"2214177","7.1533","0.0012","9.5708","0.0016","13.155","0.002","97.048","0.003","90.214","0.002","97.777","0.003","885.4","0.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Diamminebis[5-(pyrimidin-2-yl-κ<i>N</i>^1^)tetrazolato-κ<i>N</i>^1^]copper(II) dihydrate","","- C10 H16 Cu N14 O2 -","- C10 H16 Cu N14 O2 -","- C20 H32 Cu2 N28 O4 -","2","1","ER2035","Liu, Ju-Tao; Fan, Sheng-Di","Diamminebis[5-(pyrimidin-2-yl-κ<i>N</i>^1^)tetrazolato-κ<i>N</i>^1^]copper(II) dihydrate","Acta Crystallographica Section E","2007","63","7","m1942","m1942","10.1107/S1600536807028668","","","0.71073","MoKα","","0.0429","0.0357","","","0.0908","0.0967","","","","","","1.043","","","","has coordinates,has Fobs","194623","2020-10-21","18:00:00",""
"2214178","12.5939","0.0009","8.7423","0.0006","14.1918","0.001","90","","106.245","0.001","90","","1500.13","0.18","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dipyridinebis[4,4,4-trifluoro-1-(4-nitrophenyl)butane-1,3-dionato]copper(II)","","- C30 H20 Cu F6 N4 O8 -","- C30 H20 Cu F6 N4 O8 -","- C60 H40 Cu2 F12 N8 O16 -","2","0.5","ER2036","Ling Fan; Dun-Jia Wang; Jing Zheng","Dipyridinebis[4,4,4-trifluoro-1-(4-nitrophenyl)butane-1,3-dionato]copper(II)","Acta Crystallographica Section E","2007","63","7","m1980","m1980","10.1107/S1600536807029649","","","0.71073","MoKα","","0.0712","0.0466","","","0.0992","0.1081","","","","","","0.97","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214179","7.0696","0.0019","12.473","0.003","13.555","0.004","90","","90","","90","","1195.3","0.6","291","2","291","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(1S,3R)-3-monoamino-1-camphoric acid nitrate","(1<i>S</i>,3<i>R</i>)-1-Carboxy-2,2,3-trimethylcyclopentane-1-ammonium nitrate","","- C9 H18 N2 O5 -","- C9 H18 N2 O5 -","- C36 H72 N8 O20 -","4","1","EZ2077","Qian, Hui-Fen; Huang, Wei; Liu, Jian-Lan","(1<i>S</i>,3<i>R</i>)-1-Carboxy-2,2,3-trimethylcyclopentane-1-ammonium nitrate","Acta Crystallographica Section E","2007","63","7","o3070","o3072","10.1107/S1600536807025809","","","0.71073","MoKα","","0.083","0.059","","","0.119","0.13","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214180","10.1078","0.0004","6.6686","0.0002","17.3716","0.0006","90","","94","0.003","90","","1168.08","0.07","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Theophylline dimethyl sulfoxide solvate","","- C9 H14 N4 O3 S -","- C9 H14 N4 O3 S -","- C36 H56 N16 O12 S4 -","4","1","EZ2079","Christine Cardin; Yu Gan; Thomas Lewis","Low-temperature determination of theophylline dimethyl sulfoxide solvate","Acta Crystallographica Section E","2007","63","7","o3175","o3175","10.1107/S1600536807028267","","","0.71073","MoKα","","0.046","0.039","","","0.099","0.103","","","","","","1.14","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214181","6.1269","0.0002","10.2848","0.0004","21.136","0.0009","90","","90","","90","","1331.86","0.09","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","1-Pivaloyl-3-(3-chlorophenyl)thiourea","1-(3-Chlorophenyl)-3-pivaloylthiourea","","- C12 H15 Cl N2 O S -","- C12 H15 Cl N2 O S -","- C48 H60 Cl4 N8 O4 S4 -","4","1","EZ2082","Shoukat, Noreen; Rauf, M. Khawar; Bolte, Michael; Badshah, Amin","1-(3-Chlorophenyl)-3-pivaloylthiourea","Acta Crystallographica Section E","2007","63","7","o3207","o3207","10.1107/S1600536807028280","","","0.71073","MoKα","","0.023","0.023","","","0.062","0.062","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214182","7.3843","0.0015","10.282","0.002","10.757","0.002","65.54","0.03","75.14","0.03","84.22","0.03","718.6","0.3","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","1-Methyl-3-(1-methyl-2,3-dihydro-1H-indol-2-yl)-1H-indole","","- C18 H18 N2 -","- C18 H18 N2 -","- C36 H36 N4 -","2","1","EZ2083","Ao Chen; Jian-Wei Zou; Wen-Na Zhao","1-Methyl-3-(1-methyl-2,3-dihydro-1<i>H</i>-indol-2-yl)-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","7","o3229","o3229","10.1107/S1600536807028243","","","0.71073","MoKα","","0.089","0.063","","","0.196","0.215","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214183","9.4951","0.0006","21.436","0.001","18.885","0.001","90","","114.011","0.005","90","","3511.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","rac-Ethyl (8a<i>R</i>,9a<i>S</i>)-8a-methyl-8-(4-nitrophenyl)-9a,10- diphenyl-12-(p-tolyl)-9,9a-dihydro-8a<i>H</i>-di-1,2,4- triazolo[4,3-a:3',4'-d][1,5]benzodiazepine-6-carboxylate","","- C40 H35 N7 O4 -","- C40 H35 N7 O4 -","- C160 H140 N28 O16 -","4","1","FB2049","Boudina, Aicha; Baouid, Abdesselam; Hasnaoui, Aissa; Eddike, Driss; Tillard, Monique","<i>rac</i>-Ethyl (8a<i>R</i>,9a<i>S</i>)-8a-methyl-8-(4-nitrophenyl)-9a,10-diphenyl-12-(<i>p</i>-tolyl)-9,9a-dihydro-8a<i>H</i>-di-1,2,4-triazolo[4,3-<i>a</i>:3',4'-<i>d</i>][1,5]benzodiazepine-6-carboxylate","Acta Crystallographica Section E","2007","63","7","o3301","o3302","10.1107/S1600536807030103","","","0.71073","MoKα","","0.0982","0.0773","","","0.1956","0.2129","","","","","","1.137","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214184","26.634","0.003","5.6454","0.0007","18.337","0.002","90","","131.03","0.002","90","","2079.9","0.4","299","2","299","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Pyridine-2-carboxamidrazonium hydrogenoxalate","","- C8 H10 N4 O4 -","- C8 H10 N4 O4 -","- C64 H80 N32 O32 -","8","1","FB2050","Wang, Min; Hu, Bo; Wang, Xiao-Yan; Wang, Cheng-Gang; Cao, Min-Na","Pyridine-2-carboxamidrazonium hydrogenoxalate","Acta Crystallographica Section E","2007","63","7","o3215","o3215","10.1107/S160053680702822X","","","0.71073","MoKα","","0.0929","0.0581","","","0.1192","0.1366","","","","","","0.99","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214185","7.9351","0.0001","11.943","0.0002","12.6558","0.0002","70.432","0.001","79.34","0.001","71.023","0.001","1064.78","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 1-(4-<i>tert</i>-butylbenzyl)-3-(4-chlorophenyl)-1<i>H</i>-pyrazole-5- carboxylate","","- C23 H25 Cl N2 O2 -","- C23 H25 Cl N2 O2 -","- C46 H50 Cl2 N4 O4 -","2","1","FB2052","Xia, Yong; Dong, Wen-Liang; Ding, Xiao-Ling; Zhao, Bao-Xiang","Ethyl 1-(4-<i>tert</i>-butylbenzyl)-3-(4-chlorophenyl)-1<i>H</i>-pyrazole-5-carboxylate","Acta Crystallographica Section E","2007","63","7","o3257","o3257","10.1107/S1600536807028814","","","0.71073","MoKα","","0.0827","0.0589","","","0.1745","0.1975","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214186","3.9935","0.0004","15.4223","0.0013","11.1724","0.0008","90","","99.71","0.007","90","","678.24","0.1","90","1","90","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Methoxy-1-methyl-4-nitro-1H-imidazole","","- C5 H7 N3 O3 -","- C5 H7 N3 O3 -","- C20 H28 N12 O12 -","4","1","FB2054","Kubicki, Maciej; Wagner, Paweł","2-Methoxy-1-methyl-4-nitro-1<i>H</i>-imidazole","Acta Crystallographica Section E","2007","63","7","o3120","o3120","10.1107/S1600536807027201","","","0.71073","MoKα","","0.0399","0.0333","","","0.0873","0.0913","","","","","","1.084","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214187","6.8771","0.0001","7.2198","0.0001","17.7271","0.0002","90","","90","","90","","880.17","0.02","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(8aS)-8,8a-Dihydrofuro[3,2-f]indolizine-6,9(4H,7H)-dione","","- C10 H9 N O3 -","- C10 H9 N O3 -","- C40 H36 N4 O12 -","4","1","FJ2027","Švorc, Ľubomír; Vrábel, Viktor; Kožíšek, Jozef; Marchalín, Štefan; Šafář, Peter","(8a<i>S</i>)-8,8a-Dihydrofuro[3,2-<i>f</i>]indolizine-6,9(4<i>H</i>,7<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","7","o3180","o3181","10.1107/S1600536807028176","","","0.71073","MoKα","","0.0565","0.0419","","","0.1087","0.1197","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214188","6.6298","0.0007","14.6001","0.0018","18.984","0.003","90","","90","","90","","1837.6","0.4","295","2","","","","","","","","","","3","P c m n","-P 2n 2ac","62","","cis-2,2-Dimethyl-1,3-diphenyl-2,3-dihydro-1<i>H</i>-benzo[<i>c</i>]silole","","- C22 H22 Si -","- C22 H22 Si -","- C88 H88 Si4 -","4","0.5","FJ2035","Amanda J. Watson; Stephen K. Cope; Daniel S. Jones; Craig A. Ogle","<i>cis</i>-2,2-Dimethyl-1,3-diphenyl-2,3-dihydro-1<i>H</i>-benzo[<i>c</i>]silole","Acta Crystallographica Section E","2007","63","7","o3346","o3346","10.1107/S1600536807030620","","","1.54184","CuKα","","","0.0448","","","","0.1423","","","","","","1.051","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214189","7.758","0.002","28.981","0.007","9.64","0.003","90","","97.84","0.015","90","","2147.1","1","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(μ-1,4-Dithiane-κ^2^S:S')bis[μ-3,3'-(naphthalene-2,7- diyldimethylene)bis(pentane-2,4-dionato)-κ^4^O,O':O'',O''']dicopper,","","- C48 H52 Cu2 O8 S2 -","- C48 H52 Cu2 O8 S2 -","- C96 H104 Cu4 O16 S4 -","2","0.5","FJ2036","Burton, Sylvester; Fronczek, Frank R.; Maverick, Andrew W.","A cofacial binuclear copper(II) complex with a bridging 1,4-dithiane ligand","Acta Crystallographica Section E","2007","63","7","m1977","m1978","10.1107/S1600536807029583","","","0.71073","MoKα","","0.081","0.05","","","0.098","0.11","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214190","9.8631","0.0009","3.718","0.0003","12.9609","0.0009","90","","99.643","0.009","90","","468.57","0.07","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,4-diamino-1,3,5-triazine","","- C3 H5 N5 -","- C3 H5 N5 -","- C12 H20 N20 -","4","1","FJ2037","Gustavo Portalone","2,4-Diamino-1,3,5-triazine (guanamine)","Acta Crystallographica Section E","2007","63","7","o3232","o3232","10.1107/S1600536807027407","","","0.71069","MoKα","","0.0474","0.0422","","","0.1243","0.1279","","","","","","1.072","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214191","11.5142","0.0004","14.544","0.0005","21.5825","0.0008","90","","104.795","0.002","90","","3494.4","0.2","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichloridobis[N-(diphenylphosphino)isopropylamine-κP]platinum(II) chloroform solvate","","- C31 H37 Cl5 N2 P2 Pt -","- C31 H37 Cl5 N2 P2 Pt -","- C124 H148 Cl20 N8 P8 Pt4 -","4","1","FJ2039","Brown, Gavin M.; Elsegood, Mark R. J.; Evans, James R.; Sanchez Ballester, Noelia M.; Smith, Martin B.; Blann, Kevin","Dichloridobis[<i>N</i>-(diphenylphosphino)isopropylamine-κ<i>P</i>]platinum(II) chloroform solvate","Acta Crystallographica Section E","2007","63","7","m1898","m1899","10.1107/S1600536807028206","","","0.71073","MoKα","","0.0327","0.0217","","","0.0402","0.0435","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214192","15.2171","0.0013","4.9253","0.0004","20.0906","0.0016","90","","93.021","0.003","90","","1503.7","0.2","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N'-[(1E)-1-(2-Hydroxy-5-methylphenyl)ethylidene]-4-methoxybenzohydrazide","","- C17 H18 N2 O3 -","- C17 H18 N2 O3 -","- C68 H72 N8 O12 -","4","1","FJ2040","Jian-Guo Chang; Chang-You Ji","<i>N</i>'-[(1<i>E</i>)-1-(2-Hydroxy-5-methylphenyl)ethylidene]-4-methoxybenzohydrazide","Acta Crystallographica Section E","2007","63","7","o3212","o3212","10.1107/S1600536807027882","","","0.71073","MoKα","","0.0945","0.0513","","","0.145","0.1784","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214193","4.811","0.001","15.373","0.003","12.509","0.002","90","","90.99","0.03","90","","925","0.3","90","0.2","90","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4,6-Trimethylanilinium chloride","","- C9 H14 Cl N -","- C9 H14 Cl N -","- C36 H56 Cl4 N4 -","4","1","FL2132","Long, Sihui; Siegler, Maxime; Li, Tonglei","2,4,6-Trimethylanilinium chloride","Acta Crystallographica Section E","2007","63","7","o3080","o3080","10.1107/S1600536807025718","","","0.71073","MoKα","","0.0851","0.0487","","","0.1228","0.1378","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214194","11.0514","0.0002","10.062","0.0002","11.278","0.0002","90","","113.261","0.0011","90","","1152.17","0.04","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","S-quinolin-2-ylmethyldithiocarbazate","","- C11 H11 N3 S2 -","- C11 H11 N3 S2 -","- C44 H44 N12 S8 -","4","1","FL2133","How, Fiona N.-F.; Watkin, David J.; Crouse, Karen A.; M. Ibrahim M. Tahir","<i>S</i>-Quinolin-2-ylmethyldithiocarbazate","Acta Crystallographica Section E","2007","63","7","o3137","o3138","10.1107/S1600536807024609","","","0.71073","MoKα","","0.0375","0.0375","","0.0788","0.0788","0.0788","","","","","","0.9705","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214195","10.9734","0.0007","9.229","0.0006","20.7002","0.0014","90","","102.398","0.002","90","","2047.5","0.2","125","2","125","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","<i>cis</i>-Dichloridobis(dimethoxyphenylphosphino)platinum(II)","","- C16 H22 Cl2 O4 P2 Pt -","- C16 H22 Cl2 O4 P2 Pt -","- C64 H88 Cl8 O16 P8 Pt4 -","4","0.5","GG2016","Slawin, Alexandra M. Z.; Waddell, Paul G.; Woollins, J. Derek","<i>cis</i>-Dichloridobis(dimethoxyphenylphosphino)platinum(II)","Acta Crystallographica Section E","2007","63","7","m2017","m2017","10.1107/S1600536807030966","","","0.71073","MoKα","","0.0246","0.0214","","","0.0418","0.0425","","","","","","1.065","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214196","12.4262","0.0006","13.628","0.0007","15.0494","0.0008","90","","93.5316","0.0011","90","","2543.7","0.2","125.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>cis</i>-Dichloridobis(methoxydiphenylphosphino)platinum(II)","","- C26 H26 Cl2 O2 P2 Pt -","- C26 H26 Cl2 O2 P2 Pt -","- C104 H104 Cl8 O8 P8 Pt4 -","4","1","GG2017","Slawin, Alexandra M. Z.; Waddell, Paul G.; Woollins, J. Derek","<i>cis</i>-Dichloridobis(methoxydiphenylphosphino)platinum(II)","Acta Crystallographica Section E","2007","63","7","m2018","m2018","10.1107/S1600536807031005","","","0.71075","MoKα","","","0.0405","","","","0.0621","","","","","","1.133","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214197","8.5966","0.0017","8.8939","0.0018","21.872","0.004","92.08","0.03","99.69","0.03","108.92","0.03","1551.9","0.6","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","Tetraaquabis[2-(3-benzoylphenyl)propanoato-κ<i>O</i>]cobalt(II) monohydrate","","- C32 H36 Co O11 -","- C32 H36 Co O11 -","- C64 H72 Co2 O22 -","2","1","GK2071","Zhu-Yan Zhang; Peng-Gang Chen; Zhao-Peng Deng; Nan Yu; Bing-Yi Liu","Tetraaquabis[2-(3-benzoylphenyl)propanoato-κ<i>O</i>]cobalt(II) monohydrate","Acta Crystallographica Section E","2007","63","7","m1900","m1901","10.1107/S1600536807027572","","","0.71073","MoKα","","0.1036","0.0494","","","0.1259","0.1772","","","","","","1.047","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214198","5.6638","0.0002","15.1845","0.0005","15.5994","0.0004","90","","90","","90","","1341.58","0.07","183","2","183","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","N-salicylidene-3-(2-pyridyl)-propionic acid hydrazide","<i>N</i>'-(2-Hydroxybenzylidene)-3-(2-pyridyl)propionohydrazide","","- C15 H15 N3 O2 -","- C15 H15 N3 O2 -","- C60 H60 N12 O8 -","4","1","GK2074","Roth, Arne; Buchholz, Axel; Gärtner, Martin; Görls, Helmar; Plass, Winfried","3-(2-Pyridyl)-<i>N</i>'-salicylidenepropionohydrazide","Acta Crystallographica Section E","2007","63","7","o3073","o3073","10.1107/S1600536807025664","","","0.71073","MoKα","","0.0432","0.0349","","","0.0814","0.0866","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214199","8.0314","0.0006","8.7673","0.0007","8.9017","0.0007","97.74","0.001","108.721","0.001","107.289","0.001","548.17","0.07","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","5-Ethyl-2-methyl-3-methylsulfinyl-1-benzofuran","","- C12 H14 O2 S -","- C12 H14 O2 S -","- C24 H28 O4 S2 -","2","1","GK2078","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","5-Ethyl-2-methyl-3-methylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2007","63","7","o3166","o3166","10.1107/S160053680702716X","","","0.71073","MoKα","","0.0423","0.0409","","","0.1061","0.1073","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214200","8.017","0.0016","9.242","0.0018","14.088","0.003","90","","94.62","0.03","90","","1040.4","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(2,4-dibromo-6-cyclopropyliminomethylphenolato)nickel(II)","","- C20 H16 Br4 N2 Ni O2 -","- C20 H16 Br4 N2 Ni O2 -","- C40 H32 Br8 N4 Ni2 O4 -","2","0.5","GK2080","Li-Zhong Li; Li-Hua Wang","Bis[2,4-dibromo-6-(cyclopropyliminomethyl)phenolato]nickel(II)","Acta Crystallographica Section E","2007","63","7","m1791","m1791","10.1107/S160053680702689X","","","0.71073","MoKα","","0.0542","0.0362","","","0.0766","0.0837","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214201","11.857","0.002","11.562","0.002","13.84","0.003","90","","111.72","0.03","90","","1762.6","0.7","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(hydrazinocarbonyl)benzenesulfonamide","","- C7 H9 N3 O3 S -","- C7 H9 N3 O3 S -","- C56 H72 N24 O24 S8 -","8","1","GK2082","Shu-Yan Wang; Wan-Cheng Guo; Ning Ma","2-(Hydrazinocarbonyl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","7","o3192","o3192","10.1107/S1600536807027584","","","0.71073","MoKα","","0.0289","0.0264","","","0.0693","0.0706","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214202","10.951","0.002","11.885","0.002","12.916","0.002","90","","90","","90","","1681.1","0.5","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4,5-Diaza-9,9'-spirobifluorene","","- C23 H14 N2 -","- C23 H14 N2 -","- C92 H56 N8 -","4","1","GK2087","Min Hong; Chao Teng; Jin Zhu","4,5-Diaza-9,9'-spirobifluorene","Acta Crystallographica Section E","2007","63","7","o3304","o3304","10.1107/S1600536807029820","","","0.71073","MoKα","","0.0706","0.0429","","","0.087","0.0941","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214203","11.3261","0.0018","6.318","0.0012","7.3389","0.0011","90","","90","","90","","525.16","0.15","150","1","150","1","","","","","","","","4","P n m a","-P 2ac 2n","62","2-pyrazinic acid","pyrazine-2-carboxylic acid","","- C5 H4 N2 O2 -","- C5 H4 N2 O2 -","- C20 H16 N8 O8 -","4","0.5","GK2089","Małecki, Jan Grzegorz; Kruszynski, Rafal; Kusz, Joachim","The orthorhombic polymorph of pyrazine-2-carboxylic acid revisited","Acta Crystallographica Section E","2007","63","7","o3300","o3300","10.1107/S1600536807030036","","","0.71073","MoKα","","0.0467","0.0301","","","0.0775","0.0833","","","","","","0.961","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214204","5.5806","0.0003","6.0026","0.0004","9.7951","0.0006","98.823","0.003","97.302","0.004","116.858","0.003","281.99","0.03","293","2","293","2","","","","","","","","6","P 1","P 1","1","","Bis[(<i>R</i>)-lactamido-κ^2^<i>O</i>,<i>O</i>']boron(III) bromide","","- C6 H12 B Br N2 O4 -","- C6 H12 B Br N2 O4 -","- C6 H12 B Br N2 O4 -","1","1","GW2009","Bekaert, Alain; Lemoine, Pascale; Brion, Jean Daniel; Viossat, Bernard","Bis[(<i>R</i>)-lactamido-κ^2^<i>O</i>,<i>O</i>']boron(III) bromide","Acta Crystallographica Section E","2007","63","7","o3187","o3189","10.1107/S1600536807027158","","","0.71073","MoKα","","0.0323","0.0321","","","0.0835","0.0837","","","","","","1.036","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214205","17.034","0.002","9.0682","0.0009","11.832","0.002","90","","96.61","0.02","90","","1815.5","0.4","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Pyridinium 4-[(1<i>E</i>)-3-oxo-3-phenylprop-1-en-1-yl]benzenesulfonate","","- C20 H17 N O4 S -","- C20 H17 N O4 S -","- C80 H68 N4 O16 S4 -","4","1","GW2010","Andrighetti-Fröhner, Carla Regina; Nunes, Ricardo José; da Silva, Luiz Everson; Simões, Cláudia Maria Oliveira; Foro, Sabine","Pyridinium 4-[(1<i>E</i>)-3-oxo-3-phenylprop-1-en-1-yl]benzenesulfonate","Acta Crystallographica Section E","2007","63","7","o3156","o3157","10.1107/S1600536807027146","","","1.5418","CuKα","","0.0528","0.0466","","","0.1253","0.1304","","","","","","1.085","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214206","8.6219","0.0015","10.4637","0.0018","10.787","0.0019","94.045","0.002","112.017","0.003","100.632","0.002","876.2","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","3-(4-Fluorophenyl)-1,5-di-2-pyridylpentane-1,5-dione","","- C21 H17 F N2 O2 -","- C21 H17 F N2 O2 -","- C42 H34 F2 N4 O4 -","2","1","GW2012","Qing-Qing Shao; Dong-Qin Chen; Feng Shi","3-(4-Fluorophenyl)-1,5-di-2-pyridylpentane-1,5-dione","Acta Crystallographica Section E","2007","63","7","o3112","o3112","10.1107/S1600536807026530","","","0.71073","MoKα","","0.099","0.0467","","","0.0934","0.1183","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214207","11.5591","0.0002","11.745","0.0002","12.5081","0.0002","92.177","0.001","105.457","0.001","109.182","0.0008","1531.06","0.05","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Aquamalonato(1,10-phenanthroline)copper(II) sesquihydrate","","- C15 H15 Cu N2 O6.5 -","- C15 H15 Cu N2 O6.5 -","- C60 H60 Cu4 N8 O26 -","4","2","HB2396","Diallo, Madina; Dieng, Moussa; Gaye, Mohamed; Sall, Abdou Salam; Barry, Aliou Hamady; Beghidja Chahrazed","Aquamalonato(1,10-phenanthroline)copper(II) sesquihydrate","Acta Crystallographica Section E","2007","63","7","m1810","m1811","10.1107/S160053680702332X","","","0.71069","MoKα","","0.0746","0.0455","","","0.1064","0.1244","","","","","","1.065","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214208","8.5316","0.0013","11.1801","0.0017","11.8021","0.0018","82.777","0.003","81.232","0.002","85.712","0.003","1102","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","2-(3,4-Dimethoxyphenyl)-3-hydroxybut-2-enenitrile","","- C12 H13 N O3 -","- C12 H13 N O3 -","- C48 H52 N4 O12 -","4","2","HB2405","Shang, Zhen-Hua; Yu, Hai-Jun","2-(3,4-Dimethoxyphenyl)-3-hydroxybut-2-enenitrile","Acta Crystallographica Section E","2007","63","7","o3286","o3286","10.1107/S1600536807029455","","","0.71073","MoKα","","0.0702","0.046","","","","0.1471","","","","","","1.027","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214209","11.428","0.003","9.816","0.002","19.774","0.004","90","","97.098","0.004","90","","2201.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(μ-biphenyl-2,2'-dicarboxylato)bis[(2,2'-bipyridine)copper(II)] tetrahydrate","","- C48 H40 Cu2 N4 O12 -","- C48 H40 Cu2 N4 O12 -","- C96 H80 Cu4 N8 O24 -","2","0.5","HB2407","He, Hong-Yin; Zhou, Yi-Li; Gao, Jin","Bis(μ-biphenyl-2,2'-dicarboxylato)bis[(2,2'-bipyridine)copper(II)] tetrahydrate","Acta Crystallographica Section E","2007","63","7","m2007","m2007","10.1107/S1600536807030747","","","0.71073","MoKα","","0.0935","0.0577","","","0.1165","0.1315","","","","","","1.024","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2214210","18.819","0.003","10.581","0.002","19.926","0.003","90","","102.635","0.002","90","","3871.7","1.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Heptaguanidinium sodium bis(pentaaquatetracosaoxoheptamolybdocobaltate) octahydrate","","- C7 H78 Co2 Mo14 N21 Na O66 -","- C7 H78 Co2 Mo14 N21 Na O66 -","- C14 H156 Co4 Mo28 N42 Na2 O132 -","2","0.5","HB2415","Chuan-Bi Li","Heptaguanidinium sodium bis(pentaaquatetracosaoxoheptamolybdocobaltate) octahydrate","Acta Crystallographica Section E","2007","63","7","m1911","m1912","10.1107/S1600536807028772","","","0.71073","MoKα","","0.0862","0.0413","","","0.0752","0.0961","","","","","","0.988","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214211","11.3285","0.0006","11.3285","","23.837","0.001","90","","90","","90","","3059.1","0.2","295","2","295","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","(<i>S</i>)-(+)-2,2'-Bis(2-hydroxy-3-methoxybenzylideneamino)-1,1'-binaphthyl","","- C36 H28 N2 O4 -","- C36 H28 N2 O4 -","- C144 H112 N8 O16 -","4","0.5","HB2421","Chai, Wen-Li; Bi, Wei-Yu; Lü, Xing-Qiang; Song, Ji-Rong; Ng, Seik Weng","(<i>S</i>)-(+)-2,2'-Bis(2-hydroxy-3-methoxybenzylideneamino)-1,1'-binaphthyl","Acta Crystallographica Section E","2007","63","7","o3060","o3060","10.1107/S1600536807025937","","","0.71073","MoKα","","0.081","0.058","","","0.164","0.203","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214212","6.6271","0.0003","12.9233","0.0006","18.5496","0.0009","90","","90","","90","","1588.66","0.13","295","2","295","2","","","","","","","","5","P b c m","-P 2c 2b","57","","Poly[hydronium [dysprosium(III)-μ~3~-(ethylenediaminetetraacetato-\ κ^8^N,N',O,O',O'',O''':O'''':O''''')] monohydrate]","","- C10 H17 Dy N2 O10 -","- C10 H12 Dy N2 O10 -","- C40 H48 Dy4 N8 O40 -","4","0.5","HB2422","You, Xiu-Li; Ng, Seik Weng","Poly[hydronium [dysprosium(III)-μ~3~-(ethylenediaminetetraacetato-κ^8^<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''':<i>O</i>'''':<i>O</i>''''')] monohydrate]","Acta Crystallographica Section E","2007","63","7","m1819","m1819","10.1107/S1600536807025044","","","0.71073","MoKα","","0.018","0.017","","","0.05","0.05","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214213","17.527","0.002","7.2674","0.001","23.203","0.003","90","","94.826","0.002","90","","2945","0.6","292","2","292","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(dipyrido[3,2-a:2',3'-c]phenazine)sulfatoiron(II) monohydrate","","- C36 H22 Fe N8 O5 S -","- C36 H22 Fe N8 O5 S -","- C144 H88 Fe4 N32 O20 S4 -","4","0.5","HB2425","Qing-Wei Wang; Xiao-Hong Zhao; Zhi-Xing Yu; Jian Wang","Bis(dipyrido[3,2-<i>a</i>:2',3'-<i>c</i>]phenazine)sulfatoiron(II) monohydrate","Acta Crystallographica Section E","2007","63","7","m1861","m1861","10.1107/S1600536807027675","","","0.71073","MoKα","","0.0763","0.0492","","","0.1232","0.1393","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214214","11.91","0.002","11.199","0.002","19.507","0.004","90","","92.05","0.03","90","","2600.2","0.8","292","2","292","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(2-Amino-3,5-dimethylbenzenesulfonato-κN)bis(3-methylisoquinoline- κN)silver(I)","","- C28 H28 Ag N3 O3 S -","- C28 H28 Ag N3 O3 S -","- C112 H112 Ag4 N12 O12 S4 -","4","1","HB2426","Li, Yu-Jie; Shangguan, Shao-Ping; Dong, Xian-Wu","(2-Amino-3,5-dimethylbenzenesulfonato-κ<i>N</i>)bis(3-methylisoquinoline-κ<i>N</i>)silver(I)","Acta Crystallographica Section E","2007","63","7","m1806","m1806","10.1107/S1600536807025275","","","0.71073","MoKα","","0.1006","0.0363","","","0.084","0.1157","","","","","","0.905","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2214215","5.9686","0.0009","8.3214","0.0012","19.058","0.003","101.231","0.002","93.417","0.003","107.273","0.002","879.6","0.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","4-(5-Bromo-1,3-dioxoisoindolin-2-yl)benzoic acid N,N-dimethylformamide solvate","","- C18 H15 Br N2 O5 -","- C18 H15 Br N2 O5 -","- C36 H30 Br2 N4 O10 -","2","1","HB2427","Liang, Zu-Pei; Li, Jian; Yang Hua; Wang, Hong-Liang","4-(5-Bromo-1,3-dioxoisoindolin-2-yl)benzoic acid <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2007","63","7","o3065","o3065","10.1107/S1600536807025913","","","0.71073","MoKα","","0.0647","0.0396","","","0.0952","0.1179","","","","","","1.127","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214216","12.923","0.003","7.3253","0.0017","31.765","0.007","90","","90","","90","","3007","1.2","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-(4-Phenylbenzoyl)-4,5,6,7-tetrahydro-1,2,3-triazolo[1,5-a]pyrimidine","","- C18 H16 N4 O -","- C18 H16 N4 O -","- C144 H128 N32 O8 -","8","1","HB2428","Chu-Yi Yu; Xue-Ning Yuan; Zhi-Tang Huang","3-(4-Phenylbenzoyl)-4,5,6,7-tetrahydro-1,2,3-triazolo[1,5-<i>a</i>]pyrimidine","Acta Crystallographica Section E","2007","63","7","o3064","o3064","10.1107/S1600536807025986","","","0.71073","MoKα","","0.0938","0.0441","","","0.0901","0.1063","","","","","","1.027","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214217","14.644","0.005","7.597","0.003","22.711","0.008","90","","90","","90","","2526.6","1.6","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-Benzoyl-4-methyl-5,6,7-tetrahydro-1,2,3-triazolo[1,5-a]pyrimidine","","- C13 H14 N4 O -","- C13 H14 N4 O -","- C104 H112 N32 O8 -","8","1","HB2429","Chu-Yi Yu; Xue-Ning Yuan; Zhi-Tang Huang","3-Benzoyl-4-methyl-4,5,6,7-tetrahydro-1,2,3-triazolo[1,5-<i>a</i>]pyrimidine","Acta Crystallographica Section E","2007","63","7","o3078","o3078","10.1107/S1600536807025998","","","0.71073","MoKα","","0.0826","0.0407","","","0.0963","0.1155","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214218","7.129","0.003","9.038","0.003","10.846","0.004","75.677","0.005","74.138","0.005","70.16","0.005","623","0.4","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(quinoline-2-carboxylato-κ^2^N,O)magnesium(II) dihydrate methanol disolvate","","- C22 H28 Mg N2 O10 -","- C22 H28 Mg N2 O10 -","- C22 H28 Mg N2 O10 -","1","0.5","HB2431","Xi-Shi Tai; Jie Yin; Ming-Yang Hao","Diaquabis(quinoline-2-carboxylato-κ^2^<i>N</i>,<i>O</i>)magnesium(II) dihydrate methanol disolvate","Acta Crystallographica Section E","2007","63","7","m1850","m1850","10.1107/S1600536807027687","","","0.71073","MoKα","","0.0913","0.0637","","","0.1225","0.1289","","","","","","1.087","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2214219","17.455","0.003","17.455","0.003","38.952","0.003","90","","90","","90","","11868","3","298","2","298","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Tetrakis(1,10-phenanthroline)calcium(II) bis(perchlorate) 4-(dimethylamino)benzaldehyde disolvate","","- C66 H54 Ca Cl2 N10 O10 -","- C66 H54 Ca Cl2 N10 O10 -","- C528 H432 Ca8 Cl16 N80 O80 -","8","0.5","HB2432","Xi-Shi Tai; Jie Yin; Ming-Yang Hao","Tetrakis(1,10-phenanthroline)calcium(II) bis(perchlorate) 4-(dimethylamino)benzaldehyde disolvate","Acta Crystallographica Section E","2007","63","7","m1827","m1827","10.1107/S1600536807027055","","","0.71073","MoKα","","0.2233","0.0785","","","0.1998","0.3877","","","","","","1.126","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214220","10.3458","0.0006","10.3563","0.0006","19.0582","0.0014","81.361","0.006","79.041","0.006","79.987","0.005","1959.7","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Tetrakis(2,2':6',2''-terpyridinium) hexabromidorhenate(IV) bis[aquatetrabromidooxidorhenate(V)] tetrabromide dihydrate","","- C60 H60 Br18 N12 O6 Re3 -","- C60 H60 Br18 N12 O6 Re3 -","- C60 H60 Br18 N12 O6 Re3 -","1","0.5","HB2433","Kochel, Andrzej","Tetrakis(2,2':6',2''-terpyridinium) hexabromidorhenate(IV) bis[aquatetrabromidooxidorhenate(V)] tetrabromide dihydrate","Acta Crystallographica Section E","2007","63","7","m1968","m1968","10.1107/S1600536807029923","","","0.71073","MoKα","","0.0759","0.0358","","","0.0533","0.0623","","","","","","0.938","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214221","4.0384","0.0009","10.406","0.004","12.052","0.003","88.83","0.02","83.981","0.018","82.5","0.02","499.4","0.3","130","0.2","130","0.2","","","","","","","","4","P -1","-P 1","2","","Quinoxaline‒dihydroxyacetic acid (1/1)","","- C10 H10 N2 O4 -","- C10 H10 N2 O4 -","- C20 H20 N4 O8 -","2","1","HB2434","Czapik, Agnieszka; Gdaniec, Maria","Quinoxaline‒dihydroxyacetic acid (1/1)","Acta Crystallographica Section E","2007","63","7","o3081","o3081","10.1107/S1600536807025792","","","0.71073","MoKα","","0.0588","0.05","","","0.1065","0.1088","","","","","","1.225","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214222","19.354","0.004","8.1265","0.0016","22.312","0.004","90","","98.211","0.004","90","","3473.3","1.2","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","6-Chloro-N^2^-propyl-N^4^-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine- 2,4-diamine","","- C14 H26 Cl N5 -","- C14 H26 Cl N5 -","- C112 H208 Cl8 N40 -","8","1","HB2437","Yi-Ping Jiang; Ting Qiu; Liang-En Wang; Jia-Ning Wang","6-Chloro-<i>N</i>^2^-propyl-<i>N</i>^4^-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine","Acta Crystallographica Section E","2007","63","7","o3096","o3096","10.1107/S1600536807025950","","","0.71073","MoKα","","0.1026","0.0611","","","0.1697","0.1995","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214223","6.9269","0.0009","10.7876","0.0014","15.531","0.002","71.966","0.002","78.994","0.002","81.296","0.003","1077.9","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4-[(<i>Z</i>)-(4-Ethoxyphenylamino)(phenyl)methylene]-3-methyl-1-phenyl- 1<i>H</i>-pyrazol-5(4<i>H</i>)-one","","- C25 H23 N3 O2 -","- C25 H23 N3 O2 -","- C50 H46 N6 O4 -","2","1","HB2438","Ma, Rui; Chen, Ying; Song, Zhong-Ying; Bai, Yi-Qiong; Bao, Feng","4-[(<i>Z</i>)-(4-Ethoxyphenylamino)(phenyl)methylene]-3-methyl-1-phenyl-1<i>H</i>-pyrazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","7","o3158","o3158","10.1107/S1600536807026992","","","0.71073","MoKα","","0.1024","0.0526","","","0.1581","0.2112","","","","","","0.695","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214224","6.9591","0.0006","11.8636","0.001","13.1247","0.0011","65.411","0.006","78.892","0.007","75.193","0.006","947.99","0.15","296","","296","","","","","","","","","6","P -1","-P 1","2","","2-[6-(4-Bromophenyl)imidazo[2,1-b]thiazol-3-yl]-N'-(1- ethylpropylidene)acetohydrazide","","- C18 H19 Br N4 O S -","- C18 H19 Br N4 O S -","- C36 H38 Br2 N8 O2 S2 -","2","1","HB2439","Mehmet Akkurt; Şerife Pınar Yalçın; Elif Gürsoy; Nuray Ulusoy Güzeldemirci; Orhan Büyükgüngör","2-[6-(4-Bromophenyl)imidazo[2,1-<i>b</i>]thiazol-3-yl]-<i>N</i>'-(1-ethylpropylidene)acetohydrazide","Acta Crystallographica Section E","2007","63","7","o3103","o3103","10.1107/S1600536807026712","","","0.71073","MoKα","","0.0823","0.0605","","","0.1431","0.1565","","","","","","1.024","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2214225","14.433","0.0004","16.0837","0.0004","16.4677","0.0005","90","","90","","90","","3822.75","0.18","273","2","273","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Bis(5-aminoisoquinoline)diazidozinc(II)","","- C18 H16 N10 Zn -","- C18 H16 N10 Zn -","- C144 H128 N80 Zn8 -","8","1","HB2440","Zhi-Xin Miao; Min Shao; Ming-Xing Li","Bis(5-aminoisoquinoline)diazidozinc(II)","Acta Crystallographica Section E","2007","63","7","m1808","m1808","10.1107/S1600536807026700","","","0.71073","MoKα","","0.0459","0.0293","","","0.068","0.0765","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214226","10.858","0.003","8.279","0.002","22.236","0.006","90","","100.599","0.005","90","","1964.8","0.9","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(1<it>H</it>-1,2,3-Benzotriazol-1-yl)-1-(2-fluorobenzoyl)ethyl 2-chlorobenzoate","","- C22 H15 Cl F N3 O3 -","- C22 H15 Cl F N3 O3 -","- C88 H60 Cl4 F4 N12 O12 -","4","1","HB2441","Zeng, Wu-Lan; Pang, Yan; Zhang, Hua-Xiang","2-(1<i>H</i>-1,2,3-Benzotriazol-1-yl)-1-(2-fluorobenzoyl)ethyl 2-chlorobenzoate","Acta Crystallographica Section E","2007","63","7","o3256","o3256","10.1107/S1600536807026980","","","0.71073","MoKα","","0.1457","0.061","","","0.1646","0.208","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214227","18.4654","0.0003","15.2416","0.0002","28.8619","0.0005","90","","90","","90","","8123","0.2","293","2","","","","","","","","","","8","P b c a","-P 2ac 2ab","61","","[N-(2,5-Dichlorophenylsulfonyl)dithiocarbimato(2-)- κ^2^S,S']bis(triphenylphosphine-κP)nickel(II)","","- C43 H33 Cl2 N Ni O2 P2 S3 -","- C43 H33 Cl2 N Ni O2 P2 S3 -","- C344 H264 Cl16 N8 Ni8 O16 P16 S24 -","8","1","HB2442","Novais, Celice; Guilardi, Silvana; Machado Jr, Iterlandes; Oliveira, Marcelo R. L.","[<i>N</i>-(2,5-Dichlorophenylsulfonyl)dithiocarbimato(2{-})-κ^2^<i>S</i>,<i>S</i>']bis(triphenylphosphine-κ<i>P</i>)nickel(II)","Acta Crystallographica Section E","2007","63","7","m1981","m1982","10.1107/S1600536807029844","","","0.71073","MoKα","","","0.0466","","","","0.1235","","","","","","1.015","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214228","9.6068","0.0006","7.5418","0.0006","36.896","0.002","90","","93.231","0.005","90","","2669","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","8-[3,4-Bis(ethoxycarbonylmethoxy)phenyl]- 4,4-difluoro-1,3,5,7-tetramethyl-4-bora-3a,4a-diaza-<i>s</i>-indacene","","- C27 H31 B F2 N2 O6 -","- C27 H31 B F2 N2 O6 -","- C108 H124 B4 F8 N8 O24 -","4","1","HB2443","Dong-Chuan Wang; Zhi-Zhi Hu; Hai-Jun Chi; Zhi-Qiang Zhang; Xiao-Jun Peng","8-[3,4-Bis(ethoxycarbonylmethoxy)phenyl]-4,4-difluoro-1,3,5,7-tetramethyl-4-bora-3a,4a-diaza-<i>s</i>-indacene","Acta Crystallographica Section E","2007","63","7","o3106","o3106","10.1107/S1600536807026979","","","0.71073","MoKα","","0.1356","0.0563","","","0.1292","0.1521","","","","","","0.931","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2214229","7.7379","0.0005","9.9021","0.0005","15.002","0.001","90","","90","","90","","1149.48","0.12","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[aqua(pyrazine-2-carboxylato)copper(II)]-μ-pyrazine-2-carboxylato]","","- C10 H8 Cu N4 O5 -","- C10 H8 Cu N4 O5 -","- C40 H32 Cu4 N16 O20 -","4","1","HB2444","Gao, Yu-Xiang; Wang, Li-Bin; Niu, Yan-Ling; Hao, Lu-Jiang","<i>catena</i>-Poly[[aqua(pyrazine-2-carboxylato)copper(II)]-μ-pyrazine-2-carboxylato]","Acta Crystallographica Section E","2007","63","7","m2006","m2006","10.1107/S1600536807030528","","","0.71073","MoKα","","0.0451","0.0378","","","0.0922","0.0993","","","","","","1.006","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2214230","10.8177","0.0008","9.8371","0.0007","8.8206","0.0006","90","","98.938","0.001","90","","927.24","0.11","292","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[μ~2~-acetato-μ~2~-benzimidazolato-zinc(II)]","","- C9 H8 N2 O2 Zn -","- C9 H8 N2 O2 Zn -","- C36 H32 N8 O8 Zn4 -","4","1","HB2445","Xiu-Mei Li","Poly[μ~2~-acetato-μ~2~-benzimidazolato-zinc(II)]","Acta Crystallographica Section E","2007","63","7","m1984","m1984","10.1107/S1600536807030309","","","0.71073","MoKα","","0.0271","0.0233","","","0.0612","0.0632","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214231","3.785","0.001","10.787","0.002","14.784","0.003","90","","95.98","0.03","90","","600.3","0.2","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 3-amino-2-cyanoacrylate","","- C5 H6 N2 O2 -","- C5 H6 N2 O2 -","- C20 H24 N8 O8 -","4","1","HB2451","Martin Gróf; Jozef Kožíšek; Viktor Milata; Anton Gatial","Methyl 3-amino-2-cyanoacrylate","Acta Crystallographica Section E","2007","63","7","o3338","o3338","10.1107/S1600536807030516","","","0.71073","MoKα","","0.0521","0.0379","","","0.092","0.1056","","","","","","1.106","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214232","7.4616","0.0013","8.822","0.0016","13.137","0.002","96.634","0.002","100.513","0.002","113.368","0.002","763.4","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","4,5,6,7-Tetrachloro-2-(2-nitrophenyl)isoindoline-1,3-dione","","- C14 H4 Cl4 N2 O4 -","- C14 H4 Cl4 N2 O4 -","- C28 H8 Cl8 N4 O8 -","2","1","HB2452","Li, Jian","4,5,6,7-Tetrachloro-2-(2-nitrophenyl)isoindoline-1,3-dione","Acta Crystallographica Section E","2007","63","7","o3331","o3331","10.1107/S1600536807030632","","","0.71073","MoKα","","0.0336","0.0307","","","0.0785","0.0811","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214233","8.336","0.002","11.009","0.003","12.688","0.004","90","","93.674","0.003","90","","1162","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis(2,2'-biimidazole)cadmium(II) benzene-1,4-dicarboxylate","","- C20 H20 Cd N8 O6 -","- C20 H20 Cd N8 O6 -","- C40 H40 Cd2 N16 O12 -","2","0.5","HB2453","Qing Wei Wang; Wei Liang; Qiong Wu","Diaquabis(2,2'-biimidazole)cadmium(II) benzene-1,4-dicarboxylate","Acta Crystallographica Section E","2007","63","7","m2008","m2008","10.1107/S160053680703067X","","","0.71073","MoKα","","0.0199","0.0184","","","0.0479","0.049","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214234","16.593","0.004","13.816","0.003","8.815","0.002","90","","98.224","0.003","90","","2000","0.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4,5,6,7-Tetrachloro-1,3-dioxoisoindolin-2-yl)benzoic acid N,N-dimethylformamide solvate","","- C18 H12 Cl4 N2 O5 -","- C18 H12 Cl4 N2 O5 -","- C72 H48 Cl16 N8 O20 -","4","1","HB2454","Li, Jian","2-(4,5,6,7-Tetrachloro-1,3-dioxoisoindolin-2-yl)benzoic acid <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2007","63","7","o3332","o3332","10.1107/S1600536807030644","","","0.71073","MoKα","","0.0793","0.0541","","","0.1107","0.1208","","","","","","1.085","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214235","8.889","0.005","10.231","0.005","12.911","0.005","73.287","0.005","72.04","0.005","85.603","0.005","1069.7","0.9","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis[1-ethyl-6-fluoro-7-(4-methylpiperazin-4-yl)-4-oxo-1,4- dihydroquinoline-3-carboxylato]cobalt(II) octahydrate","","- C34 H58 Co F2 N6 O16 -","- C34 H58 Co F2 N6 O16 -","- C34 H58 Co F2 N6 O16 -","1","0.5","HB2455","Zhe An; Jing Huang; Wei Qi","Diaquabis[1-ethyl-6-fluoro-7-(4-methylpiperazin-4-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylato]cobalt(II) octahydrate","Acta Crystallographica Section E","2007","63","7","m2009","m2009","10.1107/S1600536807030681","","","0.71069","MoKα","","0.0384","0.0338","","","0.0924","0.1033","","","","","","1.098","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2214236","16.885","0.002","7.7823","0.0011","21.974","0.003","90","","90","","90","","2887.5","0.7","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4,5,6,7-Tetrachloro-2-hydroxyisoindoline-1,3-dione N,N-dimethylformamide solvate","","- C11 H8 Cl4 N2 O4 -","- C11 H8 Cl4 N2 O4 -","- C88 H64 Cl32 N16 O32 -","8","1","HB2456","Li, Jian","4,5,6,7-Tetrachloro-2-hydroxyisoindoline-1,3-dione <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2007","63","7","o3333","o3333","10.1107/S1600536807030656","","","0.71073","MoKα","","0.044","0.0353","","","0.0885","0.0946","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214237","9.4091","0.0008","11.4405","0.0009","11.9354","0.001","90.08","0.002","94.746","0.002","102.044","0.002","1251.96","0.18","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","2-Dipentylamino-4-(4-methoxybenzylidene)-1-phenyl-1H-imidazol-5(4H)-one","","- C27 H35 N3 O2 -","- C27 H35 N3 O2 -","- C54 H70 N6 O4 -","2","1","HB2457","Ma, Rui; Song, Zhong-Ying; Liu, Yan; Bai, Yi-Qiong; Bao, Feng","2-Dipentylamino-4-(4-methoxybenzylidene)-1-phenyl-1<i>H</i>-imidazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","7","o3336","o3336","10.1107/S1600536807030668","","","0.71073","MoKα","","0.1725","0.0633","","","0.1448","0.1829","","","","","","0.817","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214238","9.229","0.001","10.225","0.001","11.966","0.002","84.51","0.002","83.261","0.002","73.667","0.001","1073.8","0.2","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","Tetrabenzimidazolium hexacosaoxidooctamolybdate","","- C28 H28 Mo8 N8 O26 -","- C28 H28 Mo8 N8 O26 -","- C28 H28 Mo8 N8 O26 -","1","0.5","HB2458","Wen Zhi; Zhan-Guo Zong; Jie Gong; Chuan-Bi Li","Tetrabenzimidazolium hexacosaoxidooctamolybdate(VI)","Acta Crystallographica Section E","2007","63","7","m2002","m2002","10.1107/S1600536807030735","","","0.71073","MoKα","","0.0202","0.0169","","","0.0391","0.0407","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214239","7.7094","0.0007","10.5939","0.0009","14.8307","0.0013","72.274","0.0015","83.067","0.0016","74.258","0.0015","1109.52","0.17","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","2-Hydroxy-6-[(m-tolyliminio)methyl]phenolate","","- C14 H13 N O2 -","- C14 H13 N O2 -","- C56 H52 N4 O8 -","4","2","HG2201","Shuja, Shaukat; Ali, Saqib; Khalid, Nasir; Meetsma, Auke","2-Hydroxy-6-[(<i>m</i>-tolyliminio)methyl]phenolate","Acta Crystallographica Section E","2007","63","7","o3162","o3164","10.1107/S1600536807012561","","","0.71073","MoKα","","0.073","0.0475","","","0.1149","0.1272","","","","","","0.992","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214240","20.136","0.005","7.8079","0.0014","18.31","0.003","90","","118.834","0.002","90","","2521.8","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(4,4'-Bipyridyl-κN)[4'-(4-pyridyl)pyridinium-κN^1'^]tetrakis(nitrato- κ^2^N,N')europium(III)","","- C20 H17 Eu N8 O12 -","- C20 H17 Eu N8 O12 -","- C80 H68 Eu4 N32 O48 -","4","0.5","HG2235","Zeng, Xi-Rui; Liu, Yin-Qiu; Huang Lin; Xu, Ya-Ping","(4,4'-Bipyridyl-κ<i>N</i>)tetrakis(nitrato-κ^2^<i>N</i>,<i>N</i>')[4-(4-pyridyl)pyridinium-κ<i>N</i>^1^]europium(III)","Acta Crystallographica Section E","2007","63","7","m1929","m1929","10.1107/S1600536807022982","","","0.71073","MoKα","","0.0185","0.0179","","","0.0487","0.0489","","","","","","1.019","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214241","5.555","0.0005","8.9606","0.0008","16.6586","0.0016","101.698","0.002","98.907","0.002","92.186","0.002","800.11","0.13","223","2","223","2","","","","","","","","3","P -1","-P 1","2","","(+)-(1R,2S,3R)-2-[(Benzyloxycarbonyl)methyl]-3-phenylcyclopropanecarboxylic acid","","- C19 H18 O4 -","- C19 H18 O4 -","- C38 H36 O8 -","2","1","HG2238","Avery, Thomas D.; Greatrex, Ben W.; Taylor, Dennis K.; Tiekink, Edward R. T.","(+)-(1<i>R</i>,2<i>S</i>,3<i>R</i>)-2-[(Benzyloxycarbonyl)methyl]-3-phenylcyclopropanecarboxylic acid","Acta Crystallographica Section E","2007","63","7","o3344","o3344","10.1107/S1600536807030838","","","0.71069","MoKα","","0.065","0.048","","","0.13","0.149","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214242","14.6504","0.0016","5.5565","0.0006","14.7565","0.0015","90","","106.628","0.002","90","","1151","0.2","223","2","223","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(+)-(5S)-5-[(1S)-2-Benzoyl-1-hydroxyethyl]-1,2,3,4-tetrahydrofuran-2-one","","- C13 H14 O4 -","- C13 H14 O4 -","- C52 H56 O16 -","4","1","HG2239","Cuthbert, Julie A.; Taylor, Dennis K.; Tiekink, Edward R. T.","(+)-(5<i>S</i>)-5-[(1<i>S</i>)-2-Benzoyl-1-hydroxyethyl]-1,2,3,4-tetrahydrofuran-2-one","Acta Crystallographica Section E","2007","63","7","o3349","o3349","10.1107/S160053680703084X","","","0.71069","MoKα","","0.054","0.044","","","0.112","0.122","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214243","8.6208","0.0008","13.8333","0.0013","21.151","0.002","90","","90","","90","","2522.3","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","{6,6'-diethoxy-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato- 1κ^2^O^1^,O^1'^,O^6^,O^6'^:2κ^2^O^1^,N,N',O^1'^}trinitrato-1κ^O,O'- samarium(III)copper(II)","","- C20 H22 Cu N5 O13 Sm -","- C20 H22 Cu N5 O13 Sm -","- C80 H88 Cu4 N20 O52 Sm4 -","4","1","HG2240","Sui, Yan; He, De-Yong; Fang, Xiao-Niu; Chen, Li; Peng, Jia-Long","{6,6'-Diethoxy-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}trinitratosamarium(III)copper(II)","Acta Crystallographica Section E","2007","63","7","m2013","m2014","10.1107/S1600536807030905","","","0.71073","MoKα","","0.0289","0.0223","","","0.0471","0.0482","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214244","13.5529","0.001","7.0627","0.0005","12.9203","0.0009","90","","95.443","0.001","90","","1231.16","0.15","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(+)-(1R,2S,3S,4S)-2-Chloro-3-(phenylselanyl)cyclohexane-1,4-diol","","- C12 H15 Cl O2 Se -","- C12 H15 Cl O2 Se -","- C48 H60 Cl4 O8 Se4 -","4","1","HG2241","Robinson, Tony V.; Taylor, Dennis K.; Tiekink, Edward R. T.","(+)-(1<i>R</i>,2<i>S</i>,3<i>S</i>,4<i>S</i>)-2-Chloro-3-(phenylselanyl)cyclohexane-1,4-diol","Acta Crystallographica Section E","2007","63","7","o3350","o3350","10.1107/S1600536807030851","","","0.71069","MoKα","","0.033","0.029","","","0.075","0.077","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214245","20.543","0.0005","54.5902","0.0015","5.1134","0.0001","90","","90","","90","","5734.4","0.2","293","2","293","2","","","","","","","","5","F d d 2","F 2 -2d","43","","1-(6-Chloropyridin-3-ylmethyl)-3-phenyl-1<i>H</i>-pyrazole-5-carboxylic acid","","- C16 H12 Cl N3 O2 -","- C16 H12 Cl N3 O2 -","- C256 H192 Cl16 N48 O32 -","16","1","HG2243","Tang, Zheng; Tang, Zheng; Ding, Xiao-Ling; Dong, Wen-Liang; Zhao, Bao-Xiang","1-(6-Chloropyridin-3-ylmethyl)-3-phenyl-1<i>H</i>-pyrazole-5-carboxylic acid","Acta Crystallographica Section E","2007","63","7","o3348","o3348","10.1107/S1600536807030954","","","0.71073","MoKα","","0.0822","0.0442","","","0.0821","0.0951","","","","","","1.015","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214246","7.5298","0.0012","13.268","0.002","33.912","0.005","90","","90","","90","","3388","0.9","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Azido{2-[2-(piperidin-1-yl)ethyliminomethyl]-1-naphtholato}nickel(II)","","- C18 H21 N5 Ni O -","- C18 H21 N5 Ni O -","- C144 H168 N40 Ni8 O8 -","8","1","HG2245","Zhou, Zhi; Xiao, Zun-Hong","Azido{2-[2-(piperidin-1-yl)ethyliminomethyl]-1-naphtholato}nickel(II)","Acta Crystallographica Section E","2007","63","7","m2012","m2012","10.1107/S1600536807030930","","","0.71073","MoKα","","0.0746","0.0386","","","0.0824","0.0965","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214247","8.5837","0.001","13.7547","0.0016","21.153","0.002","90","","90","","90","","2497.5","0.5","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","{6,6'-diethoxy-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato- 1κ^2^O^1^,O^1'^,O^6^,O^6'^:2κ^2^O^1^,N,N',O^1'^}trinitrato-1κ^2^O,O'- yttrium(III)nickel(II)","","- C20 H22 N5 Ni O13 Y -","- C20 H22 N5 Ni O13 Y -","- C80 H88 N20 Ni4 O52 Y4 -","4","1","HG2246","Sui, Yan; Huang, Qiang; Hu, Rong-Hua; Xie, Guo-Wei","{6,6'-Diethoxy-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}trinitratoyttrium(III)nickel(II)","Acta Crystallographica Section E","2007","63","7","m2015","m2016","10.1107/S1600536807030875","","","0.71073","MoKα","","0.0402","0.0282","","","0.0584","0.0614","","","","","","0.975","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214248","16.6819","0.0017","10.959","0.0008","23.718","0.002","90","","98.983","0.008","90","","4282.9","0.7","128","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(4-bromobenzoyl)(triphenylphosphonio)methanide","","- C26 H20 Br O P -","- C26 H20 Br O P -","- C208 H160 Br8 O8 P8 -","8","1","HK2238","Sabounchei, Seyyed Javad; Dadras, Alireza; Jafarzadeh, Mojtaba; Khavasi, Hamid Reza","4-Bromobenzoylmethylene‒triphenylphosphorane ylide","Acta Crystallographica Section E","2007","63","7","o3160","o3160","10.1107/S1600536807022623","","","0.71073","MoKα","","","0.0275","","","","0.0593","","","","","","1.115","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214249","7.4801","0.0009","7.6352","0.0009","8.6505","0.0011","70.031","0.009","81.126","0.01","66.128","0.009","424.55","0.1","296","","296","","","","","","","","","5","P -1","-P 1","2","","Poly[[diaquacaesium(II)]bis(μ~3~-3-carboxypyrazine-2-carboxylato)]","","- C12 H10 Cs N4 O10 -","- C12 H10 Cs N4 O10 -","- C12 H10 Cs N4 O10 -","1","0.5","HK2251","Mustafa Tombul; Kutalmış Güven; Orhan Büyükgüngör","Poly[[diaquacaesium(I)]bis(μ~3~-3-carboxypyrazine-2-carboxylato)]","Acta Crystallographica Section E","2007","63","7","m1783","m1784","10.1107/S1600536807025536","","","0.71073","MoKα","","0.0188","0.0186","","","0.0522","0.0523","","","","","","0.983","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214250","7.3937","0.0005","18.4414","0.0011","11.3607","0.0007","90","","94.783","0.001","90","","1543.64","0.17","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[ethylenediammonium [copper(II)-μ~4~-benzene-1,2,4,5-tetracarboxylato-κ^4^O:O':O'':O'''] 2.5-hydrate]","","- C48 H68 Cu4 N8 O42 -","- C12 H17 Cu N2 O10.5 -","- C48 H68 Cu4 N8 O42 -","4","1","HK2258","Rafizadeh, Masoud; Amani, Vahid; Dehghan, Leila; Azadbakht, Fatemeh; Sahlolbei, Elham","Poly[ethylenediammonium [cuprate(II)-μ~4~-benzene-1,2,4,5-tetracarboxylato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>'''] 2.5-hydrate]","Acta Crystallographica Section E","2007","63","7","m1841","m1842","10.1107/S1600536807025834","","","0.71073","MoKα","","0.0487","0.0366","","","0.0934","0.1002","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214251","14.931","0.003","4.866","0.001","15.538","0.003","90","","107.75","0.03","90","","1075.2","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(E)-O-Ethyl N-(3-methoxyphenyl)thiocarbamate","","- C10 H13 N O2 S -","- C10 H13 N O2 S -","- C40 H52 N4 O8 S4 -","4","1","HK2259","Muhammad Hanif; Ghulam Qadeer; Lei Shi; Nasim Hasan Rama","(<i>E</i>)-<i>O</i>-Ethyl <i>N</i>-(3-methoxyphenyl)thiocarbamate","Acta Crystallographica Section E","2007","63","7","o3062","o3062","10.1107/S1600536807025846","","","0.71073","MoKα","","0.0744","0.0571","","","0.1316","0.152","","","","","","1.138","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2214252","10.824","0.002","15.204","0.003","8.93","0.0018","90","","90","","90","","1469.6","0.5","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","Methyl 3-carboxy-7-(tert-butoxycarbonyl)-4,7-diazaheptanoate","","- C12 H22 N2 O6 -","- C12 H22 N2 O6 -","- C48 H88 N8 O24 -","4","1","HK2260","Xu, Jia-Ying; Wu, Zhen-Yi; Wu, Wen-Yuan; Tian, Wen-Wen; Wang, Jin-Tang","Methyl 3-carboxy-7-(<i>tert</i>-butoxycarbonyl)-4,7-diazaheptanoate","Acta Crystallographica Section E","2007","63","7","o3079","o3079","10.1107/S1600536807025871","","","0.71073","MoKα","","0.0981","0.0574","","","0.1029","0.1293","","","","","","0.898","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214253","12.266","0.002","7.362","0.001","12.759","0.002","90","","104.457","0.002","90","","1115.7","0.3","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","unsubstituted Tröger's base","6<i>H</i>,12<i>H</i>-5,11-Methanodibenzo[<i>b</i>,<i>f</i>][1,5]diazocine","","- C15 H14 N2 -","- C15 H14 N2 -","- C60 H56 N8 -","4","1","HK2262","Faroughi, Masoud; Jensen, Paul; Try, Andrew C.","6<i>H</i>,12<i>H</i>-5,11-Methanodibenzo[<i>b</i>,<i>f</i>][1,5]diazocine","Acta Crystallographica Section E","2007","63","7","o3111","o3111","10.1107/S160053680702661X","","","0.71073","MoKα","","0.0468","0.0383","","","0.0989","0.1061","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214254","13.313","0.003","10.661","0.003","13.629","0.003","90","","116.739","0.004","90","","1727.5","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(Benzotriazol-2-yl)-1-(biphenyl-4-yl)propan-1-one","","- C21 H17 N3 O -","- C21 H17 N3 O -","- C84 H68 N12 O4 -","4","1","HK2263","Kun Cheng; Hui-Qing Zhang; Na-Na Tian; Jun Wan","3-(Benzotriazol-2-yl)-1-(biphenyl-4-yl)propan-1-one","Acta Crystallographica Section E","2007","63","7","o3091","o3091","10.1107/S1600536807026566","","","0.71073","MoKα","","0.089","0.0526","","","0.1087","0.1252","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214255","10.257","0.002","11.228","0.002","12.109","0.002","101.37","0.03","97.17","0.03","90.32","0.03","1355.8","0.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","4,6-Dibenzoylisophthalic acid pyridine disolvate","","- C32 H24 N2 O6 -","- C32 H24 N2 O6 -","- C64 H48 N4 O12 -","2","1","HK2264","Shan Liu; Peng Jiang; Shui-Ping Deng; Hong-Jun Zhu","4,6-Dibenzoylisophthalic acid pyridine disolvate","Acta Crystallographica Section E","2007","63","7","o3110","o3110","10.1107/S1600536807026657","","","0.71073","MoKα","","0.1117","0.0644","","","0.1441","0.1965","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214256","23.865","0.006","4.3199","0.001","16.829","0.004","90","","103.845","0.004","90","","1684.6","0.7","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N'-[1-(2-Furyl)ethylidene]acetohydrazide","","- C8 H10 N2 O2 -","- C8 H10 N2 O2 -","- C64 H80 N16 O16 -","8","1","HK2265","Huan-Mei Guo","<i>N</i>'-[1-(2-Furyl)ethylidene]acetohydrazide","Acta Crystallographica Section E","2007","63","7","o3159","o3159","10.1107/S1600536807026633","","","0.71073","MoKα","","0.075","0.0454","","","0.1143","0.127","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214257","10.6377","0.0009","9.8603","0.0009","18.3754","0.0016","90","","96.059","0.001","90","","1916.6","0.3","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-Chloro-1,1,1-trifluoro-3-(triphenylphosphoranylidene)propan-2-one","","- C21 H15 Cl F3 O P -","- C21 H15 Cl F3 O P -","- C84 H60 Cl4 F12 O4 P4 -","4","1","HK2266","Wang, Zeng-Xue; Jiang, Hai-Zhen; Wan, Wen; Ge, Feng-Lian; Hao, Jian","3-Chloro-1,1,1-trifluoro-3-(triphenylphosphoranylidene)propan-2-one","Acta Crystallographica Section E","2007","63","7","o3152","o3152","10.1107/S1600536807027225","","","0.71073","MoKα","","0.0395","0.035","","","0.0864","0.09","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214258","9.594","0.004","24.286","0.011","9.715","0.004","90","","114.864","0.005","90","","2053.8","1.5","298","2","298","2","","","","","","","","5","C 1 c 1","C -2yc","9","","catena-Poly[[tri-n-butyltin(IV)]-μ-pyridine-3-carboxylato-κ^2^N:O]","","- C18 H31 N O2 Sn -","- C18 H31 N O2 Sn -","- C72 H124 N4 O8 Sn4 -","4","1","HK2268","Tian-Duo Li; Hai-Ying You","<i>catena</i>-Poly[[tri-<i>n</i>-butyltin(IV)]-μ-pyridine-3-carboxylato-κ^2^<i>N</i>:O]","Acta Crystallographica Section E","2007","63","7","m1870","m1870","10.1107/S1600536807027237","","","0.71073","MoKα","","0.0711","0.0584","","","0.1506","0.1628","","","","","","1.001","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2214259","7.096","0.0014","8.406","0.0017","20.068","0.004","90","","90","","90","","1197","0.4","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Tetrafluoro-N-phenylphthalimide","","- C14 H5 F4 N O2 -","- C14 H5 F4 N O2 -","- C56 H20 F16 N4 O8 -","4","1","HK2269","Fan Wen; Ren-Jie Ni; Cheng Yao","Tetrafluoro-<i>N</i>-phenylphthalimide","Acta Crystallographica Section E","2007","63","7","o3153","o3153","10.1107/S1600536807027286","","","0.71073","MoKα","","0.0475","0.0351","","","0.0834","0.0898","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214260","4.0321","0.0003","12.3412","0.0013","13.7513","0.001","90","","90.534","0.006","90","","684.25","0.1","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Phthalazin-1(2H)-one","","- C8 H6 N2 O -","- C8 H6 N2 O -","- C32 H24 N8 O4 -","4","1","HK2270","Büyükgüngör, Orhan; Odabaşoǧlu, Mustafa; Narayana, B.; Vijeshi, A. M.; Yathirajan, H. S.","Phthalazin-1(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","7","o3198","o3198","10.1107/S1600536807027523","","","0.71073","MoKα","","0.0498","0.0379","","","0.0938","0.0996","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214263","8.0123","0.0007","13.3199","0.0015","12.5594","0.0012","90","","105.15","0.03","90","","1293.8","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(1-Tosyl-1H-pyrrol-2-yl)ethanone","","- C13 H13 N O3 S -","- C13 H13 N O3 S -","- C52 H52 N4 O12 S4 -","4","1","HK2274","Shan Liu; Ming Xia; Yu-Feng Li; Shui-Ping Deng; Hong-Jun Zhu","1-(1-Tosyl-1<i>H</i>-pyrrol-2-yl)ethanone","Acta Crystallographica Section E","2007","63","7","o3228","o3228","10.1107/S1600536807028528","","","0.71073","MoKα","","0.0796","0.0526","","","0.1496","0.1897","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214264","6.439","0.0013","8.084","0.0016","10.188","0.002","71.29","0.03","81.6","0.03","74.21","0.03","482.3","0.2","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","3,5-Dimethoxybenzamide oxime","","- C9 H12 N2 O3 -","- C9 H12 N2 O3 -","- C18 H24 N4 O6 -","2","1","HK2275","Kang, Si-Shun; Wang, Hai-Bo; Zeng, Hai-Su; Li, Hai-Lin","3,5-Dimethoxybenzamide oxime","Acta Crystallographica Section E","2007","63","7","o3279","o3279","10.1107/S1600536807029388","","","0.71073","MoKα","","0.088","0.0566","","","0.1238","0.1802","","","","","","1.11","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214267","15.657","0.002","13.14","0.002","21.287","0.003","90","","111.129","0.007","90","","4085","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[aqua(2,2'-bipyridine-N,N')cadmium(II)-μ- cyclohexane-1,4-dicarboxylato-κ^4^O,O':O'',O'''] 2.5-hydrate]","","- C18 H25 Cd N2 O7.5 -","- C18 H25 Cd N2 O7.5 -","- C144 H200 Cd8 N16 O60 -","8","1","HY2051","Li, Na; Wang, Yan-Qin; Weng, Jia-Bao","<i>catena</i>-Poly[[aqua(2,2'-bipyridine-<i>N</i>,<i>N</i>')cadmium(II)-μ-cyclohexane-1,4-dicarboxylato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''] 2.5-hydrate]","Acta Crystallographica Section E","2007","63","7","m1862","m1863","10.1107/S160053680702020X","","","0.71073","MoKα","","0.0246","0.0225","","","0.0529","0.0542","","","","","","1.065","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214268","20.94","0.003","9.6078","0.0012","14.7942","0.0019","90","","125.884","0.002","90","","2411.5","0.6","292","2","292","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis(benzene-1,3-dicarboxylato-κ^2^O,O')zinc(II)]- μ-4,4'-bipyridine-κ^2^N:N']","","- C26 H18 N2 O8 Zn -","- C26 H18 N2 O8 Zn -","- C104 H72 N8 O32 Zn4 -","4","0.5","HY2062","Xiu-Mei Li; Yan-Hui Dong; Qing-Wei Wang; Bo Liu","<i>catena</i>-Poly[[bis(benzene-1,3-dicarboxylato-κ^2^<i>O</i>,<i>O</i>')zinc(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","7","m1839","m1840","10.1107/S1600536807027067","","","0.71073","MoKα","","0.0371","0.0328","","","0.0888","0.0913","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214269","15.234","0.006","11.945","0.004","25.84","0.009","90","","90","","90","","4702","3","273","2","273","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","[μ-2-(9-Anthrylmethyl)-2-azapropane-1,3-dithiolato- κ^4^S:S']bis[tricarbonyliron(I)]","","- C23 H15 Fe2 N O6 S2 -","- C23 H15 Fe2 N O6 S2 -","- C184 H120 Fe16 N8 O48 S16 -","8","1","HY2063","Shang Gao; Xiao-Jun Peng","[μ-2-(9-Anthrylmethyl)-2-azapropane-1,3-dithiolato-κ^4^<i>S</i>:<i>S</i>']bis[tricarbonyliron(I)]","Acta Crystallographica Section E","2007","63","7","m1997","m1997","10.1107/S1600536807025469","","","0.71073","MoKα","","0.0702","0.0369","","","0.0731","0.0849","","","","","","1.014","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214270","10.2359","0.0009","12.5935","0.0011","10.2596","0.0009","90","","104.166","0.002","90","","1282.3","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-sulfido-bis[(2-aminoethanethiolato-κ^2^N,S)oxidomolybdate(V)](Mo—Mo)","","- C4 H12 Mo2 N2 O2 S4 -","- C4 H12 Mo2 N2 O2 S4 -","- C16 H48 Mo8 N8 O8 S16 -","4","1","HY2065","Li, Ya-Min; Zhang, Jing-Lai; Zhao, Xiao-Wei","Di-μ-sulfido-bis[(2-aminoethanethiolato-κ^2^<i>N</i>,<i>S</i>)oxidomolybdate(V)]","Acta Crystallographica Section E","2007","63","7","m1877","m1877","10.1107/S1600536807026384","","","0.71073","MoKα","","","0.0569","","","0.1025","0.1154","","","","","","1.18","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214271","12.71","0.007","10.903","0.006","24.729","0.014","90","","99.842","0.011","90","","3376","3","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Ni4(dmap)4Cl2","bis[μ~3~-2,6-bis(methylamino)pyridine(2-)-κ^4^N^2^:N^1^,N^6^:N^6^]bis[μ~3~- 2,6-bis(methylamino)pyridine(1-)-κ^3^N^1^:N^2^:N^2^]dichloridotetranickel(II)","","- C28 H38 Cl2 N12 Ni4 -","- C28 H38 Cl2 N12 Ni4 -","- C112 H152 Cl8 N48 Ni16 -","4","1","HY2066","Cotton, F. Abert; Murillo, Carlos A.; Wang, Qingsheng","A tetranuclear nickel(II) cluster: bis[μ~3~-2,6-bis(methylamino)pyridine(2{-})-κ^4^<i>N</i>^2^:<i>N</i>^1^,<i>N</i>^6^:<i>N</i>^6^]bis[μ~3~-2,6-bis(methylamino)pyridine(1{-})-κ^3^<i>N</i>^1^:<i>N</i>^2^:<i>N</i>^2^]dichloridotetranickel(II)","Acta Crystallographica Section E","2007","63","7","m1905","m1905","10.1107/S1600536807028371","","","0.71073","MoKα","","0.0767","0.0424","","","","0.0935","","","1.075","","","1.075","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214272","7.3481","0.0015","13.925","0.003","16.531","0.003","90","","101.42","0.03","90","","1658","0.6","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[(2,9-dimethyl-1,10-phenanthroline-κ^2^N,N')(nitrato- κ^2^O,O')cobalt(II)]-μ-dicyanamido-κ^2^N^1^:N^5^]","","- C16 H12 Co N6 O3 -","- C16 H12 Co N6 O3 -","- C64 H48 Co4 N24 O12 -","4","1","HY2068","Wang, Yan-Yan; Liu, Tian-Fu","<i>catena</i>-Poly[[(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(nitrato-κ^2^<i>O</i>,<i>O</i>')cobalt(II)]-μ-dicyanamido-κ^2^<i>N</i>^1^:<i>N</i>^5^]","Acta Crystallographica Section E","2007","63","7","m1986","m1986","10.1107/S1600536807030279","","","0.71073","MoKα","","0.0634","0.0326","","","0.0895","0.0976","","","","","","0.938","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214273","21.0726","0.0005","15.4727","0.0005","15.5907","0.0004","90","","90.991","0.001","90","","5082.6","0.2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[iodidobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)] tetraiodidocadmate(II)","","- C48 H32 Cd Cu2 I6 N8 -","- C48 H32 Cd Cu2 I6 N8 -","- C192 H128 Cd4 Cu8 I24 N32 -","4","0.5","IM2017","Ming-Lei Cao; Xin Fang; Yan-Jun Zhang; Hai-Yang Yu; Jun-Dong Wang","Bis[iodidobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)] tetraiodidocadmate(II)","Acta Crystallographica Section E","2007","63","7","m1782","m1782","10.1107/S1600536807025329","","","0.71073","MoKα","","0.0354","0.0331","","","0.084","0.0851","","","","","","1.107","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214274","9.713","0.002","10.076","0.002","14.509","0.003","90.37","0.02","91.21","0.02","117.39","0.02","1260.3","0.5","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","Chlorido(1-pyrrolidinecarbodithioato-κ^2^S,S')(triphenylphosphine- κP)nickel(II) chloroform hemisolvate","","- C47 H47 Cl5 N2 Ni2 P2 S4 -","- C47 H47 Cl5 N2 Ni2 P2 S4 -","- C47 H47 Cl5 N2 Ni2 P2 S4 -","1","0.5","IM2018","Kropidłowska, Anna; Janczak, Jan; Gołaszewska, Jolanta; Becker, Barbara","Chlorido(1-pyrrolidinecarbodithioato-κ^2^<i>S</i>,<i>S</i>')(triphenylphosphine-κ<i>P</i>)nickel(II) chloroform hemisolvate","Acta Crystallographica Section E","2007","63","7","m1947","m1947","10.1107/S1600536807027791","","","0.71073","MoKα","","0.1597","0.0577","","","0.1072","0.119","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214275","7.835","0.001","10.112","0.001","17.864","0.002","104.696","0.002","91.999","0.002","98.995","0.003","1348.1","0.3","291","2","291","2","","","","","","","","4","P -1","-P 1","2","2,2'-bis(4-cyanobenzyloxy)-1.1'-binaphthalene","4,4'-[1,1'-Binaphthalene-2,2'-diyldi(oxymethylene)]benzonitrile","","- C36 H24 N2 O2 -","- C36 H24 N2 O2 -","- C72 H48 N4 O4 -","2","1","IM2019","Fu, Dai-Wei; Zhao, Hong","4,4'-[1,1'-Binaphthalene-2,2'-diyldi(oxymethylene)]benzonitrile","Acta Crystallographica Section E","2007","63","7","o3206","o3206","10.1107/S1600536807027596","","","0.71073","MoKα","","0.0649","0.0527","","","0.1083","0.1121","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214276","11.0793","0.0005","23.3836","0.001","12.8133","0.0005","90","","117.746","0.001","90","","2937.9","0.2","200","2","200","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","Dibromido(η^5^-pentamethylcyclopentadienyl)(5-\ phenyldibenzophosphole-κP)iridium(III) dichloromethane solvate","","- C29 H30 Br2 Cl2 Ir P -","- C29 H30 Br2 Cl2 Ir P -","- C116 H120 Br8 Cl8 Ir4 P4 -","4","1","IS2170","Mai Kotera; Takayoshi Suzuki","Dibromido(η^5^-pentamethylcyclopentadienyl)(5-phenyldibenzophosphole-κ<i>P</i>)iridium(III) dichloromethane solvate","Acta Crystallographica Section E","2007","63","7","m1818","m1818","10.1107/S1600536807026621","","","0.71075","MoKα","","0.0429","0.0398","","","0.1233","0.1256","","","","","","1.081","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214277","7.845","0.0002","12.1815","0.0003","12.9442","0.0003","73.087","0.001","80.468","0.001","77.869","0.001","1149.83","0.05","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","(2,5-Dichloro-4-hydroxyphenyl)(phenyl)methanone","","- C13 H8 Cl2 O2 -","- C13 H8 Cl2 O2 -","- C52 H32 Cl8 O8 -","4","2","IS2171","Hoong-Kun Fun; Shea-Lin Ng; Zhe Li; Jian-Hua Xu","(2,5-Dichloro-4-hydroxyphenyl)(phenyl)methanone","Acta Crystallographica Section E","2007","63","7","o3121","o3121","10.1107/S1600536807026864","","","0.71073","MoKα","","0.0668","0.0442","","","0.1147","0.1341","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214278","22.9526","0.0007","22.9526","0.0007","12.7318","0.0007","90","","90","","90","","6707.4","0.5","291","2","292","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","3-(4-Fluorophenyl)-2-morpholinoquinazolin-4(3H)-one","","- C18 H16 F N3 O2 -","- C18 H16 F N3 O2 -","- C288 H256 F16 N48 O32 -","16","1","IS2172","Chang-Quan Cai; Hong Luo; Ping He; Zhen-Zhen Yang","3-(4-Fluorophenyl)-2-morpholinoquinazolin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","7","o3196","o3196","10.1107/S1600536807027535","","","0.71073","MoKα","","0.075","0.0592","","","0.1482","0.1582","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214279","11.6772","0.0003","13.8721","0.0003","13.1182","0.0003","90","","119.875","0.002","90","","1842.6","0.08","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4'-Dimethoxy-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenol","","- C22 H20 N2 O4 -","- C22 H20 N2 O4 -","- C88 H80 N8 O16 -","4","1","IS2174","Naser Eltaher Eltayeb; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun; Kamarulazizi Ibrahim","4,4'-Dimethoxy-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenol","Acta Crystallographica Section E","2007","63","7","o3234","o3235","10.1107/S1600536807027420","","","0.71073","MoKα","","0.0719","0.0533","","","0.1408","0.1539","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214280","24.5326","0.001","9.9826","0.0015","23.761","0.003","90","","110.797","0.002","90","","5439.9","1.1","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[[(μ~4~-carbonyldibenzene-3,3',4,4'-tetracarboxylato)tetrakis(1,10- phenanthroline)dicadmium(II)] dihydrate]","","- C65 H42 Cd2 N8 O11 -","- C65 H42 Cd2 N8 O11 -","- C260 H168 Cd8 N32 O44 -","4","0.5","IS2175","Gao, Yu-Xiang; Wang, Li-Bin; Niu, Yan-Ling","Poly[[(μ~4~-carbonyldibenzene-3,3',4,4'-tetracarboxylato)tetrakis(1,10-phenanthroline)dicadmium(II)] dihydrate]","Acta Crystallographica Section E","2007","63","7","m1844","m1844","10.1107/S1600536807028425","","","0.71073","MoKα","","0.0721","0.0473","","","0.1114","0.1359","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214281","8.4578","0.0016","9.0329","0.0017","9.6474","0.0018","90","","108.932","0.003","90","","697.2","0.2","298","2","298","2","","","","","","","","3","P 1 c 1","P -2yc","7","","2-(1-Naphthylmethyl)-1H-benzo[d]imidazole","","- C18 H14 N2 -","- C18 H14 N2 -","- C36 H28 N4 -","2","1","IS2176","Ming-Wu Ding; Yang-Gen Hu; Ming-Guo Liu","2-(1-Naphthylmethyl)-1<i>H</i>-benzo[<i>d</i>]imidazole","Acta Crystallographica Section E","2007","63","7","o3184","o3184","10.1107/S1600536807028449","","","0.71073","MoKα","","0.0705","0.0439","","","0.088","0.0978","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214282","7.8633","0.0002","10.781","0.0002","18.3211","0.0004","101.118","0.001","90.75","0.001","98.091","0.001","1507.54","0.06","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","Tris(2,2'-bipyridine-κ^2^N,N')copper(II) bis(tetrafluoridoborate)","","- C30 H24 B2 Cu F8 N6 -","- C30 H24 B2 Cu F8 N6 -","- C60 H48 B4 Cu2 F16 N12 -","2","1","IS2177","Chamayou, Anne-Christine; Biswas, Chaitali; Janiak, Christoph; Ghosh, Ashutosh","Tris(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')copper(II) bis(tetrafluoridoborate)","Acta Crystallographica Section E","2007","63","7","m1936","m1937","10.1107/S1600536807028863","","","0.71073","MoKα","","0.091","0.0361","","","0.0833","0.0876","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214283","13.7678","0.0019","12.7143","0.0017","20.364","0.003","90","","95.251","0.005","90","","3549.7","0.9","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[μ-diphenyl(2-pyridylmethyl)phosphine- κ^2^N,P]bis[nitratosilver(I)](Ag—Ag)","","- C36 H32 Ag2 N4 O6 P2 -","- C36 H32 Ag2 N4 O6 P2 -","- C144 H128 Ag8 N16 O24 P8 -","4","0.5","IS2178","Klausmeyer, Kevin K.; Hung-Low, Fernando","Bis[μ-diphenyl(2-pyridylmethyl)phosphine-κ^2^<i>N</i>,<i>P</i>]bis[nitratosilver(I)](<i>Ag</i>—<i>Ag</i>)","Acta Crystallographica Section E","2007","63","7","m1931","m1931","10.1107/S1600536807028875","","","0.71073","MoKα","","0.0455","0.0384","","","0.0943","0.099","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214284","5.0654","0.0002","18.8003","0.0017","8.1609","0.0004","90","","90","","90","","777.17","0.09","290","2","290","2","","","","","","","","4","P b c n","-P 2n 2ab","60","Pyridinium-betaine of squaric acid","3,4-dioxo-2-(pyridinium-1-yl)cyclobut-1-enolate","","- C9 H5 N O3 -","- C9 H5 N O3 -","- C36 H20 N4 O12 -","4","0.5","IS2179","Tsonko Kolev; Denitsa Yancheva; Boris Shivachev; Rosica Petrova","The pyridinium-betaine of squaric acid","Acta Crystallographica Section E","2007","63","7","o3259","o3259","10.1107/S1600536807028887","","","0.71073","MoKα","","0.1072","0.0534","","","0.1135","0.1335","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214285","10.1751","0.0011","14.8325","0.0011","14.6121","0.0013","90","","109.861","0.001","90","","2074.1","0.3","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaqua(1,10-phenanthroline-5,6-dione-κ^2^N,N^,^)(pyridine-2,6-dicarboxylato- κ^3^O,N,O')manganese(II) dihydrate","","- C19 H17 Mn N3 O10 -","- C19 H17 Mn N3 O10 -","- C76 H68 Mn4 N12 O40 -","4","0.5","KJ2058","Hong-Guang Ge; Qiong Xu; Xiao-Hua Guo; Wu-Juan Sun; Cai-Bin Zhao","Diaqua(1,10-phenanthroline-5,6-dione-κ^2^<i>N</i>,<i>N</i>)(pyridine-2,6-dicarboxylato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')manganese(II) dihydrate","Acta Crystallographica Section E","2007","63","7","m1798","m1798","10.1107/S1600536807026001","","","0.71073","MoKα","","0.0329","0.0289","","","0.0788","0.0824","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214286","8.1416","0.0009","12.7121","0.001","20.7789","0.0013","90","","90","","90","","2150.6","0.3","100","1","100","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Methyl-4-nitro-1-(4-nitrophenyl)-1H-imidazole","","- C10 H8 N4 O4 -","- C10 H8 N4 O4 -","- C80 H64 N32 O32 -","8","1","KP2111","Wagner, Paweł; Kubicki, Maciej","2-Methyl-4-nitro-1-(4-nitrophenyl)-1<i>H</i>-imidazole","Acta Crystallographica Section E","2007","63","7","o3083","o3083","10.1107/S1600536807026244","","","0.71073","MoKα","","0.0666","0.0383","","","0.0827","0.0986","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214287","24.5506","0.0009","10.6729","0.0004","15.8285","0.0007","90","","122.818","0.003","90","","3485.5","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Methyl 5'-acetyl-2'-amino-6'-methyl-2-oxospiro[indoline-3,4'-4H-pyran]-3'-carboxylate","","- C18 H18 N2 O5 -","- C18 H18 N2 O5 -","- C144 H144 N16 O40 -","8","1","KP2112","Shishkina, Svetlana V.; Shishkin, Oleg V.; Redkin, Ruslan Gr.; Shemchuk, Leonid A.; Chernykh, Valentin P.","Methyl 5'-acetyl-2'-amino-6'-methyl-2-oxospiro[indoline-3,4'-4<i>H</i>-pyran]-3'-carboxylate","Acta Crystallographica Section E","2007","63","7","o3193","o3193","10.1107/S1600536807027547","","","0.71073","MoKα","","0.066","0.047","","","0.131","0.149","","","","","","1.087","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214288","7.8229","0.0006","5.3093","0.0004","13.4649","0.001","90","","93.861","0.007","90","","557.98","0.07","290","2","290","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","9,10-dimethylanthracene","9,10-dimethylanthracene","","- C16 H14 -","- C16 H14 -","- C32 H28 -","2","0.5","KP2114","Marciniak, Bernard","Redetermination of 9,10-dimethylanthracene","Acta Crystallographica Section E","2007","63","7","o3183","o3183","10.1107/S1600536807027511","","","0.71073","MoKα","","0.0672","0.0455","","","0.1131","0.1369","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214289","5.0007","0.0008","10.3776","0.0017","8.2345","0.0014","90","","100.535","0.017","90","","420.13","0.12","294","1","294","1","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","2,6-Diaminopyridinium perchlorate","","- C5 H8 Cl N3 O4 -","- C5 H8 Cl N3 O4 -","- C10 H16 Cl2 N6 O8 -","2","0.5","KP2115","Jazdoń, Monika; Radecka-Paryzek, Wanda; Kubicki, Maciej","2,6-Diaminopyridinium perchlorate","Acta Crystallographica Section E","2007","63","7","o3337","o3337","10.1107/S1600536807031042","","","0.71073","MoKα","","0.0695","0.0436","","","0.0891","0.0973","","","","","","1.059","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2214290","8.029","0.0016","13.978","0.003","5.7375","0.0011","90","","107.812","0.004","90","","613.1","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5-Chloro-2-methylisothiazolin-3-one","","- C4 H4 Cl N O S -","- C4 H4 Cl N O S -","- C16 H16 Cl4 N4 O4 S4 -","4","1","LH2375","Kato, Masaru; Fujihara, Takashi; Yano, Daisaku; Nagasawa, Akira","5-Chloro-2-methylisothiazolin-3-one: intermolecular two-dimensional networks <i>via</i> unusual C—Cl···O=C interactions","Acta Crystallographica Section E","2007","63","7","o3097","o3097","10.1107/S1600536807026025","","","0.71073","MoKα","","0.0598","0.0436","","","0.0905","0.0976","","","","","","0.995","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214291","8.9865","0.0004","10.4501","0.0005","11.3544","0.0005","98.296","0.001","102.842","0.001","104.642","0.001","982.88","0.08","292","2","298","2","","","","","","","","5","P -1","-P 1","2","","[Bis(1<i>H</i>-benzimidazol-2-ylmethyl)amine-κ^3^N,N',N'']dinitratolead(II)","","- C16 H15 N7 O6 Pb -","- C16 H15 N7 O6 Pb -","- C32 H30 N14 O12 Pb2 -","2","1","LH2392","Zhang, Yong; Xia, Xian-You; Liu, Xu-Qing; Chen, Xue-Mei; Liu, Ting","[Bis(1<i>H</i>-benzimidazol-2-ylmethyl)amine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']dinitratolead(II)","Acta Crystallographica Section E","2007","63","7","m1792","m1792","10.1107/S1600536807025615","","","0.71073","Mokα","","0.0483","0.0448","","","0.1195","0.1263","","","","","","1.122","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214292","15.3277","0.0006","16.3989","0.0006","24.8735","0.001","90","","90","","90","","6252.1","0.4","299","2","299","2","","","","","","","","5","P c a b","-P 2bc 2ac","61","","{[N,N'-Bis(4-methoxybenzyl)ethane-1,2-diyldiimino]diacetato- κ^4^O,N,N',O'}bis(1H-imidazole-κN^3^)zinc(II)","","- C28 H34 N6 O6 Zn -","- C28 H34 N6 O6 Zn -","- C224 H272 N48 O48 Zn8 -","8","1","LH2393","Min Zhang; Hui-Li Weng; Bo Hu; Xing-Man Xu","{[<i>N</i>,<i>N</i>'-Bis(4-methoxybenzyl)ethane-1,2-diyldiimino]diacetato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc(II)","Acta Crystallographica Section E","2007","63","7","m1797","m1797","10.1107/S1600536807026037","","","0.71073","MoKα","","0.0977","0.0541","","","0.136","0.147","","","","","","0.859","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214293","10.2206","0.0002","11.2773","0.0004","12.7211","0.0004","109.665","0.0012","108.018","0.0018","97.7941","0.0018","1265.11","0.07","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","tetra(1,6-hexanediammonium) tetra(hydrogenarsenate) heptahydrate","","- C24 H90 As4 N8 O23 -","- C24 H76 As4 N8 O23 -","- C24 H76 As4 N8 O23 -","1","0.5","LH2394","Todd, Malcolm J.; Harrison, William T. A.","Tetrakis(1,6-hexanediammonium) tetrakis(hydrogenarsenate) heptahydrate","Acta Crystallographica Section E","2007","63","7","m1891","m1891","10.1107/S1600536807023719","","","0.71073","MoKα","","0.0599","0.047","","","0.1189","0.1263","","","","","","1.069","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2214294","8.1638","0.0001","8.8536","0.0001","30.7221","0.0005","90","","90.67","0.001","90","","2220.41","0.05","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(RS)-1-[2-(Benzyloxy)-3-methoxyphenyl]-2,2,2-trichloroethyl benzenesulfonate","","- C22 H19 Cl3 O5 S -","- C22 H19 Cl3 O5 S -","- C88 H76 Cl12 O20 S4 -","4","1","LH2396","Mohammed H. Al-Douh; Shafida A. Hamid; Hasnah Osman; Shea-Lin Ng; Hoong-Kun Fun","(<i>R</i>)- and (<i>S</i>)-1-[2-(benzyloxy)-3-methoxyphenyl]-2,2,2-trichloroethyl benzenesulfonate","Acta Crystallographica Section E","2007","63","7","o3233","o3233","10.1107/S1600536807027353","","","0.71073","MoKα","","0.0519","0.0398","","","0.0993","0.1084","","","","","","1.078","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214295","13.0527","0.0003","7.8222","0.0002","16.4471","0.0004","90","","104.29","0.0012","90","","1627.3","0.07","150","","150","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","2-Naphthylmethyl N-(3-pyridylmethylene)hydrazinecarbodithioate","","- C18 H15 N3 S2 -","- C18 H15 N3 S2 -","- C72 H60 N12 S8 -","4","1","LH2397","How, Fiona N. F.; Watkin, David J.; Crouse, Karen A.; M. Ibrahim M. Tahir","2-Naphthylmethyl <i>N</i>-(3-pyridylmethylene)hydrazinecarbodithioate","Acta Crystallographica Section E","2007","63","7","o3133","o3134","10.1107/S1600536807025676","","","0.71073","MoKα","","0.0861","0.0565","","0.1982","0.1786","0.1976","","","","","","0.8205","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214296","7.652","0.0005","11.2724","0.0008","14.0331","0.001","90","","94.047","0.001","90","","1207.43","0.14","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Acetamido-<i>N</i>-(3-amino-1,2,4-triazol-1-yl)benzenesulfonamide","","- C10 H11 N5 O3 S -","- C10 H11 N5 O3 S -","- C40 H44 N20 O12 S4 -","4","1","LH2398","Fu Juan; Zhu Chuan-Fang; Sun Yu-Ting; Hu Bo","4-Acetamido-<i>N</i>-(3-amino-1,2,4-triazol-1-yl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","7","o3116","o3116","10.1107/S1600536807026931","","","0.71073","MoKα","","0.0422","0.0395","","","0.109","0.1116","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214297","11.331","0.003","6.738","0.001","16.366","0.003","90","","96.275","0.01","90","","1242","0.4","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(3S,5R,8R,9R,10R,13S,14R,17S)-Methyl 3β-acetoxy-17β-chloro-18-oxo-19,20,21,22,29,30-hexanorlupan-28-oate","","- C27 H41 Cl O5 -","- C27 H41 Cl O5 -","- C54 H82 Cl2 O10 -","2","1","LH2400","Císařová, Ivana; Kvasnica, Miroslav; Sarek, Jan","(3<i>S</i>,5<i>R</i>,8<i>R</i>,9<i>R</i>,10<i>R</i>,13<i>S</i>,14<i>R</i>,17<i>S</i>)-Methyl 3β-acetoxy-17β-chloro-18-oxo-19,20,21,22,29,30-hexanorlupan-28-oate","Acta Crystallographica Section E","2007","63","7","o3145","o3145","10.1107/S1600536807026487","","","0.71073","MoKα","","0.0467","0.0384","","","0.0895","0.0962","","","","","","1.102","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214298","10.5204","0.001","10.6661","0.001","11.7603","0.0011","77.292","0.001","73.862","0.001","84.59","0.001","1235.8","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","Imipraminium picrate","","- C25 H27 N5 O7 -","- C25 H27 N5 O7 -","- C50 H54 N10 O14 -","2","1","LH2401","Harrison, William T. A.; Bindya, S.; Ashok, M. A.; Yathirajan, H. S.; Narayana, B.","Imipraminium picrate","Acta Crystallographica Section E","2007","63","7","o3143","o3143","10.1107/S1600536807026050","","","0.71073","MoKα","","0.0916","0.049","","","0.1113","0.1273","","","","","","0.948","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214299","12.2183","0.0011","21.3444","0.0019","14.4056","0.0013","90","","112.059","0.001","90","","3481.9","0.5","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","3-(8-Methoxyquinolin-2-ylmethyl)-1-methyl-3H-1-imidazolium hexafluorophosphate","","- C15 H17 F6 N3 O P -","- C15 H17 F6 N3 O P -","- C120 H136 F48 N24 O8 P8 -","8","1","LH2402","Zhu, Yu-Lan; Zhong, Zhi-Feng; Yin, Qi-Fan; Liu, Wei","3-(8-Methoxyquinolin-2-ylmethyl)-1-methyl-3<i>H</i>-1-imidazolium hexafluorophosphate","Acta Crystallographica Section E","2007","63","7","o3231","o3231","10.1107/S1600536807026955","","","0.71073","MoKα","","0.0621","0.0585","","","0.1655","0.1697","","","","","","1.048","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214300","11.099","0.002","14.745","0.003","7.466","0.0015","90","","106.68","0.03","90","","1170.4","0.4","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di-μ-acetato-κ^4^<it>O</it>:<it>O</it>-bis{2-[(2-\ aminoethyl)iminomethyl]phenolato-\ κ^3^<it>N</it>,<it>N</it>',<it>O</it>}copper(II)","","- C22 H28 Cu2 N4 O6 -","- C22 H28 Cu2 N4 O6 -","- C44 H56 Cu4 N8 O12 -","2","0.5","LH2403","Zhao, Chong-Chao; Jiang, Yun-Bo; Cui, Ai-Li; Kou, Hui-Zhong","Di-μ-acetato-κ^4^<i>O</i>:<i>O</i>-bis{2-[(2-aminoethyl)iminomethyl]phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>}copper(II)","Acta Crystallographica Section E","2007","63","7","m1824","m1825","10.1107/S1600536807026967","","","0.71073","MoKα","","0.0498","0.0389","","","0.0822","0.088","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214301","10.72","0.004","9.192","0.004","10.819","0.004","90","","90.89","0.005","90","","1066","0.7","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(3S,4S)-1-Benzhydryl-4-[(R)-2,2-dimethyl-1,3- dioxolan-4-yl]-3-[(S)-1-hydroxyethyl]-2-azetidinone","","- C23 H27 N O4 -","- C23 H27 N O4 -","- C46 H54 N2 O8 -","2","1","LH2404","Hao Zhang; Fen-Er Chen; Min-Qin Chen","(3<i>S</i>,4<i>S</i>)-1-Benzhydryl-4-[(<i>R</i>)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-[(<i>S</i>)-1-hydroxyethyl]azetidin-2-one","Acta Crystallographica Section E","2007","63","7","o3099","o3099","10.1107/S160053680702692X","","","0.71073","MoKα","","0.0616","0.048","","","0.1145","0.1228","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214302","10.44","0.002","15.724","0.003","16.426","0.004","75.703","0.003","87.057","0.003","89.122","0.004","2609.5","1","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2,6-Bis(4-bromobenzylidene)cyclohexanone","","- C20 H16 Br2 O -","- C20 H16 Br2 O -","- C120 H96 Br12 O6 -","6","3","LH2405","Li-You Zhou","2,6-Bis(4-bromobenzylidene)cyclohexanone","Acta Crystallographica Section E","2007","63","7","o3113","o3113","10.1107/S1600536807026943","","","0.71073","MoKα","","0.1207","0.0504","","","0.102","0.1374","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214303","6.0322","0.0009","6.8532","0.001","7.382","0.0011","105.604","0.003","95.8","0.003","106.802","0.003","276.03","0.07","100","2","100","2","","","","","","","","5","P 1","P 1","1","","N,N-Dimethyl O-p-tolyl phosphoramidocyanidate","","- C10 H13 N2 O2 P -","- C10 H13 N2 O2 P -","- C10 H13 N2 O2 P -","1","1","LH2406","Saied Ghadimi; Ali Asghar Ebrahimi Valmoozi; Mehrdad Pourayoubi","<i>N</i>,<i>N</i>-Dimethyl <i>O</i>-<i>p</i>-tolyl phosphoramidocyanidate","Acta Crystallographica Section E","2007","63","7","o3260","o3260","10.1107/S1600536807028838","","","0.71073","MoKα","","0.0356","0.0338","","","0.0823","0.0836","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214304","7.946","0.002","13.067","0.003","16.796","0.003","90","","90","","90","","1743.9","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(S)-pantolactone-O,O'-diacetyl-(R,R)-hydrogentartrate O,O'-diacetyl-(R,R)-hydrogentartrate-(S)-3,3-dimethylbutyrolakton-2-yl O,O'-diacetyl-(R,R)-hydrogentartrate ester of (S)-pantolactone","(1R,2R)-1-carboxy-2-[(3S)-4,4-dimethyl-2-oxotetrahydrofuran-3- yloxycarbonyl]ethane-1,2-diyl diacetate","","- C14 H18 O10 -","- C14 H18 O10 -","- C56 H72 O40 -","4","1","LH2407","Zachara, Janusz; Madura, Izabela D.; Bernaś, Urszula; Synoradzki, Ludwik","The <i>O</i>,<i>O</i>'-diacetyl (<i>R</i>,<i>R</i>)-hydrogentartrate ester of (<i>S</i>)-pantolactone","Acta Crystallographica Section E","2007","63","7","o3209","o3209","10.1107/S1600536807027316","","","0.71073","MoKα","","0.0481","0.0348","","","0.0848","0.0898","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214305","8.2882","0.0015","12.905","0.003","16.544","0.004","90","","90","","90","","1769.5","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(R)-pantolactone-O,O'-diacetyl-(R,R)-hydrogentartrate monohydrate O,O'-diacetyl-(R,R)-hydrogentartrate-(R)-3,3-dimethylbutyrolakton-2-yl monohydrate O,O'-diacetyl-(R,R)-hydrogentartrate ester of (R)-pantolactone monohydrate","(1R,2R)-1-carboxy-2-[(3R)-4,4-dimethyl-2-oxotetrahydrofuran-3- yloxycarbonyl]ethane-1,2-diyl diacetate monohydrate","","- C14 H20 O11 -","- C14 H20 O11 -","- C56 H80 O44 -","4","1","LH2408","Zachara, Janusz; Madura, Izabela D.; Bernaś, Urszula; Synoradzki, Ludwik","The <i>O</i>,<i>O</i>'-diacetyl (<i>R</i>,<i>R</i>)-hydrogentartrate ester of (<i>R</i>)-pantolactone monohydrate","Acta Crystallographica Section E","2007","63","7","o3210","o3210","10.1107/S1600536807027328","","","0.71073","MoKα","","0.0361","0.031","","","0.0818","0.0846","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214306","27.8814","0.0004","3.93","0.0001","11.9065","0.0002","90","","90","","90","","1304.64","0.04","100","0.1","100","0.1","","","","","","","","6","P n a 21","P 2c -2n","33","","1-(4-bromophenyl)-3-(2-chloro-6-fluorophenyl)prop-2-en-1-one","","- C15 H9 Br Cl F O -","- C15 H9 Br Cl F O -","- C60 H36 Br4 Cl4 F4 O4 -","4","1","LH2409","P. S. Patil; Mohd Mustaqim Rosli; Hoong-Kun Fun; Ibrahim Abdul Razak; S. M. Dharmaprakash","1-(4-Bromophenyl)-3-(2-chloro-6-fluorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","7","o3238","o3238","10.1107/S1600536807027365","","","0.71073","MoKα","","0.0487","0.0315","","","0.0639","0.0811","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214307","8.3024","0.0008","11.8571","0.0011","18.7334","0.0018","90","","102.63","0.002","90","","1799.5","0.3","288","2","288","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-(4,5-Dichloro-o-phenylene)dibenzamide","","- C20 H14 Cl2 N2 O2 -","- C20 H14 Cl2 N2 O2 -","- C80 H56 Cl8 N8 O8 -","4","1","LH2410","Kwak, Han; Kim, Sea-Hyun; Kim, Pan-Gi; Kim, Cheal; Kim, Youngmee","<i>N</i>,<i>N</i>'-(4,5-Dichloro-<i>o</i>-phenylene)dibenzamide","Acta Crystallographica Section E","2007","63","7","o3141","o3141","10.1107/S160053680702733X","","","0.71073","MoKα","","0.1052","0.0485","","","0.0974","0.1144","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214308","12.3699","0.0015","13.3799","0.0016","22.502","0.003","90","","95.685","0.002","90","","3705.9","0.8","291","2","291","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","8-Methoxy-2-methylquinoline","","- C11 H11 N O -","- C11 H11 N O -","- C176 H176 N16 O16 -","16","2","LH2411","Yi-Zhen Wang","8-Methoxy-2-methylquinoline","Acta Crystallographica Section E","2007","63","7","o3230","o3230","10.1107/S1600536807027614","","","0.71073","MoKα","","0.0681","0.0463","","","0.1149","0.1316","","","","","","1.018","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214309","10.005","0.0003","6.1633","0.0002","20.1048","0.0006","90","","97.5817","0.0012","90","","1228.9","0.07","90","0.2","90","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Benzyl 2,6-dihydroxy-3-nitrobenzoate","","- C14 H11 N O6 -","- C14 H11 N O6 -","- C56 H44 N4 O24 -","4","1","LH2412","Sonar, Vijayakumar N.; M. Venkatraj; Parkin, Sean; Crooks, Peter A.","Benzyl 2,6-dihydroxy-3-nitrobenzoate","Acta Crystallographica Section E","2007","63","7","o3226","o3226","10.1107/S1600536807028541","","","0.71073","MoKα","","0.0523","0.0412","","","0.1066","0.114","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214310","3.8681","0.0002","18.3596","0.0005","12.0186","0.0009","90","","91.682","0.002","90","","853.15","0.08","210","2","210","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 2,6-dihydroxy-3-nitrobenzoate","","- C8 H7 N O6 -","- C8 H7 N O6 -","- C32 H28 N4 O24 -","4","1","LH2413","Sonar, Vijayakumar N.; M. Venkatraj; Parkin, Sean; Crooks, Peter A.","Methyl 2,6-dihydroxy-3-nitrobenzoate","Acta Crystallographica Section E","2007","63","7","o3227","o3227","10.1107/S1600536807028589","","","0.71073","MoKα","","0.0848","0.05","","","0.1254","0.1455","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214311","11.1294","0.0006","12.2109","0.0007","13.2924","0.0007","90","","101.008","0.001","90","","1773.2","0.17","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>catena</i>-Poly[[[diididocadmium(II)]-μ-3,3',5,5'-tetramethyl-4,4'- bipyrazolyl-κ^2^<i>N</i>:<i>N</i>'] methanol solvate]","","- C11 H18 Cd I2 N4 O -","- C11 H18 Cd I2 N4 O -","- C44 H72 Cd4 I8 N16 O4 -","4","1","LH2414","Li, Dong-Qing; Hou, Lei; Ng, Seik Weng","<i>catena</i>-Poly[[[diididocadmium(II)]-μ-3,3',5,5'-tetramethyl-4,4'-bipyrazolyl-κ^2^<i>N</i>:<i>N</i>'] methanol solvate]","Acta Crystallographica Section E","2007","63","7","m1864","m1864","10.1107/S1600536807027626","","","0.71073","MoKα","","0.034","0.031","","","0.088","0.09","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214312","17.624","0.002","7.2013","0.0014","34.853","0.003","90","","90","","90","","4423.4","1.1","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis[2-(2-hydroxyethyliminomethyl)-6-methoxyphenolato-κ^2^N^2^,O^1^]zinc(II)","","- C20 H24 N2 O6 Zn -","- C20 H24 N2 O6 Zn -","- C160 H192 N16 O48 Zn8 -","8","1","LH2415","Jian-Fang Dong; Lian-Zhi Li; Wen-Jian Yu; Hui Cui; Da-Qi Wang","Bis[2-(2-hydroxyethyliminomethyl)-6-methoxyphenolato-κ^2^<i>N</i>,<i>O</i>^1^]zinc(II)","Acta Crystallographica Section E","2007","63","7","m1992","m1992","10.1107/S1600536807030206","","","0.71073","MoKα","","0.111","0.0777","","","0.1604","0.1701","","","","","","1.082","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214313","7.266","0.003","32.701","0.012","8.373","0.003","90","","109.971","0.006","90","","1869.8","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4'-Iminodipyridinium 5-hydroxyisophthalate trihydrate","","- C18 H21 N3 O8 -","- C18 H21 N3 O8 -","- C72 H84 N12 O32 -","4","1","LH2416","Braverman, Maxwell A.; LaDuca, Robert L.","4,4'-Iminodipyridinium 5-hydroxyisophthalate trihydrate","Acta Crystallographica Section E","2007","63","7","o3167","o3167","10.1107/S1600536807027651","","","0.71073","MoKα","","0.0582","0.0439","","","0.1104","0.1187","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214314","9.6762","0.0007","8.0284","0.0006","31.515","0.002","90","","90","","90","","2448.2","0.3","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","p-Ferrocenylaniline","","- C16 H15 Fe N -","- C16 H15 Fe N -","- C128 H120 Fe8 N8 -","8","1","LH2417","Danielle M. Bequeath; Matthias Zeller; William J. Karnofel; Courtney L. Hoch; Larry S. Curtin","<i>p</i>-Ferrocenylaniline","Acta Crystallographica Section E","2007","63","7","m1866","m1867","10.1107/S160053680702764X","","","0.71073","MoKα","","0.0462","0.044","","","0.0941","0.0951","","","","","","1.31","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214315","21.263","0.003","9.733","0.0015","14.946","0.002","90","","90.188","0.002","90","","3093.1","0.8","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","1-Acetyl-3-(2,5-dichlorophenyl)-5-(4-fluorophenyl)-2-pyrazoline","","- C17 H13 Cl2 F N2 O -","- C17 H13 Cl2 F N2 O -","- C136 H104 Cl16 F8 N16 O8 -","8","1","LH2418","Yun-Chen Zhang","1-Acetyl-3-(2,5-dichlorophenyl)-5-(4-fluorophenyl)-2-pyrazoline","Acta Crystallographica Section E","2007","63","7","o3155","o3155","10.1107/S160053680702781X","","","0.71073","MoKα","","0.0405","0.0352","","","0.0937","0.0982","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214316","5.7992","0.0011","16.661","0.003","16.056","0.003","90","","99.387","0.002","90","","1530.6","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-Acetyl-5-(4-fluorophenyl)-3-(4-nitrophenyl)-2-pyrazoline","","- C17 H14 F N3 O3 -","- C17 H14 F N3 O3 -","- C68 H56 F4 N12 O12 -","4","1","LH2419","Huan-Mei Guo","1-Acetyl-5-(4-fluorophenyl)-3-(4-nitrophenyl)-2-pyrazoline","Acta Crystallographica Section E","2007","63","7","o3179","o3179","10.1107/S1600536807027833","","","0.71073","MoKα","","0.0497","0.0402","","","0.1021","0.1094","","","","","","1.051","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214317","13.825","0.0013","6.5843","0.0006","25.291","0.002","90","","96.461","0.002","90","","2287.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis[4-(2-pyridylmethylamino)phenyl]methane dihydrate","","- C25 H28 N4 O2 -","- C25 H28 N4 O2 -","- C100 H112 N16 O8 -","4","1","LH2420","Maneiro, Marcelino; Llamas-Saiz, Antonio L.; Vembu, Nagarajan; Nolan, Kevin B.","Bis[4-(2-pyridylmethylamino)phenyl]methane dihydrate","Acta Crystallographica Section E","2007","63","7","o3194","o3195","10.1107/S1600536807027857","","","0.71073","MoKα","","0.0763","0.0424","","","0.1061","0.132","","","","","","1.018","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214318","8.4346","0.0005","35.193","0.002","9.4327","0.0006","90","","109.356","0.001","90","","2641.7","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,6-Dimethoxy-2-(methylsulfanyl)-5-phenylpyrimidine","","- C13 H14 N2 O2 S -","- C13 H14 N2 O2 S -","- C104 H112 N16 O16 S8 -","8","2","LH2421","Tong-Hui Huang; Na Zhao; Li-Fang Chen; Hong-Gang Cheng; Fei-Hua Luo","4,6-Dimethoxy-2-(methylsulfanyl)-5-phenylpyrimidine","Acta Crystallographica Section E","2007","63","7","o3274","o3274","10.1107/S160053680702908X","","","0.71073","MoKα","","0.0954","0.0597","","","0.1526","0.1765","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214319","6.9732","0.0006","12.3149","0.0011","13.6851","0.0013","90","","90","","90","","1175.2","0.18","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl 3-nitro-4-propoxybenzoate","","- C11 H13 N O5 -","- C11 H13 N O5 -","- C44 H52 N4 O20 -","4","1","LH2422","Sheng-Yin Zhao; Shi-Wei Mou; Shu-Hui Zhao; Wei-Min Qin","Methyl 3-nitro-4-propoxybenzoate","Acta Crystallographica Section E","2007","63","7","o3269","o3269","10.1107/S1600536807028619","","","0.71073","MoKα","","0.0741","0.0519","","","0.1195","0.1354","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214320","12.44","0.004","7.466","0.003","14.443","0.005","90","","111.22","0.03","90","","1250.5","0.8","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(<i>R</i>)-3,3'-Bis(3,4,5-trifluorophenyl)-1,1'-binaphthalene-2,2'-diol","","- C32 H16 F6 O2 -","- C32 H16 F6 O2 -","- C64 H32 F12 O4 -","2","1","LH2424","Kang, Tai-Ran; He, Long; Ng, Seik Weng","(<i>R</i>)-3,3'-Bis(3,4,5-trifluorophenyl)-1,1'-binaphthalene-2,2'-diol","Acta Crystallographica Section E","2007","63","7","o3190","o3190","10.1107/S1600536807027870","","","0.71073","MoKα","","0.142","0.07","","","0.16","0.184","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214321","5.7577","0.0005","13.9599","0.0012","18.6746","0.0017","90","","98.585","0.005","90","","1484.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(1H-Benzotriazol-1-yl)-1-(4-ethylphenyl)propan-1-one","","- C17 H17 N3 O -","- C17 H17 N3 O -","- C68 H68 N12 O4 -","4","1","LH2425","Zeng, Wu-Lan","3-(1<i>H</i>-Benzotriazol-1-yl)-1-(4-ethylphenyl)propan-1-one","Acta Crystallographica Section E","2007","63","7","o3219","o3219","10.1107/S1600536807028632","","","0.71073","MoKα","","0.0497","0.0411","","","0.1105","0.1164","","","","","","1.051","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214322","9.9947","0.001","24.319","0.003","8.0077","0.0008","90","","111.745","0.002","90","","1807.9","0.3","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,1'-(N-Methyliminodimethylene)di-2-naphthol","","- C23 H21 N O2 -","- C23 H21 N O2 -","- C92 H84 N4 O8 -","4","1","LH2426","Xiu-Ling Chen; Xu-Hong Yang; Ming-Hu Wu","1,1'-(<i>N</i>-Methyliminodimethylene)di-2-naphthol","Acta Crystallographica Section E","2007","63","7","o3246","o3246","10.1107/S1600536807028826","","","0.71073","MoKα","","0.08","0.0552","","","0.1343","0.1475","","","","","","1.007","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214323","12.921","0.002","16.646","0.003","14.022","0.002","90","","90.625","0.004","90","","3015.7","0.8","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tetraethylammonium dichlorido[N,N'-(o-phenylene)bis(isoquinoline-2-carboxamidato)- κ^4^N]cobaltate(III)","","- C34 H36 Cl2 Co N5 O2 -","- C34 H36 Cl2 Co N5 O2 -","- C136 H144 Cl8 Co4 N20 O8 -","4","1","LH2427","Lee, Do Nam; Lee, Eun Yong; Kim, Cheal; Kim, Sung-Jin; Kim, Youngmee","Tetraethylammonium dichlorido[<i>N</i>,<i>N</i>'-(<i>o</i>-phenylene)bis(isoquinoline-2-carboxamidato)-κ^4^<i>N</i>]cobaltate(III)","Acta Crystallographica Section E","2007","63","7","m1949","m1950","10.1107/S1600536807029091","","","0.71073","MoKα","","0.1002","0.0498","","","0.0914","0.1023","","","","","","0.894","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214324","21.419","0.004","8.1405","0.0012","12.153","0.002","90","","118.75","0.03","90","","1857.8","0.8","220","2","220","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","trans,cis-Dibromido[diethyl (ethane-1,2-diyldiimino)diacetate- κ^2^N,N']dimethylplatinum(IV)","","- C12 H26 Br2 N2 O4 Pt -","- C12 H26 Br2 N2 O4 Pt -","- C48 H104 Br8 N8 O16 Pt4 -","4","0.5","LH2429","Kaluđerović, Goran N.; Schmidt, Harry; Wagner, Christoph; Steinborn, Dirk","<i>trans</i>,<i>cis</i>-Dibromido[diethyl (ethane-1,2-diyldiimino)diacetate-κ^2^<i>N</i>,<i>N</i>']dimethylplatinum(IV)","Acta Crystallographica Section E","2007","63","7","m1985","m1985","10.1107/S1600536807029534","","","0.71073","MoKα","","0.0463","0.0438","","","0.1134","0.1155","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214325","10.5715","0.0014","10.4989","0.0014","34.966","0.008","90","","90.04","0.006","90","","3880.8","1.1","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","1-[2-(2-Thienylcarbonyl)ethyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium chloride","","- C18 H20 Cl F3 N2 O S -","- C18 H20 Cl F3 N2 O S -","- C144 H160 Cl8 F24 N16 O8 S8 -","8","2","LH2431","Chen, Xue-Jun; Tan, Sheng; Shang, Zhen-Hua; Feng, Guang-Bin","1-[2-(2-Thienylcarbonyl)ethyl]-4-[3-(trifluoromethyl)phenyl]piperazin-1-ium chloride","Acta Crystallographica Section E","2007","63","7","o3285","o3285","10.1107/S1600536807029522","","","0.71073","MoKα","","0.1584","0.0618","","","0.1468","0.1873","","","","","","0.995","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214326","12.96","0.002","13.2235","0.0019","10.4526","0.0016","90","","97.012","0.003","90","","1777.9","0.5","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-chloro-bis{aqua[5-ethyl-2-(5-isopropyl-5-methyl-4-oxo-4,5-dihydro- 1H-imidazol-2-yl)nicotinato]copper(II)}","","- C30 H40 Cl2 Cu2 N6 O8 -","- C30 H40 Cl2 Cu2 N6 O8 -","- C60 H80 Cl4 Cu4 N12 O16 -","2","0.5","LH2432","Zhao, Yan; Qian, Kun; Tu, Yong-Gang; Li, Jian-Ke; Liu, Wei","Di-μ-chlorido-bis{aqua[5-ethyl-2-(5-isopropyl-5-methyl-4-oxo-4,5-dihydro-1<i>H</i>-imidazol-2-yl)nicotinato]copper(II)}","Acta Crystallographica Section E","2007","63","7","m1972","m1973","10.1107/S1600536807029819","","","0.71073","MoKα","","0.0853","0.0494","","","0.0801","0.0877","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214327","20.269","0.004","25.503","0.006","11.345","0.011","90","","90","","90","","5864","6","293","2","293","2","","","","","","","","7","F d d 2","F 2 -2d","43","","<i>catena</i>-Poly[[diaquabis[(4-chlorophenylsulfinyl)acetato- κ<i>O</i>]nickel(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']","","- C26 H24 Cl2 N2 Ni O8 S2 -","- C26 H24 Cl2 N2 Ni O8 S2 -","- C208 H192 Cl16 N16 Ni8 O64 S16 -","8","0.5","LH2434","Su, Yu; Hou, Yan-Jun; Sun, Zhi-Zhong; Li, Bai-Yan; Hou, Guang-Feng","<i>catena</i>-Poly[[diaquabis[(4-chlorophenylsulfinyl)acetato-κ<i>O</i>]nickel(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","7","m1970","m1970","10.1107/S1600536807029832","","","0.71073","MoKα","","0.0343","0.0306","","","0.069","0.0708","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214328","21.507","0.002","10.035","0.0014","15.2976","0.0018","90","","103.196","0.002","90","","3214.4","0.7","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2-Bis(dicyclohexylphosphino)-1,2-dicarba-closo-dodecaborane","","- C26 H54 B10 P2 -","- C26 H54 B10 P2 -","- C104 H216 B40 P8 -","4","0.5","LH2435","Fang-Fang Su; Jian-Min Dou; Da-Cheng Li; Da-Qi Wang","1,2-Bis(dicyclohexylphosphino)-1,2-dicarba-<i>closo</i>-dodecaborane","Acta Crystallographica Section E","2007","63","7","o3335","o3335","10.1107/S1600536807030553","","","0.71073","MoKα","","0.0997","0.0631","","","0.1571","0.1967","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214329","9.8645","0.0011","5.2515","0.0006","27.811","0.003","90","","98.716","0.001","90","","1424.1","0.3","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Benzyl-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazine","","- C19 H17 N O -","- C19 H17 N O -","- C76 H68 N4 O4 -","4","1","LH2436","Xu-Hong Yang; Xiu-Ling Chen; Xiang-Ju Diao; Ming-Hu Wu","2-Benzyl-2,3-dihydro-1<i>H</i>-naphtho[1,2-<i>e</i>][1,3]oxazine","Acta Crystallographica Section E","2007","63","7","o3312","o3312","10.1107/S1600536807030188","","","0.71073","MoKα","","0.1148","0.0633","","","0.1749","0.1969","","","","","","0.994","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214330","12.113","0.003","13.3231","0.0014","20.0301","0.0014","74.671","0.008","87.659","0.011","63.692","0.01","2783.7","0.8","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","μ~3~-Iodido-tri-μ~3~-sulfido- tris[(triphenylphosphine)silver(I)][thioxotungsten(VI)] dichloromethane 0.45-solvate","","- C54.45 H45.9 Ag3 Cl0.9 I P3 S4 W -","- C54.449 H45.898 Ag3 Cl0.898 I P3 S4 W -","- C108.898 H91.796 Ag6 Cl1.796 I2 P6 S8 W2 -","2","1","LH2438","Beheshti, Azizolla; Clegg, William; Dale, Sophie H.; Hyvadi, Reza","μ~3~-Iodido-tri-μ~3~-sulfido-tris[(triphenylphosphine)silver(I)][thioxotungsten(VI)] dichloromethane 0.45-solvate","Acta Crystallographica Section E","2007","63","7","m1990","m1991","10.1107/S1600536807030218","","","0.71073","MoKα","","0.0426","0.028","","","0.062","0.0679","","","","","","0.984","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214331","7.2723","0.0007","8.98","0.0009","27.549","0.003","90","","90","","90","","1799.1","0.3","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Phenothiazine‒picric acid (1/1)","","- C18 H12 N4 O7 S -","- C18 H12 N4 O7 S -","- C72 H48 N16 O28 S4 -","4","1","LH2440","Harrison, William T. A.; Ashok, M. A.; Yathirajan, H. S.; Narayana Achar, B.","Phenothiazine‒picric acid (1/1)","Acta Crystallographica Section E","2007","63","7","o3322","o3322","10.1107/S1600536807030176","","","0.71073","MoKα","","0.1018","0.0466","","","0.0831","0.0965","","","","","","0.892","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214332","6.0641","0.0012","15.208","0.003","15.187","0.003","90","","91.98","0.03","90","","1399.8","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-2-(4-Bromophenyl)-3-o-tolylacrylic acid","","- C16 H13 Br O2 -","- C16 H13 Br O2 -","- C64 H52 Br4 O8 -","4","1","LW2016","Hussain, Mukhtiar; Hanif Muhammad; Ali, Saqib; VanDerveer, Don","(<i>E</i>)-2-(4-Bromophenyl)-3-<i>o</i>-tolylacrylic acid","Acta Crystallographica Section E","2007","63","7","o3169","o3169","10.1107/S1600536807026463","","","0.71073","MoKα","","0.0486","0.0406","","","0.0928","0.0976","","","","","","1.113","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214333","16.0781","0.0007","9.8406","0.0004","22.2201","0.0008","90","","90","","90","","3515.6","0.2","150","","150","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Naphthylmethyl N-[1-(4-pyridyl)ethylidene]hydrazinecarbodithioate","","- C19 H17 N3 S2 -","- C19 H17 N3 S2 -","- C152 H136 N24 S16 -","8","1","LW2018","How, Fiona N.-F.; Watkin, David J.; Crouse, Karen A.; M. Ibrahim M. Tahir","2-Naphthylmethyl <i>N</i>-[1-(4-pyridyl)ethylidene]hydrazinecarbodithioate","Acta Crystallographica Section E","2007","63","7","o3135","o3136","10.1107/S1600536807025652","","","0.71073","MoKα","","0.1306","0.0731","","0.211","0.1819","0.211","","","","","","0.9178","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214334","16.705","0.003","5.5968","0.001","37.73","0.007","90","","90","","90","","3527.5","1.1","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(1E)-5-Amino-1,5-bis[4-(methylsulfanyl)phenyl]pent-1-en-3-one","","- C19 H21 N O S2 -","- C19 H21 N O S2 -","- C152 H168 N8 O8 S16 -","8","1","LW2020","Harrison, William T. A.; Sarojini, B. K.; Bindya, S.; Narayana, B.; Yathirajan, H. S.","(1<i>E</i>)-5-Amino-1,5-bis[4-(methylsulfanyl)phenyl]pent-1-en-3-one","Acta Crystallographica Section E","2007","63","7","o3142","o3142","10.1107/S1600536807026049","","","0.71073","MoKα","","0.1322","0.0533","","","0.12","0.1494","","","","","","0.914","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214335","8.258","0.009","5.847","0.009","10.414","0.009","90","","97.7","0.08","90","","498.3","1","299","2","299","2","","","","","","","","5","P 1 21 1","P 2yb","4","Methanesulfon-3,4-dimethylanilide","N-(3,4-Dimethylphenyl)methanesulfonamide","","- C9 H13 N O2 S -","- C9 H13 N O2 S -","- C18 H26 N2 O4 S2 -","2","1","LW2021","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(3,4-Dimethylphenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","7","o3085","o3085","10.1107/S1600536807026086","","","1.5418","CuKα","","0.1079","0.0824","","","0.2381","0.2664","","","","","","1.116","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214336","11.1299","0.0009","5.1365","0.0006","16.908","0.001","90","","90.038","0.006","90","","966.61","0.15","303","2","303","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Methanesulfon-2,3-dichloroanilide","N-(2,3-dichlorophenyl)methanesulfonamide","","- C7 H7 Cl2 N O2 S -","- C7 H7 Cl2 N O2 S -","- C28 H28 Cl8 N4 O8 S4 -","4","1","LW2022","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(2,3-Dichlorophenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","7","o3086","o3086","10.1107/S160053680702555X","","","0.71073","MoKα","","0.0579","0.0536","","","0.146","0.1517","","","","","","0.866","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214337","7.58","0.001","8.269","0.001","8.285","0.001","83.7","0.01","87.95","0.01","68.57","0.01","480.47","0.11","299","2","299","2","","","","","","","","6","P -1","-P 1","2","Methanesulfon-2,4-dichloroanilide","<i>N</i>-(2,4-Dichlorophenyl)methanesulfonamide","","- C7 H7 Cl2 N O2 S -","- C7 H7 Cl2 N O2 S -","- C14 H14 Cl4 N2 O4 S2 -","2","1","LW2023","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(2,4-Dichlorophenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","7","o3087","o3087","10.1107/S1600536807026062","","","1.5418","CuKα","","0.0962","0.0947","","","0.2732","0.2771","","","","","","1.369","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214338","5.8889","0.0005","8.481","0.0006","9.937","0.001","95.45","0.01","103.3","0.01","90.16","0.01","480.64","0.08","299","2","299","2","","","","","","","","6","P -1","-P 1","2","Methanesulfon-2,5-dichloroanilide","N-(2,5-dichlorophenyl)methanesulfonamide","","- C7 H7 Cl2 N O2 S -","- C7 H7 Cl2 N O2 S -","- C14 H14 Cl4 N2 O4 S2 -","2","1","LW2024","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(2,5-Dichlorophenyl)methanesulfonamide","Acta Crystallographica Section E","2007","63","7","o3088","o3089","10.1107/S160053680702569X","","","1.5418","CuKα","","0.0711","0.0479","","","0.1135","0.1248","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214339","10.516","0.002","14.56","0.003","7.333","0.002","90","","90","","90","","1122.8","0.4","295","","293","","","","","","","","","3","P 21 n b","P -2bc 2a","33","","tridysprosium ruthenium heptaoxide","","- Dy3 O7 Ru -","- Dy3 O7 Ru -","- Dy24 O56 Ru8 -","8","2","LX2012","Nobuo Ishizawa; Tsuyoshi Suwa; Kenji Tateishi","Dy~3~RuO~7~ with partial structural disorder","Acta Crystallographica Section E","2007","63","7","i163","i163","10.1107/S1600536807029686","","","0.71073","MoKα","","0.067","0.025","","0.029","","0.022","","","1.426","","","1.562","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214340","6.1458","0.0003","8.2749","0.0004","24.2995","0.0011","90","","90","","90","","1235.77","0.1","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","mesna","Sodium 2-mercaptoethanesulfonate","","- C2 H5 Na O3 S2 -","- C2 H5 Na O3 S2 -","- C16 H40 Na8 O24 S16 -","8","1","LX2014","Bambagiotti-Alberti, Massimo; Bruni, Bruno; Di Vaira, Massimo; Giannellini, Valerio","Sodium 2-mercaptoethanesulfonate (mesna)","Acta Crystallographica Section E","2007","63","7","o1796","o1796","10.1107/S1600536807025688","","","1.5418","CuKα","","0.033","0.0318","","","0.0914","0.0927","","","","","","1.116","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214341","9.167","0.001","19.564","0.002","10.424","0.001","90","","111.3","0.01","90","","1741.8","0.3","173","1","173","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2Z)-2-Phenyl-3-(2,2':5',2''-terthiophen-3'-yl)acrylonitrile","","- C21 H13 N S3 -","- C21 H13 N S3 -","- C84 H52 N4 S12 -","4","1","LX2015","Wagner, Paweł; Officer, David L.; Kubicki, Maciej","(<i>Z</i>)-2-Phenyl-3-(2,2':5',2''-terthiophen-3'-yl)acrylonitrile","Acta Crystallographica Section E","2007","63","7","o3054","o3055","10.1107/S1600536807025366","","","0.71073","MoKα","","0.1199","0.0662","","","0.1374","0.1531","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214342","6.7921","0.0001","6.7921","0.0001","10.9922","0.0002","90","","90","","120","","439.161","0.012","293","2","293","2","","","","","","","","2","P 63 m c","P 6c -2c","186","nickel phosphide (5/4)","pentanickel tetraphosphide","","- Ni5 P4 -","- Ni5 P4 -","- Ni20 P16 -","4","0.333333","MG2021","Zelinska, Mariya; Oryshchyn, Stepan; Zhak, Olga; Pivan, Jean-Yves; Potel, Michel; Noël, Henri","Redetermination of Ni~5~P~4~","Acta Crystallographica Section E","2007","63","7","i158","i159","10.1107/S1600536807028164","","","0.71069","MoKα","","0.0447","0.0271","","","0.032","0.0341","","","","","","1.059","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214343","12.7337","0.0011","6.9096","0.0006","13.7852","0.0013","90","","115.623","0.011","90","","1093.6","0.2","100","2","100","2","","","","","","","","4","C 1 c 1","C -2yc","9","","nitroguanidinium nitrate‒guanidinium nitrate (1/1)","","- C2 H11 N9 O8 -","- C2 H11 N9 O8 -","- C8 H44 N36 O32 -","4","1","NC2037","Steinhauser, Georg; Crawford, Margaret-Jane; Darwich, Chaza; Klapötke, Thomas M.; Miró Sabaté, Carles; Welch, Jan M.","The energetic double salt nitroguanidinium nitrate‒guanidinium nitrate (1/1)","Acta Crystallographica Section E","2007","63","7","o3100","o3101","10.1107/S1600536807026451","","","0.71073","MoKα","","0.0421","0.0277","","","","0.0544","","","","","","0.881","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214344","10.315","0.002","13.62","0.003","11.073","0.002","90","0.002","90","0.002","90","0.002","1555.6","0.5","103","","103","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","α-Artemether","","- C16 H26 O5 -","- C16 H26 O5 -","- C64 H104 O20 -","4","1","NC2038","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Bindya, S; Narayana, B.","α-Artemether","Acta Crystallographica Section E","2007","63","7","o3291","o3292","10.1107/S1600536807029108","","","0.71073","MoKα","","0.0356","0.0331","","","0.0855","0.0873","","","","","","1.115","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2214345","14.095","0.003","9.9845","0.0015","14.859","0.003","90","","116.728","0.003","90","","1867.7","0.6","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4-Bis(4-chlorophenyl)-2-methyl-2,3-dihydro-1<i>H</i>-1,5-benzodiazepine","","- C22 H18 Cl2 N2 -","- C22 H18 Cl2 N2 -","- C88 H72 Cl8 N8 -","4","1","NC2040","Li-Tao An; Fei-Qing Ding; Jian-Ping Zou; Xiao-Hua Lu","2,4-Bis(4-chlorophenyl)-2-methyl-2,3-dihydro-1<i>H</i>-1,5-benzodiazepine","Acta Crystallographica Section E","2007","63","7","o3272","o3273","10.1107/S1600536807029066","","","0.7107","MoKα","","0.049","0.0432","","","0.094","0.097","","","","","","1.144","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214346","20.194","0.005","25.528","0.008","11.458","0.006","90","","90","","90","","5907","4","293","2","293","2","","","","","","","","7","F d d 2","F 2 -2d","43","","<i>catena</i>-Poly[[diaquabis[(4-chlorophenylsulfinyl)acetato-κ<i>O</i>]\ zinc(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']","","- C26 H24 Cl2 N2 O8 S2 Zn -","- C26 H24 Cl2 N2 O8 S2 Zn -","- C208 H192 Cl16 N16 O64 S16 Zn8 -","8","0.5","NG2270","Hou, Yan-Jun; Li, Bai-Yan; Yu, Ying-Hui; Sun, Zhi-Zhong; Hou, Guang-Feng","<i>catena</i>-Poly[[diaquabis[(4-chlorophenylsulfinyl)acetato-κ<i>O</i>]zinc(II)]-μ-4,4'bipyridine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","7","m1838","m1838","10.1107/S1600536807025299","","","0.71073","MoKα","","0.0267","0.0241","","","0.0603","0.0618","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214347","15.577","0.003","5.3724","0.0011","14.74","0.003","90","","99.79","0.03","90","","1215.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diaquabis[(2-nitrophenylsulfinyl)acetato-<i>κO</i>]copper(II) tetrahydrate","","- C16 H24 Cu N2 O16 S2 -","- C16 H24 Cu N2 O16 S2 -","- C32 H48 Cu2 N4 O32 S4 -","2","0.5","NG2272","Zhu, Xue-Feng; Zhao, Li-Ming; Hou, Guang-Feng; Gao, Jin-Sheng","Diaquabis[(2-nitrophenylsulfinyl)acetato-<i>{κ</i>O}]copper(II) tetrahydrate","Acta Crystallographica Section E","2007","63","7","m1809","m1809","10.1107/S1600536807026347","","","0.71073","MoKα","","0.048","0.039","","","0.1095","0.1146","","","","","","1.134","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214348","8.851","0.006","9.139","0.006","12.458","0.006","72.19","0.02","77.68","0.03","78.69","0.02","928","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[methanolcopper(II)potassium(I)]-μ~3~- 1-(3-methoxy-2-oxidobenzylideneamino)-2-(2-oxidobenzamido)ethane]","","- C18 H19 Cu K N2 O5 -","- C18 H19 Cu K N2 O5 -","- C36 H38 Cu2 K2 N4 O10 -","2","1","NG2273","Luo, Wang-Xi; Yu, Ming-Ming; Zheng, Lei; Cui, Ai-Li; Kou, Hui-Zhong","<i>catena</i>-Poly[[methanolcopper(II)potassium(I)]-μ~3~-1-(3-methoxy-2-oxidobenzylideneamino)-2-(2-oxidobenzamido)ethane]","Acta Crystallographica Section E","2007","63","7","m1853","m1854","10.1107/S1600536807027717","","","0.71073","MoKα","","0.0593","0.0418","","","0.0844","0.0907","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214349","11.439","0.002","11.964","0.002","12.343","0.003","94.794","0.018","115.82","0.03","101.128","0.012","1464.9","0.7","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Poly[tetraaquabis(μ~4~-cyclohexane-1,4-dicarboxylato- κ^6^<i>O</i>:O,<i>O</i>':O'':<i>O</i>'',<i>O</i>''')hemi(μ~2~-cyclohexane- 1,4-dicarboxylato-κ^2^O:O')hemi(μ~2~-cyclohexane-1,4-dicarboxylato- κ^4^O,O':O'',O''')dipraseodymium(III)]","","- C24 H38 O16 Pr2 -","- C24 H38 O16 Pr2 -","- C48 H76 O32 Pr4 -","2","1","NG2275","Yu, Miao; Liu, Shu-Xia; Xie, Lin-Hua; Cao, Rui-Ge; Ren, Yuan-Hang","Poly[tetraaquabis(μ~4~-cyclohexane-1,4-dicarboxylato-κ^6^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>'':<i>O</i>'',<i>O</i>''')hemi(μ~2~-cyclohexane-1,4-dicarboxylato-κ^2^<i>O</i>:<i>O</i>')hemi(μ~2~-cyclohexane-1,4-dicarboxylato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''')dipraseodymium(III)]","Acta Crystallographica Section E","2007","63","7","m1889","m1890","10.1107/S1600536807028437","","","0.71073","MoKα","","0.029","0.0244","","","0.0496","0.051","","","","","","1.083","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214350","7.9835","0.001","13.312","0.002","13.645","0.0018","90","","90","","90","","1450.1","0.3","290","2","290","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","<i>mer</i>-Trichloridotris(dimethyl sulfide-<i>κS</i>)rhodium(III)","","- C6 H18 Cl3 Rh S3 -","- C6 H18 Cl3 Rh S3 -","- C24 H72 Cl12 Rh4 S12 -","4","1","NG2277","Abbasi, Alireza; Habibian, Maryam; Sandström, Magnus","<i>mer</i>-Trichloridotris(dimethyl sulfide-<i>{κ</i>S})rhodium(III)","Acta Crystallographica Section E","2007","63","7","m1904","m1904","10.1107/S1600536807027912","","","0.71073","MoKα","","0.0173","0.0165","","","0.0386","0.0389","","","","","","1.075","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214351","7.571","0.0012","15.75","0.004","27.403","0.005","90","","96.76","0.02","90","","3244.9","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-[2-(1,3-Dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl] 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","","- C28 H28 Co N4 O16 S2 -","- C28 H28 Co N4 O16 S2 -","- C112 H112 Co4 N16 O64 S8 -","4","1","NG2278","Hou, Yan-Jun; Yu, Ying-Hui; Sun, Zhi-Zhong; Li, Bai-Yan; Hou, Guang-Feng","Triaqua[(4-nitrophenylsulfonyl)acetato-κ<i>O</i>](1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II) (4-nitrophenylsulfonyl)acetate monohydrate","Acta Crystallographica Section E","2007","63","7","m1884","m1884","10.1107/S160053680702819X","","","0.71073","MoKα","","0.0544","0.0392","","","0.0869","0.0907","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214352","14.2831","0.0006","11.1025","0.0005","16.9556","0.0007","90","","106.677","0.004","90","","2575.7","0.2","120","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>cis</i>-Dichloridobis(ethyldiphenylphosphine-<i>κP</i>)platinum(II)","","- C28 H30 Cl2 P2 Pt -","- C28 H30 Cl2 P2 Pt -","- C112 H120 Cl8 P8 Pt4 -","4","1","NG2281","Wioleta Domanska-Babul; Chojnacki, Jaroslaw; Pikies, Jerzy","<i>cis</i>-Dichloridobis(ethyldiphenylphosphine-κ<i>P</i>)platinum(II)","Acta Crystallographica Section E","2007","63","7","m1956","m1956","10.1107/S1600536807029200","","","0.71073","MoKα","","","0.0294","","","","0.072","","","","","","1.101","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214353","9.609","0.001","9.927","0.001","11.4537","0.0012","90","","106.848","0.001","90","","1045.66","0.19","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[2-(2-pyridylmethylamino)ethanesulfonato- κ^3^<i>N</i>,<i>N</i>',<i>O</i>]nickel(II)","","- C16 H22 N4 Ni O6 S2 -","- C16 H22 N4 Ni O6 S2 -","- C32 H44 N8 Ni2 O12 S4 -","2","0.5","NG2282","Bei-Ling Liao; Jun-Xia Li; Yi-Min Jiang","Bis[2-(2-pyridylmethylamino)ethanesulfonato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]nickel(II)","Acta Crystallographica Section E","2007","63","7","m1974","m1974","10.1107/S1600536807029911","","","0.71073","MoKα","","0.026","0.0237","","","0.0664","0.0683","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214354","5.7294","0.0011","12.924","0.003","23.683","0.005","90","","95.64","0.03","90","","1745.2","0.6","295","2","295","2","","","","","","","","6","P 1 c 1","P -2yc","7","","[1-(2-Oxidobenzylidene)-4-phenylthiosemicarbazonato- κ^3^S,N^1^,O](pyridine-κN)nickel(II)","","- C19 H16 N4 Ni O S -","- C19 H16 N4 Ni O S -","- C76 H64 N16 Ni4 O4 S4 -","4","2","NG2284","Zi-Ying Cao; Deng, Zhao-Peng; Gao, Shan","[1-(2-Oxidobenzylidene)-4-phenylthiosemicarbazonato-κ^3^<i>S</i>,<i>N</i>^1^,<i>O</i>](pyridine-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2007","63","7","m1961","m1962","10.1107/S1600536807029698","","","0.71073","MoKα","","0.0771","0.0369","","","0.0656","0.0885","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214355","11.4392","0.0002","15.7757","0.0002","15.6508","0.0002","90","","97.846","0.002","90","","2797.92","0.07","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>cis</i>-[2,6-Bis(di-<i>tert</i>-butylphosphinomethyl)cyclohexyl- κ^3^<i>P</i>,C^1^,<i>P</i>']bromidopalladium(II)","","- C24 H49 Br P2 Pd -","- C24 H49 Br P2 Pd -","- C96 H196 Br4 P8 Pd4 -","4","1","NG2286","Olsson, Daniel; Janse van Rensburg, J. Marthinus; Wendt, Ola F","<i>cis</i>-[2,6-Bis(di-<i>tert</i>-butylphosphinomethyl)cyclohexyl-κ^3^<i>P</i>,<i>C</i>^1^,<i>P</i>']bromidopalladium(II)","Acta Crystallographica Section E","2007","63","7","m1969","m1969","10.1107/S160053680702990X","","","0.71073","MoKα","","","0.0409","","","","0.1219","","","","","","0.944","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214356","25.664","0.005","20.103","0.007","11.705","0.002","90","","90","","90","","6039","3","293","2","293","2","","","","","","","","7","F d d 2","F 2 -2d","43","","<i>catena</i>-Poly[[diaquabis[(4-chlorophenylsulfinyl)acetato- κ<i>O</i>]cadmium(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']","","- C26 H24 Cd Cl2 N2 O8 S2 -","- C26 H24 Cd Cl2 N2 O8 S2 -","- C208 H192 Cd8 Cl16 N16 O64 S16 -","8","0.5","NG2288","Su, Yu; Hou, Yan-Jun; Sun, Zhi-Zhong; Li, Bai-Yan; Hou, Guang-Feng","<i>catena</i>-Poly[[diaquabis[(4-chlorophenylsulfinyl)acetato-κ<i>O</i>]cadmium(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","7","m2005","m2005","10.1107/S1600536807030693","","","0.71073","MoKα","","0.0279","0.0252","","","0.0609","0.0622","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214357","8.524","0.005","15.044","0.009","15.218","0.009","90","","90","","90","","1951","2","298","2","298","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","{2-(2-Pyridyl)-5-[(2-pyridylmethylidene)aminomethyl]-1,3- oxazoline-κ^4^N}bis(thiocyanato-κN)nickel(II)","","- C17 H16 N6 Ni O S2 -","- C17 H16 N6 Ni O S2 -","- C68 H64 N24 Ni4 O4 S8 -","4","1","OM2112","Hai-Ying Fu; Jian-Min Dou; Da-Cheng Li; Da-Qi Wang","{2-(2-Pyridyl)-5-[(2-pyridylmethylidene)aminomethyl]-1,3-oxazoline-κ^4^<i>N</i>}bis(thiocyanato-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2007","63","7","m1793","m1795","10.1107/S1600536807022015","","","0.71073","MoKα","","0.0934","0.0558","","","0.1372","0.1637","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214358","8.9104","0.0007","9.4736","0.0007","20.5732","0.0016","90","","92.056","0.001","90","","1735.5","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 2-(1-benzyl-5-bromo-1<i>H</i>-indol-3-yl)-2-hydroxyacetate","","- C19 H18 Br N O3 -","- C19 H18 Br N O3 -","- C76 H72 Br4 N4 O12 -","4","1","OM2116","Hong-Ming Dong; Cai-Bao Chen","Ethyl 2-(1-benzyl-5-bromo-1<i>H</i>-indol-3-yl)-2-hydroxyacetate","Acta Crystallographica Section E","2007","63","7","o3262","o3263","10.1107/S1600536807025755","","","0.71073","MoKα","","0.0654","0.0426","","","0.1016","0.11","","","","","","1.018","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214359","4.5759","0.0006","9.4134","0.0011","18.54","0.002","90","","95.049","0.002","90","","795.51","0.16","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(<i>S</i>)-2-(1-Benzyl-5-bromo-1<i>H</i>-indol-3-yl)-2-hydroxy-<i>N</i>- methylacetamide","","- C18 H17 Br N2 O2 -","- C18 H17 Br N2 O2 -","- C36 H34 Br2 N4 O4 -","2","1","OM2117","Lu, Hai-Hua; Chen, Cai-Bao; Hong-Ming Dong","(<i>S</i>)-2-(1-Benzyl-5-bromo-1<i>H</i>-indol-3-yl)-2-hydroxy-<i>N</i>-methylacetamide","Acta Crystallographica Section E","2007","63","7","o3261","o3261","10.1107/S1600536807025767","","","0.71073","MoKα","","0.0366","0.0287","","","0.0608","0.0627","","","","","","0.945","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214360","19.961","0.002","7.5009","0.0009","18.488","0.002","90","","93.583","0.008","90","","2762.7","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[4-(dimethylamino)pyridine-κ<i>N</i>]bis(salicylato-κ<i>O</i>)zinc(II)","","- C28 H30 N4 O6 Zn -","- C28 H30 N4 O6 Zn -","- C112 H120 N16 O24 Zn4 -","4","0.5","OM2121","Kun-Hua Lin; Fei-Fei Zhang; Zhe-Yin Yu","Bis[4-(dimethylamino)pyridine-κ<i>N</i>]bis(salicylato-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2007","63","7","m1930","m1930","10.1107/S1600536807028322","","","0.71073","MoKα","","0.0513","0.0419","","","0.1012","0.1068","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214361","7.7713","0.0016","16.372","0.003","17.945","0.004","90","","95.43","0.03","90","","2273","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,6-Dimethyl-4-(3-nitro-phenyl)-1,4-dihydro-pyridine-3,5- dicarboxylic acid 3-[2-(1,3-dioxo-1,3-dihydro-isoindol-2-yl) -ethyl] ester 5-methyl ester","3-[2-(1,3-Dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl] 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","","- C26 H23 N3 O8 -","- C26 H23 N3 O8 -","- C104 H92 N12 O32 -","4","1","OM2126","Sun, Feng-Xia; Chu, Xiao-He; Chen, Xiang-Min","3-[2-(1,3-Dioxo-2,3-dihydro-1<i>H</i>-isoindol-2-yl)ethyl] 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica, Section E","2007","63","6","o3176","o3176","10.1107/S1600536807028188","","","0.71073","MoKα","","0.0512","0.0456","","","0.1063","0.1109","","","","","","1.096","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2214362","8.4682","0.001","11.9287","0.0014","12.9091","0.0015","63.478","0.002","78.683","0.002","83.063","0.002","1143.3","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Piperazinium hexaaquacobalt(II) bis[bis(pyridine-2,6-dicarboxylato)cobaltate(II)] octahydrate","","- C32 H52 Co3 N6 O30 -","- C32 H52 Co3 N6 O30 -","- C32 H52 Co3 N6 O30 -","1","0.5","OM2127","Aghabozorg, Hossein; Attar Gharamaleki, Jafar; Ghadermazi, Mohammad; Ghasemikhah, Pouya; Soleimannejad, Janet","Piperazinium hexaaquacobalt(II) bis[bis(pyridine-2,6-dicarboxylato)cobaltate(II)] octahydrate","Acta Crystallographica Section E","2007","63","7","m1803","m1804","10.1107/S1600536807025640","","","0.71073","MoKα","","0.0432","0.0356","","","0.0928","0.0972","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214363","8.3605","0.0009","9.3419","0.0007","17.652","0.001","92.472","0.005","95.599","0.007","107.209","0.007","1306.91","0.19","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Bis(acetylacetonato-κ^2^O,O')[2,2'-methylenebis(4,6-xylenolato)-κ^2^O,O'] titanium(IV)","","- C27 H32 O6 Ti -","- C27 H32 O6 Ti -","- C54 H64 O12 Ti2 -","2","1","OM2129","Balakrishna, Maravanji S.; Panda, Rashmishree; Mague, Joel T.","Bis(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')[2,2'-methylenebis(4,6-xylenolato)-κ^2^<i>O</i>,<i>O</i>']titanium(IV)","Acta Crystallographica Section E","2007","63","7","m1815","m1815","10.1107/S1600536807026761","","","0.71073","MoKα","","0.0878","0.0404","","","0.1112","0.1269","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214364","6.2038","0.0003","17.8512","0.0008","16.6216","0.0009","90","","91.072","0.003","90","","1840.44","0.16","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5,5'-Dimethoxy-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenol","","- C22 H20 N2 O4 -","- C22 H20 N2 O4 -","- C88 H80 N8 O16 -","4","1","OM2130","Naser Eltaher Eltayeb; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun; Kamarulazizi Ibrahim","5,5'-Dimethoxy-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenol","Acta Crystallographica Section E","2007","63","7","o3094","o3095","10.1107/S1600536807026141","","","0.71073","MoKα","","0.0859","0.0528","","","0.1415","0.1727","","","","","","1.098","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214365","14.675","0.003","11.271","0.002","11.086","0.002","90","","109.818","0.002","90","","1725","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(4-Chlorophenyl)-5-(4-fluorophenyl)-1-phenyl-2-pyrazoline","","- C21 H16 Cl F N2 -","- C21 H16 Cl F N2 -","- C84 H64 Cl4 F4 N8 -","4","1","OM2131","Huan-Mei Guo","3-(4-Chlorophenyl)-5-(4-fluorophenyl)-1-phenyl-2-pyrazoline","Acta Crystallographica Section E","2007","63","7","o3318","o3318","10.1107/S160053680703022X","","","0.71073","MoKα","","0.054","0.0394","","","0.1007","0.1106","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214366","5.4675","0.001","16.616","0.004","17.31","0.003","90","","90","","90","","1572.6","0.5","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","[<i>N</i>,<i>N</i>'-Bis(salicylidene)benzene-1,2-diaminato]iron(II)","{2,2'-[o-phenylenebis(nitrilomethylidyne)]diphenolato}iron(II)","","- C20 H14 Fe N2 O2 -","- C20 H14 Fe N2 O2 -","- C80 H56 Fe4 N8 O8 -","4","1","OM2132","Ye, Yong-Hao; Han, Yue; Chen, Ting-Ting; Liu, Chang-Hong","[<i>N</i>,<i>N</i>'-Bis(salicylidene)benzene-1,2-diaminato]iron(II)","Acta Crystallographica Section E","2007","63","7","m1963","m1963","10.1107/S1600536807029601","","","0.71073","MoKα","","0.076","0.0544","","","0.1464","0.1697","","","","","","0.689","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214367","8.9167","0.0005","10.1639","0.0005","14.355","0.0008","71.547","0.003","72.281","0.003","85.367","0.003","1175.36","0.11","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","5-(4-Methoxyphenyl)-3,3-dimethyl-2,3,4,5-tetrahydro-1H-benzo[b]carbazole-1,6,11-trione chloroform solvate","","- C26 H22 Cl3 N O4 -","- C26 H22 Cl3 N O4 -","- C52 H44 Cl6 N2 O8 -","2","1","OM2133","Hoong-Kun Fun; Suchada Chantrapromma; Yun Liu; Jian-Hua Xu","5-(4-Methoxyphenyl)-3,3-dimethyl-2,3,4,5-tetrahydro-1<i>H</i>-benzo[<i>b</i>]carbazole-1,6,11-trione chloroform solvate","Acta Crystallographica Section E","2007","63","7","o3236","o3237","10.1107/S1600536807028334","","","0.71073","MoKα","","0.0568","0.0451","","","0.1178","0.1254","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214368","5.3851","0.0002","12.6233","0.0006","13.3282","0.0006","90","","97.048","0.003","90","","899.17","0.07","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4',6,6'-Tetramethyl-2,2'-(butane-1,4-diyldithio)dipyrimidine","","- C16 H22 N4 S2 -","- C16 H22 N4 S2 -","- C32 H44 N8 S4 -","2","0.5","OM2134","Wang, Min; Cheng, Le-Hua; Wang, An-Ming","4,4',6,6'-Tetramethyl-2,2'-(butane-1,4-diyldithio)dipyrimidine","Acta Crystallographica Section E","2007","63","7","o3296","o3296","10.1107/S1600536807029510","","","0.71073","MoKα","","0.0708","0.0411","","","0.0954","0.1086","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214369","21.1172","0.0018","16.8787","0.0014","12.0819","0.001","90","","105.531","0.001","90","","4149.1","0.6","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Bis[N-ethyl-N'-(pyridin-2-ylmethylene)ethane-1,2-diamine]nickel(II) bis(perchlorate)","","- C20 H30 Cl2 N6 Ni O8 -","- C20 H30 Cl2 N6 Ni O8 -","- C120 H180 Cl12 N36 Ni6 O48 -","6","1.5","OM2138","Zhe Hong","Bis[<i>N</i>-ethyl-<i>N</i>'-(pyridin-2-ylmethylene)ethane-1,2-diamine]nickel(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","7","m2026","m2026","10.1107/S160053680703108X","","","0.71073","MoKα","","0.097","0.0586","","","0.1609","0.1894","","","","","","0.989","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214370","12.3281","0.0003","14.9809","0.0004","12.7137","0.0003","90","","102.202","0.001","90","","2295","0.1","173","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","{μ-1,1'-[2-Cyano-2-(2-pyridyl)propane-1,3-","","- C25 H16 Mn2 N2 O6 -","- C25 H16 Mn2 N2 O6 -","- C100 H64 Mn8 N8 O24 -","4","1","PK2012","Duke, III, Charles B.; To, Tung T.; Ross, II, Charles R.; Burkey,Theodore J.","{μ-1,1'-[2-Cyano-2-(2-pyridyl)propane-1,3-diyl]di-η^5^-cyclopentadienyl}bis[tricarbonylmanganese(II)]","Acta Crystallographica Section E","2007","63","7","m1848","m1849","10.1107/S160053680701940X","","","1.54178","CuKα","","","0.026","","","","0.07","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214371","7.0497","0.0003","10.5161","0.0004","9.1022","0.0004","90","","90","","90","","674.79","0.05","150","","150","","","","","","","","","5","P n a 21","P 2c -2n","33","","3-fluorosalicylaldoxime","","- C7 H6 F N O2 -","- C7 H6 F N O2 -","- C28 H24 F4 N4 O8 -","4","1","PK2020","Peter A. Wood; Ross S. Forgan; Simon Parsons; Elna Pidcock; Peter A. Tasker","3-Fluorosalicylaldoxime","Acta Crystallographica Section E","2007","63","7","o3132","o3132","10.1107/S1600536807020776","","","0.71073","MoKα","","0.0417","0.0369","","0.0952","0.0944","0.0952","","","","","","0.9955","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214372","15.694","0.002","14.713","0.002","13.8868","0.0019","90","","112.674","0.002","90","","2958.7","0.7","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis-Bis(4,4'-dimethyl-2,2'-bipyridyl)bis(dicyanamide)zinc(II) ethanol hemisolvate","","- C29 H27 N10 O0.5 Zn -","- C29 H27 N10 O0.5 Zn -","- C116 H108 N40 O2 Zn4 -","4","1","PK2021","Xiao-Zeng Li; Li-Na Zhu; Hao Qu; Di-Di Xu; De-Ming Kong","<i>cis</i>-Bis(dicyanamido)bis(4,4'-dimethyl-2,2'-bipyridyl)zinc(II) ethanol hemisolvate","Acta Crystallographica Section E","2007","63","7","m1812","m1812","10.1107/S1600536807025263","","","0.71073","MoKα","","0.0864","0.0568","","","0.1774","0.206","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2214373","8.004","0.003","10.085","0.004","13.432","0.004","108.65","0.04","93.56","0.03","99.84","0.04","1004.2","0.7","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","cis-(±)-Phenyl[2,4,5-tri-2-pyridyl-4,5-dihydroimidazol-1-yl]methanone","","- C25 H19 N5 O -","- C25 H19 N5 O -","- C50 H38 N10 O2 -","2","1","PK2022","Campos-Gaxiola, José J.; Aguirre, Gerardo; Parra-Hake, Miguel","<i>cis</i>-(±)-Phenyl[2,4,5-tri-2-pyridyl-4,5-dihydroimidazol-1-yl]methanone","Acta Crystallographica Section E","2007","63","7","o3126","o3127","10.1107/S1600536807026414","","","0.71073","MoKα","","0.1228","0.0569","","","0.1126","0.1402","","","","","","0.994","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214374","25.8135","0.0002","25.8135","0.0002","25.8135","0.0002","90","","90","","90","","17200.5","0.2","100","2","100","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","H~4~OETPP2Cl","2,3,7,8,12,13,17,18-octaethyl-5,10,15,20-tetraphenylporphyrin dichloride toluene 1.33-solvate","","- C69.33 H74.67 Cl2 N4 -","- C69.24 H74.56 Cl2 N4 -","- C830.88 H894.72 Cl24 N48 -","12","0.25","PK2027","Hu, Chuanjiang; Noll, Bruce C.; Scheidt, W. Robert.","The highly saddled octaethyltetraphenylporphyrin-[H~4~OETPP] dichloride toluene 1.33-solvate","Acta Crystallographica Section E","2007","63","7","o3128","o3128","10.1107/S1600536807027018","","","0.71073","MoKα","","0.06","0.0456","","","0.119","0.139","","","","","","1.15","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214375","7.2673","0.0002","12.3571","0.0002","13.2963","0.0002","92.65","0.001","101.089","0.001","90.205","0.001","1170.4","0.04","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","8-{4-[<i>N</i>,<i>N</i>-Bis(2-chloroethyl)amino]phenyl}-4,4-difluoro- 1,3,5,7-tetramethyl-4-bora-3a,4a-diaza-<i>s</i>-indacene","","- C23 H26 B Cl2 F2 N3 -","- C23 H26 B Cl2 F2 N3 -","- C46 H52 B2 Cl4 F4 N6 -","2","1","PK2028","Mao-Zhong Tian; Shang Gao; Xiao-Jun Peng","8-{4-[<i>N</i>,<i>N</i>-Bis(2-chloroethyl)amino]phenyl}-4,4-difluoro-1,3,5,7-tetramethyl-4-bora-3a,4a-diaza-<i>s</i>-indacene","Acta Crystallographica Section E","2007","63","7","o3317","o3317","10.1107/S1600536807030231","","","0.71073","MoKα","","0.0786","0.0577","","0.1634","","0.1784","","","1.033","","","1.028","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214376","10.9843","0.0002","22.8189","0.0004","13.5307","0.0003","90","","90.4679","0.0008","90","","3391.35","0.11","120","2","120","2","","","","","","","","3","P 1 21 1","P 2yb","4","Oxalate dimer of DHEA","Bis(17-oxoandrost-5-en-3β-yl) oxalate","","- C40 H54 O6 -","- C40 H54 O6 -","- C160 H216 O24 -","4","2","PK2029","Cox, Philip J.; Nahar, Lutfan; Sarker, Satyajit D.; Alan B. Turner","The oxalate diester of dehydroepiandrosterone","Acta Crystallographica Section E","2007","63","7","o3222","o3222","10.1107/S1600536807028620","","","0.71073","MoKα","","","0.0409","","","","0.101","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214377","6.6692","0.0011","6.6692","0.0011","18.371","0.002","90","","90","","120","","707.64","0.18","290","2","290","2","","","","","","","","6","P 63/m c m","-P 6c 2","193","","Poly[triaquahexa-μ-cyanido-terbium(III)trisilver(I)]","","- C6 H6 Ag3 N6 O3 Tb -","- C6 H6 Ag3 N6 O3 Tb -","- C12 H12 Ag6 N12 O6 Tb2 -","2","0.0833333","PK2030","Kalachnikova, Katrina; Assefa, Zerihun; Sykora, Richard E.","Poly[triaquahexa-μ-cyanido-terbium(III)trisilver(I)]: a 4<i>f</i>‒4<i>d</i> bimetallic coordination polymer","Acta Crystallographica Section E","2007","63","7","i162","i162","10.1107/S1600536807029133","","","0.71073","MoKα","","0.0248","0.0191","","","0.045","0.0472","","","","","","1.14","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214378","10.0347","0.0004","8.4616","0.0007","20.1168","0.0009","90","","103.75","0.003","90","","1659.16","0.17","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(2,2-Dimethoxyethyl)-3-oxo-1,2,3,4,5,6-hexahydro-1,5-methano- 7H-azocino[4,3-b]indole","","- C18 H22 N2 O3 -","- C18 H22 N2 O3 -","- C72 H88 N8 O12 -","4","1","RK2017","Hökelek, Tuncer; Şahin, Ertan; Uludağ, Nesimi; Erdoğan, Ümit Işık","2-(2,2-Dimethoxyethyl)-3-oxo-1,2,3,4,5,6-hexahydro-1,5-methano-7<i>H</i>-azocino[4,3-<i>b</i>]indole","Acta Crystallographica Section E","2007","63","7","o3268","o3268","10.1107/S1600536807029480","","","0.71073","MoKα","","0.1254","0.0667","","","0.18","0.2312","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214379","29.905","0.003","10.4609","0.0009","11.4613","0.001","90","","99.507","0.004","90","","3536.2","0.6","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(<i>E</i>)-<i>N'</i>-(4-Hydroxybenzylidene)-4-(quinolin-8-yloxy)butanohydrazide hemihydrate","","- C40 H40 N6 O7 -","- C20 H20 N3 O3.5 -","- C160 H160 N24 O28 -","8","1","RK2018","Ze-Bao Zheng; Ren-Tao Wu; Ji-Kun Li; Jing-Rong Lu","(<i>E</i>)-<i>N</i>'-(4-Hydroxybenzylidene)-4-(quinolin-8-yloxy)butanohydrazide hemihydrate","Acta Crystallographica Section E","2007","63","7","o3284","o3284","10.1107/S1600536807029509","","","0.71073","MoKα","","0.1201","0.0611","","","0.1474","0.1871","","","","","","0.998","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214380","10.8327","0.00015","10.8327","0.00015","29.1244","0.0006","90","","90","","90","","3417.67","0.1","373","2","373","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","Pt(dpdpc)2(BF4)2","Bis(<i>cis</i>-1,4-diphenyl-1,4-diphosphacyclohexane-κ^2^P,P')platinum(II) bis(tetrafluoridoborate)","","- C32 H36 B2 F8 P4 Pt -","- C32 H36 B2 F8 P4 Pt -","- C128 H144 B8 F32 P16 Pt4 -","4","0.5","RK2020","Morey, Tara S.; Miller, Susie M.; Helm, Monte L.","Bis(<i>cis</i>-1,4-diphenyl-1,4-diphosphacyclohexane-κ^2^<i>P</i>,<i>P</i>')platinum(II) bis(tetrafluoridoborate)","Acta Crystallographica Section E","2007","63","7","m1983","m1983","10.1107/S1600536807030115","","","0.71073","MoKα","","0.018","0.0156","","","0.0321","0.0326","","","","","","0.98","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214381","11.9729","0.0018","16.584","0.002","22.581","0.004","90","","90","","90","","4483.7","1.2","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-Chloro-4,6-bis(1,1,3,3-tetramethylbutylamino)-s-triazine","","- C19 H36 Cl N5 -","- C19 H36 Cl N5 -","- C152 H288 Cl8 N40 -","8","1","RN2026","Fan-Yong Yan","2-Chloro-4,6-bis(1,1,3,3-tetramethylbutylamino)-<i>s</i>-triazine","Acta Crystallographica Section E","2007","63","7","o3327","o3327","10.1107/S1600536807030334","","","0.71073","MoKα","","0.1263","0.0489","","","0.1159","0.1633","","","","","","1.038","","","","has coordinates,has disorder","176787","2020-10-21","18:00:00",""
"2214382","13.079","0.003","14.764","0.004","16.693","0.004","90","","90.923","0.004","90","","3223","1.4","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6-Amino-4-(3-nitrophenyl)-2-oxo-1,2-dihydropyridine-3,5-dicarbonitrile ethanol solvate","","- C15 H13 N5 O4 -","- C15 H13 N5 O4 -","- C120 H104 N40 O32 -","8","2","RZ2140","Jia-Ning Xu; Run-Hong Jia; Shu-Jiang Tu","6-Amino-4-(3-nitrophenyl)-2-oxo-1,2-dihydropyridine-3,5-dicarbonitrile ethanol solvate","Acta Crystallographica Section E","2007","63","7","o3342","o3343","10.1107/S160053680703053X","","","0.71073","MoKα","","0.1896","0.0578","","","0.0974","0.1237","","","","","","1.006","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214383","19.591","0.001","6.478","0.001","12.843","0.002","90","","100.36","0.02","90","","1603.3","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(ethylenediammonium) dichromate oxalate","","- C6 H20 Cr2 N4 O11 -","- C6 H20 Cr2 N4 O11 -","- C24 H80 Cr8 N16 O44 -","4","0.5","RZ2143","Ben Smail, Ridha; Chebbi, Hammouda; Driss, Ahmed","Bis(ethylenediammonium) dichromate oxalate","Acta Crystallographica Section E","2007","63","7","m1859","m1860","10.1107/S1600536807027808","","","0.71073","MoKα","","0.0441","0.0412","","","0.121","0.1244","","","","","","1.079","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214384","12.507","0.002","11.552","0.001","12.787","0.002","90","","93.543","0.001","90","","1843.9","0.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Acetonitrile{2-[3-(dimethylamino)propyliminomethyl]-4-nitrophenolato- κ^3^N,N',O}(thiocyanato-κN)copper(II)","","- C15 H19 Cu N5 O3 S -","- C15 H19 Cu N5 O3 S -","- C60 H76 Cu4 N20 O12 S4 -","4","1","RZ2144","Li-Juan Ye; Zhong-Lu You","Acetonitrile{2-[3-(dimethylamino)propyliminomethyl]-4-nitrophenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>}(thiocyanato-κ<i>N</i>)copper(II)","Acta Crystallographica Section E","2007","63","7","m1837","m1837","10.1107/S1600536807025342","","","0.71073","MoKα","","0.054","0.0367","","","0.09","0.098","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214385","28.646","0.006","8.249","0.0016","21.176","0.004","90","","112.98","0.03","90","","4606.8","1.9","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(dimethylformamide-2κO)bis[μ-1-(2-oxidobenzoyl)-2- (phenoxyacetyl)hydrazine(3-)]- 1κ^3^O,N,O':2κ^2^N,O'';2κ^2^N,O'':3κ^3^O,N,O'-dipyridine-1κN,3κN- trinickel(II)","","- C46 H46 N8 Ni3 O10 -","- C46 H46 N8 Ni3 O10 -","- C184 H184 N32 Ni12 O40 -","4","0.5","RZ2145","Zhao, Yan; Luo, Jian-Hai; Huang, Xi-He; Huang, Chang-Cang; Liu, Dong-Sheng","Bis(dimethylformamide-2κ<i>O</i>)bis[μ-1-(2-oxidobenzoyl)-2-(phenoxyacetyl)hydrazine(3{-})]-1κ^3^<i>O</i>,<i>N</i>,<i>O</i>':2κ^2^<i>N</i>,<i>O</i>'';2κ^2^<i>N</i>,<i>O</i>'':3κ^3^<i>O</i>,<i>N</i>,<i>O</i>'-dipyridine-1κ<i>N</i>,3κ<i>N</i>-trinickel(II)","Acta Crystallographica Section E","2007","63","7","m1999","m2000","10.1107/S1600536807030498","","","0.71073","MoKα","","0.1091","0.06","","","0.1098","0.1291","","","","","","1.004","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214386","14.957","0.011","8.268","0.005","7.795","0.005","90","","90","","90","","964","1.1","298","1","","","","","","","","","","5","P c a 21","P 2c -2ac","29","","1-Methyl-4-methylsulfonyl-2-nitrobenzene","","- C8 H9 N O4 S -","- C8 H9 N O4 S -","- C32 H36 N4 O16 S4 -","4","1","SG2167","Qing-An Wu; Wei-Ming Fang; Da-Wei Luo; Zhen-Yuan Xu","1-Methyl-4-methylsulfonyl-2-nitrobenzene","Acta Crystallographica Section E","2007","63","7","o3320","o3320","10.1107/S1600536807027845","","","0.71075","MoKα","","","0.0325","","","","0.077","","","","","","1.018","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214387","16.098","0.006","11.55","0.004","10.687","0.004","90","","128.349","0.005","90","","1558.3","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis[μ-1,4-bis(1,2,4-triazol-1-ylmethyl)benzene- κ^2^N^4^:N^4'^]copper(I)] perchlorate]","","- C12 H12 Cl Cu N6 O4 -","- C12 H12 Cl Cu N6 O4 -","- C48 H48 Cl4 Cu4 N24 O16 -","4","0.5","SG2171","Jin Lin; Gui-Ying Dong","<i>catena</i>-Poly[[bis[μ-1,4-bis(1,2,4-triazol-1-ylmethyl)benzene-κ^2^<i>N</i>^4^:<i>N</i>^4'^]copper(I)] perchlorate]","Acta Crystallographica Section E","2007","63","7","m1944","m1944","10.1107/S1600536807029492","","","0.71073","MoKα","","0.0778","0.0463","","","0.0954","0.1069","","","","","","1.095","","","","has coordinates,has disorder","176787","2020-10-21","18:00:00",""
"2214388","3.6725","0.0019","17.96","0.009","9.01","0.005","90","","107.469","0.019","90","","566.9","0.5","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","hypoxanthine","1,7-dihydro-6<i>H</i>-purin-6-one","","- C5 H4 N4 O -","- C5 H4 N4 O -","- C20 H16 N16 O4 -","4","1","SG2177","Rui-Qing Yang; Yong-Rong Xie","A monoclinic polymorph of hypoxanthine","Acta Crystallographica Section E","2007","63","7","o3309","o3309","10.1107/S1600536807030164","","","0.71073","MoKα","","0.0406","0.0356","","","0.1049","0.1088","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214389","13.0233","0.0013","15.969","0.003","3.869","0.001","90","","90","","90","","804.6","0.3","293","","","","","","","","","","","4","P n a 21","P 2c -2n","33","7-Azathieno[3,2-c]cinnoline","pyrido[4,3-e]thieno[3,2-c]pyridazine","","- C9 H5 N3 S -","- C9 H5 N3 S -","- C36 H20 N12 S4 -","4","1","SG2180","Hansen, Lars Kr.; Stockmann, Vegar; Fiksdahl, Anne","7-Azathieno[3,2-<i>c</i>]cinnoline","Acta Crystallographica Section E","2007","63","7","o3290","o3290","10.1107/S1600536807029947","","","0.7107","MoKα","","","0.0429","","","","0.1095","","","","","","0.988","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214390","9.7056","0.0004","9.7763","0.0003","15.0413","0.0005","93.126","0.002","92.987","0.002","103.301","0.002","1383.77","0.09","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","Ethyl (2E)-[1-(4-methoxyphenyl)pyrrolidin-2-ylidene]acetate","","- C15 H19 N O3 -","- C15 H19 N O3 -","- C60 H76 N4 O12 -","4","2","SI2016","Fernandes, Manuel A.; Michael, Joseph P.; Perry, Christopher B.","Ethyl (2<i>E</i>)-[1-(4-methoxyphenyl)pyrrolidin-2-ylidene]acetate","Acta Crystallographica Section E","2007","63","7","o3139","o3140","10.1107/S1600536807023689","","","0.71073","MoKα","","0.1005","0.0473","","","0.1002","0.1204","","","","","","0.944","","","","has coordinates,has Fobs","248584","2020-10-21","18:00:00",""
"2214391","22.1138","0.0003","22.1138","0.0003","12.8884","0.0002","90","","90","","120","","5458.29","0.13","291","2","291","2","","","","","","","","7","P 31 2 1","P 31 2""","152","","Bis(μ-4-benzyl-3,5-diphenylpyrazolato-κ^2^<i>N</i>:<i>N</i>')bis[(4,4'-\ dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')palladium(II)] bis(hexafluoridophosphate) diethyl ether monosolvate monohydrate","","- C72 H70 F12 N8 O2 P2 Pd2 -","- C72 H70 F12 N8 O2 P2 Pd2 -","- C216 H210 F36 N24 O6 P6 Pd6 -","3","0.5","SI2018","Hai-Ping Huang; Li-Xia Liu","Bis(μ-4-benzyl-3,5-diphenylpyrazolato-κ^2^<i>N</i>:<i>N</i>')bis[(4,4'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')palladium(II)] bis(hexafluorophosphate) diethyl ether monosolvate monohydrate","Acta Crystallographica Section E","2007","63","7","m1875","m1876","10.1107/S1600536807028401","","","0.71073","MoKα","","0.053","0.0449","","","0.1321","0.1435","","","","","","1.095","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214392","9.2009","0.0014","12.6299","0.0019","15.598","0.002","74.435","0.002","77.913","0.002","68.677","0.002","1613.9","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","benzoato}triphenyltin(IV)","","- C37 H31 N3 O3 Sn -","- C37 H31 N3 O3 Sn -","- C74 H62 N6 O6 Sn2 -","2","1","SI2019","Fang, Xiao-Niu; Sui, Yan; Hu, Rong-Hua; Luo, Qiu-Yan; Qin, Hai-Qiong","{(<i>E</i>)-4-[(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)iminomethyl]benzoato}triphenyltin(IV)","Acta Crystallographica Section E","2007","63","7","m1843","m1843","10.1107/S1600536807027298","","","0.71073","MoKα","","0.024","0.023","","","0.0596","0.0604","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214393","10.1731","0.0002","14.1431","0.0002","6.4862","0.0001","90","","90","","90","","933.23","0.03","150","2","150","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","Bis{2-[(dimethylamino-κN)methyl]benzenethiolato-κS}zinc(II)","","- C18 H24 N2 S2 Zn -","- C18 H24 N2 S2 Zn -","- C36 H48 N4 S4 Zn2 -","2","0.5","SI2020","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.; Kleijn, Henk; van Koten, Gerard","Bis{2-[(dimethylamino-κ<i>N</i>)methyl]benzenethiolato-κ<i>S</i>}zinc(II)","Acta Crystallographica Section E","2007","63","7","m1847","m1847","10.1107/S1600536807027183","","","0.71073","MoKα","","0.0237","0.0203","","","0.0457","0.0469","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214394","10.194","0.004","10.681","0.005","15.352","0.008","80.76","0.04","80.31","0.02","72.71","0.05","1562.4","1.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5''-Benzylidene-1''-methyl-4',5'-diphenyl-1H-indole-3-spiro-2'-pyrrolidine-\ 3'-spiro-3''-piperidine-2,4''-dione","","- C35 H31 N3 O2 -","- C35 H31 N3 O2 -","- C70 H62 N6 O4 -","2","1","SJ2320","B. Ravi Kumar; S. Pandiarajan; V. Ramakrishnan; R. Ranjith Kumar; S. Perumal","5''-Benzylidene-1''-methyl-4',5'-diphenyl-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-3''-piperidine-2,4''-dione","Acta Crystallographica Section E","2007","63","7","o3221","o3221","10.1107/S1600536807025822","","","0.71073","MoKα","","0.1378","0.0514","","","0.1217","0.1433","","","","","","0.89","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2214395","7.8478","0.0008","10.3924","0.001","15.4582","0.0016","90","","90","","90","","1260.7","0.2","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Dichlorido-1κ^2^Cl-μ-[(1,2,5,6-η:3,4,7,8-η)-1,3,5,7- cyclooctatetraene]dimethyl-2κ^2^C-diplatinum(II)","","- C10 H14 Cl2 Pt2 -","- C10 H14 Cl2 Pt2 -","- C40 H56 Cl8 Pt8 -","4","0.5","SK3133","Song, Ah-Ran; Hwang, In-Chul; Ha, Kwang","Dichlorido-1κ^2^Cl-μ-[(1,2,5,6-η:3,4,7,8-η)-1,3,5,7-cyclooctatetraene]dimethyl-2κ^2^<i>C</i>-diplatinum(II)","Acta Crystallographica Section E","2007","63","7","m1878","m1878","10.1107/S1600536807028036","","","0.71073","MoKα","","0.0648","0.0576","","","0.1407","0.1445","","","","","","1.203","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214396","90.019","0.014","5.8228","0.0009","7.5301","0.0012","90","","90.868","0.004","90","","3946.5","1.1","173","","","","","","","","","","","4","C 1 c 1","C -2yc","9","","1,5-Bis(4-fluorophenyl)penta-1,4-dien-3-one","","- C17 H12 F2 O -","- C17.0235 H12 F2.00293 O1.00147 -","- C204.282 H144 F24.0352 O12.0176 -","12","3","TK2156","Butcher, Ray J.; Jasinski, Jerry P.; Sarojini, B.K.; Yathirajan, H. S.; Bindya, S; Narayana, B.","1,5-Bis(4-fluorophenyl)penta-1,4-dien-3-one","Acta Crystallographica Section E","2007","63","7","o3213","o3214","10.1107/S1600536807026116","","","0.71073","MoKα","","","0.094","","","","0.275","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","208381","2020-10-21","18:00:00",""
"2214397","10.0338","0.0007","11.5819","0.0008","34.499","0.003","90","","90","","90","","4009.1","0.5","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","4-Bromo-5-[(4-chlorobenzylidene)amino]-1-[2,6-dichloro-4- (trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile","","- C18 H7 Br Cl3 F3 N4 -","- C18 H7 Br Cl3 F3 N4 -","- C144 H56 Br8 Cl24 F24 N32 -","8","1","TK2157","Yu, Xiao-Chun; Li, Shu-Yan; Zhong, Ping","4-Bromo-5-[(4-chlorobenzylidene)amino]-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazole-3-carbonitrile","Acta Crystallographica Section E","2007","63","7","o3098","o3098","10.1107/S1600536807026256","","","0.71073","MoKα","","0.095","0.058","","","0.158","0.186","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214398","11.0257","0.0004","11.4172","0.0004","20.4527","0.0007","82.369","0.002","77.01","0.002","65.543","0.002","2281.36","0.14","296","2","100","2","","","","","","","","2","P -1","-P 1","2","","1,6,11,18,24,27,33,51,54,60-Decakis(trifluoromethyl)- 1,6,11,18,24,27,33,51,54,60-decahydro(C~60~-I~h~)[5,6]fullerene","","- C70 F30 -","- C70 F30 -","- C140 F60 -","2","1","TK2158","Shustova, Natalia B.; Peryshkov, Dimitry V.; Popov, Alexey A.; Boltalina, Olga V.; Strauss, Steven H.","1,6,11,18,24,27,33,51,54,60-Decakis(trifluoromethyl)-1,6,11,18,24,27,33,51,54,60-decahydro(C~60~-<i>I</i>~<i>h~</i>)[5,6]fullerene","Acta Crystallographica Section E","2007","63","7","o3129","o3129","10.1107/S1600536807026128","","","0.71073","MoKα","","0.105","0.051","","","0.104","0.122","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214399","10.6974","0.0009","10.4056","0.0009","11.0337","0.0009","90","","111.015","0.002","90","","1146.5","0.17","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(2E,2'E)-3,3'-(1,4-Phenylene)bis[1-(3,4-methoxyphenyl)prop-2-en-1-one]","","- C28 H26 O6 -","- C28 H26 O6 -","- C56 H52 O12 -","2","0.5","TK2159","Harrison, William T. A.; H. J. Ravindra; M. R. Suresh Kumar; S. M. Dharmaprakash","(2E,2'<i>E</i>)-3,3'-(1,4-Phenylene)bis[1-(3,4-dimethoxyphenyl)prop-2-en-1-one]","Acta Crystallographica Section E","2007","63","7","o3068","o3068","10.1107/S1600536807026281","","","0.71073","MoKα","","0.0629","0.0419","","","0.1062","0.1171","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214400","8.1417","0.0017","26.757","0.006","7.0974","0.0015","90","","115.587","0.002","90","","1394.5","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-Acetyl-3-(4-bromophenyl)-5-(2-furyl)-2-pyrazoline","","- C15 H13 Br N2 O2 -","- C15 H13 Br N2 O2 -","- C60 H52 Br4 N8 O8 -","4","1","TK2160","Huan-Mei Guo","1-Acetyl-3-(4-bromophenyl)-5-(2-furyl)-2-pyrazoline","Acta Crystallographica Section E","2007","63","7","o3165","o3165","10.1107/S160053680702778X","","","0.71073","MoKα","","0.059","0.043","","","0.11","0.119","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214401","5.7328","0.0002","10.9152","0.0004","11.2665","0.0004","90","","97.106","0.004","90","","699.58","0.04","150","2","150","2","","","","","","","","5","P 1 a 1","P -2ya","7","dimesna","poly[[di-μ-aqua-μ~4~-[2,2'-dithiobis(ethanesulfonato)]-disodium(I)] monohydrate]","","- C4 H14 Na2 O9 S4 -","- C4 H14 Na2 O9 S4 -","- C8 H28 Na4 O18 S8 -","2","1","TK2163","Bambagiotti-Alberti, Massimo; Bartolucci, Gianluca; Bruni, Bruno; Di Vaira, Massimo; Passaponti, Maurizio","Disodium 2,2'-dithiobis(ethanesulfonate) trihydrate (dimesna trihydrate)","Acta Crystallographica Section E","2007","63","7","m1948","m1948","10.1107/S1600536807029273","","","1.5418","CuKα","","0.0277","0.0263","","","0.0683","0.0693","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214402","9.138","0.0007","16.0009","0.0011","14.2139","0.001","90","","90.982","0.001","90","","2078","0.3","103","","103","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,5-Bis(3-bromothien-2-yl)-3-(2,3,5-trichlorophenyl)pentane-1,5-dione","","- C19 H11 Br2 Cl3 O2 S2 -","- C19 H11 Br2 Cl3 O2 S2 -","- C76 H44 Br8 Cl12 O8 S8 -","4","1","TK2165","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Bindya, S; Narayana, B.","1,5-Bis(3-bromothien-2-yl)-3-(2,3,5-trichlorophenyl)pentane-1,5-dione","Acta Crystallographica Section E","2007","63","7","o3330","o3330","10.1107/S1600536807030589","","","0.71073","MoKα","","0.044","0.03","","","0.068","0.073","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214403","19.122","0.001","18.499","0.001","7.2538","0.0004","90","","91.424","0.001","90","","2565.2","0.2","291","2","291","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","poly[[[μ-2,3-di-4-pyridylbutane-2,3-diol-κ^2^<i>N</i>:<i>N</i>']-μ-\ iodido-copper(I)] dimethyl sulfoxide solvate]","","- C16 H22 Cu I N2 O3 S -","- C17 H22 Cu I N2 O3 S -","- C68 H88 Cu4 I4 N8 O12 S4 -","4","0.5","TK2166","Ng, Seik Weng","Rerefinement of poly[[[μ-2,3-di-4-pyridylbutane-2,3-diol-κ^2^<i>N</i>:<i>N</i>']-μ-iodido-copper(I)] dimethyl sulfoxide solvate] as an anhydrous honeycomb structure","Acta Crystallographica Section E","2007","63","7","m2003","m2003","10.1107/S1600536807030607","","","0.71073","MoKα","","0.053","0.046","","","0.173","0.184","","","","","","1.1","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214404","9.4779","0.0002","11.065","0.0003","17.5816","0.0004","90","","95.431","0.001","90","","1835.56","0.08","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bis(dicyclohexylammonium 4-hydroxybenzoate)","","- C19 H29 N O3 -","- C19 H29 N O3 -","- C76 H116 N4 O12 -","4","1","TK2167","Zain, Sharifuddin Md.; Ng, Seik Weng","Bis(dicyclohexylammonium 4-hydroxybenzoate)","Acta Crystallographica, Section E","2007","63","7","o3303","o3303","10.1107/S1600536807029856","","","0.71073","MoKα","","0.061","0.045","","","0.122","0.135","","","","","","1.04","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2214405","6.8301","0.0007","12.1321","0.0014","12.9487","0.001","79.232","0.007","89.907","0.007","82.125","0.007","1043.82","0.18","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","2-Amino-4,5-dihydro-1<i>H</i>-imidazol-3-ium 7,8-dihydroimidazo[1,2-<i>c</i>][1,3,5]thiadiazine-2,4(6<i>H</i>)-dithione(1-) dimethylformamide disolvate","","- C14 H26 N8 O2 S3 -","- C14 H26 N8 O2 S3 -","- C28 H52 N16 O4 S6 -","2","1","TK2169","Maria Gdaniec; Jarosław Saczewski; Franciszek Saczewski","2-Amino-4,5-dihydro-1<i>H</i>-imidazol-3-ium 7,8-dihydroimidazo[1,2-<i>c</i>][1,3,5]thiadiazine-2,4(6<i>H</i>)-dithione(1{-}) dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","7","o3329","o3329","10.1107/S1600536807030590","","","0.71073","MoKα","","0.043","0.037","","","0.083","0.088","","","","","","1.12","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214406","13.4603","0.001","3.7507","0.0003","14.8398","0.0011","90","","114.531","0.005","90","","681.57","0.09","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Hydroxysalicylaldoxime","","- C7 H7 N O3 -","- C7 H7 N O3 -","- C28 H28 N4 O12 -","4","1","WK2053","Peter A. Wood; Ross S. Forgan; Simon Parsons; Elna Pidcock; Peter A. Tasker","3-Hydroxysalicylaldoxime","Acta Crystallographica Section E","2007","63","7","o3131","o3131","10.1107/S1600536807020922","","","0.71073","MoKα","","0.0601","0.035","","0.1173","0.0895","0.1173","","","","","","0.9869","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214407","14.815","0.009","6.192","0.004","17.989","0.011","90","","106.127","0.011","90","","1585.3","1.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Fluoro-N-[(E)-1-(6-methoxy-2-naphthyl)methylidene]-5-(trifluoromethyl)aniline","","- C19 H13 F4 N O -","- C19 H13 F4 N O -","- C76 H52 F16 N4 O4 -","4","1","WK2054","Guo-Bing, Yan; Liang-Gui, Wang; Chun-Niu, Zhang","2-Fluoro-<i>N</i>-[(<i>E</i>)-1-(6-methoxy-2-naphthyl)methylidene]-5-(trifluoromethyl)aniline","Acta Crystallographica Section E","2007","63","7","o3201","o3201","10.1107/S1600536807028486","","","0.71073","MoKα","","0.1055","0.0961","","","0.2003","0.2062","","","","","","1.148","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214408","6.5648","0.0005","7.3451","0.0007","25.956","0.002","90","","96.387","0.004","90","","1243.81","0.18","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Methyl-N'-(2-thienylcarboxyl)butyrohydrazide","","- C10 H16 N2 O3 S -","- C10 H16 N2 O3 S -","- C40 H64 N8 O12 S4 -","4","1","WK2059","Guo-Xiang Liu; Wen-Shi Wu; Hai-Ping Li; Guo-Dong Yang","3-Methyl-<i>N</i>'-(2-thienylcarboxyl)butyrohydrazide","Acta Crystallographica Section E","2007","63","7","o3225","o3225","10.1107/S1600536807028498","","","0.71073","MoKα","","0.0523","0.0442","","","0.1155","0.1228","","","","","","0.999","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214409","12.8097","0.0007","11.1838","0.0006","9.9046","0.0005","90","","106.084","0.001","90","","1363.4","0.13","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Bromo-2-methyl-3-phenylsulfinyl-1-benzofuran","","- C15 H11 Br O2 S -","- C15 H11 Br O2 S -","- C60 H44 Br4 O8 S4 -","4","1","WK2060","Seo, Pil Ja; Choi, Hong Dae; Son, Byeng Wha; Lee, Uk","5-Bromo-2-methyl-3-phenylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2007","63","7","o3204","o3204","10.1107/S1600536807028504","","","0.71073","MoKα","","0.0372","0.0301","","","0.0807","0.0849","","","","","","1.05","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214410","9.94","0.0012","14.9395","0.0018","17.876","0.002","90","","90","","90","","2654.6","0.5","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Benzyl 2-{[2-(tert-butoxycarbonylamino)-4-methylpentanoyl]methylamino}- 4-methylpentanoate","","- C25 H40 N2 O5 -","- C25 H40 N2 O5 -","- C100 H160 N8 O20 -","4","1","WK2061","Xiao-Jian Liao; Wen-Jie Xu; Shi-Hai Xu; Fang-Fang Dong","Benzyl 2-{[2-(<i>tert</i>-butoxycarbonylamino)-4-methylpentanoyl]methylamino}-4-methylpentanoate","Acta Crystallographica Section E","2007","63","7","o3313","o3313","10.1107/S1600536807029418","","","0.71073","MoKα","","0.0504","0.0378","","","0.0896","0.0991","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214411","12.4627","0.0015","12.1985","0.0015","17.2573","0.0002","90","","90.162","0.002","90","","2623.6","0.5","273","2","273","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Pentacarbonyl-1κ^2^C,2κ^3^C-(diphenylphosphine-1κP)(μ-2-propyl-2- azapropane-1,3-dithiolato-1κ^2^S,S':2κ^2^S,S')diiron(Fe—Fe)","","- C22 H22 Fe2 N O5 P S2 -","- C22 H22 Fe2 N O5 P S2 -","- C88 H88 Fe8 N4 O20 P4 S8 -","4","1","WK2062","Zhen Wang; Jian-Hui Liu; Li-Cheng Sun","Pentacarbonyl-1κ^2^<i>C</i>,2κ^3^<i>C</i>-(diphenylphosphine-1κ<i>P</i>)(μ-2-propyl-2-azapropane-1,3-dithiolato-1κ^2^<i>S</i>,<i>S</i>':2κ^2^<i>S</i>,<i>S</i>')diiron(<i>Fe</i>—<i>Fe</i>)","Acta Crystallographica Section E","2007","63","7","m1959","m1960","10.1107/S1600536807029431","","","0.71073","MoKα","","0.0578","0.0366","","0.0789","","0.0873","","","","","","0.917","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214412","8.219","0.0005","14.145","0.0008","11.055","0.0006","90","","103.744","0.009","90","","1248.43","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[μ-10,21-Dimethyl-3,6,14,17-tetraazatricyclo[17.3.1^8,12^]tetracosa- 1(23),8,10,12(24),19,21-hexaene-23,24-diolato- κ^4^N^3^,N^6^,O^23^,O^24^:κ^4^N^14^,N^17^,O^23^,O^24^]bis(nitrato-κO)zinc(II)","","- C22 H30 N6 O8 Zn2 -","- C22 H30 N6 O8 Zn2 -","- C44 H60 N12 O16 Zn4 -","2","0.5","WK2063","Jie Liu; Jian-Fang Ma; Shun-Li Li; Guang-Ju Ping","[μ-10,21-Dimethyl-3,6,14,17-tetraazatricyclo[17.3.1^8,12^]tetracosa-1(23),8,10,12(24),19,21-hexaene-23,24-diolato-κ^4^<i>N</i>^3^,<i>N</i>^6^,<i>O</i>^23^,<i>O</i>^24^:κ^4^<i>N</i>^14^,<i>N</i>^17^,<i>O</i>^23^,<i>O</i>^24^]bis(nitrato-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2007","63","7","m1954","m1954","10.1107/S1600536807029285","","","0.71069","MoKα","","0.0357","0.0276","","","0.076","0.08","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214413","5.7941","0.0005","17.2455","0.0015","23.012","0.002","90","","90","","90","","2299.4","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R,R)-Ethylenebis[(2-methylphenyl)phenylphosphine oxide]","","- C28 H28 O2 P2 -","- C28 H28 O2 P2 -","- C112 H112 O8 P8 -","4","1","WK2065","King, Gary; Bergin, Enda; Müller-Bunz, Helge; Gilheany, Declan G.","(<i>R</i>,<i>R</i>)-Ethylenebis[(2-methylphenyl)phenylphosphine oxide] (`<i>o</i>-Tolyl DiPAMPO')","Acta Crystallographica Section E","2007","63","7","o3278","o3278","10.1107/S1600536807029479","","","0.71073","MoKα","","0.0583","0.0472","","","0.1062","0.1131","","","","","","1.085","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214414","9.9796","0.0008","9.7047","0.0008","23.184","0.002","90","","94.508","0.002","90","","2238.4","0.3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","tetrapotassium decaselenidotetragermanate","","- Ge4 K4 Se10 -","- Ge4 K4 Se10 -","- Ge16 K16 Se40 -","4","1","WM2110","Choudhury, Amitava; Strobel, Sabine; Dorhout, Peter K.","A polymorph of K~4~Ge~4~Se~10~","Acta Crystallographica Section E","2007","63","7","i155","i155","10.1107/S1600536807023264","","","0.71073","MoKα","","0.0553","0.0415","","","0.0967","0.103","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214415","5.391","0.001","5.8678","0.0011","7.3954","0.0014","92.651","0.002","104.332","0.002","99.249","0.002","222.81","0.07","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","<i>catena</i>-poly[[dihydraziniummanganese(II)]-di-μ-sulfato-κ^4^O:O']","","- H10 Mn N4 O8 S2 -","- H10 Mn N4 O8 S2 -","- H10 Mn N4 O8 S2 -","1","0.5","WM2112","Srinivasan, Krishnan; Govindarajan, Subbaiah; Harrison, William T. A.","<i>catena</i>-Poly[[dihydraziniummanganese(II)]-di-μ-sulfato-κ^4^<i>O</i>:<i>O</i>'] from synchrotron data","Acta Crystallographica Section E","2007","63","7","i152","i152","10.1107/S1600536807024579","","","0.6905","synchrotron","","0.0824","0.0819","","","0.2471","0.2483","","","","","","1.23","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214416","10.553","0.003","10.553","0.003","10.553","0.003","90","","90","","90","","1175.2","0.6","293","","298","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","","dirubidium dicalcium tris[sulfate(VI)]","","- Ca2 O12 Rb2 S3 -","- Ca2 O12 Rb2 S3 -","- Ca8 O48 Rb8 S12 -","4","0.333333","WM2116","Boujelben, Mohamed; Toumi, Mohamed; Mhiri, Tahar","Langbeinite-type Rb~2~Ca~2~(SO~4~)~3~","Acta Crystallographica Section E","2007","63","7","i157","i157","10.1107/S1600536807027043","","","0.71073","MoKα","","0.1513","0.0651","","0.0349","0.1001","0.1278","","","","","","1.12","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214417","9.4116","0.0005","13.2967","0.0007","14.9365","0.0007","90","","98.019","0.001","90","","1850.92","0.16","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[propane-1,2-diammonium [(μ~4~-benzene-1,2,4,5-tetracarboxylato-κ^4^O:O':O'':O''')zinc(II)] tetrahydrate]","","- C13 H22 N2 O12 Zn -","- C13 H22 N2 O12 Zn -","- C52 H88 N8 O48 Zn4 -","4","1","WM2117","Rafizadeh, Masoud; Amani, Vahid; Zahiri, Sanaz","Poly[propane-1,2-diammonium [(μ~4~-benzene-1,2,4,5-tetracarboxylato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>''')zinc(II)] tetrahydrate]","Acta Crystallographica Section E","2007","63","7","m1938","m1939","10.1107/S1600536807028905","","","0.71073","MoKα","","0.0427","0.038","","","0.1068","0.1105","","","","","","1.075","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214418","20.5002","0.001","9.65","0.0005","14.7623","0.0007","90","","101.801","0.001","90","","2858.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(2,2-bipyridine)cobalt(II)]-μ-imidazole-4,5-dicarboxylato]","","- C15 H9 Co N4 O4 -","- C15 H9 Co N4 O4 -","- C120 H72 Co8 N32 O32 -","8","2","WM2118","Hao, Lu-Jiang; Bao, Zhen-Min; Yu, Tong-Li","<i>catena</i>-Poly[[(2,2-bipyridine)cobalt(II)]-μ-imidazole-4,5-dicarboxylato]","Acta Crystallographica Section E","2007","63","7","m1871","m1871","10.1107/S1600536807027699","","","0.71073","MoKα","","0.0378","0.032","","","0.0995","0.1039","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214419","6.2463","0.0002","6.647","0.0002","13.1326","0.0004","102.138","0.002","90.073","0.002","116.943","0.001","472.28","0.03","298","","298","","","","","","","","","6","P -1","-P 1","2","","Dipotassium sulfate/selenate tellurate","","- H6 K2 O10 S0.63 Se0.37 Te -","- H6 K2 O10 S0.632 Se0.368 Te -","- H12 K4 O20 S1.264 Se0.736 Te2 -","2","1","WM2119","Abdelhedi, Mohamed; Ktari, Lilia; Dammak, Mohamed; Cousson, Alain; Kolsi, Abdelwaheb","K~2~(SO~4~)~0.63~(SeO~4~)~0.37~·Te(OH)~6~","Acta Crystallographica Section E","2007","63","7","i153","i154","10.1107/S1600536807027705","","","0.71073","MoKα","","0.0448","0.0448","","0.0508","0.0508","0.0508","","","","","","1.0914","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214420","12.442","0.002","13.604","0.002","14.902","0.003","101.115","0.004","91.514","0.003","95.88","0.003","2459.2","0.7","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","Bis(1,10-phenanthroline-κ^2^N,N')copper(I) chloridobis(1,10-phenanthroline-κ^2^N,N')copper(II) hexacosaoxidooctamolybdate(VI) dihydrate","","- C96 H68 Cl2 Cu4 Mo8 N16 O28 -","- C96 H68 Cl2 Cu4 Mo8 N16 O28 -","- C96 H68 Cl2 Cu4 Mo8 N16 O28 -","1","0.5","WM2120","Wen-Ju Wang; Lin Xu","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(I) chloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) hexacosaoxidooctamolybdate(VI) dihydrate","Acta Crystallographica Section E","2007","63","7","m1993","m1994","10.1107/S1600536807030450","","","0.71073","MoKα","","0.0486","0.0324","","","0.0668","0.0722","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214421","3.7646","0.0013","3.7646","0.0013","8.354","0.004","90","","90","","90","","118.39","0.08","293","2","293","2","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","no","Lutetium(III) oxide bromide","","- Br Lu O -","- Br Lu O -","- Br2 Lu2 O2 -","2","0.125","WM2121","Zimmermann, Sina; Pantenburg, Ingo; Meyer, Gerd","Lutetium(III) oxide bromide, LuOBr","Acta Crystallographica Section E","2007","63","7","i156","","10.1107/S1600536807027821","","","0.71073","MoKα","","0.0225","0.0225","","","0.0535","0.0535","","","","","","1.285","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214422","15.7231","0.0013","12.63","0.002","16.522","0.002","90","","90","","90","","3281","0.7","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Poly[[[aqua(2,2-bipyridine)iron(II)]-μ~3~-pyridine-3,4-dicarboxylato] monohydrate]","","- C17 H15 Fe N3 O6 -","- C17 H15 Fe N3 O6 -","- C136 H120 Fe8 N24 O48 -","8","1","WM2122","Hao, Lu-Jiang; Yu, Tong-Li","Poly[[[aqua(2,2-bipyridine)iron(II)]-μ~3~-pyridine-3,4-dicarboxylato] monohydrate]","Acta Crystallographica Section E","2007","63","7","m1926","m1926","10.1107/S160053680702867X","","","0.71073","MoKα","","0.0469","0.0369","","","0.1033","0.1085","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214423","7.0358","0.0004","7.0358","0.0004","7.0358","0.0004","90","","90","","90","","348.29","0.03","295","2","295","2","","","","","","","","3","F m -3 m","-F 4 2 3","225","Magnesium dizinc cerium","Magnesium dizinc cerium","","- Ce Mg Zn2 -","- Ce Mg Zn2 -","- Ce4 Mg4 Zn8 -","4","0.0208333","WM2125","Pavlyuk, Volodymyr; Solokha, Pavlo; Dmytriv, Grygorij; Marciniak, Bernard; Paul-Boncour, Valerie","The Heusler-type alloy MgZn~2~Ce","Acta Crystallographica Section E","2007","63","7","i161","i161","10.1107/S1600536807028899","","","0.71073","MoKα","","0.016","0.016","","","0.0448","0.0448","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214424","5.8117","0.0005","8.1666","0.0007","8.983","0.0008","90","","99.665","0.014","90","","420.3","0.07","293","2","293.15","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Disodium beryllium Diborate","disodium beryllodiborate","","- B2 Be Na2 O5 -","- B2 Be Na2 O5 -","- B8 Be4 Na8 O20 -","4","0.5","WM2126","Wei Li; Ning Ye","Na~2~[BeB~2~O~5~]","Acta Crystallographica Section E","2007","63","7","i160","i160","10.1107/S1600536807028942","","","0.71073","MoKα","","0.0246","0.022","","","0.058","0.0593","","","","","","1.165","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214425","9.4383","0.0006","12.7605","0.0012","6.313","0.0006","90","","106.199","0.007","90","","730.14","0.11","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","Caesium hexaaquacopper sulfate","Dicaesium hexaaquacopper(II) bis[sulfate(VI)]","","- Cs2 Cu H12 O14 S2 -","- Cs2 Cu H12 O14 S2 -","- Cs4 Cu2 H24 O28 S4 -","2","0.5","WM2127","Paolo Ballirano; Girolamo Belardi; Ferdinando Bosi","Redetermination of the Tutton's salt Cs~2~[Cu(H~2~O)~6~](SO~4~)~2~","Acta Crystallographica Section E","2007","63","7","i164","i165","10.1107/S1600536807029790","","","0.71073","MoKα","","0.0419","0.0335","","0.0847","","0.0805","","","","","","1.091","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214426","13.7911","0.0014","12.7032","0.0013","9.9329","0.001","90","","90","","90","","1740.2","0.3","150","2","150","2","","","","","","","","5","P c a 21","P 2c -2ac","29","[N,N'-Bis(6-methoxysalicylidene)-1,3-diaminopropane]copper(II)","{2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato}copper(II)","","- C19 H20 Cu N2 O4 -","- C19 H20 Cu N2 O4 -","- C76 H80 Cu4 N8 O16 -","4","1","WM2129","Habibi, Mohammad Hossein; Mokhtari, Reza; Harrington, Ross W.; Clegg, William","[<i>N</i>,<i>N</i>'-Bis(6-methoxysalicylidene)-1,3-diaminopropane]copper(II)","Acta Crystallographica Section E","2007","63","7","m1998","m1998","10.1107/S1600536807030723","","","0.71073","MoKα","","0.0296","0.0235","","","0.0594","0.0632","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214427","10.0579","0.0009","7.2362","0.0005","12.774","0.0009","90","","90","","90","","929.7","0.12","170","2","170","2","","","","","","","","3","P n m a","-P 2ac 2n","62","cesium tetrathiotungstate","dicaesium tetrathiotungstate(VI)","","- Cs2 S4 W -","- Cs2 S4 W -","- Cs8 S16 W4 -","4","0.5","WM2130","Srinivasan, Bikshandarkoil R.; Näther, Christian; Bensch, Wolfgang","Cs~2~[WS~4~]","Acta Crystallographica Section E","2007","63","7","i167","i167","10.1107/S1600536807031029","","","0.71073","MoKα","","0.0325","0.0268","","","0.0665","0.0688","","","","","","1.032","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214428","9.24","0.0018","14.217","0.003","13.302","0.004","90","","128.408","0.019","90","","1369.3","0.7","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(Benzylideneamino)-3-(2-pyridyl)-1H-1,2,4-triazole-5(4H)-thione","","- C14 H11 N5 S -","- C14 H11 N5 S -","- C56 H44 N20 S4 -","4","1","WN2136","Fang-Fang Jian; Xiao-Yan Ren; Yong-Qi Qin; Li-Hong Hu","4-(Benzylideneamino)-3-(2-pyridyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","7","o3056","o3056","10.1107/S1600536807025573","","","0.71073","MoKα","","0.1908","0.0468","","","0.0955","0.1291","","","","","","0.955","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214429","17.955","0.002","14.338","0.001","6.6437","0.0006","90","","90","","90","","1710.3","0.3","295","2","298","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Ethylenedipyridinium dibromidodichloridocadmate(II)","","- C12 H14 Br2 Cd Cl2 N2 -","- C12 H14 Br2 Cd Cl2 N2 -","- C48 H56 Br8 Cd4 Cl8 N8 -","4","0.5","WN2141","Liu, Xiu-Cun; Liao, Xin-Cheng; Ran, Chun-Ling; Niu, Yun-Yin; Ng, Seik Weng","Ethylenedipyridinium dibromidodichloridocadmate(II)","Acta Crystallographica Section E","2007","63","7","m1780","m1780","10.1107/S1600536807025585","","","0.71073","MoKα","","0.061","0.057","","","0.175","0.179","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214430","8.1159","0.0006","15.058","0.001","15.103","0.001","90","","95.023","0.001","90","","1838.6","0.2","295","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Propane-1,3-diyldipyridinium dibromidodichloridocadmate(II)","","- C13 H16 Br2.25 Cd Cl1.75 N2 -","- C13 H16 Br2.2493 Cd Cl1.7507 N2 -","- C52 H64 Br8.9972 Cd4 Cl7.0028 N8 -","4","1","WN2142","Liu, Xiu-Cun; Shi, Jie; Niu, Yun-Yin; Xu, Na; Ng, Seik Weng","1,1'-(Propane-1,3-diyl)dipyridinium dibromidodichloridocadmate(II)","Acta Crystallographica Section E","2007","63","7","m1781","m1781","10.1107/S1600536807025597","","","0.71073","MoKα","","0.062","0.037","","","0.087","0.121","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214431","7.555","0.0011","14.938","0.002","17.763","0.003","90","","95.201","0.003","90","","1996.4","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2E,6E)-2,6-Bis(3-bromo-4-hydroxy-5-methoxybenzylidene)cyclohexanone","","- C22 H20 Br2 O5 -","- C22 H20 Br2 O5 -","- C88 H80 Br8 O20 -","4","1","WN2146","Zhi-Yun Du; Bao-Hua Huang; Kun Zhang; Yan-Xiong Fang","(2<i>E</i>,6<i>E</i>)-2,6-Bis(3-bromo-4-hydroxy-5-methoxybenzylidene)cyclohexanone","Acta Crystallographica Section E","2007","63","7","o3216","o3216","10.1107/S1600536807027559","","","0.71073","MoKα","","0.0908","0.0451","","","0.0909","0.1096","","","","","","1.018","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214432","10.0097","0.0004","10.3559","0.0003","18.803","0.0006","90","","113.032","0.002","90","","1793.74","0.11","105","0.1","105","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,3-Dimethyl-5-phenyl-3,4-dihydro-1H-benzo[b]carbazole-1,6,11(2H,5H)-trione","","- C24 H19 N O3 -","- C24 H19 N O3 -","- C96 H76 N4 O12 -","4","1","WN2149","Hoong-Kun Fun; Jeannie Bee-Jan Teh; Yun Liu; Jian-Hua Xu","3,3-Dimethyl-5-phenyl-3,4-dihydro-1<i>H</i>-benzo[<i>b</i>]carbazole-1,6,11(2<i>H</i>,5<i>H</i>)-trione","Acta Crystallographica Section E","2007","63","7","o3146","o3146","10.1107/S1600536807027213","","","0.71073","MoKα","","0.076","0.0518","","","0.1174","0.1308","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214433","7.996","0.001","8.948","0.001","11.297","0.002","108.51","0.02","94.86","0.01","93.04","0.01","761","0.2","293","","293","","","","","","","","","4","P -1","-P 1","2","","(±)-2-Benzoyl-8-ethyl-1,2-dihydroisoquinoline-1-carbonitrile","","- C19 H16 N2 O -","- C19 H16 N2 O -","- C38 H32 N4 O2 -","2","1","WN2150","A. Graulich; Bernadette Norberg; J.-F. Liégeois; Johan Wouters","(±)-2-Benzoyl-8-ethyl-1,2-dihydroisoquinoline-1-carbonitrile: an original Reissert compound","Acta Crystallographica Section E","2007","63","7","o3161","o3161","10.1107/S1600536807027729","","","1.54178","CuKα","","0.0501","0.0468","","","0.1294","0.133","","","","","","1.074","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214434","8.7272","0.0006","12.7635","0.0009","13.3411","0.0009","103.821","0.001","107.828","0.001","106.684","0.001","1265.14","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","3-(4-Chlorophenyl)-2-(diisobutylamino)-4-oxo-5-phenyl-4,5-dihydro- 3H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile","","- C27 H28 Cl N5 O -","- C27 H28 Cl N5 O -","- C54 H56 Cl2 N10 O2 -","2","1","WN2151","Ping He; Ai-Huan Zheng; Chang-Quan Cai; Chuan-Lin Fang","3-(4-Chlorophenyl)-2-(diisobutylamino)-4-oxo-5-phenyl-4,5-dihydro-3<i>H</i>-pyrrolo[3,2-<i>d</i>]pyrimidine-7-carbonitrile","Acta Crystallographica Section E","2007","63","7","o3185","o3185","10.1107/S1600536807028383","","","0.71073","MoKα","","0.0853","0.0644","","","0.1557","0.1695","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214435","12.863","0.003","12.549","0.002","8.3211","0.0016","90","","90.1","0.01","90","","1343.2","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Fluoro-N-(3-Nitrobenzylidene)-5-(trifluoromethyl)aniline","","- C14 H8 F4 N2 O2 -","- C14 H8 F4 N2 O2 -","- C56 H32 F16 N8 O8 -","4","1","WN2153","Ming-Hua Yang; Guo-Bing Yan; Yun-Fa Zheng","2-Fluoro-<i>N</i>-(3-nitrobenzylidene)-5-(trifluoromethyl)aniline","Acta Crystallographica Section E","2007","63","7","o3202","o3202","10.1107/S1600536807028395","","","0.71073","MoKα","","0.0682","0.0488","","","0.1465","0.1547","","","","","","0.998","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214436","10.8945","0.0002","9.7106","0.0002","32.6158","0.0005","90","","109.412","0.001","90","","3254.34","0.1","100","0.1","100","0.1","","","","","","","","4","P 1 c 1","P -2yc","7","","1-(3,4-Dimethoxyphenyl)-3-[4-(dimethylamino)phenyl]prop-2-en-1-one","","- C19 H21 N O3 -","- C19 H21 N O3 -","- C152 H168 N8 O24 -","8","4","WN2156","P. S. Patil; Suchada Chantrapromma; Hoong-Kun Fun; S. M. Dharmaprakash","1-(3,4-Dimethoxyphenyl)-3-[4-(dimethylamino)phenyl]prop-2-en-1-one","Acta Crystallographica Section E","2007","63","7","o3253","o3254","10.1107/S1600536807029029","","","0.71073","MoKα","","0.0562","0.044","","","0.116","0.128","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214437","30.4592","0.0017","9.5344","0.0005","22.0343","0.0014","90","","123.051","0.002","90","","5363.5","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(μ-2,2'-Biquinolinyl-4,4'-dicarboxylato-κ^2^O:O')bis[(dimethylformamide- κO)triphenyltin(IV)]","","- C62 H54 N4 O6 Sn2 -","- C62 H54 N4 O6 Sn2 -","- C248 H216 N16 O24 Sn8 -","4","0.5","WW2083","Li-Bin Wang","(μ-2,2'-Biquinolinyl-4,4'-dicarboxylato-κ^2^<i>O</i>:<i>O</i>')bis[(dimethylformamide-κ<i>O</i>)triphenyltin(IV)]","Acta Crystallographica Section E","2007","63","7","m1883","m1883","10.1107/S1600536807028048","","","0.71073","MoKα","","0.0666","0.054","","","0.163","0.17","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214438","10.408","0.01","18.91","0.017","8.911","0.008","90","","115.346","0.015","90","","1585","3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[μ-Pyruvic acid benzoylhydrazonato(2-)]bis[methanoldimethyltin(IV)]","","- C26 H36 N4 O8 Sn2 -","- C26 H36 N4 O8 Sn2 -","- C52 H72 N8 O16 Sn4 -","2","0.5","XU2188","Ling-Na Sun; Chang-Wen Hu","[μ-Pyruvic acid benzoylhydrazonato(2‒)]bis[methanoldimethyltin(IV)]","Acta Crystallographica Section E","2007","63","7","m1832","m1833","10.1107/S1600536807005570","","","0.71073","MoKα","","0.056","0.034","","","0.072","0.084","","","","","","0.996","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214439","7.495","0.002","9.998","0.003","11.384","0.004","71.699","0.004","84.631","0.005","71.66","0.004","768.8","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Poly[[μ-2-amino-4-(2-pyridyl)-6-(4-pyridyl)pyrimidine-κ^3^N,N':N'']di-μ- bromido-dicopper(I)]","","- C14 H11 Br2 Cu2 N5 -","- C14 H11 Br2 Cu2 N5 -","- C28 H22 Br4 Cu4 N10 -","2","1","XU2223","Chi, Ying-Nan; Cui, Feng-Yun; Hu, Chang-Wen","Poly[[μ-2-amino-4-(2-pyridyl)-6-(4-pyridyl)pyrimidine-κ^3^<i>N</i>,<i>N</i>':<i>N</i>'']di-μ-bromido-dicopper(I)]","Acta Crystallographica Section E","2007","63","7","m1830","m1831","10.1107/S1600536807015127","","","0.71073","MoKα","","0.061","0.048","","","0.126","0.139","","","","","","0.995","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214440","9.2135","0.0014","12.8915","0.0019","13.527","0.002","105.406","0.003","109.022","0.002","102.663","0.003","1379.5","0.4","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","[6-(2-Hydroxyphenyl)-2,2'-bipyridine]chloro(η^6^-<i>p</i>-cymene)ruthenium(II) chloride chloroform solvate","","- C27 H27 Cl5 N2 O Ru -","- C27 H27 Cl5 N2 O Ru -","- C54 H54 Cl10 N4 O2 Ru2 -","2","1","XU2245","Zhou, Hao-Fei; Bian, Zu-Qiang; Liu, Zhi-Wei; Huang, Chun-Hui; Zhao, Yong-Liang","Chlorido(η^6^-<i>p</i>-cymene)[6-(2-hydroxyphenyl)-2,2'-bipyridine]ruthenium(II) chloride chloroform solvate","Acta Crystallographica Section E","2007","63","7","m1851","m1852","10.1107/S1600536807023975","","","0.7107","MoKα","","0.034","0.026","","","0.063","0.064","","","","","","0.992","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214441","6.656","0.004","11.874","0.009","12.472","0.006","90","","96.97","0.02","90","","978.4","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis(3-methylpyridine-2-carboxamide-κ^2^N,O)copper(II) dinitrate","","- C14 H20 Cu N6 O10 -","- C14 H20 Cu N6 O10 -","- C28 H40 Cu2 N12 O20 -","2","0.5","XU2256","Hong Ruan; Hong-Wei Chen; Ri-Cheng Xuan","Diaquabis(3-methylpyridine-2-carboxamide-κ^2^<i>N</i>,<i>O</i>)copper(II) dinitrate","Acta Crystallographica Section E","2007","63","7","m1855","m1855","10.1107/S1600536807027109","","","0.71073","MoKα","","0.0417","0.0334","","","0.0881","0.0917","","","","","","1.086","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214442","7.4286","0.0015","8.1298","0.0016","34.101","0.007","90","","90","","90","","2059.5","0.7","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Methyl 5-O-triphenylmethyl-α-D-arabinofuranoside","","- C25 H26 O5 -","- C25 H26 O5 -","- C100 H104 O20 -","4","1","XU2257","Dong Han; Lin-Na Wang; Wen-He Zhong; Xiang-Bao Meng; Zhong-Jun Li","Methyl 5-<i>O</i>-triphenylmethyl-α-<small>D</small>-arabinofuranoside","Acta Crystallographica Section E","2007","63","7","o3168","o3168","10.1107/S1600536807027110","","","0.71073","MoKα","","0.056","0.038","","","0.078","0.082","","","","","","1.012","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214443","13.5112","0.0005","18.0213","0.0006","7.5559","0.0002","90","","90","","90","","1839.78","0.1","293.5","","","","","","","","","","","6","P 21 21 2","P 2 2ab","18","","1,1-Dichloro-3-(6,1,3-oxadithiaoctocan-2-ylidene)-3-nitro- 2-(4-methylphenylsulfanyl)propene","","- C15 H15 Cl2 N O3 S3 -","- C15 H15 Cl2 N O3 S3 -","- C60 H60 Cl8 N4 O12 S12 -","4","1","XU2259","Ibis, Cemil; Deniz, N.Gulsah","1,1-Dichloro-3-(6,1,3-oxadithiaoctocan-2-ylidene)-3-nitro-2-(4-methylphenylsulfanyl)propene","Acta Crystallographica Section E","2007","63","7","o3058","o3058","10.1107/S1600536807025731","","","0.7107","MoKα","","","0.037","","","","0.027","","","","","","1.131","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214444","21.782","0.003","9.743","0.002","9.271","0.002","90","","108.178","0.002","90","","1869.3","0.6","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-Oxo-3,4-dihydro-1,4-benzoxazine-4-acetic acid","","- C10 H9 N O4 -","- C10 H9 N O4 -","- C80 H72 N8 O32 -","8","1","XU2260","Hong-Gang Li; Jian-Min Dou; Da-Cheng Li; Da-Qi Wang","2-Oxo-3,4-dihydro-1,4-benzoxazine-4-acetic acid","Acta Crystallographica Section E","2007","63","7","o3092","o3092","10.1107/S160053680702613X","","","0.71073","MoKα","","0.1","0.053","","","0.123","0.171","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214445","12.636","0.0009","13.362","0.001","15.02","0.0011","90","","101.955","0.005","90","","2481","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di-μ-chlorido-bis{[(1H-benzo[d]imidazol-2- ylmethyl)dibenzylamine]chloridocadmium(II)} ethanol disolvate","","- C48 H54 Cd2 Cl4 N6 O2 -","- C48 H54 Cd2 Cl4 N6 O2 -","- C96 H108 Cd4 Cl8 N12 O4 -","2","0.5","XU2261","Guang-Ju Ping; Jian-Fang Ma; Lai-Ping Zhang","Di-μ-chlorido-bis{[(1<i>H</i>-benzo[<i>d</i>]imidazol-2-ylmethyl)dibenzylamine]chloridocadmium(II)} ethanol disolvate","Acta Crystallographica Section E","2007","63","7","m1821","m1822","10.1107/S1600536807026669","","","0.71069","MoKα","","0.032","0.027","","","0.075","0.078","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214446","18.519","0.009","4.816","0.002","11.884","0.006","90","","107.521","0.007","90","","1010.7","0.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(4-Methoxyphenyl)propanohydrazide","","- C10 H14 N2 O2 -","- C10 H14 N2 O2 -","- C40 H56 N8 O8 -","4","1","XU2262","Ghulam Qadeer; Nasim Hasan Rama; Muhammad Azaad Malik; James Raftery","3-(4-Methoxyphenyl)propanohydrazide","Acta Crystallographica Section E","2007","63","7","o3061","o3061","10.1107/S1600536807025810","","","0.71073","MoKα","","0.163","0.066","","","0.146","0.169","","","","","","0.825","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214447","6.9362","0.0007","7.4559","0.0006","8.2797","0.0007","90.342","0.008","109.848","0.007","93.161","0.007","402","0.06","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","Poly[[tetraaqua(μ~6~-benzene-1,2,4,5-tetracarboxylato)dicobalt(II)] dihydrate]","","- C5 H7 Co O7 -","- C5 H5 Co O7 -","- C10 H10 Co2 O14 -","2","1","XU2263","Liu, Yen-Hsiang; Ding, Miao-Tzu","Poly[[tetraaqua(μ~6~-benzene-1,2,4,5-tetracarboxylato)dicobalt(II)] dihydrate]","Acta Crystallographica Section E","2007","63","7","m1828","m1829","10.1107/S1600536807025901","","","0.71073","MoKα","","","0.038","","","","0.103","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214448","13.131","0.004","5.7841","0.0015","30.046","0.008","90","","90","","90","","2282","1.1","293","2","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","4-(1-Phenylethyl)benzene-1,3-diol","","- C14 H14 O2 -","- C14 H14 O2 -","- C112 H112 O16 -","8","2","XU2265","Zhi-Yun Du; Xue-Tao Xu; Kun Zhang; Bao-Hua Huang; Yan-Xiong Fang","4-(1-Phenylethyl)benzene-1,3-diol","Acta Crystallographica Section E","2007","63","7","o3217","o3217","10.1107/S1600536807026517","","","0.71073","MoKα","","0.07","0.039","","","0.09","0.103","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214449","6.31","0.0013","12.31","0.003","17.658","0.004","90","","90.24","0.03","90","","1371.6","0.5","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Amino-2-(fluoromethyl)-3-(2-methylphenyl)quinazolin-4(3H)-one","","- C16 H14 F N3 O -","- C16 H14 F N3 O -","- C64 H56 F4 N12 O4 -","4","1","XU2266","Sheng-Chun Chen; Fang-Hua Yin; Qun Chen; Qi Liu; Ming-Yang He","6-Amino-2-(fluoromethyl)-3-(2-methylphenyl)quinazolin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","7","o3109","o3109","10.1107/S1600536807026670","","","0.71073","MoKα","","0.076","0.063","","","0.149","0.154","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214450","21.2371","0.0014","7.7364","0.0005","12.6733","0.0009","90","","90","","90","","2082.2","0.2","273","2","273","2","","","","","","","","5","P n a 21","P 2c -2n","33","","cis-dichloridobis(1,10-phenanthroline-κ^2^N,N')cobalt(II)","","- C24 H16 Cl2 Co N4 -","- C24 H16 Cl2 Co N4 -","- C96 H64 Cl8 Co4 N16 -","4","1","XU2267","Li, Ling-Ling; Liu, Dong-Xia; Liu, Tian-Fu","A polymorph of <i>cis</i>-dichloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)","Acta Crystallographica Section E","2007","63","7","m1880","m1880","10.1107/S1600536807028073","","","0.71073","MoKα","","0.025","0.022","","","0.053","0.055","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214451","7.115","0.003","11.054","0.005","14.543","0.006","95.668","0.006","94.203","0.005","90.046","0.006","1135.1","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Bis(2,2'-bipyridine-κ^2^N,N')(carbonato-κ^2^O,O')cobalt(III) trifluoromethanesulfonate","","- C22 H16 Co F3 N4 O6 S -","- C22 H16 Co F3 N4 O6 S -","- C44 H32 Co2 F6 N8 O12 S2 -","2","1","XU2269","Lv, Yang-Xiao; Ling, Yun; Li, Huan; Zhang, Lei","Bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(carbonato-κ^2^<i>O</i>,<i>O</i>')cobalt(III) trifluoromethanesulfonate","Acta Crystallographica Section E","2007","63","7","m1906","m1907","10.1107/S1600536807028516","","","0.71073","MoKα","","0.09","0.053","","","0.119","0.137","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214452","14.119","0.003","7.4964","0.0017","17.083","0.004","90","","101.939","0.004","90","","1769","0.7","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Chloro-6-morpholino-N^2^-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazin-2-amine","","- C15 H26 Cl N5 O -","- C15 H26 Cl N5 O -","- C60 H104 Cl4 N20 O4 -","4","1","XU2270","Yi-Ping Jiang; Ting Qiu; Liang-En Wang; Jia-Ning Wang","4-Chloro-6-morpholino-<i>N</i>^2^-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazin-2-amine","Acta Crystallographica Section E","2007","63","7","o3173","o3173","10.1107/S1600536807027924","","","0.71073","MoKα","","0.074","0.042","","","0.099","0.114","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214453","18.764","0.005","17.769","0.005","14.749","0.005","90","","117.841","0.005","90","","4348","2","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[[(4,7-dimethyl-1,10-phenanthroline-\ κ^2^N,N')copper(II)]-μ-terephthalato-κ^2^O:O'] terephthalic acid hemisolvate]","","- C26 H19 Cu N2 O6 -","- C26 H19 Cu N2 O6 -","- C208 H152 Cu8 N16 O48 -","8","1","XU2271","Wen, Yi-Hang; Ng, Seik Weng","<i>catena</i>-Poly[[[(4,7-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)]-μ-terephthalato-κ^2^<i>O</i>:<i>O</i>'] terephthalic acid hemisolvate]","Acta Crystallographica Section E","2007","63","7","m1865","m1865","10.1107/S1600536807027663","","","0.71073","MoKα","","0.077","0.066","","","0.209","0.225","","","","","","1.15","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214454","12.062","0.002","9.3943","0.0016","15.988","0.003","90","","105.065","0.002","90","","1749.4","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Benzyl-5-ethyl-2-(2-furylcarbonylmethylsulfanyl)pyrimidin-6(1H)-one","","- C19 H18 N2 O3 S -","- C19 H18 N2 O3 S -","- C76 H72 N8 O12 S4 -","4","1","XU2272","Zhang, Sui-Shuan; He, Yan-Ping; Zheng, Yong-Tang; Rao, Zhi-Kun; Li, Cong","4-Benzyl-5-ethyl-2-(2-furylcarbonylmethylsulfanyl)pyrimidin-6(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","7","o3172","o3172","10.1107/S1600536807028218","","","0.71073","MoKα","","0.125","0.051","","","0.093","0.116","","","","","","0.99","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214455","7.6202","0.0001","9.9593","0.0003","10.1125","0.0002","77.92","0.01","85.65","0.01","71.65","0.02","712.26","0.09","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis(4-bromobenzoato-κO)bis(nicotinamide-κN^1^)cobalt(II)","","- C26 H24 Br2 Co N4 O8 -","- C26 H24 Br2 Co N4 O8 -","- C26 H24 Br2 Co N4 O8 -","1","0.5","XU2273","Hökelek, Tuncer; Çaylak, Nagihan; Necefoğlu, Hacali","Diaquabis(4-bromobenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>^1^)cobalt(II)","Acta Crystallographica Section E","2007","63","7","m1873","m1874","10.1107/S1600536807028358","","","0.71073","MoKα","","0.087","0.042","","","0.094","0.11","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214456","5.935","0.005","16.97","0.005","17.038","0.005","90","","98.948","0.005","90","","1695.1","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1-[2-(4-Chlorophenyl)acetyl]-4-(2-methoxyphenyl)thiosemicarbazide","","- C16 H16 Cl N3 O2 S -","- C16 H16 Cl N3 O2 S -","- C64 H64 Cl4 N12 O8 S4 -","4","1","XU2274","Raja Ansar Hussain Khan; Rashid Iqbal; Habib-ur-Rehman; Ghulam Qadeer; Zhong-Min Su","1-[2-(4-Chlorophenyl)acetyl]-4-(2-methoxyphenyl)thiosemicarbazide","Acta Crystallographica Section E","2007","63","7","o3299","o3299","10.1107/S1600536807030048","","","0.71069","MoKα","","0.0523","0.0397","","","0.1024","0.1105","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214457","7.6045","0.001","10.7869","0.0014","16.118","0.002","97.741","0.001","102.6","0.001","100.817","0.001","1245.9","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Di-μ~2~-aqua-bis[aqua(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^N,N')(4- nitrobenzoato-κO)cadmium(II)] bis(4-nitrobenzoate)","","- C40 H36 Cd2 N12 O20 S4 -","- C40 H36 Cd2 N12 O20 S4 -","- C40 H36 Cd2 N12 O20 S4 -","1","0.5","XU2275","Guang-Hua Chen; Yuan-Yuan Lin; Yan-Ping Yu; Bing-Xin Liu","Di-μ~2~-aqua-bis[aqua(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')(4-nitrobenzoato-κ<i>O</i>)cadmium(II)] bis(4-nitrobenzoate)","Acta Crystallographica Section E","2007","63","7","m1915","m1916","10.1107/S1600536807028462","","","0.71073","MoKα","","0.039","0.032","","","0.067","0.072","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214458","15.1514","0.0018","13.5905","0.0016","16.4702","0.0019","90","","106.901","0.002","90","","3245","0.7","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^N,N')(2-nitrobenzoato-\ κ^2^O,O')nickel(II) 2-nitrobenzoate","","- C26 H20 N10 Ni O8 S4 -","- C26 H20 N10 Ni O8 S4 -","- C104 H80 N40 Ni4 O32 S16 -","4","1","XU2277","Bing-Xin Liu; Guang-Hua Chen; Yuan-Yuan Lin; Yan-Ping Yu","Bis(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')(2-nitrobenzoato-κ^2^<i>O</i>,<i>O</i>')nickel(II) 2-nitrobenzoate","Acta Crystallographica Section E","2007","63","7","m1971","m1971","10.1107/S1600536807029741","","","0.71073","MoKα","","0.119","0.055","","","0.099","0.123","","","","","","1.004","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214459","9.886","0.003","10.055","0.003","15.876","0.004","90","","106.401","0.004","90","","1513.9","0.7","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Di-μ-chlorido-bis[2,2'-(propane-1,3-diyl)bis(2H-benzotriazole)-\ κ^2^N^1^,N^1'^]copper(I)]","","- C30 H28 Cl2 Cu2 N12 -","- C30 H28 Cl2 Cu2 N12 -","- C60 H56 Cl4 Cu4 N24 -","2","0.5","XU2279","Zhou, Xiao-Li; Wang, Li-Ping; Meng, Xiang-Ru; Ng, Seik Weng","Di-μ-chlorido-bis[2,2'-(propane-1,3-diyl)bis(2<i>H</i>-benzotriazole)-κ^2^<i>N</i>^1^,<i>N</i>^1'^]copper(I)]","Acta Crystallographica Section E","2007","63","7","m1995","m1995","10.1107/S1600536807030449","","","0.71073","MoKα","","0.038","0.036","","","0.102","0.104","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214460","10.534","0.001","10.494","0.001","7.564","0.0008","90","","120.801","0.001","90","","718.21","0.12","291","2","291","2","","","","","","","","4","C 1 c 1","C -2yc","9","","poly[aqua-μ~6~-malato-potassium(I)]","","- C4 H7 K O6 -","- C4 H7 K O6 -","- C16 H28 K4 O24 -","4","1","XU2280","Ou, Guang-Chuan; Ng, Seik Weng","A second <i>C</i>-centred monoclinic modification of racemic potassium hydrogen malate monohydrate","Acta Crystallographica Section E","2007","63","7","m2004","m2004","10.1107/S1600536807030619","","","0.71073","MoKα","","0.037","0.034","","","0.116","0.124","","","","","","1.187","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214461","7.367","0.006","7.38","0.005","12.689","0.01","96.22","0.04","94.62","0.04","118.33","0.03","596.8","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Tetraamminediaquacopper(II) 4-amino-2,5-dichlorobenzenesulfonate","","- C12 H24 Cl4 Cu N6 O8 S2 -","- C12 H24 Cl4 Cu N6 O8 S2 -","- C12 H24 Cl4 Cu N6 O8 S2 -","1","0.5","XU2281","Wen-Li Zhang; Jian-Fang Ma; Hui Jiang","Tetraamminediaquacopper(II) 4-amino-2,5-dichlorobenzenesulfonate","Acta Crystallographica Section E","2007","63","7","m2001","m2001","10.1107/S1600536807030711","","","0.71073","MoKα","","0.031","0.029","","","0.076","0.076","","","","","","1.1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214462","7.0938","0.0002","8.5918","0.0003","11.4966","0.0003","76.917","0.002","85.205","0.002","83.318","0.002","676.69","0.04","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","3-(5-<i>tert</i>-Butyl-2-hydroxybenzoyl)propanoic acid","","- C14 H18 O4 -","- C14 H18 O4 -","- C28 H36 O8 -","2","1","YA2053","Ross S. Forgan; Simon Parsons; Peter A. Tasker; Fraser J. White","3-(5-<i>tert</i>-Butyl-2-hydroxybenzoyl)propanoic acid","Acta Crystallographica Section E","2007","63","7","o3249","o3249","10.1107/S1600536807026372","","","0.71073","MoKα","","0.074","0.052","","","0.129","0.142","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214463","9.4108","0.0008","12.647","0.0011","14.5249","0.0013","90","","108.177","0.002","90","","1642.5","0.2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","trans-6,7,8,9,10,11-Hexahydrocycloocta[b]quinoxaline-8,9-diyl diacetate","","- C18 H20 N2 O4 -","- C18 H20 N2 O4 -","- C72 H80 N8 O16 -","4","1","YM2054","Madeleine Helliwell; Mostafa H. Alamdari; Mehdi M. Baradarani; John A. Joule","Hexahydrocycloocta[<i>b</i>]quinoxaline formation from 1,2-diacetoxycycloocta-5,6-dione","Acta Crystallographica Section E","2007","63","7","o3182","o3182","10.1107/S1600536807025482","","","0.71073","MoKα","","0.0779","0.0415","","","0.0821","0.0894","","","","","","0.836","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214464","9.2514","0.0007","9.2745","0.0005","11.0971","0.0006","106.259","0.001","106.542","0.002","103.337","0.002","824.9","0.09","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","1-Methyl-3-(5-methylthiazol-2-yldiazenyl)-2-phenyl-1H-indole","","- C19 H16 N4 S -","- C19 H16 N4 S -","- C38 H32 N8 S2 -","2","1","YM2060","Hökelek, Tuncer; Seferoğlu, Zeynel; Şahin, Ertan; Ertan , Nermin","1-Methyl-3-(5-methylthiazol-2-yldiazenyl)-2-phenyl-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","7","o3281","o3282","10.1107/S1600536807029571","","","0.71073","MoKα","","0.0733","0.0522","","","0.1467","0.1729","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214465","8.7991","0.001","8.916","0.002","14.1665","0.0007","88.991","0.009","82.109","0.006","63.998","0.011","988.3","0.3","290","2","290","2","","","","","","","","5","P -1","-P 1","2","","triphenylmethanol‒pyridinium chloride (1/1)","","- C24 H22 Cl N O -","- C24 H22 Cl N O -","- C48 H44 Cl2 N2 O2 -","2","1","ZL2020","Sykora, Richard E.; Cioffi, Eugene A.","A triphenylmethanol‒pyridinium chloride (1/1) adduct containing a one-dimensional ionic substructure","Acta Crystallographica Section E","2007","63","7","o3148","o3149","10.1107/S1600536807019800","","","0.71073","MoKα","","0.0499","0.0364","","","0.1018","0.1095","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214466","11.4131","0.0003","9.0543","0.0002","7.1957","0.0001","90","","100.362","0.0008","90","","731.46","0.03","298","1","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis[diaquahydrogen(1+)] naphthalene-1,5-disulfonate","","- C10 H16 O10 S2 -","- C10 H16 O10 S2 -","- C20 H32 O20 S4 -","2","0.5","ZL2026","Li, Zong-Sheng; Chai, Jian-She","Bis[diaquahydrogen(1+)] naphthalene-1,5-disulfonate","Acta Crystallographica Section E","2007","63","7","o3258","o3258","10.1107/S1600536807025743","","","0.71073","MoKα","","0.0509","0.0446","","","0.1244","0.1393","","","","","","1.23","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214467","11.471","0.004","16.99","0.006","17.698","0.006","70.218","0.004","88.973","0.004","86.239","0.005","3238.6","1.9","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-9-anthrylmethylthiolato)bis[tricarbonyliron(I)](Fe—Fe)","","- C36 H22 Fe2 O6 S2 -","- C36 H22 Fe2 O6 S2 -","- C144 H88 Fe8 O24 S8 -","4","2","ZL2028","Shang Gao; Xiao-Jun Peng","Bis(μ-9-anthrylmethylthiolato)bis[tricarbonyliron(I)](<i>Fe{—</i>Fe})","Acta Crystallographica Section E","2007","63","7","m1996","m1996","10.1107/S160053680702524X","","","0.71073","MoKα","","0.0734","0.0446","","","0.091","0.1022","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214468","7.9492","0.0009","8.8428","0.001","27.603","0.003","90","","92.421","0.002","90","","1938.6","0.4","173","","173","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,5-Bis(3,4-dimethoxybenzylidene)cyclopentanone","","- C23 H24 O5 -","- C23 H24 O5 -","- C92 H96 O20 -","4","1","ZL2029","Butcher, Ray J.; Jasinski, Jerry P.; Narayana, B.; Sarojini, B.K.; Bindya, S; Yathirajan, H. S.","2,5-Bis(3,4-dimethoxybenzylidene)cyclopentanone","Acta Crystallographica Section E","2007","63","7","o3270","o3271","10.1107/S1600536807029339","","","0.71073","MoKα","","0.0602","0.0474","","","0.1199","0.1281","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214469","7.6088","0.0015","9.3094","0.0019","12.27","0.004","90","","122.38","0.02","90","","734","0.4","113","2","113","2","","","","","","","","5","P 1 c 1","P -2yc","7","","Poly[[(2,2-bipyridine-κ^2^N,N')cobalt(II)]-μ~3~- pyridine-3,4-dicarboxylato-κ^4^N:O^4^,O^4'^:O^2^]","","- C17 H11 Co N3 O4 -","- C17 H11 Co N3 O4 -","- C34 H22 Co2 N6 O8 -","2","1","ZL2031","Hui-Hua Song; Ya-Juan Li","Poly[[(2,2-bipyridine-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-μ~3~-pyridine-3,4-dicarboxylato-κ^4^<i>N</i>:<i>O</i>^2^:<i>O</i>^4^,<i>O</i>^4'^]","Acta Crystallographica Section E","2007","63","7","m1789","m1789","10.1107/S160053680702541X","","","0.71073","MoKα","","0.0427","0.0357","","","0.0728","0.0759","","","","","","0.996","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214470","13.2093","0.0003","15.2132","0.0002","21.6851","0.0006","90","","105.462","0.002","90","","4200.03","0.17","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[2-(cycloheptyliminomethyl)pyridine-k^2^N,N']silver(I) tetraphenylborate","","- C50 H56 Ag B N4 -","- C50 H56 Ag B N4 -","- C200 H224 Ag4 B4 N16 -","4","1","ZL2033","Massa, Werner; Dehghanpour, Saeed; Tashakori, Gilda; Aoki, Katsuyuki","Bis[2-(cycloheptyliminomethyl)pyridine-κ^2^<i>N</i>,<i>N</i>']silver(I) tetraphenylborate","Acta Crystallographica Section E","2007","63","7","m1872","m1872","10.1107/S1600536807027079","","","0.71073","MoKα","","0.033","0.0295","","","0.0775","0.079","","","","","","1.076","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214471","8.1889","0.0003","8.8821","0.0003","12.6381","0.0005","95.251","0.002","98.649","0.002","95.2","0.002","899.86","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(μ-3-amino-5-carboxybenzoato-κ^2^O:O')bis[(5- aminoisophthalato)triaquasodium(I)]","","- C32 H38 N4 Na2 O22 -","- C32 H38 N4 Na2 O22 -","- C32 H38 N4 Na2 O22 -","1","0.5","ZL2034","Rong-Hua Zeng; Feng Sun; La-Sheng Jiang; You-Wen Tang; Zhan-Qiang Fang","Bis(μ-3-amino-5-carboxybenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(5-aminoisophthalato)triaquasodium(I)]","Acta Crystallographica Section E","2007","63","7","m1813","m1814","10.1107/S1600536807026013","","","0.71073","MoKα","","0.0531","0.0382","","","0.0988","0.1102","","","","","","1.059","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214472","4.5271","0.0004","12.1573","0.0013","12.69","0.0011","84.1","0.003","83.393","0.002","87.628","0.003","689.8","0.11","296","1","","","","","","","","","","4","P -1","-P 1","2","","2-[(8-Hydroxyquinolin-5-yl)methoxy]ethyl acrylate","","- C15 H15 N O4 -","- C15 H15 N O4 -","- C30 H30 N2 O8 -","2","1","ZL2035","Xu, Cun-Jin; Li, Bo-Geng; Wan, Jin-Tao; Bu, Zhi-Yang","2-[(8-Hydroxyquinolin-5-yl)methoxy]ethyl acrylate","Acta Crystallographica Section E","2007","63","7","o3244","o3244","10.1107/S1600536807028644","","","0.71075","MoKα","","","0.0509","","","","0.2201","","","","","","1.001","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2214473","18.809","0.004","10.801","0.002","13.559","0.003","90","","92.89","0.03","90","","2751.1","1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","{1,4-Bis[3-(3-methoxy-2-oxidobenzylideneamino)propyl]piperazine}iron(III) tetrafluoridoborate","","- C26 H34 B F4 Fe N4 O4 -","- C26 H34 B F4 Fe N4 O4 -","- C104 H136 B4 F16 Fe4 N16 O16 -","4","1","ZL2037","Butcher, Ray J.; Pourian, Mohamad; Jasinski, Jerry P.","{1,4-Bis[3-(3-methoxy-2-oxidobenzylideneamino)propyl]piperazine}iron(III) tetrafluoridoborate","Acta Crystallographica Section E","2007","63","7","m1913","m1914","10.1107/S1600536807028413","","","0.71073","MoKα","","0.1291","0.0534","","","0.1186","0.1443","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214474","7.9693","0.0005","8.2016","0.0005","12.1816","0.0008","77.634","0.001","72.344","0.001","68.777","0.001","702.34","0.08","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","2-(4-Bromophenyl)-5-methyl-3-methylsulfinyl-1-benzofuran","","- C16 H13 Br O2 S -","- C16 H13 Br O2 S -","- C32 H26 Br2 O4 S2 -","2","1","ZL2040","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","2-(4-Bromophenyl)-5-methyl-3-methylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2007","63","7","o3295","o3295","10.1107/S160053680702973X","","","0.71073","MoKα","","0.0217","0.0203","","","0.0553","0.0559","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214475","7.9969","0.0006","8.0326","0.0005","10.242","0.0007","87.824","0.005","71.974","0.006","80.015","0.006","616.05","0.08","294","","294","","","","","","","","","6","P -1","-P 1","2","","Tetrakis(μ-chloroacetato-κ^2^<i>O</i>:<i>O</i>')bis[(<i>N</i>,<i>N</i>-\ dimethylformamide-κ<i>O</i>)copper(II)]","","- C14 H22 Cl4 Cu2 N2 O10 -","- C14 H22 Cl4 Cu2 N2 O10 -","- C14 H22 Cl4 Cu2 N2 O10 -","1","0.5","ZL2041","Sieroń, Lesław","Tetrakis(μ-chloroacetato-κ^2^<i>O</i>:<i>O</i>')bis[(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)copper(II)]","Acta Crystallographica Section E","2007","63","7","m1966","m1966","10.1107/S1600536807029674","","","0.71073","MoKα","","0.0244","0.0232","","","0.0663","0.0669","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214476","13.2402","0.0018","7.7416","0.0014","9.777","0.0012","90","","90","","90","","1002.1","0.3","298","2","298","2","","","","","","","","4","P n c 2","P 2 -2bc","30","","6,6'-Dimethoxy-2,2'-[m-phenylenedi(iminomethylene)]diphenol","","- C22 H24 N2 O4 -","- C22 H24 N2 O4 -","- C44 H48 N4 O8 -","2","0.5","AT2307","Liu, Y.-F.; Xia, H.-T.; Yang, S.-P.; Wang, D.-Q.","6,6'-Dimethoxy-2,2'-[<i>m</i>-phenylenedi(iminomethylene)]diphenol","Acta Crystallographica Section E","2007","63","8","o3559","o3559","10.1107/S1600536807027742","","","0.71073","MoKα","","0.0954","0.0417","","","0.0925","0.1189","","","","","","1.051","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214477","5.9718","0.0011","6.8701","0.0015","21.713","0.002","90","","90.72","0.002","90","","890.7","0.3","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(6E,7E)-N,N'-Bis(2-hydroxy-3-methoxybenzylidene)benzene-1,4-diamine","","- C22 H20 N2 -","- C22 H20 N2 -","- C44 H40 N4 -","2","0.5","AT2308","Liu, Y.-F.; Xia, H.-T.; Yang, S.-P.; Wang, D.-Q.","(6<i>E</i>,7<i>E</i>)-<i>N</i>,<i>N</i>'-Bis(2-hydroxy-3-methoxybenzylidene)benzene-1,4-diamine","Acta Crystallographica Section E","2007","63","8","o3560","o3560","10.1107/S1600536807027754","","","0.71073","MoKα","","0.0972","0.0509","","","0.1167","0.1441","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214478","24.346","0.002","5.4437","0.0012","20.478","0.002","90","","109.496","0.002","90","","2558.4","0.7","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-[(4-Chlorophenyl)aminomethyl]-6-methoxyphenol","","- C14 H14 Cl N O2 -","- C14 H14 Cl N O2 -","- C112 H112 Cl8 N8 O16 -","8","1","AT2320","Liu, Y.-F.; Xia, H.-T.; Yang, S.-P.; Wang, D.-Q.","2-[(4-Chlorophenyl)aminomethyl]-6-methoxyphenol","Acta Crystallographica Section E","2007","63","8","o3561","o3561","10.1107/S1600536807027766","","","0.71073","MoKα","","0.0971","0.0527","","","0.1268","0.1583","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214479","10.4331","0.0014","15.7674","0.0016","23.398","0.002","90","","90","","90","","3849","0.7","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","6,6'-Dimethoxy-2,2'-(o-phenylenediimino)diphenol","","- C22 H24 N2 O4 -","- C22 H24 N2 O4 -","- C176 H192 N16 O32 -","8","1","AT2321","Liu, Y.-F.; Xia, H.-T.; Yang, S.-P.; Wang, D.-Q.","6,6'-Dimethoxy-2,2'-(<i>o</i>-phenylenediimino)diphenol","Acta Crystallographica Section E","2007","63","8","o3562","o3562","10.1107/S1600536807027778","","","0.71073","MoKα","","0.1271","0.0465","","","0.079","0.0961","","","","","","0.811","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214480","7.7106","0.001","6.3329","0.0009","28.673","0.004","90","","91.552","0.002","90","","1399.6","0.3","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-[(6-Chloropyridin-3-yl)methyl]-3-phenylimidazolidine-2,4-dione","","- C15 H12 Cl N3 O2 -","- C15 H12 Cl N3 O2 -","- C60 H48 Cl4 N12 O8 -","4","1","AT2329","Ke Li; De-Qing Shi","1-[(6-Chloropyridin-3-yl)methyl]-3-phenylimidazolidine-2,4-dione","Acta Crystallographica Section E","2007","63","8","o3506","o3506","10.1107/S1600536807029224","","","0.71073","MoKα","","0.0678","0.0558","","","0.1413","0.1536","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214481","6.509","0.002","7.404","0.003","14.005","0.005","79.885","0.006","80.766","0.006","68.565","0.007","615.1","0.4","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","trans-4-[2-(1,3-Benzoxazol-2-yl)ethenyl]benzaldehyde","","- C16 H11 N O2 -","- C16 H11 N O2 -","- C32 H22 N2 O4 -","2","1","AT2332","Duan-Lin Cao; Zhi-Yong Hu; Jin-Qiang Xue; Ya-Qing Feng","<i>trans</i>-4-[2-(1,3-Benzoxazol-2-yl)ethenyl]benzaldehyde","Acta Crystallographica Section E","2007","63","8","o3428","o3428","10.1107/S1600536807032606","","","0.71073","MoKα","","0.1192","0.0656","","","0.1615","0.1934","","","","","","1.18","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214483","7.056","0.004","8.854","0.004","13.976","0.006","90","","104.8","0.02","90","","844.2","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4,6-Dimethyl-2<i>H</i>-chromen-2-one","","- C11 H10 O2 -","- C11 H10 O2 -","- C44 H40 O8 -","4","1","AT2334","He-Wen Wang; Ya-Qing Feng; Jin-Qiang Xue; Zhi-Qiang Shi","4,6-Dimethyl-2<i>H</i>-chromen-2-one","Acta Crystallographica Section E","2007","63","8","o3556","o3556","10.1107/S1600536807032631","","","0.71073","MoKα","","0.1055","0.0477","","","0.1214","0.1564","","","","","","1.011","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214484","8.685","0.0005","9.9127","0.0006","10.3236","0.0007","111.007","0.001","105.027","0.001","101.552","0.001","757.78","0.08","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","5-Acetyl-4-amino-2-benzylsulfanyl-6-methylnicotinonitrile","","- C16 H15 N3 O S -","- C16 H15 N3 O S -","- C32 H30 N6 O2 S2 -","2","1","AT2335","Wen-Yan Mo; Hong-Wu He","5-Acetyl-4-amino-2-benzylsulfanyl-6-methylnicotinonitrile","Acta Crystallographica Section E","2007","63","8","o3569","o3569","10.1107/S1600536807034836","","","0.71073","MoKα","","0.1182","0.0626","","","0.1568","0.1792","","","","","","0.99","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214485","7.3978","0.001","8.8652","0.0012","20.978","0.003","90","","94.668","0.002","90","","1371.2","0.3","295","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chlorido{4-chloro-1-[2-(methylsulfanyl)phenyldiazenyl]phenyl-\ κ^3^<i>C</i>,<i>N</i>,<i>S</i>}palladium(II)","","- C13 H10 Cl2 N2 Pd S -","- C13 H10 Cl2 N2 Pd S -","- C52 H40 Cl8 N8 Pd4 S4 -","4","1","AT2336","Bagchi, Vivek; Das, Purak; Bandyopadhyay, Debkumar","Chlorido{4-chloro-1-[2-(methylsulfanyl)phenyldiazenyl]phenyl-κ^3^<i>C</i>,<i>N</i>,<i>S</i>}palladium(II): a second polymorph","Acta Crystallographica Section E","2007","63","8","m2130","m2130","10.1107/S1600536807033636","","","0.71073","MoKα","","0.0517","0.0497","","","0.102","0.103","","","","","","1.306","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214486","5.9507","0.0011","15.4492","0.0019","11.8647","0.0018","90","","90.362","0.013","90","","1090.7","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethylammonium 3,5-bis(trifluoromethyl)pyrazolide","","- C7 H9 F6 N3 -","- C7 H9 F6 N3 -","- C28 H36 F24 N12 -","4","1","AT2338","Vitze, Hannes; Lerner, Hans-Wolfram; Bolte, Michael","Dimethylammonium 3,5-bis(trifluoromethyl)pyrazolide","Acta Crystallographica Section E","2007","63","8","o3462","o3462","10.1107/S1600536807033648","","","0.71073","MoKα","","0.0974","0.0669","","","0.1702","0.1909","","","","","","1.016","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214487","15.9418","0.0011","8.7714","0.0007","16.651","0.0011","90","","92.815","0.005","90","","2325.5","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,5-Bis[(1E)-3,4-dimethoxybenzylidene]thiocarbonohydrazide tetrahydrate","","- C19 H30 N4 O8 S -","- C19 H30 N4 O8 S -","- C76 H120 N16 O32 S4 -","4","1","AT2339","Sarojini, B. K.; Yathirajan, H. S.; Narayana, B.; Sunil, K.; Bolte, Michael","1,5-Bis[(1<i>E</i>)-3,4-dimethoxybenzylidene]thiocarbonohydrazide tetrahydrate","Acta Crystallographica Section E","2007","63","8","o3521","o3521","10.1107/S1600536807034265","","","0.71073","MoKα","","0.05","0.0416","","","0.1044","0.1083","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214488","8.266","0.001","12.1458","0.0009","13.6687","0.0016","90","","92.651","0.01","90","","1370.8","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(4-Nitrobenzoyl)-3-phenylthiourea","","- C14 H11 N3 O3 S -","- C14 H11 N3 O3 S -","- C56 H44 N12 O12 S4 -","4","1","AT2340","Saeed, Aamer; Bolte, Michael","1-(4-Nitrobenzoyl)-3-phenylthiourea","Acta Crystallographica Section E","2007","63","8","o3553","o3553","10.1107/S1600536807034587","","","0.71073","MoKα","","0.0423","0.0338","","","0.0823","0.0863","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214489","24.037","0.003","5.9957","0.0004","9.3014","0.001","90","","91.673","0.009","90","","1339.9","0.2","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","N'-Isopropylidene-6-methoxy-2-naphthohydrazide","","- C15 H16 N2 O2 -","- C15 H16 N2 O2 -","- C60 H64 N8 O8 -","4","1","AT2341","Sarojini, B. K.; Narayana, B.; Sunil, K.; Yathirajan, H. S.; Bolte, Michael","<i>N</i>'-Isopropylidene-6-methoxy-2-naphthohydrazide","Acta Crystallographica Section E","2007","63","8","o3551","o3551","10.1107/S1600536807034599","","","0.71073","MoKα","","0.0319","0.0312","","","0.0863","0.0869","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214490","5.9808","0.0012","11.9617","0.0018","13.2239","0.0016","109.401","0.012","92.981","0.013","102.967","0.015","861.3","0.3","203","","203","","","","","","","","","4","P -1","-P 1","2","","(2E)-3-(Biphenyl-4-yl)-1-(quinolin-2-yl)prop-2-en-1-one","","- C24 H17 N O -","- C24 H17 N O -","- C48 H34 N2 O2 -","2","1","AT2342","Butcher, Ray J.; Jasinski, Jerry P.; Narayana, B.; Mayekar, Anil N.; Yathirajan, H. S.","(2<i>E</i>)-3-(Biphenyl-4-yl)-1-(quinolin-2-yl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","8","o3546","o3546","10.1107/S1600536807034721","","","0.71073","MoKα","","0.0732","0.0473","","","0.1292","0.1484","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214491","8.7266","0.0001","14.4778","0.0004","17.8606","0.0005","90","","90","","90","","2256.54","0.09","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Bis(3-deoxy-1,2-<i>O</i>-isopropylidene-α-D-glucofuranos-3-yl) disulfide","","- C18 H30 O10 S2 -","- C18 H30 O10 S2 -","- C72 H120 O40 S8 -","4","1","AT2343","Luboradzki, Roman; Pakulski, Zbigniew","Bis(3-deoxy-1,2-<i>O</i>-isopropylidene-α-<small>D</small>-glucofuranos-3-yl) disulfide","Acta Crystallographica Section E","2007","63","8","o3573","o3573","10.1107/S1600536807035064","","","0.71073","MoKα","","0.0311","0.029","","","0.0638","0.066","","","","","","1.089","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214493","7.3081","0.0008","11.5302","0.0012","11.5865","0.0012","114.784","0.001","97.618","0.001","107.483","0.001","806.9","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","1-(2,4-Dichlorophenyl)-2-[5-(1<i>H</i>-1,2,4-triazol-1-ylmethyl)- 1,3,4-thiadiazol-2-ylsulfanyl)ethanone","","- C13 H9 Cl2 N5 O S2 -","- C13 H9 Cl2 N5 O S2 -","- C26 H18 Cl4 N10 O2 S4 -","2","1","AT2345","Qing-Li Wei; Fu-Jin He; Yu-Sheng Lin; Sai Bi","1-(2,4-Dichlorophenyl)-2-[5-(1<i>H</i>-1,2,4-triazol-1-ylmethyl)-1,3,4-thiadiazol-2-ylsulfanyl]ethanone","Acta Crystallographica Section E","2007","63","8","o3649","o3649","10.1107/S1600536807036446","","","0.71073","MoKα","","0.0413","0.0359","","","0.0902","0.0945","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214495","5.8962","0.0005","14.665","0.0014","15.1812","0.0014","69.164","0.002","85.096","0.003","87.685","0.002","1222.28","0.19","173","2","173","2","","","","","","","","4","P -1","-P 1","2","1,1,1-Tris(benzenesulfonyloxymethyl)ethane","1,1,1-Tris(phenylsulfonyloxymethyl)ethane","","- C23 H24 O9 S3 -","- C23 H24 O9 S3 -","- C46 H48 O18 S6 -","2","1","AT2347","Fujihara, Takashi; Shioji, Eri; Nagasawa, Akira","1,1,1-Tris(phenylsulfonyloxymethyl)ethane","Acta Crystallographica Section E","2007","63","8","o3628","o3628","10.1107/S1600536807035507","","","0.71073","MoKα","","0.0646","0.0517","","","0.1179","0.1263","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214496","11.014","0.013","8.986","0.011","13.688","0.016","90","","109.746","0.018","90","","1275","3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4,10-Bis[N,N'-(2-ethyl)phthalimido]-1,7-dioxa-4,10-diazacyclododecane","N,N'-[(1,7-Dioxa-4,10-diazacyclododecane-2,10-diyl)diethylene]diphthalimide","","- C28 H32 N4 O6 -","- C28 H32 N4 O6 -","- C56 H64 N8 O12 -","2","0.5","AT2349","Sheng, Xin; Wu, Dong-Hua; Jia, Zhao-Li; Shao, Ying; Lu, Guo-Yuan","<i>N</i>,<i>N</i>'-[(1,7-Dioxa-4,10-diazacyclododecane-2,10-diyl)diethylene]diphthalimide","Acta Crystallographica Section E","2007","63","8","o3614","o3614","10.1107/S1600536807035805","","","0.71073","MoKα","","0.0742","0.0513","","","0.0997","0.1055","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214497","10.336","0.005","12.585","0.005","12.384","0.005","90","","100.497","0.005","90","","1583.9","1.2","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[(<i>E</i>)-Phenyldiazenyl]-2-[(<i>E</i>)-phenyliminomethyl]phenol","","- C19 H15 N3 O -","- C19 H15 N3 O -","- C76 H60 N12 O4 -","4","1","AT2350","Aslantaş, Mehmet; Kurtoğlu, Nurcan; Şahin, Ertan; Kurtoğlu, Mükerrem","4-[(<i>E</i>)-Phenyldiazenyl]-2-[(<i>E</i>)-phenyliminomethyl]phenol","Acta Crystallographica Section E","2007","63","8","o3637","o3637","10.1107/S1600536807036197","","","0.71073","MoKα","","","0.0616","","","","0.1638","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214498","7.2921","0.0003","21.7635","0.0009","9.5067","0.0004","90","","95.268","0.004","90","","1502.36","0.11","203","","203","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-Bromo-<i>N</i>'-[(E)-4-chlorobenzylidene]-5-methoxybenzohydrazide","","- C15 H12 Br Cl N2 O2 -","- C15 H12 Br Cl N2 O2 -","- C60 H48 Br4 Cl4 N8 O8 -","4","1","AT2351","Butcher, Ray J.; Jasinski, Jerry P.; Narayana, B.; Sunil, K.; Yathirajan, H. S.","2-Bromo-<i>N</i>'-[(<i>E</i>)-4-chlorobenzylidene]-5-methoxybenzohydrazide","Acta Crystallographica Section E","2007","63","8","o3652","o3652","10.1107/S1600536807036458","","","0.71073","MoKα","","0.1167","0.0312","","","0.0579","0.081","","","","","","0.952","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214499","10.0597","0.0005","7.4244","0.0004","24.3726","0.0013","90","","98.126","0.002","90","","1802.05","0.16","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diethyl 4-(4-bromophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate","","- C19 H22 Br N O4 -","- C19 H22 Br N O4 -","- C76 H88 Br4 N4 O16 -","4","1","AT2352","Boulcina, Raouf; Bouacida, Sofiane; Roisnel, Thierry; Debache, Abdelmadjid","Diethyl 4-(4-bromophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica Section E","2007","63","8","o3635","o3636","10.1107/S160053680703646X","","","0.71073","MoKα","","0.037","0.027","","","0.0749","0.0933","","","","","","1.132","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214500","7.357","0.0002","8.6887","0.001","15.9114","0.001","85.047","0.005","78.476","0.005","67.321","0.004","919.49","0.13","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis(4-chlorobenzoato-κ<i>O</i>)bis-(<i>N</i>,<i>N</i>'- diethylnicotinamide-κ<i>N</i>)zinc(II)","","- C34 H40 Cl2 N4 O8 Zn -","- C34 H40 Cl2 N4 O8 Zn -","- C34 H40 Cl2 N4 O8 Zn -","1","0.5","BG2071","Sarı, Musa; Gökçe, Gültekin; Gökçe, Songül; Şahin, Ertan; Necefoǧlu, Hacali","Diaquabis(4-chlorobenzoato-κ<i>O</i>)bis-(<i>N</i>,<i>N</i>'-diethylnicotinamide-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2007","63","8","m2191","m2191","10.1107/S1600536807034745","","","0.71069","MoKα","","0.0951","0.0627","","","0.1463","0.1694","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214501","5.1684","0.0002","8.5494","0.0003","15.9227","0.0005","90","","95.518","0.002","90","","700.31","0.04","90","0.2","90","0.2","","","","","","","","5","P 1 21 1","P 2yb","4","","tert-Butyl N-[(1<i>R</i>,2<i>R</i>)-2-(isothiocyanato)cyclohexyl]carbamate","","- C12 H20 N2 O2 S -","- C12 H20 N2 O2 S -","- C24 H40 N4 O4 S2 -","2","1","BG2075","Zhong, Ming; Siegler, Maxime; Long, Sihui","<i>tert</i>-Butyl <i>N</i>-[(1<i>R</i>,2<i>R</i>)-2-(isothiocyanato)cyclohexyl]carbamate","Acta Crystallographica Section E","2007","63","8","o3589","o3589","10.1107/S1600536807035015","","","0.71073","MoKα","","0.0441","0.0359","","","0.0789","0.0833","","","","","","1.065","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214502","6.7453","0.0003","5.5087","0.0001","18.1775","0.0002","90","","100.114","0.003","90","","664.94","0.03","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-poly[N,N'-bis(2-ammonioethyl)oxamide [dioxidovanadate-μ-oxido-dioxidovanadate-μ-oxido]],","","- C6 H16 N4 O8 V2 -","- C6 H16 N4 O8 V2 -","- C12 H32 N8 O16 V4 -","2","0.5","BG2076","Guo-Ming Wang; Jin-Hua Li; Jing Han; Hui-Luan Liu","A new vanadate containing helical chains","Acta Crystallographica Section E","2007","63","8","m2189","m2189","10.1107/S160053680703471X","","","0.71073","MoKα","","0.0314","0.0293","","","0.0767","0.078","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214503","7.6363","0.0005","11.0786","0.0005","15.2355","0.0008","90","","104.038","0.006","90","","1250.42","0.12","203","","203","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(2E)-1-(3-Hydroxyphenyl)-3-(4-methylphenyl)prop-2-en-1-one","","- C16 H14 O2 -","- C16 H14 O2 -","- C64 H56 O8 -","4","1","BG2079","Butcher, Ray J.; Jasinski, Jerry P.; Narayana, B.; Lakshmana, K.; Yathirajan, H. S.","(2<i>E</i>)-1-(3-Hydroxyphenyl)-3-(4-methylphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","8","o3660","o3660","10.1107/S1600536807036641","","","0.71073","MoKα","","0.1053","0.0442","","","0.1007","0.1161","","","","","","0.85","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214504","7.591","0.0007","10.8509","0.0007","15.1544","0.0011","90","","104.213","0.008","90","","1210.05","0.17","203","","203","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2E)-3-(4-Chlorophenyl)-1-(3-hydroxyphenyl)prop-2-en-1-one","","- C15 H11 Cl O2 -","- C15 H11 Cl O2 -","- C60 H44 Cl4 O8 -","4","1","BG2080","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Lakshmana, K.; Narayana, B.","(2<i>E</i>)-3-(4-Chlorophenyl)-1-(3-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","8","o3661","o3661","10.1107/S1600536807036653","","","0.71073","MoKα","","0.0956","0.0565","","","0.1475","0.1764","","","","","","0.984","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214505","11.4275","0.0003","11.4275","","20.9322","0.0006","90","","90","","120","","2367.27","0.09","295","2","295","2","","","","","","","","6","P 61","P 61","169","","<i>catena</i>-poly[[[triaqua(sulfato-κ<i>O</i>)zinc(II)]-μ- 4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] dihydrate]","","- C10 H18 N2 O9 S Zn -","- C10 H8 N2 O9 S Zn -","- C60 H48 N12 O54 S6 Zn6 -","6","1","BG3045","Ng, Seik Weng","A reinvestigation of the space group of <i>catena</i>-poly[[[triaqua(sulfato-κ<i>O</i>)zinc(II)]-<i>{μ</i>}-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] dihydrate]","Acta Crystallographica Section E","2007","63","8","m2225","m2226","10.1107/S1600536807035581","","","0.71073","MoKα","","0.0478","0.0451","","","0.1222","0.1245","","","","","","1.109","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214506","4.7829","0.0004","12.7379","0.0013","20.532","0.002","90","","90","","90","","1250.9","0.2","296","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>)-2-[2-(Hydroxymethyl)phenyliminomethyl]-6-methylphenol","","- C15 H15 N O2 -","- C15 H15 N O2 -","- C60 H60 N4 O8 -","4","1","BH2113","Gül, Zarife Sibel; Erşahin, Ferda; Aǧar, Erbil; Işık, Şamil","(<i>E</i>)-2-[2-(Hydroxymethyl)phenyliminomethyl]-6-methylphenol","Acta Crystallographica Section E","2007","63","8","o3547","o3547","10.1107/S1600536807032266","","","0.71073","MoKα","","0.0924","0.0409","","","0.0742","0.0847","","","","","","0.79","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214507","9.5303","0.0002","10.4028","0.0002","18.0951","0.0004","90","","90.1433","0.0014","90","","1793.98","0.06","100","2","100","2","","","","","","","","4","P 1 c 1","P -2yc","7","","1,1,1-Tris[(diphenylphosphoryl)methyl]propane monohydrate","","- C42 H43 O4 P3 -","- C42 H43 O4 P3 -","- C84 H86 O8 P6 -","2","1","BH2120","Grigoriev, Mikhail S.; Pisareva, Svetlana A.; Safiulina, Alfiya M.; Nifant'ev, Eduard E.","1,1,1-Tris[(diphenylphosphoryl)methyl]propane monohydrate","Acta Crystallographica Section E","2007","63","8","o3441","o3442","10.1107/S1600536807032527","","","0.71073","MoKα","","0.0453","0.0348","","","0.0657","0.0683","","","","","","0.95","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214508","8.164","0.0005","10.405","0.0006","13.7225","0.0007","76.264","0.003","74.357","0.003","86.475","0.003","1090.39","0.11","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","5-Chloro-4-chloromethyl-2-phenyl-1,3-selenazole","","- C10 H7 Cl2 N Se -","- C10 H7 Cl2 N Se -","- C40 H28 Cl8 N4 Se4 -","4","2","BH2124","Shi, Xia; Zhao, Guo-Liang","5-Chloro-4-chloromethyl-2-phenyl-1,3-selenazole","Acta Crystallographica Section E","2007","63","8","o3642","o3642","10.1107/S1600536807036409","","","0.71073","MoKα","","","0.0352","","","0.0872","0.0976","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214509","9.419","0.003","10.443","0.003","25.409","0.009","90","","97.262","0.005","90","","2479.2","1.4","293.15","","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","Poly[tetra-μ~2-aqua-diaqua-μ~2~-chlorido-di-μ~2~-oxo-dioxo[μ~7~-N,N,N',N'- (propane-1,2-diyldinitrilo)tetraacetato]dimolybdenum(V)trisodium(I)]","","- C11 H26 Cl Mo2 N2 Na3 O18 -","- C11 H26 Cl Mo2 N2 Na3 O18 -","- C44 H104 Cl4 Mo8 N8 Na12 O72 -","4","1","BI2185","Zhen-Hua Dang; Jun Zhao; Yong-Jing Wang; Ya-Zhen Ye; Li Xu","Poly[tetra-μ~2~-aqua-diaqua-μ~2~-chlorido-di-μ~2~-oxo-dioxo[μ~7~-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-(propane-1,2-diyldinitrilo)tetraacetato]dimolybdenum(V)trisodium(I)]","Acta Crystallographica Section E","2007","63","8","m2106","m2106","10.1107/S1600536807021769","","","0.71073","MoKα","","0.0415","0.0357","","","0.0577","0.0606","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214510","23.996","0.002","23.996","0.002","13.1605","0.001","90","","90","","90","","7577.9","1.1","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","cyclo-Tetrakis[μ-<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-(2-hydroxy-3-\ methoxybenzylidene)hydrazinate(2-)]tetracobalt(II)} <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","","- C72 H76 Co4 N12 O20 -","- C72 H76 Co4 N12 O20 -","- C288 H304 Co16 N48 O80 -","4","0.25","BI2200","Gao, Yu-Xiang; Wang, Li-Bin; Niu, Yan-Ling; Hao, Lu-Jiang","<i>cyclo</i>-Tetrakis[μ-<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-(2-hydroxy-3-methoxybenzylidene)hydrazinate(2‒)]tetracobalt(II) <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","Acta Crystallographica Section E","2007","63","8","m2128","m2128","10.1107/S1600536807033338","","","0.71073","MoKα","","0.0845","0.0407","","","0.1009","0.1356","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214511","10.109","0.0013","12.076","0.0016","13.356","0.0018","94.923","0.002","107.235","0.002","91.014","0.002","1549.9","0.4","292","2","292","2","","","","","","","","4","P -1","-P 1","2","N,N'-Bis(N,N-dimethyl-p-isopropylphenylamine)bis(ethoxycarbonyl)glycoluril","Diethyl 2,6-bis(4-isopropylphenyl)-4,8-dioxo-2,6,3a,4a,7a,8a- hexaazaperhydrocyclopenta[def]fluorene-8b,8c-dicarboxylate","","- C32 H40 N6 O6 -","- C32 H40 N6 O6 -","- C64 H80 N12 O12 -","2","1","BI2201","Zi-Hua Wang; Juan Li; Jing Qin","Diethyl 2,6-bis(4-isopropylphenyl)-4,8-dioxo-2,6,3a,4a,7a,8a-hexaazaperhydrocyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","Acta Crystallographica Section E","2007","63","8","o3615","o3615","10.1107/S160053680703440X","","","0.71073","MoKα","","0.0659","0.0588","","","0.1593","0.167","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214512","17.042","0.005","7.6443","0.0019","18.228","0.005","90","","93.36","0.02","90","","2370.6","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-(Isopropylidenehydrazono)-3-methyl-2,3-dihydroquinazoline-4(1H)-one","","- C12 H14 N4 O -","- C12 H14 N4 O -","- C96 H112 N32 O8 -","8","1","BI2203","Kamali, Ahmad; Sheikhshoaie, Iran; Sharif, Mahboubeh A.; Khavasi, Hamid Reza","2-(Isopropylidenehydrazono)-3-methyl-2,3-dihydroquinazolin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","8","o3612","o3612","10.1107/S1600536807035714","","","0.71073","MoKα","","0.074","0.061","","","0.1684","0.1782","","","","","","1.072","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214513","14.8886","0.0008","13.891","0.0008","10.3902","0.0006","90","","130.426","0.005","90","","1635.8","0.2","100","2","100","2","","","","","","","","3","C 1 c 1","C -2yc","9","","5,5-Dimethyl-3,4-di-<i>p</i>-tolylcyclopent-2-enone","","- C21 H22 O -","- C21 H22 O -","- C84 H88 O4 -","4","1","BI2205","Marjani, Katayoon; Sharifi Moghadam, Mahmood; Arazi, Omid; Mousavi, Mohsen","5,5-Dimethyl-3,4-di-<i>p</i>-tolylcyclopent-2-enone","Acta Crystallographica Section E","2007","63","8","o3519","o3519","10.1107/S1600536807034289","","","0.71073","MoKα","","0.0337","0.0329","","","0.0852","0.0865","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214514","16.854","0.005","6.78","0.002","24.749","0.008","90","","90","","90","","2828.1","1.5","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4,5,6,7-Tetrachloro-2-phenylisoindoline-1,3-dione","","- C14 H5 Cl4 N O2 -","- C14 H5 Cl4 N O2 -","- C112 H40 Cl32 N8 O16 -","8","1","BI2206","Li, Jian","4,5,6,7-Tetrachloro-2-phenylisoindoline-1,3-dione","Acta Crystallographica Section E","2007","63","8","o3515","o3515","10.1107/S1600536807034290","","","0.71073","MoKα","","0.0499","0.0424","","","0.1092","0.1171","","","","","","1.087","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214515","9.0029","0.0009","9.0029","0.0009","22.937","0.004","90","","90","","120","","1610","0.4","293","2","293","2","","","","","","","","6","P -3 1 c","-P 3 2c","163","","Hexakis(1H-imidazole-κN^3^)nickel(II) sulfate dihydrate","","- C18 H28 N12 Ni O6 S -","- C18 H28.02 N12 Ni O6 S -","- C36 H56.04 N24 Ni2 O12 S2 -","2","0.166667","BI2207","Xiao-Chang Sun; Guang-Peng Zhou; Zhao-Bin Liu; Yan Xu","Hexakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II) sulfate dihydrate","Acta Crystallographica Section E","2007","63","8","m2176","m2176","10.1107/S1600536807034472","","","0.71073","MoKα","","0.0646","0.0561","","","0.1719","0.1826","","","","","","1.164","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214516","8.691","0.004","8.244","0.004","13.833","0.006","90","","102.764","0.006","90","","966.6","0.8","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[(18-crown-6)potassium(I)]-μ-chlorido-silver(I)-μ-chlorido]","","- C12 H24 Ag Cl2 K O6 -","- C12 H24 Ag Cl2 K O6 -","- C24 H48 Ag2 Cl4 K2 O12 -","2","0.5","BI2208","Xing-Min Song; Xian-Qiang Huang; Jian-Min Dou; Da-Cheng Li","<i>catena</i>-Poly[[(18-crown-6)potassium(I)]-μ-chlorido-silver(I)-μ-chlorido]","Acta Crystallographica Section E","2007","63","8","m2219","m2219","10.1107/S1600536807035726","","","0.71073","MoKα","","0.0378","0.0267","","","0.073","0.0789","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214517","7.0722","0.0014","7.8143","0.0016","27.917","0.006","90","","91.75","0.03","90","","1542.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(4E)-1,5-Dimethyl-4-[(5-nitrofuran-2-yl)methyleneamino]-2-phenyl-1H-pyrazol- 3(2H)-one","","- C16 H14 N4 O4 -","- C16 H14 N4 O4 -","- C64 H56 N16 O16 -","4","1","BI2210","Jing, Zuo-Liang; Yu, Ming; Shen, Chen","(4<i>E</i>)-1,5-Dimethyl-4-[(5-nitrofuran-2-yl)methyleneamino]-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","8","o3541","o3541","10.1107/S1600536807034502","","","0.71073","MoKα","","0.0702","0.055","","","0.1449","0.1538","","","","","","1.169","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214518","12.0798","0.0002","13.0513","0.0002","19.3154","0.0003","85.17","0.0008","73.148","0.0007","74.5617","0.0008","2809.2","0.08","173","2","173","2","","","","","","","","5","P -1","-P 1","2","(18-Crown-6)bis(tetrahydrofuran-κO)potassium(I) [1,2-bis(fluoren-9-ylcarbonyl)benzene(2-)]bis(η^5^-\ cyclopentadienyl)dysprosate(III)","","","- C64 H70 Dy K O10 -","- C64 H70 Dy K O10 -","- C128 H140 Dy2 K2 O20 -","2","1","BI2211","Zaeni, Ahmad; Olbrich, Falk; Blaurock, Steffen; Edelmann, Frank T.","(18-Crown-6)bis(tetrahydrofuran-κ<i>O</i>)potassium(I) [1,2-bis(fluoren-9-ylcarbonyl)benzene(2{-})]bis(η^5^-cyclopentadienyl)dysprosate(III)","Acta Crystallographica Section E","2007","63","8","m2218","m2218","10.1107/S1600536807035738","","","0.71073","MoKα","","0.0288","0.0255","","","0.0653","0.0669","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214519","7.722","0.001","10.0002","0.0001","14.8836","0.0001","90","","90","","90","","1149.33","0.15","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[aqua(pyrazine-2-carboxylato-κ^2^N^1^,O)manganese(II)]- μ-pyrazine-2-carboxylato-κ^3^-κ^2^N^1^,O:N^4^]","","- C10 H8 Mn N4 O5 -","- C10 H8 Mn N4 O5 -","- C40 H32 Mn4 N16 O20 -","4","1","BI2213","Gao, Yu-Xiang; Wang, Li-Bin; Niu, Yan-Ling; Hao, Lu-Jiang","<i>catena</i>-Poly[[aqua(pyrazine-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)manganese(II)]-μ-pyrazine-2-carboxylato-κ^3^<i>N</i>^1^,<i>O</i>:<i>N</i>^4^]","Acta Crystallographica Section E","2007","63","8","m2185","m2185","10.1107/S1600536807034496","","","0.71073","MoKα","","0.0483","0.0391","","","0.0936","0.1014","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214520","24.1202","0.001","24.1202","0.001","13.093","0.002","90","","90","","90","","7617.3","1.2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","<i>cyclo</i>-Tetrakis[μ-<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-(2-hydroxy-3-\ methoxybenzylidene)hydrazine(2-)]tetrazinc(II)} <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","","- C72 H76 N12 O20 Zn4 -","- C72 H76 N12 O20 Zn4 -","- C288 H304 N48 O80 Zn16 -","4","0.25","BI2214","Gao, Yu-Xiang; Wang, Li-Bin; Niu, Yan-Ling","<i>cyclo</i>-Tetrakis[μ-<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-(2-hydroxy-3-methoxybenzylidene)hydrazine(2‒)]tetrazinc(II) <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","Acta Crystallographica Section E","2007","63","8","m2180","m2180","10.1107/S1600536807034514","","","0.71073","MoKα","","0.0931","0.0457","","","0.114","0.1538","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214521","12.1335","0.0004","7.7866","0.0002","10.4078","0.0003","90","","90","","90","","983.32","0.05","295","2","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","Diacetato(ethylenediamine)zinc(II)","","- C6 H14 N2 O4 Zn -","- C6 H14 N2 O4 Zn -","- C24 H56 N8 O16 Zn4 -","4","0.5","BM3031","Kim, Young-Inn; Lee, You-Soon; Seo, Hoe-Joo; Kang, Sung Kwon","Diacetato(ethylenediamine)zinc(II)","Acta Crystallographica Section E","2007","63","8","m2239","m2240","10.1107/S1600536807036616","","","0.71073","MoKα","","","0.0263","","","","0.0668","","","","","","0.99","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214522","6.1119","0.0006","12.0498","0.0011","13.9657","0.0013","100.158","0.002","95.028","0.002","103.283","0.002","976.47","0.16","292","2","292","2","","","","","","","","3","P -1","-P 1","2","","3-(4-tert-Butylphenyl)-5-(biphenyl-4-yl)-1H-pyrazole","","- C25 H24 N2 -","- C25 H24 N2 -","- C50 H48 N4 -","2","1","BQ2023","Chun-Yang Zheng; Jing Zheng; Dun-Jia Wang","5-(Biphenyl-4-yl)-3-(4-<i>tert</i>-butylphenyl)-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2007","63","8","o3444","o3444","10.1107/S1600536807028565","","","0.71073","MoKα","","0.0878","0.0598","","","0.1615","0.1835","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214523","15.7646","0.0008","16.3172","0.0008","24.7351","0.0012","90","","90","","90","","6362.7","0.5","292","2","292","2","","","","","","","","5","P c a b","-P 2bc 2ac","61","","{[N,N'-Bis(4-methoxybenzyl)ethane-1,2-diyldiimino]diacetato}bis(1H- imidazole-kN^3^)cadmium(II) dihydrate","","- C28 H38 Cd N6 O8 -","- C28 H38 Cd N6 O8 -","- C224 H304 Cd8 N48 O64 -","8","1","BQ2024","Min Zhang; She-Min Lan; Hui-Li Weng; Xing-Man Xu","{[<i>N</i>,<i>N</i>'-Bis(4-methoxybenzyl)ethane-1,2-diyldiimino]diacetato}bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)cadmium(II) dihydrate","Acta Crystallographica Section E","2007","63","8","m2045","m2045","10.1107/S1600536807031200","","","0.71073","MoKα","","0.0911","0.0589","","","0.1598","0.1786","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214524","6.9563","0.0011","11.584","0.002","20.06","0.003","90","","90.271","0.005","90","","1616.5","0.4","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Poly[[silver(I)-bis[μ~2~-3-(aminomethyl)pyridine]- κ^2^N^1^:N^3^;κ^2^N^3^:N^1^] hexafluoridophosphate]","","- C12 H16 Ag F6 N4 P -","- C12 H16 Ag F6 N4 P -","- C48 H64 Ag4 F24 N16 P4 -","4","1","BQ2026","Cody E. Carson; Feazell, Rodney P.; Kevin K. Klausmeyer","Poly[[silver(I)-bis[μ~2~-3-(aminomethyl)pyridine]-κ^2^<i>N</i>^1^:<i>N</i>^3^;κ^2^<i>N</i>^3^:<i>N</i>^1^] hexafluoridophosphate]","Acta Crystallographica Section E","2007","63","8","m2131","m2132","10.1107/S1600536807033430","","","0.71073","MoKα","","0.0348","0.0286","","","0.1004","0.1166","","","","","","0.959","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214525","11.6553","0.0008","5.7418","0.0003","18.0804","0.0012","90","","101.796","0.006","90","","1184.43","0.13","203","2","203","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","pyrazolocarbazole","1,10-Dihydro-3,9-dimethylpyrazolo[3,4-a]carbazole","","- C15 H13 N3 -","- C15 H13 N3 -","- C60 H52 N12 -","4","1","BQ2027","A. Ebenezer Martin; A. Thomas Gunaseelan; A. Thiruvalluvar; K. J. Rajendra Prasad; R. J. Butcher","1,10-Dihydro-3,9-dimethylpyrazolo[3,4-<i>a</i>]carbazole","Acta Crystallographica Section E","2007","63","8","o3471","o3471","10.1107/S160053680703351X","","","0.71073","MoKα","","0.1142","0.0432","","","0.0841","0.0956","","","","","","0.812","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214526","7.2201","0.0002","18.0627","0.0005","12.2046","0.0004","90","","90","","90","","1591.66","0.08","296","2","296","2","","","","","","","","3","P n a 21","P 2c -2n","33","","(3<i>E</i>,4<i>E</i>)-3-(1,3-Benzodioxol-5-ylmethylene)-4-\ (1-phenylethylidene)tetrahydrofuran-2,5-dione","","- C20 H14 O5 -","- C20 H14 O5 -","- C80 H56 O20 -","4","1","BQ2028","Zheng, Liang-Wen; Dong, Wen-Liang; Zhang, Jin-Hua; Zhao, Bao-Xiang","(3<i>E</i>,4<i>E</i>)-3-(1,3-Benzodioxol-5-ylmethylene)-4-(1-phenylethylidene)tetrahydrofuran-2,5-dione","Acta Crystallographica Section E","2007","63","8","o3567","o3567","10.1107/S160053680703485X","","","0.71073","MoKα","","0.0413","0.0319","","","0.0804","0.0863","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214527","8.895","0.0008","9.351","0.0008","10.551","0.0009","94.365","0.001","102.452","0.001","108.924","0.001","800.44","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","3-(3,5-Dimethoxyphenyl)-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5(4H)-thione","","- C17 H17 N3 O3 S -","- C17 H17 N3 O3 S -","- C34 H34 N6 O6 S2 -","2","1","BQ2029","Ghulam Qadeer; Nasim Hasan Rama; Javeed Akhtar; Mohammad Azad Malik; James Raftery","3-(3,5-Dimethoxyphenyl)-4-(2-methoxyphenyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","8","o3629","o3629","10.1107/S1600536807036471","","","0.71073","MoKα","","0.0412","0.0353","","","0.0963","0.0991","","","","","","1.089","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214528","9.9885","0.0002","9.0509","0.0001","19.0182","0.0003","90","","90","","90","","1719.34","0.05","297","","297","","","","","","","","","5","P c a 21","P 2c -2ac","29","","Benzimidazolium perchlorate","","- C7 H7 Cl N2 O4 -","- C7 H7 Cl N2 O4 -","- C56 H56 Cl8 N16 O32 -","8","2","BQ2032","Sieroń, Lesław","Benzimidazolium perchlorate","Acta Crystallographica Section E","2007","63","8","o3585","o3585","10.1107/S1600536807035428","","","0.71073","MoKα","","0.0438","0.0405","","","0.1083","0.1121","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214529","15.7241","0.0009","29.528","0.0018","11.3464","0.0007","90","","90.798","0.001","90","","5267.6","0.5","153","2","153","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[tetrakis(hexamethylphosphoramide-κO)bis(nitrato- κ^2^O,O')ytterbium(III)] [silver(I)-di-μ-sulfido-tungstate(VI)(Ag—W)-di-μ-sulfido]]","","- C24 H72 Ag N14 O10 P4 S4 W Yb -","- C24 H72 Ag N14 O10 P4 S4 W Yb -","- C96 H288 Ag4 N56 O40 P16 S16 W4 Yb4 -","4","1","BR2049","Cao, Yuan; Zhang, Jin-Fang; Zhang, Chi","<i>catena</i>-Poly[[tetrakis(hexamethylphosphoramide-κ<i>O</i>)bis(nitrato- κ^2^<i>O</i>,<i>O</i>')ytterbium(III)] [silver(I)-di-μ-sulfido-tungstate(VI)(<i>Ag</i>—<i>W</i>)-di-μ-sulfido]]","Acta Crystallographica Section E","2007","63","8","m2076","m2077","10.1107/S1600536807031480","","","0.7107","MoKα","","0.0354","0.0325","","","0.0674","0.0686","","","","","","1.179","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214530","15.789","0.003","29.661","0.006","11.43","0.002","90","","90.83","0.03","90","","5352.3","1.8","223","2","223","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[tetrakis(hexamethylphosphoramide-κO)bis(nitrato- κ^2^O,O')yttrium(III)] [silver(I)-di-μ-sulfido-tungstate(VI)(Ag—W)-di-μ-sulfido]]","","- C24 H72 Ag N14 O10 P4 S4 W Y -","- C24 H72 Ag N14 O10 P4 S4 W Y -","- C96 H288 Ag4 N56 O40 P16 S16 W4 Y4 -","4","1","BR2050","Zhang, Jin-Fang; Cao, Yuan; Zhang, Chi","<i>catena</i>-Poly[[tetrakis(hexamethylphosphoramide-κ<i>O</i>)bis(nitrato-κ^2^<i>O</i>,<i>O</i>')yttrium(III)] [silver(I)-di-μ-sulfido-tungstate(VI)(<i>Ag</i>—<i>W</i>)-di-μ-sulfido]]","Acta Crystallographica Section E","2007","63","8","m2248","m2249","10.1107/S1600536807036306","","","0.71073","MoKα","","0.0499","0.0437","","","0.0829","0.0848","","","","","","1.205","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214531","8.5787","0.0008","6.6953","0.0006","4.7438","0.0005","90","","90","","90","","272.47","0.05","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","Magnesium sulfate(VI)","","- Mg O4 S -","- Mg O4 S -","- Mg4 O16 S4 -","4","0.5","BR2051","Weil, Matthias","The high-temperature modification of magnesium sulfate (β-MgSO~4~) from single-crystal data","Acta Crystallographica, Section E","2007","63","8","m172","m172","10.1107/S1600536807036355","","","0.71073","MoKα","","0.0226","0.0173","","","0.0443","0.0459","","","","","","1.13","","","","has coordinates","277834","2022-09-14","16:39:45",""
"2214532","18.973","0.005","7.0494","0.0017","17.454","0.004","90","","103.137","0.003","90","","2273.3","1","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diiodidobis[(E)-1-(2-pyridylmethylene)thiosemicarbazone-κS]mercury(II)","","- C14 H16 Hg I2 N8 S2 -","- C14 H16 Hg I2 N8 S2 -","- C56 H64 Hg4 I8 N32 S8 -","4","0.5","BT2394","Fan, Ying-Ju; Ma, Jian-Ping; Sun, Zhong-Xi","Diiodidobis[(<i>E</i>)-1-(2-pyridylmethylene)thiosemicarbazone-κ<i>S</i>]mercury(II)","Acta Crystallographica Section E","2007","63","8","m2044","m2044","10.1107/S1600536807031340","","","0.71073","MoKα","","0.045","0.0422","","","0.1082","0.1103","","","","","","1.06","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214533","4.999","0.002","4.999","0.002","35.876","0.006","90","","90","","90","","896.5","0.5","299","2","299","2","","","","","","","","5","P 43","P 4cw","78","","2-Chloro-<i>N</i>-(3-nitrophenyl)acetamide","","- C8 H7 Cl N2 O3 -","- C8 H7 Cl N2 O3 -","- C32 H28 Cl4 N8 O12 -","4","1","BT2406","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","2-Chloro-<i>N</i>-(3-nitrophenyl)acetamide","Acta Crystallographica Section E","2007","63","8","o3364","o3364","10.1107/S1600536807031649","","","1.5418","CuKα","","0.0711","0.0655","","","0.1668","0.1876","","","","","","1.133","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214534","19.411","0.004","8.2182","0.0017","23.245","0.005","90","","101.091","0.004","90","","3638.9","1.3","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-Butylamino-6-chloro-4-(2,4,4-trimethylpentan-2-ylamino)-1,3,5-triazine","","- C15 H28 Cl N5 -","- C15 H28 Cl N5 -","- C120 H224 Cl8 N40 -","8","1","BT2407","Rui-Zhi Wen; Shui-Fang Li; Jiao-Juan Li","2-Butylamino-6-chloro-4-(2,4,4-trimethylpentan-2-ylamino)-1,3,5-triazine","Acta Crystallographica Section E","2007","63","8","o3367","o3367","10.1107/S1600536807031637","","","0.71073","MoKα","","0.0788","0.0542","","","0.1408","0.1605","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214535","12.7879","0.0012","8.7333","0.0008","21.531","0.002","90","","94.1","0.003","90","","2398.4","0.4","133","2","133","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3-Diisopropylimidazolium bis(cyclooctatetraenyl)erbate(III)","","- C27 H37 Er N2 -","- C27 H37 Er N2 -","- C108 H148 Er4 N8 -","4","1","BT2409","Jones, Peter G.; Hrib, Cristian G.; Panda, Tarun K.; Tamm, Matthias","1,3-Diisopropylimidazolium bis(cyclooctatetraenyl)erbate(III)","Acta Crystallographica Section E","2007","63","8","m2059","m2060","10.1107/S1600536807030899","","","0.71073","MoKα","","0.0291","0.0198","","","0.0388","0.0422","","","","","","1.111","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214536","10.069","0.002","7.1925","0.0014","13.48","0.003","90","","96.56","0.03","90","","969.8","0.4","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-Diaminopyridinium hydrogen squarate","","- C9 H9 N3 O4 -","- C9 H9 N3 O4 -","- C36 H36 N12 O16 -","4","1","BT2412","Bojidarka Koleva; Tsanko Tsanev; Tsonko Kolev; Heike Mayer-Figge; William S. Sheldrick","3,4-Diaminopyridinium hydrogen squarate","Acta Crystallographica Section E","2007","63","8","o3356","o3356","10.1107/S1600536807031170","","","0.71073","MoKα","","0.0968","0.0656","","","0.1746","0.189","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214537","4.8178","0.0003","12.1967","0.0012","29.576","0.003","90","","93.265","0.005","90","","1735.1","0.3","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Chloro-3-ethyl-N-[3-(morpholin-4-yl)propyl]-1H-indole-2-carboxamide","","- C18 H24 Cl N3 O2 -","- C18 H24 Cl N3 O2 -","- C72 H96 Cl4 N12 O8 -","4","1","BT2413","Muirhead, Kirsty E. A.; Trembleau, Laurent; Harrison, William T. A.","5-Chloro-3-ethyl-<i>N</i>-[3-(morpholin-4-yl)propyl]-1<i>H</i>-indole-2-carboxamide","Acta Crystallographica Section E","2007","63","8","o3390","o3390","10.1107/S1600536807031182","","","0.71073","MoKα","","0.1993","0.1422","","","0.3029","0.342","","","","","","1.085","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214538","12.644","0.0012","5.7698","0.0005","13.9238","0.0013","90","","102.601","0.002","90","","991.32","0.16","291","2","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Ammonio-3-(4-pyridyl)propanoate dihydrate","","- C8 H14 N2 O4 -","- C8 H14 N2 O4 -","- C32 H56 N8 O16 -","4","1","BT2415","Zhao, Hong","3-Ammonio-3-(4-pyridyl)propanoate dihydrate","Acta Crystallographica Section E","2007","63","8","o3400","o3400","10.1107/S1600536807031583","","","0.71073","MoKα","","0.0542","0.0445","","","0.0967","0.0992","","","","","","1.089","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214539","11.2828","0.0002","5.14","0.0001","20.9368","0.0005","90","","103.657","0.002","90","","1179.87","0.04","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(3,4-Dichlorophenyl)benzamide","","- C13 H9 Cl2 N O -","- C13 H9 Cl2 N O -","- C52 H36 Cl8 N4 O4 -","4","1","BT2417","B. Thimme Gowda; B. P. Sowmya; Miroslav Tokarčík; Jozef Kožíšek; Hartmut Fuess","<i>N</i>-(3,4-Dichlorophenyl)benzamide","Acta Crystallographica Section E","2007","63","8","o3365","o3365","10.1107/S1600536807031571","","","0.71073","MoKα","","0.0485","0.0329","","","0.0804","0.0932","","","","","","1.073","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214540","8.039","0.0005","11.7619","0.0007","11.8796","0.0008","109.029","0.005","103.791","0.005","102.326","0.005","978.02","0.12","296","","296","","","","","","","","","5","P -1","-P 1","2","","1,1,3-Trioxo-2,3-dihydro-1,2-benzisothiazol-2-ylmethyl 4-phenylpiperazine-1-carbodithioate","","- C19 H19 N3 O3 S3 -","- C19 H19 N3 O3 S3 -","- C38 H38 N6 O6 S6 -","2","1","BT2418","Mehmet Akkurt; Şerife Pınar Yalçın; Özlen Güzel; Aydın Salman; Orhan Büyükgüngör","1,1,3-Trioxo-2,3-dihydro-1,2-benzisothiazol-2-ylmethyl 4-phenylpiperazine-1-carbodithioate","Acta Crystallographica Section E","2007","63","8","o3383","o3383","10.1107/S1600536807031595","","","0.71073","MoKα","","0.0331","0.0291","","","0.074","0.0764","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214541","11.7563","0.0004","16.3925","0.0005","19.7019","0.0007","90","","90","","90","","3796.9","0.2","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Poly[(μ~2~-1,3-di-4-pyridylpropane-κ^2^N:N')(μ~2~-terephthalato- κ^2^O:O')zinc(II)]","","- C21 H18 N2 O4 Zn -","- C21 H18 N2 O4 Zn -","- C168 H144 N16 O32 Zn8 -","8","1","BT2419","E. Yang; Xu-Chun Song; You-Dan Lin; Shuang-Zhen Shen","Poly[(μ~2~-1,3-di-4-pyridylpropane-κ^2^<i>N</i>:<i>N</i>')(μ~2~-terephthalato-κ^2^<i>O</i>:<i>O</i>')zinc(II)]","Acta Crystallographica Section E","2007","63","8","m2067","m2067","10.1107/S1600536807031625","","","0.71073","MoKα","","","0.0356","","","0.0891","0.0955","","","","","","0.937","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214542","14.306","0.002","8.625","0.002","18.317","0.004","90","","90","","90","","2260.1","0.8","299","2","299","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2,2,2-Trichloro-<i>N</i>-(2,4-dichlorophenyl)acetamide","","- C8 H4 Cl5 N O -","- C8 H4 Cl5 N O -","- C64 H32 Cl40 N8 O8 -","8","1","BT2420","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","2,2,2-Trichloro-<i>N</i>-(2,4-dichlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","8","o3391","o3391","10.1107/S160053680703187X","","","1.5418","CuKα","","0.0606","0.0554","","","0.1497","0.1556","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214543","20.2386","0.0005","15.1259","0.0006","25.6234","0.001","90","","90","","90","","7844","0.5","108","2","108","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","Bis(μ-diethyldithiocarbamato)bis[(η^5^- pentamethylcyclopentadienyl)iridium(III)] bis(perchlorate)","","- C30 H50 Cl2 Ir2 N2 O8 S4 -","- C30 H50 Cl2 Ir2 N2 O8 S4 -","- C240 H400 Cl16 Ir16 N16 O64 S32 -","8","1","BT2421","Michael Scharwitz; Iris M. Oppel; William S. Sheldrick","Bis(μ-diethyldithiocarbamato)bis[(η^5^-pentamethylcyclopentadienyl)iridium(III)] bis(perchlorate)","Acta Crystallographica Section E","2007","63","8","m2065","m2066","10.1107/S1600536807031868","","","0.71073","MoKα","","0.0425","0.0266","","","0.0581","0.0621","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214544","9.7163","0.0007","12.8528","0.0009","6.5282","0.0006","90","","90","","90","","815.25","0.11","299","2","299","2","","","","","","","","5","P n a 21","P 2c -2n","33","4-Chloroacetanilide","<i>N</i>-(4-Chlorophenyl)acetamide","","- C8 H8 Cl N O -","- C8 H8 Cl N O -","- C32 H32 Cl4 N4 O4 -","4","1","BT2422","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(4-Chlorophenyl)acetamide: a redetermination","Acta Crystallographica Section E","2007","63","8","o3392","o3392","10.1107/S1600536807031893","","","1.5418","CuKα","","0.0358","0.0302","","","0.0795","0.0836","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214545","11.7293","0.0014","7.0854","0.0008","17.169","0.002","90","","93.841","0.01","90","","1423.7","0.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Hexaaquazinc(II) D-camphor-10-sulfonate","","- C20 H42 O14 S2 Zn -","- C20 H42 O14 S2 Zn -","- C40 H84 O28 S4 Zn2 -","2","1","BT2423","Schepke, Manuela; Edelmann, Frank T.; Blaurock, Steffen","Hexaaquazinc(II) <small>D</small>-camphor-10-sulfonate","Acta Crystallographica Section E","2007","63","8","m2071","m2071","10.1107/S1600536807031984","","","0.71073","MoKα","","0.0454","0.0339","","","0.0834","0.0871","","","","","","0.972","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214546","14.1439","0.0003","16.606","0.0003","25.8952","0.0006","90","","90","","90","","6082.1","0.2","200","2","200","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","[<it>N</it>-(2-Aminoethyl)-<it>N</it>-(2-{(<it>E</it>)-[9-(diethoxymethyl)-\ 1,10-phenanthrolin-2-yl]methylideneamino}ethyl)ethane-1,2-diamine]copper(II) bis(perchlorate)","","- C24 H34 Cl2 Cu N6 O10 -","- C24 H34 Cl2 Cu N6 O10 -","- C192 H272 Cl16 Cu8 N48 O80 -","8","1","BT2424","Keypour, Hassan; Goudarziafshar, Hamid; Brisdon, Alan K.; Pritchard, Robin G.","[<i>N</i>-(2-Aminoethyl)-<i>N</i>-(2-{(<i>E</i>)-[9-(diethoxymethyl)-1,10-phenanthrolin-2-yl]methylideneamino}ethyl)ethane-1,2-diamine]copper(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","8","m2158","m2159","10.1107/S1600536807032953","","","0.71073","MoKα","","0.1381","0.0742","","","0.1988","0.2555","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214547","18.1816","0.0009","12.4844","0.0007","16.1923","0.0008","90","","109.246","0.011","90","","3470","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[aqua-μ-cyanido-tetrakis(ethylenediamine)dicopper(II)] [nona-μ-cyanido-dizincate(II)dicuprate(I)]]","","- C18 H32 Cu4 N18 O Zn2 -","- C18 H32 Cu4 N18 O Zn2 -","- C72 H128 Cu16 N72 O4 Zn8 -","4","1","BT2425","G. Indramahalakshmi; A. Thamaraichelvan; R. Gandhidasan; S. Athimoolam; S. Natarajan","Poly[[aqua-μ-cyanido-tetrakis(ethylenediamine)dicopper(II)] [nona-μ-cyanido-dizincate(II)dicuprate(I)]]","Acta Crystallographica Section E","2007","63","8","m2160","m2160","10.1107/S1600536807032175","","","0.71073","MoKα","","0.0864","0.0371","","","0.084","0.1005","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214548","7.3437","0.0015","10.85","0.002","15.971","0.003","90","","97.88","0.004","90","","1260.5","0.4","130","2","130","2","","","","","","","","5","P 1 21 1","P 2yb","4","4-chloroaniliniun hydrogen L-(+)-tartrate monohydrate","4-chloroanilinium hydrogen (2R,3R)-tartrate monohydrate","","- C10 H14 Cl N O7 -","- C10 H14 Cl N O7 -","- C40 H56 Cl4 N4 O28 -","4","2","BT2426","Graham Smith; Urs D. Wermuth; Jonathan M. White","4-Chloroanilinium hydrogen (2<i>R</i>,3<i>R</i>)-tartrate monohydrate","Acta Crystallographica Section E","2007","63","8","o3432","o3433","10.1107/S1600536807032473","","","0.71073","MoKα","","0.0889","0.0759","","","0.1897","0.1971","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214549","9.0116","0.0014","11.8073","0.0018","13.697","0.002","86.43","0.012","85.395","0.013","78.849","0.011","1423.6","0.4","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","N-(5-Bromo-2-iodophenyl)-N-methylcyclopentanecarboxamide","","- C13 H15 Br I N O -","- C13 H15 Br I N O -","- C52 H60 Br4 I4 N4 O4 -","4","2","BT2427","Slawin, Alexandra M. Z.; Nicoll, Sarah L.; Storey, John M. D.; Harrison, William T. A.","<i>N</i>-(5-Bromo-2-iodophenyl)-<i>N</i>-methylcyclopentanecarboxamide","Acta Crystallographica Section E","2007","63","8","o3407","o3407","10.1107/S1600536807032370","","","0.71073","MoKα","","0.043","0.0392","","","0.0979","0.1021","","","","","","1.024","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214550","11.9008","0.0013","15.0138","0.0017","10.8886","0.0013","90","","102.867","0.003","90","","1896.7","0.4","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-[(2-Hydroxy-1-naphthyl)(piperidin-1-yl)methyl]benzonitrile","","- C23 H22 N2 O -","- C23 H22 N2 O -","- C92 H88 N8 O4 -","4","1","BT2428","Qu, Zhi-Rong","3-[(2-Hydroxy-1-naphthyl)(piperidin-1-yl)methyl]benzonitrile","Acta Crystallographica Section E","2007","63","8","o3429","o3429","10.1107/S160053680703259X","","","0.71073","MoKα","","0.0862","0.0501","","","0.0929","0.0995","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214551","19.592","0.004","9.2077","0.0017","19.767","0.004","90","","90.03","0.01","90","","3565.9","1.2","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Di-μ-oxido-bis{[1,3-bis(tetramethylguanidino)propane- κ^2^<i>N</i>,<i>N</i>']bromidomanganese(III)}","","- C26 H60 Br2 Mn2 N12 O2 -","- C26 H60 Br2 Mn2 N12 O2 -","- C104 H240 Br8 Mn8 N48 O8 -","4","0.5","BT2430","Neuba, Adam; Seewald, Oliver; Flörke, Ulrich; Henkel, Gerald","Di-μ-oxido-bis{[1,3-bis(tetramethylguanidino)propane-κ^2^<i>N</i>,<i>N</i>']bromidomanganese(III)}","Acta Crystallographica Section E","2007","63","8","m2099","m2100","10.1107/S1600536807032801","","","0.71073","MoKα","","0.0458","0.0372","","","0.0937","0.0977","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214552","8.2794","0.0012","10.1065","0.0014","13.7018","0.0019","90","","104.333","0.003","90","","1110.8","0.3","120","2","120","2","","","","","","","","4","P 1 c 1","P -2yc","7","","N,N'-Bis(1,3-dimethylimidazolidin-2-ylidene)-2,2'-dithiodianiline","","- C22 H28 N6 S2 -","- C22 H28 N6 S2 -","- C44 H56 N12 S4 -","2","1","BT2431","Neuba, Adam; Flörke, Ulrich; Henkel, Gerald","<i>N</i>,<i>N</i>'-Bis(1,3-dimethylimidazolidin-2-ylidene)-2,2'-dithiodianiline","Acta Crystallographica Section E","2007","63","8","o3476","o3477","10.1107/S1600536807033405","","","0.71073","MoKα","","0.0359","0.0347","","","0.0874","0.0883","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214553","8.4061","0.0008","11.2568","0.0005","16.4145","0.0016","90","","98.988","0.008","90","","1534.2","0.2","200","","200","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-(2-{[(1E)-1-(2-Hydroxyphenyl)ethylidene]amino}phenyl)-2-methoxyacetamide","","- C17 H18 N2 O3 -","- C17 H18 N2 O3 -","- C68 H72 N8 O12 -","4","1","BT2432","Sema Öztürk Yıldırım; Mehmet Akkurt; Ali Asghar Jarrahpour; Shadab Rezaei; Frank W. Heinemann","<i>N</i>-(2-{[(1<i>E</i>)-1-(2-Hydroxyphenyl)ethylidene]amino}phenyl)-2-methoxyacetamide","Acta Crystallographica Section E","2007","63","8","o3478","o3479","10.1107/S1600536807033673","","","0.71073","MoKα","","0.0676","0.041","","","0.0869","0.0985","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214554","11.7228","0.0008","13.6606","0.0008","8.6194","0.0011","90","","104.366","0.01","90","","1337.2","0.2","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-Fluorophenyl)-1-(4-pyridyl)cyclopentan-1-ol","","- C16 H16 F N O -","- C16 H16 F N O -","- C64 H64 F4 N4 O4 -","4","1","BT2433","Abu Thaher, Bassam; Schollmeyer, Dieter; Laufer, Stefan","2-(4-Fluorophenyl)-1-(4-pyridyl)cyclopentan-1-ol","Acta Crystallographica Section E","2007","63","8","o3531","o3531","10.1107/S1600536807034034","","","1.54178","CuKα","","0.2328","0.1255","","","0.3055","0.3608","","","","","","1.279","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214555","16.975","0.002","5.2277","0.0006","12.9176","0.0014","90","","90","","90","","1146.3","0.2","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Methylenebis(phosphonic difluoride)","","- C H2 F4 O2 P2 -","- C H2 F4 O2 P2 -","- C8 H16 F32 O16 P16 -","8","2","BT2436","Blaurock, Steffen; Fischer, Axel; Schmutzler, Reinhard; Edelmann, Frank T.","Methylenebis(phosphonic difluoride)","Acta Crystallographica Section E","2007","63","8","o3496","o3496","10.1107/S1600536807034046","","","0.71073","MoKα","","0.0313","0.028","","","0.0736","0.0755","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214556","19.5677","0.0007","6.8591","0.0003","29.3903","0.0011","90","","109.131","0.002","90","","3726.8","0.3","100","0.1","100","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","N,N'-Bis(2-hydroxy-3-methoxybenzylidene)1,3-diaminobenzene","6,6'-Dimethoxy-2,2'-[m-phenylenebis(nitrilomethylidyne)]diphenol","","- C22 H20 N2 O4 -","- C22 H20 N2 O4 -","- C176 H160 N16 O32 -","8","1","BT2439","Mohammed H. Al-Douh; Shafida A. Hamid; Hasnah Osman; Shea-Lin Ng; Hoong-Kun Fun","6,6'-Dimethoxy-2,2'-[<i>m</i>-phenylenebis(nitrilomethylidyne)]diphenol","Acta Crystallographica Section E","2007","63","8","o3570","o3571","10.1107/S1600536807034812","","","0.71073","MoKα","","0.0779","0.0483","","","0.1349","0.1587","","","","","","1.068","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214557","8.1684","0.0003","9.4962","0.0004","23.0376","0.0009","90","","94.147","0.001","90","","1782.32","0.12","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-bromomethyl-1-phenylsulfonyl-1H-indole-3-carboxylate","","- C18 H16 Br N O4 S -","- C18 H16 Br N O4 S -","- C72 H64 Br4 N4 O16 S4 -","4","1","BT2442","G. Chakkaravarthi; N. Ramesh; A. K. Mohanakrishnan; V. Manivannan","Ethyl 2-bromomethyl-1-phenylsulfonyl-1<i>H</i>-indole-3-carboxylate","Acta Crystallographica Section E","2007","63","8","o3564","o3564","10.1107/S1600536807034800","","","0.71073","MoKα","","0.0884","0.0397","","","0.0973","0.1147","","","","","","1.004","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214558","6.298","0.0008","7.152","0.0008","23.508","0.003","90","","90","","90","","1058.9","0.2","200","3","200","3","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","5,7,13,14-Tetraoxatrispiro[2.2.2.2^9^.2^6^.2^3^]pentadecane","","- C11 H16 O4 -","- C11 H16 O4 -","- C44 H64 O16 -","4","1","BT2444","Betz, Richard; Klüfers, Peter; Reichvilser, Moritz M.","5,7,13,14-Tetraoxatrispiro[2.2.2.2^9^.2^6^.2^3^]pentadecane","Acta Crystallographica Section E","2007","63","8","o3558","o3558","10.1107/S1600536807034915","","","0.71073","MoKα","","0.0521","0.0414","","","0.0927","0.0983","","","","","","1.075","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214559","6.5835","0.0001","11.8399","0.0002","29.0173","0.0004","90","","97.317","0.001","90","","2243.42","0.06","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[triphenyltin(IV)]-μ-2,4-dinitrobenzoato]","","- C25 H18 N2 O6 Sn -","- C25 H18 N2 O6 Sn -","- C100 H72 N8 O24 Sn4 -","4","1","BT2448","Yip Foo Win; Siang-Guan Teoh; Shea-Lin Ng; Hoong-Kun Fun; Syahida Ahmad","<i>catena</i>-Poly[[triphenyltin(IV)]-μ-2,4-dinitrobenzoato]","Acta Crystallographica Section E","2007","63","8","m2220","m2221","10.1107/S1600536807035556","","","0.71073","MoKα","","0.0557","0.0378","","","0.0914","0.1197","","","","","","1.099","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214560","17.146","0.003","10.123","0.002","17.408","0.004","90","","119.2","0.03","90","","2637.5","1.2","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-[3,5-Bis(5,6-dihydro-4<i>H</i>-1,3-thiazin-2-ylsulfanylmethyl)-2,4,6- trimethylbenzylsulfanyl]-5,6-dihydro-4<i>H</i>-1,3-thiazine","","- C24 H33 N3 S6 -","- C24 H33 N3 S6 -","- C96 H132 N12 S24 -","4","1","BV2058","Wei Wang; Bing Zhao; Dong Liang; Yu-Lai Feng; Xiao-Yu Fan","2-[3,5-Bis(5,6-dihydro-4<i>H</i>-1,3-thiazin-2-ylsulfanylmethyl)-2,4,6-trimethylbenzylsulfanyl]-5,6-dihydro-4<i>H</i>-1,3-thiazine","Acta Crystallographica Section E","2007","63","8","o3370","o3370","10.1107/S1600536807029157","","","0.71073","MoKα","","0.0687","0.0554","","","0.1305","0.139","","","","","","1.077","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214561","8.7674","0.001","16.1703","0.0018","18.224","0.002","90","","90","","90","","2583.6","0.5","173","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(<i>R</i>)-Methyl 2-(furan-2-carboxamido)-4-methylpentanoate","","- C12 H17 N O4 -","- C12 H17 N O4 -","- C96 H136 N8 O32 -","8","2","BX2093","Xiao-Jian Liao; Wen-Jie Xu; Shi-Hai Xu; Po-Run Liu","(<i>R</i>)-Methyl 2-(furan-2-carboxamido)-4-methylpentanoate","Acta Crystallographica Section E","2007","63","8","o3644","o3644","10.1107/S1600536807036410","","","0.71073","MoKα","","0.0612","0.0494","","","0.1242","0.1336","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214562","4.7749","0.001","10.253","0.002","22.183","0.004","90","","95.514","0.004","90","","1081","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N'-(4-Bromobenzylidene)propanohydrazide","","- C10 H11 Br N2 O -","- C10 H11 Br N2 O -","- C40 H44 Br4 N8 O4 -","4","1","BX2094","Huan-Mei Guo","<i>N</i>'-(4-Bromobenzylidene)propanohydrazide","Acta Crystallographica Section E","2007","63","8","o3461","o3461","10.1107/S1600536807032989","","","0.71073","MoKα","","0.0594","0.0323","","","0.0728","0.0866","","","","","","0.996","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214563","5.41","0.004","7.52","0.006","13.18","0.008","90","","90","","90","","536.2","0.7","240","2","240","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","glutaric anhydride","Oxacyclohexane-2,6-dione","","- C5 H6 O3 -","- C5 H6 O3 -","- C20 H24 O12 -","4","1","BX2098","Stefanowicz, Piotr; Jaremko, Mariusz; Jaremko, Łukasz; Lis, Tadeusz","Oxacyclohexane-2,6-dione (glutaric anhydride)","Acta Crystallographica Section E","2007","63","8","o3431","o3431","10.1107/S1600536807032977","","","0.71073","MoKα","","0.0486","0.0412","","","0.1122","0.1157","","","","","","1.138","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214564","8.3985","0.0009","6.873","0.0007","19.637","0.002","90","","90.781","0.002","90","","1133.4","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[aquazinc(II)]-μ-<i>N</i>-(3-carboxy-2- oxidobenzylidene)glycinato-κ^4^<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>''] monohydrate]","","- C10 H11 N O7 Zn -","- C10 H11 N O7 Zn -","- C40 H44 N4 O28 Zn4 -","4","1","BX2099","Wu, Zhi-Hong; Zhou, Ying-Hua; Cai, Jin-Hua","<i>catena</i>-Poly[[[aquazinc(II)]-μ-<i>N</i>-(3-carboxy-2-oxidobenzylidene)glycinato-κ^4^<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>''] monohydrate]","Acta Crystallographica Section E","2007","63","8","m2223","m2224","10.1107/S1600536807035647","","","0.71073","MoKα","","0.0302","0.0256","","","0.0746","0.0778","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214565","24.5015","0.0016","10.3868","0.0007","28.855","0.0018","90","","113.127","0.001","90","","6753.2","0.8","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[μ-2-hydroxy-N'-(4-hydroxy-2- oxidobenzylidene)benzohydrazide]bis[pyridinezinc(II)] dimethylformamide disolvate","","- C44 H44 N8 O10 Zn2 -","- C44 H44 N8 O10 Zn2 -","- C264 H264 N48 O60 Zn12 -","6","1.5","CF2107","Jin-Shang Huang; Ming-Tian Li","Bis[μ-2-hydroxy-<i>N</i>'-(4-hydroxy-2-oxidobenzylidene)benzohydrazide]bis[pyridinezinc(II)] dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","8","m2170","m2171","10.1107/S1600536807024944","","","0.71073","MoKα","","0.0862","0.0482","","","0.1111","0.1298","","","","","","1.008","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214566","7.8086","0.0016","16.342","0.003","18.316","0.004","90","","90","","90","","2337.3","0.8","153","2","153","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Potassium (4-carboxypyridine-2,6-dicarboxylato)dioxidovanadate(V) monohydrate","","- C8 H5 K N O9 V -","- C8 H5 K N O9 V -","- C64 H40 K8 N8 O72 V8 -","8","1","CF2108","Holder, Alvin A.; VanDerveer, Don","Potassium (4-carboxypyridine-2,6-dicarboxylato)dioxidovanadate(V) monohydrate","Acta Crystallographica Section E","2007","63","8","m2051","m2052","10.1107/S1600536807031418","","","0.7107","MoKα","","0.0346","0.0323","","","0.0771","0.0788","","","","","","1.152","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214567","8.271","0.001","13.067","0.002","22.207","0.002","90","","90.14","0.002","90","","2400.1","0.5","298","2","298","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Poly[[bis(18-crown-6)bis(μ~3~-1,1-dicyanoethylene-2,2-\ dithiolato)dipotassium(I)nickelate(II)] 1,2-dichloroethane solvate]","","- C34 H52 Cl2 K2 N4 Ni O12 S4 -","- C34 H52 Cl2 K2 N4 Ni O12 S4 -","- C68 H104 Cl4 K4 N8 Ni2 O24 S8 -","2","0.5","CF2109","Shi-Zhou Fu; Da-Qi Wang; Jian-Ming Dou","Poly[[bis(18-crown-6)bis(μ~3~-1,1-dicyanoethylene-2,2-dithiolato)dipotassium(I)nickelate(II)] 1,2-dichloroethane solvate]","Acta Crystallographica Section E","2007","63","8","m2167","m2167","10.1107/S1600536807033284","","","0.71073","MoKα","","0.0892","0.0435","","","0.0911","0.1279","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214568","5.721","0.002","12.919","0.003","13.955","0.004","90","","96.61","0.04","90","","1024.6","0.5","160","2","160","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","ATEMPO","4-amino-2,2,6,6-tetramethylpiperidine 1-oxyl","","- C9 H19 N2 O -","- C9 H19 N2 O -","- C36 H76 N8 O4 -","4","1","CF2110","Legros, Jean-Pierre; De Caro, Dominique; Casellas, Hélène","4-Amino-2,2,6,6-tetramethylpiperidin-1-oxyl radical (ATEMPO)","Acta Crystallographica Section E","2007","63","8","o3414","o3414","10.1107/S1600536807032898","","","0.71073","MoKα","","0.051","0.0397","","","0.0954","0.1013","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214569","8.878","0.0011","9.0141","0.0011","9.5576","0.0012","90","","116.989","0.002","90","","681.57","0.15","292","2","292","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Diaquasilver(I) 6-aminonaphthalene-1-sulfonate monohydrate","","- C10 H14 Ag N O6 S -","- C10 H14 Ag N O6 S -","- C20 H28 Ag2 N2 O12 S2 -","2","1","CF2112","Li, Yu-Jie; Dong, Xian-Wu; Wu, Hua","Diaquasilver(I) 6-aminonaphthalene-1-sulfonate monohydrate","Acta Crystallographica Section E","2007","63","8","m2230","m2230","10.1107/S1600536807036495","","","0.71073","MoKα","","0.0447","0.0331","","","0.0891","0.1405","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214570","10.857","0.002","11.274","0.002","11.978","0.002","90","","90.777","0.004","90","","1466","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(3-Methylsulfanyl-5-phenyl-1-benzofuran-2-yl)acetic acid","","- C17 H14 O3 S -","- C17 H14 O3 S -","- C68 H56 O12 S4 -","4","1","CF2113","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","2-(3-Methylsulfanyl-5-phenyl-1-benzofuran-2-yl)acetic acid","Acta Crystallographica Section E","2007","63","8","o3468","o3468","10.1107/S1600536807033326","","","0.71073","MoKα","","0.1003","0.0599","","","0.1322","0.1524","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214571","8.6247","0.0013","16.777","0.003","22.95","0.004","90","","90","","90","","3320.8","1","297","2","297","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","6,6-Dibenzyltetrazolo[1,5-<i>a</i>]pyrimidine-5,7(4<i>H</i>,6<i>H</i>)-dione","","- C18 H15 N5 O2 -","- C18 H15 N5 O2 -","- C144 H120 N40 O16 -","8","1","CF2114","Baruah, Pranjal K.; Gonnade, Rajesh G.; Sanjayan, Gangadhar J.","6,6-Dibenzyltetrazolo[1,5-<i>a</i>]pyrimidine-5,7(4<i>H</i>,6<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","8","o3550","o3550","10.1107/S1600536807034162","","","0.71073","MoKα","","0.1005","0.0515","","","0.1041","0.1217","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214572","6.277","0.002","9.6631","0.001","8.6724","0.001","90","","99.7833","0.0018","90","","518.38","0.18","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[chlorido(μ~3~-1,2,4-triazolato)manganese(II)]","","- C2 H2 Cl Mn N3 -","- C2 H2 Cl Mn N3 -","- C8 H8 Cl4 Mn4 N12 -","4","1","CF2116","Gao, Yuxiang; Wang, Libin; Hao, Xiangrong","Poly[chlorido(μ~3~-1,2,4-triazolato)manganese(II)]","Acta Crystallographica Section E","2007","63","8","m2142","m2142","10.1107/S1600536807032886","","","0.71073","MoKα","","0.0352","0.0337","","","0.1437","0.1471","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214573","30.4738","0.0014","8.8963","0.0004","6.915","0.0003","90","","90","","90","","1874.68","0.15","180","2","180","2","","","","","","","","4","P c a 21","P 2c -2ac","29","CETTM-TTF","2,3-Bis(2-cyanoethylsulfanyl)-6,7-tetramethylenetetrathiafulvalene","","- C16 H16 N2 S6 -","- C16 H16 N2 S6 -","- C64 H64 N8 S24 -","4","1","CF2117","Legros, Jean-Pierre; Fabre, Jean-Marc; Kaboub, Lakhemici","2,3-Bis(2-cyanoethylsulfanyl)-6,7-tetramethylenetetrathiafulvalene","Acta Crystallographica Section E","2007","63","8","o3572","o3572","10.1107/S1600536807034873","","","0.71073","MoKα","","0.0317","0.0259","","","0.0498","0.0511","","","","","","0.963","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214574","6.1679","0.0012","11.1657","0.0018","32.64","0.004","90","","91.708","0.002","90","","2246.9","0.6","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-Phenylindolizine-3-carbaldehyde (4-phenylthiazol-2-yl)hydrazone hydrobromide monohydrate","","- C24 H21 Br N4 O S -","- C24 H21 Br N4 O S -","- C96 H84 Br4 N16 O4 S4 -","4","1","CF2118","Liu, Wei-Wei; Wang, Ling; Tang, Li-Juan; Cao, Wei; Hu, Hong-Wen","2-Phenylindolizine-3-carbaldehyde (4-phenylthiazol-2-yl)hydrazone hydrobromide monohydrate","Acta Crystallographica Section E","2007","63","8","o3518","o3518","10.1107/S1600536807034149","","","0.71073","MoKα","","0.0949","0.0661","","","0.1431","0.1554","","","","","","1.097","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214575","7.404","0.002","9.212","0.003","9.757","0.003","110.111","0.004","90.209","0.004","96.484","0.004","620.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-Nitrophenylpiperazinium chloride monohydrate","","- C10 H16 Cl N3 O3 -","- C10 H16 Cl N3 O3 -","- C20 H32 Cl2 N6 O6 -","2","1","CF2123","Yin-Xiang Lu","4-Nitrophenylpiperazinium chloride monohydrate","Acta Crystallographica Section E","2007","63","8","o3611","o3611","10.1107/S1600536807034666","","","0.71073","MoKα","","0.047","0.0417","","","0.1152","0.1201","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214576","10.8424","0.0002","14.3465","0.0003","11.1929","0.0002","90","","108.741","0.001","90","","1648.75","0.06","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","κO)copper(II)]]-di-μ-terephthalato-κ^4^O^1^:O^4^]","","- C32 H34 Cu2 N4 O12 -","- C32 H34 Cu2 N4 O12 -","- C64 H68 Cu4 N8 O24 -","2","0.5","CF2124","Xu, Ji-Yang; Chen, Bang-Lin; Ng, Seik Weng","<i>catena</i>-Poly[[(μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>')bis[aqua(dimethylformamide-κ<i>O</i>)copper(II)]]-di-μ-terephthalato-κ^4^<i>O</i>^1^:<i>O</i>^4^]","Acta Crystallographica Section E","2007","63","8","m2200","m2200","10.1107/S1600536807035040","","","0.71073","MoKα","","0.0598","0.0333","","","0.08","0.0863","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214577","13.8732","0.0012","13.576","0.0011","16.2034","0.0014","90","","113.515","0.002","90","","2798.4","0.4","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Diethyl {2-[(4-chlorophenoxy)methyl]-9-(methylsulfanyl)-7H-pyrazolo[4,3- d][1,2,4]triazolo[1,5-d]pyrimidin-7-yl}(phenyl)methylphosphonate","","- C25 H26 Cl N6 O4 P S -","- C25 H26 Cl N6 O4 P S -","- C100 H104 Cl4 N24 O16 P4 S4 -","4","1","CF2126","Lin-Xia Xiao; De-Qing Shi","Diethyl {2-[(4-chlorophenoxy)methyl]-9-(methylsulfanyl)-7<i>H</i>-pyrazolo[4,3-<i>d</i>][1,2,4]-triazolo[1,5-<i>d</i>]pyrimidin-7-yl}(phenyl)methylphosphonate","Acta Crystallographica Section E","2007","63","8","o3613","o3613","10.1107/S1600536807035532","","","0.71073","MoKα","","0.0948","0.0591","","","0.1364","0.1502","","","","","","0.935","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214578","14.432","0.0002","14.3157","0.0003","19.5504","0.0003","90","","103.017","0.0009","90","","3935.41","0.12","150","","150","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","<i>trans</i>-Bromido[4,5-difluoro-2-(trifluoromethylsulfonyloxy)phenyl- κ<i>C</i>^1^)bis(triphenylphosphine-κ<i>P</i>)palladium(II)","","- C43 H32 Br F5 O3 P2 Pd S -","- C43 H32 Br F5 O3 P2 Pd S -","- C172 H128 Br4 F20 O12 P8 Pd4 S4 -","4","1","CI2391","Espino, Gustavo; Brown, John M.; Cowley, Andrew R.","<i>trans</i>-Bromido[4,5-difluoro-2-(trifluoromethylsulfonyloxy)phenyl-κ<i>C</i>^1^]bis(triphenylphosphine-κ<i>P</i>)palladium(II)","Acta Crystallographica Section E","2007","63","8","m2047","m2048","10.1107/S1600536807031492","","","0.71073","MoKα","","0.058","0.0301","","0.0534","0.0317","0.0317","","","","","","1.0945","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214579","8.1456","0.001","10.936","0.002","13.6897","0.0012","77.81","0.02","78.17","0.017","74.319","0.013","1133.4","0.3","290","2","290","2","","","","","","","","4","P -1","-P 1","2","1,2,3,4-Tetrahydroisoquinolinium hydrogensquarate","1,2,3,4-tetrahydroisoquinolinium 2-hydroxy-3,4-dioxocyclobut-1-en-1-olate","","- C13 H13 N O4 -","- C13 H13 N O4 -","- C52 H52 N4 O16 -","4","2","CI2392","Tsonko Kolev; Boris Shivachev; Rosica Petrova; Iliyan Ivanov; Stoyanka Atanasova; Stela Statkova","1,2,3,4-Tetrahydroisoquinolinium hydrogensquarate","Acta Crystallographica Section E","2007","63","8","o3353","o3354","10.1107/S1600536807030802","","","0.71073","MoKα","","0.0938","0.0667","","","0.2063","0.2338","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214580","9.8018","0.0004","19.4213","0.0008","10.1979","0.0004","90","","116.19","0.001","90","","1742.01","0.12","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","bis(DL-valinium) pentafluorooxoniobate(V)","(R)-1-carboxy-2-methylpropan-1-aminium (S)-1-carboxy-2-methylpropan-1-aminium pentafluoridooxidoniobate(V)","","- C10 H24 F5 N2 Nb O5 -","- C10 H24 F5 N2 Nb O5 -","- C40 H96 F20 N8 Nb4 O20 -","4","1","CI2394","Pushilin, M. A.; Gerasimenko, A. V.; Davidovich, R. L.","Bis(<small>DL</small>-valinium) pentafluoridooxidoniobate(V)","Acta Crystallographica Section E","2007","63","8","m2086","m2086","10.1107/S1600536807028346","","","0.71073","MoKα","","0.0373","0.0298","","","0.0739","0.0779","","","","","","1.079","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214581","5.7285","0.0003","27.982","0.0012","10.7301","0.0005","90","","105.816","0.003","90","","1654.87","0.14","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,5,6,7-Tetrachloro-3-(cyclohepta-1,3,6-trien-1-yl)-3-hydroxy-2- (2-hydroxyethyl)-2,3-dihydro-1<i>H</i>-isoindol-1-one","","- C17 H13 Cl4 N O3 -","- C17 H13 Cl4 N O3 -","- C68 H52 Cl16 N4 O12 -","4","1","CI2402","Hoong-Kun Fun; Jeannie Bee-Jan Teh; Yong-Miao Shen; Jian-Hua Xu","4,5,6,7-Tetrachloro-3-(cyclohepta-1,3,6-trien-1-yl)-3-hydroxy-2-(2-hydroxyethyl)-2,3-dihydro-1<i>H</i>-isoindol-1-one","Acta Crystallographica Section E","2007","63","8","o3385","o3385","10.1107/S1600536807031509","","","0.71073","MoKα","","0.0594","0.0467","","","0.1177","0.1299","","","","","","1.119","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214582","9.1795","0.0005","20.407","0.001","15.7058","0.0009","90","","93.126","0.001","90","","2937.7","0.3","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[μ~2~-N,N'-Bis(2-oxy-3-ethoxybenzylidene)ethylene-1,2-diamine] (methanol)tris(nitrato)copper(II)lutetium(III)","","- C22 H28 Cu Lu N5 O14 -","- C22 H28 Cu Lu N5 O14 -","- C88 H112 Cu4 Lu4 N20 O56 -","4","1","CI2404","Sui, Yan; Hu, Rong-Hua; Peng, Jia-Long; Ng, Seik Weng","[μ~2~-<i>N</i>,<i>N</i>'-Bis(2-oxy-3-ethoxybenzylidene)propane-1,2-diamine](methanol)trinitratocopper(II)lutetium(III)","Acta Crystallographica Section E","2007","63","8","m2120","m2121","10.1107/S1600536807032916","","","0.71073","MoKα","","0.1049","0.059","","","0.1817","0.1962","","","","","","1.072","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214583","9.2004","0.0004","20.5069","0.0008","15.6901","0.0006","90","","93.111","0.001","90","","2955.9","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","({6,6'-diethoxy-2,2'-[propane-1,2-diylbis(nitrilomethylidyne)]diphenolato- 1κ^4^<i>O</i>^1^,<i>O</i>^1'^,<i>O</i>^6^,<i>O</i>^6'^:2κ^4^<i>O</i>^1^, <i>N</i>,<i>N</i>',<i>O</i>^1'^}(methanol-2κO)trinitrato- 1κ^6^<i>O</i>,<i>O</i>'-copper(II)neodymium(III))","","- C22 H28 Cu N5 Nd O14 -","- C22 H28 Cu N5 Nd O14 -","- C88 H112 Cu4 N20 Nd4 O56 -","4","1","CI2405","Sui, Yan; Hu, Rong-Hua; Peng, Jia-Long; Ng, Seik Weng","[<i>{μ</i>}-<i>N</i>,<i>N</i>'-Bis(3-ethoxy-2-oxidobenzylidene)propane-1,2-diamine](methanol)trinitratocopper(II)neodymium(III)","Acta Crystallographica Section E","2007","63","8","m2122","m2122","10.1107/S1600536807033247","","","0.71073","MoKα","","0.0657","0.0523","","","0.1493","0.1535","","","","","","1.135","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214584","8.9474","0.0016","9.0853","0.0017","10.202","0.002","73.597","0.001","79.807","0.002","79.619","0.002","775.5","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-Chlorido-bis({2-[4-(dimethylamino)benzylideneamino]pyridine-κ<i>N</i>} chloridomercury(II))","","- C28 H30 Cl4 Hg2 N6 -","- C28 H30 Cl4 Hg2 N6 -","- C28 H30 Cl4 Hg2 N6 -","1","0.5","CI2406","Qiang Wang; Daqi Wang","Di-μ-chlorido-bis(chlorido{2-[4-(dimethylamino)benzylideneamino]pyridine-κ<i>N</i>}mercury(II))","Acta Crystallographica Section E","2007","63","8","m2074","m2074","10.1107/S1600536807032047","","","0.71073","MoKα","","0.0787","0.0695","","","0.1963","0.2045","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214585","8.687","0.003","21.863","0.009","10.904","0.004","90","","95.482","0.007","90","","2061.5","1.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","{1,3-Bis[3-(2-pyridyl)-1<i>H</i>-pyrazol-1-yl]propan-2-ol}silver(I) perchlorate","","- C19 H18 Ag Cl N6 O5 -","- C19 H18 Ag Cl N6 O5 -","- C76 H72 Ag4 Cl4 N24 O20 -","4","0.5","CI2407","Chun-Sen Liu; Xue-Song Shi","{1,3-Bis[3-(2-pyridyl)-1<i>H</i>-pyrazol-1-yl]propan-2-ol}silver(I) perchlorate","Acta Crystallographica Section E","2007","63","8","m2139","m2140","10.1107/S1600536807032928","","","0.71073","MoKα","","0.0681","0.0382","","","0.078","0.0884","","","","","","1.004","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214586","13.6706","0.0002","8.2336","0.0001","27.7541","0.0004","90","","90","","90","","3123.95","0.07","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Tetra-μ-acetato-bis[(benzofuro[3,2-<i>c</i>]pyridine)copper(II)]","","- C30 H26 Cu2 N2 O10 -","- C30 H26 Cu2 N2 O10 -","- C120 H104 Cu8 N8 O40 -","4","0.5","CI2409","Vrábel, Viktor; Švorc, Ľubomír; Juristová, Nadežda; Miklovič, Jozef; Kožíšek, Jozef","Tetra-μ-acetato-bis[(benzofuro[3,2-<i>c</i>]pyridine)copper(II)]","Acta Crystallographica Section E","2007","63","8","m2112","m2113","10.1107/S1600536807032242","","","0.71073","MoKα","","0.0454","0.0342","","","0.091","0.1032","","","","","","1.093","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214587","7.285","0.002","11.012","0.004","20.646","0.003","90","","90","","90","","1656.3","0.8","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1,1' sulfonyldiimidazole","","- C6 H6 N4 O2 S -","- C6 H6 N4 O2 S -","- C48 H48 N32 O16 S8 -","8","1","CI2410","Patel, Urmila H.; Patel, Bharat D.; Modh, Rajesh D.; Patel, Pinal D.","1,1'-Sulfonyldiimidazole","Acta Crystallographica Section E","2007","63","8","o3598","o3599","10.1107/S160053680703543X","","","0.71073","MoKα","","0.0591","0.0352","","","0.0741","0.0805","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214588","6.9508","0.0005","11.3074","0.0008","11.7833","0.0008","90","","105.643","0.001","90","","891.81","0.11","100","","100","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","7-Hydroxy-4-methyl-2<i>H</i>-chromen-2-one monohydrate","","- C10 H10 O4 -","- C10 H10 O4 -","- C40 H40 O16 -","4","1","CI2411","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Narayana, B.; Samshad","7-Hydroxy-4-methyl-2<i>H</i>-chromen-2-one monohydrate","Acta Crystallographica Section E","2007","63","8","o3412","o3413","10.1107/S1600536807032710","","","0.71073","MoKα","","0.0553","0.0517","","","0.1319","0.1346","","","","","","1.131","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214589","12.7918","0.0017","12.2489","0.0015","22.595","0.003","90","","90","","90","","3540.3","0.8","223","2","223","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(<i>Z</i>)-2-(2-Aminothiazol-3-ium-4-yl)-2-[2-(<i>tert</i>-butoxycarbonyl)- isopropoxyimino]acetate monohydrate","","- C13 H21 N3 O6 S -","- C13 H21 N3 O6 S -","- C104 H168 N24 O48 S8 -","8","1","CI2412","Xiang-Wei Cheng","(<i>Z</i>)-2-(2-Aminothiazol-3-ium-4-yl)-2-[2-(<i>tert</i>-butoxycarbonyl)isopropoxyimino]acetate monohydrate","Acta Crystallographica Section E","2007","63","8","o3582","o3582","10.1107/S1600536807034939","","","0.7107","MoKα","","0.0439","0.0415","","","0.0893","0.0906","","","","","","1.083","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214590","39.58","0.005","7.669","0.0015","14.868","0.003","90","","103.291","0.016","90","","4392.1","1.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Indane-1,3-dione Spiro(2,2')-4'-methoxy carbonyl 3'-(2-hydroxy-indane-1,3-dione) pyrrolizidine","Methyl 1'-(2-hydroxy-1,3-dioxoindan-2-yl)-1,3-dioxoindane-2- spiro-3'-pyrrolizidine-1-carboxylate","","- C26 H21 N O7 -","- C26 H21 N O7 -","- C208 H168 N8 O56 -","8","1","CI2413","S. Murugavel; P. Ramesh; A. SubbiahPandi; E. Ramesh; R. Raghunathan","Methyl 1'-(2-hydroxy-1,3-dioxoindan-2-yl)-1,3-dioxoindane-2-spiro-3'-pyrrolizidine-1'-carboxylate","Acta Crystallographica Section E","2007","63","8","o3610","o3610","10.1107/S160053680703560X","","","1.5418","CuKα","","0.0652","0.0495","","","0.1514","0.169","","","","","","0.988","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214591","12.9871","0.0004","20.0999","0.0005","8.7466","0.0003","90","","106.798","0.001","90","","2185.78","0.12","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Dimethyl 3,3-dimethoxy-4,4'-methylenedi-2-naphthoate","","- C27 H24 O6 -","- C27 H24 O6 -","- C108 H96 O24 -","4","1","CI2414","Rui He; En Gao; Shao-Jin Gu; Da-Bin Qin","Dimethyl 3,3-dimethoxy-4,4'-methylenedi-2-naphthoate","Acta Crystallographica Section E","2007","63","8","o3508","o3508","10.1107/S1600536807033909","","","0.71073","MoKα","","0.0384","0.0356","","","0.0964","0.0988","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214592","11.385","0.004","11.686","0.004","11.692","0.004","111.38","0.005","96.954","0.004","94.531","0.005","1425","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","2-Chloro-<i>N</i>-cyclopropyl-9-(3,4,5,6-tetrahydro-2<i>H</i>-pyran-2-yl)- 9<i>H</i>-purin-6-amine","","- C13 H16 Cl N5 O -","- C13 H16 Cl N5 O -","- C52 H64 Cl4 N20 O4 -","4","2","CI2415","Neng-Qiang Wang; Ting-Ting Mao","2-Chloro-<i>N</i>-cyclopropyl-9-(3,4,5,6-tetrahydro-2<i>H</i>-pyran-2-yl)-9<i>H</i>-purin-6-amine","Acta Crystallographica Section E","2007","63","8","o3588","o3588","10.1107/S1600536807035192","","","0.71073","MoKα","","0.0901","0.0662","","","0.1791","0.1966","","","","","","0.972","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214593","7.5285","0.0006","15.0366","0.0012","9.7202","0.0007","90","","105.704","0.009","90","","1059.28","0.15","203","","203","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,4-Diacetylquinoline","","- C13 H11 N O2 -","- C13 H11 N O2 -","- C52 H44 N4 O8 -","4","1","CI2417","Butcher, Ray J.; Jasinski, Jerry P.; Narayana, B.; Mayekar, Anil. N.; Yathirajan, H. S.","2,4-Diacetylquinoline","Acta Crystallographica Section E","2007","63","8","o3557","o3557","10.1107/S1600536807034769","","","0.71073","MoKα","","0.16","0.0487","","","0.0974","0.1144","","","","","","0.752","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214594","7.4149","0.0004","11.3162","0.0006","14.7472","0.0008","90","","104.311","0.006","90","","1199.02","0.12","203","","203","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2E)-3-(4-Fluorophenyl)-1-(3-hydroxyphenyl)prop-2-en-1-one","","- C15 H11 F O2 -","- C15 H11 F O2 -","- C60 H44 F4 O8 -","4","1","CI2418","Butcher, Ray J.; Jasinski, Jerry P.; Narayana, B.; Lakshmana, K.; Yathirajan, H. S.","(2<i>E</i>)-3-(4-Fluorophenyl)-1-(3-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","8","o3586","o3586","10.1107/S1600536807034964","","","0.71073","MoKα","","0.1053","0.0459","","","0.1113","0.1449","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214595","10.3292","0.0004","24.1165","0.0009","15.0923","0.0005","90","","109.782","0.001","90","","3537.7","0.2","203","","203","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(Quinolin-2-yl)ethanone","","- C11 H9 N O -","- C11 H9 N O -","- C176 H144 N16 O16 -","16","4","CI2423","Butcher, Ray J.; Jasinski, Jerry P.; Mayekar, Anil N.; Yathirajan, H. S.; Narayana, B.","1-(Quinolin-2-yl)ethanone","Acta Crystallographica Section E","2007","63","8","o3603","o3603","10.1107/S160053680703574X","","","0.71073","MoKα","","0.1566","0.0614","","","0.1436","0.1884","","","","","","1.007","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214596","13.0337","0.0011","7.9573","0.0006","19.9303","0.0017","90","","93.184","0.003","90","","2063.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 1'-(3-hydroxy-2-oxo-2,3-dihydro-1H-indol-3-yl)-2-oxo-2,3-dihydro-1H-indole-3-spiro-3'-pyrrolizidine-1'-carboxylate","","- C24 H23 N3 O5 -","- C24 H23 N3 O5 -","- C96 H92 N12 O20 -","4","1","CI2425","P. Ramesh; S. Murugavel; A. Subbiahpandi; E. Ramesh; R. Raghunathan","Methyl 1'-(3-hydroxy-2-oxo-2,3-dihydro-1<i>H</i>-indol-3-yl)-2-oxo-2,3-dihydro-1<i>H</i>-indole-3-spiro-3'-pyrrolizidine-1'-carboxylate","Acta Crystallographica Section E","2007","63","8","o3625","o3626","10.1107/S160053680703629X","","","0.71073","MoKα","","0.0775","0.0416","","","0.1194","0.1581","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214597","16.9856","0.0019","12.8279","0.0016","5.4455","0.0007","90","","90","","90","","1186.5","0.3","153","2","153","2","","","","","","","","4","P n a 21","P 2c -2n","33","","<i>N</i>-Phenylquinoline-2-carboxamide","","- C16 H12 N2 O -","- C16 H12 N2 O -","- C64 H48 N8 O4 -","4","1","CI2426","Lin-Hai Jing; Yi Feng; Da-Bin Qin; Huan-Xia Zhang; Shao-Jin Gu","<i>N</i>-Phenylquinoline-2-carboxamide","Acta Crystallographica Section E","2007","63","8","o3618","o3618","10.1107/S1600536807036318","","","0.71073","MoKα","","0.0465","0.0412","","","0.1043","0.1082","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214598","11.132","0.0004","19.4463","0.0007","19.5174","0.0007","90","","90","","90","","4225.1","0.3","283","2","283","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","μ-Carbonyl-1:2κ^2^C-carbonyl-1κC-(1<i>η</i>^5^-cyclopentadienyl)(μ- phenylvinylidene)bis(triphenylphosphine-2κP)manganeseplatinum(Mn—Pt)","","- C51 H41 Mn O2 P2 Pt -","- C51 H41 Mn O2 P2 Pt -","- C204 H164 Mn4 O8 P8 Pt4 -","4","1","CV2263","Vasiliev, Alexander D.; Antonova, Alla B.; Chudin, Oleg S.","μ-Carbonyl-1:2κ^2^<i>C</i>-carbonyl-1κ<i>C</i>-(1<i>{η</i>}^5^-cyclopentadienyl)(μ-phenylvinylidene)bis(triphenylphosphine-2κ<i>P</i>)manganeseplatinum(<i>Mn{—</i>Pt})","Acta Crystallographica Section E","2007","63","8","m2097","m2097","10.1107/S1600536807032254","","","0.71073","MoKα","","0.0243","0.0204","","","0.0433","0.0446","","","","","","0.948","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214599","15.888","0.0016","6.1274","0.0006","24.593","0.003","90","","90","","90","","2394.2","0.4","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","Methyl 2-(4,5-dibromo-1H-pyrrole-2-carboxamido)propionate","","- C9 H10 Br2 N2 O3 -","- C9 H10 Br2 N2 O3 -","- C72 H80 Br16 N16 O24 -","8","2","CV2266","Xiang-Chao Zeng; Jing Zeng; Xia Li; Xin Ling","Methyl 2-(4,5-dibromo-1<i>H</i>-pyrrole-2-carboxamido)propionate","Acta Crystallographica Section E","2007","63","8","o3424","o3424","10.1107/S1600536807032497","","","0.71073","MoKα","","0.0684","0.0524","","","0.1371","0.1483","","","","","","1.094","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214600","11.8","0.002","8.5536","0.0017","12.909","0.003","90","","105.6","0.03","90","","1254.9","0.5","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichloridobis[N-(2-pyridylmethyl)benzamide-κ^2^N,O]cadmium(II)","","- C26 H24 Cd Cl2 N4 O2 -","- C26 H24 Cd Cl2 N4 O2 -","- C52 H48 Cd2 Cl4 N8 O4 -","2","0.5","CV2267","Shu-Fang Zhang; Xiao-Gang Yang; Zhi Liu; Feng-Ling Xu; Bao-Rong Hou","Dichloridobis[<i>N</i>-(2-pyridylmethyl)benzamide-κ^2^<i>N</i>,<i>O</i>]cadmium(II)","Acta Crystallographica Section E","2007","63","8","m2058","m2058","10.1107/S1600536807031054","","","0.71073","MoKα","","0.0279","0.0252","","","0.0649","0.066","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214601","20.3689","0.0013","7.8804","0.0005","25.9921","0.0016","90","","91.697","0.001","90","","4170.3","0.5","292","2","292","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Diethyl 2,6-diethyl-4,8-dioxo-2,3,6,7-tetrahydro-1H,5H-2,3a,4a,6,7a,8a-\ hexaazacyclopenta[def]fluorene-8b,8c-dicarboxylate","","- C18 H28 N6 O6 -","- C18 H28 N6 O6 -","- C144 H224 N48 O48 -","8","1","CV2270","Li-Ping Cao; Yu-Zhou Wang; Meng Gao","Diethyl 2,6-diethyl-4,8-dioxo-2,3,6,7-tetrahydro-1<i>H</i>,5<i>H</i>-2,3a,4a,6,7a,8a-hexaazacyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","Acta Crystallographica Section E","2007","63","8","o3374","o3374","10.1107/S1600536807031819","","","0.71073","MoKα","","0.0826","0.0678","","","0.1802","0.1902","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214602","16.019","0.013","7.764","0.006","16.334","0.014","90","","97.042","0.013","90","","2016","3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","{1,1'-[<i>o</i>-Phenylenebis(nitrilomethylidyne)]di-2-naphtholato}copper(II)","","- C28 H18 Cu N2 O2 -","- C28 H18 Cu N2 O2 -","- C112 H72 Cu4 N8 O8 -","4","1","CV2271","Rui-Ting Xue; Mei-Ju Niu; Jian-Min Dou; Da-Qi Wang","{1,1'-[<i>o</i>-Phenylenebis(nitrilomethylidyne)]di-2-naphtholato}copper(II)","Acta Crystallographica Section E","2007","63","8","m2111","m2111","10.1107/S1600536807032709","","","0.71073","MoKα","","0.1147","0.0573","","","0.0898","0.1018","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214603","5.761","0.0005","6.8431","0.0005","14.194","0.0014","99.264","0.007","99.666","0.006","104.277","0.007","522.46","0.08","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","1'-Acetylferrocene-1-carbonitrile","","- C13 H11 Fe N O -","- C13 H11 Fe N O -","- C26 H22 Fe2 N2 O2 -","2","1","CV2275","Erben, Milan; Růžička, Aleš; Vinklárek, Jaromír; Šťáva, Vít; Handlíř, Karel","1'-Acetylferrocene-1-carbonitrile","Acta Crystallographica Section E","2007","63","8","m2145","m2146","10.1107/S1600536807033892","","","0.71073","MoKα","","0.0376","0.0319","","","0.0785","0.0816","","","","","","1.075","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214604","45.889","0.003","10.1112","0.0006","17.7948","0.001","90","","110.756","0.001","90","","7720.8","0.8","295","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[bis(1,10-phenanthroline-κ^2^<i>N,N</i>')\ (pentafluorobenzenecarboxylato)nitratomanganese(II)] [bis(1,10-phenanthroline-κ^2^N,N')dinitratomanganese(II)]","","- C86 H48 F10 Mn3 N16 O16 -","- C86 H48 F10 Mn3 N16 O16 -","- C344 H192 F40 Mn12 N64 O64 -","4","0.5","CV2276","Zhang, Xiangdong; Ge, Chunhua; Zhang, Xiaoyan; Guo, Ya'nan; Liu, Qitao","Bis[nitratobis(pentafluorobenzoato)(1,10-phenanthroline-κ^2^<i>N,N</i>')manganese(II)] dinitratobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)","Acta Crystallographica Section E","2007","63","8","m2237","m2238","10.1107/S160053680703557X","","","0.71073","MoKα","","0.0518","0.0391","","","0.0902","0.0968","","","","","","1.025","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214605","14.845","0.0019","8.2482","0.0011","16.86","0.002","90","","97.489","0.001","90","","2046.8","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-(4-Ethoxyphenyl)thiourea","","- C9 H12 N2 O S -","- C9 H12 N2 O S -","- C72 H96 N16 O8 S8 -","8","1","CV2277","Yan-Fang Lin; Guang-Xiang Zhong; Feng Xu; Wei-Xiao Hu","<i>N</i>-(4-Ethoxyphenyl)thiourea","Acta Crystallographica Section E","2007","63","8","o3549","o3549","10.1107/S1600536807034654","","","0.71073","MoKα","","0.0366","0.0328","","","0.0902","0.0937","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214606","6.207","0.0012","8.082","0.0016","13.409","0.003","83.42","0.03","77.67","0.03","82.67","0.03","649.1","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Pentaaqua(1-vinyl-1H-imidazole-κN^3^)cobalt(II) sulfate","","- C5 H16 Co N2 O9 S -","- C5 H16 Co N2 O9 S -","- C10 H32 Co2 N4 O18 S2 -","2","1","CV2278","Guang-Ye Liu; Wen-Li Liu; Fa-Qian Liu; Rong-Xun Li; Su-Yi Huang","Pentaaqua(1-vinyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)cobalt(II) sulfate","Acta Crystallographica Section E","2007","63","8","m2186","m2187","10.1107/S1600536807034708","","","0.71073","MoKα","","0.0459","0.0405","","","0.1165","0.1293","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214607","24.469","0.0006","4.5342","0.0002","13.5408","0.0003","90","","90","","90","","1502.32","0.08","203","","203","","","","","","","","","5","P n a 21","P 2c -2n","33","","1-(4-{[8-(Trifluoromethyl)quinolin-4-yl]amino}phenyl)ethanone","","- C18 H13 F3 N2 O -","- C18 H13 F3 N2 O -","- C72 H52 F12 N8 O4 -","4","1","CV2279","Butcher, Ray J.; Jasinski, Jerry P.; Narayana, B.; Swamy, M. T.; Yathirajan, H. S.","1-(4-{[8-(Trifluoromethyl)quinolin-4-yl]amino}phenyl)ethanone","Acta Crystallographica Section E","2007","63","8","o3604","o3604","10.1107/S1600536807035544","","","1.54178","CuKα","","0.0313","0.0286","","","0.0742","0.0758","","","","","","1.18","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214608","11.664","0.003","8.59","0.002","12.962","0.003","90","","113.917","0.004","90","","1187.2","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-[N-(4-Methylbenzoyl)carbamothioyl]glycine","","- C11 H12 N2 O3 S -","- C11 H12 N2 O3 S -","- C44 H48 N8 O12 S4 -","4","1","CV2280","Yusof, M. Sukeri M.; Roslan, Rohayati; Kadir, Maisara A.; Yamin, Bohari M.","<i>N</i>-[<i>N</i>-(4-Methylbenzoyl)carbamothioyl]glycine","Acta Crystallographica Section E","2007","63","8","o3591","o3591","10.1107/S1600536807035088","","","0.71073","MoKα","","0.0453","0.0383","","","0.1012","0.1072","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214609","5.7996","0.0005","20.838","0.002","10.4259","0.0008","90","","91.1","0.007","90","","1259.76","0.19","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,<i>N</i>-Bis(trifluoroacetyl)-7-methyloxazolo[3,2-a]pyridinium-2-imidate","","- C12 H6 F6 N2 O3 -","- C12 H6 F6 N2 O3 -","- C48 H24 F24 N8 O12 -","4","1","CV2281","Victor B. Rybakov; Alexander A. Bush; Sergei I. Troyanov; Eugene V. Babaev; Erhard Kemnitz","7-Methyl-3,<i>N</i>-bis(trifluoroacetyl)oxazolo[3,2-<i>a</i>]pyridinium-2-imidate","Acta Crystallographica Section E","2007","63","8","o3619","o3619","10.1107/S1600536807035611","","","0.71073","MoKα","","0.0543","0.0483","","","0.125","0.1313","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214610","4.747","0.0009","10.02","0.002","13.121","0.003","87.07","0.02","85.54","0.02","79.16","0.02","610.7","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","8-Methyl-3,<i>N</i>-bis(trifluoroacetyl)oxazolo[3,2-a]pyridinium-2-imidate","","- C12 H6 F6 N2 O3 -","- C12 H6 F6 N2 O3 -","- C24 H12 F12 N4 O6 -","2","1","CV2282","Victor B. Rybakov; Alexander A. Bush; Sergei I. Troyanov; Eugene V. Babaev; Erhard Kemnitz","8-Methyl-3,<i>N</i>-bis(trifluoroacetyl)oxazolo[3,2-<i>a</i>]pyridinium-2-imidate","Acta Crystallographica Section E","2007","63","8","o3620","o3620","10.1107/S1600536807036227","","","0.71073","MoKα","","0.0486","0.0478","","","0.1097","0.1098","","","","","","1.007","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214611","8.1397","0.0015","12.597","0.002","13.823","0.003","90","","90","0.01","90","","1417.4","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichlorido{2,2'-[oxydi(methylene)]dipyridine-κ^3^N,N,N'}cadmium(II)","","- C12 H12 Cd Cl2 N2 O -","- C12 H12 Cd Cl2 N2 O -","- C48 H48 Cd4 Cl8 N8 O4 -","4","1","CV2283","Li, Jin Min","Dichlorido{2,2'-[oxydi(methylene)]dipyridine-κ^3^<i>N</i>,<i>N</i>,<i>N</i>'}cadmium(II)","Acta Crystallographica Section E","2007","63","8","m2241","m2241","10.1107/S1600536807036574","","","0.71073","MoKα","","0.0312","0.0276","","","0.0717","0.0737","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214612","6.3625","0.0012","11.745","0.002","23.007","0.004","90","","90","","90","","1719.3","0.5","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","Pregna-1,4,16-triene-3,20-dione","","- C21 H26 O2 -","- C21 H26 O2 -","- C84 H104 O8 -","4","1","CV2284","Neng-Qiang Wang; Tie-Jun Wang","Pregna-1,4,16-triene-3,20-dione","Acta Crystallographica Section E","2007","63","8","o3659","o3659","10.1107/S1600536807036732","","","0.71073","MoKα","","0.0517","0.0396","","","0.0945","0.1016","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214613","11.786","0.003","8.092","0.002","18.062","0.005","90","","103.692","0.017","90","","1673.7","0.8","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,7,10-Trioxa-1,13-diazatricyclo[11.6.3.0^14,19^]icosa-14,16,18-triene- 20,22-dione","","- C17 H22 N2 O5 -","- C17 H22 N2 O5 -","- C68 H88 N8 O20 -","4","1","DN2198","Cherif Alaoui, L.; Kandri Rodi, Y.; Haoudi , A.; Obbade, S.; Essassi, E. M.","2,4-Dioxo-1,5-benzodiazepino-15-crown-3","Acta Crystallographica Section E","2007","63","8","o3494","o3494","10.1107/S1600536807029753","","","0.71073","MoKα","","0.0813","0.0486","","","0.1279","0.1505","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214614","9.773","0.004","9.773","0.004","32.63","0.012","90","","90","","120","","2699","1.9","293","2","293","2","","","","","","","","4","P 61","P 61","169","","(3<i>R</i>,4S)-2-Isopropyl-3-methyl-4-phenyl-3,4-dihydroisoquinolinium iodide","","- C19 H22 I N -","- C19 H22 I N -","- C114 H132 I6 N6 -","6","1","DN2204","Ben Ali, Karim; Chiaroni, Angèle; Bohe, Luis","(3<i>R</i>,4<i>S</i>)-2-Isopropyl-3-methyl-4-phenyl-3,4-dihydroisoquinolinium iodide","Acta Crystallographica Section E","2007","63","8","o3355","o3355","10.1107/S1600536807030565","","","0.71073","MoKα","","0.0525","0.0377","","","0.0778","0.0855","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214615","10.227","0.002","7.1414","0.0013","11.461","0.002","90","","100.163","0.004","90","","823.9","0.3","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ammonium 4-hydroxybenzenesulfonate","","- C6 H9 N O4 S -","- C6 H9 N O4 S -","- C24 H36 N4 O16 S4 -","4","1","DN2207","Kui-Wu Wang; Wen-Jie Feng; Hai-Yan Li; Lin-Lin Ma; Zhi-Min Jin","Ammonium 4-hydroxybenzenesulfonate","Acta Crystallographica Section E","2007","63","8","o3481","o3481","10.1107/S1600536807032382","","","0.7107","MoKα","","0.0329","0.0314","","","0.0835","0.0852","","","","","","1.109","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214616","24.1444","0.0003","15.3089","0.0002","26.6679","0.0005","90","","107.132","0.001","90","","9419.7","0.3","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Hexakis{μ~2~-4-[2-(diisopropylamino)ethylamino]pent-3-en-2-onato- κ^3^N,<i>O</i>:<i>O</i>}tricalcium(II) hexane solvate","","- C84 H164 Ca3 N12 O6 -","- C84 H164 Ca3 N12 O6 -","- C336 H656 Ca12 N48 O24 -","4","0.5","DN2209","P. Richard; M. Eleter; L. G. Hubert-Pfalzgraf; S. Daniele","Hexakis{μ~2~-4-[2-(diisopropylamino)ethylamino]pent-3-en-2-onato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>}tricalcium(II) hexane solvate","Acta Crystallographica Section E","2007","63","8","m2049","m2050","10.1107/S1600536807031789","","","0.71073","MoKα","","0.0605","0.0405","","","0.0959","0.1047","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214617","14.5462","0.0005","25.5247","0.0009","41.5719","0.0012","90","","90","","90","","15435.1","0.9","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","μ-Oxalato-κ^2^<i>O</i>^1^,<i>O</i>^2^:κ^2^<i>O</i>^1'^,<i>O</i>^2'^-\ bis[(η^5^-pentamethylcyclopentadienyl)(trifluoromethanesulfonato-\ κ<i>O</i>)rhodium(III)]","","- C24 H30 F6 O10 Rh2 S2 -","- C24 H30 F6 O10 Rh2 S2 -","- C480 H600 F120 O200 Rh40 S40 -","20","2.5","DN2210","Govindaswamy, Padavattan; Süss-Fink, Georg; Therrien, Bruno","μ-Oxalato-κ^2^<i>O</i>^1^,<i>O</i>^2^:κ^2^<i>O</i>^1'^,<i>O</i>^2'^-bis[(η^5^-pentamethylcyclopentadienyl)(trifluoromethanesulfonato-κ<i>O</i>)rhodium(III)]","Acta Crystallographica Section E","2007","63","8","m2046","m2046","10.1107/S1600536807031790","","","0.71073","MoKα","","0.0751","0.0514","","","0.1287","0.1388","","","","","","0.921","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214618","11.117","0.0015","6.78","0.001","30.567","0.004","90","","99.124","0.015","90","","2274.8","0.6","304","2","304","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","Sodium N-bromo-2,4-dichlorobenzenesulfonamidate sesquihydrate","","- C6 H6 Br Cl2 N Na O3.5 S -","- C6 H6 Br Cl2 N Na O3.5 S -","- C48 H48 Br8 Cl16 N8 Na8 O28 S8 -","8","1","DN2212","B. Thimme Gowda; Miroslav Tokarčík; Jozef Kožíšek; Hartmut Fuess","Sodium <i>N</i>-bromo-2,4-dichlorobenzenesulfonamidate sesquihydrate","Acta Crystallographica Section E","2007","63","8","m2115","m2116","10.1107/S1600536807033144","","","0.71073","MoKα","","0.0638","0.062","","","0.1757","0.1772","","","","","","1.088","","","","has coordinates,has Fobs","197043","2020-10-21","18:00:00",""
"2214619","21.952","0.001","7.3477","0.0003","17","0.0007","90","","104.61","0.002","90","","2653.4","0.2","291","2","291","2","","","","","","","","4","C 1 c 1","C -2yc","9","","(<i>E</i>)-4-(4-Methylstyryl)pyridine‒(E)-but-2-enedioic acid (2/1)","","- C32 H30 N2 O4 -","- C32 H30 N2 O4 -","- C128 H120 N8 O16 -","4","1","DN2213","Tian-Jia Bu; Bao Li; Li-Xin Wu","(<i>E</i>)-4-(4-Methylstyryl)pyridine‒(<i>E</i>)-but-2-enedioic acid (2/1)","Acta Crystallographica Section E","2007","63","8","o3466","o3466","10.1107/S1600536807033260","","","0.71073","MoKα","","0.062","0.0522","","","0.1315","0.1412","","","","","","0.996","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214620","10.479","0.002","8.9988","0.0018","22.561","0.005","90","","92.51","0.03","90","","2125.4","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aquabis(2,4-dichloro-6-formylphenolato-κ^2^O,O')(N,N'-dimethylformamide-\ κO)manganese(II)","","- C17 H15 Cl4 Mn N O6 -","- C17 H15 Cl4 Mn N O6 -","- C68 H60 Cl16 Mn4 N4 O24 -","4","1","DN2214","Li, Guang-Zhao; Zhang, Shu-Hua; Liu, Zheng; Jin, Li-Xia","Aquabis(2,4-dichloro-6-formylphenolato-κ^2^<i>O</i>,<i>O</i>')(<i>N</i>,<i>N</i>'-dimethylformamide-κ<i>O</i>)manganese(II)","Acta Crystallographica Section E","2007","63","8","m2107","m2107","10.1107/S1600536807033417","","","0.71073","MoKα","","0.1249","0.0769","","","0.201","0.2287","","","","","","1.077","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214621","4.8651","0.0016","12.9403","0.0017","22.884","0.003","90","","90","","90","","1440.7","0.5","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>)-4-chloro-<i>N</i>'-(2-hydroxy-3-methoxybenzylidene)benzohydrazide monohydrate","","- C15 H15 Cl N2 O4 -","- C15 H15 Cl N2 O4 -","- C60 H60 Cl4 N8 O16 -","4","1","DN2215","Jichun Cui; Handong Yin; Yanling Qiao","(<i>E</i>)-4-Chloro-<i>N</i>'-(2-hydroxy-3-methoxybenzylidene)benzohydrazide monohydrate","Acta Crystallographica Section E","2007","63","8","o3548","o3548","10.1107/S1600536807033168","","","0.71073","MoKα","","0.0795","0.0434","","","0.0832","0.0949","","","","","","0.966","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214622","15.9176","0.0007","5.8509","0.0002","12.1429","0.0005","90","","105.745","0.002","90","","1088.46","0.08","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(2-hydroxy-5-methylphenyl)(phenyl)methanone","","- C14 H12 O2 -","- C14 H12 O2 -","- C56 H48 O8 -","4","1","DN2217","Jian-Guo Chang; Lin-Lin Qiu; Dong-Feng Zhao; Guo-Fang He","(2-Hydroxy-5-methylphenyl)(phenyl)methanone","Acta Crystallographica Section E","2007","63","8","o3517","o3517","10.1107/S1600536807034095","","","0.71073","MoKα","","0.0507","0.0368","","","0.1225","0.1489","","","","","","0.999","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214623","13.1746","0.0009","13.5924","0.0009","14.7998","0.001","90.199","0.001","105.024","0.001","99.466","0.001","2521.9","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Chlorido[(1,2,5,6-η)-1,3,5,7-cyclooctatetraene]phenylplatinum(II)","","- C14 H13 Cl Pt -","- C14 H13 Cl Pt -","- C112 H104 Cl8 Pt8 -","8","4","DN2218","Song, Ah-Ran; Hwang, In-Chul; Ha, Kwang","Chlorido[(1,2,5,6-η)-1,3,5,7-cyclooctatetraene]phenylplatinum(II)","Acta Crystallographica Section E","2007","63","8","m2163","m2163","10.1107/S1600536807034083","","","0.71073","MoKα","","0.056","0.0375","","","0.0762","0.0812","","","","","","0.984","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214624","9.947","0.005","9.996","0.005","10.833","0.005","83.381","0.005","74.695","0.006","76.924","0.006","1010.2","0.9","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","(E)-4-[2-(2-Phenylindolizin-3-yl)-1-(1,2,4-triazol-1-yl)vinyl]benzonitrile","","- C25 H17 N5 -","- C25 H17 N5 -","- C50 H34 N10 -","2","1","DN2219","Tang, Li-Juan; Liu, Wei-Wei; Qian, Bao-Hua; Wang, Ling; Wang, Da-Qi","(<i>E</i>)-4-[2-(2-Phenylindolizin-3-yl)-1-(1,2,4-triazol-1-yl)vinyl]benzonitrile","Acta Crystallographica Section E","2007","63","8","o3608","o3608","10.1107/S1600536807035672","","","0.71073","MoKα","","0.0708","0.0435","","","0.1035","0.1217","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214625","13.163","0.004","9.433","0.004","14.533","0.002","90","","99.33","0.02","90","","1780.6","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Anilino-5-benzoyl-4-phenyl-1,3-thiazole","","- C22 H16 N2 O S -","- C22 H16 N2 O S -","- C88 H64 N8 O4 S4 -","4","1","DN2220","Dridi, K.; El Efrit, M. L.","2-Anilino-5-benzoyl-4-phenyl-1,3-thiazole","Acta Crystallographica Section E","2007","63","8","o3632","o3632","10.1107/S1600536807035635","","","0.71073","MoKα","","0.0962","0.0467","","","0.0998","0.1164","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214626","6.8261","0.0008","13.9705","0.0016","16.7173","0.0019","90","","90","","90","","1594.2","0.3","291","2","291","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Diaqua(5-carboxy-2-methyl-1<i>H</i>-imidazole-4-carboxylato-\ κ^2^N^3^,O^4^)cobalt(II)","","- C12 H14 Co N4 O10 -","- C12 H14 Co N4 O10 -","- C48 H56 Co4 N16 O40 -","4","0.5","DN2222","Chong-Bo Liu; Xu-Liang Nie; Hui-Liang Wen","Diaquabis(5-carboxy-2-methyl-1<i>H</i>-imidazole-4-carboxylato-κ^2^<i>N</i>^3^,<i>O</i>^4^)cobalt(II)","Acta Crystallographica Section E","2007","63","8","m2244","m2244","10.1107/S1600536807036744","","","0.71073","MoKα","","0.037","0.028","","","0.0768","0.0839","","","","","","1.075","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214627","7.6534","0.0007","12.7131","0.0014","14.3741","0.0019","90","","92.329","0.002","90","","1397.4","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-3-(1H-Indol-3-yl)2-(4-nitrophenyl)acrylonitrile","","- C17 H11 N3 O2 -","- C17 H11 N3 O2 -","- C68 H44 N12 O8 -","4","1","DN2224","Qian, Bao-Hua; Liu, Wei-Wei; Hu, Hong-Wen","(<i>Z</i>)-3-(1<i>H</i>-Indol-3-yl)-2-(4-nitrophenyl)acrylonitrile","Acta Crystallographica Section E","2007","63","8","o3627","o3627","10.1107/S160053680703632X","","","0.71073","MoKα","","0.0901","0.0454","","","0.1","0.1274","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214628","12.9555","0.0018","12.9555","0.0018","15.029","0.003","90","","90","","90","","2522.5","0.7","120","2","120","2","","","","","","","","5","P 41","P 4w","76","","gem-2,2-Diamino-4,4,6,6-tetraphenoxy-1,3,5-2λ^5^-cyclotriazaphosphorine","","- C24 H24 N5 O4 P3 -","- C24 H24 N5 O4 P3 -","- C96 H96 N20 O16 P12 -","4","1","DN3046","Lenka Dastychová; Zdirad Žák; Milan Alberti; Jan Taraba","<i>gem</i>-2,2-Diamino-4,4,6,6-tetraphenoxy-1,3,5-cyclotriaza-λ^5^-phosphorine","Acta Crystallographica Section E","2007","63","8","o3500","o3500","10.1107/S1600536807033399","","","0.71073","MoKα","","0.0259","0.0247","","","0.0577","0.0583","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214629","14.862","0.003","7.6402","0.0015","26.947","0.005","90","","90","","90","","3059.8","1","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Poly[[μ~2~-<i>trans</i>-1,2-di-4-pyridylethylene]hexa-μ~2~- oxidonickel(II)divanadate(V)]","","- C12 H10 N2 Ni O6 V2 -","- C12 H10 N2 Ni O6 V2 -","- C96 H80 N16 Ni8 O48 V16 -","8","1","DN3050","Wang, Chong-Chen","Poly[[μ~2~-<i>trans</i>-1,2-di-4-pyridylethylene]hexa-μ~2~-oxido-nickel(II)divanadate(V)]","Acta Crystallographica Section E","2007","63","8","m2233","m2233","10.1107/S1600536807034277","","","0.71073","MoKα","","0.0378","0.0317","","","0.0798","0.0831","","","","","","1.03","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214630","7.174","0.006","9.652","0.008","15.411","0.013","80.504","0.008","79.684","0.009","68.52","0.008","971.2","1.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2,2'-Ethylenedibenzimidazolium dichloride tetrahydrate","","- C16 H24 Cl2 N4 O4 -","- C16 H24 Cl2 N4 O4 -","- C32 H48 Cl4 N8 O8 -","2","1","EZ2080","Jun-Ming Yi; Yun-Qian Zhang; Sai-Feng Xue; Qian-Jiang Zhu; Zhu Tao","2,2'-Ethylenedibenzimidazolium dichloride tetrahydrate","Acta Crystallographica Section E","2007","63","8","o3578","o3578","10.1107/S1600536807031273","","","0.71073","MoKα","","0.0406","0.0361","","","0.1022","0.105","","","","","","1.089","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214631","6.1462","0.0004","14.2873","0.0008","14.8352","0.0013","90","","90","","90","","1302.72","0.16","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>)-2-Methyl-6-[3-(trifluoromethyl)phenyliminomethyl]phenol","","- C15 H12 F3 N O -","- C15 H12 F3 N O -","- C60 H48 F12 N4 O4 -","4","1","EZ2084","Akkaya, Abdullah; Erşahin, Ferda; Şenel, İsmet; Aǧar, Erbil; Büyükgüngör, Orhan","(<i>E</i>)-2-Methyl-6-[3-(trifluoromethyl)phenyliminomethyl]phenol","Acta Crystallographica Section E","2007","63","8","o3555","o3555","10.1107/S1600536807030310","","","0.71073","MoKα","","0.089","0.076","","","0.242","0.257","","","","","","1.13","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214632","14.575","0.003","9.909","0.002","14.522","0.003","90","","115.11","0.03","90","","1899.1","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(2-Methoxyethyl) 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","","- C19 H22 N2 O7 -","- C19 H22 N2 O7 -","- C76 H88 N8 O28 -","4","1","EZ2085","Sun, Feng-Xia; Rong, Fu-Gang; Chu, Xiao-He; Yan, Shu-Xia","3-(2-Methoxyethyl) 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica Section E","2007","63","8","o3451","o3451","10.1107/S1600536807032515","","","0.71073","MoKα","","0.083","0.055","","","0.121","0.138","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214633","9.6041","0.0007","10.0758","0.0007","9.2936","0.0006","90","","90","","90","","899.33","0.11","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(<i>S</i>)-(+)-2-Formamido-4-methylpentanoic acid","","- C7 H13 N O3 -","- C7 H13 N O3 -","- C28 H52 N4 O12 -","4","1","EZ2086","Boyle, Grant A.; Govender, Thavendran; Kruger, Hendrik G.; Maguire, Glenn E. M.; Naicker, Tricia","(<i>S</i>)-(+)-2-Formamido-4-methylpentanoic acid","Acta Crystallographica Section E","2007","63","8","o3445","o3445","10.1107/S1600536807032503","","","0.71073","MoKα","","0.0331","0.0309","","","0.0846","0.0863","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214634","14.3011","0.0009","16.9401","0.001","14.9839","0.0009","90","","101.371","0.001","90","","3558.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2,2'-Dicarboxy-4,4'-carbonyldibenzoato)bis(1,10-phenanthroline)copper(II) dihydrate","","- C41 H28 Cu N4 O11 -","- C41 H28 Cu N4 O11 -","- C164 H112 Cu4 N16 O44 -","4","1","EZ2087","Hao, Lu-Jiang; Yu, Tong-Li","(2,2'-Dicarboxy-4,4'-carbonyldibenzoato)bis(1,10-phenanthroline)copper(II) dihydrate","Acta Crystallographica Section E","2007","63","8","m2184","m2184","10.1107/S1600536807034678","","","0.71073","MoKα","","0.0763","0.0443","","","0.1136","0.1267","","","","","","1","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2214635","6.2944","0.0006","10.7466","0.001","10.9927","0.001","65.554","0.001","78.674","0.001","86.678","0.002","663.51","0.11","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","3-Benzyl-6-bromo-3,4-dihydro-2H-benzo[e][1,3]oxazine","","- C15 H14 Br N O -","- C15 H14 Br N O -","- C30 H28 Br2 N2 O2 -","2","1","EZ2090","Xiu-Ling Chen; Xiang-Ju Diao; Ming-Hu Wu","3-Benzyl-6-bromo-3,4-dihydro-2<i>H</i>-benzo[<i>e</i>][1,3]oxazine","Acta Crystallographica Section E","2007","63","8","o3580","o3580","10.1107/S1600536807035039","","","0.71073","MoKα","","0.0538","0.0406","","","0.1114","0.1205","","","","","","1.106","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214636","25.265","0.004","11.0076","0.0012","14.864","0.002","90","","125.82","0.003","90","","3351.9","0.8","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(3<i>RS</i>)-2'-Amino-2,5'-dioxo-1,2-dihydro-5'H-spiro[indole-3,4'- pyrano[3,2-c]chromene]-3'-carbonitrile","","- C20 H11 N3 O4 -","- C20 H11 N3 O4 -","- C160 H88 N24 O32 -","8","1","FB2056","Song-Lei Zhu; Shun-Jun Ji; Yong Zhang","(3<i>RS</i>)-2'-Amino-2,5'-dioxo-1,2-dihydro-5'<i>H</i>-spiro[indole-3,4'-pyrano[3,2-<i>c</i>]chromene]-3'-carbonitrile","Acta Crystallographica Section E","2007","63","8","o3523","o3523","10.1107/S1600536807034174","","","0.71073","MoKα","","0.0592","0.0482","","","0.1016","0.1066","","","","","","1.149","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214637","10.644","0.002","6.4661","0.0015","20.093","0.004","90","","105.25","0.016","90","","1334.2","0.5","295","2","295","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","caesium dilithium tetragadolinium pentaborate","caesium dilithium tetragadolinium pentaborate","","- B5 Cs Gd4 Li2 O15 -","- B5 Cs Gd4 Li2 O15 -","- B20 Cs4 Gd16 Li8 O60 -","4","1","FI2036","Xia, Ming-Jun; Li, R. K.","A new quaternary rare earth borate, CsLi~2~Gd~4~(BO~3~)~5~","Acta Crystallographica Section E","2007","63","8","i173","i173","10.1107/S1600536807036586","","","0.71073","MoKα","","0.0465","0.0443","","","0.1041","0.1081","","","","","","1.106","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214638","17.3207","0.0012","11.8106","0.0009","9.3661","0.0008","90","","97.736","0.007","90","","1898.6","0.3","299","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(7RS,8SR)-Ethyl 6-(1,3-benzodioxol-5-yl)-3-(3-bromo-2-thienyl)-2-oxocyclohex-3-ene-1-carboxylate","","- C20 H17 Br O5 S -","- C20 H17 Br O5 S -","- C80 H68 Br4 O20 S4 -","4","1","FJ2022","Fischer, Andreas; Yathirajan, H. S.; Ashalatha, B. V.; Naranaya, B.; Sarojini, B. K.","(7<i>RS</i>,8<i>SR</i>)-Ethyl 6-(1,3-benzodioxol-5-yl)-3-(3-bromo-2-thienyl)-2-oxocyclohex-3-ene-1-carboxylate","Acta Crystallographica Section E","2007","63","8","o3616","o3616","10.1107/S1600536807035106","","","0.71073","MoKα","","0.0958","0.0516","","","0.0967","0.1175","","","","","","1.112","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214639","6.9897","0.0006","12.6809","0.0011","16.4228","0.0014","90","","90","","90","","1455.6","0.2","273","2","273","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-(2,4,5-Trimethoxyphenyl)-1,3-benzothiazole","","- C16 H15 N O3 S -","- C16 H15 N O3 S -","- C64 H60 N4 O12 S4 -","4","1","FL2131","Chen, Lian-Qing","2-(2,4,5-Trimethoxyphenyl)-1,3-benzothiazole","Acta Crystallographica Section E","2007","63","8","o3395","o3395","10.1107/S1600536807032114","","","0.71073","MoKα","","0.0425","0.0337","","","0.0836","0.0888","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214640","10.54","0.005","10.74","0.003","10.779","0.003","82.17","0.02","83.82","0.03","82.89","0.03","1194.4","0.7","292","2","294","2","","","","","","","","4","P -1","-P 1","2","","3-(p-Tolyliminomethyl)-1,1'-binaphthol ethanol solvate","","- C30 H27 N O3 -","- C30 H27 N O3 -","- C60 H54 N2 O6 -","2","1","FL2134","Wei Wu; Xiao-Qing Qian; Lin-Zhi Zhong; Kun Wang; Rui-Xiang Li","3-(<i>p</i>-Tolyliminomethyl)-1,1'-binaphthol ethanol solvate","Acta Crystallographica Section E","2007","63","8","o3492","o3492","10.1107/S1600536807031832","","","0.71073","MoKα","","0.1508","0.0592","","","0.1543","0.1878","","","","","","0.941","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214641","8.196","0.002","9.559","0.003","12.359","0.002","70.801","0.019","98.54","0.02","108.88","0.02","864.3","0.4","296","","296","","","","","","","","","5","P -1","-P 1","2","","2-Isopropyl-4-(phenylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-b]indole","","- C19 H19 N2 O2 S -","- C19 H19 N2 O2 S -","- C38 H38 N4 O4 S2 -","2","1","FL2136","Kishbaugh, Tara L. S.; Gribble, Gordon W.; Jasinski, Jerry P.","2-Isopropyl-4-(phenylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-<i>b</i>]indole","Acta Crystallographica Section E","2007","63","8","o3408","o3408","10.1107/S1600536807032400","","","0.71069","MoKα","","0.1785","0.0538","","","0.14","0.1847","","","","","","1.011","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214642","18.113","0.005","16.14","0.009","12.146","0.008","90","","90","","90","","3551","3","296","","296","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-tert-Butyl-4-(phenylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-b]indole","","- C20 H22 N2 O2 S -","- C20 H22 N2 O2 S -","- C160 H176 N16 O16 S8 -","8","1","FL2137","Kishbaugh, Tara L. S.; Gribble, Gordon W.; Jasinski, Jerry P.","2-<i>tert</i>-Butyl-4-(phenylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-<i>b</i>]indole","Acta Crystallographica Section E","2007","63","8","o3409","o3409","10.1107/S1600536807032412","","","0.71069","MoKα","","0.193","0.0618","","","0.2041","0.283","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214643","9.178","0.002","9.6463","0.0017","12.0124","0.0014","78.68","0.012","110.275","0.013","107.904","0.018","944.5","0.3","296","","296","","","","","","","","","5","P -1","-P 1","2","","2-Benzyl-4-(phenylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-b]indole","","- C23 H20 N2 O2 S -","- C23 H20 N2 O2 S -","- C46 H40 N4 O4 S2 -","2","1","FL2138","Kishbaugh, Tara L. S.; Gribble, Gordon W.; Jasinski, Jerry P.","2-Benzyl-4-(phenylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-<i>b</i>]indole","Acta Crystallographica Section E","2007","63","8","o3410","o3410","10.1107/S1600536807032424","","","0.71069","MoKα","","0.1274","0.0403","","","0.0881","0.1173","","","","","","0.994","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214644","11.929","0.007","9.397","0.007","19.198","0.004","90","","106.47","0.03","90","","2064","2","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-Methoxybenzyl)-4-(phenylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-b]indole","","- C25 H24 N2 O2 S -","- C25 H24 N2 O2 S -","- C100 H96 N8 O8 S4 -","4","1","FL2139","Kishbaugh, Tara L. S.; Gribble, Gordon W.; Jasinski, Jerry P.","2-(4-Methoxybenzyl)-4-(phenylsulfonyl)-1,2,3,4-tetrahydropyrrolo[3,4-<i>b</i>]indole","Acta Crystallographica Section E","2007","63","8","o3411","o3411","10.1107/S1600536807032436","","","0.71069","MoKα","","0.2503","0.0613","","","0.1964","0.2835","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214645","7.1597","0.001","16.533","0.003","8.7277","0.001","90","","101.364","0.011","90","","1012.9","0.3","150","2","150","2","","","","","","","","4","C 1 c 1","C -2yc","9","","(11<i>SR</i>,13<i>RS</i>)-12-Oxa-9- azatetracyclo[7.4.1.0^2,7^.0^11,13^]tetradeca-2(7),3,5-trien-8-one","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C52 H52 N4 O8 -","4","1","FL2141","Gallucci, Judith C.; Dura, Robert D.; Paquette, Leo A.","(11<i>SR</i>,13<i>RS</i>)-12-Oxa-9-azatetracyclo[7.4.1.0^2,7^.0^11,13^]tetradeca-2(7),3,5-trien-8-one","Acta Crystallographica Section E","2007","63","8","o3417","o3417","10.1107/S160053680703228X","","","0.71073","MoKα","","0.0429","0.038","","","0.0972","0.1051","","","","","","1.015","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214646","18.5164","0.0018","12.392","0.0012","12.6929","0.0013","90","","108.528","0.005","90","","2761.5","0.5","150","","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4b,5,7,7a-Tetrahydro-4b,7a-epiminomethanoimino-6H- imidazo[4,5-f][1,10]phenanthroline-6,13-dione monohydrate","","- C14 H12 N6 O3 -","- C14 H12 N6 O3 -","- C112 H96 N48 O24 -","8","2","FL2142","Rillema, D. Paul; Kirgan, Robert A.; Moore, Curtis; Koshy, Seena","4b,5,7,7a-Tetrahydro-4b,7a-epiminomethanoimino-6<i>H</i>-imidazo[4,5-<i>f</i>][1,10]phenanthroline-6,13-dione monohydrate","Acta Crystallographica Section E","2007","63","8","o3526","o3526","10.1107/S1600536807034198","","","0.71073","MoKα","","0.0444","0.0357","","","0.0859","0.0922","","","","","","1.033","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214647","6.4996","0.0013","6.3375","0.0013","10.983","0.002","90","","93.07","0.03","90","","451.75","0.15","291","2","291","2","","","","","","","","3","P 1 21 1","P 2yb","4","","2,2-Di-C-methoxy-1,4:3,6-dianhydromannitol","","- C8 H14 O5 -","- C8 H14 O5 -","- C16 H28 O10 -","2","1","FL2143","Quan-Jian Lv; Xue-Hui Hou","2,2-Di-<i>C</i>-methoxy-1,4:3,6-dianhydromannitol","Acta Crystallographica Section E","2007","63","8","o3653","o3653","10.1107/S1600536807033387","","","0.71073","MoKα","","0.0536","0.0506","","","0.1345","0.1376","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214648","7.8251","0.0005","8.0294","0.0004","8.3899","0.0005","65.894","0.002","80.961","0.004","74.821","0.002","463.63","0.05","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","(<i>E</i>,<i>E</i>)-4,4',6,6'-Tetrachloro-2,2'-(1,1'-azinodiethylene)diphenol","","- C18 H16 Cl4 N2 O2 -","- C18 H16 Cl4 N2 O2 -","- C18 H16 Cl4 N2 O2 -","1","0.5","FL2144","Jian-Guo Chang; Xiao-Hong Liu","(<i>E</i>,<i>E</i>)-4,4',6,6'-Tetrachloro-2,2'-(1,1'-azinodiethylene)diphenol","Acta Crystallographica Section E","2007","63","8","o3382","o3382","10.1107/S1600536807031844","","","0.71073","MoKα","","0.029","0.0264","","","0.0725","0.0752","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214649","8.2562","0.0003","9.5498","0.0003","10.4583","0.0004","65.0882","0.0016","83.8718","0.0016","76.5805","0.0016","727.41","0.05","90","2","90","2","","","","","","","","4","P -1","-P 1","2","N-p-tolyl-N-(p-tolylcarbamoyl)acetamide","N-p-Tolyl-N-[N-(p-tolyl)carbamoyl]acetamide","","- C17 H18 N2 O2 -","- C17 H18 N2 O2 -","- C34 H36 N4 O4 -","2","1","FL2145","Zhong, Ming; Long, Sihui","<i>N</i>-<i>p</i>-Tolyl-<i>N</i>-[<i>N</i>-(<i>p</i>-tolyl)carbamoyl]acetamide","Acta Crystallographica Section E","2007","63","8","o3405","o3405","10.1107/S1600536807032394","","","0.71073","MoKα","","0.1102","0.0514","","","0.118","0.1403","","","","","","0.973","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214650","13.934","0.0018","5.4166","0.0004","17.789","0.002","90","","108.13","0.01","90","","1276","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2E)-1-(3-Methyl-2-thienyl)-3-(3-nitrophenyl)prop-2-en-1-one","","- C14 H11 N O3 S -","- C14 H11 N O3 S -","- C56 H44 N4 O12 S4 -","4","1","FL2146","Sarojini, B. K.; Narayana, B.; Vijesh, A. M.; Yathirajan, H. S.; Bolte, Michael","(2<i>E</i>)-1-(3-Methyl-2-thienyl)-3-(3-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","8","o3656","o3656","10.1107/S1600536807035453","","","0.71073","MoKα","","0.0647","0.0588","","","0.1565","0.1605","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214651","7.5832","0.0002","16.9532","0.0004","8.3785","0.0002","90","","96.323","0.001","90","","1070.58","0.05","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(2SR,8aSR)-1,2,3,4,6,7,8,8a-Octahydro-6-oxonaphthalene-2-acetic acid","","- C12 H16 O3 -","- C12 H16 O3 -","- C48 H64 O12 -","4","1","FL2147","Malak, Muhammad H.; Desai, Janish; Lalancette, Roger A.; Thompson, Hugh W.","(2<i>SR</i>,8a<i>SR</i>)-1,2,3,4,6,7,8,8a-Octahydro-6-oxonaphthalene-2-acetic acid: hydrogen bonding in an unsaturated bicyclic keto acid","Acta Crystallographica Section E","2007","63","8","o3606","o3606","10.1107/S1600536807035003","","","1.54178","CuKα","","0.039","0.038","","","0.103","0.104","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214652","9.0234","0.0009","10.4481","0.0013","14.1446","0.0016","95.513","0.01","102.642","0.009","106.388","0.009","1230.5","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","<i>syn</i>-1,2,3,4,5,6,7,8,11,11,12,12-Dodecachloro-9,10-dimethoxy-1,4,5,8-\ tetrahydro-1,4:5,8-dimethanoanthracene","","- C18 H6 Cl12 O2 -","- C18 H6 Cl12 O2 -","- C36 H12 Cl24 O4 -","2","1","FL2148","Amanda J. Watson; Megan E. O'Brien; Matthew D. Brooker; Daniel S. Jones; Markus Etzkorn","<i>syn</i>-1,2,3,4,5,6,7,8,11,11,12,12-Dodecachloro-9,10-dimethoxy-1,4,5,8-tetrahydro-1,4:5,8-dimethanoanthracene","Acta Crystallographica Section E","2007","63","8","o3565","o3565","10.1107/S1600536807034757","","","1.54184","CuKα","","","0.057","","","","0.1674","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214653","7.659","0.0009","11.1358","0.0013","14.6746","0.0017","107.634","0.015","100.296","0.016","100.185","0.016","1137.4","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Di-μ~3~-oxo-bis(μ~2~-2,3,4,5-tetrafluorobenzoato-κ^2^O:O')bis(2,3,4,5- tetrafluorobenzoato-κO)tetrakis[dimethyltin(IV)]","","- C36 H28 F16 O10 Sn4 -","- C36 H28 F16 O10 Sn4 -","- C36 H28 F16 O10 Sn4 -","1","0.5","GG2018","Lin-Lin Qiu; Jun-Shan Sun; Ji-Kun Li; Ru-Fen Zhang","Di-μ~3~-oxo-bis(μ~2~-2,3,4,5-tetrafluorobenzoato-κ^2^<i>O</i>:<i>O</i>')bis(2,3,4,5-tetrafluorobenzoato-κ<i>O</i>)tetrakis[dimethyltin(IV)]","Acta Crystallographica Section E","2007","63","8","m2035","m2036","10.1107/S1600536807031030","","","0.71073","MoKα","","0.0737","0.0522","","","0.1428","0.1593","","","","","","1.006","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214654","11.5958","0.0002","12.4826","0.0003","12.7543","0.0002","84.083","0.001","78.825","0.001","62.874","0.001","1611.69","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Hexa-μ~3~-N,N-diisopropyldithiocarbamato-hexasilver(I)(6 Ag—Ag)","","- C42 H84 Ag6 N6 S12 -","- C42 H84 Ag6 N6 S12 -","- C42 H84 Ag6 N6 S12 -","1","0.5","GG2019","Xia Yin; Mu-Biao Xie; Wei-Guang Zhang; Jun Fan; Matthias Zeller","Hexakis(μ~3~-<i>N</i>,<i>N</i>-diisopropyldithiocarbamato)hexasilver(I)(6 <i>Ag</i>—<i>Ag</i>)","Acta Crystallographica Section E","2007","63","8","m2063","m2064","10.1107/S1600536807031431","","","0.71073","MoKα","","0.0605","0.0373","","","0.0785","0.088","","","","","","1.054","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214655","10.3309","0.0009","45.937","0.004","13.5763","0.0008","90","","129.394","0.004","90","","4979.1","0.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[μ~2~-2,5-Dimercapto-1,3,4-thiadiazole(2-)-κ^2^N:N]bis(μ~2~- methanolato)-μ~3~-oxido-tris[bis(4-fluorobenzyl)tin(IV)] benzene hemisolvate","","- C49 H51 F6 N2 O3 S3 Sn3 -","- C49 H45 F6 N2 O3 S3 Sn3 -","- C196 H180 F24 N8 O12 S12 Sn12 -","4","1","GG2020","Jun-Hong Zhang; Chun-Lin Ma; Ru-Fen Zhang","[μ~2~-2,5-Dimercapto-1,3,4-thiadiazole(2‒)-κ^2^<i>N</i>:<i>N</i>]bis(μ~2~-methanolato)-μ~3~-oxido-tris[bis(4-fluorobenzyl)tin(IV)] benzene hemisolvate","Acta Crystallographica Section E","2007","63","8","m2161","m2161","10.1107/S1600536807033715","","","0.71073","MoKα","","0.0667","0.055","","","0.1748","0.1843","","","","","","1.015","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214656","11.96","0.004","9.448","0.003","18.756","0.006","90","","108.592","0.004","90","","2008.8","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[diaquacadmium(II)]-bis[μ-4-<i>tert</i>-butyl-2,6-bis(1,2,4- triazol-1-ylmethyl)phenol]] dinitrate dihydrate]","","- C32 H48 Cd N14 O12 -","- C32 H48 Cd N14 O12 -","- C64 H96 Cd2 N28 O24 -","2","0.5","GG2024","Chu, Zhao-Lian; Xu, Gang; Huang, Wei; Gou, Shao-Hua","<i>catena</i>-Poly[[[diaquacadmium(II)]-bis[μ-4-<i>tert</i>-butyl-2,6-bis(1,2,4-triazol-1-ylmethyl)phenol]] dinitrate dihydrate]","Acta Crystallographica Section E","2007","63","8","m2155","m2156","10.1107/S1600536807033685","","","0.71073","MoKα","","0.06","0.044","","","0.102","0.1067","","","","","","1.075","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214657","11.9028","0.0014","8.7768","0.0009","13.7394","0.0015","90","","110.144","0.004","90","","1347.5","0.3","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","4-phenylsulfonyloxy acetanilide","N-[4-(Acetylamino)phenyl]benzenesulfonate","","- C14 H13 N O4 S -","- C14 H13 N O4 S -","- C56 H52 N4 O16 S4 -","4","1","GG2025","Vembu, Nagarajan; Sparkes, Hazel A.; Howard, Judith A. K.","4-(Acetylamino)phenyl benzenesulfonate","Acta Crystallographica Section E","2007","63","8","o3544","o3544","10.1107/S1600536807034332","","","0.71073","MoKα","","0.0486","0.0378","","","0.0979","0.1036","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214658","11.891","0.0011","10.8909","0.0012","20.958","0.002","90","","90","","90","","2714.1","0.5","120","2","120","2","","","","","","","","4","P b c n","-P 2n 2ab","60","2-naphthyl benzenesulfonate","2-Napthyl benzenesulfonate","","- C16 H12 O3 S -","- C16 H12 O3 S -","- C128 H96 O24 S8 -","8","1","GG2026","Vembu, Nagarajan; Shafna, Karattu Chali; Sparkes, Hazel A.; Howard, Judith A. K.","2-Naphthyl benzenesulfonate","Acta Crystallographica Section E","2007","63","8","o3545","o3545","10.1107/S160053680703437X","","","0.71073","MoKα","","0.114","0.0474","","","0.1014","0.1272","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214659","15.64","0.007","10.886","0.007","15.711","0.007","90","","115.63","0.03","90","","2412","2","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetrakis(pyridine-κN)palladium(II) bis(tetrafluoridoborate)","","- C20 H20 B2 F8 N4 Pd -","- C20 H20 B2 F8 N4 Pd -","- C80 H80 B8 F32 N16 Pd4 -","4","0.5","GG2027","De León, Antonio; Pons, Josefina; Solans, Xavier; Font-Bardia, Mercè","Tetrakis(pyridine-κ<i>N</i>)palladium(II) bis(tetrafluoridoborate)","Acta Crystallographica Section E","2007","63","8","m2164","m2164","10.1107/S1600536807034411","","","0.71073","MoKα","","0.1113","0.046","","","0.1252","0.1544","","","","","","0.966","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214660","5.5365","0.0006","10.1199","0.0012","14.2916","0.0016","87.182","0.002","88.023","0.002","80.578","0.002","788.7","0.15","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","Doxofylline‒acrylic acid (1/1)","","- C14 H18 N4 O6 -","- C14 H18 N4 O6 -","- C28 H36 N8 O12 -","2","1","GG2028","Wen-Jie Feng; Xin-Jü Ma; Zhan Shu; Zhi-Min Jin","Doxofylline‒acrylic acid (1/1)","Acta Crystallographica Section E","2007","63","8","o3609","o3609","10.1107/S1600536807035842","","","0.71073","MoKα","","0.0772","0.0693","","","0.1628","0.1686","","","","","","1.153","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214661","13.546","0.004","33.654","0.011","3.7035","0.0012","90","","90","","90","","1688.3","0.9","294","2","294","2","","","","","","","","4","P n n a","-P 2a 2bc","52","","Isophthalic acid‒3,6-bis(2-pyrazinyl)-1,4-dihydro-1,2,4,5-tetrazine (1/1)","","- C18 H14 N8 O4 -","- C18 H14 N8 O4 -","- C72 H56 N32 O16 -","4","0.5","GG3096","Fu, Xiao-Juan; Zhang, Zhi-Hui; Du, Miao","Isophthalic acid‒3,6-bis(2-pyrazinyl)-1,4-dihydro-1,2,4,5-tetrazine (1/1)","Acta Crystallographica Section E","2007","63","8","o3530","o3530","10.1107/S1600536807034423","","","0.71073","MoKα","","0.0833","0.0406","","","0.0899","0.1061","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214662","18.4421","0.0006","7.2454","0.0002","13.1885","0.0003","90","","102.254","0.003","90","","1722.1","0.09","291","0.3","291","0.3","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,5-Bis[(2-thienyl)methyleneamino]naphthalene","","- C20 H14 N2 S2 -","- C20 H14 N2 S2 -","- C80 H56 N8 S8 -","4","0.5","GG3103","Małecki, Jan Grzegorz; Kruszynski, Rafal; Jarosz, Grzegorz","1,5-Bis[(2-thienyl)methyleneamino]naphthalene","Acta Crystallographica Section E","2007","63","8","o3368","o3369","10.1107/S1600536807031406","","","0.71073","MoKα","","0.0365","0.0311","","","0.0888","0.0936","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214663","9.5632","0.0019","9.3715","0.0019","16.089","0.003","90","","90","","90","","1441.9","0.5","295","2","295","2","","","","","","","","2","P c a 21","P 2c -2ac","29","","5,11,11-Trimethyl-11<i>H</i>-benzo[<i>a</i>]fluorene","","- C20 H18 -","- C20 H18 -","- C80 H72 -","4","1","GK2079","Li, Shu-Hong; Xu, Cai-Hong","5,11,11-Trimethyl-11<i>H</i>-benzo[<i>a</i>]fluorene","Acta Crystallographica Section E","2007","63","8","o3658","o3658","10.1107/S1600536807034320","","","0.71073","MoKα","","0.0557","0.0381","","","0.0638","0.0672","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214664","15.271","0.003","11.245","0.002","10.727","0.002","90","","108.321","0.003","90","","1748.7","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(4-Bromophenyl)-5-(4-fluorophenyl)-1-phenyl-4,5-dihydro-1H-pyrazole","","- C21 H16 Br F N2 -","- C21 H16 Br F N2 -","- C84 H64 Br4 F4 N8 -","4","1","GK2085","Hong-Li","3-(4-Bromophenyl)-5-(4-fluorophenyl)-1-phenyl-4,5-dihydro-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2007","63","8","o3499","o3499","10.1107/S1600536807033120","","","0.71073","MoKα","","0.0777","0.0435","","","0.0922","0.1069","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214665","7.9096","0.0006","11.2766","0.0008","14.1886","0.001","77.291","0.006","85.053","0.006","89.609","0.006","1229.83","0.16","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","(E)-2-Methyl-6-[(p-tolylimino)methyl]phenol","","- C15 H15 N O -","- C15 H15 N O -","- C60 H60 N4 O4 -","4","2","GW2013","Bingöl, Yelda; Erşahi̇n, Ferda; Aǧar, Erbi̇l; Isık, Şamil","(<i>E</i>)-2-Methyl-6-[(<i>p</i>-tolylimino)methyl]phenol","Acta Crystallographica Section E","2007","63","8","o3539","o3539","10.1107/S1600536807032308","","","0.71073","MoKα","","0.072","0.041","","","0.107","0.117","","","","","","0.921","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214666","12.877","0.003","4.658","0.003","15.978","0.002","90","","99.43","0.03","90","","945.4","0.7","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Amino-3-carboxypyridinium dihydrogenphosphate","","- C6 H9 N2 O6 P -","- C6 H9 N2 O6 P -","- C24 H36 N8 O24 P4 -","4","1","GW2015","Samah Akriche; Mohamed Rzaigui","2-Amino-3-carboxypyridinium dihydrogenphosphate","Acta Crystallographica Section E","2007","63","8","o3460","o3460","10.1107/S1600536807032862","","","0.71073","MoKα","","0.045","0.0316","","","0.08","0.0864","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214667","9.498","0.0009","15.6393","0.0011","7.8578","0.0007","90","","90","","90","","1167.21","0.17","100","","100","","","","","","","","","4","P c a 21","P 2c -2ac","29","","2-Chloro-1-(3-methyl-3-phenylcyclobutyl)ethanone","","- C13 H15 Cl O -","- C13 H15 Cl O -","- C52 H60 Cl4 O4 -","4","1","GW2017","Dinçer, Muharrem; Özdemir, Namık; Yılmaz, İbrahim; Büyükgüngör, Orhan","2-Chloro-1-(3-methyl-3-phenylcyclobutyl)ethanone","Acta Crystallographica Section E","2007","63","8","o3489","o3489","10.1107/S160053680703317X","","","0.71073","MoKα","","0.0352","0.0299","","","0.0696","0.0713","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214668","36.0919","0.0007","13.4372","0.0001","8.819","0.0002","90","","104.099","0.001","90","","4148.15","0.13","296","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5-(4,5-Dimethoxy-2-nitrophenyl)-1,3-diphenyl-2-pyrazoline","","- C23 H21 N3 O4 -","- C23 H21 N3 O4 -","- C184 H168 N24 O32 -","8","1","HB2376","Kumaradhas, P.; David Stephen, A.; Satheesh Rai; Balakrishna Kalluraya; Reji Thomas","5-(4,5-Dimethoxy-2-nitrophenyl)-1,3-diphenyl-2-pyrazoline","Acta Crystallographica Section E","2007","63","8","o3402","o3402","10.1107/S1600536807030504","","","0.71073","MoKα","","","0.0396","","","","0.1135","","","","","","0.987","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214669","8.1475","0.0008","10.3588","0.001","14.8263","0.0015","86.62","0.002","78.262","0.002","68.395","0.002","1138.9","0.2","296","2","","","","","","","","","","5","P -1","-P 1","2","","Ethyl 4-(4,5-dimethoxy-2-nitrophenyl)-6-methyl-1-phenyl-2-thioxo-1,2,3,4-\ tetrahydropyrimidine-5-carboxylate","","- C22 H23 N3 O6 S -","- C22 H23 N3 O6 S -","- C44 H46 N6 O12 S2 -","2","1","HB2430","Kumaradhas, P.; David Stephen, A.; Sathish Roy; Balakrishna Kalluraya; Sridar, B.","Ethyl 4-(4,5-dimethoxy-2-nitrophenyl)-6-methyl-1-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","8","o3403","o3403","10.1107/S1600536807031534","","","0.71073","MoKα","","","0.0439","","","","0.1302","","","","","","1.086","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214670","7.7587","0.0016","7.969","0.0016","13.986","0.003","102.51","0.03","101.86","0.02","94.29","0.03","819.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tetra-μ-acetato-κ^8^O:O'-bis{[2-(phenylsulfanylmethyl)pyridine-κN]copper(II)}","","- C32 H34 Cu2 N2 O8 S2 -","- C32 H34 Cu2 N2 O8 S2 -","- C32 H34 Cu2 N2 O8 S2 -","1","0.5","HB2435","Wang, Hui; Wang, Hua; Xie, Chuang; Zhou, Li-Na; Chen, Wei","Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis{[2-(phenylsulfanylmethyl)pyridine-κ<i>N</i>]copper(II)}","Acta Crystallographica Section E","2007","63","8","m2172","m2172","10.1107/S1600536807026189","","","0.71073","MoKα","","0.0299","0.0282","","","0.0768","0.0779","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214671","9.4298","0.001","11.782","0.0012","12.8118","0.0013","65.494","0.002","83.088","0.002","86.735","0.002","1285.7","0.2","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","Bis[tris(oxamide dioxime-κ^2^<i>N</i>,<i>N</i>')cobalt(III)] oxalate bis(sulfate) dodecahydrate","","- C14 H60 Co2 N24 O36 S2 -","- C14 H52 Co2 N24 O36 S2 -","- C14 H52 Co2 N24 O36 S2 -","1","0.5","HB2446","Belombe, Michel M.; Nenwa, Justin; Gouet Bebga; Fokwa, Boniface P. T.; Dronskowski, Richard","Bis[tris(oxamide dioxime-κ^2^<i>N</i>,<i>N</i>')cobalt(III)] oxalate bis(sulfate) dodecahydrate","Acta Crystallographica Section E","2007","63","8","m2037","m2038","10.1107/S1600536807031169","","","0.71073","MoKα","","0.0986","0.0622","","","0.1383","0.1579","","","","","","1.1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214672","7.545","0.004","9.24","0.005","11.055","0.006","103.598","0.008","101.898","0.008","105.876","0.008","689.7","0.6","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","Isopropyl 2-(3-nitrobenzylidene)acetoacetate","","- C14 H15 N O5 -","- C14 H15 N O5 -","- C28 H30 N2 O10 -","2","1","HB2448","Peng-Fei Deng; Guo-Bing Chen; Ya-Qing Feng; Jian Song","Isopropyl 2-(3-nitrobenzylidene)acetoacetate","Acta Crystallographica Section E","2007","63","8","o3532","o3532","10.1107/S1600536807030322","","","0.71073","MoKα","","0.1245","0.0585","","","0.1255","0.1556","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214673","6.1519","0.0007","12.029","0.002","23.655","0.004","90","","90","","90","","1750.5","0.5","291","1","291","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(3R,3aS,6R,6aR)-tert-Butyl N-(6-chloro-2-oxo-6a-phenylperhydrofuro[3,2-b]furan-3-yl)carbamate","","- C17 H20 Cl N O5 -","- C17 H20 Cl N O5 -","- C68 H80 Cl4 N4 O20 -","4","1","HB2449","Erdsack, Jörg; Schürmann, Markus; Preut, Hans; Krause, Norbert","(3<i>R</i>,3a<i>S</i>,6<i>R</i>,6a<i>R</i>)-<i>tert</i>-Butyl <i>N</i>-(6-chloro-2-oxo-6a-phenylperhydrofuro[3,2-<i>b</i>]furan-3-yl)carbamate","Acta Crystallographica Section E","2007","63","8","o3371","o3371","10.1107/S1600536807031388","","","0.71073","MoKα","","0.1433","0.0285","","","0.0552","0.0785","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214674","7.674","0.003","9.586","0.003","11.59","0.004","66.904","0.013","76.782","0.014","71.684","0.013","739.1","0.5","291","1","291","1","","","","","","","","6","P -1","-P 1","2","","rac-N-(6a-Butyl-6-chloro-2-oxoperhydrofuro[3,2-b]furan-3-yl)-2,2,2- trifluoroacetamide","","- C12 H15 Cl F3 N O4 -","- C12 H15 Cl F3 N O4 -","- C24 H30 Cl2 F6 N2 O8 -","2","1","HB2450","Erdsack, Jörg; Schürmann, Markus; Preut, Hans; Krause, Norbert","<i>rac</i>-<i>N</i>-(6a-Butyl-6-chloro-2-oxoperhydrofuro[3,2-<i>b</i>]furan-3-yl)-2,2,2-trifluoroacetamide","Acta Crystallographica Section E","2007","63","8","o3372","o3372","10.1107/S1600536807031376","","","0.71073","MoKα","","0.1384","0.0313","","","0.0571","0.079","","","","","","0.905","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214675","8.072","0.002","8.493","0.003","8.833","0.002","74.34","0.03","87.26","0.02","71.85","0.04","553.6","0.3","297","2","297","2","","","","","","","","4","P -1","-P 1","2","","Bis[2-(2-pyridylamino)pyridinium] squarate dihydrate","","- C24 H24 N6 O6 -","- C24 H24 N6 O6 -","- C24 H24 N6 O6 -","1","0.5","HB2459","Ibrahim Uçar; Ahmet Bulut; Orhan Büyükgüngör","Bis[2-(2-pyridylamino)pyridinium] squarate dihydrate","Acta Crystallographica Section E","2007","63","8","o3377","o3377","10.1107/S160053680703139X","","","0.71069","MoKα","","0.0577","0.0435","","","0.1159","0.1224","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214676","22.94","0.003","11.055","0.001","3.805","0.0004","90","","90","","90","","964.95","0.18","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","","<i>catena</i>-Poly[copper(I)-μ-[2-(3-pyridyl)benzimidazolato- κ^2^<i>N</i>:<i>N</i>']]","","- C12 H8 Cu N3 -","- C12 H8 Cu N3 -","- C48 H32 Cu4 N12 -","4","1","HB2460","Huang, Xiao-Chun; Luo, Wei; Shen, Yu-Feng; Ng, Seik Weng","<i>catena</i>-Poly[copper(I)-μ-[2-(3-pyridyl)benzimidazolato-κ^2^<i>N</i>:<i>N</i>']]","Acta Crystallographica Section E","2007","63","8","m2041","m2041","10.1107/S1600536807031455","","","0.71073","MoKα","","0.0401","0.0318","","","0.0818","0.0867","","","","","","1.053","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2214677","7.802","0.001","12.55","0.001","9.935","0.001","90","","95.75","0.001","90","","967.89","0.18","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diaquabis[N,N-dimethyl-N'-ethylethylenediamine-κ^2^N,N']nickel(II) dichloride","","- C12 H36 Cl2 N4 Ni O2 -","- C12 H36 Cl2 N4 Ni O2 -","- C24 H72 Cl4 N8 Ni2 O4 -","2","0.5","HB2461","Liang, Yu-Ning; Chen, Zi-Lu; Zhang, Yu-Zhen; Ng, Seik Weng","Diaquabis(<i>N</i>-ethyl-<i>N</i>',<i>N</i>'-dimethylethylenediamine-κ^2^<i>N</i>,<i>N</i>')nickel(II) dichloride","Acta Crystallographica Section E","2007","63","8","m2042","m2042","10.1107/S1600536807031467","","","0.71073","MoKα","","0.0378","0.0295","","","0.0734","0.0779","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214678","12.6642","0.0008","13.1613","0.0008","15.9097","0.0009","90","","90","","90","","2651.8","0.3","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(<i>R</i>)-3,3'-Diphenyl-5,6,7,8,5',6',7',8'-octahydro-1,1'-binaphthyl- 2,2'-diyl chlorophosphate","","- C32 H28 Cl O3 P -","- C32 H28 Cl O3 P -","- C128 H112 Cl4 O12 P4 -","4","1","HB2462","Li, You-Ping; Ng, Seik Weng","(<i>R</i>)-3,3'-Diphenyl-5,6,7,8,5',6',7',8'-octahydro-1,1'-binaphthyl-2,2'-diyl chlorophosphate","Acta Crystallographica Section E","2007","63","8","o3359","o3359","10.1107/S1600536807031479","","","0.71073","MoKα","","0.0487","0.0365","","","0.0921","0.0989","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2214679","13.978","0.003","7.5376","0.0015","12.176","0.002","90","","115.34","0.03","90","","1159.4","0.5","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Nitro-N-(4-pyridyl)benzenesulfonamide","","- C11 H9 N3 O4 S -","- C11 H9 N3 O4 S -","- C44 H36 N12 O16 S4 -","4","1","HB2464","Yu, Hai-Jun; Li, Jiang-Sheng","4-Nitro-<i>N</i>-(4-pyridyl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","8","o3399","o3399","10.1107/S1600536807032096","","","0.71073","MoKα","","0.0608","0.0458","","","0.1285","0.1757","","","","","","1.179","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2214680","12.1676","0.0002","9.305","0.0002","17.9081","0.0003","90","","95.4236","0.0011","90","","2018.47","0.06","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-N-(3-oxo-1-thia-4-azaspiro[4.5]dec-4-yl)-2,2-diphenylacetamide","","- C22 H24 N2 O3 S -","- C22 H24 N2 O3 S -","- C88 H96 N8 O12 S4 -","4","1","HB2465","Mehmet Akkurt; Selvi Karaca; Ertan Şahin; Özlen Güzel; Aydın Salman; Eser İlhan","2-Hydroxy-<i>N</i>-(3-oxo-1-thia-4-azaspiro[4.5]dec-4-yl)-2,2-diphenylacetamide","Acta Crystallographica Section E","2007","63","8","o3379","o3380","10.1107/S1600536807031650","","","0.7107","MoKα","","0.0935","0.0556","","","0.1439","0.1735","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214681","9.5383","0.0013","10.259","0.003","11.413","0.01","86.58","0.05","82.04","0.02","81.67","0.05","1093.5","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(Dicyclohexylamino)(phenyl)(piperdin-1-yl)phosphine","","- C23 H37 N2 P -","- C23 H37 N2 P -","- C46 H74 N4 P2 -","2","1","HB2466","T. Arun Luiz; Adinarayana Doddi; Babu Varghese; M. N. Sudheendra Rao","(Dicyclohexylamino)(phenyl)(piperidin-1-yl)phosphine","Acta Crystallographica Section E","2007","63","8","o3449","o3449","10.1107/S1600536807032084","","","0.71073","MoKα","","0.1008","0.0603","","","0.2065","0.2208","","","","","","1.257","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214682","10.5574","0.0009","12.0375","0.0012","13.557","0.0012","111.105","0.007","101.46","0.008","101.413","0.007","1505.3","0.3","297","2","297","2","","","","","","","","3","P -1","-P 1","2","","25,27-Bis(acryloyloxy)-26,28-dihydroxycalix[4]arene toluene hemisolvate","","- C37.5 H32 O6 -","- C38 H33 O6 -","- C76 H66 O12 -","2","1","HB2467","Sevil Özkinali; Ibrahim Uçar; Hasan Kocaokutgen; Ahmet Bulut","25,27-Bis(acryloyloxy)-26,28-dihydroxycalix[4]arene toluene hemisolvate","Acta Crystallographica Section E","2007","63","8","o3378","o3378","10.1107/S1600536807031777","","","0.71069","MoKα","","0.1497","0.0669","","","0.1528","0.1897","","","","","","0.984","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214683","11.147","0.003","11.5","0.003","11.832","0.003","111.722","0.004","92.011","0.004","102.066","0.004","1367.3","0.6","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis[1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-4-oxo-1,4- dihydroquinoline-3-carboxylato-κ^2^O^3^,O^4^]manganese(II) benzene-1,4-dicarboxylate tetradecahydrate","","- C42 H76 F2 Mn N6 O26 -","- C42 H76 F2 Mn N6 O26 -","- C42 H76 F2 Mn N6 O26 -","1","0.5","HB2468","Zhe An; Wei Qi; Jing Huang","Diaquabis[1-ethyl-6-fluoro-7-(4-methylpiperazin-4-ium-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylato-κ^2^<i>O</i>^3^,<i>O</i>^4^]manganese(II) benzene-1,4-dicarboxylate tetradecahydrate","Acta Crystallographica Section E","2007","63","8","m2084","m2085","10.1107/S1600536807032072","","","0.71073","MoKα","","0.0426","0.0364","","","0.0932","0.0979","","","","","","1.026","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2214684","15.8896","0.0011","26.482","0.002","10.3522","0.0007","90","","95.047","0.006","90","","4339.2","0.5","297","2","297","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","25,27-Bis(acryloyloxy)-5,11,17,23-tetra-tert-butyl-26,28-dihydroxycalix[4]arene","","- C50 H60 O6 -","- C50 H60 O6 -","- C200 H240 O24 -","4","0.5","HB2469","Sevil Özkinali; Ibrahim Uçar; Hasan Kocaokutgen; Ahmet Bulut","25,27-Bis(acryloyloxy)-5,11,17,23-tetra-<i>tert</i>-butyl-26,28-dihydroxycalix[4]arene","Acta Crystallographica Section E","2007","63","8","o3396","o3396","10.1107/S1600536807031996","","","0.71069","MoKα","","0.1399","0.0584","","","0.1249","0.1528","","","","","","0.885","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214685","7.3738","0.0016","9.671","0.002","14.689","0.003","89.128","0.004","85.961","0.004","87.693","0.004","1044","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N'-(4-Methoxybenzylidene)methoxyformohydrazide","","- C10 H12 N2 O3 -","- C10 H12 N2 O3 -","- C40 H48 N8 O12 -","4","2","HB2470","Shang, Zhen-Hua; Zhang, Hui-Li; Ding, Yue","<i>N</i>'-(4-Methoxybenzylidene)methoxyformohydrazide","Acta Crystallographica Section E","2007","63","8","o3394","o3394","10.1107/S160053680703200X","","","0.71073","MoKα","","0.0973","0.047","","","0.1151","0.1442","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214686","9.86","0.01","12.1","0.01","14.6","0.01","90","","100.63","0.03","90","","1712","3","123.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(4-Aminobenzoato-κ^2^<i>O</i>,<i>O</i>')chlorido(di-2-pyridylamine-\ κ^2^<i>N</i>,<i>N</i>')copper(II) monohydrat","","- C17 H17 Cl Cu N4 O3 -","- C17 H17 Cl Cu N4 O3 -","- C68 H68 Cl4 Cu4 N16 O12 -","4","1","HB2471","Okabe, Nobuo; Tsuji, Akio; Yodoshi, Masahiro","(4-Aminobenzoato-κ^2^<i>O</i>,<i>O</i>')chlorido(di-2-pyridylamine-κ^2^<i>N</i>,<i>N</i>')copper(II) monohydrate","Acta Crystallographica Section E","2007","63","8","m2108","m2109","10.1107/S1600536807032837","","","0.7107","MoKα","","","0.021","","","","0.062","","","","","","1.073","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2214687","13.517","0.0002","8.5778","0.0001","14.4551","0.0002","90","","114.619","0.001","90","","1523.66","0.04","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-{[3-(1<i>H</i>-indol-3-yl)propenyl]methylammonio}phenolate","","- C19 H20 N2 O -","- C19 H20 N2 O -","- C76 H80 N8 O4 -","4","1","HB2472","Ali, Hapipah M.; Emmy Maryati, Omar; Ng, Seik Weng","Zwitterionic 2-{[3-(1<i>H</i>-indol-3-yl)propenyl]methylammonio}phenolate","Acta Crystallographica Section E","2007","63","8","o3458","o3458","10.1107/S1600536807032643","","","0.71073","MoKα","","0.0564","0.0422","","","0.1113","0.1255","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214688","14.035","0.0002","14.4517","0.0002","8.1372","0.0001","90","","102.193","0.001","90","","1613.23","0.04","293","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","2-(1<i>H</i>-Indol-3-yl)-2'-(1<i>H</i>-indol-3-ylmethylene)acetohydrazide","","- C19 H16 N4 O -","- C19 H16 N4 O -","- C76 H64 N16 O4 -","4","1","HB2473","Ali, Hapipah M.; Nazzatush Shimar, Jamaludin; Ng, Seik Weng","2-(1<i>H</i>-Indol-3-yl)-2'-(1<i>H</i>-indol-3-ylmethylene)acetohydrazide","Acta Crystallographica Section E","2007","63","8","o3459","o3459","10.1107/S1600536807032655","","","0.71073","MoKα","","0.0368","0.0337","","","0.0902","0.0997","","","","","","1.171","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214689","12.5065","0.0009","15.074","0.001","28.223","0.002","90","","90","","90","","5320.7","0.6","141.2","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N,N'-(Pyrene-1,8-diyl)bis(2,3-dimethoxybenzaldehyde)","","- C34 H28 N2 O6 -","- C34 H28 N2 O6 -","- C272 H224 N16 O48 -","8","2","HB2475","Davenport, Timothy C.; Gleason, Arianna E.; Liska, Peter J.; Mugridge, Jeffrey S.; Pluth, Michael D.","<i>N</i>,<i>N</i>'-(Pyrene-1,8-diyl)bis(2,3-dimethoxybenzaldehyde)","Acta Crystallographica Section E","2007","63","8","o3621","o3621","10.1107/S1600536807035751","","","0.7107","MoKα","","0.0486","0.0486","","0.0527","","0.0527","","","","","","2.161","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214690","8.9902","0.0002","13.2497","0.0002","15.6671","0.0002","69.277","0.001","77.067","0.001","87.328","0.001","1700.12","0.05","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","(Adamantane-1,3-dicarboxylato-κO)aquabis(1,10-phenanthroline-\ κ^2^<i>N</i>,<i>N</i>')cobalt(II) tetrahydrate","","- C36 H40 Co N4 O9 -","- C36 H40 Co N4 O9 -","- C72 H80 Co2 N8 O18 -","2","1","HB2477","Zhao, Guo-Liang; Shi, Xia; Ng, Seik Weng","(Adamantane-1,3-dicarboxylato-κ<i>O</i>)aquabis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II) tetrahydrate","Acta Crystallographica Section E","2007","63","8","m2150","m2150","10.1107/S1600536807033752","","","0.71073","MoKα","","0.0565","0.0496","","","0.1591","0.1665","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214691","11.1512","0.0011","19.243","0.002","6.9905","0.0008","90","","105.076","0.006","90","","1448.4","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2'-(2-Methyl-1<i>H</i>-indol-3-ylmethylene)benzenesulfonohydrazide","","- C16 H15 N3 O2 S -","- C16 H15 N3 O2 S -","- C64 H60 N12 O8 S4 -","4","1","HB2478","Ali, Hapipah M.; Yusnita, Juahir; Wan Jefrey, Basirun; Ng, Seik Weng","2'-(2-Methyl-1<i>H</i>-indol-3-ylmethylene)benzenesulfonohydrazide","Acta Crystallographica Section E","2007","63","8","o3513","o3513","10.1107/S1600536807033740","","","0.71073","MoKα","","0.1362","0.0706","","","0.1579","0.2125","","","","","","1.145","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214692","11.0217","0.0012","8.4199","0.0009","17.2294","0.0019","90","","108.354","0.002","90","","1517.6","0.3","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(4-Oxo-3,4-dihydroquinazolin-3-yl)methyl piperidine-1-carbodithioate","","- C15 H17 N3 O S2 -","- C15 H17 N3 O S2 -","- C60 H68 N12 O4 S8 -","4","1","HB2479","Nengfang She; Wei Huang","(4-Oxo-3,4-dihydroquinazolin-3-yl)methyl piperidine-1-carbodithioate","Acta Crystallographica Section E","2007","63","8","o3617","o3617","10.1107/S1600536807036203","","","0.71073","MoKα","","0.0599","0.0483","","","0.1184","0.1249","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214693","10.002","0.0011","22.806","0.003","17.4859","0.0019","90","","97.474","0.002","90","","3954.7","0.8","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dichloridobis{2-[(triphenylmethyl)amino]pyridine-κN}zinc(II)","","- C48 H40 Cl2 N4 Zn -","- C48 H40 Cl2 N4 Zn -","- C192 H160 Cl8 N16 Zn4 -","4","1","HB2480","Guang-Ning Zhang; Yong Fang; Cui-Ying Huang; Wan-Sheng You","Dichloridobis{2-[(triphenylmethyl)amino]pyridine-κ<i>N</i>}zinc(II)","Acta Crystallographica Section E","2007","63","8","m2247","m2247","10.1107/S1600536807036380","","","0.71073","MoKα","","0.081","0.0409","","","0.0792","0.0928","","","","","","0.984","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214694","25.947","0.004","12.1604","0.0017","4.9456","0.0007","90","","90","","90","","1560.5","0.4","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Chlorido(11-methyldipyrido[3,2-a:2',3'-c]phenazine-κ^2^N^4^,N^5^)copper(I)","","- C19 H11 Cl Cu N4 -","- C19 H11 Cl Cu N4 -","- C76 H44 Cl4 Cu4 N16 -","4","0.5","HB2482","Chuan-Bi Li; Shi Zhou; Guang-Gang Gao; Bo Liu","Chlorido(11-methyldipyrido[3,2-<i>a</i>:2',3'-<i>c</i>]phenazine-κ^2^<i>N</i>^4^,<i>N</i>^5^)copper(I)","Acta Crystallographica Section E","2007","63","8","m2229","m2229","10.1107/S1600536807036173","","","0.71073","MoKα","","0.1181","0.0566","","","0.1642","0.2026","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214695","8.6504","0.0008","8.4789","0.0008","22.126","0.002","90","","93.119","0.002","90","","1620.4","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2E,5E)-2,5-Bis(2-bromobenzylidene)cyclopentanone","","- C19 H14 Br2 O -","- C19 H14 Br2 O -","- C76 H56 Br8 O4 -","4","1","HB2485","Guang Liang; Ji-Lai Tian; Cheng-Guang Zhao; Xiao-Kun Li","(2<i>E</i>,5<i>E</i>)-2,5-Bis(2-bromobenzylidene)cyclopentanone","Acta Crystallographica Section E","2007","63","8","o3630","o3630","10.1107/S1600536807036185","","","0.71073","MoKα","","0.0485","0.0369","","","0.0899","0.0953","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214696","11.0449","0.0008","9.1047","0.0004","15.775","0.001","90","","118.19","0.005","90","","1398.18","0.16","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-2-[1-(2,4-Dimethoxyphenylimino)ethyl]phenol","","- C16 H17 N O3 -","- C16 H17 N O3 -","- C64 H68 N4 O12 -","4","1","HB2486","Mehmet Akkurt; Selvi Karaca; Ali Asghar Jarrahpour; Shadab Rezaei; Orhan Büyükgüngör","(<i>E</i>)-2-[1-(2,4-Dimethoxyphenylimino)ethyl]phenol","Acta Crystallographica Section E","2007","63","8","o3597","o3597","10.1107/S1600536807035799","","","0.71073","MoKα","","0.0515","0.0376","","","0.0937","0.1003","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214697","8.396","0.002","5.99","0.002","14.012","0.004","90","","99.242","0.007","90","","695.5","0.3","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","6-aminophthalide","6-Amino-3H-isobenzofuran-1-one","","- C8 H7 N O2 -","- C8 H7 N O2 -","- C32 H28 N4 O8 -","4","1","HB2488","Wang, Junyan; Johnson, Dave M.; Tiekink, Edward R. T.","6-Amino-3<i>H</i>-isobenzofuran-1-one","Acta Crystallographica Section E","2007","63","8","o3634","o3634","10.1107/S1600536807035763","","","0.7107","MoKα","","0.044","0.042","","","0.104","0.105","","","","","","1.13","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214698","8.211","0.004","11.182","0.006","12.2","0.006","93.69","0.008","107.874","0.007","109.841","0.008","984.9","0.9","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","(2-Methoxy-5-methylphenyl)(4-methoxy-2-methylphenyl)iodonium trifluoroacetate","","- C18 H18 F3 I O4 -","- C18 H18 F3 I O4 -","- C36 H36 F6 I2 O8 -","2","1","HB2492","Liu, Chun-Yan; Li, Hui","(2-Methoxy-5-methylphenyl)(4-methoxy-2-methylphenyl)iodonium trifluoroacetate","Acta Crystallographica Section E","2007","63","8","o3647","o3647","10.1107/S1600536807036379","","","0.71073","MoKα","","0.0885","0.0556","","","0.1449","0.1686","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214699","8.9056","0.0009","11.4712","0.001","12.5918","0.0011","90","","106.484","0.008","90","","1233.5","0.2","290","2","290","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","poly[bis(μ-4,4'-bipyridine)tetra-μ-cyanido-copper(II)disilver(I)]","","- C24 H16 Ag2 Cu N8 -","- C24 H16 Ag2 Cu N8 -","- C48 H32 Ag4 Cu2 N16 -","2","0.5","HG2236","Maher, John; Sykora, Richard E.","Jahn‒Teller distorted copper(II) in poly[bis(μ-4,4'-bipyridine)tetra-μ-cyanido-copper(II)disilver(I)]","Acta Crystallographica Section E","2007","63","8","m2053","m2053","10.1107/S1600536807031108","","","0.71073","MoKα","","0.0316","0.0245","","","0.0628","0.0653","","","","","","1.105","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214700","17.702","0.0019","14.3903","0.0016","9.5678","0.0011","90","","91.431","0.001","90","","2436.5","0.5","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(benzoato-κ^2^<i>O</i>,<i>O</i>')(2,9-dimethyl-1,10-phenanthroline-\ κ^2^<i>N</i>,<i>N</i>')manganese(II)","","- C28 H22 Mn N2 O4 -","- C28 H22 Mn N2 O4 -","- C112 H88 Mn4 N8 O16 -","4","0.5","HG2237","Pei-Zheng Zhao; Xiao-Peng Xuan; Jian-Ge Wang","Bis(benzoato-κ^2^<i>O</i>,<i>O</i>')(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)","Acta Crystallographica Section E","2007","63","8","m2127","m2127","10.1107/S1600536807033302","","","0.71073","MoKα","","0.0404","0.0326","","","0.0876","0.0941","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214701","6.1539","0.0011","11.3456","0.0019","10.6126","0.0018","90","","105.845","0.002","90","","712.8","0.2","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis[5-(pyrazin-2-yl)-5H-tetrazolato-κ<i>N</i>^1^]nickel(II)","","- C10 H10 N12 Ni O2 -","- C10 H10 N12 Ni O2 -","- C20 H20 N24 Ni2 O4 -","2","0.5","HG2242","Fan, Sheng-Di; Liu, Ju-Tao","Diaquabis[5-(pyrazin-2-yl)-5<i>H</i>-tetrazolato-κ<i>N</i>^1^]nickel(II)","Acta Crystallographica Section E","2007","63","8","m2034","m2034","10.1107/S160053680703111X","","","0.71073","MoKα","","0.0313","0.0241","","","0.0613","0.0645","","","","","","1.063","","","","has coordinates,has Fobs","194623","2020-10-21","18:00:00",""
"2214702","11.6214","0.0008","13.6313","0.0009","16.4319","0.0012","90","","109.048","0.001","90","","2460.5","0.3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis[μ-bis(diphenylphosphino)methane-κ^2^P:P']digold(I)(Au—Au) dinitrate perdeuteromethanol solvate","","- C52 H44 Au2 D8 N2 O8 P4 -","- C52 H44 Au2 D8 N2 O8 P4 -","- C104 H88 Au4 D16 N4 O16 P8 -","2","0.5","HG2244","Leigh-Anne de Jongh; Christoph E. Strasser; Stephanie Cronje; Helgard G. Raubenheimer","Bis[μ-bis(diphenylphosphino)methane-κ^2^<i>P</i>:<i>P</i>']digold(I)(<i>Au{—</i>Au}) dinitrate perdeuteromethanol solvate","Acta Crystallographica Section E","2007","63","8","m2137","m2138","10.1107/S1600536807030887","","","0.71073","MoKα","","0.0248","0.0218","","","0.0507","0.0518","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214704","14.942","0.005","13.432","0.004","19.734","0.006","90","","108.97","0.006","90","","3746","2","294","2","294","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","Bis[μ-bis(diphenylphosphino)methane-κ^2^<i>P</i>:<i>P</i>'] bis[(2,2'-bipyridine-κ^2^<i>N<i>,<i>N<i>')copper(I)] bis(tetrafluoridoborate) diethyl ether disolvate","","- C78 H80 B2 Cu2 F8 N4 O2 P4 -","- C78 H80 B2 Cu2 F8 N4 O2 P4 -","- C156 H160 B4 Cu4 F16 N8 O4 P8 -","2","0.5","HG2248","Juan Mo; Su-Mei Zhang; Wen-Zhong Ge; Jian-Hua Liu","Bis[μ-bis(diphenylphosphino)methane-κ^2^<i>P</i>:<i>P</i>']bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')copper(I)] bis(tetrafluoridoborate) diethyl ether disolvate","Acta Crystallographica Section E","2007","63","8","m2096","m2096","10.1107/S1600536807032539","","","0.71073","MoKα","","0.0874","0.0447","","","0.1054","0.1318","","","","","","1.043","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214705","11.925","0.002","6.0622","0.0012","14.152","0.002","90","","98.763","0.01","90","","1011.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6,6-Diisopropyl-3,3'-dimethyl-2,2'-azinodiphenol","","- C22 H28 N2 O2 -","- C22 H28 N2 O2 -","- C44 H56 N4 O4 -","2","0.5","HG2250","Butcher, Ray J.; Bendre, Ratna S.; Kuwar, Anil S.","6,6-Diisopropyl-3,3'-dimethyl-2,2'-azinodiphenol","Acta Crystallographica Section E","2007","63","8","o3360","o3360","10.1107/S1600536807031339","","","1.54178","CuKα","","0.0687","0.0587","","","0.1608","0.181","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214706","14.164","0.002","4.6113","0.0008","21.067","0.003","90","","108.14","0.004","90","","1307.6","0.3","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 2-[(E)-(3-formyl-4-hydroxyphenyl)diazenyl]benzoate","","- C15 H12 N2 O4 -","- C15 H12 N2 O4 -","- C60 H48 N8 O16 -","4","1","HG2251","Basu Baul, Tushar S.; Basu, Smita; Tiekink, Edward R. T.","Methyl 2-[(<i>E</i>)-(3-formyl-4-hydroxyphenyl)diazenyl]benzoate","Acta Crystallographica Section E","2007","63","8","o3358","o3358","10.1107/S1600536807031327","","","0.7107","MoKα","","0.048","0.046","","","0.127","0.129","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214707","8.6439","0.0016","13.861","0.003","21.135","0.004","90","","90","","90","","2532.2","0.9","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","{6,6'-diethoxy-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato-\ 1κ^4^<i>O</i>^1^,<i>O</i>^1'^,<i>O</i>^6^,<i>O</i>^6'^:2κ^4^<i>O</i>^1^,\ <i>N</i>,<i>N</i>',<i>O</i>^1'^}trinitrato-1κ^6^<i>O</i>,<i>O</i>'-\ neodymium(III)copper(II))","","- C20 H22 Cu N5 Nd O13 -","- C20 H22 Cu N5 Nd O13 -","- C80 H88 Cu4 N20 Nd4 O52 -","4","1","HG2252","Sui, Yan; Fang, Xiao-Niu; Zhou, Xiao-Chun; Luo, Qiu-Yan; Xu, Ya-Ping","{μ-6,6'-Diethoxy-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}trinitratoneodymium(III)copper(II)","Acta Crystallographica Section E","2007","63","8","m2087","m2088","10.1107/S1600536807032552","","","0.71073","MoKα","","0.0385","0.0252","","","0.0483","0.0506","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214710","8.4504","0.0017","9.4206","0.0019","11.141","0.002","68.94","0.03","85.4","0.03","78.31","0.03","810.5","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","2-[(2-Aminophenylimino)phenylmethyl]-4-bromophenol","","- C19 H15 Br N2 O -","- C19 H15 Br N2 O -","- C38 H30 Br2 N4 O2 -","2","1","HG2255","Yamu Xia; Qi Wang; Jia You","2-[(2-Aminophenylimino)phenylmethyl]-4-bromophenol","Acta Crystallographica Section E","2007","63","8","o3529","o3529","10.1107/S1600536807034228","","","0.71073","MoKα","","0.0541","0.0383","","","0.0916","0.0987","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214712","15.191","0.0006","14.5509","0.0006","15.4249","0.0006","90","","90","","90","","3409.6","0.2","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-[(Z)-(<i>n</i>-Butylamino)(2-furyl)methylene]-3-methyl-1-phenyl- 1H-pyrazol-5(4H)-one","","- C19 H21 N3 O2 -","- C19 H21 N3 O2 -","- C152 H168 N24 O16 -","8","1","HG2259","Heng-Qiang Zhang; Jin-Zhou Li; Yong Zhang; Dan Zhang; Zhan-Hua Su","4-[(<i>Z</i>)-(<i>n</i>-Butylamino)(2-furyl)methylene]-3-methyl-1-phenyl-1<i>H</i>-pyrazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","8","o3536","o3536","10.1107/S1600536807034216","","","0.71073","MoKα","","0.1025","0.0468","","","0.1017","0.1282","","","","","","1.004","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214713","7.526","0.003","11.781","0.004","12.723","0.005","111.701","0.006","99.27","0.006","106.219","0.006","961.2","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diaqua[(<i>Z</i>)-4,4'-ethylenedipyridine N,N'-dioxide-κ<i>O</i>](malonato-κ^2^<i>O</i>:<i>O</i>)copper(II) trihydrate","","- C15 H22 Cu N2 O11 -","- C15 H22 Cu N2 O11 -","- C30 H44 Cu2 N4 O22 -","2","1","HG2260","Montney, Matthew R.; LaDuca, Robert L.","Diaqua[(<i>Z</i>)-4,4'-ethylenedipyridine <i>N</i>,<i>N</i>'-dioxide-κ<i>O</i>](malonato-κ^2^<i>O</i>:<i>O</i>)copper(II) trihydrate","Acta Crystallographica Section E","2007","63","8","m2166","m2166","10.1107/S1600536807034253","","","0.71073","MoKα","","0.0472","0.0373","","","0.1001","0.1057","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214714","6.4725","0.0017","9.003","0.002","27.19","0.007","90","","90","","90","","1584.4","0.7","298","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","5α-androst-2-en-17-one","","- C19 H28 O -","- C19 H28 O -","- C76 H112 O4 -","4","1","HG2261","Datong Zhang; Jun Liu","5α-Androst-2-en-17-one","Acta Crystallographica Section E","2007","63","8","o3645","o3645","10.1107/S1600536807036422","","","0.71073","MoKα","","0.0578","0.0481","","","0.116","0.1217","","","","","","1.087","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214715","6.643","0.005","7.997","0.003","33.23","0.008","90","","90","","90","","1765.3","1.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Desacetylepicaryoptin","Desacetyl epicaryoptin","","- C20 H30 O6 -","- C20 H30 O6 -","- C80 H120 O24 -","4","1","HG2262","S. Soundarya Devi; S. S. Rajan; S. Arvind; G. N. Krishnakumari","Desacetyl epicaryoptin","Acta Crystallographica Section E","2007","63","8","o3646","o3646","10.1107/S1600536807036434","","","0.71073","MoKα","","0.1248","0.0514","","","0.1207","0.1484","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214716","5.844","0.003","15.864","0.007","11.073","0.005","90","","103.3","0.04","90","","999","0.8","299","1","299","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","trans-Azoxybenzene","<i>trans</i>-Diphenyldiazene oxide","","- C12 H10 N2 O -","- C12 H10 N2 O -","- C48 H40 N8 O4 -","4","1","HG2265","González Martínez, Sandra Patricia; Bernès, Sylvain","<i>trans</i>-Diphenyldiazene oxide","Acta Crystallographica Section E","2007","63","8","o3639","o3639","10.1107/S1600536807035787","","","0.71073","MoKα","","0.1053","0.0551","","","0.1254","0.1564","","","","","","1.054","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214717","8.7424","0.0015","9.5039","0.0017","9.8424","0.0017","74.055","0.003","68.612","0.003","82.108","0.003","731.5","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(<i>Z</i>)-<i>N</i>-<i>tert</i>-Butyl-C-(2,3,4-trimethoxyphenyl)nitrone","","- C14 H21 N O4 -","- C14 H21 N O4 -","- C28 H42 N2 O8 -","2","1","HJ3042","Guo, Hao; Zabawa, Mark; Woo, Joyce; Zheng, Chong; Yao, Qingwei","(<i>Z</i>)-<i>N</i>-<i>tert</i>-Butyl-<i>C</i>-(2,3,4-trimethoxyphenyl)nitrone","Acta Crystallographica Section E","2007","63","8","o3552","o3552","10.1107/S1600536807031674","","","0.71073","MoKα","","0.0487","0.0423","","","0.1173","0.1236","","","","","","1.065","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214718","12.6709","0.0013","15.725","0.0016","7.9628","0.0008","90","","97.62","0.001","90","","1572.6","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","poly[diaqua(1,10-phenanthroline)(μ~3~-pyrazole-3,5- dicarboxylato)tricopper(II)],","","- C34 H22 Cu3 N8 O10 -","- C34 H22 Cu3 N8 O10 -","- C68 H44 Cu6 N16 O20 -","2","0.5","HJ3043","Ji-Jiang Wang; Bo Zhang; Hui-Ming Shu; Chuan-Qin Du; Huai-Ming Hu","A two-dimensional coordination polymer containing linear trinuclear copper(II) clusters","Acta Crystallographica Section E","2007","63","8","m2190","m2190","10.1107/S1600536807034927","","","0.71073","MoKα","","0.0404","0.029","","","0.0707","0.075","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214719","9.739","0.0004","23.859","0.001","8.5312","0.0004","90","","114.732","0.001","90","","1800.5","0.14","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Poly[[(μ~4~-iminiodiacetato)bis(μ~3~-iminodiacetato)lanthanum(III)nickel(II)] monohydrate]","","- C12 H18 La N3 Ni O13 -","- C12 H18 La N3 Ni O13 -","- C48 H72 La4 N12 Ni4 O52 -","4","0.5","HJ3046","Hu, Xiang-Yang; Ren, Yan-Ping; Ng, Seik Weng","Poly[[(<i>{μ</i>}~4~-iminiodiacetato)bis(<i>{μ</i>}~3~-iminodiacetato)lanthanum(III)nickel(II)] monohydrate]","Acta Crystallographica Section E","2007","63","8","m2124","m2125","10.1107/S1600536807032904","","","0.71073","MoKα","","0.024","0.024","","","0.062","0.062","","","","","","1.25","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214720","4.7658","0.0009","6.0323","0.0009","14.47","0.002","83.082","0.014","85.919","0.015","70.427","0.015","388.89","0.11","571","2","","","","","","","","","","4","P -1","-P 1","2","","<i>N</i>,<i>N</i>'-Diisopentyldithiooxamide","","- C12 H24 N2 S2 -","- C12 H24 N2 S2 -","- C12 H24 N2 S2 -","1","0.5","HJ3049","Bruno, Giuseppe; Rotondo, Archimede; Nicoló, Francesco; Lanza, Santo","<i>N</i>,<i>N</i>'-Diisopentyldithiooxamide","Acta Crystallographica Section E","2007","63","8","o3595","o3596","10.1107/S1600536807035374","","","0.71073","MoKα","","","0.0343","","","","0.0983","","","","","","1.115","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214722","8.3182","0.0011","12.4523","0.0017","9.0479","0.0012","90","","111.429","0.002","90","","872.4","0.2","292","2","292","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Diethyl cis-4,8-dioxo-3,4,7,8-tetrahydro-1H,5H-2,6-dioxa-3a,4a,7a,8a- tetraazacyclopenta[def]fluorene-8b,8c-dicarboxylate","","- C14 H18 N4 O8 -","- C14 H18 N4 O8 -","- C28 H36 N8 O16 -","2","1","HK2272","Neng-Fang She; Hai-Ling Xi","Diethyl <i>cis</i>-4,8-dioxo-3,4,7,8-tetrahydro-1<i>H</i>,5<i>H</i>-2,6-dioxa-3a,4a,7a,8a-tetraazacyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","Acta Crystallographica Section E","2007","63","8","o3495","o3495","10.1107/S1600536807033739","","","0.71073","MoKα","","0.0474","0.0423","","","0.1019","0.105","","","","","","1.106","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214723","6.747","0.002","14.6689","0.0007","6.9651","0.0007","90","","90.01","0.01","90","","689.3","0.2","298","2","298","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","(DiMepyH2).TlBr4(III)","2,5-dimethylpyrazinium tetrabromidothallate(III)","","- C6 H10 Br4 N2 Tl -","- C6 H10 Br4 N2 Tl -","- C12 H20 Br8 N4 Tl2 -","2","0.5","HK2276","Al-Far, Rawhi; Ali, Basem Fares","Intermolecular interactions in 2,5-dimethylpyrazinium tetrabromidothallate(III)","Acta Crystallographica Section E","2007","63","8","m2242","m2243","10.1107/S1600536807036513","","","0.71073","MoKα","","0.0343","0.0264","","","0.0476","0.0488","","","","","","0.864","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214724","9.898","0.003","13.62","0.005","16.098","0.006","90","","103.599","0.006","90","","2109.3","1.3","84","2","84","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(2,3-DMQH2).(SnBr6) 3 (H2O)","2,3-Dimethylquinoxalinediium hexabromostannate(IV) trihydrate","","- C10 H18 Br6 N2 O3 Sn -","- C10 H18 Br6 N2 O3 Sn -","- C40 H72 Br24 N8 O12 Sn4 -","4","1","HK2278","Ali, Basem Fares; Al-Far, Rawhi; Ng, Seik Weng","2,3-Dimethylquinoxalinediium hexabromidostannate(IV) trihydrate","Acta Crystallographica Section E","2007","63","8","m2102","m2103","10.1107/S1600536807032771","","","0.7107","MoKα","","0.0727","0.0623","","","0.1265","0.1319","","","","","","1.204","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214725","14.096","0.003","13.614","0.003","14.781","0.003","90","","114.53","0.03","90","","2580.5","1.1","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-poly[tetrabromido-hexakis(isonicotinato)-bis(1<i>H</i>-\ isonicotinato)pentazinc(II)]","","- C48 H34 Br4 N8 O16 Zn5 -","- C48 H34 Br4 N8 O16 Zn5 -","- C96 H68 Br8 N16 O32 Zn10 -","2","0.5","HK2280","Lu, Jilin; Zhang, Dashun; Li, Lin; Liu, Beiping","Poly[tetrabromidohexakis(μ~2~-isonicotinato)bis(μ~2~-pyridinium-4-carboxylato)pentazinc(II)]","Acta Crystallographica Section E","2007","63","8","m2147","","10.1107/S1600536807033016","","","0.71073","MoKα","","0.0503","0.0372","","","0.088","0.0928","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214726","9.252","0.0019","10.16","0.002","16.338","0.003","90.72","0.03","91.97","0.03","107.34","0.03","1464.7","0.6","298","2","298","2","","","","","","","","4","P -1","-P 1","2","5-(4-Methoxyphenyl)-1-p-tolyl-1H-pyrazol-3-ol","5-(4-Methoxyphenyl)-1-(4-methylphenyl)-1H-pyrazol-3-ol","","- C17 H16 N2 O2 -","- C17 H16 N2 O2 -","- C68 H64 N8 O8 -","4","2","HK2281","Yong-Feng Sun; Hong-Sheng Jia; Shan Liu; Hong-Jun Zhu","5-(4-Methoxyphenyl)-1-(4-methylphenyl)-1<i>H</i>-pyrazol-3-ol","Acta Crystallographica Section E","2007","63","8","o3397","o3397","10.1107/S1600536807031686","","","0.71073","MoKα","","0.1529","0.0773","","","0.1597","0.2249","","","","","","1.085","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214727","9.0537","0.0006","10.5716","0.0009","12.0287","0.0007","90","","108.952","0.004","90","","1088.88","0.14","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-methyl-4-hydroxyazobenzene","(E)-2-Methyl-4-(phenyldiazenyl)phenol","","- C13 H12 N2 O -","- C13 H12 N2 O -","- C52 H48 N8 O4 -","4","1","HK2282","Albayrak, Çiğdem; Gümrükçüoğlu, İsmail Erdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-2-Methyl-4-(phenyldiazenyl)phenol","Acta Crystallographica Section E","2007","63","8","o3662","o3663","10.1107/S1600536807036501","","","0.71073","MoKα","","0.0734","0.0505","","","0.1406","0.1523","","","","","","1.053","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214729","7.316","0.0015","14.067","0.003","19.386","0.004","85.55","0.03","83.11","0.03","85.5","0.03","1969.9","0.7","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","(1,1'-Binaphthyl-2,2'-dioxy)diacetic acid","","- C24 H18 O6 -","- C24 H18 O6 -","- C96 H72 O24 -","4","2","HK2284","Ya-Ming Wu; Guo-Qing Cao; Ming-Yi Qian; Hong-Jun Zhu","(1,1'-Binaphthyl-2,2'-dioxy)diacetic acid","Acta Crystallographica Section E","2007","63","8","o3446","o3446","10.1107/S1600536807032825","","","0.71073","MoKα","","0.1088","0.0616","","","0.1369","0.1848","","","","","","0.972","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214730","4.841","0.001","11.389","0.002","16.128","0.003","90","","90","","90","","889.2","0.3","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","4-iodo-2,6-dimethylaniline","4-iodo-2,6-dimethylaniline","","- C8 H10 I N -","- C8 H10 I N -","- C32 H40 I4 N4 -","4","1","HK2285","Rui Liu; Yu-Hao Li; Shan Liu; Shui-Ping Deng; Hong-Jun Zhu","4-Iodo-2,6-dimethylaniline","Acta Crystallographica Section E","2007","63","8","o3542","o3542","10.1107/S1600536807032151","","","0.71073","MoKα","","0.0608","0.0499","","","0.1229","0.1436","","","","","","0.999","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214732","7.3384","0.0003","8.8325","0.0003","15.756","0.0005","90","","96.576","0.002","90","","1014.53","0.06","298","2","298","2","","","","","","","","3","P 1 c 1","P -2yc","7","","3,4,5-Trimethoxybenzoic acid","","- C10 H12 O5 -","- C10 H12 O5 -","- C40 H48 O20 -","4","2","HK2288","Ghulam Qadeer; Nasim Hasan Rama; Murat Tas̨; Okan Zafer Yes̨ilel; Wai-Yeung Wong","3,4,5-Trimethoxybenzoic acid","Acta Crystallographica Section E","2007","63","8","o3456","o3456","10.1107/S1600536807033429","","","0.71073","MoKα","","0.0701","0.0388","","","0.0878","0.0941","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214733","9.1496","0.0011","12.8426","0.0015","12.6835","0.0014","90","","100.592","0.002","90","","1465","0.3","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","3-(3,4,5-Trimethoxyphenyl)isocoumarin","3-(3,4,5-trimethoxyphenyl)-1H-isochromen-1-one","","- C18 H16 O5 -","- C18 H16 O5 -","- C72 H64 O20 -","4","1","HK2289","Ghulam Qadeer; Nasim Hasan Rama; Muhammad Azaad Malik; Javeed Akhtar; Madeleine Helliwell","3-(3,4,5-Trimethoxyphenyl)-1<i>H</i>-isochromen-1-one","Acta Crystallographica Section E","2007","63","8","o3447","o3447","10.1107/S1600536807032783","","","0.71073","MoKα","","0.0597","0.0444","","","0.1094","0.1148","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214735","7.491","0.0007","16.1656","0.0015","12.9147","0.0012","90","","91.956","0.002","90","","1563","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3-(4-Fluorobenzyl)-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5(4H)-thione","","- C16 H14 F N3 O S -","- C16 H14 F N3 O S -","- C64 H56 F4 N12 O4 S4 -","4","1","HK2291","Raja Ansar Hussain Khan; Rashid Iqbal; Habib-ur-Rehman; Ghulam Qadeer; Wai-Yeung Wong","3-(4-Fluorobenzyl)-4-(2-methoxyphenyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","8","o3501","o3501","10.1107/S1600536807033879","","","0.71073","MoKα","","0.0431","0.0327","","","0.0835","0.0914","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214736","8.3664","0.0004","19.2172","0.001","11.28","0.0006","90","","102.133","0.001","90","","1773.07","0.16","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","459.0(10)","3-(4-Methoxyphenethyl)-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5(4H)-thione","","- C18 H19 N3 O2 S -","- C18 H19 N3 O2 S -","- C72 H76 N12 O8 S4 -","4","1","HK2292","Ghulam Qadeer; Muhammad Hanif; Nasim Hasan Rama; Wai-Yeung Wong","3-(4-Methoxyphenethyl)-4-(2-methoxyphenyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","8","o3502","o3502","10.1107/S1600536807033867","","","0.71073","MoKα","","0.0374","0.0338","","","0.09","0.0937","","","","","","1.027","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214737","9.8203","0.0007","16.292","0.0012","11.0178","0.0008","90","","105.203","0.001","90","","1701.1","0.2","298","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","481(2)","2-[(1E,4E)-2-(4-Methoxyphenyl)-3H-benzo[b][1,4]diazepin-4-yl]phenol","","- C22 H18 N2 O2 -","- C22 H18 N2 O2 -","- C88 H72 N8 O8 -","4","1","HK2293","Muhammad Zia-ul-Haq; Mehwash Zia; Ghulam Qadeer; Nasim Hasan Rama; Wai-Yeung Wong","2-[(1<i>E</i>,4<i>E</i>)-2-(4-Methoxyphenyl)-3<i>H</i>-benzo[<i>b</i>][1,4]diazepin-4-yl]phenol","Acta Crystallographica Section E","2007","63","8","o3554","o3554","10.1107/S1600536807034630","","","0.71073","MoKα","","0.0546","0.0395","","","0.1039","0.1156","","","","","","1.012","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214738","14.3963","0.0006","19.023","0.0008","12.7651","0.0006","90","","91.305","0.001","90","","3495","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-[(1E,4E)-4-(2-Methoxyphenyl)-3H-benzo[b][1,5]diazepin-2-yl]phenol","","- C22 H18 N2 O2 -","- C22 H18 N2 O2 -","- C176 H144 N16 O16 -","8","2","HK2294","Muhammad Zia-ul-Haq; Arshad Munir; Ghulam Qadeer; Nasim Hasan Rama; Wai-Yeung Wong","2-[(1<i>E</i>,4<i>E</i>)-4-(2-Methoxyphenyl)-3<i>H</i>-benzo[<i>b</i>][1,5]diazepin-2-yl]phenol","Acta Crystallographica Section E","2007","63","8","o3600","o3600","10.1107/S1600536807034824","","","0.71073","MoKα","","0.07","0.0415","","","0.1025","0.1199","","","","","","0.998","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214739","9.1784","0.0011","13.2446","0.0016","11.9536","0.0014","90","","91.55","0.002","90","","1452.6","0.3","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","poly[tetra-μ~2~-cyanido-bis(μ~2~-1,2-di-4- pyridylethane)manganese(II)disilver(I)]","","- C28 H24 Ag2 Mn N8 -","- C28 H24 Ag2 Mn N8 -","- C56 H48 Ag4 Mn2 N16 -","2","0.5","HK2295","Kawasaki, Takeshi; Kitazawa, Takafumi","Double interpenetrated structure of poly[tetra-μ~2~-cyanido-bis(μ~2~-1,2-di-4-pyridylethane)manganese(II)disilver(I)]","Acta Crystallographica Section E","2007","63","8","m2215","m2216","10.1107/S1600536807034897","","","0.71073","MoKα","","0.0367","0.0259","","","0.0612","0.0662","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214742","7.231","0.0008","8.1517","0.0009","12.524","0.0014","101.671","0.002","101.197","0.001","105.443","0.002","672.37","0.13","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","3-(1H-Benzotriazol-1-yl)-1-(4-bromophenyl)propan-1-one","","- C15 H12 Br N3 O -","- C15 H12 Br N3 O -","- C30 H24 Br2 N6 O2 -","2","1","HK2298","Na-Na Tian; Sai Bi; Lei-Lei Xu; Jun Wan","3-(1<i>H</i>-Benzotriazol-1-yl)-1-(4-bromophenyl)propan-1-one","Acta Crystallographica Section E","2007","63","8","o3602","o3602","10.1107/S1600536807035441","","","0.71073","MoKα","","0.0334","0.0277","","","0.0703","0.0731","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214743","9.7415","0.0016","19.174","0.003","13.6232","0.0019","90","","105.757","0.011","90","","2449","0.7","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-Naphthaleneacetic acid‒piperidine (2/1)","","- C29 H31 N O4 -","- C29 H31 N O4 -","- C116 H124 N4 O16 -","4","1","HK2300","Wang, Zhe; Yin, Qiang; Zou, Ru-Yi; Wang, Ru-Ji; Zhao, Yu-Fen","1-Naphthaleneacetic acid‒piperidine (2/1)","Acta Crystallographica Section E","2007","63","8","o3655","o3655","10.1107/S1600536807036719","","","0.71073","MoKα","","0.1103","0.064","","","0.1183","0.1366","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214744","9.429","0.0019","10.107","0.002","10.848","0.002","96.5","0.03","111.6","0.03","114.43","0.03","831","0.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","5-(3,4-dimethoxyphenyl)-1-p-tolylpyrazolidin-3-one","5-(3,4-Dimethoxyphenyl)-1-(4-methylphenyl)pyrazolidin-3-one","","- C18 H20 N2 O3 -","- C18 H20 N2 O3 -","- C36 H40 N4 O6 -","2","1","HK2301","Yong-Feng Sun; Hong-Sheng Jia; Shan Liu; Zhong-Hua Luo; Hong-Jun Zhu","5-(3,4-Dimethoxyphenyl)-1-(4-methylphenyl)pyrazolidin-3-one","Acta Crystallographica Section E","2007","63","8","o3657","o3657","10.1107/S1600536807036562","","","0.71073","MoKα","","0.1058","0.0756","","","0.1632","0.1869","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214745","12.252","0.003","13.766","0.003","12.405","0.004","90","","100.371","0.004","90","","2058.1","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[1,1'-(butane-1,4-diyl)diimidazolium] δ-octamolybdate(VI)","","- C20 H32 Mo8 N8 O26 -","- C20 H32 Mo8 N8 O26 -","- C40 H64 Mo16 N16 O52 -","2","0.5","HY2067","Hai-Ge Hou; Jing-Lin Yang","Bis[1,1'-(butane-1,4-diyl)diimidazolium] δ-octamolybdate(VI)","Acta Crystallographica Section E","2007","63","8","m2194","m2194","10.1107/S1600536807034605","","","0.71073","MoKα","","0.0253","0.0205","","","0.0462","0.048","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214746","11.407","0.0008","12.889","0.001","12.899","0.002","68.874","0.001","65.149","0.002","78.145","0.001","1601.9","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Bis[2-(3-methyl-2-pyridyl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>]\ (1,1,1-trifluoro-3-thenoylpropan-2-onato-κ^2^<i>O</i>,<i>O</i>')iridium(III) ethyl acetate solvate","","- C36 H32 F3 Ir N2 O4 S -","- C36 H32 F3 Ir N2 O4 S -","- C72 H64 F6 Ir2 N4 O8 S2 -","2","1","HY2069","Li-Ping Han; Bin Li; Jie Liu; Jun Ying","Bis[2-(3-methyl-2-pyridyl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>](1,1,1-trifluoro-3-thenoylpropan-2-onato-κ^2^<i>O</i>,<i>O</i>')iridium(III) ethyl acetate solvate","Acta Crystallographica Section E","2007","63","8","m2031","m2032","10.1107/S1600536807031145","","","0.71069","MoKα","","0.034","0.0308","","","0.0767","0.0785","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214747","27.04","0.002","27.04","0.002","14.3178","0.0018","90","","90","","90","","10468.6","1.7","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","[μ-1,2-Disalicyloylhydrazine(2-)- κ^3^N,O,O':κ^3^N',O'',O''']bis[tripyridinenickel(II)] pyridine disolvate","","- C54 H48 N10 Ni2 O4 -","- C54 H48 N10 Ni2 O4 -","- C432 H384 N80 Ni16 O32 -","8","0.5","HY2070","Yuting Chen; Jian-Min Dou; Da-Cheng Li; Da-Qi Wang; Yue-Hua Zhu","[μ-1,2-Disalicyloylhydrazine(2‒)-κ^3^<i>N</i>,<i>O</i>,<i>O</i>':κ^3^<i>N</i>',<i>O</i>'',<i>O</i>''']bis[tripyridinenickel(II)] pyridine disolvate","Acta Crystallographica Section E","2007","63","8","m2118","m2118","10.1107/S1600536807033582","","","0.71073","MoKα","","0.0916","0.0529","","","0.1328","0.1516","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214748","11.528","0.005","18.156","0.005","10.828","0.005","90","","103.801","0.005","90","","2200.9","1.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(2-aminopyridine-κN^1^)bis(N,N'-dimethylformamide-κO)(sulfato- κ^2^O,O')copper(II)","","- C16 H26 Cu N6 O6 S -","- C16 H26 Cu N6 O6 S -","- C64 H104 Cu4 N24 O24 S4 -","4","0.5","HY2071","Gai-Juan Li; Yan Xing; Shu-Yan Song","Bis(2-aminopyridine-κ<i>N</i>^1^)bis(<i>N</i>,<i>N</i>'-dimethylformamide-κ<i>O</i>)(sulfato-κ^2^<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2007","63","8","m2234","m2234","10.1107/S1600536807036677","","","0.71073","MoKα","","0.0357","0.0282","","","0.0758","0.0792","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214749","8.272","0.0003","10.918","0.0003","18.746","0.0005","90","","91.383","0.002","90","","1692.53","0.09","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Benzotriazol-1-yl methyl ferrocene-1,1'-dicarboxylate","","- C19 H15 Fe N3 O4 -","- C19 H15 Fe N3 O4 -","- C76 H60 Fe4 N12 O16 -","4","1","IM2012","Kraatz, Heinz-Bernhard; Schatte, Gabriele; Lataifeh, Anas","Benzotriazol-1-yl methyl ferrocene-1,1'-dicarboxylate","Acta Crystallographica Section E","2007","63","8","m2173","m2173","10.1107/S1600536807024105","","","0.71073","MoKα","","0.0522","0.0382","","","0.0876","0.0961","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214750","4.731","0.0006","24.042","0.002","10.799","0.001","90","","98.01","0.01","90","","1216.3","0.2","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,2-Dimethyl-<i>N</i>-(2,4,6-trichlorophenyl)acetamide","","- C10 H10 Cl3 N O -","- C10 H10 Cl3 N O -","- C40 H40 Cl12 N4 O4 -","4","1","IM2020","B. Thimme Gowda; Ingrid Svoboda; Hartmut Fuess","2,2-Dimethyl-<i>N</i>-(2,4,6-trichlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","8","o3366","o3366","10.1107/S1600536807031728","","","0.71073","MoKα","","0.1082","0.0596","","","0.1056","0.1258","","","","","","1.083","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214751","6.1688","0.0006","6.813","0.001","9.804","0.001","90","","97.236","0.008","90","","408.76","0.08","303","2","303","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","Potassium 4-chloro-benzenesulfonate","poly[μ~4~-4-chlorobenzenesulfonato-potassium(I)]","","- C6 H4 Cl K O3 S -","- C6 H4 Cl K O3 S -","- C12 H8 Cl2 K2 O6 S2 -","2","0.5","IM2021","B. Thimme Gowda; K. S. Babitha; Ingrid Svoboda; Hartmut Fuess","Potassium 4-chlorobenzenesulfonate","Acta Crystallographica Section E","2007","63","8","m2222","m2222","10.1107/S1600536807035830","","","0.71073","MoKα","","0.0435","0.0366","","","0.0938","0.0984","","","","","","1.091","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214752","7.1268","0.0005","10.09","0.0008","12.211","0.0009","92.676","0.001","100.809","0.001","90.382","0.001","861.46","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[diaqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]- μ-phthalato-κ^2^O:O']","","- C18 H16 Cd N2 O6 -","- C18 H16 Cd N2 O6 -","- C36 H32 Cd2 N4 O12 -","2","1","IM2023","Wang, Xiao-Yan; Dong, Chen-Chen; Deng, Xiao-Tao; Wang, Cheng-Gang; Hu, Bo","<i>catena</i>-Poly[[diaqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ-phthalato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","8","m2079","m2079","10.1107/S1600536807032035","","","0.71073","MoKα","","0.0404","0.0343","","","0.0866","0.1055","","","","","","1.172","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214753","7.944","0.001","33.972","0.005","11.292","0.002","90","","107.511","0.002","90","","2906.2","0.8","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(7,10-dichloro-2-methoxybenzo[<i>b</i>][1,5]naphthyridinium) chloride perchlorate","","- C26 H18 Cl6 N4 O6 -","- C26 H18 Cl6 N4 O6 -","- C104 H72 Cl24 N16 O24 -","4","1","IM2024","Wei Wang","Bis(7,10-dichloro-2-methoxybenzo[<i>b</i>][1,5]naphthyridinium) chloride perchlorate","Acta Crystallographica Section E","2007","63","8","o3430","o3430","10.1107/S1600536807033193","","","0.71073","MoKα","","0.0669","0.0516","","","0.1197","0.1252","","","","","","1.089","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214754","6.202","0.002","9.671","0.001","8.947","0.001","90","","99.49","0.02","90","","529.29","0.19","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[chlorido-μ~3~-1,2,4-triazolato-iron(II)]","","- C2 H2 Cl Fe N3 -","- C2 H2 Cl Fe N3 -","- C8 H8 Cl4 Fe4 N12 -","4","1","IM2027","Gao, Yu-Xiang; Wang, Li-Bin; Hao, Xiang-Rong","Poly[chlorido-μ~3~-1,2,4-triazolato-iron(II)]","Acta Crystallographica Section E","2007","63","8","m2232","m2232","10.1107/S1600536807036239","","","0.71073","MoKα","","0.0387","0.0353","","","0.1196","0.1228","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214755","6.5578","0.0006","11.3548","0.0013","14.156","0.0013","99.04","0.002","90.873","0.002","106.053","0.002","998.49","0.17","292","2","292","2","","","","","","","","3","P -1","-P 1","2","","3-(Biphenyl-1-yl)-1-(4-tert-butylphenyl)-3-hydroxyprop-2-en-1-one","","- C25 H24 O2 -","- C25 H24 O2 -","- C50 H48 O4 -","2","1","IS2173","Chun-Yang Zheng; Jing Zheng; Dun-Jia Wang","3-(Biphenyl-1-yl)-1-(4-<i>tert</i>-butylphenyl)-3-hydroxyprop-2-en-1-one","Acta Crystallographica Section E","2007","63","8","o3633","o3633","10.1107/S1600536807031133","","","0.71073","MoKα","","0.0983","0.0562","","","0.1355","0.1566","","","","","","0.943","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214756","11.855","0.003","11.189","0.004","13.431","0.004","90","","93.089","0.005","90","","1779","0.9","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-[(4-Hydroxy-3-iodo-5-methoxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1,2- dihydropyrazol-3-one","","- C19 H18 I N3 O3 -","- C19 H18 I N3 O3 -","- C76 H72 I4 N12 O12 -","4","1","IS2180","Jing, Zuo-Liang; Yao, Si-Qing; Chen, Xin; Yang, Nan","4-[(4-Hydroxy-3-iodo-5-methoxybenzylidene)amino]-1,5-dimethyl-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","8","o3605","o3605","10.1107/S1600536807035519","","","0.7107","MoKα","","0.0572","0.0506","","","0.0857","0.0882","","","","","","1.138","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214757","9.8194","0.0008","10.3074","0.0009","13.398","0.0012","97.224","0.002","92.143","0.002","111.53","0.002","1246.28","0.19","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","1,1'-(1,4-Phenylenedimethylene)dipyridinium bis(tetraphenylborate)","","- C66 H58 B2 N2 -","- C66 H58 B2 N2 -","- C66 H58 B2 N2 -","1","0.5","IS2181","Wu, Yang-Jie; Liu, Xiu-Cun; Du, Chen-Xia; Niu, Yin-Yun","1,1'-(1,4-Phenylenedimethylene)dipyridinium bis(tetraphenylborate)","Acta Crystallographica Section E","2007","63","8","o3457","o3457","10.1107/S1600536807032588","","","0.71073","MoKα","","0.0946","0.0583","","","0.1312","0.1486","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214758","8.4619","0.0003","8.481","0.0004","8.4929","0.0003","89.899","0.002","85.111","0.003","76.09","0.002","589.36","0.04","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","2-Acetyl-4-methylphenyl methacrylate","","- C13 H14 O3 -","- C13 H14 O3 -","- C26 H28 O6 -","2","1","IS2182","G. Chakkaravarthi; A. Anthonysamy; V. Manivannan; S. Balasubramanian","2-Acetyl-4-methylphenyl methacrylate","Acta Crystallographica Section E","2007","63","8","o3404","o3404","10.1107/S1600536807031960","","","0.71073","MoKα","","0.0625","0.0443","","","0.1346","0.1508","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214759","4.5625","0.0009","8.3514","0.0016","10.696","0.002","90","","92.472","0.016","90","","407.17","0.14","100","1","100","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Putrescinium dichloride","Butane-1,4-diyldiammonium dichloride","","- C4 H14 Cl2 N2 -","- C4 H14 Cl2 N2 -","- C8 H28 Cl4 N4 -","2","0.5","IS2183","Pospieszna-Markiewicz, Izabela; Radecka-Paryzek, Wanda; Kubicki, Maciej","Putrescinium dichloride: a redetermination at 100 K","Acta Crystallographica Section E","2007","63","8","o3650","o3650","10.1107/S160053680703156X","","","0.71073","MoKα","","0.0579","0.0371","","","0.0752","0.0849","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214760","21.1928","0.0016","9.6058","0.0006","8.302","0.0007","90","","106.696","0.006","90","","1618.8","0.2","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","1-acetonyl-4-(2,5-dimethyl-4H-\ 1,2,4-triazol-4-yl)-3-(2-thienylmethyl)-1H-1,2,4-triazol-5(4H)-one","","- C14 H16 N6 O2 S -","- C14 H16 N6 O2 S -","- C56 H64 N24 O8 S4 -","4","1","IS2184","Ustabaş, Reşat; Çoruh, Ufuk; Sancak, Kemal; Demirkan, Esra","1-Acetonyl-4-(2,5-dimethyl-4<i>H</i>-1,2,4-triazol-4-yl)-3-(2-thienylmethyl)-1<i>H</i>-1,2,4-triazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","8","o3443","o3443","10.1107/S160053680703231X","","","0.71073","MoKα","","0.0353","0.0332","","","0.0955","0.0968","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214761","8.6093","0.0006","22.973","0.0016","7.9014","0.0005","90","","111.204","0.001","90","","1456.95","0.17","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,4-Dichloro-6-{[4-chloro-3-(trifluoromethyl)phenyl]iminomethyl}phenol","","- C14 H7 Cl3 F3 N O -","- C14 H7 Cl3 F3 N O -","- C56 H28 Cl12 F12 N4 O4 -","4","1","IS2185","Chun-Niu Zhang; Ming-Hua Yang","2,4-Dichloro-6-{[4-chloro-3-(trifluoromethyl)phenyl]iminomethyl}phenol","Acta Crystallographica Section E","2007","63","8","o3401","o3401","10.1107/S1600536807031972","","","0.71073","MoKα","","0.0441","0.0306","","","0.0767","0.0797","","","","","","0.898","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214762","8.0304","0.0001","6.5332","0.0001","14.1019","0.0002","90","","95.065","0.002","90","","736.956","0.018","298","","298","","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","Bis(2-amino-2-thiazolinium) dichromate(VI)","","- C6 H14 Cr2 N4 O7 S2 -","- C6 H14 Cr2 N4 O7 S2 -","- C12 H28 Cr4 N8 O14 S4 -","2","0.5","IS2186","Sieroń, Lesław","Bis(2-amino-2-thiazolinium) dichromate(VI)","Acta Crystallographica Section E","2007","63","8","m2068","m2068","10.1107/S1600536807032023","","","0.71073","MoKα","","0.0248","0.0232","","","0.0703","0.0711","","","","","","1.123","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214763","6.233","0.003","7.819","0.003","15.06","0.006","93.849","0.007","96.353","0.006","105.908","0.008","697.9","0.5","90","","90","","","","","","","","","2","P -1","-P 1","2","","1,1,6,6-Tetrakis(4-ethylphenyl)-1,2,3,4,5-hexapentaene","","- C38 H36 -","- C38 H36 -","- C38 H36 -","1","0.5","IS2187","Suzuki, Noriyuki; Hashizume, Daisuke; Chihara, Teiji","1,1,6,6-Tetrakis(4-ethylphenyl)-1,2,3,4,5-hexapentaene","Acta Crystallographica Section E","2007","63","8","o3436","o3436","10.1107/S1600536807032576","","","0.71073","MoKα","","0.0808","0.0578","","","0.1454","0.1659","","","","","","1.096","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214764","7.8932","0.0006","9.7615","0.001","14.8921","0.0015","90","","90","","90","","1147.43","0.19","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","<i>catena</i>-Poly[aquabis(pyrazine-2-carboxylato-κ^2^N^1^,O)zinc(II)]- μ-pyrazine-2-carboxylato-κ^3^N^1^,O:N^4^]","","- C10 H8 N4 O5 Zn -","- C10 H8 N4 O5 Zn -","- C40 H32 N16 O20 Zn4 -","4","1","IS2188","Gao, Yu-Xiang; Wang, Li-Bin; Niu, Yan-Ling; Hao, Lu-Jiang","<i>catena</i>-Poly[[aqua(pyrazine-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)zinc(II)]-μ-pyrazine-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>:<i>N</i>^4^]","Acta Crystallographica Section E","2007","63","8","m2143","m2143","10.1107/S1600536807033041","","","0.71073","MoKα","","0.0379","0.034","","","0.0923","0.0962","","","","","","1.001","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2214765","23.094","0.003","8.5709","0.001","17.271","0.002","90","","94.503","0.002","90","","3408","0.7","299","2","299","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-Phenyl-2-(pyrrolidin-1-yl)-6,7-dihydro- 5H-cyclopenta[b]thieno[5,4-d]pyrimidin-4(3H)-one","","- C19 H19 N3 O S -","- C19 H19 N3 O S -","- C152 H152 N24 O8 S8 -","8","1","IS2190","Yang-Gen Hu; Yu-Lu Chen; Ting Xie; Ming-Guo Liu","3-Phenyl-2-(pyrrolidin-1-yl)-6,7-dihydro-5<i>H</i>-cyclopenta[<i>b</i>]thieno[5,4-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","8","o3474","o3475","10.1107/S160053680703365X","","","0.71073","MoKα","","0.0716","0.0535","","","0.1364","0.1534","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214766","7.1392","0.0003","10.5811","0.0005","11.6276","0.0005","102.32","0.002","107.613","0.002","101.735","0.002","783.31","0.06","298","2","298","2","","","","","","","","4","P -1","-P 1","2","diphenylpiperidin-4-one","t-3,t-5-Dimethyl-r-2,c-6-diphenylpiperidin-4-one","","- C19 H21 N O -","- C19 H21 N O -","- C38 H42 N2 O2 -","2","1","IS2193","Balamurugan, S.; Thiruvalluvar, A.; Manimekalai, A.; Jayabharathi, J.","<i>t</i>-3,<i>t</i>-5-Dimethyl-<i>r</i>-2,<i>c</i>-6-diphenylpiperidin-4-one","Acta Crystallographica Section E","2007","63","8","o3504","o3504","10.1107/S1600536807034010","","","0.71073","MoKα","","0.0678","0.0431","","","0.1122","0.1273","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214767","7.0996","0.0006","10.444","0.009","16.9985","0.0013","104.447","0.001","97.12","0.001","106.041","0.001","1147.6","1","292","2","298","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 8-amino-2-(o-tolyloxy)-4-oxo-3-phenyl-3,4-dihydro- thieno[2',3':2,3]thieno[4,5-d]pyrimidine-6-carboxylate","","- C24 H19 N3 O4 S2 -","- C24 H19 N3 O4 S2 -","- C48 H38 N6 O8 S4 -","2","1","IS2198","Ming-Guo Liu; Zuan Ma; Ting Xie; Zhen-Zhen Yang","Ethyl 8-amino-2-(<i>o</i>-tolyloxy)-4-oxo-3-phenyl-3,4-dihydrothieno[2',3':2,3]thieno[4,5-<i>d</i>]pyrimidine-6-carboxylate","Acta Crystallographica Section E","2007","63","8","o3664","o3664","10.1107/S1600536807036781","","","0.71073","MoKα","","0.1003","0.0674","","","0.1634","0.1794","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214768","6.4168","0.0004","8.0919","0.0004","10.1493","0.0007","113.184","0.001","99.946","0.003","98.995","0.002","462.28","0.05","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[diaquacobalt(II)]-μ~3~-5-aminoisophthalato- κ^4^O,<i>O</i>':<i>O</i>'':<i>N</i>]","","- C8 H9 Co N O6 -","- C8 H9 Co N O6 -","- C16 H18 Co2 N2 O12 -","2","1","KJ2057","Yang, Yan; Zeng, Ming-Hua; Zhang, Shu-Hua; Liang, Hong","<i>catena</i>-Poly[[diaquacobalt(II)]-μ~3~-5-aminoisophthalato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'':<i>N</i>]","Acta Crystallographica Section E","2007","63","8","m2056","m2057","10.1107/S160053680703173X","","","0.71073","MoKα","","0.0372","0.032","","","0.0919","0.0964","","","","","","1.006","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214769","6.6179","0.0004","7.4711","0.0005","23.1087","0.0015","90","","90","","90","","1142.56","0.13","100","1","100","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5-Methoxy-2-methyl-4-nitro-1-phenyl-1H-imidazole","","- C11 H11 N3 O3 -","- C11 H11 N3 O3 -","- C44 H44 N12 O12 -","4","1","KJ2062","Wagner, Paweł; Kubicki, Maciej","5-Methoxy-2-methyl-4-nitro-1-phenyl-1<i>H</i>-imidazole","Acta Crystallographica Section E","2007","63","8","o3587","o3587","10.1107/S1600536807035301","","","0.71073","MoKα","","0.0594","0.0341","","","0.0537","0.0579","","","","","","1.004","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214770","18.424","0.001","18.424","0.001","10.1082","0.0011","90","","90","","90","","3431.2","0.5","293","2","293","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","<i>tert</i>-Butyl 3-(4-bromophenylsulfonyl)pyrrolidine-1-carboxylate","","- C15 H20 Br N O4 S -","- C15 H20 Br N O4 S -","- C120 H160 Br8 N8 O32 S8 -","8","1","KP2116","Yao, Zheng; Li, Zhi-Gang; Deng, Jian-Cheng; Xu, Jing-Wei","<i>tert</i>-Butyl 3-(4-bromophenylsulfonyl)pyrrolidine-1-carboxylate","Acta Crystallographica Section E","2007","63","8","o3485","o3485","10.1107/S1600536807032369","","","0.71073","MoKα","","0.0453","0.0325","","","0.0692","0.0734","","","","","","0.996","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214771","18.988","0.003","32.249","0.006","12.883","0.002","90","","90","","90","","7889","2","291","2","291","2","","","","","","","","5","F d d 2","F 2 -2d","43","","catena-Poly[[[aquabis(acetato-κO)copper(II)]-μ-1,3-di-4-pyridylpropane-\ κ^2^N:N'] monohydrate]","","- C17 H24 Cu N2 O6 -","- C17 H24 Cu N2 O6 -","- C272 H384 Cu16 N32 O96 -","16","1","KP2117","Zhong-Xiang Du; Jun-Xia Li","<i>catena</i>-Poly[[[aquabis(acetato-κ<i>O</i>)copper(II)]-μ-1,3-di-4-pyridylpropane-κ^2^<i>N</i>:<i>N</i>'] monohydrate]","Acta Crystallographica Section E","2007","63","8","m2133","m2134","10.1107/S160053680703334X","","","0.71073","MoKα","","0.0796","0.0472","","","0.0978","0.1175","","","","","","1.03","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214772","9.55","0.002","10.303","0.002","17.695","0.004","90","","90","","90","","1741.1","0.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","2-chloro-acetylbenzofuran","1-(1-Benzofuran-2-yl)-2-chloroethanone","","- C10 H7 Cl O2 -","- C10 H7 Cl O2 -","- C80 H56 Cl8 O16 -","8","1","KP2118","Anna Kozakiewicz; Andrzej Prewysz-Kwinto; Andrzej Wojtczak","1-(1-Benzofuran-2-yl)-2-chloroethanone","Acta Crystallographica Section E","2007","63","8","o3469","o3469","10.1107/S1600536807033351","","","0.71073","MoKα","","0.1595","0.0862","","","0.1392","0.1649","","","","","","1.238","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214773","8.3603","0.0004","6.4935","0.0003","23.1904","0.0011","90","","99.106","0.002","90","","1243.09","0.1","100","0.1","100","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","<i>(rac)</i>-5-methoxy-3-phenyl-2,3-dihydro-1H-inden-1-one","<i>(rac)</i>-5-methoxy-3-phenyl-2,3-dihydro-1H-inden-1-one","","- C16 H14 O2 -","- C16 H14 O2 -","- C64 H56 O8 -","4","1","KP2119","Zhe Li; Jian-Hua Xu; Mohd Mustaqim Rosli; Hoong-Kun Fun","<i>rac</i>-5-Methoxy-3-phenyl-2,3-dihydro-1<i>H</i>-inden-1-one","Acta Crystallographica Section E","2007","63","8","o3435","o3435","10.1107/S1600536807032850","","","0.71073","MoKα","","0.0684","0.0471","","","0.1082","0.1247","","","","","","1.099","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214774","13.1764","0.0005","5.3356","0.0002","20.6646","0.0007","90","","106.132","0.003","90","","1395.6","0.09","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-Benzyl-3-phenyl-1<i>H</i>-pyrazole-5-carboxylic acid","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C68 H56 N8 O8 -","4","1","KP2120","Tang, Zheng; Ding, Xiao-Ling; Dong, Wen-Liang; Zhao, Bao-Xiang","1-Benzyl-3-phenyl-1<i>H</i>-pyrazole-5-carboxylic acid","Acta Crystallographica, Section E: Structure Reports Online","2007","63","8","o3473","o3473","10.1107/S1600536807033363","","","0.71073","MoKα","","0.0918","0.0471","","","0.1278","0.1639","","","","","","0.899","","","","has coordinates,has Fobs","209472","2020-10-21","18:00:00",""
"2214775","10.09","0.002","7.8736","0.0017","18.379","0.004","90","","90","","90","","1460.1","0.5","294","2","294","2","","","","","","","","2","P b c a","-P 2ac 2ab","61","p-dibenzylbenzene","1,4-dibenzylbenzene","","- C20 H18 -","- C20 H18 -","- C80 H72 -","4","0.5","LH2423","Ying-Jun Cui; Gang Li; Fen-Xia Ren; Zhong-Yu Duan; Wen-Jun Zhang","1,4-Dibenzylbenzene","Acta Crystallographica Section E","2007","63","8","o3393","o3393","10.1107/S1600536807031236","","","0.71073","MoKα","","0.0727","0.0402","","","0.0925","0.1093","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214776","12.7512","0.0015","3.9116","0.0004","16.655","0.0014","90","","126.189","0.006","90","","670.45","0.13","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[3-(chloroacetyl)phenyl]diazene","","- C14 H8 Cl2 N2 O2 -","- C14 H8 Cl2 N2 O2 -","- C28 H16 Cl4 N4 O4 -","2","0.5","LH2430","De-Mei Tian; Yong-Sheng Niu; Chuan-Xi Xiong; Bo Hu","Bis[3-(chloroacetyl)phenyl]diazene","Acta Crystallographica Section E","2007","63","8","o3373","o3373","10.1107/S1600536807030577","","","0.71073","MoKα","","0.0653","0.0499","","","0.1263","0.1365","","","","","","1.055","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2214777","8.6927","0.0014","19.106","0.003","16.834","0.003","90","","90","","90","","2795.8","0.8","298","2","298","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","Di-μ-acetato-κ^4^O:O'-μ-oxido-κ^2^O:O-bis[(acetic acid-κO)bis(1H-imidazole-κN^3^)magnesium(II)]","","- C20 H30 Mg2 N8 O9 -","- C20 H30 Mg2 N8 O9 -","- C80 H120 Mg8 N32 O36 -","4","","LH2433","Stadie, Nicholas P.; Sanchez-Smith, Rebeca; Groy, Thomas L.","Di-μ-acetato-κ^4^<i>O</i>:<i>O</i>'-μ-oxido-κ^2^<i>O</i>:<i>O</i>-bis[(acetic acid-κ<i>O</i>)bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)magnesium(II)]","Acta Crystallographica Section E","2007","63","8","m2153","m2154","10.1107/S1600536807033818","","","0.71073","MoKα","","0.0934","0.0705","","","0.1379","0.1469","","","","","","1.167","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214778","5.9667","0.0006","19.5626","0.0018","17.389","0.002","90","","97.488","0.005","90","","2012.4","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","9-(4-Bromophenyl)-3,3,6,6-tetramethyl-3,4,6,7-tetrahydro-2H-xanthene- 1,8(5H,9H)-dione","","- C23 H25 Br O3 -","- C23 H25 Br O3 -","- C92 H100 Br4 O12 -","4","1","LH2439","Bigdeli, M. Ali; Mahdavinia, Gholam Hossein; Amani, Vahid","9-(4-Bromophenyl)-3,3,6,6-tetramethyl-3,4,6,7-tetrahydro-2<i>H</i>-xanthene-1,8(5<i>H</i>,9<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","8","o3493","o3493","10.1107/S1600536807033545","","","0.71073","MoKα","","0.0447","0.0313","","","0.072","0.0768","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214779","6.1387","0.0002","7.4088","0.0003","10.8142","0.0003","90","","94.996","0.002","90","","489.97","0.03","150","","150","","","","","","","","","3","P 1 21 1","P 2yb","4","","2,3-<i>C</i>-Dimethyl-D-allono-1,4-lactone","","- C8 H14 O6 -","- C8 H14 O6 -","- C16 H28 O12 -","2","1","LH2443","Jones, Nigel A.; Jenkinson, Sarah F.; Curran, Louise A.; Watkin, David J.; Fleet, George W. J.","2,3-Di-<i>C</i>-methyl-<small>D</small>-allono-1,4-lactone","Acta Crystallographica Section E","2007","63","8","o3415","o3415","10.1107/S1600536807030541","","","0.71073","MoKα","","0.0251","0.0242","","0.0586","0.0583","0.0586","","","","","","0.9793","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214780","5.9838","0.0003","11.7424","0.0005","7.9189","0.0005","90","","91.8112","0.0018","90","","556.14","0.05","150","","150","","","","","","","","","3","P 1 21 1","P 2yb","4","","5,6-<i>O</i>-Isopropylidene-3-<i>C</i>-methyl-D-mannono-1,4-lactone","","- C10 H16 O6 -","- C10 H16 O6 -","- C20 H32 O12 -","2","1","LH2444","Curran, Louise A.; Jones, Nigel A.; Jenkinson, Sarah F.; Watkin, David J.; Fleet, George W. J.","5,6-<i>O</i>-Isopropylidene-3-<i>C</i>-methyl-<small>D</small>-mannono-1,4-lactone","Acta Crystallographica Section E","2007","63","8","o3416","o3416","10.1107/S160053680703125X","","","0.71073","MoKα","","0.0519","0.0403","","0.0941","0.0905","0.0941","","","","","","0.9078","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214781","8.6381","0.0013","17.133","0.003","12.6809","0.0019","90","","93.967","0.002","90","","1872.2","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","8-hydroxyquinoline N-oxide‒diaquabis(8-hydroxyquinoline N-oxide-κO^1^)bis(thiocyanato-κN)cobalt(II) (2/1)","","- C38 H32 Co N6 O10 S2 -","- C38 H32 Co N6 O10 S2 -","- C76 H64 Co2 N12 O20 S4 -","2","0.5","LH2445","Zhang, Shi-Guo; Xu, Hai-Yan; Shi, Jing-Min","The 2:1 adduct of 8-hydroxyquinoline <i>N</i>-oxide and diaquabis(8-hydroxyquinoline <i>N</i>-oxide)dithiocyanatocobalt(II)","Acta Crystallographica Section E","2007","63","8","m2083","m2083","10.1107/S1600536807032722","","","0.71073","MoKα","","0.0652","0.0452","","","0.1125","0.1217","","","","","","0.99","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214782","6.284","0.0002","11.2043","0.0003","14.1345","0.0005","90","","90","","90","","995.18","0.05","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-<i>C</i>-Hydroxymethyl-2,3-<i>O</i>-isopropylidene-3-<i>C</i>-methyl- β-L-erythrose","","- C9 H16 O5 -","- C9 H16 O5 -","- C36 H64 O20 -","4","1","LH2446","Booth, Kathrine V.; Jenkinson, Sarah F.; Watkin, David J.; Fleet, George W. J.","2-<i>C</i>-Hydroxymethyl-2,3-<i>O</i>-isopropylidene-3-<i>C</i>-methyl-β-<small>L</small>-erythrose","Acta Crystallographica Section E","2007","63","8","o3386","o3386","10.1107/S1600536807031522","","","0.71073","MoKα","","0.0373","0.0306","","0.0738","0.071","0.0738","","","","","","0.9412","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214783","8.256","0.002","11.684","0.003","24.086","0.007","76.134","0.007","84.875","0.01","75.718","0.006","2184.9","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Aquabis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N'</i>)[2,4,6-\ tris(4-sulfonatophenylamino)-1,3,5-triazin-1-ium-κ<i>O</i>]nickel(II) dihydrate","","- C45 H38 N10 Ni O12 S3 -","- C45 H38 N10 Ni O12 S3 -","- C90 H76 N20 Ni2 O24 S6 -","2","1","LH2447","Yun-Fang Yu; Yong-Qin Wei; Ke-Chen Wu","Aquabis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')[2,4,6-tris(4-sulfonatophenylamino)-1,3,5-triazin-1-ium-κ<i>O</i>]nickel(II) dihydrate","Acta Crystallographica Section E","2007","63","8","m2119","m2119","10.1107/S1600536807033223","","","0.71073","MoKα","","0.0657","0.0466","","","0.0976","0.1079","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214784","6.9089","0.0002","12.2072","0.0005","14.2507","0.0005","90","","90","","90","","1201.88","0.07","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2,3-<i>C</i>-Dimethyl-3,4-<i>O</i>-isopropylidene-D-allono-1,5-lactone","","- C11 H18 O6 -","- C11 H18 O6 -","- C44 H72 O24 -","4","1","LH2448","Curran, Louise A.; Jenkinson, Sarah F.; Jones, Nigel A.; Watkin, David J.; Fleet, George W. J.","2,3-<i>C</i>-Dimethyl-3,4-<i>O</i>-isopropylidene-<small>D</small>-allono-1,5-lactone","Acta Crystallographica Section E","2007","63","8","o3387","o3387","10.1107/S1600536807031510","","","0.71073","MoKα","","0.0432","0.0321","","0.0726","0.0683","0.0726","","","","","","0.9228","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214785","6.6307","0.0002","11.1029","0.0004","14.1409","0.0005","90","","90","","90","","1041.05","0.06","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2,6-Anhydro-1-deoxy-3,4-<i>O</i>-isopropylidene-3-<i>C</i>-methyl-β-D- ribo-hex-2-ulofuranose","","- C10 H16 O4 -","- C10 H16 O4 -","- C40 H64 O16 -","4","1","LH2449","Curran, Louise A.; Jenkinson, Sarah F.; Jones, Nigel A.; Watkin, David J.; Fleet, George W. J.","2,6-Anhydro-1-deoxy-3,4-<i>O</i>-isopropylidene-3-<i>C</i>-methyl-β-<small>D</small>-<i>ribo</i>-hex-2-ulofuranose","Acta Crystallographica Section E","2007","63","8","o3388","o3388","10.1107/S1600536807031546","","","0.71073","MoKα","","0.0411","0.0309","","0.0736","0.0697","0.0736","","","","","","0.9261","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214786","4.4937","0.0005","8.6731","0.001","14.4036","0.0017","101.341","0.002","91.787","0.002","103.66","0.002","533.06","0.11","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","4-(5-Bromo-2-hydroxybenzoyl)thiosemicarbazide","","- C8 H8 Br N3 O2 S -","- C8 H8 Br N3 O2 S -","- C16 H16 Br2 N6 O4 S2 -","2","1","LH2450","Long-Fei Jin","4-(5-Bromo-2-hydroxybenzoyl)thiosemicarbazide","Acta Crystallographica Section E","2007","63","8","o3465","o3465","10.1107/S1600536807033211","","","0.71073","MoKα","","0.0739","0.0575","","","0.1564","0.1678","","","","","","1.107","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214787","9.845","0.006","18.253","0.01","9.792","0.006","90","","101.157","0.006","90","","1726.4","1.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-chlorido-bis(chlorido{2-[(2-hydroxyphenyl)iminiomethyl]-6- methoxyphenolato-κ^2^O,O']cadium(II)) dimethanol solvate","","- C30 H34 Cd2 Cl4 N2 O8 -","- C30 H34 Cd2 Cl4 N2 O8 -","- C60 H68 Cd4 Cl8 N4 O16 -","2","0.5","LH2451","Jian-Fang Dong; Lian-Zhi Li; Wen-Jian Yu; Tao Xu; Da-Qi Wang","Di-μ-chlorido-bis(chlorido{2-[(2-hydroxyphenyl)iminiomethyl]-6-methoxyphenolato-κ^2^<i>O</i>,<i>O</i>'}cadium(II)) methanol disolvate","Acta Crystallographica Section E","2007","63","8","m2206","m2207","10.1107/S1600536807035210","","","0.71073","MoKα","","0.0754","0.0475","","","0.1003","0.117","","","","","","1.112","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214788","11.9121","0.0016","10.7112","0.001","12.7824","0.0015","90","","113.181","0.009","90","","1499.3","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2E)-1-(2,4-Dichlorophenyl)-3-quinolin-8-ylprop-2-en-1-one","","- C18 H11 Cl2 N O -","- C18 H11 Cl2 N O -","- C72 H44 Cl8 N4 O4 -","4","1","LH2452","Sarojini, B. K.; Yathirajan, H. S.; Mayekar, A. N.; Narayana, B.; Bolte, Michael","(2<i>E</i>)-1-(2,4-Dichlorophenyl)-3-(quinolin-8-yl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","8","o3488","o3488","10.1107/S1600536807032746","","","0.71073","MoKα","","0.067","0.0574","","","0.1457","0.1541","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214789","8.118","0.001","10.551","0.002","22.054","0.002","90","","92.13","0.01","90","","1887.7","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-[4-(2-Fluorophenyl)piperazin-1-ylmethyl]-4,6- dimethylisothiazolo[5,4-b]pyridin-3(2H)-one","","- C19 H21 F N4 O S -","- C19 H21 F N4 O S -","- C76 H84 F4 N16 O4 S4 -","4","1","LH2454","Karczmarzyk, Zbigniew; Malinka, Wiesław","2-[4-(2-Fluorophenyl)piperazin-1-ylmethyl]-4,6-dimethylisothiazolo[5,4-<i>b</i>]pyridin-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","8","o3514","o3514","10.1107/S1600536807033971","","","1.54178","CuKα","","0.1071","0.0579","","","0.1748","0.2079","","","","","","0.982","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214790","12.3994","0.0003","21.8446","0.0007","8.8062","0.0003","90","","98.26","0.001","90","","2360.5","0.12","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(6,6'-dimethyl-2,2'-dipyridyl-κ^2^N,N')silver(I) tetrafluoridoborate","","- C24 H24 Ag B F4 N4 -","- C24 H24 Ag B F4 N4 -","- C96 H96 Ag4 B4 F16 N16 -","4","1","LH2455","Klausmeyer, Kevin K.; Hung-Low, Fernando; Renz, Amanda","Bis(6,6'-dimethyl-2,2'-dipyridyl-κ^2^<i>N</i>,<i>N</i>')silver(I) tetrafluoridoborate","Acta Crystallographica Section E","2007","63","8","m2149","m2149","10.1107/S1600536807033806","","","0.71073","MoKα","","0.0309","0.0247","","","0.0583","0.0623","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214791","7.2604","0.0008","21.8931","0.0019","9.5795","0.0012","90","","97.882","0.009","90","","1508.3","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Bromo-5-methoxy-N'-[(E)-(4-nitrophenyl)methylene]benzohydrazide","","- C15 H12 Br N3 O4 -","- C15 H12 Br N3 O4 -","- C60 H48 Br4 N12 O16 -","4","1","LH2458","Narayana, B.; Siddaraju, B. P.; Raju, C. R.; Yathirajan, H. S.; Bolte, Michael","2-Bromo-5-methoxy-<i>N</i>'-[(<i>E</i>)-(4-nitrophenyl)methylene]benzohydrazide","Acta Crystallographica Section E","2007","63","8","o3522","o3522","10.1107/S1600536807034150","","","0.71073","MoKα","","0.0526","0.0417","","","0.098","0.103","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214792","10.11","0.002","22.419","0.005","17.099","0.003","90","","98.55","0.03","90","","3832.5","1.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(dipivaloylmethanato)bis(1,10-phenanthroline)potassium benzene solvate","Bis(1,10-phenanthroline)(2,2,6,6-tetramethylheptane-3,5-dionato)potassium(I) benzene sesquisolvate","","- C44 H44 K N4 O2 -","- C44 H44 K N4 O2 -","- C176 H176 K4 N16 O8 -","4","1","LH2459","Tsymbarenko, Dmitry M.; Korsakov, Igor E.; Kaul, Andrey R.; Kemnitz, Erhard; Troyanov, Sergey I.","Bis(1,10-phenanthroline)(2,2,6,6-tetramethylheptane-3,5-dionato)potassium(I) benzene sesquisolvate","Acta Crystallographica Section E","2007","63","8","m2195","m2195","10.1107/S1600536807034988","","","0.71073","MoKα","","0.1228","0.0664","","","0.1142","0.1263","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214793","6.57","0.0002","9.1317","0.0003","15.3916","0.0004","90","","90","","90","","923.42","0.05","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2,4-Di-<i>C</i>-methyl-α-L-arabinose monohydrate","","- C7 H16 O6 -","- C7 H16 O6 -","- C28 H64 O24 -","4","1","LH2460","Booth, Kathrine V.; Jenkinson, Sarah F.; Watkin, David J.; Fleet, George W. J.","2,4-Di-<i>C</i>-methyl-α-<small>L</small>-arabinose monohydrate","Acta Crystallographica Section E","2007","63","8","o3592","o3593","10.1107/S1600536807035143","","","0.71073","MoKα","","0.0335","0.0285","","0.0699","0.0686","0.0699","","","","","","0.9386","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2214794","12.189","0.003","29.983","0.005","7.3372","0.0011","90","","90","","90","","2681.5","0.9","297","2","297","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","6α-Acetoxyepoxyazadiradione","(8S*,10R*)-17-(3-furyl)-4,4,8,10,13-pentamethyl-3,16-dioxo-6,7,9,11,12,17- hexahydro-14,15-epoxy-5H-cyclopenta[a]phenanthrene-6α,7α-diyl diacetate","","- C30 H36 O8 -","- C30 H36 O8 -","- C120 H144 O32 -","4","1","LH2461","Wisanu Maneerat; Hoong-Kun Fun; Taweesak Buatip; Surat Laphookhieo; Suchada Chantrapromma","6α-Acetoxyepoxyazadiradione","Acta Crystallographica Section E","2007","63","8","o3583","o3584","10.1107/S1600536807035155","","","0.71073","MoKα","","0.0883","0.0513","","","0.1075","0.1247","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214795","23.64","0.002","5.084","0.0005","19.2139","0.0019","90","","93.974","0.01","90","","2303.7","0.4","203","2","203","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","isoxazolocarbazole","3,9-Dimethyl-10H-isoxazolo[5,4-a]carbazole","","- C15 H12 N2 O -","- C15 H12 N2 O -","- C120 H96 N16 O8 -","8","1","LH2462","A. Thiruvalluvar; A. Thomas Gunaseelan; A. Ebenezer Martin; K. J. Rajendra Prasad; R. J. Butcher","3,9-Dimethyl-10<i>H</i>-isoxazolo[5,4-<i>a</i>]carbazole","Acta Crystallographica Section E","2007","63","8","o3631","o3631","10.1107/S1600536807035222","","","0.71073","MoKα","","0.1772","0.0474","","","0.0958","0.1202","","","","","","0.795","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214796","17.2799","0.0005","10.6783","0.0003","10.5702","0.0003","90","","90.951","0.001","90","","1950.14","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Acetyl-2,6-bis(4-methoxyphenyl)-3-methyl-4-piperidone","","- C22 H25 N O4 -","- C22 H25 N O4 -","- C88 H100 N4 O16 -","4","1","LH2463","Kavitha, T.; Ponnuswamy, S.; Kaileshwaran, K.; Ponnuswamy, M. N.","1-Acetyl-2,6-bis(4-methoxyphenyl)-3-methyl-4-piperidone","Acta Crystallographica Section E","2007","63","8","o3648","","10.1107/S1600536807035489","","","0.71073","MoKα","","0.0879","0.0582","","","0.1665","0.2019","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214797","11.557","0.003","9.815","0.002","13.955","0.003","90","","100.444","0.004","90","","1556.7","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-[3-(3-Pyridyloxy)pyrazin-2-yloxy]pyridinium perchlorate","","- C14 H11 Cl N4 O6 -","- C14 H11 Cl N4 O6 -","- C56 H44 Cl4 N16 O24 -","4","1","LH2464","Li, Jin Min","3-[3-(3-Pyridyloxy)pyrazin-2-yloxy]pyridinium perchlorate","Acta Crystallographica Section E","2007","63","8","o3651","o3651","10.1107/S1600536807036367","","","0.71073","MoKα","","0.1071","0.064","","","0.1979","0.2325","","","","","","0.777","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214798","5.3887","0.0003","4.949","0.0003","28.1011","0.0016","90","","95.478","0.004","90","","746","0.07","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-Acetylbenzoic acid","","- C9 H8 O3 -","- C9 H8 O3 -","- C36 H32 O12 -","4","1","LH2466","Lalancette, Roger A.; Malak, Muhammad H.; Thompson, Hugh W.","4-Acetylbenzoic acid: hydrogen bonding and packing in a simple aromatic ε-keto acid","Acta Crystallographica Section E","2007","63","8","o3640","o3640","10.1107/S1600536807035246","","","1.54178","CuKα","","0.069","0.051","","","0.14","0.156","","","","","","1.12","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214799","22.702","0.005","6.4839","0.0013","11.626","0.002","90","","110.96","0.03","90","","1598.1","0.6","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","1,4-Bis(benzothiazol-2-yl)benzene","1,4-Bis(benzothiazol-2-yl)benzene","","- C20 H12 N2 S2 -","- C20 H12 N2 S2 -","- C80 H48 N8 S8 -","4","0.5","LW2014","Bordinhao, Jairo; Visentin, Lorenzo do C.; Machado, Raquel B.","1,4-Bis(benzothiazol-2-yl)benzene","Acta Crystallographica Section E","2007","63","8","o3426","o3426","10.1107/S1600536807023768","","","0.71073","MoKα","","0.041","0.0308","","","0.0789","0.0838","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214800","12.822","0.003","19.23","0.004","24.871","0.005","88.35","0.03","86.72","0.03","89.21","0.03","6119","2","140","2","140","2","","","","","","","","6","P -1","-P 1","2","[NBu4]+[((CF3)3CO)3Al-F-Al(OC(CF3)3)3]-","Tetra-n-butylammonium μ-fluorido-bis{tris[2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethanolato- κO]aluminate(III)}","","- C40 H36 Al2 F55 N O6 -","- C40 H36 Al2 F55 N O6 -","- C160 H144 Al8 F220 N4 O24 -","4","2","LX2013","Krossing, Ingo; Raabe, Ines","Tetra-<i>n</i>-butylammonium μ-fluorido-bis{tris[2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethanolato-κ<i>O</i>]aluminate(III)}","Acta Crystallographica Section E","2007","63","8","m2144","m2144","10.1107/S1600536807033533","","","0.71073","MoKα","","0.1049","0.0747","","","0.1959","0.2162","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2214801","13.1952","0.0006","11.4668","0.0005","15.7281","0.0009","90","","101.006","0.005","90","","2336","0.2","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tris(4-morpholinecarbodithioato-κ^2^S,S')cobalt(III)","","- C15 H24 Co N3 O3 S6 -","- C15 H24 Co N3 O3 S6 -","- C60 H96 Co4 N12 O12 S24 -","4","1","LX2018","Kropidłowska, Anna; Chojnacki, Jarosław; Gołaszewska, Jolanta; Paliwoda, Damian; Becker, Barbara","Tris(4-morpholinecarbodithioato-κ^2^<i>S</i>,<i>S</i>')cobalt(III)","Acta Crystallographica Section E","2007","63","8","m2117","m2117","10.1107/S160053680703276X","","","0.71073","MoKα","","0.0538","0.0486","","","0.122","0.1313","","","","","","1.127","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214802","8.4788","0.0004","6.9602","0.0003","7.2206","0.0004","90","","99.655","0.002","90","","420.08","0.04","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(ethylamine)tetrafluorosilicon","","- C4 H14 F4 N2 Si -","- C4 H14 F4 N2 Si -","- C8 H28 F8 N4 Si2 -","2","0.5","MG2025","Rutt, Oliver J.; Cowley, Andrew R.; Clarke, Simon J.","Bis(ethylamino)tetrafluorosilicon","Acta Crystallographica Section E","2007","63","8","o3406","o3406","10.1107/S1600536807032102","","","0.71073","MoKα","","0.0559","0.0338","","0.0517","0.0422","0.0422","","","","","","1.071","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214803","13.3641","0.0005","11.4457","0.0004","8.5211","0.0003","90","","90","","90","","1303.4","0.08","203","2","203","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Dipotassium hexafluoridozirconate(IV) hydrogen fluoride","","- F14 H2 K4 Zr2 -","- F14 H2 K4 Zr2 -","- F56 H8 K16 Zr8 -","4","0.5","MG2031","Gerasimenko, A. V.; Didenko, N. A.; Kavun, V. Ya.","Dipotassium hexafluoridozirconate(IV) hydrogen fluoride, K~2~ZrF~6~·HF","Acta Crystallographica Section E","2007","63","8","i171","i171","10.1107/S160053680703615X","","","0.71073","MoKα","","0.0342","0.0304","","","0.0699","0.0712","","","","","","1.21","","","","has coordinates,has Fobs","184482","2020-10-21","18:00:00",""
"2214804","7.473","0.002","7.974","0.002","13.092","0.004","80.201","0.004","87.226","0.004","89.146","0.004","767.8","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","1-(3-Carboxybenzyl)-1H-benzo[d]imidazol-3-ium nitrate monohydrate","","- C15 H15 N3 O6 -","- C15 H15 N3 O6 -","- C30 H30 N6 O12 -","2","1","NC2033","Zhao, Xia Xia; Ma, Jian Ping; Huang, Ru Qi.; Dong, Yu Bin","1-(3-Carboxybenzyl)-1<i>H</i>-benzo[<i>d</i>]imidazol-3-ium nitrate monohydrate","Acta Crystallographica Section E","2007","63","8","o3440","o3440","10.1107/S1600536807025949","","","0.71073","MoKα","","0.0937","0.0658","","","0.1491","0.1659","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214805","9.554","0.007","10.007","0.008","12.555","0.009","76.603","0.013","68.836","0.012","81.643","0.013","1086.4","1.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Acetophenone propionylhydrazone","","- C11 H14 N2 O -","- C11 H14 N2 O -","- C44 H56 N8 O4 -","4","2","NC2042","Huan-Mei Guo","Acetophenone propionylhydrazone","Acta Crystallographica Section E","2007","63","8","o3375","o3375","10.1107/S1600536807031662","","","0.71073","MoKα","","0.1316","0.0565","","","0.1399","0.1914","","","","","","1.011","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214806","10.754","0.001","10.95","0.001","11.307","0.002","65.02","0.002","65.64","0.02","85.92","0.02","1090.9","0.3","299","2","299","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>-(4-Methoxybenzyl)-3-[(1E)-3-oxo-3-phenylprop-1-en-1- yl]benzenesulfonamide","","- C24 H23 N O5 S -","- C24 H23 N O5 S -","- C48 H46 N2 O10 S2 -","2","1","NC2043","Andrighetti-Fröhner, Carla Regina; Nunes, Ricardo José; Silva, Luiz Everson da; Simões, Cláudia Maria Oliveira; Foro, Sabine","<i>N</i>-(4-Methoxybenzyl)-3-[(1<i>E</i>)-3-oxo-3-phenylprop-1-en-1-yl]benzenesulfonamide","Acta Crystallographica Section E","2007","63","8","o3437","o3438","10.1107/S1600536807032138","","","1.5418","CuKα","","0.0518","0.0491","","","0.1324","0.1352","","","","","","1.069","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214807","7.445","0.002","8.44","0.002","12.906","0.003","77.31","0.01","86.81","0.02","73.15","0.01","757.2","0.3","299","2","299","2","","","","","","","","4","P -1","-P 1","2","","5-[(8-Hydroxyquinolin-2-ylamino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione","","- C16 H14 N2 O5 -","- C16 H14 N2 O5 -","- C32 H28 N4 O10 -","2","1","NC2044","Silva, Luiz Everson da; Sousa Jr, Paulo Teixeira de; Dall'Oglio, Evandro Luiz; Foro, Sabine","5-[(8-Hydroxyquinolin-2-ylamino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione","Acta Crystallographica Section E","2007","63","8","o3439","o3439","10.1107/S160053680703214X","","","1.5418","CuKα","","0.0491","0.0459","","","0.1165","0.1195","","","","","","1.075","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214808","5.9308","0.0001","9.5875","0.0002","15.7529","0.0003","82.2873","0.001","89.4928","0.0009","72.8206","0.0009","847.58","0.03","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","1,1'-Bis(ferrocenylphenylphosphino)ferrocene","","- C42 H36 Fe3 P2 -","- C42 H36 Fe3 P2 -","- C42 H36 Fe3 P2 -","1","0.5","NC2045","Chrzanowski, Lars S. von; Lutz, Martin; Spek, Anthony L.","1,1'-Bis(ferrocenylphenylphosphino)ferrocene","Acta Crystallographica Section E","2007","63","8","m2098","m2098","10.1107/S160053680703262X","","","0.71073","MoKα","","0.0326","0.0297","","","0.0748","0.0765","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214809","8.3118","0.0007","8.8422","0.0007","26.829","0.002","90","","98.193","0.001","90","","1951.7","0.3","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[<i>μ</i>~3~-4-(4,5-diazafluoren-9-ylideneamino)benzoato- κ^3^<i>O</i>,<i>O</i>':<i>N</i>](methanol-κ<i>O</i>)(thiocyanoato- κ<i>N</i>)cadmium(II)]","","- C20 H14 Cd N4 O3 S -","- C20 H14 Cd N4 O3 S -","- C80 H56 Cd4 N16 O12 S4 -","4","1","NG2247","Ju-Mei Zheng; Chen-Xia Du; Yang-Jie Wu","Poly[[<i>{μ</i>}~3~-4-(4,5-diazafluoren-9-ylideneamino)benzoato-κ^3^<i>O</i>,<i>O</i>':<i>N</i>](methanol-κ<i>O</i>)(thiocyanato-κ<i>N</i>)cadmium(II)]","Acta Crystallographica Section E","2007","63","8","m2175","m2175","10.1107/S1600536807019460","","","0.71073","MoKα","","0.0377","0.0293","","","0.0684","0.0726","","","","","","1.005","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214810","7.8592","0.0019","7.959","0.002","10.734","0.003","100.458","0.003","110.406","0.003","94.199","0.003","612","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Tetra-μ-acetato-bis{[2-(chloromethyl)pyridine]copper(II)}","","- C20 H24 Cl2 Cu2 N2 O8 -","- C20 H24 Cl2 Cu2 N2 O8 -","- C20 H24 Cl2 Cu2 N2 O8 -","1","0.5","NG2274","Zhang, Shi-Guo; Liu, Qi-Sheng; Shi, Jing-Min","Tetra-μ-acetato-bis{[2-(chloromethyl)pyridine]copper(II)}","Acta Crystallographica Section E","2007","63","8","m2082","m2082","10.1107/S1600536807032321","","","0.71073","MoKα","","0.0477","0.0407","","","0.0981","0.1015","","","","","","1.035","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2214811","12.1368","0.0005","15.4218","0.0006","6.5656","0.0004","90","","90","","90","","1228.89","0.1","120","2","120","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Dichloridobis(η^5^-methylcyclopentadienyl)hafnium(IV)","","- C12 H14 Cl2 Hf -","- C12 H14 Cl2 Hf -","- C48 H56 Cl8 Hf4 -","4","0.5","NG2285","Wisniewska, Aleksandra; Baranowska, Katarzyna; Pikies, Jerzy","Dichloridobis(η^5^-methylcyclopentadienyl)hafnium(IV)","Acta Crystallographica Section E","2007","63","8","m2174","m2174","10.1107/S1600536807029868","","","0.71073","MoKα","","0.0264","0.0259","","","0.0636","0.064","","","","","","1.106","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214812","13.1073","0.0003","11.884","0.0003","14.6085","0.0004","90","","97.81","0.001","90","","2254.42","0.1","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Acetonitrile-κN)(2,2':6',2''-terpyridyl-κ^3^<i>N</i>)palladium(II)] bis(hexafluorophosphate)","","- C17 H14 F12 N4 P2 Pd -","- C17 H14 F12 N4 P2 Pd -","- C68 H56 F48 N16 P8 Pd4 -","4","1","NG2287","Guang-Quan Mei; Ke-Long Huang","(Acetonitrile-κ<i>N</i>)(2,2':6',2''-terpyridyl-κ^3^<i>N</i>)palladium(II)] bis(hexafluorophosphate)","Acta Crystallographica Section E","2007","63","8","m2029","m2029","10.1107/S160053680703070X","","","0.71073","MoKα","","0.0558","0.0448","","","0.1282","0.1421","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214813","4.9657","0.0004","7.7187","0.0007","8.4423","0.0007","75.314","0.004","88.707","0.005","80.985","0.005","309.09","0.05","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Guanidinium tetraoxidorhenate(VII) [C(NH~2~)~3~][ReO~4~]","","- C H6 N3 O4 Re -","- C H6 N3 O4 Re -","- C2 H12 N6 O8 Re2 -","2","1","NG2292","Grigoriev, Mikhail S.; German, Konstantin E.; Maruk, Alesia Ya.","Guanidinium tetraoxidorhenate(VII)","Acta Crystallographica Section E","2007","63","8","m2061","m2061","10.1107/S1600536807031881","","","0.71073","MoKα","","0.0206","0.0175","","","0.0391","0.04","","","","","","1.114","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214814","9.879","0.003","18.887","0.007","15.676","0.005","90","","95.376","0.014","90","","2912","1.7","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(acetone-2κO){6,6'-dimethoxy-2,2'-[propane-1,2- diylbis(nitrilomethylidyne)]diphenolato- 1κ^4^O^1^,O^1'^,O^6^,O^6'^:2κ^4^O^1^,N,N',O^1'^}trinitrato- 1κ^6^O,O'-copper(II)neodymium(III)","","- C22 H21.73 Cu N5 O14 Pr -","- C22 H21.734 Cu N5 O14 Pr -","- C88 H86.936 Cu4 N20 O56 Pr4 -","4","1","NG2296","Sun, Wen-Bin; Gao, Ting; Yan, Peng-Fei; Li, Guang-Ming; Hou, Guang-Feng","Acetone[<i>{μ</i>}-<i>N</i>,<i>N</i>'-bis(3-methoxy-2-oxidobenzylidene)-1,2-propanediamine]trinitratocopper(II)praseodymium(III)","Acta Crystallographica Section E","2007","63","8","m2192","m2192","10.1107/S1600536807034460","","","0.71073","MoKα","","0.0482","0.0365","","","0.1011","0.1101","","","","","","1.106","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214815","12.223","0.004","10.363","0.003","18.414","0.005","90","","102.451","0.012","90","","2277.6","1.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato- 1κ^4^<i>O</i>^1^,<i>O</i>^1'^,<i>O</i>^6^,<i>O</i>^6'^: 2κ^4^<i>O</i>^1^,<i>N</i>,<i>N</i>',<i>O</i>^1'^}(methanol- 1κ<i>O</i>)trinitrato-1κ^6^<i>O</i>,<i>O</i>'-copper(II)europium(III)","","- C17 H17 Cu Eu N5 O12 -","- C17 H18 Cu Eu N5 O12 -","- C68 H72 Cu4 Eu4 N20 O48 -","4","1","NG2297","Gao, Ting; Sun, Wen-Bin; Yan, Peng-Fei; Li, Guang-Ming; Hou, Guang-Feng","[<i>{μ</i>}-<i>N</i>,<i>N</i>'-Bis(2-oxidobenzylidene)-1,2-ethanediamine](methanol)trinitratocopper(II)europium(III)","Acta Crystallographica Section E","2007","63","8","m2201","m2202","10.1107/S1600536807034903","","","0.71073","MoKα","","0.0254","0.0213","","","0.0455","0.0467","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2214816","10.912","0.007","7.797","0.005","20.778","0.013","90","","96.899","0.013","90","","1755","1.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Bis{2-[3-(cyclohexylamino)propyliminomethyl]phenolato- κ^2^N,O}bis(thiocyanato-κN)iron(II)","","- C34 H48 Fe N6 O2 S2 -","- C34 H48 Fe N6 O2 S2 -","- C68 H96 Fe2 N12 O4 S4 -","2","0.5","OM2128","Chen, Kun; Zhang, Ying-Lao; Feng, Ming-Qian; Liu, Chang-Hong","<i>trans</i>-Bis{2-[3-(cyclohexylamino)propyliminomethyl]phenolato-κ^2^<i>N</i>,<i>O</i>}bis(thiocyanato-κ<i>N</i>)iron(II)","Acta Crystallographica Section E","2007","63","8","m2033","m2033","10.1107/S1600536807031066","","","0.71073","MoKα","","0.1347","0.0624","","","0.1415","0.1977","","","","","","0.852","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214817","6.3159","0.0003","8.6989","0.0003","21.3277","0.0009","90","","90","","90","","1171.77","0.08","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-[(<i>S</i>)-1-Phenylethyl]-1<i>H</i>-benzimidazole","","- C15 H14 N2 -","- C15 H14 N2 -","- C60 H56 N8 -","4","1","OM2136","Williamson, Craig; Storey, John M. D.; Harrison, William T. A.","1-[(<i>S</i>)-1-Phenylethyl]-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","8","o3482","o3482","10.1107/S1600536807029637","","","0.71073","MoKα","","0.0365","0.0324","","","0.0777","0.0805","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214818","10.73","0.002","10.929","0.003","11.647","0.003","105.21","0.03","99.49","0.02","108.34","0.02","1204.5","0.6","294","2","293","2","","","","","","","","3","P -1","-P 1","2","4-(4-methylphenyl)-3-(2-pyridyl)-4H-1,2,4-triazole","4-(4-methylphenyl)-3-(2-pyridyl)-4H-1,2,4-triazole","","- C14 H12 N4 -","- C14 H12 N4 -","- C56 H48 N16 -","4","2","OM2137","Mazur, Liliana; Koziol, Anna E.; Modzelewska-Banachiewicz, Bozena","4-(4-Methylphenyl)-3-(2-pyridyl)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2007","63","8","o3455","o3455","10.1107/S1600536807032990","","","1.54178","CuKα","","0.1888","0.0533","","","0.1193","0.1642","","","","","","0.959","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214819","20.2987","0.0005","9.6934","0.0003","19.0726","0.0006","90","","114.846","0.001","90","","3405.43","0.17","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(3-Methyl-5-phenoxy-1-phenylpyrazol-4-yl)-1,3,4-thiadiazol-2-amine","","- C18 H15 N5 O S -","- C18 H15 N5 O S -","- C144 H120 N40 O8 S8 -","8","2","OM2139","Yan-Rong Sun; Gang Liu; Chen-Jiang Liu; Ji-De Wang","5-(3-Methyl-5-phenoxy-1-phenylpyrazol-4-yl)-1,3,4-thiadiazol-2-amine","Acta Crystallographica Section E","2007","63","8","o3509","o3509","10.1107/S1600536807034009","","","0.71073","MoKα","","0.0412","0.0358","","","0.0976","0.1009","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214820","14.4793","0.0002","8.052","0.0001","19.1935","0.0004","90","","90","","90","","2237.72","0.06","297","2","297","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4,6-Dimethylbenzene-1,3-disulfonamide","","- C8 H12 N2 O4 S2 -","- C8 H12 N2 O4 S2 -","- C64 H96 N16 O32 S16 -","8","1","OM2140","B. Thimme Gowda; K. S. Babitha; Miroslav Tokarčík; Jozef Kožíšek; Hartmut Fuess","4,6-Dimethylbenzene-1,3-disulfonamide","Acta Crystallographica Section E","2007","63","8","o3361","o3361","10.1107/S1600536807031297","","","0.71073","MoKα","","0.0421","0.0322","","","0.096","0.0992","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214821","10.0996","0.0006","12.3843","0.0007","12.4174","0.0007","60.771","0.003","73.256","0.004","71.768","0.003","1270.06","0.13","291","2","291","2","","","","","","","","3","P -1","-P 1","2","Bis(N-2-tert-butylphenyl)imineacenaphthene","1,2-Bis(2-<i>tert</i>-butylphenylimino)-1,2-dihydroacenaphthylene","","- C32 H32 N2 -","- C32 H32 N2 -","- C64 H64 N4 -","2","1","OM2141","Ferreira, L. C.; Filgueiras, Carlos A. L.; Horner, M.; Visentin, Lorenzo do C.; Bordinhao, Jairo","1,2-Bis(2-<i>tert</i>-butylphenylimino)-1,2-dihydroacenaphthylene","Acta Crystallographica Section E","2007","63","8","o3427","o3427","10.1107/S1600536807032011","","","0.71073","MoKα","","0.1183","0.0437","","","0.0736","0.0788","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214822","5.261","0.0015","6.044","0.0013","18.807","0.0019","90","","92.839","0.012","90","","597.3","0.2","293","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5,5'-Dinitro-2,2'-dithiodipyridine","","- C10 H6 N4 O4 S2 -","- C10 H6 N4 O4 S2 -","- C20 H12 N8 O8 S4 -","2","0.5","OM2142","Brito, Iván; Mundaca, Aldo; Cárdenas, Alejandro; López-Rodríguez, Matías; Vargas, Danitza","5,5'-Dinitro-2,2'-dithiodipyridine","Acta Crystallographica Section E","2007","63","8","o3351","o3352","10.1107/S1600536807031091","","","0.71073","MoKα","","","0.0591","","","","0.1394","","","","","","1.077","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214823","8.8488","0.0008","21.5285","0.0019","13.5042","0.0011","90","","97.144","0.004","90","","2552.6","0.4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[(μ~2~-trans-di-4-pyridylethylene-κ^2^N:N')(μ~2~-fumarato-\ κ^2^O:O')zinc(II)]","","- C16 H12 N2 O4 Zn -","- C16 H12 N2 O4 Zn -","- C64 H48 N8 O16 Zn4 -","4","0.5","PK2035","Xu, Ji-Yang; Hurtado, Eric J.; Lobkovsky, Emil B.; Chen, Banglin","Poly[(μ~2~-<i>trans</i>-di-4-pyridylethylene-κ^2^<i>N</i>:<i>N</i>')(μ~2~-fumarato-κ^2^<i>O</i>:<i>O</i>')zinc(II)]","Acta Crystallographica Section E","2007","63","8","m2205","m2205","10.1107/S1600536807035209","","","0.71073","MoKα","","0.0279","0.0241","","","0.0729","0.0733","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214824","13.471","0.003","11.226","0.002","19.605","0.004","90","","94.36","0.03","90","","2956.2","1","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Di-μ-azido-κ^4^N:N-bis[(azido-κN)(2,9-dimethyl-1,10-phenanthroline- κN,N)nickel(II)]","","- C28 H24 N16 Ni2 -","- C28 H24 N16 Ni2 -","- C112 H96 N64 Ni8 -","4","0.5","PK2037","Li, Ling-Ling; Liu, Tian-Fu","Di-μ-azido-κ^4^<i>N</i>:<i>N</i>-bis[(azido-κ<i>N</i>)(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nickel(II)]","Acta Crystallographica Section E","2007","63","8","m2211","m2211","10.1107/S1600536807035313","","","0.71073","MoKα","","0.0804","0.0332","","","0.0726","0.0825","","","","","","0.93","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214825","8.0837","0.0008","10.9362","0.0017","13.469","0.0015","90","","90","","90","","1190.7","0.3","290","2","290","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Tri-2-furyl-phosphine oxide","","- C12 H9 O4 P -","- C12 H9 O4 P -","- C48 H36 O16 P4 -","4","1","PK2038","Jenkins, Darkus; Sykora, Richard E.; Assefa, Zerihun","Tri-2-furyl-phosphine oxide: an oxidation product of the weak Lewis base tri-2-furylphosphine","Acta Crystallographica Section E","2007","63","8","o3510","o3511","10.1107/S1600536807034125","","","0.71073","MoKα","","0.038","0.0345","","","0.0972","0.0993","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214826","19.301","0.004","14.725","0.003","18.583","0.004","90","","90","","90","","5281.4","1.9","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","1-(Benzylideneacetyl)-2-phenyl-1,2,3,5,10,10a-hexahydro- 1<i>H</i>-pyrrolo[1,2-<i>b</i>]isoquinoline-3-spiro-3'(2'<i>H</i>)-1<i>H</i>- indol-3'-one","","- C34 H28 N2 O2 -","- C34 H28 N2 O2 -","- C272 H224 N16 O16 -","8","2","PR2006","D. Gayathri; R. M. Sethukkarasi; D. Velmurugan; K. Ravikumar; G. Periyasami","1-(Benzylideneacetyl)-2-phenyl-1,2,3,5,10,10a-hexahydro-1<i>H</i>-pyrrolo[1,2-<i>b</i>]isoquinoline-3-spiro-3'(2'<i>H</i>)-1<i>H</i>-indol-3'-one","Acta Crystallographica Section E","2007","63","8","o3490","o3490","10.1107/S160053680703348X","","","0.71073","MoKα","","0.0624","0.0501","","","0.1153","0.1221","","","","","","1.12","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2214827","29.017","0.007","5.8088","0.0014","8.4868","0.001","90","","93.308","0.016","90","","1428.1","0.5","298","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(4-Methoxyphenyl)-5-phenylpenta-2,4-dien-1-one","","- C18 H16 O2 -","- C18 H16 O2 -","- C72 H64 O8 -","4","1","PR2008","Fischer, Andreas; Yathirajan, H. S.; Sarojini, B. K.; Bindya, S.; Narayana, B.","1-(4-Methoxyphenyl)-5-phenylpenta-2,4-dien-1-one","Acta Crystallographica Section E","2007","63","8","o3540","o3540","10.1107/S1600536807033491","","","0.71073","MoKα","","0.1188","0.0622","","","0.117","0.1426","","","","","","1.118","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2214828","10.6123","0.0005","18.7414","0.0006","12.4631","0.0009","90","","113.82","0.001","90","","2267.6","0.2","300","2","300","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-{1-[(2-Chlorothiazol-5-yl)methyl]-2-[(2-chlorothiazol-5-yl)methylsulfanyl]- 4-methyl-6-phenyl-1,6-dihydropyrimidin-5-yl}ethanone","","- C21 H18 Cl2 N4 O S3 -","- C21 H18 Cl2 N4 O S3 -","- C84 H72 Cl8 N16 O4 S12 -","4","1","PR2011","Xiao-Fei Zhu; De-Qing Shi; Fang Luo; Zhi-Fang Wang","1-{1-[(2-Chlorothiazol-5-yl)methyl]-2-[(2-chlorothiazol-5-yl)methylsulfanyl]-4-methyl-6-phenyl-1,6-dihydropyrimidin-5-yl}ethanone","Acta Crystallographica Section E","2007","63","8","o3516","o3516","10.1107/S1600536807033764","","","0.71073","MoKα","","0.0578","0.047","","","0.1278","0.1343","","","","","","1.072","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214829","11.6385","0.0006","8.7955","0.0005","14.9357","0.0008","90","","107.221","0.001","90","","1460.37","0.14","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis(pyridine-2-carboxylato)magnesium(II) 0.15-hydrate","","- C12 H12.3 Mg N2 O6.15 -","- C12 H12.3 Mg N2 O6.15 -","- C48 H49.2 Mg4 N8 O24.6 -","4","1","PR2012","Aghabozorg, Hossein; Motyeian, Elham; A. Sharif, Mahboubeh; Ghadermazi, Mohammad; Attar Gharamaleki, Jafar","Diaquabis(pyridine-2-carboxylato)magnesium(II) 0.15-hydrate","Acta Crystallographica Section E","2007","63","8","m2235","m2236","10.1107/S1600536807036604","","","0.71073","MoKα","","0.0416","0.0321","","","0.0854","0.0902","","","","","","1.04","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214830","10.8399","0.0006","11.6307","0.0007","15.3585","0.0009","73.48","0.001","73.554","0.001","73.003","0.001","1732.56","0.17","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","2,8,14,20-<i>para-</i>Methoxytetraphenylpyrogallol[4]arene dimethylformamide hexasolvate","","- C74 H90 N6 O22 -","- C74 H90 N6 O22 -","- C74 H90 N6 O22 -","1","0.5","PV2012","Zambrano, Cesar; Thomas, Ray E.; Zeller, Matthias; Salvatore, Ralph N.; Dueno, Eric E.","2,8,14,20-<i>para-</i>Methoxytetraphenylpyrogallol[4]arene dimethylformamide hexasolvate","Acta Crystallographica Section E","2007","63","8","o3452","o3453","10.1107/S1600536807021757","","","0.71073","MoKα","","0.0598","0.0509","","","0.1351","0.1432","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214831","11.6817","0.0004","5.5845","0.0002","16.4627","0.0006","90","","122.372","0.003","90","","907.06","0.06","170","2","170","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>N</i>,<i>N</i>,<i>N'</i>,<i>N'</i>-tetrakis(carboxymethyl)ethylenediammonium dichloride trihydrate","","- C10 H24 Cl2 N2 O11 -","- C10 H24 Cl2 N2 O11 -","- C20 H48 Cl4 N4 O22 -","2","0.5","PV2016","Kaluđerović, Goran N.; Gómez-Ruiz, Santiago; Schmidt, Harry; Steinborn, Dirk","A monoclinic form of <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis(carboxymethyl)ethylenediammonium dichloride trihydrate","Acta Crystallographica Section E","2007","63","8","o3491","o3491","10.1107/S1600536807033569","","","0.71073","MoKα","","0.064","0.0335","","","0.0679","0.0749","","","","","","0.916","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214832","7.9501","0.0007","11.4298","0.0009","13.9491","0.0012","90","","90","","90","","1267.53","0.19","296","1","296","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","2,2'-Azobis(6-methyl-5-chloropyridine)","(E)-1,2-Bis(5-chloro-6-methylpyridin-2-yl)diazene","","- C12 H10 Cl2 N4 -","- C12 H10 Cl2 N4 -","- C48 H40 Cl8 N16 -","4","0.5","PV2018","Odabaşoğlu, Mustafa; Arslan, Figen; Ölmez, Halis; Büyükgüngör, Orhan","(<i>E</i>)-1,2-Bis(5-chloro-6-methylpyridin-2-yl)diazene","Acta Crystallographica Section E","2007","63","8","o3654","o3654","10.1107/S1600536807036793","","","0.71073","MoKα","","0.0626","0.0534","","","0.1648","0.1713","","","","","","1.088","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214833","6.6023","0.0004","15.7426","0.001","7.0057","0.0004","90","","106.021","0.001","90","","699.87","0.07","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","diethylmethyleneammonium chloride","diethylmethyleniminium chloride","","- C5 H12 Cl N -","- C5 H12 Cl N -","- C20 H48 Cl4 N4 -","4","1","PV2019","Boeré, René T.","Diethylmethyleniminium chloride","Acta Crystallographica Section E","2007","63","8","o3581","o3581","10.1107/S160053680703499X","","","0.71073","MoKα","","0.0219","0.0214","","","0.058","0.0584","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214834","8.1315","0.0012","7.3189","0.001","15.104","0.003","90","","98.178","0.014","90","","889.8","0.3","291","1","291","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Methyl-4-nitro-1-(3-pyridyl)-1H-imidazole","","- C9 H8 N4 O2 -","- C9 H8 N4 O2 -","- C36 H32 N16 O8 -","4","1","RK2016","Kubicki, Maciej; Wagner, Paweł","2-Methyl-4-nitro-1-(3-pyridyl)-1<i>H</i>-imidazole","Acta Crystallographica Section E","2007","63","8","o3454","o3454","10.1107/S1600536807023884","","","0.71073","MoKα","","0.0493","0.0409","","","0.1132","0.1229","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214835","7.7413","0.0016","14.37","0.003","15.951","0.003","90","","90","","90","","1774.4","0.6","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(S)-N-(Phenylsulfanyl-[1,2-^13^C~2~]-acetyl)-2,10-camphorsultam","","- C18 H23 N O3 S2 -","- C18 H23 N O3 S2 -","- C72 H92 N4 O12 S8 -","4","1","RK2019","Ernest M. Asani; David R. Glass; Rodolfo A. Martinez; Tatiana V. Timofeeva","(<i>S</i>)-<i>N</i>-(Phenylsulfanyl-[1,2-^13^<i>C</i>~2~]-acetyl)-2,10-camphorsultam","Acta Crystallographica Section E","2007","63","8","o3450","o3450","10.1107/S1600536807031935","","","0.71073","MoKα","","0.0223","0.022","","","0.0567","0.0569","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214836","13.3013","0.0007","11.5852","0.0006","19.9867","0.001","90","","90","","90","","3079.9","0.3","300","2","300","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","3a,6a-Dipropoxycarbonylglycoluril","dipropyl 2,5-dioxoperhydroimidazo[4,5-d]imidazole-3a,6a-dicarboxylate","","- C12 H18 N4 O6 -","- C12 H18 N4 O6 -","- C96 H144 N32 O48 -","8","1","RK2021","Wang, Yu-Zhou; Gao, Meng; Cao, Li-Ping","3a,6a-Dipropoxycarbonylglycoluril (dipropyl 2,5-dioxoperhydroimidazo[4,5-<i>d</i>]imidazole-3a,6a-dicarboxylate)","Acta Crystallographica Section E","2007","63","8","o3419","o3419","10.1107/S1600536807032485","","","0.71073","MoKα","","0.0726","0.0558","","","0.1418","0.1516","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214837","19.322","0.006","7.482","0.004","14.104","0.003","90","","98.27","0.02","90","","2017.8","1.3","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Benzyl 4-ethyl-3-methyl-5-(phthalimidomethyl)pyrrole-2-carboxylate","","- C24 H22 N2 O4 -","- C24 H22 N2 O4 -","- C96 H88 N8 O16 -","4","1","RK2022","Senge, Mathias O.","Benzyl 4-ethyl-3-methyl-5-(phthalimidomethyl)pyrrole-2-carboxylate","Acta Crystallographica Section E","2007","63","8","o3363","o3363","10.1107/S1600536807031820","","","0.71073","MoKα","","0.0569","0.0439","","","0.1087","0.1179","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214838","9.0846","0.0017","12.0397","0.0018","17.667","0.002","76.951","0.009","89.617","0.01","75.534","0.012","1820.2","0.5","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","1,3-bis(3,5,3'',5''-tetramethyl-1,1':3';1''-terphenyl-2'-yl)triazene","","- C44 H43 N3 -","- C44 H43 N3 -","- C88 H86 N6 -","2","1","RK2023","Balireddi, Sreenivas; Niemeyer, Mark","A sterically crowded triazene: 1,3-bis(3,5,3'',5''-tetramethyl-1,1':3';1''-terphenyl-2'-yl)triazene","Acta Crystallographica Section E","2007","63","8","o3525","o3525","10.1107/S1600536807031923","","","0.71073","MoKα","","0.0656","0.0538","","","0.1536","0.1596","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214839","14.4376","0.0011","15.2861","0.0012","8.0888","0.0006","90","","90","","90","","1785.2","0.2","150","1","150","1","","","","","","","","4","P 21 21 2","P 2 2ab","18","","cis-Bis(tricyanomethanido-κN)[tris(2-aminoethyl)amine-κ^4^N]nickel(II))","","- C14 H18 N10 Ni -","- C14 H18 N10 Ni -","- C56 H72 N40 Ni4 -","4","1","RK2024","Potočňák, Ivan; Lancz, Gábor; Růžička, Aleš; Jäger, Lothar","<i>cis</i>-Bis(tricyanomethanido-κ<i>N</i>)[tris(2-aminoethyl)amine-κ^4^<i>N</i>]nickel(II)","Acta Crystallographica Section E","2007","63","8","m2072","m2073","10.1107/S1600536807031807","","","0.71073","MoKα","","0.0692","0.0406","","","0.0789","0.0906","","","","","","1.101","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214840","7.58","0.002","10.339","0.003","10.371","0.003","74.593","0.015","81.568","0.017","83.781","0.016","773","0.4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Poly[1-methyl-1-carboxymethyl-3-methylimidazolium [aqua-di-μ~3~-chlorido-di-μ~2~-chlorido-chloridodicadmate(II)]]","","- C6 H11 Cd2 Cl5 N2 O3 -","- C6 H11 Cd2 Cl5 N2 O3 -","- C12 H22 Cd4 Cl10 N4 O6 -","2","1","RK2025","Xia Shi; Jie Zhang; Tao-Kai Ying; Guo-Liang Zhao","Poly[1-carboxymethyl-3-methylimidazolium [aquadi-μ~3~-chlorido-di-μ~2~-chlorido-chloridodicadmate(II)]]","Acta Crystallographica Section E","2007","63","8","m2157","m2157","10.1107/S1600536807033508","","","0.71073","MoKα","","0.0252","0.0211","","","0.0545","0.0563","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214841","13.9986","0.0003","11.3819","0.0002","12.8982","0.0002","90","","102.013","0.001","90","","2010.08","0.06","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[diaqua(6-carboxypyridine-2-carboxylato)terbium(III)]-μ- pyridine-2,6-dicarboxylato] tetrahydrate]","","- C14 H19 N2 O14 Tb -","- C14 H19 N2 O14 Tb -","- C56 H76 N8 O56 Tb4 -","4","1","RK2026","Hao, Lu-Jiang; Yu, Tong-Li","<i>catena</i>-Poly[[[diaqua(6-carboxypyridine-2-carboxylato)terbium(III)]-μ-pyridine-2,6-dicarboxylato] tetrahydrate]","Acta Crystallographica Section E","2007","63","8","m2182","m2183","10.1107/S1600536807034629","","","0.71073","MoKα","","0.0456","0.0423","","","0.1274","0.131","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214842","19.1173","0.0008","10.9251","0.0005","7.7581","0.0003","90","","93.416","0.002","90","","1617.47","0.12","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4'-Phenyl-2,2':6',2''-terpyridine 1,1''-dioxide","","- C21 H15 N3 O2 -","- C21 H15 N3 O2 -","- C84 H60 N12 O8 -","4","0.5","RN2022","G. M. Golzar Hossain; Afroza Banu; A. J. Amoroso","4'-Phenyl-2,2':6',2''-terpyridine 1,1''-dioxide","Acta Crystallographica Section E","2007","63","8","o3607","o3607","10.1107/S1600536807035398","","","0.71073","MoKα","","0.0696","0.0446","","","0.1116","0.1256","","","","","","1.014","","","","has coordinates,has Fobs","201206","2020-10-21","18:00:00",""
"2214843","8.3874","0.0006","8.9727","0.0007","13.4394","0.001","87.5385","0.001","84.0111","0.0011","87.8028","0.0011","1004.39","0.13","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Tetra-μ-acetato-bis{[<i>N</i>-(4-methylphenyl)pyridine-3-\ carboxamide]copper(II)} ethanol disolvate","","- C38 H48 Cu2 N4 O12 -","- C38 H48 Cu2 N4 O12 -","- C38 H48 Cu2 N4 O12 -","1","0.5","RZ2147","Shi, Chun-Yue; Ge, Chun-Hua; Song, Xi-Ming; Liu, Qi-Tao","Tetra-μ-acetato-bis{[<i>N</i>-(4-methylphenyl)pyridine-3-carboxamide]copper(II)} ethanol disolvate","Acta Crystallographica Section E","2007","63","8","m2104","m2105","10.1107/S1600536807032849","","","0.71073","MoKα","","0.0345","0.0323","","","0.0867","0.0885","","","","","","1.078","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214844","7.496","0.002","12.345","0.004","15.426","0.005","90","","102.052","0.006","90","","1396","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-Amino-1-(5-methyl-1-phenylpyrazol-4-ylcarbonyl)pyrazole-4-carbonitrile","","- C15 H12 N6 O -","- C15 H12 N6 O -","- C60 H48 N24 O4 -","4","1","RZ2149","Jia-Cheng Li; Yu-Hong Feng; Qiang Lin; De-La Zhang","5-Amino-1-(5-methyl-1-phenylpyrazol-4-ylcarbonyl)pyrazole-4-carbonitrile","Acta Crystallographica Section E","2007","63","8","o3467","o3467","10.1107/S1600536807030425","","","0.71073","MoKα","","0.0838","0.0458","","","0.0992","0.115","","","","","","0.997","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214845","9.2841","0.0018","8.5863","0.0016","31.124","0.006","90","","99.917","0.005","90","","2444","0.8","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,10-Phenanthrolin-1-ium 1-oxo-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-4-carboxylate 1-oxo-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-4-carboxylic acid monohydrate","","- C22 H24 N2 O13 P2 -","- C22 H24 N2 O13 P2 -","- C88 H96 N8 O52 P8 -","4","1","RZ2150","Wang, Zhi; Zang, Hong-Jun; Guo, Ming-Lin","1,10-Phenanthrolin-1-ium 1-oxo-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-4-carboxylate 1-oxo-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-4-carboxylic acid monohydrate","Acta Crystallographica Section E","2007","63","8","o3418","","10.1107/S1600536807032813","","","0.71073","MoKα","","0.1017","0.0532","","","0.1349","0.1592","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214846","14.1631","0.0012","6.5833","0.0006","15.0751","0.0013","90","","114.771","0.001","90","","1276.27","0.19","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[4-(dimethylamino)pyridinium] bis(1,2-dicyanoethylene-1,2-dithiolato-κ^2^S,S')nickelate(II)","","- C22 H22 N8 Ni S4 -","- C22 H22 N8 Ni S4 -","- C44 H44 N16 Ni2 S8 -","2","0.5","RZ2152","Jia-Rong Zhou; Yong Hou; Chun-Lin Ni","Bis[4-(dimethylamino)pyridinium] bis(1,2-dicyanoethylene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(II)","Acta Crystallographica Section E","2007","63","8","m2030","m2030","10.1107/S1600536807031157","","","0.71073","MoKα","","0.0316","0.028","","","0.0772","0.079","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214847","6.954","0.0014","20.492","0.004","8.1272","0.0016","90","","92.53","0.03","90","","1157","0.4","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-Methyl-N-methylsulfonyl-2-nitrobenzenesulfonamide","","- C8 H10 N2 O6 S2 -","- C8 H10 N2 O6 S2 -","- C32 H40 N8 O24 S8 -","4","1","RZ2153","Xu-Yun Li; Zu-Wei Song; Wen-Ping Shi; Zhi-Qiang Hu","<i>N</i>-Methyl-<i>N</i>-methylsulfonyl-2-nitrobenzenesulfonamide","Acta Crystallographica Section E","2007","63","8","o3520","o3520","10.1107/S1600536807033946","","","0.71073","MoKα","","0.0256","0.0243","","","0.0643","0.0651","","","","","","1.076","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214848","8.2169","0.0006","15.8825","0.0012","21.7738","0.0016","90","","90","","90","","2841.6","0.4","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3,4-Di-O-acetyl-2-azidodeoxy-1-O-nitro-α-L-fucose","","- C10 H14 N4 O8 -","- C10 H14 N4 O8 -","- C80 H112 N32 O64 -","8","2","RZ2154","McCutcheon, David C.; Norris, Peter; Zeller, Matthias","3,4-Di-<i>O</i>-acetyl-2-azidodeoxy-1-<i>O</i>-nitro-α-<small>L</small>-fucose","Acta Crystallographica Section E","2007","63","8","o3484","o3484","10.1107/S160053680703303X","","","0.71073","MoKα","","0.0348","0.033","","","0.0825","0.084","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214849","7.5228","0.001","10.034","0.0014","12.3933","0.0019","78.242","0.003","73.266","0.002","73.751","0.002","852.3","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[1,10-phenanthrolin-1-ium [[dichloridoantimonate(III)]-di- μ-chlorido] methanol solvate]","","- C13 H13 Cl4 N2 O Sb -","- C13 H13 Cl4 N2 O Sb -","- C26 H26 Cl8 N4 O2 Sb2 -","2","1","RZ2155","Jun Zhai; Handong Yin; Feng Li; Daqi Wang","<i>catena</i>-Poly[1,10-phenanthrolin-1-ium [[dichloridoantimonate(III)]-di-μ-chlorido] methanol solvate]","Acta Crystallographica Section E","2007","63","8","m2165","m2165","10.1107/S1600536807034344","","","0.71073","MoKα","","0.0355","0.0283","","","0.0696","0.0772","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214850","21.9546","0.0011","6.9806","0.0004","22.6474","0.0011","90","","90","","90","","3470.9","0.3","110","2","110","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","Acetonitrile(6,6'-dimethyl-2,2'-dipyridyl)silver(I) trifluoromethanesulfonate","","- C15 H15 Ag F3 N3 O3 S -","- C15 H15 Ag F3 N3 O3 S -","- C120 H120 Ag8 F24 N24 O24 S8 -","8","1","RZ2157","Klausmeyer, Kevin K.; Hung-Low, Fernando; Renz, Amanda","Acetonitrile(6,6'-dimethyl-2,2'-dipyridyl)silver(I) trifluoromethanesulfonate","Acta Crystallographica Section E","2007","63","8","m2181","m2181","10.1107/S1600536807034617","","","0.71073","MoKα","","0.032","0.0253","","","0.0581","0.0621","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214851","10.037","0.003","17.264","0.005","13.006","0.004","90","","105.901","0.005","90","","2167.4","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","6-(2,6-Dichlorobenzyl)-5-ethyl-2-(4-methoxybenzylsulfanyl)pyrimidin-4(3H)-one","","- C21 H20 Cl2 N2 O2 S -","- C21 H20 Cl2 N2 O2 S -","- C84 H80 Cl8 N8 O8 S4 -","4","1","RZ2158","Yue-Ping Wang; Fen-Er Chen; Min-Qin Chen","6-(2,6-Dichlorobenzyl)-5-ethyl-2-(4-methoxybenzylsulfanyl)pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","8","o3590","o3590","10.1107/S1600536807034976","","","0.71073","MoKα","","0.1363","0.0693","","","0.192","0.2218","","","","","","0.869","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214852","10.7262","0.0015","17.971","0.003","9.0868","0.0013","90","","109.641","0.006","90","","1649.7","0.4","90","","90","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","dichloridodiphenylbis(pyrazine-2-carbaldehyde 4-ethylthiosemicarbazone)tin(IV)","","- C30 H36 Cl2 N10 S2 Sn -","- C30 H36 Cl2 N10 S2 Sn -","- C60 H72 Cl4 N20 S4 Sn2 -","2","0.5","RZ2159","Venkatraman, Ramaiyer; Sitole, Lungile; Adams, Tamarea D.; Cameron, Joseph A.; Fronczek, Frank R.","A diorganotin(IV) complex with pyrazine-2-carbaldehyde 4-ethylthiosemicarbazone","Acta Crystallographica Section E","2007","63","8","m2212","m2213","10.1107/S1600536807035052","","","0.71073","MoKα","","0.037","0.029","","","0.068","0.071","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214853","9.959","0.006","13.537","0.008","14.718","0.009","90","","96.186","0.01","90","","1973","2","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(5,8-diazoniadispiro[4.2.4.2]tetradecane) hexakis(thiocyanato-κN)nickel(II) dihydrate","","- C30 H52 N10 Ni O2 S6 -","- C30 H52 N10 Ni O2 S6 -","- C60 H104 N20 Ni2 O4 S12 -","2","0.5","RZ2160","Mao-Ping Song; Lin-Ke Li; Ben-Lai Wu; Yun-Yin Niu","Bis(5,8-diazoniadispiro[4.2.4.2]tetradecane) hexakis(thiocyanato-κ<i>N</i>)nickelate(II) dihydrate","Acta Crystallographica Section E","2007","63","8","m2217","m2217","10.1107/S1600536807035416","","","0.71073","MoKα","","0.0431","0.038","","","0.1006","0.1048","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214854","9.8919","0.0005","9.6229","0.0005","16.9226","0.0009","90","","91.685","0.001","90","","1610.14","0.14","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Methyl-5-phenyl-3-phenylsulfinyl-1-benzofuran","","- C21 H16 O2 S -","- C21 H16 O2 S -","- C84 H64 O8 S4 -","4","1","SG2178","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","2-Methyl-5-phenyl-3-phenylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2007","63","8","o3423","o3423","10.1107/S1600536807032199","","","0.71073","MoKα","","0.0506","0.0467","","","0.1091","0.1114","","","","","","1.163","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214855","20.5388","0.0004","4.455","0.0001","16.5764","0.0005","90","","114.955","0.002","90","","1375.14","0.06","100","0.1","100","0.1","","","","","","","","4","C 1 c 1","C -2yc","9","","3-ethyl 1-methyl pyrrolo[2,1-a]isoquinoline-1,3-dicarboxylate","","- C17 H15 N O4 -","- C17 H15 N O4 -","- C68 H60 N4 O16 -","4","1","SG2179","Hoong-Kun Fun; Suchada Chantrapromma; Yun Liu; Jian-Hua Xu","3-Ethyl 1-methyl pyrrolo[2,1-<i>a</i>]isoquinoline-1,3-dicarboxylate","Acta Crystallographica Section E","2007","63","8","o3434","o3434","10.1107/S1600536807032357","","","0.71073","MoKα","","0.0405","0.0375","","","0.0986","0.1008","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214856","6.016","0.002","8.43","0.002","14.721","0.004","101.501","0.004","100.057","0.004","93.977","0.004","716.1","0.4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","1-(3,4-Dichlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethyleneamino N-methylcarbamate","","- C12 H11 Cl2 N5 O2 -","- C12 H11 Cl2 N5 O2 -","- C24 H22 Cl4 N10 O4 -","2","1","SG2181","Shu-Yan Niu; Gong-Sheng Zhang; Yu-Xiang Jiang; Pu-Yong Zhang; Liang-Zhong Xu","1-(3,4-Dichlorophenyl)-2-(1<i>H</i>-1,2,4-triazol-1-yl)ethyleneamino <i>N-</i>methylcarbamate","Acta Crystallographica Section E","2007","63","8","o3512","o3512","10.1107/S1600536807033880","","","0.71073","MoKα","","0.0598","0.041","","","0.1","0.1114","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214857","19.826","0.004","11.702","0.002","8.146","0.002","90","","99.92","0.03","90","","1861.6","0.7","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","6,6'-Dibromo-4,4'-dimethyl-3,3'-methylenebi(2<i>H</i>,4<i>H</i>- benz[<i>e</i>][1,3]oxazine)","","- C19 H20 Br2 N2 O2 -","- C19 H20 Br2 N2 O2 -","- C76 H80 Br8 N8 O8 -","4","0.5","SG2184","Guang-You Zhang; Ming Li; Wan-Hui Wang; Zhen-Wang Qian","6,6'-Dibromo-4,4'-dimethyl-3,3'-methylenebi(2<i>H</i>,4<i>H</i>-benz[<i>e</i>][1,3]oxazine)","Acta Crystallographica Section E","2007","63","8","o3483","o3483","10.1107/S1600536807033089","","","0.71073","MoKα","","0.0447","0.0327","","","0.0705","0.0754","","","","","","1.082","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214859","7.8311","0.0005","13.646","0.0007","11.38","0.0008","90","","92.005","0.005","90","","1215.36","0.13","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Bromo-N'-isopropylidene-5-methoxybenzohydrazide","","- C11 H13 Br N2 O2 -","- C11 H13 Br N2 O2 -","- C44 H52 Br4 N8 O8 -","4","1","SG2187","Sarojini, B. K.; Yathirajan, H. S.; Sunil, K.; Narayana, B.; Bolte, Michael","2-Bromo-<i>N</i>'-isopropylidene-5-methoxybenzohydrazide","Acta Crystallographica Section E","2007","63","8","o3487","o3487","10.1107/S1600536807033090","","","0.71073","MoKα","","0.0484","0.0399","","","0.0832","0.0863","","","","","","1.169","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214860","11.823","0.002","18.307","0.004","31.517","0.006","90","","90","","90","","6822","2","170","2","170","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","bis(4,4'-bipyridinium) bis(μ~5~-hydrogen phosphate)pentakis(μ~2~-oxido)decaoxidopentamolybdate dihydrate","","- C20 H26 Mo5 N4 O25 P2 -","- C20 H26 Mo5 N4 O25 P2 -","- C160 H208 Mo40 N32 O200 P16 -","8","1","SI2017","Wu-Hua Chen; Yong Xiang; Zhan-Feng Chen; Qiu-Mu Wu; Qing-Xin Zeng","Bis(4,4'-bipyridinium) bis(μ~5~-hydrogen phosphate)pentakis(μ~2~-oxido)decaoxidopentamolybdate dihydrate","Acta Crystallographica Section E","2007","63","8","m2245","m2246","10.1107/S1600536807033119","","","0.71073","MoKα","","0.0256","0.0204","","","0.0493","0.0517","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214861","13.513","0.007","8.135","0.004","16.312","0.008","90","","99.518","0.009","90","","1768.5","1.5","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-[(2,4-Diethoxyphenyl)(hydroxy)methylene]-1-isopropylpyrrolidine-2,4-dione","","- C18 H23 N O5 -","- C18 H23 N O5 -","- C72 H92 N4 O20 -","4","1","SI2023","Gui-Sheng Yu; Hai-Zhen Xu; You-Quan Zhu","3-[(2,4-Diethoxyphenyl)(hydroxy)methylene]-1-isopropylpyrrolidine-2,4-dione","Acta Crystallographica Section E","2007","63","8","o3384","o3384","10.1107/S1600536807030759","","","0.71073","MoKα","","0.1028","0.0519","","","0.1237","0.1555","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214862","8.6227","0.0008","14.6503","0.0013","9.2118","0.0008","90","","107.339","0.002","90","","1110.8","0.17","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2-bromobenzyl)dimethylammonium bromide","","- C9 H13 Br2 N -","- C9 H13 Br2 N -","- C36 H52 Br8 N4 -","4","1","SI2024","Varga, Richard A.; Silvestru, Cristian","Hydrogen bonding in (2-bromobenzyl)dimethylammonium bromide","Acta Crystallographica Section E","2007","63","8","o3381","o3381","10.1107/S1600536807031947","","","0.71073","MoKα","","0.0592","0.0495","","","0.1066","0.1101","","","","","","1.169","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214863","9.9157","0.0009","12.3466","0.0011","23.058","0.002","90","","90","","90","","2822.9","0.4","273","2","273","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1-Dehydroabietyl-4,5-diphenyl-1<i>H</i>-imidazole","1-(7-isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthren- 1-ylmethyl)-4,5-diphenyl-1<i>H</i>-imidazole","","- C35 H40 N2 -","- C35 H40 N2 -","- C140 H160 N8 -","4","1","SI2025","Dawei Jiang; Min Hong; Fei Qiu; Jin Zhu; Lequn Huang","1-Dehydroabietyl-4,5-diphenyl-1<i>H</i>-imidazole","Acta Crystallographica Section E","2007","63","8","o3623","o3624","10.1107/S1600536807035878","","","0.71073","MoKα","","0.0741","0.0387","","","0.088","0.1024","","","","","","0.79","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214864","11.191","0.003","12.809","0.003","20.489","0.005","101.419","0.003","96.138","0.004","90.242","0.004","2861.4","1.2","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","[μ-1-Benzyl-4-(4-<i>tert</i>-butylphenyl)piperazine- κ^2^N:N']bis[trimethylaluminium(III)]","","- C27 H46 Al2 N2 -","- C27 H46 Al2 N2 -","- C108 H184 Al8 N8 -","4","2","SI2027","Yang, Li-Chao; Xu, Qiang-Guo; Ou, Jia-Bao; Li, Yi-Zhi; Wu, Lin","[μ-1-Benzyl-4-(4-<i>tert</i>-butylphenyl)piperazine-κ^2^<i>N</i>:<i>N</i>']bis[trimethylaluminium(III)]","Acta Crystallographica Section E","2007","63","8","m2169","m2169","10.1107/S1600536807034435","","","0.71073","MoKα","","0.0905","0.0639","","","0.1302","0.1354","","","","","","1.011","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214865","9.2448","0.0014","7.2284","0.0011","25.934","0.004","90","","90.295","0.003","90","","1733","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","N-(biphenyl-4-carbonyl)-N'-(2-chlorophenyl)thiourea N-(2-chlorophenylcarbamothioyl)biphenyl-4-carboxamide","<i>N</i>-(Biphenyl-4-carbonyl)-<i>N</i>'-(2-chlorophenyl)thiourea","","- C20 H15 Cl N2 O S -","- C20 H15 Cl N2 O S -","- C80 H60 Cl4 N8 O4 S4 -","4","1","SI2028","Arif, M. Asyikin M.; Yamin, Bohari M","<i>N</i>-(Biphenyl-4-carbonyl)-<i>N</i>'-(2-chlorophenyl)thiourea","Acta Crystallographica Section E","2007","63","8","o3594","o3594","10.1107/S1600536807035179","","","0.71073","MoKα","","0.137","0.063","","","0.111","0.131","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214866","10.6481","0.0005","11.5153","0.0006","14.3315","0.0007","75.748","0.001","78.462","0.001","77.891","0.001","1644.75","0.14","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","2,8,14,20-Tetrakis(4-hydroxyphenyl)pyrogallol[4]arene dimethylformamide hexasolvate","","- C70 H82 N6 O22 -","- C70 H82 N6 O22 -","- C70 H82 N6 O22 -","1","0.5","SJ2285","Dueno, Eric E.; Ray, Thomas; Salvatore, Ralph N.; Zambrano, Cesar; Zeller, Matthias; Hunter, Allen D.","2,8,14,20-Tetrakis(4-hydroxyphenyl)pyrogallol[4]arene dimethylformamide hexasolvate","Acta Crystallographica Section E","2007","63","8","o3533","o3534","10.1107/S1600536807021071","","","0.71073","MoKα","","0.061","0.0543","","","0.1443","0.1508","","","","","","1.034","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214867","10.186","0.0005","10.6926","0.0006","14.5447","0.0008","71.906","0.001","82.71","0.001","64.272","0.001","1356.46","0.13","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","[1,4-Bis(diphenylphosphino)butane-κ^2^P,P'](dithiocarbonato-k^2^S,S')nickel(II)","","- C29 H28 Ni O P2 S2 -","- C29 H28 Ni O P2 S2 -","- C58 H56 Ni2 O2 P4 S4 -","2","1","TK2161","Câmpian, Marius V.; Haiduc, Ionel; Semeniuc, Radu F.","[1,4-Bis(diphenylphosphino)butane-κ^2^<i>P</i>,<i>P</i>'](dithiocarbonato-κ^2^<i>S</i>,<i>S</i>')nickel(II)","Acta Crystallographica Section E","2007","63","8","m2168","m2168","10.1107/S1600536807028760","","","0.71073","MoKα","","0.045","0.038","","","0.092","0.097","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214868","11.4194","0.0018","20.59","0.003","8.0325","0.0013","90","","90","","90","","1888.6","0.5","293","2","293","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","(E)-N-(1,3-Oxazolidin-2-ylidene)benzamide","","- C10 H10 N2 O2 -","- C10 H10 N2 O2 -","- C80 H80 N16 O16 -","8","1","TK2168","Hong-Gang An","(<i>E</i>)-<i>N</i>-(1,3-Oxazolidin-2-ylidene)benzamide","Acta Crystallographica Section E","2007","63","8","o3357","o3357","10.1107/S1600536807030772","","","0.71073","MoKα","","0.075","0.045","","","0.111","0.122","","","","","","0.91","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214869","14.5346","0.0006","15.5805","0.0007","20.1746","0.0009","90","","99.821","0.002","90","","4501.7","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,6,11,16,18,24,27,36-Octakis(trifluoromethyl)-1,6,11,16,18,24,27,36- octahydro(C~60~-I~h~)[5,6]fullerene deuterochloroform solvate","","- C69 Cl3 D F24 -","- C69 Cl3 D F24 -","- C276 Cl12 D4 F96 -","4","1","TK2170","Shustova, Natalia B.; Peryshkov, Dimitry V.; Kareev, Ivan E.; Boltalina, Olga V.; Strauss, Steven H.","1,6,11,16,18,24,27,36-Octakis(trifluoromethyl)-1,6,11,16,18,24,27,36-octahydro(C~60~‒<i>I~h~</i>)[5,6]fullerene deuterochloroform solvate","Acta Crystallographica Section E","2007","63","8","o3398","o3398","10.1107/S1600536807031704","","","0.71073","MoKα","","0.104","0.054","","","0.128","0.15","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214870","9.1886","0.0013","9.7175","0.0013","11.2807","0.001","73.755","0.006","79.612","0.006","63.056","0.005","860.38","0.19","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","5-Chloro-3-ethyl-N-(2-morpholin-4-ylethyl)-1H-indole-2-carboxamide","","- C17 H22 Cl N3 O2 -","- C17 H22 Cl N3 O2 -","- C34 H44 Cl2 N6 O4 -","2","1","TK2171","Muirhead, Kirsty E. A.; Trembleau, Laurent; Harrison, William T. A.","5-Chloro-3-ethyl-<i>N</i>-[2-(morpholin-4-yl)ethyl]-1<i>H</i>-indole-2-carboxamide","Acta Crystallographica Section E","2007","63","8","o3389","o3389","10.1107/S1600536807031285","","","0.71073","MoKα","","0.262","0.129","","","0.22","0.289","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214871","8.2527","0.0011","8.667","0.0009","12.4651","0.0017","80.067","0.013","86.26","0.012","73.94","0.01","843.8","0.19","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Dibromidobis(quinoxaline-κN)zinc(II)","","- C16 H12 Br2 N4 Zn -","- C16 H12 Br2 N4 Zn -","- C32 H24 Br4 N8 Zn2 -","2","1","TK2172","Markowitz, Brian M. E.; Turnbull, Mark M.; Awwadi, Firas F.","Dibromidobis(quinoxaline-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2007","63","8","m2043","m2043","10.1107/S1600536807031716","","","0.71073","MoKα","","0.112","0.055","","","0.109","0.129","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214872","6.119","0.003","10.22","0.006","14.401","0.008","90","","90","","90","","900.6","0.9","160","2","160","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","catena-Poly[N-methylmorpholinium [nickelate(II)-tri-μ-chlorido]]","","- C5 H12 Cl3 N Ni O -","- C5 H12 Cl3 N Ni O -","- C20 H48 Cl12 N4 Ni4 O4 -","4","0.5","TK2175","Turnbull, Mark M.","<i>catena</i>-Poly[<i>N</i>-methylmorpholinium [nickelate(II)-tri-μ-chlorido]]","Acta Crystallographica Section E","2007","63","8","m2148","m2148","10.1107/S1600536807033788","","","0.71073","MoKα","","0.094","0.05","","","0.092","0.106","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214873","11.4637","0.0009","11.9265","0.0009","14.9016","0.0012","90","","90","","90","","2037.4","0.3","291","2","291","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","trans-Bis[2-(2-bromobenzamido)-1,3-oxazoline(1-)-κ^2^N^1^,O]copper(II)","","- C20 H16 Br2 Cu N4 O4 -","- C20 H16 Br2 Cu N4 O4 -","- C80 H64 Br8 Cu4 N16 O16 -","4","0.5","TK2176","Yu-Wei Chang; Jing-Jun Yang","<i>trans</i>-Bis[2-(2-bromobenzamido)-1,3-oxazoline(1{-})-κ^2^<i>N</i>^1^,<i>O</i>]copper(II)","Acta Crystallographica Section E","2007","63","8","m2126","m2126","10.1107/S1600536807033272","","","0.71073","MoKα","","0.059","0.046","","","0.102","0.105","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214874","12.911","0.012","3.907","0.003","18.923","0.018","90","","105.46","0.014","90","","920","1.4","103","","103","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl 5-bromo-1H-indole-2-carboxylate","","- C10 H8 Br N O2 -","- C10 H8 Br N O2 -","- C40 H32 Br4 N4 O8 -","4","1","TK2177","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Ashalatha, B. V.; Narayana, B.","Methyl 5-bromo-1<i>H</i>-indole-2-carboxylate","Acta Crystallographica Section E","2007","63","8","o3505","o3505","10.1107/S160053680703379X","","","0.71073","MoKα","","0.123","0.063","","","0.126","0.145","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214875","18.7079","0.0018","9.0553","0.0013","18.661","0.002","90","","110.918","0.008","90","","2952.9","0.6","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis(2-aminothiazole-κN)cadmium(II)]-di-μ-thiocyanato- κ^2^N:S;κ^2^S:N]","","- C8 H8 Cd N6 S4 -","- C8 H8 Cd N6 S4 -","- C64 H64 Cd8 N48 S32 -","8","1","TK2178","Suh, Seung Wook; Kim, Chong-Hyeak; Kim, Inn Hoe","<i>catena</i>-Poly[[bis(2-aminothiazole-κ<i>N</i>)cadmium(II)]-di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>]","Acta Crystallographica Section E","2007","63","8","m2177","m2177","10.1107/S1600536807033983","","","0.71073","MoKα","","0.03","0.028","","","0.077","0.078","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214876","22.1182","0.0011","7.833","0.0004","14.6177","0.0007","90","","104.57","0.002","90","","2451.1","0.2","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrachlorido-1κCl,2κ^2^Cl,3κCl- bis[μ-4-undecyl-1,4,7-triazacyclonon-1-yl)acetato]-1κ^4^N,N',N'',O:2κO'; 2κO':3κ^4^N,N',N'',O-tricopper(II) dihydrate","","- C38 H80 Cl4 Cu3 N6 O6 -","- C38 H80 Cl4 Cu3 N6 O6 -","- C76 H160 Cl8 Cu6 N12 O12 -","2","0.5","TK2179","Nagel, Lilly; Forsyth, Craig M.; Martin, Lisandra L.","Tetrachlorido-1κ<i>Cl</i>,2κ^2^<i>Cl</i>,3κ<i>Cl</i>-bis[μ-4-undecyl-1,4,7-triazacyclonon-1-yl)acetato]-1κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>O</i>:2κ<i>O</i>';2κ<i>O</i>':3κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>O</i>-tricopper(II) dihydrate","Acta Crystallographica Section E","2007","63","8","m2193","m2193","10.1107/S1600536807034538","","","0.71073","MoKα","","0.096","0.084","","","0.138","0.142","","","","","","1.32","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214877","8.87","0.01","9.085","0.008","11.23","0.01","102.67","0.03","105.34","0.03","96.72","0.04","836.6","1.4","123.1","","","","","","","","","","","6","P -1","-P 1","2","","Chlorido(di-2-pyridylamine-κ^2^N,N')(4-nitrobenzoato-κ^2^O,O')copper(II)","","- C17 H13 Cl Cu N4 O4 -","- C17 H13 Cl Cu N4 O4 -","- C34 H26 Cl2 Cu2 N8 O8 -","2","1","TK2180","Okabe, Nobuo; Tsuji, Akio; Yodoshi, Masahiro","Chlorido(di-2-pyridylamine-κ^2^<i>N</i>,<i>N</i>')(4-nitrobenzoato-κ^2^<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section E","2007","63","8","m2162","m2162","10.1107/S1600536807033776","","","0.7107","MoKα","","","0.026","","","","0.078","","","","","","1.224","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2214878","11.5274","0.0003","8.6508","0.0002","12.1738","0.0004","90","","106.701","0.003","90","","1162.78","0.06","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","7-Fluoroisatin‒1,4-dioxane (1/1)","7-fluoroindoline-2,3-dione‒1,4-dioxane (1/1)","","- C12 H12 F N O4 -","- C12 H12 F N O4 -","- C48 H48 F4 N4 O16 -","4","1","TK2181","Shankland, Kenneth; Leech, Charlotte K.; Mohamed, Sharmarke; Barnett, Sarah A.; Tocher, Derek A.","7-Fluoroisatin‒1,4-dioxane (1/1)","Acta Crystallographica Section E","2007","63","8","o3574","o3574","10.1107/S1600536807035258","","","0.71073","MoKα","","0.062","0.039","","","0.092","0.103","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214879","7.4917","0.0012","8.4911","0.0014","8.9542","0.0015","106.207","0.002","98.648","0.002","96.242","0.003","533.89","0.15","150","2","150","2","","","","","","","","6","P -1","-P 1","2","7-Fluoroisatin‒dimethyl sulfoxide (1/1)","7-fluoroindoline-2,3-dione‒dimethyl sulfoxide (1/1)","","- C10 H10 F N O3 S -","- C10 H10 F N O3 S -","- C20 H20 F2 N2 O6 S2 -","2","1","TK2182","Mohamed, Sharmarke; Barnett, Sarah A.; Tocher, Derek A.","7-Fluoroisatin‒dimethyl sulfoxide (1/1)","Acta Crystallographica Section E","2007","63","8","o3575","o3575","10.1107/S160053680703526X","","","0.71073","MoKα","","0.031","0.031","","","0.084","0.085","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214880","8.2828","0.0013","8.3702","0.0013","8.7613","0.0014","91.326","0.002","117.099","0.002","97.337","0.002","534.02","0.15","150","2","150","2","","","","","","","","6","P -1","-P 1","2","5-Fluoroisatin‒dimethyl sufoxide (1/1)","5-fluoroindoline-2,3-dione‒dimethyl sulfoxide (1/1)","","- C10 H10 F N O3 S -","- C10 H10 F N O3 S -","- C20 H20 F2 N2 O6 S2 -","2","1","TK2183","Mohamed, Sharmarke; Barnett, Sarah A.; Tocher, Derek A.","5-Fluoroisatin‒dimethyl sufoxide (1/1)","Acta Crystallographica Section E","2007","63","8","o3576","o3576","10.1107/S1600536807035271","","","0.71073","MoKα","","0.034","0.032","","","0.086","0.087","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214881","7.94","0.0008","15.7867","0.0016","7.298","0.0008","90","","105.536","0.002","90","","881.35","0.16","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Fluoro-3-hydroxy-3-(nitromethyl)-1H-indol-2(3H)-one","","- C9 H7 F N2 O4 -","- C9 H7 F N2 O4 -","- C36 H28 F4 N8 O16 -","4","1","TK2184","Mohamed, Sharmarke; Barnett, Sarah A.; Tocher, Derek A.","5-Fluoro-3-hydroxy-3-(nitromethyl)-1<i>H</i>-indol-2(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","8","o3577","o3577","10.1107/S1600536807035283","","","0.71073","MoKα","","0.039","0.038","","","0.099","0.101","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214882","10.052","0.002","12.372","0.003","15.257","0.003","72.68","0.03","77.66","0.03","71.09","0.03","1699.1","0.7","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","bis[μ-(<i>E</i>)-1,5-dimethyl-2-phenyl-4-(3-pyridylmethyleneamino)pyrazol-\ 3(2H)-one]bis{dibromido[(<i>E</i>)-1,5-dimethyl-2-phenyl-4-(3-\ pyridylmethyleneamino)pyrazol-3(2H)-one]manganese(II)}","","- C68 H64 Br4 Mn2 N16 O4 -","- C68 H64 Br4 Mn2 N16 O4 -","- C68 H64 Br4 Mn2 N16 O4 -","1","0.5","WK2058","Wen-Na Zhao","A dinuclear manganese(II) complex with a 4-aminoantipyrine-derived Schiff base ligand","Acta Crystallographica Section E","2007","63","8","m2095","m2095","10.1107/S1600536807032461","","","0.71073","MoKα","","0.1397","0.058","","","0.0903","0.1139","","","","","","0.985","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214883","5.595","0.0017","15.847","0.005","16.156","0.005","90","","90","","90","","1432.5","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3S)-4-phenyl-3-(phenylaminooxy)butan-2-one","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C64 H68 N4 O8 -","4","1","WK2064","Yang, Li; Fang, Hua; Zheng, Hu; Weng, Ling-Ling","(3<i>S</i>)-4-Phenyl-3-(phenylaminooxy)butan-2-one","Acta Crystallographica Section E","2007","63","8","o3568","o3568","10.1107/S1600536807034733","","","0.71073","MoKα","","0.111","0.0553","","","0.1251","0.1453","","","","","","0.847","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214884","5.4051","0.0019","16.885","0.006","13.626","0.005","90","","100.439","0.004","90","","1223","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Butylbenzimidazolium nitrate","","- C11 H15 N3 O3 -","- C11 H15 N3 O3 -","- C44 H60 N12 O12 -","4","1","WK2066","Jin-Cheng Feng; Yong-Ling Bian; Qing-Xiang Liu; Xiu-Mei Wu; Jian-Hua Guo","1-Butylbenzimidazolium nitrate","Acta Crystallographica Section E","2007","63","8","o3566","o3566","10.1107/S1600536807034885","","","0.71073","MoKα","","0.0517","0.0387","","","0.1056","0.1145","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214885","31.669","0.006","4.913","0.001","7.1543","0.0014","90","","101.087","0.003","90","","1092.4","0.4","292","2","292","2","","","","","","","","4","C 1 2 1","C 2y","5","","N,N'-(Methylenedi-p-phenylene)diphthalimide","","- C29 H18 N2 O4 -","- C29 H18 N2 O4 -","- C58 H36 N4 O8 -","2","0.5","WK2067","Juan Li; Yi-Tao Li; Zi-Hua Wang","<i>N</i>,<i>N</i>'-(Methylenedi-<i>p</i>-phenylene)diphthalimide","Acta Crystallographica Section E","2007","63","8","o3420","o3420","10.1107/S1600536807031698","","","0.71073","MoKα","","0.0603","0.0496","","","0.1296","0.1355","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214886","8.183","0.005","17.128","0.005","9.173","0.005","90","0.005","90","0.005","90","0.005","1285.7","1.1","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","","1,3,5-Tris(1H-pyrazol-3-yl)benzene","","- C15 H12 N6 -","- C15 H12 N6 -","- C60 H48 N24 -","4","1","WK2069","Wen-Xiu Zhao; Yu-Xiang Gao; Shun-Fu Dong; Yan Li; Wei-Ping Zhang","1,3,5-Tris(1<i>H</i>-pyrazol-3-yl)benzene","Acta Crystallographica Section E","2007","63","8","o3448","o3448","10.1107/S1600536807032667","","","0.71069","MoKα","","0.0548","0.0418","","","0.1032","0.1122","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214887","9.4786","0.0006","18.9589","0.0011","10.7557","0.0006","90","","92.313","0.001","90","","1931.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[diaqua(isonicotinato-κ^2^O,O')gadolinium(III)]-di-μ- isonicotinato-κ^4^O:O']","","- C18 H16 Gd N3 O8 -","- C18 H16 Gd N3 O8 -","- C72 H64 Gd4 N12 O32 -","4","1","WM2123","Chen, Feng-Ying; Wu, Wang-Ting; Liu, Feng; Yao, Li; He, Shui-Yang","<i>catena</i>-Poly[[diaqua(isonicotinato-κ^2^<i>O</i>,<i>O</i>')gadolinium(III)]-di-μ-isonicotinato-κ^4^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","8","m2151","m2152","10.1107/S160053680703320X","","","0.71073","MoKα","","0.023","0.0195","","","0.0427","0.0443","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214888","24.698","0.009","12.404","0.005","24.328","0.009","90","","104.145","0.007","90","","7227","5","120","2","120","2","","","","","","","","5","C 1 2 1","C 2y","5","","(P)-Tetra-μ~3~-iodido-tetrakis[(cyclohexyldiphenylphosphine-κP)silver(I)]","","- C72 H84 Ag4 I4 P4 -","- C72 H84 Ag4 I4 P4 -","- C288 H336 Ag16 I16 P16 -","4","1","WM2128","Young, John F.; Yap, Glenn P. A.","(<i>P</i>)-Tetra-μ~3~-iodido-tetrakis[(cyclohexyldiphenylphosphine-κ<i>P</i>)silver(I)]","Acta Crystallographica Section E","2007","63","8","m2075","m2075","10.1107/S1600536807031911","","","0.71073","MoKα","","0.0495","0.0431","","","0.1014","0.1068","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214889","6.5119","0.0012","7.9623","0.0012","9.5799","0.001","104.428","0.003","109.18","0.001","101.389","0.003","432.64","0.11","293","2","100","2","","","","","","","","5","P -1","-P 1","2","","cobalt manganese tetrakis(hydrogen phosphate) bis(phosphate)","","- Co4.32 H4 Mn2.68 O24 P6 -","- Co4.316 H4 Mn2.684 O24 P6 -","- Co4.316 H4 Mn2.684 O24 P6 -","1","0.5","WM2131","Boudraa, Mhamed; Merazig, Hocine; Bouacida, Sofiane; Benard-Rocherulle, Patricia; Roisnel, Thierry","The solid solution Co~4.32~Mn~2.68~(HPO~4~)~4~(PO~4~)~2~","Acta Crystallographica Section E","2007","63","8","i168","i169","10.1107/S1600536807031352","","","0.71073","MoKα","","0.0401","0.0266","","","0.0601","0.0635","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214890","12.302","0.003","8.909","0.003","14.409","0.006","90","","96.859","0.014","90","","1567.9","0.9","298","1","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Diisopropyl 3-methyl-5-oxocyclohex-3-ene-1,1-dicarboxylate","","- C15 H22 O5 -","- C15 H22 O5 -","- C60 H88 O20 -","4","1","WN2144","Bi-Song Wang; Chen Zhang; Li-Ying Yao","Diisopropyl 3-methyl-5-oxocyclohex-3-ene-1,1-dicarboxylate","Acta Crystallographica Section E","2007","63","8","o3535","o3535","10.1107/S1600536807025317","","","0.71075","MoKα","","","0.0415","","","","0.123","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214891","11.3867","0.0011","13.0719","0.0009","15.3389","0.0014","90","","90","","90","","2283.1","0.3","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","3-[(carboxyphenyl)amino]cyclohexen-2-one","2-(3-Oxocyclohex-1-enyl)benzoic acid","","- C13 H13 N O3 -","- C13 H13 N O3 -","- C104 H104 N8 O24 -","8","2","WN2148","Vieira, Flaviana T.; Menezes, Daniele C.; de Lima, Geraldo M.; Speziali, Nivaldo L.","2-(3-Oxocyclohex-1-enyl)benzoic acid","Acta Crystallographica Section E","2007","63","8","o3376","o3376","10.1107/S1600536807029959","","","0.71073","MoKα","","0.063","0.0457","","","0.117","0.1323","","","","","","0.925","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214892","14.558","0.003","14.87","0.003","16.711","0.003","90","","91.695","0.003","90","","3616","1.2","292","2","292","2","","","","","","","","4","C 1 c 1","C -2yc","9","","8b,8c-Diphenyl-2,6-dioxa-3a,4a,7a,8a-tetraazaperhydrocyclopenta[def]fluorene- 4,8-dione","","- C20 H18 N4 O4 -","- C20 H18 N4 O4 -","- C160 H144 N32 O32 -","8","2","WN2157","Meng Gao; Jing-Jing Sun","8b,8c-Diphenyl-2,6-dioxa-3a,4a,7a,8a-tetraazaperhydrocyclopenta[<i>def</i>]fluorene-4,8-dione","Acta Crystallographica Section E","2007","63","8","o3480","o3480","10.1107/S1600536807029467","","","0.71073","MoKα","","0.0793","0.0444","","","0.0691","0.0791","","","","","","0.801","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214893","15.159","0.0003","6.4761","0.0002","13.1979","0.0003","90","","90.584","0.002","90","","1295.59","0.06","160","1","160","1","","","","","","","","5","C 1 2/m 1","-C 2y","12","pyrimidine derivative","1-(5-Bromopyrimidin-2-yl)-3-phenyl-1H-pyrazole-4-carbaldehyde","","- C14 H9 Br N4 O -","- C14 H9 Br N4 O -","- C56 H36 Br4 N16 O4 -","4","0.5","WN2161","A. Thiruvalluvar; M. Subramanyam; Balakrishna Kalluraya; B. Lingappa","1-(5-Bromopyrimidin-2-yl)-3-phenyl-1<i>H</i>-pyrazole-4-carbaldehyde","Acta Crystallographica Section E","2007","63","8","o3362","o3362","10.1107/S1600536807031443","","","0.71073","MoKα","","0.0919","0.0859","","","0.2257","0.2384","","","","","","1.138","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214894","7.5655","0.0019","7.5713","0.0019","29.146","0.007","90","","92.006","0.004","90","","1668.5","0.7","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(2-Hydroxy-3-methylbenzylideneamino)-2,3-dimethyl-1-phenyl-1H-pyrazol- 5(2H)-one","","- C19 H19 N3 O2 -","- C19 H19 N3 O2 -","- C76 H76 N12 O8 -","4","1","WN2162","Chun-Niu Zhang; Yun-Fa Zheng","4-(2-Hydroxy-3-methylbenzylideneamino)-2,3-dimethyl-1-phenyl-1<i>H</i>-pyrazol-5(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","8","o3421","o3421","10.1107/S1600536807032060","","","0.71073","MoKα","","0.0646","0.0329","","","0.0599","0.0631","","","","","","0.876","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214895","8.1444","0.0001","13.2118","0.0002","10.302","0.0001","90","","109.97","0.001","90","","1041.86","0.02","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di-μ-sulfito-κ^6^O,O':O',O''-bis[(2,2'-bipyridine-κ^2^N,N')zinc(II)]","","- C20 H16 N4 O6 S2 Zn2 -","- C20 H16 N4 O6 S2 Zn2 -","- C40 H32 N8 O12 S4 Zn4 -","2","0.5","WN2163","E. Yang; Xu-Chun Song; Shuang-Zhen Shen; You-Dan Lin","Di-μ-sulfito-κ^6^<i>O</i>,<i>O</i>':<i>O</i>',<i>O</i>''-bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')zinc(II)]","Acta Crystallographica Section E","2007","63","8","m2101","m2101","10.1107/S1600536807032692","","","0.71073","MoKα","","","0.0246","","","0.0515","0.0539","","","","","","0.938","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214896","7.125","0.0003","10.6735","0.0003","12.374","0.0005","93.607","0.002","90.561","0.002","107.474","0.002","895.42","0.06","160","1","160","1","","","","","","","","5","P -1","-P 1","2","pyrimidine derivative","5-[(4,6-Dimethylpyrimidin-2-ylsulfanyl)methyl]-3-(morpholinomethyl)-1,3,4- oxadiazole-2(3H)-thione","","- C14 H19 N5 O2 S2 -","- C14 H19 N5 O2 S2 -","- C28 H38 N10 O4 S4 -","2","1","WN2165","A. Thiruvalluvar; M. Subramanyam; B. Lingappa; Balakrishna Kalluraya","5-[(4,6-Dimethylpyrimidin-2-ylsulfanyl)methyl]-3-(morpholinomethyl)-1,3,4-oxadiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","8","o3425","o3425","10.1107/S1600536807032448","","","0.71073","MoKα","","0.0798","0.0568","","","0.1624","0.1773","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214897","12.4981","0.0003","14.7956","0.0003","16.5144","0.0004","90","","91.208","0.001","90","","3053.11","0.12","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","bis(p-bromophenyl)dimethylsilane","","- C14 H14 Br2 Si -","- C14 H14 Br2 Si -","- C112 H112 Br16 Si8 -","8","2","WN2167","Böhme, Uwe; Beyer, Christian; Rheinwald, Gerd","Bis(<i>p</i>-bromophenyl)dimethylsilane","Acta Crystallographica Section E","2007","63","8","o3486","o3486","10.1107/S1600536807033077","","","0.71073","MoKα","","0.0533","0.0382","","","0.0937","0.0992","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214898","14.303","0.001","6.4799","0.0007","25.113","0.002","90","","90","","90","","2327.5","0.4","299","2","299","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","p-Methoxyphenyl benzoate","4-Methoxyphenyl benzoate","","- C14 H12 O3 -","- C14 H12 O3 -","- C112 H96 O24 -","8","1","WN2169","B. Thimme Gowda; Sabine Foro; Roopa Nayak; Hartmut Fuess","4-Methoxyphenyl benzoate","Acta Crystallographica Section E","2007","63","8","o3507","o3507","10.1107/S160053680703406X","","","1.5418","CuKα","","0.0374","0.0332","","","0.092","0.0954","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214899","14.758","0.003","12.5955","0.0019","6.8423","0.0012","90","","100.006","0.016","90","","1252.5","0.4","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","guanidinium hydrogen 3-nitrophthalate monohydrate","guanidinium 2-carboxy-6-nitrobenzoate monohydrate","","- C9 H12 N4 O7 -","- C9 H12 N4 O7 -","- C36 H48 N16 O28 -","4","1","WN2170","Graham Smith; Urs D. Wermuth; Peter C. Healy","Guanidinium 2-carboxy-6-nitrobenzoate monohydrate: a two-dimensional hydrogen-bonded network structure","Acta Crystallographica Section E","2007","63","8","o3527","o3528","10.1107/S1600536807034356","","","0.71073","MoKα","","0.0732","0.047","","","0.1101","0.1466","","","","","","0.86","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214900","10.015","0.003","10.852","0.004","11.396","0.004","90","","101.651","0.008","90","","1213","0.7","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","p-Nitrophenyl benzenesulfonate","4-Nitrophenyl benzenesulfonate","","- C12 H9 N O5 S -","- C12 H9 N O5 S -","- C48 H36 N4 O20 S4 -","4","1","WN2171","Vembu, Nagarajan; Sparkes, Hazel A.; Howard, Judith A. K.","4-Nitrophenyl benzenesulfonate","Acta Crystallographica Section E","2007","63","8","o3543","o3543","10.1107/S1600536807034381","","","0.71073","MoKα","","0.0553","0.0345","","","0.0826","0.0927","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214901","8.1488","0.0009","9.052","0.001","9.299","0.001","76.99","0.02","68.73","0.01","66.87","0.01","585.08","0.13","299","2","299","2","","","","","","","","3","P -1","-P 1","2","p-Methylphenyl benzoate","4-Methylphenyl benzoate","","- C14 H12 O2 -","- C14 H12 O2 -","- C28 H24 O4 -","2","1","WN2173","B. Thimme Gowda; Sabine Foro; Roopa Nayak; Hartmut Fuess","4-Methylphenyl benzoate","Acta Crystallographica Section E","2007","63","8","o3563","o3563","10.1107/S1600536807034848","","","1.5418","CuKα","","0.0514","0.0489","","","0.1387","0.1418","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214902","6.9814","0.0012","8.1303","0.0013","10.78","0.002","88.575","0.014","76.881","0.015","79.367","0.014","585.59","0.18","203","2","203","2","","","","","","","","4","P -1","-P 1","2","substituted carbazole","Methyl 1-oxo-2,3,4,9-tetrahydro-1H-carbazole-2-carboxylate","","- C14 H13 N O3 -","- C14 H13 N O3 -","- C28 H26 N2 O6 -","2","1","WN2176","A. Thiruvalluvar; A. Thomas Gunaseelan; A. Ebenezer Martin; K. J. Rajendra Prasad; R. J. Butcher","Methyl 1-oxo-2,3,4,9-tetrahydro-1<i>H</i>-carbazole-2-carboxylate","Acta Crystallographica Section E","2007","63","8","o3622","o3622","10.1107/S1600536807035660","","","0.71073","MoKα","","0.1126","0.0671","","","0.1988","0.221","","","","","","1.105","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214903","7.1873","0.0004","14.2273","0.0009","8.386","0.0004","90","","96.952","0.004","90","","851.21","0.08","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(4aS*,10aR*)-7-Hydroxy-8-isopropyl-1,1,4a-trimethyl-1,2,3,4,4a,9,10,10a- octahydrophenanthren-2-one","","- C20 H28 O2 -","- C20 H28 O2 -","- C40 H56 O4 -","2","1","WW2088","Zeroual, Abdellah; Mazoir, Noureddine; Berraho, Moha; Auhmani, Aziz; Benharref, Ahmed","(4a<i>S</i>*,10a<i>R</i>*)-7-Hydroxy-8-isopropyl-1,1,4a-trimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthren-2-one","Acta Crystallographica Section E","2007","63","8","o3497","o3498","10.1107/S1600536807033594","","","0.71073","MoKα","","0.052","0.0448","","","0.12","0.1255","","","","","","1.087","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214904","17.2499","0.0018","10.5008","0.0011","16.66","0.0017","90","","96.201","0.002","90","","3000.1","0.5","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","cis-diacetonitrilebis(2,2'-bipyridine)ruthenium(II) hexafluorophosphate","","- C24 H22 F12 N6 P2 Ru -","- C24 H22 F12 N6 P2 Ru -","- C96 H88 F48 N24 P8 Ru4 -","4","0.5","WW2089","Xu, Feng; Huang, Wei","Redetermination of <i>cis</i>-diacetonitrilebis(2,2'-bipyridine)ruthenium(II) hexafluorophosphate","Acta Crystallographica Section E","2007","63","8","m2114","m2114","10.1107/S1600536807033065","","","0.71073","MoKα","","0.0708","0.0479","","","0.0941","0.0982","","","","","","0.994","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214905","6.7609","0.0006","6.8452","0.0006","10.783","0.001","72.549","0.001","81.202","0.001","67.756","0.001","440.2","0.07","103","","103","","","","","","","","","3","P -1","-P 1","2","","(2,3-Dimethylphenoxy)acetic acid","","- C10 H12 O3 -","- C10 H12 O3 -","- C20 H24 O6 -","2","1","WW2090","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Swamy, M. T.; Narayana, B.","(2,3-Dimethylphenoxy)acetic acid","Acta Crystallographica Section E","2007","63","8","o3472","o3472","10.1107/S1600536807033600","","","0.71073","MoKα","","0.0415","0.0401","","","0.1166","0.1185","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214906","7.4974","0.0005","14.969","0.0011","8.9885","0.001","90","","90","","90","","1008.77","0.15","203","2","203","2","","","","","","","","4","P n a 21","P 2c -2n","33","methyl-carbazole","9-Methyl-2,3,4,9-tetrahydro-<i>1H</i>-carbazol-1-one","","- C13 H13 N O -","- C13 H13 N O -","- C52 H52 N4 O4 -","4","1","WW2091","A. Thiruvalluvar; A. Thomas Gunaseelan; A. Ebenezer Martin; K. J. Rajendra Prasad; R. J. Butcher","9-Methyl-2,3,4,9-tetrahydro-1<i>H</i>-carbazol-1-one","Acta Crystallographica Section E","2007","63","8","o3524","o3524","10.1107/S1600536807034307","","","0.71073","MoKα","","0.0591","0.0444","","","0.0987","0.1058","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214907","6.8507","0.0008","14.2231","0.0016","10.4333","0.0011","90","","94.978","0.001","90","","1012.8","0.2","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>trans</i>-Bis[2-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)phenolato-\ κ^2^<i>N</i>,<i>O</i>^1^]nickel(II)","","- C22 H24 N2 Ni O4 -","- C22 H24 N2 Ni O4 -","- C44 H48 N4 Ni2 O8 -","2","0.5","XU2276","Zhang, Yan; Liu, Tian-Fu; Xu, Wen-Guo","<i>trans</i>-Bis[2-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)phenolato-κ^2^<i>N</i>,<i>O</i>^1^]nickel(II)","Acta Crystallographica Section E","2007","63","8","m2231","m2231","10.1107/S1600536807035829","","","0.71073","MoKα","","0.032","0.027","","","0.074","0.078","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214908","9.2203","0.0018","19.744","0.004","9.3552","0.0019","90","","101.72","0.03","90","","1667.6","0.6","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Poly[[tetraaquabis(5-carboxypyridine-2-carboxylato-κ^2^N,O)bis(μ~4~- pyridine-2,5-dicarboxylato-κ^5^N,O:O:O':O'')dilanthanum(III)] dihydrate]","","- C28 H26 La2 N4 O22 -","- C28 H26 La2 N4 O22 -","- C56 H52 La4 N8 O44 -","2","1","XU2283","Zhang, Fan; Yu, Bin; Wang, Xiao-Qing; Shen, Guang-Qiu; Shen, De-Zhong","Poly[[tetraaquabis(5-carboxypyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>)bis(μ~4~-pyridine-2,5-dicarboxylato-κ^5^<i>N</i>,<i>O</i>:<i>O</i>:<i>O</i>':<i>O</i>'')dilanthanum(III)] dihydrate]","Acta Crystallographica Section E","2007","63","8","m2069","m2070","10.1107/S1600536807032059","","","0.71073","MoKα","","0.068","0.064","","","0.172","0.174","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214909","8.4695","0.0011","12.5509","0.0015","14.8615","0.0019","68.895","0.001","88.074","0.002","78.337","0.002","1442.1","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Aqua(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^N,N')(malonato-κ^2^O,O')zinc(II) monohydrate","","- C9 H12 N4 O6 S2 Zn -","- C9 H12 N4 O6 S2 Zn -","- C36 H48 N16 O24 S8 Zn4 -","4","2","XU2284","Bing-Xin Liu; Guang-Hua Chen; Yan-Ping Yu; Yuan-Yuan Lin","Aqua(2,2'-diamino-4,4'-bi-1,3-thiazole-κ^2^<i>N</i>,<i>N</i>')(malonato-κ^2^<i>O</i>,<i>O</i>')zinc(II) monohydrate","Acta Crystallographica Section E","2007","63","8","m2054","m2055","10.1107/S1600536807031741","","","0.71073","MoKα","","0.056","0.038","","","0.079","0.086","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214910","11.9151","0.0016","24.642","0.004","7.5556","0.0009","90","","115.313","0.002","90","","2005.4","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetraaqua(2,2'-bipyridine-κ^2^N,N')nickel(II) cyclohexane-1,4-dicarboxylate","","- C18 H26 N2 Ni O8 -","- C18 H26 N2 Ni O8 -","- C72 H104 N8 Ni4 O32 -","4","0.5","XU2285","Yu, Miao; Liu, Shu-Xia; Xie, Lin-Hua; Cao, Rui-Ge; Ren, Yuan-Hang","Tetraaqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')nickel(II) cyclohexane-1,4-dicarboxylate","Acta Crystallographica Section E","2007","63","8","m2110","m2110","10.1107/S1600536807032795","","","0.71073","MoKα","","0.054","0.049","","","0.127","0.13","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214911","7.4481","0.0003","24.1832","0.0009","11.6691","0.0004","90","","98.021","0.002","90","","2081.26","0.13","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aqua(2,2'-bipyridine)(2-formyl-4,6-dinitrophenolato)nickel(II) perchlorate","","- C17 H13 Cl N4 Ni O11 -","- C17 H13 Cl N4 Ni O11 -","- C68 H52 Cl4 N16 Ni4 O44 -","4","1","XU2289","Fan Zhong; Qiu-Yan Luo; Dai-Ping Duan; Qi Wang; Shao-Ming Ying","Aqua(2,2'-bipyridine)(2-formyl-4,6-dinitrophenolato)nickel(II) perchlorate","Acta Crystallographica Section E","2007","63","8","m2129","m2129","10.1107/S1600536807033442","","","0.71073","MoKα","","0.066","0.052","","","0.15","0.161","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214912","15.418","0.0016","12.153","0.0013","9.285","0.001","90","","103.299","0.002","90","","1693.1","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-[2-(2,4-Dichlorophenoxy)acetyl]-4-cyclohexylthiosemicarbazide","","- C15 H19 Cl2 N3 O2 S -","- C15 H19 Cl2 N3 O2 S -","- C60 H76 Cl8 N12 O8 S4 -","4","1","XU2290","Ghulam Qadeer; Nasim Hasan Rama; Muhammad Azaad Malik; Javeed Akhtar; James Raftery","1-[2-(2,4-Dichlorophenoxy)acetyl]-4-cyclohexylthiosemicarbazide","Acta Crystallographica Section E","2007","63","8","o3503","o3503","10.1107/S1600536807034022","","","0.71073","MoKα","","0.066","0.04","","","0.08","0.107","","","","","","0.958","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214913","12.39","0.002","13.819","0.002","21.261","0.003","90","","101.348","0.002","90","","3569.1","0.9","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Diaquabis[(1<i>R</i>,2<i>R</i>)-(+)‒1,2-diphenylethylenediamine- κ^2^<i>N</i>,<i>N</i>']nickel(II) dichloride‒dichloridobis(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')nickel(II) (1/2)","","- C76 H68 Cl6 N12 Ni3 O2 -","- C76 H68 Cl6 N12 Ni3 O2 -","- C152 H136 Cl12 N24 Ni6 O4 -","2","1","XU2291","Zhang, Yu-Zhen; Chen, Zi-Lu; Ng, Seik Weng","Diaquabis[(1<i>R</i>,2<i>R</i>)-(+)‒1,2-diphenylethylenediamine-κ^2^<i>N</i>,<i>N</i>']nickel(II) dichloride‒dichloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nickel(II) (1/2)","Acta Crystallographica Section E","2007","63","8","m2123","m2123","10.1107/S1600536807033296","","","0.71073","MoKα","","0.142","0.056","","","0.122","0.165","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214914","7.1679","0.0003","15.1517","0.0006","9.9079","0.0004","90","","90.556","0.002","90","","1076.01","0.08","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(1H-Benzo[d]imidazol-2-yl)phenol","","- C13 H10 N2 O -","- C13 H10 N2 O -","- C52 H40 N8 O4 -","4","1","XU2292","Qing-Guang Zhan; Mao-Sheng Liu; Rong-Hua Zeng; Ding-Qiao Yang; Yue-Peng Cai","4-(1<i>H</i>-Benzo[<i>d</i>]imidazol-2-yl)phenol","Acta Crystallographica Section E","2007","63","8","o3470","o3470","10.1107/S1600536807033612","","","0.71073","MoKα","","0.043","0.037","","","0.098","0.103","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214915","9.3295","0.0001","11.2863","0.0002","12.5962","0.0002","90","","90","","90","","1326.32","0.03","294","2","294","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2-(1H-Benzimidazol-1-yl)-1-phenylethanone oxime","","- C15 H13 N3 O -","- C15 H13 N3 O -","- C60 H52 N12 O4 -","4","1","XU2293","Özel Güven, Özden; Erdoğan, Taner; Çaylak, Nagihan; Hökelek, Tuncer","2-(1<i>H</i>-Benzimidazol-1-yl)-1-phenylethanone oxime","Acta Crystallographica Section E","2007","63","8","o3463","o3464","10.1107/S1600536807033570","","","0.71073","MoKα","","0.127","0.045","","","0.104","0.128","","","","","","0.998","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214916","8.1415","0.0012","11.2685","0.0017","12.0084","0.0018","74.269","0.002","82.864","0.002","87.713","0.002","1052.2","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Bis(μ-pyridine-2,3-dicarboxylato)bis[aqua(2,2'-diamino-4,4'-bi-1,3-\ thiazole)cobalt(II)] decahydrate","","- C26 H42 Co2 N10 O20 S4 -","- C26 H42 Co2 N10 O20 S4 -","- C26 H42 Co2 N10 O20 S4 -","1","0.5","XU2294","Yuan-Yuan Lin; Guang-Hua Chen; Yan-Ping Yu; Bing-Xin Liu","Bis(μ-pyridine-2,3-dicarboxylato)bis[aqua(2,2'-diamino-4,4'-bi-1,3-thiazole)cobalt(II)] decahydrate","Acta Crystallographica Section E","2007","63","8","m2178","m2179","10.1107/S160053680703454X","","","0.71073","MoKα","","0.055","0.041","","","0.086","0.094","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214917","9.8941","0.0004","15.7201","0.0007","9.0288","0.0004","90","","90","","90","","1404.31","0.1","153","2","153","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","6β,10β-Cadinene-6,10-diol","(1S,6R,7S,10S)-7-isopropyl-10-methyl-4-methylenedecahydronaphthalene-6,10-diol","","- C15 H26 O2 -","- C15 H26 O2 -","- C60 H104 O8 -","4","1","XU2295","Wei-Wei Dong; Kai-Bei Yu; Jian-Min Yue; Run-Hua Lu","6β,10β-Cadinene-6,10-diol: a sesquiterpenoid from the rhizome of <i>Acorus calamus</i> L.","Acta Crystallographica Section E","2007","63","8","o3579","o3579","10.1107/S1600536807035325","","","0.71073","MoKα","","0.031","0.031","","","0.089","0.09","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214918","14.159","0.001","9.843","0.001","15.221","0.001","90","","90","","90","","2121.3","0.3","295","2","295","2","","","","","","","","6","A b a 2","A 2 -2ab","41","","Diaqua(cyclohexane-1,2-diamine-κ^2^N,N')(N,N,N',N'- tetramethylethylenediamine-κ^2^N,N')nickel(II) dichloride dihydrate","","- C12 H38 Cl2 N4 Ni O4 -","- C12 H38 Cl2 N4 Ni O4 -","- C48 H152 Cl8 N16 Ni4 O16 -","4","","XU2296","Zhang, Yu-Zhen; Chen, Zi-Lu; Ng, Seik Weng","Diaqua(cyclohexane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine-κ^2^<i>N</i>,<i>N</i>')nickel(II) dichloride dihydrate","Acta Crystallographica Section E","2007","63","8","m2228","m2228","10.1107/S1600536807035386","","","0.71073","MoKα","","0.026","0.025","","","0.072","0.073","","","","","","1.116","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214919","9.7598","0.0005","9.8572","0.0006","9.814","0.0007","90","","104.254","0.003","90","","915.08","0.1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(1Z,2E)-1-(3,5-Dimethyl-1H-pyrazol-1-yl)-1,2-ethanedione dioxime","","- C7 H10 N4 O2 -","- C7 H10 N4 O2 -","- C28 H40 N16 O8 -","4","1","XU2297","Sarıkavaklı, Nursabah; Şahin, Ertan; Hökelek, Tuncer","(1<i>Z</i>,2<i>E</i>)-1-(3,5-Dimethyl-1<i>H</i>-pyrazol-1-yl)ethane-1,2-dione dioxime","Acta Crystallographica Section E","2007","63","8","o3601","o3601","10.1107/S1600536807035490","","","0.71073","MoKα","","0.089","0.06","","","0.146","0.164","","","","","","1.016","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214920","5.478","0.001","8.0133","0.0014","19.351","0.003","99.972","0.003","92.435","0.004","94.29","0.003","832.9","0.2","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","1-(3-Methylphenyl)-3-{5-[4-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl}urea","","- C17 H13 F3 N4 O S -","- C17 H13 F3 N4 O S -","- C34 H26 F6 N8 O2 S2 -","2","1","XU2300","Tan, Zhi-Wei; Tan, Xiao-Hong; Song, Xin-Jian","1-(3-Methylphenyl)-3-{5-[4-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl}urea","Acta Crystallographica Section E","2007","63","8","o3641","o3641","10.1107/S1600536807036343","","","0.71073","MoKα","","0.091","0.0689","","","0.1792","0.2039","","","","","","1.103","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214921","7.422","0.0004","10.2999","0.0006","12.9328","0.0007","109.85","0.001","100.866","0.001","101.95","0.001","873.04","0.08","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 2-methyl-1-(4-phenylthiazol-2-yl)-1H-benzimidazole-6-carboxylate","","- C20 H17 N3 O2 S -","- C20 H17 N3 O2 S -","- C40 H34 N6 O4 S2 -","2","1","XU2301","Li-Min He; Ai-Xi Hu; Gao Cao; Jun-Jun Peng","Ethyl 2-methyl-1-(4-phenylthiazol-2-yl)-1<i>H</i>-benzimidazole-6-carboxylate","Acta Crystallographica Section E","2007","63","8","o3643","o3643","10.1107/S1600536807036483","","","0.71073","MoKα","","0.047","0.037","","","0.1","0.107","","","","","","1.086","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214922","4.9941","0.0004","10.925","0.0008","18.0729","0.0012","90","","90","","90","","986.07","0.13","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Bis(1H-imidazolium-κN^3^)silver(I) nitrate","","- C6 H8 Ag N5 O3 -","- C6 H8 Ag N5 O3 -","- C24 H32 Ag4 N20 O12 -","4","1","XU2302","Zheng-Yuan Zhou; Mao-Sheng Liu; Xiu-Xia Zhou; Li-Cai Zhu; Yue-Peng Cai","Bis(1<i>H</i>-imidazolium-κ<i>N</i>^3^)silver(I) nitrate","Acta Crystallographica Section E","2007","63","8","m2227","m2227","10.1107/S1600536807036215","","","0.71073","MoKα","","0.024","0.023","","","0.054","0.054","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214923","16.3886","0.0002","6.5976","0.0002","16.7166","0.0003","90","","114.677","0.009","90","","1642.42","0.13","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(1H-Benzimidazol-1-yl)-1-(2-furyl)-3-phenylpropan-1-one","","- C20 H16 N2 O2 -","- C20 H16 N2 O2 -","- C80 H64 N8 O8 -","4","1","XU2303","Özel Güven, Özden; Erdoğan, Taner; Çaylak, Nagihan; Hökelek, Tuncer","2-(1<i>H</i>-Benzimidazol-1-yl)-1-(2-furyl)-3-phenylpropan-1-one","Acta Crystallographica Section E","2007","63","8","o3638","o3638","10.1107/S1600536807036550","","","0.71073","MoKα","","0.11","0.045","","","0.104","0.127","","","","","","0.993","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214924","9.6758","0.0009","18.126","0.001","16.248","0.002","90","","99.428","0.007","90","","2811.1","0.5","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(2,4,6,2'',4'',6''-hexamethyl-1,1':3';1''-terphenyl-2'-yl)\ bis(methylcyclopentadienyl)erbium(III)","","- C36 H39 Er -","- C36 H39 Er -","- C144 H156 Er4 -","4","1","YA2055","Niemeyer, Mark","An unsolvated erbium organyl: (2,4,6,2'',4'',6''-hexamethyl-1,1':3';1''-terphenyl-2'-yl)bis(methylcyclopentadienyl)erbium(III)","Acta Crystallographica Section E","2007","63","8","m2188","m2188","10.1107/S1600536807034575","","","0.71069","MoKα","","0.065","0.04","","","0.086","0.095","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214925","8.0116","0.0003","10.1247","0.0004","10.6618","0.0004","90","","101.788","0.002","90","","846.59","0.06","296","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Carboxy-1-carboxymethyl-2-oxidopyridinium","","- C8 H7 N O5 -","- C8 H7 N O5 -","- C32 H28 N4 O20 -","4","1","YM2052","Yin-Hua He; Yun-long Feng","5-Carboxy-1-carboxymethyl-2-oxidopyridinium","Acta Crystallographica Section E","2007","63","8","o3422","o3422","10.1107/S1600536807031601","","","0.71073","MoKα","","0.0397","0.0358","","","0.1019","0.1058","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214926","11.2065","0.0004","17.4485","0.0003","11.3728","0.0004","90","","98.163","0.001","90","","2201.27","0.12","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","poly[aquasodium(I) [[aquasamarium(III)]- di-μ-aqua-μ~3~-pyridine-2,6-dicarboxylato-μ~2~-pyridine-2,6-dicarboxylato] trihydrate]","","- C14 H20 N2 Na O15 Sm -","- C14 H20 N2 Na O15 Sm -","- C56 H80 N8 Na4 O60 Sm4 -","4","1","YM2055","Ikarashi, Kazuya; Taoyun, Zhu; Uematsu, Kazuyoshi; Toda, Kenji; Sato, Mineo","Reinvestigation of layered poly[aquasodium(I) [[aquasamarium(III)]-di-μ-aqua-μ~3~-pyridine-2,6-dicarboxylato-μ~2~-pyridine-2,6-dicarboxylato] trihydrate]","Acta Crystallographica Section E","2007","63","8","m2203","m2204","10.1107/S160053680702884X","","","0.7107","MoKα","","","0.0324","","","","0.0812","","","","","","1.167","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214927","10.89","0.0002","9.9227","0.0002","18.8981","0.0003","90","","104.658","0.011","90","","1975.63","0.12","170","2","170","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2,6-Dimethyl-9-oxabicyclo[3.3.1]nonane-endo-2,endo-6-diol","","- C10 H18 O3 -","- C10 H18 O3 -","- C80 H144 O24 -","8","1","YM2059","López-Rodríguez, M.; Foces-Foces, C.","2,6-Dimethyl-9-oxabicyclo[3.3.1]nonane-<i>endo</i>-2,<i>endo</i>-6-diol","Acta Crystallographica Section E","2007","63","8","o3537","o3538","10.1107/S1600536807032163","","","0.71069","MoKα","","0.0474","0.0454","","","0.1206","0.1223","","","","","","1.078","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214928","16.401","0.003","11.436","0.002","13.54","0.003","90","","99","0.03","90","","2508.3","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(N,N'-Diethyldithiocarbamato-κ^2^S,S')bis[2-(2-pyridyl)phenyl- κ^2^C^1^,N]iridium(III)","","- C27 H26 Ir N3 S2 -","- C27 H26 Ir N3 S2 -","- C108 H104 Ir4 N12 S8 -","4","0.5","ZL2022","Chen, Lian-Qing","(<i>N</i>,<i>N</i>'-Diethyldithiocarbamato-κ^2^<i>S</i>,<i>S</i>')bis[2-(2-pyridyl)phenyl-κ^2^<i>C</i>^1^,<i>N</i>]iridium(III)","Acta Crystallographica Section E","2007","63","8","m2078","m2078","10.1107/S1600536807032126","","","0.71073","MoKα","","0.0284","0.0233","","","0.0517","0.0705","","","","","","1.152","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214929","5.1378","0.0001","34.0034","0.0009","7.5922","0.0002","90","","124.181","0.002","90","","1097.27","0.05","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis(5-n-butylpyridine-2-carboxylato)cobalt(II)","","- C20 H28 Co N2 O6 -","- C20 H28 Co N2 O6 -","- C40 H56 Co2 N4 O12 -","2","0.5","ZL2048","Run-Zhen Fan; Wen-Dong Song; Xiao-Min Hao","Diaquabis(5-<i>n</i>-butylpyridine-2-carboxylato)cobalt(II)","Acta Crystallographica Section E","2007","63","8","m2214","m2214","10.1107/S1600536807035295","","","0.71073","MoKα","","0.0948","0.0489","","","0.0949","0.1094","","","","","","1.015","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214930","10.4361","0.0017","11.4199","0.0018","12.938","0.002","89.721","0.003","71.536","0.002","68.211","0.002","1346.9","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","4,4',6,6'-Tetrabromo-2,2'-[dithiobis(o-phenylenenitrilomethylidyne)]diphenol","","- C26 H16 Br4 N2 O2 S2 -","- C26 H16 Br4 N2 O2 S2 -","- C52 H32 Br8 N4 O4 S4 -","2","1","AT2337","Jin, Li-Xia; Liu, Zheng; Xia, Jin-Hong; Li, Guang-Zhao","4,4',6,6'-Tetrabromo-2,2'-[dithiobis(<i>o</i>-phenylenenitrilomethylidyne)]diphenol","Acta Crystallographica Section E","2007","63","9","o3854","o3854","10.1107/S1600536807037932","","","0.71073","MoKα","","0.1125","0.0477","","","0.0853","0.1029","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214931","7.4377","0.0016","24.554","0.005","9.385","0.002","90","","90","","90","","1713.9","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-[3-(2-Methylbenzoyl)thioureido]-3-phenylpropionic acid","","- C18 H18 N2 O3 S -","- C18 H18 N2 O3 S -","- C72 H72 N8 O12 S4 -","4","1","AT2353","Yusof, M. Sukeri M.; Aziz, Zurina A.; Kadir, Maisara A.; Yamin, Bohari M.","2-[3-(2-Methylbenzoyl)thioureido]-3-phenylpropionic acid","Acta Crystallographica Section E","2007","63","9","o3676","o3676","10.1107/S160053680703680X","","","0.71073","MoKα","","0.0403","0.037","","","0.0938","0.096","","","","","","0.983","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214932","16.5302","0.0017","9.2777","0.001","20.7248","0.0015","90","","125.58","0.005","90","","2585","0.5","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis(1H-imidazole-κN^3^)(perchlorato-κO)copper(II) perchlorate dimethylamine disolvate","","- C16 H30 Cl2 Cu N10 O8 -","- C16 H30 Cl2 Cu N10 O8 -","- C64 H120 Cl8 Cu4 N40 O32 -","4","1","AT2354","Zhou, Ying-Xia; Cheng, Guang-Xia; Wu, Ben-Lai; Zhang, Hong-Yun","Tetrakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)(perchlorato-κ<i>O</i>)copper(II) perchlorate dimethylamine disolvate","Acta Crystallographica Section E","2007","63","9","m2285","m2286","10.1107/S1600536807037440","","","0.71073","MoKα","","0.0515","0.0391","","","0.1104","0.1193","","","","","","1.067","","","","has coordinates,has Fobs","211196","2020-10-21","18:00:00",""
"2214934","8.64","0.0019","9.7671","0.0009","22.24","0.005","90","","90","","90","","1876.8","0.6","203","","203","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2-{5-Chloro-2-[(4-methoxybenzyl)amino]phenyl}-4-cyclopropyl- 1,1,1-trifluorobut-3-yn-2-ol","","- C21 H19 Cl F3 N O2 -","- C21 H19 Cl F3 N O2 -","- C84 H76 Cl4 F12 N4 O8 -","4","1","AT2356","Butcher, Ray J.; Jasinski, Jerry P.; Mayekar, Anil N.; Yathirajan, H. S.; Narayana, B.","2-{5-Chloro-2-[(4-methoxybenzyl)amino]phenyl}-4-cyclopropyl-1,1,1-trifluorobut-3-yn-2-ol","Acta Crystallographica Section E","2007","63","9","o3703","o3704","10.1107/S160053680703749X","","","0.71073","MoKα","","0.0988","0.032","","","0.0589","0.0685","","","","","","0.758","","","","has coordinates,has disorder,has Fobs","201974","2020-10-21","18:00:00",""
"2214935","8.4727","0.0015","21.327","0.004","12.942","0.002","90","","90.74","0.003","90","","2338.4","0.7","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(2-Thienylmethyleneamino)isoindoline-1,3-dione","","- C13 H8 N2 O2 S -","- C13 H8 N2 O2 S -","- C104 H64 N16 O16 S8 -","8","2","AT2357","Jing, Zuo-Liang; Yu, Ming; Chen, Xin","2-(2-Thienylmethyleneamino)isoindoline-1,3-dione","Acta Crystallographica Section E","2007","63","9","o3714","o3714","10.1107/S160053680703752X","","","0.71073","MoKα","","0.0896","0.0466","","","0.1092","0.1296","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214936","16.208","0.003","12.801","0.003","18.06","0.004","90","","98.91","0.03","90","","3701.8","1.4","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis{2,4-dibromo-6-[3-(cyclohexylamino)propyliminomethyl]phenolato}cobalt(III) perchlorate","","- C32 H42 Br4 Cl Co N4 O6 -","- C32 H42 Br4 Cl Co N4 O6 -","- C128 H168 Br16 Cl4 Co4 N16 O24 -","4","1","AT2358","Kun Li; Shan-Shan Huang; Qin Zhou; Hong Li; Yun-Peng Diao","Bis{2,4-dibromo-6-[3-(cyclohexylamino)propyliminomethyl]phenolato}cobalt(III) perchlorate","Acta Crystallographica Section E","2007","63","9","m2274","m2274","10.1107/S1600536807037579","","","0.71073","MoKα","","0.2157","0.0752","","","0.1566","0.2125","","","","","","0.963","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214937","16.565","0.002","9.9972","0.0014","10.1889","0.0015","90","","96.122","0.002","90","","1677.7","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Azido{2,4-dibromo-6-[(2-diethylaminoethylimino)methyl]phenolato}nickel(II)","","- C13 H17 Br2 N5 Ni O -","- C13 H17 Br2 N5 Ni O -","- C52 H68 Br8 N20 Ni4 O4 -","4","1","AT2359","Kun Li; Shan-Shan Huang; Bao-Jing Zhang; Yun-Peng Diao","Azido{2,4-dibromo-6-[(2-diethylaminoethylimino)methyl]phenolato}nickel(II)","Acta Crystallographica Section E","2007","63","9","m2291","m2291","10.1107/S1600536807037592","","","0.71073","MoKα","","0.0669","0.0359","","","0.0703","0.0797","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214938","10.996","0.002","11.635","0.002","13.33","0.003","90","","100.74","0.03","90","","1675.5","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Azido{2,4-dibromo-6-[2-(diethylamino)ethyliminomethyl]phenolato}copper(II)","","- C13 H17 Br2 Cu N5 O -","- C13 H17 Br2 Cu N5 O -","- C52 H68 Br8 Cu4 N20 O4 -","4","1","AT2360","Kun Li; Hong Zhang; Xiao-Na Wang; Jin-Yong Peng; Yun-Peng Diao","Azido{2,4-dibromo-6-[2-(diethylamino)ethyliminomethyl]phenolato}copper(II)","Acta Crystallographica Section E","2007","63","9","m2271","m2271","10.1107/S1600536807037798","","","0.71073","MoKα","","0.0768","0.0415","","","0.0886","0.1011","","","","","","0.99","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214939","7.3754","0.0018","8.925","0.002","13.812","0.003","92.347","0.002","97.596","0.002","96.311","0.003","894.3","0.4","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","μ-4,4'-Bipyridine-κ^2^<i>N</i>:<i>N</i>'-bis[aqua(nitrato-κ<i>O</i>)(1,10- phenanthroline-κ^2^N,N')copper(II)] dinitrate","","- C34 H28 Cu2 N10 O14 -","- C34 H28 Cu2 N10 O14 -","- C34 H28 Cu2 N10 O14 -","1","0.5","AT2361","Zhong-Xiang Du; Jun-Xia Li","μ-4,4'-Bipyridine-κ^2^<i>N</i>:<i>N</i>'-bis[aqua(nitrato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)] dinitrate","Acta Crystallographica Section E","2007","63","9","m2282","m2282","10.1107/S1600536807037804","","","0.71073","MoKα","","0.0539","0.0501","","","0.2228","0.2273","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214940","12.5658","0.0009","15.4595","0.0011","11.8864","0.0009","90","","90","","90","","2309.1","0.3","298","2","298","2","","","","","","","","5","A b a 2","A 2 -2ab","41","[(bipy)2RuCl2].CH2Cl2","cis-Bis(2,2'-bipyridyl)dichloridoruthenium(II) dichloromethane solvate","","- C21 H18 Cl4 N4 Ru -","- C21 H18 Cl4 N4 Ru -","- C84 H72 Cl16 N16 Ru4 -","4","","AT2362","Al-Noaimi, Mousa; Haddad, Salim F.","<i>cis</i>-Bis(2,2'-bipyridyl)dichloridoruthenium(II) dichloromethane solvate","Acta Crystallographica Section E","2007","63","9","m2332","m2332","10.1107/S1600536807037865","","","0.71073","MoKα","","0.0349","0.0275","","","0.0605","0.0642","","","","","","1.036","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214941","9.9032","0.0007","12.0663","0.0008","23.984","0.002","90","","90","","90","","2866","0.4","296","","296","","","","","","","","","4","P b c a","-P 2ac 2ab","61","3-methyl-4-hydroxy-4'-propylazobenzene","(<i>E</i>)-2-Methyl-4-[(4-propylphenyl)diazenyl]phenol","","- C16 H18 N2 O -","- C16 H18 N2 O -","- C128 H144 N16 O8 -","8","1","AT2363","Albayrak, Çiğdem; Gümrükçüoğlu, İsmail Erdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-2-Methyl-4-[(4-propylphenyl)diazenyl]phenol","Acta Crystallographica Section E","2007","63","9","o3733","o3733","10.1107/S1600536807038561","","","0.71073","MoKα","","0.1162","0.0532","","","0.1507","0.1767","","","","","","0.908","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214942","11.6427","0.0017","5.442","0.0007","13.2339","0.0019","90","","90.936","0.002","90","","838.4","0.2","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-(4-Chlorobenzyl)-2-(4-chlorophenyl)-1<i>H</i>-benzimidazole","","- C20 H14 Cl2 N2 -","- C20 H14 Cl2 N2 -","- C40 H28 Cl4 N4 -","2","1","AT2364","Yang, Shu-Ping; Wang, Da-Qi; Han, Li-Jun; Xia, Hai-Tao","1-(4-Chlorobenzyl)-2-(4-chlorophenyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","9","o3758","o3758","10.1107/S1600536807038871","","","0.71073","MoKα","","0.0809","0.0423","","","0.0726","0.0858","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214943","7.4956","0.0003","23.3915","0.0007","10.0552","0.0005","90","","111.008","0.005","90","","1645.82","0.13","203","2","203","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-{(<i>E</i>)-[(2-Chloro-5-nitrophenyl)imino]methyl}-5-(diethylamino)phenol","","- C17 H18 Cl N3 O3 -","- C17 H18 Cl N3 O3 -","- C68 H72 Cl4 N12 O12 -","4","1","AT2365","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Vijesh, A. M.; Narayana, B.","2-{(<i>E</i>)-[(2-Chloro-5-nitrophenyl)imino]methyl}-5-(diethylamino)phenol","Acta Crystallographica Section E","2007","63","9","o3748","o3748","10.1107/S1600536807038901","","","0.71073","MoKα","","0.08","0.0556","","","0.1416","0.1615","","","","","","1.1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214944","11.184","0.003","12.732","0.003","10.634","0.003","90","","112.636","0.004","90","","1397.6","0.6","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Methoxybenzaldehyde 2-methylpropanoylhydrazone","","- C12 H18 N2 O3 -","- C12 H18 N2 O3 -","- C48 H72 N8 O12 -","4","1","AT2366","Huan-Mei Guo","4-Methoxybenzaldehyde 2-methylpropanoylhydrazone","Acta Crystallographica Section E","2007","63","9","o3786","o3786","10.1107/S1600536807038913","","","0.71073","MoKα","","0.132","0.0466","","","0.1146","0.1535","","","","","","0.976","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214945","5.21","0.003","8.838","0.005","11.53","0.006","111.419","0.009","91.916","0.009","91.139","0.009","493.7","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Benzaldehyde propionylhydrazone","","- C10 H12 N2 O -","- C10 H12 N2 O -","- C20 H24 N4 O2 -","2","1","AT2367","Huan-Mei Guo","Benzaldehyde propionylhydrazone","Acta Crystallographica Section E","2007","63","9","o3787","o3787","10.1107/S1600536807038925","","","0.71073","MoKα","","0.1207","0.0522","","","0.1263","0.1646","","","","","","1.016","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214946","33.59","0.003","5.6421","0.0008","11.4747","0.0015","90","","107.326","0.002","90","","2076","0.4","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N,N'-Bis(3,4-methenedioxybenzyl)ethane-1,2-diammonium dinitrate","","- C18 H22 N4 O10 -","- C18 H22 N4 O10 -","- C72 H88 N16 O40 -","4","0.5","AT2368","Yang, Shu-Ping; Wang, Da-Qi; Han, Li-Jun; Xia, Hai-Tao","<i>N</i>,<i>N</i>'-Bis(3,4-methenedioxybenzyl)ethane-1,2-diammonium dinitrate: hydrogen-bonded chains of rings","Acta Crystallographica Section E","2007","63","9","o3809","o3809","10.1107/S1600536807039426","","","0.71073","MoKα","","0.1017","0.0529","","","0.1299","0.1647","","","","","","1.071","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214949","5.632","0.0011","16.664","0.003","13.077","0.003","90","","96.1","0.03","90","","1220.3","0.4","113","2","113","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(<i>E</i>)-<i>N</i>'-(2,4-Dichlorobenzylidene)thiophene-2-carbohydrazide","","- C12 H8 Cl2 N2 O S -","- C12 H8 Cl2 N2 O S -","- C48 H32 Cl8 N8 O4 S4 -","4","1","AT2371","Bai, Zheng-Chen; Jing, Zuo-Liang","(<i>E</i>)-<i>N</i>'-(2,4-Dichlorobenzylidene)thiophene-2-carbohydrazide","Acta Crystallographica Section E","2007","63","9","o3821","o3821","10.1107/S1600536807039694","","","0.71073","MoKα","","0.0678","0.0499","","","0.0895","0.0968","","","","","","1.104","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214950","8.275","0.0004","9.3951","0.0004","10.0755","0.0005","72.883","0.001","78.837","0.001","65.28","0.001","677.77","0.06","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 2-(5-chloro-3-methylsulfinyl-1-benzofuran-2-yl)acetate","","- C13 H13 Cl O4 S -","- C13 H13 Cl O4 S -","- C26 H26 Cl2 O8 S2 -","2","1","AT2372","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","Ethyl 2-(5-chloro-3-methylsulfinyl-1-benzofuran-2-yl)acetate","Acta Crystallographica Section E","2007","63","9","o3832","o3832","10.1107/S160053680704007X","","","0.71073","MoKα","","0.0381","0.0327","","","0.0781","0.0817","","","","","","1.107","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214951","8.0276","0.0013","10.0734","0.0016","16.458","0.003","105.166","0.003","94.668","0.003","90.576","0.003","1279.6","0.4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","(<i>E</i>)-4-Bromo-<i>N</i>'-[(5-methylfuran-2-yl)methylene]benzohydrazide","","- C13 H11 Br N2 O2 -","- C13 H11 Br N2 O2 -","- C52 H44 Br4 N8 O8 -","4","2","AT2374","Bai, Zheng-Chen; Jing, Zuo-Liang","(<i>E</i>)-4-Bromo-<i>N</i>'-[(5-methylfuran-2-yl)methylene]benzohydrazide","Acta Crystallographica Section E","2007","63","9","o3822","o3822","10.1107/S1600536807040081","","","0.71073","MoKα","","0.0645","0.0409","","","0.095","0.1039","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214952","16.265","0.005","8.459","0.003","15.14","0.005","90","","94.459","0.005","90","","2076.7","1.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(5-thioxo-1,5-dihydro-1,3,4- thiadiazole-3-thiolato-κS)zinc(II)","","- C14 H10 N6 S6 Zn -","- C14 H10 N6 S6 Zn -","- C56 H40 N24 S24 Zn4 -","4","0.5","AT2375","Zhang, Xiu-Ling; Qiu, Yu-E; Zhang, Cun-Lan; Xin, Bing-Wei","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(5-thioxo-1,5-dihydro-1,3,4-thiadiazole-3-thiolato-κ<i>S</i>)zinc(II)","Acta Crystallographica Section E","2007","63","9","m2381","m2382","10.1107/S160053680704010X","","","0.71073","MoKα","","0.0418","0.0275","","","0.0654","0.0721","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214953","18.701","0.004","8.8269","0.0017","9.6106","0.0018","90","","97.571","0.003","90","","1572.6","0.5","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-<i>N</i>'-(3,5-Dibromo-2-hydroxybenzylidene)-4-methoxybenzohydrazide","","- C15 H12 Br2 N2 O3 -","- C15 H12 Br2 N2 O3 -","- C60 H48 Br8 N8 O12 -","4","1","AT2376","Bai, Zheng-Chen; Jing, Zuo-Liang","(<i>E</i>)-<i>N</i>'-(3,5-Dibromo-2-hydroxybenzylidene)-4-methoxybenzohydrazide","Acta Crystallographica Section E","2007","63","9","o3823","o3823","10.1107/S1600536807040111","","","0.71073","MoKα","","0.0753","0.0402","","","0.1021","0.1295","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214954","9.4902","0.0006","10.9347","0.0008","14.8687","0.001","90","","90","","90","","1542.96","0.18","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-Bromo-N'-[(E)-4-hydroxybenzylidene]-5-methoxybenzohydrazide","","- C15 H13 Br N2 O3 -","- C15 H13 Br N2 O3 -","- C60 H52 Br4 N8 O12 -","4","1","AT2377","Sarojini, B. K.; Narayana, B.; Sunil, K.; Yathirajan, H. S.; Bolte, Michael","2-Bromo-<i>N</i>'-[(<i>E</i>)-4-hydroxybenzylidene]-5-methoxybenzohydrazide","Acta Crystallographica Section E","2007","63","9","o3862","o3863","10.1107/S1600536807040603","","","0.71073","MoKα","","0.0392","0.0324","","","0.0619","0.0637","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214956","13.8552","0.0011","7.164","0.0004","14.1324","0.0011","90","","103.29","0.006","90","","1365.2","0.17","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-bis(4-chlorophenyl)thiourea","","- C13 H10 Cl2 N2 S -","- C13 H10 Cl2 N2 S -","- C52 H40 Cl8 N8 S4 -","4","1","AT2379","Sarojini, B. K.; Narayana, B.; Swamy, M. T.; Yathirajan, H. S.; Bolte, Michael","Redetermination of <i>N</i>,<i>N</i>'-bis(4-chlorophenyl)thiourea at 173 K","Acta Crystallographica Section E","2007","63","9","o3879","o3879","10.1107/S1600536807040871","","","0.71073","MoKα","","0.0362","0.0318","","","0.0807","0.0829","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214957","4.8383","0.001","14.906","0.003","11.663","0.002","90","","100.04","0.03","90","","828.3","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-benzylacetamide","","- C9 H11 N O -","- C9 H11 N O -","- C36 H44 N4 O4 -","4","1","AV3099","Wioleta Śmiszek-Linder; Joachim Kusz","<i>N</i>-Benzylacetamide","Acta Crystallographica Section E","2007","63","9","o3713","o3713","10.1107/S1600536807037828","","","0.71073","MoKα","","0.0795","0.0392","","","0.0917","0.0958","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214958","8.952","0.0013","27.347","0.004","9.2555","0.0013","90","","107.626","0.002","90","","2159.5","0.5","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl 5-(5,6-diphenyl-1,2,4-triazin-3-yl)-2,6-dimethylnicotinate","","- C25 H22 N4 O2 -","- C25 H22 N4 O2 -","- C100 H88 N16 O8 -","4","1","BG2074","Lu, Dong-Liang; Zhang, Min; Song, Li-Ping; Huang, Pei-Gang; Xu, Li-Ying","Ethyl 5-(5,6-diphenyl-1,2,4-triazin-3-yl)-2,6-dimethylnicotinate","Acta Crystallographica Section E","2007","63","9","o3757","o3757","10.1107/S1600536807036926","","","0.71073","MoKα","","0.0827","0.0643","","","0.1894","0.2075","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214959","15.8249","0.0015","6.356","0.0007","18.0213","0.0019","90","","103.552","0.009","90","","1762.2","0.3","200","3","200","3","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2-Bis(pentafluorophenyloxy)-1,3-benzodioxole","","- C19 H4 F10 O4 -","- C19 H4 F10 O4 -","- C76 H16 F40 O16 -","4","1","BG2082","Betz, Richard; Klüfers, Peter; Reichvilser, Moritz M.","2,2-Bis(pentafluorophenyloxy)-1,3-benzodioxole","Acta Crystallographica Section E","2007","63","9","o3769","o3769","10.1107/S1600536807038950","","","0.71073","MoKα","","0.0757","0.0508","","","0.1175","0.1333","","","","","","1.115","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214960","7.491","0.003","12.316","0.004","7.621","0.003","90","","100.437","0.005","90","","691.5","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis(2-oxidopyridinium-3-carboxylate-κ^2^O^2^,O^3^)zinc(II)","","- C12 H12 N2 O8 Zn -","- C12 H12 N2 O8 Zn -","- C24 H24 N4 O16 Zn2 -","2","0.5","BG2083","Yan, Huai-Yi; Hu, Tai-Qiu","Diaquabis(2-oxidopyridinium-3-carboxylate-κ^2^<i>O</i>^2^,<i>O</i>^3^)zinc(II)","Acta Crystallographica Section E","2007","63","9","m2325","m2325","10.1107/S1600536807037750","","","0.71073","MoKα","","0.0551","0.0415","","","0.0882","0.0926","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214961","9.1976","0.0002","9.5012","0.0002","10.9418","0.0003","104.03","0.02","95.08","0.001","108.73","0.01","864.01","0.12","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","3,5-Bis(4-methylbenzylidene)-4-oxopiperidine-1-carbonitrile","","- C22 H20 N2 O -","- C22 H20 N2 O -","- C44 H40 N4 O2 -","2","1","BG2085","M. Subha Nandhini; N. Srinivasan; R. Ranjithkumar; S. Perumal; R. V. Krishnakumar","3,5-Bis[(<i>E</i>)-4-methylbenzylidene]-4-oxopiperidine-1-carbonitrile","Acta Crystallographica Section E","2007","63","9","o3749","o3749","10.1107/S1600536807037956","","","0.71073","MoKα","","0.0934","0.05","","","0.1288","0.1497","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214962","6.8286","0.001","8.5231","0.0013","11.3654","0.0016","98.442","0.002","105.614","0.003","108.859","0.002","582.69","0.15","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Dibromidobis(2-methyl-5-phenyl-s-triazolo[3,4-b][1,3,4]thiadiazole- κN)nickel(II)","","- C20 H16 Br2 N8 Ni S2 -","- C20 H16 Br2 N8 Ni S2 -","- C20 H16 Br2 N8 Ni S2 -","1","0.5","BG2086","Liang-Gui Wang","Dibromidobis(2-methyl-5-phenyl-<i>s</i>-triazolo[3,4-<i>b</i>][1,3,4]thiadiazole-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2007","63","9","m2345","m2345","10.1107/S160053680703958X","","","0.71073","MoKα","","0.0632","0.0443","","","0.1114","0.1164","","","","","","0.885","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2214963","7.6894","0.0002","8.5406","0.0002","9.3858","0.0003","84.87","0.001","86.964","0.001","78.852","0.002","601.93","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Bis(3-acetyl-6-methyl-2-oxo-2<i>H</i>-pyran-4-\ olato)bis(dimethylformamide)copper(II)","","- C22 H28 Cu N2 O10 -","- C22 H28 Cu N2 O10 -","- C22 H28 Cu N2 O10 -","1","0.5","BG2087","Bouchama, Abdelaziz; Bendaâs, Abderrahmen; Chiter, Chaabane; Beghidja, Adel; Djedouani, Amel","Bis(3-acetyl-6-methyl-2-oxo-2<i>H</i>-pyran-4-olato)bis(dimethylformamide)copper(II)","Acta Crystallographica Section E","2007","63","9","m2397","m2397","10.1107/S1600536807040585","","","0.71069","MoKα","","0.0467","0.0374","","","0.0976","0.1029","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214964","15.2109","0.0019","6.3608","0.0008","20.119","0.003","90","","93.882","0.002","90","","1942.1","0.4","187","2","187","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N',N'',N'''-Tetrakis(2-hydroxybenzylidene)biphenyl-3,3',4,4'-tetramine dimethylformamide solvate","","- C43 H37 N5 O5 -","- C43 H37 N5 O5 -","- C86 H74 N10 O10 -","2","0.5","BG2088","Xi-Quan Che","<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>'''-Tetrakis(2-hydroxybenzylidene)biphenyl-3,3',4,4'-tetramine dimethylformamide solvate","Acta Crystallographica Section E","2007","63","9","o3885","o3885","10.1107/S1600536807040883","","","0.71073","MoKα","","0.0909","0.0663","","","0.1784","0.2005","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214966","21.453","0.002","10.272","0.001","17.587","0.002","90","","109.411","0.001","90","","3655.3","0.6","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[1,3-bis(1<i>H</i>-benzimidazol-2-yl)benzene-κ<i>N</i>^3^](succinato-\ κ^2^<i>O</i>,<i>O</i>')zinc(II)","","- C44 H32 N8 O4 Zn -","- C44 H32 N8 O4 Zn -","- C176 H128 N32 O16 Zn4 -","4","0.5","BG3051","Meng, Fa-Yan; Dong, Wu-Heng; Ng, Seik Weng","Bis[1,3-bis(1<i>H</i>-benzimidazol-2-yl)benzene-κ<i>N</i>^3^](succinato-κ^2^<i>O</i>,<i>O</i>')zinc(II), a succinate-chelated monomeric compound","Acta Crystallographica Section E","2007","63","9","m2398","m2399","10.1107/S160053680704055X","","","0.71073","MoKα","","0.0489","0.035","","","0.0935","0.1027","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214967","11.7648","0.0014","5.655","0.0006","9.6367","0.0011","90","","125.843","0.006","90","","519.72","0.11","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-poly[[diaquamanganese(II)]-μ-oxalato-κ^4^O^1^,O^2^:O^1'^,O^2'^]","","- C2 H4 Mn O6 -","- C2 H4 Mn O6 -","- C8 H16 Mn4 O24 -","4","0.5","BH2112","Soleimannejad, Janet; Aghabozorg, Hossein; Hooshmand, Shabnam; Ghadermazi, Mohammad; Attar Gharamaleki, Jafar","The monoclinic polymorph of <i>catena</i>-poly[[diaquamanganese(II)]-μ-oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^]","Acta Crystallographica Section E","2007","63","9","m2389","m2390","10.1107/S1600536807040470","","","0.71073","MoKα","","0.0157","0.0156","","","0.0459","0.046","","","","","","1.098","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214968","14.521","0.003","11.405","0.002","9.719","0.002","90","","108.368","0.003","90","","1527.6","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-Acetyl-5-(4-fluorophenyl)-3-(4-methylphenyl)-2-pyrazoline","","- C18 H17 F N2 O -","- C18 H17 F N2 O -","- C72 H68 F4 N8 O4 -","4","1","BH2115","Guo, Huan-Mei","1-Acetyl-5-(4-fluorophenyl)-3-(4-methylphenyl)-2-pyrazoline","Acta Crystallographica Section E","2007","63","9","o3779","o3779","10.1107/S1600536807038810","","","0.71073","MoKα","","0.0565","0.0396","","","0.0962","0.1049","","","","","","1.024","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214969","6.9337","0.0008","16.133","0.002","8.2475","0.001","90","","99.519","0.006","90","","909.87","0.19","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5,5'-Dimethyl-2,2'-[p-phenylenebis(methylenethio)]bis(4,5-dihydrothiazole)","","- C16 H20 N2 S4 -","- C16 H20 N2 S4 -","- C32 H40 N4 S8 -","2","0.5","BH2122","Zhou, Xi-Fei; Hai-Jun Chi; Liang, Dong; Sun, Dong-Mei; Wang, Wei","5,5'-Dimethyl-2,2'-[<i>p</i>-phenylenebis(methylenethio)]bis(4,5-dihydrothiazole)","Acta Crystallographica Section E","2007","63","9","o3864","o3864","10.1107/S1600536807040469","","","0.71073","MoKα","","0.0739","0.0497","","","0.1228","0.1345","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214970","10.1128","0.0002","17.4753","0.0003","10.5053","0.0002","90","","102.599","0.001","90","","1811.84","0.06","105","2","105","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","<i>catena</i>-Poly[[(acetonitrile-κN)silver(I)]-di-μ- trifluoromethanesulfonato-κ^4^O:O'-[(acetonitrile-κN)silver(I)]-μ- tetraphenyldiphosphine-κ^2^P:P']","","- C15 H13 Ag F3 N O3 P S -","- C15 H13 Ag F3 N O3 P S -","- C60 H52 Ag4 F12 N4 O12 P4 S4 -","4","1","BH2125","Carson, Cody E.; Feazell, Rodney P.; Klausmeyer, Kevin K.","<i>catena</i>-Poly[[(acetonitrile-κ<i>N</i>)silver(I)]-di-μ-trifluoromethanesulfonato-κ^4^<i>O</i>:<i>O</i>'-[(acetonitrile-κ<i>N</i>)silver(I)]-μ-tetraphenyldiphosphine-κ^2^<i>P</i>:<i>P</i>']","Acta Crystallographica Section E","2007","63","9","m2395","m2395","10.1107/S1600536807040597","","","0.71073","MoKα","","0.0527","0.0396","","","0.1025","0.1121","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214971","6.1548","0.0007","9.8007","0.0011","11.9296","0.0013","80.552","0.009","75.167","0.009","82.188","0.009","682.86","0.14","296","","296","","","","","","","","","4","P -1","-P 1","2","","4-(4-Nitrophenyl)-3-phenoxyazetidin-2-one","","- C15 H12 N2 O4 -","- C15 H12 N2 O4 -","- C30 H24 N4 O8 -","2","1","BH2126","Mehmet Akkurt; Şerife Pınar Yalçın; Ali Asghar Jarrahpour; Mohammad Nazari; Orhan Büyükgüngör","4-(4-Nitrophenyl)-3-phenoxyazetidin-2-one","Acta Crystallographica Section E","2007","63","9","o3729","o3730","10.1107/S1600536807038354","","","0.71073","MoKα","","0.0573","0.0433","","","0.1081","0.1164","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214972","10.4453","0.0009","22.2586","0.0019","9.966","0.0009","90","","90","","90","","2317.1","0.4","291","2","291","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Diaqua(benzoato-κ^2^O,O')(2,9-dimethyl-1,10-phenanthroline-κ^2^N,N')nickel(II) nitrate dihydrate","","- C21 H25 N3 Ni O9 -","- C21 H25 N3 Ni O9 -","- C84 H100 N12 Ni4 O36 -","4","0.5","BH2128","Xuan, Xiao-Peng; Zhao, Pei-Zheng; Tang, Qing-Hu","Diaqua(benzoato-κ^2^<i>O</i>,<i>O</i>')(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nickel(II) nitrate dihydrate","Acta Crystallographica Section E","2007","63","9","m2405","m2405","10.1107/S1600536807040706","","","0.71073","MoKα","","0.0434","0.034","","","0.0903","0.0976","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214973","12.4167","0.0014","12.9964","0.0013","9.5511","0.001","90","","100.879","0.01","90","","1513.6","0.3","290","2","290","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dimethyl 2-chloro-3-tosylmaleate","","- C13 H13 Cl O6 S -","- C13 H13 Cl O6 S -","- C52 H52 Cl4 O24 S4 -","4","1","BH2129","Abbasi, Alireza; Kianmehr, Ebrahim; Beheshti, Saeideh; Eriksson, Lars","Dimethyl 2-chloro-3-tosylmaleate","Acta Crystallographica Section E","2007","63","9","o3774","o3774","10.1107/S1600536807039128","","","0.71073","MoKα","","0.0561","0.0446","","","0.1228","0.1272","","","","","","0.993","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214974","13.131","0.003","11.864","0.002","14.911","0.003","90","","91.13","0.03","90","","2322.5","0.8","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>,<i>N</i>'-Bis(2-methoxyphenyl)anthracene-1,8-dicarboxamide","","- C30 H24 N2 O4 -","- C30 H24 N2 O4 -","- C120 H96 N8 O16 -","4","1","BH2130","Gao, En; He, Rui; Zhang, Huan-Xia; Qin, Da-Bin","<i>N</i>,<i>N</i>'-Bis(2-methoxyphenyl)anthracene-1,8-dicarboxamide","Acta Crystallographica Section E","2007","63","9","o3816","o3816","10.1107/S1600536807039311","","","0.71073","MoKα","","0.0428","0.0399","","","0.1042","0.1065","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214975","7.8599","0.0014","8.1421","0.0015","17.901","0.004","90","","98.172","0.003","90","","1134","0.4","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N'-[1-(4-Chlorophenyl)ethylidene]propionohydrazide","","- C11 H13 Cl N2 O -","- C11 H13 Cl N2 O -","- C44 H52 Cl4 N8 O4 -","4","1","BH2131","Guo, Huan-Mei","<i>N</i>'-[1-(4-Chlorophenyl)ethylidene]propionohydrazide","Acta Crystallographica Section E","2007","63","9","o3870","o3870","10.1107/S1600536807040718","","","0.71073","MoKα","","0.0679","0.0386","","","0.0997","0.1207","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214976","8.4166","0.0008","5.6056","0.0005","17.9484","0.0017","90","","100.26","0.001","90","","833.27","0.13","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-tosylsulphonylhydrazine","4-Methylbenzenesulfonohydrazide","","- C7 H10 N2 O2 S -","- C7 H10 N2 O2 S -","- C28 H40 N8 O8 S4 -","4","1","BI2204","Saikat Roy; Ashwini Nangia","<i>p</i>-Tosylhydrazine: a redetermination from single-crystal data at 100 K","Acta Crystallographica Section E","2007","63","9","o3696","o3696","10.1107/S1600536807037518","","","0.71073","MoKα","","0.0628","0.0604","","","0.1159","0.117","","","","","","1.297","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214977","15.042","0.007","13.295","0.006","16.219","0.007","90","","101.792","0.007","90","","3175","2","290","2","290","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(2<i>Z</i>,3<i>E</i>)-2,3-Bis(2-thienylmethylene)succinic acid methanol hemisolvate","","- C14.5 H12 O4.5 S2 -","- C14.5 H12 O4.5 S2 -","- C116 H96 O36 S16 -","8","1","BI2212","K. N. Venugopala; Deepak Chopra; C. R. Girija; Noor Shahina Begum; G. K. Rao","(2<i>Z</i>,3<i>E</i>)-2,3-Bis(2-thienylmethylene)succinic acid methanol hemisolvate","Acta Crystallographica Section E","2007","63","9","o3722","o3722","10.1107/S1600536807037622","","","0.71073","MoKα","","0.0794","0.0724","","","0.2223","0.2326","","","","","","1.119","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214978","7.2813","0.001","15.248","0.002","13.5034","0.0019","90","","90.967","0.002","90","","1499","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dichlorido{2-[3-(2-pyridyl)pyrazol-1-ylmethyl]pyridine}zinc(II)","","- C14 H12 Cl2 N4 Zn -","- C14 H12 Cl2 N4 Zn -","- C56 H48 Cl8 N16 Zn4 -","4","1","BI2215","Chun-Sen Liu; Jiang-Ning Zhou","Dichlorido{2-[3-(2-pyridyl)pyrazol-1-ylmethyl]pyridine}zinc(II)","Acta Crystallographica Section E","2007","63","9","m2290","m2290","10.1107/S1600536807037646","","","0.71073","MoKα","","0.0582","0.0325","","","0.064","0.0734","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214979","18.407","0.002","6.8231","0.001","25.2925","0.001","90","","99.4","0.02","90","","3133.9","0.6","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","Tetraaquabis(4,4'-bipyridine)manganese(II) pyridine-2,6-dicarboxylate tetrahydrate","","- C27 H35 Mn N5 O12 -","- C27 H35 Mn N5 O12 -","- C108 H140 Mn4 N20 O48 -","4","1","BI2217","Gao, Yu-Xiang; Wang, Li-Bin; Niu, Yan-Ling","Tetraaquabis(4,4'-bipyridine)manganese(II) pyridine-2,6-dicarboxylate tetrahydrate","Acta Crystallographica Section E","2007","63","9","m2283","m2283","10.1107/S160053680703766X","","","0.71073","MoKα","","0.0377","0.0331","","","0.0868","0.0913","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214980","16.0734","0.0017","8.5147","0.0009","17.3393","0.0018","90","","113.446","0.002","90","","2177.1","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diacetato(1,4,8,11-tetraazacyclotetradecane)manganese(III) perchlorate monohydrate","","- C14 H32 Cl Mn N4 O9 -","- C14 H32 Cl Mn N4 O9 -","- C56 H128 Cl4 Mn4 N16 O36 -","4","1","BI2218","Hwang, In-Chul; Ha, Kwang","Diacetato(1,4,8,11-tetraazacyclotetradecane)manganese(III) perchlorate monohydrate","Acta Crystallographica Section E","2007","63","9","m2299","m2299","10.1107/S1600536807038421","","","0.71073","MoKα","","0.0832","0.0579","","","0.1577","0.1722","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214981","4.9002","0.0012","12.385","0.003","21.774","0.005","90","","100.727","0.006","90","","1298.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-Butanoyl-<i>N</i>'-(4-nitrophenyl)thiourea","","- C11 H13 N3 O3 S -","- C11 H13 N3 O3 S -","- C44 H52 N12 O12 S4 -","4","1","BI2219","Yusof, M. Sukeri M.; Saadum, Zati Iwani M.; Yamin, Bohari M.","<i>N</i>-Butanoyl-<i>N</i>'-(4-nitrophenyl)thiourea","Acta Crystallographica Section E","2007","63","9","o3781","o3781","10.1107/S1600536807038433","","","0.71073","MoKα","","0.0585","0.0431","","","0.117","0.1282","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214983","10.4504","0.0002","11.2896","0.0003","13.0965","0.0003","90","","100.407","0.001","90","","1519.72","0.06","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Z)-(2-Aminothiazol-1-ium-4-yl)-2-(tert-butoxycarbonylmethoxyimino)acetate monohydrate","","- C11 H17 N3 O6 S -","- C11 H17 N3 O6 S -","- C44 H68 N12 O24 S4 -","4","1","BI2222","Xiang-Wei Cheng","(<i>Z</i>)-2-(2-Aminothiazol-1-ium-4-yl)-2-(<i>tert</i>-butoxycarbonylmethoxyimino)acetate monohydrate","Acta Crystallographica Section E","2007","63","9","o3728","o3728","10.1107/S1600536807038469","","","0.71073","MoKα","","0.0329","0.0311","","","0.0824","0.0839","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214984","7.2169","0.0008","11.8122","0.0014","13.2986","0.0015","90","","90","","90","","1133.7","0.2","223","2","223","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1<i>R</i>,4<i>S</i>)-(-)-1,7,7-Trimethyl-3,3-ethylenedioxybicyclo- [2.2.1]heptan-2-one","","- C12 H18 O3 -","- C12 H18 O3 -","- C48 H72 O12 -","4","1","BI2223","Boyle, Grant A.; Govender, Thavendran; Kruger, Hendrik G.; Maguire, Glenn E. M.","(1<i>R</i>,4<i>S</i>)-({-})-3,3-Ethylenedioxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one","Acta Crystallographica Section E","2007","63","9","o3765","o3765","10.1107/S1600536807038470","","","0.71073","MoKα","","0.0425","0.0393","","","0.1087","0.1121","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214985","6.9299","0.0013","6.1868","0.0012","23.531","0.004","90","","91.528","0.002","90","","1008.5","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hexaaquacopper(II) bis(4-hydroxybenzenesulfonate)","","- C12 H22 Cu O14 S2 -","- C12 H22 Cu O14 S2 -","- C24 H44 Cu2 O28 S4 -","2","0.5","BI2224","Liu, Yin-Qiu; Zeng, Xi-Rui","Hexaaquacopper(II) bis(4-hydroxybenzenesulfonate)","Acta Crystallographica Section E","2007","63","9","m2414","m2414","10.1107/S1600536807041190","","","0.71073","MoKα","","0.0283","0.0273","","","0.0788","0.0794","","","","","","1.094","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2214986","13.677","0.002","12.7319","0.0018","9.8561","0.0014","90","","90","","90","","1716.3","0.4","150","2","150","2","","","","","","","","5","P c a 21","P 2c -2ac","29","[<i>N</i>,<i>N</i>'-Bis(6-methoxysalicylidene)-1,3-diaminopropane]nickel(II)","{3,3'-dimethoxy-2,2'-[propane-1,3- diylbis(nitrilomethylidyne)]diphenolato}nickel(II)","","- C19 H20 N2 Ni O4 -","- C19 H20 N2 Ni O4 -","- C76 H80 N8 Ni4 O16 -","4","1","BI2225","Habibi, Mohammad Hossein; Mokhtari, Reza; Harrington, Ross W.; Clegg, William","[<i>N</i>,<i>N</i>'-Bis(6-methoxysalicylidene)-1,3-diaminopropane]nickel(II)","Acta Crystallographica Section E","2007","63","9","m2304","m2304","10.1107/S1600536807038482","","","0.71073","MoKα","","0.0538","0.0374","","","0.0894","0.101","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214987","22.9779","0.0019","7.0369","0.0005","5.8425","0.0005","90","","95.229","0.003","90","","940.76","0.13","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2<i>E</i>,2'<i>E</i>)-1,1'-Bis(4-chlorophenyl)-3,3'-(1,4-phenylene)diprop- 2-en-1-one","","- C24 H16 Cl2 O2 -","- C24 H16 Cl2 O2 -","- C48 H32 Cl4 O4 -","2","0.5","BI2226","Harrison, William T. A.; H. J. Ravindra; M. R. Suresh Kumar; S. M. Dharmaprakash","(2<i>E</i>,2'<i>E</i>)-1,1'-Bis(4-chlorophenyl)-3,3'-(1,4-phenylene)diprop-2-en-1-one","Acta Crystallographica Section E","2007","63","9","o3702","o3702","10.1107/S1600536807037634","","","0.71073","MoKα","","0.0682","0.0612","","","0.1925","0.1999","","","","","","1.155","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214988","6.0213","0.001","9.96","0.002","8.6869","0.001","90","","101.021","0.01","90","","511.36","0.15","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[chlorido(μ~3~-1,2,4-triazolato)copper(II)]","","- C2 H2 Cl Cu N3 -","- C2 H2 Cl Cu N3 -","- C8 H8 Cl4 Cu4 N12 -","4","1","BI2227","Gao, Yu-Xiang; Wang, Li-Bin; Niu, Yan-Ling","Poly[chlorido(μ~3~-1,2,4-triazolato)copper(II)]","Acta Crystallographica Section E","2007","63","9","m2366","m2366","10.1107/S1600536807040007","","","0.71073","MoKα","","0.0223","0.0187","","","0.0365","0.038","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214989","7.567","0.0012","7.923","0.0013","19.042","0.0012","90","","90","","90","","1141.6","0.3","295","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(R)-Dimethyl [(2-chlorophenyl)hydroxymethyl]phosphonate","","- C9 H12 Cl O4 P -","- C9 H12 Cl O4 P -","- C36 H48 Cl4 O16 P4 -","4","1","BQ2031","Tahir, M. Nawaz; Nurcan Acar; Hamza Yilmaz; Muhammad Danish; Ülkü, Dinçer","(<i>R</i>)-Dimethyl [(2-chlorophenyl)hydroxymethyl]phosphonate","Acta Crystallographica Section E","2007","63","9","o3817","o3818","10.1107/S1600536807039499","","","0.71073","MoKα","","1.102","0.0387","","","","0.1127","","","","","","1.102","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214990","7.7508","0.0008","8.984","0.0009","10.8167","0.0011","93.728","0.008","103.541","0.008","109.994","0.008","679.4","0.13","296","","296","","","","","","","","","6","P -1","-P 1","2","Dihistaminedisaccharinatonickel(II)","bis[2-(1H-imidazol-4-yl)ethanamine]disaccharinatonickel(II)","","- C24 H26 N8 Ni O6 S2 -","- C24 H26 N8 Ni O6 S2 -","- C24 H26 N8 Ni O6 S2 -","1","0.5","BR2052","Bulut, İclal; Paşaoğlu, Hümeyra; Kaştaş, Gökhan; Bulut, Ahmet","Dihistaminedisaccharinatonickel(II)","Acta Crystallographica Section E","2007","63","9","m2409","m2410","10.1107/S1600536807040780","","","0.71073","MoKα","","0.0398","0.0362","","","0.1011","0.1037","","","","","","1.008","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2214991","15.8182","0.0013","29.778","0.002","11.4267","0.0009","90","","90.934","0.002","90","","5381.7","0.7","153","2","153","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[tetrakis(hexamethylphosphoramide-κ<i>O</i>)bis(nitrato-\ κ^2^<i>O</i>,<i>O</i>')europium(III)] [silver(I)-di-μ-sulfido-tungstate(VI)(<i>Ag—W</i>)-di-μ-sulfido]]","","- C24 H72 Ag Eu N14 O10 P4 S4 W -","- C24 H72 Ag Eu N14 O10 P4 S4 W -","- C96 H288 Ag4 Eu4 N56 O40 P16 S16 W4 -","4","1","BR2053","Zhang, Jinfang; Qian, Jun; Cao, Yuan; Zhang, Chi","<i>catena</i>-Poly[[tetrakis(hexamethylphosphoramide-κ<i>O</i>)bis(nitrato-κ^2^<i>O</i>,<i>O</i>')europium(III)] [silver(I)-di-μ-sulfido-tungstate(VI)(<i>Ag{—</i>W})-di-μ-sulfido]]","Acta Crystallographica Section E","2007","63","9","m2386","m2387","10.1107/S1600536807039293","","","0.7107","MoKα","","0.0461","0.0411","","","0.0879","0.09","","","","","","1.154","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214992","22.153","0.004","4.77","0.001","14.053","0.003","90","","100.94","0.03","90","","1458","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5-Methyl-2-[(E)-2-(5-methylbenz[d]oxazol-2-yl)vinyl]benz[d]oxazole","","- C18 H14 N2 O2 -","- C18 H14 N2 O2 -","- C72 H56 N8 O8 -","4","0.5","BT2434","Fang-Fang Jian; Wei Yi; Li-Ming Wang; Jing Wang","5-Methyl-2-[(<i>E</i>)-2-(5-methylbenz[<i>d</i>]oxazol-2-yl)vinyl]benz[<i>d</i>]oxazole","Acta Crystallographica Section E","2007","63","9","o3887","o3887","10.1107/S1600536807035362","","","0.71073","MoKα","","0.104","0.0549","","","0.1329","0.1549","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214993","7.9963","0.0008","7.9963","0.0008","25.793","0.004","90","","90","","90","","1649.2","0.3","293","2","293","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","3a-Bromoperhydro-2,6a-epoxyoxireno[e][2]benzofuran","","- C8 H9 Br O3 -","- C8 H9 Br O3 -","- C64 H72 Br8 O24 -","8","1","BT2437","Koşar, Başak; Karaarslan, Muhsin; Demircan, Aydın; Büyükgüngör, Orhan","3a-Bromoperhydro-2,6a-epoxyoxireno[<i>e</i>][2]benzofuran","Acta Crystallographica Section E","2007","63","9","o3691","o3691","10.1107/S1600536807037233","","","0.71073","MoKα","","0.0626","0.0452","","","0.0971","0.1102","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214994","4.37","0.004","34.55","0.02","9.96","0.009","90","","93.21","0.03","90","","1501","2","291","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","7-(5-Carboxypentyl)-1,3-dimethylxanthine monohydrate","6-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1<i>H</i>-purin-7-yl)hexanoic acid monohydrate","","- C13 H20 N4 O5 -","- C13 H20 N4 O5 -","- C52 H80 N16 O20 -","4","1","BT2438","Carvalho, José João; Emmerling, Franziska; Schneider, Rudolf J.","7-(5-Carboxypentyl)-1,3-dimethylxanthine monohydrate","Acta Crystallographica Section E","2007","63","9","o3718","o3718","10.1107/S1600536807037257","","","0.71073","MoKα","","0.1809","0.0484","","","0.115","0.1578","","","","","","0.857","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2214995","9.4165","0.0003","9.8777","0.0003","15.2418","0.0005","80.705","0.001","72.99","0.001","75.519","0.001","1306.61","0.07","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[bis(μ~3~-benzene-1,3-dicarboxylato)[μ~2~-4,4'-(propane-1,3-\ diyl)dipyridine]dizinc(II)]","","- C29 H22 N2 O8 Zn2 -","- C29 H22 N2 O8 Zn2 -","- C58 H44 N4 O16 Zn4 -","2","1","BT2441","Chia-Her Lin; Tai-Hsing Tsao","Poly[bis(μ~3~-benzene-1,3-dicarboxylato)[μ~2~-4,4'-(propane-1,3-diyl)dipyridine]dizinc(II)]","Acta Crystallographica Section E","2007","63","9","m2341","m2341","10.1107/S160053680703509X","","","0.71073","MoKα","","0.0553","0.0373","","","0.088","0.1059","","","","","","0.904","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214996","11.059","0.002","6.9782","0.0014","15.319","0.003","90","","100.01","0.03","90","","1164.2","0.4","170","2","170","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Poly[propane-1,2-diammonium [μ~2~-hydroxido-di-μ~2~-phosphonato-aluminium(III)] monohydrate]","","- C3 H17 Al N2 O8 P2 -","- C3 H17 Al N2 O8 P2 -","- C12 H68 Al4 N8 O32 P8 -","4","1","BT2443","Wu-Hua Chen; Yong Xiang; Jian-Zhong Chen; Qing-Xin Zeng","Poly[propane-1,2-diammonium [μ~2~-hydroxido-di-μ~2~-phosphonato-aluminium(III)] monohydrate]","Acta Crystallographica Section E","2007","63","9","m2401","m2401","10.1107/S1600536807040512","","","0.71073","MoKα","","0.027","0.0258","","","0.0791","0.0799","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214997","20.06","0.003","10.1381","0.0012","13.7285","0.0017","90","","110.844","0.002","90","","2609.2","0.6","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diaquabis[2-(2-pyridylmethoxy)pyrazine-κN^4^]bis(thiocyanato-κN)manganese(II)","","- C22 H22 Mn N8 O4 S2 -","- C22 H22 Mn N8 O4 S2 -","- C88 H88 Mn4 N32 O16 S8 -","4","0.5","BT2445","Li, Jin-Min","Diaquabis[2-(2-pyridylmethoxy)pyrazine-κ<i>N</i>^4^]bis(thiocyanato-κ<i>N</i>)manganese(II)","Acta Crystallographica Section E","2007","63","9","m2266","m2266","10.1107/S1600536807037166","","","0.71073","MoKα","","0.0326","0.0299","","","0.0803","0.0826","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214998","10.5417","0.0005","10.6758","0.0006","12.7711","0.0005","70.419","0.003","86.123","0.003","66.278","0.002","1235.97","0.11","183","2","183","2","","","","","","","","5","P -1","-P 1","2","","Poly[[μ-dioxane-κ^2^O:O'-dioxane-κ<i>O</i>-μ-diphenylamido-κ^2^N:N-\ potassium] dioxane solvate]","","- C24 H34 K N O6 -","- C24 H34 K N O6 -","- C48 H68 K2 N2 O12 -","2","1","BT2446","Gärtner, Martin; Görls, Helmar; Westerhausen, Matthias","Poly[[μ-dioxane-κ^2^<i>O</i>:<i>O</i>'-dioxane-κ<i>O</i>-μ-diphenylamido-κ^2^<i>N</i>:<i>N</i>-potassium] dioxane solvate]","Acta Crystallographica Section E","2007","63","9","m2287","m2288","10.1107/S1600536807037427","","","0.71073","MoKα","","0.0718","0.0439","","","0.0954","0.1067","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214999","9.6546","0.0003","13.966","0.0008","17.7356","0.0009","90","","92.639","0.003","90","","2388.9","0.2","183","2","183","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(μ-diphenylamido-κ^2^N:N)bis[tris(tetrahydrofuran-κ<i>O</i>)potassium(I)]","","- C48 H68 K2 N2 O6 -","- C48 H68 K2 N2 O6 -","- C96 H136 K4 N4 O12 -","2","0.5","BT2447","Gärtner, Martin; Görls, Helmar; Westerhausen, Matthias","Bis(μ-diphenylamido-κ^2^<i>N</i>:<i>N</i>)bis[tris(tetrahydrofuran-κ<i>O</i>)potassium(I)]","Acta Crystallographica Section E","2007","63","9","m2289","m2289","10.1107/S1600536807037439","","","0.71073","MoKα","","0.102","0.0603","","","0.1437","0.1686","","","","","","0.954","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215000","10.13","0.0011","10.814","0.0008","12.554","0.0013","90","","108.548","0.012","90","","1303.8","0.2","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dicyclohexyl(hydroxy)acetonitrile","","- C14 H23 N O -","- C14 H23 N O -","- C56 H92 N4 O4 -","4","1","BT2449","Betz, Richard; Klüfers, Peter","Dicyclohexyl(hydroxy)acetonitrile","Acta Crystallographica Section E","2007","63","9","o3893","o3893","10.1107/S160053680704127X","","","0.71073","MoKα","","0.0698","0.0407","","","0.0925","0.1003","","","","","","0.918","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215001","8.1302","0.0003","12.0908","0.0004","12.2445","0.0006","115.774","0.003","101.712","0.003","98.135","0.002","1024.67","0.08","100","0.1","100","0.1","","","","","","","","8","P -1","-P 1","2","","{2-[(2-Aminophenyl)iminomethyl]-4-bromophenolato-κ^3^N,N',<i>O</i>}chloridobis(dimethyl sulfoxide-κ<i>S</i>)ruthenium(II)","","- C17 H22 Br Cl N2 O3 Ru S2 -","- C17 H22 Br Cl N2 O3 Ru S2 -","- C34 H44 Br2 Cl2 N4 O6 Ru2 S4 -","2","1","BT2450","Naser Eltaher Eltayeb; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun; Kamarulazizi Ibrahim","{2-[(2-Aminophenyl)iminomethyl]-4-bromophenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>}chloridobis(dimethyl sulfoxide-κ<i>S</i>)ruthenium(II)","Acta Crystallographica Section E","2007","63","9","m2269","m2270","10.1107/S160053680703718X","","","0.71073","MoKα","","0.0624","0.0405","","","0.0879","0.1046","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215002","6.0863","0.0003","11.6958","0.0004","19.6816","0.0008","90","","90","","90","","1401.02","0.1","200","2","200","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3,4-<i>O</i>-Carbonyl-1,2:5,6-di-<i>O</i>-isopropylidene-D-mannitol","","- C13 H20 O7 -","- C13 H20 O7 -","- C52 H80 O28 -","4","1","BT2451","Betz, Richard; Klüfers, Peter; Reichvilser, Moritz M.","3,4-<i>O</i>-Carbonyl-1,2:5,6-di-<i>O</i>-isopropylidene-<small>D</small>-mannitol","Acta Crystallographica Section E","2007","63","9","o3890","o3890","10.1107/S1600536807041244","","","0.71073","MoKα","","0.094","0.0445","","","0.0971","0.1137","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215003","9.031","0.0003","4.725","0.0002","12.0343","0.0004","90","","116.119","0.002","90","","461.08","0.03","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-Hydroxycyclopropane-1-carboxylic acid","","- C4 H6 O3 -","- C4 H6 O3 -","- C16 H24 O12 -","4","1","BT2452","Betz, Richard; Klüfers, Peter","1-Hydroxycyclopropane-1-carboxylic acid","Acta Crystallographica Section E","2007","63","9","o3891","o3891","10.1107/S1600536807041256","","","0.71073","MoKα","","0.053","0.0457","","","0.1202","0.1265","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215004","17.321","0.004","5.4295","0.0012","24.6","0.005","90","","90","","90","","2313.5","0.9","123","","123","","","","","","","","","5","P c a 21","P 2c -2ac","29","","(2E)-1-(3-Bromothien-2-yl)-3-phenylprop-2-en-1-one","","- C13 H9 Br O S -","- C13 H9 Br O S -","- C104 H72 Br8 O8 S8 -","8","2","BT2454","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Ashalatha, B. V.; Narayana, B.","(2<i>E</i>)-1-(3-Bromothien-2-yl)-3-phenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","9","o3705","o3706","10.1107/S1600536807037841","","","0.71073","MoKα","","0.0941","0.0689","","","0.1648","0.1783","","","","","","0.992","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2215005","15.896","0.003","9.4181","0.0015","26.533","0.004","90","","94.957","0.012","90","","3957.4","1.1","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Bis[chloridobis(triphenylphosphine)copper(I)-μ-chlorido]\ bis(1,2-diaminopropane)copper(II) acetonitrile disolvate","bis(1,2-diaminopropane-2κ^2^N,N')di-μ-chlorido-1:2κ^2^Cl,2:3κ^2^Cl- dichlorido-1κCl,3κCl-tetrakis(triphenylphosphine)-1κ^2^P,3κ^2^P- tricopper(I,II,I) acetonitrile disolvate","","- C82 H86 Cl4 Cu3 N6 P4 -","- C82 H86 Cl4 Cu3 N6 P4 -","- C164 H172 Cl8 Cu6 N12 P8 -","2","0.5","BT2455","Habibi, Mohammad Hossein; Mikhak, Maryam; Harrington, Ross W.; Clegg, William","Bis[chloridobis(triphenylphosphine)copper(I)-μ-chlorido]bis(1,2-diaminopropane)copper(II) acetonitrile disolvate","Acta Crystallographica Section E","2007","63","9","m2305","m2306","10.1107/S1600536807037282","","","0.71073","MoKα","","0.087","0.0541","","","0.1337","0.1576","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215006","11.892","0.002","11.413","0.002","12.653","0.002","90","","96.959","0.003","90","","1704.7","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,4-Bis(4-chlorobenzoyl)piperazine","","- C18 H16 Cl2 N2 O2 -","- C18 H16 Cl2 N2 O2 -","- C72 H64 Cl8 N8 O8 -","4","1","BT2456","Jin, Hui-Min; Li, Pei-Fan; Li, Cai-Yun; Liu, Bin","1,4-Bis(4-chlorobenzoyl)piperazine","Acta Crystallographica Section E","2007","63","9","o3689","o3689","10.1107/S1600536807037300","","","0.71073","MoKα","","0.1067","0.0433","","","0.1061","0.132","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215007","8.873","0.002","23.121","0.003","8.43","0.0014","90","","116.475","0.015","90","","1548.1","0.5","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Dicyclohexylglycolic acid ethyl ester","Ethyl dicyclohexylglycolate","","- C16 H28 O3 -","- C16 H28 O3 -","- C64 H112 O12 -","4","1","BT2457","Betz, Richard; Herdlicka, Sonja; Klüfers, Peter","Ethyl dicyclohexylglycolate","Acta Crystallographica Section E","2007","63","9","o3916","o3916","10.1107/S1600536807041554","","","0.71073","MoKα","","0.0887","0.0628","","","0.1314","0.1469","","","","","","1.093","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215008","9.6696","0.0004","13.1526","0.0005","13.8048","0.0005","90","","94.898","0.001","90","","1749.29","0.12","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl (2-methyl-1-phenylsulfonyl-1H-indole-3-carbonyl)acetate","","- C19 H17 N O5 S -","- C19 H17 N O5 S -","- C76 H68 N4 O20 S4 -","4","1","BT2458","G. Chakkaravarthi; V. Dhayalan; A. K. Mohanakrishnan; V. Manivannan","Ethyl (2-methyl-1-phenylsulfonyl-1<i>H</i>-indole-3-carbonyl)acetate","Acta Crystallographica Section E","2007","63","9","o3698","o3698","10.1107/S1600536807037415","","","0.71073","MoKα","","0.0722","0.0498","","","0.1453","0.1614","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215009","7.9065","0.0003","10.1445","0.0003","14.8518","0.0006","84.097","0.003","78.2","0.003","84.869","0.002","1157","0.07","291","0.3","291","0.3","","","","","","","","5","P -1","-P 1","2","","Bis(8-methylquinolinium) tetrachloridoferrate(III) chloride","","- C20 H20 Cl5 Fe N2 -","- C20 H20 Cl5 Fe N2 -","- C40 H40 Cl10 Fe2 N4 -","2","1","BT2459","Kruszynski, Rafal; Wyrzykowski, Dariusz; Styczeń, Emilia; Chmurzyński, Lech","Bis(8-methylquinolinium) tetrachloridoferrate(III) chloride","Acta Crystallographica Section E","2007","63","9","m2279","m2280","10.1107/S1600536807037555","","","0.71073","MoKα","","0.0384","0.0291","","","0.081","0.0863","","","","","","1.094","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215010","5.0608","0.0006","15.087","0.002","9.29","0.001","90","","99.389","0.001","90","","699.81","0.15","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis(2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato- κ^2^<i>O</i>,<i>O</i>')cobalt(II)","","- C10 H10 Co N4 O10 -","- C10 H10 Co N4 O10 -","- C20 H20 Co2 N8 O20 -","2","0.5","BT2460","Xing, Hui-Hui; Chen, Zi-Lu; Ng, Seik Weng","Diaquabis(2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-κ^2^<i>O</i>,<i>O</i>')cobalt(II)","Acta Crystallographica Section E","2007","63","9","m2267","m2267","10.1107/S1600536807037312","","","0.71073","MoKα","","0.0404","0.0301","","","0.0799","0.0859","","","","","","1.046","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215011","7.7987","0.0016","8.9425","0.0018","24.472","0.005","90","","90.36","0.03","90","","1706.6","0.6","113","2","113","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Chloro-6-methoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)- 1,3,5-triazin-2-aminium chloride","","- C13 H23 Cl2 N5 O -","- C13 H23 Cl2 N5 O -","- C52 H92 Cl8 N20 O4 -","4","1","BT2461","Bin Zhou; Wen-Yuan Gao; Tie-Jun Zhang; Ke-Yue Liu","4-Chloro-6-methoxy-<i>N</i>-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-aminium chloride","Acta Crystallographica Section E","2007","63","9","o3716","o3716","10.1107/S1600536807037877","","","0.71073","MoKα","","0.0436","0.0411","","","0.0983","0.1002","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215012","7.6596","0.001","7.7316","0.001","9.0411","0.0012","104.045","0.003","95.004","0.002","103.121","0.002","500.08","0.11","130","2","130","2","","","","","","","","4","P -1","-P 1","2","(2,4,6-trinitrophenyl)guanidine","(2,4,6-Trinitrophenyl)guanidine","","- C7 H6 N6 O6 -","- C7 H6 N6 O6 -","- C14 H12 N12 O12 -","2","1","BT2462","Graham Smith; Urs D. Wermuth; Jonathan M. White","(2,4,6-Trinitrophenyl)guanidine","Acta Crystallographica Section E","2007","63","9","o3759","o3759","10.1107/S1600536807038068","","","0.71073","MoKα","","0.0509","0.0383","","","0.0791","0.0831","","","","","","0.923","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215013","7.213","0.002","13.285","0.004","13.316","0.004","61.405","0.004","76.169","0.005","86.688","0.005","1085.5","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Dichlorido(dimethyl sulfoxide-κO)(1,10-phenanthroline-5,6-dione-κ^2^N,N')copper(II) dimethyl sulfoxide monohydrate","","- C16 H20 Cl2 Cu N2 O5 S2 -","- C16 H20 Cl2 Cu N2 O5 S2 -","- C32 H40 Cl4 Cu2 N4 O10 S4 -","2","1","BT2463","Guang-Jun Xu; Ming-Jin Xie; Li Feng; Shi-Ping Yan; Dai-Zheng Liao","Dichlorido(dimethyl sulfoxide-κ<i>O</i>)(1,10-phenanthroline-5,6-dione-κ^2^<i>N</i>,<i>N</i>')copper(II) dimethyl sulfoxide monohydrate","Acta Crystallographica Section E","2007","63","9","m2313","m2313","10.1107/S1600536807038007","","","0.71073","MoKα","","0.0594","0.0392","","","0.1031","0.1213","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215014","10.4001","0.0017","10.5186","0.0017","13.415","0.002","90","","90","","90","","1467.5","0.4","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-4-(4-Mercaptophenyl)-2,2,4-trimethylchroman","","- C18 H20 O S -","- C18 H20 O S -","- C72 H80 O4 S4 -","4","1","BT2464","Tia Jacobs; Martin W. Bredenkamp; Elise J. C. de Vries","(<i>S</i>)-4-(4-Mercaptophenyl)-2,2,4-trimethylchroman","Acta Crystallographica Section E","2007","63","9","o3736","o3736","10.1107/S1600536807038184","","","0.71073","MoKα","","0.0925","0.0829","","","0.1952","0.2017","","","","","","1.129","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215015","9.53","0.001","10.676","0.001","11.654","0.002","90","","104.04","0.01","90","","1150.3","0.3","299","2","299","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-Methylphenyl benzoate","","- C14 H12 O2 -","- C14 H12 O2 -","- C56 H48 O8 -","4","1","BT2465","B. Thimme Gowda; Sabine Foro; K. S. Babitha; Hartmut Fuess","3-Methylphenyl benzoate","Acta Crystallographica Section E","2007","63","9","o3756","o3756","10.1107/S1600536807038585","","","0.71073","MoKα","","0.0678","0.0409","","","0.1054","0.1311","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215016","7.0122","0.0005","8.9766","0.0006","15.3539","0.001","75.073","0.01","89.51","0.01","85.01","0.01","930.21","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Biphenyl","2-Ethyl 3,4-dimethyl 4'-bromobiphenyl-2,3,4-tricarboxylate","","- C19 H17 Br O6 -","- C19 H17 Br O6 -","- C38 H34 Br2 O12 -","2","1","BT2466","S. Thenmozhi; A. Subbiah Pandi; D. Velmurugan; C. Prakash; K. Ravikumar","2-Ethyl 3,4-dimethyl 4'-bromobiphenyl-2,3,4-tricarboxylate","Acta Crystallographica Section E","2007","63","9","o3763","o3763","10.1107/S1600536807039141","","","0.71073","MoKα","","0.0475","0.0373","","","0.1038","0.1095","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215017","11.5051","0.0008","14.291","0.001","9.7794","0.0007","90","","102.885","0.001","90","","1567.43","0.19","295","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[μ-3,5-di-2-pyridyl-1,2,4-triazolato-\ κ^4^<i>N</i>^1^,<i>N</i>^5^:<i>N</i>^2^,<i>N</i>^3^]bis[(methanol-\ κO)(thiocyanato-κN)iron(II)]","","- C28 H24 Fe2 N12 O2 S2 -","- C28 H24 Fe2 N12 O2 S2 -","- C56 H48 Fe4 N24 O4 S4 -","2","0.5","BT2467","Jiang, Gang-Biao; Zeng, Xin-Nian; Fang, Yu-Sheng; Zeng, Ming-Hua; Ng, Seik Weng","Bis(μ-3,5-di-2-pyridyl-1,2,4-triazolato-κ^4^<i>N</i>^1^,<i>N</i>^5^:<i>N</i>^2^,<i>N</i>^3^)bis[(methanol-κ<i>O</i>)(thiocyanato-κ<i>N</i>)iron(II)]","Acta Crystallographica Section E","2007","63","9","m2319","m2319","10.1107/S1600536807039177","","","0.71073","MoKα","","0.0445","0.037","","","0.0878","0.0915","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215018","9.9723","0.0006","10.9891","0.0007","11.0273","0.0007","73.411","0.001","68.51","0.001","66.702","0.001","1018.67","0.11","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Tetraimidazolium bis(imidazole-κN)di-μ~4~-oxido-tetra-μ~3~-oxido-hexa-μ~2~-oxido-\ tetradecaoxido-octamolybdate(VI) monohydrate","","- C18 H30 Mo8 N12 O27 -","- C18 H30 Mo8 N12 O27 -","- C18 H30 Mo8 N12 O27 -","1","0.5","BT2468","Li, Chuan-Bi; Zong, Zhan-Guo; Gong, Jie; Ng, Seik Weng","Tetraimidazolium bis(imidazole-κ<i>N</i>)di-μ~4~-oxido-tetra-μ~3~-oxido-hexa-μ~2~-oxido-tetradecaoxidooctamolybdate(VI) monohydrate","Acta Crystallographica Section E","2007","63","9","m2320","m2320","10.1107/S1600536807039189","","","0.71073","MoKα","","0.0206","0.019","","","0.0492","0.0502","","","","","","1.026","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215019","7.2853","0.0002","11.1525","0.0003","14.0096","0.0003","70.123","0.001","78.582","0.001","75.987","0.001","1030.23","0.05","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[[pentaaqua[μ~4~-(5-carboxylato-m-\ phenylenedioxy)diacetato]cadmium(II)sodium(I)] tetrahydrate]","","- C11 H25 Cd Na O17 -","- C11 H25 Cd Na O17 -","- C22 H50 Cd2 Na2 O34 -","2","1","BT2469","Wen, Yi-Hang; Ng, Seik Weng","Poly[[pentaaqua[μ~4~-(5-carboxylato-<i>m</i>-phenylenedioxy)diacetato]cadmium(II)sodium(I)] tetrahydrate]","Acta Crystallographica Section E","2007","63","9","m2321","m2322","10.1107/S1600536807039220","","","0.71073","MoKα","","0.049","0.037","","","0.094","0.101","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215020","5.9466","0.0005","9.8323","0.0008","41.559","0.003","90","","90","","90","","2429.9","0.3","299","2","299","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-Chloro-<i>N</i>-(2-chlorophenyl)benzamide","","- C13 H9 Cl2 N O -","- C13 H9 Cl2 N O -","- C104 H72 Cl16 N8 O8 -","8","1","BT2470","B. Thimme Gowda; Sabine Foro; B. P. Sowmya; Hartmut Fuess","2-Chloro-<i>N</i>-(2-chlorophenyl)benzamide","Acta Crystallographica Section E","2007","63","9","o3789","o3789","10.1107/S1600536807039268","","","0.71073","MoKα","","0.0887","0.0777","","","0.1515","0.156","","","","","","1.287","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215021","5.2285","0.0001","33.4467","0.0009","9.4726","0.0003","90","","91.7226","0.0012","90","","1655.78","0.08","200","","200","","","","","","","","","4","P 1 21 1","P 2yb","4","","(2<i>R</i>,3a<i>S</i>,5a<i>R</i>,8a<i>R</i>,8b<i>S</i>)- 4-Bromo-2-(4-methoxyphenyl)-7,7-dimethyl-3a,5a,8a,8b-tetrahydrobenzo[1,2- <i>d</i>:3,4-<i>d</i>']bis[1,3]dioxole","","- C17 H19 Br O5 -","- C17 H19 Br O5 -","- C68 H76 Br4 O20 -","4","2","BT2471","Martin G. Banwell; Okanya J. Kokas; Anthony C. Willis","(2<i>R</i>,3a<i>S</i>,5a<i>R</i>,8a<i>R</i>,8b<i>S</i>)-4-Bromo-2-(4-methoxyphenyl)-7,7-dimethyl-3a,5a,8a,8b-tetrahydrobenzo[1,2-<i>d</i>:3,4-<i>d</i>']bis[1,3]dioxole","Acta Crystallographica Section E","2007","63","9","o3820","o3820","10.1107/S1600536807039232","","","0.71073","MoKα","","0.0426","0.0341","","0.0777","0.0746","0.0777","","","","","","0.9659","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215022","6.1145","0.0007","13.161","0.002","14.696","0.002","90","","94.2","0.01","90","","1179.5","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-Dichlorophenyl benzoate","","- C13 H8 Cl2 O2 -","- C13 H8 Cl2 O2 -","- C52 H32 Cl8 O8 -","4","1","BT2472","B. Thimme Gowda; Sabine Foro; K. S. Babitha; Hartmut Fuess","3,4-Dichlorophenyl benzoate","Acta Crystallographica Section E","2007","63","9","o3801","o3801","10.1107/S1600536807039396","","","1.5418","CuKα","","0.0507","0.0426","","","0.1101","0.116","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215023","9.9695","0.0006","19.6036","0.0012","21.2407","0.0012","116.799","0.003","98.316","0.003","95.098","0.003","3610.2","0.4","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Bis(thiocyanato-κN)bis(triphenylphosphine oxide-κO)zinc(II)","","- C38 H30 N2 O2 P2 S2 Zn -","- C38 H30 N2 O2 P2 S2 Zn -","- C152 H120 N8 O8 P8 S8 Zn4 -","4","2","BT2473","Li, Yinhuai","Bis(thiocyanato-κ<i>N</i>)bis(triphenylphosphine oxide-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2007","63","9","m2359","m2359","10.1107/S1600536807039700","","","0.71073","MoKα","","0.0389","0.032","","","0.0866","0.0905","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215024","29.6874","0.0008","16.7851","0.0005","23.3089","0.0006","90","","110.464","0.0001","90","","10882","0.5","100","","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","10-Acetyl-2,3,6,7-tetrahydro-1H,5H,11H-1-benzopyrano[6,7,8-ij]quinolizin-11-one","","- C17 H17 N O3 -","- C17 H17 N O3 -","- C544 H544 N32 O96 -","32","4","BT2474","Jasinski, Jerry P.; Jasinski, John M.; Crosby, Daniel J.","10-Acetyl-2,3,6,7-tetrahydro-1<i>H</i>,5<i>H</i>,11<i>H</i>-1-benzopyrano[6,7,8-<i>ij</i>]quinolizin-11-one","Acta Crystallographica Section E","2007","63","9","o3848","o3849","10.1107/S1600536807039621","","","0.71073","MoKα","","0.1019","0.0514","","","0.13","0.1626","","","","","","1.081","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215025","9.779","0.0006","16.261","0.001","15.375","0.001","90","","104.625","0.001","90","","2365.7","0.3","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraaquabis(1,3-di-4-pyridylpropane-κN)cobalt(II) bis(4-aminonaphthalene-1-sulfonate)","","- C46 H52 Co N6 O10 S2 -","- C46 H52 Co N6 O10 S2 -","- C92 H104 Co2 N12 O20 S4 -","2","0.5","BT2475","Mi, Li-Wei; Han, Min-Le; Xiao, Wei-Feng; Ng, Seik Weng","Tetraaquabis(1,3-di-4-pyridylpropane-κ<i>N</i>)cobalt(II) bis(4-aminonaphthalene-1-sulfonate)","Acta Crystallographica Section E","2007","63","9","m2353","m2353","10.1107/S1600536807039633","","","0.71073","MoKα","","0.0389","0.0308","","","0.0831","0.0891","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215026","16.0206","0.0002","10.282","0.0001","17.2086","0.0001","90","","95.329","0.001","90","","2822.41","0.05","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Di-μ-iodido-bis[(N-morpholino-2-pyridylmethanimine-κ^2^N,N')copper(I)] acetonitrile solvate","","- C22 H29 Cu2 I2 N7 O2 -","- C22 H29 Cu2 I2 N7 O2 -","- C88 H116 Cu8 I8 N28 O8 -","4","0.5","BT2476","Dehghanpour, Saeed; Rominger, Frank; Ng, Seik Weng","Di-μ-iodido-bis[(<i>N</i>-morpholino-2-pyridylmethanimine-κ^2^<i>N</i>,<i>N</i>')copper(I)] acetonitrile solvate","Acta Crystallographica Section E","2007","63","9","m2377","m2377","10.1107/S1600536807039670","","","0.71073","MoKα","","0.0357","0.0303","","","0.0757","0.0798","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215027","7.2044","0.0001","11.2959","0.0001","13.6932","0.0002","70.872","0.001","76.436","0.001","74.589","0.001","1001.59","0.02","295","2","295","2","","","","","","","","4","P 1","P 1","1","","<i>catena</i>-Poly[hexaaquazinc(II) bis[[triaquazincate(II)]-μ-(5-carboxylato-<i>m</i>-phenylenedioxy)diacetato- κ^2^<i>O</i>^1^:<i>O</i>^5^] heptahydrate]","","- C22 H52 O35 Zn3 -","- C22 H52 O35 Zn3 -","- C22 H52 O35 Zn3 -","1","1","BT2477","Wen, Yi-Hang; Ng, Seik Weng","<i>catena</i>-Poly[hexaaquazinc(II) bis[[triaquazincate(II)]-μ-(5-carboxylato-<i>m</i>-phenylenedioxy)diacetato-κ^2^<i>O</i>^1^:<i>O</i>^5^] heptahydrate]","Acta Crystallographica Section E","2007","63","9","m2378","m2379","10.1107/S1600536807040093","","","0.71073","MoKα","","0.0316","0.03","","","0.0809","0.0821","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215028","8.3857","0.0007","20.1913","0.0014","8.4229","0.0007","90","","103.836","0.002","90","","1384.77","0.19","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[bis[μ-1,4-bis(1,2,4-triazol-1-ylmethyl)benzene]dicyanatonickel(II)]","","- C26 H24 N14 Ni O2 -","- C26 H24 N14 Ni O2 -","- C52 H48 N28 Ni2 O4 -","2","0.5","BT2480","Wen-Bao Wang; Li-Yan Wang; Bao-Long Li; Yong Zhang","Poly[bis[μ-1,4-bis(1,2,4-triazol-1-ylmethyl)benzene]dicyanatonickel(II)]","Acta Crystallographica Section E","2007","63","9","m2416","m2417","10.1107/S1600536807041281","","","0.71073","MoKα","","0.0414","0.0352","","","0.0879","0.0922","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215029","12.2378","0.0006","7.8921","0.0004","14.7367","0.0008","90","","110.98","0.001","90","","1328.94","0.12","125.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Bromo-8-(phenylselenyl)naphthalene","","- C16 H11 Br Se -","- C16 H11 Br Se -","- C64 H44 Br4 Se4 -","4","1","BT2482","Fuller, Amy L.; Knight, Fergus R.; Slawin, Alexandra M. Z.; Woollins, J. Derek","1-Bromo-8-(phenylselenyl)naphthalene","Acta Crystallographica Section E","2007","63","9","o3855","o3855","10.1107/S1600536807040627","","","0.71075","MoKα","","","0.0328","","","","0.0674","","","","","","1.083","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215030","6.113","0.001","7.639","0.001","26.51","0.003","90","","95.42","0.01","90","","1232.4","0.3","299","2","299","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","p-Methylphenyl p-methylbenzoate","4-Methylphenyl 4-methylbenzoate","","- C15 H14 O2 -","- C15 H14 O2 -","- C60 H56 O8 -","4","1","BT2484","B. Thimme Gowda; Sabine Foro; K. S. Babitha; Hartmut Fuess","4-Methylphenyl 4-methylbenzoate","Acta Crystallographica Section E","2007","63","9","o3867","o3867","10.1107/S1600536807040743","","","1.5418","CuKα","","0.0526","0.0446","","","0.1357","0.1438","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215031","11.898","0.005","10.31","0.003","9.212","0.002","90","","111.23","0.03","90","","1053.3","0.6","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,2-Dichloro-<i>N</i>-(3,4-dichlorophenyl)acetamide","","- C8 H5 Cl4 N O -","- C8 H5 Cl4 N O -","- C32 H20 Cl16 N4 O4 -","4","1","BT2485","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","2,2-Dichloro-<i>N</i>-(3,4-dichlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","9","o3875","o3875","10.1107/S1600536807041025","","","1.5418","CuKα","","0.0437","0.0388","","","0.1025","0.106","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215032","10.5","0.002","7.98","0.0009","15.007","0.002","90","","102.55","0.01","90","","1227.4","0.3","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-Dichlorophenyl benzoate","","- C13 H8 Cl2 O2 -","- C13 H8 Cl2 O2 -","- C52 H32 Cl8 O8 -","4","1","BT2486","B. Thimme Gowda; Sabine Foro; K. S. Babitha; Hartmut Fuess","2,6-Dichlorophenyl benzoate","Acta Crystallographica Section E","2007","63","9","o3876","o3876","10.1107/S1600536807041062","","","1.5418","CuKα","","0.0734","0.0491","","","0.1332","0.1507","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215033","10.3126","0.0004","11.2594","0.0005","11.4304","0.0005","72.162","0.001","79.288","0.001","87.233","0.001","1241.35","0.09","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","Desipraminium picrate monohydrate","","- C24 H27 N5 O8 -","- C24 H25 N5 O8 -","- C48 H50 N10 O16 -","2","1","BT2487","Harrison, William T. A.; Swamy, M. T.; Nagaraja, P.; Yathirajan, H. S.; Narayana, B.","Desipraminium picrate monohydrate","Acta Crystallographica Section E","2007","63","9","o3892","o3892","10.1107/S1600536807041219","","","0.71073","MoKα","","0.0835","0.0671","","","0.2018","0.2204","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215034","10.6839","0.0011","8.4014","0.0008","20.285","0.002","90","","98","0.005","90","","1803.1","0.3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,13-Dithia[3.3](1,3)(2,3)naphthalenophane","","- C24 H20 S2 -","- C24 H20 S2 -","- C96 H80 S8 -","4","1","BT2489","Jones, Peter G.; Kuś, Piotr","2,13-Dithia[3.3](1,3)(2,3)naphthalenophane","Acta Crystallographica Section E","2007","63","9","o3920","o3920","10.1107/S1600536807041761","","","0.71073","MoKα","","0.0594","0.0482","","","0.1142","0.1196","","","","","","1.132","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215035","6.2729","0.0005","8.1448","0.0006","14.0994","0.0011","85.52","0.001","77.793","0.001","68.637","0.001","655.7","0.09","297","2","297","2","","","","","","","","6","P -1","-P 1","2","","2-Chloro-5-{[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl}pyridine","","- C13 H9 Cl N4 O S -","- C13 H9 Cl N4 O S -","- C26 H18 Cl2 N8 O2 S2 -","2","1","BX2092","Wei-Dong Wang; Qing-Yun Ren; Jia-Jia Wei; Hong-Wu He","2-Chloro-5-{[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl}pyridine","Acta Crystallographica Section E","2007","63","9","o3721","o3721","10.1107/S1600536807036148","","","0.71073","MoKα","","0.0512","0.0419","","","0.113","0.1305","","","","","","1.126","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215036","9.2244","0.0002","26.1163","0.0005","9.3506","0.0002","90","","103.233","0.001","90","","2192.81","0.08","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6-Methoxy-1'-methyl-4'-phenylchroman-3-spiro-3'-pyrrolidine-2'-spiro-3''(2''H)- indole-2'',4-dione","","- C27 H24 N2 O4 -","- C27 H24 N2 O4 -","- C108 H96 N8 O16 -","4","1","BX2097","Augustine, A. P. T; Charles, C. Kanakam; Suresh, R.; Christurajan, Y.; Ramkumar, V.","6-Methoxy-1'-methyl-4'-phenylchroman-3-spiro-3'-pyrrolidine-2'-spiro-3''(2''<i>H</i>)- indole-2'',4-dione","Acta Crystallographica Section E","2007","63","9","o3794","o3794","10.1107/S1600536807038755","","","0.71073","MoKα","","0.0729","0.0434","","","0.0999","0.1151","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215037","9.7198","0.0009","12.139","0.001","21.499","0.002","90","","90","","90","","2536.6","0.4","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-(3-Methoxyphenyl)-2-phenylethanone oxime","","- C15 H15 N O2 -","- C15 H15 N O2 -","- C120 H120 N8 O16 -","8","1","BX2102","H. N. Pati; B. K. Mishra; S. G. Hiriyanna; H. S. Yathirajan; R. S. Rathore","1-(3-Methoxyphenyl)-2-phenylethanone oxime","Acta Crystallographica Section E","2007","63","9","o3700","o3700","10.1107/S1600536807037361","","","0.71073","MoKα","","0.1188","0.0522","","","0.0958","0.1179","","","","","","1.012","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215039","8.349","0.0017","9.476","0.0019","17.828","0.004","90","","90","","90","","1410.5","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Poly[bis[μ~2~-5-(pyrimidin-2-yl)tetrazolato]zinc(II)]","","- C10 H6 N12 Zn -","- C10 H6 N12 Zn -","- C40 H24 N48 Zn4 -","4","0.5","BX2105","Zhang, Xiu-Ling; Zhang, Cun-Lan; Qiu, Yu-E; An, Ning","Poly[bis[μ~2~-5-(pyrimidin-2-yl)tetrazolato]zinc(II)]","Acta Crystallographica Section E","2007","63","9","m2423","m2423","10.1107/S1600536807041414","","","0.71073","MoKα","","0.0976","0.0588","","","0.0731","0.0807","","","","","","1.19","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215040","10.6492","0.0012","19.1865","0.0018","18.6632","0.0014","90","","91.236","0.004","90","","3812.4","0.6","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,3,9,10-Tetrakis(triisopropylsilylethynyl)- 6,13-bis(trimethylsilylethynyl)pentacene","","- C76 H110 Si6 -","- C76 H110 Si6 -","- C152 H220 Si12 -","2","0.5","CF2122","Jiang, Jinyue; Kaafarani, Bilal R.; Kirschbaum, Kristin; Hu, Ying; Neckers, Douglas C.","Non-merohedral twin crystal of 2,3,9,10-tetrakis(triisopropylsilylethynyl)-6,13-bis(trimethylsilylethynyl)pentacene","Acta Crystallographica Section E","2007","63","9","o3760","o3761","10.1107/S1600536807038664","","","0.71073","MoKα","","0.0701","0.0526","","","0.1356","0.154","","","","","","1.316","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215041","6.595","0.001","9.688","0.001","16.301","0.001","72.72","0.01","89.68","0.01","83.82","0.01","988.3","0.2","293","2","293","2","","","","","","","","4","P 1","P 1","1","","2-N,5'-O-Diacetyl-2',3'-O-isopropylideneguanosine monohydrate","","- C17 H23 N5 O8 -","- C17 H23 N5 O8 -","- C34 H46 N10 O16 -","2","2","CF2128","Meier, Lidiane; Sá, Marcus M.; Bortoluzzi, Adailton J.","2-<i>N</i>,5'-Di-<i>O</i>-acetyl-2',3'-<i>O</i>-isopropylideneguanosine monohydrate","Acta Crystallographica Section E","2007","63","9","o3751","o3752","10.1107/S1600536807038330","","","0.71069","MoKα","","0.0913","0.0501","","","0.13","0.1479","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215042","13.0833","0.0005","6.6401","0.0003","18.6698","0.0007","90","","90.445","0.001","90","","1621.88","0.11","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[hemiaquacopper(II)]-μ-3,9-dimethyl-4,8-diazaundeca-3,8-diene- 2,10-dione dioximato-κ^4^N,N',N'',N'':κO)] perchlorate]","","- C11 H20 Cl Cu N4 O6.5 -","- C11 H20 Cl Cu N4 O6.5 -","- C44 H80 Cl4 Cu4 N16 O26 -","4","1","CF2129","Golchoubian, Hamid; Nazari, Omelila","<i>catena</i>-Poly[[[hemiaquacopper(II)]-μ-(3,9-dimethyl-4,8-diazaundeca-3,8-diene-2,10-dione dioximato)-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>'':κ<i>O</i>] perchlorate]","Acta Crystallographica Section E","2007","63","9","m2324","m2324","10.1107/S160053680703886X","","","0.71073","MoKα","","0.0524","0.0336","","","0.0711","0.0808","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215043","10.5014","0.0003","11.3187","0.0004","11.6458","0.0004","91.07","0.02","98.45","0.02","104.1","0.03","1325.8","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","8-[(<i>E</i>)-4-Methoxybenzylidene]-4-(4-Methoxyphenyl)-3- (3-phenyl-1,2,4-oxadiazol-5-yl)-5,6,7,8-tetrahydro-4<i>H</i>-chromen-2-amine","","- C32 H29 N3 O4 -","- C32 H29 N3 O4 -","- C64 H58 N6 O8 -","2","1","CF2131","N. Srinivasan; M. Subha Nandhini; R. Ranjithkumar; S. Perumal; R. V. Krishnakumar","8-[(<i>E</i>)-4-Methoxybenzylidene]-4-(4-methoxyphenyl)-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-5,6,7,8-tetrahydro-4<i>H</i>-chromen-2-ylamine","Acta Crystallographica Section E","2007","63","9","o3750","o3750","10.1107/S1600536807038093","","","0.71073","MoKα","","0.0829","0.0543","","","0.1505","0.1777","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215044","11.268","0.004","14.141","0.005","22.831","0.012","90","","90","","90","","3638","3","297","2","297","2","","","","","","","","5","I m c b","-I 2a 2","72","","Aqua(N,N-diethylethylenediamine-κ^2^<i>N</i>,<i>N</i>')(pyridine-2,6-\ dicarboxylato-κ^3^N,O,O')nickel(II) 2.5-hydrate","","- C13 H26 N3 Ni O7.5 -","- C13 H22 N3 Ni O7.5 -","- C104 H176 N24 Ni8 O60 -","8","0.5","CI2403","Ibrahim Uçar; Ahmet Bulut; Canan Kazak","Aqua(<i>N</i>,<i>N</i>-diethylethylenediamine-κ^2^<i>N</i>,<i>N</i>')(pyridine-2,6-dicarboxylato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>')nickel(II) 2.5-hydrate","Acta Crystallographica Section E","2007","63","9","m2327","m2328","10.1107/S1600536807038196","","","0.71069","MoKα","","0.0493","0.0461","","","0.1206","0.1229","","","","","","1.175","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2215045","15.1164","0.0014","13.1426","0.0012","19.6898","0.0019","90","","91.204","0.001","90","","3910.9","0.6","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(2,2'-Bipyridine-κ^2^N,N')[3-(2-oxidobenzylideneamino)propanoato- κ^3^O,N,O']copper(II) dihydrate","","- C20 H21 Cu N3 O5 -","- C20 H21 Cu N3 O5 -","- C160 H168 Cu8 N24 O40 -","8","1","CI2408","Xie, Ji-Min; Zhao, Gan-Qing; Shao, Min; Liu, Hua; Lu, Xiao-Jing","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')[3-(2-oxidobenzylideneamino)propanoato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']copper(II) dihydrate","Acta Crystallographica Section E","2007","63","9","m2351","m2352","10.1107/S1600536807034691","","","0.71073","MoKα","","0.0346","0.0285","","","0.0765","0.0801","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215046","12.069","0.002","10.9474","0.0018","13.609","0.002","90","","92.662","0.003","90","","1796.1","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dichlorido[1-(1-naphthylmethyl)-3-(2-pyridyl)-1H-pyrazole- κ^2^N^2^,N^3^]zinc(II)","","- C19 H15 Cl2 N3 Zn -","- C19 H15 Cl2 N3 Zn -","- C76 H60 Cl8 N12 Zn4 -","4","1","CI2416","Chun-Sen Liu; Li-Fen Yan; Jun-Jie Wang","Dichlorido[1-(1-naphthylmethyl)-3-(2-pyridyl)-1<i>H</i>-pyrazole-κ^2^<i>N</i>^2^,<i>N</i>^3^]zinc(II)","Acta Crystallographica Section E","2007","63","9","m2265","m2265","10.1107/S1600536807036756","","","0.71073","MoKα","","0.0674","0.0353","","","0.0789","0.0933","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215047","9.9811","0.0003","14.847","0.0005","12.0093","0.0004","90","","96.036","0.002","90","","1769.78","0.1","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>cis</i>-Bis(acetylacetonato)diaquachromium(III) perchlorate monohydrate","","- C10 H20 Cl Cr O11 -","- C10 H20 Cl Cr O11 -","- C40 H80 Cl4 Cr4 O44 -","4","1","CI2419","Arulsamy, Navamoney; Crawford, Jared L.","<i>cis</i>-Bis(acetylacetonato)diaquachromium(III) perchlorate monohydrate","Acta Crystallographica Section E","2007","63","9","m2307","m2307","10.1107/S1600536807038688","","","0.71073","MoKα","","0.0689","0.0477","","","0.1431","0.1583","","","","","","1.105","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215048","7.5227","0.0003","10.3081","0.0003","12.2764","0.0005","107.167","0.002","94.932","0.002","103.092","0.002","873.89","0.06","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[μ-11,24-dimethyl-16,19-dioxa-3,7,15,20- tetraazatricyclo[20.3.1.1^9,13^]heptacosa- 1(25),2,7,9,11,13(27),14,20,22(26),23-decaene-26,27- diolato]bis[diaquanickel(II)] bis(perchlorate) tetrahydrate","","- C23 H40 Cl2 N4 Ni2 O20 -","- C23 H40 Cl2 N4 Ni2 O20 -","- C23 H40 Cl2 N4 Ni2 O20 -","1","0.5","CI2420","S. Anbu; M. Kandaswamy; Babu Varghese","A binuclear unsymmetrical compartmental Ni^II^ complex: [μ-11,24-dimethyl-16,19-dioxa-3,7,15,20-tetraazatricyclo[20.3.1.1^9,13^]heptacosa-1(25),2,7,9,11,13(27),14,20,22(26),23-decaene-26,27-diolato]bis[diaquanickel(II)] bis(perchlorate) tetrahydrate","Acta Crystallographica Section E","2007","63","9","m2330","m2331","10.1107/S1600536807039001","","","0.71073","MoKα","","0.0452","0.0342","","","0.1049","0.1129","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215049","7.8866","0.0013","9.5474","0.0016","10.2881","0.0016","90","","97.28","0.002","90","","768.4","0.2","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","<i>N</i>-(2-Bromo-1-phenylethyl)-4-methylbenzenesulfonamide","","- C15 H16 Br N O2 S -","- C15 H16 Br N O2 S -","- C30 H32 Br2 N2 O4 S2 -","2","0.5","CI2421","Yue Meng; Guang-Xiang Zhong; Wei-Xiao Hu","<i>N</i>-(2-Bromo-1-phenylethyl)-4-methylbenzenesulfonamide","Acta Crystallographica Section E","2007","63","9","o3744","o3744","10.1107/S1600536807038445","","","0.71073","MoKα","","0.0688","0.0374","","","0.0849","0.0975","","","","","","0.986","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215050","12.272","0.003","12.537","0.003","14.361","0.003","90.847","0.003","91.539","0.003","93.809","0.003","2203.5","0.9","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","1-Benzyl-3-(8-methoxyquinolin-2-ylmethyl)imidazolium hexafluoridophosphate","","- C21 H20 F6 N3 O P -","- C21 H20 F6 N3 O P -","- C84 H80 F24 N12 O4 P4 -","4","2","CI2422","Xiao-Na Fan; Guo-Lun XiaHou; Zhi-Qin Huang; Ye-Chun Ding","1-Benzyl-3-(8-methoxyquinolin-2-ylmethyl)imidazolium hexafluoridophosphate","Acta Crystallographica Section E","2007","63","9","o3785","o3785","10.1107/S1600536807038767","","","0.71073","MoKα","","0.1175","0.0653","","","0.1864","0.2153","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215051","5.9505","0.0017","20.478","0.006","8.475","0.002","90","","90","","90","","1032.7","0.5","295","2","295","2","","","","","","","","5","C m c 21","C 2c -2","36","","(1,3-Propanediamine-κ^2^<i>N</i>,<i>N</i>')bis(thiocyanato-κ<i>N</i>)\ copper(II)","","- C5 H10 Cu N4 S2 -","- C5 H10 Cu N4 S2 -","- C20 H40 Cu4 N16 S8 -","4","0.5","CI2424","Zhong-Lu You; Seik Weng Ng","(1,3-Propanediamine-κ^2^<i>N</i>,<i>N</i>')bis(thiocyanato-κ<i>N</i>)copper(II)","Acta Crystallographica Section E","2007","63","9","m2347","m2347","10.1107/S1600536807039645","","","0.71073","MoKα","","0.0236","0.0231","","","0.0653","0.0657","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215052","5.973","0.00001","15.0731","0.0005","14.6768","0.0004","90","","95.785","0.002","90","","1314.65","0.06","203","","203","","","","","","","","","4","P 1 c 1","P -2yc","7","","(2E)-1-(4-Methylphenyl)-3-(4-nitrophenyl)prop-2-en-1-one","","- C16 H13 N O3 -","- C16 H13 N O3 -","- C64 H52 N4 O12 -","4","2","CI2427","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Veena, K.; Narayana, B.","(2<i>E</i>)-1-(4-Methylphenyl)-3-(4-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","9","o3680","o3680","10.1107/S1600536807037063","","","0.71073","MoKα","","0.1071","0.0551","","","0.1245","0.1619","","","","","","1.245","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215053","11.446","0.002","11.1475","0.0019","10.5155","0.0018","90","","103.108","0.002","90","","1306.8","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[2-Imino-4-methyl-3-(4-nitrophenyl)-2,3-dihydrothiazol-5-yl]ethanone","","- C12 H11 N3 O3 S -","- C12 H11 N3 O3 S -","- C48 H44 N12 O12 S4 -","4","1","CI2428","Yan-Fang Lin; Guang-Xiang Zhong; Feng Xu; Wei-Xiao Hu","1-[2-Imino-4-methyl-3-(4-nitrophenyl)-2,3-dihydrothiazol-5-yl]ethanone","Acta Crystallographica Section E","2007","63","9","o3699","o3699","10.1107/S1600536807037543","","","0.71073","MoKα","","0.0538","0.038","","","0.1005","0.1098","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215054","12.4177","0.0014","12.4177","0.0014","33.389","0.006","90","","90","","90","","5148.6","1.2","292","2","292","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Bis[2-(1H-benzimidazol-2-yl-κN^3^)-4,6-dibromophenolato-κO]nickel(II)","","- C26 H14 Br4 N4 Ni O2 -","- C26 H14 Br4 N4 Ni O2 -","- C208 H112 Br32 N32 Ni8 O16 -","8","0.5","CI2430","Yu Wu; Bin Xie; Like Zou; Jian-Shen Feng; Zongqiu Hu","Bis[2-(1<i>H</i>-benzimidazol-2-yl-κ<i>N</i>^3^)-4,6-dibromophenolato-κ<i>O</i>]nickel(II)","Acta Crystallographica Section E","2007","63","9","m2298","m2298","10.1107/S1600536807038214","","","0.71073","MoKα","","0.1348","0.0652","","","0.1552","0.1798","","","","","","0.953","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215055","8.1049","0.0009","14.084","0.002","12.1998","0.0017","90","","108.264","0.002","90","","1322.4","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-5-(2-hydroxy-3-methoxybenzylideneamino)benzoic acid","","- C15 H13 N O5 -","- C15 H13 N O5 -","- C60 H52 N4 O20 -","4","1","CI2431","Rui-Ting Xue; Mei-Ju Niu","2-Hydroxy-5-(2-hydroxy-3-methoxybenzylideneamino)benzoic acid","Acta Crystallographica Section E","2007","63","9","o3812","o3812","10.1107/S1600536807036768","","","0.71073","MoKα","","0.1551","0.0558","","","0.1184","0.17","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215056","9.1387","0.0001","9.7188","0.0001","11.7006","0.0002","90.796","0.001","108.274","0.001","100.432","0.001","967.71","0.02","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","<i>N</i>-methylataphyllinine","6,11-dihydroxy-3,3,12-trimethyl-5-(3-methylbut-2-enyl)-3,12-dihydro- 7<i>H</i>-pyrano[2,3-c]acridin-7-one","","- C24 H25 N O4 -","- C24 H25 N O4 -","- C48 H50 N2 O8 -","2","1","CI2432","Arnon Chukaew; Hoong-Kun Fun; Suchada Chantrapromma; Chanita Ponglimanont","<i>N</i>-Methylataphyllinine","Acta Crystallographica Section E","2007","63","9","o3723","o3724","10.1107/S1600536807038238","","","0.71073","MoKα","","0.0615","0.0448","","","0.1154","0.1288","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215057","20.4841","0.0006","7.1692","0.0002","13.9008","0.0004","90","","90","","90","","2041.4","0.1","90","2","90","2","","","","","","","","6","C m c a","-C 2ac 2","64","(hfac)2Ni(MeCN)2","<i>trans</i>-Bis(acetonitrile-κN)bis(1,1,1,5,5,5-hexafluoropentane-2,4-\ dionato-κ^2^O,O')nickel(II)","","- C14 H8 F12 N2 Ni O4 -","- C14 H8 F12 N2 Ni O4 -","- C56 H32 F48 N8 Ni4 O16 -","4","","CI2433","Southerland, Heather; Donovan, Jeff; Twamley, Brendan; Manson, Jamie","<i>trans</i>-Bis(acetonitrile-κ<i>N</i>)bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')nickel(II)","Acta Crystallographica Section E","2007","63","9","m2308","m2308","10.1107/S1600536807038226","","","0.71073","MoKα","","0.028","0.0259","","","0.0666","0.0685","","","","","","1.077","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215058","8.2703","0.0009","13.1939","0.0014","23.363","0.003","90","","90","","90","","2549.3","0.5","100","0.1","100","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Dicyclohexano-18-crown-6 hydroxonium tribromide","","- C20 H39 Br3 O7 -","- C20 H39 Br3 O7 -","- C80 H156 Br12 O28 -","4","1","CI2434","Muhammad Idiris Saleh; Eny Kusrini; Hoong-Kun Fun; Jeannie Bee-Jan Teh","Dicyclohexano-18-crown-6 hydroxonium tribromide","Acta Crystallographica Section E","2007","63","9","o3790","o3791","10.1107/S1600536807039244","","","0.71073","MoKα","","0.0815","0.0428","","","0.0945","0.1223","","","","","","1.093","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215059","5.9729","0.0002","13.558","0.0004","19.8855","0.0006","90","","107.438","0.001","90","","1536.33","0.08","100","0.1","100","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5,6-Diphenyl-3-(2-pyridyl)-1,2,4-triazine","","- C20 H14 N4 -","- C20 H14 N4 -","- C80 H56 N16 -","4","1","CI2435","Naser Eltaher Eltayeb; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun; Kamarulazizi Ibrahim","A second monoclinic polymorph of 5,6-diphenyl-3-(2-pyridyl)-1,2,4-triazine","Acta Crystallographica Section E","2007","63","9","o3792","o3793","10.1107/S1600536807039463","","","0.71073","MoKα","","0.0489","0.0445","","","0.1136","0.1172","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215060","17.907","0.002","10.1825","0.0012","7.5055","0.0008","90","","92.166","0.006","90","","1367.6","0.3","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 7-(4-bromophenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-<i>a</i>]pyrimidine- 6-carboxylate","","- C13 H12 Br N5 O2 -","- C13 H12 Br N5 O2 -","- C52 H48 Br4 N20 O8 -","4","1","CI2436","Chang-Sheng Yao; Chen-Xia Yu; Lei Song; Shu-Jiang Tu","Methyl 7-(4-bromophenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-<i>a</i>]pyrimidine-6-carboxylate","Acta Crystallographica Section E","2007","63","9","o3808","o3808","10.1107/S160053680703824X","","","0.7107","MoKα","","0.0452","0.035","","","0.0798","0.0832","","","","","","0.992","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215061","8.9624","0.0012","12.5413","0.0016","15.881","0.002","90","","90","","90","","1785","0.4","123","2","123","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-Hydroxy-3,5-dimethoxybenzonitrile","","- C9 H9 N O3 -","- C9 H9 N O3 -","- C72 H72 N8 O24 -","8","1","CI2440","Xiang-Wei Cheng","4-Hydroxy-3,5-dimethoxybenzonitrile at 125K","Acta Crystallographica Section E","2007","63","9","o3797","o3797","10.1107/S1600536807039256","","","0.71073","MoKα","","0.0592","0.0406","","","0.102","0.1128","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215062","12.983","0.003","11.448","0.002","7.6035","0.0015","90","","90","","90","","1130.1","0.4","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Poly[bis(μ~2~-5-thioxo-1H-1,2,4-thiadiazole-3-thiolato-κ^2^S^3^:S^5^)zinc(II)]","","- C4 H2 N4 S6 Zn -","- C4 H2 N4 S6 Zn -","- C16 H8 N16 S24 Zn4 -","4","0.5","CI2441","Zhang, Xiu-Ling; An, Ning; Qiu, Yu-E.; Zhang, Cun-Lan; Wang, Yi-Chun","Poly[bis(μ~2~-5-thioxo-1<i>H</i>-1,2,4-thiadiazole-3-thiolato-κ^2^<i>S</i>^3^:<i>S</i>^5^)zinc(II)]","Acta Crystallographica Section E","2007","63","9","m2432","m2433","10.1107/S1600536807041797","","","0.71073","MoKα","","0.0211","0.0189","","","0.0459","0.0468","","","","","","1.075","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215063","11.479","0.005","11.279","0.005","9.934","0.004","90","","93.745","0.008","90","","1283.4","1","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-4-Hydroxy-<i>N</i>'-(2-thienylmethylene)benzohydrazide","","- C13 H12 N2 O2 S -","- C13 H12 N2 O2 S -","- C52 H48 N8 O8 S4 -","4","1","CI2442","Jing, Zuo-Liang; Yu, Ming; Chen, Xin","(<i>E</i>)-4-Hydroxy-<i>N</i>'-(2-thienylmethylene)benzohydrazide","Acta Crystallographica Section E","2007","63","9","o3843","o3843","10.1107/S1600536807040159","","","0.71073","MoKα","","0.0664","0.0401","","","0.0942","0.1077","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215064","10.115","0.0015","4.7969","0.0007","20.033","0.003","90","","90","","90","","972","0.2","294","2","294","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","(<i>E</i>)-<i>N</i>'-(3-Thienylmethylene)furan-2-carbohydrazide","","- C10 H8 N2 O2 S -","- C10 H8 N2 O2 S -","- C40 H32 N8 O8 S4 -","4","1","CI2444","Jing, Zuo-Liang; Yu, Ming; Chen, Xin","(<i>E</i>)-<i>N</i>'-(3-Thienylmethylene)furan-2-carbohydrazide","Acta Crystallographica Section E","2007","63","9","o3899","o3899","10.1107/S1600536807041293","","","0.71073","MoKα","","0.0251","0.023","","","0.0624","0.0646","","","","","","1.113","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215065","24.427","0.008","9.463","0.003","15.644","0.005","90","","98.253","0.006","90","","3579","2","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","9,9'-Biacridine","","- C26 H16 N2 -","- C26 H16 N2 -","- C208 H128 N16 -","8","1","CI2445","Chun-Sen Liu","9,9'-Biacridine","Acta Crystallographica Section E","2007","63","9","o3904","o3904","10.1107/S1600536807041463","","","0.71073","MoKα","","0.1763","0.0597","","","0.0842","0.1126","","","","","","0.96","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215066","11.402","0.002","7.9941","0.0016","24.039","0.005","90","","90","","90","","2191.1","0.7","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(<i>E</i>)-<i>N</i>'-[(5-Methylfuran-2-yl)methylene]furan-2-carbohydrazide","","- C11 H10 N2 O3 -","- C11 H10 N2 O3 -","- C88 H80 N16 O24 -","8","1","CI2448","Yao, Xiao-Ling; Jing, Zuo-Liang","(<i>E</i>)-<i>N</i>'-[(5-Methylfuran-2-yl)methylene]furan-2-carbohydrazide","Acta Crystallographica Section E","2007","63","9","o3900","o3900","10.1107/S1600536807041323","","","0.71073","MoKα","","0.0601","0.0506","","","0.1202","0.1264","","","","","","1.116","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215067","7.7063","0.0002","12.1886","0.0003","20.4444","0.0005","90","","96.217","0.003","90","","1909.03","0.08","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(1-benzofuro[3,2-c]pyridine-κN)dichloridocobalt(II)","","- C22 H14 Cl2 Co N2 O2 -","- C22 H14 Cl2 Co N2 O2 -","- C88 H56 Cl8 Co4 N8 O8 -","4","0.5","CI2450","Vrábel, Viktor; Švorc, Ľubomír; Juristová, Nadežda; Miklovič, Jozef; Kožíšek, Jozef","Bis(1-benzofuro[3,2-<i>c</i>]pyridine-κ<i>N</i>)dichloridocobalt(II)","Acta Crystallographica Section E","2007","63","9","m2427","m2428","10.1107/S160053680704161X","","","0.71073","MoKα","","0.0602","0.0532","","","0.1923","0.1963","","","","","","1.069","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215068","6.8348","0.0009","8.0756","0.0011","12.077","0.0017","90.994","0.002","98.153","0.002","95.63","0.003","656.34","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-[3-(Trifluoromethyl)phenyl]perhydro-1,2,4-triazolo[1,2-a]pyridazine-1,3-dione","","- C13 H12 F3 N3 O2 -","- C13 H12 F3 N3 O2 -","- C26 H24 F6 N6 O4 -","2","1","CS2041","Zu-Guang Sun; Xiao-Qing Li; Wei Xu; Xiao-Hua Du","2-[3-(Trifluoromethyl)phenyl]perhydro-1,2,4-triazolo[1,2-<i>a</i>]pyridazine-1,3-dione","Acta Crystallographica Section E","2007","63","9","o3840","o3840","10.1107/S1600536807039748","","","0.71073","MoKα","","0.0646","0.0557","","","0.1402","0.1476","","","","","","0.968","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215069","5.3031","0.0006","21.159","0.002","13.2837","0.0014","90","","90.027","0.015","90","","1490.5","0.3","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(3-Methoxyphenyl)-3-(4-methylbenzoyl)thiourea","","- C16 H16 N2 O2 S -","- C16 H16 N2 O2 S -","- C64 H64 N8 O8 S4 -","4","1","CS2042","Saeed, Aamer; Flörke, Ulrich","1-(3-Methoxyphenyl)-3-(4-methylbenzoyl)thiourea","Acta Crystallographica Section E","2007","63","9","o3695","o3695","10.1107/S1600536807037531","","","0.71073","MoKα","","0.0995","0.045","","","0.103","0.1149","","","","","","0.879","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2215070","6.047","0.0002","15.7158","0.0007","29.6845","0.0012","90","","90","","90","","2821.02","0.19","180","2","180","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1S,3R,6S)-3-Chloro-trans-himachalene","","- C15 H25 Cl -","- C15 H25 Cl -","- C120 H200 Cl8 -","8","2","CS2043","Benharref, Ahmed; Mazoir, Noureddine; Moha, Berraho; Essediya, Lassaba; Daran, Jean-Claude","(1<i>S</i>,3<i>R</i>,6<i>S</i>)-3-Chloro-<i>trans</i>-himachalene","Acta Crystallographica Section E","2007","63","9","o3681","o3681","10.1107/S1600536807037403","","","0.71073","MoKα","","0.0905","0.0439","","","0.0964","0.1322","","","","","","1.006","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215071","11.5045","0.0011","12.3189","0.0011","12.5197","0.0012","95.568","0.002","91.851","0.002","96.973","0.002","1751.1","0.3","273","2","291","2","","","","","","","","6","P -1","-P 1","2","","2-(2-Hydroxy-1-naphthyldiazenyl)pyridinium [1-(2-pyridyldiazenyl)-2-naphtholato-κ^3^N,N',O]tris(thiocyanato- κ<i>N</i>)chromium(III) methanol solvate","","- C34 H26 Cr N9 O3 S3 -","- C34 H26 Cr N9 O3 S3 -","- C68 H52 Cr2 N18 O6 S6 -","2","1","CS2044","Liu, Tian-Fu; Lv, Hong-Yan; Zhao, Bang-Tun; Wang, Jian-Ge","2-(2-Hydroxy-1-naphthyldiazenyl)pyridinium [1-(2-pyridyldiazenyl)-2-naphtholato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]tris(thiocyanato-κ<i>N</i>)chromium(III) methanol solvate","Acta Crystallographica Section E","2007","63","9","m2406","m2406","10.1107/S1600536807040688","","","0.71073","MoKα","","0.1813","0.0671","","","0.1502","0.2089","","","","","","0.957","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215072","8.493","0.002","11.26","0.003","13.19","0.004","112.525","0.003","103.682","0.004","97.378","0.004","1097.9","0.5","93","2","273","2","","","","","","","","6","P -1","-P 1","2","","Bis(1,10-phenanthroline-5,6-dione-κ^2^N,N')silver(I) perchlorate","","- C24 H12 Ag Cl N4 O8 -","- C24 H12 Ag Cl N4 O8 -","- C48 H24 Ag2 Cl2 N8 O16 -","2","1","CS2045","Onuegbu, Jonathan; Butcher, Ray J.; Hosten, Charles; Udeochu, Uche Charles; Bakare, Oladapo","Bis(1,10-phenanthroline-5,6-dione-κ^2^<i>N</i>,<i>N</i>')silver(I) perchlorate","Acta Crystallographica Section E","2007","63","9","m2309","m2310","10.1107/S1600536807037580","","","0.71073","MoKα","","0.0809","0.0657","","","0.1715","0.1838","","","","","","1.073","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215073","13.4321","0.0007","9.4977","0.0007","9.8629","0.001","90","","94.435","0.001","90","","1254.48","0.17","293","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-amino-4-isobutylthiophene-3-carboxylate","","- C11 H17 N O2 S -","- C11 H17 N O2 S -","- C44 H68 N4 O8 S4 -","4","1","CS2046","Quan-Bin Liao; Jie Huang; Zhen-Zhen Yang; Ming-Guo Liu","Ethyl 2-amino-4-isobutylthiophene-3-carboxylate","Acta Crystallographica Section E","2007","63","9","o3824","o3824","10.1107/S160053680703975X","","","0.71073","MoKα","","0.0892","0.0696","","","0.161","0.1717","","","","","","1.162","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215074","5.9962","0.0006","11.2616","0.0011","14.0125","0.0011","71.243","0.002","84.181","0.002","83.948","0.002","888.68","0.14","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","5-Amino-1-[2-(4-chlorophenyl)-3-methylbutanoyl]-3-(methylsulfanyl)- 1H-pyrazole-4-carbonitrile","","- C16 H17 Cl N4 O S -","- C16 H17 Cl N4 O S -","- C32 H34 Cl2 N8 O2 S2 -","2","1","CV2274","Bao-Han Zhou","5-Amino-1-[2-(4-chlorophenyl)-3-methylbutanoyl]-3-(methylsulfanyl)-1<i>H</i>-pyrazole-4-carbonitrile","Acta Crystallographica Section E","2007","63","9","o3838","o3838","10.1107/S1600536807034101","","","0.71073","MoKα","","0.0981","0.059","","","0.1402","0.1588","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215075","13.7633","0.0016","14.454","0.0017","7.702","0.0009","90","","90","","90","","1532.2","0.3","298","2","298","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","5-Bromothiophene-2-sulfonic acid","","- C4 H3 Br O3 S2 -","- C4 H3 Br O3 S2 -","- C32 H24 Br8 O24 S16 -","8","1","CV2285","Jian-Ping Liu; Yu-Bin Zheng","5-Bromothiophene-2-sulfonic acid","Acta Crystallographica Section E","2007","63","9","o3697","o3697","10.1107/S1600536807037208","","","0.71073","MoKα","","0.0554","0.0502","","","0.1288","0.1337","","","","","","1.081","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215076","9.763","0.003","9.278","0.003","20.586","0.005","90","","90","","90","","1864.7","0.9","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-(4-Nitrophenyl)propionamide","","- C9 H10 N2 O3 -","- C9 H10 N2 O3 -","- C72 H80 N16 O24 -","8","1","CV2289","Zhang, Hou-Ying; Guo, Ming-Lin; Guo, Chen-Hu; Ye, Ya-Nan","<i>N</i>-(4-Nitrophenyl)propionamide","Acta Crystallographica Section E","2007","63","9","o3903","o3903","10.1107/S1600536807041372","","","0.71073","MoKα","","0.09","0.0504","","","0.1232","0.1466","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215077","8.7936","0.0017","8.8609","0.0018","16.058","0.002","90","","90","","90","","1251.2","0.4","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-Amino-3,5-bis(1-hydroxyethyl)-4H-1,2,4-triazole","","- C4 H8 N4 O2 -","- C4 H8 N4 O2 -","- C32 H64 N32 O16 -","8","1","CV2290","Kao-Zhen Li; Qing-Peng He; Rong-Shan Li; Da-Qi Wang; Ze-Hua Lu","4-Amino-3,5-bis(1-hydroxyethyl)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2007","63","9","o3908","o3908","10.1107/S160053680704158X","","","0.71073","MoKα","","0.0537","0.0389","","","0.0897","0.106","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215078","15.5498","0.0006","6.97","0.0001","17.4872","0.0007","90","","92.488","0.002","90","","1893.51","0.11","293","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","14b-Chloro-4a-methoxy-3,3-dimethyl-2,3,4a,14b-tetrahydro-1H- benzo[a]pyrano[2,3-c]phenazine","","- C22 H21 Cl N2 O2 -","- C22 H21 Cl N2 O2 -","- C88 H84 Cl4 N8 O8 -","4","1","DN2211","Nunes, I. K. da C.; De Simone, C. A.; Silva, R. S. F.; Pinto, A. V.; Goulart, M. O. F.","14b-Chloro-4a-methoxy-3,3-dimethyl-2,3,4a,14b-tetrahydro-1<i>H</i>-benzo[<i>a</i>]pyrano[2,3-<i>c</i>]phenazine: a new active structural type against <i>Mycobacterium tuberculosis</i>","Acta Crystallographica Section E","2007","63","9","o3686","o3687","10.1107/S1600536807033259","","","0.71073","MoKα","","0.0674","0.0472","","","0.1085","0.1209","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215079","10.2676","0.0008","9.733","0.0008","10.8624","0.0009","90","","90","","90","","1085.53","0.15","295","2","295","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Poly[sodium [μ~4~-2-hydroxyphosphonoacetato(3-)]iron(II)]","","- C2 H2 Fe Na O6 P -","- C2 H2 Fe Na O6 P -","- C16 H16 Fe8 Na8 O48 P8 -","8","1","DN2221","Jing Li; Yan-Yu Zhu; Cui-Ying Huang; Zhen-Gang Sun; Da-Peng Dong","Poly[sodium [μ~4~-2-hydroxyphosphonoacetato(3{-})]iron(II)]","Acta Crystallographica Section E","2007","63","9","m2350","m2350","10.1107/S1600536807036598","","","0.71073","MoKα","","0.0242","0.0215","","","0.0548","0.0559","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215080","8.7832","0.0015","9.1136","0.0016","17.173","0.003","90","","101.686","0.002","90","","1346.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>catena</i>-poly[[nitrato(1,10-phenanthroline)copper(II)]-μ-nitrato]","","- C12 H8 Cu N4 O6 -","- C12 H8 Cu N4 O6 -","- C48 H32 Cu4 N16 O24 -","4","1","DN2223","Zhou, Xiao-Chun; Liu, Yin-Qiu","Redetermination of <i>catena</i>-poly[[nitrato(1,10-phenanthroline)copper(II)]-μ-nitrato]","Acta Crystallographica Section E","2007","63","9","m2268","m2268","10.1107/S1600536807037154","","","0.71073","MoKα","","0.0283","0.0235","","","0.0623","0.0639","","","","","","1.059","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215081","5.417","0.0009","13.02","0.002","15.648","0.003","90","","92.915","0.002","90","","1102.2","0.3","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[μ-1-(4-pyridylmethyl)-1H-imidazole]disilver(I) dinitrate","","- C18 H18 Ag2 N8 O6 -","- C18 H18 Ag2 N8 O6 -","- C36 H36 Ag4 N16 O12 -","2","0.5","ER2033","Jun-Ping Xiao; Qing-Xiang Zhou; Jia-Hongwen Tu","Bis[μ-1-(4-pyridylmethyl)-1<i>H</i>-imidazole]disilver(I) dinitrate","Acta Crystallographica Section E","2007","63","9","m2371","m2371","10.1107/S1600536807040032","","","0.71073","MoKα","","0.0333","0.0293","","","0.0803","0.0839","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215082","9.907","0.003","9.712","0.002","18.01","0.005","90","","95.436","0.005","90","","1725.1","0.8","123","2","123","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,3,4,6,7,9-Hexabromo-2,3,4,5,6,7,8,9-octahydro-1H-trindene","","- C15 H12 Br6 -","- C15 H12 Br6 -","- C60 H48 Br24 -","4","1","ER2037","Zhou, Sheng-Jun; Xie, Su-Yuan; Huang, Rong-Bin; Zheng, Lan-Sun","1,3,4,6,7,9-Hexabromo-2,3,4,5,6,7,8,9-octahydro-1<i>H</i>-trindene","Acta Crystallographica Section E","2007","63","9","o3819","o3819","10.1107/S1600536807039578","","","0.71073","MoKα","","0.0542","0.0461","","","0.1091","0.1142","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215083","13.2369","0.0014","10.2666","0.0011","13.8635","0.0015","90","","96.434","0.002","90","","1872.2","0.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Aqua[N,N'-bis(5-bromosalicylidene)propylene-1,3-diiminato]chlorido manganese(III)]","Aquachlorido{4,4'-dibromo-2,2'-[propane-1,3- diylbis(nitrilomethylidyne)]diphenolato}manganese(III)","","- C17 H16 Br2 Cl Mn N2 O3 -","- C17 H16 Br2 Cl Mn N2 O3 -","- C68 H64 Br8 Cl4 Mn4 N8 O12 -","4","1","ER2038","Hwang, In-Chul; Ha, Kwang","Aquachlorido{4,4'-dibromo-2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato}manganese(III)","Acta Crystallographica Section E","2007","63","9","m2365","m2365","10.1107/S1600536807039815","","","0.71073","MoKα","","0.0573","0.0341","","","0.0586","0.0623","","","","","","0.84","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215084","9.843","0.004","9.843","","33.073","0.005","90","","90","","120","","2775","1.2","100","2","100","2","","","","","","","","6","R -3 :H","-R 3","148","","Poly[μ~2~-chlorido-nonamethyl-μ~3~-nitrato-tritin(IV)]","","- C9 H27 Cl N O3 Sn3 -","- C9 H27 Cl N O3 Sn3 -","- C54 H162 Cl6 N6 O18 Sn18 -","6","0.333333","EZ2088","Sadiq-ur-Rehman; Sherzaman, Saira; Ali, Saqib; Shahzadi, Saira; Helliwell, Madeleine","Poly[μ~2~-chlorido-nonamethyl-μ~3~-nitrato-tritin(IV)]","Acta Crystallographica Section E","2007","63","9","m2329","m2329","10.1107/S1600536807038792","","","0.71069","MoKα","","0.0508","0.0495","","","0.1302","0.131","","","","","","1.166","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215085","6.7364","0.0007","11.1705","0.0012","31.738","0.003","90","","95.568","0.002","90","","2377","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Strontium 4-nitrobenzoate nonahydrate","Heptaaqua(4-nitrobenzoato-κ^2^O,O')strontium(II) 4-nitrobenzoate dihydrate","","- C14 H26 N2 O17 Sr -","- C14 H26 N2 O17 Sr -","- C56 H104 N8 O68 Sr4 -","4","1","EZ2092","Srinivasan, Bikshandarkoil R.; Raghavaiah, Pallepogu; Sawant, Jyoti V.","Heptaaqua(4-nitrobenzoato-κ^2^<i>O</i>,<i>O</i>')strontium(II) 4-nitrobenzoate dihydrate","Acta Crystallographica Section E","2007","63","9","m2251","m2252","10.1107/S1600536807036872","","","0.71073","MoKα","","0.0403","0.0286","","","0.063","0.067","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215086","3.9704","0.0005","14.3246","0.0013","14.4926","0.0014","90","","90.201","0.009","90","","824.25","0.15","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(2,6-dichlorobenzyl)ethylenediimine","","- C16 H12 Cl4 N2 -","- C16 H12 Cl4 N2 -","- C32 H24 Cl8 N4 -","2","0.5","EZ2093","Abbasi, Alireza; Badiei, Alireza; Khaniani, Yeganeh; Golchoubian, Hamid; Eriksson, Lars","<i>N</i>,<i>N</i>'-Bis(2,6-dichlorobenzyl)ethylenediimine","Acta Crystallographica Section E","2007","63","9","o3773","o3773","10.1107/S1600536807039074","","","0.71073","MoKα","","0.1202","0.054","","","0.1178","0.1274","","","","","","0.802","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215087","8.9243","0.0009","9.9867","0.0009","10.4339","0.001","90","","99.667","0.002","90","","916.71","0.15","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>catena</i>-Poly[[dichloridocopper(II)]-μ-1,4-bis(pyrimidin-2-\ ylsulfanylmethyl)benzene-κ^2^<i>N</i>:<i>N</i>']","","- C16 H14 Cl2 Cu N4 S2 -","- C16 H14 Cl2 Cu N4 S2 -","- C32 H28 Cl4 Cu2 N8 S4 -","2","0.5","EZ2094","Peng, Rong; Lin, Shi-Hong; Yang, Ying-Yi","<i>catena</i>-Poly[[dichloridocopper(II)]-μ-1,4-bis(pyrimidin-2-ylsulfanylmethyl)benzene-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","9","m2385","m2385","10.1107/S1600536807039967","","","0.71073","MoKα","","0.064","0.0468","","","0.1034","0.1107","","","","","","1.014","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215088","6.6253","0.0009","8.8218","0.0009","11.7625","0.0015","106.662","0.008","95.398","0.01","96.066","0.009","649.32","0.14","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2,5-Bis(methoxymethyl)-1,4-dioctyloxybenzene","","- C26 H46 O4 -","- C26 H46 O4 -","- C26 H46 O4 -","1","0.5","FB2057","Zhang, Hai-Guang; Yang, Qin-Zheng; Yu, Wen-Tao; Tao, Xu-Tang; Jiang, Min-Hua","2,5-Bis(methoxymethyl)-1,4-dioctyloxybenzene","Acta Crystallographica Section E","2007","63","9","o3778","o3778","10.1107/S1600536807039219","","","0.71073","MoKα","","0.1597","0.0738","","","0.1672","0.2041","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215089","7.231","0.005","4.964","0.004","8.489","0.006","90","","90","","90","","304.7","0.4","293","2","293","2","","","","","","","Synthetic","4","P n m a","-P 2ac 2n","62","","poly[μ-hydroxido-μ-carbonato-neodymium]","Gysinite-(Nd)","- C H Nd O4 -","- C H Nd O4 -","- C4 H4 Nd4 O16 -","4","0.5","FI2039","Wun-Jun Feng; Guang-Peng Zhou; Zhao-Bin Liu; Yan Xu","Nd(CO~3~)(OH) from single-crystal data","Acta Crystallographica Section E","2007","63","9","i174","i174","10.1107/S160053680703721X","","","0.71073","MoKα","","0.0212","0.0195","","","0.0491","0.0499","","","","","","1.074","","","","has coordinates,has Fobs","282548","2023-04-10","20:38:56",""
"2215090","22.324","0.0019","5.7263","0.0005","16.5526","0.0014","90","","109.069","0.002","90","","1999.9","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-Methylphenylsulfonamido)acetic acid","","- C9 H11 N O4 S -","- C9 H11 N O4 S -","- C72 H88 N8 O32 S8 -","8","2","FL2149","Dao-Fa He; Xin-Jü Ma; Lin Lin Ma; Shan Shu; Zhi-Min Jin","2-(4-Methylphenylsulfonamido)acetic acid","Acta Crystallographica Section E","2007","63","9","o3719","o3719","10.1107/S1600536807037749","","","0.71073","MoKα","","0.0741","0.0565","","","0.1052","0.1135","","","","","","1.286","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215091","6.059","0.001","17.956","0.003","18.982","0.003","90","","90","","90","","2065.2","0.6","90","0.2","90","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3aR,7aR)-Bis(4-nitrophenyl) 2-oxoperhydrobenzo[d]imidazole-1,3-dicarboxylate","","- C21 H18 N4 O9 -","- C21 H18 N4 O9 -","- C84 H72 N16 O36 -","4","1","FL2150","Xu, Yun-Hua; Siegler, Maxime; Long, Sihui","(3a<i>R</i>,7a<i>R</i>)-Bis(4-nitrophenyl) 2-oxoperhydrobenzo[<i>d</i>]imidazole-1,3-dicarboxylate","Acta Crystallographica Section E","2007","63","9","o3835","o3835","10.1107/S1600536807039785","","","0.71073","MoKα","","0.059","0.0416","","","0.0943","0.1026","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215092","11.9016","0.0012","11.9344","0.0012","7.8351","0.0007","90","","90","","90","","1112.89","0.19","150","2","150","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","9-Oxo-4,5-diazoniafluorene sulfate","","- C11 H8 N2 O5 S -","- C11 H8 N2 O5 S -","- C44 H32 N8 O20 S4 -","4","0.5","FL2152","Rillema, D. Paul; Kirgan, Robert; Moore, Curtis","9-Oxo-4,5-diazoniafluorene sulfate","Acta Crystallographica Section E","2007","63","9","o3740","o3740","10.1107/S1600536807038457","","","0.71073","MoKα","","0.086","0.0566","","","0.1221","0.1376","","","","","","1.072","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215093","11.2005","0.001","8.8432","0.0008","11.697","0.0011","90","","114.666","0.001","90","","1052.86","0.17","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-Amino-1-(2-chlorophenyl)-1H-pyrazole-4-carbonitrile","","- C10 H7 Cl N4 -","- C10 H7 Cl N4 -","- C40 H28 Cl4 N16 -","4","1","FL2153","Lin, Q-Lian; Zhong, Ping; Hu, Mao-Lin","5-Amino-1-(2-chlorophenyl)-1<i>H</i>-pyrazole-4-carbonitrile","Acta Crystallographica Section E","2007","63","9","o3813","o3813","10.1107/S1600536807039037","","","0.71073","MoKα","","0.0528","0.0465","","","0.1205","0.1251","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215094","12.8324","0.0006","7.3821","0.0004","10.8437","0.0005","90","","103.449","0.003","90","","999.06","0.09","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","8-Amino-11-hydroxypentacycloundecane-8,11-lactam","","- C12 H14 N2 O2 -","- C12 H14 N2 O2 -","- C48 H56 N8 O8 -","4","1","FL2154","Boyle, Grant A.; Govender, Thavendran; Kruger, Hendrik G.; Ndlovu, Nombuso I.","8-Amino-11-hydroxypentacycloundecane-8,11-lactam","Acta Crystallographica Section E","2007","63","9","o3906","o3906","10.1107/S1600536807039827","","","0.71073","MoKα","","0.0524","0.0405","","","0.1049","0.1129","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215095","9.524","0.002","8.111","0.002","11.586","0.003","90","","99.71","0.03","90","","882.2","0.4","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","10,11-Dihydroxy-4-azatricyclo[5.2.2.0^2,6^]undec-8-ene-3,5-dione","","- C10 H11 N O4 -","- C10 H11 N O4 -","- C40 H44 N4 O16 -","4","1","FL2155","Krawiecka, Mariola; Wawrzycka-Gorczyca, Irena; Galazka, Agnieszka; Kossakowski, Jerzy; Koziol, Anna E.","10,11-Dihydroxy-4-azatricyclo[5.2.2.0^2,6^]undec-8-ene-3,5-dione","Acta Crystallographica Section E","2007","63","9","o3878","o3878","10.1107/S1600536807040962","","","1.54178","CuKα","","0.0668","0.0425","","","0.1115","0.1274","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215096","17.092","0.007","9.602","0.002","13.897","0.005","90","","116.367","0.014","90","","2043.5","1.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Poly[[hexaaquabis(μ~3~-trans-propene-1,2,3-tricarboxylato)trimanganese(II)] 0.2-hydrate]","","- C12 H18.4 Mn3 O18.2 -","- C12 H18.4 Mn3 O18.2 -","- C48 H73.6 Mn12 O72.8 -","4","0.5","GG2031","Ming-Sheng Wang; Guo-Wei Zhou; Guo-Cong Guo; Jin-Shun Huang","Poly[[hexaaquabis(μ~3~-<i>trans</i>-propene-1,2,3-tricarboxylato)trimanganese(II)] 0.2-hydrate]","Acta Crystallographica Section E","2007","63","9","m2400","m2400","10.1107/S1600536807040172","","","0.71073","MoKα","","0.0666","0.0525","","","0.0719","0.0759","","","","","","1.245","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215097","8.2951","0.001","18.01","0.002","8.9186","0.001","90","","114.103","0.004","90","","1216.2","0.2","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(2-Hydroxy-5-methylphenyl)-2-phenylethanone","","- C15 H14 O2 -","- C15 H14 O2 -","- C60 H56 O8 -","4","1","GG2032","Jian-Guo Chang; Chun-Hong He; Jian-Ping Zhang","1-(2-Hydroxy-5-methylphenyl)-2-phenylethanone","Acta Crystallographica Section E","2007","63","9","o3810","o3810","10.1107/S1600536807039542","","","0.71073","MoKα","","0.1009","0.0638","","","0.1835","0.2416","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215098","21.967","0.002","10.6232","0.001","19.2852","0.0019","90","","106.102","0.002","90","","4323.8","0.7","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis{<i>N</i>-[(1<i>Z</i>,3<i>Z</i>)-1,3-bis(4-fluorophenyl)-3- (phenylimino)prop-1-enyl]aniline(1-)}zinc(II)","","- C54 H38 F4 N4 Zn -","- C54 H38 F4 N4 Zn -","- C216 H152 F16 N16 Zn4 -","4","0.5","GG2033","Peng, Ya-Liu; Hsueh, Mao-Lin; Lin, Chu-Chieh","Bis{<i>N</i>-[(1<i>Z</i>,3<i>Z</i>)-1,3-bis(4-fluorophenyl)-3-(phenylimino)prop-1-enyl]aniline(1‒)}zinc(II)","Acta Crystallographica Section E","2007","63","9","m2388","m2388","10.1107/S1600536807040123","","","0.71073","MoKα","","0.0651","0.0404","","","0.0947","0.1054","","","","","","0.953","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215099","5.2638","0.0004","13.6385","0.0008","20.4415","0.0011","90","","90","","90","","1467.5","0.16","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,4-Bis(4-aminophenoxy)butane","","- C16 H20 N2 O2 -","- C16 H20 N2 O2 -","- C64 H80 N8 O8 -","4","0.5","GG2035","Naz, Touseef; Akhter, Zareen; Bolte, Michael; Siddiqi, Humaira M.","1,4-Bis(4-aminophenoxy)butane","Acta Crystallographica Section E","2007","63","9","o3777","o3777","10.1107/S1600536807039013","","","0.71073","MoKα","","0.0404","0.0364","","","0.0961","0.0991","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215101","18.2372","0.0004","15.4778","0.0004","15.9465","0.0004","90","","110.339","0.002","90","","4220.61","0.19","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Bis[4'-(4-methylphenyl)-2,2':6',2''-terpyridine- κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']manganese(II) bis(perchlorate)","Bis[4'-(4-methylphenyl)-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>', <i>N</i>'']manganese(II) bis(perchlorate)","","- C44 H34 Cl2 Mn N6 O8 -","- C44 H34 Cl2 Mn N6 O8 -","- C176 H136 Cl8 Mn4 N24 O32 -","4","1","GG2037","Liu, Han-Guo; Qiu, Yong-Cai; Wu, Jian-Zhong","Bis[4'-(4-methylphenyl)-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']manganese(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","9","m2393","m2394","10.1107/S1600536807040391","","","0.71073","MoKα","","0.1562","0.0604","","","0.1533","0.2044","","","","","","0.982","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215102","10.9516","0.0004","15.1202","0.0005","16.5498","0.0004","90","","92.063","0.001","90","","2738.71","0.15","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[[aqua(μ~2~-4,4'-bipyridine)(μ~4~-4,4'-oxydibenzene-1,2- carboxylato)dizinc(II)] 4,4'-bipyridine hemisolvate]","","- C31 H20 N3 O10 Zn2 -","- C31 H20 N3 O10 Zn2 -","- C124 H80 N12 O40 Zn8 -","4","1","GG3085","Pei-Xiu Yin; Zhao-Ji Li; Xin-Yi Cao; Ye-Yan Qin; Yuan-Gen Yao","Poly[[aqua(μ~2~-4,4'-bipyridine)(μ~5~-4,4'-oxydibenzene-1,2-carboxylato)dizinc(II)] 4,4'-bipyridine hemisolvate]","Acta Crystallographica Section E","2007","63","9","m2258","m2258","10.1107/S1600536807016893","","","0.71073","MoKα","","","0.0481","","","0.0838","0.0992","","","","","","1.077","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215103","8.3129","0.0003","14.34","0.003","12.869","0.004","90","","90","","90","","1534.1","0.6","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Adnan620","5-Hydrazino-1,3-dimethyl-4-nitro-1H-pyrazole","","- C5 H9 N5 O2 -","- C5 H9 N5 O2 -","- C40 H72 N40 O16 -","8","1","GG3110","Abu-Safieh, Kayed A.; Khanfer, Monther; Al-Far, Rawhi; Ali, Basem Fares; Maichle-Moessmer, C.; Abu-Rayyan, Ahmad","5-Hydrazino-1,3-dimethyl-4-nitro-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2007","63","9","o3814","o3815","10.1107/S1600536807039517","","","0.71073","MoKα","","0.073","0.0415","","","0.1118","0.1271","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215104","5.7889","0.0015","5.5654","0.0014","29.858","0.003","90","","91.638","0.003","90","","961.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Dibenzylethane-1,2-diammonium dinitrate","","- C16 H22 N4 O6 -","- C16 H22 N4 O6 -","- C32 H44 N8 O12 -","2","0.5","GG3117","Liu, Yu-Fen; Xia, Hai-Tao; Wang, Da-Qi; Yang, Shu-Ping; Meng, Yong-Lu","<i>N</i>,<i>N</i>'-Dibenzylethane-1,2-diammonium dinitrate","Acta Crystallographica Section E","2007","63","9","o3836","o3836","10.1107/S1600536807039736","","","0.71073","MoKα","","0.115","0.0719","","","0.1903","0.2153","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215105","6.834","0.0018","7.656","0.002","8.847","0.002","104.172","0.003","101.376","0.004","107.042","0.005","410.63","0.18","293","2","298","2","","","","","","","","4","P -1","-P 1","2","7-Azathieno[2,3-<i>c</i>]cinnoline","pyrido[4,3-<i>e</i>]thieno[2,3-<i>c</i>]pyridazine","","- C9 H5 N3 S -","- C9 H5 N3 S -","- C18 H10 N6 S2 -","2","1","GK2090","Hansen, Lars Kr.; Stockmann, Vegar; Fiksdahl, Anne","7-Azathieno[2,3-<i>c</i>]cinnoline","Acta Crystallographica Section E","2007","63","9","o3896","o3896","10.1107/S1600536807041335","","","0.71069","MoKα","","0.0547","0.0411","","","0.1244","0.1315","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215106","12.055","0.003","12.819","0.004","13.409","0.004","82.532","0.012","82.378","0.011","71.364","0.009","1937.7","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[8,17-Bis(5-nitro-2-oxidobenzyl-κO)-5,6:19,20-dibenzo-1,4,11,14-tetraoxa-8,17- diazacycloeicosane-κ^4^<i>N</i>,<i>N</i>']copper(II) chloroform solvate","","- C37 H39 Cl3 Cu N4 O10 -","- C37 H38 Cl3 Cu N4 O10 -","- C74 H76 Cl6 Cu2 N8 O20 -","2","1","GK2091","Ting-Ting Han; Jian-Fang Ma; Guang-Ju Ping; Zhi-Fang Jia","[8,17-Bis(5-nitro-2-oxidobenzyl-κ<i>O</i>)-5,6:19,20-dibenzo-1,4,11,14-tetraoxa-8,17-diazacycloeicosane-κ^4^<i>N</i>,<i>N</i>']copper(II) chloroform solvate","Acta Crystallographica Section E","2007","63","9","m2301","m2301","10.1107/S1600536807038202","","","0.71069","MoKα","","0.0731","0.0556","","","0.1381","0.148","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215107","7.076","0.0006","9.5221","0.0008","12.1934","0.0012","90","","90","","90","","821.57","0.13","291","2","291","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-(+)-2-Formylamino-3-methylbutanoic acid","","- C6 H11 N O3 -","- C6 H11 N O3 -","- C24 H44 N4 O12 -","4","1","GK2094","Boyle, Grant A.; Govender, Thavendran; Kruger, Hendrik G.; Maguire, Glenn E. M.; Negus, Tyrone K.; Rademeyer, Melanie","(<i>S</i>)-(+)-2-Formylamino-3-methylbutanoic acid","Acta Crystallographica Section E","2007","63","9","o3912","o3912","10.1107/S1600536807041311","","","0.71073","MoKα","","0.0694","0.0449","","","0.1228","0.1318","","","","","","0.983","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215108","13.9269","0.0013","15.399","0.002","22.133","0.004","90","","90","","90","","4746.7","1.1","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Dioxido{1-[(phenyl)(2-pyridyl)methylene]-4-(<i>p</i>-\ tolyl)thiosemicarbazonato}vanadium(V) dimethyl sulfoxide solvate","","- C22 H23 N4 O3 S2 V -","- C22 H23 N4 O3 S2 V -","- C176 H184 N32 O24 S16 V8 -","8","1","GK2096","Mendes, Isolda C.; Speziali, Nivaldo L.; Beraldo, Heloisa","Dioxido{1-[(phenyl)(2-pyridyl)methylene]-4-(<i>p</i>-tolyl)thiosemicarbazonato}vanadium(V) dimethyl sulfoxide solvate","Acta Crystallographica Section E","2007","63","9","m2391","m2391","10.1107/S1600536807038275","","","0.71073","MoKα","","0.1095","0.0594","","","0.1355","0.1646","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215109","5.8557","0.0004","4.7942","0.0004","31.822","0.002","90","","90.531","0.006","90","","893.31","0.11","299","2","299","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>-(2,5-Dichlorophenyl)acetamide","","- C8 H7 Cl2 N O -","- C8 H7 Cl2 N O -","- C32 H28 Cl8 N4 O4 -","4","1","GW2016","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(2,5-Dichlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","9","o3709","o3709","10.1107/S1600536807037178","","","1.5418","CuKα","","0.0925","0.0546","","","0.0948","0.1083","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215110","33.729","0.006","6.9503","0.0012","5.8487","0.001","90","","90.868","0.003","90","","1370.9","0.4","100","","100","","","","","","","","","5","C 1 c 1","C -2yc","9","","(2E)-1-(4-Bromophenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-en-1-one","","- C16 H13 Br O S -","- C16 H13 Br O S -","- C64 H52 Br4 O4 S4 -","4","1","GW2019","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Narayana, B.; Mithun, A.","(2<i>E</i>)-1-(4-Bromophenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-en-1-one","Acta Crystallographica Section E","2007","63","9","o3731","o3732","10.1107/S1600536807038147","","","0.71073","MoKα","","0.0374","0.0353","","","0.0774","0.0777","","","","","","1.533","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215111","9.772","0.001","22.761","0.003","9.832","0.001","90","","100.02","0.01","90","","2153.5","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","poly[aminotris(μ-4-aminobenzoato)holmium(III)]","","- C21 H20 Ho N3 O7 -","- C21 H20 Ho N3 O7 -","- C84 H80 Ho4 N12 O28 -","4","1","GW2020","Yong-Lan Feng; Jin-Sheng Xu; Dai-Zhi Kuang; Yun-Lin Peng","A two-dimensional holmium(III) coordination polymer: poly[aminotris(μ-4-aminobenzoato)holmium(III)]","Acta Crystallographica Section E","2007","63","9","m2338","m2338","10.1107/S1600536807038846","","","0.71073","MoKα","","0.0341","0.0209","","","0.049","0.0516","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215112","17.209","0.003","17.209","0.003","16.836","0.003","90","","90","","90","","4986","1.5","298","2","298","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Tetrakis(μ~3~-2-{[1,1-bis(hydroxymethyl)-2-\ oxidoethyl]iminomethyl}phenolato)tetracopper(II)","","- C44 H52 Cu4 N4 O16 -","- C44 H52 Cu4 N4 O16 -","- C176 H208 Cu16 N16 O64 -","4","0.25","HB2463","Jian-Fang Dong; Lian-Zhi Li; Hong-Yu Xu; Da-Qi Wang","Tetrakis(μ~3~-2-{[1,1-bis(hydroxymethyl)-2-oxidoethyl]iminomethyl}phenolato)tetracopper(II)","Acta Crystallographica Section E","2007","63","9","m2300","m2300","10.1107/S1600536807037920","","","0.71073","MoKα","","0.0354","0.0275","","","0.072","0.0753","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215113","6.361","0.003","6.931","0.003","11.82","0.005","105.35","0.02","92.05","0.02","113.64","0.02","454.4","0.4","100","","100","","","","","","","","","4","P -1","-P 1","2","","meso-1,2-Diphenylethylenediammonium adipate","","- C20 H26 N2 O4 -","- C20 H26 N2 O4 -","- C20 H26 N2 O4 -","1","0.5","HB2481","Ramasamy Ramasubramanian; Murugan Indrani; Sudalaiandi Kumaresan; Frank R. Fronczek; Bahlul Z. Awen","<i>meso</i>-1,2-Diphenylethylenediammonium adipate","Acta Crystallographica Section E","2007","63","9","o3800","o3800","10.1107/S1600536807038937","","","0.71073","MoKα","","0.107","0.061","","","0.142","0.165","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215114","5.4549","0.0001","12.7528","0.0003","12.9382","0.0003","114.646","0.001","101.477","0.001","90.919","0.001","796.73","0.03","140","2","140","2","","","","","","","","6","P -1","-P 1","2","","hexaaquacobalt(II) 3-ammonionahthalene-1,5-disulfonate tetrahydrate","","- C20 H36 Co N2 O22 S4 -","- C20 H32 Co N2 O22 S4 -","- C20 H32 Co N2 O22 S4 -","1","0.5","HB2483","Genther, Dane J.; Squattrito, Philip J.; Kirschbaum, Kristin; Pinkerton, A. Alan","Hexaaquacobalt(II) 3-ammonionaphthalene-1,5-disulfonate tetrahydrate","Acta Crystallographica Section E","2007","63","9","m2260","m2261","10.1107/S160053680703694X","","","0.71073","MoKα","","0.0365","0.0351","","","0.0971","0.098","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215115","5.4294","0.0002","12.7411","0.0005","12.9537","0.0006","114.497","0.001","101.563","0.001","90.889","0.001","793.98","0.06","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","Hexaaquazinc(II) 3-ammonionaphthalene-1,5-disulfonate tetrahydrate","","- C20 H36 N2 O22 S4 Zn -","- C20 H32 N2 O22 S4 Zn -","- C20 H32 N2 O22 S4 Zn -","1","0.5","HB2484","Genther, Dane J.; Squattrito, Philip J.; Kirschbaum, Kristin; Pinkerton, A. Alan","Hexaaquazinc(II) 3-ammonionaphthalene-1,5-disulfonate tetrahydrate","Acta Crystallographica Section E","2007","63","9","m2262","m2262","10.1107/S1600536807036938","","","0.71073","MoKα","","0.0419","0.0384","","","0.1051","0.1073","","","","","","0.944","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215116","28.848","0.006","13.648","0.003","13.562","0.003","90","","117.58","0.03","90","","4733","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N-(2,6-Dimethylphenyl)- 2-(2-{3-[4-(methylsulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}phenoxy)acetamide","","- C25 H23 N3 O5 S -","- C25 H23 N3 O5 S -","- C200 H184 N24 O40 S8 -","8","1","HB2487","Wang, Hai-Bo; Yin, Jun; Xing, Zhi-Tao","<i>N</i>-(2,6-Dimethylphenyl)-2-(2-{3-[4-(methylsulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}phenoxy)acetamide","Acta Crystallographica Section E","2007","63","9","o3668","o3668","10.1107/S1600536807036136","","","0.71073","MoKα","","0.1804","0.075","","","0.1425","0.1781","","","","","","0.969","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215117","10.814","0.004","7.04","0.003","15.487","0.006","90","","97.68","0.03","90","","1168.5","0.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Guanidinium 4-chloro-3-nitrobenzoate monohydrate","","- C8 H11 Cl N4 O5 -","- C8 H11 Cl N4 O5 -","- C32 H44 Cl4 N16 O20 -","4","1","HB2489","Najafpour, M. Mahdi; Hołyńska, Małgorzata; Lis, Tadeusz","Guanidinium 4-chloro-3-nitrobenzoate monohydrate","Acta Crystallographica Section E","2007","63","9","o3727","o3727","10.1107/S1600536807037944","","","0.71073","MoKα","","0.0693","0.0412","","","0.0877","0.0942","","","","","","1.011","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215118","13.9688","0.0006","8.1164","0.0004","19.79","0.001","90","","90","","90","","2243.72","0.19","295","2","295","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","6,7,8-Trimethoxycoumarin","","- C12 H12 O5 -","- C12 H12 O5 -","- C96 H96 O40 -","8","1","HB2490","Nurdin, Saidi; Mukhtar, Mat Ropi; Awang, Khalijah; Hadi, A. Hamid A.; Ng, Seik Weng","6,7,8-Trimethoxycoumarin from <i>Cryptocarya bracteolata</i>","Acta Crystallographica Section E","2007","63","9","o3692","o3693","10.1107/S1600536807036914","","","0.71073","MoKα","","0.0616","0.0406","","","0.1066","0.1176","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215119","8.5829","0.0017","15.587","0.003","25.277","0.005","90","","90","","90","","3381.6","1.1","120","2","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","4,4,6,6-Tetrachloro-2-[(2,4-dimethylphenyl)sulfanyl]-<i>N</i>-[4-(2,2,4,4-\ tetrachloro-1,3,5,7,11-pentaaza-2λ^5^,4λ^5^,6λ^5^-\ triphosphaspiro[5.5]undeca-1,3,5-trien-7-yl)butyl]-\ 1,3,5,2λ^5^,4λ^5^,6λ^5^-triazatriphosphinin-2-amine","","- C15 H25 Cl8 N9 P6 S -","- C15 H25 Cl8 N9 P6 S -","- C60 H100 Cl32 N36 P24 S4 -","4","1","HB2491","Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; İbişoğlu, Hanife; Kılıç, Adem; Shaw, Robert A.","4,4,6,6-Tetrachloro-2-[(2,4-dimethylphenyl)sulfanyl]-<i>N</i>-[4-(2,2,4,4-tetrachloro-1,3,5,7,11-pentaaza-2λ^5^,4λ^5^,6λ^5^-triphosphaspiro[5.5]undeca-1,3,5-trien-7-yl)butyl]-1,3,5,2λ^5^,4λ^5^,6λ^5^-triazatriphosphinin-2-amine","Acta Crystallographica Section E","2007","63","9","o3753","o3753","10.1107/S1600536807038962","","","0.71073","MoKα","","0.0641","0.0433","","","0.0946","0.1071","","","","","","0.991","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215120","8.525","0.0009","23.686","0.003","14.0227","0.0015","90","","90.533","0.002","90","","2831.4","0.6","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-(2-Nitrobenzenesulfonamido)pyridinium chloride hemihydrate","","- C11 H11 Cl N3 O4.5 S -","- C11 H11 Cl N3 O4.5 S -","- C88 H88 Cl8 N24 O36 S8 -","8","2","HB2493","Yu, Hai-Jun; Li, Jiang-Sheng","4-(2-Nitrobenzenesulfonamido)pyridinium chloride hemihydrate","Acta Crystallographica Section E","2007","63","9","o3766","o3766","10.1107/S1600536807038378","","","0.71073","MoKα","","0.0573","0.0368","","","0.0842","0.0939","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2215121","8.8263","0.0006","5.9804","0.0004","15.3032","0.0011","90","","93.48","0.002","90","","806.29","0.1","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[μ~2~-nitrato-(μ~4~-pyrazine-2-carboxylato)disilver(I)]","","- C5 H3 Ag2 N3 O5 -","- C5 H3 Ag2 N3 O5 -","- C20 H12 Ag8 N12 O20 -","4","1","HB2494","Seward, Kathryn L.; Ellsworth, Joseph M.; Khaliq, Zeeshan M.; Smith, Mark D.; zur Loye, Hans-Conrad","Poly[μ~2~-nitrato-(μ~4~-pyrazine-2-carboxylato)disilver(I)]","Acta Crystallographica Section E","2007","63","9","m2333","m2333","10.1107/S1600536807037968","","","0.71073","MoKα","","0.0397","0.03","","","0.059","0.0631","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215122","7.999","0.003","11.073","0.004","15.116","0.005","90","","96.822","0.006","90","","1329.4","0.8","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(2,4-Dimethylphenyl)benzenesulfonamide","","- C14 H15 N O2 S -","- C14 H15 N O2 S -","- C56 H60 N4 O8 S4 -","4","1","HB2495","Chang, Jun; Zhang, Tie-Jun; Liu, Chang-Xiao; Zhao, Xue-Ming","<i>N</i>-(2,4-Dimethylphenyl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","9","o3670","o3670","10.1107/S160053680703677X","","","0.71073","MoKα","","0.0571","0.04","","","0.1105","0.1224","","","","","","1.048","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215123","8.3929","0.0012","14.862","0.002","8.888","0.0012","90","","95.963","0.002","90","","1102.6","0.3","290","2","290","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-Butyl-1H-isochromen-1-one","","- C13 H14 O2 -","- C13 H14 O2 -","- C52 H56 O8 -","4","1","HB2496","Venkatesha R. Hathwar; P. Manivel; F. Nawaz Khan; T. N. Guru Row","3-Butyl-1<i>H</i>-isochromen-1-one","Acta Crystallographica Section E","2007","63","9","o3707","o3707","10.1107/S1600536807037671","","","0.71073","MoKα","","0.1015","0.0432","","","0.0858","0.1008","","","","","","0.93","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215124","15.83","0.003","11.3918","0.0015","16.787","0.003","90","","114.118","0.011","90","","2763","0.8","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(<i>E</i>)-2-(2-Anilinovinyl)-3,4-dimethylthiazol-3-ium iodide","","- C13 H15 I N2 S -","- C13 H15 I N2 S -","- C104 H120 I8 N16 S8 -","8","1","HB2497","Ge, Chun-Hua; Guo, Zhi-Jun; Guo Yanan; Guan, Wei; Zhang, Xiang-Dong","(<i>E</i>)-2-(2-Anilinovinyl)-3,4-dimethylthiazol-3-ium iodide","Acta Crystallographica Section E","2007","63","9","o3798","o3798","10.1107/S1600536807038780","","","0.71073","MoKα","","0.0432","0.031","","","0.077","0.0837","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215125","6.2657","0.001","8.6591","0.0014","13.504","0.002","90","","90","","90","","732.7","0.2","292","2","292","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Garcinia lactone","(2S,3S)-3-hydroxy-5-oxo-2,3,4,5-tetrahydrofuran-2,3-dicarboxylic acid","","- C6 H6 O7 -","- C6 H6 O7 -","- C24 H24 O28 -","4","1","HB2498","Sudarshan Mahapatra; Srijita Basu Mallik; G. Venkateswara Rao; G. Chandrasekara Reddy; Guru Row, T. N.","Garcinia lactone","Acta Crystallographica Section E","2007","63","9","o3869","o3869","10.1107/S160053680703838X","","","0.71073","MoKα","","0.0281","0.0271","","","0.0655","0.0663","","","","","","1.101","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215126","7.8699","0.0006","8.584","0.0006","9.8083","0.0007","82.032","0.001","76.713","0.001","62.924","0.001","573.75","0.07","290","2","290","2","","","","","","","","4","P -1","-P 1","2","","3-Butyl-1H-isochromene-1-thione","","- C13 H14 O S -","- C13 H14 O S -","- C26 H28 O2 S2 -","2","1","HB2499","Venkatesha R. Hathwar; P. Manivel; Nawaz Khan, F.; Guru Row, T. N.","3-Butyl-1<i>H</i>-isochromene-1-thione","Acta Crystallographica Section E","2007","63","9","o3708","o3708","10.1107/S1600536807037683","","","0.71073","MoKα","","0.0535","0.0409","","","0.0998","0.1068","","","","","","1.051","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215127","10.385","0.005","11.252","0.005","14.074","0.005","90","","104.81","0.005","90","","1589.9","1.2","290","2","290","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[μ-2,4-dibromo-6-(2-pyridylmethylaminomethyl)phenolato]\ bis[nitratocopper(II)]","","- C26 H22 Br4 Cu2 N6 O8 -","- C26 H22 Br4 Cu2 N6 O8 -","- C52 H44 Br8 Cu4 N12 O16 -","2","0.5","HB2500","Ji-Cheng Ma; Jin Yang; Jian-Fang Ma","Bis[μ-2,4-dibromo-6-(2-pyridylmethylaminomethyl)phenolato]bis[nitratocopper(II)]","Acta Crystallographica Section E","2007","63","9","m2284","m2284","10.1107/S1600536807037695","","","0.71069","MoKα","","0.0556","0.0345","","","0.0654","0.0711","","","","","","1.046","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215129","7.6059","0.0009","10.9913","0.0012","13.8057","0.0015","108.448","0.002","100.227","0.002","105.178","0.002","1013","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","5(4H)-one","","- C24 H18 F3 N3 O -","- C24 H18 F3 N3 O -","- C48 H36 F6 N6 O2 -","2","1","HB2502","Yi-Feng Sun; Xin-Li Wang; Shi-Ying Ma; Zi-Ying Wang","3-Methyl-1-phenyl-4-{phenyl[4-(trifluoromethyl)anilino]methylene}-1<i>H</i>-pyrazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","9","o3725","o3725","10.1107/S1600536807037993","","","0.71073","MoKα","","0.0608","0.0552","","","0.1552","0.1628","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215130","7.4989","0.0005","20.364","0.0016","13.6083","0.0008","90","","104.844","0.005","90","","2008.7","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3-Dibromo-3-(4-bromo-6-methoxy-2-naphthyl)-1-(4-methoxyphenyl)propan-1-one","","- C21 H17 Br3 O3 -","- C21 H17 Br3 O3 -","- C84 H68 Br12 O12 -","4","1","HB2503","Sarojini, B. K.; Narayana, B.; Yathirajan, H. S.; Mayekar, Anil N.; Bolte, Michael","2,3-Dibromo-3-(4-bromo-6-methoxy-2-naphthyl)-1-(4-methoxyphenyl)propan-1-one","Acta Crystallographica Section E","2007","63","9","o3755","o3755","10.1107/S1600536807038883","","","0.71073","MoKα","","0.0791","0.0686","","","0.1669","0.1739","","","","","","1.075","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215131","14.353","0.005","15.09","0.006","7.5017","0.0018","90","","93.287","0.01","90","","1622.1","0.9","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Amino-4-bromo-2-benzofuran-1(3H)-one","","- C8 H6 Br N O2 -","- C8 H6 Br N O2 -","- C64 H48 Br8 N8 O16 -","8","2","HB2505","Wang, Junyan; Johnson, Dave M.; Tiekink, Edward R. T.","5-Amino-4-bromo-2-benzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","9","o3771","o3771","10.1107/S1600536807039049","","","0.7107","MoKα","","0.065","0.06","","","0.155","0.16","","","","","","1.12","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215132","9.881","0.0014","10.222","0.0017","13.256","0.002","80.108","0.011","86.653","0.011","84.143","0.01","1311","0.4","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","(6-Aminonaphthalene-1-sulfonato-κO)bis(3-methylisoquinoline-κN)silver(I)","","- C30 H26 Ag N3 O3 S -","- C30 H26 Ag N3 O3 S -","- C60 H52 Ag2 N6 O6 S2 -","2","1","HB2506","Wang, Xiu-Yan; Ma, Chao-Hong; Gao, Qian-Qian; Lu, Shu-Qin; Dong, Xian-Wu","(6-Aminonaphthalene-1-sulfonato-κ<i>O</i>)bis(3-methylisoquinoline-κ<i>N</i>)silver(I)","Acta Crystallographica Section E","2007","63","9","m2361","m2361","10.1107/S1600536807039955","","","0.71073","MoKα","","0.1429","0.0482","","","0.0594","0.0741","","","","","","0.755","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215133","9.017","0.005","19.115","0.005","17.397","0.007","90","","105.605","0.016","90","","2888","2","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(μ-pyridine-1-carbaldehyde azine-κ^2^N,N':κ^2^N'',N''')disilver(I) bis(methanesulfonate)","","- C26 H26 Ag2 N8 O6 S2 -","- C26 H26 Ag2 N8 O6 S2 -","- C104 H104 Ag8 N32 O24 S8 -","4","1","HB2507","Broker, Grant A.; Tiekink, Edward R. T.","Bis(μ-pyridine-1-carbaldehyde azine-κ^2^<i>N</i>,<i>N</i>':κ^2^<i>N</i>'',<i>N</i>''')disilver(I) bis(methanesulfonate)","Acta Crystallographica Section E","2007","63","9","m2368","m2368","10.1107/S1600536807039980","","","0.7107","MoKα","","0.03","0.029","","","0.066","0.067","","","","","","1.1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215134","6.5951","0.0004","10.6971","0.0007","11.6112","0.0007","97.21","0.001","94.384","0.001","106.411","0.001","774.16","0.08","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Aqua(2,2'-biimidazole)(pyridine-2,6-dicarboxylato)copper(II) monohydrate","","- C13 H13 Cu N5 O6 -","- C13 H13 Cu N5 O6 -","- C26 H26 Cu2 N10 O12 -","2","1","HB2508","Minna Cao; Min Wang; Feihua Luo; Cuixia Cheng; Zongqiu Hu","Aqua(2,2'-biimidazole)(pyridine-2,6-dicarboxylato)copper(II) monohydrate","Acta Crystallographica Section E","2007","63","9","m2372","m2372","10.1107/S1600536807040366","","","0.71073","MoKα","","0.0565","0.0491","","","0.1391","0.1476","","","","","","1.096","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215135","7.9619","0.0017","9.4382","0.0011","13.468","0.003","78.12","0.03","76.75","0.03","70.13","0.03","917.4","0.4","98","2","98","2","","","","","","","","6","P -1","-P 1","2","","Bis(μ-pyridine-1-carbaldehyde azine-κ^2^N,N':κN'')disilver(I) bis(p-toluenesulfonate)","","- C38 H34 Ag2 N8 O6 S2 -","- C38 H34 Ag2 N8 O6 S2 -","- C38 H34 Ag2 N8 O6 S2 -","1","0.5","HB2512","Broker, Grant A.; Tiekink, Edward R. T.","Bis(μ-pyridine-1-carbaldehyde azine-κ^2^<i>N</i>,<i>N</i>':κ<i>N</i>'')disilver(I) bis(<i>p</i>-toluenesulfonate)","Acta Crystallographica Section E","2007","63","9","m2420","m2421","10.1107/S1600536807040809","","","0.7107","MoKα","","0.02","0.02","","","0.051","0.052","","","","","","1.07","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215136","13.447","0.004","16.628","0.005","6.881","0.002","90","","99.179","0.004","90","","1518.9","0.8","305","2","305","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Chlorido[2,4-dibromo-6-(2-pyridylmethylaminomethyl)phenolato]copper(II)","","- C13 H11 Br2 Cl Cu N2 O -","- C13 H11 Br2 Cl Cu N2 O -","- C52 H44 Br8 Cl4 Cu4 N8 O4 -","4","1","HB2515","Ma, Ji-Cheng; Yang, Jin; Ma, Jian-Fang","Chlorido[2,4-dibromo-6-(2-pyridylmethylaminomethyl)phenolato]copper(II)","Acta Crystallographica Section E","2007","63","9","m2431","m2431","10.1107/S1600536807041669","","","0.71073","MoKα","","0.1003","0.0506","","","0.1152","0.1373","","","","","","0.941","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215137","25.083","0.009","12.284","0.004","21.009","0.007","90","","113.79","0.007","90","","5923","3","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[silver(I)-μ-1,4-di-4-pyridyl-2,3-diazabuta-1,3-diene] methanesulfonate]","","- C13 H13 Ag N4 O3 S -","- C13 H13 Ag N4 O3 S -","- C208 H208 Ag16 N64 O48 S16 -","16","2","HB2517","Broker, Grant A.; Tiekink, Edward R. T.","<i>catena</i>-Poly[[silver(I)-μ-1,4-di-4-pyridyl-2,3-diazabuta-1,3-diene] methanesulfonate]","Acta Crystallographica Section E","2007","63","9","m2436","m2436","10.1107/S1600536807041645","","","0.7107","MoKα","","0.057","0.054","","","0.13","0.132","","","","","","1.16","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215138","8.5649","0.001","10.3212","0.0013","10.5563","0.0013","63.783","0.002","71.937","0.002","65.953","0.002","754.83","0.16","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","5,7-Dimethoxy-3-(4-methoxyphenyl)-4H-chromen-4-one","","- C18 H16 O5 -","- C18 H16 O5 -","- C36 H32 O10 -","2","1","HB2521","Li, Huan-Qiu; Xiao, Zhu-Ping; Fang, Rui-Qin; Zhu, Hai-Liang","5,7-Dimethoxy-3-(4-methoxyphenyl)-4<i>H</i>-chromen-4-one","Acta Crystallographica Section E","2007","63","9","o3923","o3923","10.1107/S1600536807041773","","","0.71073","MoKα","","0.0701","0.0526","","","0.1337","0.145","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215139","8.1871","0.0005","7.4046","0.0004","14.7415","0.0005","90","","94.6","0.004","90","","890.78","0.08","173","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Methylanilinium chloride monohydrate","","- C7 H12 Cl N O -","- C7 H12 Cl N O -","- C28 H48 Cl4 N4 O4 -","4","1","HG2263","Benslimane, Meriem; Merazig, Hocine; Bouacida, Sofiane; Dembri, Sabrina; Beghidja, Adel; Ouahab, Lahcène","2-Methylanilinium chloride monohydrate","Acta Crystallographica Section E","2007","63","9","o3682","o3683","10.1107/S1600536807037117","","","0.71073","MoKα","","0.0523","0.0397","","","0.1176","0.1414","","","","","","1.107","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215140","10.6343","0.0008","10.8217","0.0007","22.603","0.002","90","","90","","90","","2601.2","0.3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Bis{methyl [1-(6-acetyl-2-pyridyl)ethylidene]hydrazinecarbodithioato}nickel(II)","","- C22 H24 N6 Ni O2 S4 -","- C22 H24 N6 Ni O2 S4 -","- C88 H96 N24 Ni4 O8 S16 -","4","1","HG2264","Akbar Ali, Mohammad; Mirza, Aminul Huq; Bernhardt, Paul V.","Bis{methyl [1-(6-acetyl-2-pyridyl)ethylidene]hydrazinecarbodithioato}nickel(II)","Acta Crystallographica Section E","2007","63","9","m2255","m2255","10.1107/S1600536807037129","","","0.71073","MoKα","","0.0403","0.0274","","","0.0699","0.075","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215141","18.7266","0.0016","14.5252","0.0012","15.2375","0.0013","90","","94.782","0.002","90","","4130.3","0.6","243","2","243","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[manganese(II)-μ-[N,N,N',N'-tetrakis(2-pyridylmethyl)hexane- 1,6-diamine]] diperchlorate acetone disolvate dihydrate]","","- C36 H52 Cl2 Mn N6 O12 -","- C36 H48 Cl2 Mn N6 O12 -","- C144 H192 Cl8 Mn4 N24 O48 -","4","0.5","HG2266","Hwang, In-Chul; Ha, Kwang","<i>catena</i>-Poly[[manganese(II)-μ-[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis(2-pyridylmethyl)hexane-1,6-diamine]] bis(perchlorate) acetone disolvate dihydrate]","Acta Crystallographica Section E","2007","63","9","m2302","m2302","10.1107/S1600536807038603","","","0.71073","MoKα","","0.1312","0.0729","","","0.1991","0.2271","","","","","","0.92","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215142","4.7368","0.0013","11.295","0.003","18.324","0.005","88.289","0.005","83.774","0.005","84.268","0.004","969.5","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","N-(3,4-Dichlorophenyl)-N'-decanoylthiourea","","- C17 H24 Cl2 N2 O S -","- C17 H24 Cl2 N2 O S -","- C34 H48 Cl4 N4 O2 S2 -","2","1","HG2267","Kadir, Maisara A.; Ahmad, Khadijah; Yusof, M. Sukeri M.; Yamin, Bohari M.","<i>N</i>-(3,4-Dichlorophenyl)-<i>N</i>'-decanoylthiourea","Acta Crystallographica Section E","2007","63","9","o3711","o3711","10.1107/S1600536807037762","","","0.71073","MoKα","","0.0639","0.0448","","","0.1067","0.1154","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215143","14.6807","0.0004","7.38","0.0002","17.4291","0.0005","90","","92.8487","0.0015","90","","1886","0.09","200","","200","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Methyl 3,4-dibromo-2-(triisopropylsilyl)-1<i>H</i>-pyrrole-1-carboxylate","","- C15 H25 Br2 N O2 Si -","- C15 H25 Br2 N O2 Si -","- C60 H100 Br8 N4 O8 Si4 -","4","1","HG2268","Martin G. Banwell; Kate E. Holden; Anthony C. Willis","Methyl 3,4-dibromo-2-(triisopropylsilyl)-1<i>H</i>-pyrrole-1-carboxylate","Acta Crystallographica Section E","2007","63","9","o3712","o3712","10.1107/S1600536807037774","","","0.71073","MoKα","","0.0464","0.0237","","0.0324","0.0267","0.0267","","","","","","1.1481","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215145","7.3705","0.001","18.386","0.002","8.9368","0.0016","90","","97.063","0.002","90","","1201.9","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5,5'-Bis(diethylamino)-2,2'-[ethylenedioxybis(nitrilomethylidyne)]diphenol","","- C24 H34 N4 O4 -","- C24 H34 N4 O4 -","- C48 H68 N8 O8 -","2","0.5","HG2270","Yan-Ping Zhang; Xiao Chen; Jun-Yan Shi; Li Xu; Wen-Kui Dong","5,5'-Bis(diethylamino)-2,2'-[ethylenedioxybis(nitrilomethylidyne)]diphenol","Acta Crystallographica Section E","2007","63","9","o3852","o3852","10.1107/S1600536807038597","","","0.71073","MoKα","","0.0925","0.0428","","","0.0921","0.1231","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215147","11.0085","0.0015","11.8934","0.0017","15.698","0.002","90","","90","","90","","2055.3","0.5","294","2","294","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Ethyl 2-anilino-4-(2,4-dichlorophenyl)-6-trifluoromethyl-3,4- dihydropyrimidine-5-carboxylate","","- C20 H16 Cl2 F3 N3 O2 -","- C20 H16 Cl2 F3 N3 O2 -","- C80 H64 Cl8 F12 N12 O8 -","4","1","HG2273","Chen-Xia Yu; Song Lei; Chang-Sheng Yao; Shu-Jiang Tu","Ethyl 2-anilino-4-(2,4-dichlorophenyl)-6-trifluoromethyl-3,4-dihydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","9","o3804","o3804","10.1107/S1600536807037786","","","0.71073","MoKα","","0.0596","0.0373","","","0.0812","0.0917","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215148","17.937","0.004","6.4674","0.0013","19.047","0.004","90","","113.31","0.03","90","","2029.2","0.9","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4-Di-tert-butyl-6-(4-nitrophenyliminomethyl)phenol","","- C21 H26 N2 O3 -","- C21 H26 N2 O3 -","- C84 H104 N8 O12 -","4","1","HG2274","Yi-Feng Sun; Xin-Li Wang; Shi-Ying Ma; Hong-Ji Chen","2,4-Di-<i>tert</i>-butyl-6-(4-nitrophenyliminomethyl)phenol","Acta Crystallographica Section E","2007","63","9","o3746","o3746","10.1107/S1600536807038615","","","0.71073","MoKα","","0.2377","0.0779","","","0.1333","0.1763","","","","","","0.972","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215149","13.749","0.004","9.713","0.004","14.471","0.006","90","","91.56","0.03","90","","1931.8","1.3","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Poly[tetraaquadi-μ~6~-citrato-tetracopper(II)]","","- C12 H16 Cu4 O18 -","- C12 H16 Cu4 O18 -","- C48 H64 Cu16 O72 -","4","1","HG2275","Drzewiecka, Aleksandra; Koziol, Anna E.; Lowczak, Maria; Lis, Tadeusz","Poly[tetraaquadi-μ~6~-citrato-tetracopper(II)]: a redetermination","Acta Crystallographica Section E","2007","63","9","m2339","m2340","10.1107/S1600536807039086","","","0.71073","MoKα","","0.0349","0.0272","","","0.0665","0.069","","","","","","1.015","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215150","7.8783","0.0001","12.2854","0.0002","35.3968","0.0005","90","","90","","90","","3425.99","0.09","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R)-(+)-3,3'-(1,1'-Binaphthyl-2,2'-dioxy)diphthalonitrile benzene solvate","","- C42 H24 N4 O2 -","- C42 H24 N4 O2 -","- C168 H96 N16 O8 -","4","1","HG2276","Zhang, Xiao-Mei; Lu, Ji-Tao","(<i>R</i>)-(+)-3,3'-(1,1'-Binaphthyl-2,2'-dioxy)diphthalonitrile benzene solvate","Acta Crystallographica Section E","2007","63","9","o3861","o3861","10.1107/S1600536807040639","","","0.71073","MoKα","","0.0825","0.0523","","","0.1308","0.1485","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215151","9.0899","0.0002","5.6626","0.0001","24.244","0.0005","90","","92.626","0.002","90","","1246.59","0.04","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Methoxy-2-(2-pyridylmethyliminomethyl)phenol","","- C14 H14 N2 O2 -","- C14 H14 N2 O2 -","- C56 H56 N8 O8 -","4","1","HG2277","Ni, Zhong-Hai; Wang, Hai-Long","6-Methoxy-2-(2-pyridylmethyliminomethyl)phenol","Acta Crystallographica Section E","2007","63","9","o3799","o3799","10.1107/S1600536807039372","","","0.71073","MoKα","","0.0662","0.0432","","","0.1145","0.1344","","","","","","0.985","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215152","9.64","0.0019","10.242","0.002","14.705","0.003","109.46","0.03","90.16","0.03","100.16","0.03","1344.5","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(thiocyanato-κN)tetrakis(1-vinyl-1H-imidazole-κN^3^)nickel(II)","","- C22 H24 N10 Ni S2 -","- C22 H24 N10 Ni S2 -","- C44 H48 N20 Ni2 S4 -","2","1","HG2278","Su-Juan Pang; Juan Su; Qiang Lin","Bis(thiocyanato-κ<i>N</i>)tetrakis(1-vinyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II)","Acta Crystallographica Section E","2007","63","9","m2369","m2369","10.1107/S1600536807039888","","","0.71073","MoKα","","0.0814","0.0521","","","0.1435","0.1983","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215153","8.3772","0.0006","13.7441","0.001","16.9684","0.0012","90","","90","","90","","1953.7","0.2","90","0.2","90","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(11R)-13-(Benzylamino)-4,5-epoxy-11,13-dihydrocostunolide","","- C22 H29 N O3 -","- C22 H29 N O3 -","- C88 H116 N4 O12 -","4","1","HG2279","Nasim, Shama; Parkin, Sean; Crooks, Peter A.","(11<i>R</i>)-13-(Benzylamino)-4,5-epoxy-11,13-dihydrocostunolide","Acta Crystallographica Section E","2007","63","9","o3922","o3922","10.1107/S1600536807041712","","","1.54178","CuKα","","0.0371","0.0363","","","0.0949","0.096","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215154","6.746","0.002","9.573","0.002","13.335","0.003","100.52","0.03","98.43","0.03","95.68","0.03","830.5","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","1-[2,4-Bis(4-fluorophenoxy)phenyl]ethanone","","- C20 H14 F2 O3 -","- C20 H14 F2 O3 -","- C40 H28 F4 O6 -","2","1","HG2280","Gao-Ning Li; Yu-Xiang Jiang; Zhi-Wei Zhai; Zhong-Jie Xu; Liang-Zhong Xu","1-[2,4-Bis(4-fluorophenoxy)phenyl]ethanone","Acta Crystallographica Section E","2007","63","9","o3825","o3825","10.1107/S1600536807040056","","","0.71073","MoKα","","0.0822","0.0679","","","0.1853","0.1982","","","","","","1.108","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215156","7.728","0.0015","15.144","0.003","11.039","0.002","90","","107.23","0.03","90","","1233.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dibromidotetrakis(1-vinyl-1H-imidazole-κN^3^)copper(II)","","- C20 H24 Br2 Cu N8 -","- C20 H24 Br2 Cu N8 -","- C40 H48 Br4 Cu2 N16 -","2","0.5","HG2284","Fa-Qian Liu; Rong-Xun Li; Shao-Xiang Li; Chao-Qin Li; Guang-Ye Liu","Dibromidotetrakis(1-vinyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II)","Acta Crystallographica Section E","2007","63","9","m2437","m2437","10.1107/S1600536807041700","","","0.71073","MoKα","","0.1156","0.0651","","","0.1429","0.164","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215157","5.039","0.003","13.656","0.008","14.043","0.009","90","","90","","90","","966.3","1","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Poly[(μ~3~-N-acetyl-L-histidinato-κ^4^N,O:O:O')silver(I)]","","- C8 H10 Ag N3 O3 -","- C8 H10 Ag N3 O3 -","- C32 H40 Ag4 N12 O12 -","4","1","HG2285","Noriko, Kasuga C.; Shinichiro Tsuruta; Akifumi Amano; Kenji Nomiya","Poly[(μ~3~-<i>N</i>-acetyl-<small>L</small>-histidinato-κ^4^<i>N</i>,<i>O</i>:<i>O</i>:<i>O</i>')silver(I)]","Acta Crystallographica Section E","2007","63","9","m2440","m2440","10.1107/S1600536807041724","","","0.71073","MoKα","","0.029","0.0276","","","0.0626","0.0635","","","","","","1.114","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215158","13.826","0.005","14.436","0.005","15.525","0.005","70.674","0.005","69.206","0.005","87.85","0.005","2722.3","1.6","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","9-Ethyl-3,6-bis(2-thienyl)carbazole","","- C22 H17 N S2 -","- C22 H17 N S2 -","- C132 H102 N6 S12 -","6","3","HK2250","Wang, Peng; Ju, Yi; Tang, Shi Ya; Wu, Jie Ying; Zhou, Hong Ping","9-Ethyl-3,6-bis(2-thienyl)carbazole","Acta Crystallographica Section E","2007","63","9","o3671","o3671","10.1107/S1600536807033053","","","0.71069","MoKα","","0.0907","0.0645","","","0.1764","0.2015","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215159","7.9571","0.0006","17.7596","0.0013","7.7258","0.0006","90","","90","","90","","1091.77","0.14","291","2","291","2","","","","","","","","5","P c a 21","P 2c -2ac","29","potassium salt of salicylidene-β-hydroxyalanine","poly[[μ-3-hydroxy-2-(2-hydroxybenzylideneamino)propionato]potassium]","","- C10 H10 K N O4 -","- C10 H10 K N O4 -","- C40 H40 K4 N4 O16 -","4","1","HK2286","Xu-Sheng Gao; Yong-Min Wan; Zhi-Fang Lv; Yuan-Xiang Shi; Jin-Tang Wang","Potassium salt of salicylidene-β-hydroxyalanine","Acta Crystallographica Section E","2007","63","9","m2370","m2370","10.1107/S1600536807040329","","","0.71073","MoKα","","0.0262","0.0244","","","0.0646","0.0677","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215160","13.785","0.005","10.664","0.004","18.233","0.006","90","","90","","90","","2680.3","1.7","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1-(2,2-Dimethylcyclopropylcarbonyl)-3-(2-pyridyl)thiourea","","- C12 H15 N3 O S -","- C12 H15 N3 O S -","- C96 H120 N24 O8 S8 -","8","1","HK2302","Jing Wang; Li Tian; Shang-Yuan Liu","1-(2,2-Dimethylcyclopropylcarbonyl)-3-(2-pyridyl)thiourea","Acta Crystallographica Section E","2007","63","9","o3667","o3667","10.1107/S1600536807036690","","","0.71073","MoKα","","0.0559","0.0417","","","0.11","0.1209","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215161","5.722","0.0011","8.063","0.0016","10.963","0.002","102.74","0.03","101.59","0.03","97.49","0.03","475.14","0.19","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","2,5-Dibenzoylterephthalic acid dihydrate","","- C22 H18 O8 -","- C22 H18 O8 -","- C22 H18 O8 -","1","0.5","HK2303","Shan Liu; Wei Han; Qin Zhang; Hong-Jun Zhu","2,5-Dibenzoylterephthalic acid dihydrate","Acta Crystallographica Section E","2007","63","9","o3874","o3874","10.1107/S1600536807036707","","","0.71073","MoKα","","0.0977","0.0614","","","0.1357","0.2","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215162","18.808","0.004","6.39","0.0013","18.925","0.004","90","","90.97","0.03","90","","2274.1","0.8","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2,2'-Bis[4-(benzyloxy)phenyl]propane","","- C29 H28 O2 -","- C29 H28 O2 -","- C116 H112 O8 -","4","0.5","HK2304","Wang, Guo-Wei; Wu, Wen-Yuan; Wang, Jin-Tang","2,2'-Bis[4-(benzyloxy)phenyl]propane","Acta Crystallographica Section E","2007","63","9","o3726","o3726","10.1107/S1600536807038044","","","0.71073","MoKα","","0.0714","0.0468","","","0.1122","0.1233","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215163","9.5461","0.0019","5.6297","0.0011","15.688","0.003","90","","90.7","0.03","90","","843","0.3","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,10-Diazonia-18-crown-6 dichloride","","- C12 H28 Cl2 N2 O4 -","- C12 H28 Cl2 N2 O4 -","- C24 H56 Cl4 N4 O8 -","2","0.5","HK2305","Mohammad Yousefi; Amani, Vahid; Hamid Reza, Khavasi","1,10-Diazonia-18-crown-6 dichloride","Acta Crystallographica Section E","2007","63","9","o3782","o3782","10.1107/S160053680703807X","","","0.71073","MoKα","","0.0357","0.03","","","0.0639","0.0657","","","","","","1.131","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215164","12.344","0.003","11.074","0.002","19.772","0.003","90","","102.286","0.003","90","","2640.9","0.9","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-(1,3-Benzodioxol-5-yl)-3,3,6,6-tetramethyl-10-p-tolyl-3,4,6,7- tetrahydroacridine-1,8(2H,5H,9H,10H)-dione","","- C31 H33 N O4 -","- C31 H33 N O4 -","- C124 H132 N4 O16 -","4","1","HK2306","Zi-Qiang Tang; Xu-Dong Cao; Bo Jiang; Chun-Mei Li; Dian-Xiang Zhou","9-(1,3-Benzodioxol-5-yl)-3,3,6,6-tetramethyl-10-<i>p</i>-tolyl-3,4,6,7-tetrahydroacridine-1,8(2<i>H</i>,5<i>H</i>,9<i>H</i>,10<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","9","o3811","o3811","10.1107/S1600536807038998","","","0.71073","MoKα","","0.1498","0.0507","","","0.1085","0.1629","","","","","","1.005","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215166","11.4232","0.0003","10.1303","0.0003","18.4399","0.0004","90","0.005","107.753","0.005","90","0.005","2032.26","0.11","298","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-[1,1'-(Propane-2,2-diyldiimino)diethylidene]diphenol","","- C21 H30 N2 O2 -","- C21 H30 N2 O2 -","- C84 H120 N8 O8 -","4","1","HK2308","Şahin, Ertan; Bilgiç, Rauf; Kenar, Adnan; Atakol, Orhan","2,2'-[1,1'-(Propane-2,2-diyldiimino)diethylidene]diphenol","Acta Crystallographica Section E","2007","63","9","o3770","o3770","10.1107/S1600536807039153","","","0.71073","MoKα","","","0.0609","","","","0.2069","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215168","15.081","0.002","9.4381","0.0014","35.102","0.003","90","","92.041","0.003","90","","4993.1","1.1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","7,7-Dimethyl-5-phenyl-10-(2-thienyl)-7,8-dihydro-5H-indeno[1,2-b]quinoline-\ 9,11(6H,10H)-dione dimethylformamide hemisolvate","","- C29.5 H26.5 N1.5 O2.5 S -","- C29.5 H26.5 N1.5 O2.5 S -","- C236 H212 N12 O20 S8 -","8","2","HK2311","Weijun Zhu; Chunmei Li; Yan Xiang","7,7-Dimethyl-5-phenyl-10-(2-thienyl)-7,8-dihydro-5<i>H</i>-indeno[1,2-<i>b</i>]quinoline-9,11(6<i>H</i>,10<i>H</i>)-dione dimethylformamide hemisolvate","Acta Crystallographica Section E","2007","63","9","o3910","o3910","10.1107/S1600536807041621","","","0.71073","MoKα","","0.1643","0.0669","","","0.1574","0.2157","","","","","","1.002","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2215171","10.3035","0.0013","17.894","0.004","12.584","0.002","90","","92.124","0.013","90","","2318.5","0.7","298","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[μ~2~-<i>N</i>,<i>N</i>'-bis(2-oxidobenzyl)propane-1,3-diamine]- 1κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>':2κ^2^<i>O</i>,<i>O</i>'; 2κ^2^<i>O</i>,<i>O</i>':3κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'- bis(<i>N</i>,<i>N</i>'-dimethylformamide)-1κ<i>O</i>,3κ<i>O</i>-di-μ~2~- formato-1:2κ^2^<i>O</i>:<i>O</i>';2:3κ^2^<i>O</i>:<i>O</i>'- dinickel(II)zinc(II)","","- C44 H60 N6 Ni2 O10 Zn -","- C44 H60 N6 Ni2 O10 Zn -","- C88 H120 N12 Ni4 O20 Zn2 -","2","0.5","HK2314","Tatar Yıldırım, Leyla; Ergun, Ümit","Bis[μ~2~-<i>N</i>,<i>N</i>'-bis(2-oxidobenzyl)propane-1,3-diamine]-1κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>':2κ^2^<i>O</i>,<i>O</i>';2κ^2^<i>O</i>,<i>O</i>':3κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'-bis(<i>N</i>,<i>N</i>'-dimethylformamide)-1κ<i>O</i>,3κ<i>O</i>-di-μ~2~-acetato-1:2κ^2^<i>O</i>:<i>O</i>';2:3κ^2^<i>O</i>:<i>O</i>'-dinickel(II)zinc(II)","Acta Crystallographica Section E","2007","63","9","m2424","m2425","10.1107/S160053680704144X","","","1.54184","CuKα","","0.1257","0.0559","","","0.1423","0.176","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215172","4.3132","0.0001","9.4355","0.0003","13.821","0.0004","87.736","0.002","84.396","0.002","86.166","0.002","558.23","0.03","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Ethyl 4-cyano-5-iodo-3-methylthiophene-2-carboxylate","","- C9 H8 I N O2 S -","- C9 H8 I N O2 S -","- C18 H16 I2 N2 O4 S2 -","2","1","HK2315","Moncol, Jan; Puterová, Zita; Végh, Daniel","Ethyl 4-cyano-5-iodo-3-methylthiophene-2-carboxylate","Acta Crystallographica Section E","2007","63","9","o3921","o3921","10.1107/S1600536807041451","","","0.71069","MoKα","","0.0442","0.0258","","","0.0651","0.0674","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215173","12.339","0.002","10.991","0.002","19.753","0.003","90","","102.054","0.002","90","","2619.8","0.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","9-(1,3-Benzodioxol-5-yl)-10-(4-chlorophenyl)-3,3,6,6-tetramethyl-\ 3,4,6,7-tetrahydroacridine-1,8(2H,5H,9H,10H)-dione","","- C30 H30 Cl N O4 -","- C30 H30 Cl N O4 -","- C120 H120 Cl4 N4 O16 -","4","1","HK2316","Quande Liu; Ziqiang Tang; Xihua Du","9-(1,3-Benzodioxol-5-yl)-10-(4-chlorophenyl)-3,3,6,6-tetramethyl-3,4,6,7-tetrahydroacridine-1,8(2<i>H</i>,5<i>H</i>,9<i>H</i>,10<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","9","o3924","o3924","10.1107/S160053680704175X","","","0.71073","MoKα","","0.1591","0.0688","","","0.1556","0.2004","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215174","18.712","0.003","13.801","0.001","8.3681","0.0012","90","","97.791","0.002","90","","2141.1","0.5","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","{[(5-Bromo-2-oxidophenyl)methyleneamino]methanesulfonato- κ^3^O,N,O'}(methanol-κO)(1,10-phenanthroline-κ^2^N,N')cadmium(II)","","- C21 H18 Br Cd N3 O5 S -","- C21 H18 Br Cd N3 O5 S -","- C84 H72 Br4 Cd4 N12 O20 S4 -","4","1","HY2072","Jin-Sheng Xu; Chun-Hua Zhang; Dai-Zhi Kuang; Yong-Lan Feng; Yun-Lin Peng","{[(5-Bromo-2-oxidophenyl)methyleneamino]methanesulfonato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}(methanol-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)","Acta Crystallographica Section E","2007","63","9","m2250","m2250","10.1107/S1600536807036811","","","0.71073","MoKα","","0.0823","0.0402","","","0.0885","0.106","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215175","9.3705","0.0006","9.9598","0.0007","15.031","0.001","81.334","0.002","72.739","0.002","76.015","0.001","1295.2","0.15","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[[(μ~3~-benzene-1,3-dicarboxylato-κ^4^O,O':O'':O''')(μ~4~- benzene-1,3-dicarboxylato-κ^5^O,O':O':O'':O''')(μ~2~-1,3-di-4- pyridylpropane-κ^2^N:N')dicobalt(II)]","","- C29 H22 Co2 N2 O8 -","- C29 H22 Co2 N2 O8 -","- C58 H44 Co4 N4 O16 -","2","1","HY2073","Tai-Hsing Tsao; Chia-Her Lin","Poly[(μ~3~-benzene-1,3-dicarboxylato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'':<i>O</i>''')(μ~4~-benzene-1,3-dicarboxylato-κ^5^<i>O</i>,<i>O</i>':<i>O</i>':<i>O</i>'':<i>O</i>''')(μ~2~-1,3-di-4-pyridylpropane-κ^2^<i>N</i>:<i>N</i>')dicobalt(II)]","Acta Crystallographica Section E","2007","63","9","m2342","m2342","10.1107/S1600536807038020","","","0.71073","MoKα","","0.0661","0.0366","","","0.0681","0.0762","","","","","","0.811","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215176","9.981","0.002","10.269","0.002","11.913","0.002","68.99","0.03","67.88","0.03","79.08","0.03","1053.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(2,2'-Bipyridine-κ^2^N,N')(3,5-dinitrosalicylato-κ^2^O^1^,O^2^)(pyridine- κN)copper(II)","","- C22 H15 Cu N5 O7 -","- C22 H15 Cu N5 O7 -","- C44 H30 Cu2 N10 O14 -","2","1","HY2074","Wen, De-Cai; Wu, Lin-Hua; Zhong, Chun-Long; Xie, Tian-Yang; Ta, Hong-Gui","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')(3,5-dinitrosalicylato-κ^2^<i>O</i>^1^,<i>O</i>^2^)(pyridine-κ<i>N</i>)copper(II)","Acta Crystallographica Section E","2007","63","9","m2362","m2363","10.1107/S1600536807039876","","","0.71073","MoKα","","0.0684","0.0521","","","0.1334","0.1489","","","","","","1.1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215177","8.17","0.004","14.25","0.007","21.171","0.009","90","","95.871","0.009","90","","2452","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Z)-Methyl 2-(1,3-dithian-2-ylidene)-4-(triphenylstannyl)but-3-enoate","","- C27 H26 O2 S2 Sn -","- C27 H26 O2 S2 Sn -","- C108 H104 O8 S8 Sn4 -","4","1","HY2075","Chao-Guang Zhu; Dong-Sheng Zhu; Xiao-Yan Wu; Yan-Hua Wang; Da-Feng Du","(<i>Z</i>)-Methyl 2-(1,3-dithian-2-ylidene)-4-(triphenylstannyl)but-3-enoate","Acta Crystallographica Section E","2007","63","9","m2346","m2346","10.1107/S160053680703961X","","","0.71073","MoKα","","0.0534","0.0295","","","0.0654","0.0746","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215178","11.266","0.002","9.711","0.001","15.024","0.002","90","","104.547","0.008","90","","1591","0.4","296","2","296","2","","","","","","","","4","C 1 c 1","C -2yc","9","2-Amino-6-methylpyridinium Ferulate","2-Amino-6-methylpyridinium 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate monohydrate","","- C16 H20 N2 O5 -","- C16 H20 N2 O5 -","- C64 H80 N8 O20 -","4","1","IM2026","Si-Feng Ni; Wen-Jie Feng; Hui Guo; Zhi-Min Jin","2-Amino-6-methylpyridinium 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate monohydrate","Acta Crystallographica Section E","2007","63","9","o3866","o3866","10.1107/S160053680704038X","","","0.71073","MoKα","","0.0419","0.0329","","","0.072","0.0746","","","","","","0.977","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215179","6.9065","0.0001","15.748","0.0004","15.838","0.0004","90","","90","","90","","1722.6","0.07","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-Benzyl 2-(6-methyl-2-pyridylaminocarbonyl)pyrrolidine-1-carboxylate","","- C19 H21 N3 O3 -","- C19 H21 N3 O3 -","- C76 H84 N12 O12 -","4","1","IM2028","Kang, Tai-Ran; Ng, Seik Weng; He, Long","(<i>S</i>)-Benzyl 2-(6-methyl-2-pyridylaminocarbonyl)pyrrolidine-1-carboxylate","Acta Crystallographica Section E","2007","63","9","o3847","o3847","10.1107/S1600536807036689","","","0.71073","MoKα","","0.0329","0.0322","","","0.0911","0.0918","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215180","14.767","0.001","7.7345","0.0007","13.964","0.001","90","","99.34","0.001","90","","1573.8","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Acetato-κ^2^O,O')(aqua-κO)[1-(2-pyridylmethylidene-κN)semicarbazide-\ κ^2^N^1^,O](thiocyanato-κS)cadmium(II) monohydrate","","- C10 H15 Cd N5 O5 S -","- C10 H15 Cd N5 O5 S -","- C40 H60 Cd4 N20 O20 S4 -","4","1","IM2029","Ling-Feng Deng; Gui-Quan Guo; Di-Chang Zhong; Ji-Hua Deng","(Acetato-κ^2^<i>O</i>,<i>O</i>')(aqua-κ<i>O</i>)[1-(2-pyridylmethylidene-κ<i>N</i>)semicarbazide-κ^2^<i>N</i>^1^,<i>O</i>](thiocyanato-κ<i>S</i>)cadmium(II) monohydrate","Acta Crystallographica Section E","2007","63","9","m2434","m2435","10.1107/S1600536807041487","","","0.71073","MoKα","","0.0447","0.028","","","0.0522","0.0563","","","","","","0.93","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215181","14.4164","0.0015","35.646","0.004","8.5214","0.0008","90","","90","","90","","4379","0.8","183","1","183","1","","","","","","","","5","P c c n","-P 2ab 2ac","56","","(Diphenyl sulfoxide)dimethyl(η^5^-pentamethylcyclopentadienyl)rhodium(III)","","- C24 H31 O Rh S -","- C24 H31 O Rh S -","- C192 H248 O8 Rh8 S8 -","8","1","IS2194","Andreas Decken; Annie Michaud; Sophie Mathiotte; Frédéric-Georges Fontaine","(Diphenyl sulfoxide)dimethyl(η^5^-pentamethylcyclopentadienyl)rhodium(III)","Acta Crystallographica Section E","2007","63","9","m2253","m2253","10.1107/S1600536807034204","","","0.71073","MoKα","","0.0686","0.0389","","","0.0902","0.0989","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215182","12.704","0.002","9.4917","0.0014","15.142","0.003","90","","94.612","0.004","90","","1819.9","0.5","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-Bromophenyl)-3-phenylbenzo[f]quinoline","","- C25 H16 Br N -","- C25 H16 Br N -","- C100 H64 Br4 N4 -","4","1","IS2196","Xiang-Shan Wang; Qing Li; Mei-Mei Zhang; Shu-Jiang Tu","2-(4-Bromophenyl)-3-phenylbenzo[<i>f</i>]quinoline","Acta Crystallographica Section E","2007","63","9","o3675","o3675","10.1107/S1600536807036975","","","0.7107","MoKα","","0.0493","0.0423","","","0.0814","0.0838","","","","","","1.169","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215183","9.7005","0.0003","12.9924","0.0004","13.4224","0.0003","90","","96.189","0.001","90","","1681.8","0.08","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Methyl 2-(2-methyl-1-phenyl sulfonylindole-3-yl)-2-oxoacetate","Methyl (2-methyl-1-phenylsulfonyl-1H-indol-3-yl)glyoxylate","","- C18 H15 N O5 S -","- C18 H15 N O5 S -","- C72 H60 N4 O20 S4 -","4","1","IS2199","G. Chakkaravarthi; V. Dhayalan; A. K. Mohanakrishnan; V. Manivannan","Methyl (2-methyl-1-phenylsulfonyl-1<i>H</i>-indol-3-yl)glyoxylate","Acta Crystallographica Section E","2007","63","9","o3673","o3673","10.1107/S1600536807036987","","","0.71073","MoKα","","0.0619","0.0429","","","0.118","0.1324","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215184","10.081","0.0009","9.9429","0.0009","13.2735","0.0012","90","","90.3","0.002","90","","1330.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[diaquabis(methanol)cobalt(II)]-μ-phthalato]","","- C10 H16 Co O8 -","- C10 H16 Co O8 -","- C40 H64 Co4 O32 -","4","1","IS2201","Liu, Cheng-Qi; Yang, Xin-Tao; An, Li-Li; Li, Rong; Shi, Jing-Min","<i>catena</i>-Poly[[diaquabis(methanol)cobalt(II)]-μ-phthalato]","Acta Crystallographica Section E","2007","63","9","m2311","m2311","10.1107/S1600536807038573","","","0.71073","MoKα","","0.0848","0.0765","","","0.1294","0.1327","","","","","","1.265","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215185","17.3315","0.0012","8.4507","0.0006","17.7874","0.0012","90","","94.652","0.001","90","","2596.6","0.3","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","rac-12a,11b-Diphenyl-1,2,3,4,5,11-hexahydro-2,3,4a,5a,10a,11a-hexaazabenz[f]\ indeno[2,1,8-ija]naphth[2,3-f]azulene-1,4,10-trione chloroform solvate","","- C26 H21 Cl3 N6 O3 -","- C26 H21 Cl3 N6 O3 -","- C104 H84 Cl12 N24 O12 -","4","1","KP2109","Hu, Sheng-Li; Zhang, Jian-Min; Yan, Gang; Wang, Shuai","<i>rac</i>-12a,11b-Diphenyl-1,2,3,4,5,11-hexahydro-2,3,4a,5a,10a,11a-hexaazabenz[<i>f</i>]indeno[2,1,8-<i>ija</i>]naphth[2,3-<i>f</i>]azulene-1,4,10-trione chloroform solvate","Acta Crystallographica Section E","2007","63","9","o3909","o3909","10.1107/S1600536807041591","","","0.71073","MoKα","","0.0668","0.0563","","","0.164","0.1711","","","","","","1.12","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2215186","15.3208","0.0013","10.6729","0.0009","14.8266","0.0012","90","","111.887","0.002","90","","2249.7","0.3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[[diaqualithium(I)]-μ-bis(1H-imidazol-1-yl)methane- κ^2^N^3^:N^3'^] chloride]","","- C7 H12 Cl Li N4 O2 -","- C7 H12 Cl Li N4 O2 -","- C56 H96 Cl8 Li8 N32 O16 -","8","1","KP2121","Hwang, In-Chul; Chang, Jeong Ah","<i>catena</i>-Poly[[[diaqualithium(I)]-μ-bis(1<i>H</i>-imidazol-1-yl)methane-κ^2^<i>N</i>^3^:<i>N</i>^3'^] chloride]","Acta Crystallographica Section E","2007","63","9","m2303","m2303","10.1107/S1600536807038706","","","0.71073","MoKα","","0.0464","0.0419","","","0.122","0.1259","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215187","5.5576","0.0006","7.3252","0.0009","9.3021","0.0011","75.065","0.002","84.298","0.002","71.503","0.002","346.93","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis(pyrazine-2-carboxylato-κ^2^N^1^,O^2^)nickel(II) dihydrate","","- C10 H10 N4 Ni O6 -","- C10 H10 N4 Ni O6 -","- C10 H10 N4 Ni O6 -","1","0.5","KP2122","Hao, Lujiang; Yu, Tongli","Bis(pyrazine-2-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>^2^)nickel(II) dihydrate","Acta Crystallographica Section E","2007","63","9","m2415","m2415","10.1107/S1600536807041268","","","0.71073","MoKα","","0.0429","0.0386","","","0.0937","0.0963","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215188","12.36","0.003","3.7323","0.001","27.575","0.007","90","","93.128","0.004","90","","1270.2","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Hydroxypyridinium 2,4,6-trinitrophenolate","","- C11 H8 N4 O8 -","- C11 H8 N4 O8 -","- C44 H32 N16 O32 -","4","1","KP2123","Zhong-Lu You; Wei-Min Dai; Yi-Qiao Hu","2-Hydroxypyridinium 2,4,6-trinitrophenolate","Acta Crystallographica Section E","2007","63","9","o3735","o3735","10.1107/S160053680703872X","","","0.71073","MoKα","","0.1284","0.0665","","","0.1434","0.1699","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215189","12.428","0.003","9.167","0.002","17.245","0.006","90","","108.85","0.01","90","","1859.3","0.9","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2,2'-Bipyridine-κ^2^N,N')(1-formyl-2-naphtholato-κ^2^O,O')(nitrato-\ κO)copper(II)","","- C21 H15 Cu N3 O5 -","- C21 H15 Cu N3 O5 -","- C84 H60 Cu4 N12 O20 -","4","1","KP2125","Bi-Rong Lian; Jun-Xia Li; Yi-Min Jiang; Bo-Lin Liang","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')(1-formyl-2-naphtholato-κ^2^<i>O</i>,<i>O</i>')(nitrato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2007","63","9","m2358","m2358","10.1107/S1600536807039669","","","0.71073","MoKα","","0.0468","0.034","","","0.0895","0.0932","","","","","","1.05","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215190","7.654","0.0008","10.2633","0.001","11.505","0.0012","102.622","0.002","92.777","0.002","92.852","0.002","879.21","0.16","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Diaqua[N,N'-bis(salicylidene)propylene-1,3-diiminato]manganese(III) chloride","diaqua{2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato}manganese(III) chloride","","- C17 H20 Cl Mn N2 O4 -","- C17 H20 Cl Mn N2 O4 -","- C34 H40 Cl2 Mn2 N4 O8 -","2","1","KP2127","Hwang, In-Chul; Ha, Kwang","Diaqua[<i>N</i>,<i>N</i>'-bis(salicylidene)propanediamine(2‒)]manganese(III) chloride","Acta Crystallographica Section E","2007","63","9","m2337","m2337","10.1107/S1600536807039475","","","0.71073","MoKα","","0.0457","0.0319","","","0.0658","0.0692","","","","","","0.946","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215191","8.9827","0.0006","24.8632","0.0016","7.5784","0.0005","90","","90","","90","","1692.55","0.19","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Aqua{6,6'-dimethoxy-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato- κ^4^O,N,N',O'}cobalt(II)","","- C18 H20 Co N2 O5 -","- C18 H20 Co N2 O5 -","- C72 H80 Co4 N8 O20 -","4","0.5","KP2129","Jiang, Gang-Biao; Zhang, Shu-Hua; Zeng, Ming-Hua","Aqua{6,6'-dimethoxy-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}cobalt(II)","Acta Crystallographica Section E","2007","63","9","m2383","m2383","10.1107/S1600536807039487","","","0.71073","MoKα","","0.048","0.0368","","","0.0927","0.101","","","","","","1.074","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215192","7.937","0.007","14.733","0.014","10.43","0.01","90","","107.513","0.017","90","","1163.1","1.9","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","cis-Diiodido(N,N,N',N'-tetramethylethylenediamine-κ^2^N,N')platinum(II)","","- C6 H16 I2 N2 Pt -","- C6 H16 I2 N2 Pt -","- C24 H64 I8 N8 Pt4 -","4","0.5","KP2130","Łakomska, Iwona; Dobrzańska, Liliana","<i>cis</i>-Diiodido(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine-κ^2^<i>N</i>,<i>N</i>')platinum(II)","Acta Crystallographica Section E","2007","63","9","m2367","m2367","10.1107/S1600536807039761","","","0.71073","MoKα","","0.0561","0.047","","","0.1014","0.1051","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215193","10.09","0.0016","8.8239","0.0015","12.846","0.002","90","","105.811","0.01","90","","1100.4","0.3","93.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-Bis[2-(4-pyridyl)ethyl]naphthalene-1,8:4,5-bis(dicarboximide)","","- C28 H20 N4 O4 -","- C28 H20 N4 O4 -","- C56 H40 N8 O8 -","2","0.5","KP2131","Tsukada, Yuichiro; Hirao, Keita; Mizuguchi, Jin","<i>N</i>,<i>N</i>'-Bis[2-(4-pyridyl)ethyl]naphthalene-1,8:4,5-bis(dicarboximide)","Acta Crystallographica Section E","2007","63","9","o3872","o3872","10.1107/S1600536807040767","","","1.54187","CuKα","","","0.0367","","","","0.1225","","","","","","0.936","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215194","26.286","0.004","32.908","0.005","11.1681","0.0017","90","","90","","90","","9661","3","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","Bis{2,4-dibromo-6-[(2-oxidoethylimino)methyl]phenolato-κ^3^O,N,O'}manganese(IV) methanol hemisolvate monohydrate","","- C18.4 H18 Br4 Mn N2 O5.5 -","- C18.5 H18 Br4 Mn N2 O5.5 -","- C296 H288 Br64 Mn16 N32 O88 -","16","1","KP2132","Jiang Gang-Biao; Zhang, Shu-Hua; Zeng, Ming-Hua","Bis{2,4-dibromo-6-[(2-oxidoethylimino)methyl]phenolato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}manganese(IV) methanol hemisolvate monohydrate","Acta Crystallographica Section E","2007","63","9","m2418","m2419","10.1107/S1600536807041037","","","0.71073","MoKα","","0.0682","0.0511","","","0.1271","0.1334","","","","","","1.048","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2215195","12.1767","0.0003","12.1767","0.0003","41.055","0.003","90","","90","","90","","6087.3","0.5","193","2","193","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Diaqua[2,6-bis(2,6-diethyl-4-sulfonatophenyl)-3,5-dimethyl-2,6-\ diazoniaheptan-4-ido]sodium(I)","","- C25 H37 N2 Na O8 S2 -","- C25 H33 N2 Na O8 S2 -","- C200 H264 N16 Na8 O64 S16 -","8","0.5","LH2437","Guo, Xu-Ming; Wang, Qi-Bao; Harms, Klaus; Sun, Hong-Jian","Diaqua[2,6-bis(2,6-diethyl-4-sulfonatophenyl)-3,5-dimethyl-2,6-diazoniaheptan-4-ido]sodium(I)","Acta Crystallographica Section E","2007","63","9","m2316","m2316","10.1107/S1600536807038305","","","0.71073","MoKα","","0.1091","0.0641","","","0.1689","0.1863","","","","","","1.012","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215196","12.6568","0.0002","14.7729","0.0003","15.0674","0.0003","68.71","0.001","83.896","0.001","78.303","0.001","2568.84","0.09","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[aqua(1,10-phenanthroline-κ^2^N,N')cadmium(II)]-μ- o-phenylenediacetato-κ^2^O,O':κO''-[bis(1,10-phenanthroline- κ^2^N,N')cadmium(II)]-μ-o-phenylenediacetato-κO:κ^2^O',O''] ethanol 0.79-solvate 3.05-hydrate]","","- C57.58 H52.85 Cd2 N6 O12.85 -","- C57.584 H50.752 Cd2 N6 O12.846 -","- C115.168 H101.504 Cd4 N12 O25.692 -","2","1","LH2456","Yang, Yan; Zeng, Ming-Hua; Zhang, Shu-Hua; Liang, Hong","<i>catena</i>-Poly[[[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ-<i>o</i>-phenylenediacetato-κ^2^<i>O</i>,<i>O</i>':κ<i>O</i>''-[bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ-<i>o</i>-phenylenediacetato-κ<i>O</i>:κ^2^<i>O</i>',<i>O</i>''] ethanol 0.79-solvate 3.05-hydrate]","Acta Crystallographica Section E","2007","63","9","m2392","m2392","10.1107/S1600536807040214","","","0.71073","MoKα","","0.0308","0.0254","","","0.0844","0.0929","","","","","","1.007","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2215197","8.7881","0.0002","9.7924","0.0002","15.8527","0.0003","90","","90","","90","","1364.23","0.05","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Trichlormethiazide","6-chloro-3-(dichloromethyl)-3,4-dihydro-2<i>H</i>-1,2,4-benzothiadazine- 7-sulfonamide 1,1-dioxide","","- C8 H8 Cl3 N3 O4 S2 -","- C8 H8 Cl3 N3 O4 S2 -","- C32 H32 Cl12 N12 O16 S8 -","4","1","LH2457","Fernandes, Philippe; Leech, Charlotte K.; Johnston, Andrea; Shankland, Kenneth; David, William I. F.; Shankland, Norman; Florence, Alastair J.","(<i>S</i>)-Trichlormethiazide","Acta Crystallographica Section E","2007","63","9","o3685","o3685","10.1107/S1600536807034137","","","0.71073","MoKα","","0.0334","0.0318","","","0.0781","0.0788","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215198","13.4112","0.0011","5.1816","0.0004","19.422","0.0017","90","","105.007","0.001","90","","1303.63","0.19","290","2","290","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Benzyl-6-methyl-3,4-dihydro-2H-1,3-benzoxazine","","- C16 H17 N O -","- C16 H17 N O -","- C64 H68 N4 O4 -","4","1","LH2465","Xiu-Ling Chen; Ming-Hu Wu","3-Benzyl-6-methyl-3,4-dihydro-2<i>H</i>-1,3-benzoxazine","Acta Crystallographica Section E","2007","63","9","o3684","o3684","10.1107/S1600536807037348","","","0.71073","MoKα","","0.0818","0.0562","","","0.1363","0.1496","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215199","7.3871","0.0015","9.3453","0.0019","9.4942","0.0019","82.93","0.03","83.73","0.03","72.24","0.03","617.7","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Hydrazinediium bis(3,5,6-tricarboxypyrazine-2-carboxylate) hexahydrate","","- C16 H24 N6 O22 -","- C16 H24 N6 O22 -","- C16 H24 N6 O22 -","1","0.5","LH2467","Starosta, Wojciech; Leciejewicz, Janusz","Hydrazinediium bis(3,5,6-tricarboxypyrazine-2-carboxylate) hexahydrate","Acta Crystallographica Section E","2007","63","9","o3734","o3734","10.1107/S1600536807038135","","","0.71073","MoKα","","0.0675","0.0428","","","0.1233","0.138","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215200","11.0782","0.0019","9.6177","0.0019","13.352","0.003","90","","96.511","0.009","90","","1413.4","0.5","295","2","295","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","trans-3-(2-Chloro-3-quinolyl)-1-phenyl-2,3-epoxypropan-1-one","","- C18 H12 Cl N O2 -","- C18 H12 Cl N O2 -","- C72 H48 Cl4 N4 O8 -","4","1","LH2468","Raouf Boulcina; Sofiane Bouacida; Thierry Roisnel; Abdelmadjid Debache","<i>trans</i>-3-(2-Chloro-3-quinolyl)-1-phenyl-2,3-epoxypropan-1-one","Acta Crystallographica Section E","2007","63","9","o3795","o3796","10.1107/S1600536807039335","","","0.71073","MoKα","","0.0686","0.0439","","","0.0989","0.1093","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215201","12.238","0.006","7.459","0.004","12.124","0.006","90","","110.231","0.007","90","","1038.4","0.9","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N-(4-pyridyl)benzenesulfonamide","N-(4-pyridinio)benzenesulfonamidate","","- C11 H10 N2 O2 S -","- C11 H10 N2 O2 S -","- C44 H40 N8 O8 S4 -","4","1","LH2469","Yu, Hai-Jun; Chen, Jin-Zhe; Simpson, Jim; Li, Jiang-Sheng; Bai, Guo-Yi","A zwitterionic form of <i>N</i>-(4-pyridyl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","9","o3720","o3720","10.1107/S1600536807037713","","","0.71073","MoKα","","0.0595","0.0443","","","0.1134","0.1239","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215202","9.2349","0.0006","10.429","0.0007","11.5344","0.0008","100.5","0.001","101.763","0.001","99.417","0.001","1045.83","0.12","296","2","299","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrakis(benzimidazol-2-ylmethyl)\ ethane-1,2-diamine methanol tetrasolvate dihydrate","","- C38 H52 N10 O6 -","- C38 H52 N10 O6 -","- C38 H52 N10 O6 -","1","0.5","LH2470","Ya-Mei Pei; Xiang-Gao Meng; Chun-Shan Zhou","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetrakis(benzimidazol-2-ylmethyl)ethane-1,2-diamine methanol tetrasolvate dihydrate","Acta Crystallographica Section E","2007","63","9","o3762","o3762","10.1107/S1600536807038111","","","0.71073","Mokα","","0.0852","0.0586","","","0.1496","0.1627","","","","","","1.011","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215203","10.289","0.002","14.054","0.005","17.005","0.004","90","","103.433","0.019","90","","2391.7","1.1","293","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis[μ~2~-2,2'-dimethyl-N,N'-bis(2-oxidobenzyl)propane-1,3-diamine]- 1κ^4^O,N,N',O':2κ^2^O,O';2κ^2^O,O':3κ^4^O,N,N',O'-bis(N,N'- dimethylformamide)-1κO,3κO-di-μ~2~-formato-1:2κ^2^O:O';2:3κ^2^O:O'- trinickel(II)","","- C46 H64 N6 Ni3 O10 -","- C46 H64 N6 Ni3 O10 -","- C92 H128 N12 Ni6 O20 -","2","0.5","LH2472","Tatar Yıldırım, Leyla; Atakol, Orhan; Kavak, Gülten","Bis[μ~2~-2,2'-dimethyl-<i>N</i>,<i>N</i>'-bis(2-oxidobenzyl)propane-1,3-diamine]-1κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>':2κ^2^<i>O</i>,<i>O</i>';2κ^2^<i>O</i>,<i>O</i>':3κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'-bis(<i>N</i>,<i>N</i>'-dimethylformamide)-1κ<i>O</i>,3κ<i>O</i>-di-μ~2~-formato-1:2κ^2^<i>O</i>:<i>O</i>';2:3κ^2^<i>O</i>:<i>O</i>'-trinickel(II)","Acta Crystallographica Section E","2007","63","9","m2403","m2404","10.1107/S1600536807040184","","","1.54184","CuKα","","0.1863","0.0564","","","0.1182","0.1503","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215204","6.0647","0.0002","7.1798","0.0002","10.1956","0.0002","90","","109.195","0.002","90","","419.27","0.02","150","","150","","","","","","","","","4","P 1 21 1","P 2yb","4","","(2<i>R</i>,3<i>S</i>)-3-Hydroxy-<i>N</i>,<i>N</i>-dimethylproline monohydrate","","- C7 H15 N O4 -","- C7 H15 N O4 -","- C14 H30 N2 O8 -","2","1","LH2473","Jenkinson, Sarah F.; Cowley, Andrew; Atsushi Kato; Noriko Kato; Jackie Hollinshead; Robert J. Nash; Kathrine V. Booth; George W. J. Fleet","(2<i>R</i>,3<i>S</i>)-3-Hydroxy-<i>N</i>,<i>N</i>-dimethylproline monohydrate","Acta Crystallographica Section E","2007","63","9","o3717","o3717","10.1107/S1600536807038123","","","1.5418","CuKα","","0.0334","0.0328","","0.039","0.0385","0.0385","","","","","","1.076","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215205","14.922","0.001","7.0382","0.0004","14.03","0.001","90","","98.634","0.002","90","","1456.79","0.17","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraaquabis(nicotinamide-κN)cadmium(II) bis(4-formylbenzoate)","","- C28 H30 Cd N4 O12 -","- C28 H30 Cd N4 O12 -","- C56 H60 Cd2 N8 O24 -","2","0.5","LH2474","Deng, Zhao-Peng; Gao, Shan; Ng, Seik Weng","Tetraaquabis(nicotinamide-κ<i>N</i>)cadmium(II) bis(4-formylbenzoate)","Acta Crystallographica Section E","2007","63","9","m2323","m2323","10.1107/S160053680703927X","","","0.71073","MoKα","","0.0569","0.048","","","0.1449","0.151","","","","","","1.141","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215206","8.9815","0.0013","10.4501","0.0016","10.7488","0.0016","97.639","0.002","110.18","0.003","98.242","0.002","918.9","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","Bis(4-methylpyridinium) pentachloridoantimonate(III)","","- C12 H16 Cl5 N2 Sb -","- C12 H16 Cl5 N2 Sb -","- C24 H32 Cl10 N4 Sb2 -","2","1","LH2475","Wen-Jie Feng; Xin-Jü Ma; Feng Zhang; Yi-Chao Yuan; Zhi-Min Jin","Bis(4-methylpyridinium) pentachloridoantimonate(III)","Acta Crystallographica Section E","2007","63","9","m2375","m2375","10.1107/S1600536807040196","","","0.71073","MoKα","","0.0293","0.0271","","","0.0692","0.0707","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215207","7.9121","0.0003","15.5258","0.0007","14.2523","0.0006","90","","103.621","0.003","90","","1701.54","0.13","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(acetylacetonato)oxidopyridinevanadium(IV)","","- C15 H19 N O5 V -","- C15 H19 N O5 V -","- C60 H76 N4 O20 V4 -","4","0.5","LH2476","Silva, Rubia M. S. da; Spiazzi, Cristiano C.; Bortolotto, Ricardo; Burrow, Robert A.","Redetermination of bis(acetylacetonato)oxidopyridinevanadium(IV)","Acta Crystallographica Section E","2007","63","9","m2422","m2422","10.1107/S1600536807039323","","","0.71073","MoKα","","0.0605","0.0391","","","0.105","0.1161","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215208","15.6156","0.0017","7.7312","0.0015","9.8876","0.0009","90","","98.531","0.008","90","","1180.5","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1-(2-Bromo-5-methoxybenzoyl)thiosemicarbazide","","- C9 H10 Br N3 O2 S -","- C9 H10 Br N3 O2 S -","- C36 H40 Br4 N12 O8 S4 -","4","1","LH2477","Sarojini, B. K.; Narayana, B.; Veena, K.; Yathirajan, H. S.; Bolte, Michael","1-(2-Bromo-5-methoxybenzoyl)thiosemicarbazide","Acta Crystallographica Section E","2007","63","9","o3844","o3845","10.1107/S1600536807039803","","","0.71073","MoKα","","0.0399","0.0303","","","0.068","0.0709","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215209","6.905","0.0003","13.9594","0.0007","15.6665","0.0008","90","","90","","90","","1510.09","0.13","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-Methylimidazolium 3-carboxy-4-hydroxybenzenesulfonate dihydrate","","- C11 H16 N2 O8 S -","- C11 H16 N2 O8 S -","- C44 H64 N8 O32 S4 -","4","1","LH2478","Hou, Hai-Yun","2-Methylimidazolium 3-carboxy-4-hydroxybenzenesulfonate dihydrate","Acta Crystallographica Section E","2007","63","9","o3868","o3868","10.1107/S160053680704069X","","","0.71073","MoKα","","0.0567","0.0493","","","0.1195","0.1325","","","","","","1.109","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215210","7.37","0.002","18.375","0.005","9.84","0.003","90","","96.363","0.004","90","","1324.4","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,3-Dimethoxy-6,7-methylenedioxyphenanthrene","","- C17 H14 O4 -","- C17 H14 O4 -","- C68 H56 O16 -","4","1","LH2479","Yuan-Xing Wang; Chong-Bo Liu; Zhi-Jie Fang; Hui-Liang Wen; Ming-Yong Xie","2,3-Dimethoxy-6,7-methylenedioxyphenanthrene","Acta Crystallographica Section E","2007","63","9","o3905","o3905","10.1107/S1600536807041116","","","0.71073","MoKα","","0.151","0.0488","","","0.0732","0.0957","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215211","14.952","0.004","7.1736","0.0018","25.787","0.006","90","","94.571","0.007","90","","2757.1","1.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3,8,12,13-Pentamethoxy-5H-dibenzo[c,n]acridin-7(6H)-one toluene solvate","","- C33 H33 N O6 -","- C33 H33 N O6 -","- C132 H132 N4 O24 -","4","1","LH2480","Marlon R Lutz Jr; Matthias Zeller; Daniel P. Becker","2,3,8,12,13-Pentamethoxy-5<i>H</i>-dibenzo[<i>c</i>,<i>n</i>]acridin-7(6<i>H</i>)-one toluene solvate","Acta Crystallographica Section E","2007","63","9","o3857","o3858","10.1107/S1600536807040548","","","0.71073","MoKα","","0.105","0.0759","","","0.1812","0.1987","","","","","","1.081","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215212","10.2696","0.0003","6.8543","0.0002","23.3599","0.0006","90","","98.932","0.002","90","","1624.38","0.08","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","10,11-Dihydrocarbamazepine‒dimethyl sulfoxide (1/1)","10,11-dihydro-<i>5H</i>-dibenz[<i>b,f</i>]azepine-5-carboxamide‒dimethyl sulfoxide (1/1)","","- C17 H20 N2 O2 S -","- C17 H20 N2 O2 S -","- C68 H80 N8 O8 S4 -","4","1","LH2481","Johnston, Andrea; Florence, Alastair J.; Shankland, Kenneth; Leech, Charlotte K.; Shankland, Norman; Fernandes, Philippe","10,11-Dihydrocarbamazepine‒dimethyl sulfoxide (1/1)","Acta Crystallographica Section E","2007","63","9","o3918","o3919","10.1107/S1600536807041104","","","0.71073","MoKα","","0.0576","0.0421","","","","0.1137","","","","","","1.055","","","","has coordinates,has disorder","176787","2020-10-21","18:00:00",""
"2215213","6.1374","0.0001","10.3379","0.0002","10.634","0.0002","107.269","0.001","98.391","0.001","96.098","0.001","629.36","0.02","90","0.2","90","0.2","","","","","","","","5","P -1","-P 1","2","","rac-(Z)-2-(2,4-Dichlorobenzylidene)-1-azabicyclo[2.2.2]octan-3-ol","","- C14 H15 Cl2 N O -","- C14 H15 Cl2 N O -","- C28 H30 Cl4 N2 O2 -","2","1","LH2483","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","<i>rac</i>-(<i>Z</i>)-2-(2,4-Dichlorobenzylidene)-1-azabicyclo[2.2.2]octan-3-ol","Acta Crystallographica Section E","2007","63","9","o3907","o3907","10.1107/S1600536807041128","","","0.71073","MoKα","","0.0418","0.0342","","","0.0843","0.0886","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215214","6.1892","0.0001","8.8706","0.0002","25.1693","0.0005","90","","96.0631","0.0008","90","","1374.11","0.05","90","0.2","90","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","rac-(<i>Z</i>)-2-(1-Naphthylmethylene)-1-azabicyclo[2.2.2]octan-3-ol","","- C18 H19 N O -","- C18 H19 N O -","- C72 H76 N4 O4 -","4","1","LH2484","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","<i>rac</i>-(<i>Z</i>)-2-(1-Naphthylmethylene)-1-azabicyclo[2.2.2]octan-3-ol","Acta Crystallographica Section E","2007","63","9","o3915","o3915","10.1107/S1600536807041682","","","0.71073","MoKα","","0.079","0.0474","","","0.1113","0.1264","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215215","10.1178","0.0004","11.9884","0.0005","12.3722","0.0004","94.713","0.002","90.775","0.002","105.608","0.002","1439.48","0.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","κ^2^<i>O</i>:<i>O</i>)tetraisopropoxytetra-μ~3~-oxo-tetratitaniumdizirconium","","- C38 H72 O30 Ti4 Zr2 -","- C38 H72 O30 Ti4 Zr2 -","- C38 H72 O30 Ti4 Zr2 -","1","0.5","LH2485","Lucky, Rahima A.; Sui, Ruohong; Charpentier, Paul A.; Jennings, Michael C.","Decakis(μ~2~-acetato-κ^2^<i>O</i>:<i>O</i>')bis(μ~2~-isopropoxy-κ^2^<i>O</i>:<i>O</i>)tetraisopropoxytetra-μ~3~-oxo-tetratitaniumdizirconium","Acta Crystallographica Section E","2007","63","9","m2429","m2430","10.1107/S1600536807041694","","","0.71073","MoKα","","0.0565","0.0428","","","0.1073","0.1161","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215216","13.4675","0.0008","12.3257","0.0007","16.2266","0.0006","90","","111.771","0.003","90","","2501.4","0.2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Aza-1-azoniabicyclo[2.2.2]octane eosinide","","- C26 H20 Br4 N2 O5 -","- C26 H20 Br4 N2 O5 -","- C104 H80 Br16 N8 O20 -","4","1","LH2486","Harrison, William T. A.; Ramadevi, Palani; P. G. Seethalakshmi; Kumaresan, Sudalaiandi","4-Aza-1-azoniabicyclo[2.2.2]octane eosinide","Acta Crystallographica Section E","2007","63","9","o3911","o3911","10.1107/S1600536807041396","","","0.70173","MoKα","","0.1759","0.0956","","","0.1277","0.1487","","","","","","1.358","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215217","13.034","0.002","7.099","0.002","22.468","0.003","90","","97.11","0.03","90","","2062.9","0.7","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","pyrimethaminium 3,5-dinitrobenzoate","2,4-diamino-5-(4-chlorophenyl)-6-ethylpyrimidin-1-ium 3,5-dinitrobenzoate","","- C19 H17 Cl N6 O6 -","- C19 H17 Cl N6 O6 -","- C76 H68 Cl4 N24 O24 -","4","1","LW2025","Annamalai Subashini; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","Hydrogen-bonding patterns in pyrimethaminium 3,5-dinitrobenzoate","Acta Crystallographica Section E","2007","63","9","o3775","o3775","10.1107/S1600536807038342","","","1.54178","CuKα","","0.0858","0.0491","","","0.1223","0.1436","","","","","","0.912","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215218","9.9921","0.0005","10.2126","0.0005","11.5332","0.0006","70.716","0.001","77.98","0.001","87.355","0.001","1086.19","0.1","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","Nevirapininium picrate","","- C21 H17 N7 O8 -","- C21 H17 N7 O8 -","- C42 H34 N14 O16 -","2","1","LW2026","Harrison, William T. A.; Sreevidya, T. V.; Narayana, B.; Sarojini, B. K.; Yathirajan, H. S.","Nevirapininium picrate","Acta Crystallographica Section E","2007","63","9","o3871","o3871","10.1107/S1600536807040731","","","0.71073","MoKα","","0.0612","0.042","","","0.1114","0.12","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215219","5.4499","0.0005","16.883","0.002","20.042","0.002","90","","95.321","0.008","90","","1836.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(1<i>R</i>,2<i>R</i>)/(1<i>S</i>,2<i>S</i>)-1,2-\ Bis(2-hydroxyphenyl)ethylenediammonium dibromide monohydrate","","- C14 H20 Br2 N2 O3 -","- C14 H18 Br2 N2 O2.999 -","- C56 H72 Br8 N8 O11.996 -","4","1","LW2027","Kim, Hae-Jo; Lough, Alan J.; Chin, Jik","(1<i>R</i>,2<i>R</i>)/(1<i>S</i>,2<i>S</i>)-1,2-Bis(2-hydroxyphenyl)ethylenediammonium dibromide monohydrate","Acta Crystallographica Section E","2007","63","9","o3901","o3901","10.1107/S1600536807040810","","","0.71073","MoKα","","0.0871","0.0522","","","0.133","0.1526","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215220","15.1489","0.0002","6.5736","0.0001","15.3111","0.0002","90","","93.557","0.001","90","","1521.79","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[[tetra-μ~2~-aqua-diaqua-μ~6~-oxalato-barium(II)] 2,4,6-trinitrophenolate monohydrate]","","- C14 H24 Ba2 N6 O28 -","- C14 H24 Ba2 N6 O28 -","- C28 H48 Ba4 N12 O56 -","2","0.5","LX2010","Peng-Zhi Hong; Wen-Dong Song; Zao-He Wu","Poly[[tetra-μ~2~-aqua-diaqua-μ~6~-oxalato-barium(II)] 2,4,6-trinitrophenolate monohydrate]","Acta Crystallographica Section E","2007","63","9","m2296","m2296","10.1107/S1600536807038159","","","0.71073","MoKα","","0.031","0.0237","","","0.0523","0.0555","","","","","","1.027","","","","has coordinates,has Fobs","223448","2020-10-21","18:00:00",""
"2215221","9.046","0.004","5.1579","0.0018","6.103","0.003","90","","118.691","0.012","90","","249.79","0.19","113","2","113","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Strontium magnesium borate","Distrontium magnesium diborate","","- B2 Mg O6 Sr2 -","- B2 Mg O6 Sr2 -","- B4 Mg2 O12 Sr4 -","2","0.25","MG2030","Chen, Guo-Jun; Wu, Yi-Cheng; Fu, Pei-Zhen","Strontium magnesium borate, Sr~2~Mg(BO~3~)~2~","Acta Crystallographica Section E","2007","63","9","i175","i175","10.1107/S1600536807037099","","","0.7107","MoKα","","0.0836","0.0653","","","0.148","0.1532","","","","","","1.138","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215222","4.0049","0.0006","4.0049","0.0006","23.055","0.007","90","","90","","120","","320.24","0.12","150","2","150","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","Strontium nitride iodide","Distrontium nitride iodide","","- I N Sr2 -","- I N Sr2 -","- I3 N3 Sr6 -","3","0.0833333","MG2033","Bailey, Andrew S.; Gregory, Duncan H.; Hubberstey, Peter; Wilson, Claire","Crystal growth and redetermination of strontium nitride iodide, Sr~2~NI","Acta Crystallographica Section E","2007","63","9","i177","i177","10.1107/S1600536807039797","","","0.71073","MoKα","","0.061","0.0608","","","0.192","0.1922","","","","","","1.205","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215223","9.9251","0.0017","13.362","0.0018","15.9435","0.0019","78.435","0.015","84.99","0.017","69.339","0.018","1937.9","0.5","295","","295","1","","","","","","","","7","P -1","-P 1","2","","Bis(4,4'-di-<i>tert</i>-butyl-2,2'-bipyridine-κ^2^N,N')silver(I) trifluoromethanesulfonate","","- C37 H48 Ag F3 N4 O3 S -","- C37 H48 Ag F3 N4 O3 S -","- C74 H96 Ag2 F6 N8 O6 S2 -","2","1","NC2048","Tobias Fischer; Manfred Zabel; Hartmut Yersin; Uwe Monkowius","Bis(4,4'-di-<i>tert</i>-butyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')silver(I) trifluoromethanesulfonate","Acta Crystallographica Section E","2007","63","9","m2364","m2364","10.1107/S1600536807036835","","","0.71073","MoKα","","0.069","0.0474","","","0.1302","0.1397","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215224","11.1697","0.0004","11.8605","0.0004","12.4512","0.0004","82.838","0.003","64.605","0.002","65.588","0.002","1354.13","0.09","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","3',6'-Bis(diethylamino)-2-propylspiro[isoindoline-1,9'-xanthen]-3-one","","- C31 H37 N3 O2 -","- C31 H37 N3 O2 -","- C62 H74 N6 O4 -","2","1","NC2050","Li-Zhu Zhang; Xiao-Jun Peng; Shang Gao; Xiao-Qiang Chen","3',6'-Bis(diethylamino)-2-propylspiro[isoindoline-1,9'-xanthen]-3-one","Acta Crystallographica Section E","2007","63","9","o3677","o3677","10.1107/S1600536807037221","","","0.71073","MoKα","","0.0967","0.061","","","0.1761","0.2006","","","1.066","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215225","11.7341","0.0017","14.9","0.002","16.235","0.002","90","","106.582","0.002","90","","2720.4","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[4',4''-Dichloro-7,12-diphenyl-5,6:13,14-dibenzo-1,4,8,11- tetraazacyclopentadeca-5,7,11,13-tetraene-2,3-dione(2-)]nickel(II)","","- C31 H22 Cl2 N4 Ni O2 -","- C31 H22 Cl2 N4 Ni O2 -","- C124 H88 Cl8 N16 Ni4 O8 -","4","1","NC2051","Zhang, Rui-Hong; Yang, Guang-Ming","[4',4''-Dichloro-7,12-diphenyl-5,6:13,14-dibenzo-1,4,8,11-tetraazacyclopentadeca-5,7,11,13-tetraene-2,3-dione(2‒)]nickel(II)","Acta Crystallographica Section E","2007","63","9","m2335","m2335","10.1107/S1600536807039451","","","0.71073","MoKα","","0.0733","0.0378","","","0.0796","0.0945","","","","","","1.031","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215226","19.48","0.003","8.6889","0.0013","14.085","0.002","90","","122.361","0.015","90","","2013.8","0.6","165","2","165","2","","","","","","","","5","C 1 2 1","C 2y","5","","(R)-(+)-[μ-2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene-\ κ^2^P:P']bis[chloridogold(I)] dichloromethane solvate","","- C45 H34 Au2 Cl4 P2 -","- C45 H34 Au2 Cl4 P2 -","- C90 H68 Au4 Cl8 P4 -","2","0.5","NC2053","Bats, Jan W.; Hamzic, Melissa; Hashmi, A. Stephen K.","(<i>R</i>)-(+)-[μ-2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene-κ^2^<i>P</i>:<i>P</i>']bis[chloridogold(I)] dichloromethane solvate","Acta Crystallographica Section E","2007","63","9","m2344","m2344","10.1107/S1600536807039529","","","0.71073","MoKα","","0.0585","0.038","","","0.0734","0.0772","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215227","7.911","0.002","10.851","0.002","18.482","0.004","100.88","0.03","90.26","0.02","98.08","0.03","1541.8","0.6","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","Tris(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')copper(II) bis(tetrafluoridoborate)","","- C30 H24 B2 Cu F8 N6 -","- C30 H24 B2 Cu F8 N6 -","- C60 H48 B4 Cu2 F16 N12 -","2","1","NG2301","Huang, Wei","Tris(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')copper(II) bis(tetrafluoridoborate)","Acta Crystallographica Section E","2007","63","9","m2254","m2254","10.1107/S1600536807037002","","","0.71073","MoKα","","0.0661","0.0609","","","0.1555","0.1595","","","","","","1.065","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2215228","9.0115","0.0001","10.7771","0.0002","12.9018","0.0002","94.338","0.001","103.963","0.001","109.851","0.001","1126.55","0.03","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","Aqua{6,6-dimethyl-2,2'-[o-phenylenebis(nitrilomethylidyne)]diphenolato-<i>κ^4^O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}zinc(II) chloroform solvate","","- C23 H21 Cl3 N2 O3 Zn -","- C23 H21 Cl3 N2 O3 Zn -","- C46 H42 Cl6 N4 O6 Zn2 -","2","1","NG2303","Naser Eltaher Eltayeb; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun; Kamarulazizi Ibrahim","Aqua{6,6-dimethyl-2,2'-[<i>o</i>-phenylenebis(nitrilomethylidyne)]diphenolato-<i>{κ</i>^4^O},<i>N</i>,<i>N</i>',<i>O</i>'}zinc(II) chloroform solvate","Acta Crystallographica Section E","2007","63","9","m2294","m2295","10.1107/S1600536807038536","","","0.71073","MoKα","","0.0556","0.0366","","","0.0695","0.0765","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215229","9.8715","0.0013","8.394","0.0007","11.8276","0.0016","90","","91.557","0.011","90","","979.7","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(2,6-Dimethylphenyl)thiourea","","- C9 H12 N2 S -","- C9 H12 N2 S -","- C36 H48 N8 S4 -","4","1","NG2304","Sarojini, B. K.; Narayana, B.; Sunil, K.; Yathirajan, H. S.; Bolte, Michael","1-(2,6-Dimethylphenyl)thiourea","Acta Crystallographica Section E","2007","63","9","o3754","o3754","10.1107/S1600536807039165","","","0.71073","MoKα","","0.0385","0.0325","","","0.084","0.0865","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215230","12.4401","0.0003","5.748","0.0002","11.042","0.0003","90","","90","","90","","789.57","0.04","100","2","100","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","Morpholinium tetraoxidorhenate(VII)","","- C4 H10 N O5 Re -","- C4 H10 N O5 Re -","- C16 H40 N4 O20 Re4 -","4","1","NG2306","Grigoriev, Mikhail S.; German, Konstantin E.; Maruk, Alesia Ya.","Morpholinium tetraoxidorhenate(VII)","Acta Crystallographica Section E","2007","63","9","m2355","m2355","10.1107/S1600536807039608","","","0.71073","MoKα","","0.0107","0.0096","","","0.0197","0.0199","","","","","","0.944","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215231","9.4452","0.0007","10.0151","0.0007","32.566","0.002","90","","90","","90","","3080.6","0.4","100","2","100","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Tetraaqualithium(I) bis(tropolonato-κ^2^O,O')lithate(I)","","- C14 H18 Li2 O8 -","- C14 H18 Li2 O8 -","- C112 H144 Li16 O64 -","8","0.25","NG2307","Steyl, Gideon","Tetraaqualithium(I) bis(tropolonato-κ^2^<i>O</i>,<i>O</i>')lithate(I)","Acta Crystallographica Section E","2007","63","9","m2343","m2343","10.1107/S1600536807039657","","","0.71073","MoKα","","0.0635","0.0549","","","0.1427","0.1567","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215232","9.8733","0.0007","9.4382","0.0007","9.7356","0.0006","90","","118.785","0.002","90","","795.12","0.1","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Coumarin-3-carboxylic acid","2-oxo-2H-1-benzopyran-3-carboxylic acid","","- C10 H6 O4 -","- C10 H6 O4 -","- C40 H24 O16 -","4","1","NG2309","Sparkes, Hazel A.; Howard, Judith A. K.","Coumarin-3-carboxylic acid: a second <i>P</i>2~1~/<i>c</i> modification","Acta Crystallographica Section E","2007","63","9","o3894","","10.1107/S1600536807040834","","","0.71073","MoKα","","0.0753","0.0406","","","0.0957","0.1112","","","","","","0.987","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215233","5.2932","0.0001","18.4568","0.0005","9.7473","0.0003","90","","98.768","0.001","90","","941.14","0.04","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(Bromoacetyl)coumarin","","- C11 H7 Br O3 -","- C11 H7 Br O3 -","- C44 H28 Br4 O12 -","4","1","NG2310","Sparkes, Hazel A.; Howard, Judith A. K.","3-(Bromoacetyl)coumarin: a second <i>P</i>2~1~/<i>c</i> modification","Acta Crystallographica Section E","2007","63","9","o3895","o3895","10.1107/S1600536807040846","","","0.71073","MoKα","","0.029","0.0235","","","0.0588","0.0611","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215234","8.8345","0.0005","11.7429","0.0006","15.2162","0.0008","90","","92.817","0.001","90","","1576.66","0.15","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2E)-3-(Biphenyl-4-yl)-1-(3-bromo-2-thienyl)prop-2-en-1-one","","- C19 H13 Br O S -","- C19 H13 Br O S -","- C76 H52 Br4 O4 S4 -","4","1","NG2313","Harrison, William T. A.; Ashalatha, B. V.; Narayana, B.; Sarojini, B. K.; Yathirajan, H. S.","(2<i>E</i>)-3-(Biphenyl-4-yl)-1-(3-bromo-2-thienyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","9","o3898","o3898","10.1107/S1600536807041141","","","0.71073","MoKα","","0.0641","0.0457","","","0.1311","0.1389","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215235","9.184","0.0018","11.495","0.002","12.265","0.003","70.85","0.03","68.62","0.03","69.69","0.03","1100.2","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","2,4-Dibromo-6-(cyclopropyliminomethyl)phenol","","- C10 H9 Br2 N O -","- C10 H9 Br2 N O -","- C40 H36 Br8 N4 O4 -","4","2","OM2147","De-Suo Yang","2,4-Dibromo-6-(cyclopropyliminomethyl)phenol","Acta Crystallographica Section E","2007","63","9","o3737","o3737","10.1107/S1600536807038494","","","0.71073","MoKα","","0.0941","0.0449","","","0.0898","0.105","","","","","","0.954","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215236","28.125","0.011","3.8193","0.0015","12.281","0.005","90","","92.764","0.005","90","","1317.7","0.9","298","2","298","2","","","","","","","","5","C 1 c 1","C -2yc","9","","6-Chloro-2'-(2-hydroxybenzylidene)nicotinohydrazide monohydrate","","- C13 H12 Cl N3 O3 -","- C13 H12 Cl N3 O3 -","- C52 H48 Cl4 N12 O12 -","4","1","OM2148","De-Suo Yang","6-Chloro-2'-(2-hydroxybenzylidene)nicotinohydrazide monohydrate","Acta Crystallographica Section E","2007","63","9","o3738","o3738","10.1107/S1600536807038500","","","0.71073","MoKα","","0.0445","0.0364","","","0.0848","0.0913","","","","","","1.043","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2215237","10.535","0.006","12.363","0.007","12.889","0.007","90","","110.067","0.006","90","","1576.8","1.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Bromo-2'-[4-(dimethylamino)benzylidene]nicotinohydrazide monohydrate","","- C15 H17 Br N4 O2 -","- C15 H17 Br N4 O2 -","- C60 H68 Br4 N16 O8 -","4","1","OM2149","De-Suo Yang","6-Bromo-2'-[4-(dimethylamino)benzylidene]nicotinohydrazide monohydrate","Acta Crystallographica Section E","2007","63","9","o3739","o3739","10.1107/S1600536807038512","","","0.71073","MoKα","","0.0712","0.0348","","","0.0729","0.0857","","","","","","1.009","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215238","8.681","0.004","11.777","0.006","12.982","0.009","72.06","0.02","76.98","0.02","81.592","0.019","1226","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Aquabis(5-chlorosalicylato-κO)(1,10-phenanthroline-κ^2^N,N')zinc(II)","","- C26 H18 Cl2 N2 O7 Zn -","- C26 H18 Cl2 N2 O7 Zn -","- C52 H36 Cl4 N4 O14 Zn2 -","2","1","OM2150","Wen, Decai; Ying, Shaoming","Aquabis(5-chlorosalicylato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II)","Acta Crystallographica Section E","2007","63","9","m2407","m2408","10.1107/S1600536807040937","","","0.71073","MoKα","","0.0504","0.0365","","","0.0781","0.0838","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215239","10.612","0.002","11.566","0.002","17.067","0.003","90","","90","","90","","2094.8","0.7","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","[(1<i>R</i>,4aS)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a- octahydrophenanthren-1-yl](piperidin-1-yl)methanone","","- C25 H37 N O -","- C25 H37 N O -","- C100 H148 N4 O4 -","4","1","OM2152","Xiao-Ping Rao; Zhan-Qian Song; Wei-Hong Jia; Shi-Bin Shang","[(1<i>R</i>,4a<i>S</i>)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10<i>a</i>-octahydrophenanthren-1-yl](piperidin-1-yl)methanone","Acta Crystallographica Section E","2007","63","9","o3886","o3886","10.1107/S1600536807040998","","","0.71073","MoKα","","0.0746","0.051","","","0.1195","0.134","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215240","16.2786","0.0014","11.472","0.001","8.1035","0.0007","90","","94.318","0.005","90","","1509","0.2","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(RS)-5-ethyl-2,6-dimethyl-4-p-tolyl-3-cyclohexenecarboxylic acid","","- C18 H24 O2 -","- C18 H24 O2 -","- C72 H96 O8 -","4","1","OM2154","Xie, Songwen; Kenny, Colin; Robinson, Paul D.","Racemic 5-ethyl-2,6-dimethyl-4-<i>p</i>-tolyl-3-cyclohexenecarboxylic acid: an <i>RS</i> dimer","Acta Crystallographica Section E","2007","63","9","o3897","o3897","10.1107/S1600536807041098","","","0.71073","MoKα","","0.0807","0.058","","","0.1358","0.1501","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215241","20.029","0.0016","9.0893","0.0007","15.5393","0.0013","90","","98.197","0.002","90","","2800","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(benzoato-κ^2^O,O')chloridocadmium(II)]-μ-2,2'-diphenyl-1,1'-\ (butane-1,4-diyl)diimidazole-κ^2^N^3^:N^3'^]","","- C29 H27 Cd Cl N4 O2 -","- C29 H17 Cd Cl N4 O2 -","- C116 H68 Cd4 Cl4 N16 O8 -","4","1","PR2014","Ying-Ying Liu; Jian-Fang Ma; Lai-Ping Zhang","<i>catena</i>-Poly[[(benzoato-κ^2^<i>O</i>,<i>O</i>')chloridocadmium(II)]-μ-2,2'-diphenyl-1,1'-(butane-1,4-diyl)diimidazole-κ^2^<i>N</i>^3^:<i>N</i>^3'^]","Acta Crystallographica Section E","2007","63","9","m2317","m2317","10.1107/S1600536807036628","","","0.71073","MoKα","","0.0888","0.0522","","","0.1361","0.1606","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215242","5.289","0.005","8.308","0.008","9.047","0.008","100.346","0.009","94.286","0.009","101.732","0.009","380.3","0.6","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","3-Hydroxypyridinium perchlorate","","- C5 H6 Cl N O5 -","- C5 H6 Cl N O5 -","- C10 H12 Cl2 N2 O10 -","2","1","PR2015","Jing-Cai Yao; Jin-Bo Guo; Li Zhang; Hai-Yan Wen; Wei Wang","3-Hydroxypyridinium perchlorate","Acta Crystallographica Section E","2007","63","9","o3678","o3678","10.1107/S160053680703663X","","","0.71073","MoKα","","0.0344","0.0318","","","0.0823","0.085","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215243","9.0961","0.0016","13.571","0.002","19.338","0.003","90","","103.507","0.003","90","","2321.1","0.6","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Aquabis(2,2'-bipyridine-κ^2^N,N')copper(II) bis(tetrafluoridoborate)","","- C20 H18 B2 Cu F8 N4 O -","- C20 H18 B2 Cu F8 N4 O -","- C80 H72 B8 Cu4 F32 N16 O4 -","4","1","PV2015","Yu, Ming-Ming; Zhang, Yu-Na; Wei, Liu-He","Aquabis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')copper(II) bis(tetrafluoridoborate)","Acta Crystallographica Section E","2007","63","9","m2380","m2380","10.1107/S1600536807033557","","","0.71073","MoKα","","0.0904","0.0477","","","0.1133","0.1357","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215244","4.5403","0.001","12.418","0.003","16.439","0.004","90","","91.812","0.003","90","","926.4","0.4","291","2","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Diethyl 1,1'-ethane-1,2-diylbis(2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate)","","- C18 H24 N2 O6 -","- C18 H24 N2 O6 -","- C36 H48 N4 O12 -","2","0.5","PV2017","Zhen-Feng Zhang; Si-Qian Wang; Jian-Ping Li; Gui-Rong Qu","Diethyl 1,1'-ethane-1,2-diylbis(2-methyl-5-oxo-4,5-dihydro-1<i>H</i>-pyrrole-3-carboxylate)","Acta Crystallographica Section E","2007","63","9","o3865","o3865","10.1107/S1600536807035684","","","0.71073","MoKα","","0.0795","0.0522","","","0.1229","0.1386","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215245","8.8387","0.0008","20.2043","0.0018","10.0232","0.0009","90","","107.839","0.002","90","","1703.9","0.3","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-acetyl-6-methyl-4-(4-methoxyphenyl)-2-oxo-\ 1,2,3,4-tetrahydropyrimidine-5-carboxylate","","- C17 H20 N2 O5 -","- C17 H20 N2 O5 -","- C68 H80 N8 O20 -","4","1","PV2022","Noor Shahina Begum; D. E. Vasundhara","Ethyl 3-acetyl-4-(4-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","9","o3741","o3742","10.1107/S1600536807037890","","","0.71073","MoKα","","","0.0581","","","","0.1213","","","","","","1.097","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215246","7.4216","0.0019","12.33","0.003","7.55","0.002","90","","99.921","0.004","90","","680.6","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis(2-oxidopyridinium-3-carboxylate)cobalt(II)","","- C12 H12 Co N2 O8 -","- C12 H12 Co N2 O8 -","- C24 H24 Co2 N4 O16 -","2","0.5","PV2023","Yan, Huai-Yi; Hu, Tai-Qiu","Diaquabis(2-oxidopyridinium-3-carboxylato-κ^2^<i>O</i>^2^,<i>O</i>^3^)cobalt(II)","Acta Crystallographica Section E","2007","63","9","m2326","m2326","10.1107/S1600536807036896","","","0.71073","MoKα","","0.0408","0.0335","","","0.0796","0.0829","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215247","8.5731","0.0015","11.858","0.002","14.899","0.003","90","","90","","90","","1514.6","0.5","223","2","223","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Bis(dimethyloxonium) pentachloridoantimonate(III)","","- C4 H14 Cl5 O2 Sb -","- C4 H14 Cl5 O2 Sb -","- C16 H56 Cl20 O8 Sb4 -","4","0.5","PV2024","Wen-Jie Feng; Zhan Shu; Xin-Jü Ma; Zhi-Min Jin","Bis(dimethyloxonium) pentachloridoantimonate(III)","Acta Crystallographica Section E","2007","63","9","m2411","m2411","10.1107/S1600536807040901","","","0.7107","MoKα","","0.0304","0.0289","","","0.065","0.0657","","","","","","1.178","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215248","11.4142","0.0011","7.9101","0.0008","20.553","0.002","90","","94.869","0.002","90","","1849","0.3","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-(4-Methylphenyl)-5-(methylsulfanyl)-2-phenyl-1,3-benzothiazole-4-carbonitrile","","- C22 H16 N2 S2 -","- C22 H16 N2 S2 -","- C88 H64 N8 S8 -","4","1","PV2025","Noor Shahina Begum; D. E. Vasundhara; V. S. Hegde; I. M. Khazi","7-(4-Methylphenyl)-5-(methylsulfanyl)-2-phenyl-1,3-benzothiazole-4-carbonitrile","Acta Crystallographica Section E","2007","63","9","o3902","o3902","10.1107/S1600536807041347","","","0.71073","MoKα","","0.0698","0.0563","","","0.1229","0.1289","","","","","","1.154","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215249","22.529","0.001","9.1786","0.0005","21.941","0.001","90","","92.469","0.001","90","","4532.9","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","μ-Carbonyl-1:2κ^2^<i>C</i>-carbonyl-1κ<i>C</i>-(1<i>η</i>^5^- cyclopentadienyl)(μ- phenylvinylidene)bis(triphenylphosphine-2κ<i>P</i>)rheniumplatinum(Re—Pt) diethyl ether hemisolvate","","- C53 H46 O2.5 P2 Pt Re -","- C53 H46 O2.5 P2 Pt Re -","- C212 H184 O10 P8 Pt4 Re4 -","4","1","RK2027","Vasiliev, Alexander D.; Chudin, Oleg S.; Antonova, Alla B.","μ-Carbonyl-1:2κ^2^<i>C</i>-carbonyl-1κ<i>C</i>-(1<i>{η</i>}^5^-cyclopentadienyl)(μ-phenylvinylidene)bis(triphenylphosphine-2κ<i>P</i>)rheniumplatinum(<i>Re</i>—<i>Pt</i>) diethyl ether hemisolvate","Acta Crystallographica Section E","2007","63","9","m2272","m2272","10.1107/S1600536807036902","","","0.71073","MoKα","","0.0573","0.0307","","","0.0638","0.0732","","","","","","0.999","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215250","7.6661","0.0014","6.1482","0.0009","15.792","0.002","90","","96.437","0.013","90","","739.6","0.2","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Hydroxyanilinium bromide","","- C6 H8 Br N O -","- C6 H8 Br N O -","- C24 H32 Br4 N4 O4 -","4","1","RK2028","Dominik Cinčić; Branko Kaitner","3-Hydroxyanilinium bromide","Acta Crystallographica Section E","2007","63","9","o3873","o3873","10.1107/S1600536807036884","","","0.71073","MoKα","","0.0369","0.0303","","","0.0756","0.0815","","","","","","0.954","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215251","8.92","0.0013","6.4935","0.0009","14.464","0.002","90","","95.378","0.006","90","","834.1","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,6-Bis(2-aminophenoxy)hexane","","- C18 H24 N2 O2 -","- C18 H24 N2 O2 -","- C36 H48 N4 O4 -","2","0.5","RK2030","Jie Cai; Xin-Chen Zhu; Yun-Qian Zhang; Bi-Xue Zhu","1,6-Bis(2-aminophenoxy)hexane","Acta Crystallographica Section E","2007","63","9","o3710","o3710","10.1107/S1600536807037324","","","0.71073","MoKα","","0.042","0.0355","","","0.1043","0.1089","","","","","","1.087","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215252","14.4167","0.0011","6.9068","0.0004","12.9531","0.0007","90","","117.94","0.004","90","","1139.44","0.13","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichloridodiglycinezinc dihydrate","","- C4 H14 Cl2 N2 O6 Zn -","- C4 H14 Cl2 N2 O6 Zn -","- C16 H56 Cl8 N8 O24 Zn4 -","4","0.5","RK2031","Mary Navis Priya, S.; Babu Varghese; Mary Linet, J.; Jerome Das, S.","Dichloridodiglycinezinc dihydrate","Acta Crystallographica Section E","2007","63","9","m2318","m2318","10.1107/S1600536807038263","","","0.71073","MoKα","","0.0129","0.0129","","","0.0338","0.0338","","","","","","1.117","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2215254","13.6695","0.0009","8.7917","0.0005","14.987","0.0008","90","","90","","90","","1801.11","0.18","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-(p-Tolyl)thioacetamide","","- C9 H11 N S -","- C9 H11 N S -","- C72 H88 N8 S8 -","8","1","RK2038","Śmiszek-Lindert, Wioleta; Nowak, Maria; Kusz, Joachim","<i>N</i>-(<i>p</i>-Tolyl)thioacetamide","Acta Crystallographica Section E","2007","63","9","o3917","o3917","10.1107/S1600536807041633","","","0.71073","MoKα","","0.0627","0.0359","","","0.1071","0.1134","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215255","6.6645","0.0009","14.5796","0.0019","10.5615","0.0014","90","","95.163","0.001","90","","1022.1","0.2","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-Bis[(S)-2-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)phenolato- κ^2^N,O]copper(II)","","- C22 H24 Cu N2 O4 -","- C22 H24 Cu N2 O4 -","- C44 H48 Cu2 N4 O8 -","2","0.5","RN2023","Zhang, Yan; Liu, Tian-Fu; Xu, Wen-Guo; Zhao, Bang-Tun; Wang, Jian-Ge","<i>trans</i>-Bis[(<i>S</i>)-2-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)phenolato-κ^2^<i>N</i>,<i>O</i>]copper(II)","Acta Crystallographica Section E","2007","63","9","m2292","m2293","10.1107/S1600536807037919","","","0.71073","MoKα","","0.0308","0.0261","","","0.0743","0.0774","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215256","6.3442","0.0003","7.3885","0.0003","11.7831","0.0005","85.72","0.002","82.122","0.002","83.572","0.002","542.68","0.04","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","7,8-dichloro-1,2,3,4-tetrahydrophenazine","","- C12 H10 Cl2 N2 -","- C12 H10 Cl2 N2 -","- C24 H20 Cl4 N4 -","2","1","RT2001","Cesar H. Zambrano; Robert D. Pike; Ricky Joseph Paul Gibson; Barger, Brittany D.; Eric Efrain Dueno","7,8-Dichloro-1,2,3,4-tetrahydrophenazine","Acta Crystallographica Section E","2007","63","9","o3841","o3841","10.1107/S1600536807032874","","","1.54178","CuKα","","0.0323","0.0318","","","0.0885","0.0893","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215257","7.3627","0.0001","14.0874","0.0003","16.7287","0.0003","90","","90","","90","","1735.12","0.05","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","5-Phenyluridine trihydrate","2,4-dihydroxy-5-phenyl-1-β-D-ribofuranosylpyrimidine trihydrate","","- C15 H22 N2 O9 -","- C15 H22 N2 O9 -","- C60 H88 N8 O36 -","4","1","RT2004","Valerio Bertolasi; Pavel Hradil; Lucie Spáčilová; Alfred Muller; Jan Hlaváč","5-Phenyluridine trihydrate","Acta Crystallographica Section E","2007","63","9","o3805","o3805","10.1107/S1600536807039414","","","0.71073","MoKα","","","0.0529","","","","0.1849","","","","","","1.157","","","","has coordinates,has disorder,has Fobs","194538","2020-10-21","18:00:00",""
"2215258","5.3477","0.0003","9.1719","0.0006","13.5284","0.0008","90","","90","","90","","663.55","0.07","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Poly[μ~2~-L-alanine-μ~3~-nitrato-sodium(I)]","","- C3 H7 N2 Na O5 -","- C3 H7 N2 Na O5 -","- C12 H28 N8 Na4 O20 -","4","1","RT2007","Van Hecke, Kristof; Cartuyvels, Els; Parac-Vogt, Tatjana N.; Görller-Walrand, Christiane; Van Meervelt, Luc","Poly[μ~2~-<small>L</small>-alanine-μ~3~-nitrato-sodium(I)]","Acta Crystallographica Section E","2007","63","9","m2354","m2354","10.1107/S1600536807039438","","","1.54178","CuKα","","0.0388","0.0371","","","0.0914","0.0924","","","","","","1.095","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215259","9.0763","0.001","9.8053","0.0011","24.628","0.003","90","","90","","90","","2191.8","0.4","295","2","295","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2-(4-Methylphenyl)-1H-benzimidazole","","- C14 H12 N2 -","- C14 H12 N2 -","- C112 H96 N16 -","8","1","RT2008","Shi, Wen-Juan; Ruan, Cheng-Xiang","2-(4-Methylphenyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","9","o3688","o3688","10.1107/S1600536807037373","","","0.71073","MoKα","","0.0593","0.0516","","","0.1307","0.1351","","","","","","1.103","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215260","7.4007","0.0006","24.858","0.002","8.269","0.0007","90","","112.49","0.002","90","","1405.5","0.2","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","5-(4-Acetylamidophenyl)dipyrromethane","N-[4-(Di-2-pyrrolylmethyl)phenyl]acetamide","","- C17 H17 N3 O -","- C17 H17 N3 O -","- C68 H68 N12 O4 -","4","1","RT2013","Senge, Mathias O.","<i>N</i>-[4-(Di-2-pyrrolylmethyl)phenyl]acetamide","Acta Crystallographica Section E","2007","63","9","o3679","o3679","10.1107/S1600536807037385","","","0.71073","MoKα","","0.087","0.0509","","","0.1139","0.1312","","","","","","1.007","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215261","20.376","0.004","19.648","0.004","10.213","0.002","90","","107.605","0.004","90","","3897.3","1.3","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-(1H-1,2,3-Benzotriazol-1-yl)-1-benzoylethyl 4-methylbenzoate","","- C23 H19 N3 O3 -","- C23 H19 N3 O3 -","- C184 H152 N24 O24 -","8","1","RZ2151","Zeng, Wu-Lan; Zhang, Yun-Chen; Hong, Yi-Ming","2-(1<i>H</i>-1,2,3-Benzotriazol-1-yl)-1-benzoylethyl 4-methylbenzoate","Acta Crystallographica Section E","2007","63","9","o3715","o3715","10.1107/S1600536807036331","","","0.71073","MoKα","","0.1213","0.0486","","","0.1136","0.1403","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215262","20.0791","0.0006","5.9534","0.0002","10.2062","0.0003","90","","90","","90","","1220.04","0.07","100","2","100","2","","","","","","","","4","F d d 2","F 2 -2d","43","","trisodium dihydroxidotetraoxidoneptunate(VII)","","- H2 Na3 Np O6 -","- H2 Na3 Np O6 -","- H16 Na24 Np8 O48 -","8","0.5","SG2188","Grigoriev, Mikhail S.; Krot, Nikolai N.","Reinvestigation of trisodium dihydroxidotetraoxidoneptunate(VII)","Acta Crystallographica Section E","2007","63","9","i176","i176","10.1107/S1600536807039025","","","0.71073","MoKα","","0.0141","0.0116","","","0.0219","0.0222","","","","","","1.25","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215263","8.4686","0.0011","18.341","0.002","11.1313","0.0014","90","","102.971","0.002","90","","1684.8","0.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(4<i>RS</i>,6<i>SR</i>)-2-Amino-4-(4-methoxyphenyl)-6-phenyl-5,6-dihydro- 4<i>H</i>-[1,3]thiazin-3-ium chloride","","- C17 H19 Cl N2 O S -","- C17 H19 Cl N2 O S -","- C68 H76 Cl4 N8 O4 S4 -","4","1","SI2026","Lin Lin; Jie-Ping Wan; Cui-Rong Sun","(4<i>RS</i>,6<i>SR</i>)-2-Amino-4-(4-methoxyphenyl)-6-phenyl-5,6-dihydro-4<i>H</i>-1,3-thiazin-3-ium chloride","Acta Crystallographica Section E","2007","63","9","o3842","o3842","10.1107/S1600536807033107","","","0.71073","MoKα","","0.0685","0.0562","","","0.1567","0.1673","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215264","13.8146","0.0012","14.0793","0.0012","12.8194","0.0011","90","","95.681","0.002","90","","2481.1","0.4","243","2","243","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Tetra-μ~3~-bromido-tetrakis[trimethylplatinum(IV)]","","- C12 H36 Br4 Pt4 -","- C12 H36 Br4 Pt4 -","- C48 H144 Br16 Pt16 -","4","0.5","SI2029","Song, Ah-Ran; Hwang, In-Chul; Ha, Kwang","Tetra-μ~3~-bromido-tetrakis[trimethylplatinum(IV)]","Acta Crystallographica Section E","2007","63","9","m2259","m2259","10.1107/S160053680703704X","","","0.71073","MoKα","","0.0419","0.0331","","","0.0749","0.0775","","","","","","0.98","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215265","6.2917","0.0005","10.5847","0.0009","17.838","0.002","90","","97.137","0.001","90","","1178.73","0.19","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5-<i>tert</i>-Butylbenzene-1,3-dicarboxylic acid","","- C12 H14 O4 -","- C12 H14 O4 -","- C48 H56 O16 -","4","1","SJ2322","Xu, Xiao-Bin; Lan, Fei-Fei; Yang, Shi-Yao; Huang, Rong-Bin; Seik Weng Ng","5-<i>tert</i>-Butylbenzene-1,3-dicarboxylic acid","Acta Crystallographica Section E","2007","63","9","o3747","o3747","10.1107/S1600536807038408","","","0.71073","MoKα","","0.0677","0.0586","","","0.1621","0.1709","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215266","8.4063","0.0004","9.0758","0.0007","12.8451","0.0006","72.82","0.004","78.778","0.004","69.938","0.005","874.7","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Dichloridobis(2-methyl-1,3-benzothiazole-κ<i>N</i>)zinc(II)","","- C16 H14 Cl2 N2 S2 Zn -","- C16 H14 Cl2 N2 S2 Zn -","- C32 H28 Cl4 N4 S4 Zn2 -","2","1","SJ2323","Roh, Soo-Gyun; Jeong, Jong Hwa","Dichloridobis(2-methyl-1,3-benzothiazole-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2007","63","9","m2334","m2334","10.1107/S1600536807039104","","","0.71073","MoKα","","0.0324","0.0257","","","0.0742","0.0759","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215267","10.2391","0.0012","5.3647","0.0006","17.5907","0.0017","90","","106.581","0.008","90","","926.07","0.18","291","3","291","3","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Phenyl-1H-pyrazole-5-carboxylic acid","","- C10 H8 N2 O2 -","- C10 H8 N2 O2 -","- C40 H32 N8 O8 -","4","1","SJ2324","Zhang, Xiao-Yuan; Liu, Wei; Tang, Wei; Lai, Yue-Bo","3-Phenyl-1<i>H</i>-pyrazole-5-carboxylic acid","Acta Crystallographica Section E","2007","63","9","o3764","o3764","10.1107/S1600536807038809","","","0.7107","MoKα","","0.0703","0.054","","","0.1514","0.1668","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215268","12.3432","0.0013","13.2611","0.0014","15.5179","0.0017","90","","98.992","0.002","90","","2508.8","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[copper(I)-di-μ-chlorido-copper(I)- bis[μ-bis(pyrimidin-2-ylsulfanyl)methane-κ^2^<i>N</i>:<i>N</i>']]","","- C18 H16 Cl2 Cu2 N8 S4 -","- C18 H16 Cl2 Cu2 N8 S4 -","- C72 H64 Cl8 Cu8 N32 S16 -","4","0.5","SJ2325","Shi, Wen-Juan; Gong, Zhen-Qi","<i>catena</i>-Poly[copper(I)-di-μ-chlorido-copper(I)-bis[μ-bis(pyrimidin-2-ylsulfanyl)methane-κ^2^<i>N</i>:<i>N</i>']]","Acta Crystallographica Section E","2007","63","9","m2314","m2314","10.1107/S160053680703913X","","","0.71073","MoKα","","0.0512","0.0414","","","0.096","0.1012","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215269","8.1499","0.0008","9.4958","0.0009","10.283","0.001","73.216","0.002","79.023","0.002","65.188","0.002","689.37","0.12","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 2-(5-methyl-3-methylsulfinyl-1-benzofuran-2-yl)acetate","","- C14 H16 O4 S -","- C14 H16 O4 S -","- C28 H32 O8 S2 -","2","1","SJ2328","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","Ethyl 2-(5-methyl-3-methylsulfinyl-1-benzofuran-2-yl)acetate","Acta Crystallographica Section E","2007","63","9","o3839","o3839","10.1107/S1600536807040263","","","0.71073","MoKα","","0.0603","0.048","","","0.1051","0.1104","","","","","","1.131","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215270","9.341","0.0019","10.957","0.002","12.21","0.002","108.28","0.03","104.21","0.03","100.8","0.03","1101.8","0.5","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Bis{2,4-dibromo-6-[3-(cyclohexylammonio)propyliminomethyl]phenolato- κ^2^N,O}bis(thiocyanato-κN)nickel(II) methanol disolvate","","- C36 H52 Br4 N6 Ni O4 S2 -","- C36 H52 Br4 N6 Ni O4 S2 -","- C36 H52 Br4 N6 Ni O4 S2 -","1","0.5","SJ2329","Min Liu; Wen-Bing Yuan; Hong-Wu Xu; Qi Zhang; Jin-Xia Li","Bis{2,4-dibromo-6-[3-(cyclohexylammonio)propyliminomethyl]phenolato-κ^2^<i>N</i>,<i>O</i>}bis(thiocyanato-κ<i>N</i>)nickel(II) methanol disolvate","Acta Crystallographica Section E","2007","63","9","m2376","m2376","10.1107/S1600536807040238","","","0.71073","MoKα","","0.0812","0.0445","","","0.0931","0.1071","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215271","12.5113","0.0006","12.5113","0.0006","13.4435","0.0009","90","","90","","90","","2104.3","0.2","100","0.1","100","0.1","","","","","","","","6","I 41/a :2","-I 4ad","88","","Tetrakis(N-methylthiourea-κS)copper(I) iodide","","- C8 H24 Cu I N8 S4 -","- C8 H24 Cu I N8 S4 -","- C32 H96 Cu4 I4 N32 S16 -","4","0.25","SJ2330","Muhammad Mufakkar; Saeed Ahmad; Islam Ullah Khan; Hoong-Kun Fun; Suchada Chantrapromma","Tetrakis(<i>N</i>-methylthiourea-κ<i>S</i>)copper(I) iodide","Acta Crystallographica Section E","2007","63","9","m2384","m2384","10.1107/S160053680704024X","","","0.71073","MoKα","","0.0479","0.034","","","0.0773","0.0853","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215272","7.8473","0.001","7.7271","0.001","9.2429","0.0014","90","","95.777","0.006","90","","557.61","0.13","150","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-Propylurea","","- C4 H10 N2 O -","- C4 H10 N2 O -","- C16 H40 N8 O4 -","4","1","SJ2331","Chohan, Sunil; Lancaster, Richard; Pritchard, Robin G.","<i>N</i>-Propylurea: the missing link","Acta Crystallographica Section E","2007","63","9","o3837","o3837","10.1107/S1600536807040251","","","0.71073","MoKα","","","0.0644","","","","0.1723","","","","","","1.098","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215273","12.4737","0.0014","18.358","0.002","10.9196","0.0013","90","","114.148","0.001","90","","2281.7","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraaquabis(4,4'-bipyridine)cobalt(II) 2-aminonaphthalene-1-sulfonate hexahydrate","","- C40 H52 Co N6 O16 S2 -","- C40 H52 Co N6 O16 S2 -","- C80 H104 Co2 N12 O32 S4 -","2","0.5","SJ2334","Ming-Jie Wu; Pei-Xia Dai; Xiu-Guang Wang; En-Cui Yang; Xiao-Jun Zhao","Tetraaquabis(4,4'-bipyridine)cobalt(II) 2-aminonaphthalene-1-sulfonate hexahydrate","Acta Crystallographica Section E","2007","63","9","m2413","m2413","10.1107/S1600536807040913","","","0.71073","MoKα","","0.0487","0.0387","","","0.1036","0.109","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215274","9.3092","0.0006","11.0636","0.0007","18.8384","0.0012","93.181","0.001","91.912","0.002","113.81","0.002","1769.1","0.2","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","(Pyrimidine-2-thiolato-κ^2^<i>N</i>,<i>S</i>)bis(triphenylphosphine- κ<i>P</i>)copper(I)","","- C40 H33 Cu N2 P2 S -","- C40 H33 Cu N2 P2 S -","- C80 H66 Cu2 N4 P4 S2 -","2","1","SJ2336","Ruan, Cheng-Xiang; Shi, Wen-Juan","(Pyrimidine-2-thiolato-κ^2^<i>N</i>,<i>S</i>)bis(triphenylphosphine-κ<i>P</i>)copper(I)","Acta Crystallographica Section E","2007","63","9","m2412","m2412","10.1107/S1600536807040925","","","0.71073","MoKα","","0.0585","0.0435","","","0.1046","0.1128","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215275","9.3879","0.0019","9.2952","0.0019","20.721","0.004","90","","90","","90","","1808.2","0.6","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-(4-Bromophenyl)propionamide","","- C9 H10 Br N O -","- C9 H10 Br N O -","- C72 H80 Br8 N8 O8 -","8","1","SJ2337","Guo, Chen-Hu; Guo, Ming-Lin; Zhang, Hou-Ying; Ye, Ya-Nan","<i>N</i>-(4-Bromophenyl)propionamide","Acta Crystallographica Section E","2007","63","9","o3884","o3884","10.1107/S1600536807040950","","","0.71073","MoKα","","0.0423","0.0357","","","0.0884","0.0925","","","","","","1.101","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215276","11.663","0.002","12.53","0.003","13.484","0.003","90","","111.77","0.03","90","","1830","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{1-[2-(Piperidin-1-yl)ethyliminomethyl]-2-naphtholato}thiocyanatonickel(II)","","- C19 H21 N3 Ni O S -","- C19 H21 N3 Ni O S -","- C76 H84 N12 Ni4 O4 S4 -","4","1","SJ2338","Yun-Peng Diao; Kun Li; Shan-Shan Huang; Li Lv; Ke-Xin Liu","{1-[2-(Piperidin-1-yl)ethyliminomethyl]-2-naphtholato}thiocyanatonickel(II)","Acta Crystallographica Section E","2007","63","9","m2426","m2426","10.1107/S1600536807041505","","","0.71073","MoKα","","0.1534","0.072","","","0.144","0.1787","","","","","","0.973","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215277","9.3919","0.0011","11.6665","0.0013","9.5762","0.0009","90","","108.336","0.008","90","","996","0.19","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Phenyl 2,3,4-tri-<i>O</i>-acetyl-1-thio-α-L-rhamnopyranoside","","- C18 H22 O7 S -","- C18 H22 O7 S -","- C36 H44 O14 S2 -","2","1","TK2174","Yow-Fu Tsai; Jen-Ta Yang; Jhy-Der Chen; Chia-Her Lin","Phenyl 2,3,4-tri-<i>O</i>-acetyl-1-thio-α-<small>L</small>-rhamnopyranoside: a glycosyl donor","Acta Crystallographica Section E","2007","63","9","o3772","o3772","10.1107/S1600536807038974","","","0.71073","MoKα","","0.043","0.035","","","0.089","0.095","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215278","12.1351","0.0008","14.2016","0.0007","16.0716","0.0008","90","","90.012","0.006","90","","2769.7","0.3","203","","203","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Methoxybenzaldehyde (phthalazin-1-ylidene)hydrazone","","- C16 H14 N4 O -","- C16 H14 N4 O -","- C128 H112 N32 O8 -","8","2","TK2185","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Vijesh, A.M.; Narayana, B.","4-Methoxybenzaldehyde (phthalazin-1-ylidene)hydrazone","Acta Crystallographica Section E","2007","63","9","o3674","o3674","10.1107/S1600536807037051","","","0.71073","MoKα","","0.142","0.057","","","0.134","0.18","","","","","","0.99","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215279","4.2503","0.0001","25.5022","0.0007","11.3995","0.0003","90","","99.457","0.003","90","","1218.82","0.06","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-(4-Hydroxybenzylamino)purin-3-ium chloride","","- C12 H12 Cl N5 O -","- C12 H12 Cl N5 O -","- C48 H48 Cl4 N20 O4 -","4","1","TK2186","Trávníček, Zdeněk; George, Kara M.; Matiková-Maľarová, Miroslava; Baran, Peter","6-(4-Hydroxybenzylamino)purin-3-ium chloride: a protonated form of <i>para</i>-topoline","Acta Crystallographica Section E","2007","63","9","o3859","o3859","10.1107/S1600536807039979","","","0.71073","MoKα","","0.032","0.03","","","0.081","0.082","","","","","","1.16","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215280","12.3438","0.0004","11.8161","0.0004","11.9435","0.0003","90","","96.6568","0.0014","90","","1730.28","0.09","100","1","100","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Di-μ-iodido-bis[(η^4^-cycloocta-1,5-diene)iridium(I)]","","- C16 H24 I2 Ir2 -","- C16 H24 I2 Ir2 -","- C64 H96 I8 Ir8 -","4","0.5","TK2187","Tsuneaki Yamagata; Mitsuhiro Nagata; Kazushi Mashima; Kazuhide Tani","Di-μ-iodido-bis[(η^4^-cycloocta-1,5-diene)iridium(I)]","Acta Crystallographica Section E","2007","63","9","m2402","m2402","10.1107/S1600536807040421","","","0.71075","MoKα","","0.042","0.042","","","0.102","0.102","","","","","","1.19","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215281","8.3557","0.0004","9.5625","0.0005","10.0192","0.0005","71.644","0.001","78.619","0.001","65.304","0.001","688.31","0.06","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 2-(5-bromo-3-methylsulfinyl-1-benzofuran-2-yl)acetate","","- C13 H13 Br O4 S -","- C13 H13 Br O4 S -","- C26 H26 Br2 O8 S2 -","2","1","TK2188","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","Ethyl 2-(5-bromo-3-methylsulfinyl-1-benzofuran-2-yl)acetate","Acta Crystallographica Section E","2007","63","9","o3850","o3850","10.1107/S160053680704041X","","","0.71073","MoKα","","0.024","0.022","","","0.058","0.059","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215282","6.787","0.0005","11.1876","0.0008","15.8669","0.0011","90","","97.18","0.002","90","","1195.33","0.15","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(4-Ethynylphenyl)-3,5-dimethylbiuret","","- C12 H13 N3 O2 -","- C12 H13 N3 O2 -","- C48 H52 N12 O8 -","4","1","TK2190","Harrison, William T. A.","1-(4-Ethynylphenyl)-3,5-dimethylbiuret","Acta Crystallographica Section E","2007","63","9","o3883","o3883","10.1107/S1600536807040895","","","0.71073","MoKα","","0.057","0.037","","","0.097","0.105","","","","","","0.98","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215283","8.039","0.005","8.428","0.005","12.391","0.008","102.186","0.007","90.633","0.008","90.074","0.008","820.6","0.9","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","4-Amino-3-{5-[(3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-2,6-dimethyl-3-pyridyl}- 1H-1,2,4-triazole-5(4H)-thione","","- C15 H17 N7 O S -","- C15 H17 N7 O S -","- C30 H34 N14 O2 S2 -","2","1","WK2068","Lu, Dong-Liang; Zhang, Min; Song, Li-Ping; Huang, Pei-Gang; Zhang, Jun","4-Amino-3-{5-[(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)carbonyl]-2,6-dimethyl-3-pyridyl}-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","9","o3846","o3846","10.1107/S1600536807038640","","","0.71073","MoKα","","0.0701","0.0514","","","0.1218","0.1364","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215284","8.6776","0.0009","9.7953","0.001","16.7592","0.0016","90","","90","","90","","1424.5","0.2","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","catena-poly[[diaquanickel(II)]-μ-2-hydroxyphosphonatoacetato]","","- C2 H7 Ni O8 P -","- C2 H7 Ni O8 P -","- C16 H56 Ni8 O64 P8 -","8","1","WK2072","Jing Li; Da-Peng Dong; Cui-Ying Huang; Zhen-Gang Sun; Yan-Yu Zhu","<i>catena</i>-Poly[[diaquanickel(II)]-μ-2-hydroxyphosphonatoacetato]","Acta Crystallographica Section E","2007","63","9","m2348","m2349","10.1107/S160053680703869X","","","0.71073","MoKα","","0.0308","0.0252","","","0.0643","0.0679","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215285","5.4576","0.0002","7.6077","0.0002","18.684","0.001","99.429","0.001","91.277","0.001","108.319","0.002","724.23","0.05","293","","293","","","","","","","","","5","P -1","-P 1","2","","Bis(2-aminopyrimidin-1-ium) dichromate(VI)","","- C8 H12 Cr2 N6 O7 -","- C8 H12 Cr2 N6 O7 -","- C16 H24 Cr4 N12 O14 -","2","1","WK2074","Sieroń, Lesław","Bis(2-aminopyrimidin-1-ium) dichromate(VI)","Acta Crystallographica Section E","2007","63","9","m2336","m2336","10.1107/S1600536807039347","","","0.71073","MoKα","","0.0233","0.0228","","","0.0692","0.0699","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215286","20.424","0.002","9.6712","0.001","14.751","0.001","90","","101.798","0.001","90","","2852.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[(2,2'-bipyridine)nickel(II)]-μ-imidazole-4,5-dicarboxylato]","","- C15 H9 N4 Ni O4 -","- C15 H9 N4 Ni O4 -","- C120 H72 N32 Ni8 O32 -","8","2","WM2133","Hao, Lu-Jiang; Yu, Tong-Li","<i>catena</i>-Poly[[(2,2'-bipyridine)nickel(II)]-μ-imidazole-4,5-dicarboxylato]","Acta Crystallographica Section E","2007","63","9","m2374","m2374","10.1107/S1600536807040330","","","0.71073","MoKα","","0.0327","0.027","","","0.063","0.0656","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215287","12.3885","0.0013","13.1003","0.0014","17.4966","0.0018","90","","90","","90","","2839.6","0.5","120","2","120","2","","","","","","","","3","I b a 2","I 2 -2c","45","","undecastrontium indium nonaantimonide","","- In Sb9 Sr11 -","- In Sb9 Sr11 -","- In4 Sb36 Sr44 -","4","0.5","WM2135","Hullmann, Jonathan; Xia, Shengqing; Bobev, Svilen","Sr~11~InSb~9~ grown from molten In","Acta Crystallographica Section E","2007","63","9","i178","i178","10.1107/S1600536807040615","","","0.71073","MoKα","","0.0249","0.0223","","0.0353","","0.0341","","","","","","0.896","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215288","6.0611","0.0012","16.0637","0.0016","19.494","0.002","90","","91.545","0.002","90","","1897.3","0.5","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,3-Dibenzyl-2-phenylimidazolidine","","- C23 H24 N2 -","- C23 H24 N2 -","- C92 H96 N8 -","4","1","WN2158","Xia, H.-T.; Liu, Y.-F.; Wang, D.-Q.; Li, B.","1,3-Dibenzyl-2-phenylimidazolidine","Acta Crystallographica Section E","2007","63","9","o3666","o3666","10.1107/S1600536807037026","","","0.71073","MoKα","","0.1375","0.0657","","","0.1297","0.1613","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215289","6.0912","0.0011","16.9","0.002","19.621","0.003","90","","98.304","0.002","90","","1998.6","0.5","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,3-Dibenzyl-2-phenylperhydropyrimidine","","- C24 H26 N2 -","- C24 H26 N2 -","- C96 H104 N8 -","4","1","WN2159","Xia, H.-T.; Liu, Y.-F.; Wang, D.-Q.; Gao, W.","1,3-Dibenzyl-2-phenylperhydropyrimidine","Acta Crystallographica Section E","2007","63","9","o3665","o3665","10.1107/S1600536807036859","","","0.71073","MoKα","","0.1466","0.0445","","","0.0757","0.0943","","","","","","0.753","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215290","10.238","0.007","11.295","0.004","21.072","0.012","90","","115.481","0.002","90","","2200","2","295","2","295","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[1-(4-Chloro-2-fluorophenylsulfonyl)piperidin-4-yl]diphenylmethanol","","- C24 H23 Cl F N O3 S -","- C24 H23 Cl F N O3 S -","- C96 H92 Cl4 F4 N4 O12 S4 -","4","1","WN2179","Benakaprasad, S. B.; Naveen, S.; Sridhar, M. A.; Shashidhara Prasad, J.; Rangappa, K. S.","[1-(4-Chloro-2-fluorophenylsulfonyl)piperidin-4-yl]diphenylmethanol","Acta Crystallographica Section E","2007","63","9","o3669","o3669","10.1107/S1600536807037075","","","0.71073","MoKα","","0.0564","0.0466","","","0.1349","0.1515","","","","","","1.136","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215291","12.436","0.003","7.1581","0.0014","15.048","0.003","90","","100.95","0.03","90","","1315.2","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-N'-(3-Hydroxy-4-methoxybenzylidene)-2-hydroxybenzohydrazide","","- C15 H14 N2 O4 -","- C15 H14 N2 O4 -","- C60 H56 N8 O16 -","4","1","WN2180","Luo, Zhi-Gang","(<i>E</i>)-2-Hydroxy-<i>N</i>'-(3-hydroxy-4-methoxybenzylidene)benzohydrazide","Acta Crystallographica Section E","2007","63","9","o3672","o3672","10.1107/S1600536807037014","","","0.71073","MoKα","","0.079","0.0486","","","0.147","0.1659","","","","","","1.103","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215292","12.6858","0.0009","13.1117","0.0009","13.353","0.001","90","","90","","90","","2221","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Cedrelone butyrolactone","24-nor-13α,14β,15β,17α-chola-1,5,20-triene- 14,15:21,23-diepoxy-6-hydroxy-4,4,8-trimethyl-3,7,21-trione","","- C26 H30 O6 -","- C26 H30 O6 -","- C104 H120 O24 -","4","1","WN2184","S. Soundarya Devi; R. Malathi; S. S. Rajan; K. Ravikumar","Cedrelone butyrolactone","Acta Crystallographica Section E","2007","63","9","o3806","o3807","10.1107/S1600536807039402","","","0.71073","MoKα","","0.0627","0.0473","","","0.1171","0.1252","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215293","11.206","0.003","11.139","0.003","10.075","0.002","90","","102.7","0.03","90","","1226.8","0.5","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(2,3-Dichlorophenyl)-2,2,2-trimethylacetamide","","- C11 H13 Cl2 N O -","- C11 H13 Cl2 N O -","- C44 H52 Cl8 N4 O4 -","4","1","WN2185","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","<i>N</i>-(2,3-Dichlorophenyl)-2,2,2-trimethylacetamide","Acta Crystallographica Section E","2007","63","9","o3788","o3788","10.1107/S160053680703930X","","","1.5418","CuKα","","0.0755","0.0607","","","0.1628","0.1764","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215294","6.4536","0.0002","6.7954","0.0002","20.7965","0.0008","90","","90","","90","","912.03","0.05","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(2<i>S</i>,3<i>R</i>,4<i>R</i>,5<i>S</i>)-3,4,5-Trihydroxypipecolic acid dihydrate","(2<i>S</i>,3<i>R</i>,4<i>R</i>,5<i>S</i>)-3,4,5-Trihydroxypiperidine-2-\ carboxylic acid dihydrate","","- C6 H15 N O7 -","- C6 H15 N O7 -","- C24 H60 N4 O28 -","4","1","WN2187","Kathrine V. Booth; Sarah F. Jenkinson; Watkin, David J.; Hazel Sharp; Paul Wyn Jones; Robert J. Nash; George W. J. Fleet","(2<i>S</i>,3<i>R</i>,4<i>R</i>,5<i>S</i>)-3,4,5-Trihydroxypipecolic acid dihydrate [(2<i>S</i>,3<i>R</i>,4<i>R</i>,5<i>S</i>)-3,4,5-trihydroxypiperidine-2-carboxylic acid dihydrate]","Acta Crystallographica Section E","2007","63","9","o3783","o3784","10.1107/S1600536807039281","","","0.71073","MoKα","","0.0417","0.0381","","0.0973","0.0954","0.0973","","","","","","0.9684","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215295","10.9244","0.0002","8.8066","0.0002","17.4316","0.0004","90","","90","","90","","1677.04","0.06","100","0.1","100","0.1","","","","","","","","3","P b c n","-P 2n 2ab","60","","2,7-Bis(bromomethyl)-9,9'-diethylfluorene","","- C19 H20 Br2 -","- C19 H20 Br2 -","- C76 H80 Br8 -","4","0.5","WN2191","K. Chinnakali; R. Surendran; M. Pushparani; A. K. Mohanakrishnan; Hoong-Kun Fun","2,7-Bis(bromomethyl)-9,9'-diethylfluorene","Acta Crystallographica Section E","2007","63","9","o3826","o3826","10.1107/S1600536807040020","","","0.71073","MoKα","","0.0672","0.0417","","","0.1226","0.1397","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215296","12.9995","0.0006","11.5063","0.0005","9.7556","0.0004","90","","106.004","0.001","90","","1402.65","0.11","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Iodo-2-methyl-3-phenylsulfinyl-1-benzofuran","","- C15 H11 I O2 S -","- C15 H11 I O2 S -","- C60 H44 I4 O8 S4 -","4","1","WN2192","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","5-Iodo-2-methyl-3-phenylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2007","63","9","o3851","o3851","10.1107/S1600536807040482","","","0.71073","MoKα","","0.0267","0.025","","","0.065","0.0664","","","","","","1.051","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215297","11.4683","0.0002","8.8983","0.0001","21.5088","0.0003","90","","99.406","0.001","90","","2165.43","0.05","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 3-[2-benzyl-1-(phenylsulfonyl)-1<i>H</i>-indol-3-yl]acrylate","","- C26 H23 N O4 S -","- C26 H23 N O4 S -","- C104 H92 N4 O16 S4 -","4","1","WN2193","K. Chinnakali; R. Surendran; R. Balamurugan; A. K. Mohanakrishnan; Hoong-Kun Fun","Ethyl 3-[2-benzyl-1-(phenylsulfonyl)-1<i>H</i>-indol-3-yl]acrylate","Acta Crystallographica Section E","2007","63","9","o3856","o3856","10.1107/S1600536807040536","","","0.71073","MoKα","","0.0704","0.0476","","","0.1074","0.1191","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215298","8.469","0.0004","9.0215","0.0004","10.3137","0.0004","74.363","0.003","83.63","0.003","70.847","0.003","716.61","0.06","120","2","120","2","","","","","","","","4","P -1","-P 1","2","Dihydrocarbamazepine formamide","10,11-dihydro-<i>5H</i>-dibenz[<i>b,f</i>]azepine-5-carboxamide‒formamide solvate (1/1)","","- C16 H17 N3 O2 -","- C16 H17 N3 O2 -","- C32 H34 N6 O4 -","2","1","WN2194","Johnston, Andrea; Florence, Alastair J.; Fernandes, Philippe; Shankland, Norman; Kennedy, Alan R.","10,11-Dihydrocarbamazepine‒formamide solvate (1/1)","Acta Crystallographica Section E","2007","63","9","o3888","o3889","10.1107/S1600536807041049","","","0.71073","MoKα","","0.1375","0.0738","","","0.154","0.1935","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215299","11.854","0.001","7.2039","0.0009","15.653","0.002","90","","108.67","0.009","90","","1266.3","0.3","299","2","299","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,4-Dichlorophenyl 4-methylbenzoate","","- C14 H10 Cl2 O2 -","- C14 H10 Cl2 O2 -","- C56 H40 Cl8 O8 -","4","1","WN2195","B. Thimme Gowda; Sabine Foro; K. S. Babitha; Hartmut Fuess","2,4-Dichlorophenyl 4-methylbenzoate","Acta Crystallographica Section E","2007","63","9","o3877","o3877","10.1107/S1600536807041050","","","1.5418","CuKα","","0.0486","0.0443","","","0.1258","0.1299","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215300","11.0082","0.0007","10.7499","0.0006","11.5415","0.0007","90","","117.122","0.009","90","","1215.6","0.16","203","","203","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-3-(4-Fluorophenyl)-1-(4-methylphenyl)prop-2-en-1-one","","- C16 H13 F O -","- C16 H13 F O -","- C64 H52 F4 O4 -","4","1","WW2095","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Narayana, B.; Veena, K.","(<i>E</i>)-3-(4-Fluorophenyl)-1-(4-methylphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","9","o3833","o3833","10.1107/S160053680703989X","","","0.71073","MoKα","","0.1353","0.0495","","","0.1091","0.1373","","","","","","0.892","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215301","11.638","0.002","15.667","0.003","17.016","0.003","90","","90","","90","","3102.6","1","153","2","153","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","N-(4-hydroxybenzylidene)-N'-(2-(4-hydroxybenzylideneamino)ethyl)ethane- 1,2-diamine","N-[2-(4-hydroxybenzylideneamino)ethyl]-N-[2-(4- oxidobenzylideneamino)ethyl]ammonium","","- C18 H21 N3 O2 -","- C18 H21 N3 O2 -","- C144 H168 N24 O16 -","8","1","XU2286","Xiu-Mei Tian; Gang Liu; Yue Feng; Ji-De Wang","<i>N</i>-[2-(4-Hydroxybenzylideneamino)ethyl]-<i>N</i>-[2-(4-oxidobenzylideneamino)ethyl]ammonium","Acta Crystallographica Section E","2007","63","9","o3701","o3701","10.1107/S1600536807037397","","","0.71073","MoKα","","0.041","0.036","","","0.108","0.112","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215302","15.6505","0.0019","15.6505","0.0019","5.012","0.0014","90","","90","","120","","1063.2","0.3","293","2","293","2","","","","","","","","5","P 31","P 31","144","","Poly[(μ~3~-N,N-dibenzyldithiocarbamato-κ^4^S,S':S:S')silver(I)]","","- C15 H14 Ag N S2 -","- C15 H14 Ag N S2 -","- C45 H42 Ag3 N3 S6 -","3","1","XU2287","Xia Yin; Mu-Biao Xie; Wei-Guang Zhang; Jun Fan","Poly[(μ~3~-<i>N</i>,<i>N</i>-dibenzyldithiocarbamato-κ^4^<i>S</i>,<i>S</i>':<i>S</i>:<i>S</i>')silver(I)]","Acta Crystallographica Section E","2007","63","9","m2273","m2273","10.1107/S1600536807035180","","","0.71073","MoKα","","0.099","0.045","","","0.065","0.08","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215303","10.7765","0.001","16.9259","0.0017","10.8518","0.001","90","","116.78","0.001","90","","1767.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-[2-(1,3-Dioxoisoindolin-2-yl)phenyl]isoindoline-1,3-dione","","- C22 H12 N2 O4 -","- C22 H12 N2 O4 -","- C88 H48 N8 O16 -","4","1","XU2298","Xiao-Yan Wu; Dong-Sheng Zhu; Yan-Hua Wang; Chao-Guang Zhu","2-[2-(1,3-Dioxoisoindolin-2-yl)phenyl]isoindoline-1,3-dione","Acta Crystallographica Section E","2007","63","9","o3694","o3694","10.1107/S1600536807037038","","","0.71073","MoKα","","0.061","0.041","","","0.086","0.094","","","","","","0.951","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215304","8.487","0.005","9.167","0.005","10.557","0.005","85.282","0.005","83.264","0.005","89.711","0.005","812.9","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","4,4',6,6'-Tetramethyl-2,2'-(ethylenedithio)dipyrimidine","","- C14 H18 N4 S2 -","- C14 H18 N4 S2 -","- C28 H36 N8 S4 -","2","1","XU2299","Wu, Guang-Hui; Wu, Xin-Min; Zhang, Jing-Ping; Liu, Tian-Bao","4,4',6,6'-Tetramethyl-2,2'-(ethylenedithio)dipyrimidine","Acta Crystallographica Section E","2007","63","9","o3776","o3776","10.1107/S1600536807038858","","","0.71069","MoKα","","0.052","0.043","","","0.136","0.144","","","","","","1.375","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215305","9.6739","0.0007","12.993","0.001","14.5927","0.0011","68.148","0.001","86.352","0.001","75.553","0.001","1647.7","0.2","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[[diaqua(3-nitrobenzoato-κ^2^O,O')erbium(III)]-di-μ-3-\ nitrobenzoato-κ^4^O:O'] 2,2'-diamino-4,4'-bi-1,3-thiazole]","","- C27 H22 Er N7 O14 S2 -","- C27 H22 Er N7 O14 S2 -","- C54 H44 Er2 N14 O28 S4 -","2","1","XU2305","Bing-Xin Liu; Guang-Hua Chen; Liang-Jun Zhang","<i>catena</i>-Poly[[[diaqua(3-nitrobenzoato-κ^2^<i>O</i>,<i>O</i>')erbium(III)]-di-μ-3-nitrobenzoato-κ^4^<i>O</i>:<i>O</i>'] 2,2'-diamino-4,4'-bi-1,3-thiazole]","Acta Crystallographica Section E","2007","63","9","m2263","m2264","10.1107/S1600536807037087","","","0.71073","MoKα","","0.038","0.032","","","0.064","0.066","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215306","9.917","0.003","6.927","0.003","10.518","0.003","90","","109.35","0.03","90","","681.7","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2-[Hydroxy(4-nitrophenyl)methyl]-4-methylcyclohexanone","","- C14 H17 N O4 -","- C14 H17 N O4 -","- C28 H34 N2 O8 -","2","1","XU2309","You-Ping Li","2-[Hydroxy(4-nitrophenyl)methyl]-4-methylcyclohexanone","Acta Crystallographica Section E","2007","63","9","o3834","o3834","10.1107/S1600536807039943","","","0.71073","MoKα","","0.113","0.069","","","0.177","0.205","","","","","","0.97","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215307","11.2363","0.0002","11.9889","0.0003","12.8785","0.0004","90","","109.886","0.01","90","","1631.43","0.13","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N-Bis[2-(2-furyl)-2-(hydroxyimino)ethyl]aniline","","- C18 H17 N3 O4 -","- C18 H17 N3 O4 -","- C72 H68 N12 O16 -","4","1","XU2310","Özel Güven, Özden; Çaylak, Nagihan; Hökelek, Tuncer","<i>N</i>,<i>N</i>-Bis[2-(2-furyl)-2-(hydroxyimino)ethyl]aniline","Acta Crystallographica Section E","2007","63","9","o3827","o3828","10.1107/S1600536807039864","","","0.71073","MoKα","","0.1362","0.0419","","","0.0884","0.1102","","","","","","0.992","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215308","5.6168","0.0007","31.132","0.003","5.7361","0.0008","90","","91.533","0.002","90","","1002.7","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N,N'-Bis(4-chlorobenzyl)ethane-1,2-diammonium dinitrate","","- C16 H20 Cl2 N4 O6 -","- C16 H20 Cl2 N4 O6 -","- C32 H40 Cl4 N8 O12 -","2","0.5","XU2312","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Xia, Hai-Tao","<i>N</i>,<i>N</i>'-Bis(4-chlorobenzyl)ethane-1,2-diammonium dinitrate","Acta Crystallographica Section E","2007","63","9","o3880","o3880","10.1107/S1600536807040949","","","0.71073","MoKα","","0.066","0.0564","","","0.1615","0.1691","","","","","","1.004","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215309","9.597","0.0002","10.0316","0.0003","12.4952","0.0003","98.498","0.015","107.499","0.018","96.362","0.019","1119.21","0.16","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","(3aR,10bR)-3a,4,10,10b-Tetrahydro-2H-furo[2,3-a]carbazol-5(3H)-one","","- C14 H13 N O2 -","- C14 H13 N O2 -","- C56 H52 N4 O8 -","4","2","XU2317","Çaylak, Nagihan; Hökelek, Tuncer; Uludağ, Nesimi; Patır, Süleyman","3a,4,10,10b-Tetrahydro-2<i>H</i>-furo[2,3-<i>a</i>]carbazol-5(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","9","o3913","o3914","10.1107/S1600536807041608","","","0.71073","MoKα","","0.2067","0.0589","","","0.123","0.1694","","","","","","0.957","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215310","10.8821","0.0019","9.5688","0.0016","12.952","0.002","90","","95.754","0.004","90","","1341.9","0.4","223","2","223","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(1S,2S,3S)-N-(2-(4-Chlorophenyl)-1-{N-[2-methyl-1-(N- methylcarbamoyl)propyl]carbamoyl}-3-phenylcyclopropyl)benzamide","","- C29 H30 Cl N3 O3 -","- C29 H30 Cl N3 O3 -","- C58 H60 Cl2 N6 O6 -","2","1","ZL2036","Wan-Yun Huang; Gui-Fa Su; Cheng-Xue Pan; Zi-Lu Chen; Yong Zhang","(1<i>S</i>,2<i>S</i>,3<i>S</i>)-<i>N</i>-(2-(4-Chlorophenyl)-1-{<i>N</i>-[2-methyl-1-(<i>N</i>-methylcarbamoyl)propyl]carbamoyl}-3-phenylcyclopropyl)benzamide","Acta Crystallographica Section E","2007","63","9","o3743","o3743","10.1107/S1600536807038391","","","0.7107","MoKα","","0.0443","0.039","","","0.0831","0.0868","","","","","","1.089","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215311","8.1495","0.0004","8.1823","0.0004","11.2007","0.0006","93.584","0.001","92.941","0.001","112.197","0.001","687.91","0.06","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","5-Iodo-3-methylsulfinyl-2-phenyl-1-benzofuran","","- C15 H11 I O2 S -","- C15 H11 I O2 S -","- C30 H22 I2 O4 S2 -","2","1","ZL2044","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","5-Iodo-3-methylsulfinyl-2-phenyl-1-benzofuran","Acta Crystallographica Section E","2007","63","9","o3745","o3745","10.1107/S1600536807038822","","","0.71073","MoKα","","0.0177","0.0171","","","0.0438","0.0441","","","","","","1.086","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215312","6.847","0.003","10.839","0.004","14.11","0.006","90","","101.622","0.006","90","","1025.7","0.7","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-phenyl-4H-thiazolo[3,2-a][1,3,5]triazine-4-thione","","- C11 H7 N3 S2 -","- C11 H7 N3 S2 -","- C44 H28 N12 S8 -","4","1","ZL2050","Yunus, Uzma; Tahir, Mohammad Kalim; Bhatti, Moazzam Hussain; Ali, Saqib; Helliwell, Madeleine","2-Phenyl-4<i>H</i>-thiazolo[3,2-<i>a</i>][1,3,5]triazine-4-thione","Acta Crystallographica Section E","2007","63","9","o3690","o3690","10.1107/S1600536807036963","","","0.71073","MoKα","","0.0358","0.031","","","0.087","0.0883","","","","","","1.153","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215313","7.5559","0.001","12.3351","0.0015","36.597","0.004","90","","90","","90","","3410.9","0.7","296","2","296","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-[(4-Hexyloxyphenyl)iminomethyl]benzene-1,4-diol","","- C19 H23 N O3 -","- C19 H23 N O3 -","- C152 H184 N8 O24 -","8","1","ZL2051","Herrera, Ana M.; Bernès, Sylvain; López, Delia","2-[(4-Hexyloxyphenyl)iminomethyl]benzene-1,4-diol","Acta Crystallographica Section E","2007","63","9","o3853","o3853","10.1107/S1600536807040408","","","0.71073","MoKα","","0.096","0.0515","","","0.1311","0.1582","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215314","5.2406","0.0011","7.8236","0.0014","9.718","0.002","90","","94.2","0.02","90","","397.37","0.14","100","2","","","","","","","","","","3","P 1 21 1","P 2yb","4","","(<i>S</i>)-(2,2-Dimethyl-5-oxo-1,3-dioxolan-4-yl)acetic acid","","- C7 H10 O5 -","- C7 H10 O5 -","- C14 H20 O10 -","2","1","ZL2053","Stocksdale, Mark G.; Margaret K. Padgitt; Berg, Michael A. G.; Slebodnick, Carla","(<i>S</i>)-(2,2-Dimethyl-5-oxo-1,3-dioxolan-4-yl)acetic acid","Acta Crystallographica Section E","2007","63","9","o3767","o3768","10.1107/S1600536807038317","","","1.54184","CuKα","","","0.0253","","","","0.0643","","","","","","1.132","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215315","6.7576","0.0009","8.6138","0.0011","12.1019","0.0015","95.588","0.001","104.037","0.001","102.496","0.001","658.81","0.15","291","2","291","2","","","","","","","","7","P -1","-P 1","2","","Dichloridobis(methanol-κO)bis(6-methyl-3-phenyl-1,2,4-\ triazolo[3,4-b][1,3,4]thiadiazole-κN^1^)cadmium(II)","","- C22 H24 Cd Cl2 N8 O2 S2 -","- C22 H24 Cd Cl2 N8 O2 S2 -","- C22 H24 Cd Cl2 N8 O2 S2 -","1","0.5","ZL2054","Peng-Zhi Hong; Wen-Dong Song; Zao-He Wu","Dichloridobis(methanol-κ<i>O</i>)bis(6-methyl-3-phenyl-1,2,4-triazolo[3,4-<i>b</i>][1,3,4]thiadiazole-κ<i>N</i>^1^)cadmium(II)","Acta Crystallographica Section E","2007","63","9","m2297","m2297","10.1107/S1600536807038524","","","0.71073","MoKα","","0.0191","0.0187","","","0.0502","0.0505","","","","","","1.123","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215316","8.229","0.0016","13.304","0.003","11.691","0.002","90","","92.931","0.003","90","","1278.2","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","{3,3'-[ethane-1,2-diylbis(methylimino)]dipropane-1-thiolato}nickel(II)","{3,3'-[ethane-1,2-diylbis(methylimino)]dipropane-1-thiolato}nickel(II)","","- C10 H22 N2 Ni S2 -","- C10 H22 N2 Ni S2 -","- C40 H88 N8 Ni4 S8 -","4","1","ZL2056","Grapperhaus, Craig A.; O'Toole, Martin G.; Mashuta, Mark S.","{3,3'-[Ethane-1,2-diylbis(methylimino)]bis(propane-1-thiolato)}nickel(II)","Acta Crystallographica Section E","2007","63","9","m2281","m2281","10.1107/S1600536807037725","","","0.71073","MoKα","","0.0231","0.0197","","","0.0498","0.0631","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215317","5.0622","0.0004","6.7001","0.0005","8.0543","0.0005","90","","91.706","0.005","90","","273.06","0.03","90","","90","","","","","","","","","4","P 1 21 1","P 2yb","4","L-Asparagine","L-Asparagine","","- C4 H8 N2 O3 -","- C4 H8 N2 O3 -","- C8 H16 N4 O6 -","2","1","ZL2057","Yamada, Kazuhiko; Hashizume, Daisuke; Shimizu, Tadashi; Yokoyama, Shigeyuki","<small>L</small>-Asparagine","Acta Crystallographica Section E","2007","63","9","o3802","o3803","10.1107/S1600536807039505","","","0.71073","MoKα","","0.0346","0.0324","","","0.0834","0.0853","","","","","","1.082","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215318","7.6977","0.001","29.54","0.004","10.7808","0.0015","90","","90.76","0.002","90","","2451.2","0.6","100","1","100","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(2-phenylethylammonium) tetraaquadichloridonickel(II) dichloride dihydrate","","- C16 H36 Cl4 N2 Ni O6 -","- C16 H36 Cl4 N2 Ni O6 -","- C64 H144 Cl16 N8 Ni4 O24 -","4","1","ZL2059","Arkenbout, Anne H.; Meetsma, Auke; Palstra, Thom T. M.","Bis(2-phenylethylammonium) tetraaquadichloridonickel(II) dichloride dihydrate","Acta Crystallographica, Section E: Structure Reports Online","2007","63","9","m2421","m2421","10.1107/S160053680704130X","","","0.71073","MoKα","","0.0891","0.0415","","","0.0847","0.1001","","","","","","0.957","","","","has coordinates,has Fobs","208984","2020-10-21","18:00:00",""
"2215319","9.777","0.002","12.304","0.003","13.716","0.003","67.84","0.03","81.97","0.03","68.41","0.03","1420.9","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>-(3,4-Dimethoxybenzylidene)-4-methylaniline","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C64 H68 N4 O8 -","4","2","AT2373","Li, Zhen-Jiang; Gao, Li; Meng, A-lan; Huang, Jun-e","<i>N</i>-(3,4-Dimethoxybenzylidene)-4-methylaniline","Acta Crystallographica Section E","2007","63","10","o4086","","10.1107/S1600536807043784","","","0.71073","MoKα","","0.1732","0.0633","","","0.1754","0.2289","","","","","","1.009","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215320","8.784","0.0018","12.914","0.003","13.747","0.003","90","","99.2","0.03","90","","1539.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-[(1S,3S)-3-acetyl-2,2-dimethylcyclobutyl]-N-(2,6-difluorophenyl)acetamide","","- C16 H19 F2 N O2 -","- C16 H19 F2 N O2 -","- C64 H76 F8 N4 O8 -","4","1","AT2381","Yan-bai Yin; Chun-rui Han; Zhan-qian Song; Zong-de Wang","2-[(1<i>S</i>,3<i>S</i>)-3-Acetyl-2,2-dimethylcyclobutyl]-<i>N</i>-(2,6-difluorophenyl)acetamide","Acta Crystallographica Section E","2007","63","10","o4048","o4048","10.1107/S1600536807043127","","","0.71073","MoKα","","0.1253","0.0688","","","0.1529","0.2068","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215321","12.648","0.003","12.647","0.003","21.915","0.004","90","","90","","90","","3505.5","1.3","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","{1-[(2-Morpholin-4-ylethylimino-κ^2^N,N')methyl]naphthalen-2-olato-κO} (thiocyanato-N)nickel(II)","","- C18 H19 N3 Ni O2 S -","- C18 H19 N3 Ni O2 S -","- C144 H152 N24 Ni8 O16 S8 -","8","1","AT2382","Yun-Peng Diao; Yuan-Zhi Wang; Ming-Dong Wang; Kun Li","{1-[(2-Morpholin-4-ylethylimino-κ^2^<i>N</i>,<i>N</i>')methyl]naphthalen-2-olato-κ<i>O</i>}(thiocyanato-<i>N</i>)nickel(II)","Acta Crystallographica Section E","2007","63","10","m2494","m2494","10.1107/S1600536807043073","","","0.71073","MoKα","","0.0881","0.0631","","","0.1248","0.1348","","","","","","1.164","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215322","5.9896","0.0007","15.2593","0.0018","21.581","0.002","90","","90","","90","","1972.4","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Poly[(μ~2~-1,4-benzenedicarboxylato)aquadipyridinecopper(II) 0.25-hydrate]","","- C18 H16.5 Cu N2 O5.25 -","- C18 H16 Cu N2 O5.25 -","- C72 H64 Cu4 N8 O21 -","4","1","AT2383","Wang, Ming-Sheng; Zhou, Guo-Wei; Guo, Guo-Cong; Huang, Jin-Shun","Poly[(μ~2~-1,4-benzenedicarboxylato)aquadipyridinecopper(II) 0.25-hydrate]","Acta Crystallographica, Section E","2007","63","10","m2524","m2524","10.1107/S1600536807043942","","","0.71073","MoKα","","0.1223","0.0653","","","0.1243","0.1408","","","","","","1.007","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2215323","7.22","0.002","13.873","0.002","33.63","0.005","90","","90","","90","","3368.5","1.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Azido{1-[(2-diethylaminoethylimino-κ^2^N,N')methyl]\ naphthalen-2-olato-κO}nickel(II)","","- C17 H21 N5 Ni O -","- C17 H21 N5 Ni O -","- C136 H168 N40 Ni8 O8 -","8","1","AT2384","Yun-Peng Diao; Shan-Shan Huang; Bao-Jing Zhang; Kun Li","Azido{1-[(2-diethylaminoethylimino-κ^2^<i>N</i>,<i>N</i>')methyl]naphthalen-2-olato-κ<i>O</i>}nickel(II)","Acta Crystallographica Section E","2007","63","10","m2495","m2495","10.1107/S1600536807043103","","","0.71073","MoKα","","0.0854","0.0551","","","0.1363","0.1523","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215324","19.789","0.008","4.809","0.002","12.106","0.006","90","","90","","90","","1152.1","0.9","113","2","113","2","","","","","","","","5","P n a 21","P 2c -2n","33","","(E)-N'-[(5-Methyl-2-thienyl)methylene]furan-2-carbohydrazide monohydrate","","- C11 H12 N2 O3 S -","- C11 H12 N2 O3 S -","- C44 H48 N8 O12 S4 -","4","1","AT2385","Jing, Zuo-Liang; Yu, Ming; Chen, Xin","(<i>E</i>)-<i>N</i>'-[(5-Methyl-2-thienyl)methylene]furan-2-carbohydrazide monohydrate","Acta Crystallographica Section E","2007","63","10","o3992","o3992","10.1107/S1600536807043115","","","0.7107","MoKα","","0.0457","0.0437","","","0.0904","0.0915","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215325","9.743","0.004","10.226","0.004","10.975","0.004","99.167","0.005","114.399","0.005","103.444","0.005","927.4","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(1H-Benzotriazol-1-yl)-1-(2-fluorobenzoyl)ethyl isonicotinate","","- C21 H15 F N4 O3 -","- C21 H15 F N4 O3 -","- C42 H30 F2 N8 O6 -","2","1","AT2386","Jun Wan; Fang Li; Wu-Lan Zeng; Jing Li; Sai Bi","2-(1<i>H</i>-Benzotriazol-1-yl)-1-(2-fluorobenzoyl)ethyl isonicotinate","Acta Crystallographica Section E","2007","63","10","o3989","o3989","10.1107/S1600536807043310","","","0.71073","MoKα","","0.0589","0.0424","","","0.1005","0.1117","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215326","14.23","0.0014","9.412","0.0008","10.728","0.001","90","","101.29","0.004","90","","1409","0.2","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-Dibutyl-1H-purine-2,6(3H,7H)-dione","","- C13 H20 N4 O2 -","- C13 H20 N4 O2 -","- C52 H80 N16 O8 -","4","1","AT2387","Jing, Zuo-Liang; Yu, Ming; Chen, Xin","1,3-Dibutyl-1<i>H</i>-purine-2,6(3<i>H</i>,7<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","10","o3996","o3996","10.1107/S1600536807043334","","","0.7107","MoKα","","0.0701","0.0572","","","0.1365","0.1469","","","","","","1.109","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215327","11.645","0.002","12.363","0.002","12.507","0.002","71.619","0.012","63.139","0.012","66.862","0.013","1456.1","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H80 B4 Fe2 N12 O4 -","- C54 H80 B4 Fe2 N12 O4 -","- C54 H80 B4 Fe2 N12 O4 -","1","0.5","AT2388","Zhang, Fan; Lerner, Hans-Wolfram; Bolte, Michael","Bis(μ-{(1,3-phenylene)[<i>tert</i>-butyl(pyrazol-1-yl)borato][<i>tert</i>-butyl(dipyrazol-1-yl)borato]})dihydroxydiiron(II) tetrahydrofuran disolvate","Acta Crystallographica Section E","2007","63","10","m2505","m2505","10.1107/S1600536807043346","","","0.71073","MoKα","","0.0976","0.0625","","","0.1427","0.1548","","","","","","0.887","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215328","15.076","0.003","6.6127","0.0013","20.297","0.004","90","","98.46","0.03","90","","2001.5","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-Benzylidene-o-(diphenylphosphino)aniline","","- C25 H20 N P -","- C25 H20 N P -","- C100 H80 N4 P4 -","4","1","AT2389","Li, Aike; Chen, Jianxin; Li, Zhongshui; Zhang, Wenjie; Zhu, Meiping","<i>N</i>-Benzylidene-<i>o</i>-(diphenylphosphino)aniline","Acta Crystallographica Section E","2007","63","10","o4020","o4020","10.1107/S1600536807043358","","","0.71073","MoKα","","0.0891","0.0473","","","0.1325","0.1633","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215331","43.71","0.003","9.5091","0.0016","28.476","0.003","90","","130.37","0.003","90","","9017.5","1.9","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis{N-[2-(2-hydroxy-3-methoxybenzylamino)ethyl]-N'-(2-hydroxy-3-methoxybenzyl) ethane-1,2-diamine}nickel(II) dinitrate 1.25-hydrate","","- C160 H242 N32 Ni4 O61 -","- C40 H60.5 N8 Ni O15.25 -","- C320 H484 N64 Ni8 O122 -","8","1","AT2393","Xia, Hai-Tao; Liu, Yu-Fen; Wang, Da-Qi; Yang, Shu-Ping","Bis{<i>N</i>-[2-(2-hydroxy-3-methoxybenzylamino)ethyl]-<i>N</i>'-(2-hydroxy-3-methoxybenzyl)ethane-1,2-diamine}nickel(II) dinitrate 1.25-hydrate","Acta Crystallographica Section E","2007","63","10","m2512","m2513","10.1107/S160053680704353X","","","0.71073","MoKα","","0.1411","0.0641","","","0.1341","0.1537","","","","","","1.005","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215332","16.5354","0.0007","4.6157","0.0002","23.1486","0.0011","90","","102.489","0.005","90","","1724.95","0.14","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2E)-1-(2,4-Dichlorophenyl)-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-one","","- C18 H16 Cl2 O4 -","- C18 H16 Cl2 O4 -","- C72 H64 Cl8 O16 -","4","1","AT2394","Butcher, Ray J.; Jasinski, Jerry P.; Mayekar, Anil N.; Narayana, B.; Yathirajan, H. S.","(2<i>E</i>)-1-(2,4-Dichlorophenyl)-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","10","o4059","o4060","10.1107/S1600536807044303","","","0.71073","MoKα","","0.127","0.0422","","","0.0904","0.1139","","","","","","0.883","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215333","24.645","0.003","14.1144","0.0019","18.162","0.002","90","","120.575","0.002","90","","5439.3","1.2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Dihydrate bis[(naphthalene-1-acetato- <i>κO</i>)(1,10-phenanthroline-<i>κ^2^N</i>,<i>N' </i>)] erbium(III) (1-naphthaleneacetate) hydrate","Diaquabis(1-naphthaleneacetato-κ<i>O</i>)bis(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')erbium(III) 1-naphthaleneacetate monohydrate","","- C60 H49 Er N4 O9 -","- C60 H49 Er N4 O9 -","- C240 H196 Er4 N16 O36 -","4","0.5","AT2395","Liu, Y.-F.; Xia, H.-T.; Wang, D.-Q.; Yang, S.-P.; Meng, Y.-L.","Diaquabis(1-naphthaleneacetato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')erbium(III) 1-naphthaleneacetate monohydrate","Acta Crystallographica Section E","2007","63","10","m2544","m2544","10.1107/S1600536807044546","","","0.71073","MoKα","","0.1034","0.0784","","","0.1949","0.2195","","","","","","1.003","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215334","10.4059","0.0019","13.699","0.002","15.196","0.002","113.549","0.003","96.908","0.002","99.792","0.002","1913.9","0.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","4-Hydroxy-<i>N</i>,<i>N</i>-bis(2-hydroxy-3-methoxybenzyl)aniline","","- C22 H23 N O5 -","- C22 H23 N O5 -","- C88 H92 N4 O20 -","4","2","AT2396","Liu, Y.-F.; Xia, H.-T.; Wang, D.-Q.; Yang, S.-P.; Meng, Y.-L.","4-Hydroxy-<i>N</i>,<i>N</i>-bis(2-hydroxy-3-methoxybenzyl)aniline","Acta Crystallographica Section E","2007","63","10","o4070","o4070","10.1107/S1600536807044558","","","0.71073","MoKα","","0.1413","0.0498","","","0.0559","0.0674","","","","","","0.89","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215335","7.176","0.004","7.789","0.004","9.8","0.004","79.74","0.04","84.4","0.04","83.53","0.04","533.9","0.5","296","","296","","","","","","","","","3","P -1","-P 1","2","","(1Z)-Phthalazin-1(2H)-one isopropylidenehydrazone","","- C11 H12 N4 -","- C11 H12 N4 -","- C22 H24 N8 -","2","1","AT2397","Büyükgüngör, Orhan; Odabaşoğlu, Mustafa; A. M. Vijesh; H. S. Yathirajan","(1<i>Z</i>)-Phthalazin-1(2<i>H</i>)-one isopropylidenehydrazone","Acta Crystallographica Section E","2007","63","10","o4084","o4085","10.1107/S1600536807044807","","","0.71073","MoKα","","0.0511","0.0415","","","0.1163","0.123","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215336","8.2941","0.0004","7.0893","0.0005","22.2665","0.0011","90","","109.545","0.004","90","","1233.82","0.13","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-{[2-(Trifluoromethyl)phenyl]hydrazono}pentane-2,4-dione","","- C12 H11 F3 N2 O2 -","- C12 H11 F3 N2 O2 -","- C48 H44 F12 N8 O8 -","4","1","AT2398","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan; B. K. Sarojini; B. Narayana","3-{[2-(Trifluoromethyl)phenyl]hydrazono}pentane-2,4-dione","Acta Crystallographica Section E","2007","63","10","o4135","o4136","10.1107/S1600536807045631","","","0.71073","MoKα","","0.0537","0.0443","","","0.1376","0.1451","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215337","14.497","0.002","6.1192","0.0014","14.732","0.002","90","","102.819","0.002","90","","1274.3","0.4","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(<i>E</i>)-4-Methoxy-<i>N</i>-(3,4-methylenedioxybenzylidene)aniline","","- C15 H13 N O3 -","- C15 H13 N O3 -","- C60 H52 N4 O12 -","4","2","AT2399","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Yu, Zhi-Qun","(<i>E</i>)-4-Methoxy-<i>N</i>-(3,4-methylenedioxybenzylidene)aniline","Acta Crystallographica Section E","2007","63","10","o4098","o4098","10.1107/S1600536807045503","","","0.71073","MoKα","","0.1783","0.1027","","","0.2505","0.3028","","","","","","0.952","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215338","11.366","0.001","24.875","0.002","9.075","0.0011","90","","112.425","0.002","90","","2371.7","0.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl N-(4-methyl-2-oxo-1<i>H</i>-benzopyran-7-yl)carbamate","","- C13 H13 N O4 -","- C13 H13 N O4 -","- C104 H104 N8 O32 -","8","2","AT2400","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Xia, Hai-Tao","Ethyl <i>N</i>-(4-methyl-2-oxo-1<i>H</i>-benzopyran-7-yl)carbamate","Acta Crystallographica Section E","2007","63","10","o4099","o4099","10.1107/S1600536807045515","","","0.71073","MoKα","","0.1139","0.0501","","","0.1062","0.1438","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215339","54.05","0.003","7.353","0.001","6.483","0.0009","90","","90","","90","","2576.5","0.5","298","2","298","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","4-Methoxy-<i>N</i>-(3,4-methylenedioxybenzyl)aniline","","- C15 H15 N O3 -","- C15 H15 N O3 -","- C120 H120 N8 O24 -","8","1","AT2401","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Zhao, Cui","4-Methoxy-<i>N</i>-(3,4-methylenedioxybenzyl)aniline","Acta Crystallographica Section E","2007","63","10","o4100","o4100","10.1107/S1600536807045527","","","0.71073","MoKα","","0.1264","0.0938","","","0.1985","0.2144","","","","","","1.069","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215340","3.8488","0.0018","13.629","0.005","11.083","0.005","90","","93.17","0.04","90","","580.5","0.4","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Fluorobenzaldehyde [(E)-4-fluorobenzylidene]hydrazone","","- C14 H10 F2 N2 -","- C14 H10 F2 N2 -","- C28 H20 F4 N4 -","2","0.5","AT2402","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan; K. Sunil; B. Narayana","4-Fluorobenzaldehyde [(<i>E</i>)-4-fluorobenzylidene]hydrazone","Acta Crystallographica Section E","2007","63","10","o4145","o4146","10.1107/S1600536807045989","","","0.71073","MoKα","","0.0679","0.0489","","","0.1298","0.1427","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215341","13.529","0.002","15.095","0.002","22.171","0.003","90","","103.866","0.002","90","","4395.8","1.1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexakis(μ-naphthalene-1-acetato)bis[(1,10-phenanthroline)europium(III)] N,N-dimethylformamide disolvate","","- C102 H84 Eu2 N6 O14 -","- C102 H84 Eu2 N6 O14 -","- C204 H168 Eu4 N12 O28 -","2","0.5","AT2403","Liu, Yu-Fen; Xia, Hai-Tao; Wang, Da-Qi; Yang, Shu-Ping","Hexakis(μ-naphthalene-1-acetato)bis[(1,10-phenanthroline)europium(III)] <i>N</i>,<i>N</i>-dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","10","m2608","m2609","10.1107/S1600536807046818","","","0.71073","MoKα","","0.1197","0.0566","","","0.0917","0.1169","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215342","13.0204","0.0012","17.1379","0.0019","20.417","0.003","66.336","0.002","81.554","0.002","85.998","0.003","4127.3","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Hexakis(μ-naphthalene-1-acetato)bis[(1,10-phenanthroline)praseodymium(III)] <i>N</i>,<i>N</i>-dimethylformamide solvate","","- C99 H77 N5 O13 Pr2 -","- C99 H77 N5 O13 Pr2 -","- C198 H154 N10 O26 Pr4 -","2","1","AT2404","Xia, Hai-Tao; Liu, Yu-Fen; Wang, Da-Qi; Chen, Liang","Hexakis(μ-naphthalene-1-acetato)bis[(1,10-phenanthroline)praseodymium(III)] <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2007","63","10","m2610","m2611","10.1107/S160053680704682X","","","0.71073","MoKα","","0.0756","0.0403","","","0.0786","0.1004","","","","","","1.079","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215343","13.4619","0.0016","15.086","0.002","22.166","0.002","90","","103.584","0.002","90","","4375.7","0.9","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexakis(μ-naphthalene-1-acetato)bis[(1,10-phenanthroline)terbium(III)] <i>N</i>,<i>N</i>-dimethylformamide disolvate","","- C102 H84 N6 O14 Tb2 -","- C102 H84 N6 O14 Tb2 -","- C204 H168 N12 O28 Tb4 -","2","0.5","AT2407","Xia, Hai-Tao; Liu, Yu-Fen; Wang, Da-Qi; Yang, Shu-Ping","Hexakis(μ-naphthalene-1-acetato)bis[(1,10-phenanthroline)terbium(III)] <i>N</i>,<i>N</i>-dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","10","m2624","m2624","10.1107/S1600536807047095","","","0.71073","MoKα","","0.1317","0.0773","","","0.1559","0.1965","","","","","","1.072","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215344","13.4762","0.0019","15.103","0.002","22.178","0.002","90","","103.698","0.002","90","","4385.5","0.9","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexakis(μ-naphthalene-1-acetato)bis[(1,10-phenanthroline)gadolinium(III)] N,N-dimethylformamide disolvate","","- C102 H84 Gd2 N6 O14 -","- C102 H84 Gd2 N6 O14 -","- C204 H168 Gd4 N12 O28 -","2","0.5","AT2408","Liu, Yu-Fen; Xia, Hai-Tao; Wang, Da-Qi; Yang, Shu-Ping","Hexakis(μ-naphthalene-1-acetato)bis[(1,10-phenanthroline)gadolinium(III)] <i>N</i>,<i>N</i>-dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","10","m2625","m2626","10.1107/S1600536807047101","","","0.71073","MoKα","","0.083","0.0408","","","0.066","0.0814","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215345","7.0601","0.0006","10.5406","0.0006","15.7074","0.001","90","","90","","90","","1168.91","0.14","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Di-<i>tert</i>-butylmethylphosphonium chloride","","- C9 H22 Cl P -","- C9 H22 Cl P -","- C36 H88 Cl4 P4 -","4","1","AT2409","Müller, Manuela; Lerner, Hans-Wolfram; Bolte, Michael","Di-<i>tert</i>-butylmethylphosphonium chloride","Acta Crystallographica Section E","2007","63","10","o4150","o4150","10.1107/S1600536807046417","","","0.71073","MoKα","","0.024","0.0231","","","0.0595","0.06","","","","","","1.076","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215346","18.2558","0.0006","15.9362","0.0006","11.7096","0.0004","90","","110.591","0.002","90","","3189","0.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Diaquabis(1,10-phenanthroline-κ2N,N')nickel(II) diperchlorate 0.4-hydrate","","- C24 H20.8 Cl2 N4 Ni O10.4 -","- C24 H20 Cl2 N4 Ni O10.4 -","- C96 H80 Cl8 N16 Ni4 O41.6 -","4","0.5","AV3106","Xiao-Yong Tang; Yong-Cai Qiu; Feng Sun; Shan-Tang Yue","Diaquabis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nickel(II) diperchlorate 0.4-hydrate","Acta Crystallographica Section E","2007","63","10","m2515","m2515","10.1107/S1600536807043565","","","0.71073","MoKα","","0.1309","0.0711","","","0.2232","0.262","","","","","","1.076","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2215347","12.807","0.006","7.803","0.004","24.734","0.011","90","","90","","90","","2472","2","294","2","294","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(<i>E</i>)-4-Bromo-<i>N</i>'-(2-thienylmethylene)benzohydrazide","","- C12 H9 Br N2 O S -","- C12 H9 Br N2 O S -","- C96 H72 Br8 N16 O8 S8 -","8","1","BG2091","Jing, Zuo-Liang; Yu, Ming; Chen, Xin","(<i>E</i>)-4-Bromo-<i>N</i>'-(2-thienylmethylene)benzohydrazide","Acta Crystallographica Section E","2007","63","10","o3925","o3925","10.1107/S1600536807042006","","","0.71073","MoKα","","0.0839","0.0474","","","0.1266","0.1478","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215348","19.137","0.002","8.0716","0.0015","6.1464","0.0013","90","","90","","90","","949.4","0.3","298","2","298","2","","","","","","","","4","P m n 21","P 2ac -2","31","","1,3-Bis(2-hydroxybenzyl)-2,2-dimethyl-2,3-dihydro-1<i>H</i>-benzimidazole","","- C23 H24 N2 O2 -","- C23 H24 N2 O2 -","- C46 H48 N4 O4 -","2","0.5","BG2092","Yang, Shu-Ping; Wang, Da-Qi; Han, Li-Jun; Xia, Hai-Tao","1,3-Bis(2-hydroxybenzyl)-2,2-dimethyl-2,3-dihydro-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","10","o4088","o4088","10.1107/S1600536807044601","","","0.71073","MoKα","","0.0471","0.0379","","","0.1028","0.1179","","","","","","1.189","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215349","17.5813","0.0002","7.4369","0.0005","9.1807","0.0003","90","","116.436","0.003","90","","1074.86","0.09","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","D,L-aspartic acid","","- C4 H7 N O4 -","- C4 H7 N O4 -","- C32 H56 N8 O32 -","8","1","BG2096","Guo-Ming Wang; Zeng-Xin Li; Chun-Sheng Duan; Hui Li","<small>DL</small>-Aspartic acid","Acta Crystallographica Section E","2007","63","10","o4003","o4003","10.1107/S1600536807043097","","","0.71073","MoKα","","0.0434","0.0385","","","0.0997","0.1032","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215350","8.2621","0.0017","8.7358","0.0017","17.502","0.004","76.58","0.03","76.53","0.03","78.94","0.03","1182.2","0.5","295","2","295","2","","","","","","","","5","P -1","-P 1","2","Bis[(pyridine-κN)-di-3-(4-carboxylatophenoxy)propionato-κO]-cobalt(II)","Bis[3-(4-carboxyphenoxy)propionato-κ<i>O</i>]bis[3- (4-carboxyphenoxy)propionic acid-κ<i>O</i>]bis(pyridine-κ<i>N</i>)cobalt(II)","","- C50 H48 Co N2 O20 -","- C50 H48 Co N2 O20 -","- C50 H48 Co N2 O20 -","1","0.5","BG2101","Li-Li Kong; Shan Gao; Li-Hua Huo","Bis[3-(4-carboxyphenoxy)propionato-κ<i>O</i>]bis[3-(4-carboxyphenoxy)propionic acid-κ<i>O</i>]bis(pyridine-κ<i>N</i>)cobalt(II)","Acta Crystallographica Section E","2007","63","10","m2554","m2554","10.1107/S1600536807045229","","","0.71073","MoKα","","0.1307","0.0557","","","0.1554","0.215","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215351","8.2571","0.0017","8.2797","0.0017","12.521","0.003","105.97","0.03","92.13","0.03","118.51","0.03","708.6","0.4","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","(E)-N-[2-(Pyridin-2-yl)isoindolin-1-ylidene]pyridin-2-amine","","- C18 H14 N4 -","- C18 H14 N4 -","- C36 H28 N8 -","2","1","BG2102","Li-Na Zhu; Shan Gao; Li-Hua Huo; Hui Zhao","(<i>E</i>)-<i>N</i>-[2-(Pyridin-2-yl)isoindolin-1-ylidene]pyridin-2-amine","Acta Crystallographica Section E","2007","63","10","o4111","o4111","10.1107/S1600536807044984","","","0.71073","MoKα","","0.0521","0.0376","","","0.0998","0.1148","","","","","","1.134","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215352","6.7817","0.0009","9.1535","0.0014","15.057","0.002","90","","90","","90","","934.7","0.2","293","2","293","2","","","","","","","","5","I m m m","-I 2 2","71","","<i>catena</i>-Poly[tetramethylammonium [argentate(I)-di-μ-bromido]]","","- C4 H12 Ag Br2 N -","- C4 H16 Ag Br2 N -","- C16 H64 Ag4 Br8 N4 -","4","0.25","BG3057","Liu, Xi","<i>catena</i>-Poly[tetramethylammonium [argentate(I)-di-μ-bromido]]","Acta Crystallographica Section E","2007","63","10","m2619","m2619","10.1107/S1600536807046880","","","0.71073","MoKα","","0.0339","0.03","","","0.0661","0.0682","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215353","12.807","0.003","7.616","0.0015","34.43","0.007","90","","90","","90","","3358.2","1.2","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,3-Bis(3-nitrophenyl)quinoxaline","","- C20 H12 N4 O4 -","- C20 H12 N4 O4 -","- C160 H96 N32 O32 -","8","1","BH2119","Lei, Peng; Hu, Zhi-Zhi; Wang, Cui-Ping; Chen, Xing; Zhang, Zhi-Qiang","2,3-Bis(3-nitrophenyl)quinoxaline","Acta Crystallographica Section E","2007","63","10","o3969","o3969","10.1107/S1600536807042055","","","0.71073","MoKα","","0.1298","0.0569","","","0.1491","0.1903","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215354","5.843","0.002","7.224","0.003","25.459","0.009","90","","94.837","0.001","90","","1070.8","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexaaquacobalt(II) 4-hydroxybenzenesulfonate dihydrate","","- C12 H26 Co O16 S2 -","- C12 H26 Co O16 S2 -","- C24 H52 Co2 O32 S4 -","2","0.5","BH2133","Du, Jun-Min; Li, Qiang; Li, Wei; Lin, Hong-Mei; Guo, Guo-Cong","Hexaaquacobalt(II) 4-hydroxybenzenesulfonate dihydrate","Acta Crystallographica Section E","2007","63","10","m2597","m2597","10.1107/S1600536807045904","","","0.71073","MoKα","","0.0412","0.0338","","","0.0852","0.0902","","","","","","1.025","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215355","19.873","0.0015","17.4039","0.0013","21.0008","0.0016","90","","90","","90","","7263.5","0.9","294","2","294","2","","","","","","","","8","P b c n","-P 2n 2ab","60","","Bis[μ-bis(diphenylphosphino)amine-κ^2^<i>P</i>:<i>P</i>']bis[(1,10-\ phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(I)] bis(tetrafluoridoborate) dichloromethane solvate","","- C73 H58 B2 Cl2 Cu2 F8 N6 P4 -","- C73 H58 B2 Cl2 Cu2 F8 N6 P4 -","- C292 H232 B8 Cl8 Cu8 F32 N24 P16 -","4","0.5","BI2209","Juan Mo; Heng-Yu Qian; Xiang-Dang Du; Wen Chen","Bis[μ-bis(diphenylphosphino)amine-κ^2^<i>P</i>:<i>P</i>']bis[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(I)] bis(tetrafluoridoborate) dichloromethane solvate","Acta Crystallographica Section E","2007","63","10","m2449","m2449","10.1107/S1600536807037567","","","0.71073","MoKα","","0.0874","0.0489","","","0.1356","0.1945","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215356","7.3998","0.001","16.383","0.002","9.2162","0.0013","90","","92.322","0.002","90","","1116.4","0.3","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H26 N2 O7 -","- C24 H26 N2 O7 -","- C48 H52 N4 O14 -","2","1","BI2220","Yong Bao; Fen-Er Chen; Min-Qin Chen","(4'<i>S</i>)-4'-Ethyl-3',10'-dioxo-3',4',7',8'-tetrahydrospiro[1,3-dioxolane-2,6'-1'<i>H</i>,6'<i>H</i>-pyrano[3,4-<i>f</i>]indolizin]-4'-yl <i>N</i>-(1-phenylethyl)carbamate","Acta Crystallographica Section E","2007","63","10","o3941","o3941","10.1107/S1600536807038731","","","0.71073","MoKα","","0.0399","0.0344","","","0.0837","0.0872","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215357","20.6543","0.0003","3.7998","0.0001","21.6509","0.0003","90","","100.832","0.001","90","","1668.93","0.06","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Imidazolium 4-nitrophenolate 4-nitrophenol monohydrate","","- C15 H16 N4 O7 -","- C15 H16 N4 O7 -","- C60 H64 N16 O28 -","4","1","BI2228","Rodrigues, V. H.; Costa, M. M. R. R.; de Matos Gomes, E.; Belsley, M. S.","Imidazolium 4-nitrophenolate 4-nitrophenol monohydrate","Acta Crystallographica Section E","2007","63","10","o4031","o4031","10.1107/S1600536807039992","","","0.71073","MoKα","","0.0864","0.0466","","","0.1224","0.1569","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215358","7.7355","0.0009","10.4503","0.0017","17.185","0.003","77.971","0.012","89.779","0.011","81.075","0.011","1341.7","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Diaquachlorido(4-hydroxypyridine-2,6-carboxylato-κ^3^N,O,O')iron(III) 18-crown-6 dihydrate","","- C19 H35 Cl Fe N O15 -","- C19 H35 Cl Fe N O15 -","- C38 H70 Cl2 Fe2 N2 O30 -","2","1","BI2229","Guo-Wei Zhou; A-Qing Wu; Ming-Sheng Wang; Guo-Cong Guo; Jin-Shun Huang","Diaquachlorido(4-hydroxypyridine-2,6-carboxylato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>')iron(III) 18-crown-6 dihydrate","Acta Crystallographica Section E","2007","63","10","m2463","m2464","10.1107/S1600536807041955","","","0.71073","MoKα","","0.1145","0.0596","","","0.1156","0.1331","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215359","24.42","0.003","12.3883","0.0013","18.3113","0.0019","90","","127.564","0.001","90","","4391.1","0.8","292","2","292","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","2-Bromo-3-ethoxy-3-[4-(methylsulfanyl)phenyl]-1-[3-(<i>p</i>-tolyl)-4-\ sydnonyl]propan-1-one","","- C21 H21 Br N2 O4 S -","- C21 H21 Br N2 O4 S -","- C168 H168 Br8 N16 O32 S8 -","8","1","BI2231","S. J. Prathap; Satheesha Rai Nooji; Balakrishna Kalluraya; T. N. Guru Row","2-Bromo-3-ethoxy-3-[4-(methylsulfanyl)phenyl]-1-[3-(<i>p</i>-tolyl)-4-sydnonyl]propan-1-one","Acta Crystallographica Section E","2007","63","10","o3976","o3976","10.1107/S1600536807041931","","","0.71073","MoKα","","0.0628","0.0402","","","0.102","0.1098","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215362","8.697","0.004","10.164","0.005","12.212","0.006","71.111","0.007","72.765","0.006","79.16","0.007","970.4","0.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Hexamethylenetetraminium disalicylatoborate","","- C20 H21 B N4 O6 -","- C20 H21 B N4 O6 -","- C40 H42 B2 N8 O12 -","2","1","BI2234","Wei-He Han; Ping Li; Zhi-Hong Liu","Hexamethylenetetraminium disalicylatoborate","Acta Crystallographica Section E","2007","63","10","o3946","o3946","10.1107/S1600536807042146","","","0.71073","MoKα","","0.0818","0.0457","","","0.1046","0.129","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215364","17.7714","0.0006","6.4837","0.0002","18.972","0.0007","90","","103.997","0.001","90","","2121.13","0.12","295","2","295","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","4,4'-[Isopropylidenebis(p-phenyleneoxy)]dibutanoic acid","","- C23 H28 O6 -","- C23 H28 O6 -","- C92 H112 O24 -","4","0.5","BI2236","Ze-Bao Zheng; Ren-Tao Wu; Ning-Ning Ji; Yi-Feng Sun","4,4'-[Isopropylidenebis(<i>p</i>-phenyleneoxy)]dibutanoic acid","Acta Crystallographica Section E","2007","63","10","o3936","o3936","10.1107/S1600536807042195","","","0.71073","MoKα","","0.0693","0.0437","","","0.1064","0.1219","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215365","21.26","0.004","7.501","0.0015","20.819","0.004","90","","109.17","0.03","90","","3135.9","1.2","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[[(4,7-dimethyl-1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')(formato-κO)copper(II)]- μ-formato-κ^2^<i>O</i>:<i>O</i>'] monohydrate]","","- C16 H16 Cu N2 O5 -","- C16 H16 Cu N2 O5 -","- C128 H128 Cu8 N16 O40 -","8","1","BQ2034","Jian-Li Lin; Xue-ke Qiu; Yue-Qing Zheng","<i>catena</i>-Poly[[[(4,7-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(formato-κ<i>O</i>)copper(II)]-μ-formato-κ^2^<i>O</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2007","63","10","m2559","m2560","10.1107/S1600536807044650","","","0.71073","MoKα","","0.0731","0.0424","","","0.0916","0.1037","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215366","7.3563","0.0004","15.6735","0.0011","20.9978","0.0016","90","","90","","90","","2421","0.3","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","<i>catena</i>-{[(μ-Tetramethylthiourea-<i>S</i>)Ag][(Ag(CN)~2~]}","Poly[di-μ~2~-cyanido-κ^2^C:N;κ^2^N:C-μ~2~-N,N,N',N'- tetramethylthiourea-κ^2^S:S-disilver(I)]","","- C7 H12 Ag2 N4 S -","- C7 H12 Ag2 N4 S -","- C56 H96 Ag16 N32 S8 -","8","1","BQ2035","Hanif, Muhammad; Ahmad, Saeed; Altaf, Muhammad; Stoeckli-Evans, Helen","Poly[bis(μ~2~-cyanido)-κ^2^<i>C</i>:<i>N</i>;κ^2^<i>N</i>:<i>C</i>-(μ~2~-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylthiourea-κ^2^<i>S</i>:<i>S</i>)disilver(I)]","Acta Crystallographica Section E","2007","63","10","m2594","m2594","10.1107/S1600536807044844","","","0.71073","MoKα","","0.0422","0.0304","","","0.0655","0.0696","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215367","13.346","0.003","9.636","0.002","14.887","0.003","90","","95.668","0.004","90","","1905.1","0.7","290","2","290","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","4-(4-Chlorophenyl)-5-[2-methyl-1-(4-methylphenyl)-2-nitropropyl]-1,2,3- selenadiazole","","- C19 H18 Cl N3 O2 Se -","- C19 H18 Cl N3 O2 Se -","- C76 H72 Cl4 N12 O8 Se4 -","4","1","BT2479","Gunasekaran, B.; Manivannan, V.; Saravanan, S.; Muthusubramanian, S.; Nethaji, M.","4-(4-Chlorophenyl)-5-[2-methyl-1-(4-methylphenyl)-2-nitropropyl]-1,2,3-selenadiazole","Acta Crystallographica Section E","2007","63","10","o4024","o4024","10.1107/S1600536807043553","","","0.71073","MoKα","","0.0797","0.0441","","","0.0893","0.1023","","","","","","1.009","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215368","6.3751","0.0017","6.9998","0.0017","19.791","0.005","83.57","0.02","81.7","0.02","64.16","0.02","785.3","0.4","296","","296","","","","","","","","","5","P -1","-P 1","2","","3-(4-methylphenyl)-5-[4-(methylthio)phenyl]-4, 5-dihydro-1H-pyrazole-1-carbaldehyde","","- C18 H18 N2 O S -","- C18 H18 N2 O S -","- C36 H36 N4 O2 S2 -","2","1","BT2481","Butcher, Ray J.; Jasinski, Jerry P.; Prasad, D. Jagadeesh; Narayana, B.; Yathirajan, H. S.","3-(4-Methylphenyl)-5-[4-(methylthio)phenyl]-4,5-dihydro-1<i>H</i>-pyrazole-1-carbaldehyde","Acta Crystallographica Section E","2007","63","10","o4005","o4006","10.1107/S1600536807043000","","","0.71073","MoKα","","0.0976","0.0463","","","0.1185","0.141","","","","","","0.983","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215369","9.3523","0.0011","19.615","0.003","17.4933","0.001","90","","105.39","0.012","90","","3094","0.6","293","2","","","","","","","","","","7","C 1 c 1","C -2yc","9","","Diiodido-2κ2I-bis(4-methylpyridine-1κN)-μ-{2,2'-[1,3-propanediylbis (nitrilomethylidyne)]diphenolato-1κ4O,N,N',O':2κ2O,O'}nickel(II)zinc(II)","","- C29 H30 I2 N4 Ni O2 Zn -","- C29 H30 I2 N4 Ni O2 Zn -","- C116 H120 I8 N16 Ni4 O8 Zn4 -","4","1","BT2490","Tatar Yıldırım, Leyla; Atakol, Orhan; Kavak, Gülten","Diiodido-2κ^2^<i>I</i>-bis(4-methylpyridine-1κ<i>N</i>)-μ-{2,2'-[1,3-propanediylbis(nitrilomethylidyne)]diphenolato-1κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>':2κ^2^<i>O</i>,<i>O</i>'}nickel(II)zinc(II)","Acta Crystallographica Section E","2007","63","10","m2489","m2490","10.1107/S1600536807043061","","","0.71073","MoKα","","0.0784","0.0328","","","0.0644","0.0752","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215370","8.805","0.0005","8.8051","0.0007","16.6614","0.0014","90","","90","","90","","1291.74","0.17","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Poly[(μ~2~-2,2'-bi-1H-imidazole)bis(μ~3~-hydrogenphosphato)dizinc(II)]","","- C6 H8 N4 O8 P2 Zn2 -","- C6 H8 N4 O8 P2 Zn2 -","- C24 H32 N16 O32 P8 Zn8 -","4","0.5","BT2492","Min-Na Cao; Min Wang; Fei-Hua Luo; Cui-Xia Cheng; Zong-Qiu Hu","Poly[(μ~2~-2,2'-bi-1<i>H</i>-imidazole)bis(μ~3~-hydrogenphosphato)dizinc(II)]","Acta Crystallographica Section E","2007","63","10","m2456","m2456","10.1107/S160053680704250X","","","0.71073","MoKα","","0.0358","0.0325","","","0.074","0.0756","","","","","","1.082","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215371","31.64","0.02","15.586","0.01","17.638","0.011","90","","122.54","0.02","90","","7333","8","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","{N,N'-Bis[3-(2-nitrophenyl)prop-2-enylidene]ethylenediamine- κ^2^N,N'}iodido(triphenylphosphane-κP)copper(I)","","- C38 H33 Cu I N4 O4 P -","- C38 H33 Cu I N4 O4 P -","- C304 H264 Cu8 I8 N32 O32 P8 -","8","1","BT2493","Habibi, Mohammad Hossein; Lalegani, Arash; Mokhtari, Reza; Suzuki, Takayoshi","{<i>N</i>,<i>N</i>'-Bis[3-(2-nitrophenyl)prop-2-enylidene]ethylenediamine-κ^2^<i>N</i>,<i>N</i>'}iodido(triphenylphosphane-κ<i>P</i>)copper(I)","Acta Crystallographica Section E","2007","63","10","m2472","m2472","10.1107/S1600536807042493","","","0.71075","MoKα","","0.0288","0.0217","","","0.0499","0.0507","","","","","","0.942","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215372","7.7365","0.0004","9.8294","0.0005","12.806","0.0006","93.512","0.001","94.215","0.001","109.394","0.001","912.29","0.08","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","(2,2'-Biquinoline)tetracarbonylmolybdenum(0)","","- C22 H12 Mo N2 O4 -","- C22 H12 Mo N2 O4 -","- C44 H24 Mo2 N4 O8 -","2","1","BT2494","Muir, Kathleen J.; McQuillan, Geoffrey P.; Harrison, William T. A.","(2,2'-Biquinoline)tetracarbonylmolybdenum(0)","Acta Crystallographica Section E","2007","63","10","m2452","m2452","10.1107/S1600536807042547","","","0.71073","MoKα","","0.0414","0.0312","","","0.0753","0.0789","","","","","","0.989","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215373","6.1391","0.0002","8.9537","0.0002","12.5976","0.0004","90","","90","","90","","692.46","0.04","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","N-Methyl-2-pyrrolidone hydrochloride","N-Methyl-2-pyrrolidone hydrochloride","","- C5 H10 Cl N O -","- C5 H10 Cl N O -","- C20 H40 Cl4 N4 O4 -","4","1","BT2495","Sebastian Herler; Peter Mayer; Axel Schulz; Alexander Villinger","<i>N</i>-Methyl-2-pyrrolidone hydrochloride","Acta Crystallographica Section E","2007","63","10","o3991","o3991","10.1107/S1600536807042997","","","0.71073","MoKα","","0.0325","0.0297","","","0.0702","0.0722","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215374","9.751","0.002","10.867","0.002","14.255","0.003","100.857","0.018","98.929","0.012","105.55","0.02","1395","0.5","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","4-Methyl-<i>N</i>-(2,4-dimethylphenyl)benzenesulfonamide","","- C15 H17 N O2 S -","- C15 H17 N O2 S -","- C60 H68 N4 O8 S4 -","4","2","BT2496","Shi, Fa-En","4-Methyl-<i>N</i>-(2,4-dimethylphenyl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","10","o4004","o4004","10.1107/S1600536807043012","","","0.71073","MoKα","","0.0446","0.0386","","","0.1174","0.1222","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215375","9.8351","0.0006","20.5513","0.0014","10.9955","0.0007","90","","102.841","0.001","90","","2166.9","0.2","184","2","184","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[(E)-4-Benzenesulfonyl-3-methyl-but-2-enyl]-2,3,4,5- tetramethoxy-6-methylbenzene","","- C22 H28 O6 S -","- C22 H28 O6 S -","- C88 H112 O24 S4 -","4","1","BT2497","Li, Quan; Yan, Sheng-Jiao; Lin, Xin-Rong; Zhang, Cong-Hai; Lin, Jun","1-[(<i>E</i>)-4-Benzenesulfonyl-3-methyl-but-2-enyl]-2,3,4,5-tetramethoxy-6-methylbenzene","Acta Crystallographica Section E","2007","63","10","o3998","","10.1107/S1600536807043309","","","0.71073","MoKα","","0.072","0.0512","","","0.126","0.1382","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215376","9.102","0.006","14.328","0.009","16.41","0.007","109.51","0.02","103.29","0.03","90.45","0.03","1955","2","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","Azido{<i>N</i>,<i>N</i>'-bis[3-(2-nitrophenyl)prop-2- enylidene]ethylenediamine}(triphenylphosphine)copper(I) chloroform solvate","","- C39 H34 Cl3 Cu N7 O4 P -","- C39 H34 Cl3 Cu N7 O4 P -","- C78 H68 Cl6 Cu2 N14 O8 P2 -","2","1","BT2498","Habibi, Mohammad Hossein; Lalegani, Arash; Mokhtari, Reza; Suzuki, Takayoshi","Azido{<i>N</i>,<i>N</i>'-bis[3-(2-nitrophenyl)prop-2-enylidene]ethylenediamine}(triphenylphosphine)copper(I) chloroform solvate","Acta Crystallographica Section E","2007","63","10","m2580","m2580","10.1107/S160053680704559X","","","0.71075","MoKα","","0.0382","0.0302","","","0.0879","0.0918","","","","","","0.995","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215377","8.154","0.001","11.42","0.002","12.238","0.002","79.38","0.02","71.06","0.02","71.2","0.02","1016.3","0.3","293","","293","","","","","","","","","5","P -1","-P 1","2","pyrimethamine hydrogen adipate","2,4-diamino-5-(p-chlorophenyl)-6-ethylpyrimidinium hydrogen adipate","","- C18 H23 Cl N4 O4 -","- C18 H23 Cl N4 O4 -","- C36 H46 Cl2 N8 O8 -","2","1","BT2499","Periasamy Devi; Packianathan Thomas Muthiah; Tayur N. Guru Row; Vijay Thiruvenkatam","Hydrogen bonding in pyrimethamine hydrogen adipate","Acta Crystallographica Section E","2007","63","10","o4065","o4066","10.1107/S1600536807044364","","","0.71073","MoKα","","0.0651","0.0538","","","0.1456","0.1547","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215378","25.19","0.002","6.5076","0.0005","24.2792","0.0019","90","","119.567","0.001","90","","3461.7","0.5","292","2","292","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-(4-Azobenzenyl)-5-norbornene-2,3-dicarboximide","","- C21 H17 N3 O2 -","- C21 H17 N3 O2 -","- C168 H136 N24 O16 -","8","1","BT2500","Demei Tian; Bo Hu; Yongsheng Niu","<i>N</i>-(4-Azobenzenyl)-5-norbornene-2,3-dicarboximide","Acta Crystallographica Section E","2007","63","10","o4040","o4040","10.1107/S1600536807043863","","","0.71073","MoKα","","0.1008","0.0589","","","0.1222","0.1391","","","","","","1.059","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2215379","19.3652","0.0015","7.2856","0.0006","8.8571","0.0007","90","","90","","90","","1249.62","0.17","295","2","295","2","","","","","","","","5","I m m a","-I 2b 2","74","","Poly[(μ~2~-<i>N</i>,<i>N</i>-dimethylformamide-κ^2^<i>O</i>:<i>O</i>)( μ~4~-terephthalato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>''')iron(II)]","","- C11 H11 Fe N O5 -","- C11 H11 Fe N O5 -","- C44 H44 Fe4 N4 O20 -","4","0.25","BT2503","Lu, Hui; Fu, Yun-Long; Zhang, Yu; Ng, Seik Weng","Poly[(μ~2~-<i>N</i>,<i>N</i>-dimethylformamide-κ^2^<i>O</i>:<i>O</i>)(μ~4~-terephthalato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>''')iron(II)]","Acta Crystallographica Section E","2007","63","10","m2534","m2534","10.1107/S1600536807044091","","","0.71073","MoKα","","0.0429","0.0404","","","0.1104","0.1128","","","","","","1.081","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215380","8.4261","0.0004","8.0183","0.0004","21.4692","0.001","90","","98.604","0.001","90","","1434.2","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-Iodo-1-methyl-1H-pyrazol-3-yl)-pyridinium dichloroiodide","","- C9 H9 Cl2 I2 N3 -","- C9 H9 Cl2 I2 N3 -","- C36 H36 Cl8 I8 N12 -","4","1","BT2504","Harrison, William T. A.","2-(4-Iodo-1-methyl-1<i>H</i>-pyrazol-3-yl)-pyridinium dichloroiodide","Acta Crystallographica Section E","2007","63","10","o4045","o4045","10.1107/S1600536807044169","","","0.71073","MoKα","","0.0317","0.0274","","","0.0672","0.0692","","","","","","1.039","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215381","4.8473","0.001","33.907","0.007","8.9148","0.0018","90","","91.61","0.03","90","","1464.6","0.5","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Hydroxy-N'-phenylnaphthalene-2-carbohydrazide","","- C18 H14 N2 O3 -","- C18 H14 N2 O3 -","- C72 H56 N8 O12 -","4","1","BT2506","Ke-Wei Lei; Hai-Mei Feng; Feng-Qing Li","3-Hydroxy-<i>N</i>'-phenylnaphthalene-2-carbohydrazide","Acta Crystallographica Section E","2007","63","10","o4153","o4153","10.1107/S1600536807045497","","","0.71073","MoKα","","0.0738","0.0544","","","0.1109","0.1169","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215382","16.2448","0.0007","12.3442","0.0003","17.3988","0.0007","90","","101.675","0.001","90","","3416.8","0.2","183","2","183","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(<i>p</i>-Methylbenzenethiolato)[tris(3-phenyl-5-methylpyrazolyl)borato]zinc(II)","","- C37 H35 B N6 S Zn -","- C37 H35 B N6 S Zn -","- C148 H140 B4 N24 S4 Zn4 -","4","1","BT2507","Görls, Helmar; Günther, Wolfgang; Johannes Notni; Anders, Ernst","(<i>p</i>-Methylbenzenethiolato)[tris(3-phenyl-5-methylpyrazolyl)borato]zinc(II)","Acta Crystallographica Section E","2007","63","10","m2545","m2545","10.1107/S160053680704439X","","","0.71073","MoKα","","0.0705","0.0385","","","0.083","0.0869","","","","","","0.871","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215383","15.2027","0.0004","7.6207","0.0002","16.2411","0.0004","90","","110.568","0.001","90","","1761.67","0.08","173","0.1","173","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","<i>N</i>-[1-(Silatran-1-yl)propyl]pentafluorobenzamide","<i>N</i>-[3-(5-aza-2,8,9-trioxa-1-silabicyclo[3.3.3]undecan-1-yl)propyl] pentafluorobenzamide","","- C16 H19 F5 N2 O4 Si -","- C16 H19 F5 N2 O4 Si -","- C64 H76 F20 N8 O16 Si4 -","4","1","BT2508","Lahtinen, Tanja; Rissanen, Kari","<i>N</i>-[1-(Silatran-1-yl)propyl]pentafluorobenzamide","Acta Crystallographica Section E","2007","63","10","o4114","o4114","10.1107/S1600536807044777","","","0.71069","MoKα","","","0.0394","","","","0.0922","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215384","13.811","0.003","10.971","0.002","11.995","0.002","90","","93.88","0.03","90","","1813.3","0.6","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,6-Diisopropyl-N-[(Z)-quinolin-2-ylmethylidene]aniline","","- C22 H24 N2 -","- C22 H24 N2 -","- C88 H96 N8 -","4","1","BT2509","Sood, Anjali; Räisänen, Minna T.; Ahlgrén, Markku; Leskelä, Markku; Repo, Timo","2,6-Diisopropyl-<i>N</i>-[(<i>Z</i>)-quinolin-2-ylmethylidene]aniline","Acta Crystallographica Section E","2007","63","10","o4083","o4083","10.1107/S1600536807044947","","","0.71073","MoKα","","0.1132","0.053","","","0.101","0.1159","","","","","","1.057","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215385","15.6005","0.0007","8.8031","0.0004","16.2518","0.0006","90","","117.777","0.002","90","","1974.72","0.15","183","2","183","2","","","","","","","","5","C 1 c 1","C -2yc","9","","(Phenylmethanethiolato)(1,5,9-triazacyclododecane)zinc(II) thiocyanate","","- C17 H28 N4 S2 Zn -","- C17 H28 N4 S2 Zn -","- C68 H112 N16 S8 Zn4 -","4","1","BT2510","Görls, Helmar; Johannes Notni; Anders, Ernst","(Phenylmethanethiolato)(1,5,9-triazacyclododecane)zinc(II) thiocyanate","Acta Crystallographica Section E","2007","63","10","m2556","m2556","10.1107/S1600536807045096","","","0.71073","MoKα","","0.0471","0.0356","","","0.071","0.0766","","","","","","1.008","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215386","14.4104","0.0017","14.4104","0.0017","14.4104","0.0017","90","","90","","90","","2992.5","0.6","293","2","293","2","","","","","","","","4","I m -3","-I 2 2 3","204","amido-bis(cyclopentadienyl)ytterbium","di-μ-amido-bis[bis(η^5^-cyclopentadienyl)ytterbium(III)]","","- C20 H24 N2 Yb2 -","- C20 H24 N2 Yb2 -","- C120 H144 N12 Yb12 -","6","0.125","BT2511","Zeuner, Martin; Schnick, Wolfgang","Cubic di-μ-amido-bis[bis(η^5^-cyclopentadienyl)ytterbium(III)]","Acta Crystallographica Section E","2007","63","10","m2581","","10.1107/S1600536807045187","","","0.71073","MoKα","","0.0507","0.0245","","","0.0457","0.0505","","","","","","0.869","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215387","12.8328","0.0005","11.75","0.0005","15.8477","0.0007","90","","93.184","0.001","90","","2385.91","0.17","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","rac-Diethyl [(1S,2R)-1-(4-bromophenyl)-6-hydroxy-3-oxo-2,3-dihydro-1H- benzo[f]chromen-2-yl]phosphonate","","- C23 H22 Br O6 P -","- C23 H22 Br O6 P -","- C92 H88 Br4 O24 P4 -","4","1","BT2512","Henryk Krawczyk; Łukasz Albrecht; Jakub Wojciechowski; Wojciech M. Wolf","<i>rac</i>-Diethyl [(1<i>S</i>,2<i>R</i>)-1-(4-bromophenyl)-6-hydroxy-3-oxo-2,3-dihydro-1<i>H</i>-benzo[<i>f</i>]chromen-2-yl]phosphonate","Acta Crystallographica Section E","2007","63","10","o4148","o4148","10.1107/S1600536807045576","","","0.71073","MoKα","","0.0266","0.0231","","","0.0622","0.0641","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215388","7.2936","0.0015","14.881","0.003","44.751","0.009","90","","90.12","0.03","90","","4857.1","1.7","84","2","84","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[DEA]2[CuCl4]","Bis(diethylammonium) tetrachloridocuprate(II)","","- C8 H24 Cl4 Cu N2 -","- C8 H24 Cl4 Cu N2 -","- C96 H288 Cl48 Cu12 N24 -","12","3","BT2513","Willett, Roger D.; Twamley, Brendan","Bis(diethylammonium) tetrachloridocuprate(II)","Acta Crystallographica Section E","2007","63","10","m2591","m2591","10.1107/S1600536807045606","","","0.71073","MoKα","","0.037","0.0316","","","0.0671","0.069","","","","","","1.148","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215389","6.1368","0.0002","7.8038","0.0003","20.9032","0.0008","90","","98.202","0.002","90","","990.82","0.06","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Morpholine","1-(Morpholin-4-ylmethyl)pyrrolidine-2,5-dione","","- C9 H14 N2 O3 -","- C9 H14 N2 O3 -","- C36 H56 N8 O12 -","4","1","BT2514","P. Sakthivel; P. S. Joseph; A. Sebastin; M. Yosuva Suvaikin; M. Ramesh","1-(Morpholin-4-ylmethyl)pyrrolidine-2,5-dione","Acta Crystallographica Section E","2007","63","10","o4143","o4143","10.1107/S1600536807046053","","","0.71073","MoKα","","0.0458","0.033","","","0.0813","0.0887","","","","","","1.015","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215390","10.184","0.003","10.592","0.003","17.408","0.004","90","","101.637","0.004","90","","1839.2","0.9","290","2","290","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-[2-Methyl-1-(4-methylphenyl)-2-nitropropyl]-4-phenyl-1,2,3-selenadiazole","","- C19 H19 N3 O2 Se -","- C19 H19 N3 O2 Se -","- C76 H76 N12 O8 Se4 -","4","1","BT2516","B. Gunasekaran; S. Saravanan; V. Manivannan; S. Muthusubramanian; M. Nethaji","5-[2-Methyl-1-(4-methylphenyl)-2-nitropropyl]-4-phenyl-1,2,3-selenadiazole","Acta Crystallographica Section E","2007","63","10","o4167","o4167","10.1107/S1600536807046223","","","0.71073","MoKα","","0.104","0.0505","","","0.0998","0.1188","","","","","","0.99","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215391","11.9321","0.0006","11.9345","0.0006","17.921","0.001","96.799","0.001","103.136","0.001","91.532","0.001","2464","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Diaquatetrakis(2,3,5-triiodobenzoato- κ^2^<i>O</i>:<i>O</i>')dicopper(II)(<i>Cu‒Cu</i>) bis(methanol-κO)tetrakis(2,3,5-triiodobenzoato- κ^2^<i>O</i>:<i>O</i>')dicopper(II)(<i>Cu‒Cu</i>) methanol disolvate","","- C60 H36 Cu4 I24 O22 -","- C60 H36 Cu4 I24 O22 -","- C60 H36 Cu4 I24 O22 -","1","0.5","BT2517","Chen, Peng-Gang; Gao, Shan; Ng, Seik Weng","Diaquatetrakis(2,3,5-triiodobenzoato-κ^2^<i>O</i>:<i>O</i>')dicopper(II)(<i>Cu{‒</i>Cu}) bis(methanol-κ<i>O</i>)tetrakis(2,3,5-triiodobenzoato-κ^2^<i>O</i>:<i>O</i>')dicopper(II)(<i>Cu{‒</i>Cu}) methanol disolvate","Acta Crystallographica Section E","2007","63","10","m2617","m2617","10.1107/S1600536807046430","","","0.71073","MoKα","","0.0612","0.0514","","","0.1354","0.1459","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215392","9.326","0.0002","26.7485","0.0005","12.1579","0.0003","90","","112.31","0.003","90","","2805.84","0.12","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Bis{bis[2-(dimethylaminomethyl)phenyl]hydroxytelluronium} hexafluorosilicate chloroform tetrasolvate","","- C40 H54 Cl12 F6 N4 O2 Si Te2 -","- C40 H54 Cl12 F6 N4 O2 Si Te2 -","- C80 H108 Cl24 F12 N8 O4 Si2 Te4 -","2","0.5","BT2520","Klapötke, Thomas M.; Krumm, Burkhard; Scherr, Matthias","Bis{bis[2-(dimethylaminomethyl)phenyl]hydroxytelluronium} hexafluorosilicate chloroform tetrasolvate","Acta Crystallographica Section E","2007","63","10","o4189","o4189","10.1107/S1600536807047253","","","0.71073","MoKα","","0.029","0.0223","","","0.0505","0.0533","","","","","","1.035","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2215393","7.2028","0.0006","8.8006","0.0007","15.6983","0.0013","101.93","0.001","95.491","0.002","104.21","0.001","932.5","0.13","293","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis(salicylhydrazide-κ^2^<i>N</i>,<i>O</i>)sulfatozinc(II) monohydrate","","- C14 H18 N4 O9 S Zn -","- C14 H18 N4 O9 S Zn -","- C28 H36 N8 O18 S2 Zn2 -","2","1","BV2063","Luo, Wei; Meng, Xiang-Gao; Li, Xiong; Cheng, Gong-Zhen; Ji, Zheng-Ping","Bis(salicylhydrazide-κ^2^<i>N</i>,<i>O</i>)sulfatozinc(II) monohydrate","Acta Crystallographica Section E","2007","63","10","m2482","m2482","10.1107/S1600536807042614","","","0.71073","MoKα","","0.0774","0.0478","","","0.0909","0.1014","","","","","","0.916","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215394","10.878","0.003","7.1855","0.0016","13.423","0.003","90","","112.095","0.003","90","","972.1","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(3E)-3-(1,3-Dithiolan-2-ylidenehydrazono)butan-2-one","","- C7 H10 N2 O S2 -","- C7 H10 N2 O S2 -","- C28 H40 N8 O4 S8 -","4","1","BV2064","Liu, Xiao-Lan; Liu, Yong-Hong; Dai, Xiang-Qian; Zhao, Yue; Tong, Ben-Wan","(3<i>E</i>)-3-(1,3-Dithiolan-2-ylidenehydrazono)butan-2-one","Acta Crystallographica Section E","2007","63","10","o4019","o4019","10.1107/S1600536807042420","","","0.71073","MoKα","","0.0619","0.0434","","","0.1305","0.1406","","","","","","1.172","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215395","8.2041","0.0003","11.9243","0.0004","14.5839","0.0005","90","","100.624","0.003","90","","1402.26","0.09","108","2","108","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>fac</i>-Trichloridotrispyrazolerhodium(III)","","- C9 H12 Cl3 N6 Rh -","- C9 H12 Cl3 N6 Rh -","- C36 H48 Cl12 N24 Rh4 -","4","1","BV2069","Ruth Bieda; Manuela C. Winter; William S. Sheldrick","<i>fac</i>-Trichloridotrispyrazolerhodium(III)","Acta Crystallographica Section E","2007","63","10","m2473","m2473","10.1107/S1600536807042444","","","0.71073","MoKα","","0.0424","0.0315","","","0.0752","0.0807","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215396","20.408","0.008","5.69","0.002","11.949","0.005","90","","121.11","0.014","90","","1188","0.8","98","2","98","2","","","","","","","","4","C 1 2 1","C 2y","5","","N-Phenylindazole-1-thiocarboxamide","","- C14 H11 N3 S -","- C14 H11 N3 S -","- C56 H44 N12 S4 -","4","1","BV2071","Sadr, Moayad Hossaini; Khalilizadeh, Zahra; Tiekink, Edward R. T.","<i>N</i>-Phenylindazole-1-thiocarboxamide","Acta Crystallographica Section E","2007","63","10","o4126","o4126","10.1107/S1600536807045734","","","0.7107","MoKα","","0.03","0.03","","","0.068","0.069","","","","","","1.05","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215397","9.383","0.004","7.918","0.003","12.612","0.005","90","","109.041","0.006","90","","885.7","0.6","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,2-Dibromo-4,5-dimethylbenzene","","- C8 H8 Br2 -","- C8 H8 Br2 -","- C32 H32 Br8 -","4","1","BX2106","Li Yinhuai","1,2-Dibromo-4,5-dimethylbenzene","Acta Crystallographica Section E","2007","63","10","o3971","o3971","10.1107/S1600536807042602","","","0.71073","MoKα","","0.0502","0.0356","","","0.0903","0.0974","","","","","","1.072","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215398","9.337","0.009","13.418","0.015","9.667","0.008","90","","116.04","0.07","90","","1088","2","295","","295","","","","","","","","","5","C 1 c 1","C -2yc","9","","Methyl (1<i>H</i>-benzimidazol-2-ylsulfanyl)acetate","","- C10 H10 N2 O2 S -","- C10 H10 N2 O2 S -","- C40 H40 N8 O8 S4 -","4","1","CF2115","Bibila Mayaya Bisseyou, Yvon; Adohi-Krou, A.; Zoakouma, Roger S. P.; Yao-Kakou, R. C. A.; Ebby, N'dédé","Methyl (1<i>H</i>-benzimidazol-2-ylsulfanyl)acetate","Acta Crystallographica Section E","2007","63","10","o3987","o3987","10.1107/S1600536807042572","","","0.71073","MoKα","","0.0415","0.037","","0.0619","0.0593","0.0619","","","","","","0.9151","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215399","8.1395","0.0009","14.3894","0.0016","19.271","0.002","71.76","0.001","79.411","0.001","79.966","0.001","2090.6","0.4","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","(N-Salicylidene-β-alanine)[1,1-bis(3,5-dimethylpyrazol-1-yl)methane] copper(II)","","- C21 H25 Cu N5 O3 -","- C21 H25 Cu N5 O3 -","- C84 H100 Cu4 N20 O12 -","4","2","CF2130","Zhao, Gan-Qing; Hao, Cheng-Jun; Lu, Xiao-Jing; Xie, Ji-Min; Song, Yuan-Zhi","(<i>N</i>-Salicylidene-β-alanine)[1,1-bis(3,5-dimethylpyrazol-1-yl)methane]copper(II)","Acta Crystallographica Section E","2007","63","10","m2514","m2514","10.1107/S1600536807043607","","","0.71073","MoKα","","0.0531","0.0378","","","0.0904","0.0994","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215400","6.8286","0.001","8.5231","0.0013","11.3654","0.0016","98.442","0.002","105.614","0.002","108.859","0.002","582.69","0.15","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Dibromidobis(6-methyl-3-phenyl-s-triazolo[3,4-b][1,3,4]thiadiazole-κN^1^)\ copper(II)","","- C20 H16 Br2 Cu N8 S2 -","- C20 H16 Br2 Cu N8 S2 -","- C20 H16 Br2 Cu N8 S2 -","1","0.5","CF2132","Hui-Qin, Liu","Dibromidobis(6-methyl-3-phenyl-<i>s</i>-triazolo[3,4-<i>b</i>][1,3,4]thiadiazole-κ<i>N</i>^1^)copper(II)","Acta Crystallographica Section E","2007","63","10","m2466","m2466","10.1107/S1600536807042560","","","0.71073","MoKα","","0.0522","0.0407","","","0.1027","0.106","","","","","","0.887","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215401","8.4916","0.0001","25.8266","0.0003","14.9202","0.0002","90","","97.979","0.001","90","","3240.46","0.07","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Triphenyl-n-propylphosphonium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)aurate(III)","","- C27 H22 Au P S10 -","- C27 H22 Au P S10 -","- C108 H88 Au4 P4 S40 -","4","1","CF2133","Wang, Xin Qiang; Fan, Jian Dong; Xu, Dong; Yu, Wen Tao; Sun, Jing","Triphenyl-<i>n</i>-propylphosphonium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)aurate(III)","Acta Crystallographica Section E","2007","63","10","m2529","m2530","10.1107/S1600536807043929","","","0.71073","MoKα","","0.0361","0.0248","","","0.0562","0.0598","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215402","23.958","0.003","5.5569","0.0012","21.617","0.003","90","","125.03","0.03","90","","2356.6","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(<i>E</i>)-4-Chloro-2-[(cyclopentylimino)methyl]phenol","","- C12 H14 Cl N O -","- C12 H14 Cl N O -","- C96 H112 Cl8 N8 O8 -","8","1","CF2134","Shi, Lei; Fang, Rui-Qin; Li, Huan-Qiu; Zhu, Hai-Liang","(<i>E</i>)-4-Chloro-2-[(cyclopentylimino)methyl]phenol","Acta Crystallographica Section E","2007","63","10","o4041","o4041","10.1107/S1600536807043711","","","0.71073","MoKα","","0.1819","0.0747","","","0.1759","0.2352","","","","","","1.015","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215403","27.8221","0.0012","5.1082","0.0001","13.009","0.0005","90","","98.71","0.002","90","","1827.53","0.11","200","2","200","2","","","","","","","","3","C 1 2 1","C 2y","5","4,6-<i>O</i>-benzylidene-methyl-α-D-glucopyranoside-2,3-diyl 1',2'- phenylene orthocarbonate","4,6-<i>O</i>-Benzylidene-1-<i>O</i>-methyl-2,3-deoxy-α-D-glucopyranos-2,3-diyl- 1',2'-phenylene orthocarbonate","","- C21 H20 O8 -","- C21 H20 O8 -","- C84 H80 O32 -","4","1","CF2136","Betz, Richard; Klüfers, Peter","4,6-<i>O</i>-Benzylidene-1-<i>O</i>-methyl-2,3-deoxy-α-<small>D</small>-glucopyranose-2,3-diyl 1,2-phenylene orthocarbonate","Acta Crystallographica Section E","2007","63","10","o4132","o4132","10.1107/S1600536807045266","","","0.71073","MoKα","","0.0674","0.043","","","0.0893","0.1008","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215404","6.1276","0.0002","8.8248","0.0003","30.2629","0.001","90","","90","","90","","1636.46","0.09","150","","150","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-O-(4,4'-Dimethylbenzhydryl)-L-erythronolactone","","- C19 H20 O4 -","- C19 H20 O4 -","- C76 H80 O16 -","4","1","CF2137","Petursson, Sigthor; Jenkinson, Sarah F.; Booth, Kathrine V.; Weymouth-Wilson, Alexander C.; Watkin, David J.; Fleet, George W.J.; Best, Daniel","2-<i>O</i>-(4,4'-Dimethylbenzhydryl)-<small>L</small>-erythronolactone","Acta Crystallographica Section E","2007","63","10","o4121","o4121","10.1107/S1600536807044911","","","0.71073","MoKα","","0.0943","0.0592","","0.1708","0.15","0.1708","","","","","","0.9337","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215405","8.4311","0.0004","9.8128","0.0005","10.0299","0.0005","70.629","0.001","78.623","0.001","65.37","0.001","709.92","0.06","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 2-(5-iodo-3-methylsulfinyl-1-benzofuran-2-yl)acetate","","- C13 H13 I O4 S -","- C13 H13 I O4 S -","- C26 H26 I2 O8 S2 -","2","1","CF2138","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","Ethyl 2-(5-iodo-3-methylsulfinyl-1-benzofuran-2-yl)acetate","Acta Crystallographica Section E","2007","63","10","o4081","o4081","10.1107/S1600536807044583","","","0.71073","MoKα","","0.0222","0.0204","","","0.0532","0.0546","","","","","","1.083","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215407","10.167","0.002","9.617","0.002","18.11","0.004","90","","94.68","0.03","90","","1764.8","0.6","183","2","183","2","","","","","","","","4","P 1 21 1","P 2yb","4","","μ-[Bis(3,3-dimethylbut-1-ynyl)diphenylsilane]bis[(cycloocta-1,5- diene)nickel(II)](<i>Ni—Ni</i>)","","- C40 H52 Ni2 Si -","- C40 H52 Ni2 Si -","- C80 H104 Ni4 Si2 -","2","1","CF2141","Imhof, Wolfgang; Klettke, Thomas; Walther, Dirk","μ-[Bis(3,3-dimethylbut-1-ynyl)diphenylsilane]bis[(cycloocta-1,5-diene)nickel(II)](<i>Ni{—</i>Ni})","Acta Crystallographica Section E","2007","63","10","m2567","m2567","10.1107/S1600536807045825","","","0.71073","MoKα","","0.0353","0.0271","","","0.0654","0.07","","","","","","1.149","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215408","12.8951","0.0011","14.4427","0.0013","13.9409","0.0012","90","","106.613","0.001","90","","2488","0.4","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(tetraphenylphosphonium) di-μ-iodidobis[diiodidodipalladate(II)]","","- C48 H40 I6 P2 Pd2 -","- C48 H40 I6 P2 Pd2 -","- C96 H80 I12 P4 Pd4 -","2","0.5","CF2142","Mulligan, Frank; Nichol, Gary S.; Hurst, Stephanie K.","Bis(tetraphenylphosphonium) di-μ-iodido-bis[diiodidopalladate(II)]","Acta Crystallographica Section E","2007","63","10","m2558","","10.1107/S160053680704528X","","","0.71073","MoKα","","0.0675","0.0318","","","0.0701","0.1008","","","","","","1.143","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215409","14.046","0.003","10.863","0.002","14.862","0.003","90","","117.485","0.002","90","","2011.7","0.7","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetrakis(1<i>H</i>-pyrazole-κ<i>N</i>^2^)bis(thiocyanato-κ<i>N</i>)nickel(II)","","- C14 H16 N10 Ni S2 -","- C14 H16 N10 Ni S2 -","- C56 H64 N40 Ni4 S8 -","4","0.5","CF2144","Yan, Huai Yi","Tetrakis(1<i>H</i>-pyrazole-κ<i>N</i>^2^)bis(thiocyanato-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2007","63","10","m2602","m2602","10.1107/S1600536807046211","","","0.71073","MoKα","","0.0414","0.0348","","","0.0893","0.0925","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215410","8.4906","0.0003","24.6848","0.0007","9.4361","0.0004","90","","90","","90","","1977.7","0.12","298","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","thiopyran","2-[2,6-Bis(4-methoxyphenyl)tetrahydrothiopyran-4-ylidene]malononitrile","","- C22 H20 N2 O2 S -","- C22 H20 N2 O2 S -","- C88 H80 N8 O8 S4 -","4","0.5","CF2145","Thiruvalluvar, A.; Balamurugan, S.; Manimekalai, A.; Anusuya, J.","2-[2,6-Bis(4-methoxyphenyl)tetrahydrothiopyran-4-ylidene]malononitrile","Acta Crystallographica Section E","2007","63","10","o4149","o4149","10.1107/S1600536807046296","","","0.71073","MoKα","","0.0669","0.055","","","0.1714","0.1932","","","","","","1.175","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215411","11.478","0.0006","6.8145","0.0003","10.1444","0.0005","90","","102.506","0.002","90","","774.64","0.07","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","<i>endo</i>-2-Hydroxy-2-norbornane-2-carboxylic acid","2-Hydroxybicyclo[2.2.1]heptane-2-<i>endo</i>-carboxylic acid","","- C8 H12 O3 -","- C8 H12 O3 -","- C32 H48 O12 -","4","1","CF2148","Betz, Richard; Klüfers, Peter","2-Hydroxybicyclo[2.2.1]heptane-2-<i>endo</i>-carboxylic acid","Acta Crystallographica Section E","2007","63","10","o4185","o4185","10.1107/S1600536807047071","","","0.71073","MoKα","","0.066","0.0448","","","0.1067","0.119","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215412","8.691","0.002","23.223","0.006","10.705","0.003","90","","111.949","0.004","90","","2004","0.9","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(Benzoylmethylsulfanyl)-6-benzyl-5-isopropylpyrimidin-4(3<i>H</i>)-one","","- C22 H22 N2 O2 S -","- C22 H22 N2 O2 S -","- C88 H88 N8 O8 S4 -","4","1","CI2429","Rao, Zhi-Kun; Zhang, Sui-Shuan; He, Yan-Ping; Zheng, Yong-Tang; Li, Cong","2-(Benzoylmethylsulfanyl)-6-benzyl-5-isopropylpyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","10","o3942","o3942","10.1107/S1600536807037610","","","0.71073","MoKα","","0.2323","0.0654","","","0.1012","0.1376","","","","","","0.996","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215413","13.5514","0.0003","13.5514","0.0003","11.4588","0.0006","90","","90","","120","","1822.38","0.11","100","0.1","100","0.1","","","","","","","","7","P -3","-P 3","147","Iodotris(<i>N</i>-butylthiourea-<i>κS</i>) copper(I) 0.6-hydrate","Iodidotris(<i>N</i>,<i>N</i>'-dibutylthiourea-<i>κS</i>)copper(I) 0.6-hydrate","","- C27 H61.2 Cu I N6 O0.6 S3 -","- C27 H60 Cu I N6 O0.6 S3 -","- C54 H120 Cu2 I2 N12 O1.2 S6 -","2","0.333333","CI2443","Islam Ullah Khan; Muhammad Mufakkar; Saeed Ahmad; Hoong-Kun Fun; Suchada Chantrapromma","Tris(<i>N</i>,<i>N</i>'-dibutylthiourea-<i>{κ</i>S})iodidocopper(I) 0.6-hydrate","Acta Crystallographica Section E","2007","63","10","m2550","m2551","10.1107/S1600536807044649","","","0.71073","MoKα","","0.0972","0.0616","","","0.1564","0.1734","","","","","","1.053","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215414","7.2804","0.0015","12.8846","0.0018","14.106","0.002","108.87","0.003","101.16","0.002","99.516","0.002","1190.8","0.3","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","2'-(2-Hydroxyethoxy)-1,1'-biphenyl-2-ol","","- C14 H14 O3 -","- C14 H14 O3 -","- C56 H56 O12 -","4","2","CI2446","Mei-Ju Niu; Gui-Hua Liu; Lian-Zhi Li; Da-Qi Wang; Jian-Min Dou","2'-(2-Hydroxyethoxy)-1,1'-biphenyl-2-ol","Acta Crystallographica Section E","2007","63","10","o4089","o4089","10.1107/S1600536807044029","","","0.71073","MoKα","","0.0875","0.0494","","","0.121","0.1452","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215415","14.012","0.002","7.806","0.0014","17.655","0.003","90","","110.401","0.005","90","","1809.9","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Ethyl-2,6-bis(4-methoxyphenyl)piperidin-4-one","","- C21 H25 N O3 -","- C21 H25 N O3 -","- C84 H100 N4 O12 -","4","1","CI2447","Kavitha, T.; Ponnuswamy, S.; Mohanraj, V.; Ilango, S. S.; Ponnuswamy, M. N.","3-Ethyl-2,6-bis(4-methoxyphenyl)piperidin-4-one","Acta Crystallographica Section E","2007","63","10","o3985","o3985","10.1107/S1600536807041475","","","0.71073","MoKα","","0.0928","0.066","","","0.1883","0.2195","","","","","","1.097","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215416","6.7578","0.0016","12.107","0.003","21.269","0.005","90","","90","","90","","1740.2","0.7","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,1'-Ureylenedi-7,7-dimethylbicyclo[2.2.1]heptan-2-one","","- C19 H28 N2 O3 -","- C19 H28 N2 O3 -","- C76 H112 N8 O12 -","4","1","CI2449","Gao, Yu-Xing; Liu, Peng; Fang, Yi-Xin; Tang, Guo; Zhao, Yu-Fen","1,1'-Ureylenedi-7,7-dimethylbicyclo[2.2.1]heptan-2-one","Acta Crystallographica Section E","2007","63","10","o3994","o3994","10.1107/S1600536807042754","","","0.71073","MoKα","","0.048","0.045","","","0.113","0.115","","","","","","1.106","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215417","12.227","0.002","10.883","0.002","20.178","0.003","90","","100.788","0.002","90","","2637.6","0.8","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","10-(4-Chlorophenyl)-9-(4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7- tetrahydroacridine-1,8(2H,5H,9H,10H)-dione","","- C30 H32 Cl N O3 -","- C30 H32 Cl N O3 -","- C120 H128 Cl4 N4 O12 -","4","1","CI2452","Yan Chen; Wen-Juan Hao; Zi-Qiang Tang; Bo Jiang; Chun-Mei Li","10-(4-Chlorophenyl)-9-(4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7-tetrahydroacridine-1,8(2<i>H</i>,5<i>H</i>,9<i>H</i>,10<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","10","o3934","o3934","10.1107/S1600536807042365","","","0.71073","MoKα","","0.1334","0.0565","","","0.1136","0.1462","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215418","10.661","0.002","14.153","0.003","9.041","0.0018","90","","110.7","0.03","90","","1276.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-[Methoxy(4-nitrophenyl)methyl]pyridin-2-amine","","- C13 H13 N3 O3 -","- C13 H13 N3 O3 -","- C52 H52 N12 O12 -","4","1","CI2453","Fang, Rui-Qin; Li, Huan-Qiu; Shi, Lei; Xiao, Zhu-Ping; Zhu, Hai-Liang","<i>N</i>-[Methoxy(4-nitrophenyl)methyl]pyridin-2-amine","Acta Crystallographica Section E","2007","63","10","o3975","o3975","10.1107/S160053680704247X","","","0.71073","MoKα","","0.0889","0.05","","","0.1107","0.1308","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215419","10.378","0.005","10.131","0.005","18.143","0.009","90","","97.406","0.008","90","","1891.6","1.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-(4-Chlorophenyl)-9,9-dimethyl-3,7-dioxo-2,3,4,6,7,8,9,10-octahydro- 1<i>H</i>-pyrimido[1,2-<i>a</i>]quinoline-5-carbonitrile","","- C21 H20 Cl N3 O2 -","- C21 H20 Cl N3 O2 -","- C84 H80 Cl4 N12 O8 -","4","1","CI2454","Dong-Qin Chen; Chun-Mei Li; Shu-Jiang Tu","6-(4-Chlorophenyl)-9,9-dimethyl-3,7-dioxo-2,3,4,6,7,8,9,10-octahydro-1<i>H</i>-pyrimido[1,2-<i>a</i>]quinoline-5-carbonitrile","Acta Crystallographica Section E","2007","63","10","o3931","o3931","10.1107/S1600536807042389","","","0.71073","MoKα","","0.184","0.0644","","","0.1503","0.2226","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215420","7.5235","0.0014","6.5887","0.0011","11.1748","0.0019","90","","105.045","0.01","90","","534.95","0.16","125","2","125","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Amino-6-chloropyridazine","","- C4 H4 Cl N3 -","- C4 H4 Cl N3 -","- C16 H16 Cl4 N12 -","4","1","CI2455","Bo Gao","3-Amino-6-chloropyridazine at 125K","Acta Crystallographica Section E","2007","63","10","o3962","o3962","10.1107/S1600536807042481","","","0.71073","MoKα","","0.0349","0.0331","","","0.0867","0.0884","","","","","","1.117","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215421","19.861","0.004","5.1856","0.001","10.103","0.002","90","","99.55","0.03","90","","1026.1","0.4","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>N</i>'-[(Thiophen-3-yl)methylene]isonicotinohydrazide","","- C11 H9 N3 O S -","- C11 H9 N3 O S -","- C44 H36 N12 O4 S4 -","4","1","CI2456","Jing, Zuo-Liang; Yu, Ming; Chen, Xin","<i>N</i>'-[(Thiophen-3-yl)methylene]isonicotinohydrazide","Acta Crystallographica Section E","2007","63","10","o4029","o4029","10.1107/S1600536807043760","","","0.71073","MoKα","","0.043","0.0386","","","0.0951","0.0983","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215422","11.4663","0.0006","6.2309","0.0003","18.847","0.001","90","","100.343","0.001","90","","1324.65","0.12","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,5-Dimethyl-3-phenylsulfinyl-1-benzofuran","","- C16 H14 O2 S -","- C16 H14 O2 S -","- C64 H56 O8 S4 -","4","1","CI2457","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","2,5-Dimethyl-3-phenylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2007","63","10","o4042","o4042","10.1107/S1600536807043954","","","0.71073","MoKα","","0.0637","0.0502","","","0.1118","0.1183","","","","","","1.131","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215423","7.8013","0.0012","11.19","0.002","11.438","0.003","113.88","0.02","98.649","0.016","95.991","0.014","887.4","0.4","296","","296","","","","","","","","","5","P -1","-P 1","2","","3-Bromo-1-(2,4-dichlorophenyl)-2-methoxy-3-(4-methoxyphenyl)propan-1-one‒\ 2-bromo-3-(3-chloro-4-methoxyphenyl)-1-(4-chlorophenyl)-3-methoxypropan-1-one (0.91/0.09)","","- C17 H15 Br Cl2 O3 -","- C17 H15 Br Cl2 O3 -","- C34 H30 Br2 Cl4 O6 -","2","1","CI2459","Butcher, Ray J.; Jasinski, Jerry P.; Narayana, B.; Mayekar, Anil N.; Yathirajan, H. S.","3-Bromo-1-(2,4-dichlorophenyl)-2-methoxy-3-(4-methoxyphenyl)propan-1-one‒2-bromo-3-(3-chloro-4-methoxyphenyl)-1-(4-chlorophenyl)-3-methoxypropan-1-one (0.91/0.09)","Acta Crystallographica Section E","2007","63","10","o4123","o4124","10.1107/S1600536807045977","","","0.71073","MoKα","","0.1263","0.0476","","","0.1182","0.1556","","","","","","1.078","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215424","10.8362","0.0003","9.0056","0.0002","24.7698","0.0005","90","","95.272","0.001","90","","2406.97","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1,3-Dihydroindole-2-one spiro [3.2']- (2E)-3-(4-methyl-1, 3-thiazole-5-yl)-1-[1-(4-methyl-1,3-thiazol-5-yl)hexahydro- 1H-pyrrolizin-2-yl]prop-2-en-1-one","3-(4-methyl-1,3-thiazol-5-yl)-1-[1'-(4-methyl-1,3-thiazol-5-yl)-2-oxo- 2,3,2',3',5',6',7',7a'-octahydro-1H-indole- 3-spiro-3'-1H-pyrrolizin-2'-yl]prop-2-en-1-one","","- C25 H24 N4 O2 S2 -","- C25 H24 N4 O2 S2 -","- C100 H96 N16 O8 S8 -","4","1","CI2460","P. Ramesh; S. Murugavel; A. SubbiahPandi; R. Murugan; S. Sriman Narayanan","3-(4-Methyl-1,3-thiazol-5-yl)-1-[1'-(4-methyl-1,3-thiazol-5-yl)-2-oxo-2,3,2',3',5',6',7',7a'-octahydro-1<i>H</i>-indole-3-spiro-3'-1<i>H</i>-pyrrolizin-2'-yl]prop-2-en-1-one","Acta Crystallographica Section E","2007","63","10","o4106","o4107","10.1107/S1600536807045072","","","0.71073","MoKα","","0.0745","0.0509","","","0.1394","0.1601","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215425","9.202","0.003","9.989","0.003","10.454","0.004","87.363","0.019","80.67","0.02","84.187","0.019","942.9","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","6-[(4-Bromophenylimino)methyl]-1,3-dimethyl-7-(2-methylpropenyl)-1,7- dihydro-pyrrolo[2,3-d]pyrimidine-2,4-dione","6-[(4-Bromophenyl)iminomethyl]-1,3-dimethyl-7-(2-methylpropenyl)-1,2,3,4- tetrahydro-7H-pyrrolo[2,3-<i>d</i>]pyrimidine-2,4-dione","","- C20 H21 Br N4 O2 -","- C20 H21 Br N4 O2 -","- C40 H42 Br2 N8 O4 -","2","1","CI2465","S. Murugavel; P. Ramesh; A. SubbiahPandi; E. Ramesh; R. Raghunathan","6-[(4-Bromophenyl)iminomethyl]-1,3-dimethyl-7-(2-methylpropenyl)-1,2,3,4-tetrahydro-7<i>H</i>-pyrrolo[2,3-<i>d</i>]pyrimidine-2,4-dione","Acta Crystallographica Section E","2007","63","10","o4108","o4108","10.1107/S1600536807045692","","","0.71073","MoKα","","0.09","0.0423","","","0.1207","0.1469","","","","","","1.006","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215426","9.5355","0.0001","17.3405","0.0003","17.8604","0.0003","92.84","0.001","105.372","0.001","102.523","0.001","2761.8","0.08","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","4-Allyl-2-[1-(5-allyl-2-hydroxy-3-methoxybenzyl)-1<i>H</i>-benzimidazol-2-yl]-6-methoxyphenol pyridine solvate","","- C33 H33 N3 O4 -","- C33 H33 N3 O4 -","- C132 H132 N12 O16 -","4","2","CI2468","Naser Eltaher Eltayeb; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun","4-Allyl-2-[1-(5-allyl-2-hydroxy-3-methoxybenzyl)-1<i>H</i>-benzimidazol-2-yl]-6-methoxyphenol pyridine solvate","Acta Crystallographica Section E","2007","63","10","o4141","o4142","10.1107/S1600536807046065","","","0.71073","MoKα","","0.0814","0.0524","","","0.1275","0.1434","","","","","","1.095","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215427","7.1833","0.0014","8.8173","0.0018","15.351","0.003","77.907","0.013","77.691","0.013","81.392","0.014","923.2","0.3","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","2-Amino-2',5-dioxo-5,6,7,8-tetrahydrospiro[chromene-4,3'-indoline]- 3-carbonitrile N,N-dimethylformamide solvate","","- C20 H20 N4 O4 -","- C20 H20 N4 O4 -","- C40 H40 N8 O8 -","2","1","CI2470","Jing Wang; Song-Lei Zhu","2-Amino-2',5-dioxo-5,6,7,8-tetrahydrospiro[chromene-4,3'-indoline]-3-carbonitrile <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2007","63","10","o4190","o4190","10.1107/S1600536807047083","","","0.7107","MoKα","","0.0535","0.0453","","","0.1088","0.114","","","","","","1.091","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215428","6.2922","0.0013","27.423","0.006","10.009","0.002","90","","90.84","0.03","90","","1726.9","0.6","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(S)-3-(ammoniomethyl)-5-methylhexanoate‒(S)-mandelic acid (1/1)","","- C16 H25 N O5 -","- C16 H25 N O5 -","- C64 H100 N4 O20 -","4","2","CS2049","Samas, Brian; Wang, Wei; Godrej, Delara B","1:1 Cocrystal of (<i>S</i>)-3-(ammoniomethyl)-5-methylhexanoate and (<i>S</i>)-mandelic acid","Acta Crystallographica Section E","2007","63","10","o3938","o3938","10.1107/S1600536807041803","","","0.71073","MoKα","","0.1108","0.0585","","","0.1282","0.148","","","","","","0.917","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215429","9.4343","0.0003","9.769","0.0005","9.8842","0.0005","90","","116.13","0.002","90","","817.86","0.07","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","ortho-nitromandelic acid","<i>rac</i>-2-Hydroxy-2-(2-nitrophenyl)acetic acid","","- C8 H7 N O5 -","- C8 H7 N O5 -","- C32 H28 N4 O20 -","4","1","CS2054","Betz, Richard; Betzler, Franziska; Klüfers, Peter","<i>rac</i>-2-Hydroxy-2-(2-nitrophenyl)acetic acid","Acta Crystallographica Section E","2007","63","10","o4184","o4184","10.1107/S1600536807047113","","","0.71073","MoKα","","0.0624","0.0458","","","0.116","0.1256","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215430","13.984","0.002","14.092","0.005","16.084","0.003","103.948","0.002","101.743","0.003","117.769","0.004","2531.1","1.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Tris[diphenyl(4-tolyl)phosphane]-1κ^2^P,2κP-μ-di-iodido-1:2κ^4^I-dicopper(I)","","- C57 H51 Cu2 I2 P3 -","- C57 H51 Cu2 I2 P3 -","- C114 H102 Cu4 I4 P6 -","2","1","CV2286","Steyl, Gideon","Tris[diphenyl(4-tolyl)phosphane]-1κ^2^<i>P</i>,2κ<i>P</i>-μ-di-iodido-1:2κ^4^<i>I</i>-dicopper(I)","Acta Crystallographica Section E","2007","63","10","m2522","m2522","10.1107/S1600536807041384","","","0.71073","MoKα","","0.0505","0.0342","","","0.0699","0.0765","","","","","","1.028","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215431","8.5117","0.0004","8.5273","0.0004","12.0711","0.0005","103.33","0.002","103.243","0.002","106.142","0.003","777.6","0.06","220","2","220","2","","","","","","","","5","P -1","-P 1","2","","Bis(triethylammonium) 4,4'-diamino-trans-stilbene-2,2'-disulfonate","","- C26 H44 N4 O6 S2 -","- C26 H44 N4 O6 S2 -","- C26 H44 N4 O6 S2 -","1","0.5","CV2287","Dufresne, Stéphane; Gaultois, Michael; Skene, W. G.","Bis(triethylammonium) 4,4'-diamino-<i>trans</i>-stilbene-2,2'-disulfonate","Acta Crystallographica Section E","2007","63","10","o3926","o3926","10.1107/S1600536807041360","","","1.54178","CuKα","","0.053","0.0516","","","0.1488","0.1504","","","","","","1.078","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215432","7.7788","0.0007","24.625","0.002","7.9948","0.0008","90","","93.03","0.001","90","","1529.3","0.2","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-[5-(2-Chloropyridin-3-yl)-2-methyl-2-phenyl-1,3,4-oxadiazol-3(2H)-yl]ethanone","","- C16 H14 Cl N3 O2 -","- C16 H14 Cl N3 O2 -","- C64 H56 Cl4 N12 O8 -","4","1","CV2288","Li-Fang Pan; Yue-Qing Lu; Quan Qin; Chen-Ze Qi; Qing-Bao Song","1-[5-(2-Chloropyridin-3-yl)-2-methyl-2-phenyl-1,3,4-oxadiazol-3(2<i>H</i>)-yl]ethanone","Acta Crystallographica Section E","2007","63","10","o3988","o3988","10.1107/S1600536807042729","","","0.71073","MoKα","","0.0491","0.0364","","","0.0967","0.1053","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215433","16.527","0.003","8.18","0.0016","14.463","0.003","90","","113.19","0.03","90","","1797.3","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis(1-vinyl-1H-imidazole-κN^3^)copper(II)]-μ-phthalato-κ^2^O:O']","","- C18 H16 Cu N4 O4 -","- C18 H16 Cu N4 O4 -","- C72 H64 Cu4 N16 O16 -","4","0.5","CV2291","Fa-Qian Liu; Rong-Xun Li; Shao-Xiang Li; Li-Shui Sun; Guang-Ye Liu","<i>catena</i>-Poly[[bis(1-vinyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II)]-μ-phthalato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","10","m2441","m2441","10.1107/S1600536807042109","","","0.71073","MoKα","","0.0693","0.0476","","","0.1235","0.1355","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215434","9.4241","0.0019","10.073","0.002","19.849","0.004","90","","102.52","0.03","90","","1839.4","0.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Ethyl 1-benzoyl-4-chloro-2-phenylprolinate","","- C20 H20 Cl N O3 -","- C20 H20 Cl N O3 -","- C80 H80 Cl4 N4 O12 -","4","2","CV2292","Tamazyan, Rafael; Ayvazyan, Armen; Martirosyan, Ashot; Martirosyan, Vahan; Raymond Schinazi","Ethyl 1-benzoyl-4-chloro-2-phenylprolinate","Acta Crystallographica Section E","2007","63","10","o3967","o3967","10.1107/S1600536807042213","","","0.71073","MoKα","","0.1273","0.0604","","","0.1161","0.1409","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215435","8.1634","0.0001","9.718","0.0001","19.6761","0.0002","100.453","0.007","92.23","0.011","106.272","0.008","1466.87","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-chlorido-bis[chlorido(di-2-pyridylmethanediol-κ^3^N,N',O)cadmium(II)] trihydrate","","- C22 H26 Cd2 Cl4 N4 O7 -","- C22 H26 Cd2 Cl4 N4 O7 -","- C44 H52 Cd4 Cl8 N8 O14 -","2","1","CV2294","Li, Ya-Min; Zhang, Jing-Lai; Zhao, Xiao-Wei","Di-μ-chlorido-bis[chlorido(di-2-pyridylmethanediol-κ^3^<i>N</i>,<i>N</i>',<i>O</i>)cadmium(II)] trihydrate","Acta Crystallographica Section E","2007","63","10","m2475","m2475","10.1107/S1600536807042717","","","0.71073","MoKα","","0.0419","0.0331","","","0.0742","0.0797","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215436","16","0.0016","6.349","0.0004","19.664","0.002","90","","96.812","0.012","90","","1983.4","0.3","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1-Hydroxycyclopentane-1-carboxylic acid","1-Hydroxycyclopentane-1-carboxylic acid","","- C6 H10 O3 -","- C6 H10 O3 -","- C72 H120 O36 -","12","3","CV2295","Betz, Richard; Klüfers, Peter","1-Hydroxycyclopentane-1-carboxylic acid","Acta Crystallographica Section E","2007","63","10","o3932","o3932","10.1107/S1600536807042183","","","0.71073","MoKα","","0.0739","0.0497","","","0.1317","0.1436","","","","","","0.953","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215437","7.835","0.0007","9.1368","0.0009","10.3272","0.001","79.72","0.002","77.381","0.002","64.657","0.002","648.97","0.11","302","2","302","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 4-amino-5-cyano-6-[(2-hydroxyethyl)amino]-2-methylnicotinate","","- C12 H16 N4 O3 -","- C12 H16 N4 O3 -","- C24 H32 N8 O6 -","2","1","CV2296","Qing-Yun Ren; Hong-Wu He; Chuan-Fei Jin; Yu-Cheng Gu","Ethyl 4-amino-5-cyano-6-[(2-hydroxyethyl)amino]-2-methylnicotinate","Acta Crystallographica Section E","2007","63","10","o4015","o4015","10.1107/S1600536807043383","","","0.71073","MoKα","","0.0777","0.0581","","","0.1572","0.1723","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215438","4.7758","0.0008","10.9093","0.0013","9.9204","0.0012","90","","91.024","0.001","90","","516.78","0.12","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,2-Diisobutyrylhydrazine","","- C8 H16 N2 O2 -","- C8 H16 N2 O2 -","- C16 H32 N4 O4 -","2","0.5","CV2297","Kao-Zhen Li; Yong Wang; Rong-Shan Li; Da-Qi Wang; Ze-Hua Lu","1,2-Diisobutyrylhydrazine","Acta Crystallographica Section E","2007","63","10","o4068","o4068","10.1107/S1600536807044406","","","0.71073","MoKα","","0.1063","0.0756","","","0.2156","0.2361","","","","","","0.994","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215439","9.6435","0.0003","9.1107","0.0003","10.2872","0.0003","90","","117.429","0.002","90","","802.22","0.05","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","<i>para</i>-bromophenylarsonic acid","(4-Bromophenyl)arsonic acid","","- C6 H6 As Br O3 -","- C6 H6 As Br O3 -","- C24 H24 As4 Br4 O12 -","4","1","CV2298","Betz, Richard; Klüfers, Peter; Walter, Andreas","(4-Bromophenyl)arsonic acid","Acta Crystallographica Section E","2007","63","10","m2483","m2483","10.1107/S1600536807043140","","","0.71073","MoKα","","0.0271","0.0215","","","0.0468","0.0492","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215440","9.3355","0.0019","14.707","0.003","5.9504","0.0012","90","","103.22","0.03","90","","795.3","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-methylthiobenzamide","","- C8 H9 N S -","- C8 H9 N S -","- C32 H36 N4 S4 -","4","1","CV2299","Śmiszek-Lindert, Wioleta; Nowak, Maria; Kusz, Joachim","<i>N</i>-Methylthiobenzamide","Acta Crystallographica Section E","2007","63","10","o4030","","10.1107/S1600536807043723","","","0.71073","MoKα","","0.0552","0.0377","","","0.1249","0.1285","","","","","","1.306","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215441","18.6554","0.0015","13.3102","0.0013","13.0653","0.0018","90","","91.643","0.009","90","","3242.9","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(4-fluorophenyl)phosphine selenide","","- C18 H12 F3 P Se -","- C18 H12 F3 P Se -","- C144 H96 F24 P8 Se8 -","8","2","CV2301","Muller, Alfred; Meijboom, Reinout","Tris(4-fluorophenyl)phosphine selenide","Acta Crystallographica Section E","2007","63","10","o4055","o4055","10.1107/S1600536807044170","","","0.71073","MoKα","","","0.0247","","","","0.0609","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215442","6.227","0.002","28.113","0.009","9.376","0.003","90","","103.85","0.014","90","","1593.6","0.9","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dimethyl 2,5-bis[2-(2-hydroxybenzoyl)hydrazino]cyclohexa- 1,4-diene-1,4-dicarboxylate dimethylformamide disolvate","","- C30 H38 N6 O10 -","- C30 H38 N6 O10 -","- C60 H76 N12 O20 -","2","0.5","CV2302","Hui Xu; Jianmin Dou; Dacheng Li; Daqi Wang","Dimethyl 2,5-bis[2-(2-hydroxybenzoyl)hydrazino]cyclohexa-1,4-diene-1,4-dicarboxylate dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","10","o4092","o4092","10.1107/S1600536807045175","","","0.71073","MoKα","","0.1243","0.0592","","","0.1424","0.1893","","","","","","0.999","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215443","12.079","0.002","11.089","0.002","6.38","0.0013","90","","97.57","0.03","90","","847.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethaneselenol","","- C6 H9 N3 O2 Se -","- C6 H9 N3 O2 Se -","- C24 H36 N12 O8 Se4 -","4","1","CV2303","Zhao, Hui; Gong, Hai-Bin","2-(2-Methyl-5-nitro-1<i>H</i>-imidazol-1-yl)ethaneselenol","Acta Crystallographica Section E","2007","63","10","o4096","o4096","10.1107/S1600536807045588","","","0.71073","MoKα","","0.1237","0.0647","","","0.1508","0.1775","","","","","","1.049","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2215444","19.477","0.003","12.1666","0.0019","23.97","0.004","90","","90","","90","","5680.1","1.6","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,4-Dibenzoyl-1-phenyl-3,5-di-2-thienylcyclohexanol","","- C34 H28 O3 S2 -","- C34 H28 O3 S2 -","- C272 H224 O24 S16 -","8","1","CV2306","Xian-Qiang Huang; Jin-Xian Wang","2,4-Dibenzoyl-1-phenyl-3,5-di2-thienylcyclohexanol","Acta Crystallographica Section E","2007","63","10","o4168","o4168","10.1107/S1600536807046843","","","0.71073","MoKα","","0.1563","0.0772","","","0.2","0.2687","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215445","8.3305","0.0019","16.982","0.004","9.137","0.002","90","","106.562","0.003","90","","1239","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Di-μ-thiocyanato-κ^4^N:N-bis({2-[2- (methylamino)ethyliminomethyl]phenolato}copper(II))","","- C22 H26 Cu2 N6 O2 S2 -","- C22 H26 Cu2 N6 O2 S2 -","- C44 H52 Cu4 N12 O4 S4 -","2","0.5","CV2307","Wei, Yi-Jun; Wang, Feng-Wu; Zhu, Qi-Yong","Di-μ-thiocyanato-κ^4^<i>N</i>:<i>N</i>-bis({2-[2-(methylamino)ethyliminomethyl]phenolato}copper(II))","Acta Crystallographica Section E","2007","63","10","m2629","m2629","10.1107/S1600536807047022","","","0.71073","MoKα","","0.1125","0.0642","","","0.1396","0.1598","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215446","14.109","0.003","9.274","0.0019","19.577","0.004","90","","106.94","0.03","90","","2450.4","1","423","2","423","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2-Formyl-4-phenylcyclohexen-1-olato- <i>cis</i>-dimethyl-<i>trans</i>-bis(trimethylphosphine)cobalt(III)","","- C21 H37 Co O2 P2 -","- C21 H37 Co O2 P2 -","- C84 H148 Co4 O8 P8 -","4","1","DN2225","Fang, Shimin; Zhou, Jin; Sun, Hongjian; Li, Xiaoyan","(2-Formyl-4-phenylcyclohexen-1-olato)-<i>cis</i>-dimethyl-<i>trans</i>-bis(trimethylphosphine)cobalt(III)","Acta Crystallographica Section E","2007","63","10","m2590","m2590","10.1107/S1600536807045163","","","0.71073","MoKα","","0.0652","0.0605","","","0.1661","0.1705","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215447","10.454","0.004","7.745","0.003","18.021","0.007","90","","105.228","0.007","90","","1407.9","0.9","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","diethyl hydroxy(4-methoxyphenyl)methylphosphonate","","- C12 H19 O5 P -","- C12 H19 O5 P -","- C48 H76 O20 P4 -","4","1","DN2226","Fang, Hua; Fang, Mei-Juan; Zhao, Yu-Fen","Diethyl hydroxy(4-methoxyphenyl)methylphosphonate","Acta Crystallographica Section E","2007","63","10","o4002","o4002","10.1107/S1600536807043280","","","0.71073","MoKα","","0.094","0.0645","","","0.1493","0.1586","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215448","21.031","0.002","7.5299","0.0009","13.5789","0.0016","90","","90.464","0.001","90","","2150.3","0.4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[μ-4,7-dioxa-1,10-diazaoctane-1,1,10,10-tetraacetato- 1κ^4^O^1^,O^1'^,N^1^,O^4^:2κ^4^O^7^,N^10^,O^10^,O^10'^] bis[aquanickel(II)] dihydrate","","- C14 H28 N2 Ni2 O14 -","- C14 H28 N2 Ni2 O14 -","- C56 H112 N8 Ni8 O56 -","4","0.5","DN2227","Hui-Qin Liu","[μ-4,7-Dioxa-1,10-diazaoctane-1,1,10,10-tetraacetat0-1κ^4^<i>O</i>^1^,<i>O</i>^1'^,<i>N</i>^1^,<i>O</i>^4^:2κ^4^<i>O</i>^7^,<i>N</i>^10^,<i>O</i>^10^,<i>O</i>^10'^]bis[aquanickel(II)] dihydrate","Acta Crystallographica Section E","2007","63","10","m2575","m2575","10.1107/S1600536807044893","","","0.71073","MoKα","","0.0295","0.0237","","","0.0573","0.0602","","","","","","1.078","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215449","17.531","0.004","6.6251","0.0013","11.335","0.002","90","","90","","90","","1316.5","0.5","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","Bis(melamine-κN)dihydroxidozinc(II) monohydrate","Dihydroxidobis(melamine-κ<i>N</i>)zinc(II) monohydrate","","- C6 H16 N12 O3 Zn -","- C6 H16 N12 O3 Zn -","- C24 H64 N48 O12 Zn4 -","4","1","DN2228","Wang, Guo-wei; Wu, Wen-yuan; Zhuang, Ling-hua","Dihydroxidobis(melamine-κ<i>N</i>)zinc(II) monohydrate","Acta Crystallographica Section E","2007","63","10","m2552","m2553","10.1107/S1600536807045254","","","0.71073","MoKα","","0.0603","0.0531","","","0.1353","0.1433","","","","","","1.088","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215450","8.606","0.002","5.94","0.001","9.843","0.002","90","","98.641","0.003","90","","497.46","0.17","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Methyl-3-thiosemicarbazide","","- C2 H7 N3 S -","- C2 H7 N3 S -","- C8 H28 N12 S4 -","4","1","DN2229","Valdés-Martínez, Jesús; Toscano, Rubén A.","2-Methyl-3-thiosemicarbazide","Acta Crystallographica Section E","2007","63","10","o4082","o4082","10.1107/S1600536807045102","","","0.71073","MoKα","","0.0433","0.0373","","","0.0851","0.0877","","","","","","1.072","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215451","7.2622","0.0004","10.5603","0.0009","11.9036","0.0009","92.908","0.004","95.723","0.005","97.278","0.005","899.17","0.11","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","Diethyl 2,2'-(ethylenediimino)di(cyclopentenecarboxylate)","","- C18 H28 N2 O4 -","- C18 H28 N2 O4 -","- C36 H56 N4 O8 -","2","1","DN2230","Görls, Helmar; Johannes Notni; Kempe, Kristian; Anders, Ernst","Diethyl 2,2'-(ethylenediimino)di(cyclopentenecarboxylate)","Acta Crystallographica Section E","2007","63","10","o4095","o4095","10.1107/S1600536807045539","","","0.71073","MoKα","","0.096","0.0615","","","0.154","0.1779","","","","","","1.012","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215452","12.7339","0.0007","14.5313","0.0008","9.7716","0.0006","90","","90","","90","","1808.14","0.18","298","2","298","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","<i>cis</i>-(Cyclobutane-1,1-dicarboxylato)bis(2-methylpyridine)platinum(II)","","- C18 H20 N2 O4 Pt -","- C18 H20 N2 O4 Pt -","- C72 H80 N8 O16 Pt4 -","4","0.5","DN2231","Ming-Jin, Xie; Xi-Zhu Chen; Wei-Ping Liu; Shu-Qian Hou; Qing-Shong Ye","<i>cis</i>-(Cyclobutane-1,1-dicarboxylato)bis(2-methylpyridine)platinum(II)","Acta Crystallographica Section E","2007","63","10","m2589","m2589","10.1107/S1600536807045771","","","0.71073","MoKα","","0.0215","0.017","","","0.0417","0.0436","","","","","","1.041","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2215453","5.472","0.0011","7.9623","0.0016","9.7363","0.0019","91.01","0.03","93.96","0.03","105.57","0.03","407.38","0.15","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","1,2-Di-2-pyridyl-1,2-bis(1,3,4-thiadiazol-2-ylamino)ethane","","- C16 H12 N8 S2 -","- C16 H12 N8 S2 -","- C16 H12 N8 S2 -","1","0.5","DN2232","Zhang, Yu-Xia; Li, Yu-Ling","1,2-Di-2-pyridyl-1,2-bis(1,3,4-thiadiazol-2-ylamino)ethane","Acta Crystallographica Section E","2007","63","10","o4179","o4179","10.1107/S1600536807046673","","","0.71073","MoKα","","0.0594","0.0366","","","0.0886","0.1007","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215454","9.926","0.002","5.934","0.0012","23.049","0.005","90","","100.39","0.03","90","","1335.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Methyl-5-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1,3,4-thiadiazole","","- C12 H10 N4 O S2 -","- C12 H10 N4 O S2 -","- C48 H40 N16 O4 S8 -","4","1","DN2233","Wang, Pin-liang; Wang, Hai-bo; Kang, Si-shun; Li, Hai-ling; Wu, Wen-yuan","2-Methyl-5-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-1,3,4-thiadiazole","Acta Crystallographica Section E","2007","63","10","o4180","o4180","10.1107/S1600536807046910","","","0.71073","MoKα","","0.1352","0.0765","","","0.1557","0.2036","","","","","","0.998","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215455","14.0633","0.0003","14.7277","0.0004","20.7043","0.0007","104.681","0.004","90.45","0.001","102.226","0.003","4045.6","0.2","291","2","291","2","","","","","","","","7","P -1","-P 1","2","","μ-nitrato-bis[(2,2':6',2''-terpyridyl-κ3N)palladium(II)] hexakis(hexafluorophosphate) acetonitrile solvate","","- C31 H23.5 F18 N7.5 O3 P3 Pd2 -","- C31 H23.5 F18 N7.5 O3 P3 Pd2 -","- C124 H94 F72 N30 O12 P12 Pd8 -","4","2","DN3057","Mei, Guang-Quan; Huang, Ke-Long; Huang, Hai-Ping","A dimer-to-dimer metal‒metal linear aggregate from a nitrate-bridged <i>cis</i>-(2,2':6',2''-terpyridyl-κ^3^<i>N</i>)palladium(II) cofacial dimer","Acta Crystallographica Section E","2007","63","10","m2510","m2511","10.1107/S1600536807042766","","","0.71073","MoKα","","0.0842","0.0628","","","0.1463","0.1559","","","","","","1.07","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2215456","16.074","0.003","8.087","0.0016","19.333","0.004","90","","90","","90","","2513.1","0.9","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","<i>N</i>-(2,4-Dichlorobenzylidene)-<i>N</i>'-phenylhydrazine","","- C13 H10 Cl2 N2 -","- C13 H10 Cl2 N2 -","- C104 H80 Cl16 N16 -","8","1","DN3063","Yin, Zhi-Gang; Qian, Heng-Yu; Chen, Yu-Zhen; Feng, Yu-Li","<i>N</i>-(2,4-Dichlorobenzylidene)-<i>N</i>'-phenylhydrazine","Acta Crystallographica Section E","2007","63","10","o4119","o4119","10.1107/S1600536807045552","","","0.71073","MoKα","","0.0668","0.0604","","","0.1286","0.1324","","","","","","1.218","","","","has coordinates,has Fobs","192349","2020-10-21","18:00:00",""
"2215457","7.28","0.0015","14.678","0.003","27.368","0.006","90","","90","","90","","2924.4","1.1","298","2","298","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","3-Bromo-4-methoxybenzaldehyde 4-nitrophenylhydrazone","","- C14 H12 Br N3 O3 -","- C14 H12 Br N3 O3 -","- C112 H96 Br8 N24 O24 -","8","1","DN3064","Zhang, Chun-Xia; Yin, Zhi-Gang; Qian, Heng-Yu; Hu, Jie; Feng, Yu-Li","3-Bromo-4-methoxybenzaldehyde 4-nitrophenylhydrazone","Acta Crystallographica Section E","2007","63","10","o4165","o4165","10.1107/S1600536807046533","","","0.71073","MoKα","","0.1105","0.0911","","","0.1661","0.1756","","","","","","1.217","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215458","21.9895","0.0017","21.9895","0.0017","24.035","0.003","90","","90","","90","","11621.8","1.9","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","(E)-2,4,6-Triisopropyl-N-[2- (2-pyridylmethyleneamino)cyclohexyl]benzenesulfonamide acetonitrile hemisolvate","","- C28 H40.5 N3.5 O2 S -","- C28 H39 N3.5 O2 S -","- C448 H624 N56 O32 S16 -","16","1","ER2029","Cheng Wang; Jin-Cai Wu","(<i>E</i>)-2,4,6-Triisopropyl-<i>N</i>-[2-(2-pyridylmethyleneamino)cyclohexyl]benzenesulfonamide acetonitrile hemisolvate","Acta Crystallographica Section E","2007","63","10","o4064","o4064","10.1107/S1600536807039918","","","0.71073","MoKα","","0.1116","0.0618","","","0.1829","0.2158","","","","","","1.042","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215459","15.9298","0.0016","11.8296","0.0012","16.8033","0.0017","90","","108.502","0.002","90","","3002.8","0.5","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","Pterodondiol","Pterodondiol","","- C15 H28 O2 -","- C15 H28 O2 -","- C120 H224 O16 -","8","4","ER2031","Mei, Zhi-nan; Li, Yun-fang; Yang, Guang-zhong","Pterodondiol","Acta Crystallographica Section E","2007","63","10","o4010","o4010","10.1107/S1600536807043152","","","0.71073","MoKα","","0.0784","0.053","","","0.1293","0.1476","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215460","8.924","0.002","9.046","0.002","17.183","0.004","90","","96.787","0.001","90","","1377.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Benzylbutyldimethylammonium bromide","","- C13 H22 Br N -","- C13 H22 Br N -","- C52 H88 Br4 N4 -","4","1","ER2039","Hodorowicz, Maciej","Benzylbutyldimethylammonium bromide","Acta Crystallographica Section E","2007","63","10","o3940","o3940","10.1107/S1600536807042274","","","0.71073","MoKα","","0.0738","0.0383","","","0.0662","0.0768","","","","","","1.075","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215461","10.7181","0.0003","10.7364","0.0003","17.9238","0.0005","89.209","0.001","89.22","0.001","85.373","0.001","2055.48","0.1","90","1","90","1","","","","","","","","5","P -1","-P 1","2","Cp*Ru(m-NO)2RuCp*","Di-μ-nitrosyl-bis[(η^5^-pentamethylcyclopentadienyl)ruthenium(0)](Ru—Ru)","","- C20 H30 N2 O2 Ru2 -","- C20 H30 N2 O2 Ru2 -","- C80 H120 N8 O8 Ru8 -","4","2","ER2041","Pearsal, Matthew; Gembicky, Milan; Dominiak, Paulina; Larsen, Anna; Coppens, Philip","Di-μ-nitrosyl-bis[(η^5^-pentamethylcyclopentadienyl)ruthenium(0)](<i>Ru{—</i>Ru})","Acta Crystallographica Section E","2007","63","10","m2596","m2596","10.1107/S1600536807045321","","","0.71073","MoKα","","0.0479","0.0455","","","0.1346","0.1386","","","","","","1.259","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215462","21.8136","0.0015","8.9446","0.0006","15.9938","0.0011","90","","105.087","0.001","90","","3013.1","0.4","292","2","292","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","9,9-Bis(cyanoethanoic)fluorene","","- C19 H16 N2 -","- C19 H16 N2 -","- C152 H128 N16 -","8","2","EZ2095","Liu, Hongxia","9,9-Bis(cyanoethanoic)fluorene","Acta Crystallographica Section E","2007","63","10","o4033","o4033","10.1107/S1600536807043772","","","0.71073","MoKα","","0.071","0.0499","","","0.1349","0.1443","","","","","","1.074","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215463","5.9497","0.0003","10.6987","0.0008","13.4021","0.0012","90","","90","","90","","853.1","0.11","113","2","113","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2,6-dimethylquinoline","","- C11 H11 N -","- C11 H11 N -","- C44 H44 N4 -","4","1","EZ2096","Ying-Qian Xu; Jun-Yi Hu","2,6-Dimethylquinoline","Acta Crystallographica Section E","2007","63","10","o3993","o3993","10.1107/S1600536807043139","","","0.7107","MoKα","","0.0456","0.0411","","","0.099","0.1015","","","","","","1.147","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215464","12.075","0.004","10.907","0.004","12.328","0.004","90","","101.396","0.005","90","","1591.6","0.9","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(4R,5S)-Methyl 1,3-dibenzyl-5-[(R)-2-(hydroxydiphenylmethyl)pyrrolidine-1-carbonyl]- 2-oxoimidazolidine-4-carboxylate","","- C37 H37 N3 O5 -","- C37 H37 N3 O5 -","- C74 H74 N6 O10 -","2","1","EZ2097","Jian Liu; Fen-Er Chen; Min-Qin Chen","(4<i>R</i>,5<i>S</i>)-Methyl 1,3-dibenzyl-5-[(<i>R</i>)-2-(hydroxydiphenylmethyl)pyrrolidine-1-carbonyl]-2-oxoimidazolidine-4-carboxylate","Acta Crystallographica Section E","2007","63","10","o4127","o4127","10.1107/S1600536807045874","","","0.71073","MoKα","","0.0645","0.0419","","","0.1009","0.1107","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215465","15.89","0.0004","15.89","0.0004","9.4584","0.0005","90","","90","","120","","2068.22","0.13","193","2","193","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","chlorido[hydridotris(3-tert-butyl-5-methylpyrazolyl)borato]nickel(II)","","- C24 H40 B Cl N6 Ni -","- C24 H40 B Cl N6 Ni -","- C72 H120 B3 Cl3 N18 Ni3 -","3","0.166667","FI2040","Adam D. Beitelman; Gregory M. Ferrence","A redetermination of chlorido[hydridotris(3-<i>tert</i>-butyl-5-methylpyrazolyl)borato]nickel(II)","Acta Crystallographica Section E","2007","63","10","m2520","m2521","10.1107/S1600536807043814","","","0.71073","MoKα","","","0.0175","","","","0.0448","","","","","","1.078","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215466","9.4119","0.0014","10.7164","0.0016","12.321","0.003","104.955","0.002","101.123","0.003","104.538","0.002","1117.2","0.4","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","1,1'-[1,4-Phenylenebis(methylene)]dipyridinium hexacyanidoferrate(II) octahydrate","","- C42 H52 Fe N10 O8 -","- C42 H52 Fe N10 O8 -","- C42 H52 Fe N10 O8 -","1","0.5","FI2041","Tang, Ming-Sheng; Wu, Yang-Jie; Liu, Xiu-Cun; Du, Chen-Xia; Niu, Yun-Yin","1,1'-[1,4-Phenylenebis(methylene)]dipyridinium hexacyanidoferrate(II) octahydrate","Acta Crystallographica Section E","2007","63","10","m2517","m2517","10.1107/S1600536807042705","","","0.71073","MoKα","","0.0765","0.0568","","","0.1598","0.1759","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215467","27.3272","0.0015","4.8389","0.0003","21.6639","0.0012","90","","90","","90","","2864.7","0.3","273","2","273","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","4-methoxy-N-[(1E)-(2-nitrophenyl)methylene]benzhydrazide","","- C15 H13 N3 O4 -","- C15 H13 N3 O4 -","- C120 H104 N24 O32 -","8","2","FI2043","Jian-Guo Chang; Guo-Fang He; Yan-Fei Li","4-Methoxy-<i>N</i>-[(1<i>E</i>)-(2-nitrophenyl)methylene]benzhydrazide","Acta Crystallographica Section E","2007","63","10","o3997","o3997","10.1107/S1600536807043085","","","0.71073","MoKα","","0.0519","0.0366","","","0.0858","0.0939","","","","","","1.076","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215468","3.9794","0.0002","15.9296","0.001","10.9957","0.0006","90","","90","","90","","697.02","0.07","150","1","150","1","","","","","","","","3","C m c 21","C 2c -2","36","","Zirconium germanium tetratelluride","","- Ge Te4 Zr -","- Ge Te4 Zr -","- Ge4 Te16 Zr4 -","4","0.5","FI2044","Chang-Ho Lee; Gyung-Joo Jang; Hoseop Yun","Stoichiometric ZrGeTe~4~","Acta Crystallographica Section E","2007","63","10","i183","i183","10.1107/S1600536807045862","","","0.71073","MoKα","","","0.0361","","","","0.0803","","","","","","1.065","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215469","12.051","0.002","4.1223","0.0008","17.58","0.004","90","","90","","90","","873.3","0.3","295","2","295","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","dilanthanum copper indium pentaselenide","","- Cu In La2 Se5 -","- Cu In La2 Se5 -","- Cu4 In4 La8 Se20 -","4","0.5","FI2045","Gulay, L. D.; Daszkiewicz, M.; Huch, M. R.; Pietraszko, A.","Dilanthanum copper indium pentaselenide, La~2~CuInSe~5~","Acta Crystallographica Section E","2007","63","10","i182","i182","10.1107/S1600536807046041","","","0.71073","MoKα","","0.025","0.0204","","","0.0397","0.0409","","","","","","1.124","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215470","7.678","0.004","8.063","0.004","19.58","0.01","90","","90","","90","","1212.2","1.1","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4-hydroxy-3-(1-methylethylidene)-6,7,8,8a-tetrahydro-1-oxaacenaphthylen-2-one","","- C14 H14 O3 -","- C14 H14 O3 -","- C56 H56 O12 -","4","1","FL2135","Wang, Qi; Chen, Dao-Feng","2-Hydroxyplatyphyllid","Acta Crystallographica Section E","2007","63","10","o4018","o4018","10.1107/S1600536807037105","","","0.71073","MoKα","","0.1097","0.0795","","","0.1536","0.1643","","","","","","1.201","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215471","12.2729","0.0006","8.283","0.0007","14.3335","0.001","90","","112.851","0.003","90","","1342.74","0.16","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(6-Methoxy-7H-purine-7-yl)-1-phenylethanone","","- C14 H14 N4 O3 -","- C14 H14 N4 O3 -","- C56 H56 N16 O12 -","4","1","FL2156","Buehler, Stefanie; Schollmeyer, Dieter; Hauser, Dominik; Laufer, Stefan; Peifer, Christian","2-(6-Methoxy-7<i>H</i>-purin-7-yl)-1-phenylethanone monohydrate","Acta Crystallographica Section E","2007","63","10","o4154","o4155","10.1107/S1600536807044212","","","1.54178","CuKα","","0.0543","0.0442","","","0.1186","0.1268","","","","","","1.078","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215472","3.9105","0.0002","6.2985","0.0004","15.1479","0.0009","89.52","0.002","88.792","0.001","86.164","0.002","372.17","0.04","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","(E,E)-4,4'-Dichloro-2,2'-(1,1'-azinodiethylene)diphenol","","- C16 H14 Cl2 N2 O2 -","- C16 H14 Cl2 N2 O2 -","- C16 H14 Cl2 N2 O2 -","1","0.5","FL2158","Jian-Guo Chang; Guo-Fang He; Yan-Fei Li","(<i>E</i>,<i>E</i>)-4,4'-Dichloro-2,2'-(1,1'-azinodimethylene)diphenol","Acta Crystallographica Section E","2007","63","10","o3982","o3982","10.1107/S1600536807042870","","","0.71073","MoKα","","0.0506","0.036","","","0.0731","0.0807","","","","","","1.004","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215473","6.9355","0.0005","21.3303","0.0013","8.1859","0.0005","90","","101.435","0.003","90","","1186.95","0.13","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","<i>exo</i>-8-<i>exo</i>-11-Divinylpentacyclo[5.4.0.0^2,6^.0^3,10^.0^5,6^]\ undecane-<i>endo</i>-8,<i>endo</i>-11-diol","","- C15 H18 O2 -","- C15 H18 O2 -","- C60 H72 O8 -","4","1","FL2159","Boyle, Grant A.; Govender, Thavendran; Karpoormath, Rajshekhar; Kruger, Hendrik G.","<i>exo</i>-8,<i>exo</i>-11-Divinylpentacyclo[5.4.0.0^2,6^.0^3,10^.0^5,6^]undecane-<i>endo</i>-8,<i>endo</i>-11-diol","Acta Crystallographica Section E","2007","63","10","o3977","o3977","10.1107/S1600536807042596","","","0.71073","MoKα","","0.0461","0.0412","","","0.1112","0.1148","","","","","","1.082","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215474","8.8601","0.0017","10.706","0.002","11.147","0.002","80.24","0.008","78.177","0.008","87.504","0.009","1019.9","0.3","273","2","293","2","","","","","","","","4","P -1","-P 1","2","","6-Methoxy-2-[tri(2-pyridyl)methyliminomethyl]phenol","","- C24 H20 N4 O2 -","- C24 H20 N4 O2 -","- C48 H40 N8 O4 -","2","1","FL2160","Ni, Zhong-Hai; Zhang, Li-Fang; Wang, Hai-Long","6-Methoxy-2-[tri(2-pyridyl)methyliminomethyl]phenol","Acta Crystallographica Section E","2007","63","10","o4052","o4052","10.1107/S1600536807044224","","","0.71073","MoKα","","0.0449","0.0399","","","0.1085","0.1126","","","","","","1.011","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215475","10.907","0.002","14.2","0.003","17.391","0.004","90","","90","","90","","2693.5","1","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","3,7-dideacetylkhivorin","1α-acetyloxy-14,15β:21,23-diepoxy-3α,7α-dihydroxy-4,4,8-trimethyl-D-\ <i>homo</i>-24-<i>nor</i>-17-oxochola-20,22-dien-16-one","","- C28 H38 O8 -","- C28 H38 O8 -","- C112 H152 O32 -","4","1","FL2161","Zhang, Huaping; VanDerveer, Don; Chen, Feng; Wang, Xi; Wargovich, Michael J.","3,7-Dideacetylkhivorin","Acta Crystallographica Section E","2007","63","10","o4162","o4162","10.1107/S1600536807046363","","","0.7107","MoKa","","0.0458","0.0407","","","0.1045","0.1085","","","","","","1.065","","","","has coordinates,has Fobs","213923","2020-10-21","18:00:00",""
"2215476","13.7876","0.0015","6.5268","0.0007","7.7517","0.0009","90","","90","","90","","697.57","0.13","150","2","150","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","picolinic acid hydrochloride","","- C6 H6 Cl N O2 -","- C6 H6 Cl N O2 -","- C24 H24 Cl4 N4 O8 -","4","0.5","FL2162","Elsegood, Mark R. J.; Hussain, Dasthagir A.; Sanchez-Ballester, Noelia M.","Redetermination of picolinic acid hydrochloride at 150 K","Acta Crystallographica Section E","2007","63","10","o4044","o4044","10.1107/S1600536807044030","","","0.71073","MoKα","","0.0331","0.0293","","","0.0797","0.0823","","","","","","1.126","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215477","19.519","0.004","7.6868","0.0015","15.117","0.003","90","","92.77","0.03","90","","2265.5","0.8","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","butobarbitone","5-butyl-5-ethylbarbituric acid","","- C10 H16 N2 O3 -","- C10 H16 N2 O3 -","- C80 H128 N16 O24 -","8","1","FL2163","Nichol, Gary S.; Clegg, William","A second <i>C</i>2/<i>c</i> polymorph of butobarbitone","Acta Crystallographica Section E","2007","63","10","o4147","o4147","10.1107/S1600536807045448","","","0.71073","MoKα","","0.061","0.0389","","","0.097","0.1076","","","","","","1.076","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215478","8.7122","0.0002","9.8523","0.0002","10.4304","0.0002","103.255","0.0014","90.6852","0.0014","97.4368","0.0012","863.31","0.03","150","2","293","","","","","","","","","4","P -1","-P 1","2","","2-(2-Hydroxyethyl)-2,3-dihydro-1<i>H</i>-benzo[<i>c</i>]pyrrol-1-one","","- C10 H11 N O2 -","- C10 H10.9581 N O2 -","- C40 H43.8324 N4 O8 -","4","2","GG2022","Urban, Jiří; Fábry, Jan; Zuman, Petr; Ludvík, Jiří; Císařová, Ivana","2-(2-Hydroxyethyl)-2,3-dihydro-1<i>H</i>-benzo[<i>c</i>]pyrrol-1-one","Acta Crystallographica Section E","2007","63","10","o4137","o4138","10.1107/S1600536807045291","","","0.71073","MoKα","","0.0459","0.039","","","0.114","0.1172","","","","","","2.09","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2215479","7.0292","0.0001","11.9861","0.0005","18.0014","0.0007","90","","90","","90","","1516.67","0.09","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(3R*,1'S*,3'R*)-2-(2''-hydroxyethyl)-3- (3'-hydroxy-1'H,3'H- benzo[c]furan)-1'-yl-1H,3H-benzo[c]pyrrol-1-one","(3<i>R</i>*,1'<i>S</i>*,3'<i>R</i>*)-3-(3'-Hydroxy-1'<i>H</i>,3'<i>H</i>- benzo[<i>c</i>]furan-1'-yl)-2-(2''-hydroxyethyl)-2,3-dihydro-1<i>H</i>- benzo[<i>c</i>]pyrrol-1-one","","- C18 H17 N O4 -","- C18 H17 N O4 -","- C72 H68 N4 O16 -","4","1","GG2023","Urban, Jiří; Fábry, Jan; Zuman, Petr; Ludvík, Jiří; Císařová, Ivana","(3<i>R</i>*,1'<i>S</i>*,3'<i>R</i>*)-3-(3'-Hydroxy-1'<i>H</i>,3'<i>H</i>-benzo[<i>c</i>]furan-1'-yl)-2-(2''-hydroxyethyl)-2,3-dihydro-1<i>H</i>-benzo[<i>c</i>]pyrrol-1-one","Acta Crystallographica Section E","2007","63","10","o4139","o4140","10.1107/S1600536807045308","","","0.71073","MoKα","","0.0509","0.0365","","","0.0663","0.0693","","","","","","1.65","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215480","11.6054","0.001","6.7122","0.0006","10.5718","0.0008","90","","102.821","0.007","90","","802.99","0.12","130","2","130","2","","","","","","","","4","C 1 2 1","C 2y","5","","Tetraammonium benzene-1,2,4,5-tetracarboxylate dihydrate","","- C10 H22 N4 O10 -","- C10 H22 N4 O10 -","- C20 H44 N8 O20 -","2","0.5","GG2029","Dutkiewicz, Grzegorz; Borowiak, Teresa; Pietraszkiewicz, Marek; Pietraszkiewicz, Oksana","Tetraammonium benzene-1,2,4,5-tetracarboxylate dihydrate","Acta Crystallographica Section E","2007","63","10","o4101","","10.1107/S1600536807045205","","","0.71073","MoKα","","0.0274","0.0259","","","0.0748","0.0758","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215481","7.7881","0.0003","9.3199","0.0004","16.5419","0.0006","90","","98.388","0.002","90","","1187.84","0.08","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E,E)-4,4'-Dimethyl-2,2'-(1,1'-dibenzylazino)diphenol","","- C30 H28 N2 O2 -","- C30 H28 N2 O2 -","- C60 H56 N4 O4 -","2","0.5","GG2038","Jian-Guo Chang; Ji-Kun Li","(<i>E</i>,<i>E</i>)-4,4'-Dimethyl-2,2'-(1,1'-dibenzylazino)diphenol","Acta Crystallographica Section E","2007","63","10","o4061","o4061","10.1107/S1600536807044182","","","0.71073","MoKα","","0.0708","0.0445","","","0.1371","0.163","","","","","","1.005","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215482","7.5594","0.0003","9.8406","0.0003","13.0494","0.0004","95.559","0.002","102.98","0.002","111.7","0.0017","861.36","0.05","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Phenylammonium tetrachlorozincate(II)","Bis(phenylammonium) tetrachloridozincate(II) monohydrate","","- C12 H18 Cl4 N2 O Zn -","- C12 H18 Cl4 N2 O Zn -","- C24 H36 Cl8 N4 O2 Zn2 -","2","1","GG2040","Guo, Ning; Yi, Jianglong; Chen, Yuan; Liao, Shijun; Fu, Zhiyong","Bis(phenylammonium) tetrachloridozincate(II) monohydrate","Acta Crystallographica Section E","2007","63","10","m2571","m2571","10.1107/S1600536807044674","","","0.71073","MoKα","","0.0433","0.0327","","","0.069","0.0742","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215483","8.3339","0.0005","6.4906","0.0003","25.6571","0.0015","90","","92.804","0.002","90","","1386.18","0.13","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","syn-Acetophenone(2,4-dinitrophenyl)hydrazone","syn-Acetophenone(2,4-dinitrophenyl)hydrazone","","- C14 H12 N4 O4 -","- C14 H12 N4 O4 -","- C56 H48 N16 O16 -","4","1","GG2041","W. D. Samuel Motherwell; John Ramsay","<i>syn</i>-Acetophenone-(2,4-dinitrophenyl)hydrazone","Acta Crystallographica Section E","2007","63","10","o4043","o4043","10.1107/S1600536807043917","","","0.71073","MoKα","","0.0728","0.0506","","","0.1163","0.1279","","","","","","1.153","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215484","25.6719","0.0007","12.2509","0.0003","22.6278","0.0006","90","","122.701","0.001","90","","5988.6","0.3","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorido-[N,N'-bis(2,6-dimethylphenyl)pentane-2,4- diiminato](indenyl)zirconium(IV) toluene hemisolvate","","- C33.5 H36 Cl2 N2 Zr -","- C33.5 H36 Cl2 N2 Zr -","- C268 H288 Cl16 N16 Zr8 -","8","1","GG2042","Verguet, Emilie; Fortuné, Rose-Verla; Oguadinma, Paul O.; Schaper, Frank","Dichlorido-[<i>N</i>,<i>N</i>'-bis(2,6-dimethylphenyl)pentane-2,4-diiminato](indenyl)zirconium(IV) toluene hemisolvate","Acta Crystallographica Section E","2007","63","10","m2539","m2540","10.1107/S1600536807043966","","","1.54178","CuKα","","0.0354","0.0324","","","0.0846","0.0859","","","","","","1","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215485","10.0163","0.0003","10.599","0.0004","13.1392","0.0005","73.803","0.001","78.869","0.002","66.178","0.001","1220.27","0.08","150","","150","","","","","","","","","5","P -1","-P 1","2","","Dichlorido-[<it>N</it>,<it>N</it>'-bis(2,6-dimethylphenyl)pentane-2,4- diiminato](cyclopentadienyl)zirconium(IV)","","- C26 H30 Cl2 N2 Zr -","- C26 H30 Cl2 N2 Zr -","- C52 H60 Cl4 N4 Zr2 -","2","1","GG2043","Verguet, Emilie; Oguadinma, Paul O.; Schaper, Frank","Dichlorido-[<i>N</i>,<i>N</i>'-bis(2,6-dimethylphenyl)pentane-2,4-diiminato](cyclopentadienyl)zirconium(IV)","Acta Crystallographica Section E","2007","63","10","m2541","m2541","10.1107/S1600536807043978","","","1.54178","CuKα","","0.0417","0.0416","","","0.103","0.1031","","","","","","1.13","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215486","9.208","0.005","8.643","0.004","12.458","0.006","90","","107.46","0.02","90","","945.8","0.8","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","N-Chloromethylsaccharin","2-Chloromethyl-1,2-benzisothiazole-1,1,3(2<i>H</i>)-trione","","- C8 H6 Cl N O3 S -","- C8 H6 Cl N O3 S -","- C32 H24 Cl4 N4 O12 S4 -","4","1","GG2045","Siddiqui, Waseeq Ahmad; Ahmad, Saeed; Khan, Islam Ullah; Siddiqui, Hamid Latif; Parvez, Masood","2-Chloromethyl-1,2-benzisothiazole-1,1,3(2<i>H</i>)-trione","Acta Crystallographica Section E","2007","63","10","o4116","o4116","10.1107/S1600536807044923","","","0.71073","MoKα","","0.0582","0.0388","","","0.0923","0.102","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215487","9.365","0.006","8.103","0.005","17.691","0.012","90","","99.673","0.012","90","","1323.4","1.5","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Di-μ-chlorido-bis(chlorido{2-[(2S)-pyrrolidin-2-yl]-1H- benzimidazole}cadmium(II))","","- C22 H26 Cd2 Cl4 N6 -","- C22 H26 Cd2 Cl4 N6 -","- C44 H52 Cd4 Cl8 N12 -","2","1","GK2093","Fu, Da-Wei; Ye, Heng-Yun","Di-μ-chlorido-bis(chlorido{2-[(2<i>S</i>)-pyrrolidin-2-yl]-1<i>H</i>-benzimidazole}cadmium(II))","Acta Crystallographica Section E","2007","63","10","m2453","m2453","10.1107/S1600536807041980","","","0.71073","MoKα","","0.0305","0.0274","","","0.0594","0.0607","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215488","16.711","0.005","8.306","0.002","10.425","0.003","90","","101.963","0.009","90","","1415.6","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Methylphenyl (dimethylamido)(isopropylamido)phosphate","","- C12 H21 N2 O2 P -","- C12 H21 N2 O2 P -","- C48 H84 N8 O8 P4 -","4","1","GK2098","Mehrdad Pourayoubi; Saied Ghadimi; Ali Asghar Ebrahimi Valmoozi","4-Methylphenyl (dimethylamido)(isopropylamido)phosphate","Acta Crystallographica Section E","2007","63","10","o4093","o4093","10.1107/S1600536807045679","","","0.71073","MoKα","","0.14","0.0573","","","0.0756","0.0928","","","","","","0.999","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215489","10.947","0.002","11.13","0.002","13.636","0.002","112.798","0.002","91.999","0.003","90.908","0.002","1529.9","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","7-Bromo-2-methyl-1-(phenylsulfanyl)naphtho[2,1-b]furan","","- C19 H13 Br O S -","- C19 H13 Br O S -","- C76 H52 Br4 O4 S4 -","4","2","GK2104","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","7-Bromo-2-methyl-1-(phenylsulfanyl)naphtho[2,1-<i>b</i>]furan","Acta Crystallographica Section E","2007","63","10","o4102","o4102","10.1107/S160053680704562X","","","0.71073","MoKα","","0.0715","0.0583","","","0.1456","0.152","","","","","","1.136","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215490","9.8035","0.0017","9.4636","0.0016","16.457","0.003","90","","100.064","0.002","90","","1503.3","0.5","294","2","566","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Z)-3-(4-Hydroxyphenethylamino)-2-methyl-1-phenylprop-2-en-1-one","","- C18 H19 N O2 -","- C18 H19 N O2 -","- C72 H76 N4 O8 -","4","1","GW2021","Li, Zhenhuan; Guo, Ming-Lin; Su, Kunmei","(<i>Z</i>)-3-(4-Hydroxyphenethylamino)-2-methyl-1-phenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","10","o4046","","10.1107/S1600536807043851","","","0.71073","MoKα","","0.0986","0.0741","","","0.1439","0.1574","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215491","30.626","0.005","12.981","0.002","17.164","0.002","90","","90","","90","","6823.7","1.7","273","2","273","2","","","","","","","","5","F d d 2","F 2 -2d","43","Poly-[trimethyltin-3-{(carboxyphenyl)amino}cyclohexen-2-one]","<it>catena</it>-Poly[[trimethyltin(IV)]-μ-2-[(3-oxocyclohex-1- enyl)amino]benzoato-κ^2^<it>O</it>:<it>O</it>']","","- C16 H21 N O3 Sn -","- C16 H21 N O3 Sn -","- C256 H336 N16 O48 Sn16 -","16","1","GW2023","Vieira, Flaviana T.; Menezes, Daniele C.; de Lima, Geraldo M.; Ardisson, José D.; Maia, José R. da S.; Speziali, Nivaldo L.","<i>catena</i>-Poly[[trimethyltin(IV)]-μ-2-[(3-oxocyclohex-1-enyl)amino]benzoato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","10","m2587","m2587","10.1107/S1600536807044273","","","0.71073","MoKα","","0.0284","0.0239","","","0.0764","0.0866","","","","","","0.74","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215492","9.478","0.0009","9.2118","0.0008","15.0863","0.0013","90","","94.402","0.004","90","","1313.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-poly[μ~2~-oxalato-κ^4^O,O':O'',O'''-bis(pyridine-κN)zinc(II)]","","- C12 H10 N2 O4 Zn -","- C12 H10 N2 O4 Zn -","- C48 H40 N8 O16 Zn4 -","4","1","GW2024","Hua-Gang Yao; Min Ji; Long-Jiang Zou; Yong-Lin An","<i>catena</i>-Poly[μ~2~-oxalato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''-bis(pyridine-κ<i>N</i>)zinc(II)]","Acta Crystallographica Section E","2007","63","10","m2535","m2535","10.1107/S1600536807044285","","","0.71073","MoKα","","0.0519","0.0296","","","0.0734","0.0805","","","","","","0.824","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215493","20.928","0.003","4.898","0.002","22.869","0.002","90","","90","","90","","2344.2","1","293","","293","","","","","","","","","4","P c a 21","P 2c -2ac","29","Trimethoprim 3,5-dinitrosalicylate","2,4-diamino-5-(3,4,5-trimethoxybenzyl)pyrimidinium 2-hydroxy-3,5-dinitrobenzoate","","- C21 H22 N6 O10 -","- C21 H22 N6 O10 -","- C84 H88 N24 O40 -","4","1","HB2509","Annamalai Subashini; Ebenezer Samuel; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","Trimethoprimium 3,5-dinitrosalicylate","Acta Crystallographica Section E","2007","63","10","o4049","o4049","10.1107/S160053680704189X","","","1.54178","CuKα","","0.1901","0.0635","","","0.1082","0.1518","","","","","","0.923","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215494","11.632","0.004","12.26","0.004","14.748","0.004","90","","91.692","0.009","90","","2102.3","1.1","125","2","125","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Bromo-8-(ethylsulfanyl)naphthalene","","- C12 H11 Br S -","- C12 H11 Br S -","- C96 H88 Br8 S8 -","8","2","HB2511","Fuller, Amy L.; Knight, Fergus R.; Slawin, Alexandra M. Z.; Woollins, J. Derek","1-Bromo-8-(ethylsulfanyl)naphthalene","Acta Crystallographica Section E","2007","63","10","o3957","o3957","10.1107/S1600536807042432","","","0.71073","MoKα","","0.1023","0.0532","","","0.0928","0.1057","","","","","","0.992","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215495","12.0969","0.0006","14.4457","0.0007","10.1629","0.0005","90","","111.045","0.001","90","","1657.49","0.14","292","2","292","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[[[(2,2'-bipyridine)cadmium(II)]-μ~3~-pyridine-2,4-dicarboxylato] monohydrate]","","- C17 H13 Cd N3 O5 -","- C17 H13 Cd N3 O5 -","- C68 H52 Cd4 N12 O20 -","4","1","HB2513","Xiu-Mei Li; Qing-Wei Wang; Bo Liu","Poly[[[(2,2'-bipyridine)cadmium(II)]-μ~3~-pyridine-2,4-dicarboxylato] monohydrate]","Acta Crystallographica Section E","2007","63","10","m2443","m2443","10.1107/S160053680704202X","","","0.71073","MoKα","","0.0275","0.0233","","","0.0587","0.0607","","","","","","1.038","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215496","10.0097","0.0003","10.1372","0.0003","17.7908","0.0007","94.74","0.002","101.12","0.002","113.086","0.002","1604.25","0.1","220","2","220","2","","","","","","","","4","P -1","-P 1","2","","Tetra-μ~3~-tert-butoxo-tetrakis[ethylzinc(II)]","","- C24 H56 O4 Zn4 -","- C24 H56 O4 Zn4 -","- C48 H112 O8 Zn8 -","2","1","HB2516","Moratti, Stephen C.; Simpson, Jim","Tetra-μ~3~-<i>tert</i>-butoxo-tetrakis[ethylzinc(II)]","Acta Crystallographica Section E","2007","63","10","m2444","m2444","10.1107/S1600536807042018","","","0.71073","MoKα","","0.0893","0.0611","","","0.1486","0.1688","","","","","","1.057","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215497","14.2159","0.0016","12.7207","0.0015","9.22","0.0011","90","","101.668","0.002","90","","1632.9","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","7-Methoxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-5-yl acetate","","- C19 H16 O6 -","- C19 H16 O6 -","- C76 H64 O24 -","4","1","HB2519","Li, Huan-Qiu; Shi, Lei; Xiao, Zhu-Ping; Zhu, Hai-Liang","7-Methoxy-3-(4-methoxyphenyl)-4-oxo-4<i>H</i>-chromen-5-yl acetate","Acta Crystallographica Section E","2007","63","10","o3953","o3953","10.1107/S1600536807042353","","","0.71073","MoKα","","0.1088","0.0643","","","0.1609","0.1795","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215498","9.803","0.002","10.653","0.002","12.364","0.003","72.12","0.03","85.82","0.03","63.71","0.03","1098.7","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","1-benzoyl-2-(2-benzyloxyphenyl)-2-pyrrolidinecarbonitrile","<i>cis</i>-1-Benzoyl-2-(2-benzyloxy-5-chlorophenyl)-4- chloropyrrolidine-2-carbonitrile","","- C25 H20 Cl2 N2 O2 -","- C25 H20 Cl2 N2 O2 -","- C50 H40 Cl4 N4 O4 -","2","1","HB2520","Tamazyan, Rafael; Matevosyan, Levon; Martirosyan, Ashot; Gasparyan, Sahak; Raymond Schinazi","<i>cis</i>-1-Benzoyl-2-(2-benzyloxy-5-chlorophenyl)-4-chloropyrrolidine-2-carbonitrile","Acta Crystallographica Section E","2007","63","10","o4069","o4069","10.1107/S1600536807043875","","","0.71073","MoKα","","0.0646","0.046","","","0.1171","0.1307","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215499","8.81","0.0018","31.318","0.006","9.046","0.0018","90","","103.42","0.03","90","","2427.7","0.9","298","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Benzene-1,2,3-triyl tris(benzenesulfonate)","","- C24 H18 O9 S3 -","- C24 H18 O9 S3 -","- C96 H72 O36 S12 -","4","2","HB2522","Xiao, Zhu-Ping; Li, Huan-Qiu; Shi, Lei; Fang, Rui-Qin; Zhu, Hai-Liang","Benzene-1,2,3-triyl tris(benzenesulfonate)","Acta Crystallographica Section E","2007","63","10","o4130","o4130","10.1107/S1600536807043887","","","0.71073","MoKα","","0.0645","0.0442","","","0.101","0.1158","","","","","","1.093","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215500","8.9608","0.0018","8.9816","0.0018","10.804","0.002","75.99","0.03","71.09","0.03","83.3","0.03","797.4","0.3","98","2","98","2","","","","","","","","7","P -1","-P 1","2","","catena-Poly[[silver(I)-μ-1,4-di-4-pyridyl-2,3-diazabuta-1,3-diene] trifluoromethanesulfonate]","","- C13 H10 Ag F3 N4 O3 S -","- C13 H10 Ag F3 N4 O3 S -","- C26 H20 Ag2 F6 N8 O6 S2 -","2","1","HB2524","Broker, Grant A.; Tiekink, Edward R. T.","<i>catena</i>-Poly[[silver(I)-μ-1,4-di-4-pyridyl-2,3-diazabuta-1,3-diene] trifluoromethanesulfonate]","Acta Crystallographica Section E","2007","63","10","m2442","m2442","10.1107/S1600536807041888","","","0.7107","MoKα","","0.026","0.025","","","0.068","0.068","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215501","10.302","0.01","9.089","0.009","20.38","0.02","90","","99.687","0.018","90","","1881","3","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(1H-Benzotriazol-1-yl)-1-(4-fluorobenzoyl)ethyl benzoate","","- C22 H16 F N3 O3 -","- C22 H16 F N3 O3 -","- C88 H64 F4 N12 O12 -","4","1","HB2525","Zeng, Wu-Lan","3-(1<i>H</i>-Benzotriazol-1-yl)-1-(4-fluorobenzoyl)ethyl benzoate","Acta Crystallographica Section E","2007","63","10","o3978","o3978","10.1107/S1600536807041876","","","0.71073","MoKα","","0.1098","0.0472","","","0.1036","0.1295","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215502","7.7818","0.0013","9.6799","0.0016","9.9742","0.0015","106.5","0.01","91.12","0.01","106.5","0.01","686.6","0.2","98","2","98","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[silver(I)-μ-1,4-di-3-pyridyl-2,3-diazabuta-1,3-diene] methanesulfonate]","","- C13 H13 Ag N4 O3 S -","- C13 H13 Ag N4 O3 S -","- C26 H26 Ag2 N8 O6 S2 -","2","1","HB2526","Broker, Grant A.; Tiekink, Edward R. T.","<i>catena</i>-Poly[[silver(I)-μ-1,4-di-3-pyridyl-2,3-diazabuta-1,3-diene] methanesulfonate]","Acta Crystallographica Section E","2007","63","10","m2467","m2467","10.1107/S1600536807042419","","","0.7107","MoKα","","0.046","0.044","","","0.112","0.115","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215503","8.0987","0.0016","20.811","0.004","23.984","0.005","105.36","0.03","96.33","0.03","96.46","0.03","3831.6","1.5","113","2","113","2","","","","","","","","4","P -1","-P 1","2","","N^2^-Benzyl-6-chloro-N^4^-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine- 2,4-diamine","","- C18 H26 Cl N5 -","- C18 H26 Cl N5 -","- C144 H208 Cl8 N40 -","8","4","HB2528","Cui, Jian-Lan; Cai, Jian-Bo; Deng, Yi","<i>N</i>^2^-Benzyl-6-chloro-<i>N</i>^4^-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine","Acta Crystallographica Section E","2007","63","10","o3968","o3968","10.1107/S1600536807042559","","","0.71073","MoKα","","0.0701","0.0562","","","0.125","0.1339","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215504","8.4762","0.0005","7.4377","0.0004","10.3117","0.0006","90","","102.68","0.001","90","","634.23","0.06","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diaquabis(malato-κ^2^O,O')nickel(II)","","- C8 H14 Ni O12 -","- C8 H14 Ni O12 -","- C16 H28 Ni2 O24 -","2","0.5","HB2529","Hui-Qin Liu","Diaquabis(malato-κ^2^<i>O</i>,<i>O</i>')nickel(II)","Acta Crystallographica Section E","2007","63","10","m2470","m2470","10.1107/S1600536807042730","","","0.71073","MoKα","","0.0245","0.0209","","","0.06","0.0613","","","","","","1.017","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215505","7.917","0.003","10.416","0.003","11.357","0.005","75.58","0.05","70.66","0.03","81.11","0.04","853.2","0.6","98","2","98","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[silver(I)-μ-1,4-di-3-pyridyl-2,3-diaza-1,3-butadiene hexafluoridophosphate‒acetonitrile (1/1)]","","- C14 H13 Ag F6 N5 P -","- C14 H13 Ag F6 N5 P -","- C28 H26 Ag2 F12 N10 P2 -","2","1","HB2531","Broker, Grant A.; Tiekink, Edward R. T.","<i>catena</i>-Poly[silver(I)-μ-1,4-di-3-pyridyl-2,3-diaza-1,3-butadiene hexafluoridophosphate‒acetonitrile (1/1)]","Acta Crystallographica Section E","2007","63","10","m2485","","10.1107/S1600536807042912","","","0.7107","MoKα","","0.025","0.024","","","0.061","0.061","","","","","","1.12","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215506","21.746","0.006","12.011","0.003","7.7","0.002","90","","99.472","0.005","90","","1983.8","0.9","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E)-N'-[4-(4-Chlorobenzoyloxy)-3-methoxybenzylidene]isonicotinohydrazide","","- C21 H16 Cl N3 O4 -","- C21 H16 Cl N3 O4 -","- C84 H64 Cl4 N12 O16 -","4","1","HB2532","Han, Jian-Rong; Wang, Hui-Jun; Zhen, Xiao-Li; Tian, Xia","(<i>E</i>)-<i>N</i>'-[4-(4-Chlorobenzoyloxy)-3-methoxybenzylidene]isonicotinohydrazide","Acta Crystallographica Section E","2007","63","10","o4013","o4013","10.1107/S1600536807043395","","","0.71073","MoKα","","0.0886","0.0429","","","0.0898","0.1106","","","","","","1.016","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215507","7.018","0.005","10.364","0.008","20.72","0.02","90","","90","","90","","1507","2","123.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[[(2,2'-bipyridylamine-κ^2^N,N')copper(II)]- μ~2~-L-aspartate-κ^3^O,N:O'] monohydrate]","","- C14 H16 Cu N4 O5 -","- C14 H16 Cu N4 O5 -","- C56 H64 Cu4 N16 O20 -","4","1","HB2533","Okabe, Nobuo; Mototsuji, Mari; Yodoshi, Masahiro","<i>catena</i>-Poly[[[(2,2'-bipyridylamine-κ^2^<i>N</i>,<i>N</i>')copper(II)]-μ~2~-<small>L</small>-aspartate-κ^3^<i>O</i>,<i>N</i>:<i>O</i>'] monohydrate]","Acta Crystallographica Section E","2007","63","10","m2518","m2519","10.1107/S1600536807043905","","","0.7107","MoKα","","","0.04","","","","0.079","","","","","","0.944","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2215508","31.764","0.007","6.7113","0.0016","25.605","0.006","90","","126.165","0.003","90","","4406.7","1.8","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(E)-4-[(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro -1H-pyrazol-4-ylimino)methyl]phenyl 4-chlorobenzoate","","- C25 H20 Cl N3 O3 -","- C25 H20 Cl N3 O3 -","- C200 H160 Cl8 N24 O24 -","8","1","HB2534","Han, Jian-Rong; Zhen, Xiao-Li; Tian, Xia; Li, Fang; Liu, Shou-Xin","(<i>E</i>)-4-[(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-ylimino)methyl]phenyl 4-chlorobenzoate","Acta Crystallographica Section E","2007","63","10","o4035","o4035","10.1107/S1600536807043796","","","0.71073","MoKα","","0.0869","0.0436","","","0.1017","0.1204","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215509","11.996","0.002","12.154","0.003","18.206","0.003","90","","125.43","0.02","90","","2162.9","0.9","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(2-Amino-6-methylpyridinium) aquatetrabromidooxidorhenate(V) bromide","","- C12 H20 Br5 N4 O2 Re -","- C12 H20 Br5 N4 O2 Re -","- C48 H80 Br20 N16 O8 Re4 -","4","1","HB2535","Kochel, Andrzej","Bis(2-Amino-6-methylpyridinium) aquatetrabromidooxidorhenate(V) bromide","Acta Crystallographica Section E","2007","63","10","m2533","m2533","10.1107/S1600536807044133","","","0.71073","MoKα","","0.0995","0.0388","","","0.0565","0.0686","","","","","","0.921","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215510","19.403","0.0015","7.23","0.0005","17.283","0.0013","90","","110.583","0.006","90","","2269.8","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(3-{4-[(2,4-Dinitroanilino)methyl]phenoxy}propyl)piperidinium chloride","","- C21 H27 Cl N4 O5 -","- C21 H27 Cl N4 O5 -","- C84 H108 Cl4 N16 O20 -","4","1","HB2536","Stark, Holger; Amon, Michael; Bolte, Michael","1-(3-{4-[(2,4-Dinitroanilino)methyl]phenoxy}propyl)piperidinium chloride","Acta Crystallographica Section E","2007","63","10","o4074","o4074","10.1107/S1600536807044157","","","0.71073","MoKα","","0.1207","0.0717","","","0.1147","0.1284","","","","","","1.07","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215511","18.57","0.004","7.142","0.0014","12.431","0.003","90","","116.46","0.03","90","","1476","0.7","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","2-tert-Butyl 4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate","","- C14 H21 N O4 -","- C14 H21 N O4 -","- C56 H84 N4 O16 -","4","0.5","HB2539","Kang, Si-Shun; Wang, Hai-Ying; Li, Hai-Lin; Zeng, Hai-Su; Wang, Hai-Bo","2-<i>tert</i>-Butyl 4-ethyl 3,5-dimethyl-1<i>H</i>-pyrrole-2,4-dicarboxylate","Acta Crystallographica Section E","2007","63","10","o4186","o4186","10.1107/S1600536807047186","","","0.71073","MoKα","","0.1225","0.0753","","","0.1574","0.1766","","","","","","1.105","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215512","7.287","0.001","12.228","0.002","13.431","0.002","90","","90","","90","","1196.8","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","8-Hydroxy-3,4,5-trimethyl-6-oxo-2,3,4,6-tetrahydroisoquinoline-7-carboxylic acid","","- C13 H15 N O4 -","- C13 H15 N O4 -","- C52 H60 N4 O16 -","4","1","HB2541","Zhao, Hui; Gong, Hai-Bin","8-Hydroxy-3,4,5-trimethyl-6-oxo-2,3,4,6-tetrahydroisoquinoline-7-carboxylic acid","Acta Crystallographica Section E","2007","63","10","o4097","o4097","10.1107/S1600536807045424","","","0.71073","MoKα","","0.1074","0.0678","","","0.1874","0.2308","","","","","","1.132","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215513","11.283","0.002","8.7613","0.0018","13.151","0.003","90","","97.13","0.03","90","","1290","0.5","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2-Pyridyl)bis(1,3,4-thiadiazol-2-ylamino)methane","","- C10 H9 N7 S2 -","- C10 H9 N7 S2 -","- C40 H36 N28 S8 -","4","1","HB2543","Zhang, Yu-Xia; Liu, Peng","(2-Pyridyl)bis(1,3,4-thiadiazol-2-ylamino)methane","Acta Crystallographica Section E","2007","63","10","o4128","o4128","10.1107/S1600536807045473","","","0.71073","MoKα","","0.0712","0.0374","","","0.0878","0.095","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215514","18.1827","0.0005","6.8537","0.001","25.1485","0.0005","90","","99.398","0.01","90","","3091.9","0.5","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","Tetraaquabis(4,4'-bipyridine)cobalt(II) pyridine-2,6-dicarboxylate tetrahydrate","","- C27 H35 Co N5 O12 -","- C27 H35 Co N5 O12 -","- C108 H140 Co4 N20 O48 -","4","1","HB2544","Guan, Guizhi; Gao, Yuxiang; Wang, Lixia; Wang, Tao","Tetraaquabis(4,4'-bipyridine)cobalt(II) pyridine-2,6-dicarboxylate tetrahydrate","Acta Crystallographica Section E","2007","63","10","m2601","m2601","10.1107/S1600536807046107","","","0.71073","MoKα","","0.0475","0.043","","","0.1226","0.1293","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215515","7.2627","0.0003","10.2917","0.0004","15.6218","0.0006","72.742","0.002","80.847","0.003","82.978","0.003","1097.4","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Bis[<i>O</i>-propyl <i>N</i>'-(2-thienylcarbonyl)thiocarbamato]nickel(II)","","- C18 H20 N2 Ni O4 S4 -","- C18 H20 N2 Ni O4 S4 -","- C36 H40 N4 Ni2 O8 S8 -","2","1","HB2545","Gomes, Ligia R.; Low, John Nicolson; Schröder, Bernd; Brandão, Paula; Luís M. N. B. F. Santos","Bis[<i>O</i>-propyl <i>N</i>'-(2-thienylcarbonyl)thiocarbamato]nickel(II)","Acta Crystallographica Section E","2007","63","10","m2588","m2588","10.1107/S1600536807045850","","","0.71073","MoKα","","0.0618","0.041","","","0.0833","0.0905","","","","","","1.079","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215516","10.322","0.002","10.843","0.002","12.285","0.003","90.93","0.03","108.13","0.03","112.14","0.03","1196.3","0.6","120","2","120","2","","","","","","","","4","P -1","-P 1","2","1,2-bis(diphenylselenophosphinyl)ethane","1,2-bis(Diphenylphosphinoselenoyl)ethane","","- C26 H24 P2 Se2 -","- C26 H24 P2 Se2 -","- C52 H48 P4 Se4 -","2","1","HB2546","Risto, Maarit; Jahr, Esther M.; Oilunkaniemi, Raija; Laitinen, Risto S.","1,2-Bis(Diphenylphosphinoselenoyl)ethane","Acta Crystallographica Section E","2007","63","10","o4169","o4169","10.1107/S1600536807046594","","","0.71073","MoKα","","0.0712","0.0518","","","0.1342","0.1603","","","","","","1.108","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215517","8.904","0.002","7.0683","0.0016","22.331","0.005","90","","90.002","0.003","90","","1405.4","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Aminopyridinium 3,5-dinitrobenzoate monohydrate","","- C12 H12 N4 O7 -","- C12 H12 N4 O7 -","- C48 H48 N16 O28 -","4","1","HB2550","Wei, Lin-Heng","3-Aminopyridinium 3,5-dinitrobenzoate monohydrate","Acta Crystallographica Section E","2007","63","10","o4174","o4174","10.1107/S1600536807046740","","","0.71073","MoKα","","0.0615","0.0453","","","0.1082","0.1158","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215518","14.1959","0.0009","12.7099","0.0007","12.5451","0.0006","90","","90","","90","","2263.5","0.2","113","2","113","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","4-Amino-2,2,6,6-tetramethylpiperidin-1-ium chloride monohydrate","","- C9 H23 Cl N2 O -","- C9 H23 Cl N2 O -","- C72 H184 Cl8 N16 O8 -","8","1","HB2551","Huang, Peng-Mian; Deng, Yi","4-Amino-2,2,6,6-tetramethylpiperidin-1-ium chloride monohydrate","Acta Crystallographica Section E","2007","63","10","o4170","o4170","10.1107/S1600536807046697","","","0.7107","MoKα","","0.0365","0.0359","","","0.085","0.0853","","","","","","1.151","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215519","8.469","0.002","9.362","0.003","11.183","0.003","97.935","0.004","107.783","0.004","108.777","0.004","771.4","0.4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-thioxo- 1,2,3,4-tetrahydropyrimidine-5-carboxylate","","- C15 H18 N2 O4 S -","- C15 H18 N2 O4 S -","- C30 H36 N4 O8 S2 -","2","1","HB2552","Shang, Zhen-Hua; Xiu, Yong; Lin, Yan-Yan","Ethyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","10","o4172","o4172","10.1107/S1600536807046752","","","0.71073","MoKα","","0.0602","0.0395","","","0.0935","0.1067","","","","","","1.024","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215520","8.411","0.006","12.342","0.008","16.291","0.011","91.93","0.01","90.1","0.01","95.77","0.01","1682","2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2-Methylpyridinium benzylate","","- C20 H19 N O3 -","- C20 H19 N O3 -","- C80 H76 N4 O12 -","4","2","HB2553","Li, Jie","2-Methylpyridinium benzylate","Acta Crystallographica Section E","2007","63","10","o4171","o4171","10.1107/S1600536807046867","","","0.71073","MoKα","","0.0931","0.0568","","","0.1411","0.1559","","","","","","0.993","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215521","6.151","0.0008","7.2726","0.0009","27.914","0.004","90","","90","","90","","1248.7","0.3","292","2","292","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","N-(4-Bromobenzylidene)-4-methoxyaniline","","- C14 H12 Br N O -","- C14 H12 Br N O -","- C56 H48 Br4 N4 O4 -","4","1","HB2554","Ma, Rui; Hou, Yubang; Yong, Xuejian; Cen, Yunbin","<i>N</i>-(4-Bromobenzylidene)-4-methoxyaniline","Acta Crystallographica Section E","2007","63","10","o4188","o4188","10.1107/S1600536807046855","","","0.71073","MoKα","","0.1097","0.0635","","","0.1066","0.1213","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215522","11.857","0.003","5.3296","0.0014","20.03","0.005","90","","94.983","0.004","90","","1261","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","catena-Poly[[diaquacadmium(II)]-μ-3,3'-(p-phenylene)diacrylato]","","- C12 H12 Cd O6 -","- C12 H12 Cd O6 -","- C48 H48 Cd4 O24 -","4","0.5","HB2555","Chun-Bo Liu; Lu Lu; Zhan-Lin Xu; Qing-Wei Wang","<i>catena</i>-Poly[[diaquacadmium(II)]-μ-3,3'-(<i>p</i>-phenylene)diacrylato]","Acta Crystallographica Section E","2007","63","10","m2595","m2595","10.1107/S1600536807046909","","","0.71073","MoKα","","0.0206","0.0197","","","0.0456","0.0461","","","","","","1.105","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215523","7.6864","0.0015","10.948","0.002","11.372","0.002","93.14","0.03","92.61","0.03","105.54","0.03","918.8","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[bis(1-ethyl-1H-imidazole-κN^3^)copper(II)]-μ- benzene-1,4-dicarboxylato]","","- C18 H20 Cu N4 O4 -","- C18 H20 Cu N4 O4 -","- C36 H40 Cu2 N8 O8 -","2","1","HB2556","Guang-Bo Che; Yang Liu; Lu Lu; Jun Sun; Jian Wang","<i>catena</i>-Poly[[bis(1-ethyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II)]-μ-benzene-1,4-dicarboxylato]","Acta Crystallographica Section E","2007","63","10","m2612","m2612","10.1107/S1600536807046879","","","0.71073","MoKα","","0.0401","0.0323","","","0.104","0.1108","","","","","","1.148","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215524","4.6684","0.0007","7.0328","0.0011","12.842","0.002","93.802","0.013","97.688","0.013","98.28","0.012","411.9","0.11","173","2","173","2","","","","","","","","5","P 1","P 1","1","","5-Bromo-3-(methylaminocarbonyl)pyridinium picrate","","- C13 H10 Br N5 O8 -","- C13 H10 Br N5 O8 -","- C13 H10 Br N5 O8 -","1","1","HB2557","Sarojini, B. K.; Narayana, B.; Swamy, M. T.; Yathirajan, H. S.; Bolte, Michael","5-Bromo-3-(methylaminocarbonyl)pyridinium picrate","Acta Crystallographica Section E","2007","63","10","o4181","o4181","10.1107/S1600536807046934","","","0.71073","MoKα","","0.1043","0.1031","","","0.2604","0.2629","","","","","","1.153","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215525","20.304","0.004","8.609","0.0017","17.364","0.004","90","","119.65","0.03","90","","2637.8","1.2","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","Chloridotetrakis(1-ethyl-1H-imidazole-κN^3^)copper(II) chloride monohydrate","","- C20 H34 Cl2 Cu N8 O -","- C20 H34 Cl2 Cu N8 O -","- C80 H136 Cl8 Cu4 N32 O4 -","4","1","HG2282","Fa-Qian Liu; Wen-Li Liu; Wei Li; Rong-Xun Li; Guang-Ye Liu","Chloridotetrakis(1-ethyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II) chloride monohydrate","Acta Crystallographica Section E","2007","63","10","m2454","m2454","10.1107/S1600536807041864","","","0.71073","MoKα","","0.0812","0.0563","","","0.1251","0.1403","","","","","","0.947","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215526","31.3716","0.0002","11.3509","0.0002","22.703","0.0003","90","","131.147","0.001","90","","6087.78","0.17","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","8-chloro-11-[4-(8-chloro-5H-dibenzo[<i>b,e</i>][1,4] diazepin-11-yl)piperazin-1-yl]-5H-dibenzo[<i>b,e</i>][1,4]diazepine‒ acetone‒pentane (2/1/1)","","- C68 H66 Cl4 N12 O -","- C68 H66 Cl4 N12 O -","- C272 H264 Cl16 N48 O4 -","4","0.5","HG2283","Capuano, Ben; Crosby, Ian T.; Fallon, Gary D.; Forsyth, Craig M.; Lloyd, Edward J.; Podloucka, Anna; Yuriev, Elizabeth","Geometric forms of 8-chloro-11-[4-(8-chloro-5<i>H</i>-dibenzo[<i>b</i>,<i>e</i>][1,4]diazepin-11-yl)piperazin-1-yl]-5<i>H</i>-dibenzo[<i>b</i>,<i>e</i>][1,4]diazepine‒acetone‒pentane (2/1/1)","Acta Crystallographica Section E","2007","63","10","o4034","o4034","10.1107/S1600536807042973","","","0.71073","MoKα","","0.1026","0.0645","","","0.1447","0.1584","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215527","8.9833","0.0018","9.4191","0.0019","11.361","0.002","66.61","0.03","72.87","0.03","72.38","0.03","824","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-[(2-Aminophenylimino)(phenyl)methyl]-4,6-dichlorophenol","","- C19 H14 Cl2 N2 O -","- C19 H14 Cl2 N2 O -","- C38 H28 Cl4 N4 O2 -","2","1","HG2286","Wei-Hua Li; Fa-Qian Liu; Xiao-Dong Zhao; Jun-Ying Deng; Bao-Rong Hou","2-[(2-Aminophenylimino)(phenyl)methyl]-4,6-dichlorophenol","Acta Crystallographica Section E","2007","63","10","o3944","o3944","10.1107/S160053680704233X","","","0.71073","MoKα","","0.0643","0.054","","","0.1472","0.1714","","","","","","1.13","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215528","10.696","0.002","12.83","0.003","9.482","0.0019","90","","105.65","0.03","90","","1253","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetra-μ-acetato-κ^8^O:O'-bis[(4-vinylpyridine-κN)copper(II)](Cu—Cu)","","- C22 H26 Cu2 N2 O8 -","- C22 H26 Cu2 N2 O8 -","- C44 H52 Cu4 N4 O16 -","2","0.5","HG2288","Fa-Qian Liu; Rong-Xun Li; Shao-Xiang Li; Li-Shui Sun; Guang-Ye Liu","Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis[(4-vinylpyridine-κ<i>N</i>)copper(II)](<i>Cu</i>—<i>Cu</i>)","Acta Crystallographica Section E","2007","63","10","m2455","m2455","10.1107/S1600536807042328","","","0.71073","MoKα","","0.0811","0.0613","","","0.1641","0.1824","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215529","12.488","0.003","20.633","0.004","16.152","0.003","90","","105.51","0.03","90","","4010.2","1.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(1,10-phenanthroline-<i>κ</i>^2^<i>N</i>,<i>N'</i>)- bis(cyanido-<i>κ</i><i>C</i>)cobalt(III) bis(azido-<i>κ</i>^1^<i>N</i>)[1,2-bis(pyridine-2-carboxamido)benzene- <i>κ</i>^4^<i>N</i>]chromate(III) monohydrate","","- C44 H30 Co Cr N16 O3 -","- C44 H30 Co Cr N16 O3 -","- C176 H120 Co4 Cr4 N64 O12 -","4","1","HG2289","Ni, Zhong-Hai","Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')-bis(cyanido-κ<i>C</i>)cobalt(III) bis(azido-κ^1^<i>N</i>)[1,2-bis(pyridine-2-carboxamido)benzene-κ^4^<i>N</i>]chromate(III) monohydrate","Acta Crystallographica Section E","2007","63","10","m2531","m2532","10.1107/S1600536807043693","","","0.71073","MoKα","","0.0665","0.0548","","","0.1548","0.1621","","","","","","1.082","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215530","22.55","0.0007","5.629","0.0001","17.9416","0.0006","90","","91.255","0.002","90","","2276.85","0.11","200","2","200","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","1,2-Dicyclopentylethane-1,2-diol","1,2-Dicyclopentylethane-1,2-diol","","- C12 H22 O2 -","- C12 H22 O2 -","- C96 H176 O16 -","8","1","HG2290","Betz, Richard; Herdlicka, Sonja; Klüfers, Peter","1,2-Dicyclopentylethane-1,2-diol","Acta Crystallographica Section E","2007","63","10","o3986","o3986","10.1107/S1600536807042961","","","0.71073","MoKα","","0.0814","0.0595","","","0.1663","0.1849","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215531","6.7644","0.0017","9.386","0.002","9.855","0.003","95.51","0.004","101.915","0.004","104.563","0.004","585.3","0.3","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","3,3'-(2-Oxocyclopentane-1,3-diyl)dipropanoic acid","","- C11 H16 O5 -","- C11 H16 O5 -","- C22 H32 O10 -","2","1","HG2292","Yan-xue Chen; Jin-hui Yang; Yi Deng; Guang-bin Li; Wei Wang","3,3'-(2-Oxocyclopentane-1,3-diyl)dipropanoic acid","Acta Crystallographica Section E","2007","63","10","o4054","o4054","10.1107/S1600536807043838","","","0.71073","MoKα","","0.0692","0.0452","","","0.109","0.1264","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215532","10.609","0.003","13.588","0.003","8.1997","0.0018","90","","103.841","0.004","90","","1147.7","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","8-Chloro-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine","","- C14 H12 Cl N -","- C14 H12 Cl N -","- C56 H48 Cl4 N4 -","4","1","HG2293","Juan Wang; Ling Qin; Yue Wang; Guang-Bin Li; Yi Deng","8-Chloro-6,11-dihydro-5<i>H</i>-benzo[5,6]cyclohepta[1,2-<i>b</i>]pyridine","Acta Crystallographica Section E","2007","63","10","o4131","o4131","10.1107/S1600536807045813","","","0.71073","MoKα","","0.0548","0.0425","","","0.1034","0.1151","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215533","7.2245","0.0004","9.7093","0.0005","9.9373","0.0005","90","","95.689","0.003","90","","693.62","0.06","200","","200","","","","","","","","","4","P 1 21 1","P 2yb","4","","Cocrystal of (2<i>S</i>,3a<i>S</i>,4<i>R</i>,5<i>R</i>,7a<i>S</i>)- and (2<i>R</i>,3a<i>S</i>,4<i>R</i>,5<i>R</i>,7a<i>S</i>)-7-bromo- 2-(4-methoxyphenyl)-3a,4,5,7a-tetrahydro-1,3-benzodioxole-4,5-diol (17:3)","","- C14 H15 Br O5 -","- C14 H15 Br O5 -","- C28 H30 Br2 O10 -","2","1","HG2294","Banwell, Martin G.; Kokas, Okanya J.; Willis, Anthony C.","A cocrystal of (2<i>S</i>,3a<i>S</i>,4<i>R</i>,5<i>R</i>,7a<i>S</i>)- and (2<i>R</i>,3a<i>S</i>,4<i>R</i>,5<i>R</i>,7a<i>S</i>)-7-bromo-2-(4-methoxyphenyl)-3a,4,5,7a-tetrahydro-1,3-benzodioxole-4,5-diol (17:3)","Acta Crystallographica Section E","2007","63","10","o4187","o4187","10.1107/S1600536807046995","","","0.71073","MoKα","","0.0349","0.0302","","0.0764","0.074","0.0764","","","","","","0.9847","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215534","13.204","0.003","10.131","0.002","20.795","0.005","90","","99.973","0.003","90","","2739.7","1.1","298","2","298","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ-Oxo-bis[dichlorido(diethylamido-κN)(diethylamine-κN)titanium(IV)]","","- C16 H42 Cl4 N4 O Ti2 -","- C16 H42 Cl4 N4 O Ti2 -","- C64 H168 Cl16 N16 O4 Ti8 -","4","0.5","HG2295","Straessler, Nicholas A.; Caudle, M. Tyler; Groy, Thomas L.","μ-Oxido-bis[dichlorido(diethylamido-κ<i>N</i>)(diethylamine-κ<i>N</i>)titanium(IV)]","Acta Crystallographica Section E","2007","63","10","m2563","m2563","10.1107/S1600536807044832","","","0.71073","MoKα","","0.0932","0.0578","","","0.1411","0.1532","","","","","","0.931","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215535","7.267","0.003","8.863","0.003","12.002","0.005","103.234","0.007","90.318","0.007","106.71","0.006","718.6","0.5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Methyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-thioxo- 1,2,3,4-tetrahydropyrimidine-5-carboxylate","","- C14 H16 N2 O4 S -","- C14 H16 N2 O4 S -","- C28 H32 N4 O8 S2 -","2","1","HG2303","Shang, Zhen-Hua; Ha, Jing","Methyl 4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","10","o4173","o4173","10.1107/S1600536807046788","","","0.71073","MoKα","","0.0743","0.0434","","","0.1","0.1147","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215536","10.7519","0.0011","10.0159","0.001","11.8287","0.0012","90","","98.426","0.002","90","","1260.1","0.2","298","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>Z</i>)-α-5-Bromo-<i>N</i>-<i>tert</i>-butyl-2-methoxyphenylnitrone","","- C12 H16 Br N O2 -","- C12 H16 Br N O2 -","- C48 H64 Br4 N4 O8 -","4","1","HK2299","Guo, Hao; Zabawa, Mark; Woo, Joyce; Zheng, Chong; Yao, Qingwei","(<i>Z</i>)-α-5-Bromo-<i>N</i>-<i>tert</i>-butyl-2-methoxyphenylnitrone","Acta Crystallographica Section E","2007","63","10","o3943","o3943","10.1107/S1600536807035568","","","0.71073","MoKα","","0.0326","0.0277","","","0.0773","0.0808","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215537","10.197","0.002","7.537","0.0015","27.143","0.005","90","","99.04","0.03","90","","2060.2","0.7","298","2","298","2","","","","","","","","3","C 1 2 1","C 2y","5","","3β-Acetoxy-17-ethylenedioxyandrost-5-ene","","- C23 H34 O4 -","- C23 H34 O4 -","- C92 H136 O16 -","4","1","HK2310","Ye-Ming Xu; Shi-Gui Tang; Yi-Xin Zhou; Shan Liu; Cheng Guo","3β-Acetoxy-17-ethylenedioxyandrost-5-ene","Acta Crystallographica Section E","2007","63","10","o3980","o3980","10.1107/S160053680703944X","","","0.71073","MoKα","","0.1108","0.0783","","","0.1779","0.1985","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215538","6.7574","0.0012","7.8615","0.0014","14.371","0.003","90","","90","","90","","763.4","0.2","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Perhydrophthalimide","","- C8 H11 N O2 -","- C8 H11 N O2 -","- C32 H44 N4 O8 -","4","1","HK2317","Wang, De-Cai; Jiang, Liang; Lin, Wei; Pan, Yong; Sun, Ning-Ning","Perhydrophthalimide","Acta Crystallographica Section E","2007","63","10","o3990","o3990","10.1107/S1600536807042742","","","0.71073","MoKα","","0.0356","0.033","","","0.0874","0.0896","","","","","","1.065","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215539","9.936","0.005","10.819","0.004","19.038","0.011","90","","93.49","0.02","90","","2042.7","1.7","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-[2-(Diphenylphosphino)phenyl]benzamide","","- C25 H20 N O P -","- C25 H20 N O P -","- C100 H80 N4 O4 P4 -","4","1","HK2318","Zhang, Wen-Jie; Chen, Jian-Xin; Li, Zhong-Shui; Li, Ai-Ke; Lin, Xin-Rong","<i>N</i>-[2-(Diphenylphosphino)phenyl]benzamide","Acta Crystallographica Section E","2007","63","10","o4016","o4016","10.1107/S1600536807042092","","","0.71073","MoKα","","0.1082","0.054","","","0.1275","0.152","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215540","9.8423","0.0009","9.9736","0.001","11.4","0.0011","64.459","0.001","67.157","0.001","76.313","0.001","927.28","0.15","298","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-(1H-Benzotriazol-1-yl)-1-(2-fluorobenzoyl)ethyl nicotinate","","- C21 H15 F N4 O3 -","- C21 H15 F N4 O3 -","- C42 H30 F2 N8 O6 -","2","1","HK2319","Jun Wan; Wu-Lan Zeng; Jing Li; Sai Bi","3-(1<i>H</i>-Benzotriazol-1-yl)-1-(2-fluorobenzoyl)ethyl nicotinate","Acta Crystallographica Section E","2007","63","10","o3949","o3949","10.1107/S1600536807041967","","","0.71073","MoKα","","0.0519","0.0417","","","0.106","0.114","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215541","10.781","0.003","14.937","0.004","9.839","0.003","90","","106.27","0.005","90","","1521","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(4-Fluorophenyl)-2,6-dioxo-2,3,6,7,8,9-hexahydro-1H,5H- imidazo[1,2-a]quinoline-4-carbonitrile","","- C18 H14 F N3 O2 -","- C18 H14 F N3 O2 -","- C72 H56 F4 N12 O8 -","4","1","HK2320","Qiya Zhuang; Chunmei Li; Qingqing Shao; Bo Jiang","5-(4-Fluorophenyl)-2,6-dioxo-2,3,6,7,8,9-hexahydro-1<i>H</i>,5<i>H</i>-imidazo[1,2-<i>a</i>]quinoline-4-carbonitrile","Acta Crystallographica Section E","2007","63","10","o3935","o3935","10.1107/S1600536807042110","","","0.71073","MoKα","","0.1168","0.0465","","","0.0845","0.1118","","","","","","1.005","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215542","9.414","0.0019","10.227","0.002","12.923","0.003","110.44","0.03","98.8","0.03","100.58","0.03","1113.7","0.5","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","(S)-Diethyl {(4-fluorophenyl)[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2- ylamino]methyl}phosphonate","","- C20 H23 F N3 O4 P S -","- C20 H23 F N3 O4 P S -","- C40 H46 F2 N6 O8 P2 S2 -","2","1","HK2321","Wan, Rong; Han, Feng; Zhang, Jin-jun; Yin, Li-he; Wang, Jin-tang","(<i>S</i>)-Diethyl {(4-fluorophenyl)[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-ylamino]methyl}phosphonate","Acta Crystallographica Section E","2007","63","10","o4158","o4158","10.1107/S1600536807046521","","","0.71073","MoKα","","0.0701","0.0497","","","0.1257","0.1568","","","","","","0.823","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215543","9.3668","0.0012","12.5688","0.0011","10.9546","0.0015","90","","112.384","0.009","90","","1192.5","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,10-Diazonia-18-crown-6 hexachloridoplatinate(IV) dihydrate","","- C12 H32 Cl6 N2 O6 Pt -","- C12 H32 Cl6 N2 O6 Pt -","- C24 H64 Cl12 N4 O12 Pt2 -","2","0.5","HK2322","Mohammad Yousefi; Teimouri, Shabahang; Amani, Vahid; Khavasi, Hamid Reza","1,10-Diazonia-18-crown-6 hexachloridoplatinate(IV) dihydrate","Acta Crystallographica Section E","2007","63","10","m2460","m2461","10.1107/S1600536807042341","","","0.71073","MoKα","","0.0436","0.0304","","","0.0784","0.0846","","","","","","1.217","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215547","36.14","0.015","11.701","0.005","11.78","0.005","90","","103.122","0.006","90","","4851","4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","8-(4-fluorophenyl)-11,11-dimethyl-5,9-dioxo-6,8,9,10,11,12-hexahydro-5H- quinolino[1,2-a]quinazoline-7-carbonitrile dimethylformamide solvate","","- C28 H27 F N4 O3 -","- C28 H27 F N4 O3 -","- C224 H216 F8 N32 O24 -","8","1","HK2326","Hong Jiang; Chunmei Li; Longji Cao; Dianxiang Zhou","8-(4-Fluorophenyl)-11,11-dimethyl-5,9-dioxo-6,8,9,10,11,12-hexahydro-5<i>H</i>-quinolino[1,2-<i>a</i>]quinazoline-7-carbonitrile dimethylformamide solvate","Acta Crystallographica Section E","2007","63","10","o4133","o4133","10.1107/S1600536807045643","","","0.71073","MoKα","","0.194","0.0638","","","0.1374","0.1905","","","","","","0.999","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215548","12.9","0.003","8.675","0.0017","14.775","0.003","90","","102.51","0.03","90","","1614.2","0.6","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 4-(4-fluorophenyl)-6-isopropyl-2-(methylamino)pyrimidine-5-carboxylate","","- C16 H18 F N3 O2 -","- C16 H18 F N3 O2 -","- C64 H72 F4 N12 O8 -","4","1","HK2328","He, Wei; Sun, Hong-Shun; Xu, Ye-ming; Tang, Shi-gui; Guo, Cheng","Methyl 4-(4-fluorophenyl)-6-isopropyl-2-(methylamino)pyrimidine-5-carboxylate","Acta Crystallographica Section E","2007","63","10","o4157","o4157","10.1107/S1600536807046181","","","0.71073","MoKα","","0.166","0.089","","","0.1696","0.2008","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215549","9.3787","0.0012","10.7935","0.0014","11.8795","0.0015","86.447","0.002","81.805","0.002","79.847","0.002","1170.8","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis{(E)-2-[2-(2-hydroxybenzoyl)hydrazono]propanoato-κ^3^O,N,O'}copper(II) trihydrate","","- C20 H24 Cu N4 O11 -","- C20 H24 Cu N4 O11 -","- C40 H48 Cu2 N8 O22 -","2","1","HY2076","Liu, Feng; Wu, Wang-Ting; Zhang, Wei-Ping; Chen, Feng-Ying; He, Shui-Yang","Bis{(<i>E</i>)-2-[2-(2-hydroxybenzoyl)hydrazono]propanoato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}copper(II) trihydrate","Acta Crystallographica Section E","2007","63","10","m2450","m2451","10.1107/S160053680704072X","","","0.71073","MoKα","","0.0622","0.0453","","","0.0807","0.0911","","","","","","0.868","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215550","16.54","0.004","16.54","0.004","5.9554","0.0012","90","","90","","120","","1411","0.6","298","2","298","2","","","","","","","","5","R 3 :H","R 3","146","Terbium N-acetylglycinate","Tris(N-acetylglycinato-κ^2^O,O')triaquaterbium(III)","","- C12 H24 N3 O12 Tb -","- C12 H24 N3 O12 Tb -","- C36 H72 N9 O36 Tb3 -","3","0.333333","HY2077","Kameshwar, Prashant M.; Wadawale, Amey; Ajgaonkar, Vishnu R.","Tris(<i>N</i>-acetylglycinato-κ^2^<i>O</i>,<i>O</i>')triaquaterbium(III)","Acta Crystallographica Section E","2007","63","10","m2584","m2584","10.1107/S1600536807045618","","","0.71073","MoKα","","0.015","0.015","","","0.0366","0.0366","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215551","16.58","0.004","16.58","0.004","5.978","0.001","90","","90","","120","","1423.2","0.5","298","2","298","2","","","","","","","","5","R 3 :H","R 3","146","Samarium N-acetylglycinate","Tris(N-acetylglycinato-κ^2^O,O')triaquasamarium(III)","","- C12 H24 N3 O12 Sm -","- C12 H24 N3 O12 Sm -","- C36 H72 N9 O36 Sm3 -","3","0.333333","HY2078","Kameshwar, Prashant M.; Wadawale, Amey; Ajgaonkar, Vishnu R.","Tris(<i>N</i>-acetylglycinato-κ^2^<i>O</i>,<i>O</i>')triaquasamarium(III)","Acta Crystallographica Section E","2007","63","10","m2598","m2598","10.1107/S1600536807046429","","","0.71069","MoKα","","0.0203","0.0203","","","0.0514","0.0514","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215552","10.114","0.005","11.141","0.006","11.553","0.006","112.72","0.02","93.208","0.019","97.93","0.02","1180.8","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Aquabis(5-chlorosalicylato-κO)(2,2'-bipyridine-κ^2^N,N')zinc(II)","","- C24 H18 Cl2 N2 O7 Zn -","- C24 H18 Cl2 N2 O7 Zn -","- C48 H36 Cl4 N4 O14 Zn2 -","2","1","HY2079","Wen, Decai; Ta, Honggui; Zhong, Chunlong; Xie, Tianyang; Wu, Linhua","Aqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(5-chlorosalicylato-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2007","63","10","m2446","m2447","10.1107/S1600536807042316","","","0.71073","MoKα","","0.0356","0.0309","","","0.0922","0.094","","","","","","1.109","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215553","9.456","0.001","14.966","0.003","18.166","0.004","90","","93.74","0.01","90","","2565.3","0.8","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Poly[bis[diaqua(isonicotinato-κ2O,O')dysprosium(III)] [bis(isonicotinato-κO)copper(II)]tetra(μ3-isonicotinato-κ3O:O':N)]","","- C48 H40 Cu Dy2 N8 O20 -","- C48 H40 Cu Dy2 N8 O20 -","- C96 H80 Cu2 Dy4 N16 O40 -","2","0.5","HY2080","Dai-Zhi Kuang; Yong-Lan Feng; Yun-Lin Peng; Yi-Fang Deng","Poly[bis[diaqua(isonicotinato-κ^2^<i>O</i>,<i>O</i>')dysprosium(III)][bis(isonicotinato-κ<i>O</i>)copper(II)]tetra(μ~3~-isonicotinato-κ^3^<i>O</i>:<i>O</i>':<i>N</i>)]","Acta Crystallographica Section E","2007","63","10","m2526","m2527","10.1107/S1600536807043899","","","0.71073","MoKα","","0.0334","0.0255","","","0.0562","0.0577","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215554","14.545","0.003","15.074","0.003","14.758","0.003","90","","111.516","0.002","90","","3010.2","1.1","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dichlorido{2,6-bis[1-(2,4,6-trimethylphenylimino)ethyl] pyridine-κ3N,N',N''}cadmium(II) acetonitrile solvate","","- C29 H34 Cd Cl2 N4 -","- C29 H34 Cd Cl2 N4 -","- C116 H136 Cd4 Cl8 N16 -","4","1","HY2081","Fan, Rui-Qing; Wang, Ping; Yang, Yu-Lin; Lv, Zhi-Wei","Dichlorido{2,6-bis[1-(2,4,6-trimethylphenylimino)ethyl]pyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>''}cadmium(II) acetonitrile solvate","Acta Crystallographica Section E","2007","63","10","m2501","m2502","10.1107/S1600536807043255","","","0.71073","MoKα","","0.0665","0.0421","","","0.0827","0.0909","","","","","","0.877","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215555","7.1289","0.0002","31.6743","0.0009","13.0217","0.0004","90","","98.286","0.001","90","","2909.64","0.15","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3-Nitro-4-hydroxyphenylarsenic(III) oxide cyclic tetramer","cyclo-Tetra-μ-oxido-tetra[3-nitro-4-hydroxyphenylarsenic(III)]","","- C24 H16 As4 N4 O16 -","- C24 H16 As4 N4 O16 -","- C96 H64 As16 N16 O64 -","4","1","HY2082","Lloyd, Nicholas C.; Nicholson, Brian K.","<i>cyclo</i>-Tetra-μ-oxido-tetrakis[3-nitro-4-hydroxyphenylarsenic(III)]","Acta Crystallographica Section E","2007","63","10","m2573","m2573","10.1107/S1600536807044728","","","0.71073","MoKα","","0.1385","0.0683","","","0.1087","0.1313","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215556","9.5","0.005","9.523","0.005","13.669","0.007","97.527","0.003","98.781","0.006","101.555","0.006","1180.6","1.1","293","2","130.15","","","","","","","","","4","P -1","-P 1","2","","4-{[6-(4,4'-Bipyridin-1-ium-1-yl)-2-(4-carboxyanilino)-1,3,5-triazin- 2-yl]amino}benzoate monohydrate","","- C27 H21 N7 O5 -","- C27 H21 N7 O5 -","- C54 H42 N14 O10 -","2","1","IM2030","Jie Chen; Yuzhong Ruan","4-{[6-(4,4'-Bipyridin-1-ium-1-yl)-2-(4-carboxyanilino)-1,3,5-triazin-2-yl]amino}benzoate monohydrate","Acta Crystallographica Section E","2007","63","10","o3937","o3937","10.1107/S1600536807041943","","","0.71073","MoKα","","0.0761","0.052","","","0.1398","0.1605","","","","","","1.004","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215557","6.2149","0.0005","14.138","0.001","19.05","0.001","90","","90","","90","","1673.9","0.2","292","2","292","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(Z)-ethyl 3-(benzamido)-2-cyano-3-(4-fluorophenyl)acrylate","","- C19 H15 F N2 O3 -","- C19 H15 F N2 O3 -","- C76 H60 F4 N8 O12 -","4","1","IM2031","Dehua Zhang; Jianquan Lu; Xiaoyan Zhang","(<i>Z</i>)-Ethyl 3-benzamido-2-cyano-3-(4-fluorophenyl)acrylate","Acta Crystallographica Section E","2007","63","10","o4053","o4053","10.1107/S1600536807044145","","","0.71073","MoKα","","0.078","0.0572","","","0.1138","0.124","","","","","","1.109","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2215558","4.515","0.003","10.325","0.006","19.28","0.01","90","","95.127","0.007","90","","895.2","0.9","223","","223","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","anthrazine","Dinaphtho[2,3-<i>a</i>,2',3'-<i>h</i>]phenazine","","- C28 H16 N2 -","- C28 H16 N2 -","- C56 H32 N4 -","2","0.5","IM2032","Kitamura, Chitoshi; Sakamoto, Chika; Kawatsuki, Nobuhiro; Yoneda, Akio","Dinaphtho[2,3-<i>a</i>,2',3'-<i>h</i>]phenazine","Acta Crystallographica Section E","2007","63","10","o3952","o3952","10.1107/S1600536807041992","","","0.71073","MoKα","","","0.0718","","","","0.1615","","","","","","1.226","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215559","8.0216","0.0004","8.9771","0.0003","9.4799","0.0005","91.251","0.003","112.426","0.002","92.418","0.002","629.93","0.05","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","4,5-Bis(2-cyanoethylsulfanyl)-1,2-dithiole-3-thione","","- C9 H8 N2 S5 -","- C9 H8 N2 S5 -","- C18 H16 N4 S10 -","2","1","IM2033","Fang, Qi; Batsanov, Andrei S.; Howard, Judith A. K.","4,5-Bis(2-cyanoethylsulfanyl)-1,2-dithiole-3-thione","Acta Crystallographica Section E","2007","63","10","o4056","o4056","10.1107/S1600536807044078","","","0.71073","MoKα","","0.0339","0.0331","","","0.0852","0.086","","","","","","1.101","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215560","13.121","0.005","13.739","0.005","14.051","0.005","83.625","0.005","86.621","0.005","79.662","0.005","2474.5","1.6","101","2","101","2","","","","","","","","6","P -1","-P 1","2","","Acetatotris(triphenylarsine)silver(I) acetonitrile solvate monohydrate","","- C58 H53 Ag As3 N O3 -","- C58 H53 Ag As3 N O3 -","- C116 H106 Ag2 As6 N2 O6 -","2","1","IM2035","Meijboom, Reinout; Muller, Alfred","Acetatotris(triphenylarsine)silver(I) acetonitrile solvate monohydrate","Acta Crystallographica Section E","2007","63","10","m2572","m2572","10.1107/S1600536807044595","","","0.71069","MoKα","","","0.022","","","","0.0752","","","","","","1.201","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215561","12.7031","0.001","24.477","0.003","13.6165","0.0011","90","","103.357","0.005","90","","4119.3","0.7","90","","90","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","μ-Sulfato-1κ<i>O</i>:2κ<i>O</i>-μ-oxo-bis[tris(2-pyridylmethyl)amine-κ^4^ <i>N</i>,<i>N</i>',<i>N</i>"",<i>N</i>'""]diiron(III) diperchlorate acetonitrile/water (0.75/0.25) solvate","","- C150 H155 Cl8 Fe8 N35 O53 S4 -","- C150 H155 Cl8 Fe8 N35 O53 S4 -","- C150 H155 Cl8 Fe8 N35 O53 S4 -","1","0.25","IS2197","Smith, Christine M.; Norman, Richard E.","μ-Sulfato-1κ<i>O</i>:2κ<i>O</i>-μ-oxo-bis[tris(2-pyridylmethyl)amine-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']diiron(III) diperchlorate acetonitrile/water (0.75/0.25) solvate","Acta Crystallographica Section E","2007","63","10","m2480","m2481","10.1107/S1600536807042857","","","0.7107","MoKα","","0.0695","0.0538","","0.1103","","0.0933","","","0.9022","","","1.0195","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215562","6.6413","0.0002","7.2833","0.0003","12.4387","0.0004","84.02","0.001","87.447","0.002","65.866","0.001","546.09","0.03","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","2-Hydroxy-4-(methacryloyloxy)acetophenone","","- C12 H12 O4 -","- C12 H12 O4 -","- C24 H24 O8 -","2","1","IS2203","G. Chakkaravarthi; A. Anthonysamy; S. Balasubramanian; V. Manivannan","2-Hydroxy-4-(methacryloyloxy)acetophenone","Acta Crystallographica Section E","2007","63","10","o4163","o4163","10.1107/S1600536807046478","","","0.71073","MoKα","","0.0723","0.0474","","","0.1453","0.1663","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215563","14.598","0.009","8.627","0.005","30.508","0.019","90","","90.322","0.003","90","","3842","4","291","2","291","2","","","","","","","","5","C 1 2 1","C 2y","5","","Diaquabis[μ2-3-(1H-imidazol-5-yl)-2-(3-iminopropionamido)propionato- κ4N:N',N'',O]dicopper(II) dihydrate","","- C18 H28 Cu2 N8 O10 -","- C18 H28 Cu2 N8 O10 -","- C108 H168 Cu12 N48 O60 -","6","1.5","IS2204","Shen, Jie; Li, Yi-Zhi; Zhang, Dong-Mei; Chen, Jun-Hui","Diaquabis[μ~2~-3-(1<i>H</i>-imidazol-5-yl)-2-(3-iminopropionamido)propionato-κ^4^<i>N</i>:<i>N</i>',<i>N</i>'',<i>O</i>]dicopper(II) dihydrate","Acta Crystallographica Section E","2007","63","10","m2569","m2570","10.1107/S160053680704473X","","","0.71073","MoKα","","0.0708","0.0548","","","0.1058","0.1088","","","","","","1.072","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215564","17.223","0.004","7.9231","0.0018","19.236","0.004","90","","107.618","0.003","90","","2501.8","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bromido(3,5-dimethylpyrazole-κN)[hydrotris(3,5-dimethylpyrazolyl)\ borato-κ^3^N,N',N'']copper(II)","","- C20 H30 B Br Cu N8 -","- C20 H30 B Br Cu N8 -","- C80 H120 B4 Br4 Cu4 N32 -","4","1","IS2205","Zhang, Xing-Jing; Han, Jing; Wang, Chun-Guang; Xing, Yong-Heng","Bromido(3,5-dimethylpyrazole-κ<i>N</i>)[hydrotris(3,5-dimethylpyrazolyl)borato-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']copper(II)","Acta Crystallographica Section E","2007","63","10","m2620","m2621","10.1107/S1600536807046491","","","0.71073","MoKα","","0.0829","0.0502","","","0.1198","0.1356","","","","","","1.034","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215565","20.375","0.0012","13.3513","0.0008","7.7876","0.0005","90","","90","","90","","2118.5","0.2","223","","223","","","","","","","","","4","P n a 21","P 2c -2n","33","","1,8-Bis(4-chlorobenzoyl)-2,7-dimethoxynaphthalene","","- C26 H18 Cl2 O4 -","- C26 H18 Cl2 O4 -","- C104 H72 Cl8 O16 -","4","1","IS2207","Nakaema, Kosuke; Okamoto, Akiko; Noguchi, Keiichi; Yonezawa, Noriyuki","1,8-Bis(4-chlorobenzoyl)-2,7-dimethoxynaphthalene","Acta Crystallographica Section E","2007","63","10","o4120","o4120","10.1107/S1600536807045114","","","1.54187","CuKα","","0.0298","0.0278","","","0.0728","0.0749","","","","","","1.078","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215566","8.2518","0.0003","10.0817","0.0004","12.8169","0.0005","97.244","0.002","97.876","0.002","105.709","0.002","1001.76","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(4-Methoxybenzyl)-3-methyl-1-phenylsulfonyl-1H-indole","","- C23 H21 N O3 S -","- C23 H21 N O3 S -","- C46 H42 N2 O6 S2 -","2","1","IS2208","M. Balasubramanian; Pon. Sathya Moorthy; V. Dhayalan; A. K. Mohanakrishnan; M. N. Ponnuswamy","2-(4-Methoxybenzyl)-3-methyl-1-phenylsulfonyl-1<i>H</i>-indole","Acta Crystallographica Section E","2007","63","10","o4134","o4134","10.1107/S1600536807045369","","","0.71073","MoKα","","0.0549","0.0411","","","0.115","0.1256","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215567","6.525","0.004","15.885","0.01","14.401","0.009","90","","100.475","0.01","90","","1467.8","1.6","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(24<i>R</i>)-24-acetoxy-11<i>β</i>, 25-dihydroxy-16<i>β</i>,23<i>β</i>-epoxyprotost-13(17)-en-3-one","","- C32 H50 O6 -","- C32 H50 O6 -","- C64 H100 O12 -","2","1","IS2209","Wang, Xiao-Bing; Kong, Ling-Yi","Alisol F 24-acetate: (24<i>R</i>)-24-acetoxy-11<i>{β</i>},25-dihydroxy-16<i>{β</i>},23<i>{β</i>}-epoxyprotost-13(17)-en-3-one","Acta Crystallographica Section E","2007","63","10","o4110","","10.1107/S1600536807045126","","","0.71073","MoKα","","0.1179","0.0892","","","0.2151","0.2357","","","","","","1.004","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215568","30.158","0.004","8.9113","0.0012","6.5744","0.0009","90","","96.594","0.002","90","","1755.2","0.4","291","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>N</i>,<i>N</i>'-Bis(2,3,4,5-tetrafluorobenzoyl)piperazine","","- C18 H10 F8 N2 O2 -","- C18 H10 F8 N2 O2 -","- C72 H40 F32 N8 O8 -","4","0.5","IS2210","Zhang, Xiao-Mei; Lu, Ji-Tao","<i>N</i>,<i>N</i>'-Bis(2,3,4,5-tetrafluorobenzoyl)piperazine","Acta Crystallographica Section E","2007","63","10","o4178","o4178","10.1107/S1600536807046776","","","0.71073","MoKα","","0.0477","0.039","","","0.1029","0.1091","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215569","10.0677","0.0004","9.6526","0.0004","23.6791","0.0009","90","","99.193","0.002","90","","2271.57","0.16","93","2","93","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-Bis(4-bromophenyl)-2,5-diphenylcyclopenta-2,4-dienone","","- C29 H18 Br2 O -","- C29 H18 Br2 O -","- C116 H72 Br8 O4 -","4","1","KJ2060","Schwarzer, Anke; Weber, Edwin","3,4-Bis(4-bromophenyl)-2,5-diphenylcyclopenta-2,4-dienone","Acta Crystallographica Section E","2007","63","10","o3966","o3966","10.1107/S1600536807035702","","","0.71073","MoKα","","0.0238","0.0193","","","0.0454","0.0465","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215570","10.615","0.004","11.097","0.004","12.094","0.005","72.23","0.004","85.285","0.004","82.876","0.004","1344.7","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","(1,2-Disalicyloylhydrazine)hexakis(pyridine)dinickel(II) 1,2-disalicyloylhydrazine solvate","","- C58 H50 N10 Ni2 O8 -","- C58 H50 N10 Ni2 O8 -","- C58 H50 N10 Ni2 O8 -","1","0.5","KJ2063","Yuting Chen; Jian-Min Dou; Da-Cheng Li; Da-Qi Wang; Yuehua Zhu","(1,2-Disalicyloylhydrazine)hexakis(pyridine)dinickel(II) 1,2-disalicyloylhydrazine solvate","Acta Crystallographica Section E","2007","63","10","m2503","m2504","10.1107/S1600536807042936","","","0.71073","MoKα","","0.0547","0.0349","","","0.0853","0.1016","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215571","8.8662","0.0003","13.3199","0.0004","13.919","0.0004","90","","90.042","0.001","90","","1643.79","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Chloridotetrakis(imidazole)copper(II) chloride","","- C12 H12 Cl2 Cu N8 -","- C12 H12 Cl2 Cu N8 -","- C48 H48 Cl8 Cu4 N32 -","4","1","KP2113","Li, Ting Bin; Hu, Ya Li; Li, Ji Kun; He, Guo Fang","Chloridotetrakis(imidazole)copper(II) chloride","Acta Crystallographica Section E","2007","63","10","m2536","m2536","10.1107/S1600536807044108","","","0.71073","MoKα","","0.0273","0.0254","","","0.0704","0.072","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215572","8.1428","0.0016","9.1856","0.0018","13.606","0.003","90.37","0.03","100.53","0.03","112.32","0.03","922.4","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3,3',4,4'-Tetrabutyl-5,5'-(biphenyl-4,4'-diyldiethynyl)bis(thiophene-2-\ carbonitrile)","","- C42 H44 N2 S2 -","- C42 H44 N2 S2 -","- C42 H44 N2 S2 -","1","0.5","KP2126","Lei Liu; Wei Xu; Xun-Wen Xiao; Dao-Ben Zhu","3,3',4,4'-Tetrabutyl-5,5'-(biphenyl-4,4'-diyldiethynyl)bis(thiophene-2-carbonitrile)","Acta Crystallographica Section E","2007","63","10","o3961","o3961","10.1107/S1600536807041578","","","0.71073","MoKα","","0.0851","0.0711","","","0.2178","0.2354","","","","","","1.013","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2215573","10.7808","0.0007","15.9978","0.0011","7.2944","0.0005","90","","97.122","0.001","90","","1248.35","0.15","283","2","283","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(2-Chlorobenzamido)benzoic acid","","- C14 H10 Cl N O3 -","- C14 H10 Cl N O3 -","- C56 H40 Cl4 N4 O12 -","4","1","KP2128","Zulfiqar Ali Khan; Khalid M. Khan; Shazia Anjum","2-(2-Chlorobenzamido)benzoic acid","Acta Crystallographica Section E","2007","63","10","o4103","o4103","10.1107/S1600536807044352","","","0.71073","MoKα","","0.0604","0.0452","","","0.1001","0.1086","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215574","28.7995","0.0017","8.0475","0.0005","15.2845","0.0009","90","","114.262","0.001","90","","3229.5","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[bis(μ~2~-quinoline-3-carboxylato-κ^2^<i>N</i>:<i>O</i>)zinc(II)]","","- C20 H12 N2 O4 Zn -","- C20 H12 N2 O4 Zn -","- C160 H96 N16 O32 Zn8 -","8","1","KP2135","Hu, Sheng; Zhang, Shu-Hua; Zeng, Ming-Hua","Poly[bis(μ~2~-quinoline-3-carboxylato-κ^2^<i>N</i>:<i>O</i>)zinc(II)]","Acta Crystallographica Section E","2007","63","10","m2565","m2565","10.1107/S1600536807044868","","","0.71073","MoKα","","0.0402","0.0359","","","0.0932","0.0969","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215575","8.1821","0.0011","10.2161","0.0013","10.6133","0.0014","95.118","0.002","90.579","0.002","110.977","0.002","824.21","0.19","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","6,6'-Dimethoxy-2,3,2',5'-tetranitro-1,1'-biphenyl","","- C14 H10 N4 O10 -","- C14 H10 N4 O10 -","- C28 H20 N8 O20 -","2","1","LH2441","Xue-Yang Xiao; Shao-Bin Miao; Hong-Hong Lan; Yuan-Yuan Jiang; Bao-Ming Ji","6,6'-Dimethoxy-2,3,2',5'-tetranitro-1,1'-biphenyl","Acta Crystallographica Section E","2007","63","10","o4012","o4012","10.1107/S1600536807040202","","","0.71073","MoKα","","0.068","0.0459","","","0.1177","0.1346","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215576","8.403","0.0002","12.5575","0.0004","19.698","0.0007","82.8707","0.0015","83.869","0.002","84.9637","0.0018","2044.82","0.11","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Diethylammonium ethyl (4-methylanilino)phosphonate chloroform solvate","","- C14 H26 Cl3 N2 O3 P -","- C14 H26 Cl3 N2 O3 P -","- C56 H104 Cl12 N8 O12 P4 -","4","2","LH2482","Fu, Zhiyong; Yi, Jianglong; Chen, Yuan; Liao, Shijun; Guo, Ning","Diethylammonium ethyl (4-methylanilino)phosphonate chloroform solvate","Acta Crystallographica Section E","2007","63","10","o3955","o3955","10.1107/S1600536807041499","","","0.71073","MoKα","","0.0819","0.0515","","","0.1342","0.1549","","","","","","1.037","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2215577","11.9025","0.0012","18.2497","0.0019","12.7798","0.0013","90","","109.639","0.002","90","","2614.5","0.5","120","2","120","2","","","","","","","","6","P 1 21 1","P 2yb","4","","1-(1<i>H</i>-1,3-benzimidazol-2-yl)guanidinium dihydrogendodecamolybdophosphate‒methanol‒water (1:2.5:4)","","- C10.5 H30 Mo12 N5 O46.5 P -","- C10.5 H30 Mo12 N5 O46.5 P -","- C21 H60 Mo24 N10 O93 P2 -","2","1","LH2487","Mehrdad Pourayoubi; Ali Reza Mahjoub","1-(1<i>H</i>-1,3-Benzimidazol-2-yl)guanidinium dihydrogendodecamolybdophosphate‒methanol‒water (1/2.5/4)","Acta Crystallographica Section E","2007","63","10","m2622","m2623","10.1107/S1600536807046612","","","0.71073","MoKα","","0.0436","0.0427","","","0.0943","0.0949","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2215578","5.4984","0.0002","10.4062","0.0003","10.7217","0.0003","104.694","0.0011","97.7636","0.0014","91.1473","0.0012","587.02","0.03","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","(+/-)-4-(2-Oxo-1,2,3,4,4a,5,6,7-octahydroquinolin-8-yl)butan-2-one","","- C13 H19 N O2 -","- C13 H19 N O2 -","- C26 H38 N2 O4 -","2","1","LH2489","Zewge, Daniel; Brunskill, Andrew P. J.; Thompson, Hugh W.; Lalancette, Roger A.","(+/-)-4-(2-Oxo-1,2,3,4,4a,5,6,7-octahydroquinolin-8-yl)butan-2-one. A Michael-reaction adduct from acid-catalyzed alkylation of a bicyclic enamide","Acta Crystallographica Section E","2007","63","10","o4007","o4008","10.1107/S160053680704319X","","","1.54178","CuKα","","0.044","0.042","","","0.113","0.115","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215579","10.787","0.002","10.895","0.002","16.876","0.003","90","","93.91","0.03","90","","1978.7","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Methoxy-5-nitrobenzene-1,3-diyl bis(benzenesulfonate)","","- C19 H15 N O9 S2 -","- C19 H15 N O9 S2 -","- C76 H60 N4 O36 S8 -","4","1","LH2490","Xiao, Zhu-Ping; Fang, Rui-Qin; Li, Huan-Qiu; Zhu, Hai-Liang","2-Methoxy-5-nitrobenzene-1,3-diyl bis(benzenesulfonate)","Acta Crystallographica Section E","2007","63","10","o4050","o4050","10.1107/S160053680704398X","","","0.71073","MoKα","","0.0648","0.044","","","0.1169","0.1309","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215580","6.9486","0.0005","14.5898","0.0011","12.0504","0.0009","90","","104.22","0.001","90","","1184.22","0.15","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Imidazolium 3-carboxy-4-hydroxybenzenesulfonate","","- C10 H10 N2 O6 S -","- C10 H10 N2 O6 S -","- C40 H40 N8 O24 S4 -","4","1","LH2493","Yang, De-jun","Imidazolium 3-carboxy-4-hydroxybenzenesulfonate","Acta Crystallographica Section E","2007","63","10","o4038","o4038","10.1107/S1600536807043826","","","0.71073","Mokα","","0.0821","0.0565","","","0.1563","0.169","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215581","8.5179","0.0004","9.6376","0.0004","18.4119","0.0007","77.78","0.001","87.979","0.001","70.723","0.001","1393.42","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tricarbonyl-1,10-phenanthroline(triphenylphosphine)molybdenum(0)","","- C33 H23 Mo N2 O3 P -","- C33 H23 Mo N2 O3 P -","- C66 H46 Mo2 N4 O6 P2 -","2","1","LH2494","Muir, Kathleen J.; McQuillan, Geoffrey P.; Harrison, William T. A.","Tricarbonyl-1,10-phenanthroline(triphenylphosphine)molybdenum(0)","Acta Crystallographica Section E","2007","63","10","m2492","m2492","10.1107/S1600536807043176","","","0.71073","MoKα","","0.0397","0.029","","","0.0646","0.0678","","","","","","0.954","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215582","8.5206","0.0004","9.3188","0.0004","18.4747","0.0008","91.986","0.001","102.425","0.001","110.762","0.001","1329.62","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tricarbonyl-2,2-bipyridyl(triphenylphosphine)molybdenum(0)","","- C31 H23 Mo N2 O3 P -","- C31 H23 Mo N2 O3 P -","- C62 H46 Mo2 N4 O6 P2 -","2","1","LH2495","Muir, Kathleen J.; McQuillan, Geoffrey P.; Harrison, William T. A.","Tricarbonyl-2,2-bipyridyl(triphenylphosphine)molybdenum(0)","Acta Crystallographica Section E","2007","63","10","m2493","m2493","10.1107/S1600536807043164","","","0.71073","MoKα","","0.0449","0.0316","","","0.0657","0.0693","","","","","","0.961","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215583","12.2004","0.0005","12.6825","0.0006","13.6436","0.0006","88.703","0.001","74.892","0.001","78.197","0.001","1993.98","0.15","153","2","153","2","","","","","","","","6","P -1","-P 1","2","[2-Methacrylate[tris(N-methylbenzimidazol-2-ylmethyl)amine]copper(II)] perchlorate","(2-Methacrylato)[tris(<i>N</i>-methylbenzimidazol-2-ylmethyl)amine]copper(II) perchlorate dimethylformamide disolvate hemihydrate","","- C37 H47 Cl Cu N9 O8.5 -","- C37 H47 Cl Cu N9 O8.5 -","- C74 H94 Cl2 Cu2 N18 O17 -","2","1","LH2496","Huilu Wu; Wei Ying; Jian Ding; Jingkun Yuan","(2-Methacrylato)[tris(1-methyl-1<i>H</i>-benzimidazol-2-ylmethyl)amine]copper(II) perchlorate dimethylformamide disolvate hemihydrate at 153(2) K","Acta Crystallographica Section E","2007","63","10","m2576","m2576","10.1107/S160053680704500X","","","0.71073","MoKα","","0.0762","0.0564","","","0.1494","0.1698","","","","","","1.113","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2215584","6.914","0.0008","9.3481","0.0011","11.0289","0.0011","90","","90","","90","","712.83","0.14","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Bis(cyanido-κC)(ethane-1,2-diamine-κ^2^N,N')silver(II)","","- C4 H8 Ag N4 -","- C4 H8 Ag N4 -","- C16 H32 Ag4 N16 -","4","1","LH2497","Ahmad, Saeed; Monim-ul-Mehboob, Muhammad; Hanif, Muhammad; Altaf, Muhammad; Stoeckli-Evans, Helen","Bis(cyanido-κ<i>C</i>)(ethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')silver(II)","Acta Crystallographica Section E","2007","63","10","m2548","m2548","10.1107/S1600536807044431","","","0.71073","MoKα","","0.0166","0.0163","","","0.0419","0.042","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215585","21.1804","0.0004","10.1644","0.0002","11.3208","0.0003","90","","113.841","0.002","90","","2229.24","0.09","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(2RS,4aRS,8aRS)-6-Oxoperhydronaphthalene-2-acetic acid","","- C12 H18 O3 -","- C12 H18 O3 -","- C96 H144 O24 -","8","1","LH2498","Desai, Janish; Lalancette, Roger A.; Thompson, Hugh W.","(2<i>RS</i>,4a<i>RS</i>,8a<i>RS</i>)-6-Oxoperhydronaphthalene-2-acetic acid: catemeric hydrogen bonding in a bicyclic keto acid","Acta Crystallographica Section E","2007","63","10","o4009","o4009","10.1107/S1600536807043206","","","1.54178","CuKα","","0.047","0.037","","","0.095","0.102","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215586","9.6288","0.0006","8.3351","0.0006","9.8244","0.0006","90","","113.854","0.001","90","","721.12","0.08","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bisimidazolium terephthalate","","- C14 H14 N4 O4 -","- C14 H14 N4 O4 -","- C28 H28 N8 O8 -","2","0.5","LH2499","Tian, Zhi-gao","Bisimidazolium terephthalate","Acta Crystallographica Section E","2007","63","10","o4067","o4067","10.1107/S1600536807044236","","","0.71073","Mokα","","0.055","0.0458","","","0.1296","0.137","","","","","","1.123","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215587","8.086","0.002","17.96","0.005","12.135","0.003","90","","101.467","0.005","90","","1727.1","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,5-Dimethyl-1,2-bis(pyridine-3-carboxamido)benzene","","- C20 H18 N4 O2 -","- C20 H18 N4 O2 -","- C80 H72 N16 O8 -","4","1","LH2501","Kwak, Han; Park, Chi-Ho; Kim, Pan-Gi; Kim, Cheal; Kim, Youngmee","4,5-Dimethyl-1,2-bis(pyridine-3-carboxamido)benzene","Acta Crystallographica Section E","2007","63","10","o4104","o4105","10.1107/S1600536807044492","","","0.71073","MoKα","","0.0689","0.0429","","","0.101","0.1108","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215588","6.8753","0.0004","10.5598","0.0007","11.2757","0.0007","71.105","0.001","78.984","0.001","74.738","0.001","742.17","0.08","297","2","297","2","","","","","","","","4","P -1","-P 1","2","","Bis(2-methylimidazolium) terephthalate bis(2-methylimidazole) tetrahydrate","","- C24 H38 N8 O8 -","- C24 H38 N8 O8 -","- C24 H38 N8 O8 -","1","0.5","LH2502","Qu, Shao-hua","Bis(2-methylimidazolium) terephthalate bis(2-methylimidazole) tetrahydrate","Acta Crystallographica Section E","2007","63","10","o4071","o4071","10.1107/S1600536807044698","","","0.71073","Mokα","","0.0604","0.046","","","0.139","0.1506","","","","","","1.101","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215589","4.865","0.003","10.481","0.006","20.103","0.011","90","","92.539","0.01","90","","1024","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis{2-[(3,5-Dibromo-2-oxidophenyl)methylamino]ethanol- κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}nickel(II)","","- C18 H20 Br4 N2 Ni O4 -","- C18 H20 Br4 N2 Ni O4 -","- C36 H40 Br8 N4 Ni2 O8 -","2","0.5","LH2503","Zhang, Shu-Hua; Zou, Hua-Hong; Zeng, Ming-Hua; Liang, Hong","Bis{2-[(3,5-dibromo-2-oxidophenyl)methylamino]ethanol-κ^3^<i>O</i>,<i>N</i>,<i>O</i>'}nickel(II)","Acta Crystallographica Section E","2007","63","10","m2564","m2564","10.1107/S1600536807044996","","","0.71073","MoKα","","0.1181","0.0645","","","0.154","0.1871","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215590","9.159","0.001","5.067","0.001","12.041","0.001","90","","108.27","0.02","90","","530.64","0.14","118","2","118","2","","","","","","","","5","P 1 21 1","P 2yb","4","(+)-5-bromo-2'-deoxyuridine","(+)-5-bromo-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]- pyrimidine-2,4-dione","","- C9 H11 Br N2 O5 -","- C9 H11 Br N2 O5 -","- C18 H22 Br2 N4 O10 -","2","1","LH2504","Pawel Sledz; Maksymilian Chruszcz; Wladek Minor","Absolute configuration from a redetermination of (+)-5-bromo-1-[(2<i>R</i>,4<i>S</i>,5<i>R</i>)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione at 118(2) K","Acta Crystallographica Section E","2007","63","10","o4159","o4160","10.1107/S1600536807046077","","","0.71074","MoKα","","0.0209","0.0206","","","0.0547","0.0549","","","","","","1.039","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2215591","15.0631","0.0019","5.979","0.0008","17.689","0.002","90","","99.204","0.002","90","","1572.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2E,6E)-2,6-Bis[(5-methylthiophen-2-yl)methylene]cyclohexanone","","- C18 H18 O S2 -","- C18 H18 O S2 -","- C72 H72 O4 S8 -","4","1","LH2505","Guang Liang; Shu-Lin Yang; Xiao-Hui Wang; Yue-Ru Li; Xiao-Kun Li","(2<i>E</i>,6<i>E</i>)-2,6-Bis[(5-methylthiophen-2-yl)methylene]cyclohexanone","Acta Crystallographica Section E","2007","63","10","o4118","o4118","10.1107/S160053680704531X","","","0.71073","MoKα","","0.074","0.0556","","","0.1352","0.1436","","","","","","0.959","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215592","4.9171","0.0001","7.8826","0.0002","10.5731","0.0003","96.167","0.001","102.295","0.001","99.211","0.001","390.968","0.017","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","Diaquabis(saccharinato-κ<i>N</i>)copper(II)","","- C14 H12 Cu N2 O8 S2 -","- C14 H12 Cu N2 O8 S2 -","- C14 H12 Cu N2 O8 S2 -","1","0.5","LH2507","Farook Adam; Ishraga Abdelmoniem Hassan; Mohd Mustaqim Rosli; Hoong-Kun Fun","Diaquabis(saccharinato-κ<i>N</i>)copper(II)","Acta Crystallographica Section E","2007","63","10","m2600","m2600","10.1107/S1600536807046089","","","0.71073","MoKα","","0.0323","0.0268","","","0.0766","0.0798","","","","","","1.124","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215593","9.5631","0.0013","11.8424","0.0016","11.8849","0.0016","107.16","0.002","101.8","0.002","110.47","0.002","1131.4","0.3","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","Tetra-μ~2~-acetato-κ^8^<i>O</i>:<i>O</i>'-bis{[1-(1-adamantyliminomethyl)- 2-naphthol-κO]rhodium(II)}","","- C50 H58 N2 O10 Rh2 -","- C50 H58 N2 O10 Rh2 -","- C50 H58 N2 O10 Rh2 -","1","0.5","LH2508","Franco, Jimmy U.; Olmstead, Marilyn M.; Hammons, Justin C.","Tetra-μ~2~-acetato-κ^8^<i>O</i>:<i>O</i>'-bis{[1-(1-adamantyliminiomethyl)-2-naphtholato-κ<i>O</i>]rhodium(II)}","Acta Crystallographica Section E","2007","63","10","m2606","m2607","10.1107/S1600536807046302","","","0.71073","MoKα","","0.0413","0.0386","","","0.1103","0.1114","","","","","","1.148","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215594","12.2","0.004","15.824","0.006","9.012","0.004","90","","100.45","0.02","90","","1710.9","1.2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","o-Sulfamoylbenzoic acid","","- C7 H7 N O4 S -","- C7 H7 N O4 S -","- C56 H56 N8 O32 S8 -","8","1","LH2510","Siddiqui, Waseeq Ahmad; Ahmad, Saeed; Siddiqui, Hamid Latif; Tariq, Muhammad Ilyas; Parvez, Masood","<i>o</i>-Sulfamoylbenzoic acid","Acta Crystallographica Section E","2007","63","10","o4117","o4117","10.1107/S1600536807045710","","","0.71073","MoKα","","0.04","0.0333","","","0.085","0.0894","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215595","11.162","0.002","17.432","0.004","13.794","0.003","90","","90","","90","","2684","1","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Di-μ-iodo-bis[(4,4'-dimethyl-2,2'-bipyridine)copper(I)]","","- C24 H24 Cu2 I2 N4 -","- C24 H24 Cu2 I2 N4 -","- C96 H96 Cu8 I8 N16 -","4","0.5","LN3051","Feng, Hua; Hu, Dong-Cheng; Guo, Hui-Xia; Zha, Fei; Hu, Chang-Qiu","Di-μ-iodo-bis[(4,4'-dimethyl-2,2'-bipyridine)copper(I)]","Acta Crystallographica Section E","2007","63","10","m2538","m2538","10.1107/S1600536807018041","","","0.71073","MoKα","","0.0707","0.0503","","","0.1189","0.1294","","","","","","1.099","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215596","9.143","0.006","10.079","0.006","10.217","0.006","84.059","0.01","79.41","0.011","77.095","0.009","900.2","1","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","(1<i>S</i>)-Benzyl 3-methyl-5-oxo-4-phenylhydrazono-4,5-dihydro-1H-pyrazole-1-dithiocarboxylate","","- C18 H16 N4 O S2 -","- C18 H16 N4 O S2 -","- C36 H32 N8 O2 S4 -","2","1","LW2028","Liu, Yong-Hong; Zhao, Yue; Liu, Xiao-Lan; Tong, Ben-Wan; Ye, Jun","(1<i>S</i>)-Benzyl 3-methyl-5-oxo-4-phenylhydrazono-4,5-dihydro-1<i>H</i>-pyrazole-1-dithiocarboxylate","Acta Crystallographica Section E","2007","63","10","o4072","o4072","10.1107/S1600536807044327","","","0.71073","MoKα","","0.0904","0.0446","","","0.098","0.12","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215597","5.2691","0.0003","16.1279","0.0011","11.9181","0.0007","90","","98.252","0.003","90","","1002.31","0.11","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(1SR,8aRS)-1,2,3,5,6,7,8,8a-Octahydro-3-oxonaphthalene-1-carboxylic acid","","- C11 H14 O3 -","- C11 H14 O3 -","- C44 H56 O12 -","4","1","LW2029","Davison, Mark; Malak, Muhammad H.; Lalancette, Roger A.; Thompson, Hugh W.","(1<i>SR</i>,8a<i>RS</i>)-1,2,3,5,6,7,8,8a-Octahydro-3-oxonaphthalene-1-carboxylic acid: catemeric hydrogen bonding in a bicyclic unsaturated γ-keto acid","Acta Crystallographica Section E","2007","63","10","o4014","o4014","10.1107/S1600536807043425","","","1.54178","CuKα","","0.038","0.036","","","0.094","0.095","","","","","","1.08","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215598","14.0913","0.0018","10.764","0.0014","7.6056","0.001","90","","100.349","0.002","90","","1134.8","0.3","120","","120","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1-benzyloxy-4-nitrobenzene","1-benzyloxy-4-nitrobenzene","","- C13 H11 N O3 -","- C13 H11 N O3 -","- C52 H44 N4 O12 -","4","1","LW2030","Andivelu Ilangovan; Rajendran Ganesh Kumar; Hongze Liang; Kasthuri Balasubramani; Packianathan Thomas Muthiah","1-Benzyloxy-4-nitrobenzene","Acta Crystallographica Section E","2007","63","10","o4087","o4087","10.1107/S160053680704425X","","","0.71073","MoKα","","0.0602","0.0463","","","0.1058","0.1143","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215599","5.522","0.0011","12.365","0.003","9.797","0.002","90","","94.38","0.03","90","","667","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N'-Hydroxynicotinamidine","","- C6 H7 N3 O -","- C6 H7 N3 O -","- C24 H28 N12 O4 -","4","1","LW2034","Wang, Pin-liang; Li, Hai-ling; Zeng, Hai-su; Kang, Si-shun; Wang, Hai-bo","<i>N</i>'-Hydroxynicotinamidine","Acta Crystallographica Section E","2007","63","10","o4151","o4151","10.1107/S1600536807046508","","","0.71073","MoKα","","0.1088","0.0595","","","0.1278","0.1577","","","","","","1.159","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215600","12.6501","0.0014","8.231","0.0009","17.0111","0.0018","90","","103.031","0.002","90","","1725.6","0.3","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-[(4-Bromophenyl)(4-fluorophenylamino)methyl]cyclohexanone","","- C19 H19 Br F N O -","- C19 H19 Br F N O -","- C76 H76 Br4 F4 N4 O4 -","4","1","NC2047","Yuan, Guang-Xin; Sun, Jing-Bo; Zhang, Li-Hua; Lu, Gang","2-[(4-Bromophenyl)(4-fluorophenylamino)methyl]cyclohexanone","Acta Crystallographica Section E","2007","63","10","o3960","o3960","10.1107/S1600536807036847","","","0.71073","MoKα","","0.0841","0.0477","","","0.1023","0.1134","","","","","","0.821","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215601","5.3719","0.0003","6.8819","0.0003","10.8378","0.0006","90","","90","","90","","400.66","0.04","200","2","200","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Cyclobutane-1,2-dione","Cyclobutane-1,2-dione","","- C4 H4 O2 -","- C4 H4 O2 -","- C16 H16 O8 -","4","1","NC2049","Betz, Richard; Klüfers, Peter","Cyclobutane-1,2-dione","Acta Crystallographica Section E","2007","63","10","o3981","o3981","10.1107/S1600536807042924","","","0.71073","MoKα","","0.0386","0.0307","","","0.075","0.0812","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215602","6.8774","0.0002","13.7315","0.0003","20.4667","0.0008","90","","97.01","0.003","90","","1918.37","0.1","203","","203","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(4-Chlorophenyl)-3-{[(1E)-(4-chlorophenyl)methylene]amino}-2,3- dihydroquinazolin-4(1H)-one","","- C21 H15 Cl2 N3 O -","- C21 H15 Cl2 N3 O -","- C84 H60 Cl8 N12 O4 -","4","1","NC2054","Butcher, Ray J.; Jasinski, Jerry P.; Narayana, B.; Sunil, K.; Yathirajan, H. S.","2-(4-Chlorophenyl)-3-{[(1<i>E</i>)-(4-chlorophenyl)methylene]amino}-2,3-dihydroquinazolin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","10","o4025","o4026","10.1107/S1600536807043632","","","0.71073","MoKα","","0.1256","0.0454","","","0.0512","0.055","","","","","","1.629","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215603","8.7215","0.0005","12.1042","0.0004","12.4678","0.0007","64.267","0.003","69.759","0.005","87.895","0.003","1102.36","0.11","293","","293","","","","","","","","","5","P -1","-P 1","2","","3-Benzoyl-1-[(4-methylphenyl)sulfonyl]-1a,2,3,7 b-tetrahydro-1<i>H</i>-azireno [2,3-<i>c</i>]quinoline-2-carbonitrile","","- C24 H19 N3 O3 S -","- C24 H19 N3 O3 S -","- C48 H38 N6 O6 S2 -","2","1","NC2055","Evain, Michel; Jean-Gérard, Ludivine; Collet, Sylvain; Guingant, André","3-Benzoyl-1-[(4-methylphenyl)sulfonyl]-1a,2,3,7b-tetrahydro-1<i>H</i>-azireno[2,3-<i>c</i>]quinoline-2-carbonitrile","Acta Crystallographica Section E","2007","63","10","o4023","o4023","10.1107/S1600536807043644","","","0.71069","MoKα","","0.1052","0.066","","","0.1425","0.1567","","","","","","2.06","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2215604","14.476","0.003","12.643","0.003","8.2179","0.0016","90","","90","","90","","1504","0.6","293","2","293","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","Poly[bis(μ2-pyridine-2,6-dicarboxylato)cobalt(II)disodium(I)]","","- C14 H6 Co N2 Na2 O8 -","- C14 H6 Co N2 Na2 O8 -","- C56 H24 Co4 N8 Na8 O32 -","4","0.5","NC2057","Liu, Fu-Chen; Ouyang, Jie","Poly[bis(μ~2~-pyridine-2,6-dicarboxylato)cobalt(II)disodium(I)]","Acta Crystallographica Section E","2007","63","10","m2557","m2557","10.1107/S1600536807044121","","","0.71073","MoKα","","0.0338","0.0292","","","0.0667","0.0688","","","","","","1.162","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215605","8.579","0.0006","15.8079","0.0011","11.5595","0.0008","90","","107.748","0.001","90","","1493.04","0.18","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-(Malonato-κ^2^O,O')bis(2-methylpyridine-κN)platinum(II)","","- C15 H16 N2 O4 Pt -","- C15 H16 N2 O4 Pt -","- C60 H64 N8 O16 Pt4 -","4","1","NC2058","Ming-Jin Xie; Yao Yu; Wei-Ping Liu; Shu-Qian Hou; Xi-Zhu Chen","<i>cis</i>-(Malonato-κ^2^<i>O</i>,<i>O</i>')bis(2-methylpyridine-κ<i>N</i>)platinum(II)","Acta Crystallographica Section E","2007","63","10","m2627","m2627","10.1107/S1600536807047034","","","0.71073","MoKα","","0.0282","0.0206","","","0.0429","0.0458","","","","","","0.95","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215606","12.022","0.003","8.3484","0.0018","14.894","0.003","90","","101.096","0.003","90","","1466.9","0.6","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Diethyleneglycol bis(allylsulfonate)","3-Oxapentane-1,5-diyl bis(allylsulfonate)","","- C10 H18 O7 S2 -","- C10 H18 O7 S2 -","- C40 H72 O28 S8 -","4","0.5","NC2062","Srinivasan, Bikshandarkoil R.; Nadkarni, Vishnu S.; Mandrekar, Vinod; Raghavaiah, Pallepogu","3-Oxapentane-1,5-diyl bis(allylsulfonate)","Acta Crystallographica Section E","2007","63","10","o4166","o4166","10.1107/S160053680704679X","","","0.71073","MoKα","","0.0435","0.0388","","","0.1072","0.1111","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215607","9.125","0.003","11.326","0.004","17.137","0.003","87.652","0.008","78.285","0.007","72.121","0.008","1650","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(Diphenylmethoxyphosphane-κP)(diphenylphosphanito-κP)(3,5,7- tribromotropolonato-κ^2^O,O')palladium(II) methanol solvate","","- C33 H29 Br3 O5 P2 Pd -","- C33 H29 Br3 O5 P2 Pd -","- C66 H58 Br6 O10 P4 Pd2 -","2","1","NG2311","Steyl, Gideon","(Diphenylmethoxyphosphane-κ<i>P</i>)(diphenylphosphanito-κ<i>P</i>)(3,5,7-tribromotropolonato-κ^2^<i>O</i>,<i>O</i>')palladium(II) methanol solvate","Acta Crystallographica Section E","2007","63","10","m2613","m2614","10.1107/S1600536807046399","","","0.71073","MoKα","","0.0534","0.0389","","","0.0994","0.1106","","","","","","1.085","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215608","8.9532","0.0017","12.038","0.002","13.645","0.003","90","","99.973","0.014","90","","1448.4","0.5","293","2","293","2","","","","","","","","6","P 1 n 1","P -2yac","7","","(Oxalato-κ^2^<i>O</i>,<i>O</i>')bis(propane-1,3-diamine- κ^2^<i>N</i>,<i>N</i>')chromium(III) chloride monohydrate","","- C8 H22 Cl Cr N4 O5 -","- C8 H22 Cl Cr N4 O5 -","- C32 H88 Cl4 Cr4 N16 O20 -","4","2","NG2312","Zhang, Li-Fang; Kou, Jian-Yi; Kou, Hui-Zhong","(Oxalato-κ^2^<i>O</i>,<i>O</i>')bis(propane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>')chromium(III) chloride monohydrate","Acta Crystallographica Section E","2007","63","10","m2457","m2458","10.1107/S1600536807041839","","","0.71073","MoKα","","0.0269","0.0267","","","0.0705","0.0708","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215609","3.8181","0.0018","15.742","0.007","12.127","0.006","90","","95.05","0.04","90","","726.1","0.6","297","1","297","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,4,6-Trichlorophenol","2,4,6-Trichlorophenol","","- C6 H3 Cl3 O -","- C6 H3 Cl3 O -","- C24 H12 Cl12 O4 -","4","1","NG2314","González Martínez, Sandra Patricia; Bernès, Sylvain","2,4,6-Trichlorophenol","Acta Crystallographica Section E","2007","63","10","o3947","o3947","10.1107/S1600536807042080","","","0.71073","MoKα","","0.0571","0.0404","","","0.098","0.1093","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215610","6.0509","0.0002","18.125","0.0006","10.3711","0.0003","90","","95.689","0.002","90","","1131.82","0.06","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,7-Norbornanediol-pyrocatechol-<i>spiro</i>-orthocarbonate","Norbornane-2,7-diyl 1',2'-phenylene orthocarbonate","","- C14 H14 O4 -","- C14 H14 O4 -","- C56 H56 O16 -","4","1","NG2315","Betz, Richard; Klüfers, Peter","Norbornane-2,7-diyl 1',2'-phenylene orthocarbonate","Acta Crystallographica Section E","2007","63","10","o3933","o3933","10.1107/S1600536807042298","","","0.71073","MoKα","","0.0745","0.0436","","","0.1019","0.1168","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215611","8.9323","0.0002","9.6863","0.0002","12.1478","0.0003","77.05","0.001","87.529","0.001","70.191","0.001","963.08","0.04","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>-(4-Methylpyridin-2-yl)-5<i>H</i>-dibenzo[d,f][1,3]diazepine-6- carboxamide toluene hemisolvate","","- C23.5 H20 N4 O -","- C23.5 H20 N4 O -","- C47 H40 N8 O2 -","2","1","NG2316","Hodorowicz, Maciej; Stadnicka, Katarzyna; Trzewik, Bartosz; Zaleska, Barbara","<i>N</i>-(4-Methylpyridin-2-yl)-5<i>H</i>-dibenzo[<i>d</i>,<i>f</i>][1,3]diazepine-6-carboxamide toluene hemisolvate","Acta Crystallographica Section E","2007","63","10","o4115","o4115","10.1107/S1600536807042687","","","0.71073","MoKα","","0.1243","0.0519","","","0.1273","0.1479","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215612","10.0431","0.0003","10.2145","0.0003","16.4136","0.0005","100.213","0.002","98.218","0.002","98.642","0.002","1613.22","0.09","180","2","180","2","","","","","","","","3","P -1","-P 1","2","","2,6-Bis[2-(4-benzyloxyphenyl)ethyl]biphenyl","","- C42 H38 O2 -","- C42 H38 O2 -","- C84 H76 O4 -","2","1","NG2317","Moratti, Stephen C.; Simpson, Jim; Tierney, Steven M.","2,6-Bis[2-(4-benzyloxyphenyl)ethyl]biphenyl","Acta Crystallographica Section E","2007","63","10","o3954","o3954","10.1107/S1600536807042304","","","0.71073","MoKα","","0.1","0.0662","","","0.1516","0.1693","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215613","15.15","0.003","8.6713","0.0017","13.89","0.003","90","","99.31","0.03","90","","1800.7","0.7","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(4,6-dimethyl-2-pyrimidinethiolato-κ^2^<i>N</i>,<i>S</i>)-\ bis(methanol-κ<i>O</i>)manganese(II)","","- C14 H22 Mn N4 O2 S2 -","- C14 H22 Mn N4 O2 S2 -","- C56 H88 Mn4 N16 O8 S8 -","4","0.5","NG2320","Li, Hai-Yan; Li, Hong-Xi; Tang, Xiao-Yan; Chen, Yang; Lang, Jian-Ping","Bis(4,6-dimethyl-2-pyrimidinethiolato-κ^2^<i>N</i>,<i>S</i>)bis(methanol-κ<i>O</i>)manganese(II)","Acta Crystallographica Section E","2007","63","10","m2486","m2487","10.1107/S1600536807042833","","","0.71073","MoKα","","0.0334","0.0305","","","0.0694","0.071","","","","","","1.092","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215614","11.19","0.0003","18.8378","0.0005","22.4202","0.0008","90","","90","","90","","4726.1","0.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis{2-[tris(hydroxymethyl)methyliminomethyl]phenolato-κ3N,O,O'}nickel(II) methanol solvate","","- C23 H32 N2 Ni O9 -","- C23 H32 N2 Ni O9 -","- C184 H256 N16 Ni8 O72 -","8","1","NG2321","Qing-wei Wang; Xiu-mei Li; Xiu-yan Wang; Yue Zhang","Bis{2-[tris(hydroxymethyl)methyliminomethyl]phenolato-<i>{κ</i>}^3^<i>N</i>,<i>O</i>,<i>O</i>'}nickel(II) methanol solvate","Acta Crystallographica Section E","2007","63","10","m2537","m2537","10.1107/S160053680704384X","","","0.71073","MoKα","","0.1548","0.0395","","","0.0507","0.0627","","","","","","0.816","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215615","9.4846","0.0004","9.4846","","13.7339","0.0006","90","","90","","90","","1235.47","0.08","293","2","293","2","","","","","","","","6","P 42/m n m","-P 4n 2n","136","","Tetraaquabis(thiocyanato-κN)cobalt(II) hexamethylenetetramine (1/2) cocrystal","","- C14 H32 Co N10 O4 S2 -","- C14 H32 Co N10 O4 S2 -","- C28 H64 Co2 N20 O8 S4 -","2","0.125","NG2324","Li, Xiu-Ling; Niu, De-Zhong; Lu, Zai-Sheng","Tetraaquabis(thiocyanato-<i>{κ</i>N})cobalt(II) hexamethylenetetramine (1/2) cocrystal","Acta Crystallographica Section E","2007","63","10","m2478","m2478","10.1107/S1600536807043024","","","0.71073","MoKα","","0.0403","0.0344","","","0.0945","0.1001","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215616","8.6965","0.0009","6.5597","0.0007","11.8601","0.0013","90","","109.245","0.002","90","","638.77","0.12","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Poly[bis(μ~2~-azido-κ^2^<i>N</i>^1^:<i>N</i>^3^)(μ~2~-3,5-di-2-pyridyl- 1,2,4-triazole-κ^4^N^1^,N^5^:N^2^,N^3^)manganese(II)]","","- C24 H16 Mn2 N16 -","- C24 H16 Mn2 N16 -","- C24 H16 Mn2 N16 -","1","0.5","NG2325","Hu,Sheng; Zhang, Shu-Hua; Zeng, Ming-Hua","Poly[bis(μ~2~-azido-κ^2^<i>N</i>^1^:<i>N</i>^3^)(μ~2~-3,5-di-2-pyridyl-1,2,4-triazole-κ^4^<i>N</i>^1^,<i>N</i>^5^:<i>N</i>^2^,<i>N</i>^3^)manganese(II)]","Acta Crystallographica Section E","2007","63","10","m2543","m2543","10.1107/S1600536807044066","","","0.71073","MoKα","","0.0375","0.0349","","","0.0751","0.0762","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215617","10.245","0.003","4.726","0.002","13.531","0.004","90","","92.73","0.02","90","","654.4","0.4","295","2","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-iodo-1H-pyrrole-2-carbaldehyde","","- C5 H4 I N O -","- C5 H4 I N O -","- C20 H16 I4 N4 O4 -","4","1","NG2326","Rohan A. Davis; Anthony R. Carroll; Ronald J. Quinn; Peter C. Healy; Alan R. White","4-Iodo-1<i>H</i>-pyrrole-2-carbaldehyde","Acta Crystallographica Section E","2007","63","10","o4076","o4076","10.1107/S1600536807044534","","","0.71069","MoKα","","0.0346","0.0256","","","0.064","0.0681","","","","","","1.114","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215618","5.937","0.002","15.785","0.006","7.167","0.003","90","","100.416","0.004","90","","660.6","0.4","130","","130","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","poly[di-μ~2~-aqua-di-μ~5~-oxalato-μ~4~-oxalato-disodiumdimanganese(II)],","","- C6 H4 Mn2 Na2 O14 -","- C6 H4 Mn2 Na2 O14 -","- C12 H8 Mn4 Na4 O28 -","2","0.5","NG2327","Xin-Yang Huang; Yu-Ling Wang","Disodium dimanganese(II) trioxalate dihydrate","Acta Crystallographica Section E","2007","63","10","m2577","m2577","10.1107/S1600536807045564","","","0.71073","MoKα","","0.0269","0.0238","","","0.052","0.0536","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215619","10.129","0.0003","7.229","0.0002","20.075","0.0007","90","","90","","90","","1469.94","0.08","200","2","200","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","rac-trans-cycloheptane-1,2-diol","<i>rac</i>-<i>trans</i>-Cycloheptane-1,2-diol","","- C7 H14 O2 -","- C7 H14 O2 -","- C56 H112 O16 -","8","1","NG2328","Betz, Richard; Klüfers, Peter","<i>rac</i>-<i>trans</i>-Cycloheptane-1,2-diol","Acta Crystallographica Section E","2007","63","10","o4129","o4129","10.1107/S1600536807045746","","","0.71073","MoKα","","0.0761","0.0421","","","0.1012","0.113","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215620","21.236","0.002","13.4486","0.0013","11.4351","0.0013","90","","111.537","0.01","90","","3037.8","0.6","200","2","200","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","tert-butylglycolic acid","<i>tert</i>-Butylglycolic acid","","- C6 H12 O3 -","- C6 H12 O3 -","- C96 H192 O48 -","16","2","NG2330","Betz, Richard; Klüfers, Peter; Mangstl, Martin M.","<i>tert</i>-Butylglycolic acid","Acta Crystallographica Section E","2007","63","10","o4144","o4144","10.1107/S1600536807046156","","","0.71073","MoKα","","0.066","0.0482","","","0.1274","0.142","","","","","","1.1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215621","9.091","0.0018","5.8499","0.0013","20.019","0.003","90","","94.779","0.002","90","","1060.9","0.4","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-[(Butane-1,4-diyldioxy)bis(nitrilomethylidyne)]dinaphthalene","","- C26 H24 N2 O2 -","- C26 H24 N2 O2 -","- C52 H48 N4 O4 -","2","0.5","OM2146","Junyan Shi; Wenkui Dong; Yanping Zhang; Suxia Gao","2,2'-[(Butane-1,4-diyldioxy)bis(nitrilomethylidyne)]dinaphthalene","Acta Crystallographica Section E","2007","63","10","o4080","o4080","10.1107/S1600536807040822","","","0.71073","MoKα","","0.0995","0.0462","","","0.0982","0.1205","","","","","","0.987","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215622","8.7008","0.0003","10.4873","0.0002","10.9779","0.0003","64.1072","0.0013","78.4779","0.0012","74.2744","0.0017","863.58","0.04","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","[1,2-Bis(phenylseleno)benzene]dichloridopalladium(II)","","- C18 H14 Cl2 Pd Se2 -","- C18 H14 Cl2 Pd Se2 -","- C36 H28 Cl4 Pd2 Se4 -","2","1","OM2151","Nobuhiro Takeda; Toru Isobe; Takahiro Sasamori; Norihiro Tokitoh","[1,2-Bis(phenylseleno)benzene]dichloridopalladium(II)","Acta Crystallographica Section E","2007","63","10","m2546","m2546","10.1107/S1600536807044510","","","0.71069","MoKα","","0.0147","0.0142","","","0.0365","0.0368","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215623","14.3559","0.0011","7.7688","0.0006","14.5566","0.0011","90","","113.073","0.001","90","","1493.6","0.2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichlorido[bis(2-hexylsulfanyl)-1<i>H</i>-benzimidazole- κ<i>N</i>^3^]palladium(II)","","- C26 H36 Cl2 N4 Pd S2 -","- C26 H36 Cl2 N4 Pd S2 -","- C52 H72 Cl4 N8 Pd2 S4 -","2","0.5","OM2153","Zhang-Jie Huang; Lin Du; Ming-Jin Xie; Jing Chen","Dichlorido[bis(2-hexylsulfanyl)-1<i>H</i>-benzimidazole-κ<i>N</i>^3^]palladium(II)","Acta Crystallographica Section E","2007","63","10","m2474","m2474","10.1107/S1600536807042584","","","0.71073","MoKα","","0.059","0.0452","","","0.1254","0.139","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215624","13.1756","0.0013","10.5514","0.0013","18.0297","0.0019","90","","91.356","0.003","90","","2505.8","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5-Amino-1-(2,6-dichloro-4-nitrophenyl)pyrazole-3-carbonitrile","","- C10 H5 Cl2 N5 O2 -","- C10 H5 Cl2 N5 O2 -","- C80 H40 Cl16 N40 O16 -","8","1","OM2155","Luo, Yi; Zhong, Ping; Hu, Maolin","5-Amino-1-(2,6-dichloro-4-nitrophenyl)pyrazole-3-carbonitrile","Acta Crystallographica Section E","2007","63","10","o4077","o4077","10.1107/S1600536807044509","","","0.71073","MoKα","","0.0683","0.0584","","","0.1379","0.144","","","","","","1.115","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215625","6.6535","0.0006","8.417","0.0008","10.3399","0.0009","78.493","0.002","79.524","0.002","71.284","0.002","533.07","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[piperazindiium [zincate(II)-bis(μ-pyridine-2,3-dicarboxylato)- κ^3^N,O^2^:O^3^;κ^3^O^3^:N,O^2^] tetrahydrate]","","- C18 H26 N4 O12 Zn -","- C18 H26 N4 O12 Zn -","- C18 H26 N4 O12 Zn -","1","0.5","OM2156","Aghabozorg, Hossein; Daneshvar, Shirin; Motyeian, Elham; Ghadermazi, Mohammad; Attar Gharamaleki, Jafar","<i>catena</i>-Poly[piperazindiium [zincate(II)-bis(μ-pyridine-2,3-dicarboxylato)-κ^3^<i>N</i>,<i>O</i>^2^:<i>O</i>^3^;κ^3^<i>O</i>^3^:<i>N</i>,<i>O</i>^2^] tetrahydrate]","Acta Crystallographica Section E","2007","63","10","m2468","m2469","10.1107/S1600536807042651","","","0.71073","MoKα","","0.0296","0.0268","","","0.0695","0.0712","","","","","","1.005","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215626","16.8531","0.0011","5.5629","0.0004","18.7889","0.0013","90","","96.877","0.002","90","","1748.8","0.2","90","0.2","90","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(<i>Z</i>)-3-[1-(4-Chlorobenzyl)-1<i>H</i>-indol-3-yl]-2-(3- thienyl)acrylonitrile","","- C22 H15 Cl N2 S -","- C22 H15 Cl N2 S -","- C88 H60 Cl4 N8 S4 -","4","1","OM2157","Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.","(<i>Z</i>)-3-[1-(4-Chlorobenzyl)-1<i>H</i>-indol-3-yl]-2-(3-thienyl)acrylonitrile","Acta Crystallographica Section E","2007","63","10","o3979","o3979","10.1107/S1600536807042638","","","1.54178","CuKα","","0.036","0.033","","","0.0847","0.0879","","","","","","1.046","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215627","7.9421","0.0016","20.761","0.004","10.403","0.002","90","","94.47","0.03","90","","1710.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(4-methylphenyl)-5-oxo-2-phenylpyrrolidine-2-carboxamide ‒methanol (1/1)","","- C19 H22 N2 O3 -","- C19 H22 N2 O3 -","- C76 H88 N8 O12 -","4","1","OM2158","Tamazyan, Rafael; Ayvazyan, Armen; Martirosyan, Ashot; Harutyunyan, Gohar; Raymond Schinazi","1-(4-Methylphenyl)-5-oxo-2-phenylpyrrolidine-2-carboxamide‒methanol (1/1)","Acta Crystallographica Section E","2007","63","10","o4017","o4017","10.1107/S1600536807043188","","","0.71073","MoKα","","0.0676","0.0431","","","0.0993","0.1102","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215628","8.3637","0.0012","10.1098","0.0015","11.6897","0.0017","90","","97.928","0.003","90","","979","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bromido[(1,2,5,6-η)-1,3,5,7-cyclooctatetraene]methylplatinum(II)","","- C9 H11 Br Pt -","- C9 H11 Br Pt -","- C36 H44 Br4 Pt4 -","4","1","OM2159","Song, Ah-Ran; Hwang, In-Chul; Ha, Kwang","Bromido[(1,2,5,6-η)-1,3,5,7-cyclooctatetraene]methylplatinum(II)","Acta Crystallographica Section E","2007","63","10","m2484","m2484","10.1107/S1600536807043279","","","0.71073","MoKα","","0.0786","0.0573","","","0.1674","0.1756","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215629","16.0658","0.0003","17.2662","0.0004","18.2153","0.0004","90","","90","","90","","5052.84","0.19","100","1","100","1","","","","","","","","2","P b c n","-P 2n 2ab","60","","1,4,10,19,25,41,55,60,67,69-Decakis(trifluoromethyl)- 1,4,10,19,25,41,55,60,67,69-decahydro(C~70~-D~5h~)[5,6]fullerene","","- C80 F30 -","- C80 F30 -","- C320 F120 -","4","0.5","OM2161","Shustova, Natalia B.; Peryshkov, Dimitry V.; Boltalina, Olga V.; Strauss, Steven H.","1,4,10,19,25,41,55,60,67,69-Decakis(trifluoromethyl)-1,4,10,19,25,41,55,60,67,69-decahydro(C~70~-<i>D</i>~5<i>h~</i>)[5,6]fullerene","Acta Crystallographica Section E","2007","63","10","o4073","o4073","10.1107/S1600536807043991","","","0.71073","MoKα","","0.1162","0.0531","","","0.1034","0.1244","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215630","9.2861","0.0019","13.026","0.003","15.722","0.003","90","","102.089","0.008","90","","1859.6","0.7","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N'-[(1E)-(5-chloro-2-hydroxyphenyl)(phenyl)methylene]-4- methoxybenzohydrazide","","- C21 H17 Cl N2 O3 -","- C21 H17 Cl N2 O3 -","- C84 H68 Cl4 N8 O12 -","4","1","PK2040","Jian-Guo Chang","<i>N</i>'-[(1<i>E</i>)-(5-Chloro-2-hydroxyphenyl)(phenyl)methylene]-4-methoxybenzohydrazide","Acta Crystallographica Section E","2007","63","10","o4022","o4022","10.1107/S1600536807043590","","","0.71073","MoKα","","0.0647","0.0425","","","0.1289","0.1498","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215631","7.2124","0.0004","10.1722","0.0006","10.4117","0.0006","65.904","0.001","76.889","0.001","74.014","0.001","664.62","0.07","89","2","89","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>-(3-Hydroxymethyl-5-nitrophenyl)acetamide dimethyl sulfoxide solvate","","- C11 H16 N2 O5 S -","- C11 H16 N2 O5 S -","- C22 H32 N4 O10 S2 -","2","1","PK2041","Khan, Gul S.; Lehmann, Anna L.; George R. Clark; Barker, David","<i>N</i>-(3-Hydroxymethyl-5-nitrophenyl)acetamide dimethyl sulfoxide solvate","Acta Crystallographica Section E","2007","63","10","o3983","o3983","10.1107/S1600536807042778","","","0.71073","MoKα","","0.0507","0.0382","","","0.0943","0.103","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215632","10.5303","0.0002","21.2894","0.0002","15.541","0.0002","90","","105.508","0.001","90","","3357.2","0.08","89","2","89","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Acetamido-5-nitrobenzyl acetate","","- C11 H12 N2 O5 -","- C11 H12 N2 O5 -","- C132 H144 N24 O60 -","12","3","PK2042","Khan, Gul S.; Lehmann, Anna L.; George R. Clark; Barker, David","3-Acetamido-5-nitrobenzyl acetate","Acta Crystallographica Section E","2007","63","10","o3984","o3984","10.1107/S160053680704278X","","","0.71073","MoKα","","0.057","0.041","","","0.1","0.11","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215633","9.1906","0.0011","23.704","0.003","9.3251","0.0013","90","","113.941","0.012","90","","1856.7","0.4","290","2","290","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-Triphenylmethyl-2,4-pentanedione","","- C24 H22 O2 -","- C24 H22 O2 -","- C96 H88 O8 -","4","1","PK2043","Sykora, Richard E.; Kalachnikova, Katrina; Spyridis, Greg T.","3-Triphenylmethyl-2,4-pentanedione","Acta Crystallographica Section E","2007","63","10","o4075","","10.1107/S1600536807043619","","","0.71073","MoKα","","0.1283","0.0471","","","0.1189","0.1476","","","","","","0.988","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215634","12.758","0.003","21.015","0.006","12.828","0.004","90","","90","","90","","3439.3","1.7","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Tetraaqua(2,2'-bipyridine)zinc(II) 4,4'-(6-diethylamino-1,3,5-triazine-2,4-diyldiimino)dibenzenesulfonate","","- C29 H36 N8 O10 S2 Zn -","- C29 H36 N8 O10 S2 Zn -","- C116 H144 N32 O40 S8 Zn4 -","4","0.5","PK2046","Jie Chen; Yuzhong Ruan","Tetraaqua(2,2'-bipyridine)zinc(II) 4,4'-(6-diethylamino-1,3,5-triazine-2,4-diyldiimino)dibenzenesulfonate","Acta Crystallographica Section E","2007","63","10","m2586","m2586","10.1107/S1600536807045849","","","0.71073","MoKα","","0.0624","0.0528","","","0.13","0.1362","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215635","4.7125","0.0012","8.032","0.002","9.997","0.003","80.49","0.015","81.977","0.015","77.324","0.014","361.99","0.17","193","2","193","2","","","","","","","","4","P 1","P 1","1","","2-(2-Hydroxyethyl)-6-[(2-hydroxyethyl)amino]-5-nitro- 1H-benzo[de]isoquinoline-1,3(2H)-dione","","- C16 H15 N3 O6 -","- C16 H15 N3 O6 -","- C16 H15 N3 O6 -","1","1","PV2026","Wen Qin; Ye Zhang; Heng-Shan Wang; Yong Zhang","2-(2-Hydroxyethyl)-6-[(2-hydroxyethyl)amino]-5-nitro-1<i>H</i>-benzo[<i>de</i>]isoquinoline-1,3(2<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","10","o3995","o3995","10.1107/S160053680704295X","","","0.7107","MoKα","","0.049","0.038","","","0.0796","0.0859","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215636","16.0277","0.0016","9.5884","0.0014","16.8714","0.0016","90","","93.892","0.008","90","","2586.8","0.5","85","0.1","85","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","[5,10,15,20-Tetrakis(4-<i>tert</i>-butylphenyl)porphyrinato-κ^4^N]zinc(II) toluene solvate","","- C67 H68 N4 Zn -","- C67 H68 N4 Zn -","- C134 H136 N8 Zn2 -","2","0.5","PV2028","Słota, Rudolf; Mele, Giuseppe; Ejsmont, Krzysztof; Domański, Andrzej A.; Sole, Roberta del","[5,10,15,20-Tetrakis(4-<i>tert</i>-butylphenyl)porphyrinato-κ^4^<i>N</i>]zinc(II) toluene solvate","Acta Crystallographica Section E","2007","63","10","m2582","m2582","10.1107/S1600536807045953","","","0.71073","MoKα","","0.0631","0.046","","","0.112","0.1221","","","","","","1.047","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215637","10.6339","0.0017","10.857","0.002","14.5207","0.0012","90","","91.819","0.01","90","","1675.6","0.4","213","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-N'-[(furan-2-yl)methylene]-2-hydroxy-2,2- diphenylacetohydrazide monohydrate","","- C19 H18 N2 O4 -","- C19 H18 N2 O4 -","- C76 H72 N8 O16 -","4","1","PV2031","Khanfar, Monther A.; Abu-Safieh, Kayed A.; Al-Far, Rawhi; Ali, Basem Fares; Maichle-Moessmer, Caecilia","(<i>E</i>)-<i>N</i>'-[(Furan-2-yl)methylene]-2-hydroxy-2,2-diphenylacetohydrazide monohydrate","Acta Crystallographica Section E","2007","63","10","o4078","o4079","10.1107/S1600536807044443","","","0.71073","MoKα","","0.1153","0.0493","","","0.1027","0.123","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215638","11.639","0.004","13.027","0.002","14.417","0.005","90","","90","","90","","2185.9","1.1","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Isocedrelone","17-furan-3-yl-6,15-dihydroxy-4,4,8,10,14-pentamethyl-8,9,10,11,12,14,15,16- octahydro-4<i>H</i>-cyclopenta[<i>a</i>]phenanthrene-3,7-dione","","- C26 H30 O5 -","- C26 H30 O5 -","- C104 H120 O20 -","4","1","RK2029","S. Soundarya Devi; R. Malathi; S. S. Rajan; V. P. Santhanakrishnan; S. Narasimhan","Isocedrelone","Acta Crystallographica Section E","2007","63","10","o3948","o3948","10.1107/S1600536807042201","","","0.71073","MoKα","","0.147","0.0587","","","0.1509","0.1875","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215639","11.8283","0.0009","12.4842","0.0009","14.134","0.001","97.971","0.001","91.017","0.001","98.036","0.001","2045.2","0.3","243","2","243","2","","","","","","","","6","P -1","-P 1","2","","Diaquabromido[N,N'-bis(2-pyridylmethylidene)cyclohexane-1,2- diamine]manganese(II) bromide dibromido[N,N'-bis(2-pyridylmethylidene)cyclohexane-1,2-diamine]manganese(II)","","- C36 H44 Br4 Mn2 N8 O2 -","- C36 H44 Br4 Mn2 N8 O2 -","- C72 H88 Br8 Mn4 N16 O4 -","2","1","RK2035","Hwang, In-Chul; Ha, Kwang","Diaquabromido[<i>N</i>,<i>N</i>'-bis(2-pyridylmethylidene)cyclohexane-1,2-diamine]manganese(II) bromide dibromido[<i>N</i>,<i>N</i>'-bis(2-pyridylmethylidene)cyclohexane-1,2-diamine]manganese(II)","Acta Crystallographica Section E","2007","63","10","m2465","m2465","10.1107/S1600536807042249","","","0.71073","MoKα","","0.0641","0.0442","","","0.1318","0.1369","","","","","","1.004","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215640","4.8362","0.0004","10.582","0.0009","10.1164","0.0007","90","","102.183","0.005","90","","506.06","0.07","296","2","296","2","","","","","","","","6","P 1 c 1","P -2yc","7","","catena-Poly[[dichloridozinc(II)]-μ-1-carboxylatomethyl-3-methylimidazolium-\ κ^2^O:O']","","- C6 H8 Cl2 N2 O2 Zn -","- C6 H8 Cl2 N2 O2 Zn -","- C12 H16 Cl4 N4 O4 Zn2 -","2","1","RK2036","Xia Shi; Jie Zhang; Tao-Kai Ying; Guo-Liang Zhao","<i>catena</i>-Poly[[dichloridozinc(II)]-μ-1-carboxylatomethyl-3-methylimidazolium-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","10","m2603","m2603","10.1107/S1600536807046545","","","0.71073","MoKα","","","0.0328","","","0.065","0.0681","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215641","6.0138","0.0009","7.1653","0.001","25.932","0.004","84.666","0.006","88.774","0.007","71.078","0.004","1052.4","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,10-Bis(2-aminophenoxy)decane","","- C22 H32 N2 O2 -","- C22 H32 N2 O2 -","- C44 H64 N4 O4 -","2","1","RK2040","Qi-Long Zhang; Xin-Chen Zhu; Yun-Qian Zhang; Bi-Xue Zhu","1,10-Bis(2-aminophenoxy)decane","Acta Crystallographica Section E","2007","63","10","o4039","o4039","10.1107/S1600536807043577","","","0.71073","MoKα","","0.0819","0.0478","","","0.119","0.1336","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215642","16.023","0.003","6.9877","0.0014","8.067","0.0016","90","","103.35","0.03","90","","878.8","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(m-Tolyl)thioacetamide","","- C9 H11 N S -","- C9 H11 N S -","- C36 H44 N4 S4 -","4","1","RK2046","Śmiszek-Lindert, Wioleta; Nowak, Maria; Kusz, Joachim","<i>N</i>-(<i>m</i>-Tolyl)thioacetamide","Acta Crystallographica Section E","2007","63","10","o4161","o4161","10.1107/S1600536807046582","","","0.71073","MoKα","","0.0939","0.0388","","","0.0797","0.0855","","","","","","0.809","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215643","7.4207","0.0004","7.3115","0.0004","16.421","0.001","90","","102.899","0.001","90","","868.46","0.09","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Tetrahydropyrimidin-2-ylideneammonium camphor-10-sulfonate","Tetrahydropyrimidin-2-ylideneammonium 2-oxobornane-10-sulfonate","","- C14 H25 N3 O4 S -","- C14 H25 N3 O4 S -","- C28 H50 N6 O8 S2 -","2","1","RN2027","Harrison, William T. A.","Tetrahydropyrimidin-2-ylideneammonium camphor-10-sulfonate","Acta Crystallographica Section E","2007","63","10","o4058","o4058","10.1107/S160053680704442X","","","0.71073","MoKα","","0.0417","0.0356","","","0.0947","0.0974","","","","","","1.087","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215644","7.323","0.003","6.985","0.003","13.982","0.006","90","","95.614","0.004","90","","711.8","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Pyridine-2,4-dicarboxylic acid N-oxide","","- C7 H5 N O5 -","- C7 H5 N O5 -","- C28 H20 N4 O20 -","4","1","RT2012","Hai-Ping Li; Wen-Shi Wu; Guo-Dong Yang; Guo-Xiang Liu","Pyridine-2,4-dicarboxylic acid <i>N</i>-oxide","Acta Crystallographica Section E","2007","63","10","o3950","o3950","10.1107/S160053680703992X","","","0.71073","MoKα","","0.0377","0.0346","","","0.0934","0.0959","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215645","8.7594","0.0007","28.192","0.003","8.516","0.0008","90","","109.885","0.002","90","","1977.6","0.3","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Z)-Ethyl 3-(4-chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxamido)- 2-cyano-3-(4-fluorophenyl)acrylate","","- C19 H18 Cl F N4 O3 -","- C19 H18 Cl F N4 O3 -","- C76 H72 Cl4 F4 N16 O12 -","4","1","RZ2156","Dehua Zhang; Xiaoyan Zhang; Yang Liu","(Z)-Ethyl 3-(4-chloro-3-ethyl-1-methyl-1<i>H</i>-pyrazole-5-carboxamido)-2-cyano-3-(4-fluorophenyl)acrylate","Acta Crystallographica Section E","2007","63","10","o4051","o4051","10.1107/S1600536807042699","","","0.71073","MoKα","","0.1437","0.0612","","","0.1227","0.1448","","","","","","0.906","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215646","8.175","0.0007","12.8971","0.0008","15.241","0.0006","73.509","0.01","86.259","0.012","74.206","0.01","1482.5","0.2","295","2","295","2","","","","","","","","3","P -1","-P 1","2","loureirin A","3-(2,4-dimethoxyphenyl)-1-(4-hydroxyphenyl)propan-1-one","","- C17 H18 O4 -","- C17 H18 O4 -","- C68 H72 O16 -","4","2","RZ2161","Yang, Shi-Ying; Lu, Yong-Bin; Zheng, Qi-Tai; Lu, Yang","Loureirin A","Acta Crystallographica Section E","2007","63","10","o3927","o3927","10.1107/S1600536807035520","","","0.71073","MoKα","","0.0893","0.0573","","","0.1625","0.1885","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215647","14.8957","0.0005","9.0402","0.0005","16.3565","0.0005","90","","94.865","0.003","90","","2194.63","0.16","120","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>cis</i>-Dichloridobis(diethylphenylphosphine-κP)platinum(II)","","- C20 H30 Cl2 P2 Pt -","- C20 H30 Cl2 P2 Pt -","- C80 H120 Cl8 P8 Pt4 -","4","1","RZ2163","Domańska-Babul, Wioleta; Pikies, Jerzy; Chojnacki, Jaroslaw","<i>cis</i>-Dichloridobis(diethylphenylphosphine-κ<i>P</i>)platinum(II)","Acta Crystallographica Section E","2007","63","10","m2583","m2583","10.1107/S1600536807045540","","","0.71073","MoKα","","","0.0248","","","","0.0889","","","","","","1.358","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215648","11.197","0.004","12.394","0.004","16.897","0.006","73.715","0.005","73.06","0.006","86.618","0.006","2152.5","1.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","catena-Poly[bis[μ-1,4-bis(2-pyrimidinylthio)butane-κ2N:N']disilver(I) diperchlorate chloroform sesquisolvate]","","- C51 H59 Ag4 Cl13 N16 O16 S8 -","- C51 H59 Ag4 Cl13 N16 O16 S8 -","- C51 H59 Ag4 Cl13 N16 O16 S8 -","1","0.5","SG2189","Wang, Shu-Li; Zheng, Yan","<i>catena</i>-Poly[bis[μ-1,4-bis(2-pyrimidinylthio)butane-κ^2^<i>N</i>:<i>N</i>']disilver(I) diperchlorate chloroform sesquisolvate]","Acta Crystallographica Section E","2007","63","10","m2528","m2528","10.1107/S1600536807043802","","","0.71073","MoKα","","0.1192","0.053","","","0.1347","0.167","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215649","7.703","0.002","8.409","0.002","11.454","0.003","69.97","0.005","85.267","0.005","66.655","0.005","638.8","0.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","1-(3,4-Dimethoxybenzoyl)-3,5-dimethyl-1H-pyrazole","","- C14 H16 N2 O3 -","- C14 H16 N2 O3 -","- C28 H32 N4 O6 -","2","1","SG2191","Saeed, Aamer; Mumtaz, Amara; Flörke, Ulrich","1-(3,4-Dimethoxybenzoyl)-3,5-dimethyl-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2007","63","10","o4122","o4122","10.1107/S1600536807044960","","","0.71073","MoKα","","0.0599","0.0451","","","0.1134","0.1203","","","","","","0.968","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215650","10.1102","0.0004","13.6587","0.0005","19.4363","0.0008","90","","90","","90","","2684","0.18","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(<i>S</i>,<i>S</i>,<i>R</i>p)-(+)-2-{1-[1-(2-diphenylphosphino ferrocenyl)ethyl]pyrrolidin-2-yl}propan-2-ol","","- C31 H36 Fe N O P -","- C31 H36 Fe N O P -","- C124 H144 Fe4 N4 O4 P4 -","4","1","SI2031","Liu, Jin-Ting; Mao, Yan-Jun; Xi, Ri-Muo; Dong, Wen-Liang","(<i>S</i>,<i>S</i>,<i>Rp</i>)-(+)-2-{1-[1-(2-Diphenylphosphinoferrocenyl)ethyl]pyrrolidin-2-yl}propan-2-ol","Acta Crystallographica Section E","2007","63","10","m2499","m2500","10.1107/S160053680704305X","","","0.71073","MoKα","","0.0442","0.0331","","","0.0817","0.0884","","","","","","0.921","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215651","6.8922","0.0004","22.8669","0.0013","8.0727","0.0005","90","","98.469","0.002","90","","1258.41","0.13","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-1,2-Bis(4-nitrophenyl)ethene","","- C14 H10 N2 O4 -","- C14 H10 N2 O4 -","- C56 H40 N8 O16 -","4","1","SI2032","Chenguan Chen; Chenzhong Cao","(<i>Z</i>)-1,2-Bis(4-nitrophenyl)ethene","Acta Crystallographica Section E","2007","63","10","o3999","o4000","10.1107/S1600536807042158","","","0.71073","MoKα","","0.0588","0.0426","","","0.1051","0.1157","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215652","10.158","0.005","10.158","0.005","28.747","0.005","90","","90","","120","","2568.9","1.8","293","2","293","2","","","","","","","","3","R 3 c :H","R 3 -2""c","161","1-Hydroxycyclobutane-1-carboxylic acid","1-Hydroxycyclobutane-1-carboxylic acid","","- C5 H8 O3 -","- C5 H8 O3 -","- C90 H144 O54 -","18","1","SI2033","Betz, Richard; Klüfers, Peter","1-Hydroxycyclobutane-1-carboxylic acid","Acta Crystallographica Section E","2007","63","10","o4032","o4032","10.1107/S1600536807043747","","","0.71073","MoKα","","0.0311","0.0293","","","0.0776","0.0794","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215653","9.067","0.0008","17.4159","0.0016","7.12","0.0006","90","","101.62","0.001","90","","1101.28","0.17","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-[Anthracene-9,10-diyldi(methylenethio)]dianiline","","- C28 H24 N2 S2 -","- C28 H24 N2 S2 -","- C56 H48 N4 S4 -","2","0.5","SI2034","Zhi-Gang Niu; Wei Zhong; Yi-Zhen Wang","2,2'-[Anthracene-9,10-diyldi(methylenethio)]dianiline","Acta Crystallographica Section E","2007","63","10","o4164","o4164","10.1107/S1600536807045837","","","0.71073","MoKα","","0.0684","0.0435","","","0.1315","0.1417","","","","","","1.005","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215654","7.415","0.005","12.621","0.008","14.4387","0.0013","90","","90","","90","","1351.2","1.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2'-(4-methoxybenzylidene)isonicotinohydrazide monohydrate","","- C14 H15 N3 O3 -","- C14 H15 N3 O3 -","- C56 H60 N12 O12 -","4","1","SJ2327","Lin, Min; Liu, Shi-Xiong","A new polymorph of 2'-(4-methoxybenzylidene)isonicotinohydrazide monohydrate","Acta Crystallographica Section E","2007","63","10","o3974","o3974","10.1107/S1600536807042067","","","0.71073","MoKα","","0.0763","0.0513","","","0.1249","0.1355","","","","","","1.094","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215655","13.8398","0.0012","17.4607","0.0016","20.3779","0.0018","90","","98.316","0.001","90","","4872.6","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-methoxido-κ^4^O:O-bis[bis(3-methyl-5-phenyl-1H-pyrazole- κN^2^)copper(II)] bis(perchlorate)","","- C42 H46 Cl2 Cu2 N8 O10 -","- C42 H46 Cl2 Cu2 N8 O10 -","- C168 H184 Cl8 Cu8 N32 O40 -","4","1","SJ2335","He, Hongshan; Sykes, Andrew G.","Di-μ-methoxido-κ^4^<i>O</i>:<i>O</i>-bis[bis(3-methyl-5-phenyl-1<i>H</i>-pyrazole-κ<i>N</i>^2^)copper(II)] bis(perchlorate)","Acta Crystallographica Section E","2007","63","10","m2448","m2448","10.1107/S1600536807042079","","","0.71073","MoKα","","0.1077","0.0494","","","0.1124","0.1372","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215656","8.6236","0.0011","5.6273","0.0007","23.958","0.003","90","","97.305","0.002","90","","1153.2","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(4-Methylphenyl)-1-(2-pyrrolyl)prop-2-en-1-one","","- C14 H13 N O -","- C14 H13 N O -","- C56 H52 N4 O4 -","4","1","SJ2339","Gong, Zhen-Qi; Shen, You-Liang","3-(4-Methylphenyl)-1-(2-pyrrolyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","10","o3939","o3939","10.1107/S1600536807041852","","","0.71073","MoKα","","0.0634","0.0505","","","0.1361","0.1451","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215657","8.2566","0.0006","14.1915","0.0013","12.9584","0.0009","90","","107.504","0.006","90","","1448.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dichlorido[N,N,N',N'-tetramethylcyclohexane-1,2-diamine-κ^2^N,N']zinc(II)","","- C10 H22 Cl2 N2 Zn -","- C10 H22 Cl2 N2 Zn -","- C40 H88 Cl8 N8 Zn4 -","4","1","SJ2341","Lee, Na Young; Yoon, Jong Uk; Jeong, Jong Hwa","Dichlorido[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylcyclohexane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>']zinc(II)","Acta Crystallographica Section E","2007","63","10","m2471","m2471","10.1107/S1600536807042675","","","0.71073","MoKα","","0.0732","0.067","","","0.1581","0.1593","","","","","","1.275","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215658","4.8098","0.0003","10.7863","0.0008","12.7709","0.0009","81.835","0.001","83.714","0.002","85.316","0.002","650.42","0.08","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","(2E)-1-(3-Bromo-2-thienyl)-3-(4-nitrophenyl)prop-2-en-1-one","","- C13 H8 Br N O3 S -","- C13 H8 Br N O3 S -","- C26 H16 Br2 N2 O6 S2 -","2","1","SJ2342","Harrison, William T. A.; Ashalatha, B. V.; Narayana, B.; Sarojini, B. K.; Yathirajan, H. S.","(2<i>E</i>)-1-(3-Bromo-2-thienyl)-3-(4-nitrophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","10","o4183","o4183","10.1107/S1600536807041736","","","0.71073","MoKα","","0.0624","0.0374","","","0.0859","0.0928","","","","","","0.883","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215659","11.769","0.0004","11.9057","0.0004","15.0898","0.0007","66.769","0.001","73.304","0.002","82.38","0.001","1860.57","0.13","96","","96","","","","","","","","","5","P -1","-P 1","2","","Methyltriphenylphosphonium bromide chloroform hemisolvate","","- C19.5 H18.5 Br Cl1.5 P -","- C19.5 H18.5 Br Cl1.5 P -","- C78 H74 Br4 Cl6 P4 -","4","2","SJ2343","Curnow, Owen J.; Robinson, Ward T.; Shang, Rong","Methyltriphenylphosphonium bromide chloroform hemisolvate","Acta Crystallographica Section E","2007","63","10","o3951","o3951","10.1107/S160053680704192X","","","0.71073","MoKα","","0.0371","0.0275","","","0.0869","0.1047","","","","","","0.796","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215660","20.288","0.002","14.5052","0.0018","15.227","0.002","90","","116.977","0.002","90","","3993.4","0.8","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis{2,4-dibromo-6-[(naphthalen-1-ylimino)methyl]phenolato-κ^2^N, O}(1,10-phenanthroline-κ^2^N,N')copper(II)","","- C46 H28 Br4 Cu N4 O2 -","- C46 H28 Br4 Cu N4 O2 -","- C184 H112 Br16 Cu4 N16 O8 -","4","0.5","SJ2345","Liu, Zheng; Jin, Li Xia; Xia, Jin Hong; Li, Guang Zhao","Bis{2,4-dibromo-6-[(naphthalen-1-ylimino)methyl]phenolato-κ^2^<i>N</i>,<i>O</i>}(1,10-phenanthroline-κ^2^<i>N,N</i>')copper(II)","Acta Crystallographica Section E","2007","63","10","m2488","","10.1107/S1600536807042882","","","0.71073","MoKα","","0.1295","0.0591","","","0.1288","0.1649","","","","","","0.973","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215661","12.8844","0.0008","12.335","0.0007","15.3485","0.0009","90","","112.471","0.001","90","","2254.1","0.2","446","2","446","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetramethyl-1-(4-chlorobenzyl)-3a,7a-dihydro-1<i>H</i>-indole-2,3,3a,4- tetracarboxylate","","- C23 H22 Cl N O8 -","- C23 H22 Cl N O8 -","- C92 H88 Cl4 N4 O32 -","4","1","SJ2346","Lee, Chang Kiu; Kang, Youngjin; Jeon, Kiuook; Moon, Suk-Hee; Park, Ki-Min","Tetramethyl-1-(4-chlorobenzyl)-3a,7a-dihydro-1<i>H</i>-indole-2,3,3a,4-tetracarboxylate","Acta Crystallographica Section E","2007","63","10","o4011","","10.1107/S1600536807042894","","","0.71073","MoKα","","0.0516","0.0362","","","0.0897","0.1017","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215662","18.475","0.002","10.3014","0.0013","19.723","0.003","90","","90","","90","","3753.6","0.8","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-(1H-Benzotriazol-1-yl)-1-(4-fluorobenzoyl)ethyl isonicotinate","","- C21 H15 F N4 O3 -","- C21 H15 F N4 O3 -","- C168 H120 F8 N32 O24 -","8","1","SJ2347","Jing Li; Wu-Lan Zeng; Ming-Hui Wang; Jun Wan","2-(1<i>H</i>-Benzotriazol-1-yl)-1-(4-fluorobenzoyl)ethyl isonicotinate","Acta Crystallographica Section E","2007","63","10","o4177","o4177","10.1107/S1600536807042900","","","0.71073","MoKα","","0.127","0.0569","","","0.1232","0.1562","","","","","","0.936","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215663","4.7749","0.0001","18.8511","0.0006","16.0164","0.0005","90","","97.931","0.002","90","","1427.88","0.07","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Heptazoline","2,8-Dihydroxy-1-(3-methylbut-2-enyl)-9H-carbazole-3-carbaldehyde","","- C18 H17 N O3 -","- C18 H17 N O3 -","- C72 H68 N4 O12 -","4","1","SJ2348","Hoong-Kun Fun; Surat Laphookhieo; Wisanu Maneerat; Suchada Chantrapromma","2,8-Dihydroxy-1-(3-methylbut-2-enyl)-9<i>H</i>-carbazole-3-carbaldehyde","Acta Crystallographica Section E","2007","63","10","o3964","o3965","10.1107/S1600536807042626","","","0.71073","MoKα","","0.0633","0.0443","","","0.1056","0.1162","","","","","","1.098","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215664","9.7031","0.0006","14.5684","0.001","14.7006","0.0009","90","","101.142","0.002","90","","2038.9","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dicarbonyl-bis(1,10-phenanthroline)molybdenum(0)","","- C26 H16 Mo N4 O2 -","- C26 H16 Mo N4 O2 -","- C104 H64 Mo4 N16 O8 -","4","1","SJ2349","Muir, Kathleen J.; McQuillan, Geoffrey P.; Harrison, William T. A.","Dicarbonyl-bis(1,10-phenanthroline)molybdenum(0)","Acta Crystallographica Section E","2007","63","10","m2491","m2491","10.1107/S1600536807042791","","","0.71073","MoKα","","0.0948","0.0542","","","0.1256","0.1414","","","","","","0.952","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215665","10.247","0.002","16.718","0.003","12.107","0.002","90","","94.82","0.03","90","","2066.7","0.7","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,6-Dimorpholino-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazin-2-amine","","- C19 H34 N6 O2 -","- C19 H34 N6 O2 -","- C76 H136 N24 O8 -","4","1","SJ2350","Dong, Jun-Ying; Huang, Peng-Mian","4,6-Dimorpholino-<i>N</i>-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazin-2-amine","Acta Crystallographica Section E","2007","63","10","o4028","o4028","10.1107/S1600536807043462","","","0.71073","MoKα","","0.0458","0.0389","","","0.0983","0.1032","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215666","16.232","0.003","13.54","0.002","13.997","0.003","90","","105.821","0.002","90","","2959.7","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(azido)(μ-azido)bis{2-[(2-dimethylaminoethylimino)methyl]- 6-methoxyphenolato}dicopper(II) monohydrate","","- C24 H38 Cu2 N10 O6 -","- C24 H38 Cu2 N10 O6 -","- C96 H152 Cu8 N40 O24 -","4","1","SJ2351","Yun-Peng Diao; Kun Li","Aqua(azido)(μ-azido)bis{2-[(2-dimethylaminoethylimino)methyl]-6-methoxyphenolato}dicopper(II) monohydrate","Acta Crystallographica Section E","2007","63","10","m2496","m2497","10.1107/S1600536807043267","","","0.71073","MoKα","","0.1186","0.0664","","","0.1523","0.1775","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215667","8.4272","0.0006","9.0905","0.0007","10.4381","0.0007","89.525","0.001","66.852","0.001","87.722","0.001","734.66","0.09","292","2","297","2","","","","","","","","6","P -1","-P 1","2","","4-(2-Chlorobenzylidenehydrazinocarbonyl)-2-methyl-2H-pyrazole-3-sulfonic acid amide","","- C12 H12 Cl N5 O3 S -","- C12 H12 Cl N5 O3 S -","- C24 H24 Cl2 N10 O6 S2 -","2","1","SJ2353","Jia-Jia Wei; Wei-Dong Wang; Wen-Ying Li; Hong-Wu He","4-(2-Chlorobenzylidenehydrazinocarbonyl)-2-methyl-2<i>H</i>-pyrazole-3-sulfonamide","Acta Crystallographica Section E","2007","63","10","o4057","o4057","10.1107/S1600536807044054","","","0.71073","MoKα","","0.0507","0.0428","","","0.1219","0.1362","","","","","","1.112","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215668","16.9804","0.0006","16.9804","0.0006","17.4605","0.0011","90","","90","","120","","4360","0.4","293","2","293","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","tris(<i>tert</i>-butylisonitrile)hexacarbonyl-μ~3~-ethylidyne- triangulo-tricobalt(I)(3 Co—Co)","","- C23 H30 Co3 N3 O6 -","- C23 H29.997 Co3 N3 O6 -","- C138 H179.982 Co18 N18 O36 -","6","0.333333","SJ2355","Brown, Jolene M.; Nicholson, Brian K.","Tris(<i>tert</i>-butylisonitrile)hexacarbonyl-μ~3~-ethylidyne-<i>triangulo</i>-tricobalt(I)(3 <i>Co{—</i>Co})","Acta Crystallographica Section E","2007","63","10","m2542","m2542","10.1107/S1600536807044261","","","0.71073","MoKα","","0.0322","0.0247","","","0.0561","0.0592","","","","","","1.001","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215669","7.9906","0.0007","20.5197","0.0016","13.6338","0.001","90","","97.273","0.003","90","","2217.5","0.3","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6-Chloro-N4-(2,2,6,6-tetramethylpiperidin-4-yl)-N2-(2,4,4- trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine","","- C20 H37 Cl N6 -","- C20 H37 Cl N6 -","- C80 H148 Cl4 N24 -","4","1","SJ2356","Dong, Jun-Ying; Huang, Peng-Mian","6-Chloro-<i>N</i>^4^-(2,2,6,6-tetramethylpiperidin-4-yl)-<i>N</i>^2^-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine","Acta Crystallographica Section E","2007","63","10","o4113","o4113","10.1107/S1600536807045035","","","0.7107","MoKα","","0.0482","0.0443","","","0.0996","0.1022","","","","","","1.092","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215670","16.221","0.003","8.4722","0.0018","10.136","0.002","90","","90","","90","","1393","0.5","292","2","292","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","N,N'-[Methylenedi(3,5-dimethyl-o-phenylene)]diphthalimide","","- C33 H26 N2 O4 -","- C33 H26 N2 O4 -","- C66 H52 N4 O8 -","2","0.5","SJ2357","Hai-Ling Xi; Jian-Ming Zhang; Yi-Tao Li","<i>N</i>,<i>N</i>'-[Methylenedi(3,5-dimethyl-<i>o</i>-phenylene)]diphthalimide","Acta Crystallographica Section E","2007","63","10","o4176","o4176","10.1107/S1600536807046624","","","0.71073","MoKα","","0.071","0.0486","","","0.125","0.1353","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215671","8.189","0.002","10.252","0.002","11.38","0.002","107.629","0.002","102.061","0.002","108.185","0.004","815","0.3","298","2","173","2","","","","","","","","4","P -1","-P 1","2","","Bis[μ-5-(pyrazin-2-yl)tetrazol-1-ido]bis[azido(2,2'-bipyridine)copper(II)]","","- C30 H22 Cu2 N22 -","- C30 H22 Cu2 N22 -","- C30 H22 Cu2 N22 -","1","0.5","SJ2359","Yan-Jun Zhang; Xin Fang; Ming-Lei Cao; Hai-Yang Yu; Jun-Dong Wang","Bis[μ-5-(pyrazin-2-yl)tetrazol-1-ido]bis[azido(2,2'-bipyridine)copper(II)]","Acta Crystallographica Section E","2007","63","10","m2630","m2630","10.1107/S1600536807046764","","","0.71069","MoKα","","0.071","0.0621","","","0.1599","0.1739","","","","","","1.083","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215672","7.677","0.003","13.929","0.005","12.173","0.005","90","","99.008","0.005","90","","1285.6","0.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(di-2-pyridylmethanediol-κ^2^N,N')palladium(II) bis(perchlorate)","","- C22 H20 Cl2 N4 O12 Pd -","- C22 H20 Cl2 N4 O12 Pd -","- C44 H40 Cl4 N8 O24 Pd2 -","2","0.5","SJ2361","Li, Ya-Min; Zhao, Xiao-Wei; Zhang, Jing-Lai","Bis(di-2-pyridylmethanediol-κ^2^<i>N</i>,<i>N</i>')palladium(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","10","m2585","m2585","10.1107/S1600536807045722","","","0.71073","MoKα","","0.0566","0.0462","","","0.1018","0.1074","","","","","","1.122","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215673","14.069","0.003","15.312","0.003","16.036","0.003","90","","90","","90","","3454.5","1.2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Aqua(hexamethylenetetramine-κN)bis(methanol)bis(thiocyanato-κN)nickel(II)","","- C10 H22 N6 Ni O3 S2 -","- C10 H22 N6 Ni O3 S2 -","- C80 H176 N48 Ni8 O24 S16 -","8","1","SJ2363","Bai, Yan; Shang, Wei-Li; Zhang, Fu-Lian; Pan, Xiao-Jing; Niu, Xiao-Fang","Aqua(hexamethylenetetramine-κ<i>N</i>)bis(methanol)bis(thiocyanato-κ<i>N</i>)nickel(II)","Acta Crystallographica Section E","2007","63","10","m2628","m2628","10.1107/S1600536807046648","","","0.71073","MoKα","","0.0448","0.0309","","","0.0711","0.0773","","","","","","1.015","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215674","20.0202","0.0004","18.916","0.0003","23.4108","0.0004","90","","90","","90","","8865.7","0.3","93","2","93","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","4-Dimethylaminopyridinium tetrakis[3,3,3-trifluoro-1-(2-thienylcarbonyl)prop-1-en-2-olato]europate(III)","","- C39 H27 Eu F12 N2 O8 S4 -","- C39 H27 Eu F12.003 N2 O8 S4 -","- C312 H216 Eu8 F96.024 N16 O64 S32 -","8","1","TK2189","Wei, Xiu-Cheng; Bian, Yu-Kun; Yu, Kai-Bei; He, De-Yan","4-Dimethylaminopyridinium tetrakis[3,3,3-trifluoro-1-(2-thienylcarbonyl)prop-1-en-2-olato]europate(III)","Acta Crystallographica Section E","2007","63","10","m2566","m2566","10.1107/S1600536807045667","","","0.71073","MoKα","","0.034","0.032","","","0.084","0.085","","","","","","1","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215675","11.6304","0.0007","11.6304","0.0007","8.7665","0.001","90","","90","","90","","1185.81","0.17","293","2","293","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","Poly[bis(μ~2~-4-pyridinecarboxylato-κ^3^N:O,O')cobalt(II)]","","- C12 H8 Co N2 O4 -","- C12 H8 Co N2 O4 -","- C48 H32 Co4 N8 O16 -","4","0.5","TK2191","Hao, Hong-Qin; Peng, Meng-Xia; Chen, Zi-Yun","Poly[bis(μ~2~-4-pyridinecarboxylato-κ^3^<i>N</i>:<i>O</i>,<i>O</i>')cobalt(II)]: a triply interpenetrated structure with diamonoid topology","Acta Crystallographica Section E","2007","63","10","m2605","m2605","10.1107/S1600536807046314","","","0.71073","MoKα","","0.029","0.027","","","0.062","0.063","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215676","4.2227","0.0004","12.2001","0.0012","15.4865","0.0016","90","","97.506","0.002","90","","790.99","0.14","291","2","291","2","","","","","","","","5","P 1 n 1","P -2yac","7","","1-(4-Aminophenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one‒1-(4- aminophenyl)-3-(3-bromo-4,5-trimethoxyphenyl)prop-2-en-1-one (0.972/0.028)","","- C17.97 H18.91 Br0.03 N O3.97 -","- C17.972 H18.916 Br0.028 N O3.972 -","- C35.944 H37.832 Br0.056 N2 O7.944 -","2","1","TK2192","Harrison, William T. A.; H. J. Ravindra; M. R. Suresh Kumar; S. M. Dharmaprakash","1-(4-Aminophenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one‒1-(4-aminophenyl)-3-(3-bromo-4,5-trimethoxyphenyl)prop-2-en-1-one (0.972/0.028)","Acta Crystallographica Section E","2007","63","10","o3970","o3970","10.1107/S1600536807041840","","","0.71073","MoKα","","0.042","0.036","","","0.094","0.098","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215677","11.1385","0.0016","6.4148","0.0012","24.49","0.002","90","","96.254","0.002","90","","1739.4","0.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-{[4-(Trimethylstannylthio)phenylimino]methyl}phenol","","- C16 H19 N O S Sn -","- C16 H19 N O S Sn -","- C64 H76 N4 O4 S4 Sn4 -","4","1","TK2193","Jikun Li; Chunlin Ma; Guofang He","2-{[4-(Trimethylstannylthio)phenylimino]methyl}phenol","Acta Crystallographica Section E","2007","63","10","m2498","m2498","10.1107/S1600536807043371","","","0.71073","MoKα","","0.076","0.054","","","0.148","0.165","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215678","20.929","0.007","8.945","0.003","17.232","0.006","90","","109.905","0.004","90","","3033.3","1.8","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3,3,4,4,5,5-Hexafluoro-1,2-bis(5-formyl-2-n-heptyl-3-thienyl)cyclopent-1-ene","","- C29 H34 F6 O2 S2 -","- C29 H34 F6 O2 S2 -","- C116 H136 F24 O8 S8 -","4","0.5","TK2194","Zhu, Shengsheng; Rao, Yi; Liu, Gang; Xie, Yihui; Pu, Shouzhi","3,3,4,4,5,5-Hexafluoro-1,2-bis(5-formyl-2-<i>n</i>-heptyl-3-thienyl)cyclopent-1-ene: a new photochromic diarylethene compound","Acta Crystallographica Section E","2007","63","10","o4175","o4175","10.1107/S1600536807046326","","","0.71073","MoKα","","0.071","0.062","","","0.17","0.181","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215679","9.5561","0.001","9.6073","0.0011","30.11","0.003","92.064","0.002","95.43","0.002","104.936","0.003","2653.7","0.5","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","[4-(2-Hydroxybenzylideneamino)benzenethiolato]triphenyltin(IV)","","- C31 H25 N O S Sn -","- C31 H25 N O S Sn -","- C124 H100 N4 O4 S4 Sn4 -","4","2","TK2196","Jianquan Du; Jikun Li; Chunlin Ma; Guofang He","[4-(2-Hydroxybenzylideneamino)benzenethiolato]triphenyltin(IV)","Acta Crystallographica Section E","2007","63","10","m2599","m2599","10.1107/S1600536807046338","","","0.71073","MoKα","","0.092","0.064","","","0.129","0.142","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215680","8.5825","0.0004","17.2754","0.0007","26.6505","0.0011","90","","90","","90","","3951.4","0.3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Triphenylphosphine oxide‒succinimide (1/1)","","- C22 H20 N O3 P -","- C22 H20 N O3 P -","- C176 H160 N8 O24 P8 -","8","1","TK2197","Harrison, William T. A.","Triphenylphosphine oxide‒succinimide (1/1)","Acta Crystallographica Section E","2007","63","10","o4182","o4182","10.1107/S1600536807047356","","","0.71073","MoKα","","0.081","0.044","","","0.109","0.121","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215681","25.4423","0.0016","14.1495","0.0007","22.6519","0.0011","90","","107.07","0.005","90","","7795.4","0.8","100","1","100","1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,4,7,11,18,21,24,31,35,39,51,58,61,64-Tetradecakis(trifluoromethyl)- 1,4,7,11,18,21,24,31,35,39,51,58,61,64- tetradecahydro(C~70~-D~5h~)[5,6]fullerene p-xylene trisolvate","","- C108 H30 F42 -","- C108 H30 F42 -","- C432 H120 F168 -","4","0.5","WK2073","Shustova, Natalia B.; Peryshkov, Dimitry V.; Kareev, Ivan E.; Boltalina, Olga V.; Strauss, Steven H.","1,4,7,11,18,21,24,31,35,39,51,58,61,64-Tetradecakis(trifluoromethyl)-1,4,7,11,18,21,24,31,35,39,51,58,61,64-tetradecahydro(C~70~‒<i>D</i>~5<i>h~</i>)[5,6]fullerene <i>p</i>-xylene trisolvate","Acta Crystallographica Section E","2007","63","10","o3928","o3929","10.1107/S1600536807040755","","","0.71073","MoKα","","0.0835","0.0548","","","0.142","0.161","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215682","9.8816","0.0015","13.382","0.002","15.173","0.002","90","","102.431","0.003","90","","1959.4","0.5","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(5,8-diazoniadispiro[4.2.4.2]tetradecane) hexakis(thiocyanato-κN)- manganate(II)","","- C30 H48 Mn N10 S6 -","- C30 H48 Mn N10 S6 -","- C60 H96 Mn2 N20 S12 -","2","0.5","WM2137","Li, Yu-Xiao; Guo, Xiao-Ling; Wang, Zheguang; Niu, Yunyin","Bis(5,8-diazoniadispiro[4.2.4.2]tetradecane) hexakis(thiocyanato-κ<i>N</i>)manganate(II)","Acta Crystallographica Section E","2007","63","10","m2568","m2568","10.1107/S1600536807044753","","","0.71073","MoKα","","0.0621","0.0457","","","0.1268","0.1411","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215683","6.6361","0.0014","8.1378","0.0018","11.087","0.003","81.246","0.018","80.32","0.018","76.302","0.018","569.5","0.2","120","2","","","","","","","","","","6","P -1","-P 1","2","","Bis(benzylammonium) tetraaqua[bis(sulfato)cadmate(II)]","","- C14 H28 Cd N2 O12 S2 -","- C14 H28 Cd N2 O12 S2 -","- C14 H28 Cd N2 O12 S2 -","1","0.5","WM2138","Amini, Mostafa M.; Mohammadnezhad, Gholamhossein Sh.; Khavasi, Hamid Reza","Bis(benzylammonium) tetraaqua[bis(sulfato)cadmate(II)]","Acta Crystallographica Section E","2007","63","10","m2516","m2516","10.1107/S1600536807043504","","","0.71073","MoKα","","","0.0195","","","","0.052","","","","","","1.091","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215684","10.372","0.004","7.602","0.003","14.559","0.009","90","","92.05","0.05","90","","1147.2","1","295","2","293","5","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","Tetraphenylphosphonium dibromidoaurate(I)","","- C24 H20 Au Br2 P -","- C24 H20 Au Br2 P -","- C48 H40 Au2 Br4 P2 -","2","0.5","WM2140","Cassandra L. Noack; Robbie W. Buckley; Peter C. Healy","Tetraphenylphosphonium dibromidoaurate(I)","Acta Crystallographica Section E","2007","63","10","m2459","m2459","10.1107/S160053680704216X","","","0.7107","MoKα","","0.0946","0.0302","","","0.0707","0.0886","","","","","","0.994","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215685","7.8731","0.0001","7.8731","0.0001","7.8731","0.0001","90","","90","","90","","488.02","0.011","291","0.3","291","0.3","","","","","","","","3","P a -3","-P 2ac 2ab 3","205","Hydrazine Dihydrochloride","Hydrogenhydrazinium dichloride","","- Cl2 H6 N2 -","- Cl2 H6 N2 -","- Cl8 H24 N8 -","4","0.166667","WM2141","Kruszynski, Rafal; Trzesowska, Agata","Redetermination of hydrogenhydrazinium dichloride","Acta Crystallographica Section E","2007","63","10","i179","i179","10.1107/S1600536807042523","","","0.71073","MoKα","","0.0172","0.0172","","","0.0437","0.0437","","","","","","1.335","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215686","10.3272","0.0005","10.3272","0.0005","37.132","0.002","90","","90","","120","","3429.6","0.3","293","2","293","2","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","Nonacalcium chromium(III) heptakis(orthophosphate)","","- Ca9 Cr O28 P7 -","- Ca9 Cr O28 P7 -","- Ca54 Cr6 O168 P42 -","6","0.333333","WM2144","Zatovsky, Igor V.; Strutynska, Nataliya Yu.; Baumer, Vyacheslav N.; Shishkin, Oleg V.; Slobodyanik, Nikolay S.","The whitlockite-related phosphate Ca~9~Cr(PO~4~)~7~","Acta Crystallographica Section E","2007","63","10","i180","i181","10.1107/S1600536807044765","","","0.71073","MoKα","","","0.0297","","","","0.0734","","","","","","1.104","","","","has coordinates,has Fobs","282542","2023-04-10","17:14:06",""
"2215687","4.9822","0.0007","4.9822","0.0007","4.9822","0.0007","90","","90","","90","","123.67","0.03","120","2","120","2","","","","","","","","3","P m -3 m","-P 4 2 3","221","","tripraseodinium indium oxide","","- In O Pr3 -","- In O Pr3 -","- In O Pr3 -","1","0.0208333","WM2146","Christianson, Andrew D.; Bobev, Svilen","Pr~3~InO: re-assessment of the cubic Pr~3~In structure","Acta Crystallographica Section E","2007","63","10","i184","i184","10.1107/S1600536807046727","","","0.71073","MoKα","","0.0255","0.023","","0.059","","0.0574","","","","","","1.287","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215688","4.7748","0.0007","23.629","0.007","8.34","0.003","90","","103.94","0.03","90","","913.2","0.5","293","2","","","","","","","","","","5","C 1 c 1","C -2yc","9","","4-carbamoylpyridinium dihydrogen phosphate","","- C6 H9 N2 O5 P -","- C6 H9 N2 O5 P -","- C24 H36 N8 O20 P4 -","4","1","WN2188","Gholivand, Khodayar; Zare , Karim; Afshar, Farzaneh; Shariatinia, Zahra; Khavasi, Hamid Reza","4-Carbamoylpyridinium dihydrogen phosphate","Acta Crystallographica Section E","2007","63","10","o4027","o4027","10.1107/S1600536807042869","","","0.71073","MoKα","","","0.0242","","","","0.0855","","","","","","1.272","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215689","5.557","0.0001","20.8433","0.0004","17.4142","0.0003","90","","93.54","0.002","90","","2013.17","0.06","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Hydroflumethiazide dimethylsulfoxide disolvate","3,4-dihydro-6-(trifluoromethyl)-2<i>H</i>-1,2,4-benzothiadiazine-7- sulfonamide 1,1-dioxide dimethyl sulfoxide disolvate","","- C12 H20 F3 N3 O6 S4 -","- C12 H20 F3 N3 O6 S4 -","- C48 H80 F12 N12 O24 S16 -","4","1","WN2189","Fernandes, Philippe; Johnston, Andrea; Leech, Charlotte K.; Shankland, Kenneth; David, William I. F.; Florence, Alastair J.","Hydroflumethiazide dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2007","63","10","o3956","o3956","10.1107/S1600536807039931","","","0.71073","MoKα","","0.0615","0.0401","","","0.0877","0.0967","","","","","","1.037","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215690","8.302","0.004","10.15","0.002","13.56","0.005","90","","95.33","0.003","90","","1137.7","0.7","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","1,2 dihydrocedrelone","7-furan-3-yl-6-hydroxy-4,4,8,10,13-pentamethyl-1,8,9,10,11,12,13,15,16,17- decahydro-2H,4H-20-oxacyclopropa[14,15]cyclopenta[<i>a</i>]phenanthrene- 3,7-dione","","- C26 H32 O5 -","- C26 H32 O5 -","- C52 H64 O10 -","2","1","WN2196","S. Soundarya Devi; S. S. Rajan; R. Mohan Kumar; S. Narasimhan","1,2-Dihydrocedrelone","Acta Crystallographica Section E","2007","63","10","o3963","o3963","10.1107/S1600536807042535","","","1.54184","CuKα","","0.0657","0.0617","","","0.1714","0.1893","","","","","","0.797","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215691","8.2985","0.0005","21.5271","0.0014","8.3676","0.0005","90","","105.58","0.003","90","","1439.89","0.16","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","chlorothiazide formic acid solvate (1/2)","6-chloro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide methanoic acid disolvate","","- C9 H10 Cl N3 O8 S2 -","- C9 H10 Cl N3 O8 S2 -","- C36 H40 Cl4 N12 O32 S8 -","4","1","WN2197","Johnston, Andrea; Florence, Alastair J.; Kennedy, Alan R.","Chlorothiazide formic acid solvate (1/2)","Acta Crystallographica Section E","2007","63","10","o4021","o4021","10.1107/S1600536807042845","","","0.71073","MoKα","","0.0887","0.0519","","","","0.114","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215692","10.0411","0.0008","20.15","0.0016","12.1807","0.0007","90","","117.534","0.005","90","","2185.4","0.3","297","2","297","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Gerontoxanthone I methanol solvate","4-(1,1-dimethylprop-2-enyl)-1,3,5,6-tetrahydroxy-2-(3-methylbut-2-enyl)- 9<i>H</i>-xanthen-9-one methanol solvate","","- C24 H28 O7 -","- C24 H28 O7 -","- C96 H112 O28 -","4","1","WN2198","Nawong Boonnak; Hoong-Kun Fun; Suchada Chantrapromma; Chatchanok Karalai","Gerontoxanthone I methanol solvate","Acta Crystallographica Section E","2007","63","10","o3958","o3959","10.1107/S1600536807041906","","","0.71073","MoKα","","0.0519","0.048","","","0.1357","0.1414","","","","","","1.051","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215693","7.061","0.003","7.052","0.002","24.959","0.011","90","","93.997","0.018","90","","1239.8","0.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3-Benzylamino-1,2-benzisothiazole 1,1-dioxide","","","- C14 H12 N2 O2 S -","- C14 H12 N2 O2 S -","- C56 H48 N8 O8 S4 -","4","1","WN2201","Siddiqui, Waseeq Ahmad; Ahmad, Saeed; Siddiqui, Hamid Latif; Tariq, Muhammad Ilyas; Parvez, Masood","3-Benzylamino-1,2-benzisothiazole 1,1-dioxide","Acta Crystallographica Section E","2007","63","10","o4001","","10.1107/S1600536807043036","","","0.71073","MoKα","","0.0492","0.0361","","","0.085","0.0922","","","","","","1.039","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215694","10.6174","0.0004","14.2451","0.0009","10.8862","0.0006","90","","111.795","0.003","90","","1528.8","0.14","183","2","183","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-Acetyl-1,3-dicyclohexyurea","","- C15 H26 N2 O2 -","- C15 H26 N2 O2 -","- C60 H104 N8 O8 -","4","1","WN2203","Imhof, Wolfgang","1-Acetyl-1,3-dicyclohexylurea","Acta Crystallographica Section E","2007","63","10","o4036","o4037","10.1107/S1600536807043656","","","0.71073","MoKα","","0.0747","0.0443","","","0.1027","0.1078","","","","","","0.95","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215695","11.8983","0.0003","14.3772","0.0003","15.1835","0.0003","90","","90","","90","","2597.35","0.1","100","0.1","100","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","24-Norolean-12-en-28-oic acid, 2,19-dihydroxy-3-oxo-,(2α, 4α, 19α) monohydrate","2,19-Dihydroxy-3-oxo-(2α,4α,19α)-24-nor-olean-12-en-28-oic acid monohydrate","","- C29 H46 O6 -","- C29 H46 O6 -","- C116 H184 O24 -","4","1","WN2205","Watcharee Waratchareeyakul; Kittisak Seatyoa; Suchada Chantrapromma; Hoong-Kun Fun","2,19-Dihydroxy-3-oxo-(2α,4α,19α)-24-nor-olean-12-en-28-oic acid monohydrate","Acta Crystallographica Section E","2007","63","10","o4062","o4063","10.1107/S1600536807044339","","","0.71073","MoKα","","0.0428","0.039","","","0.1071","0.11","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215696","6.7327","0.0011","10.1503","0.0017","20.249","0.003","78.521","0.003","83.357","0.003","77.113","0.003","1318.3","0.4","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","Poly[bis(μ~3~-benzene-1,4-dicarboxylato-κ^4^O:O':O'',O''')bis(1- methylpyrrolidin-2-one-κO)dilead(II)]","","- C26 H26 N2 O10 Pb2 -","- C26 H26 N2 O10 Pb2 -","- C52 H52 N4 O20 Pb4 -","2","1","WW2082","Du, Chao; Yang, Shi-Yao; Huang, Rong-Bin","Poly[bis(μ~3~-benzene-1,4-dicarboxylato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'',<i>O</i>''')bis(1-methylpyrrolidin-2-one-κ<i>O</i>)dilead(II)]","Acta Crystallographica Section E","2007","63","10","m2476","m2476","10.1107/S1600536807037981","","","0.71073","MoKα","","0.0396","0.0334","","","0.0764","0.0792","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215697","14.0563","0.0002","6.6947","0.0001","17.2336","0.0003","90","","97.408","0.001","90","","1608.19","0.04","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Pentaaqua(1,3,5-triazinanyl-2,4,6-trione)iron(II) 1,3,5-triazinanate-2,4,6-trione dihydrate","Pentaaqua(isocyanurato)iron(II) isocyanurate dihydrate","","- C6 H18 Fe N6 O13 -","- C6 H18 Fe N6 O13 -","- C24 H72 Fe4 N24 O52 -","4","1","WW2093","Liu, Mao-Sheng; Zhou, Zheng-Yuan; Zhu, Li-Cai; Zhou, Xiu-Xia; Cai, Yue-Peng","Pentaaqua(isocyanurato)iron(II) isocyanurate dihydrate","Acta Crystallographica Section E","2007","63","10","m2578","","10.1107/S1600536807045060","","","0.71073","MoKα","","0.0452","0.0367","","","0.1064","0.1128","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215698","7.792","0.002","7.602","0.002","24.746","0.007","90","","93.61","0.005","90","","1462.9","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","7,9-Dimethyl-3-phenylnaphtho[1,2-b]furan-4,5-dione","","- C20 H14 O3 -","- C20 H14 O3 -","- C80 H56 O12 -","4","1","WW2097","Shen, Yudong; Tian, Yuan-Xin; Bu, Xian-Zhang","7,9-Dimethyl-3-phenylnaphtho[1,2-<i>b</i>]furan-4,5-dione","Acta Crystallographica Section E","2007","63","10","o4125","o4125","10.1107/S1600536807045059","","","0.71073","MoKα","","0.0517","0.0401","","","0.1083","0.1186","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215699","14.78","0.005","8.762","0.003","11.576","0.004","90","","104.193","0.005","90","","1453.4","0.9","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-{N'-[3-(Dimethylammonio)propyl]oxamido}benzoate","","- C14 H19 N3 O4 -","- C14 H19 N3 O4 -","- C56 H76 N12 O16 -","4","1","XU2306","Han, Ya-Ting; Li, Yan-Tuan; Wu, Zhi-Yong; Sun, Wei; Zhu, Chun-Yuan","2-{<i>N</i>'-[3-(Dimethylammonio)propyl]oxamido}benzoate","Acta Crystallographica Section E","2007","63","10","o3945","o3945","10.1107/S1600536807040676","","","0.71073","MoKα","","0.115","0.051","","","0.114","0.139","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215701","11.3232","0.0003","10.338","0.0002","11.8925","0.0003","90","","96.069","0.002","90","","1384.32","0.06","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl (9-oxo-9,10-dihydroacridin-10-yl)acetate","","- C17 H15 N O3 -","- C17 H15 N O3 -","- C68 H60 N4 O12 -","4","1","XU2311","Karol Krzymiński; Artur Sikorski; Jerzy Błażejowski","Ethyl (9-oxo-9,10-dihydroacridin-10-yl)acetate","Acta Crystallographica Section E","2007","63","10","o3972","o3973","10.1107/S1600536807042663","","","0.71073","MoKα","","0.0486","0.0365","","","0.0913","0.0954","","","","","","0.984","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215702","17.623","0.003","14.587","0.002","9.7581","0.0015","90","","94.199","0.002","90","","2501.7","0.7","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(2,9-Dimethyl-1,10-phenanthroline-κ^2^N,N')bis(3-hydroxybenzoato-κO) copper(II)","","- C28 H22 Cu N2 O6 -","- C28 H22 Cu N2 O6 -","- C112 H88 Cu4 N8 O24 -","4","0.5","XU2313","Zhao, Pei-Zheng; Yan, Feng-Mei; Xuan, Xiao-Peng; Tang, Qing-Hu","(2,9-Dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bis(3-hydroxybenzoato-κ<i>O</i>) copper(II)","Acta Crystallographica Section E","2007","63","10","m2523","m2523","10.1107/S1600536807043449","","","0.71073","MoKα","","0.0534","0.0378","","","0.0953","0.1048","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215703","9.4407","0.0001","5.3902","0.0002","18.6522","0.0003","90","","94.036","0.01","90","","946.81","0.04","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2-(1H-Benzimidazol-1-yl)-1-(furan-2-yl)ethanone O-2,4-dichlorobenzyloxime","","- C20 H15 Cl2 N3 O2 -","- C20 H15 Cl2 N3 O2 -","- C40 H30 Cl4 N6 O4 -","2","1","XU2319","Özel Güven, Özden; Erdoğan, Taner; Çaylak, Nagihan; Hökelek, Tuncer","2-(1<i>H</i>-Benzimidazol-1-yl)-1-(furan-2-yl)ethanone <i>O</i>-2,4-dichlorobenzyloxime","Acta Crystallographica Section E","2007","63","10","o4090","o4091","10.1107/S1600536807045345","","","0.71073","MoKα","","0.1188","0.0438","","","0.0941","0.1175","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215704","31.288","0.019","15.486","0.009","17.381","0.01","90","","122.34","0.02","90","","7115","7","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","(Bromido)[<i>N</i>,<i>N</i>'-bis(2-nitrocinnamaldehyde)ethylenediamine] (triphenylphosphine)copper(I)","","- C38 H33 Br Cu N4 O4 P -","- C38 H33 Br Cu N4 O4 P -","- C304 H264 Br8 Cu8 N32 O32 P8 -","8","1","XU2320","Habibi, Mohammad Hossein; Lalegani, Arash; Mokhtari, Reza; Suzuki, Takayoshi","(Bromido)[<i>N</i>,<i>N</i>'-bis(2-nitrocinnamaldehyde)ethylenediamine](triphenylphosphine)copper(I)","Acta Crystallographica Section E","2007","63","10","m2479","m2479","10.1107/S160053680704281X","","","0.71075","MoKα","","0.0467","0.0274","","","0.0516","0.059","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215705","7.4261","0.0002","8.7188","0.0003","15.0798","0.0004","98.44","0.02","95.73","0.02","112.94","0.03","876.1","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Diaquabis(N,N-diethylnicotinamide-κN)bis(4-fluorobenzoato-κO)zinc(II)","","- C34 H40 F2 N4 O8 Zn -","- C34 H40 F2 N4 O8 Zn -","- C34 H40 F2 N4 O8 Zn -","1","0.5","XU2321","Hökelek, Tuncer; Çaylak, Nagihan; Necefoğlu, Hacali","Diaquabis(<i>N</i>,<i>N</i>-diethylnicotinamide-κ<i>N</i>)bis(4-fluorobenzoato-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2007","63","10","m2561","m2562","10.1107/S1600536807045382","","","0.71073","MoKα","","0.0708","0.0503","","","0.1282","0.1401","","","","","","1.079","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215706","7.919","0.0016","10.955","0.002","15.479","0.003","78.88","0.03","80.11","0.03","69.08","0.03","1223","0.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","(<i>E</i>)-<i>N</i>'-(1,3-benzodioxol-5-ylmethylene)isonicotinohydrazide","","- C14 H11 N3 O3 -","- C14 H11 N3 O3 -","- C56 H44 N12 O12 -","4","2","XU2324","Yin, Zhi-gang; Qian, Heng-yu; Feng Yu-li; Chen Yu-zhen","(<i>E</i>)-<i>N</i>'-(1,3-Benzodioxol-5-ylmethylene)isonicotinohydrazide","Acta Crystallographica Section E","2007","63","10","o4109","o4109","10.1107/S1600536807044881","","","0.71073","MoKα","","0.1043","0.083","","","0.154","0.1647","","","","","","1.169","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215707","7.38","0.0016","10.8935","0.0014","22.01","0.02","90","","90","","90","","1769.5","1.7","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1-{(<i>E</i>)-2-[(2E,3Z)-4-Oxidopent-3-en-2- ylideneamino]ethyliminomethyl}naphthalen-2-olato)manganese(II) methanol solvate","","- C19 H22 Mn N2 O3 -","- C19 H22 Mn N2 O3 -","- C76 H88 Mn4 N8 O12 -","4","1","XU2325","Xu, Bin; Ran, Jing-Wen; Li, Ya-Hong","(1-{(<i>E</i>)-2-[(2<i>E</i>,3<i>Z</i>)-4-Oxidopent-3-en-2-ylideneamino]ethyliminomethyl}naphthalen-2-olato)manganese(II) methanol solvate","Acta Crystallographica Section E","2007","63","10","m2579","m2579","10.1107/S1600536807045370","","","0.71073","MoKα","","0.1044","0.0503","","","0.1218","0.1516","","","","","","0.907","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215708","21.0869","0.0006","14.8065","0.0004","24.565","0.0006","90","","90","","90","","7669.8","0.4","295","2","295","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Bis(μ-N,2-di-3-pyridylisoindoline-1-imine-κ^2^N,N')bis[aqua(perchlorato-\ κO)cadmium(II)] bis(perchlorate) methanol disolvate","","- C74 H68 Cd2 Cl4 N16 O20 -","- C74 H68 Cd2 Cl4 N16 O20 -","- C296 H272 Cd8 Cl16 N64 O80 -","4","0.5","XU2328","Zhu, Li-Na; Gao, Shan; Ng, Seik Weng","Bis(μ-<i>N</i>,2-di-3-pyridylisoindoline-1-imine-κ^2^<i>N</i>,<i>N</i>')bis[aqua(perchlorato-κ<i>O</i>)cadmium(II)] bis(perchlorate) methanol disolvate","Acta Crystallographica Section E","2007","63","10","m2618","m2618","10.1107/S1600536807046272","","","0.71073","MoKα","","0.1093","0.0561","","","0.1431","0.1806","","","","","","1.093","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215709","15.0375","0.0017","8.1402","0.0009","18.966","0.002","90","","101.97","0.001","90","","2271.1","0.4","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diazidobis(2,2'-bipyridine)cobalt(III) perchlorate","","- C20 H16 Cl Co N10 O4 -","- C20 H16 Cl Co N10 O4 -","- C80 H64 Cl4 Co4 N40 O16 -","4","1","XU2329","Zhang, Fan; Xie, Cheng-Zhi; Wang, Xiao-Qing; Shen, Guang-Qiu; Shen, De-Zhong","Diazidobis(2,2'-bipyridine)cobalt(III) perchlorate","Acta Crystallographica Section E","2007","63","10","m2615","m2616","10.1107/S1600536807046806","","","0.71073","MoKα","","0.066","0.0449","","","0.1257","0.1419","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215710","12.165","0.002","8.242","0.0012","13.321","0.002","90","","114.146","0.016","90","","1218.8","0.4","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,2,3,3-Tetramethylbutane-2,3-diyl 1',2'-phenylene orthocarbonate","2,3-Dimethylbutane-2,3-diyl 1,2-phenylene orthocarbonate","","- C13 H16 O4 -","- C13 H16 O4 -","- C52 H64 O16 -","4","1","XU2330","Betz, Richard; Jahn, Nico; Klüfers, Peter","2,3-Dimethylbutane-2,3-diyl 1,2-phenylene orthocarbonate","Acta Crystallographica Section E","2007","63","10","o4152","o4152","10.1107/S1600536807046405","","","0.71073","MoKα","","0.1167","0.0704","","","0.1227","0.1451","","","","","","1.129","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215711","8.5814","0.0017","19.426","0.004","10.118","0.002","90","","96.62","0.03","90","","1675.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[aqua(μ~4~-benzene-1,3-dicarboxylato-κ^4^O:O':O'':O''') bis(imidazole-κN)palladium(II)]","","- C14 H14 N4 O5 Pd -","- C14 H14 N4 O5 Pd -","- C56 H56 N16 O20 Pd4 -","4","1","ZL2039","Hao, Lu-Jiang; Yu, Tong-Li","Poly[aqua(μ~4~-benzene-1,3-dicarboxylato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>''')bis(imidazole-κ<i>N</i>)palladium(II)]","Acta Crystallographica Section E","2007","63","10","m2555","m2555","10.1107/S1600536807044315","","","0.71073","MoKα","","0.0451","0.0308","","","0.0648","0.0711","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215712","11.3154","0.0003","17.5465","0.0005","12.6528","0.0005","90","","109.657","0.001","90","","2365.76","0.13","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Lithium potassium hexamethyldisilazide","[μ~2~-bis(trimethylsilyl)amido-κ^2^<i>N</i>:<i>N</i>]-potassium]","","- C12 H36 K Li N2 Si4 -","- C12 H36 K Li N2 Si4 -","- C48 H144 K4 Li4 N8 Si16 -","4","0.5","ZL2045","Morris, J. Jacob; Noll, Bruce C.; Henderson, Kenneth W.","A polymeric mixed-metal hexamethyldisilazide","Acta Crystallographica Section E","2007","63","10","m2477","m2477","10.1107/S1600536807033922","","","0.71073","MoKα","","0.0356","0.0287","","","0.0771","0.0828","","","","","","1.081","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215713","7.3899","0.0002","12.2135","0.0003","12.2633","0.0003","90","","119.726","0.001","90","","961.19","0.04","294","","291","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>Z</i>)-3-(2-aminophenylcarbamoyl)propenoic acid","","- C10 H10 N2 O3 -","- C10 H10 N2 O3 -","- C40 H40 N8 O12 -","4","1","ZL2058","Santos-Sánchez, Norma Francenia; Salas-Coronado, Raúl; Peña-Hueso, Adrián; Flores-Parra, Angelina","<i>N</i>-(2-Aminophenyl)maleamic acid","Acta Crystallographica Section E","2007","63","10","o4156","o4156","10.1107/S1600536807046132","","","0.71073","MoKα","","0.1074","0.0412","","0.1297","0.0511","0.0511","","","","","","1.0098","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215714","9.0483","0.0018","11.045","0.002","24.192","0.005","90","","111.64","0.03","90","","2247.3","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","{N-[2-(2,6-Dimethylphenylamino)benzylidene]-2,6-dimethylaniline- κ^2^<i>N</i>,<i>N</i>'}dimethylaluminium(III)","","- C25 H29 Al N2 -","- C25 H29 Al N2 -","- C100 H116 Al4 N8 -","4","1","ZL2062","Liu, Xiao-Ming; Gao, Wei; Li, Bao; Ni, Jian-Guo; Mu, Ying","{<i>N</i>-[2-(2,6-Dimethylphenylamino)benzylidene]-2,6-dimethylaniline-κ^2^<i>N</i>,<i>N</i>'}dimethylaluminium(III)","Acta Crystallographica Section E","2007","63","10","m2549","","10.1107/S1600536807044388","","","0.71073","MoKα","","0.099","0.0469","","","0.0953","0.1055","","","","","","0.962","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215715","14.4046","0.0008","14.7669","0.0007","24.3537","0.0013","90","","90","","90","","5180.3","0.5","193","2","193","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis(acetonitrile-κ<i>N</i>)(η^5^-pentamethylcyclopentadienyl)(pyrimidine- κ<i>N</i>)rhodium(III) bis(hexafluoridophosphate)","","- C18 H25 F12 N4 P2 Rh -","- C18 H25 F12 N4 P2 Rh -","- C144 H200 F96 N32 P16 Rh8 -","8","1","ZL2063","Boyer, Julie L.; Wilson, Scott R.; Rauchfuss, Thomas B.","Bis(acetonitrile-κ<i>N</i>)(η^5^-pentamethylcyclopentadienyl)(pyrimidine-κ<i>N</i>)rhodium(III) bis(hexafluoridophosphate)","Acta Crystallographica Section E","2007","63","10","m2574","m2574","10.1107/S1600536807044716","","","0.71073","MoKα","","0.0459","0.0367","","","0.0932","0.0998","","","","","","1.043","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215716","12.7721","0.0003","12.5364","0.0003","23.3622","0.0006","90","","103.874","0.002","90","","3631.53","0.16","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-(2,2':6',2""-Terpyridyl)benzyltriphenylphosphonium bromide","","- C40 H31 Br N3 P -","- C40 H31 Br N3 P -","- C160 H124 Br4 N12 P4 -","4","1","ZL2064","Wen-Dong Song; Peng-Zhi Hong; Zao-He Wu","4-(2,2':6',2''-Terpyridyl)benzyltriphenylphosphonium bromide","Acta Crystallographica Section E","2007","63","10","o4047","o4047","10.1107/S1600536807043668","","","0.71073","MoKα","","0.1504","0.0513","","","0.09","0.1095","","","","","","0.831","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215717","4.5204","0.0005","11.3606","0.0014","23.501","0.003","90","","90","","90","","1206.9","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,3-bis(4-fluorophenyl)propan-2-one","","- C15 H12 F2 O -","- C15 H12 F2 O -","- C60 H48 F8 O4 -","4","1","ZL2068","Guzei, Ilia A.; Kolonko, Kris; Reich, Hans","Unexpected crystallization of 1,3-bis(4-fluorophenyl)propan-2-one in paratone oil","Acta Crystallographica Section E","2007","63","10","o4094","o4094","10.1107/S1600536807044704","","","0.71073","MoKα","","0.0609","0.0339","","","0.066","0.0732","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215718","8.4987","0.0009","14.7982","0.0015","11.1828","0.0012","90","","95.395","0.001","90","","1400.2","0.3","291","2","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,2',4,4'-tetranitrodiphenylamine","Bis(2,4-Dinitrophenyl)amine","","- C12 H7 N5 O8 -","- C12 H7 N5 O8 -","- C48 H28 N20 O32 -","4","1","AT2406","Wu, De-Lin; Jia, Zhao-Li; Shi, Jie-Ping; Lu, Guo-Yuan","Bis(2,4-Dinitrophenyl)amine","Acta Crystallographica Section E","2007","63","11","o4194","o4194","10.1107/S1600536807046831","","","0.71073","MoKα","","0.0514","0.046","","","0.1299","0.1346","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215719","4.8729","0.0011","7.9736","0.0018","23.604","0.006","93.744","0.004","94.26","0.004","104.173","0.004","883.4","0.4","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","3,3'-Dimethoxy-4,4'-(propane-1,3-diyldioxy)dibenzoic acid","","- C19 H20 O8 -","- C19 H20 O8 -","- C38 H40 O16 -","2","1","AT2410","Rui-Xue Deng; Pu Liu; Wei-Yi Zhou","3,3'-Dimethoxy-4,4'-(propane-1,3-diyldioxy)dibenzoic acid","Acta Crystallographica Section E","2007","63","11","o4193","o4193","10.1107/S1600536807047216","","","0.71073","MoKα","","0.1164","0.0504","","","0.1021","0.1352","","","","","","0.993","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215720","6.2528","0.0005","14.877","0.0011","19.174","0.0015","90","","93.806","0.001","90","","1779.7","0.2","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Anilino-2-hexylsulfanyl-4,4-dimethyl-1<i>H</i>-imidazol-5(4H)-one","","- C17 H25 N3 O S -","- C17 H25 N3 O S -","- C68 H100 N12 O4 S4 -","4","1","AT2411","Shao-Fa Sun; Yu-Lu Chen; Gui-Hua Li","1-Anilino-2-hexylsulfanyl-4,4-dimethyl-1<i>H</i>-imidazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4219","o4219","10.1107/S1600536807047228","","","0.71073","MoKα","","0.0674","0.0529","","","0.1482","0.1571","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215721","7.8036","0.0004","4.3526","0.0002","26.6839","0.0011","90","","97.02","0.004","90","","899.55","0.07","296","","296","","","","","","","","","4","P 1 c 1","P -2yc","7","","(2E)-3-(3,5-Dichloro-4-methoxy-2,6-dimethylphenyl)-1-(2,4-dichlorophenyl)prop- 2-en-1-one","","- C18 H14 Cl4 O2 -","- C18 H14 Cl4 O2 -","- C36 H28 Cl8 O4 -","2","1","AT2412","Jasinski, Jerry P.; Butcher, Ray J.; Mayekar, Anil N.; Narayana, B.; Yathirajan, H. S.","(2<i>E</i>)-3-(3,5-Dichloro-4-methoxy-2,6-dimethylphenyl)-1-(2,4-dichlorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","11","o4229","o4230","10.1107/S1600536807047654","","","0.71073","MoKα","","0.1273","0.081","","","0.2024","0.2386","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215722","10.6129","0.0005","13.957","0.0007","12.6858","0.0006","90","","106.012","0.005","90","","1806.17","0.16","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2E)-1-(2,4-Dichlorophenyl)-3-[4-(diethylamino)-2-hydroxyphenyl]prop-2-en-1-one","","- C19 H19 Cl2 N O2 -","- C19 H19 Cl2 N O2 -","- C76 H76 Cl8 N4 O8 -","4","1","AT2413","Jasinski, Jerry P.; Butcher, Ray J.; Mayekar, Anil N.; Narayana, B.; Yathirajan, H. S.","(2<i>E</i>)-1-(2,4-Dichlorophenyl)-3-[4-(diethylamino)-2-hydroxyphenyl]prop-2-en-1-one","Acta Crystallographica Section E","2007","63","11","o4231","o4232","10.1107/S1600536807047666","","","0.71073","MoKα","","0.1835","0.0456","","","0.113","0.1487","","","","","","0.826","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215723","7.97","0.002","20.781","0.002","16.401","0.003","90","","102.298","0.007","90","","2654.1","0.9","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Triaquatris(nitrato-κ^2^O,O')lanthanum(III) 4,4'-bipyridine disolvate","","- C20 H22 La N7 O12 -","- C20 H22 La N7 O12 -","- C80 H88 La4 N28 O48 -","4","1","AT2414","Nai-Gen Li; Rui-Min Tao; Bang-Feng Fu","Triaquatris(nitrato-κ^2^<i>O</i>,<i>O</i>')lanthanum(III) 4,4'-bipyridine disolvate","Acta Crystallographica Section E","2007","63","11","m2715","m2716","10.1107/S1600536807049227","","","0.71073","MoKα","","0.0335","0.0284","","","0.0803","0.0818","","","","","","0.986","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215726","7.329","0.002","8.107","0.002","12.926","0.003","86.68","0.03","89.84","0.03","77.49","0.03","748.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis[5-(pyrimidin-2-yl-κN)tetrazolato-κN^1^]copper(II)","","- C10 H10 Cu N12 O2 -","- C10 H10 Cu N12 O2 -","- C20 H20 Cu2 N24 O4 -","2","1","AT2417","Jin, Mei-Fang; Qiu, Yu-E; Zhang, Xiu-Ling","Diaquabis[5-(pyrimidin-2-yl-κ<i>N</i>)tetrazolato-κ<i>N</i>^1^]copper(II)","Acta Crystallographica Section E","2007","63","11","m2718","m2719","10.1107/S1600536807049197","","","0.71073","MoKα","","0.066","0.0379","","","0.0933","0.105","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215727","9.8103","0.0013","23.541","0.003","7.259","0.001","90","","130.756","0.009","90","","1269.9","0.3","296","","296","","","","","","","","","4","C 1 c 1","C -2yc","9","","3-(3-Methoxyanilino)isobenzofuran-1(3<i>H</i>)-one","","- C15 H13 N O3 -","- C15 H13 N O3 -","- C60 H52 N4 O12 -","4","1","AT2418","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","3-(3-Methoxyanilino)isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4296","o4297","10.1107/S1600536807048714","","","0.71073","MoKα","","0.0267","0.0246","","","0.0624","0.0634","","","","","","1.073","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215728","13.4961","0.0017","15.096","0.002","22.15","0.002","90","","103.72","0.002","90","","4384","0.9","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetrakis(μ-naphthalene-1-acetato)bis[(naphthalene-1-acetato)(1,10- phenanthroline)samarium(III) N,N-dimethylformamide disolvate","","- C102 H84 N6 O14 Sm2 -","- C102 H84 N6 O14 Sm2 -","- C204 H168 N12 O28 Sm4 -","2","0.5","AT2419","Xia, Hai-Tao; Liu, Yu-Fen; Wang, Da-Qi; Yang, Shu-Ping","Tetrakis(μ-naphthalene-1-acetato)bis[(naphthalene-1-acetato)(1,10-phenanthroline)samarium(III)] <i>N</i>,<i>N</i>-dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","11","m2708","m2709","10.1107/S1600536807049203","","","0.71073","MoKα","","0.1323","0.0615","","","0.1012","0.1328","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215729","6.3682","0.0007","10.8299","0.0012","11.8619","0.0013","74.18","0.009","78.048","0.009","88.588","0.009","769.59","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-hydroxido-bis[aquatrichloridotin(IV)] benzene hemisolvate monohydrate","","- C3 H11 Cl6 O5 Sn2 -","- C3 H11 Cl6 O5 Sn2 -","- C6 H22 Cl12 O10 Sn4 -","2","1","AT2421","Müller, Manuela; Lerner, Hans-Wolfram; Bolte, Michael","Di-μ-hydroxido-bis[aquatrichloridotin(IV)] benzene hemisolvate monohydrate","Acta Crystallographica Section E","2007","63","11","m2765","m2765","10.1107/S1600536807049185","","","0.71073","MoKα","","0.0508","0.0397","","","0.1017","0.107","","","","","","1.04","","","","has coordinates,has Fobs","194546","2020-10-21","18:00:00",""
"2215730","28.717","0.004","11.5393","0.0014","4.666","0.0006","90","","90","","90","","1546.2","0.3","293","2","293","2","","","","","","","","7","P n 21 a","P -2ac -2n","33","","Chlorido{1-[2-(methylsulfanyl)phenyldiazenyl]naphtholato-κ^3^O,N,S}nickel(II)","","- C17 H13 Cl N2 Ni O S -","- C17 H13 Cl N2 Ni O S -","- C68 H52 Cl4 N8 Ni4 O4 S4 -","4","1","AT2422","Das, Purak; Biswas, Achintesh Narayan","Chlorido{1-[2-(methylsulfanyl)phenyldiazenyl]naphtholato-κ^3^<i>O</i>,<i>N</i>,<i>S</i>}nickel(II)","Acta Crystallographica Section E","2007","63","11","m2740","m2740","10.1107/S1600536807049719","","","0.71073","MoKα","","0.0504","0.0453","","","0.1026","0.1134","","","","","","1.187","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215731","16.9642","0.0016","11.8744","0.0008","11.8783","0.0011","90","","103.133","0.008","90","","2330.2","0.4","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(4-ethylanilinium) 4,5-dichlorophthalate","","- C24 H27 Cl2 N2 O4 -","- C24 H27 Cl2 N2 O4 -","- C96 H108 Cl8 N8 O16 -","4","1","AT2423","Büyükgüngör, Orhan; Odabaşoğlu, Mustafa","Bis(4-ethylanilinium) 4,5-dichlorophthalate","Acta Crystallographica Section E","2007","63","11","o4376","o4377","10.1107/S1600536807050490","","","0.71073","MoKα","","0.0981","0.0524","","","0.1281","0.1451","","","","","","0.924","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215732","12.493","0.001","14.199","0.002","20.253","0.002","90","","104.263","0.002","90","","3481.9","0.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis{2,2'-[ethane-1,2-diylbis(iminomethylene)]diphenolato- κ^4^O,N,N',O'}cerium(IV) chloroform solvate","","- C33 H37 Ce Cl3 N4 O4 -","- C33 H37 Ce Cl3 N4 O4 -","- C132 H148 Ce4 Cl12 N16 O16 -","4","1","AT2424","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Wang, Bo","Bis{2,2'-[ethane-1,2-diylbis(iminomethylene)]diphenolato-κ^2^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}cerium(IV) chloroform solvate","Acta Crystallographica Section E","2007","63","11","m2777","m2778","10.1107/S160053680705101X","","","0.71073","MoKα","","0.0814","0.0457","","","0.1161","0.1285","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215734","12.364","0.001","13.5622","0.0012","13.5954","0.0013","114.189","0.003","99.559","0.002","103.485","0.002","1932.3","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C96 H70 N4 O12 Yb2 -","- C96 H70 N4 O12 Yb2 -","- C96 H70 N4 O12 Yb2 -","1","0.5","AT2427","Xia, Hai-Tao; Liu, Yu-Fen; Wang, Da-Qi; Yang, Shu-Ping","Tetrakis(μ-naphthalene-1-acetato)bis[(naphthalene-1-acetato)(1,10-phenanthroline)ytterbium(III)]","Acta Crystallographica Section E","2007","63","11","m2795","m2796","10.1107/S1600536807051252","","","0.71073","MoKα","","0.0456","0.0314","","","0.0745","0.0892","","","","","","1.011","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215735","13.4985","0.0014","15.132","0.0017","22.181","0.002","90","","103.723","0.002","90","","4401.3","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis(μ-naphthalene-1-acetato)bis(naphthalene-1-acetato)bis(1,10- phenanthroline)samarium(III)terbium(III) <i>N</i>,<i>N</i>-dimethylformamide disolvate","","- C102 H84 N6 O14 Sm Tb -","- C102 H84 N6 O14 Sm Tb -","- C204 H168 N12 O28 Sm2 Tb2 -","2","0.5","AT2428","Xia, Hai-Tao; Liu, Yu-Fen; Wang, Da-Qi; Yang, Shu-Ping","Tetrakis(μ-naphthalene-1-acetato)bis(naphthalene-1-acetato)bis(1,10-phenanthroline)samarium(III)terbium(III) <i>N</i>,<i>N</i>-dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","11","m2797","m2798","10.1107/S1600536807051720","","","0.71073","MoKα","","0.0714","0.0529","","","0.1116","0.1179","","","","","","1.106","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215736","14.4986","0.0013","13.9962","0.0014","5.9375","0.0008","90","","90","","90","","1204.9","0.2","298","2","298","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","4-Chloro-N-(3,4-methylenedioxybenzyl)aniline","","- C14 H12 Cl N O2 -","- C14 H12 Cl N O2 -","- C56 H48 Cl4 N4 O8 -","4","1","AT2429","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Xia, Hai-Tao","4-Chloro-<i>N</i>-(3,4-methylenedioxybenzyl)aniline","Acta Crystallographica Section E","2007","63","11","o4403","o4403","10.1107/S1600536807051732","","","0.71073","MoKα","","0.0944","0.0562","","","0.1169","0.1301","","","","","","0.914","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215737","14.6264","0.0013","14.265","0.0012","5.9752","0.0008","90","","90","","90","","1246.7","0.2","298","2","298","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","4-Bromo-N-(3,4-methylenedioxybenzyl)aniline","","- C14 H12 Br N O2 -","- C14 H12 Br N O2 -","- C56 H48 Br4 N4 O8 -","4","1","AT2430","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Xia, Hai-Tao","4-Bromo-<i>N</i>-(3,4-methylenedioxybenzyl)aniline","Acta Crystallographica Section E","2007","63","11","o4404","o4404","10.1107/S1600536807051744","","","0.71073","MoKα","","0.0648","0.0447","","","0.0992","0.1062","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215740","5.7064","0.0011","22.174","0.004","6.1717","0.0012","90","","105.29","0.03","90","","753.3","0.3","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,4-Bis(3-pyridylaminomethyl)benzene","","- C18 H18 N4 -","- C18 H18 N4 -","- C36 H36 N8 -","2","0.5","AT2434","Li-Na Zhu; Shan Gao; Li-Hua Huo","1,4-Bis(3-pyridylaminomethyl)benzene","Acta Crystallographica Section E","2007","63","11","o4459","o4459","10.1107/S1600536807052476","","","0.71073","MoKα","","0.0686","0.0455","","","0.122","0.1419","","","","","","1.106","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215741","16.036","0.004","15.874","0.004","16.882","0.004","90","","117.98","0.004","90","","3795.1","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di-μ-iodido-bis[iodido(triphenylphosphine-κP)platinum(II)]","","- C36 H30 I4 P2 Pt2 -","- C36 H30 I4 P2 Pt2 -","- C144 H120 I16 P8 Pt8 -","4","1","AT2435","Biswas, Achintesh Narayan; Bagchi, Vivek; Das, Purak; Bandyopadhyay, Pinaki","Di-μ-iodido-bis[iodido(triphenylphosphine-κ<i>P</i>)platinum(II)]","Acta Crystallographica Section E","2007","63","11","m2836","m2836","10.1107/S1600536807052488","","","0.71073","MoKα","","0.0255","0.0225","","","0.0541","0.0587","","","","","","1.093","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215742","7.0942","0.0018","7.984","0.002","10.092","0.004","88.92","0.03","84.84","0.03","74.93","0.02","549.7","0.3","296","","296","","","","","","","","","5","P -1","-P 1","2","3-(2-fluoroanilino)phthalide","3-(2-Fluoroanilino)isobenzofuran-1(3<i>H</i>)-one","","- C14 H10 F N O2 -","- C14 H10 F N O2 -","- C28 H20 F2 N2 O4 -","2","1","AT2436","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","3-(2-Fluoroanilino)isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4401","o4401","10.1107/S1600536807051483","","","0.71073","MoKα","","0.038","0.031","","","0.0825","0.0852","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215743","6.0059","0.0005","34.018","0.003","8.0271","0.0006","90","","107.727","0.006","90","","1562.1","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-[1-(4-Chlorophenyl)-3-oxobutylamino]benzoic acid","","- C17 H16 Cl N O3 -","- C17 H16 Cl N O3 -","- C68 H64 Cl4 N4 O12 -","4","1","AT2438","Narayana, B.; Sunil, K.; Sarojini, B. K.; Yathirajan, H. S.; Bolte, Michael","4-[1-(4-Chlorophenyl)-3-oxobutylamino]benzoic acid","Acta Crystallographica Section E","2007","63","11","o4420","o4421","10.1107/S1600536807051471","","","0.71073","MoKα","","0.0462","0.0382","","","0.1018","0.1055","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215744","9.7647","0.0017","11.347","0.002","11.553","0.002","87.357","0.003","86.416","0.003","68.734","0.003","1190.2","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1-[2-Hydroxy-4-(3-methylbut-2-enyloxy)phenyl]ethan-1-one","","- C13 H16 O3 -","- C13 H16 O3 -","- C52 H64 O12 -","4","2","AT2439","Die Cheng; Mo Liu; Deng-Ke Liu; Ying Liu; Chang-Xiao Liu","1-[2-Hydroxy-4-(3-methylbut-2-enyloxy)phenyl]ethan-1-one","Acta Crystallographica Section E","2007","63","11","o4496","o4496","10.1107/S1600536807053056","","","0.71073","MoKα","","0.0815","0.0443","","","0.1163","0.1424","","","","","","1.009","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215745","16.7102","0.0011","7.513","0.0004","10.8805","0.0008","90","","104.395","0.005","90","","1323.09","0.15","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2E)-1-(2-Thienyl)-3-(2,3,5-trichlorophenyl)prop-2-en-1-one","","- C13 H7 Cl3 O S -","- C13 H7 Cl3 O S -","- C52 H28 Cl12 O4 S4 -","4","1","AT2441","Narayana, B.; Mustafa, K.; Sarojini, B. K.; Yathirajan, H. S.; Bolte, Michael","(2<i>E</i>)-1-(2-Thienyl)-3-(2,3,5-trichlorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","11","o4422","o4423","10.1107/S1600536807051768","","","0.71073","MoKα","","0.0381","0.0318","","","0.0844","0.0876","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215746","4.9979","0.0005","9.3847","0.0007","27.778","0.003","90","","94.857","0.008","90","","1298.2","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl (6-bromo-2-naphthyloxy)acetate","","- C14 H13 Br O3 -","- C14 H13 Br O3 -","- C56 H52 Br4 O12 -","4","1","AT2442","Sarojini, B. K.; Narayana, B.; Mayekar, Anil N.; Yathirajan, H. S.; Bolte, Michael","Ethyl (6-bromo-2-naphthyloxy)acetate","Acta Crystallographica Section E","2007","63","11","o4447","o4447","10.1107/S1600536807052300","","","0.71073","MoKα","","0.0463","0.0397","","","0.0995","0.103","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215747","6.6516","0.0009","7.0223","0.0011","15.0248","0.0017","90.789","0.011","93.409","0.011","105.718","0.012","674.04","0.16","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","(2E)-1-(2-Hydroxyphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-en-1-one","","- C16 H14 O2 S -","- C16 H14 O2 S -","- C32 H28 O4 S2 -","2","1","AT2443","Sarojini, B. K.; Yathirajan, H. S.; Mustafa, K.; Sarfraz, H.; Bolte, Michael","(2<i>E</i>)-1-(2-Hydroxyphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-en-1-one","Acta Crystallographica Section E","2007","63","11","o4448","o4448","10.1107/S1600536807052312","","","0.71073","MoKα","","0.0632","0.0572","","","0.1795","0.1838","","","","","","1.099","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215748","25.7789","0.0009","9.7238","0.0007","16.4653","0.0008","90","","99.507","0.001","90","","4070.7","0.4","278","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-Nitro-<i>N</i>,<i>N</i>-bis(p-tolylsulfonyl)aniline","","- C20 H18 N2 O6 S2 -","- C20 H18 N2 O6 S2 -","- C160 H144 N16 O48 S16 -","8","1","AT2445","Ke-Jian Zhao; Xiang-Xiang Wu; Guoping Wang; Mao-Lin Hu","3-Nitro-<i>N</i>,<i>N</i>-bis(<i>p</i>-tolylsulfonyl)aniline","Acta Crystallographica Section E","2007","63","11","o4472","o4472","10.1107/S160053680705307X","","","0.71073","MoKα","","0.0604","0.0545","","","0.1311","0.1348","","","","","","1.145","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215749","25.4158","0.0015","3.9662","0.0003","12.6046","0.001","90","","90","","90","","1270.6","0.16","173","2","173","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","(2E)-1-(2-Hydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one","","- C16 H14 O3 -","- C16 H14 O3 -","- C64 H56 O12 -","4","1","AT2447","Sarojini, B. K.; Yathirajan, H. S.; Mustafa, K.; Sarfraz, H.; Bolte, Michael","(2<i>E</i>)-1-(2-Hydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","11","o4477","o4477","10.1107/S1600536807052737","","","0.71073","MoKα","","0.0384","0.0356","","","0.0898","0.0915","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215750","9.1868","0.0004","13.9634","0.0008","17.1928","0.0008","90","","94.687","0.004","90","","2198.1","0.19","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,8-bis(trifluoromethyl)quinolin-4-ol‒ 2,8-bis(trifluoromethyl)quinolin-4(1H)-one (1/1)","","- C22 H10 F12 N2 O2 -","- C22 H10 F12 N2 O2 -","- C88 H40 F48 N8 O8 -","4","1","AT2454","Sarojini, B. K.; Narayana, B.; Mayekar, Anil N.; Yathirajan, H. S.; Bolte, Michael","A 1:1 cocrystal of 2,8-bis(trifluoromethyl)quinolin-4-ol and 2,8-bis(trifluoromethyl)quinolin-4(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4478","o4479","10.1107/S1600536807053482","","","0.71073","MoKα","","0.0695","0.0548","","","0.1361","0.1437","","","","","","1.141","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215751","8.1415","0.0006","18.6885","0.0015","6.323","0.0005","90","","99.86","0.004","90","","947.85","0.13","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Disodium 5,5'-diamino-2,2'-ethylenedibenzenesulfonate tetrahydrate","","- C14 H20 N2 Na2 O10 S2 -","- C14 H20 N2 Na2 O10 S2 -","- C28 H40 N4 Na4 O20 S4 -","2","0.5","AV3102","Dufresne, Stéphane; Gaultois, Michael; Skene, W. G.","Disodium 5,5'-diamino-2,2'-ethylenedibenzenesulfonate tetrahydrate","Acta Crystallographica Section E","2007","63","11","m2714","m2714","10.1107/S1600536807049410","","","1.54178","CuKα","","0.0715","0.0675","","","0.1812","0.1855","","","","","","1.073","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215752","18.8782","0.0012","8.0923","0.0005","16.8906","0.0011","90","","94.741","0.001","90","","2571.5","0.3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(5,16-Dimethyl-2,6,13,17-tetraazatricyclo[14.4.0^1,18^.0^7,12^] docosane-κ^4^N)bis(perchlorato-κO)copper(II)","","- C20 H40 Cl2 Cu N4 O8 -","- C20 H40 Cl2 Cu N4 O8 -","- C80 H160 Cl8 Cu4 N16 O32 -","4","0.5","AV3109","Choi, Jong-Ha; Ryoo, Keon Sang; Park, Ki-Min","(5,16-Dimethyl-2,6,13,17-tetraazatricyclo[14.4.0^1,18^.0^7,12^]docosane-κ^4^<i>N</i>)bis(perchlorato-κ<i>O</i>)copper(II)","Acta Crystallographica Section E","2007","63","11","m2674","m2675","10.1107/S1600536807048039","","","0.71073","MoKα","","0.0568","0.0509","","","0.1004","0.1025","","","","","","1.258","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215753","8.0506","0.0009","6.764","0.0008","18.858","0.002","90","","95.639","0.002","90","","1021.9","0.2","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","Demethylincisterol A3","(3aS,5aR,6R,8aR)-3a-Hydroxy-5a-methyl-6-[(1R,2E,4R)-1,4,5-trimethyl-2-hexen- 1-yl]-3a,4,5,5a,6,7,8,8a-octahydro-2H-cyclopenta[e]benzofuran-2-one","","- C21 H32 O3 -","- C21 H32 O3 -","- C42 H64 O6 -","2","1","AV3110","Wang, Wen-liang; Tao, Hong-wen; Sun, Wei; Gu, Qian-Qun; Zhu, Wei-Ming","(3a<i>S</i>,5a<i>R</i>,6<i>R</i>,8a<i>R</i>)-3a-Hydroxy-5a-methyl-6-[(1<i>R</i>,2<i>E</i>,4<i>R</i>)-1,4,5-trimethyl-2-hexen-1-yl]-3a,4,5,5a,6,7,8,8a-octahydro-2<i>H</i>-cyclopenta[<i>e</i>]benzofuran-2-one","Acta Crystallographica Section E","2007","63","11","o4196","o4196","10.1107/S1600536807047307","","","0.71073","MoKα","","0.0862","0.0454","","","0.0948","0.1127","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215754","6.6349","0.0019","10.659","0.004","24.586","0.007","90","","90","","90","","1738.8","1","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","glaucocalyxin A","7α,14β-dihydroxy-ent-kaur-16-ene-3,5-dione","","- C20 H28 O4 -","- C20 H28 O4 -","- C80 H112 O16 -","4","1","BG2095","Ma, Xing-Ke; He, Zhi-An; Bai, Su-Ping","A diterpenoid from <i>Isodon japonica</i> var. glaucocalyx","Acta Crystallographica Section E","2007","63","11","o4203","o4203","10.1107/S1600536807043048","","","0.71073","MoKα","","0.0531","0.044","","","0.1212","0.1269","","","","","","0.995","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215755","25.584","0.003","7.4506","0.0011","11.5739","0.0015","90","","113.926","0.002","90","","2016.6","0.5","298","2","298","2","","","","","","","","5","C 1 2 1","C 2y","5","","μ-Chlorido-bis({<i>N</i>-benzyl-<i>N</i>'-[2-(benzylamino)ethyl]ethane- 1,2-diamine}chloridocopper(II))","","- C36 H50 Cl4 Cu2 N6 -","- C36 H50 Cl4 Cu2 N6 -","- C72 H100 Cl8 Cu4 N12 -","2","0.5","BG2104","Liu, Yu-Fen; Xia, Hai-Tao; Wang, Da-Qi; Yang, Shu-Ping","μ-Chlorido-bis({<i>N</i>-benzyl-<i>N</i>'-[2-(benzylamino)ethyl]ethane-1,2-diamine}chloridocopper(II)) chloride","Acta Crystallographica Section E","2007","63","11","m2805","m2806","10.1107/S1600536807051434","","","0.71073","MoKα","","0.1155","0.0556","","","0.0943","0.103","","","","","","0.997","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215756","11.432","0.0002","15.8134","0.0004","26.2781","0.0006","90","","90.06","0.02","90","","4750.52","0.18","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(N-<i>tert</i>-Butylpyrazine-2-carboxamide- κN^4^)chloridobis(dimethylglyoximato-κ^2^N,N')cobalt(III) hemihydrate","","- C17 H28 Cl Co N7 O5.5 -","- C17 H27 Cl Co N7 O5.5 -","- C136 H216 Cl8 Co8 N56 O44 -","8","2","BG2106","Martin, S.; Revathi, C.; Babu Varghese; Dayalan, A.","(<i>N</i>-<i>tert</i>-Butylpyrazine-2-carboxamide-κ<i>N</i>^4^)chloridobis(dimethylglyoximato-κ^2^<i>N</i>,<i>N</i>')cobalt(III) hemihydrate","Acta Crystallographica Section E","2007","63","11","m2670","m2670","10.1107/S1600536807047903","","","0.71073","MoKα","","0.0522","0.0387","","","0.1013","0.1208","","","","","","1.173","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2215757","6.4436","0.0007","10.4563","0.0011","11.5762","0.0013","65.68","0.002","86.755","0.002","72.641","0.002","676.4","0.13","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","1,4-Bis(5,5-dimethyl-2-oxo-4-phenyl-1,3,2-dioxaphosphorinan-2-yl)piperazine","","- C26 H36 N2 O6 P2 -","- C26 H36 N2 O6 P2 -","- C26 H36 N2 O6 P2 -","1","0.5","BG2110","Xuemei Chen; Wensheng Xiao; Ping Jiao","1,4-Bis(5,5-dimethyl-2-oxo-4-phenyl-1,3,2-dioxaphosphorinan-2-yl)piperazine","Acta Crystallographica Section E","2007","63","11","o4271","o4271","10.1107/S1600536807048349","","","0.71073","MoKα","","0.0992","0.0623","","","0.1357","0.1507","","","","","","1.059","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215758","8.6095","0.0017","12.322","0.003","14.342","0.003","90","","90","","90","","1521.5","0.6","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","catena-Poly[silver(I)-μ-4-aminobenzenesulfonato-μ-2,3-diethylpyrazine]","","- C14 H18 Ag N3 O3 S -","- C14 H18 Ag N3 O3 S -","- C56 H72 Ag4 N12 O12 S4 -","4","1","BG2112","Hai-Yan Liu; Ji-Cheng Ma; Jin Yang","<i>catena</i>-Poly[silver(I)-μ-4-aminobenzenesulfonato-μ-2,3-diethylpyrazine]","Acta Crystallographica Section E","2007","63","11","m2707","m2707","10.1107/S160053680704901X","","","0.71073","MoKα","","0.0458","0.0336","","","0.0736","0.0792","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215759","10.701","0.0009","24.865","0.002","14.5083","0.0012","90","","94.514","0.001","90","","3848.4","0.5","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2,9-Dimethyl-1,10-phenanthroline-κ^2^N,N')bis(3-hydroxybenzoato- κ^2^O,O')manganese(II) 2,9-dimethyl-1,10-phenanthroline solvate dihydrate","","- C42 H38 Mn N4 O8 -","- C42 H38 Mn N4 O8 -","- C168 H152 Mn4 N16 O32 -","4","1","BG2114","Xuan, Xiao-peng; Zhao, Pei-zheng; Zhang, Shu-xia","(2,9-Dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bis(3-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>')manganese(II) 2,9-dimethyl-1,10-phenanthroline dihydrate","Acta Crystallographica Section E","2007","63","11","m2813","m2814","10.1107/S1600536807051628","","","0.71073","MoKα","","0.0775","0.0526","","","0.1496","0.1701","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215760","5.2217","0.001","9.9614","0.0017","11.507","0.0019","79.378","0.003","79.191","0.003","80.152","0.003","572.05","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diaquabis(5-<i>n</i>-butylpyridine-2-carboxylato-\ κ^2^<i>N</i>,<i>O</i>)nickel(II) dihydrate","","- C20 H32 N2 Ni O8 -","- C20 H32 N2 Ni O8 -","- C20 H32 N2 Ni O8 -","1","0.5","BG2115","Liang Qin; Hai-Fu Guo; Xiang Li; De-Yun Ma; Wen-Dong Song","Diaquabis(5-<i>n</i>-butylpyridine-2-carboxylato-κ^2^<i>N</i>,<i>O</i>)nickel(II) dihydrate","Acta Crystallographica Section E","2007","63","11","m2853","m2853","10.1107/S1600536807053603","","","0.71073","MoKα","","0.0514","0.041","","","0.0986","0.1049","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215761","11.109","0.002","6.0063","0.0012","22.871","0.005","90","","90.54","0.03","90","","1526","0.5","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","<i>catena</i>-Poly[[[aquabis[3-(4-carboxyphenoxy)propionato- κ^2^<i>O</i>,O']zinc(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] dihydrate]","","- C30 H32 N2 O13 Zn -","- C30 H32 N2 O13 Zn -","- C60 H64 N4 O26 Zn2 -","2","0.5","BG2117","Li-Li Kong; Shan Gao; Li-Hua Huo","<i>catena</i>-Poly[[[aquabis[3-(4-carboxyphenoxy)propionato-κ^2^<i>O</i>,<i>O</i>']zinc(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] dihydrate]","Acta Crystallographica Section E","2007","63","11","m2791","m2792","10.1107/S1600536807050611","","","0.71073","MoKα","","0.0801","0.0391","","","0.0906","0.1176","","","","","","1.116","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215762","10.385","0.002","17.919","0.002","6.308","0.001","90","","90","","90","","1173.8","0.3","293","2","293","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","Tetrakis[(<i>R</i>)-lactamide-κ^2^<i>O</i>,<i>O</i>']strontium(II) dibromide","Tetrakis[(<i>R</i>)-propionamide-κ^2^<i>O</i>,<i>O</i>']strontium(II) dibromide","","- C12 H28 Br2 N4 O8 Sr -","- C12 H28 Br2 N4 O8 Sr -","- C24 H56 Br4 N8 O16 Sr2 -","2","0.5","BG2119","Lemoine, Pascale; Viossat, Bernard; Brion, Jean Daniel; Bekaert, Alain","Tetrakis[(<i>R</i>)-lactamide-κ^2^<i>O</i>,<i>O</i>']strontium(II) dibromide","Acta Crystallographica Section E","2007","63","11","m2844","m2845","10.1107/S1600536807052646","","","0.71073","MoKα","","0.0906","0.0454","","","0.974","0.1108","","","","","","0.987","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215763","10.643","0.002","11.165","0.002","13.196","0.003","89.945","0.004","71.953","0.003","79.463","0.003","1463.2","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Aquachloridotriphenyltin(IV)‒2-[1-(4-pyridylmethyl)-1H-imidazol-2-yl]pyridine (1/1)","","- C32 H29 Cl N4 O Sn -","- C32 H29 Cl N4 O Sn -","- C64 H58 Cl2 N8 O2 Sn2 -","2","1","BG2120","Shun-Li Li; Guang-Ju Ping; Jian-Fang Ma","Aquachloridotriphenyltin(IV)‒2-[1-(4-pyridylmethyl)-1<i>H</i>-imidazol-2-yl]pyridine (1/1)","Acta Crystallographica Section E","2007","63","11","m2830","m2830","10.1107/S1600536807052695","","","0.71069","MoKα","","0.065","0.0406","","","0.0712","0.0849","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215764","21.866","0.013","7.699","0.004","15.519","0.008","90","","101.44","0.02","90","","2561","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>catena</i>-Poly[[bis(4-methoxybenzoato)copper(II)]-μ-1,1'-\ (oxydiethylene)diimidazole-κ^2^N^3^:N^3'^]","","- C26 H28 Cu N4 O7 -","- C26 H20 Cu N4 O7 -","- C104 H80 Cu4 N16 O28 -","4","0.5","BG2121","Guo-Hua Wei; Lai-Ping Zhang; Ji-Chen Ma; Jin Yang","<i>catena</i>-Poly[[bis(4-methoxybenzoato)copper(II)]-μ-1,1'-(oxydiethylene)diimidazole-κ^2^<i>N</i>^3^:<i>N</i>^3'^]","Acta Crystallographica Section E","2007","63","11","m2866","m2866","10.1107/S1600536807053007","","","0.71069","MoKα","","0.0703","0.0488","","","0.1418","0.1551","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215765","6.5499","0.0002","6.6563","0.0002","18.854","0.0007","92.253","0.003","95.026","0.003","114.841","0.002","740.44","0.04","150","2","150","2","","","","","","","","6","P 1","P 1","1","","Chlorido(η^4^-cycloocta-1,5-diene)[(<i>S</i>)-2-(methoxymethyl)pyrrolidine- κN]rhodium(I)","","- C14 H25 Cl N O Rh -","- C14 H25 Cl N O Rh -","- C28 H50 Cl2 N2 O2 Rh2 -","2","2","BG3061","Dahlenburg, Lutz; Treffert, Harald; Heinemann, Frank W.","Chlorido(η^4^-cycloocta-1,5-diene)[(<i>S</i>)-2-(methoxymethyl)pyrrolidine-κ<i>N</i>]rhodium(I)","Acta Crystallographica Section E","2007","63","11","m2855","m2855","10.1107/S1600536807052920","","","0.71073","MoKα","","0.0174","0.016","","","0.035","0.0353","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215766","19.1098","0.0015","16.1767","0.0013","38.158","0.003","90","","90","","90","","11795.9","1.6","291","2","291","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","Diaquatetrakis(1,3-di-4-pyridylpropane-κN)manganese(II) bis(hexafluoridophosphate) monohydrate","","- C52 H62 F12 Mn N8 O3 P2 -","- C52 H62 F12 Mn N8 O3 P2 -","- C416 H496 F96 Mn8 N64 O24 P16 -","8","1","BH2123","Zheng, Xianfu; Niu, Caoyuan; Wan, Xinsheng; Kou, Chunhong","Diaquatetrakis(1,3-di-4-pyridylpropane-κ<i>N</i>)manganese(II) bis(hexafluoridophosphate) monohydrate","Acta Crystallographica Section E","2007","63","11","m2682","m2683","10.1107/S1600536807048209","","","0.71073","MoKα","","0.0806","0.0462","","","0.1119","0.1354","","","","","","1.024","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215767","14.812","0.0007","16.7384","0.0009","12.4943","0.0006","90","","113.58","0.01","90","","2839.1","0.3","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorido[(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)methane]copper(II)","","- C11 H16 Cl2 Cu N4 -","- C11 H16 Cl2 Cu N4 -","- C88 H128 Cl16 Cu8 N32 -","8","1","BH2127","Malinowska, Katarzyna; Modranka, Roman","Dichlorido[(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)methane]copper(II)","Acta Crystallographica Section E","2007","63","11","m2782","m2782","10.1107/S1600536807048878","","","0.71073","MoKα","","0.0316","0.0301","","","0.0749","0.0754","","","","","","1.108","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215768","6.8715","0.0009","19.892","0.003","22.594","0.003","90","","90","","90","","3088.3","0.7","292","2","292","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,1'-Methylenebis(2,3-dimethylimidazolium) dipicrate acetonitrile solvate","","- C25 H25 N11 O14 -","- C25 H25 N11 O14 -","- C100 H100 N44 O56 -","4","1","BH2132","Li, Jian","1,1'-Methylenebis(2,3-dimethylimidazolium) dipicrate acetonitrile solvate","Acta Crystallographica Section E","2007","63","11","o4470","o4470","10.1107/S160053680705338X","","","0.71073","MoKα","","0.0749","0.0591","","","0.1394","0.1478","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215769","9.0301","0.0002","12.0559","0.0003","9.8618","0.0002","90","","110.546","0.002","90","","1005.32","0.04","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,1'-Dibutyl-isoindigo (E)-1-butyl-3-(1-butyl-2-oxoindolin-3-ylidene)indolin-2-one","1,1'-Dibutyl-3,3'-biindolinylidene-2,2'-dione","","- C24 H26 N2 O2 -","- C24 H26 N2 O2 -","- C48 H52 N4 O4 -","2","0.5","BH2134","Yuan, Mao-Sen; Fang, Qi; Ji, Lei; Yu, Wen-Tao","1,1'-Dibutyl-3,3'-biindolinylidene-2,2'-dione","Acta Crystallographica Section E","2007","63","11","o4342","o4342","10.1107/S160053680705009X","","","0.71073","MoKα","","0.1207","0.0573","","","0.1388","0.1695","","","","","","0.996","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215770","10.836","0.005","11.366","0.004","23.1","0.003","90","","92.63","0.01","90","","2842","1.7","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","1-(4-Chlorophenyl)-8-(4-fluorophenyl)-4-[(<i>E</i>)-(4- fluorophenyl)methylidene]-6-methyl-4,5,6,7,7a,8-hexahydro- 1,2,4-oxadiazolo[5,4-<i>d</i>]pyrido[3,4-<i>c</i>][1,5]benzothiazepine","","- C33 H26 Cl F2 N3 O S -","- C33 H26 Cl F2 N3 O S -","- C132 H104 Cl4 F8 N12 O4 S4 -","4","1","BH2135","N. Srinivasan; R. Sribala; R. Ranjithkumar; S. Perumal; R.V. Krishnakumar","1-(4-Chlorophenyl)-8-(4-fluorophenyl)-4-[(<i>E</i>)-(4-fluorophenyl)methylidene]-6-methyl-4,5,6,7,7a,8-hexahydro-1,2,4-oxadiazolo[5,4-<i>d</i>]pyrido[3,4-<i>c</i>][1,5]benzothiazepine","Acta Crystallographica Section E","2007","63","11","o4268","o4268","10.1107/S1600536807048465","","","0.71073","MoKα","","0.0816","0.0448","","","0.1075","0.128","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215771","3.9934","0.0002","13.8082","0.0005","14.3502","0.0004","90","","97.008","0.004","90","","785.38","0.05","105","2","105","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","S-Methyl 5-methylpyrazine-2-carbothioate","","- C7 H8 N2 O S -","- C7 H8 N2 O S -","- C28 H32 N8 O4 S4 -","4","1","BH2136","Aubert, Emmanuel; Mamane, Victor; Fort, Yves","<i>S</i>-Methyl 5-methylpyrazine-2-carbothioate","Acta Crystallographica Section E","2007","63","11","o4306","o4307","10.1107/S1600536807048970","","","0.71073","MoKα","","0.0454","0.0397","","","0.1044","0.1093","","","","","","1.135","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215772","10.9824","0.0002","11.2924","0.0003","15.1189","0.0003","90","","110.331","0.001","90","","1758.2","0.07","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Poly[aqua(μ~2~-4,4'-bipyridyl-κ^2^<i>N</i>:<i>N</i>')(μ~2~-3-\ phosphonatobenzenesulfonato-κ^2^<i>O</i>:<i>O</i>')copper(II)]","","- C16 H15 Cu N2 O7 P S -","- C16 H15 Cu N2 O7 P S -","- C64 H60 Cu4 N8 O28 P4 S4 -","4","1","BH2137","Du, Zi-Yi; Xie, Yong-Rong; Wen, He-Rui","Poly[aqua(μ~2~-4,4'-bipyridyl-κ^2^<i>N</i>:<i>N</i>')(μ~2~-3-phosphonatobenzenesulfonato-κ^2^<i>O</i>:<i>O</i>')copper(II)]","Acta Crystallographica Section E","2007","63","11","m2766","m2767","10.1107/S1600536807050763","","","0.71073","MoKα","","0.0814","0.0465","","","0.092","0.1055","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215773","10.041","0.002","14.371","0.003","11.953","0.003","90","","104.714","0.003","90","","1668.2","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Aminopyridinium 2-hydroxy-2,2-diphenylacetate","","- C19 H18 N2 O3 -","- C19 H18 N2 O3 -","- C76 H72 N8 O12 -","4","1","BH2138","Li, Jie; Li, Hongbing; Sui, Lihui","2-Aminopyridinium 2-hydroxy-2,2-diphenylacetate","Acta Crystallographica Section E","2007","63","11","o4370","o4370","10.1107/S1600536807050787","","","0.71073","MoKα","","0.0692","0.0476","","","0.1172","0.1252","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215775","8.307","0.0002","6.5027","0.0002","22.0392","0.0006","90","","97.219","0.001","90","","1181.07","0.06","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,4-Naphthoquinon-2-yldimethylacetic acid","2-(1,4-Dioxo-1,4-dihydro-2-naphthyl)-2-methylpropanoic acid","","- C14 H12 O4 -","- C14 H12 O4 -","- C56 H48 O16 -","4","1","BI2238","Dempster-Rivett, Kieran J.; Main, Lyndsay; Nicholson, Brian K.; Denny, William A.","2-(1,4-Dioxo-1,4-dihydro-2-naphthyl)-2-methylpropanoic acid","Acta Crystallographica Section E","2007","63","11","o4251","o4251","10.1107/S1600536807048131","","","0.71073","MoKα","","0.0453","0.0333","","","0.0851","0.092","","","","","","1.027","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215776","24.1627","0.0005","24.1627","0.001","13.0428","0.0005","90","","90","","90","","7614.9","0.5","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","<i>cyclo</i>-Tetrakis[μ-<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-(2-hydroxy-3-\ methoxybenzylidene)hydrazinato(2-)]tetranickel(II) <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","","- C72 H76 N12 Ni4 O20 -","- C72 H76 N12 Ni4 O20 -","- C288 H304 N48 Ni16 O80 -","4","0.25","BI2239","Guan, Guizhi; Gao, Yuxiang; Wang, Lixia; Wang, Tao","<i>cyclo</i>-Tetrakis[μ-<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-(2-hydroxy-3-methoxybenzylidene)hydrazinato(2{-})]tetranickel(II) <i>N</i>,<i>N</i>-dimethylformamide tetrasolvate","Acta Crystallographica Section E","2007","63","11","m2662","m2662","10.1107/S1600536807048325","","","0.71073","MoKα","","0.0899","0.0415","","","0.1084","0.1479","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215777","12.3657","0.0005","20.8371","0.001","15.9938","0.0005","90","","105.48","0.02","90","","3971.6","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(cyanido-κC)bis(1,10-phenanthroline-κ^2^N,N')chromium(III) bis(azido-κN)[N,N'-(o-phenylene)bis(pyridine-2-carboxamide)-\ κ^4^N]chromate(III) monohydrate","","- C44 H30 Cr2 N16 O3 -","- C44 H30 Cr2 N16 O3 -","- C176 H120 Cr8 N64 O12 -","4","1","BI2240","Guan, Guizhi; Gao, Yuxiang; Wang, Lixia; Wang, Tao","Bis(cyanido-κ<i>C</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')chromium(III) bis(azido-κ<i>N</i>)[<i>N</i>,<i>N</i>'-(<i>o</i>-phenylene)bis(pyridine-2-carboxamide)-κ^4^<i>N</i>]chromate(III) monohydrate","Acta Crystallographica Section E","2007","63","11","m2750","m2750","10.1107/S1600536807049872","","","0.71073","MoKα","","0.067","0.0562","","","0.1552","0.1636","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215778","6.7323","0.0003","14.3303","0.0007","15.6502","0.0008","90","","99.152","0.001","90","","1490.65","0.12","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2,8-Trimethyl-2,3-dihydropyrano[2,3-<i>a</i>]carbazol-4(11<i>H</i>)-one","","- C18 H17 N O2 -","- C18 H17 N O2 -","- C72 H68 N4 O8 -","4","1","BI2241","Makuteswaran Sridharan; Karnam J. Rajendra Prasad; Matthias Zeller","2,2,8-Trimethyl-2,3-dihydropyrano[2,3-<i>a</i>]carbazol-4(11<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4344","o4344","10.1107/S1600536807050015","","","0.71073","MoKα","","0.069","0.0547","","","0.139","0.1497","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215779","20.236","0.003","7.5613","0.0011","17.379","0.003","90","","102.573","0.012","90","","2595.4","0.7","295","2","295","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","p-cresyl cinnamate","4-methylphenyl (<i>E</i>)-3-phenylpropenoate","","- C16 H14 O2 -","- C16 H14 O2 -","- C128 H112 O16 -","8","1","BI2242","Branko Kaitner; Vladimir Stilinović","<i>p</i>-Cresyl cinnamate","Acta Crystallographica Section E","2007","63","11","o4347","o4347","10.1107/S1600536807050064","","","0.71073","MoKα","","","0.0733","","","","0.1798","","","","","","1.128","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215780","9.777","0.004","7.772","0.004","12.184","0.006","90","","96.326","0.006","90","","920.2","0.8","298","2","298","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","1,1,4,4-Tetramethylpiperazinium tetraiodidocadmium(II)","","- C8 H20 Cd I4 N2 -","- C8 H20 Cd I4 N2 -","- C16 H40 Cd2 I8 N4 -","2","0.5","BI2243","Guo, Hong-Xu; Wu, Shu-Zhen; Cai, Mei-Shuang; Yao, Shan-Shan","1,1,4,4-Tetramethylpiperazinium tetraiodidocadmate(II)","Acta Crystallographica Section E","2007","63","11","m2747","m2747","10.1107/S1600536807050180","","","0.71073","MoKα","","0.0381","0.0334","","","0.0806","0.083","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215781","22.465","0.006","5.9323","0.0017","23.668","0.007","90","","92.432","0.005","90","","3151.4","1.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>S</i>-Benzyl 3-(2-bromobenzylidene)dithiocarbazate","","- C15 H13 Br N2 S2 -","- C15 H13 Br N2 S2 -","- C120 H104 Br8 N16 S16 -","8","2","BI2244","Qiu, Xiao-Yang; Luo, Zhi-Gang","<i>S</i>-Benzyl 3-(2-bromobenzylidene)dithiocarbazate","Acta Crystallographica Section E","2007","63","11","o4339","o4339","10.1107/S1600536807050209","","","0.71073","MoKα","","0.1885","0.0442","","","0.0877","0.1218","","","","","","0.792","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215782","7.865","0.003","17.017","0.007","13.711","0.006","90","","105.322","0.006","90","","1769.8","1.3","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Methyl 6-methoxygambogate","","- C40 H48 O8 -","- C40 H48 O8 -","- C80 H96 O16 -","2","1","BQ2036","Wenyuan Liu; Feng Feng; Xiaobing Wang; Qinglong Guo; Qidong You","Methyl 6-methoxygambogate","Acta Crystallographica Section E","2007","63","11","o4319","o4319","10.1107/S1600536807049537","","","0.71073","MoKα","","0.0929","0.0485","","","0.1207","0.1525","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215783","12.191","0.002","6.4315","0.0012","18.911","0.004","90","","100.713","0.003","90","","1456.9","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-Methylbenzoyl)-N'-(4-methylphenyl)thiourea","","- C16 H16 N2 O S -","- C16 H16 N2 O S -","- C64 H64 N8 O4 S4 -","4","1","BQ2038","Razis, S. Aminah A.; Yusof, M. Sukeri M.; Kadir, A. Maisara; Yamin, Bohari M.","<i>N</i>-(4-Methylbenzoyl)-<i>N</i>'-(4-methylphenyl)thiourea","Acta Crystallographica Section E","2007","63","11","o4395","o4395","10.1107/S1600536807049720","","","0.71073","MoKα","","0.0903","0.0563","","","0.1267","0.1422","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215784","13.052","0.003","22.35","0.005","8.0698","0.0016","90","","103.39","0.03","90","","2290.1","0.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichlorido(2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline)zinc(II) 0.35-hydrate","","- C26 H20.7 Cl2 N2 O0.35 Zn -","- C26 H20.7 Cl2 N2 O0.35 Zn -","- C104 H82.8 Cl8 N8 O1.4 Zn4 -","4","1","BQ2039","Qiu, Yu-E","Dichlorido(2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline)zinc(II) 0.35-hydrate","Acta Crystallographica Section E","2007","63","11","m2835","m2835","10.1107/S1600536807052580","","","0.71073","MoKα","","0.0687","0.0438","","","0.0966","0.1076","","","","","","1.009","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215785","9.054","0.003","8.535","0.002","17.828","0.005","90","","90.1","0.02","90","","1377.7","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(4-Chlorobenzyloxy)-3-methoxybenzaldehyde","","- C15 H13 Cl O3 -","- C15 H13 Cl O3 -","- C60 H52 Cl4 O12 -","4","1","BQ2040","Liu, Shou-Xin; Tian, Xia; Zhen, Xiao-Li; Li, Zhen-Chao; Han, Jian-Rong","4-(4-Chlorobenzyloxy)-3-methoxybenzaldehyde","Acta Crystallographica Section E","2007","63","11","o4481","o4481","10.1107/S1600536807052853","","","0.71073","MoKα","","0.1299","0.054","","","0.1257","0.1571","","","","","","1.075","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215786","7.374","0.001","7.374","0.001","10.709","0.002","90","","90","","90","","582.31","0.16","293","2","293","2","","","","","","","","5","P 4 21 2","P 4ab 2ab","90","sodium titanium silicate","disodium titanium tetrasilicate dihydrate","","- H4 Na2 O13 Si4 Ti -","- H4 Na2 O13 Si4 Ti -","- H8 Na4 O26 Si8 Ti2 -","2","0.25","BR2055","Ferdov, Stanislav; Kolitsch, Uwe; Lengauer, Christian; Tillmanns, Ekkehart; Lin, Zhi; Sá Ferreira, Rute A.","Refinement of the layered titanosilicate AM-1 from single-crystal X-ray diffraction data","Acta Crystallographica Section E","2007","63","11","i186","i186","10.1107/S160053680704812X","","","0.71073","MoKα","","0.0308","0.0245","","","0.0589","0.0606","","","","","","1.157","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215787","13.136","0.002","14.071","0.002","20.636","0.003","90","","90","","90","","3814.3","1","93","2","93","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Tris(1,10-phenanthroline-5,6-dione-κ^2^N,N')copper(II) bis(perchlorate) 4.5-hydrate","","- C36 H27 Cl2 Cu N6 O18.5 -","- C36 H27 Cl2 Cu N6 O18.5 -","- C144 H108 Cl8 Cu4 N24 O74 -","4","1","BR2056","Khalaji, Aliakbar Dehno; Slawin, Alexandra M. Z.; Woollins, J. Derek","Tris(1,10-phenanthroline-5,6-dione-κ^2^<i>N</i>,<i>N</i>')copper(II) bis(perchlorate) 4.5-hydrate","Acta Crystallographica Section E","2007","63","11","m2848","m2848","10.1107/S1600536807052348","","","0.71073","MoKα","","0.0544","0.0468","","","0.1147","0.1216","","","","","","0.954","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215788","11.1089","0.0013","8.7842","0.001","6.9077","0.0008","90","","120.074","0.002","90","","583.33","0.12","173","2","173","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","Bis(μ-dimethylamine-<i>N</i>:<i>N</i>)bis(dibromoboron)","2,2,4,4-Tetrabromo-1,1,3,3-tetramethylcyclodiborazane","","- C4 H12 B2 Br4 N2 -","- C4 H12 B2 Br4 N2 -","- C8 H24 B4 Br8 N4 -","2","0.25","BR2057","Fuks, Gad; Saffon, Nathalie; Bourissou, Didier; Bertrand, Guy","2,2,4,4-Tetrabromo-1,1,3,3-tetramethylcyclodiborazane","Acta Crystallographica Section E","2007","63","11","o4476","o4476","10.1107/S1600536807052385","","","0.71073","MoKα","","0.0363","0.0315","","","0.0817","0.0848","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215789","8.127","0.001","8.1518","0.0009","15.821","0.002","79.518","0.008","88.256","0.009","72.328","0.008","981.7","0.2","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","(E)-3-(2-Chloro-3,3,3-trifluoroprop-1-enyl)-N-(9,10-dioxo-9,10- dihydroanthracen-1-yl)-2,2-dimethylcyclopropanecarboxamide","","- C23 H17 Cl F3 N O3 -","- C23 H17 Cl F3 N O3 -","- C46 H34 Cl2 F6 N2 O6 -","2","1","BT2502","Yan, Fan-Yong; Liu, Dong-Qing","(<i>E</i>)-3-(2-Chloro-3,3,3-trifluoroprop-1-enyl)-<i>N</i>-(9,10-dioxo-9,10-dihydroanthracen-1-yl)-2,2-dimethylcyclopropanecarboxamide","Acta Crystallographica Section E","2007","63","11","o4201","o4201","10.1107/S160053680704408X","","","0.7107","MoKα","","0.0756","0.047","","","0.1078","0.1203","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215790","5.439","0.0007","8.7181","0.0011","12.0169","0.0015","78.835","0.002","80.571","0.002","87.946","0.002","551.47","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","<i>trans</i>-Dimethanolbis(1,1,1-trifluoro-5,5-dimethylhexane-2,4-\ dionato)cobalt(II)","","- C18 H28 Co F6 O6 -","- C18 H28 Co F6 O6 -","- C18 H28 Co F6 O6 -","1","0.5","BT2505","Lerach, Jordan O.; Zeller, Matthias; Leskiw, Brian D.","<i>trans</i>-Dimethanolbis(1,1,1-trifluoro-5,5-dimethylhexane-2,4-dionato)cobalt(II)","Acta Crystallographica Section E","2007","63","11","m2639","","10.1107/S1600536807044340","","","0.71073","MoKα","","0.0479","0.0431","","","0.1093","0.114","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215791","9.6312","0.0019","13.806","0.003","14.802","0.003","113.036","0.01","95.653","0.017","102.388","0.012","1732.3","0.7","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-chlorido-bis({2-[(triisopropylsilyl)aminomethyl]pyridine-κN}lithium(I))","","- C60 H112 Cl2 Li2 N8 Si4 -","- C60 H112 Cl2 Li2 N8 Si4 -","- C60 H112 Cl2 Li2 N8 Si4 -","1","0.5","BT2518","Koch, Christian; Görls, Helmar; Westerhausen, Matthias","Di-μ-chlorido-bis({2-[(triisopropylsilyl)aminomethyl]pyridine-κ<i>N</i>}lithium(I))","Acta Crystallographica Section E","2007","63","11","m2633","m2634","10.1107/S1600536807046442","","","0.71073","MoKα","","0.1369","0.0764","","","0.1788","0.2146","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215792","7.4399","0.0002","13.9413","0.0005","8.4118","0.0002","90","","96.928","0.002","90","","866.12","0.04","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>O</i>-methyl 3,4-dimethylpyrrole-2-thiocarboxylate","","- C8 H11 N O S -","- C8 H11 N O S -","- C32 H44 N4 O4 S4 -","4","1","BT2521","Kerscher, Tobias; Klüfers, Peter; Kügel, Wolfgang","Hydrogen-bond thio acceptors in <i>O</i>-methyl 3,4-dimethylpyrrole-2-thiocarboxylate","Acta Crystallographica Section E","2007","63","11","o4217","o4217","10.1107/S1600536807047599","","","0.71073","MoKα","","0.0462","0.0405","","","0.1133","0.1184","","","","","","1.096","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215793","13.102","0.003","6.4224","0.0017","18.292","0.005","90","","102.34","0.004","90","","1503.6","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-Methoxyphenyl)-N'-(4-methylbenzoyl)thiourea","","- C16 H16 N2 O2 S -","- C16 H16 N2 O2 S -","- C64 H64 N8 O8 S4 -","4","1","BT2523","Razis, Aminah M.; Yusof, M. Sukeri M.; Yamin, Bohari M.","<i>N</i>-(4-Methoxyphenyl)-<i>N</i>'-(4-methylbenzoyl)thiourea","Acta Crystallographica Section E","2007","63","11","o4225","o4225","10.1107/S1600536807047551","","","0.71073","MoKα","","0.0747","0.0499","","","0.1113","0.1225","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215794","25.663","0.004","8.2546","0.0011","14.894","0.002","90","","115.779","0.002","90","","2841.1","0.7","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-nitro-N-(2,4-dimethylphenyl)benzenesulfonamide","","- C14 H14 N2 O4 S -","- C14 H14 N2 O4 S -","- C112 H112 N16 O32 S8 -","8","1","BT2524","Shi, Fa-En","<i>N</i>-(2,4-Dimethylphenyl)-2-nitrobenzenesulfonamide","Acta Crystallographica Section E","2007","63","11","o4372","o4372","10.1107/S1600536807050489","","","0.71073","MoKα","","0.0516","0.0362","","","0.0906","0.1022","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215795","9.3891","0.0006","5.4617","0.0003","23.5796","0.0016","90","","92.209","0.002","90","","1208.27","0.13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Morpholine","2-(Morpholin-4-ylmethyl)isoindole-1,3-dione","","- C13 H14 N2 O3 -","- C13 H14 N2 O3 -","- C52 H56 N8 O12 -","4","1","BT2525","P. Sakthivel; P. S. Joseph; A. Sebastiyan; M. Ramesh; M. Yosuva Suvaikin","2-(Morpholin-4-ylmethyl)isoindole-1,3-dione","Acta Crystallographica Section E","2007","63","11","o4284","o4284","10.1107/S1600536807048738","","","0.71073","MoKα","","0.0715","0.0443","","","0.1237","0.145","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215796","10.696","0.001","3.982","0.0006","27.796","0.003","90","","93.045","0.008","90","","1182.2","0.2","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3-Dichlorophenyl benzoate","","- C13 H8 Cl2 O2 -","- C13 H8 Cl2 O2 -","- C52 H32 Cl8 O8 -","4","1","BT2526","B. Thimme Gowda; Sabine Foro; K. S. Babitha; Hartmut Fuess","2,3-Dichlorophenyl benzoate","Acta Crystallographica Section E","2007","63","11","o4286","o4286","10.1107/S1600536807048751","","","1.5418","CuKα","","0.0513","0.0473","","","0.1241","0.1286","","","","","","1.078","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215797","7.954","0.007","10.317","0.008","13.537","0.011","90","","97.157","0.016","90","","1102.2","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexaaquamanganese(II) bis[5-(4-nitrophenyl)tetrazolate]","","- C14 H20 Mn N10 O10 -","- C14 H20 Mn N10 O10 -","- C28 H40 Mn2 N20 O20 -","2","0.5","BT2527","Hu, Bin; Xu, Xiong-Bin; Li, Yong-Xiu; Ye, Heng-Yun","Hexaaquamanganese(II) bis[5-(4-nitrophenyl)tetrazolate]","Acta Crystallographica Section E","2007","63","11","m2698","m2698","10.1107/S1600536807048945","","","0.71073","MoKα","","0.0438","0.0378","","","0.0958","0.1003","","","","","","1.084","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215798","14.671","0.003","11.947","0.002","8.2025","0.0016","90","","90","","90","","1437.7","0.5","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","catena-Poly[[(2-amino-5-chlorobenzenesulfonato-κ^2^N,O)silver(I)]-μ- 2,5-dimethylpyrazine-κ^2^N:N']","","- C12 H13 Ag Cl N3 O3 S -","- C12 H13 Ag Cl N3 O3 S -","- C48 H52 Ag4 Cl4 N12 O12 S4 -","4","1","BT2528","Hai-Yan Liu; Ji-Cheng Ma; Jin Yang","<i>catena</i>-Poly[[(2-amino-5-chlorobenzenesulfonato-κ^2^<i>N</i>,<i>O</i>)silver(I)]-μ-2,5-dimethylpyrazine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","11","m2700","m2700","10.1107/S1600536807048957","","","0.71073","MoKα","","0.0304","0.0254","","","0.0509","0.0527","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215799","12.1073","0.0007","11.4851","0.0005","20.2336","0.0009","90","","100.858","0.003","90","","2763.2","0.2","183","2","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-(2,2'-bipyridine)dichlorido[methyl 1-(phenylhydrazono)-1-(phenylimino)acetato]ruthenium(II) dichloromethane solvate","","- C26 H23 Cl4 N5 O2 Ru -","- C26 H23 Cl4 N5 O2 Ru -","- C104 H92 Cl16 N20 O8 Ru4 -","4","1","BT2529","Al-Noaimi, Mousa; El-khateeb, Mohammad; Görls, Helmar","<i>trans</i>-(2,2'-Bipyridine)dichlorido[methyl 1-(phenylhydrazono)-1-(phenylimino)acetato]ruthenium(II) dichloromethane solvate","Acta Crystallographica Section E","2007","63","11","m2712","m2712","10.1107/S1600536807049239","","","0.71073","MoKα","","0.143","0.0664","","","0.1395","0.1692","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215800","7.9714","0.0016","12.045","0.002","15.434","0.003","90","","91.44","0.03","90","","1481.4","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,2'-Bipyridinium 1-oxide triiodide","","- C10 H9 I3 N2 O -","- C10 H9 I3 N2 O -","- C40 H36 I12 N8 O4 -","4","1","BT2530","Lin, Xiao Lan; Wang, Yun Jie; Chen, Zhi Rong; Liu, Ji Bo","2,2'-Bipyridinium 1-oxide triiodide","Acta Crystallographica Section E","2007","63","11","o4322","o4322","10.1107/S1600536807049215","","","0.71073","MoKα","","0.0715","0.0387","","","0.0804","0.0901","","","","","","1.062","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215801","7.2518","0.0007","20.6995","0.0019","11.3088","0.0011","90","","95.914","0.005","90","","1688.5","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[2-(2-pyridyl)-1H-benzimidazole]cobalt(II)]-μ-\ benzene-1,4-dicarboxylato]","","- C20 H13 Co N3 O4 -","- C20 H13 Co N3 O4 -","- C80 H52 Co4 N12 O16 -","4","1","BT2531","Xia, Chang-Kun; Wu, Wen; Chen, Qiu-Yun; Xie, Ji-Min","<i>catena</i>-Poly[[[2-(2-pyridyl)-1<i>H</i>-benzimidazole]cobalt(II)]-μ-benzene-1,4-dicarboxylato]","Acta Crystallographica Section E","2007","63","11","m2726","m2726","10.1107/S1600536807049264","","","0.71073","MoKα","","0.0647","0.0487","","","0.0924","0.1","","","","","","1.102","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2215802","13.689","0.001","13.689","0.001","20.098","0.001","90","","90","","90","","3766.1","0.4","173","2","173","2","","","","","","","","3","I -4","I -4","82","","Tetrakis(phenylethynyl)tin(IV)","","- C32 H20 Sn -","- C32 H20 Sn -","- C192 H120 Sn6 -","6","0.75","BT2532","Lahcini, Mohammed; Räisänen, Minna T.; Castro, Pascal M.; Klinga, Martti; Leskelä, Markku","Tetrakis(phenylethynyl)tin(IV)","Acta Crystallographica Section E","2007","63","11","m2762","m2762","10.1107/S1600536807050507","","","0.71073","MoKα","","0.1186","0.0487","","","0.0647","0.0775","","","","","","0.928","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215803","7.97","0.004","9.77","0.004","9.913","0.004","117.964","0.004","104.582","0.005","91.773","0.005","649.7","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","bis[μ-bis(imidazol-1-yl)methane]bis[aqua(oxalato)copper(II)] dihydrate","","- C18 H24 Cu2 N8 O12 -","- C18 H24 Cu2 N8 O12 -","- C18 H24 Cu2 N8 O12 -","1","0.5","BT2533","Shouwen Jin; Daqi Wang","Bis[μ-bis(imidazol-1-yl)methane]bis[aqua(oxalato)copper(II)] dihydrate","Acta Crystallographica Section E","2007","63","11","m2755","m2756","10.1107/S1600536807050465","","","0.71073","MoKα","","0.0327","0.0273","","","0.0689","0.0717","","","","","","1.084","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215804","9.0609","0.0003","10.0777","0.0003","13.0192","0.0003","90","","90","","90","","1188.82","0.06","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Pyrrolidine","2-(Pyrrolidin-1-ylmethyl)isoindoline-1,3-dione","","- C13 H14 N2 O2 -","- C13 H14 N2 O2 -","- C52 H56 N8 O8 -","4","1","BT2534","P. Sakthivel; P. S. Joseph; A. Sebastiyan; M. Yosuva Suvaikin; M. Ramesh","2-(Pyrrolidin-1-ylmethyl)isoindoline-1,3-dione","Acta Crystallographica Section E","2007","63","11","o4388","o4388","10.1107/S1600536807050519","","","0.71073","MoKα","","0.0679","0.0442","","","0.1182","0.1335","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215805","5.7585","0.0004","9.8447","0.0008","12.9961","0.001","79.216","0.001","79.014","0.001","83.779","0.001","708.46","0.09","100","","100","","","","","","","","","4","P -1","-P 1","2","","N-(4-nitrophenyl)-N'-phenylsuccinamide","","- C16 H15 N3 O4 -","- C16 H15 N3 O4 -","- C32 H30 N6 O8 -","2","1","BT2535","Butcher, Ray J.; Jasinski, Jerry P.; Ravindra, H.J.; Dharmaprakash, S.M.","<i>N</i>-(4-Nitrophenyl)-<i>N</i>'-phenylsuccinamide","Acta Crystallographica Section E","2007","63","11","o4367","o4367","10.1107/S1600536807050477","","","0.71073","MoKα","","0.0572","0.0539","","","0.146","0.149","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215806","8.677","0.002","15.615","0.003","10.435","0.002","90","","111.29","0.02","90","","1317.4","0.5","293","","293","","","","","","","","","6","C 1 c 1","C -2yc","9","Sulfamethoxazole chloride","4-[(5-methylisoxazol-3-yl)aminosulfonyl]anilinium chloride","","- C10 H12 Cl N3 O3 S -","- C10 H12 Cl N3 O3 S -","- C40 H48 Cl4 N12 O12 S4 -","4","1","BT2536","Annamalai Subashini; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","Hydrogen-bonding patterns in 4-[(5-methylisoxazol-3-yl)aminosulfonyl]anilinium chloride","Acta Crystallographica Section E","2007","63","11","o4312","o4313","10.1107/S1600536807049446","","","0.71073","MoKα","","0.0728","0.0367","","","0.0626","0.0709","","","","","","0.897","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215807","7.6493","0.0008","12.8459","0.001","14.2061","0.0011","90","","90","","90","","1395.9","0.2","290","2","290","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Ethyl (1-methyl-3-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-4-yl)acetate","","- C13 H15 N3 O2 S -","- C13 H15 N3 O2 S -","- C52 H60 N12 O8 S4 -","4","1","BT2537","Kruszynski, Rafal; Trzesowska, Agata; Przybycin, Magdalena; Dopieralski, Mariusz; Dobosz, Maria","Ethyl (1-methyl-3-phenyl-5-thioxo-4,5-dihydro-1<i>H</i>-1,2,4-triazol-4-yl)acetate","Acta Crystallographica Section E","2007","63","11","o4371","o4371","10.1107/S1600536807050635","","","1.54178","CuKα","","0.0509","0.0402","","","0.113","0.1202","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215808","7.8978","0.0008","18.534","0.002","6.8486","0.0006","90","","103.232","0.008","90","","975.87","0.17","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-(Dicyanomethylidene)-6,6-dimethylcyclohexa-1,4-diene","","- C11 H10 N2 -","- C11 H10 N2 -","- C44 H40 N8 -","4","1","BT2538","Kämpen, Jan; Jones, Peter G.; Bubenitschek, Peter; Hopf, Henning","3-(Dicyanomethylidene)-6,6-dimethylcyclohexa-1,4-diene","Acta Crystallographica Section E","2007","63","11","o4351","o4351","10.1107/S160053680705060X","","","0.71073","MoKα","","0.0626","0.0512","","","0.126","0.1318","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215809","32.008","0.008","4.9175","0.0012","13.945","0.004","90","","95.326","0.004","90","","2185.5","1","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(E,E)-N,N'-Bis(3,4,5-trimethoxybenzylidene)ethylenediamine","","- C22 H28 N2 O6 -","- C22 H28 N2 O6 -","- C88 H112 N8 O24 -","4","0.5","BT2540","Aliakbar Dehno Khalaji; Korbanjhon Brad; Yan Zhang","(<i>E</i>,<i>E</i>)-<i>N</i>,<i>N</i>'-Bis(3,4,5-trimethoxybenzylidene)ethylenediamine","Acta Crystallographica Section E","2007","63","11","o4389","o4389","10.1107/S1600536807050532","","","0.71073","MoKα","","0.0635","0.0379","","","0.1046","0.1214","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215810","7.1741","0.0014","8.5862","0.0017","19.994","0.004","90","","90","","90","","1231.6","0.4","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4,5,6,7-Tetrafluoro-2-(2-hydroxyphenyl)isoindoline-1,3-dione","","- C14 H5 F4 N O3 -","- C14 H5 F4 N O3 -","- C56 H20 F16 N4 O12 -","4","1","BT2541","Wang, Shou-Xin; Tian, Lai-Jin","4,5,6,7-Tetrafluoro-2-(2-hydroxyphenyl)isoindoline-1,3-dione","Acta Crystallographica Section E","2007","63","11","o4382","o4382","10.1107/S1600536807050908","","","0.71073","MoKα","","0.0304","0.029","","","0.0768","0.0783","","","","","","1.085","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215811","8.7642","0.0015","8.7401","0.0014","11.0393","0.0018","90","","106.459","0.007","90","","811","0.2","113","2","113","2","","","","","","","","3","P 1 21 1","P 2yb","4","","1,2,3,4-Tetrahydroquinolin-7-amine","","- C9 H12 N2 -","- C9 H12 N2 -","- C36 H48 N8 -","4","2","BT2542","Yan, Fan-Yong; Liu, Dong-Qing; Cao, Xiao-Hui; Yan, Xi-Long; Wang, Jin-Peng","1,2,3,4-Tetrahydroquinolin-7-amine","Acta Crystallographica Section E","2007","63","11","o4455","o4455","10.1107/S1600536807050878","","","0.7107","MoKα","","0.0492","0.0423","","","0.0895","0.0932","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215812","9.0309","0.0012","13.824","0.002","15.654","0.002","109.619","0.003","101.729","0.004","94.164","0.003","1781.3","0.4","133","2","133","2","","","","","","","","7","P -1","-P 1","2","","{2,6-bis[(1,3-di-tert-butylimidazolin-2-ylideneamino)methyl]pyridine}(hydrogen carbonato)copper(II) hexafluoridophosphate","","- C30 H48 Cu F6 N7 O3 P -","- C30 H48 Cu F6 N7 O3 P -","- C60 H96 Cu2 F12 N14 O6 P2 -","2","1","BT2543","Jones, Peter G.; Hrib, Cristian G.; Petrovic, Dejan; Tamm, Matthias","A solvent-free modification of {2,6-bis[(1,3-di-<i>tert</i>-butylimidazolin-2-ylideneamino)methyl]pyridine}(hydrogen carbonato)copper(II) hexafluoridophosphate","Acta Crystallographica Section E","2007","63","11","m2768","m2768","10.1107/S1600536807051203","","","0.71073","MoKα","","0.0762","0.0415","","","0.0844","0.0979","","","","","","1.015","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215813","5.1706","0.0003","9.4818","0.0006","15.6763","0.0009","90","","99.25","0.005","90","","758.56","0.08","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(3-Methyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-4-yl)acetic acid","","- C5 H7 N3 O2 S -","- C5 H7 N3 O2 S -","- C20 H28 N12 O8 S4 -","4","1","BT2545","Kruszynski, Rafal; Trzesowska, Agata; Przybycin, Magdalena; Gil, Kamil; Dobosz, Maria","2-(3-Methyl-5-thioxo-4,5-dihydro-1<i>H</i>-1,2,4-triazol-4-yl)acetic acid","Acta Crystallographica Section E","2007","63","11","o4378","o4378","10.1107/S1600536807051185","","","0.71073","MoKα","","0.0474","0.0343","","","0.0799","0.0872","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215814","7.7201","0.0006","19.4695","0.0016","13.412","0.0011","90","","100.29","0.004","90","","1983.5","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(SP-4-2)-(4,4'-Di-<i>tert</i>-butyl-2,2'-bipyridine- κ<i>N</i>,κ<i>N</i>')diiodidopalladium(II)","","- C18 H24 I2 N2 Pd -","- C18 H24 I2 N2 Pd -","- C72 H96 I8 N8 Pd4 -","4","1","BT2547","Jones, Peter G.; Fernández-Rodríguez, María J.; Martínez-Martínez, Antonio J.","(<i>SP</i>-4-2)-(4,4'-Di-<i>tert</i>-butyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')diiodidopalladium(II)","Acta Crystallographica Section E","2007","63","11","m2758","m2758","10.1107/S1600536807050830","","","0.71073","MoKα","","0.053","0.0434","","","0.1152","0.1211","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215815","10.0763","0.0008","6.9018","0.0007","22.1841","0.0018","90","","98.69","0.007","90","","1525.1","0.2","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-Benzylidene-8-methoxy-6-(prop-1-enyl)chroman-4-one","","- C20 H18 O3 -","- C20 H18 O3 -","- C80 H72 O12 -","4","1","BT2548","R. Suresh; Charles C. Kanagam; P. R. Umarani; V. Manivannan; Büyükgüngör, Orhan","3-Benzylidene-8-methoxy-6-(prop-1-enyl)chroman-4-one","Acta Crystallographica Section E","2007","63","11","o4387","o4387","10.1107/S1600536807051161","","","0.71073","MoKα","","0.1434","0.0679","","","0.1491","0.1826","","","","","","0.917","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215816","8.8554","0.0003","7.8466","0.0003","16.6251","0.0005","90","","90","","90","","1155.19","0.07","120","2","120","2","","","","","","","","6","P b c m","-P 2c 2b","57","","2-Hydroxypropane-1,3-diammonium bis(phosphonato)zincate(II) hemihydrate","","- C3 H15 N2 O7.5 P2 Zn -","- C3 H15 N2 O7.5 P2 Zn -","- C12 H60 N8 O30 P8 Zn4 -","4","0.5","BT2549","Holtby, Andrew S.; Harrison, William T. A.","2-Hydroxypropane-1,3-diammonium bis(phosphonato)zincate(II) hemihydrate","Acta Crystallographica Section E","2007","63","11","m2779","m2779","10.1107/S1600536807051197","","","0.71073","MoKα","","0.0312","0.0284","","","0.0623","0.0638","","","","","","1.122","","","","has coordinates,has disorder,has Fobs","211332","2020-10-21","18:00:00",""
"2215817","7.365","0.002","19.788","0.003","13.658","0.002","90","","92.7","0.02","90","","1988.3","0.7","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,6-Diamino-5-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-ylmethyl)-4-oxopyrimidin-1-ium 3,5-dinitrobenzoate","","- C16 H16 N10 O8 -","- C16 H16 N10 O8 -","- C64 H64 N40 O32 -","4","1","BT2550","Annamalai Subashini; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","2,6-Diamino-5-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-ylmethyl)-4-oxopyrimidin-1-ium 3,5-dinitrobenzoate","Acta Crystallographica Section E","2007","63","11","o4408","o4409","10.1107/S1600536807051276","","","0.71073","MoKα","","0.0636","0.0441","","","0.121","0.1287","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215818","12.529","0.003","12.71","0.003","17.707","0.007","90","","113.58","0.02","90","","2584.3","1.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5-(4'-Methylbiphenyl-2-yl)-2-triphenylmethyl-2H-tetrazole","","- C33 H26 N4 -","- C33 H26 N4 -","- C132 H104 N16 -","4","1","BT2551","Wang, Guo-Xi; Ye, Heng-Yun","5-(4'-Methylbiphenyl-2-yl)-2-triphenylmethyl-2<i>H</i>-tetrazole","Acta Crystallographica Section E","2007","63","11","o4410","o4410","10.1107/S1600536807051537","","","0.71073","MoKα","","0.0987","0.0595","","","0.1292","0.148","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215819","33.867","0.002","7.4289","0.0003","12.2015","0.0008","90","","94.241","0.002","90","","3061.4","0.3","120","","120","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,4-diamino-6-phenyl-1,3,5-triazine‒sorbic acid (1/1)","","- C15 H17 N5 O2 -","- C15 H17 N5 O2 -","- C120 H136 N40 O16 -","8","1","BT2556","Kaliyaperumal Thanigaimani; Packianathan Thomas Muthiah; Daniel E. Lynch","Hydrogen-bonding patterns in the cocrystal 2,4-diamino-6-phenyl-1,3,5-triazine‒sorbic acid (1/1)","Acta Crystallographica Section E","2007","63","11","o4450","o4451","10.1107/S1600536807052543","","","0.71073","MoKα","","0.0904","0.0587","","","0.1337","0.1505","","","","","","1.097","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215820","4.4223","0.0009","22.469","0.004","9.022","0.002","90","","99.89","0.02","90","","883.1","0.3","299","2","299","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Chloro-<i>N</i>-(4-chlorophenyl)acetamide","","- C8 H7 Cl2 N O -","- C8 H7 Cl2 N O -","- C32 H28 Cl8 N4 O4 -","4","1","BT2563","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","2-Chloro-<i>N</i>-(4-chlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","11","o4488","o4488","10.1107/S1600536807053093","","","0.71073","MoKα","","0.0559","0.0453","","","0.1183","0.1251","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215821","12.364","0.003","16.826","0.004","8.77","0.002","90","","108.682","0.005","90","","1728.4","0.7","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(<i>Z</i>)-2,5-Dimethyl-3,4-diphenylhex-3-ene-2,5-diol","","- C20 H24 O2 -","- C20 H24 O2 -","- C80 H96 O8 -","4","1","BV2060","Li, Shu-Hong; Xu, Cai-Hong","(<i>Z</i>)-2,5-Dimethyl-3,4-diphenylhex-3-ene-2,5-diol","Acta Crystallographica Section E","2007","63","11","o4200","o4200","10.1107/S1600536807042250","","","0.71073","MoKα","","0.0841","0.0433","","","0.0923","0.1108","","","","","","1.012","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215822","18.701","0.003","9.418","0.0016","19.356","0.003","90","","90","","90","","3409.1","1","294","2","294","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","(<i>E</i>)-<i>N</i>-(2-Bromophenyl)-3-(2-chloro-3,3,3-trifluoroprop-1-enyl)- 2,2-dimethylcyclopropanecarboxamide","","- C15 H14 Br Cl F3 N O -","- C15 H14 Br Cl F3 N O -","- C120 H112 Br8 Cl8 F24 N8 O8 -","8","1","BV2066","Liu, Dong-Qing; Yan, Fan-Yong","(<i>E</i>)-<i>N</i>-(2-Bromophenyl)-3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropanecarboxamide","Acta Crystallographica Section E","2007","63","11","o4202","o4202","10.1107/S1600536807045916","","","0.71073","MoKα","","0.1308","0.0545","","","0.1437","0.2045","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215823","11.715","0.002","9.7852","0.0017","18.079","0.003","90","","95.631","0.002","90","","2062.5","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis{(E)-1-[1-(2-pyridyl)ethylidene]thiosemicarbazonato-κ^3^N,N',S}gallium(III) nitrate","","- C16 H18 Ga N9 O3 S2 -","- C16 H18 Ga N9 O3 S2 -","- C64 H72 Ga4 N36 O12 S8 -","4","1","BV2067","Fan, Ying-Ju; Ma, Jian-Ping; Sun, Zhong-Xi","Bis{(<i>E</i>)-1-[1-(2-pyridyl)ethylidene]thiosemicarbazonato-κ^3^<i>N</i>,<i>N</i>',<i>S</i>}gallium(III) nitrate","Acta Crystallographica Section E","2007","63","11","m2663","m2663","10.1107/S160053680704799X","","","0.71073","MoKα","","0.0333","0.0287","","","0.0776","0.0802","","","","","","1.019","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2215824","7.666","0.0009","9.581","0.0008","10.278","0.0006","104.325","0.003","99.768","0.004","96.03","0.003","712.23","0.11","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2,2'-Methylenebis(isoindoline-1,3-dione)","","- C17 H10 N2 O4 -","- C17 H10 N2 O4 -","- C34 H20 N4 O8 -","2","1","BV2068","Zhou Jiang; Jun-Dong Wang; Mei-Jin Lin; Nai-Sheng Chen; Jin-Ling Huang","2,2'-Methylenebis(isoindoline-1,3-dione)","Acta Crystallographica Section E","2007","63","11","o4385","o4385","10.1107/S1600536807050738","","","0.71069","MoKα","","0.0583","0.0455","","","0.1163","0.1244","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215826","8.6071","0.0009","5.9337","0.0006","9.7415","0.001","90","","98.508","0.009","90","","492.04","0.09","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-methylthiosemicarbazide","","- C2 H7 N3 S -","- C2 H7 N3 S -","- C8 H28 N12 S4 -","4","1","BV2072","Thomas M. Klapötke; Stefan M. Sproll","2-Methylthiosemicarbazide","Acta Crystallographica Section E","2007","63","11","o4270","o4270","10.1107/S1600536807048398","","","0.71073","MoKα","","0.0348","0.034","","","0.078","0.0786","","","","","","1.128","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215827","8.629","0.002","9.155","0.002","26.484","0.005","90","","90","","90","","2092.2","0.8","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2,8-Dimethoxy-4,10-dimethyl-1,3,7,9-tetranitro Tröger's base","2,8-Dimethoxy-4,10-dimethyl-1,3,7,9-tetranitro-6<i>H</i>,12<i>H</i>- 5,11-methanodibenzo[<i>b</i>,<i>f</i>][1,5]diazocine","","- C19 H18 N6 O10 -","- C19 H18 N6 O10 -","- C76 H72 N24 O40 -","4","1","BV2074","Bhuiyan, M. Delower H.; Jensen, Paul; Try, Andrew C.","2,8-Dimethoxy-4,10-dimethyl-1,3,7,9-tetranitro-6<i>H</i>,12<i>H</i>-5,11-methanodibenzo[<i>b</i>,<i>f</i>][1,5]diazocine","Acta Crystallographica Section E","2007","63","11","o4393","o4393","10.1107/S1600536807050945","","","0.71073","MoKα","","0.0337","0.0312","","","0.0835","0.0869","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215828","6.0449","0.0005","12.7217","0.001","13.6242","0.0011","68.414","0.001","81.952","0.001","81.507","0.001","959.37","0.13","297","2","297","2","","","","","","","","4","P -1","-P 1","2","","1-Bromo-2,6-bis(4-methylpiperazin-1-ylmethyl)benzene","","- C18 H29 Br N4 -","- C18 H29 Br N4 -","- C36 H58 Br2 N8 -","2","1","BV2075","Copolovici, Lucian; Bojan, Vilma; Silvestru, Cristian; Varga, Richard A.","1-Bromo-2,6-bis(4-methylpiperazin-1-ylmethyl)benzene","Acta Crystallographica Section E","2007","63","11","o4323","o4323","10.1107/S1600536807049781","","","0.71073","MoKα","","0.0677","0.0549","","","0.105","0.1093","","","","","","1.165","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215830","7.7101","0.0015","12.987","0.003","13.059","0.003","113.31","0.03","103.62","0.03","100.99","0.03","1106.5","0.6","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Triaqua[3-(4-carboxylatophenoxy)propionato-κO](1,10-phenanthroline- κ^2^N,N')zinc(II)","","- C22 H22 N2 O8 Zn -","- C22 H22 N2 O8 Zn -","- C44 H44 N4 O16 Zn2 -","2","1","BX2110","Li-Li Kong; Shan Gao; Li-Hua Huo","Triaqua[3-(4-carboxylatophenoxy)propionato-κ<i>O</i>](1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II)","Acta Crystallographica Section E","2007","63","11","m2800","m2801","10.1107/S1600536807051318","","","0.71073","MoKα","","0.0435","0.0315","","","0.0776","0.1005","","","","","","1.158","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215831","6.809","0.004","4.84","0.003","11.946","0.007","90","","92.218","0.009","90","","393.4","0.4","298","2","298","2","","","","","","","","5","P 1 c 1","P -2yc","7","1-(carboxymethyl)-5-fluorouracil","5-fluoro-2,4,-dioxo-1,2,3,4-tetrahydropyrimidine-1-acetic acid","","- C6 H5 F N2 O4 -","- C6 H5 F N2 O4 -","- C12 H10 F2 N4 O8 -","2","1","CF2143","Qiao-Chu Zhang; Zhan Shu; Liang Shen; Qi Wang; Zhi-Min Jin","A second polymorph of 1-(carboxymethyl)-5-fluorouracil","Acta Crystallographica Section E","2007","63","11","o4214","o4214","10.1107/S1600536807046454","","","0.71073","MoKα","","0.0729","0.067","","","0.1978","0.2034","","","","","","1.009","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215832","25.009","0.0008","21.194","0.0005","14.5843","0.0004","90","","119.81","0.0009","90","","6707.4","0.3","180","1","180","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","[(Z)-2-(3-Methyl-1,2,4-oxadiazol-5-yl)-2-(1-naphthyl)ethenylamino]formaldehyde oxime 1,4-dioxane hemisolvate","","- C18 H18 N4 O3 -","- C18 H18 N4 O3 -","- C288 H288 N64 O48 -","16","2","CF2149","Okuda, Kensuke; Watanabe, Hiromi; Hirota, Takashi; Gotoh, Kazuma; Ishida, Hiroyuki","[(<i>Z</i>)-2-(3-Methyl-1,2,4-oxadiazol-5-yl)-2-(1-naphthyl)ethenylamino]formaldehyde oxime 1,4-dioxane hemisolvate","Acta Crystallographica Section E","2007","63","11","o4261","o4262","10.1107/S1600536807048301","","","0.71075","MoKα","","0.0719","0.047","","","0.1277","0.1373","","","","","","1.063","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2215833","6.601","0.0001","13.8353","0.0002","37.7572","0.0006","90","","90","","90","","3448.24","0.09","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","benzodiazepine","2,4,4-Trimethyl-N-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-1-carboxamide","","- C19 H23 N3 O -","- C19 H23 N3 O -","- C152 H184 N24 O8 -","8","1","CF2151","Thiruvalluvar, A; Ponnuswamy, S","2,4,4-Trimethyl-<i>N</i>-phenyl-2,3,4,5-tetrahydro-1<i>H</i>-1,5-benzodiazepine-1-carboxamide","Acta Crystallographica Section E","2007","63","11","o4264","o4264","10.1107/S1600536807048519","","","0.71073","MoKα","","0.0715","0.0451","","","0.1035","0.1158","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215835","10.9161","0.0005","9.9986","0.0005","17.7812","0.001","90","","101.291","0.002","90","","1903.18","0.17","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di-μ-oxido-bis({2,2'-[propane-1,3- diylbis(nitrilomethylidyne)]diphenolato}vanadium(IV)) dimethylformamide disolvate","","- C40 H46 N6 O8 V2 -","- C40 H46 N6 O8 V2 -","- C80 H92 N12 O16 V4 -","2","0.5","CF2153","Liu, Ying; Dou, Jianmin; Niu, Meiju; Zhang, Xianxi","Di-μ-oxido-bis({2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato}vanadium(IV)) dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","11","m2731","m2731","10.1107/S1600536807049987","","","0.71073","MoKα","","0.0513","0.0439","","","0.125","0.1335","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215836","10.086","0.003","12.05","0.003","10.521","0.003","90","","91.281","0.003","90","","1278.4","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[(1,3-benzothiazol-2-ylsulfanyl)acetato-κO]bis(imidazole-κN^3^)copper(II)","","- C24 H20 Cu N6 O4 S4 -","- C24 H20 Cu N6 O4 S4 -","- C48 H40 Cu2 N12 O8 S8 -","2","0.5","CF2156","Bian, He-Dong; Huang, Fu-Ping; Yu, Qing; Liang, Hong","Bis[(1,3-benzothiazol-2-ylsulfanyl)acetato-κ<i>O</i>]bis(imidazole-κ<i>N</i>^3^)copper(II)","Acta Crystallographica Section E","2007","63","11","m2821","m2821","10.1107/S1600536807051586","","","0.71073","MoKα","","0.047","0.0307","","","0.0756","0.0894","","","","","","1.003","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215837","14.638","0.002","10.77","0.001","26.09","0.003","90","","90","","90","","4113.1","0.8","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","[N,N'-Bis(4-chlorobenzyl)propane-1,2-diamine]dichloridozinc(II)","","- C17 H20 Cl4 N2 Zn -","- C17 H20 Cl4 N2 Zn -","- C136 H160 Cl32 N16 Zn8 -","8","1","CF2157","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Xia, Hai-Tao","[<i>N</i>,<i>N</i>'-Bis(4-chlorobenzyl)propane-1,2-diamine]dichloridozinc(II)","Acta Crystallographica Section E","2007","63","11","m2763","m2763","10.1107/S1600536807050866","","","0.71073","MoKα","","0.2121","0.115","","","0.1837","0.217","","","","","","1.286","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215838","14.7784","0.0013","11.9726","0.0009","8.6133","0.0006","90","","90","","90","","1524","0.2","296","","296","","","","","","","","","4","P n a 21","P 2c -2n","33","","4-(4-Allyl-2-methoxyphenoxy)benzene-1,2-dicarbonitrile","","- C18 H14 N2 O2 -","- C18 H14 N2 O2 -","- C72 H56 N8 O8 -","4","1","CI2458","S̨ahin, Onur; Büyükgüngör, Orhan; S̨as̨maz, Selami; Kantar, Cihan","4-(4-Allyl-2-methoxyphenoxy)benzene-1,2-dicarbonitrile","Acta Crystallographica Section E","2007","63","11","o4205","o4205","10.1107/S1600536807045138","","","0.71073","MoKα","","0.0555","0.0351","","","0.089","0.0993","","","","","","0.906","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215839","9.6123","0.0008","15.7991","0.0013","21.4207","0.0018","90","","90","","90","","3253.1","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Al-TADDOLate","(2,2-Dimethyl-α,α,α',α'-tetraphenyl-1,3-dioxolane-4,5-dimethanolato- κ^2^<i>O</i>^4^,<i>O</i>^5^)ethyl(tetrahydrofuran-κ<i>O</i>)aluminium(III)","","- C37 H41 Al O5 -","- C37 H41 Al O5 -","- C148 H164 Al4 O20 -","4","1","CI2463","Chen, Chien-An; Wu, Kuo-Hui; Gau, Han-Mou","(2,2-Dimethyl-α,α,α',α'-tetraphenyl-1,3-dioxolane-4,5-dimethanolato-κ^2^<i>O</i>^4^,<i>O</i>^5^)ethyl(tetrahydrofuran-κ<i>O</i>)aluminium(III)","Acta Crystallographica Section E","2007","63","11","m2665","m2666","10.1107/S1600536807048052","","","0.71073","MoKα","","0.054","0.0423","","","0.1144","0.1216","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215840","12.6551","0.0005","10.2166","0.0003","16.096","0.0006","90","","102.738","0.002","90","","2029.87","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl 2-acetamidomethyl-5-methoxy-1-(phenylsulfonyl)indole-3-carboxylate","","- C21 H22 N2 O6 S -","- C21 H22 N2 O6 S -","- C84 H88 N8 O24 S4 -","4","1","CI2467","Pon. Sathya Moorthy; M. Balasubramanian; V. Dhayalan; A. K. Mohanakrishnan; M. N. Ponnuswamy","Ethyl 2-acetamidomethyl-5-methoxy-1-(phenylsulfonyl)indole-3-carboxylate","Acta Crystallographica Section E","2007","63","11","o4223","o4223","10.1107/S1600536807047563","","","0.71073","MoKα","","0.0592","0.0418","","","0.117","0.132","","","","","","1.027","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215841","10.0344","0.0011","17.3861","0.0019","20.768","0.002","90","","91.521","0.001","90","","3621.9","0.7","294","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Trichlorido(<i>N</i>,<i>N</i>-dimethylformamide-κO)bis(1,10-phenanthroline-\ κ^2^<i>N</i>,<i>N</i>')lanthanum(III) <i>N</i>,<i>N</i>-dimethylformamide disolvate","","- C33 H37 Cl3 La N7 O3 -","- C33 H37 Cl3 La N7 O3 -","- C132 H148 Cl12 La4 N28 O12 -","4","1","CI2472","Li-Ming Zhou; Guang-Hui Sun; Li-Jun Gao; Shao-Ming Fang; Wei-Dong Yan","Trichlorido(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')lanthanum(III) <i>N</i>,<i>N</i>-dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","11","m2637","m2638","10.1107/S1600536807046739","","","0.71073","MoKα","","0.0498","0.0334","","","0.0731","0.0815","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215842","8.7554","0.0018","17.94","0.004","16.116","0.003","90","","104.65","0.03","90","","2449.1","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>catena</i>-Poly[[[bis(2-methyl-1<i>H</i>-imidazole-κN^3^)copper(II)]- μ-biphenyl-2,2'-dicarboxylato-κ^2^O:O'] dihydrate]","","- C22 H24 Cu N4 O6 -","- C22 H24 Cu N4 O6 -","- C88 H96 Cu4 N16 O24 -","4","1","CI2473","Liang Wang; Xiu-Ying Li; Yang Liu; Jian Wang","<i>catena</i>-Poly[[[bis(2-methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II)]-μ-biphenyl-2,2'-dicarboxylato-κ^2^<i>O</i>:<i>O</i>'] dihydrate]","Acta Crystallographica Section E","2007","63","11","m2636","m2636","10.1107/S160053680704723X","","","0.71073","MoKα","","0.0696","0.0432","","","0.0919","0.1009","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215843","7.265","0.004","10.174","0.006","18.957","0.011","90.519","0.01","90.205","0.009","110.247","0.008","1314.5","1.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Dimethyl(1,10-phenanthroline)bis(2,3,4,5-tetrafluorobenzoato)tin(IV)","","- C28 H16 F8 N2 O4 Sn -","- C28 H16 F8 N2 O4 Sn -","- C56 H32 F16 N4 O8 Sn2 -","2","1","CI2474","Junshan Sun; Chunlin Ma; Rufen Zhang","Dimethyl(1,10-phenanthroline)bis(2,3,4,5-tetrafluorobenzoato)tin(IV)","Acta Crystallographica Section E","2007","63","11","m2691","m2692","10.1107/S1600536807048362","","","0.71073","MoKα","","0.1138","0.0808","","","0.1985","0.2216","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215844","9.058","0.005","12.3","0.005","13.5","0.005","90.526","0.005","105.382","0.005","98.637","0.005","1431.9","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","(Acetonitrile-κN)(3-amino-4-methylbenzenesulfonato- κN)aqua(triphenylphosphine-κP)silver(I) hemihydrate","","- C27 H29 Ag N2 O4.5 P S -","- C27 H29 Ag N2 O4.5 P S -","- C54 H58 Ag2 N4 O9 P2 S2 -","2","1","CI2475","Jia-Jun Han; Ning Li","(Acetonitrile-κ<i>N</i>)(3-amino-4-methylbenzenesulfonato-κ<i>N</i>)aqua(triphenylphosphine-κ<i>P</i>)silver(I) hemihydrate","Acta Crystallographica Section E","2007","63","11","m2807","m2807","10.1107/S1600536807051549","","","0.71069","MoKα","","0.0531","0.0353","","","0.1004","0.1096","","","","","","1","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215845","8.2465","0.0009","10.4325","0.0012","25.382","0.003","90","","93.344","0.002","90","","2179.9","0.4","300","1","300","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,3-Diethylthiazolium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)nickelate(III)","","- C13 H12 N Ni S11 -","- C13 H12 N Ni S11 -","- C52 H48 N4 Ni4 S44 -","4","1","CI2476","Tomiyama, Etsuko; Tomono, Kazuaki; Miyamura, Kazuo","2,3-Diethylthiazolium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)nickelate(III)","Acta Crystallographica Section E","2007","63","11","m2741","m2741","10.1107/S1600536807049070","","","0.71073","MoKα","","0.0754","0.0524","","","0.0909","0.0987","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215846","16.6","0.006","13.228","0.005","23.957","0.009","90","","97.71","0.006","90","","5213","3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetrabutylammonium 5-(2-hydroxyphenyl)-1,3,4-oxadiazole-2-thiolate","","- C24 H41 N3 O2 S -","- C24 H41 N3 O2 S -","- C192 H328 N24 O16 S8 -","8","2","CI2477","Singh, N. K.; Pandey, A. K.; Singh, M.; Bharty, M. K.; Butcher, Ray J.","Tetrabutylammonium 5-(2-hydroxyphenyl)-1,3,4-oxadiazole-2-thiolate","Acta Crystallographica Section E","2007","63","11","o4327","o4327","10.1107/S1600536807049471","","","0.71073","MoKα","","0.1503","0.0498","","","0.1064","0.1497","","","","","","0.985","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215847","7.6661","0.0004","8.1331","0.0003","12.3871","0.0005","95.979","0.001","105.389","0.002","100.749","0.001","721.88","0.06","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","2-Methylquinolin-8-yl 2-nitrobenzoate","","- C17 H12 N2 O4 -","- C17 H12 N2 O4 -","- C34 H24 N4 O8 -","2","1","CI2478","Gang Lei","2-Methylquinolin-8-yl 2-nitrobenzoate","Acta Crystallographica Section E","2007","63","11","o4304","o4304","10.1107/S1600536807049069","","","0.71073","MoKα","","0.0386","0.0347","","","0.0996","0.1034","","","","","","0.999","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215848","8.997","0.0006","9.3627","0.0005","13.5538","0.0007","105.329","0.001","92.391","0.002","111.656","0.002","1010.95","0.1","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>,<i>N</i>'-Dimethyl-<i>N</i>,<i>N</i>'-diphenylnaphthalene-1,4- dicarboxamide","","- C26 H22 N2 O2 -","- C26 H22 N2 O2 -","- C52 H44 N4 O4 -","2","1","CI2482","Lin-Hai Jing; Da-Bin Qin","<i>N</i>,<i>N</i>'-Dimethyl-<i>N</i>,<i>N</i>'-diphenylnaphthalene-1,4-dicarboxamide","Acta Crystallographica Section E","2007","63","11","o4302","o4302","10.1107/S1600536807049495","","","0.71073","MoKα","","0.0508","0.039","","","0.1153","0.1359","","","","","","0.999","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215849","10.0276","0.0008","13.4211","0.0011","20.2414","0.0013","88.56","0.002","89.279","0.002","74.523","0.003","2624.5","0.3","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetraphenylnaphthalene-1,4-dicarboxamide","","- C36 H26 N2 O2 -","- C36 H26 N2 O2 -","- C144 H104 N8 O8 -","4","2","CI2483","Lin-Hai Jing; Da-Bin Qin","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetraphenylnaphthalene-1,4-dicarboxamide","Acta Crystallographica Section E","2007","63","11","o4417","o4417","10.1107/S1600536807051495","","","0.71073","MoKα","","0.1159","0.0659","","","0.1533","0.1918","","","","","","0.997","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215850","7.8303","0.0003","23.973","0.001","13.3136","0.0005","90","","90","","90","","2499.17","0.17","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","catena-Poly[[aqua(<i>N</i>,<i>N</i>-dimethylformamide-κO)strontium(II)]- bis[μ-2-(4-carboxyphenoxy)propionato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>']]","","- C23 H27 N O12 Sr -","- C23 H27 N O12 Sr -","- C92 H108 N4 O48 Sr4 -","4","0.5","CI2486","Li-Li Kong; Shan Gao; Li-Hua Huo; Ng, Seik Weng","<i>catena</i>-Poly[[aqua(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)strontium(II)]-bis[μ-2-(4-carboxyphenoxy)propionato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>']]","Acta Crystallographica Section E","2007","63","11","m2849","m2849","10.1107/S1600536807052166","","","0.71073","MoKα","","0.0777","0.0591","","","0.162","0.1831","","","","","","1.17","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215851","24.5348","0.0008","13.2964","0.0004","7.5147","0.0002","90","","97.3494","0.0009","90","","2431.34","0.13","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","catena-Poly[[[diaquabarium(II)]-bis[μ-2-(4-carboxyphenoxy)propionato-\ κ^3^O,O':O'] dihydrate]","","- C20 H26 Ba O14 -","- C20 H26 Ba O14 -","- C80 H104 Ba4 O56 -","4","0.5","CI2487","Li-Li Kong; Shan Gao; Li-Hua Huo; Ng, Seik Weng","<i>catena</i>-Poly[[[diaquabarium(II)]-bis[μ-2-(4-carboxyphenoxy)propionato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>'] dihydrate]","Acta Crystallographica Section E","2007","63","11","m2850","m2850","10.1107/S1600536807052178","","","0.71073","MoKα","","0.0221","0.0216","","","0.0579","0.0582","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215852","6.777","0.0003","16.2626","0.0006","17.373","0.0005","90","","90","","90","","1914.71","0.12","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[aqua(4,4'-bipyridine-κ^2^N,N')manganese(II)]- μ-3-(4-carboxylatophenoxy)propionato-κ^3^O:O',O'']","","- C20 H18 Mn N2 O6 -","- C20 H18 Mn N2 O6 -","- C80 H72 Mn4 N8 O24 -","4","1","CI2488","Li-Li Kong; Shan Gao; Li-Hua Huo; Ng, Seik Weng","<i>catena</i>-Poly[[aqua(4,4'-bipyridine-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-μ-3-(4-carboxylatophenoxy)propionato-κ^3^<i>O</i>:<i>O</i>',<i>O</i>'']","Acta Crystallographica Section E","2007","63","11","m2851","m2851","10.1107/S160053680705218X","","","0.71073","MoKα","","0.0592","0.0334","","","0.0761","0.0885","","","","","","0.949","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215853","6.7193","0.0002","16.1369","0.0005","17.2762","0.0007","90","","90","","90","","1873.24","0.11","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","catena-Poly[[aqua(4,4'-bipyridine-κ^2^N,N')cobalt(II)]- μ-3-(4-carboxylatophenoxy)propionato-κ^3^O:O',O'']","","- C20 H18 Co N2 O6 -","- C20 H18 Co N2 O6 -","- C80 H72 Co4 N8 O24 -","4","1","CI2489","Li-Li Kong; Shan Gao; Li-Hua Huo; Ng, Seik Weng","<i>catena</i>-Poly[[aqua(4,4'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-μ-3-(4-carboxylatophenoxy)propionato-κ^3^<i>O</i>:<i>O</i>',<i>O</i>'']","Acta Crystallographica Section E","2007","63","11","m2852","m2852","10.1107/S1600536807052191","","","0.71073","MoKα","","0.0561","0.034","","","0.0747","0.0865","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215854","25.273","0.004","9.5496","0.0018","11.115","0.002","90","","90","","90","","2682.6","0.8","294","2","294","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","4-tert-Butyl-2-{[(E)-2,6-diisopropylphenylimino]methyl}-6-(1-phenylethyl)phenol","","- C31 H39 N O -","- C31 H39 N O -","- C124 H156 N4 O4 -","4","1","CS2047","Jin Cui; Mingjie Zhang; Jie Zhu; Naijing Cui; Bo Liu","4-<i>tert</i>-Butyl-2-{[(<i>E</i>)-2,6-diisopropylphenylimino]methyl}-6-(1-phenylethyl)phenol","Acta Crystallographica Section E","2007","63","11","o4400","o4400","10.1107/S1600536807051306","","","0.71073","MoKα","","0.0585","0.0375","","","0.0894","0.1049","","","","","","1.059","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215855","10.4321","0.0005","10.5977","0.0005","19.0145","0.0009","90","","90","","90","","2102.17","0.17","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Conessine","conessine","","- C24 H40 N2 -","- C24 H40 N2 -","- C96 H160 N8 -","4","1","CS2048","Alain Meli Lannang; Shazia Anjum; Jean Gustave Tangmouo; Karsten Krohn; M. Iqbal Choudhary","Conessine isolated from <i>Holarrhena floribunda</i>","Acta Crystallographica Section E","2007","63","11","o4398","o4398","10.1107/S1600536807051215","","","0.71073","MoKα","","0.0515","0.0478","","","0.1158","0.1185","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215856","24.873","0.003","8.4962","0.0016","22.294","0.002","90","","93.732","0.002","90","","4701.3","1.1","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Tegaserod(+) maleate(-)","[(5-methoxyindol-3-yl)methylenehydrazino](pentylamino)methaniminium maleate","","- C20 H27 N5 O5 -","- C20 H27 N5 O5 -","- C160 H216 N40 O40 -","8","1","CV2304","Qingfang, Cheng; Xingyou Xu; Tianya Liu; Cheng Zhang","Tegaserod maleate","Acta Crystallographica Section E","2007","63","11","o4198","o4198","10.1107/S1600536807047368","","","0.71073","MoKα","","0.1478","0.0492","","","0.0766","0.0838","","","","","","0.995","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215857","11.2606","0.0011","15.5269","0.0015","17.7586","0.0017","90","","96.024","0.008","90","","3087.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraethylammonium [12,12-diethyl-2,2,9,9,-tetramethyl-1,4,7,10-tetraza-5,6-benzotridecane- 3,8,11,13-tetraone(4-)]oxidomanganate(V)","","- C29 H46 Mn N5 O5 -","- C29 H46 Mn N5 O5 -","- C116 H184 Mn4 N20 O20 -","4","1","CV2305","Berggren, Gustav; Kaynak, Filiz Betul; Anderlund, Magnus F.; Eriksson, Lars; Åkermark, Björn","Tetraethylammonium [12,12-diethyl-2,2,9,9-tetramethyl-1,4,7,10-tetraza-5,6-benzotridecane-3,8,11,13-tetraone(4{-})]oxidomanganate(V)","Acta Crystallographica Section E","2007","63","11","m2672","m2673","10.1107/S1600536807047691","","","0.71073","MoKα","","0.1264","0.044","","","0.0622","0.0735","","","","","","0.819","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215858","7.3189","0.0016","18.187","0.004","9.534","0.002","90","","108.482","0.004","90","","1203.6","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2-Furoyl)-N'-(6-methyl-2-pyridyl)thiourea","","- C12 H11 N3 O2 S -","- C12 H11 N3 O2 S -","- C48 H44 N12 O8 S4 -","4","1","CV2308","Hassan, N. Norainun N.; Kadir, Maisara A.; Yusof, M. Sukeri M.; Yamin, Bohari M.","<i>N</i>-(2-Furoyl)-<i>N</i>'-(6-methyl-2-pyridyl)thiourea","Acta Crystallographica Section E","2007","63","11","o4224","o4224","10.1107/S1600536807047265","","","0.71073","MoKα","","0.053","0.0442","","","0.1214","0.1297","","","","","","0.969","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215859","21.257","0.003","11.653","0.003","11.938","0.003","90","","91.686","0.003","90","","2955.9","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[(3-hydroxy-2-naphthyl)(2-pyridylmethylenehydrazono)methanolato]nickel(II)","","- C34 H24 N6 Ni O4 -","- C34 H24 N6 Ni O4 -","- C136 H96 N24 Ni4 O16 -","4","1","CV2309","Wenjun Kang; Shizhu Sun; Dacheng Li; Daqi Wang; Jianmin Dou","Bis[(3-hydroxy-2-naphthyl)(2-pyridylmethylenehydrazono)methanolato]nickel(II)","Acta Crystallographica Section E","2007","63","11","m2667","m2667","10.1107/S1600536807047770","","","0.71073","MoKα","","0.1018","0.047","","","0.1094","0.1485","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215860","9.4617","0.0004","12.8806","0.0005","12.9114","0.0008","108.212","0.002","108.535","0.003","107.424","0.002","1270.69","0.12","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","N'-(Diphenylmethylene)-3-(3-nitrophenyl)-1',3'-dioxospiro[cyclopropane-2'- indan]-2-carbohydrazide","","- C31 H21 N3 O5 -","- C31 H21 N3 O5 -","- C62 H42 N6 O10 -","2","1","CV2310","G. Chakkaravarthi; G. Periyasamy; R. Raghunathan; V. Manivannan","<i>N</i>'-(Diphenylmethylene)-3-(3-nitrophenyl)-1',3'-dioxospiro[cyclopropane-2'-indan]-2-carbohydrazide","Acta Crystallographica Section E","2007","63","11","o4290","o4290","10.1107/S160053680704891X","","","0.71073","MoKα","","0.0588","0.0441","","","0.1119","0.122","","","","","","1.024","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215861","11.632","0.003","7.5534","0.0019","25.704","0.006","90","","102.87","0.03","90","","2201.6","1","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Triaquachloridobis[4-(dimethylamino)benzaldehyde-κO]nickel(II) chloride","","- C18 H28 Cl2 N2 Ni O5 -","- C18 H28 Cl2 N2 Ni O5 -","- C72 H112 Cl8 N8 Ni4 O20 -","4","1","CV2311","Qiang Wang; Daqi Wang; Yuying Sun","Triaquachloridobis[4-(dimethylamino)benzaldehyde-κ<i>O</i>]nickel(II) chloride","Acta Crystallographica Section E","2007","63","11","m2819","m2819","10.1107/S1600536807048684","","","0.71073","MoKα","","0.0901","0.0442","","","0.0995","0.1085","","","","","","0.957","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215862","8.762","0.003","15.297","0.005","17.247","0.005","90","","90","","90","","2311.7","1.3","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis{2-methoxy-6-[3-(methylamino)propyliminomethyl]phenolato}nickel(II)","","- C24 H34 N4 Ni O4 -","- C24 H34 N4 Ni O4 -","- C96 H136 N16 Ni4 O16 -","4","0.5","CV2312","Chun-Bao Tang","Bis{2-methoxy-6-[3-(methylamino)propyliminomethyl]phenolato}nickel(II)","Acta Crystallographica Section E","2007","63","11","m2654","m2654","10.1107/S1600536807048155","","","0.71073","MoKα","","0.0709","0.0347","","","0.0766","0.0946","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215863","7.8535","0.0004","16.5308","0.0007","16.7344","0.0008","90","","96.35","0.001","90","","2159.21","0.18","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[cobalt(II)-μ-[N,N'-1,3-bis(imidazol-1-ylmethyl)benzene]- κ^2^N^3^:N^3'^-μ-(5-carboxybenzene-1,3-dicarboxylato)-κ^2^O^1^:O^3^] monohydrate]","","- C23 H20 Co N4 O7 -","- C23 H20 Co N4 O7 -","- C92 H80 Co4 N16 O28 -","4","1","CV2313","Ying-Ying Liu; Jian-Fang Ma; Guo-Hua Wei","<i>catena</i>-Poly[[cobalt(II)-μ-[<i>N</i>,<i>N</i>'-1,3-bis(imidazol-1-ylmethyl)benzene]-κ^2^<i>N</i>^3^:<i>N</i>^3'^-μ-(5-carboxybenzene-1,3-dicarboxylato)-κ^2^<i>O</i>^1^:<i>O</i>^3^] monohydrate]","Acta Crystallographica Section E","2007","63","11","m2703","m2704","10.1107/S1600536807048532","","","0.71069","MoKα","","0.0744","0.0465","","","0.1201","0.1359","","","","","","1.039","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215864","18.102","0.004","7.4538","0.0019","15.089","0.004","90","","90","","90","","2035.9","0.9","293","2","293","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","catena-Poly[[triaquacobalt(II)]-μ-5-hydroxybenzene-1,3-dicarboxylato- κO^1^:O^3^]","","- C8 H10 Co O8 -","- C8 H10 Co O8 -","- C64 H80 Co8 O64 -","8","1","CV2314","Hu, Yue-hua; Li, Yi-Zhi; Zhang, Rui-Long; Wu, Jie-Ying","<i>catena</i>-Poly[[triaquacobalt(II)]-μ-5-hydroxybenzene-1,3-dicarboxylato-κ<i>O</i>^1^:<i>O</i>^3^]","Acta Crystallographica Section E","2007","63","11","m2721","m2721","10.1107/S1600536807049288","","","0.71073","MoKα","","0.0708","0.0513","","","0.1075","0.1112","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215865","23.1133","0.0014","12.6202","0.0008","12.9917","0.0009","90","","107.293","0.002","90","","3618.3","0.4","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N,N,N',N'-Tetraethylnaphthalene-1,4-dicarboxamide","","- C20 H26 N2 O2 -","- C20 H26 N2 O2 -","- C160 H208 N16 O16 -","8","1","CV2315","Lin-Hai Jing; Li-Mei Zhou; Da-Bin Qin","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetraethylnaphthalene-1,4-dicarboxamide","Acta Crystallographica Section E","2007","63","11","o4273","o4273","10.1107/S1600536807048544","","","0.71073","MoKα","","0.0445","0.0386","","","0.1102","0.1169","","","","","","1.005","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215866","16.297","0.003","8.9962","0.0018","20.314","0.004","90","","99.28","0.03","90","","2939.3","1","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-[(E)-(Dimethylamino)methyleneamino]-N-phenylbenzenesulfonamide","","- C15 H17 N3 O2 S -","- C15 H17 N3 O2 S -","- C120 H136 N24 O16 S8 -","8","1","CV2317","Qian-shou Zhong","2-[(<i>E</i>)-(Dimethylamino)methyleneamino]-<i>N</i>-phenylbenzenesulfonamide","Acta Crystallographica Section E","2007","63","11","o4446","o4446","10.1107/S1600536807050040","","","0.71073","MoKα","","0.0328","0.0317","","","0.0815","0.0822","","","","","","1.074","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215867","10.7033","0.0011","12.0722","0.0012","7.2121","0.0007","90","","125.651","0.002","90","","757.24","0.13","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ammonium 6-carboxypyridine-2-carboxylate","","- C7 H8 N2 O4 -","- C7 H8 N2 O4 -","- C28 H32 N8 O16 -","4","0.5","CV2318","Aghabozorg, Hossein; Manteghi, Faranak; Ghadermazi, Mohammad","Ammonium 6-carboxypyridine-2-carboxylate","Acta Crystallographica Section E","2007","63","11","o4454","o4454","10.1107/S1600536807052610","","","0.71073","MoKα","","0.0361","0.0343","","","0.0997","0.1015","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215868","15.9189","0.0008","7.3729","0.0003","15.4895","0.0007","90","","98.125","0.004","90","","1799.73","0.14","295","1","295","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,3-Dibromo-3-(5-bromo-2-methoxyphenyl)-1-(2,4-dichlorophenyl)propan-1-one","","- C16 H11 Br3 Cl2 O2 -","- C16 H11 Br3 Cl2 O2 -","- C64 H44 Br12 Cl8 O8 -","4","1","CV2319","Narayana, B.; Mayekar, Anil N.; Yathirajan, H. S.; Sarojini, B. K.; Kubicki, Maciej","2,3-Dibromo-3-(5-bromo-2-methoxyphenyl)-1-(2,4-dichlorophenyl)propan-1-one","Acta Crystallographica Section E","2007","63","11","o4362","o4362","10.1107/S1600536807050842","","","0.71073","MoKα","","0.0549","0.0368","","","0.091","0.0989","","","","","","1.201","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215869","11.3887","0.0005","24.6558","0.0014","5.1828","0.0002","90","","90","","90","","1455.32","0.12","200","","200","2","","","","","","","","5","P n m a","-P 2ac 2n","62","cis-2-(p-Fluoro)phenyl-6-phenyldithian-4-one 1-oxide","2-(4-Fluorophenyl)-6-phenyltetrahydro-2H-thiopyran-4-one 1-oxide","","- C17 H14 F O2 S -","- C17 H14 F O2 S -","- C68 H56 F4 O8 S4 -","4","0.5","CV2320","A. Thiruvalluvar; S. Balamurugan; R. J. Butcher; K. Pandiarajan; D. Devanathan","2-(4-Fluorophenyl)-6-phenyltetrahydro-2<i>H</i>-thiopyran-4-one 1-oxide","Acta Crystallographica Section E","2007","63","11","o4486","o4486","10.1107/S1600536807053111","","","0.71073","MoKα","","0.0881","0.0853","","","0.1691","0.1702","","","","","","1.225","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215870","6.0653","0.0008","12.4906","0.0016","25.472","0.003","90","","90","","90","","1929.7","0.4","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3β,5α,15α-Trihydroxy-5-androsten-17-one dihydrate","","- C19 H32 O6 -","- C19 H32 O6 -","- C76 H128 O24 -","4","1","CV2322","Wei Zhou; Guo-Hong Wang; Wei-Xiao Hu; Chun-Nian Xia","3β,5α,15α-Trihydroxy-5-androsten-17-one dihydrate","Acta Crystallographica Section E","2007","63","11","o4445","o4445","10.1107/S1600536807052336","","","0.71073","MoKα","","0.0415","0.0365","","","0.0951","0.0986","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215871","14.63","0.0015","25.025","0.003","5.9754","0.0006","90","","90","","90","","2187.7","0.4","298","2","298","2","","","","","","","","3","P n a 21","P 2c -2n","33","","2,4,5,7,9,10-Hexathia-1,3,6,8(1,4)-tetrabenzenacyclodecaphane","","- C24 H16 S6 -","- C24 H16 S6 -","- C96 H64 S24 -","4","1","CV2323","Zhifo Guo; Rufen Zhang","2,4,5,7,9,10-Hexathia-1,3,6,8(1,4)-tetrabenzenacyclodecaphane","Acta Crystallographica Section E","2007","63","11","o4465","o4465","10.1107/S1600536807052567","","","0.71073","MoKα","","0.0404","0.034","","","0.0842","0.0894","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215872","14.5282","0.0019","10.3604","0.0014","14.708","0.002","90","","103.312","0.003","90","","2154.3","0.5","290","2","290","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-Methyl-2,6-bis(2-naphthylmethylene)cyclohexan-1-one","","- C29 H24 O -","- C29 H24 O -","- C116 H96 O4 -","4","1","CV2324","Brinda; Rajeev Mudakavi; Deepak Chopra; M. Srinivas Murthy; T. N. Guru Row","4-Methyl-2,6-bis(2-naphthylmethylene)cyclohexan-1-one","Acta Crystallographica Section E","2007","63","11","o4494","o4494","10.1107/S1600536807053032","","","0.71073","MoKα","","0.0653","0.0401","","","0.1003","0.1153","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215873","7.542","0.003","27.81","0.01","8.111","0.003","90","","97.257","0.005","90","","1687.6","1.1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","10-(4-Hydroxy-3-methoxy-5-nitrobenzylidene)anthrone","","- C22 H15 N O5 -","- C22 H15 N O5 -","- C88 H60 N4 O20 -","4","1","CV2325","Wei Zhou; Zhimin Wu; Weixiao Hu; Chunnian Xia","10-(4-Hydroxy-3-methoxy-5-nitrobenzylidene)anthrone","Acta Crystallographica Section E","2007","63","11","o4498","o4498","10.1107/S1600536807052919","","","0.71073","MoKα","","0.1073","0.0558","","","0.0998","0.1156","","","","","","0.918","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215874","6.0881","0.0005","14.7605","0.0011","18.9354","0.0014","90","","90","","90","","1701.6","0.2","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(<i>S</i>)-1-Methyl-2-[1-(p-tolylsulfonyl)pyrrolidin-2-ylmethylsulfanyl]-\ 1<i>H</i>-imidazole","","- C16 H21 N3 O2 S2 -","- C16 H21 N3 O2 S2 -","- C64 H84 N12 O8 S8 -","4","1","DN2234","Pingsheng Chen; Xuefen Liu; Shuping Luo; Danqian Xu","(<i>S</i>)-1-Methyl-2-[1-(<i>p</i>-tolylsulfonyl)pyrrolidin-2-ylmethylsulfanyl]-1<i>H</i>-imidazole","Acta Crystallographica Section E","2007","63","11","o4260","o4260","10.1107/S1600536807047757","","","0.71073","MoKα","","0.078","0.0721","","","0.1414","0.144","","","","","","1.268","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215875","9.3787","0.0012","10.7935","0.0014","11.8795","0.0015","86.447","0.002","81.805","0.002","79.847","0.002","1170.8","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis[2-(2-hydroxybenzoylhydrazono)propionato]nickel(II) trihydrate","","- C20 H24 N4 Ni O11 -","- C20 H24 N4 Ni O11 -","- C40 H48 N8 Ni2 O22 -","2","1","DN2235","Wei-Ping Wu; Feng-Chun Zeng","Bis[2-(2-hydroxybenzoylhydrazono)propionato]nickel(II) trihydrate","Acta Crystallographica Section E","2007","63","11","m2664","m2664","10.1107/S1600536807048027","","","0.71073","MoKα","","0.0635","0.045","","","0.1028","0.1163","","","","","","1.032","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215876","18.7173","0.0011","14.7968","0.0008","23.1967","0.0018","90","","90","","90","","6424.5","0.7","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(±)-Di-μ-chlorido-[μ-<i>N</i>,<i>N</i>'-{[3,3'-methylenebis(2,4,6-trimethyl- 3,1-phenylene)]dimethylene}bis(2-methylpropan-2- amine)]bis[chloridopalladium(II)]","","- C29 H46 Cl4 N2 Pd2 -","- C29 H46 Cl4 N2 Pd2 -","- C232 H368 Cl32 N16 Pd16 -","8","1","DN2236","Chahen, Ludovic; Therrien, Bruno; Süss-Fink, Georg","(±)-Di-μ-chlorido-(μ-<i>N</i>,<i>N</i>'-{[3,3'-methylenebis(2,4,6-trimethyl-3,1-phenylene)]dimethylene}bis(2-methylpropan-2-amine))bis[chloridopalladium(II)]","Acta Crystallographica Section E","2007","63","11","m2687","m2687","10.1107/S1600536807047745","","","0.71073","MoKα","","0.0575","0.0407","","","0.0982","0.1054","","","","","","0.922","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215877","12.478","0.003","17.1","0.004","12.084","0.003","90","","99.129","0.004","90","","2545.7","1.1","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(±)-4,6-Dimethoxy-3-(trichloromethyl)isobenzofuran-1(3<i>H</i>)-one","","- C11 H9 Cl3 O4 -","- C11 H9 Cl3 O4 -","- C88 H72 Cl24 O32 -","8","2","DN2237","Saeed, Aamer; Flörke, Ulrich","(±)-4,6-Dimethoxy-3-(trichloromethyl)isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4332","o4332","10.1107/S1600536807049409","","","0.71073","MoKα","","0.0382","0.0319","","","0.0835","0.087","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215878","8.9994","0.0004","11.3852","0.0009","15.0563","0.0012","106.387","0.003","104.123","0.004","99.231","0.005","1391.01","0.18","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","trans-(2,2'-Bipyridine)dichlorido[1-(4-methylphenylimino)-1- (phenylhydrazono)propan-2-one]ruthenium(II) dichloromethane solvate","","- C27 H25 Cl4 N5 O Ru -","- C27 H25 Cl4 N5 O Ru -","- C54 H50 Cl8 N10 O2 Ru2 -","2","1","DN2238","Al-Noaimi, Mousa; El-khateeb, Mohammad; Görls, Helmar","<i>trans</i>-(2,2'-Bipyridine)dichlorido[1-(4-methylphenylimino)-1-(phenylhydrazono)propan-2-one]ruthenium(II) dichloromethane solvate","Acta Crystallographica Section E","2007","63","11","m2713","m2713","10.1107/S1600536807049112","","","0.71073","MoKα","","0.1269","0.0596","","","0.1152","0.1424","","","","","","1.004","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215879","13.0233","0.0006","8.4361","0.0004","20.3957","0.0011","90","","105.849","0.005","90","","2155.61","0.19","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N^2^-[Bis(benzylsulfanyl)methylene]-2-methoxybenzohydrazide","","- C23 H22 N2 O2 S2 -","- C23 H22 N2 O2 S2 -","- C92 H88 N8 O8 S8 -","4","1","DN2239","Singh, N. K.; Singh, Mamata; Butcher, Ray J.","<i>N</i>^2^-[Bis(benzylsulfanyl)methylene]-2-methoxybenzohydrazide","Acta Crystallographica Section E","2007","63","11","o4405","o4405","10.1107/S1600536807051811","","","0.71073","MoKα","","0.2051","0.0732","","","0.1749","0.2447","","","","","","1.077","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215880","8.2975","0.0006","9.234","0.0006","9.9647","0.0007","65.242","0.001","72.803","0.001","85.004","0.001","661.72","0.08","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","4,4'-(Ethane-1,2-diyl)dipyridinium di-μ-citrato-bis[aquacobaltate(II)]","","- C24 H26 Co2 N2 O16 -","- C24 H26 Co2 N2 O16 -","- C24 H26 Co2 N2 O16 -","1","0.5","DN2240","Jian Yu","4,4'-(Ethane-1,2-diyl)dipyridinium di-μ-citrato-bis[aquacobaltate(II)]","Acta Crystallographica Section E","2007","63","11","m2729","m2729","10.1107/S1600536807049124","","","0.71073","MoKα","","0.051","0.0395","","","0.1138","0.1176","","","","","","1.152","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215881","9.2939","0.0019","9.888","0.002","18.124","0.004","90","","99.83","0.03","90","","1641.1","0.6","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","{μ-[Dimethyl(1,1,2-trimethylpropyl)silyl](2- pyridylmethyl)amido}bis[methylzinc(II)]","","- C30 H56 N4 Si2 Zn2 -","- C30 H56 N4 Si2 Zn2 -","- C60 H112 N8 Si4 Zn4 -","2","0.5","DN2241","Koch, Christian; Görls, Helmar; Westerhausen, Matthias","{μ-[Dimethyl(1,1,2-trimethylpropyl)silyl](2-pyridylmethyl)amido}bis[methylzinc(II)]","Acta Crystallographica Section E","2007","63","11","m2732","m2732","10.1107/S1600536807049847","","","0.71073","MoKα","","0.0716","0.0415","","","0.0866","0.0974","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215882","12.907","0.003","7.469","0.002","18.52","0.004","90","","90","","90","","1785.4","0.7","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","2-Chloro-3-(2,2,2-trifluoroethoxy)pyridine","","- C7 H5 Cl F3 N O -","- C7 H5 Cl F3 N O -","- C56 H40 Cl8 F24 N8 O8 -","8","1","DN2242","Wang, Pin-Liang; Zeng, Hai-Su; Kang, Si-Shun; Wang, Hai-Bo","2-Chloro-3-(2,2,2-trifluoroethoxy)pyridine","Acta Crystallographica Section E","2007","63","11","o4355","o4355","10.1107/S1600536807050337","","","0.71073","MoKα","","0.1669","0.0795","","","0.182","0.2369","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215883","7.915","0.003","17.243","0.006","9.127","0.003","90","","106.442","0.004","90","","1194.7","0.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis{1-[bis(2-aminoethyl)amino]propan-2-ol}nickel(II) bis(perchlorate)","","- C14 H38 Cl2 N6 Ni O10 -","- C14 H38 Cl2 N6 Ni O10 -","- C28 H76 Cl4 N12 Ni2 O20 -","2","0.5","DN2243","Qian, Bao-Hua; Zhang, Zhen-Ming; Lu, Lu-De; Yang, Xu-Jie; Wang, Xin","Bis{1-[bis(2-aminoethyl)amino]propan-2-ol}nickel(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","11","m2754","m2754","10.1107/S1600536807050386","","","0.71073","MoKα","","0.0782","0.0565","","","0.1511","0.1666","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215884","31.05","0.002","6.5882","0.0007","13.1661","0.0014","90","","92.293","0.007","90","","2691.1","0.4","100","1","100","1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,4-Bis[2,2-bis(trimethylsilyl)ethenyl]benzene","","- C22 H42 Si4 -","- C22 H42 Si4 -","- C88 H168 Si16 -","4","0.5","DN2244","Pawluć, Piotr; Marciniec, Bogdan; Kubicki, Maciej","1,4-Bis[2,2-bis(trimethylsilyl)ethenyl]benzene","Acta Crystallographica Section E","2007","63","11","o4357","o4357","10.1107/S1600536807050398","","","0.71073","MoKα","","0.0529","0.0331","","","0.0792","0.0832","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215885","7.5144","0.001","9.135","0.001","11.6595","0.0013","90","","90.691","0.015","90","","800.3","0.16","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Di-μ-chlorido-bis[chlorido(η^6^-toluene)ruthenium(II)]","","- C14 H16 Cl4 Ru2 -","- C14 H16 Cl4 Ru2 -","- C28 H32 Cl8 Ru4 -","2","0.5","DN2246","Mattsson, Johan; Therrien, Bruno","Di-μ-chlorido-bis[chlorido(η^6^-toluene)ruthenium(II)]","Acta Crystallographica Section E","2007","63","11","m2757","m2757","10.1107/S1600536807050544","","","0.71073","MoKα","","0.0444","0.039","","","0.0796","0.0819","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215886","8.2208","0.0005","10.9657","0.0006","14.5206","0.0008","90","","101.881","0.001","90","","1280.94","0.13","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>'-(3,4-Dichlorobenzylidene)isonicotinohydrazide","","- C13 H9 Cl2 N3 O -","- C13 H9 Cl2 N3 O -","- C52 H36 Cl8 N12 O4 -","4","1","DN2248","Yin, Zhi-gang; Guo, Shu-ling; Qian, Heng-yu; Feng, Yu-li","<i>N</i>'-(3,4-Dichlorobenzylidene)isonicotinohydrazide","Acta Crystallographica Section E","2007","63","11","o4407","o4407","10.1107/S1600536807051847","","","0.71073","MoKα","","0.0437","0.038","","","0.1039","0.1089","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215887","7.2753","0.0007","14.9201","0.0013","16.4212","0.0015","90","","98.375","0.001","90","","1763.5","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(±)-3-[2-(Methylsulfanyl)ethyl]-1-phenyl-2,3-dihydro-1<i>H</i>- naphtho[1,2-<i>e</i>][1,3]oxazine","","- C21 H21 N O S -","- C21 H21 N O S -","- C84 H84 N4 O4 S4 -","4","1","DN2249","Yin, Zhi-Gang; Qian, Heng-Yu; Chen, Yu-Zhen; Feng, Yu-Li","(±)-3-[2-(Methylsulfanyl)ethyl]-1-phenyl-2,3-dihydro-1<i>H</i>-naphtho[1,2-<i>e</i>][1,3]oxazine","Acta Crystallographica Section E","2007","63","11","o4469","o4469","10.1107/S1600536807051896","","","0.71073","MoKα","","0.0548","0.0416","","","0.1118","0.1216","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215888","11.95","0.0011","13.7531","0.0016","25.377","0.003","90","","90","","90","","4170.7","0.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1<i>R</i>,4<i>S</i>,8<i>R</i>,12<i>S</i>,13<i>S</i>,14<i>R</i>,16<i>S</i>, 17<i>R</i>,19<i>R</i>)-14-Hydroxy-7,7,17-trimethyl-2,9,18-trioxo-3,10- dioxapentacyclo[14.2.1.0^1,13^.0^4,12^.0^8,12^]nonadec-19-yl acetate","","- C22 H28 O8 -","- C22 H28 O8 -","- C176 H224 O64 -","8","2","DN2250","Shi, Hao","(1<i>R</i>,4<i>S</i>,8<i>R</i>,12<i>S</i>,13<i>S</i>,14<i>R</i>,16<i>S</i>,17<i>R</i>,19<i>R</i>)-14-Hydroxy-7,7,17-trimethyl-2,9,18-trioxo-3,10-dioxapentacyclo[14.2.1.0^1,13^.0^4,12^.0^8,12^]nonadec-19-yl acetate","Acta Crystallographica Section E","2007","63","11","o4495","o4495","10.1107/S1600536807053317","","","0.71073","MoKα","","0.0693","0.0379","","","0.0787","0.0947","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215889","11.3254","0.0015","7.8829","0.001","13.1264","0.0017","90","","100.519","0.002","90","","1152.2","0.3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[diaquazinc(II)]-μ-2,2'-bipyridine-3,3'-dicarboxyato- κ^4^N,N':O,O']","","- C12 H10 N2 O6 Zn -","- C12 H10 N2 O6 Zn -","- C48 H40 N8 O24 Zn4 -","4","0.5","DN2251","Lu Lu; Jun Wang; Bao-zhong, Zhao; Feng-Chun Zeng","<i>catena</i>-Poly[[diaquazinc(II)]-μ-2,2'-bipyridine-3,3'-dicarboxyato-κ^4^<i>N</i>,<i>N</i>':<i>O</i>,<i>O</i>']","Acta Crystallographica Section E","2007","63","11","m2857","m2857","10.1107/S1600536807053305","","","0.71073","MoKα","","0.0425","0.0416","","","0.1271","0.1277","","","","","","1.167","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215890","10.7704","0.0009","13.1196","0.0011","19.6427","0.0014","90","","115.63","0.004","90","","2502.5","0.4","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","Bis[<i>N</i>^3^-(2-hydroxybenzoyl)pyridine-2-carboxamidrazonato- κ^3^N^1^,N^2^,O]zinc(II)","","- C26 H22 N8 O4 Zn -","- C26 H22 N8 O4 Zn -","- C104 H88 N32 O16 Zn4 -","4","1","DN2252","Li, Yong","Bis[<i>N</i>^3^-(2-hydroxybenzoyl)pyridine-2-carboxamidrazonato-κ^3^<i>N</i>^1^,<i>N</i>^2^,<i>O</i>]zinc(II)","Acta Crystallographica Section E","2007","63","11","m2837","m2837","10.1107/S1600536807052750","","","0.71073","MoKα","","0.0376","0.0347","","","0.0958","0.0978","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215891","9.9944","0.0003","9.3091","0.0003","14.3752","0.0005","90","","97.245","0.001","90","","1326.77","0.07","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[(1,3-Dioxoisochroman-4-ylidene)hydroxymethyl]benzonitrile","","- C17 H9 N O4 -","- C17 H9 N O4 -","- C68 H36 N4 O16 -","4","1","DN3062","Kakou-Yao, Rita; Djande, Abdoulaye; Kabore, Leopold; Saba, Adama; Aycard, Jean Pierre","4-[(1,3-Dioxoisochroman-4-ylidene)hydroxymethyl]benzonitrile","Acta Crystallographica Section E","2007","63","11","o4275","o4275","10.1107/S1600536807045357","","","0.71073","MoKα","","0.0924","0.0501","","4.7335","0.1248","0.1248","","","","","","0.9095","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215892","46.176","0.003","5.1633","0.0019","21.793","0.002","90","","116.186","0.004","90","","4662.6","1.8","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","κO^1^](dimethylformamide-κO)copper(II) dimethylformamide solvate monohydrate","","- C17 H25 Br2 Cu N3 O9 -","- C17 H25 Br2 Cu N3 O9 -","- C136 H200 Br16 Cu8 N24 O72 -","8","1","ER2034","Jin, Li-Xia; Liu, Zheng; Zhang, Shu-Hua; Li, Guang-Zhao","Aqua[3-carboxy-2-(3,5-dibromo-2-oxidobenzylamino-κ^2^<i>N</i>,<i>O</i>)propanoato-κ<i>O</i>^1^](dimethylformamide-κ<i>O</i>)copper(II) dimethylformamide solvate monohydrate","Acta Crystallographica Section E","2007","63","11","m2631","m2632","10.1107/S1600536807041517","","","0.71073","MoKα","","0.0545","0.0381","","","0.0818","0.0867","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215893","9.668","0.005","20.096","0.005","9.852","0.005","90","","110.639","0.005","90","","1791.3","1.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(4-Methoxybenzyl)pyridinium <i>p</i>-toluenesulfonate","","- C20 H21 N O4 S -","- C20 H21 N O4 S -","- C80 H84 N4 O16 S4 -","4","1","EZ2098","Achilonu, Matthew C.; Janse van Rensburg, J. Marthinus; Westhuizen, Jan H. van der; Roodt, Andreas","1-(4-Methoxybenzyl)pyridinium <i>p</i>-toluenesulfonate","Acta Crystallographica Section E","2007","63","11","o4326","o4326","10.1107/S1600536807046703","","","0.71069","MoKα","","","0.036","","","","0.0919","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215894","15.122","0.003","13.477","0.003","6.6922","0.0013","90","","101.21","0.03","90","","1337.8","0.5","297","2","297","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3,6-Diaminoacridinium perchlorate","","- C13 H12 Cl N3 O4 -","- C13 H12 Cl N3 O4 -","- C52 H48 Cl4 N12 O16 -","4","0.5","EZ2099","Varga, Richard A.; Rus, Adina; Venter, Monica M.; Negreanu-Pirjol, Ticuta; Guran, Cornelia","3,6-Diaminoacridinium perchlorate","Acta Crystallographica Section E","2007","63","11","o4317","o4317","10.1107/S1600536807049057","","","0.71073","MoKα","","0.0553","0.0512","","","0.129","0.132","","","","","","1.124","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215895","7.4654","0.0008","13.7051","0.0018","9.5361","0.0017","90","","99.961","0.002","90","","961","0.2","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-[1-(3-Aminophenyl)ethylidene]propanedinitrile","","- C11 H9 N3 -","- C11 H9 N3 -","- C44 H36 N12 -","4","1","EZ2100","Qingfang Cheng; Xingyou Xu; Changyong Zong; Huiling Feng","2-[1-(3-Aminophenyl)ethylidene]propanedinitrile","Acta Crystallographica Section E","2007","63","11","o4316","o4316","10.1107/S1600536807047423","","","0.71073","MoKα","","0.1002","0.0509","","","0.1087","0.1239","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215896","24.719","0.003","5.0827","0.0006","10.8593","0.0014","90","","103.59","0.003","90","","1326.2","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Octane-1,8-diammonium dichloride monohydrate","","- C8 H24 Cl2 N2 O -","- C8 H24 Cl2 N2 O -","- C32 H96 Cl8 N8 O4 -","4","0.5","EZ2101","van Blerk, Charmaine; Kruger, Gert J.","Octane-1,8-diammonium dichloride monohydrate","Acta Crystallographica Section E","2007","63","11","o4289","o4289","10.1107/S1600536807045990","","","0.71073","MoKα","","0.0534","0.0343","","","0.0888","0.0973","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215897","7.1472","0.0003","11.5574","0.0006","12.5284","0.0006","90","","98.343","0.004","90","","1023.93","0.08","294","","294","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(1H-Benzimidazol-2-ylsulfanyl)propan-1-ol","","- C10 H12 N2 O S -","- C10 H12 N2 O S -","- C40 H48 N8 O4 S4 -","4","1","FB2063","Kakou-Yao, Rita; Abou, Akoun; Adjou, Ané; Bany, Guy Euloge; Ebby, N'Dédé","3-(1<i>H</i>-Benzimidazol-2-ylsulfanyl)propan-1-ol","Acta Crystallographica Section E","2007","63","11","o4463","o4463","10.1107/S160053680705194X","","","0.71073","MoKα","","0.0473","0.0385","","0.1045","0.0907","0.1045","","","","","","0.9607","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215898","24.5585","0.0011","18.5726","0.0008","25.2655","0.0011","90","","90","","90","","11524","0.9","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","N-phenylimido-bis-N',N""-diphenylphosphoramide","(<i>N</i>-Phenylimino)bis[phosphonic bis(diphenylamide)]","","- C30 H29 N5 O2 P2 -","- C30 H29 N5 O2 P2 -","- C480 H464 N80 O32 P32 -","16","2","FI2046","Chartrand, Daniel; Hanan, Garry S.","(<i>N</i>-Phenylimino)bis[phosphonic bis(diphenylamide)]","Acta Crystallographica Section E","2007","63","11","o4428","o4428","10.1107/S1600536807048520","","","1.54178","CuKα","","0.063","0.039","","","0.0857","0.0893","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215899","9.306","0.002","9.635","0.002","9.954","0.002","68.594","0.003","67.663","0.003","68.422","0.003","740.9","0.3","168","2","168","2","","","","","","","","4","P -1","-P 1","2","Orthomanganated 3-acetylacetophenone","(6-Acetoxy-2-acetylphenyl-κ^2^C^1^,O^1^)tetracarbonylmanganese(I)","","- C14 H9 Mn O7 -","- C14 H9 Mn O7 -","- C28 H18 Mn2 O14 -","2","1","FJ2041","Fester, Victor D.; Main, Lyndsay; Nicholson, Brian K.","(6-Acetoxy-2-acetylphenyl-κ^2^<i>C</i>^1^,<i>O</i>^1^)tetracarbonylmanganese(I)","Acta Crystallographica Section E","2007","63","11","m2655","m2655","10.1107/S1600536807047605","","","0.71073","MoKα","","0.0286","0.0256","","","0.0711","0.073","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215900","7.8394","0.001","22.936","0.003","7.879","0.0009","90","","116.462","0.002","90","","1268.3","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(2-Chlorophenyl)-7-methyl-4<i>H</i>-chromen-4-one","","- C16 H11 Cl O2 -","- C16 H11 Cl O2 -","- C64 H44 Cl4 O8 -","4","1","FJ2043","Xiao-Bing Wang; Ling-Yi Kong","2-(2-Chlorophenyl)-7-methyl-4<i>H</i>-chromen-4-one","Acta Crystallographica Section E","2007","63","11","o4340","o4340","10.1107/S1600536807050155","","","0.71073","MoKα","","0.0862","0.0454","","","0.1017","0.1277","","","","","","1.015","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215901","13.4654","0.0014","8.8808","0.0009","14.2371","0.0016","90","","103.34","0.002","90","","1656.6","0.3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,4',6,6'-Tetramethyl-2,2'-(propyldithio)dipyrimidine","","- C15 H20 N4 S2 -","- C15 H20 N4 S2 -","- C60 H80 N16 S8 -","4","0.5","FJ2044","Wu, Guang-Hui; Liu, Tian-Bao; Peng, Yan-Fen; Wu, Guo-Zhi","4,4',6,6'-Tetramethyl-2,2'-(propyldithio)dipyrimidine","Acta Crystallographica Section E","2007","63","11","o4349","o4349","10.1107/S1600536807050167","","","0.71073","MoKα","","0.051","0.0396","","","0.1067","0.1231","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215902","18.069","0.003","8.2939","0.0012","5.6759","0.0008","90","","90","","90","","850.6","0.2","297","2","297","2","","","","","","","","5","P m n 21","P 2ac -2","31","","4,4'-Bipyridine‒2,4,5,6-tetrafluoro-1,3-diiodobenzene (1/1)","","- C16 H8 F4 I2 N2 -","- C16 H8 F4 I2 N2 -","- C32 H16 F8 I4 N4 -","2","0.5","FJ2045","Pierangelo Metrangolo; Franck Meyer; Tullio Pilati; Giuseppe Resnati; Giancarlo Terraneo","4,4'-Bipyridine‒2,4,5,6-tetrafluoro-1,3-diiodobenzene (1/1)","Acta Crystallographica Section E","2007","63","11","o4243","o4243","10.1107/S1600536807047630","","","0.71069","MoKα","","0.0392","0.0298","","","0.0689","0.0741","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215903","5.7476","0.0007","15.6207","0.0012","15.6735","0.0012","90","","90","","90","","1407.2","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl 1-deoxy-1-(N^1^-thyminyl)-β-D-psicofuranoside","","- C12 H18 N2 O7 -","- C12 H18 N2 O7 -","- C48 H72 N8 O28 -","4","1","FJ2046","Roivainen, Jarkko; Reuter, Hans; Mikhailopulo, Igor A.; Eickmeier, Henning","Methyl 1-deoxy-1-(<i>N</i>^1^-thyminyl)-β-<small>D</small>-psicofuranoside","Acta Crystallographica Section E","2007","63","11","o4294","o4294","10.1107/S1600536807048866","","","0.71073","MoKα","","0.0488","0.0439","","","0.1274","0.1323","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215904","11.7776","0.0011","9.4779","0.0008","18.818","0.0018","90","","90","","90","","2100.6","0.3","93","2","93","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","N-(4-Propoxyphenyl)acetamide","","- C11 H15 N O2 -","- C11 H15 N O2 -","- C88 H120 N8 O16 -","8","1","FJ2048","Slawin, Alexandra M. Z.; Harrison, William T. A.","<i>N</i>-(4-Propoxyphenyl)acetamide","Acta Crystallographica Section E","2007","63","11","o4280","o4280","10.1107/S1600536807048854","","","0.71073","MoKα","","0.0472","0.0425","","","0.1108","0.1147","","","","","","1.056","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215905","7.708","0.0004","7.146","0.0003","17.9718","0.0009","90","","95.366","0.002","90","","985.57","0.08","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(adeninium) chloranilate dihydrate","","- C16 H16 Cl2 N10 O6 -","- C16 H16 Cl2 N10 O6 -","- C32 H32 Cl4 N20 O12 -","2","0.5","FJ2052","Gotoh, Kazuma; Ishikawa, Rie; Ishida, Hiroyuki","Bis(adeninium) chloranilate dihydrate","Acta Crystallographica Section E","2007","63","11","o4433","o4433","10.1107/S1600536807052087","","","0.71075","MoKα","","0.0443","0.0349","","","0.0853","0.089","","","","","","1.076","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215906","12.0055","0.0011","13.5835","0.0013","25.027","0.002","90","","90","","90","","4081.3","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1<i>R</i>,4<i>S</i>,8<i>R</i>,12<i>S</i>,13<i>S</i>,14<i>R</i>,16<i>S</i>, 19<i>R</i>)-14-Hydroxy-7,7-dimethyl-17-methylene-2,9,18-trioxo-3,10- dioxapentacyclo[14.2.1.0^1,13^.0^4,12^.0^8,12^]nonadec-19-yl acetate","","- C22 H26 O8 -","- C22 H26 O8 -","- C176 H208 O64 -","8","2","FJ2053","Shi, Hao","(1<i>R</i>,4<i>S</i>,8<i>R</i>,12<i>S</i>,13<i>S</i>,14<i>R</i>,16<i>S</i>,19<i>R</i>)-14-Hydroxy-7,7-dimethyl-17-methylene-2,9,18-trioxo-3,10-dioxapentacyclo[14.2.1.0^1,13^.0^4,12^.0^8,12^]nonadec-19-yl acetate","Acta Crystallographica Section E","2007","63","11","o4439","o4439","10.1107/S1600536807052099","","","0.71073","MoKα","","0.0694","0.0512","","","0.1082","0.1153","","","","","","0.997","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215907","5.9812","0.0007","7.3117","0.001","16.45","0.002","101.031","0.01","90.948","0.01","103.984","0.01","683.69","0.15","296","","296","","","","","","","","","4","P -1","-P 1","2","","(E)-1-[4-(2,4-Dihydroxybenzylideneamino)phenyl]ethanone sesquihydrate","","- C15 H16 N O4.5 -","- C15 H16 N O4.5 -","- C30 H32 N2 O9 -","2","1","FJ2057","Özek, Arzu; Albayrak, Çiǧdem; Odabaşoǧlu, Mustafa; Büyükgüngör, Orhan","(<i>E</i>)-1-[4-(2,4-Dihydroxybenzylideneamino)phenyl]ethanone sesquihydrate","Acta Crystallographica Section E","2007","63","11","o4457","o4457","10.1107/S1600536807052373","","","0.71073","MoKα","","0.0969","0.0429","","","0.0934","0.1079","","","","","","0.872","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215908","41.236","0.0016","10.111","0.0008","8.693","0.0006","90","","90","","90","","3624.4","0.4","293","2","293","2","","","","","","","","3","C m c 21","C 2c -2","36","","9-(Methoxymethyl)anthracene","","- C16 H14 O -","- C16 H14 O -","- C192 H168 O12 -","12","1.5","FJ2058","Jie Liu; Guo-Hua Wei; Guang-Ju Ping; Jian-Fang Ma","9-(Methoxymethyl)anthracene","Acta Crystallographica Section E","2007","63","11","o4442","o4442","10.1107/S1600536807052324","","","0.71073","MoKα","","0.0551","0.0372","","","0.0865","0.1023","","","","","","1.084","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215909","6.9912","0.0001","10.8651","0.0002","12.2528","0.0003","108.407","0.001","99.878","0.001","103.834","0.001","826.08","0.03","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 3-(4-chlorophenyl)-5-(ethoxycarbonyl)-1<i>H</i>-pyrazole-1-acetate","","- C16 H17 Cl N2 O4 -","- C16 H17 Cl N2 O4 -","- C32 H34 Cl2 N4 O8 -","2","1","FJ2060","Dong, Wen-Liang; Dong, Wen-Liang; Xia, Yong; Ge, Yan-Qing; Zhao, Bao-Xiang","Ethyl 3-(4-chlorophenyl)-5-(ethoxycarbonyl)-1<i>H</i>-pyrazole-1-acetate","Acta Crystallographica Section E","2007","63","11","o4468","o4468","10.1107/S1600536807052208","","","0.71073","MoKα","","0.0483","0.038","","","0.1002","0.1082","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215910","11.79","0.002","6.7956","0.0014","9.61","0.0019","90","","104.97","0.03","90","","743.8","0.3","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-Hydroxycyclohexanecarboxylic acid","","- C7 H12 O3 -","- C7 H12 O3 -","- C28 H48 O12 -","4","1","FL2157","Liang-zhong Xu; Guang-Wei An; Xu-Dong Yang; Xu Yi","1-Hydroxycyclohexanecarboxylic acid","Acta Crystallographica Section E","2007","63","11","o4213","o4213","10.1107/S1600536807046351","","","0.71073","MoKα","","0.0335","0.0319","","","0.0807","0.0819","","","","","","1.084","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215911","7.3388","0.0011","11.798","0.002","31.001","0.005","90","","90","","90","","2684.2","0.7","93","2","93","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(2-Benzylidenepropylidene)-4-bromoaniline","","- C16 H14 Br N -","- C16 H14 Br N -","- C128 H112 Br8 N8 -","8","2","FL2165","Khalaji, Aliakbar Dehno; Alexandra M. Z. Slawin; Woollins, J. Derek","<i>N</i>-(2-Benzylidenepropylidene)-4-bromoaniline","Acta Crystallographica Section E","2007","63","11","o4257","o4257","10.1107/S1600536807048222","","","0.71073","MoKα","","0.0566","0.0475","","","0.1021","0.1076","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215912","7.1325","0.0003","13.7067","0.0005","7.2998","0.0003","90","","92.369","0.002","90","","713.04","0.05","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","4-Acetylresorcinol","1-(2,4-dihydroxyphenyl)ethanone","","- C8 H8 O3 -","- C8 H8 O3 -","- C32 H32 O12 -","4","1","FL2166","Robert, Kirgan; Moore, Curtis; Eichhorn, David; Rillema, D. Paul","4-Acetylresorcinol","Acta Crystallographica Section E","2007","63","11","o4252","o4252","10.1107/S1600536807047794","","","0.71073","MoKα","","0.0527","0.0411","","","0.1047","0.1149","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215913","7.0164","0.0004","7.9267","0.0004","18.5843","0.0011","90","","90.871","0.006","90","","1033.48","0.1","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","12-Methoxy-15-(pyridin-3-ylmethylamino)podocarpa-8,11,13-trien-15-one","6-methoxy-1,4a-dimethyl-N-(3-pyridylmethyl)-1,2,3,4,4a,9,10,10a- octahydrophenanthrene-1-carboxamide","","- C24 H30 N2 O2 -","- C24 H30 N2 O2 -","- C48 H60 N4 O4 -","2","1","FL2167","Mouamba, Claudia; Butcher, Raymond J.; Bakare, Oladapo","12-Methoxy-15-(pyridin-3-ylmethylamino)podocarpa-8,11,13-trien-15-one","Acta Crystallographica Section E","2007","63","11","o4350","o4350","10.1107/S1600536807050088","","","0.71073","MoKα","","0.0324","0.0317","","","0.0871","0.0877","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215914","9.5085","0.001","12.9946","0.0013","11.5893","0.0012","90","","104.11","0.002","90","","1388.8","0.2","130","2","130","2","","","","","","","","5","P 1 21 1","P 2yb","4","brucinium hydrogen 4,5-dichlorophthalate","2,3-Dimethoxy-10-oxostrychnidinium 2-carboxy-4,5-dichlorobenzoate","","- C31 H30 Cl2 N2 O8 -","- C31 H30 Cl2 N2 O8 -","- C62 H60 Cl4 N4 O16 -","2","1","FL2168","Graham Smith; Urs D. Wermuth; Jonathan M. White","2,3-Dimethoxy-10-oxostrychnidinium 2-carboxy-4,5-dichlorobenzoate","Acta Crystallographica Section E","2007","63","11","o4276","o4277","10.1107/S1600536807047952","","","0.71073","MoKα","","0.0379","0.0362","","","0.0856","0.0867","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215915","13.254","0.006","8.285","0.003","12.078","0.006","90","","95.64","0.009","90","","1319.9","1","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-{(1E)-1-[(4-Chlorophenyl)imino]ethyl}-4-methylphenol","","- C15 H14 Cl N O -","- C15 H14 Cl N O -","- C60 H56 Cl4 N4 O4 -","4","1","FL2169","Jian-Guo Chang","2-{(1<i>E</i>)-1-[(4-Chlorophenyl)imino]ethyl}-4-methylphenol","Acta Crystallographica Section E","2007","63","11","o4328","o4328","10.1107/S1600536807049148","","","0.71073","MoKα","","0.0909","0.0477","","","0.1264","0.1551","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215916","8.354","0.002","10.314","0.003","12.503","0.003","78.068","0.004","87.225","0.004","69.065","0.004","984.1","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2-Benzyl-6-(benzylamino)-1<i>H</i>-benzo[de]isoquinoline-1,3(2<i>H</i>)-dione","","- C26 H20 N2 O2 -","- C26 H20 N2 O2 -","- C52 H40 N4 O4 -","2","1","GK2103","Ye Zhang; Gui-Ming Han; Qiang Wu; Heng-Shan Wang","2-Benzyl-6-(benzylamino)-1<i>H</i>-benzo[<i>de</i>]isoquinoline-1,3(2<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","11","o4336","o4336","10.1107/S1600536807049975","","","0.71073","MoKα","","0.0729","0.0507","","","0.1263","0.1358","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215917","8.9068","0.0006","5.9555","0.0004","18.4541","0.0011","90","","90","","90","","978.89","0.11","100","2","100","2","","","","","","","","3","P n a 21","P 2c -2n","33","","(RS,RS)-5-[Hydroxy(4-methylphenyl)methyl]furan-2(5<i>H</i>)-one","","- C12 H12 O3 -","- C12 H12 O3 -","- C48 H48 O12 -","4","1","GK2106","Ollevier, Thierry; Bouchard, Jean-Emmanuel; Desyroy, Valerie; Tessier, Christian","(<i>RS</i>,<i>RS</i>)-5-[Hydroxy(4-methylphenyl)methyl]furan-2(5<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4298","o4298","10.1107/S1600536807048817","","","0.71073","MoKα","","0.0265","0.026","","","0.0716","0.0723","","","","","","1.077","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215918","6.0544","0.0012","10.968","0.002","11.436","0.002","110.404","0.003","98.028","0.003","104.489","0.003","667.2","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","<i>N</i>-Butanoyl-<i>N</i>'-(3,4-dichlorophenyl)thiourea","","- C11 H12 Cl2 N2 O S -","- C11 H12 Cl2 N2 O S -","- C22 H24 Cl4 N4 O2 S2 -","2","1","GK2107","Yusof, M. Sukeri M.; Saadum, Zati Iwani M.; Yamin, Bohari M.","<i>N</i>-Butanoyl-<i>N</i>'-(3,4-dichlorophenyl)thiourea","Acta Crystallographica Section E","2007","63","11","o4285","o4285","10.1107/S1600536807048568","","","0.71073","MoKα","","0.0453","0.0398","","","0.1041","0.1091","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215919","7.607","0.0015","9.0859","0.0018","14.147","0.003","88.88","0.03","74.49","0.03","86.6","0.03","940.5","0.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Aqua(4-formylbenzoato-κ<i>O</i>)(nitrato-κ<i>O</i>)(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')copper(II)","","- C20 H15 Cu N3 O7 -","- C20 H15 Cu N3 O7 -","- C40 H30 Cu2 N6 O14 -","2","1","GK2110","Zhao-Peng Deng; Shan Gao; Li-Hua Huo; Hui Zhao","Aqua(4-formylbenzoato-κ<i>O</i>)(nitrato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II)","Acta Crystallographica Section E","2007","63","11","m2739","m2739","10.1107/S1600536807049744","","","0.71073","MoKα","","0.1019","0.0488","","","0.114","0.1569","","","","","","1.088","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215920","9.7939","0.0004","9.7333","0.0004","19.4436","0.0006","90","","91.635","0.003","90","","1852.74","0.12","296","","296","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(2Z)-2-Bromo-3-[3,5-dibromo-4-(ethylamino)phenyl]-1- (2,4-dichlorophenyl)prop-2-en-1-one","","- C17 H12 Br3 Cl2 N O -","- C17 H12 Br3 Cl2 N O -","- C68 H48 Br12 Cl8 N4 O4 -","4","1","GW2025","Butcher, Ray J.; Jasinski, Jerry P.; Mayekar, Anil N.; Narayana, B.; Yathirajan, H. S.","(2<i>Z</i>)-2-Bromo-3-[3,5-dibromo-4-(ethylamino)phenyl]-1-(2,4-dichlorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","11","o4308","o4309","10.1107/S160053680704946X","","","0.71073","MoKα","","0.2074","0.0667","","","0.1829","0.2746","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215921","14.0437","0.0006","16.059","0.0006","9.6644","0.0003","90","","102.223","0.001","90","","2130.18","0.14","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Bis[4-(4-fluorophenylsulfonyl)phenyl] ether","4,4'-Bis(4-fluorophenylsulfonyl)oxydibenzene","","- C24 H16 F2 O5 S2 -","- C24 H16 F2 O5 S2 -","- C96 H64 F8 O20 S8 -","4","1","GW2026","Lister, Adam R.; Moratti, Stephen C.; Simpson, Jim","4,4'-Bis(4-fluorophenylsulfonyl)oxydibenzene","Acta Crystallographica Section E","2007","63","11","o4237","o4237","10.1107/S1600536807047204","","","0.71073","MoKα","","0.0616","0.0392","","","0.0871","0.0964","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215922","14.0662","0.0006","8.739","0.0004","24.6881","0.0011","90","","90","","90","","3034.8","0.2","130","2","130","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Bis(1-naphthyl) telluride","","- C20 H14 Te -","- C20 H14 Te -","- C160 H112 Te8 -","8","1","GW2027","Chauhan, Ashok K. S.; Anamika; Srivastava, Ramesh C.; Duthie, Andrew","Bis(1-naphthyl) telluride","Acta Crystallographica Section E","2007","63","11","o4386","o4386","10.1107/S160053680705091X","","","0.71073","MoKα","","0.0315","0.0279","","","0.0709","0.0729","","","","","","1.063","","","","has coordinates,has Fobs","192350","2020-10-21","18:00:00",""
"2215923","8.271","0.003","9.663","0.003","10.514","0.004","108.837","0.006","90.689","0.006","94.101","0.006","792.7","0.5","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","Ethyl 2-[2-acetyl-5-(3-methylbut-2-enyloxy)phenoxy]acetate","","- C17 H22 O5 -","- C17 H22 O5 -","- C34 H44 O10 -","2","1","HB2518","Zhang, Cunyan; Li, Hui; Liu, Dengke; Liu, Mo","Ethyl 2-[2-acetyl-5-(3-methylbut-2-enyloxy)phenoxy]acetate","Acta Crystallographica Section E","2007","63","11","o4210","o4210","10.1107/S1600536807041530","","","0.71073","MoKα","","0.055","0.039","","","0.0954","0.1087","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215924","4.9336","0.0019","19.121","0.007","9.568","0.004","90","","92.136","0.007","90","","902","0.6","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Methyl-3-propyl-1H-pyrazole-5-carboxylic acid","","- C8 H12 N2 O2 -","- C8 H12 N2 O2 -","- C32 H48 N8 O8 -","4","1","HB2523","Zhang, Cunyan; Li, Hui; Liu, Dengke; Liu, Mo","1-Methyl-3-propyl-1<i>H</i>-pyrazole-5-carboxylic acid","Acta Crystallographica Section E","2007","63","11","o4209","o4209","10.1107/S1600536807041827","","","0.71073","MoKα","","0.0801","0.0538","","","0.1378","0.1569","","","","","","1.034","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215925","18.908","0.004","12.014","0.002","6.3685","0.0013","90","","90","","90","","1446.7","0.5","113","2","113","2","","","","","","","","5","P n a 21","P 2c -2n","33","","catena-Poly[[[aquaformato(1,10-phenanthroline)cobalt(II)]-μ-formato] monohydrate]","","- C14 H14 Co N2 O6 -","- C14 H14 Co N2 O6 -","- C56 H56 Co4 N8 O24 -","4","1","HB2527","Bin Zhou; Peng-Wu Zheng; Ke-Yue Liu","<i>catena</i>-Poly[[[aquaformato(1,10-phenanthroline)cobalt(II)]-μ-formato] monohydrate]","Acta Crystallographica Section E","2007","63","11","m2635","m2635","10.1107/S1600536807047162","","","0.71073","MoKα","","0.052","0.0426","","","0.093","0.1004","","","","","","0.86","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215926","6.9471","0.0004","17.3603","0.0008","11.6372","0.0006","90","","104.884","0.004","90","","1356.4","0.12","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Hexaaquanickel(II) chelidonate monohydrate","","- C7 H16 Ni O13 -","- C7 H16 Ni O13 -","- C28 H64 Ni4 O52 -","4","1","HB2530","Vaduganathan Yasodha; Subbaiah Govindarajan; V. Manivannan; O. Büyükgüngör","Hexaaquanickel(II) chelidonate monohydrate","Acta Crystallographica Section E","2007","63","11","m2720","m2720","10.1107/S1600536807049045","","","0.71073","MoKα","","0.025","0.0228","","","0.0557","0.0565","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215927","7.5175","0.001","9.3631","0.0013","12.7886","0.0017","98.198","0.002","103.259","0.002","112.517","0.002","782.33","0.18","296","2","","","","","","","","","","4","P -1","-P 1","2","","3-[4-(Dimethylamino)benzylideneamino]-2-methylquinazolin-4(3H)-one","","- C18 H18 N4 O -","- C18 H18 N4 O -","- C36 H36 N8 O2 -","2","1","HB2537","Kumaradhas, P.; Sankara Lakshmi, G.; Sridhar, B.; Paneer Selvam, P.; Saravanan, G.","3-[4-(Dimethylamino)benzylideneamino]-2-methylquinazolin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4293","o4293","10.1107/S1600536807047393","","","0.71073","MoKα","","","0.0491","","","","0.1495","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215928","7.6001","0.0004","9.9758","0.0005","17.5108","0.0008","90","","90","","90","","1327.62","0.11","150","1","150","1","","","","","","","","5","P n m a","-P 2ac 2n","62","","Poly[(nitrato-κO)tris(μ~3~-1<i>H</i>-1,2,4-triazolato)dizinc(II)]","","- C6 H6 N10 O3 Zn2 -","- C6 H6 N10 O3 Zn2 -","- C24 H24 N40 O12 Zn8 -","4","0.5","HB2547","Joseph M. Ellsworth; Smith, Mark D.; Loye, Hans-Conrad zur","Poly[(nitrato-κ<i>O</i>)tris(μ~3~-1<i>H</i>-1,2,4-triazolato)dizinc(II)]: a three-dimensional coordination polymer","Acta Crystallographica Section E","2007","63","11","m2744","m2744","10.1107/S1600536807049574","","","0.71073","MoKα","","0.0268","0.0245","","","0.0609","0.062","","","","","","1.078","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215929","9.9318","0.0004","10.6434","0.0005","14.9527","0.0007","88.643","0.002","77.279","0.002","80.879","0.002","1522.23","0.12","173","2","298","2","","","","","","","","5","P -1","-P 1","2","","cis-Bis(benzylmethylphenylphosphine-kP)tetracarbonylmolybdenum(0)","","- C32 H30 Mo O4 P2 -","- C32 H30 Mo O4 P2 -","- C64 H60 Mo2 O8 P4 -","2","1","HB2548","Adinarayana Doddi; T. Arun Luiz; V. Ramkumar; M. N. Sudheendra Rao","<i>cis</i>-Bis(benzylmethylphenylphosphine-κ<i>P</i>)tetracarbonylmolybdenum(0)","Acta Crystallographica Section E","2007","63","11","m2727","m2727","10.1107/S1600536807048982","","","0.71073","MoKα","","0.071","0.0462","","","0.1221","0.141","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215930","12.9585","0.0012","8.847","0.0008","14.9378","0.0015","90","","100.422","0.002","90","","1684.3","0.3","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Oxo-3,4-dihydroquinazolin-3-ylmethyl <i>N</i>,<i>N</i>-diisopropylcarbamodithioate","","- C16 H21 N3 O S2 -","- C16 H21 N3 O S2 -","- C64 H84 N12 O4 S8 -","4","1","HB2549","Ming-zhen Liu; Wei Huang","4-Oxo-3,4-dihydroquinazolin-3-ylmethyl <i>N</i>,<i>N</i>-diisopropylcarbamodithioate","Acta Crystallographica Section E","2007","63","11","o4299","o4299","10.1107/S160053680704932X","","","0.71073","MoKα","","0.0675","0.0496","","","0.1203","0.1288","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215931","6.8164","0.0002","7.0862","0.0003","7.2305","0.0003","74.925","0.002","72.281","0.002","79.183","0.002","318.99","0.02","293","","293","","","","","","","","","6","P -1","-P 1","2","","Ethylenediammonium tetraaquabis(sulfato)cobaltate(II)","","- C2 H18 Co N2 O12 S2 -","- C2 H18 Co N2 O12 S2 -","- C2 H18 Co N2 O12 S2 -","1","0.5","HB2558","Leyva-Bailen, Patricia; Powell, Anthony V.; Vaqueiro, Paz","Ethylenediammonium tetraaquabis(sulfato)cobaltate(II)","Acta Crystallographica Section E","2007","63","11","m2643","m2644","10.1107/S1600536807047174","","","0.71073","MoKα","","0.0191","0.0168","","0.0209","0.0194","0.0194","","","","","","1.0587","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215932","15.817","0.003","7.2249","0.0014","17.509","0.004","90","","108.29","0.03","90","","1899.8","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis(1-ethyl-1H-imidazole)copper(II)]-μ-benzene-1,3-dicarboxylato]","","- C18 H20 Cu N4 O4 -","- C18 H20 Cu N4 O4 -","- C72 H80 Cu4 N16 O16 -","4","0.5","HB2560","Jun Hong","<i>catena</i>-Poly[[bis(1-ethyl-1<i>H</i>-imidazole)copper(II)]-μ-benzene-1,3-dicarboxylato]","Acta Crystallographica Section E","2007","63","11","m2671","m2671","10.1107/S1600536807047976","","","0.71073","MoKα","","0.0434","0.0346","","","0.1059","0.1116","","","","","","1.15","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215933","6.555","0.005","7.626","0.006","12.129","0.0011","78.889","0.004","85.746","0.007","87.754","0.004","593.1","0.7","293","2","292","2","","","","","","","","6","P -1","-P 1","2","","(2-Amino-4,5-dimethylbenzenesulfonato-κN)aquasilver(I) monohydrate","","- C8 H14 Ag N O5 S -","- C8 H14 Ag N O5 S -","- C16 H28 Ag2 N2 O10 S2 -","2","1","HB2561","Li, Yu-Jie; Li, Shi-Hua; Dong, Xian-Wu","(2-Amino-4,5-dimethylbenzenesulfonato-κ<i>N</i>)aquasilver(I) monohydrate","Acta Crystallographica Section E","2007","63","11","m2695","m2695","10.1107/S1600536807047897","","","0.71073","MoKα","","0.0327","0.0256","","","0.0738","0.0872","","","","","","1.138","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215934","28.903","0.006","8.6828","0.0018","6.79","0.0014","90","","90","","90","","1704","0.6","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","3-Aminopyridinium 2-hydroxy-2,2-diphenylacetate monohydrate","","- C19 H20 N2 O4 -","- C19 H20 N2 O4 -","- C76 H80 N8 O16 -","4","1","HB2562","Li, Jie","3-Aminopyridinium 2-hydroxy-2,2-diphenylacetate monohydrate","Acta Crystallographica Section E","2007","63","11","o4238","o4238","10.1107/S160053680704785X","","","0.71073","MoKα","","0.0442","0.0376","","","0.0834","0.0855","","","","","","1.076","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215935","7.295","0.003","9.781","0.002","10.104","0.003","102.27","0.03","107.76","0.02","105.76","0.03","625.5","0.4","293","","293","","","","","","","","","4","P -1","-P 1","2","","2,6-Diaminopyrimidin-4(3H)-one‒4-nitrobenzoic acid (1/1)","","- C11 H11 N5 O5 -","- C11 H11 N5 O5 -","- C22 H22 N10 O10 -","2","1","HB2563","Annamalai Subashini; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","2,6-Diaminopyrimidin-4(3<i>H</i>)-one‒4-nitrobenzoic acid (1/1)","Acta Crystallographica Section E","2007","63","11","o4244","o4244","10.1107/S1600536807047861","","","1.54178","CuKα","","0.052","0.048","","","0.1432","0.1484","","","","","","1.069","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215936","26.695","0.003","8.2513","0.0009","13.5873","0.0016","90","","116.589","0.005","90","","2676.3","0.5","98","2","98","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Methyl 2-{[(E)-8-oxo-5,8-dihydroquinolin-5-ylidene]hydrazino}benzoate","","- C17 H13 N3 O3 -","- C17 H13 N3 O3 -","- C136 H104 N24 O24 -","8","1","HB2564","Basu Baul, Tushar S.; Mizar, Archana; Tiekink, Edward R. T.","Methyl 2-{[(<i>E</i>)-8-oxo-5,8-dihydroquinolin-5-ylidene]hydrazino}benzoate","Acta Crystallographica Section E","2007","63","11","o4256","o4256","10.1107/S1600536807047848","","","0.71069","MoKα","","0.069","0.062","","","0.13","0.132","","","","","","1.36","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215938","13.782","0.003","12.252","0.003","25.243","0.005","90","","94.32","0.03","90","","4250.3","1.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(2-Amino-3,5-dimethylbenzenesulfonato-κN)bis(triphenylphosphine-κP)silver(I) acetonitrile solvate","","- C46 H43 Ag N2 O3 P2 S -","- C46 H43 Ag N2 O3 P2 S -","- C184 H172 Ag4 N8 O12 P8 S4 -","4","1","HB2567","Jia-Jun Han; Ning Li","(2-Amino-3,5-dimethylbenzenesulfonato-κ<i>N</i>)bis(triphenylphosphine-κ<i>P</i>)silver(I) acetonitrile solvate","Acta Crystallographica Section E","2007","63","11","m2650","m2650","10.1107/S1600536807048076","","","0.71073","MoKα","","0.0481","0.0342","","","0.0833","0.092","","","","","","0.837","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215939","11.1722","0.0005","24.8188","0.0011","13.9443","0.0006","90","","97.968","0.001","90","","3829.2","0.3","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Poly[tetra-<i>n</i>-butylammonium [(dimethyl sulfoxide-κO) sesqui(μ~2~-terephthalato-κ^2^<i>O</i>:<i>O</i>')zincate(II)] 0.67-dimethyl sulfoxide 0.25-pyrazine solvate]","","- C32.33 H53 N1.5 O7.67 S1.67 Zn -","- C32.34 H53.02 N1.5 O7.67 S1.67 Zn -","- C129.36 H212.08 N6 O30.68 S6.68 Zn4 -","4","1","HB2568","Yang, Shi-Yao; Du, Chao; Huang, Rong-Bin; Ng, Seik Weng","Poly[tetra-<i>n</i>-butylammonium [(dimethyl sulfoxide-κ<i>O</i>)sesqui(μ~2~-terephthalato-κ^2^<i>O</i>:<i>O</i>')zincate(II)] 0.67-dimethyl sulfoxide 0.25-pyrazine solvate]","Acta Crystallographica Section E","2007","63","11","m2788","m2788","10.1107/S1600536807050672","","","0.71073","MoKα","","0.0688","0.0601","","","0.1739","0.1809","","","","","","1.049","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2215940","29.411","0.01","6.731","0.006","13.511","0.006","90","","110.91","0.02","90","","2499","3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,1'-Biphenyl-4,4'-diammonium bis(2-nitrobenzoate) dihydrate","","- C26 H26 N4 O10 -","- C26 H26 N4 O10 -","- C104 H104 N16 O40 -","4","0.5","HB2569","Wei, Lin-heng","1,1'-Biphenyl-4,4'-diammonium bis(2-nitrobenzoate) dihydrate","Acta Crystallographica Section E","2007","63","11","o4305","o4305","10.1107/S1600536807048994","","","0.71073","MoKα","","0.076","0.0446","","","0.1064","0.1206","","","","","","0.962","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215941","7.1113","0.0007","16.8303","0.0015","15.985","0.0014","90","","91.291","0.002","90","","1912.7","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aquabis(but-2-enoato-κO)(di-2-pyridylamine-κ^2^N,N')nickel(II)","","- C18 H21 N3 Ni O5 -","- C18 H21 N3 Ni O5 -","- C72 H84 N12 Ni4 O20 -","4","1","HB2571","Jian Yu; Ling Zhang","Aquabis(but-2-enoato-κ<i>O</i>)(di-2-pyridylamine-κ^2^<i>N</i>,<i>N</i>')nickel(II)","Acta Crystallographica Section E","2007","63","11","m2706","m2706","10.1107/S1600536807049100","","","0.71073","MoKα","","0.0471","0.0366","","","0.0816","0.0856","","","","","","0.909","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215942","8.0793","0.001","8.57","0.0011","10.3148","0.0013","88.39","0.002","85.615","0.002","70.393","0.002","670.81","0.15","293","2","292","2","","","","","","","","5","P 1","P 1","1","","<i>N</i>-(4-Bromobenzylidene)-4-ethoxyaniline","","- C15 H14 Br N O -","- C15 H14 Br N O -","- C30 H28 Br2 N2 O2 -","2","2","HB2572","Ma, Rui; Ma, Rongming; Hou, Yubang; Yong, Xuejian; Bao, Feng","<i>N</i>-(4-Bromobenzylidene)-4-ethoxyaniline","Acta Crystallographica Section E","2007","63","11","o4310","o4310","10.1107/S1600536807049094","","","0.71073","MoKα","","0.0999","0.0593","","","0.168","0.2218","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215943","13.336","0.006","6.477","0.003","14.454","0.007","90","","114.777","0.007","90","","1133.6","0.9","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-(4-Aminobenzyl)anilinium 2-hydroxy-2,2-diphenylacetate","","- C27 H26 N2 O3 -","- C27 H26 N2 O3 -","- C54 H52 N4 O6 -","2","1","HB2574","Li, Jie","4-(4-Aminobenzyl)anilinium 2-hydroxy-2,2-diphenylacetate","Acta Crystallographica Section E","2007","63","11","o4303","o4303","10.1107/S1600536807049331","","","0.71073","MoKα","","0.0842","0.0585","","","0.1385","0.1509","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215944","12.0853","0.0003","7.4188","0.0002","14.6724","0.0004","90","","99.924","0.001","90","","1295.82","0.06","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2,2'-Bipyidyl-κ^2^N,N')(succinamidato-κN)silver","","- C14 H12 Ag N3 O2 -","- C14 H12 Ag N3 O2 -","- C56 H48 Ag4 N12 O8 -","4","1","HB2575","Whitcomb, David R.; Rajeswaran, Manju","(2,2'-Bipyridyl-κ^2^<i>N</i>,<i>N</i>')(succinamidato-κ<i>N</i>)silver(I)","Acta Crystallographica Section E","2007","63","11","m2753","m2753","10.1107/S1600536807050301","","","0.71073","MoKα","","0.0604","0.037","","","0.0773","0.0836","","","","","","1.07","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215945","6.96","0.005","14.094","0.005","14.947","0.005","90","0.005","95.099","0.005","90","0.005","1460.4","1.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Poly[(2,2-bipyridine)bis(μ~4~-naphthalene-1,4-dicarboxylato)dilead(II)]","","- C34 H20 N2 O8 Pb2 -","- C34 H20 N2 O8 Pb2 -","- C68 H40 N4 O16 Pb4 -","2","1","HB2578","Yan-Bing Yin; Hai-Xia Yu","Poly[(2,2-bipyridine)bis(μ~4~-naphthalene-1,4-dicarboxylato)dilead(II)]","Acta Crystallographica Section E","2007","63","11","m2804","m2804","10.1107/S1600536807051380","","","0.71073","MoKα","","0.0301","0.0281","","","0.0601","0.0608","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215946","7.063","0.003","14.602","0.005","14.526","0.005","90","","94.922","0.005","90","","1492.6","1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(1E,4E)-1,5-Bis(2-chlorophenyl)penta-1,4-dien-3-one","","- C36 H20 N2 O8 Pb2 -","- C36 H20 N2 O8 Pb2 -","- C72 H40 N4 O16 Pb4 -","2","1","HB2579","Yan-Bing Yin; Hai-Xia Yu","Poly[bis(μ~3~-naphthalene-1,4-dicarboxylato)(1,10-phenanthroline)dilead(II)]","Acta Crystallographica Section E","2007","63","11","m2761","m2761","10.1107/S1600536807050702","","","0.71073","MoKα","","0.0262","0.0236","","","0.044","0.0461","","","","","","0.912","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215947","8.7567","0.0011","10.0467","0.0017","24.921","0.005","90","","90","","90","","2192.4","0.6","291","1","291","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-3-[(R)-2,4-Dimethylpent-4-enoyl]-4-isopropyl-5,5-diphenyl- 1,3-oxazolidin-2-one","","- C25 H29 N O3 -","- C25 H29 N O3 -","- C100 H116 N4 O12 -","4","1","HB2580","Tannert, Rene; Schürmann, Markus; Preut, Hans; Arndt, Hans-Dieter; Waldmann, Herbert","(<i>S</i>)-3-[(<i>R</i>)-2,4-Dimethylpent-4-enoyl]-4-isopropyl-5,5-diphenyl-1,3-oxazolidin-2-one","Acta Crystallographica Section E","2007","63","11","o4381","o4381","10.1107/S1600536807050295","","","0.71073","MoKα","","0.1896","0.0317","","","0.0533","0.0857","","","","","","1.009","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215948","15.391","0.003","7.9002","0.0016","24.161","0.005","90","","92.57","0.03","90","","2934.8","1","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 O10 -","- C15 H16 O10 -","- C120 H128 O80 -","8","2","HB2581","Xu, Zhongwei; Liu, Benguo; Ning, Zhengxiang; Zhang, Yan","Racemic dihydromyricetin dihydrate","Acta Crystallographica Section E","2007","63","11","o4384","o4384","10.1107/S1600536807050416","","","0.71073","MoKα","","0.0985","0.0589","","","0.1312","0.1552","","","","","","1.025","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215949","13.759","0.003","14.334","0.003","26.195","0.006","90","","90","","90","","5166","2","294","2","294","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","1,4-Dibenzyl-1,4-diazoniabicyclo[2.2.2]octane bis(trifluoromethanesulfonate)","","- C22 H26 F6 N2 O6 S2 -","- C22 H26 F6 N2 O6 S2 -","- C176 H208 F48 N16 O48 S16 -","8","1","HB2583","Chen, Chungang; Zhang, Yan","1,4-Dibenzyl-1,4-diazoniabicyclo[2.2.2]octane bis(trifluoromethanesulfonate)","Acta Crystallographica Section E","2007","63","11","o4464","o4464","10.1107/S1600536807052063","","","0.71073","MoKα","","0.1772","0.0592","","","0.1246","0.173","","","","","","1.005","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215950","14.619","0.006","6.442","0.003","24.938","0.01","90","","105.499","0.007","90","","2263.1","1.7","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-(4-Aminophenoxy)anilinium 2-hydroxy-2,2-diphenylacetate","","- C26 H24 N2 O4 -","- C26 H24 N2 O4 -","- C104 H96 N8 O16 -","4","2","HB2584","Han, Qiuxia; Li, Jie","4-(4-Aminophenoxy)anilinium 2-hydroxy-2,2-diphenylacetate","Acta Crystallographica Section E","2007","63","11","o4380","o4380","10.1107/S1600536807051057","","","0.71073","MoKα","","0.1332","0.0579","","","0.1271","0.1539","","","","","","0.838","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215951","24.011","0.003","14.2004","0.0016","12.5487","0.0015","90","","104.601","0.002","90","","4140.5","0.9","293","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5(4H)-one","","- C25 H23 N3 O -","- C25 H23 N3 O -","- C200 H184 N24 O8 -","8","2","HB2585","Ma, Rui; Ma, Rongming; Hou, Yubang; Yong, Xuejian; Bao, Feng","4-[(<i>Z</i>)-(2,5-Dimethylphenylamino)phenylmethylene]-3-methyl-1-phenyl-1<i>H</i>-pyrazol-5(4<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4416","o4416","10.1107/S1600536807051033","","","0.71073","MoKα","","0.1626","0.0632","","","0.1177","0.1438","","","","","","0.853","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215952","23.844","0.005","7.0493","0.0014","9.2504","0.0019","90","","90","","90","","1554.8","0.6","295","2","295","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","1,3-Bis(2-pyridylaminomethyl)benzene","","- C18 H18 N4 -","- C18 H18 N4 -","- C72 H72 N16 -","4","0.5","HB2587","Li-Na Zhu; Shan Gao; Li-Hua Huo","1,3-Bis(2-pyridylaminomethyl)benzene","Acta Crystallographica Section E","2007","63","11","o4399","o4399","10.1107/S1600536807051069","","","0.71073","MoKα","","0.096","0.0436","","","0.0963","0.1164","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215953","7.7689","0.0016","8.339","0.0017","18.345","0.004","80.93","0.03","77.85","0.03","86.5","0.03","1146.9","0.4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","(E)-N'-[4-(2,4-Dichlorobenzyloxy)-3-methoxybenzylidene]-2-methoxybenzohydrazide sesquihydrate","","- C23 H23 Cl2 N2 O5.5 -","- C23 H23 Cl2 N2 O5.5 -","- C46 H46 Cl4 N4 O11 -","2","1","HB2588","Liu, Shou-Xin; Tian, Xia; Zhen, Xiao-Li; Li, Zhen-Chao; Han, Jian-Rong","(<i>E</i>)-<i>N</i>'-[4-(2,4-Dichlorobenzyloxy)-3-methoxybenzylidene]-2-methoxybenzohydrazide sesquihydrate","Acta Crystallographica Section E","2007","63","11","o4396","o4396","10.1107/S1600536807051070","","","0.71073","MoKα","","0.0846","0.0485","","","0.1096","0.1295","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215954","7.3242","0.0009","13.2452","0.0017","15.3145","0.0019","108.731","0.002","93.303","0.002","94.91","0.002","1396.1","0.3","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","(E)-4-Chloro-2-[(2,3-dimethyl-5-oxo-1-phenyl-2,5-dihydro-1H-pyrazol-4-\ yl)iminomethyl]-6-methoxyphenyl 4-methylbenzenesulfonate acetonitrile solvate","","- C28 H27 Cl N4 O5 S -","- C28 H27 Cl N4 O5 S -","- C56 H54 Cl2 N8 O10 S2 -","2","1","HB2589","Zhen, Xiao-Li; Tian, Xia; Li, Zhen-Chao; Han, Jian-Rong; Liu, Shou-Xin","(<i>E</i>)-4-Chloro-2-[(2,3-dimethyl-5-oxo-1-phenyl-2,5-dihydro-1<i>H</i>-pyrazol-4-yl)iminomethyl]-6-methoxyphenyl 4-methylbenzenesulfonate acetonitrile solvate","Acta Crystallographica Section E","2007","63","11","o4397","o4397","10.1107/S1600536807051021","","","0.71073","MoKα","","0.0533","0.0438","","","0.1213","0.1326","","","","","","1.018","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215955","9.848","0.005","10.738","0.005","11.318","0.006","90","","108.165","0.008","90","","1137.2","1","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 1-methyl-8-nitro-5-oxo-1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-7-carboxylate","","- C10 H11 N3 O5 -","- C10 H11 N3 O5 -","- C40 H44 N12 O20 -","4","1","HB2590","Wang, Li; Li, Hui","Methyl 1-methyl-8-nitro-5-oxo-1,2,3,5-tetrahydroimidazo[1,2-<i>a</i>]pyridine-7-carboxylate","Acta Crystallographica Section E","2007","63","11","o4427","o4427","10.1107/S1600536807051379","","","0.71073","MoKα","","0.0667","0.04","","","0.105","0.1257","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215956","8.9061","0.0012","9.8617","0.0014","10.6066","0.0015","100.014","0.002","94.614","0.002","111.107","0.002","845.4","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[[aquazinc(II)]-bis[μ-(p-phenylenedioxy)diacetato]-zinc(II)- μ-1,4-bis(1H-imidazol-l-yl)butane] dihydrate]","","- C15 H19 N2 O8 Zn -","- C15 H19 N2 O8 Zn -","- C30 H38 N4 O16 Zn2 -","2","1","HB2591","Ming Lu","<i>catena</i>-Poly[[[aquazinc(II)]-bis[μ-(<i>p</i>-phenylenedioxy)diacetato]-zinc(II)-μ-1,4-bis(1<i>H</i>-imidazol-l-yl)butane] dihydrate]","Acta Crystallographica Section E","2007","63","11","m2833","m2833","10.1107/S1600536807052518","","","0.71073","MoKα","","0.065","0.0498","","","0.0998","0.1071","","","","","","1.067","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215957","10.146","0.0006","15.8638","0.001","15.0545","0.0009","90","","104.256","0.003","90","","2348.5","0.2","98","2","98","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis(O-isopropyl dithiocarbonato-κ^2^S,S')nickel(II)]-μ-1,2-di-4-pyridylethane-κ^2^N:N']","","- C20 H26 N2 Ni O2 S4 -","- C20 H26 N2 Ni O2 S4 -","- C80 H104 N8 Ni4 O8 S16 -","4","0.5","HB2592","Hill, Denise D.; Tiekink, Edward R. T.","<i>catena</i>-Poly[[bis(<i>O</i>-isopropyl dithiocarbonato-κ^2^<i>S</i>,<i>S</i>')nickel(II)]-μ-1,2-di-4-pyridylethane-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","11","m2808","m2808","10.1107/S1600536807051616","","","0.71069","MoKα","","0.045","0.042","","","0.087","0.088","","","","","","1.19","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215958","5.484","0.002","6.491","0.003","12.82","0.005","86.779","0.006","82.921","0.005","71.956","0.006","430.5","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","4,4'-Diazenediyldiphthalic acid dihydrate","","- C16 H14 N2 O10 -","- C16 H14 N2 O10 -","- C16 H14 N2 O10 -","1","0.5","HB2593","Jun Wang; Lu Lu; Jianwei Bai; Bao-zhong Zhao","4,4'-Diazenediyldiphthalic acid dihydrate","Acta Crystallographica Section E","2007","63","11","o4414","o4414","10.1107/S160053680705163X","","","0.71073","MoKα","","0.065","0.0612","","","0.1865","0.194","","","","","","1.097","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215959","5.8092","0.0012","14.635","0.003","27.6","0.006","90","","91.87","0.03","90","","2345.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[(pyrazino[2,3-f][1,10]phenanthroline)copper(II)]-μ-4,4'- oxydibenzoato] monohydrate]","","- C28 H18 Cu N4 O6 -","- C28 H18 Cu N4 O6 -","- C112 H72 Cu4 N16 O24 -","4","1","HB2595","Chun-Bo Liu; Yang Liu; Lu Lu; Jun Sun","<i>catena</i>-Poly[[[(pyrazino[2,3-<i>f</i>][1,10]phenanthroline)copper(II)]-μ-4,4'-oxydibenzoato] monohydrate]","Acta Crystallographica Section E","2007","63","11","m2823","m2823","10.1107/S1600536807051963","","","0.71073","MoKα","","0.0554","0.0369","","","0.0832","0.0928","","","","","","0.925","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215960","10.3239","0.0016","5.2878","0.0008","16.762","0.003","90","","102.059","0.003","90","","894.9","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Phenyl-2H-1,2,3-triazole-4-carboxylic acid","","- C9 H7 N3 O2 -","- C9 H7 N3 O2 -","- C36 H28 N12 O8 -","4","1","HB2597","Zhang, Ling-Yu; Tian, Lai-Jin; Zhang, Chang-Fa","2-Phenyl-2<i>H</i>-1,2,3-triazole-4-carboxylic acid","Acta Crystallographica Section E","2007","63","11","o4415","o4415","10.1107/S1600536807051823","","","0.71073","MoKα","","0.0579","0.0431","","","0.1012","0.1102","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215961","22.177","0.007","7.551","0.002","12.293","0.004","90","","109.299","0.004","90","","1942.9","1","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-(6-Bromopyridin-2-yl)pyridin-2-amine","","- C10 H8 Br N3 -","- C10 H8 Br N3 -","- C80 H64 Br8 N24 -","8","1","HB2598","Jian Wu","<i>N</i>-(6-Bromopyridin-2-yl)pyridin-2-amine","Acta Crystallographica Section E","2007","63","11","o4413","o4413","10.1107/S1600536807051860","","","0.71073","MoKα","","0.0389","0.0325","","","0.0849","0.0865","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215962","7.1583","0.0011","7.1326","0.0008","19.575","0.002","90","","97.956","0.007","90","","989.8","0.2","173","1","173","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(2R,4S,7R,9S)-5,6-Diisopropyl-1,10-dimethoxy-3,8-dimethyldeca- 3,4,6,7-tetraene-2,9-diol","","- C20 H34 O4 -","- C20 H34 O4 -","- C40 H68 O8 -","2","0.5","HB2599","Poonoth, Manojkumar; Schürmann, Markus; Preut, Hans; Krause, Norbert","(2<i>R</i>,4<i>S</i>,7<i>R</i>,9<i>S</i>)-5,6-Diisopropyl-1,10-dimethoxy-3,8-dimethyldeca-3,4,6,7-tetraene-2,9-diol","Acta Crystallographica Section E","2007","63","11","o4402","o4402","10.1107/S1600536807051835","","","0.71073","MoKα","","0.1043","0.0369","","","0.0603","0.0639","","","","","","0.933","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215963","9.855","0.002","10.046","0.002","13.539","0.003","100.36","0.03","101.14","0.03","92.04","0.03","1290.3","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[(4,7-diphenyl-1,10-phenanthroline)lead(II)]-μ-benzene- 1,4-dicarboxylato]","","- C32 H20 N2 O4 Pb -","- C32 H20 N2 O4 Pb -","- C64 H40 N4 O8 Pb2 -","2","1","HB2600","Yan-Bing Yin; Hai-Xia Yu","<i>catena</i>-Poly[[(4,7-diphenyl-1,10-phenanthroline)lead(II)]-μ-benzene-1,4-dicarboxylato]","Acta Crystallographica Section E","2007","63","11","m2803","m2803","10.1107/S1600536807051859","","","0.71073","MoKα","","0.0307","0.026","","","0.074","0.0819","","","","","","1.116","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215964","9.155","0.004","16.429","0.005","12.964","0.005","90","","101.61","0.03","90","","1910","1.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(methyltriphenylphosphonium) hexachloridorhenate(IV)","","- C38 H36 Cl6 P2 Re -","- C38 H36 Cl6 P2 Re -","- C76 H72 Cl12 P4 Re2 -","2","0.5","HB2601","Hołyńska, Małgorzata; Korabik, Maria; Lis, Tadeusz","Redetermination of bis(methyltriphenylphosphonium) hexachloridorhenate(IV)","Acta Crystallographica Section E","2007","63","11","m2859","m2859","10.1107/S1600536807052579","","","0.71073","MoKα","","0.1184","0.0529","","","0.0483","0.056","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215965","11.8315","0.0012","11.3603","0.0011","11.9716","0.0012","90","","90.261","0.002","90","","1609.1","0.3","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,2,13,14,14a,15,16,17,18,18a-Decahydro-1,14-methano-4H,6H,8H- 1,3,5-oxadiazino[3',4':3,3a]benzimidazo[1,7a-b][2,4]benzodiazepine- 6,19-dione","","- C18 H20 N4 O3 -","- C18 H20 N4 O3 -","- C72 H80 N16 O12 -","4","1","HB2603","Nengfang She; Hailing Xi","1,2,13,14,14a,15,16,17,18,18a-Decahydro-1,14-methano-4<i>H</i>,6<i>H</i>,8<i>H</i>-1,3,5-oxadiazino[3',4':3,3a]benzimidazo[1,7a-<i>b</i>][2,4]benzodiazepine-6,19-dione","Acta Crystallographica Section E","2007","63","11","o4440","o4440","10.1107/S1600536807052038","","","0.71073","MoKα","","0.0518","0.0452","","","0.1232","0.1294","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215966","5.0438","0.0019","10.632","0.004","15.55","0.006","90","","95.515","0.005","90","","830","0.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,4-Dichloro-5-fluorobenzoic acid","","- C7 H3 Cl2 F O2 -","- C7 H3 Cl2 F O2 -","- C28 H12 Cl8 F4 O8 -","4","1","HB2604","Zhao, Yun-Feng","2,4-Dichloro-5-fluorobenzoic acid","Acta Crystallographica Section E","2007","63","11","o4449","o4449","10.1107/S1600536807052130","","","0.71073","MoKα","","0.0608","0.0516","","","0.1337","0.1416","","","","","","1.057","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215967","24.462","0.0015","24.462","0.0015","8.8325","0.001","90","","90","","90","","5285.3","0.8","292","2","292","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","4,4'-Methylenedianilinium 2,2'-dithiodibenzoate","","- C27 H24 N2 O4 S2 -","- C27 H24 N2 O4 S2 -","- C216 H192 N16 O32 S16 -","8","1","HB2607","Han,Qiuxia","4,4'-Methylenedianilinium 2,2'-dithiodibenzoate","Acta Crystallographica Section E","2007","63","11","o4456","o4456","10.1107/S1600536807052403","","","0.71073","MoKα","","0.1098","0.0859","","","0.1645","0.1743","","","","","","1.166","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215968","6.57","0.002","16.055","0.003","9.48","0.002","90","","99.19","0.03","90","","987.1","0.4","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","pyrimethamine nicotinate","Pyrimethaminium nicotinate monohydrate","","- C18 H20 Cl N5 O3 -","- C18 H20 Cl N5 O3 -","- C36 H40 Cl2 N10 O6 -","2","1","HB2608","Kasthuri Balasubramani; Packianathan Thomas Muthiah; Gabriele Bocelli; Andrea Cantoni","Pyrimethaminium nicotinate monohydrate","Acta Crystallographica Section E","2007","63","11","o4452","o4452","10.1107/S1600536807052397","","","0.71069","MoKα","","0.2305","0.056","","","0.0361","0.0555","","","","","","0.846","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2215969","5.8826","0.0014","11.927","0.003","12.752","0.003","90","","90","","90","","894.7","0.4","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","6-Methyl citrate","methyl 3-carboxy-2-carboxymethyl-2-hydroxypropanoate","","- C7 H10 O7 -","- C7 H10 O7 -","- C28 H40 O28 -","4","1","HB2611","Li, Mingjing; Wang, Yong; Fu, Dexue; Liu, Xiuhua","6-Methyl citrate from <i>Dioscorea opposita</i> Thunb.","Acta Crystallographica Section E","2007","63","11","o4497","o4497","10.1107/S1600536807052828","","","0.71073","MoKα","","0.0291","0.0282","","","0.0715","0.0723","","","","","","1.141","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215970","11.52","0.005","11.302","0.004","26.219","0.011","90","","99.409","0.001","90","","3368","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Octabenzyldi-μ~2~-methanolato-di-μ~3~-oxido-bis(p- toluenesulfonato)tetratin(IV)","","- C72 H76 O10 S2 Sn4 -","- C72 H76 O10 S2 Sn4 -","- C144 H152 O20 S4 Sn8 -","2","0.5","HB2613","Shun-Li Li; Ting-Ting Han; Jin Yang","Octabenzyldi-μ~2~-methanolato-di-μ~3~-oxido-bis(<i>p</i>-toluenesulfonato)tetratin(IV)","Acta Crystallographica Section E","2007","63","11","m2865","m2865","10.1107/S1600536807052804","","","0.71069","MoKα","","0.0545","0.0357","","","0.0698","0.0769","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215971","15.346","0.004","6.0908","0.0015","13.784","0.003","90","","102.098","0.004","90","","1259.8","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(E)-N-(1-(3-oxo-3-phenylpropyl)imidazolidin-2-ylidene)nitramide","(E)-3-(2-Nitriminoimidazolidin-1-yl)-1-phenylpropan-1-one","","- C12 H14 N4 O3 -","- C12 H14 N4 O3 -","- C48 H56 N16 O12 -","4","1","HG2297","Yu, Haibo; Zhang, Bingnan; Fang, Jianxin","(<i>E</i>)-3-(2-Nitriminoimidazolidin-1-yl)-1-phenylpropan-1-one","Acta Crystallographica Section E","2007","63","11","o4242","o4242","10.1107/S1600536807047939","","","0.71073","MoKα","","0.0857","0.0444","","","0.1099","0.1347","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215972","7.8124","0.0013","8.4132","0.0015","10.8144","0.0018","103.127","0.003","96.272","0.003","97.569","0.003","679","0.2","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","κ^4^N^3^,N^6^,O^23^,O^24^:κ^4^N^14^,N^17^,O^23^,O^24^]bis[methanolcopper(II)] bis(perchlorate)","","- C22 H24 Cl2 Cu2 F2 N4 O12 -","- C22 H24 Cl2 Cu2 F2 N4 O12 -","- C22 H24 Cl2 Cu2 F2 N4 O12 -","1","0.5","HG2298","Jun-Lin Bai; Hong Zhou; Zhi-Quan Pan; Xiang-Gao Meng","[μ-10,21-Difluoro-3,6,14,17-tetrazatricyclo[17.3.1.1^8,12^]tetracosa-1(23),2,6,8,10,12(24),13,17,19,21-decaene-23,24-diolato-κ^4^<i>N</i>^3^,<i>N</i>^6^,<i>O</i>^23^,<i>O</i>^24^:κ^4^<i>N</i>^14^,<i>N</i>^17^,<i>O</i>^23^,<i>O</i>^24^]bis[methanolcopper(II)] bis(perchlorate)","Acta Crystallographica Section E","2007","63","11","m2641","m2641","10.1107/S1600536807047009","","","0.71073","MoKα","","0.0376","0.031","","","0.0824","0.0864","","","","","","1.067","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215973","11.5151","0.0002","11.9323","0.0002","22.7986","0.0005","93.655","0.001","92.921","0.001","118.676","0.001","2730.83","0.09","173","2","173","2","","","","","","","","4","P -1","-P 1","2","7,11,15,28-Tetrakis(bromomethyl)-1,21,23,25- tetrapentyl-resorcin[4]arene cavitand","7,11,15,28-tetrakis(bromomethyl)-1,21,23,25-tetrapentyl-2,20:3,19-dimetheno- 1H,21H,23H,25H-bis[1,3]dioxocino[5,4-i:5',4'-i']benzo[1,2-d:5,4-d']bis[1,3] benzodioxocine stereoisomer","","- C56 H68.83 Br4 O8.41 -","- C56 H68.83 Br4 O8.415 -","- C112 H137.66 Br8 O16.83 -","2","1","HG2300","McKay, Michael G.; Friedrich, Holger B.; Maguire, Glenn E. M.","7,11,15,28-Tetrakis(bromomethyl)-1,21,23,25-tetrapentylresorcin[4]arene cavitand 0.415-hydrate","Acta Crystallographica Section E","2007","63","11","o4345","o4345","10.1107/S1600536807050106","","","0.71073","MoKα","","0.0731","0.0515","","","0.1753","0.1873","","","","","","1.119","","","","has coordinates,has disorder,has Fobs","194389","2020-10-21","18:00:00",""
"2215974","9.3842","0.0006","11.9025","0.0007","18.6386","0.0013","90","","90","","90","","2081.8","0.2","90","0.2","90","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(11R)-13-(1-Naphthylmethylamino)-4,5-epoxy-11,13-dihydrocostunolide","","- C26 H31 N O3 -","- C26 H31 N O3 -","- C104 H124 N4 O12 -","4","1","HG2301","Nasim, Shama; Parkin, Sean; Crooks, Peter A.","(11<i>R</i>)-13-(1-Naphthylmethylamino)-4,5-epoxy-11,13-dihydrocostunolide","Acta Crystallographica Section E","2007","63","11","o4274","o4274","10.1107/S1600536807046983","","","1.54178","CuKα","","0.0341","0.0336","","","0.08","0.0805","","","","","","1.112","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215975","9.035","0.003","20.805","0.007","11.79","0.003","90","","110.95","0.01","90","","2069.7","1.1","294","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","9-Methyl-2,6-di-<i>p</i>-tolyl-2,3,6,7-tetrahydro-1<i>H</i>,5<i>H</i>- pyrimido[5,6,1-<i>ij</i>]quinazoline","","- C25 H27 N3 -","- C25 H27 N3 -","- C100 H108 N12 -","4","1","HG2304","Mahon, Andrew; Craig, Donald C.; Try, Andrew C.","9-Methyl-2,6-di-<i>p</i>-tolyl-2,3,6,7-tetrahydro-1<i>H</i>,5<i>H</i>-pyrimido[5,6,1-<i>ij</i>]quinazoline","Acta Crystallographica Section E","2007","63","11","o4311","o4311","10.1107/S1600536807049173","","","0.71073","MoKα","","","0.058","","","","0.065","","","","","","1.85","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215976","14.1273","0.0015","6.6082","0.0007","16.5781","0.0018","90","","103.924","0.002","90","","1502.2","0.3","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","N'-[1-(2,4-Difluorophenyl)ethylidene]-4-methylbenzenesulfonohydrazide","","- C15 H14 F2 N2 O2 S -","- C15 H14 F2 N2 O2 S -","- C60 H56 F8 N8 O8 S4 -","4","1","HG2305","Shang, Zhen-Hua","<i>N</i>'-[1-(2,4-Difluorophenyl)ethylidene]-4-methylbenzenesulfonohydrazide","Acta Crystallographica Section E","2007","63","11","o4222","o4222","10.1107/S1600536807047629","","","0.71073","MoKα","","0.0388","0.0323","","","0.0885","0.0955","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215977","13.02","0.004","26.448","0.007","4.978","0.002","90","","90","","90","","1714.2","1","294","","","","","","","","","","","4","C c c 2","C 2 -2c","37","","1,1'-Methylenebis(naphthalen-2-amine) methanol solvate","","- C22 H22 N2 O -","- C22 H18 N2 O -","- C88 H72 N8 O4 -","4","0.5","HG2306","Mahon, Andrew B.; Craig, Donald C.; Try, Andrew C.","1,1'-Methylenebis(naphthalen-2-amine) methanol solvate","Acta Crystallographica Section E","2007","63","11","o4341","o4341","10.1107/S1600536807050131","","","0.71073","MoKα","","","0.049","","","","0.065","","","","","","1.34","","","","has coordinates,has Fobs","202213","2020-10-21","18:00:00",""
"2215978","12.3109","0.0003","30.6151","0.0007","16.5024","0.0003","90","","92.8385","0.0019","90","","6212.1","0.2","105","2","105","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2-phenethyl octol","5,11,17,23-tetramethyl-2,8,14,16-tetrakis(2-phenylethyl)pentacyclo [19.3.1.1^3,7^.1^9,13^.1^15,19^]octacosa- 1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23- dodecaene-4,6,10,12,16,18,22,24-octol","","- C69 H84.21 O13.103 -","- C69 H84.206 O13.103 -","- C276 H336.824 O52.412 -","4","1","HG2307","Friedrich, Holger B.; Howie, R. Alan; Maguire, Glenn E. M.; Mc Kay, Michael G.","5,11,17,23-Tetramethyl-2,8,14,20-tetrakis(2-phenylethyl)-4,6,10,12,16,18,22,24-octahydroxycalix[4]arene methanol pentasolvate 0.10-hydrate","Acta Crystallographica Section E","2007","63","11","o4346","o4346","10.1107/S160053680705012X","","","0.71073","MoKα","","0.0868","0.0582","","","0.1623","0.1752","","","","","","1.089","","","","has coordinates,has Fobs","194389","2020-10-21","18:00:00",""
"2215979","9.5105","0.0011","11.3594","0.0013","10.4939","0.0012","90","","91.305","0.002","90","","1133.4","0.2","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","","[N-(5-Chloro-2-oxidobenzylidene)-L-valinato-κ^3^O,N,O']diphenyltin(IV)","","- C24 H22 Cl N O3 Sn -","- C24 H22 Cl N O3 Sn -","- C48 H44 Cl2 N2 O6 Sn2 -","2","1","HG2308","Dong, Yan","[<i>N</i>-(5-Chloro-2-oxidobenzylidene)-<small>L</small>-valinato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>']diphenyltin(IV)","Acta Crystallographica Section E","2007","63","11","m2689","m2689","10.1107/S1600536807048647","","","0.71073","MoKα","","0.0344","0.0313","","","0.0653","0.0667","","","","","","1.018","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2215980","14.4115","0.0017","11.3618","0.0011","18.582","0.002","90","","96.829","0.003","90","","3021","0.6","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis(O,O'-diisopropyl dithiophosphato-κ^2^S,S')(1,10-phenanthroline)nickel(II)","","- C24 H36 N2 Ni O4 P2 S4 -","- C24 H36 N2 Ni O4 P2 S4 -","- C96 H144 N8 Ni4 O16 P8 S16 -","4","1","HG2309","Berdugo, Erick; Tiekink, Edward R. T.","Bis(<i>O</i>,<i>O</i>'-diisopropyl dithiophosphato-κ^2^<i>S</i>,<i>S</i>')(1,10-phenanthroline)nickel(II)","Acta Crystallographica Section E","2007","63","11","m2688","m2688","10.1107/S1600536807048659","","","0.7107","MoKα","","0.062","0.057","","","0.116","0.118","","","","","","1.17","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215981","11.8025","0.0004","14.9842","0.0004","8.7569","0.0003","90","","90","","90","","1548.67","0.09","294","2","294","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","{3-Hydroxymethyl-1-[2-(3-methoxyphenyl)ethyl]-7-oxabicyclo[2.2.1]hept-5-en-2- yl}methanol","","- C17 H22 O4 -","- C17 H22 O4 -","- C68 H88 O16 -","4","1","HG2310","Ya-Wen Wang; Yu Peng","{3-Hydroxymethyl-1-[2-(3-methoxyphenyl)ethyl]-7-oxabicyclo[2.2.1]hept-5-en-2-yl}methanol","Acta Crystallographica Section E","2007","63","11","o4352","o4352","10.1107/S1600536807050234","","","0.71073","MoKα","","0.0375","0.0324","","","0.0806","0.0835","","","","","","1.077","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215982","5.5438","0.0009","12.234","0.002","24.312","0.004","90","","90","","90","","1648.9","0.5","298","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1,5-Anhydro-2,3,4,6-tetra-O-acetyl-D-lyxo-hex-1-enitol","","- C14 H18 O9 -","- C14 H18 O9 -","- C56 H72 O36 -","4","1","HG2312","Yan Zhang; Jiong Jia; Li-Na Pang; Jian-Wu Wang","1,5-Anhydro-2,3,4,6-tetra-<i>O</i>-acetyl-<small>D</small>-<i>lyxo</i>-hex-1-enitol","Acta Crystallographica Section E","2007","63","11","o4321","o4321","10.1107/S1600536807049379","","","0.71073","MoKα","","0.0408","0.039","","","0.103","0.1045","","","","","","1.073","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215983","9.9579","0.0019","10.811","0.002","11.294","0.002","72.064","0.003","86.885","0.004","81.366","0.003","1143.6","0.4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>,<i>N</i>-Dicyclohexyl-2-(5,7-dibromoquinolin-8-yloxy)acetamide","","- C23 H28 Br2 N2 O2 -","- C23 H28 Br2 N2 O2 -","- C46 H56 Br4 N4 O4 -","2","1","HG2315","Liu, Jian-Fei; Tang, Xiao-Fang; Wen, Yong-Hong","<i>N</i>,<i>N</i>-Dicyclohexyl-2-(5,7-dibromoquinolin-8-yloxy)acetamide","Acta Crystallographica Section E","2007","63","11","o4458","o4458","10.1107/S1600536807052117","","","0.71073","MoKα","","0.0836","0.0443","","","0.091","0.1066","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215984","8.84","0.0013","10.4431","0.0015","10.9693","0.0016","111.074","0.006","96.544","0.006","102.119","0.006","903.7","0.2","273","2","273","2","","","","","","","","4","P -1","-P 1","2","4-(4-Acetoxy-3,5-dimethoxybenzylidene)-2-phenyloxazol-5(4H)-one","2,6-Dimethoxy-4-(5-oxo-2-phenyl-4,5-dihydro-1,3-oxazol-4-ylidenemethyl)phenyl acetate","","- C20 H17 N O6 -","- C20 H17 N O6 -","- C40 H34 N2 O12 -","2","1","HG2317","Yi-Feng Sun; Xin-Li Wang; Ji-Kun Li; Ze-Bao Zheng; Ren-Tao Wu","2,6-Dimethoxy-4-(5-oxo-2-phenyl-4,5-dihydro-1,3-oxazol-4-ylidenemethyl)phenyl acetate","Acta Crystallographica Section E","2007","63","11","o4426","o4426","10.1107/S1600536807051458","","","0.71073","MoKα","","0.0617","0.0402","","","0.1016","0.1171","","","","","","1.023","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215985","17.025","0.003","11.048","0.002","18.736","0.004","90","","110.281","0.003","90","","3305.6","1.1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>catena</i>-poly-[[(terephthalato-κ^2^<i>O</i>:<i>O</i>)bis(di-4- pyridylamine-κN)nickel(II)]-μ-di-4-pyridylamine-κ^2^<i>N</i>:<i>N'</i>]","","- C38 H30 N9 Ni O4 -","- C38 H30 N9 Ni O4 -","- C152 H120 N36 Ni4 O16 -","4","1","HG2318","Braverman, Maxwell A.; LaDuca, Robert L.","<i>catena</i>-Poly[[bis(di-4-pyridylamine-κ<i>N</i>)(terephthalato-κ^2^<i>O</i>,<i>O</i>')nickel(II)]-μ-di-4-pyridylamine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","11","m2780","m2780","10.1107/S1600536807051112","","","0.71073","MoKα","","0.1389","0.0682","","","0.1398","0.1682","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215987","4.667","0.0009","12.202","0.002","12.935","0.003","106.7","0.03","92.36","0.03","96.94","0.03","698.1","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","6-Chloro-N'-(2,4-dichlorobenzylidene)nicotinohydrazide","","- C13 H8 Cl3 N3 O -","- C13 H8 Cl3 N3 O -","- C26 H16 Cl6 N6 O2 -","2","1","HG2327","Feng Zhi; Yi-Lin Yang","6-Chloro-<i>N</i>'-(2,4-dichlorobenzylidene)nicotinohydrazide","Acta Crystallographica Section E","2007","63","11","o4471","o4471","10.1107/S1600536807053184","","","0.71073","MoKα","","0.2038","0.0857","","","0.1431","0.1898","","","","","","0.965","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215988","6.549","0.005","7.658","0.005","14.093","0.01","81.691","0.011","86.585","0.011","84.035","0.01","694.9","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Methyl 6-amino-5-cyano-4-(4-fluorophenyl)-2-methylpyridine-3-carboxylate","","- C15 H12 F N3 O2 -","- C15 H12 F N3 O2 -","- C30 H24 F2 N6 O4 -","2","1","HK2330","Qian Wang; Dianxiang Zhou; Chunmei Li; Qingqing Shao; Shujiang Tu","Methyl 6-amino-5-cyano-4-(4-fluorophenyl)-2-methylpyridine-3-carboxylate","Acta Crystallographica Section E","2007","63","11","o4220","o4220","10.1107/S1600536807047502","","","0.71073","MoKα","","0.1639","0.0655","","","0.1296","0.1683","","","","","","0.937","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215990","25.072","0.003","7.3183","0.0016","23.335","0.002","90","","107.922","0.002","90","","4073.8","1.1","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","12-(4-Methoxyphenyl)-9,10-dihydrobenzo[b][4,7]phenanthrolin-11(7H,8H,12H)-one","","- C23 H20 N2 O2 -","- C23 H20 N2 O2 -","- C184 H160 N16 O16 -","8","1","HK2333","Xiaojing Zhang; Dianxiang Zhou; Shujiang Tu; Qingqing Shao; Chunmei Li","12-(4-Methoxyphenyl)-9,10-dihydrobenzo[<i>b</i>][4,7]phenanthrolin-11(7<i>H</i>,8<i>H</i>,12<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4245","o4245","10.1107/S1600536807048246","","","0.71073","MoKα","","0.174","0.0743","","","0.146","0.1792","","","","","","0.896","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215991","13.189","0.0004","9.718","0.0003","10.82","0.0003","90","","112.08","0.0018","90","","1285.1","0.07","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Dibromido(η^5^,η^5^-propane-2,2-diyldicyclopentadienyl)titanium(IV)","","- C13 H14 Br2 Ti -","- C13 H14 Br2 Ti -","- C52 H56 Br8 Ti4 -","4","0.5","HK2334","Erben, Milan; Císařová, Ivana; Dušek, Michal; Vinklárek, Jaromír; Picka, Michal","Dibromido(η^5^,η^5^-propane-2,2-diyldicyclopentadienyl)titanium(IV)","Acta Crystallographica Section E","2007","63","11","m2699","m2699","10.1107/S1600536807048921","","","0.71073","MoKα","","0.058","0.0525","","","0.1423","0.1474","","","","","","1.167","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215992","19.357","0.003","9.213","0.0007","18.3269","0.0015","90","","114.382","0.01","90","","2976.9","0.6","294","2","","","","","","","","","","7","C 1 c 1","C -2yc","9","","Dibromido-2κ^2^Br-bis(4-methylpyridine-1κN){μ-2,2'-[propane-1,3- diylbis(nitrilomethylidyne)]diphenolato- 1κ^4^O,N,N',O':2κ^2^O,O'}nickel(II)zinc(II)","","- C29 H30 Br2 N4 Ni O2 Zn -","- C29 H30 Br2 N4 Ni O2 Zn -","- C116 H120 Br8 N16 Ni4 O8 Zn4 -","4","1","HK2335","Tatar Yıldırım, Leyla; Atakol, Orhan","Dibromido-2κ^2^<i>Br</i>-bis(4-methylpyridine-1κ<i>N</i>){μ-2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato-1κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>':2κ^2^<i>O</i>,<i>O</i>'}nickel(II)zinc(II)","Acta Crystallographica Section E","2007","63","11","m2676","m2677","10.1107/S1600536807048581","","","0.71073","MoKα","","0.1395","0.0656","","","0.1723","0.2062","","","","","","1.038","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2215993","7.32","0.0015","12.63","0.003","13.106","0.003","95.37","0.03","101.06","0.03","103.48","0.03","1144.2","0.5","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","2-{2-[3-(3,5-Dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]phenoxy}- N-(2,6-dimethylphenyl)acetamide","","- C26 H25 N3 O5 -","- C26 H25 N3 O5 -","- C52 H50 N6 O10 -","2","1","HK2336","Li, Hai-Lin; Wang, Hai-Bo; Yin, Jun; Kang, Si-Shun; Zeng, Hai-Su","2-{2-[3-(3,5-Dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]phenoxy}-<i>N</i>-(2,6-dimethylphenyl)acetamide","Acta Crystallographica Section E","2007","63","11","o4314","o4314","10.1107/S1600536807049501","","","0.71073","MoKα","","0.1683","0.0827","","","0.1488","0.179","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215995","10.1367","0.0007","22.519","0.002","10.8253","0.0008","90","","90","","90","","2471.1","0.3","296","","296","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-(6-Methyl-2-pyridylamino)isobenzofuran-1(3H)-one","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C112 H96 N16 O16 -","8","1","HK2338","Odabaşoǧlu, Mustafa; Büyükgüngör, Orhan","3-(6-Methyl-2-pyridylamino)isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4348","o4348","10.1107/S1600536807049677","","","0.71073","MoKα","","0.0868","0.0372","","","0.0811","0.0948","","","","","","0.891","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2215996","10.3739","0.0003","16.4326","0.0005","34.9438","0.0008","90","","98.313","0.002","90","","5894.3","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tris(tribenzylammonium) hexachloridoplatinate(IV) chloride","","- C63 H66 Cl7 N3 Pt -","- C63 H66 Cl7 N3 Pt -","- C252 H264 Cl28 N12 Pt4 -","4","1","HK2340","Yousefi Mohammad; Teimouri, Shabahang; Amani, Vahid; Khavasi, Hamid Reza","Tris(tribenzylammonium) hexachloridoplatinate(IV) chloride","Acta Crystallographica Section E","2007","63","11","m2748","m2749","10.1107/S1600536807049689","","","0.71073","MoKα","","0.0546","0.0504","","","0.1332","0.139","","","","","","1.077","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2215998","7.268","0.0008","7.5916","0.0011","18.038","0.002","90","","91.25","0.03","90","","995","0.2","294","2","294","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","(Z)-5-(2-Chlorobenzylidene)thiazolidine-2,4-dione","","- C10 H6 Cl N O2 S -","- C10 H6 Cl N O2 S -","- C40 H24 Cl4 N4 O8 S4 -","4","1","HK2342","Sun, Hong-shun; He, Wei; Xu, Ye-ming; Tang, Shi-gui; Guo, Cheng","(<i>Z</i>)-5-(2-Chlorobenzylidene)thiazolidine-2,4-dione","Acta Crystallographica Section E","2007","63","11","o4325","o4325","10.1107/S1600536807049756","","","0.71073","MoKα","","0.1229","0.0678","","","0.1464","0.1727","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216001","7.2107","0.0007","14.6318","0.0018","11.8392","0.0011","90","","90","","90","","1249.1","0.2","120","2","120","2","","","","","","","","5","C m c a","-C 2ac 2","64","","trans-Tetrachloridobis(pyrazine-κN)platinum(IV)","","- C8 H8 Cl4 N4 Pt -","- C8 H8 Cl4 N4 Pt -","- C32 H32 Cl16 N16 Pt4 -","4","","HK2345","Mohammad Yousefi; Teimouri, Shabahang; Amani, Vahid; Khavasi, Hamid Reza","<i>trans</i>-Tetrachloridobis(pyrazine-κ<i>N</i>)platinum(IV)","Acta Crystallographica Section E","2007","63","11","m2869","m2870","10.1107/S1600536807052555","","","0.71073","MoKα","","0.0533","0.0529","","","0.153","0.1536","","","","","","1.382","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216002","11.127","0.002","11.325","0.002","13.155","0.003","90","","90","","90","","1657.7","0.6","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d]cycloheptan-5-ol","","- C20 H23 N O -","- C20 H23 N O -","- C80 H92 N4 O4 -","4","1","HK2346","Li, Xiang; Chen, Jun; Wan, Dan; Han, Feng; Yao, Cheng","5-[3-(Dimethylamino)propyl]-5<i>H</i>-dibenzo[<i>a</i>,<i>d</i>]cycloheptan-5-ol","Acta Crystallographica Section E","2007","63","11","o4460","o4460","10.1107/S1600536807052026","","","0.71073","MoKα","","0.1223","0.0798","","","0.1708","0.2007","","","","","","1.006","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216005","9.8372","0.0011","9.8985","0.0012","11.6126","0.0013","115.187","0.002","101.572","0.002","103.929","0.002","932.17","0.19","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","2-(1H-Benzotriazol-1-yl)-1-(2-fluorobenzoyl)ethyl benzoate","","- C22 H16 F N3 O3 -","- C22 H16 F N3 O3 -","- C44 H32 F2 N6 O6 -","2","1","HK2350","Sai Bi; Hao Luo; Wu-Lan Zeng; Jun Wan","2-(1<i>H</i>-Benzotriazol-1-yl)-1-(2-fluorobenzoyl)ethyl benzoate","Acta Crystallographica Section E","2007","63","11","o4499","o4499","10.1107/S1600536807053251","","","0.71073","MoKα","","0.0787","0.0527","","","0.1039","0.1178","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216006","5.12","0.001","21.189","0.004","9.031","0.0018","90","","105.49","0.03","90","","944.2","0.3","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Z)-5-(2-Fluorobenzylidene)-1,3-thiazolidine-2,4-dione","","- C10 H6 F N O2 S -","- C10 H6 F N O2 S -","- C40 H24 F4 N4 O8 S4 -","4","1","HK2351","Sun, Hong-shun; Yao, Chuan-hao; He, Wei; Tang, Shi-gui; Guo, Cheng","(<i>Z</i>)-5-(2-Fluorobenzylidene)-1,3-thiazolidine-2,4-dione","Acta Crystallographica Section E","2007","63","11","o4473","o4473","10.1107/S1600536807052798","","","0.71073","MoKα","","0.097","0.0604","","","0.13","0.1727","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216007","13.193","0.001","8.453","0.0008","17.913","0.002","90","","98.211","0.002","90","","1977.2","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(μ-3,4:9,10:17,18:23,24-Tetrabenzo-1,12,15,26-tetraaza-5,8,19,22- tetraoxacyclooctacosane- κ^4^N^1^,N^26^:N^12^,N^15^)bis[aquadichloridocopper(II)]","","- C36 H48 Cl4 Cu2 N4 O6 -","- C36 H48 Cl4 Cu2 N4 O6 -","- C72 H96 Cl8 Cu4 N8 O12 -","2","0.5","HY2086","Zhi-Fang Jia; Jian-Fang Ma; Lai-Ping Zhang; Ting-Ting Han","(μ-3,4:9,10:17,18:23,24-Tetrabenzo-1,12,15,26-tetraaza-5,8,19,22-tetraoxacyclooctacosane-κ^4^<i>N</i>^1^,<i>N</i>^26^:<i>N</i>^12^,<i>N</i>^15^)bis[aquadichloridocopper(II)]","Acta Crystallographica Section E","2007","63","11","m2652","m2653","10.1107/S1600536807047678","","","0.71073","MoKα","","0.0958","0.048","","","0.1089","0.1422","","","","","","1.011","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216008","7.172","0.004","9.154","0.005","9.472","0.005","104.372","0.008","105.944","0.008","94.731","0.008","571.6","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","Isopropylaminium N-isopropyloxalamate monohydrate","Isopropylammonium (isopropylaamino)oxoacetate monohydrate","","- C8 H20 N2 O4 -","- C8 H20 N2 O4 -","- C16 H40 N4 O8 -","2","1","HY2088","Xia Sheng; Christoph E. Strasser; H. G. Raubenheimer; Robert C. Luckay","Isopropylammonium (isopropylamino)oxoacetate monohydrate","Acta Crystallographica Section E","2007","63","11","o4361","o4361","10.1107/S1600536807050374","","","0.71073","MoKα","","0.0494","0.0447","","","0.1034","0.106","","","","","","1.156","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216009","8.317","0.003","9.097","0.004","9.934","0.004","105.949","0.018","96.797","0.015","116.892","0.011","618.2","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis[μ-2-(3-pyridyl)-1H-benzimidazole-κ^2^N:N']disilver(I) dinitrate","","- C24 H18 Ag2 N8 O6 -","- C24 H18 Ag2 N8 O6 -","- C24 H18 Ag2 N8 O6 -","1","0.5","HY2089","Xia, Chang-Kun; Wu, Wen; Chen, Qiu-Yun; Xie, Ji-Min","Bis[μ-2-(3-pyridyl)-1<i>H</i>-benzimidazole-κ^2^<i>N</i>:<i>N</i>']disilver(I) dinitrate","Acta Crystallographica Section E","2007","63","11","m2820","m2820","10.1107/S1600536807052129","","","0.71073","MoKα","","0.0253","0.0235","","","0.0622","0.0632","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216010","13.405","0.004","13.154","0.005","20.019","0.006","90","","105.52","0.03","90","","3401","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(2-{1-[2-(2-hydroxyethylamino)ethylimino]propyl}phenolato)- 1κ^4^O,N,N',O';2κ^4^O,N,N',O'-methanol-2κO-μ-perchlorato-1:2κ^2^O:O'- perchlorato-1κO-dicopper(II)","","- C27 H42 Cl2 Cu2 N4 O13 -","- C27 H42 Cl2 Cu2 N4 O13.0004 -","- C108 H168 Cl8 Cu8 N16 O52.0016 -","4","1","IM2022","Butcher, Ray J.; Towns, William","Bis(2-{1-[2-(2-hydroxyethylamino)ethylimino]propyl}phenolato)-1κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>';2κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'-methanol-2κ<i>O</i>-μ-perchlorato-1:2κ^2^<i>O</i>:<i>O</i>'-perchlorato-1κ<i>O</i>-dicopper(II)","Acta Crystallographica Section E","2007","63","11","m2863","m2864","10.1107/S1600536807053500","","","0.71073","MoKα","","0.169","0.0828","","","0.1545","0.189","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216011","6.357","0.001","19.668","0.004","9.766","0.002","90","","90.11","0.03","90","","1221","0.4","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Aquabis(4-formylbenzoato)-κ^2^<i>O</i>,<i>O</i>';κ<i>O</i>- (1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)","","- C28 H20 Cd N2 O7 -","- C28 H20 Cd N2 O7 -","- C56 H40 Cd2 N4 O14 -","2","1","IM2036","Zhao-Peng Deng; Shan Gao; Li-Hua Huo; Hui Zhao","Aquabis(4-formylbenzoato)-κ^2^<i>O</i>,<i>O</i>';κ<i>O</i>-(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)","Acta Crystallographica Section E","2007","63","11","m2694","m2694","10.1107/S1600536807048787","","","0.71073","MoKα","","0.0277","0.0253","","","0.0617","0.0628","","","","","","1.051","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216012","7.861","0.002","8.502","0.002","9.537","0.002","80.72","0.03","73.9","0.03","70.09","0.03","574.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","5-Chloromethyl-3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazole","","- C11 H11 Cl N2 O3 -","- C11 H11 Cl N2 O3 -","- C22 H22 Cl2 N4 O6 -","2","1","IM2037","Wang, Pin-liang; Zeng, Hai-su; Wang, Hai-bo; Wu, Wen-yuan","5-Chloromethyl-3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazole","Acta Crystallographica Section E","2007","63","11","o4234","o4234","10.1107/S1600536807048064","","","0.71073","MoKα","","0.0859","0.0541","","","0.123","0.1732","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216013","6.661","0.001","9.251","0.002","10.328","0.002","65.765","0.002","82.438","0.002","74.637","0.002","559.41","0.18","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Bis[N-aminocarbonyl-N'-(3-pyridylmethylene-κN)hydrazine]diaquabis(thiocyanato- κN)zinc(II)","","- C16 H20 N10 O4 S2 Zn -","- C16 H20 N10 O4 S2 Zn -","- C16 H20 N10 O4 S2 Zn -","1","0.5","IM2038","Ji-Hua Deng; Gui-Quan Guo; Di-Chang Zhong","Bis[<i>N</i>-aminocarbonyl-<i>N</i>'-(3-pyridylmethylene-κ<i>N</i>)hydrazine]diaquabis(thiocyanato-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2007","63","11","m2696","m2697","10.1107/S1600536807048908","","","0.71073","MoKα","","0.0345","0.0316","","","0.0928","0.1071","","","","","","1.006","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216014","13.885","0.001","6.8246","0.0006","21.313","0.002","90","","98.63","0.005","90","","1996.7","0.3","293.5","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1,1,2-Trichloro-4,4-bis(4-methylphenylsulfanyl)-3-nitrobuta-1,3-diene","","- C18 H14 Cl3 N O2 S2 -","- C18 H14 Cl3 N O2 S2 -","- C72 H56 Cl12 N4 O8 S8 -","4","1","IM2039","Ibis, Cemil; Deniz, N. Gulsah","1,1,2-Trichloro-4,4-bis(4-methylphenylsulfanyl)-3-nitrobuta-1,3-diene","Acta Crystallographica Section E","2007","63","11","o4394","o4394","10.1107/S1600536807050957","","","0.7107","MoKα","","","0.036","","","","0.049","","","","","","1.119","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216015","5.857","0.001","27.104","0.005","9.026","0.002","90","","102.85","0.03","90","","1397","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2-{[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl}-5-methyl- 1,3,4-thiadiazole","","- C12 H9 Cl N4 O S2 -","- C12 H9 Cl N4 O S2 -","- C48 H36 Cl4 N16 O4 S8 -","4","1","IM2041","Wang, Pin-liang; Li, Hai-ling; Kang, Si-shun; Wang, Hai-bo","2-{[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl}-5-methyl-1,3,4-thiadiazole","Acta Crystallographica Section E","2007","63","11","o4411","o4411","10.1107/S160053680705177X","","","0.71073","MoKα","","0.0944","0.0566","","","0.1284","0.1585","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216016","8.4679","0.0019","8.713","0.002","20.147","0.005","90","","91.565","0.004","90","","1485.9","0.6","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Benzoyl)[2-(cyanoimino)-1,3-thiazolidin-2-yl]methyl acetate","","- C14 H13 N3 O3 S -","- C14 H13 N3 O3 S -","- C56 H52 N12 O12 S4 -","4","1","IS2211","Dai, Hong; Zhang, Xin; Liu, Jian-Bing; Yu, Hai-Bo; Fang, Jian-Xin","(Benzoyl)[2-(cyanoimino)-1,3-thiazolidin-2-yl]methyl acetate","Acta Crystallographica Section E","2007","63","11","o4211","o4211","10.1107/S1600536807047472","","","0.71073","MoKα","","0.0715","0.0429","","","0.101","0.1188","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216017","9.927","0.004","8.389","0.004","10.883","0.005","90","","112.66","0.008","90","","836.3","0.7","294","2","294","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(Z)-2-[2-(Cyanoimino)-1,3-thiazolidin-1-yl]-1,3-diphenylprop-2-en-1-one","","- C19 H15 N3 O S -","- C19 H15 N3 O S -","- C38 H30 N6 O2 S2 -","2","1","IS2212","Dai, Hong; Zhang, Xin; Qin, Xue; Qin, Zheng-Fang; Fang, Jian-Xin","(<i>Z</i>)-2-[2-(Cyanoimino)-1,3-thiazolidin-1-yl]-1,3-diphenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","11","o4283","o4283","10.1107/S1600536807048696","","","0.71073","MoKα","","0.0807","0.0438","","","0.0909","0.108","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216018","7.9148","0.0016","12.307","0.003","13.737","0.003","90","","105.49","0.03","90","","1289.5","0.5","297","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(2-Ethoxyphenyl)-1H-benzimidazole monohydrate","","- C15 H16 N2 O2 -","- C15 H16 N2 O2 -","- C60 H64 N8 O8 -","4","1","IS2213","Navarrete-Vázquez, Gabriel; Moreno-Diaz, Hermenegilda; Estrada-Soto, Samuel; Tlahuext, Hugo","2-(2-Ethoxyphenyl)-1<i>H</i>-benzimidazole monohydrate","Acta Crystallographica Section E","2007","63","11","o4208","o4208","10.1107/S1600536807047496","","","0.71073","MoKα","","0.0402","0.0372","","","0.0912","0.0932","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216019","8.9229","0.0005","14.091","0.0006","12.3493","0.0006","90","","92.93","0.004","90","","1550.68","0.13","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-Benzylidene-8-methoxy-6-(prop-2-enyl)chroman-4-one","","- C20 H18 O3 -","- C20 H18 O3 -","- C80 H72 O12 -","4","1","IS2214","R. Suresh; Charles C. Kanagam; P. R. Umarani; V. Manivannan; Büyükgüngör, Orhan","3-Benzylidene-8-methoxy-6-(prop-2-enyl)chroman-4-one","Acta Crystallographica Section E","2007","63","11","o4248","o4248","10.1107/S1600536807047915","","","0.71073","MoKα","","0.0576","0.0445","","","0.1222","0.1291","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216021","9.941","0.002","15.416","0.003","13.357","0.003","90","","90","","90","","2047","0.7","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Diaqua[N,N'-(o-phenylene)bis(pyridine-2-carboxamidato)- <i>κ</i>^4^<i>N</i>]manganese(III) perchlorate","","- C18 H16 Cl Mn N4 O8 -","- C18 H16 Cl Mn N4 O8 -","- C72 H64 Cl4 Mn4 N16 O32 -","4","0.5","IS2217","Zhang, Li-Fang","Diaqua[<i>N</i>,<i>N</i>'-(<i>o</i>-phenylene)bis(pyridine-2-carboxamidato)-<i>{κ</i>}^4^<i>N</i>]manganese(III) perchlorate","Acta Crystallographica Section E","2007","63","11","m2760","m2760","10.1107/S1600536807050453","","","0.71073","MoKα","","0.0463","0.0344","","","0.0782","0.0812","","","","","","1.017","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216022","12.3567","0.0006","11.2675","0.0005","20.4103","0.0012","90","","90","","90","","2841.7","0.3","150","2","150","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","2-Benzylidene-2,3-dihydro-1H-benzo[f]chromen-1-one","","- C20 H14 O2 -","- C20 H14 O2 -","- C160 H112 O16 -","8","2","IS2219","A. Marx; V. Manivannan; R. Suresh; Charles Christopher Kanagam; Büyükgüngör, Orhan","2-Benzylidene-2,3-dihydro-1<i>H</i>-benzo[<i>f</i>]chromen-1-one","Acta Crystallographica Section E","2007","63","11","o4383","o4383","10.1107/S1600536807050258","","","0.71073","MoKα","","0.05","0.0321","","","0.0584","0.0612","","","","","","0.943","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216023","9.8979","0.0008","10.3679","0.0009","10.9645","0.0009","113.537","0.001","107.679","0.001","100.167","0.001","923.97","0.13","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","3-Butyl-2-(piperidin-1-yl)-5,6,7,8-tetrahydrobenzothieno[2,3-d]pyrimidin- 4(3H)-one","","- C19 H27 N3 O S -","- C19 H27 N3 O S -","- C38 H54 N6 O2 S2 -","2","1","IS2220","Wang, Hong-Mei; Zeng, Xiao-Hua; Zheng, Ai-Hua; Tian, Jia-Hua; He, Ting-Yun","3-Butyl-2-(piperidin-1-yl)-5,6,7,8-tetrahydrobenzothieno[2,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4365","o4365","10.1107/S160053680705026X","","","0.71073","MoKα","","0.0909","0.0588","","","0.1499","0.1838","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216024","14.5605","0.0002","8.9142","0.0001","15.3963","0.0003","90","","94.316","0.001","90","","1992.7","0.05","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4,6,8-Tetramethyl-2-tosylpyrrolo[3,4-<i>c</i>]pyrano[6,5-<i>b</i>]pyrimidine- 7,9-dione","","- C20 H25 N3 O5 S -","- C20 H25 N3 O5 S -","- C80 H100 N12 O20 S4 -","4","1","IS2221","K. Chinnakali; M. Jayagopi; D. Sudha; R. Raghunathan; Hoong-Kun Fun","4,4,6,8-Tetramethyl-2-tosylpyrrolo[3,4-<i>c</i>]pyrano[6,5-<i>b</i>]pyrimidine-7,9-dione","Acta Crystallographica Section E","2007","63","11","o4363","o4363","10.1107/S1600536807050799","","","0.71073","MoKα","","0.0572","0.0421","","","0.1119","0.1279","","","","","","1.096","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216025","16.281","0.0002","8.4063","0.0001","16.003","0.0002","90","","93.4","0.001","90","","2186.36","0.05","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6,8-Dimethyl-4-phenyl-2-tosylpyrrolo[3,4-<i>c</i>]pyrano[6,5-<i>b</i>] pyrimidine-7,9-dione","","- C24 H25 N3 O5 S -","- C24 H25 N3 O5 S -","- C96 H100 N12 O20 S4 -","4","1","IS2222","K. Chinnakali; M. Jayagopi; D. Sudha; R. Raghunathan; Hoong-Kun Fun","6,8-Dimethyl-4-phenyl-2-tosylpyrrolo[3,4-<i>c</i>]pyrano[6,5-<i>b</i>]pyrimidine-7,9-dione","Acta Crystallographica Section E","2007","63","11","o4364","o4364","10.1107/S1600536807050805","","","0.71073","MoKα","","0.0656","0.0468","","","0.122","0.1377","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216026","19.724","0.003","5.6139","0.0011","9.0372","0.0018","90","","97.616","0.002","90","","991.8","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","<i>rac</i>-catena-Poly[nickel(II)-di-μ-tryptophanato]","<i>rac</i>-catena-Poly[nickel(II)-μ-[(R)-2-amino-3-(3-indolyl)propionato]- μ-[(S)-2-amino-3-(3-indolyl)propionato]]","","- C22 H22 N4 Ni O4 -","- C22 H22 N4 Ni O4 -","- C44 H44 N8 Ni2 O8 -","2","0.5","IS2224","Jian Wang; Xingyou Xu; Weixing Ma; Lude Lu; Xvjie Yang","<i>rac</i>-<i>catena</i>-Poly[nickel(II)-di-μ-tryptophanato]","Acta Crystallographica Section E","2007","63","11","m2867","m2868","10.1107/S1600536807053421","","","0.71073","MoKα","","0.0796","0.0534","","","0.1269","0.1451","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216027","17.3013","0.0007","8.3742","0.0004","12.3687","0.0005","90","","98.647","0.004","90","","1771.66","0.13","200","","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","piperidine derivative","<i>r</i>-2,<i>c</i>-6-Bis(4-chlorophenyl)-<i>t</i>-3-isopropylpiperidin-4-one","","- C20 H21 Cl2 N O -","- C20 H21 Cl2 N O -","- C80 H84 Cl8 N4 O4 -","4","1","IS2229","A. Thiruvalluvar; S. Balamurugan; R. J. Butcher; A. Manimekalai; S. Sivakumar","<i>r</i>-2,<i>c</i>-6-Bis(4-chlorophenyl)-<i>t</i>-3-isopropylpiperidin-4-one","Acta Crystallographica Section E","2007","63","11","o4482","o4482","10.1107/S160053680705341X","","","0.71073","MoKα","","0.0812","0.0563","","","0.1396","0.1586","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216028","5.0179","0.0004","17.3056","0.0015","11.5804","0.0009","90","","94.487","0.004","90","","1002.53","0.14","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-[(4-Nitrophenyl)aminocarbonyl]propanoic acid","","- C10 H10 N2 O5 -","- C10 H10 N2 O5 -","- C40 H40 N8 O20 -","4","1","KJ2061","Nigam P. Rath; H. J. Ravindra; M. R. Suresh Kumar; S. M. Dharmaprakash","3-[(4-Nitrophenyl)aminocarbonyl]propanoic acid","Acta Crystallographica Section E","2007","63","11","o4424","o4424","10.1107/S1600536807050325","","","0.71073","MoKα","","0.0411","0.035","","","0.0927","0.0973","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216029","11.9683","0.0005","15.7252","0.0006","8.9289","0.0003","90","","94.998","0.002","90","","1674.06","0.11","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(7-Dimethoxymethyl-4-oxo-3,4-dihydropteridin-2-yl)-2,2-dimethylpropionamide monohydrate","","- C14 H21 N5 O5 -","- C14 H21 N5 O5 -","- C56 H84 N20 O20 -","4","1","KJ2066","Hoong-Kun Fun; Shyamaprosad Goswami; Sibaprasad Maity; Annada C. Maity; Suchada Chantrapromma","<i>N</i>-(7-Dimethoxymethyl-4-oxo-3,4-dihydropteridin-2-yl)-2,2-dimethylpropionamide monohydrate","Acta Crystallographica Section E","2007","63","11","o4249","o4250","10.1107/S1600536807047940","","","0.71073","MoKα","","0.1206","0.0612","","","0.1366","0.1655","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216030","21.3691","0.0003","37.1989","0.0008","19.4382","0.0005","90","","120.368","0.001","90","","13331.5","0.5","150","2","","","","","","","","","","6","C 1 c 1","C -2yc","9","","Dichloridobis(triphenylphosphine oxide)cobalt(II) methanol solvate","","- C36.125 H30.5 Cl2 Co O2.125 P2 -","- C36.125 H30.5 Cl2 Co O2.125 P2 -","- C578 H488 Cl32 Co16 O34 P32 -","16","4","KJ2068","Lancaster, Richard; Pritchard, Robin G.","Dichloridobis(triphenylphosphine oxide)cobalt(II) methanol 0.125-solvate, a lamellar structure","Acta Crystallographica Section E","2007","63","11","m2783","m2784","10.1107/S1600536807050726","","","0.71073","MoKα","","","0.0594","","","","0.1328","","","","","","1.068","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216031","8.1821","0.0004","9.9884","0.0005","11.9142","0.0006","98.249","0.001","103.299","0.001","95.618","0.001","929.08","0.08","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","Dimethyl [(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-ylamino)phenylmethyl]phosphonate","","- C16 H21 N2 O5 P S -","- C16 H21 N2 O5 P S -","- C32 H42 N4 O10 P2 S2 -","2","1","KJ2070","Di-Fan Xu; Xiao-Kou Liu; Hong-Wu He","Dimethyl [(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-ylamino)phenylmethyl]phosphonate","Acta Crystallographica Section E","2007","63","11","o4392","o4392","10.1107/S1600536807051082","","","0.71073","MoKα","","0.0532","0.0449","","","0.1251","0.1358","","","","","","1.073","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216032","8.6392","0.0006","24.6618","0.0017","8.0637","0.0007","90","","103.665","0.007","90","","1669.4","0.2","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1-{4-[(<i>E</i>)-α-(9<i>H</i>-Carbazol-9-yl)styryl]}ethan-1-one","1-{4-[(<i>E</i>)-2-(9<i>H</i>-Carbazol-9-yl)ethenyl]phenyl}ethan-1-one","","- C22 H17 N O -","- C22 H17 N O -","- C88 H68 N4 O4 -","4","1","KP2134","Prukała, Wiesław; Marciniec, Bogdan; Kubicki, Maciej","1-{4-[(<i>E</i>)-2-(9<i>H</i>-Carbazol-9-yl)ethenyl]phenyl}ethan-1-one","Acta Crystallographica Section E","2007","63","11","o4255","o4255","10.1107/S1600536807045151","","","0.71073","MoKα","","0.0875","0.0417","","","0.0897","0.0951","","","","","","1.094","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216033","7.945","0.004","9.215","0.005","11.408","0.005","90","","107.17","0.04","90","","798","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","meso-2-Methyl-5-[2-(4-methylfuran-2-yl)-1,2-bis(prop-2-ynyloxy)ethyl]furan","","- C18 H18 O4 -","- C18 H18 O4 -","- C36 H36 O8 -","2","0.5","KP2137","Frey, Wolfgang; Wölfle, Michael; Hashmi, A. Stephen K.","<i>meso</i>-2-Methyl-5-[2-(4-methylfuran-2-yl)-1,2-bis(prop-2-ynyloxy)ethyl]furan","Acta Crystallographica Section E","2007","63","11","o4272","o4272","10.1107/S1600536807048106","","","0.71073","MoKα","","0.0558","0.0482","","","0.1223","0.1287","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216034","9.5157","0.0007","13.1417","0.0009","15.2884","0.0011","90","","90","","90","","1911.9","0.2","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","cis-(3-Hydroxycyclobutane-1,1-dicarboxylato-κ^2^O,O')bis(2-methylpyridine- κN)platinum(II)","","- C18 H20 N2 O5 Pt -","- C18 H20 N2 O5 Pt -","- C72 H80 N8 O20 Pt4 -","4","1","KP2138","Ming-Jin Xie; Yao Yu; Wei-Ping Liu; Shu-Qian Hou; Xizhu Chen","<i>cis</i>-(3-Hydroxycyclobutane-1,1-dicarboxylato-κ^2^<i>O</i>,<i>O</i>')bis(2-methylpyridine-κ<i>N</i>)platinum(II)","Acta Crystallographica Section E","2007","63","11","m2728","m2728","10.1107/S1600536807049513","","","0.71073","MoKα","","0.06","0.0529","","","0.1455","0.1505","","","","","","1.098","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216035","7.4512","0.0001","15.7995","0.0002","6.3015","0.0001","90","","99.93","0.003","90","","730.732","0.019","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","cis-bis(methylamine) dichlore platinum(II)","cis-dichloridobis(methylamine)platinum(II)","","- C2 H10 Cl2 N2 Pt -","- C2 H10 Cl2 N2 Pt -","- C8 H40 Cl8 N8 Pt4 -","4","1","LH2492","Kirik, Sergei D.; Starkov, Aleksandr K.","X-ray powder study of <i>cis</i>-dichloridobis(methylamine)platinum(II)","Acta Crystallographica Section E","2007","63","11","m2685","m2686","10.1107/S1600536807048428","","","1.5418","CuKα","","","","","","","","","","1.43","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2216036","10.3357","0.0011","13.1659","0.0014","22.894","0.003","90","","102.085","0.002","90","","3046.3","0.6","297","2","297","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","1,1'-Bis(diphenylphosphino)cobaltocenium tetrafluoridoborate","","- C34 H28 B Co F4 P2 -","- C34 H28 B Co F4 P2 -","- C136 H112 B4 Co4 F16 P8 -","4","0.5","LH2500","Jian-Guo Hou; Pu Zhang; Chen Ye; Tie-Gang Yu","1,1'-Bis(diphenylphosphino)cobaltocenium tetrafluoridoborate","Acta Crystallographica Section E","2007","63","11","m2730","m2730","10.1107/S1600536807048404","","","0.71073","MoKα","","0.0492","0.0445","","","0.121","0.1245","","","","","","1.081","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216037","6.8848","0.0003","8.3979","0.0003","26.9433","0.001","90","","90","","90","","1557.8","0.11","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(R)-Phenylethylaminium (R)-4-chloromandelate","(R)-phenylethylaminium (R)-2-(4-chlorophenyl)-2-hydroxyacetate,","","- C16 H18 Cl N O3 -","- C16 H18 Cl N O3 -","- C64 H72 Cl4 N4 O12 -","4","1","LH2509","He, Quan; Jennings, Michael C.; Rohani, Sohrab; Zhu, Jesse; Gomaa, Hassan","(<i>R</i>)-Phenylethylammonium (<i>R</i>)-4-chloromandelate","Acta Crystallographica Section E","2007","63","11","o4199","o4199","10.1107/S160053680704696X","","","0.71073","MoKα","","0.0609","0.0383","","","0.0844","0.0946","","","","","","1.027","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216038","8.597","0.002","12.986","0.003","10.335","0.003","90","","100.802","0.005","90","","1133.4","0.5","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(Acetylaminomethyl)-1-methylpyridinium iodide","","- C9 H13 I N2 O -","- C9 H13 I N2 O -","- C36 H52 I4 N8 O4 -","4","1","LH2511","Slawin, Alexandra M. Z.; Harrison, William T. A.","4-(Acetylaminomethyl)-1-methylpyridinium iodide","Acta Crystallographica Section E","2007","63","11","o4278","o4278","10.1107/S1600536807046090","","","0.71073","MoKα","","0.0203","0.0188","","","0.0464","0.0475","","","","","","1.044","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2216039","10.6163","0.0013","10.9054","0.0013","17.542","0.002","90","","90","","90","","2030.9","0.4","297","2","297","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(S)-1,1-Dimethyl-N-[(S)-1-phenyl-3-(phenylsulfonyl)but-3-enyl]ethane-2- sulfinamide","","- C20 H25 N O3 S2 -","- C20 H25 N O3 S2 -","- C80 H100 N4 O12 S8 -","4","1","LH2512","Dan Zhan; Zuo-An Xiao; Hua-Jun Liu; Xiao-Peng Shi","(<i>S</i>)-1,1-Dimethyl-<i>N</i>-[(<i>S</i>)-1-phenyl-3-(phenylsulfonyl)but-3-enyl]ethane-2-sulfinamide","Acta Crystallographica Section E","2007","63","11","o4221","o4221","10.1107/S160053680704737X","","","0.71073","MoKα","","0.1002","0.0639","","","0.1335","0.1602","","","","","","0.943","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216040","11.9747","0.001","9.5514","0.0008","18.883","0.0018","90","","98.125","0.005","90","","2138.1","0.3","150","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-Bis[5-(4-fluorophenyl)tetrazolato]bis(triphenylphosphine)platinum(II)","","- C50 H38 F2 N8 P2 Pt -","- C50 H38 F2 N8 P2 Pt -","- C100 H76 F4 N16 P4 Pt2 -","2","0.5","LH2513","Mukhopadhyay, Suman; Lasri, Jamal; Guedes da Silva, M. Fátima C.; Charmier, M. Adília J.; Pombeiro, Armando J.L.","<i>trans</i>-Bis[5-(4-fluorophenyl)tetrazolato]bis(triphenylphosphine)platinum(II)","Acta Crystallographica Section E","2007","63","11","m2656","m2656","10.1107/S1600536807047617","","","0.71069","MoKα","","","0.0197","","","","0.0468","","","","","","1.011","","","","has coordinates,has Fobs","278324","2022-10-03","14:41:54",""
"2216041","14.6116","0.0019","14.6116","0.0019","13.199","0.004","90","","90","","120","","2440.4","0.9","298","2","298","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","Tris(3,3'-diamino-2,2'-bipyridine)zinc(II) bis(nitrate)","","- C30 H30 N14 O6 Zn -","- C30 H30 N14 O6 Zn -","- C90 H90 N42 O18 Zn3 -","3","0.166667","LH2515","Wu, Chang-Ju; Chen, Ju-Na; Shi, Jing-Min","Tris(3,3'-diamino-2,2'-bipyridine)zinc(II) dinitrate","Acta Crystallographica Section E","2007","63","11","m2668","m2668","10.1107/S1600536807048192","","","0.71073","MoKα","","0.0422","0.0382","","","0.0798","0.0813","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216042","9.775","0.002","34.665","0.007","12.615","0.003","90","","90","","90","","4274.6","1.6","113","2","113","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","1-Bromo-4-nitro-2-(trifluoromethyl)benzene","","- C7 H3 Br F3 N O2 -","- C7 H3 Br F3 N O2 -","- C140 H60 Br20 F60 N20 O40 -","20","2.5","LH2517","Shang, Zhenhua; Yu, Yifeng","1-Bromo-4-nitro-2-(trifluoromethyl)benzene","Acta Crystallographica Section E","2007","63","11","o4266","o4266","10.1107/S1600536807048180","","","0.71073","MoKα","","0.0573","0.0479","","","0.0891","0.0927","","","","","","1.225","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216043","18.292","0.002","19.966","0.002","7.8479","0.0004","90","","90","","90","","2866.2","0.4","183","2","183","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","N-Phenyl-2-(phenyliminomethyl)pyrrole-1-carboxamide","","- C18 H15 N3 O -","- C18 H15 N3 O -","- C144 H120 N24 O8 -","8","1","LH2518","Imhof, Wolfgang","<i>N</i>-Phenyl-2-(phenyliminomethyl)pyrrole-1-carboxamide","Acta Crystallographica Section E","2007","63","11","o4265","o4265","10.1107/S1600536807048416","","","0.71073","MoKα","","0.1193","0.0414","","","0.0739","0.0823","","","","","","0.743","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216044","13.515","0.001","12.8743","0.001","15.2839","0.0009","90","","94.037","0.005","90","","2652.7","0.3","294","1","294","1","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","N-Ferrocenylmethyl-2-(3-methylstyryl)-N'-methylbenzimidazolium hexafluorophosphate","","- C28 H27 F6 Fe N2 P -","- C28 H27 F6 Fe N2 P -","- C112 H108 F24 Fe4 N8 P4 -","4","1","LH2519","Gallagher, John F.; Hanlon, Keith; Howarth, Joshua","<i>N</i>-Ferrocenylmethyl-2-(3-methylstyryl)-<i>N</i>'-methylbenzimidazolium hexafluorophosphate","Acta Crystallographica Section E","2007","63","11","m2649","m2649","10.1107/S1600536807047769","","","0.71073","MolybdenumKα","","0.0953","0.0466","","","0.0952","0.1128","","","","","","1.013","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216045","12.162","0.002","9.8259","0.0016","10.2461","0.0017","90","","104.857","0.002","90","","1183.5","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N'-[1-(2-Thienyl)ethylidene]pyridine-2-carbohydrazide","","- C12 H11 N3 O S -","- C12 H11 N3 O S -","- C48 H44 N12 O4 S4 -","4","1","LH2521","Guodong Yao; Shizhu Sun; Dacheng Li; Daqi Wang; Jianmin Dou","<i>N</i>'-[1-(2-Thienyl)ethylidene]pyridine-2-carbohydrazide","Acta Crystallographica Section E","2007","63","11","o4324","o4324","10.1107/S1600536807049811","","","0.71073","MoKα","","0.0664","0.0464","","","0.1327","0.1541","","","","","","1.009","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216046","10.6093","0.0007","17.6593","0.0012","14.0164","0.0008","90","","112.238","0.001","90","","2430.7","0.3","292","2","292","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2,2',2'',2'''-(3,6-Dioxaoctane-1,8-diyldinitrilo)tetrabenzimidazolium tetrakis(perchlorate) dihydrate","","- C38 H48 Cl4 N10 O20 -","- C38 H48 Cl4 N10 O20 -","- C76 H96 Cl8 N20 O40 -","2","1","LH2522","Zhou, Chun-Shan; Pei, Ya-Mei; Meng, Xiang-Gao","2,2',2'',2'''-(3,6-Dioxaoctane-1,8-diyldinitrilo)tetrabenzimidazolium tetrakis(perchlorate) dihydrate","Acta Crystallographica Section E","2007","63","11","o4334","o4335","10.1107/S160053680704980X","","","0.71073","Mokα","","0.1358","0.0778","","","0.1879","0.2249","","","","","","0.878","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216047","9.6147","0.0018","10.027","0.002","13.503","0.003","68.355","0.004","75.939","0.004","88.494","0.004","1170.8","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","N-Benzylpropan-2-aminium (benzylisopropylamido)(2,2,2-trifluoroacetamido)phosphate","","- C22 H31 F3 N3 O3 P -","- C22 H31 F3 N3 O3 P -","- C44 H62 F6 N6 O6 P2 -","2","1","LH2523","Mohammad Yazdanbakhsh; Fahimeh Sabbaghi","<i>N</i>-Benzylpropan-2-aminium (benzylisopropylamido)(2,2,2-trifluoroacetamido)phosphate","Acta Crystallographica Section E","2007","63","11","o4318","o4318","10.1107/S1600536807049586","","","0.71073","MoKα","","0.145","0.054","","","0.082","0.1028","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216048","7.4838","0.0002","7.1954","0.0002","14.3623","0.0004","90","","90","","90","","773.39","0.04","295","2","295","2","","","","","","","","6","C m c m","-C 2c 2","63","","<i>catena</i>-Poly[[silver(I)-μ-pyrazine-κ^2^<i>N</i>:<i>N</i>'] perchlorate]","","- C4 H4 Ag Cl N2 O4 -","- C4 H4 Ag Cl N2 O4 -","- C16 H16 Ag4 Cl4 N8 O16 -","4","0.25","LH2524","Song, Wen-Dong; Gu, Chang-Sheng; Yan, Jian-Bin; Ng, Seik Weng","<i>catena</i>-Poly[[silver(I)-μ-pyrazine-κ^2^<i>N</i>:<i>N</i>'] perchlorate]","Acta Crystallographica Section E","2007","63","11","m2701","m2701","10.1107/S1600536807048969","","","0.71073","MoKα","","0.0245","0.0211","","","0.0487","0.0517","","","","","","1.08","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216049","7.162","0.004","16.298","0.009","13.721","0.006","90","","103.26","0.02","90","","1558.9","1.4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","catena-Poly[[[aquasilver(I)]-μ-2,3-dimethylpyrazine-κ^2^N:N'] 4-amino-2,5-dichlorobenzenesulfonate]","","- C12 H14 Ag Cl2 N3 O4 S -","- C12 H14 Ag Cl2 N3 O4 S -","- C48 H56 Ag4 Cl8 N12 O16 S4 -","4","1","LH2525","Hai-Yan Liu; Ji-Cheng Ma; Jin Yang","<i>catena</i>-Poly[[[aquasilver(I)]-μ-2,3-dimethylpyrazine-κ^2^<i>N</i>:<i>N</i>'] 4-amino-2,5-dichlorobenzenesulfonate]","Acta Crystallographica Section E","2007","63","11","m2734","m2735","10.1107/S160053680704977X","","","0.71069","MoKα","","0.0815","0.0739","","","0.1907","0.1936","","","","","","1.144","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216050","9.6613","0.0011","10.9314","0.0008","19.7129","0.0015","90","","92.194","0.008","90","","2080.4","0.3","294","1","294","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(3,5-Dimethylbenzene)-1-ferrocenylmethyl-1H-1,3-benzimidazole","","- C26 H24 Fe N2 -","- C26 H24 Fe N2 -","- C104 H96 Fe4 N8 -","4","1","LH2528","Gallagher, John F.; Hanlon, Keith; Howarth, Joshua","2-(3,5-Dimethylbenzene)-1-ferrocenylmethyl-1<i>H</i>-1,3-benzimidazole","Acta Crystallographica Section E","2007","63","11","m2746","m2746","10.1107/S1600536807049549","","","0.71073","MolybdenumKα","","0.0488","0.0369","","","0.0925","0.0989","","","","","","1.04","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216051","14.359","0.001","16.809","0.001","16.78","0.001","90","","90","","90","","4050","0.4","293","2","291","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Bis[1,3-bis(1<i>H</i>-benzimidazol-2-yl)benzene-κN^3^]bis(nitrato- κ^2^<i>O</i>,<i>O</i>')cadmium(II) dihydrate","","- C40 H32 Cd N10 O8 -","- C40 H32 Cd N10 O8 -","- C160 H128 Cd4 N40 O32 -","4","0.5","LH2532","Meng, Fa-Yan; Zhang, Yi-Ming; Ng, Seik Weng","Bis[1,3-bis(1<i>H</i>-benzimidazol-2-yl)benzene-κ<i>N</i>^3^]bis(nitrato-κ^2^<i>O</i>,<i>O</i>')cadmium(II) dihydrate","Acta Crystallographica Section E","2007","63","11","m2752","m2752","10.1107/S1600536807050210","","","0.71073","MoKα","","0.0461","0.0354","","","0.1017","0.1114","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216052","15.0142","0.0004","5.2871","0.0001","20.2489","0.0006","90","","101.735","0.003","90","","1573.79","0.07","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Carbamazepine trifluoroacetic acid solvate","5<i>H</i>-dibenzo[b,f]azepine-5-carboxamide trifluoroacetic acid solvate","","- C17 H13 F3 N2 O3 -","- C17 H13 F3 N2 O3 -","- C68 H52 F12 N8 O12 -","4","1","LW2031","Fernandes, Philippe; Bardin, Julie; Johnston, Andrea; Florence, Alastair J.; Leech, Charlotte K.; David, William I. F.; Shankland, Kenneth","Carbamazepine trifluoroacetic acid solvate","Acta Crystallographica Section E","2007","63","11","o4269","o4269","10.1107/S1600536807045333","","","0.71073","MoKα","","0.0589","0.0386","","","0.0937","0.1018","","","","","","1.089","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216053","10.2291","0.0014","11.3075","0.0015","11.384","0.0015","91.451","0.002","96.411","0.002","108.696","0.002","1236.8","0.3","297","2","297","2","","","","","","","","6","P -1","-P 1","2","","Hydrogen bis(tetraphenylimidodiphospinic acid) triiodide","","- C48 H43 I3 N2 O4 P4 -","- C48 H43 I3 N2 O4 P4 -","- C48 H43 I3 N2 O4 P4 -","1","0.5","LW2032","Copolovici, Lucian; Varga, Richard A.; Lippolis, Vito; Silvestru, Cristian","Hydrogen bis(tetraphenylimidodiphospinic acid) triiodide","Acta Crystallographica Section E","2007","63","11","o4206","o4207","10.1107/S1600536807047198","","","0.71073","MoKα","","0.0645","0.0533","","","0.1152","0.1205","","","","","","1.116","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216054","11.2175","0.0003","7.3323","0.0002","17.7651","0.0004","90","","90.776","0.002","90","","1461.05","0.06","120","","120","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-amino-4,6-dimethoxy pyrimidine phthalic acid","2-amino-4,6-dimethoxypyrimidine‒phthalic acid (1/1)","","- C14 H15 N3 O6 -","- C14 H15 N3 O6 -","- C56 H60 N12 O24 -","4","1","LW2035","Kaliyaperumal Thanigaimani; Packianathan Thomas Muthiah; Daniel E. Lynch","Hydrogen-bonding patterns in 2-amino-4,6-dimethoxypyrimidine‒phthalic acid (1/1)","Acta Crystallographica Section E","2007","63","11","o4212","o4212","10.1107/S1600536807047447","","","0.71073","MoKα","","0.0522","0.0413","","","0.1071","0.1144","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216055","35.939","0.007","5.654","0.0011","13.714","0.003","90","","92.55","0.03","90","","2783.9","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-Methyl-5-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-ylmethylenesulfanyl]-1,3,4- thiadiazole","","- C12 H9 N5 O3 S2 -","- C12 H9 N5 O3 S2 -","- C96 H72 N40 O24 S16 -","8","1","LW2036","Wang, Pin-Liang; Kang, Si-Shun; Li, Hai-Ling; Zeng, Hai-Su; Wang, Hai-Bo","2-Methyl-5-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-ylmethylenesulfanyl]-1,3,4-thiadiazole","Acta Crystallographica Section E","2007","63","11","o4236","o4236","10.1107/S1600536807047812","","","0.71073","MoKα","","0.0913","0.0635","","","0.1709","0.212","","","","","","1.102","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216056","32.926","0.003","4.5564","0.0002","17.7214","0.0016","90","","108.465","0.007","90","","2521.8","0.4","296","","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(<i>E</i>)-4-Bromo-2-(2-methoxyphenyliminomethyl)phenol","","- C14 H12 Br N O2 -","- C14 H12 Br N O2 -","- C112 H96 Br8 N8 O16 -","8","1","LW2037","Gül, Zarife Sibel; Erşahin, Ferda; Ağar, Erbil; Işık, Şamil","(<i>E</i>)-4-Bromo-2-(2-methoxyphenyliminomethyl)phenol","Acta Crystallographica Section E","2007","63","11","o4241","o4241","10.1107/S1600536807047824","","","0.71073","MoKα","","0.0564","0.0321","","","0.0703","0.0779","","","","","","0.977","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216057","7.9802","0.0004","9.1652","0.0004","11.6042","0.0004","103.104","0.003","91.737","0.003","106.648","0.003","787.84","0.06","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","2-(4-Bromophenyl)-5,7-dimethyl-3-methylsulfinyl-1-benzofuran","","- C17 H15 Br O2 S -","- C17 H15 Br O2 S -","- C34 H30 Br2 O4 S2 -","2","1","LW2038","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","2-(4-Bromophenyl)-5,7-dimethyl-3-methylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2007","63","11","o4282","o4282","10.1107/S1600536807048672","","","0.71073","MoKα","","0.0736","0.055","","","0.1576","0.1684","","","","","","1.131","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216058","12.365","0.003","15.956","0.003","8.24","0.0016","90","","108.26","0.03","90","","1543.9","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Methyl-5-{3-[4-(methylsulfonyl)phenyl]-1,2,4-oxadiazol-5-ylmethylsulfanyl}- 1,3,4-thiadiazole","","- C13 H12 N4 O3 S3 -","- C13 H12 N4 O3 S3 -","- C52 H48 N16 O12 S12 -","4","1","LW2039","Wang, Pin-Liang; Zeng, Hai-Shu; Kang, Si-Shun; Li, Hai-Ling; Wang, Hai-Bo","2-Methyl-5-{3-[4-(methylsulfonyl)phenyl]-1,2,4-oxadiazol-5-ylmethylsulfanyl}-1,3,4-thiadiazole","Acta Crystallographica Section E","2007","63","11","o4356","o4356","10.1107/S1600536807050313","","","0.71073","MoKα","","0.0668","0.051","","","0.1277","0.1376","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216059","13.749","0.006","13.817","0.006","14.771","0.007","90","","90","","90","","2806","2","294","2","294","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","Bis(2-hydroxybenzonitrile-κN)dimethylbis(trimethylphosphine-κP)cobalt(III) iodide","","- C22 H34 Co I N2 O2 P2 -","- C22 H34 Co I N2 O2 P2 -","- C88 H136 Co4 I4 N8 O8 P8 -","4","0.5","LX2017","Yu, Fengli; Zhou, Jin; Li, Xiaoyan","Bis(2-hydroxybenzonitrile-κ<i>N</i>)dimethylbis(trimethylphosphine-κ<i>P</i>)cobalt(III) iodide","Acta Crystallographica Section E","2007","63","11","m2787","m2787","10.1107/S1600536807051690","","","0.71073","MoKα","","0.0962","0.0389","","","0.0796","0.1015","","","","","","0.987","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216060","24.54","0.006","5.98","0.001","16.387","0.004","90","","122.933","0.002","90","","2018.3","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Methyl 5-phenyl-1<i>H</i>-pyrazole-3-carboxylate","","- C11 H10 N2 O2 -","- C11 H10 N2 O2 -","- C88 H80 N16 O16 -","8","1","LX2019","Zhou, Guanghua; An, Yue; Han, Jing; Ge, Maofa; Xing, Yongheng","Methyl 5-phenyl-1<i>H</i>-pyrazole-3-carboxylate","Acta Crystallographica Section E","2007","63","11","o4474","o4474","10.1107/S1600536807052452","","","0.71073","MoKα","","0.0616","0.0436","","","0.1079","0.1197","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216061","6.5858","0.0005","7.1397","0.0005","19.996","0.001","90","","94.78","0.001","90","","936.95","0.11","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(<i>S</i>)-O-[4-(2,2,4-Trimethylchroman-4-yl)phenyl] N,N-dimethylthiocarbamate","","- C21 H25 N O2 S -","- C21 H25 N O2 S -","- C42 H50 N2 O4 S2 -","2","1","LX2021","Jacobs, Tia; Bredenkamp, Martin W.","(<i>S</i>)-<i>O</i>-[4-(2,2,4-Trimethylchroman-4-yl)phenyl] <i>N</i>,<i>N</i>-dimethylthiocarbamate","Acta Crystallographica Section E","2007","63","11","o4444","o4444","10.1107/S160053680705249X","","","0.71073","MoKα","","0.0423","0.0415","","","0.1077","0.109","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216062","18.205","0.003","18.205","0.003","7.371","0.002","90","","90","","90","","2442.9","0.9","293","2","293","2","","","","","","","","5","P 42 b c","P 4c -2ab","106","","catena-Poly[1-ethyl-4-methylpyridinium [argentate(I)-di-μ-iodido]]","","- C8 H12 Ag I2 N -","- C8 H12 Ag I2 N -","- C64 H96 Ag8 I16 N8 -","8","1","LX2023","Wang, Yun Jie; Li, Hao Hong; Chen, Zhi Rong; Huang, Chang Cang; Liu, Ji Bo","<i>catena</i>-Poly[1-ethyl-4-methylpyridinium [argentate(I)-di-μ-iodido]]","Acta Crystallographica Section E","2007","63","11","m2846","m2847","10.1107/S1600536807052269","","","0.71073","MoKα","","0.0454","0.0362","","","0.092","0.0964","","","","","","1.119","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216063","9.569","0.0007","9.7554","0.0007","10.5083","0.0007","78.757","0.001","73.902","0.001","83.115","0.002","922.14","0.11","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","N-Benzyl-2-propanaminium O-methyl trichloroacetamidophosphate","","- C13 H20 Cl3 N2 O4 P -","- C13 H20 Cl3 N2 O4 P -","- C26 H40 Cl6 N4 O8 P2 -","2","1","LX2024","Pourayoubi, Mehrdad; Sabbaghi, Fahimeh","<i>N</i>-Benzyl-2-propanaminium <i>O</i>-methyl trichloroacetamidophosphate","Acta Crystallographica Section E","2007","63","11","o4366","o4366","10.1107/S1600536807050428","","","0.71073","MoKα","","0.0417","0.0316","","","0.0704","0.0758","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216064","8.61","0.005","9.871","0.006","18.892","0.012","90","","90","","90","","1605.6","1.7","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","catena-Poly[[[aquacopper(II)]-μ-2-(hydroxyphosphonato)acetato] dihydrate]","","- C2 H9 Cu O9 P -","- C2 H9 Cu O9 P -","- C16 H72 Cu8 O72 P8 -","8","1","NC2059","Jing Li; Dapeng Dong; Yanyu Zhu; Zhengang Sun; Hui Chen","<i>catena</i>-Poly[[[aquacopper(II)]-μ-2-(hydroxyphosphonato)acetato] dihydrate]","Acta Crystallographica Section E","2007","63","11","m2646","m2647","10.1107/S1600536807047332","","","0.71073","MoKα","","0.0639","0.0348","","","0.0724","0.0839","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216065","8.6689","0.0017","9.6727","0.0019","10.142","0.002","73.41","0.03","81.41","0.03","86.48","0.03","805.7","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","1-Ethyl-6-fluoro-7-(4-formylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline- 3-carboxylic acid","","- C17 H18 F N3 O4 -","- C17 H18 F N3 O4 -","- C34 H36 F2 N6 O8 -","2","1","NC2060","Lou, Benyong; Boström, Dan; Velaga, Sitaram P.","1-Ethyl-6-fluoro-7-(4-formylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid","Acta Crystallographica Section E","2007","63","11","o4281","o4281","10.1107/S1600536807048726","","","0.71073","MoKα","","0.0566","0.0429","","","0.1116","0.1225","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216066","8.3233","0.0006","9.2393","0.0007","15.9107","0.0012","79.969","0.004","88.82","0.004","86.311","0.004","1202.3","0.16","297","2","297","2","","","","","","","","4","P -1","-P 1","2","","6''-Methoxy-1'-methyl-4'-phenylacenaphthene-1-spiro-2'-pyrrolidine-3'- spiro-3''-chroman-2,4''-dione","","- C31 H25 N O4 -","- C31 H25 N O4 -","- C62 H50 N2 O8 -","2","1","NC2063","Augustine, T.; Ramkumar, V.; Arul Antony, S.; Charles. C. Kanakam","6''-Methoxy-1'-methyl-4'-phenylacenaphthene-1-spiro-2'-pyrrolidine-3'-spiro-3''-chroman-2,4''-dione","Acta Crystallographica Section E","2007","63","11","o4412","o4412","10.1107/S1600536807051264","","","0.71073","MoKα","","0.0869","0.0551","","","0.1335","0.1601","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216067","7.1857","0.0012","10.7376","0.0018","14.881","0.002","110.811","0.002","90.608","0.003","100.504","0.003","1051.7","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis[benzyl(methyl)ammonium] tetrathiomolybdate(VI)","","- C16 H24 Mo N2 S4 -","- C16 H24 Mo N2 S4 -","- C32 H48 Mo2 N4 S8 -","2","1","NC2064","Srinivasan, Bikshandarkoil R.; Girkar, Siddhali V.; Raghavaiah, Pallepogu","Bis[benzyl(methyl)ammonium] tetrathiomolybdate(VI)","Acta Crystallographica Section E","2007","63","11","m2737","m2738","10.1107/S1600536807049562","","","0.71073","MoKα","","0.0639","0.0499","","","0.0951","0.1","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216068","16.585","0.006","11.584","0.006","7.391","0.003","90","","90","","90","","1420","1.1","295","","295","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","<i>trans</i>-1,4-Diphenyl-1,4-diphosphacyclohexane","","- C16 H18 P2 -","- C16 H18 P2 -","- C64 H72 P8 -","4","0.5","NG2331","Michael L. Williams; Samuel P.C. Dunstan; Peter C. Healy","<i>trans</i>-1,4-Diphenyl-1,4-diphosphacyclohexane","Acta Crystallographica Section E","2007","63","11","o4258","o4258","10.1107/S1600536807048507","","","0.71069","MoKα","","0.0718","0.0424","","","0.1163","0.1324","","","","","","1.041","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216069","9.435","0.004","9.628","0.004","12.698","0.006","90","","90","","90","","1153.5","0.9","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","<i>tert</i>-Butyl N-(3,6-dihydro-1,2-dioxin-4-ylmethyl)carbamate","","- C10 H17 N O4 -","- C10 H17 N O4 -","- C40 H68 N4 O16 -","4","1","NG2332","Sejer Pedersen, Daniel; Taylor, Dennis K.; Tiekink, Edward R. T.","<i>tert</i>-Butyl <i>N</i>-(3,6-dihydro-1,2-dioxin-4-ylmethyl)carbamate","Acta Crystallographica Section E","2007","63","11","o4301","o4301","10.1107/S1600536807049252","","","0.7107","MoKα","","0.039","0.038","","","0.099","0.1","","","","","","1.07","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216070","7.9245","0.0002","21.7051","0.0005","22.8134","0.0005","90","","90","","90","","3923.95","0.16","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Poly[tris(μ-di-4-pyridylamine-κ^2^N:N')tetrathiocyanato-κ^4^Ndicobalt(II)]","","- C34 H27 Co2 N13 S4 -","- C34 H27 Co2 N13 S4 -","- C136 H108 Co8 N52 S16 -","4","1","NG2333","Knapp, Warren R.; Martin, David P.; LaDuca, Robert L.","Poly[tris(μ-di-4-pyridylamine-κ^2^<i>N</i>:<i>N</i>')tetrathiocyanato-κ^4^<i>N</i>-dicobalt(II)]","Acta Crystallographica Section E","2007","63","11","m2745","m2745","10.1107/S160053680705057X","","","0.71073","MoKα","","0.1772","0.0662","","","0.1266","0.1682","","","","","","0.996","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216071","7.597","0.005","8.651","0.007","10.715","0.007","69.9","0.03","69.75","0.02","83.58","0.02","620.4","0.8","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","<i>trans</i>-Tetraaquabis(2,6-dimethylpyridinium-3,5-dicarboxylato- κ<i>O</i>)cobalt(II) tetrahydrate","","- C18 H32 Co N2 O16 -","- C18 H32 Co N2 O16 -","- C18 H32 Co N2 O16 -","1","0.5","NG2335","Gao, Jin-Sheng; Zhang, Yi-Ming; Li, Bai-Yan; Hou, Guang-Feng","<i>trans</i>-Tetraaquabis(2,6-dimethylpyridinium-3,5-dicarboxylato-κ<i>O</i>)cobalt(II) tetrahydrate","Acta Crystallographica Section E","2007","63","11","m2717","m2717","10.1107/S1600536807049161","","","0.71073","MoKα","","0.0308","0.0285","","","0.0925","0.0998","","","","","","1.214","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216072","9.9075","0.0003","17.5746","0.0005","12.2212","0.0004","90","","96.714","0.001","90","","2113.37","0.11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(4-Flouroanilino)tropone","","- C13 H10 F N O -","- C13 H10 F N O -","- C104 H80 F8 N8 O8 -","8","2","NG2336","Steyl, Gideon","2-(4-Flouroanilino)tropone","Acta Crystallographica Section E","2007","63","11","o4353","o4353","10.1107/S1600536807050271","","","0.71073","MoKα","","0.039","0.0324","","","0.0768","0.0834","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216073","21.214","0.004","10.506","0.002","19.775","0.004","90","","120.02","0.03","90","","3816.1","1.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[[(1,10-phenanthroline)cadmium(II)]- μ~3~-2-(4-carboxylatophenoxy)propionato]","","- C22 H16 Cd N2 O5 -","- C22 H16 Cd N2 O5 -","- C176 H128 Cd8 N16 O40 -","8","1","NG2338","Li-Li Kong; Shan Gao; Li-Hua Huo","Poly[[(1,10-phenanthroline)cadmium(II)]-μ~3~-2-(4-carboxylatophenoxy)propionato]","Acta Crystallographica Section E","2007","63","11","m2759","m2759","10.1107/S1600536807050350","","","0.71073","MoKα","","0.0543","0.039","","","0.0767","0.0825","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216074","18.3436","0.0016","12.9426","0.0011","20.5064","0.0017","90","","95.957","0.002","90","","4842.2","0.7","297","2","297","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis[2-(dimethylaminomethyl)phenyl]-1κC,2κC,3κC,4κC- hexa-μ-sulfido-1:2κ^4^S:S;1,4κ^2^S:S;2:3κ^2^S:S;3:4κ^4^S:S- tetratin(IV) chloroform solvate","","- C37 H49 Cl3 N4 S6 Sn4 -","- C37 H49 Cl3 N4 S6 Sn4 -","- C148 H196 Cl12 N16 S24 Sn16 -","4","1","NG2339","Varga, Richard A.; Silvestru, Cristian","Tetrakis[2-(dimethylaminomethyl)phenyl]-1κ<i>C</i>,2κ<i>C</i>,3κ<i>C</i>,4κ<i>C</i>-hexa-μ-sulfido-1:2κ^4^<i>S</i>:<i>S</i>;1,4κ^2^<i>S</i>:<i>S</i>;2:3κ^2^<i>S</i>:<i>S</i>;3:4κ^4^<i>S</i>:<i>S</i>-tetratin(IV) chloroform solvate","Acta Crystallographica Section E","2007","63","11","m2789","m2789","10.1107/S1600536807051501","","","0.71073","MoKα","","0.0508","0.0449","","","0.0827","0.0847","","","","","","1.249","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216075","23.878","0.005","6.3586","0.0013","17.048","0.003","90","","106.1","0.03","90","","2486.9","0.9","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(2,2'-bipyridine-κ^2^N,N')bis(4-formylbenzoato-κ^2^O,O')cadmium(II) monohydrate","","- C26 H22 Cd N2 O8 -","- C26 H22 Cd N2 O8 -","- C104 H88 Cd4 N8 O32 -","4","1","NG2340","Zhao-Peng Deng; Shan Gao; Li-Hua Huo; Hui Zhao","Aqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(4-formylbenzoato-κ^2^<i>O</i>,<i>O</i>')cadmium(II) monohydrate","Acta Crystallographica Section E","2007","63","11","m2799","m2799","10.1107/S160053680705115X","","","0.71073","MoKα","","0.036","0.0284","","","0.0631","0.0658","","","","","","1.081","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216076","7.4463","0.0015","8.8","0.0018","30.843","0.006","90","","90.01","0.03","90","","2021.1","0.7","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Triaquabis(4-formylbenzoato-κ^2^<i>O</i>,<i>O</i>')cadmium(II) trihydrate","","- C16 H22 Cd O12 -","- C16 H22 Cd O12 -","- C64 H88 Cd4 O48 -","4","1","NG2342","Zhao-Peng Deng; Shan Gao; Li-Hua Huo; Hui Zhao","Triaquabis(4-formylbenzoato-κ^2^<i>O</i>,<i>O</i>')cadmium(II) trihydrate","Acta Crystallographica Section E","2007","63","11","m2818","m2818","10.1107/S1600536807052014","","","0.71073","MoKα","","0.0254","0.0218","","","0.0533","0.055","","","","","","1.098","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216077","9.4682","0.0005","12.7534","0.0006","18.4602","0.0009","90","","90","","90","","2229.1","0.19","100","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(Acetylacetonato-κ^2^<i>O</i>,<i>O</i>')carbonyl(cyclohexyldiphenylphosphine- κP)rhodium(I)","","- C24 H28 O3 P Rh -","- C24 H28 O3 P Rh -","- C96 H112 O12 P4 Rh4 -","4","1","NG2345","Brink, Alice; Roodt, Andreas; Visser, Hendrik G.","(Acetylacetonato-κ^2^<i>O</i>,<i>O</i>')carbonyl(cyclohexyldiphenylphosphine-κ<i>P</i>)rhodium(I)","Acta Crystallographica Section E","2007","63","11","m2831","m2832","10.1107/S1600536807052427","","","0.71073","MoKα","","","0.0241","","","","0.061","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216078","7.7856","0.0016","11.956","0.002","18.509","0.004","90","","94.84","0.03","90","","1716.8","0.6","295","2","295","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","2,2'-[m-Phenylenebis(methyleneimino)]dipyridinium dichloridobis(4-formylbenzoato-κ^2^<i>O</i>,<i>O</i>')cadmate(II) dihydrate","","- C34 H34 Cd Cl2 N4 O8 -","- C34 H34 Cd Cl2 N4 O8 -","- C68 H68 Cd2 Cl4 N8 O16 -","2","0.5","NG2347","Zhao-Peng Deng; Shan Gao; Li-Hua Huo; Hui Zhao","2,2'-[<i>m</i>-Phenylenebis(methyleneimino)]dipyridinium dichloridobis(4-formylbenzoato-κ^2^<i>O</i>,<i>O</i>')cadmate(II) dihydrate","Acta Crystallographica Section E","2007","63","11","m2834","m2834","10.1107/S1600536807052439","","","0.71073","MoKα","","0.0871","0.0412","","","0.0655","0.098","","","","","","1.097","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216079","13.6082","0.0005","14.597","0.0005","16.3293","0.0006","114.948","0.002","98.898","0.002","107.951","0.002","2641.04","0.19","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","[N,N'-bis(2,6-dimethylphenyl)pentane-2,4-diiminato-κ^2^N,N']\ trichlorido(tetrahydrofuran-κO)zirconium","","- C25 H33 Cl3 N2 O Zr -","- C25 H33 Cl3 N2 O Zr -","- C100 H132 Cl12 N8 O4 Zr4 -","4","2","OM2160","Fortuné, Rose-Verla; Verguet, Emilie; Oguadinma, Paul O.; Schaper, Frank","[<i>N</i>,<i>N</i>'-Bis(2,6-dimethylphenyl)pentane-2,4-diiminato-κ^2^<i>N</i>,<i>N</i>']trichlorido(tetrahydrofuran-κ<i>O</i>)zirconium","Acta Crystallographica Section E","2007","63","11","m2822","m2822","10.1107/S160053680704322X","","","1.54178","CuKα","","0.0326","0.0311","","","0.0863","0.0877","","","","","","0.993","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216080","16.968","0.006","16.968","0.006","5.8668","0.0017","90","","90","","90","","1689.1","1","103","2","103","2","","","","","","","","4","P 42/n :2","-P 4bc","86","diferrocenylethene","<i>trans</i>-1,2-Diferrocenyl-1,2-difluoroethene","","- C22 H18 F2 Fe2 -","- C22 H18 F2 Fe2 -","- C88 H72 F8 Fe8 -","4","0.5","OM2164","Noriyoshi Nagahora; Akihiro Yuasa; Takahiro Sasamori; Norihiro Tokitoh","<i>trans</i>-1,2-Diferrocenyl-1,2-difluoroethene","Acta Crystallographica Section E","2007","63","11","m2702","m2702","10.1107/S1600536807048842","","","0.7107","MoKα","","0.0407","0.0349","","","0.0652","0.0672","","","","","","1.216","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216081","15.146","0.003","9.146","0.0018","26.18","0.005","90","","90","","90","","3626.6","1.2","297","2","297","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","r-2,c-6-Bis(4-bromophenyl)-t-3,t-5-dimethyltetrahydropyran-4-one","","- C19 H18 Br2 O2 -","- C19 H18 Br2 O2 -","- C152 H144 Br16 O16 -","8","1","OM2166","P. Parthiban; S. Umamatheswari; Adinarayana Doddi; V. Ramkumar; S. Kabilan","<i>r</i>-2,<i>c</i>-6-Bis(4-bromophenyl)-<i>t</i>-3,<i>t</i>-5-dimethyltetrahydropyran-4-one","Acta Crystallographica Section E","2007","63","11","o4373","o4373","10.1107/S1600536807050660","","","0.71073","MoKα","","0.096","0.0436","","","0.078","0.0939","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216082","16.4011","0.0003","7.1786","0.0001","14.2586","0.0002","90","","90","","90","","1678.76","0.05","100","2","100","2","","","","","","","","5","I m a 2","I 2 -2a","46","","Poly[propane-1,3-diammonium [diaqua(μ~4~-4-benzene-1,2,4,5-tetracarboxylato)cobaltate(II)] hemihydrate]","","- C13 H19 Co N2 O10.5 -","- C13 H19 Co N2 O10.5 -","- C52 H76 Co4 N8 O42 -","4","0.5","OM2167","Aghabozorg, Hossein; Attar Gharamaleki, Jafar; Motyeian, Elham; Ghadermazi, Mohammad","Poly[propane-1,3-diammonium [diaqua(μ~4~-4-benzene-1,2,4,5-tetracarboxylato)cobaltate(II)] hemihydrate]","Acta Crystallographica Section E","2007","63","11","m2793","m2794","10.1107/S1600536807050659","","","0.71073","MoKα","","0.0224","0.0219","","","0.0655","0.066","","","","","","0.997","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216083","6.1511","0.001","11.4414","0.0018","13.593","0.002","90","","90","","90","","956.6","0.3","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","6-(N-Methyl)-2-bromonaphthalene","6-Bromo-<i>N</i>-methylnaphthalen-2-amine","","- C11 H10 Br N -","- C11 H10 Br N -","- C44 H40 Br4 N4 -","4","1","OM2168","Garon, Christian N.; Milliard, Alex; Fontaine, Frédéric-Georges","6-Bromo-<i>N</i>-methylnaphthalen-2-amine","Acta Crystallographica Section E","2007","63","11","o4338","o4338","10.1107/S1600536807049951","","","0.71073","MoKα","","0.0265","0.0234","","","0.0583","0.0593","","","","","","1.078","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216084","15.307","0.004","13.48","0.003","12.263","0.003","90","","102.56","0.03","90","","2469.8","1.1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","9-(2-tert-Butylphenoxycarbonyl)-10-methylacridinium trifluoromethanesulfonate","","- C26 H24 F3 N O5 S -","- C26 H24 F3 N O5 S -","- C104 H96 F12 N4 O20 S4 -","4","1","OM2169","Artur Sikorski; Karol Krzymiński; Piotr Malecha; Tadeusz Lis; Jerzy Błażejowski","9-(2-<i>tert</i>-Butylphenoxycarbonyl)-10-methylacridinium trifluoromethanesulfonate","Acta Crystallographica Section E","2007","63","11","o4484","o4485","10.1107/S1600536807052002","","","0.71073","MoKα","","0.0912","0.0468","","","0.0908","0.1018","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216085","10.538","0.002","10.883","0.002","11.628","0.002","74.27","0.03","63.15","0.03","81.66","0.03","1144.8","0.5","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","3-(tert-Butyliminomethyl)-1,1'-binaphthol ethanol solvate","","- C27 H29 N O3 -","- C27 H29 N O3 -","- C54 H58 N2 O6 -","2","1","PK2049","Xiao-Yan Ma; Lin-Zhi Zhong; Wei Wu; Kun Wang; Rui-Xiang Li","3-(<i>tert</i>-Butyliminomethyl)-1,1'-binaphthol ethanol solvate","Acta Crystallographica Section E","2007","63","11","o4288","o4288","10.1107/S1600536807047435","","","0.71073","MoKα","","0.202","0.06","","","0.107","0.128","","","","","","1.006","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216086","13.421","0.0002","9.1096","0.0002","23.8185","0.0004","90","","99.5191","0.0006","90","","2871.95","0.09","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(μ-1<i>H</i>-benzimidazole-5,6-dicarboxylato)bis[tetraaquadicobalt(II)] pentahydrate","","- C18 H34 Co2 N4 O21 -","- C18 H32.68 Co2 N4 O21 -","- C72 H130.72 Co8 N16 O84 -","4","1","PK2050","Lo, Yu-Lin; Wang, Wen-Chieh; Lee, Gon-Ann; Liu, Yen-Hsiang","Bis(μ-1<i>H</i>-benzimidazole-5,6-dicarboxylato)bis[tetraaquadicobalt(II)] pentahydrate","Acta Crystallographica Section E","2007","63","11","m2657","m2658","10.1107/S1600536807048088","","","0.71073","MoKα","","","0.0397","","","","0.103","","","","","","1.097","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216087","16.8286","0.001","26.1041","0.0015","17.6845","0.001","90","","92.813","0.001","90","","7759.4","0.8","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[5,10,15,20-Tetrakis(2,6-dimethoxyphenyl)porphyrinato]nickel(II)‒toluene‒ dichloromethane (3/2/4)","","- C58 H52 Cl2.67 N4 Ni O8 -","- C58 H52 Cl2.66667 N4 Ni O8 -","- C348 H312 Cl16 N24 Ni6 O48 -","6","1.5","PK2051","Diane Conrad; Jennifer DeCoskey; Christopher Yeisley; Matthias Zeller; Allen D. Hunter; Edward P. Zovinka","[5,10,15,20-Tetrakis(2,6-dimethoxyphenyl)porphyrinato]nickel(II)‒toluene‒dichloromethane (3/2/4):a mixed solvate","Acta Crystallographica Section E","2007","63","11","m2824","m2824","10.1107/S1600536807051872","","","0.71073","MoKα","","0.0574","0.0479","","","0.113","0.117","","","","","","1.074","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216088","11.3975","0.0009","14.8905","0.0012","17.0136","0.0014","90","","90","","90","","2887.5","0.4","173","2","173","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","<i>catena</i>-Poly[[bis(thiocyanato-κ<i>N</i>)cobalt(II)]-μ- di-4-pyridylamine-κ^2^<i>N</i>:<i>N'</i>]","","- C12 H9 Co N5 S2 -","- C12 H9 Co N5 S2 -","- C96 H72 Co8 N40 S16 -","8","1","PK2052","Springsteen, Caleb H.; LaDuca, Robert L.","<i>catena</i>-Poly[[bis(thiocyanato-κ<i>N</i>)cobalt(II)]-μ-di-4-pyridylamine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","11","m2705","m2705","10.1107/S1600536807049276","","","0.71073","MoKα","","0.1132","0.0638","","","0.1104","0.1253","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216089","3.7963","0.0003","7.776","0.0007","22.483","0.0014","93.444","0.003","94.338","0.003","92.322","0.004","659.92","0.09","95","1","","","","","","","","","","5","P -1","-P 1","2","","Quinoxaline‒chloranilic acid (1/1)","","- C14 H8 Cl2 N2 O4 -","- C14 H8 Cl2 N2 O4 -","- C28 H16 Cl4 N4 O8 -","2","1","PK2054","Gotoh, Kazuma; Nagoshi, Hirokazu; Ishida, Hiroyuki","Quinoxaline‒chloranilic acid (1/1)","Acta Crystallographica Section E","2007","63","11","o4295","o4295","10.1107/S1600536807049483","","","0.71075","MoKα","","0.0628","0.044","","","0.097","0.1022","","","","","","1.002","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216090","10.3029","0.0014","4.7411","0.0005","17.288","0.002","90","","90","","90","","844.47","0.18","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","ammonium lead iodide","","- H4 I3 N Pb -","- H4 I3 N Pb -","- H16 I12 N4 Pb4 -","4","0.5","PK2055","Fan, Le-Qing; Wu, Ji-Huai","NH~4~PbI~3~","Acta Crystallographica Section E","2007","63","11","i189","i189","10.1107/S1600536807050581","","","0.71073","MoKα","","0.0364","0.0333","","","0.0808","0.0827","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216091","7.5156","0.0015","16.161","0.003","17.654","0.004","90","","90","","90","","2144.2","0.8","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","(N,N'-Bis(3-(salicylideneamino)propyl)ethane-1,2-diamine)iron(III) chloride","[2,2'-(2,6,9,13-Tetraazatetradeca-1,13-diene-1,14-diyl)diphenolato]iron(III) chloride","","- C22 H28 Cl Fe N4 O2 -","- C22 H28 Cl Fe N4 O2 -","- C88 H112 Cl4 Fe4 N16 O8 -","4","0.5","PR2016","Butcher, Ray J.; Pourian, Mohamad; Jasinski, Jerry P.","[2,2'-(2,6,9,13-Tetraazatetradeca-1,13-diene-1,14-diyl)diphenolato]iron(III) chloride","Acta Crystallographica Section E","2007","63","11","m2742","m2743","10.1107/S1600536807049999","","","0.71073","MoKα","","0.0803","0.0402","","","0.0944","0.1142","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216092","14.2816","0.0004","8.3056","0.0002","25.0612","0.0007","90","","90","","90","","2972.69","0.14","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(1E,4E)-1,5-Bis(2-chlorophenyl)penta-1,4-dien-3-one","","- C17 H12 Cl2 O -","- C17 H12 Cl2 O -","- C136 H96 Cl16 O8 -","8","1","PV2035","M. NizamMohideen; S. Thenmozhi; A. SubbiahPandi; Ramalingam Murugan; S. Sriman Narayanan","(1<i>E</i>,4<i>E</i>)-1,5-Bis(2-chlorophenyl)penta-1,4-dien-3-one","Acta Crystallographica Section E","2007","63","11","o4379","o4379","10.1107/S1600536807050696","","","0.71073","MoKα","","0.1037","0.0494","","","0.1314","0.1638","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216093","9.0139","0.0013","21.663","0.003","7.8198","0.0011","90","","93.653","0.005","90","","1523.9","0.4","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Hydroxy-3,5-dimethoxybenzaldehyde isonicotinoylhydrazone monohydrate","","- C15 H17 N3 O5 -","- C15 H17 N3 O5 -","- C60 H68 N12 O20 -","4","1","PV2036","Yi-Feng Sun; Xin-Li Wang; Ji-Kun Li; Xue-Li Cheng; Ren-Tao Wu","4-Hydroxy-3,5-dimethoxybenzaldehyde isonicotinoylhydrazone monohydrate","Acta Crystallographica Section E","2007","63","11","o4467","o4467","10.1107/S1600536807052683","","","0.71073","MoKα","","0.0498","0.0419","","","0.104","0.1121","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216094","5.015","0.0005","11.4093","0.001","16.1736","0.0014","90","","90","","90","","925.42","0.15","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-Bromo-5-methoxybenzohydrazide","","- C8 H9 Br N2 O2 -","- C8 H9 Br N2 O2 -","- C32 H36 Br4 N8 O8 -","4","1","PV2037","Sarojini, B. K.; Mustafa, K.; Narayana, B.; Yathirajan, H. S.; Bolte, Michael","2-Bromo-5-methoxybenzohydrazide","Acta Crystallographica Section E","2007","63","11","o4419","o4419","10.1107/S1600536807051367","","","0.71073","MoKα","","0.0496","0.0463","","","0.1139","0.116","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216095","5.6112","0.0005","13.1253","0.0012","14.8985","0.0013","101.314","0.008","96.944","0.007","92.41","0.007","1065.6","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Aqua(nitrato-κ^2^O,O')bis(4-nitrobenzohydrazide-κ^2^N^2^,O)cadmium(II) nitrate","","- C14 H16 Cd N8 O13 -","- C14 H16 Cd N8 O13 -","- C28 H32 Cd2 N16 O26 -","2","1","PV2039","Chundak, S. Yu.; Lukachinec, L. Yu.; Daszkiewicz, M.","Aqua(nitrato-κ^2^<i>O</i>,<i>O</i>')bis(4-nitrobenzohydrazide-κ^2^<i>N</i>^2^,<i>O</i>)cadmium(II) nitrate","Acta Crystallographica Section E","2007","63","11","m2815","m2816","10.1107/S1600536807051914","","","0.71073","MoKα","","0.034","0.0257","","","0.0503","0.0524","","","","","","0.973","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216096","23.202","0.008","8.289","0.002","22.27","0.007","90","","103.996","0.014","90","","4156","2","298","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Ornidazole hemihydrate","","- C7 H11 Cl N3 O3.5 -","- C7 H11 Cl N3 O3.5 -","- C112 H176 Cl16 N48 O56 -","16","2","RK2037","Deng, Liping; Wang, Wei; Lv, Jianguo","Ornidazole hemihydrate","Acta Crystallographica Section E","2007","63","11","o4204","o4204","10.1107/S1600536807045680","","","0.71075","MoKα","","","0.0447","","","","0.1456","","","","","","1.005","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216097","7.544","0.003","8.974","0.002","9.291","0.003","107.509","0.007","97.844","0.006","100.735","0.007","576.8","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","(3E)-5-Hydroxy-3-[5-(hydroxymethyl)furan-2-ylmethylene]-1-benzofuran-2(3H)-one","","- C14 H10 O5 -","- C14 H10 O5 -","- C28 H20 O10 -","2","1","RK2041","Ma, Hong-Yan; Shi, Ji; Wang, Chang-Hong; Wang, Zheng-Tao","(3<i>E</i>)-5-Hydroxy-3-[5-(hydroxymethyl)furan-2-ylmethylene]-1-benzofuran-2(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4354","o4354","10.1107/S1600536807047381","","","0.71073","MoKα","","0.0827","0.0641","","","0.1524","0.1638","","","","","","0.968","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216099","9.355","0.0006","9.3562","0.0004","13.3177","0.0007","83.362","0.004","72.448","0.005","65.563","0.004","1011.77","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","{Bis[2-(3,5-dimethylpyrazol-1-yl)ethyl]amine- κ^2^<i>N</i>,<i>N</i>'}dichloridozinc(II) methanol solvate","","- C15 H27 Cl2 N5 O Zn -","- C15 H27 Cl2 N5 O Zn -","- C30 H54 Cl4 N10 O2 Zn2 -","2","1","RK2043","Lee, Rae Eun; Park, Yeon Do; Jeong, Jong Hwa","{Bis[2-(3,5-dimethylpyrazol-1-yl)ethyl]amine-κ^2^<i>N</i>,<i>N</i>'}dichloridozinc(II) methanol solvate","Acta Crystallographica Section E","2007","63","11","m2679","m2679","10.1107/S1600536807048179","","","0.71069","MoKα","","0.0356","0.0277","","","0.0795","0.0815","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216100","10.369","0.009","9.809","0.006","12.792","0.008","90","","90","","90","","1301.1","1.6","293","2","","","","","","","","","","6","P b c n","-P 2n 2ab","60","","Diiodidobis(thioacetamide-κS)cadmium(II)","","- C4 H10 Cd I2 N2 S2 -","- C4 H10 Cd I2 N2 S2 -","- C16 H40 Cd4 I8 N8 S8 -","4","0.5","RK2044","Ilia A. Zamilatskov; Evgeny A. Buravlev; Elena V. Savinkina; Natalya S. Roukk; Dmitry V. Albov","Diiodidobis(thioacetamide-κ<i>S</i>)cadmium(II)","Acta Crystallographica Section E","2007","63","11","m2669","m2669","10.1107/S1600536807044820","","","0.71073","MoKα","","","0.0292","","","","0.0546","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216101","7.9553","0.0017","9.5504","0.0019","10.003","0.002","84.042","0.016","86.787","0.017","83.798","0.017","750.7","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","(2,2'-Bipyridine-κ^2^N,N')dichlorido(dimethyl sulfoxide-κO)zinc(II)","","- C12 H14 Cl2 N2 O S Zn -","- C12 H14 Cl2 N2 O S Zn -","- C24 H28 Cl4 N4 O2 S2 Zn2 -","2","1","RK2047","Marjani, Katayoun; Mousavi, Mohsen; Khavasi, Hamid Reza; Ansari, Maryam; Qumi, Hamid Reza","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')dichlorido(dimethyl sulfoxide-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2007","63","11","m2645","m2645","10.1107/S1600536807047320","","","0.71073","MoKα","","0.0311","0.0301","","","0.0788","0.0795","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216102","9.084","0.004","9.5","0.005","10.495","0.007","69.28","0.05","75.47","0.05","83.76","0.04","819.8","0.8","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","<i>N</i>-(2-Iodophenylmethyl)hexamethylenetetraminium bromide dihydrate","","- C13 H22 Br I N4 O2 -","- C13 H22 Br I N4 O2 -","- C26 H44 Br2 I2 N8 O4 -","2","1","RK2048","Betz, Richard; Klüfers, Peter","<i>N</i>-(2-Iodophenylmethyl)hexamethylenetetraminium bromide dihydrate","Acta Crystallographica Section E","2007","63","11","o4279","o4279","10.1107/S1600536807048623","","","0.71073","MoKα","","0.0398","0.0262","","","0.0562","0.0612","","","","","","0.952","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216103","6.303","0.002","7.774","0.002","17.466","0.005","88.15","0.03","88.99","0.04","86.62","0.04","853.8","0.4","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","(3SR,2'SR)-3-(2'-Anilino-2'-phenylethyl)phtalide","","- C22 H19 N O2 -","- C22 H19 N O2 -","- C44 H38 N2 O4 -","2","1","RK2049","Laghrib, Naoual; Azrour, Mohamed; Daran, Jean-Claude; Fihia Rachid; Majidia Lhou","(3<i>SR</i>,2'<i>SR</i>)-3-(2'-Anilino-2'-phenylethyl)phthalide","Acta Crystallographica Section E","2007","63","11","o4333","o4333","10.1107/S1600536807050039","","","0.71073","MoKα","","0.0709","0.0373","","","0.0754","0.0829","","","","","","0.81","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216104","18.9118","0.0008","6.937","0.0003","13.4509","0.0005","90","","90","","90","","1764.64","0.13","295","2","295","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","4,4'-Dimethyl-2,2'-[1,1'-(ethane-1,2-diyldinitrilo)diethylidyne]diphenol","","- C20 H24 N2 O2 -","- C20 H24 N2 O2 -","- C80 H96 N8 O8 -","4","0.5","RK2050","G. Chakkaravarthi; A. Anthonysamy; S. Balasubramanian; V. Manivannan","4,4'-Dimethyl-2,2'-[1,1'-(ethane-1,2-diyldinitrilo)diethylidyne]diphenol","Acta Crystallographica Section E","2007","63","11","o4475","o4475","10.1107/S1600536807052622","","","0.71073","MoKα","","0.0703","0.0485","","","0.1387","0.1573","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216105","21.3198","0.0005","6.1626","0.0002","8.6023","0.0003","90","","90","","90","","1130.22","0.06","200","2","200","2","","","","","","","","3","P n a 21","P 2c -2n","33","1-(Ylomethyl)cyclopentyl 1',2'-phenylene orthocarbonate","1,4,6,13-Tetraoxa-2,3-benzodispiro[4.1.4.2]tridecane cyclopentanespiro-4'-(1,3-dioxolane)-2'-spiro-2''-1,3-benzodioxole]","","- C13 H14 O4 -","- C13 H14 O4 -","- C52 H56 O16 -","4","1","RN2032","Betz, Richard; Klüfers, Peter","1-(Ylomethyl)cyclopentyl 1',2'-phenylene orthocarbonate","Acta Crystallographica Section E","2007","63","11","o4300","o4300","10.1107/S1600536807049434","","","0.71073","MoKα","","0.0418","0.0359","","","0.0882","0.0927","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216106","12.685","0.003","7.045","0.0014","17.501","0.004","90","","106.57","0.03","90","","1499","0.6","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Diaquabis{2,4-dibromo-6-[2- (isopropylammonio)ethyliminomethyl]phenolato}nickel(II) dichloride hemihydrate","","- C24 H37 Br4 Cl2 N4 Ni O4.5 -","- C24 H37 Br4 Cl2 N4 Ni O4.5 -","- C48 H74 Br8 Cl4 N8 Ni2 O9 -","2","0.5","RZ2166","Chun-Bao Tang","Diaquabis{2,4-dibromo-6-[2-(isopropylammonio)ethyliminomethyl]phenolato}nickel(II) dichloride hemihydrate","Acta Crystallographica Section E","2007","63","11","m2785","m2786","10.1107/S1600536807051513","","","0.71073","MoKα","","0.0981","0.0501","","","0.1075","0.1264","","","","","","1.007","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216107","8.6384","0.0018","17.701","0.004","20.619","0.004","90","","90","","90","","3152.8","1.1","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Bis[μ-(2-carboxylatoethyl)phosphonato]bis[aqua(2,2'-bipyridine)cobalt(II)]","","- C26 H30 Co2 N4 O12 P2 -","- C26 H30 Co2 N4 O12 P2 -","- C104 H120 Co8 N16 O48 P8 -","4","0.5","RZ2168","Shao-Ming Ying; Yun Chen; Jun-Yue Lin; Guang-Pei Zhou; Jian-Hong Wu","Bis[μ-(2-carboxylatoethyl)phosphonato]bis[aqua(2,2'-bipyridine)cobalt(II)]","Acta Crystallographica Section E","2007","63","11","m2862","m2862","10.1107/S1600536807052592","","","0.71073","MoKα","","0.0521","0.0289","","","0.0668","0.0696","","","","","","0.781","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216108","6.5047","0.0016","19.194","0.005","5.619","0.0013","90","","110.078","0.005","90","","658.9","0.3","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Thymine hydrogen peroxide 0.55-solvate 0.45-hydrate","","- C5 H8 N2 O3.55 -","- C5 H8 N2 O3.55 -","- C20 H32 N8 O14.2 -","4","1","RZ2169","Churakov, Andrei V.; Howard, Judith A. K.","Thymine hydrogen peroxide 0.55-solvate 0.45-hydrate","Acta Crystallographica Section E","2007","63","11","o4483","o4483","10.1107/S1600536807053585","","","0.71073","MoKα","","0.0804","0.0449","","","0.0975","0.1076","","","","","","1.016","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216109","17.76","0.002","17.76","0.002","17.76","0.002","90","","90","","90","","5601.8","1.1","295","2","295","2","","","","","","","","5","F -4 3 c","F -4a 2 3","219","","tetra-μ~4~-fluorido-dodecamethyltetrapotassiumtetragallium","","- C12 H36 F4 Ga4 K4 -","- C12 H36 F4 Ga4 K4 -","- C96 H288 F32 Ga32 K32 -","8","0.0833333","SF3049","Harald Krautscheid; Oliver Kluge","(KF)~4~·4GaMe~3~","Acta Crystallographica Section E","2007","63","11","m2690","m2690","10.1107/S1600536807048453","","","0.71073","MoKα","","0.0181","0.0137","","","0.0338","0.035","","","","","","1.096","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216110","13.985","0.004","15.054","0.004","7.976","0.002","90","","90","","90","","1679.2","0.8","298","2","298","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","(2,2-Bipyridyl N,N'-dioxide-κ^2^O,O')trichloridobis(methanol-κO)terbium(III)","","- C12 H16 Cl3 N2 O4 Tb -","- C12 H16 Cl3 N2 O4 Tb -","- C48 H64 Cl12 N8 O16 Tb4 -","4","0.5","SG2182","Liu, Yin-Qiu; Zeng, Xi-Rui; Lei, Liang-Ping","(2,2-Bipyridyl <i>N</i>,<i>N</i>'-dioxide-κ^2^<i>O</i>,<i>O</i>')trichloridobis(methanol-κ<i>O</i>)terbium(III)","Acta Crystallographica Section E","2007","63","11","m2693","m2693","10.1107/S1600536807033910","","","0.71073","MoKα","","0.0502","0.0391","","","0.072","0.0731","","","","","","0.975","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216111","11.9859","0.0007","25.1527","0.0016","13.8358","0.0009","90","","98.647","0.001","90","","4123.8","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(1<i>H</i>-Benzotriazol-1-yl)-1-(4-fluorobenzoyl)ethyl 2,4-dichlorobenzoate","","- C22 H14 Cl2 F N3 O3 -","- C22 H14 Cl2 F N3 O3 -","- C176 H112 Cl16 F8 N24 O24 -","8","2","SG2192","Sai Bi; Jing Li; Wu-Lan Zeng; Jun Wan","2-(1<i>H</i>-Benzotriazol-1-yl)-1-(4-fluorobenzoyl)ethyl 2,4-dichlorobenzoate","Acta Crystallographica Section E","2007","63","11","o4192","o4192","10.1107/S1600536807047046","","","0.71073","MoKα","","0.1147","0.0602","","","0.1263","0.1506","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216112","9.997","0.002","4.896","0.001","24.729","0.005","90","","94.24","0.03","90","","1207.1","0.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Methoxy-6-[(4-methylpyridin-2-ylimino)methyl]phenol","","- C14 H14 N2 O2 -","- C14 H14 N2 O2 -","- C56 H56 N8 O8 -","4","1","SG2194","He-Bing Li","2-Methoxy-6-[(4-methylpyridin-2-yl)iminomethyl]phenol","Acta Crystallographica Section E","2007","63","11","o4246","o4246","10.1107/S1600536807048350","","","0.71073","MoKα","","0.1153","0.0596","","","0.1327","0.1592","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216113","6.3126","0.0002","11.2823","0.0004","22.8044","0.0007","90","","90","","90","","1624.14","0.09","100","0.1","100","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","<i>ent</i>-Kaur-16-en-19-al","<i>ent</i>-Kaur-16-en-19-al","","- C20 H30 O -","- C20 H30 O -","- C80 H120 O4 -","4","1","SI2036","Suchada Chantrapromma; Abdul Wahab Salae; Hoong-Kun Fun; Chanita Ponglimanont","<i>ent</i>-Kaur-16-en-19-al","Acta Crystallographica Section E","2007","63","11","o4329","o4329","10.1107/S1600536807049823","","","0.71073","MoKα","","0.0378","0.0354","","","0.0949","0.0967","","","","","","1.072","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216114","10.218","0.001","25.199","0.004","19.621","0.001","90","","102.06","0.005","90","","4940.6","1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(<i>OC</i>-6-13)-Bis(acetone)dihydridobis(tricyclohexylphosphine)iridium(III) tetrafluoridoborate acetone solvate","","- C45 H86 B F4 Ir O3 P2 -","- C45 H86 B F4 Ir O3 P2 -","- C180 H344 B4 F16 Ir4 O12 P8 -","4","1","SI2038","Dahlenburg, Lutz; Menzel, Ralf; Heinemann, Frank W.","(<i>OC</i>-6-13)-Bis(acetone)dihydridobis(tricyclohexylphosphine)iridium(III) tetrafluoridoborate acetone solvate","Acta Crystallographica Section E","2007","63","11","m2769","m2770","10.1107/S1600536807050970","","","0.71073","MoKα","","0.0399","0.024","","","0.0398","0.0433","","","","","","1.039","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216115","10.266","0.0016","11.2985","0.0018","14.522","0.002","90","","97.923","0.003","90","","1668.3","0.4","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","cis-1,3,12,5b,5c,6-hexahydro-<i>2H,5H</i>-1a,2a,4a,5a- tetraimidazo[4,5-d]imidazole-2,5<i>(1H,3H)</i>-dione","15a,15b-Dihydro-5H,7H,9H,14H,17H-15,16-methanodibenzo[e]diazepino\ [2,3-c;3',2'-e]imidazole-7,18-dione","","- C20 H18 N4 O2 -","- C20 H18 N4 O2 -","- C80 H72 N16 O8 -","4","1","SI2040","Yan Hu; Bao-han Zhou; Li-ping Cao","15a,15b-Dihydro-5<i>H</i>,7<i>H</i>,9<i>H</i>,14<i>H</i>,17<i>H</i>-15,16-methanodibenzo[<i>e</i>]diazepino[2,3-<i>c</i>;3',2'-<i>e</i>]imidazole-7,18-dione","Acta Crystallographica Section E","2007","63","11","o4480","o4480","10.1107/S1600536807053378","","","0.71073","MoKα","","0.1046","0.0532","","","0.1123","0.1274","","","","","","0.982","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216116","19.6407","0.0019","12.969","0.0012","9.8195","0.0009","90","","90","","90","","2501.2","0.4","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","<i>catena</i>-Poly[(2,9-dimethyl-1,10-phenanthroline-κ^2^N,N')lead(II)]- di-μ-2-hydroxybenzoato-κ^3^O^1^,O^1'^:O^2^;κ^3^O^2^:O^1^,O^1'^]","","- C28 H22 N2 O6 Pb -","- C28 H22 N2 O6 Pb -","- C112 H88 N8 O24 Pb4 -","4","0.5","SJ2340","Xuan, Xiao-Peng; Zhao, Pei-Zheng","<i>catena</i>-Poly[[(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')lead(II)]-di-μ-2-hydroxybenzoato-κ^3^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^2^;κ^3^<i>O</i>^2^:<i>O</i>^1^,<i>O</i>^1'^]","Acta Crystallographica Section E","2007","63","11","m2678","m2678","10.1107/S1600536807045941","","","0.71073","MoKα","","0.0316","0.0181","","","0.0392","0.0441","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216117","12.807","0.003","11.362","0.002","15.297","0.003","90","","97.912","0.004","90","","2204.7","0.8","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3,3'-Diethyl-1,1'-(ethane-1,2-diyl)dibenzimidazolium dibromide dihydrate","","- C20 H28 Br2 N4 O2 -","- C20 H28 Br2 N4 O2 -","- C80 H112 Br8 N16 O8 -","4","0.5","SJ2352","Xiu-Mei Wu; Qing-Xiang Liu; Xiu-Guang Wang; Hai-Bin Song; Zhan-Ying Zheng","3,3'-Diethyl-1,1'-(ethane-1,2-diyl)dibenzimidazolium dibromide dihydrate","Acta Crystallographica Section E","2007","63","11","o4263","o4263","10.1107/S160053680704367X","","","0.71073","MoKα","","0.0315","0.0258","","","0.0673","0.0696","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216118","9.4373","0.0019","9.55","0.0019","16.175","0.003","81.27","0.03","76.03","0.03","72.82","0.03","1346.5","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-Propylquinolinium triiodidocuprate(I)","","- C24 H28 Cu I3 N2 -","- C24 H28 Cu I3 N2 -","- C48 H56 Cu2 I6 N4 -","2","1","SJ2354","Wang, Yun Jie; Li, Hao Hong; Chen, Zhi Rong; Huang, Chang Cang; Liu, Ji Bo","1-Propylquinolinium triiodidocuprate(I)","Acta Crystallographica Section E","2007","63","11","m2736","m2736","10.1107/S1600536807049136","","","0.71073","MoKα","","0.0698","0.0429","","","0.1234","0.1487","","","","","","0.867","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216119","5.8174","0.0006","9.115","0.0012","15.0897","0.0017","93.167","0.009","97.233","0.01","96.592","0.01","786.55","0.16","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","6-Methylbenzo[d]thiazol-2-amine","","- C8 H8 N2 S -","- C8 H8 N2 S -","- C32 H32 N8 S4 -","4","2","SJ2362","Saeed, Aamer; Rafique, Hummera; Bolte, Michael","6-Methylbenzo[<i>d</i>]thiazol-2-amine","Acta Crystallographica Section E","2007","63","11","o4247","o4247","10.1107/S1600536807046958","","","0.71073","MoKα","","0.0357","0.0322","","","0.0825","0.0844","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216120","12.469","0.006","7.56","0.003","14.382","0.009","90","","97.347","0.011","90","","1344.6","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","bis(creatininium) sulfate","bis(creatininium) sulfate","","- C8 H16 N6 O6 S -","- C8 H16 N6 O6 S -","- C32 H64 N24 O24 S4 -","4","1","SJ2364","S. Asath Bahadur; M. Rajalakshmi; Shunmuganarayanan Athimoolam; R. Sayee Kannan; V. Ramakrishnan","Chain and ring motifs in bis(creatininium) sulfate","Acta Crystallographica Section E","2007","63","11","o4195","o4195","10.1107/S1600536807046119","","","0.71069","MoKα","","0.0366","0.0306","","","0.0814","0.0854","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216121","12.7385","0.0002","15.6542","0.0003","16.7194","0.0003","90","","90","","90","","3334.03","0.1","113","2","113","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","[1,2-Bis(diphenylphosphino)ethane]diiodidoplatinum(II) dichloromethane disolvate","","- C28 H28 Cl4 I2 P2 Pt -","- C28 H28 Cl4 I2 P2 Pt -","- C112 H112 Cl16 I8 P8 Pt4 -","4","0.5","SJ2365","Akella Sivaramakrishna; Hong Su; John R. Moss","[1,2-Bis(diphenylphosphino)ethane]diiodidoplatinum(II) dichloromethane disolvate","Acta Crystallographica Section E","2007","63","11","m2648","m2648","10.1107/S1600536807046636","","","0.71073","MoKα","","0.0446","0.029","","","0.0621","0.0677","","","","","","1.116","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216122","22.6458","0.0013","7.2018","0.0003","21.326","0.0012","90","","109.258","0.007","90","","3283.4","0.3","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","Bis(methyl 2,4,6-tri-O-acetyl-β-D-allofuranosid-3-yl)sulfane","","- C26 H38 O16 S -","- C26 H38 O16 S -","- C104 H152 O64 S4 -","4","1","SJ2366","Cumpstey, Ian; Eriksson, Lars","Bis(methyl 2,4,6-tri-<i>O</i>-acetyl-β-<small>D</small>-allofuranosid-3-yl)sulfane","Acta Crystallographica Section E","2007","63","11","o4197","o4197","10.1107/S1600536807047150","","","0.71073","MoKα","","0.0516","0.0394","","","0.1035","0.1102","","","","","","1.046","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216123","10.683","0.002","13.987","0.003","15.385","0.003","90","","102.07","0.03","90","","2248.1","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[silver(I)-μ-1,2-bis[(1H-imidazol-1-yl)methyl]benzene- κ^2^N^3^:N^3'^] 2-amino-3,5-dimethylbenzenesulfonate]","","- C22 H24 Ag N5 O3 S -","- C22 H24 Ag N5 O3 S -","- C88 H96 Ag4 N20 O12 S4 -","4","1","SJ2368","Hai-Yan Liu; Ji-Cheng Ma; Jin Yang","<i>catena</i>-Poly[[silver(I)-μ-1,2-bis[(1<i>H</i>-imidazol-1-yl)methyl]benzene-κ^2^<i>N</i>^3^:<i>N</i>^3'^] 2-amino-3,5-dimethylbenzenesulfonate]","Acta Crystallographica Section E","2007","63","11","m2723","m2723","10.1107/S160053680704963X","","","0.71073","MoKα","","0.0674","0.0499","","","0.1373","0.1465","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216124","5.2254","0.0001","9.5742","0.0003","19.4882","0.0005","90","","95.512","0.001","90","","970.47","0.04","100","0.1","100","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis[4-(dimethylamino)benzylidene]butane-1,4-diamine","","- C22 H30 N4 -","- C22 H30 N4 -","- C44 H60 N8 -","2","0.5","SJ2369","Mohammad Hossein Habibi; Mahmoud Zendehdel; Suchada Chantrapromma; Hoong-Kun Fun","<i>N</i>,<i>N</i>'-Bis[4-(dimethylamino)benzylidene]butane-1,4-diamine","Acta Crystallographica Section E","2007","63","11","o4330","o4330","10.1107/S1600536807049914","","","0.71073","MoKα","","0.0592","0.0499","","","0.1399","0.1482","","","","","","1.063","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216125","15.0048","0.0007","14.527","0.0009","7.3292","0.0003","90","","99.887","0.004","90","","1573.85","0.14","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(Trifluoromethyl)anilinium 2-carboxy-4,5-dichlorobenzoate","","- C15 H10 Cl2 F3 N O4 -","- C15 H10 Cl2 F3 N O4 -","- C60 H40 Cl8 F12 N4 O16 -","4","1","SJ2370","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","3-(Trifluoromethyl)anilinium 2-carboxy-4,5-dichlorobenzoate","Acta Crystallographica Section E","2007","63","11","o4374","o4375","10.1107/S1600536807051124","","","0.71073","MoKα","","0.0516","0.0358","","","0.0932","0.0988","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216126","9.0439","0.0006","11.5363","0.001","12.6602","0.0009","90","","112.593","0.005","90","","1219.51","0.16","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(5-Chloro-2-hydroxy-5-chloroanilino)isobenzofuran-1(3H)-one","","- C14 H10 Cl N O3 -","- C14 H10 Cl N O3 -","- C56 H40 Cl4 N4 O12 -","4","1","SJ2371","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","3-(5-Chloro-2-hydroxyanilino)isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","11","o4343","o4343","10.1107/S1600536807049641","","","0.71073","MoKα","","0.0645","0.0525","","","0.1371","0.1466","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216127","11.7545","0.0006","15.5571","0.0007","12.1496","0.0006","90","","106.114","0.001","90","","2134.46","0.18","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Benzylidene-2-methyl-11-phenyl-1,2,3,4,11,11a-hexahydropyrido[3,4-<i>c</i>][1,5]benzothiazepine","","- C26 H24 N2 S -","- C26 H24 N2 S -","- C104 H96 N8 S4 -","4","1","SJ2372","S. Athimoolam; R. Ranjith Kumar; R. Sayee Kannan; B. Sridhar; S. Asath Bahadur","4-Benzylidene-2-methyl-11-phenyl-1,2,3,4,11,11a-hexahydropyrido[3,4-<i>c</i>][1,5]benzothiazepine","Acta Crystallographica Section E","2007","63","11","o4359","o4360","10.1107/S1600536807049598","","","0.71073","MoKα","","0.0424","0.0373","","","0.0959","0.1001","","","","","","1.032","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216128","13.1371","0.0007","13.3281","0.0007","16.6587","0.0009","90","","107.043","0.001","90","","2788.7","0.3","298","2","298","2","","","","","","","","3","P 1 2/n 1","-P 2yac","13","","2,3,5',6,6',7-Hexamethoxy-3'H,10H-spiro[anthracene-9,1'-isobenzofuran]- 3',10-dione","","- C27 H24 O9 -","- C27 H24 O9 -","- C108 H96 O36 -","4","1","SJ2373","Marlon R. Lutz Jr; Matthias Zeller; Daniel P. Becker","2,3,5',6,6',7-Hexamethoxy-3'<i>H</i>,10<i>H</i>-spiro[anthracene-9,1'-isobenzofuran]-3',10-dione","Acta Crystallographica Section E","2007","63","11","o4390","o4391","10.1107/S1600536807051136","","","0.71073","MoKα","","0.0673","0.0562","","","0.1681","0.1787","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216129","7.9831","0.0006","8.8661","0.0007","12.2797","0.001","69.012","0.001","86.342","0.001","88.835","0.001","809.83","0.11","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 4-amino-5-cyano-2-methyl-6-(2-nitrophenoxy)nicotinate","","- C16 H14 N4 O5 -","- C16 H14 N4 O5 -","- C32 H28 N8 O10 -","2","1","SJ2374","Qing-Yun Ren; Hong-Wu He; Yong-Yan Yao; Yu-Cheng Gu","Ethyl 4-amino-5-cyano-2-methyl-6-(2-nitrophenoxy)nicotinate","Acta Crystallographica Section E","2007","63","11","o4320","o4320","10.1107/S1600536807049616","","","0.71073","MoKα","","0.0737","0.0493","","","0.1457","0.1666","","","","","","1.074","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216130","6.5959","0.0009","9.4351","0.0013","9.5669","0.0013","91.477","0.002","100.083","0.002","100.425","0.002","575.49","0.14","293","2","291","2","","","","","","","","5","P -1","-P 1","2","","Bis(piperidinium) bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^S,S')nickel(II)","","- C18 H24 N6 Ni S4 -","- C18 H24 N6 Ni S4 -","- C18 H24 N6 Ni S4 -","1","0.5","SJ2375","Yong Hou; Hongrong Zuo; Qian Huang; Chunlin Ni","Bis(piperidinium) bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickel(II)","Acta Crystallographica Section E","2007","63","11","m2802","m2802","10.1107/S1600536807050362","","","0.71073","MoKα","","0.0364","0.0351","","","0.1065","0.1077","","","","","","1.065","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216131","7.7531","0.0001","10.8299","0.0001","19.5621","0.0002","104.131","0.001","93.631","0.001","92.87","0.001","1585.99","0.03","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","2-[5-(4-Bromophenyl)-3-methylsulfanyl-1-benzofuran-2-yl]acetic acid","","- C17 H13 Br O3 S -","- C17 H13 Br O3 S -","- C68 H52 Br4 O12 S4 -","4","2","SJ2376","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","2-[5-(4-Bromophenyl)-3-methylsulfanyl-1-benzofuran-2-yl]acetic acid","Acta Crystallographica Section E","2007","63","11","o4331","o4331","10.1107/S1600536807049926","","","0.71073","MoKα","","0.0608","0.0415","","","0.1015","0.1129","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216132","9.8553","0.0014","13.1962","0.0019","18.825","0.003","90","","90","","90","","2448.2","0.6","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(R)-1-(2-Hydroxy-5-methylphenyl)-N-[(S)-1-(2-methoxy-5-methylphenyl)-2- phenylethyl]butan-1-aminium chloride","","- C27 H34 Cl N O2 -","- C27 H34 Cl N O2 -","- C108 H136 Cl4 N4 O8 -","4","1","SJ2377","Guang-You Zhang; Ming Li; Wan-Hui Wang; Xun-Gang Gu","(<i>R</i>)-1-(2-Hydroxy-5-methylphenyl)-<i>N</i>-[(<i>S</i>)-1-(2-methoxy-5-methylphenyl)-2-phenylethyl]butan-1-aminium chloride","Acta Crystallographica Section E","2007","63","11","o4368","o4369","10.1107/S1600536807050714","","","0.71073","MoKα","","0.046","0.0393","","","0.0956","0.0997","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216133","6.8095","0.0007","12.3823","0.0012","20.645","0.002","90","","93.198","0.001","90","","1738","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Chloridobis(η^5^-cyclopentadienyl)(4-methoxyphenethyl)zirconium(IV)","","- C19 H21 Cl O Zr -","- C19 H21 Cl O Zr -","- C76 H84 Cl4 O4 Zr4 -","4","1","SJ2378","Burford, Richard; Garon, Christian N.; Fontaine, Frédéric-Georges; Westcott, Stephen A.","Chloridobis(η^5^-cyclopentadienyl)(4-methoxyphenethyl)zirconium(IV)","Acta Crystallographica Section E","2007","63","11","m2790","m2790","10.1107/S1600536807050775","","","0.71073","MoKα","","0.0242","0.0223","","","0.0576","0.0589","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216134","4.727","0.0009","10.936","0.002","11.276","0.002","117.41","0.03","97.93","0.03","93.36","0.03","507.6","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","(Z)-5-(3-Nitrobenzylidene)-1,3-thiazolidine-2,4-dione","","- C10 H6 N2 O4 S -","- C10 H6 N2 O4 S -","- C20 H12 N4 O8 S2 -","2","1","SJ2379","Sun, Hong-shun; He, Wei; Xu, Ye-ming; Tang, Shi-gui; Guo, Cheng","(<i>Z</i>)-5-(3-Nitrobenzylidene)-1,3-thiazolidine-2,4-dione","Acta Crystallographica Section E","2007","63","11","o4425","o4425","10.1107/S1600536807051653","","","0.71073","MoKα","","0.1074","0.0768","","","0.1658","0.194","","","","","","1.007","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216135","7.75","0.002","8.831","0.002","11.27","0.003","89.44","0.04","71.66","0.03","87.81","0.04","731.6","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Dibromido{2-[(4-iodophenyl)iminomethyl]pyridine-κ^2^<i>N</i>,<i>N</i>'}zinc(II)","","- C12 H9 Br2 I N2 Zn -","- C12 H9 Br2 I N2 Zn -","- C24 H18 Br4 I2 N4 Zn2 -","2","1","SJ2380","Dehghanpour, Saeed; Mahmoudi, Ali; Khalaj, Mehdi; Salmanpour, Sadegh","Dibromido{2-[(4-iodophenyl)iminomethyl]pyridine-κ^2^<i>N</i>,<i>N</i>'}zinc(II)","Acta Crystallographica Section E","2007","63","11","m2840","m2840","10.1107/S1600536807051987","","","0.71073","MoKα","","0.0196","0.0174","","","0.0437","0.0446","","","","","","1","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2216136","7.568","0.0006","8.5363","0.0006","10.8772","0.0008","89.79","0.002","72.613","0.002","88.926","0.002","670.47","0.09","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Dichlorido{2-[(4-iodophenyl)iminomethyl]pyridine- κ^2^<i>N</i>,<i>N</i>'}zinc(II)","","- C12 H9 Cl2 I N2 Zn -","- C12 H9 Cl2 I N2 Zn -","- C24 H18 Cl4 I2 N4 Zn2 -","2","1","SJ2381","Dehghanpour, Saeed; Mahmoudi, Ali; Khalaj, Mehdi; Salmanpour, Sadegh; Adib, Mitra","Dichlorido{2-[(4-iodophenyl)iminomethyl]pyridine-κ^2^<i>N</i>,<i>N</i>'}zinc(II)","Acta Crystallographica Section E","2007","63","11","m2841","m2841","10.1107/S1600536807051999","","","0.71073","MoKα","","0.0736","0.061","","","0.1353","0.1443","","","","","","0.97","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216137","10.3766","0.001","8.6973","0.0009","24.555","0.003","90","","93.5","0.002","90","","2211.9","0.4","273","2","273","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,6-Bis(3,4-dimethoxybenzylidene)-4-ethylcyclohexanone","","- C26 H30 O5 -","- C26 H30 O5 -","- C104 H120 O20 -","4","1","SJ2382","Rajeev Mudakavi; Brinda; M. Srinivas Murthy; Deepak Chopra; T. N. Guru Row","2,6-Bis(3,4-dimethoxybenzylidene)-4-ethylcyclohexanone","Acta Crystallographica Section E","2007","63","11","o4432","o4432","10.1107/S1600536807051781","","","0.71073","MoKα","","0.1293","0.0689","","","0.1548","0.1823","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216138","9.429","0.001","14.625","0.001","18.912","0.001","90","","98.73","0.01","90","","2577.7","0.4","291","2","291","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis[(3-fluorobenzyl)triphenylphosphonium] bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickel(II)","","- C58 H42 F2 N4 Ni P2 S4 -","- C58 H42 F2 N4 Ni P2 S4 -","- C116 H84 F4 N8 Ni2 P4 S8 -","2","0.5","SJ2383","Quan-Bin Liao; Ming-Guo Liu; Chun-Lin Ni","Bis[(3-fluorobenzyl)triphenylphosphonium] bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickel(II)","Acta Crystallographica Section E","2007","63","11","m2858","m2858","10.1107/S160053680705297X","","","0.71073","MoKα","","0.0427","0.0336","","","0.1017","0.1063","","","","","","1.005","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216139","9.9044","0.0009","18.8261","0.0017","23.238","0.002","90","","90","","90","","4333","0.7","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","(<i>N</i>,<i>N</i>'-dibenzylideneethane-1,2-diamine)dichloro(2,2-dimethyl-α, α,α',α'-tetraphenyl-1,3-dioxolane-4,5-methanolato)titanium(IV) or Ti-TADDOLate","Dichlorido(<i>N</i>,<i>N</i>'-dibenzylideneethane-1,2-diamine-κ^2^N,N')[(2,2- dimethyl-1,3-dioxolane-4,5-diyl)bis(diphenylmethanolato)-κ^2^O,O']titanium(IV)","","- C47 H44 Cl2 N2 O4 Ti -","- C47 H44 Cl2 N2 O4 Ti -","- C188 H176 Cl8 N8 O16 Ti4 -","4","1","SJ2384","Chen, Chien-An; Chiang, Liang-Ying; Gau, Han-Mou","Dichlorido(<i>N</i>,<i>N</i>'-dibenzylideneethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')[(2,2-dimethyl-1,3-dioxolane-4,5-diyl)bis(diphenylmethanolato)-κ^2^<i>O</i>,<i>O</i>']titanium(IV)","Acta Crystallographica Section E","2007","63","11","m2842","m2843","10.1107/S1600536807052725","","","0.71073","MoKα","","0.0551","0.0356","","","0.078","0.0846","","","","","","0.951","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216140","10.9278","0.0015","28.509","0.004","7.9738","0.0011","90","","119.311","0.001","90","","2166.1","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaqua(2,9-dimethyl-1,10-phenanthroline-κ^2^N,N')(3-hydroxybenzoato-\ κ^2^O,O')nickel(II) nitrate","","- C21 H20 N3 Ni O8 -","- C21 H20 N3 Ni O8 -","- C84 H80 N12 Ni4 O32 -","4","0.5","SJ2386","Xuan, Xiao-peng; Zhao, Pei-zheng","Diaqua(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(3-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>')nickel(II) nitrate","Acta Crystallographica Section E","2007","63","11","m2856","m2856","10.1107/S1600536807052944","","","0.71073","MoKα","","0.0409","0.0326","","","0.0807","0.0845","","","","","","0.991","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216141","4.7462","0.0001","13.929","0.0002","15.1128","0.0002","82.147","0.001","82.367","0.001","85.64","0.001","979.26","0.03","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","Aqua{5,5'-dihydroxy-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenolato-κ^4^O,<i>N</i>,<i>N</i>',<i>O</i>'}zinc(II) trihydrate","","- C20 H22 N2 O8 Zn -","- C20 H22 N2 O8 Zn -","- C40 H44 N4 O16 Zn2 -","2","1","SJ2387","Naser Eltaher Eltayeb; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun; Kamarulazizi Ibrahim","Aqua{5,5'-dihydroxy-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenolato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}zinc(II) trihydrate","Acta Crystallographica Section E","2007","63","11","m2838","m2839","10.1107/S1600536807052713","","","0.71073","MoKα","","0.0514","0.0389","","","0.0814","0.0882","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216142","28.946","0.006","10.803","0.002","13.302","0.003","90","","94.61","0.03","90","","4146.1","1.5","292","2","292","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","azoxystrobin","(2E)-Methyl 2-{2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]phenyl}-3-methoxyacrylate","","- C22 H16 N3 O5 -","- C22 H16 N3 O5 -","- C176 H128 N24 O40 -","8","1","SJ2388","Chopra, Deepak; Mohan, T. P.; Rao, K. S.; Guru Row, T. N.","(2<i>E</i>)-Methyl 2-{2-[6-(2-cyanophenoxy)pyrimidin-4-yloxy]phenyl}-3-methoxyacrylate","Acta Crystallographica Section E","2007","63","11","o4493","o4493","10.1107/S1600536807052956","","","0.71073","MoKα","","0.0899","0.0788","","","0.2096","0.2202","","","","","","1.139","","","","has coordinates,has disorder","176787","2020-10-21","18:00:00",""
"2216143","8.8314","0.0005","9.1405","0.0005","24.5041","0.0014","90","","96.499","0.002","90","","1965.34","0.19","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>-[2-(Aminocarbonyl)phenyl]-4-hydroxy-2<i>H</i>-1,2-benzothiazine- 3-carboxamide 1,1-dioxide dimethyl sulfoxide solvate","","- C18 H19 N3 O6 S2 -","- C18 H19 N3 O6 S2 -","- C72 H76 N12 O24 S8 -","4","1","SK3158","Zia-ur-Rehman, Muhammad; Choudary, Jamil Anwar; Elsegood, Mark R. J.; Siddiqui, Hamid Latif; Weaver, George W.","<i>N</i>-[2-(Aminocarbonyl)phenyl]-4-hydroxy-2<i>H</i>-1,2-benzothiazine-3-carboxamide 1,1-dioxide dimethyl sulfoxide solvate","Acta Crystallographica Section E","2007","63","11","o4215","o4216","10.1107/S1600536807047058","","","0.71073","MoKα","","0.0357","0.0302","","","0.0801","0.0847","","","","","","1.015","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216144","10.7975","0.0007","11.429","0.0007","14.0515","0.0009","90","","92.756","0.001","90","","1732.01","0.19","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","10,10'-spirobi(dibenzo[b,e][1,4]oxa)silane","9-Sila-9,9''-spirobixanthene","","- C24 H16 O2 Si -","- C24 H16 O2 Si -","- C96 H64 O8 Si4 -","4","1","SK3175","Mague, Joel T.; Balakrishna, Maravanji S.; Venkateswaran, Ramalingam","9-Sila-9,9''-spirobixanthene","Acta Crystallographica Section E","2007","63","11","o4429","o4430","10.1107/S1600536807051604","","","0.71073","MoKα","","0.0434","0.0367","","","0.0929","0.0976","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216145","6.2461","0.0002","9.7949","0.0002","11.6966","0.0005","75.475","0.001","84.808","0.001","76.251","0.002","672.51","0.04","294","","294","","","","","","","","","5","P -1","-P 1","2","","2-Methylsulfanyl-1-(morpholin-4-ylmethyl)-1H-benzimidazole","","- C13 H17 N3 O S -","- C13 H17 N3 O S -","- C26 H34 N6 O2 S2 -","2","1","TK2195","Abou, Akoun; Bany, Guy E.; Kakou-Yao, Rita; Touré Seikou; Ebby, N'Dédé","2-Methylsulfanyl-1-(morpholin-4-ylmethyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","11","o4218","o4218","10.1107/S1600536807047344","","","0.71073","MoKα","","0.052","0.043","","0.096","0.086","0.096","","","","","","0.917","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216146","6.1543","0.0005","6.4278","0.0005","9.0298","0.0009","81.763","0.004","75.98","0.005","84.015","0.008","342.09","0.05","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","3-Amino-6-chloropyridazinium chloride","","- C4 H5 Cl2 N3 -","- C4 H5 Cl2 N3 -","- C8 H10 Cl4 N6 -","2","1","TK2198","Miao-Miao Hu; Lu-Ping Lv; Zhen-Hua Chen; Lin Zhou; Xian-Chao Hu","3-Amino-6-chloropyridazinium chloride","Acta Crystallographica Section E","2007","63","11","o4292","o4292","10.1107/S1600536807048799","","","0.71073","MoKα","","0.034","0.033","","","0.089","0.09","","","","","","1.19","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216147","16.317","0.004","8.3488","0.0016","18.035","0.004","90","","116.014","0.004","90","","2207.9","0.8","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ethyl (E)-2-(4-chlorobenzylidene)hydrazinecarboxylate","","- C10 H11 Cl N2 O2 -","- C10 H11 Cl N2 O2 -","- C80 H88 Cl8 N16 O16 -","8","2","TK2199","Bo Gao","Ethyl (<i>E</i>)-2-(4-chlorobenzylidene)hydrazinecarboxylate","Acta Crystallographica Section E","2007","63","11","o4418","o4418","10.1107/S1600536807051410","","","0.7107","MoKα","","0.061","0.049","","","0.105","0.111","","","","","","1.16","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216148","6.965","0.0006","12.8654","0.0012","20.9341","0.0018","90","","90.335","0.005","90","","1875.8","0.3","295","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 Cl5 N3 Zn -","- C13 H14 Cl5 N3 Zn -","- C52 H56 Cl20 N12 Zn4 -","4","1","TK2200","Kim, Young-Inn; Lee, You-Soon; Seo, Hoe-Joo; Lee, Jin-Young; Kang, Sung Kwon","[Bis(2-pyridylmethyl)amine]dichloridozinc(II) chloroform solvate","Acta Crystallographica Section E","2007","63","11","m2810","m2811","10.1107/S1600536807051422","","","0.71073","MoKα","","","0.046","","","","0.132","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216149","11.7409","0.0002","30.6727","0.0005","16.959","0.0004","90","","107.633","0.002","90","","5820.4","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(μ~3~-Benzene-1,3,5-tricarboxylato)tris[aqua(<i>N</i>,<i>N</i>,N',N'',N''- pentamethyldiethylenetriamine)nickel(II)] tris(perchlorate) 4.25-hydrate","","- C36 H86.5 Cl3 N9 Ni3 O25.25 -","- C36 H86.5 Cl3 N9 Ni3 O25.25 -","- C144 H346 Cl12 N36 Ni12 O101 -","4","1","TK2201","Trávníček, Zdeněk; Marek, Jaromír; Čermáková, Šárka","(μ~3~-Benzene-1,3,5-tricarboxylato)tris[aqua(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''-pentamethyldiethylenetriamine)nickel(II)] tris(perchlorate) 4.25-hydrate","Acta Crystallographica Section E","2007","63","11","m2860","m2861","10.1107/S1600536807051938","","","0.71073","MoKα","","0.058","0.041","","","0.09","0.096","","","","","","1.01","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2216150","9.208","0.003","9.718","0.003","15.844","0.005","90","","150.03","0.02","90","","708.2","0.6","298","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Diisopropyl terephthalate","","- C14 H18 O4 -","- C14 H18 O4 -","- C28 H36 O8 -","2","0.5","TK2202","Branko Kaitner; Vladimir Stilinović","Diisopropyl terephthalate","Acta Crystallographica Section E","2007","63","11","o4487","o4487","10.1107/S1600536807051926","","","0.71073","MoKα","","","0.056","","","","0.17","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216151","12.0875","0.0011","8.0695","0.0009","24.61","0.002","90","","101.143","0.002","90","","2355.2","0.4","173","1","173","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,4'-Bipyridyl‒2-chloro-4-nitrobenzoic acid (1/2)","","- C24 H16 Cl2 N4 O8 -","- C24 H16 Cl2 N4 O8 -","- C96 H64 Cl8 N16 O32 -","4","1","TK2205","Gotoh, Kazuma; Ishida, Hiroyuki","4,4'-Bipyridyl‒2-chloro-4-nitrobenzoic acid (1/2)","Acta Crystallographica Section E","2007","63","11","o4500","o4500","10.1107/S1600536807052865","","","0.71075","MoKα","","0.037","0.034","","","0.088","0.091","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216152","9.176","0.0018","7.51","0.0015","10.857","0.002","90","","90","","90","","748.2","0.3","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","Gallium trichloride‒acetonitrile","(Acetonitrile-κ<i>N</i>)trichloridogallium(III)","","- C2 H3 Cl3 Ga N -","- C2 H3 Cl3 Ga N -","- C8 H12 Cl12 Ga4 N4 -","4","0.5","WM2142","Markus Schaffrath; Axel Schulz; Alexander Villinger","(Acetonitrile-κ<i>N</i>)trichloridogallium(III)","Acta Crystallographica Section E","2007","63","11","m2764","m2764","10.1107/S1600536807043516","","","0.71073","MoKα","","0.0234","0.0171","","","0.041","0.0423","","","","","","1.042","","","","has coordinates,has Fobs","213925","2020-10-21","18:00:00",""
"2216153","4.3665","0.0002","9.368","0.0004","10.8267","0.0008","81.532","0.009","85.369","0.009","83.641","0.008","434.41","0.04","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","ammonium catena-[monoboro-mono-dihydrogendiborate-monohydrogenphosphate] hemihydrate","","- B3 H8 N O9.5 P -","- B3 H7 N O9.5 P -","- B6 H14 N2 O19 P2 -","2","1","WM2143","Liu, Wei; Zhao, Jingtai","(NH~4~)[B~3~PO~6~(OH)~3~].0.5H~2~O","Acta Crystallographica, Section E","2007","63","11","i85","i85","10.1107/S1600536807046193","","","0.71073","MoKα","","0.0395","0.0375","","","0.0968","0.0992","","","","","","1.064","","","","has coordinates","277834","2022-09-14","16:39:47",""
"2216154","7.72","0.004","9.167","0.005","15.054","0.008","90.446","0.012","91.727","0.012","114.38","0.01","969.7","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","2,4,6-Trichloro-1,3,5-trimethylborazine","","- C3 H9 B3 Cl3 N3 -","- C3 H9 B3 Cl3 N3 -","- C12 H36 B12 Cl12 N12 -","4","2","WM2148","Weinmann, Markus; Nuss, Jürgen; Jansen, Martin","2,4,6-Trichloro-1,3,5-trimethylborazine","Acta Crystallographica Section E","2007","63","11","o4235","o4235","10.1107/S1600536807047241","","","0.71073","MoKα","","0.0906","0.061","","","0.156","0.1728","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216155","10.2626","0.0015","10.2626","0.0015","5.7679","0.0012","90","","90","","120","","526.09","0.15","293","2","293","2","","","","","","","","4","P 63","P 6c","173","","tricerium hemimagnesium germanium heptasulfide","","- Ce3 Ge Mg0.5 S7 -","- Ce3 Ge Mg0.5 S7 -","- Ce6 Ge2 Mg S14 -","2","0.333333","WM2149","Gulay, L. D.; Daszkiewicz, M.; Huch, M. R.; Pietraszko, A.","Ce~3~Mg~0.5~GeS~7~ from single-crystal data","Acta Crystallographica Section E","2007","63","11","i187","i187","10.1107/S1600536807048593","","","0.71073","MoKα","","0.0137","0.0127","","","0.0216","0.0217","","","","","","1.007","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216156","10.1025","0.0005","14.3045","0.001","19.2547","0.0011","90","","90","","90","","2782.5","0.3","296","","296","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","[N,N'-Bis(3-aminopropyl)ethylendiamine]disaccharinatozinc(II) monohydrate","","- C22 H32 N6 O7 S2 Zn -","- C22 H32 N6 O7 S2 Zn -","- C88 H128 N24 O28 S8 Zn4 -","4","1","WM2151","Paşaoǧlu, Hümeyra; Kaştaş, Gökhan; Yeşilel, Okan Z.; Şahin, Onur; Büyükgüngör, Orhan","[<i>N</i>,<i>N</i>'-Bis(3-aminopropyl)ethylenediamine]disaccharinatozinc(II) monohydrate","Acta Crystallographica Section E","2007","63","11","m2710","m2711","10.1107/S1600536807049458","","","0.71069","MoKα","","0.1108","0.0678","","","0.1111","0.1221","","","","","","0.92","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216157","12.38","0.002","3.9192","0.0008","6.8818","0.0013","90","","90","","90","","333.9","0.11","293","2","293","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","nickel telluride","","- Ni2.6 Te2 -","- Ni2.6 Te2 -","- Ni10.4 Te8 -","4","0.5","WM2152","Gulay, L. D.; Daszkiewicz, M.; Pietraszko, A.","Evidence of a centre of symmetry: redetermination of Ni~2.60~Te~2~ from single-crystal data","Acta Crystallographica Section E","2007","63","11","i188","i188","10.1107/S1600536807050568","","","0.71073","MoKα","","0.026","0.0254","","","0.0593","0.06","","","","","","1.096","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216158","11.67521","0.00008","11.67521","0.00008","11.67521","0.00008","90","","90","","90","","1591.45","0.019","293","","293","","","","","","","","","4","P n -3 m :2","-P 4bc 2bc 3","224","","trirubidium molybdophosphate","","- Mo12 O40 P Rb3 -","- Mo12 O40 P Rb3 -","- Mo24 O80 P2 Rb6 -","2","0.0416667","WM2153","P. Armand; D. Granier; A. van der Lee","Rb~3~[PMo~12~O~40~], a compound containing Keggin anions","Acta Crystallographica Section E","2007","63","11","i191","i191","10.1107/S1600536807052506","","","0.71073","MoKα","","0.0419","0.0325","","0.0855","0.0851","0.0855","","","","","","0.9066","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216159","14.935","0.006","16.321","0.006","15.469","0.006","90","","98.786","0.006","90","","3726","2","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","N-(4-Methylphenyl)-N'-(5-chloro-3-methyl-1- phenylpyrazol-4-ylcarbonyl)thiourea","","- C19 H17 Cl N4 O S -","- C19 H17 Cl N4 O S -","- C152 H136 Cl8 N32 O8 S8 -","8","1","WN2200","Haitang Du; Ming Lu; Weiyi Zhou; Lili Sun","<i>N</i>-(5-Chloro-3-methyl-1-phenylpyrazol-4-ylcarbonyl)-<i>N</i>'-(4-methylphenyl)thiourea","Acta Crystallographica Section E","2007","63","11","o4287","o4287","10.1107/S1600536807043541","","","0.71073","MoKα","","0.056","0.0374","","","0.0882","0.1021","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216160","10.2536","0.0013","10.6867","0.0014","18.213","0.002","90","","100.612","0.011","90","","1961.6","0.4","298","1","298","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Tetrakis(tert-butylammonium) benzene-1,2,4,5-tetracarboxylate octahydrate","","- C26 H66 N4 O16 -","- C26 H66 N4 O16 -","- C52 H132 N8 O32 -","2","0.5","WN2206","Ejsmont, Krzysztof; Zaleski Jacek","Tetrakis(<i>tert</i>-butylammonium) benzene-1,2,4,5-tetracarboxylate octahydrate","Acta Crystallographica Section E","2007","63","11","o4315","o4315","10.1107/S1600536807049690","","","0.71073","MoKα","","0.0514","0.0375","","","0.1001","0.1085","","","","","","1.056","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216161","10.7977","0.0012","14.9156","0.0016","12.7543","0.0014","90","","103.044","0.002","90","","2001.1","0.4","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Azido{2-[(tri-2-pyridylmethyl)iminomethyl]phenolato}nickel(II)","","- C23 H17 N7 Ni O -","- C23 H17 N7 Ni O -","- C92 H68 N28 Ni4 O4 -","4","1","WN2208","Tian, Lai-Jin; Yang, Hong-Jun; Ni, Zhong-Hai","Azido{2-[(tri-2-pyridylmethyl)iminomethyl]phenolato}nickel(II)","Acta Crystallographica Section E","2007","63","11","m2812","m2812","10.1107/S1600536807051793","","","0.71073","MoKα","","0.0723","0.0468","","","0.089","0.0968","","","","","","0.936","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216162","11.6929","0.0003","11.7844","0.0003","17.9339","0.0004","71.576","0.002","88.034","0.002","68.674","0.002","2174.87","0.1","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","1-Ethyl-4,4,6,8-tetramethyl-2-tosyl-2,3,3a,4,6,7,8,9-octahydro-1H-\ pyrrolo[3,4-<i>c</i>]pyrano[6,5-<i>d</i>]pyrimidine-7,9-dione","","- C22 H29 N3 O5 S -","- C22 H29 N3 O5 S -","- C88 H116 N12 O20 S4 -","4","2","WN2209","Chinnakali, K.; Sudha, D.; Jayagopi, M.; Raghunathan, R.; Fun, Hoong-Kun","1-Ethyl-4,4,6,8-tetramethyl-2-tosyl-2,3,3a,4,6,7,8,9-octahydro-1<i>H</i>-pyrrolo[3,4-<i>c</i>]pyrano[6,5-<i>d</i>]pyrimidine-7,9-dione","Acta Crystallographica Section E","2007","63","11","o4434","o4435","10.1107/S160053680705221X","","","0.71073","MoKα","","0.1056","0.0652","","","0.1454","0.1664","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216163","14.5021","0.0007","15.0787","0.0007","16.9696","0.0008","64.059","0.002","69.821","0.002","71.636","0.003","3072.3","0.3","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","4,4,7,7-Tetramethyl-2-tosyl-2,3,3a,4,6,7,8,9-octahydro-1H- pyrrolo[3,4-c]pyrano[6,5-b]cyclohexan-9-one","","- C22 H29 N O4 S -","- C22 H29 N O4 S -","- C132 H174 N6 O24 S6 -","6","3","WN2210","K. Chinnakali; D. Sudha; M. Jayagopi; R. Raghunathan; Hoong-Kun Fun","4,4,7,7-Tetramethyl-2-tosyl-2,3,3a,4,6,7,8,9-octahydro-1<i>H</i>-pyrrolo[3,4-<i>c</i>]pyrano[6,5-<i>b</i>]cyclohexan-9-one","Acta Crystallographica Section E","2007","63","11","o4436","o4437","10.1107/S1600536807052221","","","0.71073","MoKα","","0.0662","0.0462","","","0.1166","0.1281","","","","","","1.059","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216164","8.0219","0.0002","8.6106","0.0002","15.0432","0.0004","104.557","0.001","99.182","0.001","93.192","0.001","987.84","0.04","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","4,4-Dimethyl-2-tosyl-2,3,3a,4-tetrahydro-1H,10H- pyrrolo[3,4-c]pyrano[6,5-b]indan-10-one","","- C23 H23 N O4 S -","- C23 H23 N O4 S -","- C46 H46 N2 O8 S2 -","2","1","WN2211","K. Chinnakali; D. Sudha; M. Jayagopi; R. Raghunathan; Hoong-Kun Fun","4,4-Dimethyl-2-tosyl-2,3,3a,4-tetrahydro-1<i>H</i>,10<i>H</i>-pyrrolo[3,4-<i>c</i>]pyrano[6,5-<i>b</i>]indan-10-one","Acta Crystallographica Section E","2007","63","11","o4438","o4438","10.1107/S1600536807052233","","","0.71073","MoKα","","0.0381","0.0345","","","0.1","0.1055","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216165","15.1413","0.0003","14.7008","0.0003","20.9973","0.0004","90","","111.336","0.001","90","","4353.45","0.15","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis-4,4,10-Trimethyl-2-tosyl-1,2,3,3a,4,11b-hexahydro- 11H-pyrrolo[3,4-<i>c</i>]pyrano[5,6-<i>c</i>]quinolin-11-one hemihydrate","","- C24 H27 N2 O4.5 S -","- C24 H27 N2 O4.5 S -","- C192 H216 N16 O36 S8 -","8","2","WN2212","K. Chinnakali; D. Sudha; M. Jayagopi; R. Raghunathan; Hoong-Kun Fun","<i>cis</i>-4,4,10-Trimethyl-2-tosyl-1,2,3,3a,4,11b-hexahydro-11<i>H</i>-pyrrolo[3,4-<i>c</i>]pyrano[5,6-<i>c</i>]quinolin-11-one hemihydrate","Acta Crystallographica Section E","2007","63","11","o4489","o4490","10.1107/S1600536807053287","","","0.71073","MoKα","","0.0809","0.053","","","0.1167","0.1292","","","","","","1.073","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216166","10.4111","0.0002","13.8576","0.0002","18.046","0.0003","90","","117.834","0.001","90","","2302.33","0.07","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis-1-Ethyl-4,4,10-trimethyl-2-tosyl-1,2,3,3a,4,11b-hexahydro- 11H-pyrrolo[3,4-<i>c</i>]pyrano[5,6-<i>c</i>]quinolin-11-one","","- C26 H30 N2 O4 S -","- C26 H30 N2 O4 S -","- C104 H120 N8 O16 S4 -","4","1","WN2214","K. Chinnakali; D. Sudha; M. Jayagopi; R. Raghunathan; Hoong-Kun Fun","<i>cis</i>-1-Ethyl-4,4,10-trimethyl-2-tosyl-1,2,3,3a,4,11b-hexahydro-11<i>H</i>-pyrrolo[3,4-<i>c</i>]pyrano[5,6-<i>c</i>]quinolin-11-one","Acta Crystallographica Section E","2007","63","11","o4491","o4492","10.1107/S1600536807053263","","","0.71073","MoKα","","0.0856","0.0591","","","0.146","0.1629","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216167","7.6403","0.0014","7.4693","0.0013","22.047","0.004","90","","105.595","0.006","90","","1211.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7-Nitro-2-phenyl-4H-3,1-benzoxazin-4-one","","- C14 H8 N2 O4 -","- C14 H8 N2 O4 -","- C56 H32 N8 O16 -","4","1","WW2096","Khan, Zulfiqar Ali; Khan, Khalid M.; Anjum, Shazia","7-Nitro-2-phenyl-4<i>H</i>-3,1-benzoxazin-4-one","Acta Crystallographica Section E","2007","63","11","o4226","o4227","10.1107/S1600536807046168","","","0.71073","MoKα","","0.0619","0.0567","","","0.1669","0.1714","","","","","","1.004","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216168","7.7836","0.0013","7.8829","0.0008","13.0927","0.0019","83.05","0.01","88.899","0.013","78.596","0.011","781.68","0.19","296","","296","","","","","","","","","5","P -1","-P 1","2","","(2E)-3-(2-Bromo-5-methoxyphenyl)-1-(2,4-dichlorophenyl)prop-2-en-1-one","","- C16 H11 Br Cl2 O2 -","- C16 H11 Br Cl2 O2 -","- C32 H22 Br2 Cl4 O4 -","2","1","WW2098","Butcher, Ray J.; Jasinski, Jerry P.; Yathirajan, H. S.; Narayana, B.; Mayekar, Anil N.","(2<i>E</i>)-3-(2-Bromo-5-methoxyphenyl)-1-(2,4-dichlorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","11","o4253","o4254","10.1107/S1600536807048271","","","0.71073","MoKα","","0.0947","0.0528","","","0.1037","0.1263","","","","","","1.077","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216169","12.7307","0.0007","12.7307","0.0007","19.5433","0.0018","90","","90","","90","","3167.4","0.4","130","","130","","","","","","","","","6","I 41/a :2","-I 4ad","88","","Poly[di-μ~2~-chlorido-μ~4~-hexamethylenetetramine-\ bis[chlorido(methanol-κO)cadmium(II)]]","","- C8 H20 Cd2 Cl4 N4 O2 -","- C8 H18 Cd2 Cl4 N4 O2 -","- C64 H144 Cd16 Cl32 N32 O16 -","8","0.5","XU2326","Yun Chen; Yu-Ling Wang; Shao-Ming Ying; Shuang-Lian Cai","Poly[di-μ~2~-chlorido-μ~4~-hexamethylenetetramine-bis[chlorido(methanol-κ<i>O</i>)cadmium(II)]]","Acta Crystallographica Section E","2007","63","11","m2751","m2751","10.1107/S1600536807046715","","","0.71073","MoKα","","0.0661","0.0518","","","0.0902","0.0969","","","","","","1.099","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216170","17.018","0.002","6.5466","0.0007","9.6698","0.0013","90","","90","","90","","1077.3","0.2","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Poly[tetramethylammonium [μ~4~-bromido-di-μ~2~-bromido-dicopper(I)]]","","- C4 H12 Br3 Cu2 N -","- C4 H12 Br3 Cu2 N -","- C16 H48 Br12 Cu8 N4 -","4","0.5","XU2327","Liu, Xi","Poly[tetramethylammonium [μ~4~-bromido-di-μ~2~-bromido-dicuprate(I)]]","Acta Crystallographica Section E","2007","63","11","m2651","m2651","10.1107/S1600536807047885","","","0.71073","MoKα","","0.0461","0.0361","","","0.0906","0.0965","","","","","","1.004","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216171","8.3766","0.0009","11.1515","0.0011","11.2575","0.0012","101.848","0.001","108.359","0.001","107.077","0.001","901.19","0.16","150","2","150","2","","","","","","","","4","P -1","-P 1","2","N,N'-Bis(6-methoxysalicylidene)-1,2-diaminobenzene","3,3'-Dimethoxy-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenol","","- C22 H20 N2 O4 -","- C22 H20 N2 O4 -","- C44 H40 N4 O8 -","2","1","XU2333","Habibi, Mohammad Hossein; Montazerozohori, Morteza; Mokhtari, Reza; Harrington, Ross W.; Clegg, William","3,3'-Dimethoxy-2,2'-[<i>o</i>-phenylenebis(nitrilomethylidyne)]diphenol","Acta Crystallographica Section E","2007","63","11","o4462","o4462","10.1107/S160053680704826X","","","0.71073","MoKα","","0.0474","0.0386","","","0.1037","0.1112","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216172","17.11","0.02","5.456","0.005","7.988","0.007","90","","98.25","0.04","90","","738","1.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(E)-3-phenylprop-2-enal azine","(1E,2E)-1,2-Bis[(E)-3-phenylallylidene]hydrazine","","- C18 H16 N2 -","- C18 H16 N2 -","- C36 H32 N4 -","2","0.5","XU2335","Chen, Xiaohua","(1<i>E</i>,2<i>E</i>)-1,2-Bis[(<i>E</i>)-3-phenylallylidene]hydrazine","Acta Crystallographica Section E","2007","63","11","o4443","o4443","10.1107/S1600536807051707","","","0.71073","MoKα","","0.062","0.041","","","0.0903","0.0944","","","","","","0.953","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2216173","23.719","0.003","4.9052","0.0018","12.353","0.002","90","","90","","90","","1437.2","0.6","291","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","(E)-1,3-Benzodioxole-5-carbaldehyde 4-nitrophenylhydrazone","","- C14 H11 N3 O4 -","- C14 H11 N3 O4 -","- C56 H44 N12 O16 -","4","1","XU2338","Yin, Zhi-Gang; Qian, Heng-Yu; Hu Jie; Feng Yu-Li","(<i>E</i>)-1,3-Benzodioxole-5-carbaldehyde 4-nitrophenylhydrazone","Acta Crystallographica Section E","2007","63","11","o4406","o4406","10.1107/S1600536807051719","","","0.71073","MoKα","","0.0801","0.0508","","","0.0824","0.0884","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216174","6.2419","0.0014","15.785","0.004","17.574","0.004","90","","90","","90","","1731.5","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H18 Cl N3 O3 -","- C18 H18 Cl N3 O3 -","- C72 H72 Cl4 N12 O12 -","4","1","XU2339","Long He","(<i>S</i>)-Benzyl 2-[<i>N</i>-(5-chloropyridin-2-yl)carbamoyl]pyrrolidine-1-carboxylate","Acta Crystallographica Section E","2007","63","11","o4358","o4358","10.1107/S1600536807050441","","","0.71073","MoKα","","0.0365","0.0318","","","0.0835","0.0875","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216175","8.937","0.001","22.593","0.001","13.745","0.002","90","","105.411","0.001","90","","2675.5","0.5","295","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diethyl 3-methyl-5-(triphenylphosphoranyleneamino)thiophene-2,4-dicarboxylate","","- C29 H28 N O4 P S -","- C29 H28 N O4 P S -","- C116 H112 N4 O16 P4 S4 -","4","1","XU2341","Jiao, Yuan-Hong; Zhang, Qian; Ng, Seik Weng","Diethyl 3-methyl-5-(triphenylphosphoranyleneamino)thiophene-2,4-dicarboxylate","Acta Crystallographica Section E","2007","63","11","o4466","o4466","10.1107/S1600536807051689","","","0.71073","MoKα","","0.0996","0.0631","","","0.1551","0.1722","","","","","","0.942","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216176","12.588","0.003","10.023","0.004","12.461","0.004","90","","117.617","0.013","90","","1393.1","0.8","298","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Methyl-1-(pyrrolidinium-2-ylmethyl)pyridinium dibromide","","- C11 H18 Br2 N2 -","- C11 H18 Br2 N2 -","- C44 H72 Br8 N8 -","4","1","YA2056","Liping Wang; Huadong Yue; Xuefen Liu; Shuping Luo; Danqian Xu","2-Methyl-1-(pyrrolidinium-2-ylmethyl)pyridinium dibromide","Acta Crystallographica Section E","2007","63","11","o4291","o4291","10.1107/S1600536807048003","","","0.71075","MoKα","","","0.045","","","","0.139","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216177","17.543","0.003","17.543","0.003","10.42","0.003","90","","90","","90","","3206.8","1.2","293","2","293","2","","","","","","","","5","P -4 b 2","P -4 -2ab","117","","Bis(μ-2-{[3-(dimethylamino)propyl]iminomethyl}phenolato- κ^4^N,N',O:O)bis[(acetato-κ^2^O,O')cadmium(II)] monohydrate","","- C28 H42 Cd2 N4 O7 -","- C28 H42 Cd2 N4 O7 -","- C112 H168 Cd8 N16 O28 -","4","0.5","YA2057","Wen-Xuan Cai; Xiao-Yong Zheng; Hong Su; Yun-Long Feng","Bis(μ-2-{[3-(dimethylamino)propyl]iminomethyl}phenolato-κ^4^<i>N</i>,<i>N</i>',<i>O</i>:<i>O</i>)bis[(acetato-κ^2^<i>O</i>,<i>O</i>')cadmium(II)] monohydrate","Acta Crystallographica Section E","2007","63","11","m2828","m2829","10.1107/S1600536807052105","","","0.71073","MoKα","","0.031","0.022","","","0.044","0.046","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216178","10.8491","0.0014","11.8882","0.0016","11.1206","0.0015","90","","103.723","0.003","90","","1393.4","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2-Nitrophenyl)-3-pivaloylthiourea","","- C12 H15 N3 O3 S -","- C12 H15 N3 O3 S -","- C48 H60 N12 O12 S4 -","4","1","ZL2060","Saeed, Aamer; Flörke, Ulrich","1-(2-Nitrophenyl)-3-pivaloylthiourea","Acta Crystallographica Section E","2007","63","11","o4259","o4259","10.1107/S160053680704593X","","","0.71073","MoKα","","0.0448","0.0392","","","0.1003","0.1041","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216179","10.167","0.0004","10.4488","0.0004","22.9795","0.0011","90","","90","","90","","2441.18","0.18","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(<i>R</i>,<i>E</i>)-[4-(Benzyloxy)-2-(cinnamoyloxy)- 4-oxobutyl]trimethylammonium chloride hydrochloride","","- C23 H29 Cl2 N O4 -","- C23 H29 Cl2 N O4 -","- C92 H116 Cl8 N4 O16 -","4","1","ZL2065","Xun Li; Xiao-Wei Gong; Jin-Pei Li; Wei-Xia Wang; Wen-Fang Xu","(<i>R</i>,<i>E</i>)-[4-(Benzyloxy)-2-(cinnamoyloxy)-4-oxobutyl]trimethylammonium chloride hydrochloride","Acta Crystallographica Section E","2007","63","11","o4239","o4240","10.1107/S1600536807047988","","","0.71073","MoKα","","0.0954","0.0491","","","","0.206","","","","","","0.813","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216180","14.8713","0.0003","21.0882","0.0003","11.9741","0.0002","90","","90","","90","","3755.18","0.11","297","2","297","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Bis(4-carboxypyridinium) aquapentakis(isothiocyanato-κ<i>N</i>)iron(III) bis(pyridinium-4-carboxylate)","","- C29 H24 Fe N9 O9 S5 -","- C29 H24 Fe N9 O9 S5 -","- C116 H96 Fe4 N36 O36 S20 -","4","0.5","ZL2066","Li, Xiu-Ling; Lu, Zai-Sheng; Niu, De-Zhong","Bis(4-carboxypyridinium) aquapentakis(isothiocyanato-κ<i>N</i>)iron(III) bis(pyridinium-4-carboxylate)","Acta Crystallographica Section E","2007","63","11","m2640","m2640","10.1107/S1600536807047460","","","0.71073","MoKα","","0.0736","0.0491","","","0.1138","0.1321","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216181","10.5553","0.0002","14.9526","0.0003","17.4798","0.0003","90","","103.908","0.001","90","","2677.94","0.09","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Poly[[diaquabis(μ~4~-benzene-1,3-dicarboxylato)(μ~3~-benzene-1,3- dicarboxylato)dierbium(III)] monohydrate]","","- C24 H18 Er2 O15 -","- C24 H18 Er2 O15 -","- C96 H72 Er8 O60 -","4","1","ZL2067","Wen-Dong Song; De-Yun Ma; Chao-Hua Zhang","Poly[[diaquabis(μ~4~-benzene-1,3-dicarboxylato)(μ~3~-benzene-1,3-dicarboxylato)dierbium(III)] monohydrate]","Acta Crystallographica Section E","2007","63","11","m2826","m2827","10.1107/S1600536807051975","","","0.71073","MoKα","","0.0221","0.0188","","","0.0434","0.0445","","","","","","1.06","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216182","10.9476","0.0013","7.4005","0.0006","14.8518","0.0014","90","","100.043","0.006","90","","1184.8","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Acetylphenyl)-2,5-dimethyl-1H-pyrrole","","- C14 H15 N O -","- C14 H15 N O -","- C56 H60 N4 O4 -","4","1","ZL2069","Santos, Ana C.; Marques, Ana T.; Ramos Silva, Manuela; Matos Beja, Ana; Sobral, Abilio J.F.N.","1-(4-Acetylphenyl)-2,5-dimethyl-1<i>H</i>-pyrrole","Acta Crystallographica Section E","2007","63","11","o4233","o4233","10.1107/S1600536807047800","","","0.71073","MoKα","","0.1121","0.0463","","","0.1061","0.1312","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216183","10.0546","0.0008","19.5493","0.0015","25.359","0.002","90","","94.329","0.002","90","","4970.4","0.7","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","octachlorido-1κ^4^Cl,3κ^4^Cl-di-μ~2~-nitrido-1:2κ^2^N:N;2:3κ^2^N:N-\ tetrapyridine-1κN,2κ^2^N,3κN-bis(trimethylsilylimido-2κN)tritungsten(V) dichloromethane disolvate","","- C28 H42 Cl12 N8 Si2 W3 -","- C28 H42 Cl12 N8 Si2 W3 -","- C112 H168 Cl48 N32 Si8 W12 -","4","0.5","ZL2070","Koller, Jürgen; McElwee-White, Lisa; Abboud, Khalil A.","An N-bridged tritungsten compound for the chemical vapor deposition of WN~<i>x~</i> thin films","Acta Crystallographica Section E","2007","63","11","m2733","m2733","10.1107/S1600536807049033","","","0.71073","MoKα","","0.0541","0.0293","","","0.0506","0.0535","","","","","","0.758","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216184","7.5865","0.0009","19.9375","0.0015","20.4751","0.0019","90","","90","","90","","3097","0.5","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","3-Fluoro-2,4,5-triphenylfuran","3-Fluoro-2,4,5-triphenylfuran","","- C22 H15 F O -","- C22 H15 F O -","- C176 H120 F8 O8 -","8","1","ZL2071","Jacobsen, Jesse M.; Arimitsu, Satoru; Hammond, Gerald B.; Mashuta, Mark S.","3-Fluoro-2,4,5-triphenylfuran","Acta Crystallographica Section E","2007","63","11","o4337","o4337","10.1107/S1600536807049902","","","0.71073","MoKα","","0.048","0.0447","","","0.1164","0.119","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216185","4.99","0.003","12.12","0.004","21.176","0.01","90","","90","","90","","1280.7","1.1","295","","295","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(S)-Methyl 2-(2-iodobenzamido)propionate","","- C11 H12 I N O3 -","- C11 H12 I N O3 -","- C44 H48 I4 N4 O12 -","4","1","ZL2072","Koposov, Alexey Y.; Nemykin, Victor N.; Zhdankin, Victor V.","(<i>S</i>)-Methyl 2-(2-iodobenzamido)propionate","Acta Crystallographica Section E","2007","63","11","o4461","o4461","10.1107/S160053680705266X","","","0.71073","MoKα","","0.0416","0.0382","","0.0965","0.0943","0.0965","","","","","","0.9921","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216186","13.1733","0.0004","18.2824","0.0005","12.6656","0.0004","90","","90","","90","","3050.38","0.16","293","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","4-Hydroxyimino-2-phenylperhydroquinolinium chloride hemihydrate","","- C15 H22 Cl N2 O1.5 -","- C15 H22.001 Cl N2 O1.5005 -","- C120 H176.008 Cl8 N16 O12.004 -","8","2","ZL2073","Thiruvalluvar, A.; Natarajan, D.","4-Hydroxyimino-2-phenylperhydroquinolinium chloride hemihydrate","Acta Crystallographica Section E","2007","63","11","o4431","o4431","10.1107/S1600536807052245","","","0.71073","MoKα","","0.0324","0.0276","","","0.0713","0.0745","","","","","","1.04","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216187","23.164","0.0004","10.474","0.0005","22.777","0.0008","90","","112.494","0.001","90","","5105.7","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis{4,4'-[(2,2'-bi-1H-imidazole-1,1'-diyl)dimethylene]dipyridinium} β-octamolybdate","","- C36 H36 Mo8 N12 O26 -","- C36 H36 Mo8 N12 O26 -","- C144 H144 Mo32 N48 O104 -","4","0.5","ZL2074","Ya-Qian Lan; Jun-Sheng Qin; Zhong-Min Su","Bis{4,4'-[(2,2'-bi-1<i>H</i>-imidazole-1,1'-diyl)dimethylene]dipyridinium} β-octamolybdate","Acta Crystallographica Section E","2007","63","11","m2817","m2817","10.1107/S1600536807052294","","","0.71069","MoKα","","0.0289","0.0225","","","0.051","0.0537","","","","","","1.015","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216188","15.195","0.0009","5.8261","0.0002","18.804","0.0007","90","","100.893","0.002","90","","1634.68","0.13","298","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[bis(thiocyanato-κN)zinc(II)]-μ-1,4-bis(1,2,4-triazol-1- yl)butane]","","- C10 H12 N8 S2 Zn -","- C10 H12 N8 S2 Zn -","- C40 H48 N32 S8 Zn4 -","4","0.5","AT2425","Liang Shen","<i>catena</i>-Poly[[bis(thiocyanato-κ<i>N</i>)zinc(II)]-μ-1,4-bis(1,2,4-triazol-1-yl)butane]","Acta Crystallographica Section E","2007","63","12","m3045","m3045","10.1107/S1600536807051239","","","0.71069","MoKα","","","0.0338","","","","0.1317","","","","","","1.004","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216189","12.2884","0.0015","17.069","0.002","19.373","0.002","90","","94.31","0.002","90","","4052","0.8","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[2,4-dibromo-6-(1-naphthyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]\ bis(N,N'-dimethylformamide-κO)cobalt(II)","","- C40 H34 Br4 Co N4 O4 -","- C40 H34 Br4 Co N4 O4 -","- C160 H136 Br16 Co4 N16 O16 -","4","1","AT2437","Liu, Zheng; Jin, Li Xia; Xia, Jin Hong; Liu, Er Xi; Li, Guang Zhao","Bis[2,4-dibromo-6-(1-naphthyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]bis(<i>N</i>,<i>N</i>'-dimethylformamide-κ<i>O</i>)cobalt(II)","Acta Crystallographica Section E","2007","63","12","m3037","m3037","10.1107/S1600536807053044","","","0.71073","MoKα","","0.1496","0.0571","","","0.1088","0.1233","","","","","","0.996","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216191","6.6872","0.0002","7.1478","0.0002","15.0725","0.0005","98.27","0.001","97.013","0.001","105.353","0.001","677.76","0.04","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Hexaaquacadmium(II) bis{[1-(4-hydroxyphenyl)-1H-tetrazol-5-ylsulfanyl]acetate}","","- C18 H26 Cd N8 O12 S2 -","- C18 H26 Cd N8 O12 S2 -","- C18 H26 Cd N8 O12 S2 -","1","0.5","AT2446","Shu-Guang Zhang; Yun-Long Feng; Hong Su","Hexaaquacadmium(II) bis{[1-(4-hydroxyphenyl)-1<i>H</i>-tetrazol-5-ylsulfanyl]acetate}","Acta Crystallographica Section E","2007","63","12","m2907","m2907","10.1107/S1600536807053081","","","0.71073","MoKα","","0.0253","0.0246","","","0.0677","0.0681","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216193","7.22","0.0014","11.961","0.002","12.936","0.003","90","","90","","90","","1117.1","0.4","113","2","113","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3'-(Methylsulfanyl)biphenyl-4-carbonitrile","","- C14 H11 N S -","- C14 H11 N S -","- C56 H44 N4 S4 -","4","1","AT2450","Zhi-Qiang Zhang; Zhi-Zhi Hu; Cui-Ping Wang; Jing-Bo Yan; Ren He","3'-(Methylsulfanyl)biphenyl-4-carbonitrile","Acta Crystallographica Section E","2007","63","12","o4581","o4581","10.1107/S1600536807054463","","","0.71073","MoKα","","0.048","0.0449","","","0.0948","0.0965","","","","","","1.091","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216194","7.1757","0.0006","7.2196","0.0006","18.7629","0.0016","90","","90","","90","","972.02","0.14","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-(2-Pyridyl)piperazin-1-ium chloride","","- C9 H14 Cl N3 -","- C9 H14 Cl N3 -","- C36 H56 Cl4 N12 -","4","1","AT2451","Sadiq-ur-Rehman; Saeed, Sadia; Ali, Saqib; Shahzadi, Saira; Helliwell, Madeleine","4-(2-Pyridyl)piperazin-1-ium chloride","Acta Crystallographica Section E","2007","63","12","o4526","o4526","10.1107/S1600536807053470","","","0.71073","MoKα","","0.0322","0.0288","","","0.06","0.061","","","","","","0.958","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216195","10.6707","0.001","10.762","0.001","17.2223","0.0017","81.199","0.002","72.27","0.002","81.439","0.002","1850.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(1<i>H</i>-Benzotriazol-1-yl)-1-(4-fluorobenzoyl)ethyl nicotinate","","- C21 H15 F N4 O3 -","- C21 H15 F N4 O3 -","- C84 H60 F4 N16 O12 -","4","2","AT2452","Sai Bi; Hao Luo; Wu-Lan Zeng; Jun Wan","2-(1<i>H</i>-Benzotriazol-1-yl)-1-(4-fluorobenzoyl)ethyl nicotinate","Acta Crystallographica Section E","2007","63","12","o4594","o4594","10.1107/S1600536807054487","","","0.71073","MoKα","","0.1115","0.057","","","0.1165","0.1429","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216196","19.184","0.004","4.6066","0.001","21.734","0.005","90","","114.838","0.004","90","","1743","0.7","153","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4'-Bis[2-(benzylsulfanyl)phenylhydrazono]-2,2'-binaphthalene- 1,1'(4H,4'H)-dione","","- C46 H34 N4 O2 S2 -","- C46 H34 N4 O2 S2 -","- C92 H68 N8 O4 S4 -","2","0.5","AT2453","Biswas, Achintesh Narayan; Das, Purak; Neogi, Debatra Narayan; Bhawmick, Rupa; Bandyopadhyay, Pinaki","4,4'-Bis[2-(benzylsulfanyl)phenylhydrazono]-2,2'-binaphthalene-1,1'(4<i>H</i>,4'<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","12","o4554","o4554","10.1107/S1600536807054499","","","0.71073","MoKα","","0.1162","0.0652","","","0.1217","0.1388","","","","","","0.971","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216197","12.59","0.003","6.959","0.0014","16.32","0.003","90","","96.61","0.03","90","","1420.4","0.5","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(4-Methoxyphenyl)-6-phenylpyrimidin-2-amine","","- C17 H15 N3 O -","- C17 H15 N3 O -","- C68 H60 N12 O4 -","4","1","AT2455","Fang-Fang Jian; Jian-Hui Wang; Jing Zhang; Xiao-Yan Ren","4-(4-Methoxyphenyl)-6-phenylpyrimidin-2-amine","Acta Crystallographica Section E","2007","63","12","o4886","o4886","10.1107/S1600536807054530","","","0.71073","MoKα","","0.0973","0.0473","","","0.1152","0.1371","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216198","13.2344","0.0008","11.0471","0.0008","16.1466","0.0009","90","","90","","90","","2360.7","0.3","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(2E)-3-(5-Bromo-2-thienyl)-1-(4-hydroxyphenyl)prop-2-en-1-one","","- C13 H9 Br O2 S -","- C13 H9 Br O2 S -","- C104 H72 Br8 O16 S8 -","8","1","AT2456","Narayana, B.; Lakshmana, K.; Sarojini, B. K.; Yathirajan, H. S.; Bolte, Michael","(2<i>E</i>)-3-(5-Bromo-2-thienyl)-1-(4-hydroxyphenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","12","o4552","o4552","10.1107/S1600536807054359","","","0.71073","MoKα","","0.0368","0.0306","","","0.0636","0.0658","","","","","","1.074","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216199","17.4418","0.0008","10.5913","0.0006","15.7326","0.0008","90","","110.921","0.004","90","","2714.7","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Triacetonitrile(1,1,4,7,7-pentamethyldiethylenetriamine)nickel(II) bis(hexafluoridophosphate)","","- C15 H32 F12 N6 Ni P2 -","- C15 H32 F12 N6 Ni P2 -","- C60 H128 F48 N24 Ni4 P8 -","4","1","AT2457","Morawitz, Thorsten; Lerner, Hans-Wolfram; Bolte, Michael","Triacetonitrile(1,1,4,7,7-pentamethyldiethylenetriamine)nickel(II) bis(hexafluoridophosphate)","Acta Crystallographica, Section E","2007","63","12","o4551","o4551","10.1107/S1600536807054360","","","0.71073","MoKα","","0.0597","0.0483","","","0.1241","0.1303","","","","","","1.04","","","","has coordinates,has disorder","176787","2020-10-21","18:00:00",""
"2216200","6.8876","0.0004","7.4022","0.0004","9.4124","0.0005","70.654","0.004","72.438","0.005","65.019","0.005","403.01","0.04","200","2","200","2","","","","","","","","4","P -1","-P 1","2","2-Chloro-3-methylquinoxaline","2-Chloro-3-methylquinoxaline","","- C9 H7 Cl N2 -","- C9 H7 Cl N2 -","- C18 H14 Cl2 N4 -","2","1","AT2458","A. Thiruvalluvar; M. Subramanyam; R. J. Butcher; A. V. Adhikari; S. Wagle","2-Chloro-3-methylquinoxaline","Acta Crystallographica Section E","2007","63","12","o4534","o4534","10.1107/S1600536807054475","","","0.71073","MoKα","","0.0564","0.0439","","","0.1267","0.1348","","","","","","1.079","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216202","12.8891","0.0013","20.009","0.002","9.0073","0.0009","90","","94.734","0.002","90","","2315","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tris(morpholine-4-dithiocarboxylato-κ^2^<i>S</i>,<i>S</i>')antimony(III)","","- C15 H24 N3 O3 S6 Sb -","- C15 H24 N3 O3 S6 Sb -","- C60 H96 N12 O12 S24 Sb4 -","4","1","AT2460","Jun Zhai; Handong Yin; Daqi Wang","Tris(morpholine-4-dithiocarboxylato-κ^2^<i>S</i>,<i>S</i>')antimony(III)","Acta Crystallographica Section E","2007","63","12","m2989","m2989","10.1107/S1600536807056516","","","0.71073","MoKα","","0.0817","0.0442","","","0.0904","0.1113","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216203","13.834","0.003","11.661","0.002","9.988","0.002","90","","99.86","0.03","90","","1587.4","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[{2-[3-(dimethylamino)propyliminomethyl]-4- nitrophenolato}copper(II)]-μ-acetato]","","- C14 H19 Cu N3 O5 -","- C14 H19 Cu N3 O5 -","- C56 H76 Cu4 N12 O20 -","4","1","AT2461","Wen-Hui Li","<i>catena</i>-Poly[[{2-[3-(dimethylamino)propyliminomethyl]-4-nitrophenolato}copper(II)]-μ-acetato]","Acta Crystallographica Section E","2007","63","12","m2982","m2983","10.1107/S1600536807057376","","","0.71073","MoKα","","0.1462","0.0793","","","0.1554","0.1839","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216204","21.187","0.0018","17.1097","0.0014","13.4827","0.0011","90","","124.824","0.001","90","","4012.2","0.6","295","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Chlorido{1-[2-(ethylsulfonyl)phenyldiazenyl]-4-methoxy-2-naphthyl- κ^3^C,N,O}palladium(II) sesquihydrate","","- C19 H20 Cl N2 O4.5 Pd S -","- C19 H20 Cl N2 O4.5 Pd S -","- C152 H160 Cl8 N16 O36 Pd8 S8 -","8","1","AT2462","Chhetri, Satyadeep Singh; Biswas, Achintesh Narayan; Das, Purak; Saha, Abhisek; Bandyopadhyay, Pinaki","Chlorido{1-[2-(ethylsulfonyl)phenyldiazenyl]-4-methoxy-2-naphthyl-κ^3^<i>C</i>,<i>N</i>,<i>O</i>}palladium(II) sesquihydrate","Acta Crystallographica Section E","2007","63","12","m2973","m2974","10.1107/S1600536807054815","","","0.71073","MoKα","","0.0352","0.031","","","0.0802","0.0826","","","","","","1.08","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216205","13.2649","0.0009","17.0653","0.0009","7.9635","0.0005","90","","96.769","0.005","90","","1790.13","0.19","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Amino-4,5-dimethoxybenzonitrile","","- C9 H10 N2 O2 -","- C9 H10 N2 O2 -","- C72 H80 N16 O16 -","8","2","AT2463","Sarojini, B. K.; Narayana, B.; Mayekar, Anil N.; Yathirajan, H. S.; Bolte, Michael","2-Amino-4,5-dimethoxybenzonitrile","Acta Crystallographica Section E","2007","63","12","o4553","o4553","10.1107/S1600536807054827","","","0.71073","MoKα","","0.0443","0.036","","","0.0928","0.0971","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216206","9.9552","0.0018","9.7684","0.0012","5.7191","0.0007","90","","90","","90","","556.16","0.14","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Dimethylammonium nitrate","","- C2 H8 N2 O3 -","- C2 H8 N2 O3 -","- C8 H32 N8 O12 -","4","1","AT2464","Vitze, Hannes; Lerner, Hans-Wolfram; Bolte, Michael","Dimethylammonium nitrate","Acta Crystallographica Section E","2007","63","12","o4621","o4621","10.1107/S1600536807054839","","","0.71073","MoKα","","0.0427","0.0355","","","0.0847","0.0867","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216207","9.2494","0.0009","22.9431","0.0017","7.185","0.0006","90","","124.157","0.006","90","","1261.7","0.2","296","","296","","","","","","","","","5","C 1 c 1","C -2yc","9","3-(2-Bromoanilino)phthalide","3-(2-Bromoanilino)isobenzofuran-1(3<i>H</i>)-one","","- C14 H10 Br N O2 -","- C14 H10 Br N O2 -","- C56 H40 Br4 N4 O8 -","4","1","AT2466","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","3-(2-Bromoanilino)isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","12","o4668","o4668","10.1107/S1600536807056474","","","0.71073","MoKα","","0.029","0.0266","","","0.0571","0.0582","","","","","","1.114","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216210","10.7513","0.0005","13.2684","0.0007","13.221","0.0007","90","","93.89","0.001","90","","1881.66","0.17","273","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Ethoxy-3-(4-fluorophenyl)-4-oxo-5-phenyl-3,4-dihydro-5H- pyrrolo[3,2-d]pyrimidine-7-carbonitrile","","- C21 H15 F N4 O2 -","- C21 H15 F N4 O2 -","- C84 H60 F4 N16 O8 -","4","1","AT2469","Ping He; Xin-Min Peng; Gui-Hua Li","2-Ethoxy-3-(4-fluorophenyl)-4-oxo-5-phenyl-3,4-dihydro-5<i>H</i>-pyrrolo[3,2-<i>d</i>]pyrimidine-7-carbonitrile","Acta Crystallographica Section E","2007","63","12","o4884","o4884","10.1107/S1600536807060187","","","0.71073","MoKα","","0.1296","0.0595","","","0.1206","0.1408","","","","","","0.897","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216211","13.4351","0.0015","7.9688","0.0009","15.7183","0.0018","90","","104.133","0.001","90","","1631.9","0.3","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[diaquacobalt(II)]-μ-(<i>E</i>)-1,2-bis(4- pyridyl)ethylene-κ^2^<i>N</i>:<i>N</i>'] bis(4-aminobenzenesulfonate) hexahydrate]","","- C24 H38 Co N4 O14 S2 -","- C24 H38 Co N4 O14 S2 -","- C48 H76 Co2 N8 O28 S4 -","2","0.5","AT2470","Zhong-Xiang Du; Jun-Xia Li","<i>catena</i>-Poly[[[diaquacobalt(II)]-μ-(<i>E</i>)-1,2-bis(4-pyridyl)ethylene-κ^2^<i>N</i>:<i>N</i>'] bis(4-aminobenzenesulfonate) hexahydrate]","Acta Crystallographica Section E","2007","63","12","m3080","m3081","10.1107/S1600536807058461","","","0.71073","MoKα","","0.0642","0.0507","","","0.1409","0.155","","","","","","1.049","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216212","7.861","0.0016","22.579","0.005","12.012","0.002","90","","104.22","0.03","90","","2066.7","0.8","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Chloro-N^2^,N^4^-di-p-tolyl-1,3,5-triazine-2,4-diamine acetone solvate","","- C20 H22 Cl N5 O -","- C20 H22 Cl N5 O -","- C80 H88 Cl4 N20 O4 -","4","1","AT2472","Fang-Fang Jian; Yong-Xiang Wei; Li-Hua Huang; Xiao-Yan Ren","6-Chloro-<i>N</i>^2^,<i>N</i>^4^-di-<i>p</i>-tolyl-1,3,5-triazine-2,4-diamine acetone solvate","Acta Crystallographica Section E","2007","63","12","o4937","o4937","10.1107/S1600536807060151","","","0.71073","MoKα","","0.1724","0.0774","","","0.2148","0.3292","","","","","","1.063","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216213","16.059","0.002","10.631","0.0016","20.69","0.003","90","","90","","90","","3532.3","0.9","292","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Ethyl 2-[(Z)-4-isobutyl-5-oxo-2-(phenylimino)imidazolidin-1-yl]acetate","","- C17 H23 N3 O3 -","- C17 H23 N3 O3 -","- C136 H184 N24 O24 -","8","1","AT2473","Yong Sun; Hong-Xia Li; Ping He; Gui-hua Li","Ethyl 2-[(<i>Z</i>)-4-isobutyl-5-oxo-2-(phenylimino)imidazolidin-1-yl]acetate","Acta Crystallographica Section E","2007","63","12","o4768","o4768","10.1107/S1600536807058473","","","0.71073","MoKα","","0.1013","0.0691","","","0.179","0.1952","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216214","7.3269","0.0007","9.828","0.001","13.6139","0.0012","91.093","0.007","98.068","0.008","99.789","0.008","955.56","0.16","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","3-[4-(Methylsulfanyl)benzyl]-4-{(1E)-[4-(methylsulfanyl)phenyl]methyleneamino}- 4,5-dihydro-1H-1,2,4-triazole-5-thione","","- C18 H18 N4 S3 -","- C18 H18 N4 S3 -","- C36 H36 N8 S6 -","2","1","AT2474","Narayana, B.; Jagadeesh Prasad, D.; Sarojini, B. K.; Yathirajan, H.S.; Bolte, Michael","3-[4-(Methylsulfanyl)benzyl]-4-{(1<i>E</i>)-[4-(methylsulfanyl)phenyl]methyleneamino}-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione","Acta Crystallographica Section E","2007","63","12","o4705","o4706","10.1107/S1600536807056462","","","0.71073","MoKα","","0.0339","0.029","","","0.0751","0.0773","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216215","9.531","0.0019","14.174","0.003","20.849","0.004","86.93","0.03","86.54","0.03","84.92","0.03","2797.1","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Bis{[1-(quinolin-2-ylmethylenehydrazono)ethyl]-η^5^-cyclopentadienyl}iron(II)","","- C34 H28 Fe N6 -","- C34 H28 Fe N6 -","- C136 H112 Fe4 N24 -","4","2","AT2475","Zhou, Jing; Zheng, Lin-Ping; Chen, Chun-Ling; Li, Ming-Xue","Bis{[1-(quinolin-2-ylmethylenehydrazono)ethyl]-η^5^-cyclopentadienyl}iron(II)","Acta Crystallographica Section E","2007","63","12","m3079","m3079","10.1107/S1600536807058503","","","0.71073","MoKα","","0.0981","0.057","","","0.1505","0.1689","","","","","","1.077","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216216","14.0116","0.0013","6.182","0.0004","16.8726","0.0015","90","","97.14","0.007","90","","1450.2","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(Pyridin-2-yl)thiourea","","- C6 H7 N3 S -","- C6 H7 N3 S -","- C48 H56 N24 S8 -","8","2","AT2476","Tutughamiarso, Maya; Bolte, Michael","1-(Pyridin-2-yl)thiourea","Acta Crystallographica Section E","2007","63","12","o4682","o4682","10.1107/S1600536807057388","","","0.71073","MoKα","","0.042","0.0346","","","0.0875","0.091","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216218","7.0051","0.0014","9.7371","0.0019","11.201","0.002","112.88","0.03","95.63","0.03","100.18","0.03","681","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","<i>catena</i>-Poly[pentaaqua(μ~3~-5-carboxylato-2-oxidopyridinium-1-\ acetato)barium(II)]","","- C8 H15 Ba N O10 -","- C8 H15 Ba N O10 -","- C16 H30 Ba2 N2 O20 -","2","1","AT2479","Hong Lin; Yin-Hua He","<i>catena</i>-Poly[pentaaqua(μ~3~-5-carboxylato-2-oxidopyridinium-1-acetato)barium(II)]","Acta Crystallographica Section E","2007","63","12","m3204","m3205","10.1107/S1600536807058539","","","0.71073","MoKα","","0.017","0.0161","","","0.0415","0.042","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216219","7.6075","0.0004","14.9759","0.0007","6.8285","0.0003","90","","106.585","0.003","90","","745.6","0.06","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis[5-(1H-tetrazol-5-ylamino-κN^4^)-1H-tetrazolato-κN^1^]iron(II) dihydrate","","- C4 H12 Fe N18 O4 -","- C4 H12 Fe N18 O4 -","- C8 H24 Fe2 N36 O8 -","2","0.5","AT2481","Guan, Yang-Fan; Wang, Dong-Yao; Dong, Wen","Diaquabis[5-(1<i>H</i>-tetrazol-5-ylamino-κ<i>N</i>^4^)-1<i>H</i>-tetrazolato-κ<i>N</i>^1^]iron(II) dihydrate","Acta Crystallographica Section E","2007","63","12","m3150","m3150","10.1107/S1600536807058448","","","0.71073","MoKα","","0.0319","0.0253","","","0.0667","0.0704","","","","","","1.049","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216220","9.669","0.004","9.892","0.004","11.557","0.005","78.62","0.006","78.135","0.006","76.979","0.006","1040.6","0.8","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","4-[4-Amino-5-(4-pyridyl)-4H-1,2,4-triazol-3-yl]pyridinium 2,4,5-tricarboxybenzoate","","- C22 H16 N6 O8 -","- C22 H16 N6 O8 -","- C44 H32 N12 O16 -","2","1","AT2483","Jing-Jing Liu; Ming-Xing Li; Min Shao; Xiang He","4-[4-Amino-5-(4-pyridyl)-4<i>H</i>-1,2,4-triazol-3-yl]pyridinium 2,4,5-tricarboxybenzoate","Acta Crystallographica Section E","2007","63","12","o4883","o4883","10.1107/S1600536807059351","","","0.71073","MoKα","","0.0948","0.0708","","","0.1822","0.204","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216222","7.1717","0.0008","7.7","0.0015","18.901","0.006","85.88","0.02","83.518","0.015","77.656","0.012","1011.9","0.4","296","","296","","","","","","","","","4","P -1","-P 1","2","","3-(2-Chlorophenyl)-1,5-bis(4-chlorophenyl)pentane-1,5-dione","","- C23 H17 Cl3 O2 -","- C23 H17 Cl3 O2 -","- C46 H34 Cl6 O4 -","2","1","AT2485","Jasinski, Jerry P.; Butcher, Ray J.; Yathirajan, H. S.; Narayana, B.; Swamy, M.T.","3-(2-Chlorophenyl)-1,5-bis(4-chlorophenyl)pentane-1,5-dione","Acta Crystallographica Section E","2007","63","12","o4808","o4809","10.1107/S1600536807059089","","","0.71073","MoKα","","0.0975","0.0408","","","0.1013","0.1183","","","","","","0.931","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216223","11.128","0.002","6.682","0.001","11.311","0.002","90","","98.375","0.015","90","","832.1","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Ethyl-4-methylpiperidine-2,6-dione","","- C8 H13 N O2 -","- C8 H13 N O2 -","- C32 H52 N4 O8 -","4","1","AT2486","Tutughamiarso, Maya; Bolte, Michael","4-Ethyl-4-methylpiperidine-2,6-dione","Acta Crystallographica Section E","2007","63","12","o4743","o4743","10.1107/S1600536807058436","","","0.71073","MoKα","","0.0778","0.0558","","","0.143","0.1566","","","","","","1.04","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216224","10.1782","0.001","12.4456","0.0008","7.1922","0.0008","90","","96.08","0.009","90","","905.94","0.15","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dimethyl 3,4-dihydroxy-1<i>H</i>-pyrrole-2,5-dicarboxylate","","- C8 H9 N O6 -","- C8 H9 N O6 -","- C32 H36 N4 O24 -","4","1","AT2487","Tutughamiarso, Maya; Bolte, Michael","Dimethyl 3,4-dihydroxy-1<i>H</i>-pyrrole-2,5-dicarboxylate","Acta Crystallographica Section E","2007","63","12","o4742","o4742","10.1107/S1600536807058424","","","0.71073","MoKα","","0.0479","0.0392","","","0.1022","0.108","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216225","12.034","0.002","9.1824","0.0016","16.416","0.002","90","","113.532","0.01","90","","1663.1","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-Fumarato-κ^4^<i>O</i>,<i>O</i>';<i>O</i>'',<i>O</i>'''-bis[aqua(2,9- dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>)(nitrato- κ^2^O,O')manganese(II)]","","- C32 H30 Mn2 N6 O12 -","- C32 H30 Mn2 N6 O12 -","- C64 H60 Mn4 N12 O24 -","2","0.5","AT2488","Lin Li; Hui Zhang; Mei-Ling Zhang; Sai Bi","μ-Fumarato-κ^4^<i>O</i>,<i>O</i>';<i>O</i>'',<i>O</i>'''-bis[aqua(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>)(nitrato-κ^2^<i>O</i>,<i>O</i>')manganese(II)]","Acta Crystallographica Section E","2007","63","12","m3096","m3096","10.1107/S1600536807059090","","","0.71073","MoKα","","0.0465","0.0432","","","0.1302","0.1343","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216226","19.172","0.007","5.884","0.002","10.273","0.004","90","","97.309","0.007","90","","1149.5","0.7","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-<i>N</i>'-[(5-Methylthiophen-2-yl)methylene]isonicotinohydrazide","","- C12 H11 N3 O S -","- C12 H11 N3 O S -","- C48 H44 N12 O4 S4 -","4","1","AT2489","Wang, Chang-Lu; Zhang, Zhen-Heng; Jing, Zuo-Liang","(<i>E</i>)-<i>N</i>'-[(5-Methylthiophen-2-yl)methylene]isonicotinohydrazide","Acta Crystallographica Section E","2007","63","12","o4825","o4825","10.1107/S1600536807059363","","","0.71073","MoKα","","0.0753","0.0428","","","0.0981","0.1152","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216227","7.2854","0.0012","25.711","0.002","6.478","0.0011","90","","102.613","0.002","90","","1184.1","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>^2^,<i>N</i>^2'^-Bis(2-hydroxy-3- methoxybenzylidene)terephthalohydrazide dihydrate","","- C24 H26 N4 O8 -","- C24 H26 N4 O8 -","- C48 H52 N8 O16 -","2","0.5","AT2490","Yanling Qiao; Handong Yin; Jichun Cui","<i>N</i>^2^,<i>N</i>^2'^-Bis(2-hydroxy-3-methoxybenzylidene)terephthalohydrazide dihydrate","Acta Crystallographica Section E","2007","63","12","o4819","o4819","10.1107/S1600536807059375","","","0.71073","MoKα","","0.137","0.055","","","0.1084","0.1332","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216228","37.091","0.006","7.5543","0.0012","11.6123","0.0018","90","","99.874","0.002","90","","3205.5","0.9","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5,5'-Dimethyl-N,N'-(iminodiethylene)di-1<i>H</i>-pyrazole-3-carboxamide","","- C14 H21 N7 O2 -","- C14 H21 N7 O2 -","- C112 H168 N56 O16 -","8","1","AT2491","Jing Hu; Guofeng Chen; Guochun Ma; Hongguang Song","5,5'-Dimethyl-<i>N</i>,<i>N</i>'-(iminodiethylene)bis(1<i>H</i>-pyrazole-3-carboxamide)","Acta Crystallographica Section E","2007","63","12","o4806","o4806","10.1107/S1600536807059387","","","0.71073","MoKα","","0.0641","0.0412","","","0.1027","0.1169","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216229","7.1273","0.0005","8.7534","0.0007","12.8912","0.001","90","","99.516","0.006","90","","793.19","0.11","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-Bis(4-nitrophenoxy)butane","","- C16 H16 N2 O6 -","- C16 H16 N2 O6 -","- C32 H32 N4 O12 -","2","0.5","AT2492","Qi-Long Zhang; You-Cai Zhao; Yun-Qian Zhang; Sai-Feng Xue; Zhu Tao","1,4-Bis(4-nitrophenoxy)butane","Acta Crystallographica Section E","2007","63","12","o4885","o4885","10.1107/S1600536807060114","","","0.71073","MoKα","","0.0616","0.0445","","","0.1252","0.1337","","","","","","1.088","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216230","7.383","0.0015","7.5819","0.0015","10.712","0.002","96.9","0.03","94.62","0.03","116","0.03","529","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tetraaquabis[4-(tetrazol-1-yl)benzoato-κN^4^]nickel(II) dihydrate","","- C16 H22 N8 Ni O10 -","- C16 H22 N8 Ni O10 -","- C16 H22 N8 Ni O10 -","1","0.5","AT2494","Zhang, Shu-Ming; Du, Jian-Long","Tetraaquabis[4-(tetrazol-1-yl)benzoato-κ<i>N</i>^4^]nickel(II) dihydrate","Acta Crystallographica Section E","2007","63","12","m3139","m3139","10.1107/S1600536807060138","","","0.71073","MoKα","","0.0369","0.0314","","","0.0664","0.0683","","","","","","1.139","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216231","13.4393","0.0011","8.9757","0.0007","18.8114","0.0015","90","","95.033","0.001","90","","2260.4","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Chloro-2-[1-(5-chloro-2-hydroxybenzyl)-1<i>H</i>-benzimidazol-2-yl]phenol","","- C20 H14 Cl2 N2 O2 -","- C20 H14 Cl2 N2 O2 -","- C80 H56 Cl8 N8 O8 -","4","1","AT2495","Fang, Xiao-Niu; Liu, Li-Min; Huang, Gan-Sheng; Hu, Ping","4-Chloro-2-[1-(5-chloro-2-hydroxybenzyl)-1<i>H</i>-benzimidazol-2-yl]phenol","Acta Crystallographica Section E","2007","63","12","o4881","o4881","10.1107/S160053680706014X","","","0.71073","MoKα","","0.1144","0.0665","","","0.1891","0.2109","","","","","","1.002","","","","has coordinates,has disorder,has Fobs","201974","2020-10-21","18:00:00",""
"2216234","6.8035","0.0007","12.8775","0.0014","17.8597","0.0018","90","","94.909","0.003","90","","1559","0.3","113","2","113","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Benzyl oleanolate","","- C37 H54 O3 -","- C37 H54 O3 -","- C74 H108 O6 -","2","1","AT2498","Jun-Yi Hu; Ying-Qian Xu; Yong Ju","Benzyl oleanolate","Acta Crystallographica Section E","2007","63","12","o4882","o4882","10.1107/S1600536807060655","","","0.7107","MoKα","","0.05","0.0447","","","0.0973","0.1001","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216235","8.6097","0.0014","13.75","0.002","21.113","0.003","90","","90","","90","","2499.4","0.7","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","{6,6'-diethoxy-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato-\ 1κ^4^O^1^,O^1^',O^6^,O^6^':2κ^4^O^1^,N,N'O^1^'}trinitrato-1κ^6^O,O'-\ samarium(III)nickel(II)","","- C20 H22 N5 Ni O13 Sm -","- C20 H22 N5 Ni O13 Sm -","- C80 H88 N20 Ni4 O52 Sm4 -","4","1","AT2499","Hu, Rong-Hua; Sui, Yan; Chen, Li; Xie, Guo-Wei; Ai, Yan-Li","{μ-6,6'-Diethoxy-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}trinitratosamarium(III)nickel(II)","Acta Crystallographica Section E","2007","63","12","m3191","m3192","10.1107/S1600536807061508","","","0.71073","MoKα","","0.1089","0.045","","","0.0779","0.0841","","","","","","0.995","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216236","6.0901","0.0003","32.3775","0.0018","11.5057","0.0006","90","","96.741","0.004","90","","2253","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Diphenylphosphane selenide","","- C12 H11 P Se -","- C12 H11 P Se -","- C96 H88 P8 Se8 -","8","2","AT2507","Dornhaus, Franz; Lerner, Hans-Wolfram; Bolte, Michael","Diphenylphosphane selenide","Acta Crystallographica Section E","2007","63","12","o4917","o4917","10.1107/S1600536807062575","","","0.71073","MoKα","","0.0488","0.041","","","0.1028","0.1073","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216237","13.26","0.001","15.317","0.0011","13.266","0.001","90","0.001","94.936","0.001","90","0.001","2684.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tetrakis[μ~3~-2-(5-hydroxy-2-oxidobenzylideneamino)-2- methylpropanolato]tetracopper(II) methanol tetrasolvate","","- C48 H68 Cu4 N4 O16 -","- C48 H68 Cu4 N4 O16 -","- C96 H136 Cu8 N8 O32 -","2","0.5","AV3116","Zhang, Mei-Shan; Jin, Jing-Yi; Wu, Xue; Shao, Kui-Zhan; Su, Zhong-Min","A tetranuclear copper(II) complex constructed from the salen ligand with alkoxo groups","Acta Crystallographica Section E","2007","63","12","m2932","m2932","10.1107/S1600536807050891","","","0.71069","MoKα","","0.0543","0.0349","","","0.081","0.0894","","","","","","1.014","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216238","19.165","0.004","6.4232","0.0013","23.093","0.005","90","","96.19","0.03","90","","2826.2","1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","<i>N</i>-[Phenyl(piperidin-1-yl)methyl]-1,3,4-thiadiazol-2-amine","","- C14 H18 N4 S -","- C14 H18 N4 S -","- C112 H144 N32 S8 -","8","1","AV3121","Liu, Juan; Deng, Yu-Heng; Li, Pei-Zhou; Jin, Qiong-Hua","<i>N</i>-[Phenyl(piperidin-1-yl)methyl]-1,3,4-thiadiazol-2-amine","Acta Crystallographica Section E","2007","63","12","o4849","o4849","10.1107/S1600536807059107","","","0.71073","MoKα","","0.0836","0.0533","","","0.1105","0.1226","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216239","16.6215","0.0006","6.652","0.0002","11.5581","0.0005","90","","90","","90","","1277.94","0.08","173","2","173","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","Methyl 4-[(1-methylcyclopent-3-en-1-yl)carbonyl]benzoate","","- C15 H16 O3 -","- C15 H16 O3 -","- C60 H64 O12 -","4","0.5","BG2118","Yang, Chao; Xia, Wujiong; Zhang, Xiao; Li, Bing; Gou, Baoquan","Methyl 4-[(1-methylcyclopent-3-en-1-yl)carbonyl]benzoate","Acta Crystallographica Section E","2007","63","12","o4729","o4729","10.1107/S1600536807052658","","","0.71073","MoKα","","0.0543","0.0407","","","0.1075","0.1156","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216240","7.503","0.002","28.45","0.002","5.03","0.004","90","","93.572","0.002","90","","1071.6","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-Bis{[2-(pyridin-2-yl)-1H-imidazol-1-yl]methyl}benzene dihydrate","","- C24 H24 N6 O2 -","- C24 H24 N6 O2 -","- C48 H48 N12 O4 -","2","0.5","BG2122","Rui-Hai Cui; Ya-Qian Lan","1,4-Bis{[2-(pyridin-2-yl)-1<i>H</i>-imidazol-1-yl]methyl}benzene dihydrate","Acta Crystallographica Section E","2007","63","12","o4515","o4515","10.1107/S1600536807054104","","","0.71069","MoKα","","0.0798","0.0403","","","0.0903","0.0978","","","","","","0.975","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216241","10.9405","0.0014","28.75","0.004","7.967","0.001","90","","119.142","0.001","90","","2188.7","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaqua(2,9-dimethyl-1,10-phenanthroline-κ^2^N,N')(3-hydroxybenzoato- κ^2^O,O')cobalt(II) nitrate","","- C21 H20 Co N3 O8 -","- C21 H20 Co N3 O8 -","- C84 H80 Co4 N12 O32 -","4","0.5","BG2125","Xuan, Xiao-peng; Zhao, Pei-zheng","Diaqua(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(3-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>')cobalt(II) nitrate","Acta Crystallographica Section E","2007","63","12","m3009","m3009","10.1107/S1600536807057509","","","0.71073","MoKα","","0.0351","0.0321","","","0.0989","0.1023","","","","","","1.018","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216242","12.3214","0.0016","6.1103","0.0008","14.1971","0.0019","90","","104.527","0.003","90","","1034.7","0.2","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-Acetyl-4-hydroxyphenyl acrylate","","- C11 H10 O4 -","- C11 H10 O4 -","- C44 H40 O16 -","4","1","BG2126","G. Chakkaravarthi; A. Anthonysamy; S. Balasubramanian; V. Manivannan","3-Acetyl-4-hydroxyphenyl acrylate","Acta Crystallographica Section E","2007","63","12","o4725","o4725","10.1107/S1600536807057492","","","0.71073","MoKα","","0.0791","0.049","","","0.1287","0.1496","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216243","5.09","0.0003","5.4159","0.0003","10.1413","0.0006","97.959","0.002","90.397","0.002","92.271","0.002","276.63","0.03","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>,<i>N</i>'-(p-Phenylene)bis(2,2,2-trifluoroacetamide)","","- C10 H6 F6 N2 O2 -","- C10 H6 F6 N2 O2 -","- C10 H6 F6 N2 O2 -","1","0.5","BG2127","Lin Huang; Huisheng Li","<i>N</i>,<i>N</i>'-(<i>p</i>-Phenylene)bis(2,2,2-trifluoroacetamide)","Acta Crystallographica Section E","2007","63","12","o4657","o4657","10.1107/S1600536807056723","","","0.71073","MoKα","","0.0435","0.0406","","","0.0995","0.1015","","","","","","1.084","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216244","11.0919","0.0015","13.587","0.002","17.329","0.003","90","","90","","90","","2611.6","0.7","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","verruculogen","10,10a-dihydroxy-7-methoxy-2,2-dimethyl-5-(2-methylprop-1-en-1-yl)- 1,10,10a,14,14a,15b-hexahydro-5H,12<i>H</i>-3,4-dioxa-5a,11a,15a- triazacyclooct[lm]indeno[5,6-<i>b</i>]fluorene-11,15(2<i>H</i>,13H)-dione","","- C27 H33 N3 O7 -","- C27 H33 N3 O7 -","- C108 H132 N12 O28 -","4","1","BG2129","Fang, Yu-Chun; Wang, Wen-Liang; Sun, Wei; Gu, Qian-Qun; Zhu, Wei-Ming","10,10a-Dihydroxy-7-methoxy-2,2-dimethyl-5-(2-methylprop-1-en-1-yl)-1,10,10a,14,14a,15b-hexahydro-5<i>H</i>,12<i>H</i>-3,4-dioxa-5a,11a,15a-triazacyclooct[<i>lm</i>]indeno[5,6-<i>b</i>]fluorene-11,15(2<i>H</i>,13<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","12","o4788","o4788","10.1107/S160053680705828X","","","0.71073","MoKα","","0.0883","0.0382","","","0.0787","0.1024","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216245","12.502","0.0009","13.049","0.0009","19.198","0.0013","90","","90","","90","","3131.9","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(4,4'-Dimethyl-2,2'-bipyridine-κ^2^N,N')bis[2-(2-pyridyl)phenyl- κ^2^N,C]iridium(III) hexafluoridophosphate","","- C34 H28 F6 Ir N4 P -","- C34 H28 F6 Ir N4 P -","- C136 H112 F24 Ir4 N16 P4 -","4","1","BG2132","Li-Ping Han; Bin Li; Jun Ying","(4,4'-Dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')bis[2-(2-pyridyl)phenyl-κ^2^<i>N</i>,<i>C</i>^1^]iridium(III) hexafluoridophosphate","Acta Crystallographica Section E","2007","63","12","m3133","m3133","10.1107/S1600536807059314","","","0.71069","MoKα","","0.0299","0.0277","","","0.0665","0.0672","","","","","","1.004","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216246","9.816","0.0009","10.911","0.0009","14.4422","0.0013","83.279","0.002","70.934","0.002","89.364","0.002","1451.3","0.2","213","1","213","1","","","","","","","","4","P -1","-P 1","2","","1,3,5-Tris(bromomethyl)-2,4,6-tris(2-methoxycarbonyl-2-methylpropyl)benzene","","- C27 H39 Br3 O6 -","- C27 H39 Br3 O6 -","- C54 H78 Br6 O12 -","2","1","BG2134","Pierre Baillargeon; Yves Dory; Andreas Decken","1,3,5-Tris(bromomethyl)-2,4,6-tris(2-methoxycarbonyl-2-methylpropyl)benzene","Acta Crystallographica Section E","2007","63","12","o4905","o4905","10.1107/S1600536807060072","","","0.71073","MoKα","","0.0321","0.0262","","","0.067","0.0688","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216247","9.348","0.002","12.361","0.003","23.184","0.006","90","","90","","90","","2678.9","1.1","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-(2-Pyridylsulfanyl)-<i>N</i>-<i>p</i>-tolylacetamide","","- C14 H14 N2 O S -","- C14 H14 N2 O S -","- C112 H112 N16 O8 S8 -","8","1","BG2139","Yan Gao; Dong Liang; Li-Xing Gao; Guang-Jun Fang; Wei Wang","2-(2-Pyridylsulfanyl)-<i>N</i>-<i>p</i>-tolylacetamide","Acta Crystallographica Section E","2007","63","12","o4854","o4854","10.1107/S160053680706045X","","","0.71073","MoKα","","0.0823","0.045","","","0.1056","0.1299","","","","","","1.007","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216248","9.7612","0.0016","10.3405","0.0017","12.309","0.002","107.354","0.013","109.709","0.013","100.096","0.012","1062.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 6-ethoxy-10-(3-methoxypropyl)-9-methyl-11-thioxo-8-oxa-10,12- diazatricyclo[7.3.1.0^2,7^]trideca-2,4,6-triene-13-carboxylate","","- C20 H28 N2 O5 S -","- C20 H28 N2 O5 S -","- C40 H56 N4 O10 S2 -","2","1","BG2144","Konovalova, I. S.; Zaremba, O. V.; Kovalenko, S. S.; Chernykh, V. P.; Kovalenko, S. M.; Baumer, V. N.; Shishkin, O. V.","Ethyl 6-ethoxy-10-(3-methoxypropyl)-9-methyl-11-thioxo-8-oxa-10,12-diazatricyclo[7.3.1.0^2,7^]trideca-2,4,6-triene-13-carboxylate","Acta Crystallographica Section E","2007","63","12","o4906","o4906","10.1107/S1600536807061247","","","0.71073","MoKα","","0.1161","0.0376","","","0.0575","0.0663","","","","","","0.892","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216249","6.851","0.0012","10.3094","0.0017","10.7294","0.0018","105.174","0.003","92.224","0.003","92.896","0.003","729.4","0.2","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","(2,9-Dimethoxy-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nitratosilver(I)","","- C14 H12 Ag N3 O5 -","- C14 H12 Ag N3 O5 -","- C28 H24 Ag2 N6 O10 -","2","1","BH2139","Wan, Xin-Sheng; Zhang, Hai-Yan; Niu, Cao-Yuan; Kou, Chun-Hong; Feng, Cao-Ling","(2,9-Dimethoxy-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')nitratosilver(I)","Acta Crystallographica Section E","2007","63","12","m2951","m2951","10.1107/S1600536807055146","","","0.71073","MoKα","","0.0506","0.0433","","","0.1146","0.1221","","","","","","1.071","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216250","6.197","0.0003","10.072","0.0005","11.816","0.0007","78.098","0.004","76.452","0.004","78.903","0.003","693.47","0.06","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","1-(3,4-Dichlorobenzoyl)ferrocene","","- C17 H12 Cl2 Fe O -","- C17 H12 Cl2 Fe O -","- C34 H24 Cl4 Fe2 O2 -","2","1","BH2140","Erben, Milan; Růžička, Aleš; Vinklárek, Jaromír; Šťáva, Vít; Veselý, David","1-(3,4-Dichlorobenzoyl)ferrocene","Acta Crystallographica Section E","2007","63","12","m3067","m3067","10.1107/S1600536807053391","","","0.71073","MoKα","","0.0516","0.0424","","","0.0958","0.1015","","","","","","1.152","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216251","7.569","0.001","8.498","0.001","8.892","0.001","100.78","0.01","93.64","0.01","91.56","0.01","560.27","0.12","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2-Carboxy-1-naphthyl acetate","","- C13 H10 O4 -","- C13 H10 O4 -","- C26 H20 O8 -","2","1","BH2141","Souza, Bruno S.; Bortoluzzi, Adailton J.; Nome, Faruk","2-Carboxy-1-naphthyl acetate","Acta Crystallographica Section E","2007","63","12","o4523","o4523","10.1107/S1600536807053433","","","0.71073","MoKα","","0.0585","0.0378","","","0.1034","0.1155","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216252","28.708","0.004","7.9756","0.0011","15.305","0.002","90","","121.576","0.002","90","","2985.5","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(ferrocene-1,1'-diacetyl-carbohydrazide) dihydrate","","- C30 H36 Fe2 N8 O4 -","- C30 H36 Fe2 N8 O4 -","- C120 H144 Fe8 N32 O16 -","4","0.5","BH2142","Zhou, Jing; Zhou, Hui; Chen, Chun-Ling; Li, Ming-Xue","1,5:1',5'-Bis[1,1'-(ferrocene-1,1'-diyl)diethylidyne]dicarbonohydrazide dihydrate","Acta Crystallographica Section E","2007","63","12","m2961","m2961","10.1107/S1600536807055407","","","0.71073","MoKα","","0.0642","0.0406","","","0.0717","0.0759","","","","","","0.807","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216253","10.819","0.004","12.019","0.005","12.968","0.006","76.75","0.03","87.91","0.03","80.37","0.02","1618.3","1.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","aqua[1-cyclopropyl-7-(4-ethylpiperazin-1-yl)-6-fluoro-4-oxo-1,4- dihydroquinoline-3-carboxylato](1,10-phenanthroline)copper(II) nitrate dihydrate","","- C31 H35 Cu F N6 O9 -","- C31 H35 Cu F N6 O9 -","- C62 H70 Cu2 F2 N12 O18 -","2","1","BH2143","Recillas-Mota, Jesús; Flores-Alamo, Marcos; Moreno-Esparza, Rafael; Gracia-Mora, Jesús","A copper(II) complex of 1,10-phenanthroline and enrofloxacin","Acta Crystallographica Section E","2007","63","12","m3030","m3031","10.1107/S1600536807057649","","","0.71073","MoKα","","0.1403","0.0612","","","0.1011","0.1288","","","","","","1.028","","","","has coordinates,has Fobs","278247","2022-09-28","15:09:33",""
"2216254","14.156","0.004","6.2251","0.0017","16.295","0.005","90","","112.821","0.005","90","","1323.6","0.7","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>N</i>,4-Dimethyl-<i>N</i>-phenylbenzenesulfonamide","","- C14 H15 N O2 S -","- C14 H15 N O2 S -","- C56 H60 N4 O8 S4 -","4","1","BH2144","Zhou, Bin; Zheng, Peng-Wu","<i>N</i>,4-Dimethyl-<i>N</i>-phenylbenzenesulfonamide","Acta Crystallographica Section E","2007","63","12","o4727","o4727","10.1107/S1600536807057650","","","0.71073","MoKα","","0.0618","0.0427","","","0.1077","0.1208","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216255","31.662","0.003","10.8291","0.001","27.381","0.004","90","","123.53","0.001","90","","7825.9","1.5","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(2,9-Dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bis(3- hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>')lead(II)‒2,9-dimethyl-1,10- phenanthroline‒water (1/1/3)","","- C42 H40 N4 O9 Pb -","- C42 H40 N4 O9 Pb -","- C336 H320 N32 O72 Pb8 -","8","1","BH2147","Zhao, Pei-Zheng; Xuan, Xiao-Peng","(2,9-Dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bis(3-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>')lead(II)‒2,9-dimethyl-1,10-phenanthroline‒water (1/1/3)","Acta Crystallographica Section E","2007","63","12","m3179","m3179","10.1107/S1600536807061065","","","0.71073","MoKα","","0.0277","0.0197","","","0.0443","0.0474","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216256","15.908","0.0012","18.4137","0.0014","15.4744","0.0011","90","","115.585","0.001","90","","4088.4","0.5","297","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(2,9-dimethyl-1,10-phenanthroline-κ^2^N,N')bis(4-hydroxybenzoato)- κO,κ^2^O,O'-manganese(II)‒2,9-dimethyl-1,10-phenanthroline‒ethanol‒water (1/1/1/1)","","- C44 H44 Mn N4 O9 -","- C44 H44 Mn N4 O9 -","- C176 H176 Mn4 N16 O36 -","4","1","BH2148","Xuan, Xiao-peng; Zhao, Pei-zheng","Aqua(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bis(4-hydroxybenzoato)-κ<i>O</i>,κ^2^<i>O</i>,<i>O</i>'-manganese(II)‒2,9-dimethyl-1,10-phenanthroline‒ethanol‒water (1/1/1/1)","Acta Crystallographica Section E","2007","63","12","m3180","m3181","10.1107/S1600536807061077","","","0.71073","MoKαradiation","","0.0607","0.0417","","","0.1122","0.1281","","","","","","1.03","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216257","7.6782","0.0012","14.844","0.002","11.2565","0.0016","90","","96.348","0.002","90","","1275.1","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(3,5-Dimethyl-1<i>H</i>-pyrazol-1-yl)phthalazin-1(2<i>H</i>)-one monohydrate","","- C13 H14 N4 O2 -","- C13 H14 N4 O2 -","- C52 H56 N16 O8 -","4","1","BI2237","Zhao Kai; Yin, Xian-Hong; Feng Yu; Zhu Jie","4-(3,5-Dimethyl-1<i>H</i>-pyrazol-1-yl)phthalazin-1(2<i>H</i>)-one monohydrate","Acta Crystallographica Section E","2007","63","12","o4618","o4618","10.1107/S1600536807048313","","","0.71073","MoKα","","0.0864","0.048","","","0.1151","0.1448","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216258","4.7646","0.0006","25.075","0.003","11.942","0.0012","90","","111.081","0.004","90","","1331.3","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-<i>N</i>'-(2,4-Dichlorobenzylidene)nicotinohydrazide","","- C13 H9 Cl2 N3 O -","- C13 H9 Cl2 N3 O -","- C52 H36 Cl8 N12 O4 -","4","1","BI2245","Qiu, Xiao-Yang","(<i>E</i>)-<i>N</i>'-(2,4-Dichlorobenzylidene)nicotinohydrazide","Acta Crystallographica Section E","2007","63","12","o4524","o4524","10.1107/S1600536807053147","","","0.71073","MoKα","","0.0946","0.0467","","","0.1102","0.127","","","","","","0.85","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216259","10.4738","0.0017","10.5498","0.0015","12.94","0.002","72.322","0.006","78.691","0.007","87.622","0.006","1335.6","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","K2[Cu(opo)](H2O)3","Dipotassium [N,N'-(propane-1,3-diyl)dioxamato-κ^4^O,N,N',O']copper(II) trihydrate","","- C7 H12 Cu K2 N2 O9 -","- C7 H12 Cu K2 N2 O9 -","- C28 H48 Cu4 K8 N8 O36 -","4","2","BI2246","Price, Daniel J.; Martinez-Belmonte, Marta","Dipotassium [<i>N</i>,<i>N</i>'-(propane-1,3-diyl)dioxamato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>']copper(II) trihydrate: redetermination at 100 K","Acta Crystallographica Section E","2007","63","12","m3158","m3158","10.1107/S1600536807060837","","","0.71073","MoKα","","0.0423","0.0321","","","0.0785","0.0835","","","","","","1.05","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216260","6.8404","0.0011","12.2627","0.0019","14.156","0.002","90","","101.044","0.002","90","","1165.4","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,6-Dichloro-N-phenylpicolinamide","","- C12 H8 Cl2 N2 O -","- C12 H8 Cl2 N2 O -","- C48 H32 Cl8 N8 O4 -","4","1","BI2247","Xian-Hong Yin; Kai Zhao; Yu Feng; Jie Zhu","3,6-Dichloro-<i>N</i>-phenylpicolinamide","Acta Crystallographica Section E","2007","63","12","o4617","o4617","10.1107/S1600536807055936","","","0.71073","MoKα","","0.0726","0.0371","","","0.0777","0.0999","","","","","","1.083","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216261","21.687","0.003","8.3203","0.0011","13.8618","0.0017","90","","124.528","0.002","90","","2060.7","0.5","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","<i>N</i>,<i>N'</i>-Bis[2-(quinolin-8-yloxy)acetoyl]hydrazine dihydrate","","- C22 H22 N4 O6 -","- C22 H22 N4 O6 -","- C88 H88 N16 O24 -","4","0.5","BI2254","Ze-Bao Zheng; Ren-Tao Wu; Ji-Kun Li; Yi-Feng Sun","<i>N</i>,<i>N</i>'-Bis[2-(quinolin-8-yloxy)acetoyl]hydrazine dihydrate","Acta Crystallographica Section E","2007","63","12","o4658","o4658","10.1107/S160053680705667X","","","0.71073","MoKα","","0.063","0.0392","","","0.0773","0.088","","","","","","1.003","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216263","7.999","0.006","6.794","0.005","22.442","0.017","90","","95.819","0.012","90","","1213.3","1.6","290","2","290","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6-Bromo-3-(dibromoacetyl)-2<i>H</i>-chromen-2-one","","- C11 H5 Br3 O3 -","- C11 H5 Br3 O3 -","- C44 H20 Br12 O12 -","4","1","BI2256","Deepak Chopra; K. N. Venugopala; G. K. Rao","6-Bromo-3-(dibromoacetyl)-2<i>H</i>-chromen-2-one","Acta Crystallographica Section E","2007","63","12","o4872","o4872","10.1107/S1600536807060886","","","0.71073","MoKα","","0.1133","0.0676","","","0.1509","0.1731","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216264","8.8398","0.0018","19.308","0.004","9.7463","0.0019","90","","103.8","0.03","90","","1615.5","0.6","78","2","78","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Hydroxy-<i>N</i>'-(phenylacetyl)naphthalene-2-carbohydrazide","","- C19 H16 N2 O3 -","- C19 H16 N2 O3 -","- C76 H64 N8 O12 -","4","1","BQ2037","Ke-Wei Lei; Hai-Mei Feng","3-Hydroxy-<i>N</i>'-(phenylacetyl)naphthalene-2-carbohydrazide","Acta Crystallographica Section E","2007","63","12","o4769","o4769","10.1107/S1600536807058199","","","0.71073","MoKα","","0.0706","0.0573","","","0.1704","0.1835","","","","","","1.076","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216265","6.525","0.003","10.249","0.005","11.589","0.005","78.093","0.007","87.915","0.007","88.072","0.007","757.6","0.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","N-(3-Iodophenyl)-N'-(2-methylbenzoyl)thiourea","","- C15 H13 I N2 O S -","- C15 H13 I N2 O S -","- C30 H26 I2 N4 O2 S2 -","2","1","BQ2043","Yusof, M. Sukeri M.; Ahmad Mushtari, Nurwahyuni; Yamin, Bohari M.","<i>N</i>-(3-Iodophenyl)-<i>N</i>'-(2-methylbenzoyl)thiourea","Acta Crystallographica Section E","2007","63","12","o4709","o4709","10.1107/S1600536807057194","","","0.71073","MoKα","","0.0314","0.026","","","0.0592","0.0617","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216266","5.263","0.0002","35.631","0.002","9.0145","0.0003","90","","91.651","0.004","90","","1689.75","0.13","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","pyrazole","1-Acetyl-3-[4-(methylsulfanyl)phenyl]-5-(4-nitrophenyl)-4,5-dihydro-1H-pyrazole","","- C18 H17 N3 O3 S -","- C18 H17 N3 O3 S -","- C72 H68 N12 O12 S4 -","4","1","BQ2044","A. Thiruvalluvar; M. Subramanyam; R. J. Butcher; M. Mahalinga","1-Acetyl-3-[4-(methylsulfanyl)phenyl]-5-(4-nitrophenyl)-4,5-dihydro-1<i>H</i>-pyrazole","Acta Crystallographica Section E","2007","63","12","o4770","o4770","10.1107/S1600536807058205","","","0.71073","MoKα","","0.1174","0.0706","","","0.1308","0.1414","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216267","13.466","0.003","6.6966","0.0015","18.183","0.004","90","","101.875","0.003","90","","1604.6","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Diholmium(III) disulfate tetrahydrate","Poly[tetraaquatri-μ~2~-sulfato-diholmium(III)]","","- H16 Ho2 O20 S3 -","- H16 Ho2 O20 S3 -","- H64 Ho8 O80 S12 -","4","0.5","BR2059","Wanli Zhou; Shahua Ding; Xin Xu; Yan Xu","Diholmium(III) trisulfate tetrahydrate","Acta Crystallographica Section E","2007","63","12","i194","i194","10.1107/S1600536807056346","","","0.71073","MoKα","","0.0493","0.0465","","","0.1251","0.1295","","","","","","1.081","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216268","20.896","0.0009","9.592","0.0005","38.832","0.002","90","","99.804","0.003","90","","7669.6","0.7","150","1","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis{μ-1,4-bis[(diphenylphosphanyl)ethynyl]benzene-κ^2^P:P'}bis[trans- diiodidopalladium(II)] chloroform trisolvate","","- C71 H51 Cl9 I4 P4 Pd2 -","- C71 H51 Cl9 I4 P4 Pd2 -","- C284 H204 Cl36 I16 P16 Pd8 -","4","0.5","BT2515","Chan, Wing Yan; Baumgartner, Thomas; Lough, Alan J.; Manners, Ian","Bis{μ-1,4-bis[(diphenylphosphanyl)ethynyl]benzene-κ^2^<i>P</i>:<i>P</i>'}bis[<i>trans</i>-diiodidopalladium(II)] chloroform trisolvate","Acta Crystallographica Section E","2007","63","12","m2886","m2886","10.1107/S160053680704620X","","","0.71073","MoKα","","0.1302","0.0555","","","0.0888","0.1118","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216269","20.9203","0.0019","21.295","0.002","8.1553","0.0008","90","","104.149","0.001","90","","3522.9","0.6","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","catena-Poly[diaquatris(μ~3~-biphenyl-2,2'-dicarboxylato)dierbium(III)]","","- C21 H14 Er O7 -","- C21 H14 Er O7 -","- C168 H112 Er8 O56 -","8","1","BT2544","Yang Rui; Liu Yu-Qi; Yang Wen","<i>catena</i>-Poly[diaquatris(μ~3~-biphenyl-2,2'-dicarboxylato)dierbium(III)]","Acta Crystallographica Section E","2007","63","12","m2899","m2900","10.1107/S1600536807054633","","","0.71073","MoKα","","0.0459","0.0291","","","0.0618","0.0687","","","","","","0.999","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216270","4.7699","0.0007","10.859","0.002","16.599","0.003","90","","91.48","0.02","90","","859.5","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","<i>N</i>-(2-Chlorophenyl)-2-chloroacetamide","2-Chloro-<i>N</i>-(2-chlorophenyl)acetamide","","- C8 H7 Cl2 N O -","- C8 H7 Cl2 N O -","- C32 H28 Cl8 N4 O4 -","4","1","BT2553","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","2-Chloro-<i>N</i>-(2-chlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","12","o4611","o4611","10.1107/S1600536807055201","","","0.71073","MoKα","","0.0991","0.0913","","","0.2436","0.2473","","","","","","1.303","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216271","32.0342","0.0008","15.5594","0.0005","22.1536","0.0005","90","","125.338","0.01","90","","9007.6","1.2","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","(4-Hydroxycinnamato)[tris(<i>N</i>-methylbenzimidazol-2-ylmethyl)amine]zinc(II)] perchlorate dimethylformamide ethanol hemimethanol","(4-Hydroxycinnamato)[tris(<i>N</i>-methylbenzimidazol-2-ylmethyl)amine]zinc(II)] perchlorate‒dimethylformamide‒ethanol‒methanol (2/2/2/1)","","- C41.5 H49 Cl N8 O9.5 Zn -","- C41.5 H49 Cl N8 O9.5 Zn -","- C332 H392 Cl8 N64 O76 Zn8 -","8","1","BT2554","Huilu Wu; Ruirui Yun; Jian Ding; Jingkun Yuan","(4-Hydroxycinnamato)[tris(<i>N</i>-methylbenzimidazol-2-ylmethyl)amine]zinc(II)] perchlorate‒dimethylformamide‒ethanol‒methanol (2/2/2/1)","Acta Crystallographica Section E","2007","63","12","m3022","m3022","10.1107/S1600536807058023","","","0.71073","MoKα","","0.0531","0.0464","","","0.15","0.1549","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2216272","6.1943","0.0016","12.544","0.004","15.561","0.005","90","","90","","90","","1209.1","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Poly[(R)-2-methylpiperazinediium [μ~3~-chlorido-μ~2~-chlorido-dichloridodicopper(I)]]","","- C5 H14 Cl4 Cu2 N2 -","- C5 H14 Cl4 Cu2 N2 -","- C20 H56 Cl16 Cu8 N8 -","4","1","BT2555","Luo, Hui-Zhou; Ye, Heng-Yun","Poly[(<i>R</i>)-2-methylpiperazinediium [μ~3~-chlorido-μ~2~-chlorido-dichloridodicopper(I)]]","Acta Crystallographica Section E","2007","63","12","m2884","m2884","10.1107/S1600536807052774","","","0.71073","MoKα","","0.0475","0.0396","","","0.0866","0.0911","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216273","6.3634","0.0013","12.608","0.003","8.1146","0.0016","90","","95.59","0.03","90","","647.9","0.2","113","2","113","2","","","","","","","","3","P 1 21 1","P 2yb","4","","4-Hydroxy-3,4a,8-trimethyl-3,3a,4,4a,7a,8,9,9a- octahydroazuleno[6,5-b]furan-2,5-dione","","- C15 H20 O4 -","- C15 H20 O4 -","- C30 H40 O8 -","2","1","BT2557","Shou-Cheng Pu; Chun-Ling Tu; Yi Deng","4-Hydroxy-3,4a,8-trimethyl-3,3a,4,4a,7a,8,9,9a-octahydroazuleno[6,5-<i>b</i>]furan-2,5-dione","Acta Crystallographica Section E","2007","63","12","o4543","o4543","10.1107/S1600536807054116","","","0.71073","MoKα","","0.0333","0.0304","","","0.0755","0.0769","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216274","7.5329","0.0005","14.604","0.0001","7.9904","0.0005","90","","95.951","0.006","90","","874.29","0.08","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","5-(Diethylamino)-2-[(Z)-(1-naphthylimino)methyl]phenol","","- C21 H22 N2 O -","- C21 H22 N2 O -","- C42 H44 N4 O2 -","2","1","BT2558","Jasinski, Jerry P.; Butcher, Ray J.; Narayana, B.; Swamy, M. T.; Yathirajan, H. S.","5-(Diethylamino)-2-[(<i>Z</i>)-(1-naphthylimino)methyl]phenol","Acta Crystallographica Section E","2007","63","12","o4588","o4589","10.1107/S1600536807053135","","","0.71073","MoKα","","0.0871","0.0465","","","0.1119","0.1294","","","","","","0.958","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216275","8.4684","0.001","16.5749","0.0019","26.321","0.003","100.338","0.003","90.767","0.003","103.499","0.003","3528.2","0.7","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","{N,N'-Bis[3-(2-nitrophenyl)prop-2-enylidene]ethylenediamine- κ^2^N,N'}chlorido(triphenylphosphine-κP)copper(I)","","- C38 H33 Cl Cu N4 O4 P -","- C38 H33 Cl Cu N4 O4 P -","- C152 H132 Cl4 Cu4 N16 O16 P4 -","4","2","BT2559","Habibi, Mohammad Hossein; Lalegani, Arash; Mokhtari, Reza; Montazerozohori, Morteza; Harrington, Ross W.; Clegg, William","{<i>N</i>,<i>N</i>'-Bis[3-(2-nitrophenyl)prop-2-enylidene]ethylenediamine-κ^2^<i>N</i>,<i>N</i>'}chlorido(triphenylphosphine-κ<i>P</i>)copper(I)","Acta Crystallographica Section E","2007","63","12","m2933","m2934","10.1107/S1600536807056267","","","0.71073","MoKα","","0.0997","0.0505","","","0.1037","0.1318","","","","","","1.098","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2216276","6.6461","0.0001","11.2214","0.0002","17.0108","0.0004","90","","90","","90","","1268.64","0.04","200","","200","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1<i>R</i>,2<i>R</i>)-1-(2-Bromo-4-hydroxy-3,5-dimethoxyphenyl)-2,3- dihydroxypropanol","","- C11 H15 Br O6 -","- C11 H15 Br O6 -","- C44 H60 Br4 O24 -","4","1","BT2560","Chand, Satish; Willis, Anthony C.","(1<i>R</i>,2<i>R</i>)-1-(2-Bromo-4-hydroxy-3,5-dimethoxyphenyl)-2,3-dihydroxypropanol","Acta Crystallographica Section E","2007","63","12","o4505","o4505","10.1107/S160053680705310X","","","0.71073","MoKα","","0.0332","0.0218","","0.0582","0.0506","0.0582","","","","","","0.9096","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216277","7.3125","0.0001","9.0935","0.0001","13.4543","0.0002","79.271","0.001","82.634","0.0001","74.064","0.001","842.42","0.02","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","Decaaquabis[μ~2~-(5-carboxylato-m-phenylenedioxy)diacetato]trizinc(II) dihydrate","","- C22 H38 O28 Zn3 -","- C22 H38 O28 Zn3 -","- C22 H38 O28 Zn3 -","1","0.5","BT2561","Wen, Yi-Hang; Feng, Xia; Ng, Seik Weng","Decaaquabis[μ~2~-(5-carboxylato-<i>m</i>-phenylenedioxy)diacetato]trizinc(II) dihydrate","Acta Crystallographica Section E","2007","63","12","m2941","m2942","10.1107/S1600536807055237","","","0.71073","MoKα","","0.0374","0.0267","","","0.0621","0.0665","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216278","19.4117","0.0006","8.1486","0.0003","13.4528","0.0004","90","","90","","90","","2127.94","0.12","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","1,4-Diazoniabicyclo[2.2.2]octane bis(3-carboxypyridine-2-carboxylate) 2.17-hydrate","","- C20 H26.34 N4 O10.17 -","- C20 H22 N4 O10.342 -","- C80 H88 N16 O41.368 -","4","0.5","BT2562","P. G. Seethalakshmi; P. Ramadevi; S. Kumaresan; Harrison, William T. A.","1,4-Diazoniabicyclo[2.2.2]octane bis(3-carboxypyridine-2-carboxylate) 2.17-hydrate","Acta Crystallographica Section E","2007","63","12","o4837","o4837","10.1107/S1600536807059818","","","0.71073","MoKα","","0.0673","0.0506","","","0.1396","0.155","","","","","","1.033","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2216279","20.87","0.0019","17.1153","0.0016","7.3375","0.0007","90","","90","","90","","2620.9","0.4","293","2","294","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Tetraaqua(2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylato- κ^2^N^3^,O)cobalt(II) 2.5-hydrate","","- C5 H15 Co N2 O10.5 -","- C5 H15 Co N2 O10.5 -","- C40 H120 Co8 N16 O84 -","8","1","BT2564","B. Sridhar; K. Ravikumar","Tetraaqua(2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylato-κ^2^<i>N</i>^3^,<i>O</i>)cobalt(II) 2.5-hydrate","Acta Crystallographica Section E","2007","63","12","m2887","m2888","10.1107/S1600536807054050","","","0.71073","MoKα","","0.0711","0.0625","","","0.1897","0.1993","","","","","","1.118","","","","has coordinates,has Fobs","189124","2020-10-21","18:00:00",""
"2216280","14.2014","0.0004","7.0513","0.0001","22.11","0.0005","90","","90","","90","","2214.06","0.09","291","2","291","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Poly[bis(μ~4~-benzene-1,4-dicarboxylato)-μ~6~-succinato-dilanthanum(III)]","","- C10 H6 La O6 -","- C10 H6 La O6 -","- C80 H48 La8 O48 -","8","1","BT2565","Qin He; Bao-Jun Huang","Poly[bis(μ~4~-benzene-1,4-dicarboxylato)-μ~6~-succinato-dilanthanum(III)]","Acta Crystallographica Section E","2007","63","12","m2879","m2879","10.1107/S1600536807053123","","","0.71073","MoKα","","0.0292","0.0209","","","0.0493","0.0508","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216281","7.9066","0.0002","27.9935","0.0006","11.8849","0.0002","90","","100.832","0.001","90","","2583.66","0.1","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 2-[2,2-bis(ethoxycarbonyl)ethyl]-1-(phenylsulfonyl)indole-3-carboxylate","","- C25 H27 N O8 S -","- C25 H27 N O8 S -","- C100 H108 N4 O32 S4 -","4","1","BT2566","G. Chakkaravarthi; V. Dhayalan; A. K. Mohanakrishnan; V. Manivannan","Ethyl 2-[2,2-bis(ethoxycarbonyl)ethyl]-1-(phenylsulfonyl)indole-3-carboxylate","Acta Crystallographica Section E","2007","63","12","o4724","o4724","10.1107/S1600536807057078","","","0.71073","MoKα","","0.0882","0.06","","","0.1753","0.1915","","","","","","1.088","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216282","7.217","0.0009","6.3101","0.0008","57.061","0.007","90","","90","","90","","2598.6","0.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-Methoxy-N-(3-phenylallylidene)aniline","","- C16 H15 N O -","- C16 H15 N O -","- C128 H120 N8 O8 -","8","1","BT2567","Ying Li; Xiao-Lian He; Xiao-Yan Yang","4-Methoxy-<i>N</i>-(3-phenylallylidene)aniline","Acta Crystallographica Section E","2007","63","12","o4546","o4546","10.1107/S1600536807054542","","","0.71073","MoKα","","0.0587","0.0514","","","0.1458","0.1517","","","","","","1.089","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216283","14.573","0.003","7.716","0.0015","16.662","0.004","90","","105.038","0.003","90","","1809.4","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[μ-2-(3-pyridyl)benzimidazole]bis[bis(3,5-dicarboxybenzoato)silver(I)]","","- C42 H28 Ag2 N6 O12 -","- C42 H28 Ag2 N6 O12 -","- C84 H56 Ag4 N12 O24 -","2","0.5","BT2568","Xia, Chang-Kun; Wu, Wen; Qiu, Lin; Xie, Ji-Min","Bis[μ-2-(3-pyridyl)benzimidazole]bis[bis(3,5-dicarboxybenzoato)silver(I)]","Acta Crystallographica Section E","2007","63","12","m2881","m2881","10.1107/S1600536807054025","","","0.71073","MoKα","","0.0324","0.0301","","","0.0682","0.0699","","","","","","1.093","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216284","19.965","0.006","8.958","0.003","17.482","0.006","90","","98.356","0.005","90","","3093.4","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[1-Benzyl-3-(2-pyridyl)-1<i>H</i>-pyrazole- κ^2^<i>N</i>^2^,<i>N</i>^3^]dichloridopalladium(II)","","- C15 H13 Cl2 N3 Pd -","- C15 H13 Cl2 N3 Pd -","- C120 H104 Cl16 N24 Pd8 -","8","1","BT2570","Chun-Sen Liu; Xue-Song Shi","[1-Benzyl-3-(2-pyridyl)-1<i>H</i>-pyrazole-κ^2^<i>N</i>^2^,<i>N</i>^3^]dichloridopalladium(II)","Acta Crystallographica Section E","2007","63","12","m2892","m2892","10.1107/S1600536807054049","","","0.71073","MoKα","","0.0487","0.0294","","","0.0708","0.0908","","","","","","1.019","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216285","9.637","0.003","10.649","0.003","14.442","0.004","79.178","0.004","78.343","0.004","65.894","0.004","1315.7","0.7","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis(7-amino-2,4-dimethyl-1,8-naphthyridine)dichloridomanganese(II) methanol disolvate","","- C22 H30 Cl2 Mn N6 O2 -","- C22 H30 Cl2 Mn N6 O2 -","- C44 H60 Cl4 Mn2 N12 O4 -","2","1","BT2572","Shouwen Jin; Daqi Wang","Bis(7-amino-2,4-dimethyl-1,8-naphthyridine)dichloridomanganese(II) methanol disolvate","Acta Crystallographica Section E","2007","63","12","m3036","m3036","10.1107/S1600536807055262","","","0.71073","MoKα","","0.0861","0.0465","","","0.1025","0.1248","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216286","11.7182","0.0015","15.503","0.002","14.0158","0.0019","90","","99.892","0.003","90","","2508.4","0.6","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aquachlorido[4,4'-dimethyl-N,N'-(o-phenylene)bis(pyridine-2- carboxamidato)]manganese(III) dimethylformamide solvate","","- C23 H25 Cl Mn N5 O4 -","- C23 H25 Cl Mn N5 O4 -","- C92 H100 Cl4 Mn4 N20 O16 -","4","1","BT2573","Li Yang; Zhaoqiong Jiang; Xiang-Ge Zhou","Aquachlorido[4,4'-dimethyl-<i>N</i>,<i>N</i>'-(<i>o</i>-phenylene)bis(pyridine-2-carboxamidato)]manganese(III) dimethylformamide solvate","Acta Crystallographica Section E","2007","63","12","m3055","m3055","10.1107/S1600536807054517","","","0.71073","MoKα","","0.1546","0.0594","","","0.1396","0.1784","","","","","","1.015","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216287","10.534","0.003","11.682","0.003","20.533","0.005","90","","91.847","0.003","90","","2525.4","1.1","293","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Di-μ~2~-acetato-1:2κ^3^O,O':O;2:3κ^3^O:O,O'-tetrakis(μ~2~-2- hydroxybenzoato)-1:2κ^4^O:O';2:3κ^4^O:O'-bis(1,10-phenanthroline)- 1κ^2^<i>N</i>,<i>N</i>';3κ^2^<i>N</i>,<i>N</i>'-trizinc(II)","","- C56 H42 N4 O16 Zn3 -","- C56 H42 N4 O16 Zn3 -","- C112 H84 N8 O32 Zn6 -","2","0.5","BT2574","Cai, Jin-Hua; Xu, Ying-Hua; Ng, Seik Weng","Di-μ~2~-acetato-1:2κ^3^<i>O</i>,<i>O</i>':<i>O</i>;2:3κ^3^<i>O</i>:<i>O</i>,<i>O</i>'-tetrakis(μ~2~-2-hydroxybenzoato)-1:2κ^4^<i>O</i>:<i>O</i>';2:3κ^4^<i>O</i>:<i>O</i>'-bis(1,10-phenanthroline)-1κ^2^<i>N</i>,<i>N</i>';3κ^2^<i>N</i>,<i>N</i>'-trizinc(II)","Acta Crystallographica Section E","2007","63","12","m2940","m2940","10.1107/S1600536807054852","","","0.71073","MoKα","","0.0506","0.0378","","","0.1","0.1094","","","","","","0.868","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216288","7.547","0.003","10.06","0.004","10.286","0.004","77.262","0.011","69.963","0.011","77.409","0.01","706.9","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","<i>catena</i>-Poly[[bis[μ-2-(3-pyridyl)-1H-benzimidazole]disilver(I)]- μ-benzene-1,4-disulfonato]","","- C15 H11 Ag N3 O3 S -","- C15 H11 Ag N3 O3 S -","- C30 H22 Ag2 N6 O6 S2 -","2","1","BT2575","Jie Chen; Yuzhong Ruan","<i>catena</i>-Poly[[bis[μ-2-(3-pyridyl)-1<i>H</i>-benzimidazole]disilver(I)]-μ-benzene-1,4-disulfonato]","Acta Crystallographica Section E","2007","63","12","m2964","m2964","10.1107/S1600536807055213","","","0.71073","MoKα","","0.0652","0.0606","","","0.1839","0.1877","","","","","","1.106","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216289","9.1071","0.0003","14.7657","0.0006","12.2829","0.0006","90","","123.465","0.003","90","","1377.9","0.11","120","","120","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-amino-4,6-dimethoxy pyrimidinium salicylate","2-amino-4,6-dimethoxypyrimidinium salicylate","","- C13 H15 N3 O5 -","- C13 H15 N3 O5 -","- C52 H60 N12 O20 -","4","1","BT2576","Kaliyaperumal Thanigaimani; Packianathan Thomas Muthiah; Daniel E. Lynch","Hydrogen-bonding patterns in 2-amino-4,6-dimethoxypyrimidinium salicylate","Acta Crystallographica Section E","2007","63","12","o4555","o4556","10.1107/S1600536807054621","","","0.71073","MoKα","","0.0693","0.0537","","","0.1271","0.137","","","","","","1.108","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216290","12.3477","0.0008","12.3477","0.0008","14.7379","0.001","90","","90","","90","","2247","0.3","300","2","300","2","","","","","","","","5","I 41","I 4bw","80","","Tris(2,2'-bi-1H-imidazole)cadmium(II) carbonate","","- C19 H18 Cd N12 O3 -","- C19 H18 Cd N12 O3 -","- C76 H72 Cd4 N48 O12 -","4","0.5","BT2579","Minna Cao; Bo Hu; Feihua Luo; Cuixia Cheng; Zongqiu Hu","Tris(2,2'-bi-1<i>H</i>-imidazole)cadmium(II) carbonate","Acta Crystallographica Section E","2007","63","12","m2927","m2927","10.1107/S1600536807054888","","","0.71073","MoKα","","0.0537","0.0429","","","0.106","0.1324","","","","","","1.173","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216291","6.4694","0.0008","17.8264","0.0018","12.939","0.002","90","","96.872","0.01","90","","1481.5","0.3","218","2","218","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dichloro(dicyclohexylamino)phosphine","","- C12 H22 Cl2 N P -","- C12 H22 Cl2 N P -","- C48 H88 Cl8 N4 P4 -","4","1","BT2580","Boag, Neil M.; Guest, Andrew J.","Dichlorido(dicyclohexylamino)phosphine","Acta Crystallographica Section E","2007","63","12","o4606","o4606","10.1107/S1600536807055183","","","0.71073","MoKα","","0.0458","0.0405","","","0.0947","0.0968","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216292","12.679","0.005","14.69","0.006","14.833","0.007","69.37","0.02","82.05","0.02","65.13","0.02","2345.6","1.8","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[[(μ~4~-naphthalene-1,4-dicarboxylato- κ^4^<i>O</i>:<i>O</i>:<i>O</i>:<i>O</i>')(μ~2~-naphthalene-1,4- dicarboxylato-κ^2^<i>O</i>:<i>O</i>')bis(pyrazino[2,3- <i>f</i>][1,10]phenanthroline-κ^2^<i>N</i>,<i>N</i>')dicopper(II)] tetrahydrate]","","- C52 H36 Cu2 N8 O12 -","- C52 H28 Cu2 N8 O12 -","- C104 H56 Cu4 N16 O24 -","2","1","BT2581","Che, Guang-Bo; Liu, Chun-Bo; Ng, Seik Weng","Poly[[(μ~4~-naphthalene-1,4-dicarboxylato-κ^4^<i>O</i>:<i>O</i>:<i>O</i>:<i>O</i>')(μ~2~-naphthalene-1,4-dicarboxylato-κ^2^<i>O</i>:<i>O</i>')bis(pyrazino[2,3-<i>f</i>][1,10]phenanthroline-κ^2^<i>N</i>,<i>N</i>')dicopper(II)] tetrahydrate]","Acta Crystallographica Section E","2007","63","12","m2984","m2985","10.1107/S1600536807056310","","","0.71073","MoKα","","0.0888","0.0547","","","0.1692","0.1904","","","","","","1.085","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216293","16.445","0.003","9.5147","0.0017","21.856","0.004","90","","90","","90","","3419.8","1.1","294","2","294","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","(E)-3-(2-Chloro-3,3,3-trifluoroprop-1-enyl)-N-(2,5-dimethylphenyl)- 2,2-dimethylcyclopropanecarboxamide","","- C17 H19 Cl F3 N O -","- C17 H19 Cl F3 N O -","- C136 H152 Cl8 F24 N8 O8 -","8","1","BT2582","Yan, Fan-Yong; Liu, Dong-Qing","(<i>E</i>)-3-(2-Chloro-3,3,3-trifluoroprop-1-enyl)-<i>N</i>-(2,5-dimethylphenyl)-2,2-dimethylcyclopropanecarboxamide","Acta Crystallographica Section E","2007","63","12","o4637","o4637","10.1107/S1600536807055924","","","0.71073","MoKα","","0.1077","0.0565","","","0.1401","0.179","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216294","11.285","0.002","18.31","0.004","6.954","0.0014","90","","94.39","0.03","90","","1432.7","0.5","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-(2-Hydroxybenzylideneamino)-1,8-naphthalimide","","- C19 H12 N2 O3 -","- C19 H12 N2 O3 -","- C76 H48 N8 O12 -","4","1","BT2584","Fang-Fang Jian; Li Du; Wei Yi","<i>N</i>-(2-Hydroxybenzylideneamino)-1,8-naphthalimide","Acta Crystallographica Section E","2007","63","12","o4748","o4748","10.1107/S1600536807057066","","","0.71073","MoKα","","0.0763","0.0599","","","0.1669","0.1748","","","","","","1.19","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216295","7.8095","0.001","9.2787","0.0012","11.4058","0.0015","104.678","0.002","99.653","0.002","94.906","0.002","781.06","0.18","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","2-Ethoxy-4-methylphenyl p-toluenesulfonate","","- C16 H18 O4 S -","- C16 H18 O4 S -","- C32 H36 O8 S2 -","2","1","BT2585","G. Ramachandran; Charles Christopher Kanakam; V. Manivannan; Vijay Thiruvenkatam; T. N. Guru Row","2-Ethoxy-4-methylphenyl <i>p</i>-toluenesulfonate","Acta Crystallographica Section E","2007","63","12","o4638","o4638","10.1107/S160053680705619X","","","0.71073","MoKα","","0.0444","0.0387","","","0.1028","0.1065","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216296","19.0061","0.0007","5.0646","0.0003","12.6534","0.0004","90","","90","","90","","1217.99","0.09","296","","296","","","","","","","","","4","P c a 21","P 2c -2ac","29","","(2E)-3-(2-Chlorophenyl)-1-phenylprop-2-en-1-one","","- C15 H11 Cl O -","- C15 H11 Cl O -","- C60 H44 Cl4 O4 -","4","1","BT2586","Jasinski, Jerry P.; Butcher, Ray J.; Lakshmana, K.; Narayana, B.; Yathirajan, H. S.","(2<i>E</i>)-3-(2-Chlorophenyl)-1-phenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","12","o4715","o4715","10.1107/S1600536807058011","","","0.71073","MoKα","","0.0644","0.036","","","0.0798","0.0865","","","","","","0.956","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216297","9.7893","0.0004","10.3641","0.0004","10.6649","0.0004","111.801","0.001","100.498","0.001","109.257","0.001","889.29","0.06","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Poly[dimethylammonium [bis(dimethylamine)tri-μ~4~-terephthalato-sodium(I)dizinc(II)]]","","- C30 H34 N3 Na O12 Zn2 -","- C30 H34 N3 Na O12 Zn2 -","- C30 H34 N3 Na O12 Zn2 -","1","0.5","BT2587","Li-Na Zhu; Shan Gao; Ng, Seik Weng","Poly[dimethylammonium [bis(dimethylamine)tri-μ~4~-terephthalato-sodium(I)dizinc(II)]]","Acta Crystallographica Section E","2007","63","12","m2987","m2988","10.1107/S1600536807056243","","","0.71073","MoKα","","0.0471","0.0442","","","0.1294","0.1335","","","","","","1.075","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216298","17.371","0.009","9.423","0.005","17.511","0.009","90","","110.065","0.007","90","","2692","2","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","9-(Chlorodimethylsilyl)fluorene","","- C15 H15 Cl Si -","- C15 H15 Cl Si -","- C120 H120 Cl8 Si8 -","8","2","BT2588","Guan, Ling-Ling; Chen, Xia; Tong, Hong-Bo; Li, Hai-Fen","9-(Chlorodimethylsilyl)fluorene","Acta Crystallographica Section E","2007","63","12","o4602","o4602","10.1107/S1600536807056231","","","0.71073","MoKα","","0.0742","0.063","","","0.1455","0.1516","","","","","","1.142","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216299","5.2098","0.0009","17.738","0.003","13.046","0.003","90","","97.998","0.019","90","","1193.9","0.4","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(6-Amino-7<i>H</i>-purin-7-yl)-1-phenylethanone","","- C13 H11 N5 O -","- C13 H11 N5 O -","- C52 H44 N20 O4 -","4","1","BT2589","Buehler, Stefanie; Schollmeyer, Dieter; Hauser, Dominik; Laufer, Stefan; Peifer, Christian","2-(6-Amino-7<i>H</i>-purin-7-yl)-1-phenylethanone","Acta Crystallographica Section E","2007","63","12","o4646","o4647","10.1107/S1600536807056450","","","1.54178","CuKα","","0.0676","0.047","","","0.121","0.1357","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216300","10.5755","0.0015","20.287","0.003","12.1172","0.0017","90","","115.63","0.003","90","","2343.9","0.6","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2',2'-(2,2'-Dithiodiphenylene)bis(1,1,3,3-tetramethylguanidine)","","- C22 H32 N6 S2 -","- C22 H32 N6 S2 -","- C88 H128 N24 S8 -","4","1","BT2590","Neuba, Adam; Flörke, Ulrich; Henkel, Gerald","2',2'-(2,2'-Dithiodiphenylene)bis(1,1,3,3-tetramethylguanidine)","Acta Crystallographica Section E","2007","63","12","o4661","o4661","10.1107/S1600536807056486","","","0.71073","MoKα","","0.0754","0.0501","","","0.1026","0.1113","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216301","7.493","0.002","10.23","0.003","11.212","0.004","74.56","0.03","81.49","0.03","77.61","0.02","805.3","0.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Benzyl <i>N</i>'-(2-methoxybenzoyl)hydrazinecarbodithioate","","- C16 H16 N2 O2 S2 -","- C16 H16 N2 O2 S2 -","- C32 H32 N4 O4 S4 -","2","1","BT2591","Singh, N.K.; Singh, Mamata; Butcher, Ray J.","Benzyl <i>N</i>'-(2-methoxybenzoyl)hydrazinecarbodithioate","Acta Crystallographica Section E","2007","63","12","o4679","o4679","10.1107/S1600536807056528","","","0.71073","MoKα","","0.1494","0.0832","","","","0.2731","","","","","","1.07","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216302","11.7059","0.0006","13.8102","0.0007","14.2886","0.0007","90","","101.063","0.001","90","","2267","0.2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,1,3,3-Tetramethyl-2-[2-(tritylsulfanyl)ethyl]guanidine","","- C26 H31 N3 S -","- C26 H31 N3 S -","- C104 H124 N12 S4 -","4","1","BT2594","Neuba, Adam; Flörke, Ulrich; Henkel, Gerald","1,1,3,3-Tetramethyl-2-[2-(tritylsulfanyl)ethyl]guanidine","Acta Crystallographica Section E","2007","63","12","o4683","o4683","10.1107/S1600536807056759","","","0.71073","MoKα","","0.0635","0.0486","","","0.1297","0.1419","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216303","13.422","0.003","10.761","0.003","12.82","0.003","90","","109.158","0.004","90","","1749.1","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N'-[4-(Diethylamino)benzylidene]pyrazine-2-carbohydrazide dihydrate","","- C16 H23 N5 O3 -","- C16 H23 N5 O3 -","- C64 H92 N20 O12 -","4","1","BT2595","Xue-Fang Shi; Zhi-Yong Xing","<i>N</i>'-[4-(Diethylamino)benzylidene]pyrazine-2-carbohydrazide dihydrate","Acta Crystallographica Section E","2007","63","12","o4723","o4723","10.1107/S1600536807058047","","","0.71073","MoKα","","0.1087","0.0459","","","0.1018","0.1262","","","","","","0.954","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216304","13.572","0.002","4.4991","0.0007","14.623","0.002","90","","115.52","0.02","90","","805.8","0.2","290","2","290","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-Bis(2,4-dichlorobenzylidene)ethylenediamine","","- C16 H12 Cl4 N2 -","- C16 H12 Cl4 N2 -","- C32 H24 Cl8 N4 -","2","0.5","BT2596","Abbasi, Alireza; Mohammadi Ziarani, Ghodsi; Badiei, Alireza; Khaniani, Yeganeh","<i>N</i>,<i>N</i>'-Bis(2,4-dichlorobenzylidene)ethylenediamine","Acta Crystallographica Section E","2007","63","12","o4736","o4736","10.1107/S1600536807057030","","","0.71073","MoKα","","0.1334","0.0966","","","0.239","0.2477","","","","","","1.472","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216305","4.674","0.001","11.804","0.002","19.833","0.003","90","","95.05","0.01","90","","1090","0.3","299","2","299","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,2-Dichloro-<i>N</i>-(2,3-dichlorophenyl)acetamide","","- C8 H5 Cl4 N O -","- C8 H5 Cl4 N O -","- C32 H20 Cl16 N4 O4 -","4","1","BT2597","B. Thimme Gowda; Sabine Foro; Hartmut Fuess","2,2-Dichloro-<i>N</i>-(2,3-dichlorophenyl)acetamide","Acta Crystallographica Section E","2007","63","12","o4708","o4708","10.1107/S1600536807057054","","","1.5418","CuKα","","0.0728","0.0456","","","0.1161","0.1292","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216306","6.5376","0.0004","18.6415","0.0012","15.5507","0.001","90","","94.967","0.001","90","","1888.1","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Ethyl-2-(piperidin-1-yl)-3-p-tolylthieno[2,3-d]pyrimidin-4(3H)-one","","- C20 H23 N3 O S -","- C20 H23 N3 O S -","- C80 H92 N12 O4 S4 -","4","1","BT2600","Hai Xie; Xin-min Peng; Yang-gen Hu","6-Ethyl-2-(piperidin-1-yl)-3-<i>p</i>-tolylthieno[2,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","12","o4700","o4700","10.1107/S1600536807057145","","","0.71073","MoKα","","0.0945","0.0691","","","0.1556","0.1681","","","","","","1.093","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216307","6.6489","0.0001","11.2217","0.0002","17.0148","0.0004","90","","90","","90","","1269.51","0.04","200","","200","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1<i>S</i>,2<i>S</i>)-1-(2-Bromo-4-hydroxy-3,5-dimethoxyphenyl)propane- 1,2,3-triol","","- C11 H15 Br O6 -","- C11 H15 Br O6 -","- C44 H60 Br4 O24 -","4","1","BT2601","Chand, Satish; Willis, Anthony C.","(1<i>S</i>,2<i>S</i>)-1-(2-Bromo-4-hydroxy-3,5-dimethoxyphenyl)propane-1,2,3-triol","Acta Crystallographica Section E","2007","63","12","o4866","o4866","10.1107/S1600536807058035","","","0.71073","MoKα","","0.0285","0.022","","0.0319","0.0296","0.0319","","","","","","1.0198","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216308","9.532","0.002","9.866","0.003","10.07","0.003","106.877","0.004","102.705","0.004","110.461","0.004","792.6","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(E)-N'-[1-(4-Aminophenyl)ethylidene]-2-hydroxybenzohydrazide methanol solvate","","- C16 H19 N3 O3 -","- C16 H19 N3 O3 -","- C32 H38 N6 O6 -","2","1","BT2602","Xue-Fang Shi; Zhi-Yong Xing","(<i>E</i>)-<i>N</i>'-[1-(4-Aminophenyl)ethylidene]-2-hydroxybenzohydrazide methanol solvate","Acta Crystallographica Section E","2007","63","12","o4771","o4771","10.1107/S1600536807058552","","","0.71073","MoKα","","0.0679","0.0469","","","0.1202","0.137","","","","","","1.055","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216309","11.325","0.0019","8.3903","0.0018","12.6041","0.0017","90","","90","","90","","1197.6","0.4","295","2","295","2","","","","","","","","5","P b c n","-P 2n 2ab","60","S-Methyl-thiuronium sulfate","bis(S-methylthiuronium) sulfate","","- C4 H14 N4 O4 S3 -","- C4 H14 N4 O4 S3 -","- C16 H56 N16 O16 S12 -","4","0.5","BT2603","Harald Brand; Christopher Hubrich; Kurt Polborn; Axel Schulz; Alexander Villinger","Redetermination of bis(<i>S</i>-methylthiuronium) sulfate","Acta Crystallographica Section E","2007","63","12","o4733","o4733","10.1107/S1600536807058059","","","0.71073","MoKα","","0.035","0.033","","","0.0903","0.0918","","","","","","1.082","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216310","5.8927","0.0018","6.72","0.002","8.212","0.003","70.136","0.004","89.296","0.005","82.674","0.005","303.17","0.17","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","1,4-Bis(pyrazin-2-yloxy)benzene","","- C14 H10 N4 O2 -","- C14 H10 N4 O2 -","- C14 H10 N4 O2 -","1","0.5","BT2604","Lei He; Wen-Qin Zhang","1,4-Bis(pyrazin-2-yloxy)benzene","Acta Crystallographica Section E","2007","63","12","o4749","o4749","10.1107/S1600536807058175","","","0.71073","MoKα","","0.042","0.0342","","","0.0921","0.101","","","","","","1.044","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216311","13.4911","0.0012","8.3947","0.0008","17.4615","0.0016","90","","100.674","0.002","90","","1943.4","0.3","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(4-Chlorophenyl)-2-diethylamino-9-phenyl-1H-purin-6(9H)-one","","- C21 H20 Cl N5 O -","- C21 H20 Cl N5 O -","- C84 H80 Cl4 N20 O4 -","4","1","BT2605","Huang, Nian-Yu; Zhong, Ying; Wang, Wen-Qin; Chen, Xiang; Yang, Jin-Shou","1-(4-Chlorophenyl)-2-diethylamino-9-phenyl-1<i>H</i>-purin-6(9<i>H</i>)-one","Acta Crystallographica Section E","2007","63","12","o4737","o4737","10.1107/S1600536807058187","","","0.71073","MoKα","","0.0784","0.0512","","","0.1148","0.1258","","","","","","0.942","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216312","10.7803","0.0002","9.7683","0.0001","15.6176","0.0002","90","","100.198","0.0008","90","","1618.64","0.04","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(2,2'-Bipyridine)saccharinatosilver(I)","","- C17 H12 Ag N3 O3 S -","- C17 H12 Ag N3 O3 S -","- C68 H48 Ag4 N12 O12 S4 -","4","1","BT2607","Yilmaz, Veysel T.; Hamamci, Sevim; Harrison, William T. A.","(2,2'-Bipyridine)saccharinatosilver(I)","Acta Crystallographica Section E","2007","63","12","m3071","m3071","10.1107/S160053680705845X","","","0.71073","MoKα","","0.0347","0.025","","","0.0533","0.0562","","","","","","1.075","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216313","20.317","0.002","5.0919","0.0005","13.9364","0.0015","90","","102.903","0.002","90","","1405.3","0.2","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-picraminobenzoic acid","4-(2,4,6-Trinitroanilino)benzoic acid","","- C13 H8 N4 O8 -","- C13 H8 N4 O8 -","- C52 H32 N16 O32 -","4","1","BT2608","Graham Smith; Urs D. Wermuth; Jonathan M. White","4-(2,4,6-Trinitroanilino)benzoic acid","Acta Crystallographica Section E","2007","63","12","o4803","o4803","10.1107/S1600536807058497","","","0.71073","MoKα","","0.0556","0.0437","","","0.0955","0.0997","","","","","","1.098","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216314","8.5807","0.0001","10.1447","0.0001","16.9834","0.0002","78.927","0.001","85.539","0.001","89.174","0.001","1446.46","0.03","291","0.3","291","0.3","","","","","","","","6","P -1","-P 1","2","","Dichloridotripyridine(triphenylphosphine)ruthenium(II)","","- C33 H30 Cl2 N3 P Ru -","- C33 H30 Cl2 N3 P Ru -","- C66 H60 Cl4 N6 P2 Ru2 -","2","1","BT2611","Kruszynski, Rafal; Małecki, Jan Grzegorz","Dichloridotripyridine(triphenylphosphine)ruthenium(II)","Acta Crystallographica Section E","2007","63","12","m3052","m3052","10.1107/S1600536807058576","","","0.71073","MoKα","","0.0235","0.0191","","","0.0512","0.0524","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216315","7.1951","0.0006","11.4501","0.0007","40.252","0.002","90","","90","","90","","3316.1","0.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(E)-2-Methyl-4-[(4-nitrophenyl)diazenyl]phenol dimethylformamide solvate","","- C16 H18 N4 O4 -","- C16 H18 N4 O4 -","- C128 H144 N32 O32 -","8","1","BT2612","Koşar, Başak; Albayrak,Çigdem; Gümrükçüoglu, \?Ismail; Büyükgüngör, Orhan","(<i>E</i>)-2-Methyl-4-[(4-nitrophenyl)diazenyl]phenol dimethylformamide solvate","Acta Crystallographica Section E","2007","63","12","o4772","o4772","10.1107/S1600536807059454","","","0.71073","MoKα","","0.1358","0.0518","","","0.114","0.1425","","","","","","0.839","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216316","5.5911","0.0016","7.932","0.002","11.803","0.003","90.649","0.005","91.985","0.004","90.323","0.005","523.1","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","2-(Anilinomethyl)phenol","","- C13 H13 N O -","- C13 H13 N O -","- C26 H26 N2 O2 -","2","1","BT2613","Qu, Yuan; Tian, Lai-Jin; Dong, Jie","2-(Anilinomethyl)phenol","Acta Crystallographica Section E","2007","63","12","o4832","o4832","10.1107/S1600536807058692","","","0.71073","MoKα","","0.0484","0.0405","","","0.1026","0.1079","","","","","","1.065","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216317","9.998","0.0005","15.7885","0.0009","16.9696","0.0012","90","","90","","90","","2678.7","0.3","166","2","166","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","betamethasone-21-pentanoate methanol solvate","2-((8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11,17-dihydroxy- 10,13,16-trimethyl-3-oxo- 6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H -cyclopenta[a]phenanthren- 17-yl)-2-oxoethyl pentanoate methanol solvate","","- C28 H41 F O7 -","- C28 H41 F O7 -","- C112 H164 F4 O28 -","4","1","BT2615","Suitchmezian, Viktor; Jeß, Inke; Näther, Christian","Betamethasone-21-pentanoate methanol solvate","Acta Crystallographica Section E","2007","63","12","o4839","o4839","10.1107/S1600536807059545","","","0.71073","MoKα","","0.0538","0.042","","","0.1071","0.1143","","","","","","1.025","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216318","24.8293","0.0016","9.6387","0.0006","24.0094","0.0017","90","","100.912","0.003","90","","5642.1","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","(2E)-4-(2-chlorophenyl)-1-[(spiro-3'-indolino)-1-(2- chlorophenyl)decahydro-1H-pyrrolo[1,2-a]indol-2-yl]but-2-en-1-one","(2E)-3-(2-Chlorophenyl)-1-[1'-(2-chlorophenyl)indoline-3-spiro-3'- perhydropyrrolo[1,2-<i>a</i>]indol-2'-yl]prop-2-en-1-one","","- C33 H30 Cl2 N2 O2 -","- C33 H30 Cl2 N2 O2 -","- C264 H240 Cl16 N16 O16 -","8","1","BT2616","P. Ramesh; S. Murugavel; A. Subbiah Pandi; Ramalingam Murugan; S. Sriman Narayanan","(2<i>E</i>)-3-(2-Chlorophenyl)-1-[1'-(2-chlorophenyl)indoline-3-spiro-3'-perhydropyrrolo[1,2-<i>a</i>]indol-2'-yl]prop-2-en-1-one","Acta Crystallographica Section E","2007","63","12","o4851","o4851","10.1107/S1600536807059661","","","0.71073","MoKα","","0.0884","0.052","","","0.1404","0.1642","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216319","9.3553","0.0008","11.087","0.004","22.188","0.0019","90","","90","","90","","2301.4","0.9","294","2","294","2","","","","","","","","4","P b c n","-P 2n 2ab","60","not relevant","Cyclohexylammonium hydrogensquarate hemihydrate","","- C10 H16 N O4.5 -","- C10 H16 N O4.5 -","- C80 H128 N8 O36 -","8","1","BT2617","Tsonko Kolev; Bojidarka Koleva; Rüdiger W. Seidel; Michael Spiteller; William S. Sheldrick","Cyclohexylammonium hydrogensquarate hemihydrate","Acta Crystallographica Section E","2007","63","12","o4852","o4852","10.1107/S1600536807059132","","","0.71073","MoKα","","0.0907","0.0512","","","0.1212","0.1415","","","","","","1.02","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216320","8.0456","0.0005","9.5454","0.0004","9.5698","0.0004","90.094","0.002","104.405","0.002","93.273","0.002","710.58","0.06","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","2-(8-Chloro-6,9-dimethyl-2,3,4,9-tetrahydro-1 H-carbazol-4-yl)acetaldehyde","","- C16 H18 Cl N O -","- C16 H18 Cl N O -","- C32 H36 Cl2 N2 O2 -","2","1","BT2618","Yuan-Yuan Lai; Jia-Rong Chen; Guang-Di Jia; Xing Tao","2-(8-Chloro-6,9-dimethyl-2,3,4,9-tetrahydro-1<i>H</i>-carbazol-4-yl)acetaldehyde","Acta Crystallographica Section E","2007","63","12","o4818","o4818","10.1107/S1600536807059156","","","0.71073","MoKα","","0.0706","0.0574","","","0.1579","0.1693","","","","","","1.087","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216321","8.5316","0.001","7.3356","0.0007","11.118","0.0013","90","","101.006","0.003","90","","683.02","0.13","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","Dimethylgold(III) N-phenylsalicylaldiminate","Dimethyl[2-(phenyliminomethyl)phenolato-κ^2^N,O]gold(III)","","- C15 H16 Au N O -","- C15 H16 Au N O -","- C30 H32 Au2 N2 O2 -","2","0.5","BT2619","Bessonov, Alexander A.; Smolentsev, Anton I.; Baidina, Iraida A.; Morozova, Natalia B.","Dimethyl[2-(phenyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]gold(III)","Acta Crystallographica Section E","2007","63","12","m3154","m3154","10.1107/S1600536807060709","","","0.71073","MoKα","","0.0138","0.0122","","","0.0271","0.0273","","","","","","1.111","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216322","9.955","0.0003","11.0928","0.0004","11.2096","0.0004","80.5113","0.0014","82.6627","0.0013","67.2202","0.0019","1122.91","0.07","200","2","200","2","","","","","","","","5","P -1","-P 1","2","N-(trimethylsilyl)nicotineamide","<i>N</i>-(Trimethylsilyl)pyridine-3-carboxamide","","- C9 H14 N2 O Si -","- C9 H14 N2 O Si -","- C36 H56 N8 O4 Si4 -","4","2","BT2620","Gilg, Kathrin; Klüfers, Peter","<i>N</i>-(Trimethylsilyl)pyridine-3-carboxamide","Acta Crystallographica Section E","2007","63","12","o4764","o4764","10.1107/S1600536807059478","","","0.71073","MoKα","","0.0954","0.0515","","","0.1078","0.1257","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216323","15.3161","0.0009","15.3161","0.0009","13.2602","0.0008","90","","90","","90","","3110.6","0.3","170","2","170","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","Hexabromido-tetrakis(μ~3~-4-pyridiniumthiolato-κ^3^S)hexacopper(I)","","- C20 H20 Br6 Cu6 N4 S4 -","- C20 H20 Br6 Cu6 N4 S4 -","- C80 H80 Br24 Cu24 N16 S16 -","4","0.25","BT2621","Wriedt, Mario; Jeß, Inke; Näther, Christian","Hexabromidotetrakis(μ~3~-4-pyridiniumthiolato-κ^3^<i>S</i>:<i>S</i>:<i>S</i>)hexacopper(I)","Acta Crystallographica Section E","2007","63","12","m3145","m3145","10.1107/S1600536807059855","","","0.71073","MoKα","","0.0431","0.0324","","","0.0723","0.0763","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216324","12.8976","0.0004","11.2682","0.0004","15.2359","0.0005","90","","114.715","0.002","90","","2011.44","0.12","183","2","183","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","<i>trans</i>-Bis(1,2-dimethoxyethane- κ^2^<i>O</i>,<i>O</i>')diiodido(tetrahydrofuran-κ<i>O</i>)calcium(II)","","- C12 H28 Ca I2 O5 -","- C12 H28 Ca I2 O5 -","- C48 H112 Ca4 I8 O20 -","4","0.5","BT2622","Gärtner, Martin; Görls, Helmar; Westerhausen, Matthias","<i>trans</i>-Bis(1,2-dimethoxyethane-κ^2^<i>O</i>,<i>O</i>')diiodido(tetrahydrofuran-κ<i>O</i>)calcium(II)","Acta Crystallographica Section E","2007","63","12","m3169","m3169","10.1107/S1600536807059399","","","0.71073","MoKα","","0.0309","0.0239","","","0.0642","0.069","","","","","","1.062","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216325","8.3005","0.0004","19.0883","0.001","13.3014","0.0007","90","","106.121","0.001","90","","2024.63","0.18","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(E)-2-{[(4-tert-Butyl-5-(2,4-dichlorobenzyl)thiazol-2-yl]iminomethyl}phenol","","- C21 H20 Cl2 N2 O S -","- C21 H20 Cl2 N2 O S -","- C84 H80 Cl8 N8 O4 S4 -","4","1","BT2623","Ai-Xi Hu; Gao Cao; Ying-Qi Mang","(<i>E</i>)-2-{[4-<i>tert</i>-Butyl-5-(2,4-dichlorobenzyl)thiazol-2-yl]iminomethyl}phenol","Acta Crystallographica Section E","2007","63","12","o4812","o4812","10.1107/S1600536807059600","","","0.71073","MoKα","","0.0585","0.041","","","0.1002","0.1104","","","","","","1.047","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216326","8.077","0.004","11.153","0.006","11.724","0.006","94.77","0.04","106.22","0.04","98.36","0.04","994.8","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","5-[(3,4-Dimethylphenyl)sulfonyl]-8-methoxy-2-methyl-2,3,5,6-tetrahydro-4H- 2,6-methano-1,3-benzoxazocin-4-one","","- C21 H23 N O5 S -","- C21 H23 N O5 S -","- C42 H46 N2 O10 S2 -","2","1","BT2625","Baumer, Vyacheslav N.; Kovalenko, Svitlana S.; Silin, Olexiy V.; Kovalenko, Segriy M.","5-(3,4-Dimethylphenylsulfonyl)-8-methoxy-2-methyl-2,3,5,6-tetrahydro-4<i>H</i>-2,6-methano-1,3-benzoxazocin-4-one","Acta Crystallographica Section E","2007","63","12","o4845","o4845","10.1107/S1600536807059910","","","0.71073","MoKα","","","0.045","","","","0.0916","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216327","20.578","0.004","12.431","0.003","12.462","0.003","90","","123.867","0.002","90","","2647","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetraaqua(1,10-phenanthroline)cobalt(II) naphthalene-1,5-disulfonate dihydrate","","- C22 H26 Co N2 O12 S2 -","- C22 H26 Co N2 O12 S2 -","- C88 H104 Co4 N8 O48 S8 -","4","0.5","BT2626","Liu, Yin-Qiu; Wu, Yuan-Xiang; Zeng, Xi-Rui; Wen, He-Rui","Tetraaqua(1,10-phenanthroline)cobalt(II) naphthalene-1,5-disulfonate dihydrate","Acta Crystallographica Section E","2007","63","12","m3120","m3120","10.1107/S160053680705982X","","","0.71073","MoKα","","0.0369","0.0339","","","0.0952","0.0975","","","","","","1.066","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216328","13.2742","0.0012","6.3787","0.0007","17.5375","0.0016","90","","105.151","0.006","90","","1433.3","0.2","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N'-(4-Hydroxy-3-methoxybenzylidene)isonicotinohydrazide methanol solvate","","- C15 H17 N3 O4 -","- C15 H17 N3 O4 -","- C60 H68 N12 O16 -","4","1","BT2627","Xia Liu; Xue-Fang Shi","<i>N</i>'-(4-Hydroxy-3-methoxybenzylidene)isonicotinohydrazide methanol solvate","Acta Crystallographica Section E","2007","63","12","o4807","o4807","10.1107/S1600536807059430","","","0.7107","MoKα","","0.0695","0.0445","","","0.113","0.1546","","","","","","1.124","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216329","7.9342","0.0012","8.494","0.0014","13.8971","0.0016","87.144","0.008","85.696","0.008","77.821","0.008","912.4","0.2","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","(E)-Methyl 3-[3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2- dimethylcyclopropanecarboxamido]thiophene-2-carboxylate","","- C15 H15 Cl F3 N O3 S -","- C15 H15 Cl F3 N O3 S -","- C30 H30 Cl2 F6 N2 O6 S2 -","2","1","BT2628","Yan, Fan-Yong; Liu, Dong-Qing","(<i>E</i>)-Methyl 3-[3-(2-chloro-3,3,3-trifluoroprop-1-enyl)-2,2-dimethylcyclopropanecarboxamido]thiophene-2-carboxylate","Acta Crystallographica Section E","2007","63","12","o4877","o4877","10.1107/S1600536807061120","","","0.71073","MoKα","","0.0817","0.0549","","","0.1419","0.1642","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216330","5.8595","0.0003","7.2955","0.0003","10.5515","0.0005","92.107","0.003","100.758","0.003","112.263","0.003","407.22","0.03","200","2","200","2","","","","","","","","3","P -1","-P 1","2","2,2-Di(cyclopropyl)glycolic acid","2,2-Dicyclopropylglycolic acid","","- C8 H12 O3 -","- C8 H12 O3 -","- C16 H24 O6 -","2","1","BT2631","Betz, Richard; Klüfers, Peter","2,2-Dicyclopropylglycolic acid","Acta Crystallographica Section E","2007","63","12","o4921","o4921","10.1107/S1600536807061168","","","0.71073","MoKα","","0.0567","0.0386","","","0.0935","0.1035","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216331","11.6721","0.0015","10.5156","0.0012","9.6565","0.0012","90","","90","","90","","1185.2","0.3","113","2","113","2","","","","","","","","4","C m c 21","C 2c -2","36","","4-Hydroxy-2,2,6,6-tetramethylpiperidinium nitrate","","- C9 H20 N2 O4 -","- C9 H20 N2 O4 -","- C36 H80 N8 O16 -","4","0.5","BT2639","Shou-Cheng Pu; Wen-Yuan Gao; Yi Deng; Chun-Ling Tu","4-Hydroxy-2,2,6,6-tetramethylpiperidinium nitrate","Acta Crystallographica Section E","2007","63","12","o4896","o4896","10.1107/S1600536807061612","","","0.7107","MoKα","","0.0524","0.0473","","","0.1117","0.115","","","","","","1.109","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216332","9.1404","0.0003","16.0798","0.0005","7.2639","0.0002","90","","109.601","0.002","90","","1005.75","0.05","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-5-methylbenzene-1,3-dicarbaldehyde","","- C11 H12 O3 -","- C11 H12 O3 -","- C44 H48 O12 -","4","1","BT2648","Chen, Deng-Tai; Tian, Lai-Jin; Wang, Hai-Long","2-Hydroxy-5-methylbenzene-1,3-dicarbaldehyde","Acta Crystallographica Section E","2007","63","12","o4925","o4925","10.1107/S1600536807062162","","","0.71073","MoKα","","0.0706","0.0478","","","0.1206","0.1439","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216333","13.1763","0.0013","9.7513","0.001","13.151","0.0013","90","","96.427","0.002","90","","1679.1","0.3","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[μ~2~-aqua-diaquabis(μ~3~-pyridine-2,6-dicarboxylato)manganese(II)]","","- C14 H12 Mn2 N2 O11 -","- C14 H12 Mn2 N2 O11 -","- C56 H48 Mn8 N8 O44 -","4","0.5","BV2065","Shuxin Cui; Yulong Zhao; Jingping Zhang","Redetermination of poly[μ~2~-aqua-diaquabis(μ~3~-pyridine-2,6-dicarboxylato)manganese(II)]","Acta Crystallographica Section E","2007","63","12","m3102","m3102","10.1107/S1600536807045898","","","0.71073","MoKα","","0.0379","0.0318","","","0.0721","0.0754","","","","","","1.048","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216334","8.021","0.0017","17.939","0.004","10.227","0.002","90","","100.108","0.003","90","","1448.7","0.5","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2E,3E)-2,3-Bis(1,3-dithiolan-2-ylidenehydrazono)butane","","- C10 H14 N4 S4 -","- C10 H14 N4 S4 -","- C40 H56 N16 S16 -","4","1","BV2077","Yang, Ling-Juan; Li, Zhi-Gang; Liu, Xiao-Lan; Liu, Yong-Hong","(2<i>E</i>,3<i>E</i>)-2,3-Bis(1,3-dithiolan-2-ylidenehydrazono)butane","Acta Crystallographica Section E","2007","63","12","o4501","o4501","10.1107/S1600536807053639","","","0.71073","MoKα","","0.0667","0.0405","","","0.1023","0.1168","","","","","","1.017","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216335","16.094","0.002","13.472","0.001","14.488","0.001","90","","90","","90","","3141.3","0.5","100","1","100","1","","","","","","","","4","P n a 21","P 2c -2n","33","","tris(4-methylbenzyl)(1,4,7-trimethyl-1,4,7-triazacyclononane)lanthanum(III)","","- C33 H48 La N3 -","- C33 H48 La N3 -","- C132 H192 La4 N12 -","4","1","BV2078","Bambirra, Sergio; Meetsma, Auke; Bart Hessen, Bart","Tris(4-methylbenzyl)(1,4,7-trimethyl-1,4,7-triazacyclononane)lanthanum(III)","Acta Crystallographica Section E","2007","63","12","m2891","m2891","10.1107/S1600536807053640","","","0.71073","MoKα","","0.091","0.0479","","","0.0943","0.1086","","","","","","0.965","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216336","6.6633","0.0003","8.3996","0.0003","10.7882","0.0004","84.7541","0.0009","83.001","0.0008","67.6991","0.0008","553.81","0.04","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Tetraaqua(pyridine-2,5-dicarboxylato-κ^2^N,O^2^)nickel(II) monohydrate","","- C7 H13 N Ni O9 -","- C7 H13 N Ni O9 -","- C14 H26 N2 Ni2 O18 -","2","1","BX2109","Aghabozorg, Hossein; Derikvand, Zohreh; Nemati, Andya; Ghadermazi, Mohammad","Tetraaqua(pyridine-2,5-dicarboxylato-κ^2^<i>N</i>,<i>O</i>^2^)nickel(II) monohydrate","Acta Crystallographica Section E","2007","63","12","m2919","m2920","10.1107/S1600536807053627","","","0.71073","MoKα","","0.0272","0.024","","","0.0643","0.067","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216337","11.914","0.003","5.2297","0.0012","14.946","0.003","90","","98.555","0.004","90","","920.9","0.4","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","3-acetyl-4-hydroxyquinolin-2(1H)-one","3-Acetyl-4-hydroxyquinolin-2(1<i>H</i>)-one","","- C11 H9 N O3 -","- C11 H9 N O3 -","- C44 H36 N4 O12 -","4","1","BX2112","S. Sarveswari; T. K. Raja; R. Vijayaraghavan; T. Narasimhamurthy; R. S. Rathore","3-Acetyl-4-hydroxyquinolin-2(1<i>H</i>)-one: resonance-assisted O—H···O hydrogen bonding","Acta Crystallographica Section E","2007","63","12","o4600","o4601","10.1107/S1600536807054153","","","0.71073","MoKα","","0.0787","0.0478","","","0.1086","0.1243","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216338","10.4676","0.0002","12.2005","0.0003","15.238","0.0004","85.576","0.001","71.757","0.001","70.956","0.001","1746.4","0.07","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","cis-(Carbonato-κ^2^O,O')bis(triphenylphosphine-κP)platinum(II)‒benzene‒ dichloromethane (2/1/1)","","- C40.5 H34 Cl O3 P2 Pt -","- C40.5 H34 Cl O3 P2 Pt -","- C81 H68 Cl2 O6 P4 Pt2 -","2","1","BX2113","Akella Sivaramakrishna; Hong Su; John R. Moss","<i>cis</i>-(Carbonato-κ^2^<i>O</i>,<i>O</i>')bis(triphenylphosphine-κ<i>P</i>)platinum(II)‒benzene‒dichloromethane mixed solvate (2/1/1)","Acta Crystallographica Section E","2007","63","12","m3097","m3097","10.1107/S1600536807058709","","","0.71073","MoKα","","0.059","0.0358","","","0.0542","0.0601","","","","","","1.045","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2216339","13.0699","0.0015","11.3731","0.0012","8.2215","0.0011","90","","90","","90","","1222.1","0.3","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","N-(3-Chlorophenyl)-2-nitrobenzamide","","- C13 H9 Cl N2 O3 -","- C13 H9 Cl N2 O3 -","- C52 H36 Cl4 N8 O12 -","4","1","BX2116","Saeed, Aamer; Hussain, Shahid; Bolte, Michael","<i>N</i>-(3-Chlorophenyl)-2-nitrobenzamide","Acta Crystallographica Section E","2007","63","12","o4666","o4666","10.1107/S1600536807056358","","","0.71073","MoKα","","0.0535","0.0456","","","0.1068","0.11","","","","","","1.104","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216340","6.4356","0.0013","4.6361","0.0005","42.693","0.008","90","","96.904","0.016","90","","1264.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(E)-4-Bromo-2-[2-(hydroxymethyl)phenyliminomethyl]phenol","","- C14 H12 Br N O2 -","- C14 H12 Br N O2 -","- C56 H48 Br4 N4 O8 -","4","1","BX2117","Yavuz Köysal; Şamil Işık; Ayşen Aǧar","(<i>E</i>)-4-Bromo-2-[2-(hydroxymethyl)phenyliminomethyl]phenol","Acta Crystallographica Section E","2007","63","12","o4916","o4916","10.1107/S1600536807061855","","","0.71073","MoKα","","0.1477","0.0825","","","0.139","0.164","","","","","","0.99","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216341","7.3158","0.0018","19.824","0.004","11.901","0.002","90","","95.18","0.02","90","","1718.9","0.6","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,3'-(5-Chloro-2-hydroxy-m-phenylenedimethylene)diimidazolium oxalate","","- C16 H15 Cl N4 O5 -","- C16 H15 Cl N4 O5 -","- C64 H60 Cl4 N16 O20 -","4","1","CF2146","Xiao-Yu Su; Wen-Hai Wang; Jing-Bo Lan; Zhi-Hua Mao; Ru-Gang Xie","3,3'-(5-Chloro-2-hydroxy-<i>m</i>-phenylenedimethylene)diimidazolium oxalate","Acta Crystallographica Section E","2007","63","12","o4513","o4514","10.1107/S160053680704809X","","","0.71073","MoKα","","0.1324","0.0695","","","0.1708","0.2014","","","","","","0.96","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216342","12.494","0.0006","6.193","0.0004","16.817","0.0009","90","","95.054","0.004","90","","1296.16","0.13","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-Methoxy-2-methylimidazolidine-4,5-dione","2-Methoxy-2-methylimidazolidine-4,5-dione","","- C5 H8 N2 O3 -","- C5 H8 N2 O3 -","- C40 H64 N16 O24 -","8","2","CF2150","Ružička, Aleš; Ottis, Jan; Jalový, Zdeněk","2-Methoxy-2-methylimidazolidine-4,5-dione","Acta Crystallographica Section E","2007","63","12","o4704","o4704","10.1107/S160053680705708X","","","0.71073","MoKα","","0.1009","0.0625","","","0.1259","0.1462","","","","","","1.115","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216343","8.0113","0.0014","8.3126","0.0014","14.215","0.003","99.374","0.003","102.689","0.003","107.041","0.002","856.4","0.3","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","Bis[3-ethyl-4-(4-methylphenyl)-5-(2-pyridyl)-4H-1,2,4-triazole-\ κ^2^N,N']copper(II) bis(perchlorate)","","- C32 H32 Cl2 Cu N8 O8 -","- C32 H32 Cl2 Cu N8 O8 -","- C32 H32 Cl2 Cu N8 O8 -","1","0.5","CF2155","Pingfeng Wu; Zuoxiang Wang; Bugao Zhou; Liaocheng Huang","Bis[3-ethyl-4-(4-methylphenyl)-5-(2-pyridyl)-4<i>H</i>-1,2,4-triazole-κ^2^<i>N</i>,<i>N</i>']copper(II) bis(perchlorate)","Acta Crystallographica Section E","2007","63","12","m3060","m3060","10.1107/S1600536807057686","","","0.71073","MoKα","","0.0791","0.0584","","","0.1226","0.1271","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216344","9.629","0.002","5.617","0.005","24.657","0.004","90","","92.379","0.009","90","","1332.5","1.2","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(1H-Benzimidazol-2-yl)-3-(3-chlorophenyl)prop-2-en-1-one","","- C16 H11 Cl N2 O -","- C16 H11 Cl N2 O -","- C64 H44 Cl4 N8 O4 -","4","1","CF2159","Adohi-Krou, A.; Ouattara, M.; Zoro-Diama, E. G.; Akonan, L.; Aycard, J. P.","1-(1<i>H</i>-Benzimidazol-2-yl)-3-(3-chlorophenyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","12","o4761","o4761","10.1107/S1600536807053196","","","0.7107","MoKα","","0.0603","0.0461","","0.1294","0.1146","0.1146","","","","","","1.0067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216345","24.872","0.005","14.634","0.003","11.01","0.002","90","","94.7","0.03","90","","3993.9","1.4","292","2","292","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(2-Amino-4,5-dimethylbenzenesulfonato-κN)aquabis(triphenylphosphine- κP)silver(I)","","- C44 H42 Ag N O4 P2 S -","- C44 H42 Ag N O4 P2 S -","- C176 H168 Ag4 N4 O16 P8 S4 -","4","1","CF2160","Dong, Xian-Wu; Wu, Fa-Yuan; Li, Yu-Jie","(2-Amino-4,5-dimethylbenzenesulfonato-κ<i>N</i>)aquabis(triphenylphosphine-κ<i>P</i>)silver(I)","Acta Crystallographica Section E","2007","63","12","m2885","m2885","10.1107/S1600536807053524","","","0.71073","MoKα","","0.0513","0.0345","","","0.0852","0.0942","","","","","","1.079","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216346","12.373","0.007","9.807","0.005","9.942","0.003","90","","91.084","0.003","90","","1206.2","1","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Benzylsulfanyl-1<i>H</i>-benzimidazole","","- C14 H12 N2 S -","- C14 H12 N2 S -","- C56 H48 N8 S4 -","4","1","CF2161","Yavo, Edi Aimé; Kakou-Yao, R.; Coulibaly, Siomenan; Abou, Akoun; Tenon, A. Jules","2-Benzylsulfanyl-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","12","o4551","o4551","10.1107/S1600536807055687","","","0.71073","MoKα","","0.0434","0.038","","0.069","0.0653","0.069","","","","","","0.9341","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216348","10.644","0.003","4.4834","0.0012","15.807","0.004","90","","105.672","0.006","90","","726.3","0.3","298","2","298","2","","","","","","","","4","P 1 c 1","P -2yc","7","","2-(1<i>H</i>-Benzotriazol-1-yl)-<i>N'</i>-(2-hydroxybenzylidene)acetohydrazide","","- C15 H13 N5 O2 -","- C15 H13 N5 O2 -","- C30 H26 N10 O4 -","2","1","CF2170","Zhi-Qiang Shi; Ning-Ning Ji; Ze-Bao Zheng; Ji-Kun Li","2-(1<i>H</i>-Benzotriazol-1-yl)-<i>N</i>-(2-hydroxybenzylidene)acetohydrazide","Acta Crystallographica Section E","2007","63","12","o4642","o4642","10.1107/S1600536807056206","","","0.71073","MoKα","","0.1002","0.0455","","","0.0773","0.0954","","","","","","0.998","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216349","11.2479","0.0018","8.9729","0.0014","17.007","0.002","90","","96.06","0.03","90","","1706.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,4'-Dichloro-2,2'-[(1E,1'E)-propane-1,3-diylbis(nitrilomethylidyne)]diphenol","","- C17 H16 Cl2 N2 O2 -","- C17 H16 Cl2 N2 O2 -","- C68 H64 Cl8 N8 O8 -","4","1","CF2172","Shi, Lei; Xiao, Zhu-Ping; Zhuang, Zhong; Zhong, Zhao-Zhao; Zhu, Hai-Liang","4,4'-Dichloro-2,2'-[(1<i>E</i>,1'<i>E</i>)-propane-1,3-diylbis(nitrilomethylidyne)]diphenol","Acta Crystallographica Section E","2007","63","12","o4726","o4726","10.1107/S1600536807057698","","","0.71073","MoKα","","0.1658","0.0656","","","0.1249","0.1606","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216350","5.988","0.003","6.783","0.002","13.391","0.002","85.39","0.02","82.87","0.02","82.88","0.02","534.4","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tetraaquadiglycinemagnesium(II) hexaaquamagnesium(II) bis(sulfate)","","- C4 H30 Mg2 N2 O22 S2 -","- C4 H30 Mg2 N2 O22 S2 -","- C4 H30 Mg2 N2 O22 S2 -","1","0.5","CI2471","K. Elayaraja; S. Prakash Parthiban; S. Ramalingom; G. Bocelli; S. Narayana Kalkura","Tetraaquadiglycinemagnesium(II) hexaaquamagnesium(II) bis(sulfate)","Acta Crystallographica Section E","2007","63","12","m2901","m2902","10.1107/S1600536807052890","","","0.71073","MoKα","","0.0659","0.0658","","","0.1714","0.1714","","","","","","1.156","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216351","7.1271","0.0014","12.707","0.003","16.401","0.004","90","","106.95","0.03","90","","1420.8","0.6","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis[5-(pyrimidin-2-yl-κ<i>N</i>)tetrazolato-κ<i>N</i>^1^]nickel(II)","","- C10 H10 N12 Ni O2 -","- C10 H10 N12 Ni O2 -","- C40 H40 N48 Ni4 O8 -","4","1","CI2479","Qiu, Y.-E","Diaquabis[5-(pyrimidin-2-yl-κ<i>N</i>)tetrazolato-κ<i>N</i>^1^]nickel(II)","Acta Crystallographica Section E","2007","63","12","m2872","m2873","10.1107/S1600536807053998","","","0.71073","MoKα","","0.0989","0.0789","","","0.1739","0.1893","","","","","","1.004","","","","has coordinates,has Fobs","194623","2020-10-21","18:00:00",""
"2216352","10.101","0.005","10.631","0.006","15.831","0.007","90","","96.18","0.019","90","","1690.1","1.5","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","catena-Poly[[(6-aminonaphthalene-1-sulfonato-kO)silver(I)]-μ-2,3,5,6- tetramethylpyrazine-κ^2^N:N']","","- C18 H20 Ag N3 O3 S -","- C18 H20 Ag N3 O3 S -","- C72 H80 Ag4 N12 O12 S4 -","4","1","CI2480","Hai-Yan Liu; Ji-Cheng Ma; Ying-Ying Liu","<i>catena</i>-Poly[[(6-aminonaphthalene-1-sulfonato-κ<i>O</i>)silver(I)]-μ-2,3,5,6-tetramethylpyrazine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","12","m3035","m3035","10.1107/S1600536807049550","","","0.71069","MoKα","","0.0209","0.0203","","","0.047","0.0472","","","","","","1.117","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216353","18.295","0.006","10.851","0.004","28.097","0.009","90","","90","","90","","5578","3","292","2","292","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","3-(4-Chlorophenyl)-2-(2,4-dichlorophenoxy)-5-methyl-8,9,10,11-tetrahydro- 2-benzothieno[2',3':2,3]pyrido[4,5-<i>d</i>]pyrimidin-4(3<i>H</i>)-one dichloromethane solvate","","- C27 H20 Cl5 N3 O2 S -","- C27 H20 Cl5 N3 O2 S -","- C216 H160 Cl40 N24 O16 S8 -","8","1","CI2481","Liu, Jian-Chao","3-(4-Chlorophenyl)-2-(2,4-dichlorophenoxy)-5-methyl-8,9,10,11-tetrahydro-2-benzothieno[2',3':2,3]pyrido[4,5-<i>d</i>]pyrimidin-4(3<i>H</i>)-one dichloromethane solvate","Acta Crystallographica Section E","2007","63","12","o4571","o4571","10.1107/S1600536807054013","","","0.71073","MoKα","","0.1283","0.0777","","","0.2078","0.2342","","","","","","1.044","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216354","19.966","0.004","7.8761","0.0009","13.9861","0.0008","90","","120.81","0.01","90","","1889","0.5","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Poly[[diaquatri-μ~4~-succinato-dineodymium(III)] monohydrate]","","- C12 H18 Nd2 O15 -","- C12 H18 Nd2 O15 -","- C48 H72 Nd8 O60 -","4","0.5","CI2484","He, Yong-Ke; Wang, Xiao-Fang; Zhang, Li-Tian; Han, Zheng-Bo; Ng, Seik Weng","Poly[[diaquatri-μ~4~-succinato-dineodymium(III)] monohydrate]","Acta Crystallographica Section E","2007","63","12","m3019","m3019","10.1107/S1600536807057303","","","0.71073","MoKα","","0.0253","0.0239","","","0.0651","0.066","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216355","6.0731","0.0016","7.929","0.003","9.257","0.003","113.841","0.006","92.66","0.005","92.22","0.005","406.5","0.2","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","[(Amino)(5-amino-4-aminocarbonyl-1H-imidazol-3-ium-4-yl)methylene]oxonium 5-amino-4-aminocarbonyl-1H-imidazolium sulfate hydrogen sulfate","","- C8 H16 N8 O10 S2 -","- C8 H16 N8 O10 S2 -","- C8 H16 N8 O10 S2 -","1","0.5","CI2490","Lu-Ping Lv; Xiao-Jun Li; Wei-Wei Li; Wen-Bo Yu; Xian-Chao Hu","[(Amino)(5-amino-4-aminocarbonyl-1<i>H</i>-imidazol-3-ium-4-yl)methylene]oxonium 5-amino-4-aminocarbonyl-1<i>H</i>-imidazolium sulfate hydrogen sulfate","Acta Crystallographica Section E","2007","63","12","o4662","o4663","10.1107/S1600536807056590","","","0.7107","MoKα","","0.0322","0.0297","","","0.0737","0.0752","","","","","","1.1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216356","8.0618","0.0002","9.6671","0.0003","17.1819","0.0005","90","","91.535","0.003","90","","1338.58","0.07","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Benzoylmethyl 4-methoxybenzoate","","- C16 H14 O4 -","- C16 H14 O4 -","- C64 H56 O16 -","4","1","CI2491","Ji, Tao; Wang, Xi-Lin; Gao, Yu-Xing; Tang, Guo; Zhao, Yu-Fen","Benzoylmethyl 4-methoxybenzoate","Acta Crystallographica Section E","2007","63","12","o4766","o4766","10.1107/S1600536807055250","","","0.71073","MoKα","","0.0541","0.0346","","","0.0854","0.0922","","","","","","1.017","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216357","36.34","0.015","11.78","0.005","11.87","0.005","90","","102.714","0.005","90","","4957","4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","8-(4-Chlorophenyl)-11,11-dimethyl-5,9-dioxo-6,8,9,10,11,12-hexahydro- 5<i>H</i>-quinolino[1,2-<i>a</i>]quinazoline-7-carbonitrile <i>N</i>,<i>N</i>-dimethylformamide solvate","","- C28 H27 Cl N4 O3 -","- C28 H27 Cl N4 O3 -","- C224 H216 Cl8 N32 O24 -","8","1","CI2492","Hong Jiang; Shanshan Wu; Chunmei Li","8-(4-Chlorophenyl)-11,11-dimethyl-5,9-dioxo-6,8,9,10,11,12-hexahydro-5<i>H</i>-quinolino[1,2-<i>a</i>]quinazoline-7-carbonitrile <i>N</i>,<i>N</i>-dimethylformamide solvate","Acta Crystallographica Section E","2007","63","12","o4531","o4531","10.1107/S1600536807054037","","","0.71073","MoKα","","0.1448","0.0738","","","0.1776","0.2164","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216358","14.54","0.005","24.005","0.005","15.701","0.005","90","","93.84","0.005","90","","5468","3","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[<i>N</i>,<i>N</i>'-Bis(3-aminopropyl)ethylenediamine]disaccharinatocadmium(II) 0.25-hydrate","","- C22 H30 Cd N6 O6.13 S2 -","- C22 H30 Cd N6 O6.125 S2 -","- C176 H240 Cd8 N48 O49 S16 -","8","2","CI2495","Pas̨aoǧlu, Hümeyra; Kas̨tas̨, Gökhan; Yes̨ilel, Okan Z.; S̨ahin, Onur","[<i>N</i>,<i>N</i>'-Bis(3-aminopropyl)ethylenediamine]disaccharinatocadmium(II) 0.25-hydrate","Acta Crystallographica Section E","2007","63","12","m2953","m2954","10.1107/S1600536807055481","","","0.71073","MoKα","","0.0706","0.0357","","","0.0764","0.084","","","","","","0.831","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216359","12.179","0.002","15.898","0.002","16.42","0.002","90","","102.834","0.004","90","","3099.8","0.7","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>catena</i>-Poly[[[bis(1H-benzimidazole-κN^3^)copper(II)]-μ- 3-(4-carboxylatophenoxy)propionato-κ^2^<i>O</i>:<i>O</i>'] <i>N</i>,<i>N</i>-dimethylformamide solvate pentahydrate]","","- C27 H37 Cu N5 O11 -","- C27 H37 Cu N5 O11 -","- C108 H148 Cu4 N20 O44 -","4","1","CI2497","Li-Li Kong; Shan Gao; Li-Hua Huo; Ng, Seik Weng","<i>catena</i>-Poly[[[bis(1<i>H</i>-benzimidazole-κ<i>N</i>^3^)copper(II)]-μ-3-(4-carboxylatophenoxy)propionato-κ^2^<i>O</i>:<i>O</i>'] <i>N</i>,<i>N</i>-dimethylformamide solvate pentahydrate]","Acta Crystallographica Section E","2007","63","12","m3153","m3153","10.1107/S1600536807060096","","","0.71073","MoKα","","0.1135","0.0711","","","0.2017","0.2471","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216360","13.4075","0.0016","12.1237","0.0009","7.3008","0.001","90","","104.754","0.013","90","","1147.6","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[3-(Trifluoromethyl)phenyl]furo[2,3-<i>c</i>]pyridine","","- C14 H8 F3 N O -","- C14 H8 F3 N O -","- C56 H32 F12 N4 O4 -","4","1","CI2498","Vrábel, Viktor; Švorc, Ľubomír; Bradiaková, Ivana; Kožíšek, Jozef; Krutošíková, Alžbeta","2-[3-(Trifluoromethyl)phenyl]furo[2,3-<i>c</i>]pyridine","Acta Crystallographica Section E","2007","63","12","o4516","o4516","10.1107/S1600536807054062","","","0.71073","MoKα","","0.1268","0.0652","","","0.1234","0.1373","","","","","","1.026","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216361","8.1283","0.0016","10.461","0.002","12.309","0.003","90","","94.04","0.03","90","","1044","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaquabis[3-(2-pyridyl)-1<i>H</i>-pyrazole- κ^2^<i>N</i>^2^,<i>N</i>^3^]cadmium(II) dinitrate","","- C16 H18 Cd N8 O8 -","- C16 H18 Cd N8 O8 -","- C32 H36 Cd2 N16 O16 -","2","0.5","CI2499","Chun-Sen Liu","Diaquabis[3-(2-pyridyl)-1<i>H</i>-pyrazole- κ^2^<i>N</i>^2^,<i>N</i>^3^]cadmium(II) dinitrate","Acta Crystallographica Section E","2007","63","12","m3038","m3039","10.1107/S1600536807054918","","","0.71073","MoKα","","0.0386","0.0245","","","0.055","0.0574","","","","","","0.928","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216362","6.9291","0.0005","10.0551","0.0007","20.62","0.002","78.03","0.001","81.044","0.001","77.266","0.001","1361.71","0.19","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[[diaquabis(μ~2~-terephthalato- κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>''')dizinc(II)] <i>N</i>,<i>N</i>-dimethylacetamide disolvate]","","- C24 H30 N2 O12 Zn2 -","- C24 H30 N2 O12 Zn2 -","- C48 H60 N4 O24 Zn4 -","2","1","CI2501","Lv, Ming; Ng, Seik Weng","Poly[[diaquabis(μ~2~-terephthalato-κ^4^<i>O</i>:<i>O</i>':<i>O</i>'':<i>O</i>''')dizinc(II)] <i>N</i>,<i>N</i>-dimethylacetamide disolvate]","Acta Crystallographica Section E","2007","63","12","m3136","m3136","10.1107/S1600536807060357","","","0.71073","MoKα","","0.0423","0.0354","","","0.0933","0.0988","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216363","9.808","0.004","10.083","0.004","10.274","0.004","70.415","0.005","73.417","0.006","69.768","0.006","881.5","0.6","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","5-(4-Chlorophenyl)-4-(4-methoxyphenyl)-3-(2-pyridyl)-4<i>H</i>-1,2,4-triazole","","- C20 H15 Cl N4 O -","- C20 H15 Cl N4 O -","- C40 H30 Cl2 N8 O2 -","2","1","CI2502","Liu, Zhao-Di; Zhang, Shu-Ping; Wei, Ying; Shao, Si-Chang","5-(4-Chlorophenyl)-4-(4-methoxyphenyl)-3-(2-pyridyl)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2007","63","12","o4634","o4634","10.1107/S160053680705547X","","","0.71073","MoKα","","0.0566","0.0455","","","0.1148","0.1299","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216364","7.3996","0.0006","13.1784","0.0011","15.4245","0.0013","90","","100.664","0.001","90","","1478.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(1<i>H</i>-Benzotriazol-1-yl)-2-bromo-1-<i>o</i>-tolylpropan-1-one","","- C16 H14 Br N3 O -","- C16 H14 Br N3 O -","- C64 H56 Br4 N12 O4 -","4","1","CI2503","Jian-Li Bi; Fang Li; Sai Bi","3-(1<i>H</i>-Benzotriazol-1-yl)-2-bromo-1-<i>o</i>-tolylpropan-1-one","Acta Crystallographica Section E","2007","63","12","o4610","o4610","10.1107/S1600536807055286","","","0.71073","MoKα","","0.0463","0.0346","","","0.0851","0.0903","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216365","8.843","0.003","9.415","0.003","10.861","0.004","77.701","0.005","78.427","0.006","84.221","0.005","863.9","0.5","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","Bis[1-(3,5-dibromobenzyl)pyridinium] bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(II)","","- C32 H20 Br4 N6 Ni S4 -","- C32 H20 Br4 N6 Ni S4 -","- C32 H20 Br4 N6 Ni S4 -","1","0.5","CI2505","Quan-Bin Liao; Ming-Guo Liu; Chun-Lin Ni","Bis[1-(3,5-dibromobenzyl)pyridinium] bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(II)","Acta Crystallographica Section E","2007","63","12","m3003","m3003","10.1107/S1600536807056620","","","0.71073","MoKα","","0.0753","0.0548","","","0.1125","0.1169","","","","","","0.989","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216366","8.2763","0.0008","8.4451","0.0009","18.795","0.002","90","","90","","90","","1313.7","0.2","296","","296","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(<i>E</i>)-4-Bromo-2-[(2-hydroxy-5-methylphenyl)iminomethyl]phenol","","- C14 H12 Br N O2 -","- C14 H12 Br N O2 -","- C56 H48 Br4 N4 O8 -","4","1","CI2507","Gül, Zarife Sibel; Aǧar, Ays̨en Alaman; Is̨ık, S̨amil","(<i>E</i>)-4-Bromo-2-[(2-hydroxy-5-methylphenyl)iminomethyl]phenol","Acta Crystallographica Section E","2007","63","12","o4564","o4564","10.1107/S1600536807055304","","","0.71073","MoKα","","0.088","0.0428","","","0.0734","0.0842","","","","","","0.909","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216367","7.1218","0.0002","10.2061","0.0002","32.9005","0.0007","90","","90","","90","","2391.4","0.1","100","0.1","100","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1,5,8-Trimethyl-1,2-dihydronaphtho[2,1-b]furan-6,7-dione","","- C15 H14 O3 -","- C15 H14 O3 -","- C120 H112 O24 -","8","2","CI2508","Sompong Boonsri; Suchada Chantrapromma; Hoong-Kun Fun; Chatchanok Karalai","1,5,8-Trimethyl-1,2-dihydronaphtho[2,1-<i>b</i>]furan-6,7-dione","Acta Crystallographica Section E","2007","63","12","o4901","o4901","10.1107/S1600536807060291","","","0.71073","MoKα","","0.1128","0.0883","","","0.2396","0.2589","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216368","7.085","0.001","9.048","0.001","13.182","0.001","71.68","0.01","74.93","0.01","82.11","0.01","773.19","0.16","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","Bis[1-(4-fluorobenzyl)pyridinium] bis(2,2-dicyanoethene-1,1-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(II)","","- C32 H22 F2 N6 Ni S4 -","- C32 H22 F2 N6 Ni S4 -","- C32 H22 F2 N6 Ni S4 -","1","0.5","CI2509","Ai-Qun Zhou; Chun-Lin Ni","Bis[1-(4-fluorobenzyl)pyridinium] bis(2,2-dicyanoethene-1,1-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(II)","Acta Crystallographica Section E","2007","63","12","m3084","m3084","10.1107/S160053680705814X","","","0.71073","MoKα","","0.0261","0.025","","","0.0699","0.0707","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216369","9.762","0.001","6.415","0.001","22.611","0.003","90","","94.353","0.002","90","","1411.9","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","<i>catena</i>-Poly[[{2-[2-(isopropylamino)ethyliminomethyl]-4-\ nitrophenolato}copper(II)]-μ-chlorido]","","- C12 H16 Cl Cu N3 O3 -","- C12 H16 Cl Cu N3 O3 -","- C48 H64 Cl4 Cu4 N12 O12 -","4","1","CI2510","Li-Juan Ye; Zhonglu You","<i>catena</i>-Poly[[{2-[2-(isopropylamino)ethyliminomethyl]-4-nitrophenolato}copper(II)]-μ-chlorido]","Acta Crystallographica Section E","2007","63","12","m3137","m3137","10.1107/S1600536807060163","","","0.71073","MoKα","","0.0539","0.0418","","","0.0917","0.0962","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216370","8.834","0.0013","14.84","0.002","12.2062","0.0017","90","","97.057","0.002","90","","1588.1","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,6-Dimethylpyridinium 3-carboxy-4-hydroxybenzenesulfonate monohydrate","","- C14 H17 N O7 S -","- C14 H17 N O7 S -","- C56 H68 N4 O28 S4 -","4","1","CI2511","Su, Kun-Mei; Li, Zhen-Huan","2,6-Dimethylpyridinium 3-carboxy-4-hydroxybenzenesulfonate monohydrate","Acta Crystallographica Section E","2007","63","12","o4900","o4900","10.1107/S1600536807060400","","","0.71073","MoKα","","0.0427","0.0333","","","0.0989","0.1099","","","","","","0.994","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216371","9.0031","0.0012","19.352","0.003","6.9742","0.0009","90","","126.596","0.009","90","","975.6","0.3","296","","296","","","","","","","","","4","C 1 c 1","C -2yc","9","","(1<i>Z</i>,2E)-2-(Hydroxyimino)-<i>N</i>-<i>p</i>-tolylacetamide oxime","","- C9 H11 N3 O2 -","- C9 H11 N3 O2 -","- C36 H44 N12 O8 -","4","1","CI2513","Özek, Arzu; Büyükgüngör, Orhan; Ilkimen, Halil; Yenikaya, Cengiz","(1<i>Z</i>,2<i>E</i>)-2-(Hydroxyimino)-<i>N</i>-<i>p</i>-tolylacetamide oxime","Acta Crystallographica Section E","2007","63","12","o4738","o4738","10.1107/S1600536807058163","","","0.71073","MoKα","","0.0334","0.0318","","","0.0811","0.082","","","","","","1.121","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216372","6.4822","0.0008","7.4181","0.001","13.1433","0.0015","90","","101.425","0.002","90","","619.48","0.13","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","<i>N</i>,<i>N</i>'-Bis(2-thienylmethylene)ethane-1,2-diamine","","- C12 H12 N2 S2 -","- C12 H12 N2 S2 -","- C24 H24 N4 S4 -","2","1","CI2514","Da-Qi Wang; Qiang Wang; Li-Jun Xiao","<i>N</i>,<i>N</i>'-Bis(2-thienylmethylene)ethane-1,2-diamine","Acta Crystallographica Section E","2007","63","12","o4865","o4865","10.1107/S1600536807060308","","","0.71073","MoKα","","0.0762","0.044","","","0.0705","0.0809","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216373","10.224","0.003","8.9132","0.0014","6.9636","0.0014","90","","116.053","0.016","90","","570.1","0.2","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,3-Benzodioxol-2-one","","- C7 H4 O3 -","- C7 H4 O3 -","- C28 H16 O12 -","4","0.5","CI2515","Betz, Richard; Klüfers, Peter","1,3-Benzodioxol-2-one","Acta Crystallographica Section E","2007","63","12","o4713","o4713","10.1107/S1600536807058096","","","0.71073","MoKα","","0.0489","0.0303","","","0.0636","0.0723","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216374","16.9951","0.0007","6.7365","0.0002","14.3313","0.0006","90","","98.221","0.003","90","","1623.89","0.11","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichloridobis(picolinohydrazide)cadmium(II)","","- C12 H14 Cd Cl2 N6 O2 -","- C12 H14 Cd Cl2 N6 O2 -","- C48 H56 Cd4 Cl8 N24 O8 -","4","0.5","CI2521","Van Hecke, Kristof; Nockemann, Peter; Binnemans, Koen; Van Meervelt, Luc","Dichloridobis(picolinohydrazide)cadmium(II)","Acta Crystallographica Section E","2007","63","12","m3187","m3187","10.1107/S1600536807062447","","","1.54178","CuKα","","0.0279","0.0269","","","0.0657","0.0665","","","","","","1.107","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216375","13.701","0.001","13.771","0.001","13.59","0.002","90","","90","","90","","2564.1","0.5","173","2","173","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","(Methyl (S)-3-(imidazol-4-yl)-\ 2-{6-[(S)-2-(imidazol-4-yl)-1-(methoxycarbonyl)ethylaminocarbonyl]pyridine-\ 2-carbonylamino}propionato)copper(II) methanol sesquisolvate","","- C22.5 H25 Cu N7 O7.5 -","- C22.5 H25 Cu N7 O7.5 -","- C90 H100 Cu4 N28 O30 -","4","1","CS2055","Räisänen, Minna T.; Klinga, Martti; Leskelä, Markku; Repo, Timo","(Methyl (<i>S</i>)-3-(imidazol-4-yl)-2-{6-[(<i>S</i>)-2-(imidazol-4-yl)-1-(methoxycarbonyl)ethylaminocarbonyl]pyridine-2-carbonylamino}propionato)copper(II) methanol sesquisolvate","Acta Crystallographica Section E","2007","63","12","m3021","m3021","10.1107/S1600536807056863","","","0.71073","MoKα","","0.0821","0.0448","","","0.0891","0.1007","","","","","","0.923","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216376","8.0065","0.0002","16.901","0.0004","12.0204","0.0003","90","","92.633","0.002","90","","1624.86","0.07","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1,2,4-triazole","3-[(E)-4-(2-Nitrophenyl)vinyl]-1-(trifluoromethyl)- 1,2,4-triazolo[4,3-a]quinoxaline","","- C18 H10 F3 N5 O2 -","- C18 H10 F3 N5 O2 -","- C72 H40 F12 N20 O8 -","4","1","CS2062","A. Thiruvalluvar; M. Subramanyam; R. J. Butcher; S. Wagle; A. V. Adhikari","3-[(<i>E</i>)-4-(2-Nitrophenyl)vinyl]-1-(trifluoromethyl)-1,2,4-triazolo[4,3-<i>a</i>]quinoxaline","Acta Crystallographica Section E","2007","63","12","o4867","o4868","10.1107/S1600536807060783","","","0.71073","MoKα","","0.0768","0.0429","","","0.1145","0.1249","","","","","","0.979","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216377","12.9023","0.0009","16.4032","0.0011","12.1719","0.0008","90","","114.657","0.001","90","","2341.2","0.3","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diethyl 1,4-dioxo-6-(3-pyridyl)perhydro-2,3,4a,6,7a-pentaazacyclopenta[cd]indene- 2a,7b-dicarboxylate 1,2-dichoroethane solvate","","- C20 H26 Cl2 N6 O6 -","- C20 H26 Cl2 N6 O6 -","- C80 H104 Cl8 N24 O24 -","4","1","CV2321","Li-ping Cao; Zhi-guo Wang; Yan Hu","Diethyl 1,4-dioxo-6-(3-pyridyl)perhydro-2,3,4a,6,7a-pentaazacyclopenta[<i>cd</i>]indene-2a,7b-dicarboxylate 1,2-dichoroethane solvate","Acta Crystallographica Section E","2007","63","12","o4540","o4540","10.1107/S1600536807054566","","","0.71073","MoKα","","0.1051","0.0725","","","0.2029","0.2247","","","","","","1.044","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216378","12.452","0.011","12.527","0.011","20.631","0.018","94.152","0.015","97.683","0.014","100.908","0.014","3116","5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2,4-Dibenzoyl-1,3,5-triphenylcyclohexan-1-ol dichloromethane hemisolvate","","- C38.5 H33 Cl O3 -","- C38.5 H33 Cl O3 -","- C154 H132 Cl4 O12 -","4","2","CV2326","Jun-Hong Zhang; Qing-Peng He; Yong-Wang; Da-Qi Wang","2,4-Dibenzoyl-1,3,5-triphenylcyclohexan-1-ol dichloromethane hemisolvate","Acta Crystallographica Section E","2007","63","12","o4652","o4652","10.1107/S1600536807056322","","","0.71073","MoKα","","0.1356","0.0568","","","0.1372","0.1747","","","","","","1.005","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2216379","8.061","0.004","11.529","0.006","17.065","0.009","90","","91.245","0.013","90","","1585.6","1.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","N,N-dibenzylaniline","","- C20 H19 N -","- C20 H19 N -","- C80 H76 N4 -","4","1","CV2328","Tong, Hong-Bo; Zhou, Mei-Su; Bi, Quan-Xi; Chao, Jian-Bin","A new polymorph of <i>N</i>,<i>N</i>-dibenzylaniline","Acta Crystallographica Section E","2007","63","12","o4560","o4560","10.1107/S1600536807054402","","","0.71073","MoKα","","0.1051","0.0691","","","0.1448","0.1601","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216380","8.411","0.0017","16.329","0.003","14.083","0.003","90","","100.87","0.03","90","","1899.5","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[bis(1-vinylimidazole-κN^3^)zinc(II)]-μ-phthalato-κ^2^O^1^:O^2^]","","- C18 H16 N4 O4 Zn -","- C18 H16 N4 O4 Zn -","- C72 H64 N16 O16 Zn4 -","4","1","CV2329","Rong-Xun Li; Shao-Xiang Li; Qi-Ye Wu; Guang-Ye Liu; Fa-Qian Liu","<i>catena</i>-Poly[[bis(1-vinylimidazole-κ<i>N</i>^3^)zinc(II)]-μ-phthalato-κ^2^<i>O</i>^1^:<i>O</i>^2^]","Acta Crystallographica Section E","2007","63","12","m2874","m2874","10.1107/S160053680705355X","","","0.71073","MoKα","","0.0752","0.0451","","","0.0793","0.1391","","","","","","1.077","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216381","5.062","0.0013","16.401","0.004","15.056","0.004","90","","96.522","0.005","90","","1241.9","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Dibenzyl-2,2'-ethylenedioxydibenzamide","","- C30 H28 N2 O4 -","- C30 H28 N2 O4 -","- C60 H56 N4 O8 -","2","0.5","CV2330","Hui-Ling Wen; Qing-Hua Huang; Yong-Hong Wen","<i>N</i>,<i>N</i>'-Dibenzyl-2,2'-ethylenedioxydibenzamide","Acta Crystallographica Section E","2007","63","12","o4547","o4547","10.1107/S1600536807054189","","","0.71073","MoKα","","0.1163","0.0693","","","0.1781","0.2072","","","","","","1.116","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216382","10.017","0.002","13.696","0.003","16.792","0.003","69.84","0.03","81.37","0.03","69.09","0.03","2019.2","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","catena-Poly[[[bis(triphenylphosphine)silver(I)]-μ-6- aminonaphthalene-1-sulfonato-κ^2^O:N] monohydrate]","","- C46 H40 Ag N O4 P2 S -","- C46 H40 Ag N O4 P2 S -","- C92 H80 Ag2 N2 O8 P4 S2 -","2","1","CV2332","Hua Wu; Ying-Ying Liu; Hong-Ye Bai","<i>catena</i>-Poly[[[bis(triphenylphosphine)silver(I)]-μ-6-aminonaphthalene-1-sulfonato-κ^2^<i>O</i>:<i>N</i>] monohydrate]","Acta Crystallographica Section E","2007","63","12","m3027","m3027","10.1107/S1600536807057121","","","0.71073","MoKα","","0.0871","0.0396","","","0.0844","0.1076","","","","","","0.913","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216383","9.1682","0.0018","9.7011","0.0019","12.986","0.003","90.87","0.03","108.79","0.03","94.09","0.03","1089.8","0.4","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","4-Bromo-2-{[2-(2-hydroxybenzylideneamino)phenylimino]phenylmethyl}phenol","","- C26 H19 Br N2 O2 -","- C26 H19 Br N2 O2 -","- C52 H38 Br2 N4 O4 -","2","1","CV2333","Fengke Yang; Yan Wang; Zhantao Zhang","4-Bromo-2-{[2-(2-hydroxybenzylideneamino)phenylimino]phenylmethyl}phenol","Acta Crystallographica Section E","2007","63","12","o4608","o4608","10.1107/S1600536807055018","","","0.71073","MoKα","","0.0506","0.0342","","","0.0845","0.0907","","","","","","1.073","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216384","10.841","0.002","13.426","0.003","8.2811","0.0017","90","","100.737","0.004","90","","1184.2","0.4","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(1<i>H</i>-Benzotriazol-1-yl)-<i>N</i>'-(propan-2-ylidene)acetohydrazide","","- C11 H13 N5 O -","- C11 H13 N5 O -","- C44 H52 N20 O4 -","4","1","CV2334","Zhi-Qiang Shi; Ning-Ning Ji; Ze-Bao Zheng; Ji-Kun Li","2-(1<i>H</i>-Benzotriazol-1-yl)-<i>N</i>'-(propan-2-ylidene)acetohydrazide","Acta Crystallographica Section E","2007","63","12","o4561","o4561","10.1107/S1600536807054347","","","0.71073","MoKα","","0.0838","0.0505","","","0.1559","0.187","","","","","","1.003","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216385","11.434","0.007","14.233","0.009","15.453","0.01","113.92","0.007","92.418","0.008","93.818","0.009","2287","3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","(5-Bromosalicylato)triphenyltin(IV)","","- C25 H19 Br O3 Sn -","- C25 H19 Br O3 Sn -","- C100 H76 Br4 O12 Sn4 -","4","2","CV2335","Hongyun Wang; Handong Yin; Daqi Wang","(5-Bromosalicylato)triphenyltin(IV)","Acta Crystallographica Section E","2007","63","12","m2955","m2955","10.1107/S1600536807055249","","","0.71073","MoKα","","0.1107","0.0497","","","0.0862","0.1037","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216386","10.091","0.002","6.9995","0.0014","12.47","0.003","90","","101.59","0.03","90","","862.8","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","<i>catena</i>-Poly[(m/^2^-2-phenylimidazolato-N,N')-silver(I)]","","- C9 H7 Ag N2 -","- C9 H7 Ag N2 -","- C36 H28 Ag4 N8 -","4","2","CV2336","Gao, Qian; Feng, Jian-Bo; Zhang, Chao-Yan; Xie, Ya-Bo","<i>catena</i>-Poly[silver(I)-μ-2-phenylimidazolato-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","12","m2952","m2952","10.1107/S160053680705533X","","","0.71073","MoKα","","0.0553","0.0412","","","0.064","0.0675","","","","","","0.997","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216387","8.964","0.008","9.656","0.008","15.481","0.013","84.423","0.01","86.911","0.01","63.11","0.008","1189.4","1.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Triphenyl(4-amino-5-phenyl-4H-1,2,4-triazole-3-thiol-κN^2^)tin(IV)","","- C26 H22 N4 S Sn -","- C26 H22 N4 S Sn -","- C52 H44 N8 S2 Sn2 -","2","1","CV2338","Qingfeng Wang; Rufen Zhang; Lingyun Du","(4-Amino-3-phenyl-5-thioxo-4,5-dihydro-1<i>H</i>-1,2,4-triazol-1-yl)triphenyltin(IV)","Acta Crystallographica Section E","2007","63","12","m2959","m2959","10.1107/S1600536807055560","","","0.71073","MoKα","","0.0834","0.0514","","","0.1067","0.122","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216388","7.016","0.003","24.855","0.009","19.422","0.007","90","","98.697","0.014","90","","3348","2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Piperazinediium bis[bis(pyridine-2,6-dicarboxylato)ferrate(III)] monohydrate","","- C32 H26 Fe2 N6 O17 -","- C32 H26 Fe2 N6 O17 -","- C128 H104 Fe8 N24 O68 -","4","1","CV2339","Aghabozorg, Hossein; Nemati, Andya; Derikvand, Zohreh; Ghadermazi, Mohammad","Piperazinediium bis[bis(pyridine-2,6-dicarboxylato)ferrate(III)] monohydrate","Acta Crystallographica Section E","2007","63","12","m2921","m2921","10.1107/S1600536807055468","","","0.71073","MoKα","","0.0756","0.0416","","","0.0678","0.0812","","","","","","0.998","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216389","15.807","0.005","8.324","0.003","13.715","0.005","90","","107.644","0.006","90","","1719.7","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,5-Dimethyl-4-[3-oxo-1,3-bis(trifluoromethyl)prop-1-enylamino]-2-phenyl- 1H-pyrazol-3(2H)-one","","- C16 H13 F6 N3 O2 -","- C16 H13 F6 N3 O2 -","- C64 H52 F24 N12 O8 -","4","1","CV2343","Zhang, Shu-Ming; Zhang, Wen-Jun; Wang, Jin-Ling","1,5-Dimethyl-4-[3-oxo-1,3-bis(trifluoromethyl)prop-1-enylamino]-2-phenyl-1<i>H</i>-pyrazol-3(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","12","o4687","o4687","10.1107/S1600536807056619","","","0.71073","MoKα","","0.1107","0.0428","","","0.0758","0.0932","","","","","","0.983","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216390","8.0213","0.0017","8.5936","0.0018","11.29","0.002","87.066","0.003","76.541","0.004","66.203","0.003","691.7","0.2","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","2,4-Dibromo-6-(4-iodophenyliminomethyl)phenol","","- C13 H8 Br2 I N O -","- C13 H8 Br2 I N O -","- C26 H16 Br4 I2 N2 O2 -","2","1","CV2344","Ming-Lin Guo; Xiu-Ru Nong; Heng Yin","2,4-Dibromo-6-(4-iodophenyliminomethyl)phenol","Acta Crystallographica Section E","2007","63","12","o4640","o4640","10.1107/S1600536807055675","","","0.71073","MoKα","","0.0864","0.0673","","","0.1756","0.1967","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216391","8.478","0.0012","9.2472","0.0015","11.291","0.002","109.914","0.003","94.884","0.002","102.663","0.003","799.6","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","<i>N</i>,<i>N</i>'-Bis(4-pyridylmethylene)benzene-1,4-diamine monohydrate","","- C18 H16 N4 O -","- C18 H16 N4 O -","- C36 H32 N8 O2 -","2","1","CV2345","Qiang Wang; Da-Qi Wang; Yu-Ying Sun","<i>N</i>,<i>N</i>'-Bis(4-pyridylmethylene)benzene-1,4-diamine monohydrate","Acta Crystallographica Section E","2007","63","12","o4665","o4665","10.1107/S1600536807056711","","","0.71073","MoKα","","0.1211","0.0663","","","0.1734","0.2305","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216392","12.833","0.005","11.445","0.005","24.888","0.01","90","","93.696","0.006","90","","3648","3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')sodium(I)]- μ-aqua-[diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')sodium(I)]-μ-aqua] dibromide 1,10-phenanthroline solvate]","","- C36 H34 Br2 N6 Na2 O5 -","- C36 H34 Br2 N6 Na2 O5 -","- C144 H136 Br8 N24 Na8 O20 -","4","1","CV2346","Jun Zhai; Handong Yin; Daqi Wang","<i>catena</i>-Poly[[[aqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')sodium(I)]-μ-aqua-[diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')sodium(I)]-μ-aqua] dibromide 1,10-phenanthroline solvate]","Acta Crystallographica Section E","2007","63","12","m3006","m3006","10.1107/S1600536807057352","","","0.71073","MoKα","","0.1365","0.0521","","","0.105","0.145","","","","","","0.846","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216393","6.815","0.0008","28.981","0.0016","15.448","0.00008","90","","99.226","0.002","90","","3011.6","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Aqua(1,10-phenanthroline-κN,N')bis(2,3,4,5-tetrafluorobenzoato-κO)copper(II) 1,2,3,4-tetrafluorobenzene solvate","","- C32 H14 Cu F12 N2 O5 -","- C32 H14 Cu F12 N2 O5 -","- C128 H56 Cu4 F48 N8 O20 -","4","1","CV2347","Junshan Sun; Chunlin Ma; Guofang He; Jikun Li","Aqua(1,10-phenanthroline-κ<i>N</i>,<i>N</i>')bis(2,3,4,5-tetrafluorobenzoato-κ<i>O</i>)copper(II) 1,2,3,4-tetrafluorobenzene solvate","Acta Crystallographica Section E","2007","63","12","m3048","m3048","10.1107/S1600536807056887","","","0.71073","MoKα","","0.1589","0.0758","","","0.1842","0.2405","","","","","","1.033","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216394","12.979","0.006","7.418","0.003","13.881","0.006","90","","101.064","0.007","90","","1311.6","1","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-{[2-Chloro-5-(trifluoromethyl)phenyl]iminomethyl]phenol","","- C14 H9 Cl F3 N O -","- C14 H9 Cl F3 N O -","- C56 H36 Cl4 F12 N4 O4 -","4","1","CV2348","Ming-Hua Yang; Yun-Fa Zheng","2-{[2-Chloro-5-(trifluoromethyl)phenyl]iminomethyl]phenol","Acta Crystallographica, Section E","2007","63","12","o4677","o4677","10.1107/S1600536807057017","","","0.71073","MoKα","","0.0494","0.0299","","","0.0668","0.0702","","","","","","0.962","","","","has coordinates,has disorder","176787","2020-10-21","18:00:00",""
"2216395","20.276","0.002","21.9129","0.0009","22.058","0.002","90","","90","","90","","9800.5","1.4","293","2","293","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","catena-Poly[neodymate(III)bis[μ-dimethyl(phenylsulfonyl)amidophosphato]-\ sodium(I)bis[μ-dimethyl(phenylsulfonyl)amidophosphato]]","","- C32 H44 N4 Na Nd O20 P4 S4 -","- C32 H44 N4 Na Nd O20 P4 S4 -","- C256 H352 N32 Na8 Nd8 O160 P32 S32 -","8","2","CV2351","Olesia V. Moroz; Svitlana V. Shishkina; Viktor A. Trush; Tetyana Yu. Sliva; Volodymyr M. Amirkhanov","<i>catena</i>-Poly[neodymate(III)bis[μ-dimethyl(phenylsulfonyl)amidophosphato]sodium(I)bis[μ-dimethyl(phenylsulfonyl)amidophosphato]]","Acta Crystallographica Section E","2007","63","12","m3175","m3176","10.1107/S1600536807060023","","","0.71073","MoKα","","0.1085","0.0535","","","0.1286","0.1518","","","","","","0.895","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216396","11.054","0.002","8.9058","0.0018","15.306","0.003","90","","105.037","0.003","90","","1455.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis[N-(2-pyridylmethyl)benzamide-κ^2^O,N]zinc(II) dinitrate","","- C26 H28 N6 O10 Zn -","- C26 H28 N6 O10 Zn -","- C52 H56 N12 O20 Zn2 -","2","0.5","CV2353","Xiao-Ru Zhang; Bao-Ping Qi; Fang Li; Sai Bi","Diaquabis[<i>N</i>-(2-pyridylmethyl)benzamide-κ^2^<i>O</i>,<i>N</i>]zinc(II) dinitrate","Acta Crystallographica Section E","2007","63","12","m3068","m3068","10.1107/S1600536807058357","","","0.71073","MoKα","","0.0449","0.0357","","","0.0943","0.1008","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216397","30.6054","0.00012","10.1073","0.0004","8.1631","0.0003","90","","90","","90","","2525.16","0.14","298","2","298","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","4,4',5,5'-Tetraphenyl-2,2'-dithiodi-1,3-oxazole","","- C30 H20 N2 O2 S2 -","- C30 H20 N2 O2 S2 -","- C120 H80 N8 O8 S8 -","4","0.5","CV2354","Jikun Li; Guofang He","4,4',5,5'-Tetraphenyl-2,2'-dithiodi-1,3-oxazole","Acta Crystallographica Section E","2007","63","12","o4783","o4783","10.1107/S1600536807058369","","","0.71073","MoKα","","0.1583","0.0525","","","0.0876","0.1079","","","","","","1","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216398","8.3009","0.0017","13.972","0.003","10.814","0.002","90","","90.27","0.03","90","","1254.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Poly[(2,2'-bipyridyl)-μ~3~-cyano-di-μ~2~-cyano-dicopper(I,II)]","","- C13 H8 Cu2 N5 -","- C13 H8 Cu2 N5 -","- C52 H32 Cu8 N20 -","4","1","CV2355","Rui, Yu-lan; Lu, Mai-xi","Poly[(2,2'-bipyridyl)-μ~3~-cyanido-di-μ~2~-cyanido-dicopper(I,II)]","Acta Crystallographica, Section E: Structure Reports Online","2007","63","12","m3134","m3134","10.1107/S1600536807060771","","","0.71073","MoKα","","0.0393","0.0313","","","0.0777","0.0808","","","","","","1.086","","","","has coordinates,has Fobs","209473","2020-10-21","18:00:00",""
"2216399","9.7994","0.0014","27.571","0.004","10.8814","0.0016","90","","113.816","0.002","90","","2689.6","0.7","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2<i>Z</i>)-2-Methylsulfanyl-1,4-di-2-thienylbut-2-ene-1,4-dione","","- C13 H10 O2 S3 -","- C13 H10 O2 S3 -","- C104 H80 O16 S24 -","8","2","CV2356","Chen, Ai-Hua; Wu, Jun","(2<i>Z</i>)-2-Methylsulfanyl-1,4-di-2-thienylbut-2-ene-1,4-dione","Acta Crystallographica Section E","2007","63","12","o4810","o4810","10.1107/S1600536807059533","","","0.71073","MoKα","","0.0504","0.0446","","","0.1237","0.1287","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216400","6.1224","0.0001","6.8021","0.0001","8.7056","0.0001","110.539","0.001","105.431","0.001","94.732","0.001","320.992","0.009","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","<i>trans</i>-Diaquadichloridobis(<i>N</i>,<i>N</i>-dimethylformamide-\ κ<i>O</i>)manganese(II)","","- C6 H18 Cl2 Mn N2 O4 -","- C6 H18 Cl2 Mn N2 O4 -","- C6 H18 Cl2 Mn N2 O4 -","1","0.5","CV2357","Sluch, Ilya M.; Slaughter, LeGrande M.","<i>trans</i>-Diaquadichloridobis(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)manganese(II)","Acta Crystallographica Section E","2007","63","12","m3095","m3095","10.1107/S1600536807059508","","","0.71073","MoKα","","0.0185","0.017","","","0.0492","0.0506","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216401","5.2594","0.001","16.342","0.003","8.1426","0.0015","90","","97.939","0.002","90","","693.1","0.2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Poly[tetraaqua(μ~6~-benzene-1,2,4,5-tetracarboxylato)dicopper(II)]","","- C5 H5 Cu O6 -","- C5 H5 Cu O6 -","- C20 H20 Cu4 O24 -","4","1","CV2358","Ling, Zhang","Poly[tetraaqua(μ~6~-benzene-1,2,4,5-tetracarboxylato)dicopper(II)]","Acta Crystallographica Section E","2007","63","12","m3190","m3190","10.1107/S1600536807062198","","","0.71073","MoKα","","0.0472","0.046","","","0.1105","0.1117","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216402","4.7573","0.0002","9.7204","0.0006","14.2018","0.0008","90","","94.216","0.003","90","","654.95","0.06","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,2'-Bis(trifluoromethyl)azobenzene","2,2'-Bis(trifluoromethyl)diphenyldiazene","","- C14 H8 F6 N2 -","- C14 H8 F6 N2 -","- C28 H16 F12 N4 -","2","0.5","CV2362","Betz, Richard; Klüfers, Peter","2,2'-Bis(trifluoromethyl)diphenyldiazene","Acta Crystallographica Section E","2007","63","12","o4920","o4920","10.1107/S160053680706206X","","","0.71073","MoKα","","0.0609","0.0358","","","0.0941","0.1052","","","","","","1.051","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216403","17.92","0.002","10.4888","0.0014","10.366","0.0014","90","","92.638","0.002","90","","1946.3","0.4","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,4-Di-<i>tert</i>-butyl-6-(4-chlorophenyliminomethyl)phenol","","- C21 H26 Cl N O -","- C21 H26 Cl N O -","- C84 H104 Cl4 N4 O4 -","4","1","CV2363","Jikun Li; Rengao Zhao; Chunlin Ma","2,4-Di-<i>tert</i>-butyl-6-(4-chlorophenyliminomethyl)phenol","Acta Crystallographica Section E","2007","63","12","o4923","o4923","10.1107/S1600536807062083","","","0.71073","MoKα","","0.0935","0.0648","","","0.2158","0.255","","","","","","0.996","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216404","4.1213","0.0005","11.4948","0.0012","14.831","0.0014","90","","90","","90","","702.6","0.13","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","ortho-Iodobenzaldehyde","2-Iodobenzaldehyde","","- C7 H5 I O -","- C7 H5 I O -","- C28 H20 I4 O4 -","4","1","CV2365","Betz, Richard; Klüfers, Peter","2-Iodobenzaldehyde","Acta Crystallographica Section E","2007","63","12","o4879","o4879","10.1107/S1600536807061272","","","0.71073","MoKα","","0.029","0.0247","","","0.0466","0.0486","","","","","","0.977","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216405","17.97","0.004","7.137","0.0014","26.305","0.005","90","","104.73","0.03","90","","3262.8","1.2","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-(2,4-Dinitrophenyl)-2-(3-phenylallylidene)hydrazine pyridine solvate","","- C35 H29 N9 O8 -","- C35 H29 N9 O8 -","- C140 H116 N36 O32 -","4","0.5","DN2254","Yin, Zhi-Gang; Qian, Heng-Yu; Chen, Yu-Zhen; Feng, Yu-Li","1-(2,4-Dinitrophenyl)-2-(3-phenylallylidene)hydrazine pyridine hemisolvate","Acta Crystallographica Section E","2007","63","12","o4625","o4625","10.1107/S1600536807055444","","","0.71073","MoKα","","0.0943","0.0635","","","0.1312","0.1433","","","","","","1.126","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2216406","10.8041","0.0009","10.0189","0.0009","36.119","0.003","90","","90","","90","","3909.7","0.6","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(+/-)-3-(2,6-Dichlorophenyl)-1-phenyl-2,3-dihydro-1<i>H</i>-naphtho[1,2-\ <i>e</i>][1,3]oxazine","","- C24 H17 Cl2 N O -","- C24 H17 Cl2 N O -","- C192 H136 Cl16 N8 O8 -","8","1","DN2255","Yin, Zhi-Gang; Qian, Heng-Yu; Chen Yu-Zhen; Feng Yu-Li","(±)-3-(2,6-Dichlorophenyl)-1-phenyl-2,3-dihydro-1<i>H</i>-naphtho[1,2-<i>e</i>][1,3]oxazine","Acta Crystallographica Section E","2007","63","12","o4626","o4626","10.1107/S1600536807055432","","","0.71073","MoKα","","0.0859","0.0503","","","0.1315","0.1512","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216407","14.2225","0.0008","8.2788","0.0005","14.7043","0.0008","90","","90","","90","","1731.36","0.17","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","iron(II) monohydrate]","","- C4 H10 Fe O8 -","- C4 H10 Fe O8 -","- C32 H80 Fe8 O64 -","8","1","DN2256","Licai Zhu; Feng Sun","Poly[[diaqua-μ~3~-malonato-iron(II)] monohydrate]","Acta Crystallographica Section E","2007","63","12","m2966","m2966","10.1107/S1600536807055377","","","0.71073","MoKα","","0.033","0.0283","","","0.0787","0.0827","","","","","","1.104","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216408","6.3433","0.0003","28.903","0.0008","6.9439","0.0003","90","","109.821","0.005","90","","1197.67","0.09","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","pyrimidine derivative","Ethyl 5-amino-1-(5-bromopyrimidin-2-yl)-1<i>H</i>-pyrazole-4-carboxylate","","- C10 H10 Br N5 O2 -","- C10 H10 Br N5 O2 -","- C40 H40 Br4 N20 O8 -","4","1","DN2257","M. Subramanyam; B. Lingappa; A. Thiruvalluvar; Balakrishna Kalluraya; R. J. Butcher","Ethyl 5-amino-1-(5-bromopyrimidin-2-yl)-1<i>H</i>-pyrazole-4-carboxylate","Acta Crystallographica Section E","2007","63","12","o4535","o4535","10.1107/S1600536807054554","","","0.7107","MoKα","","0.074","0.0301","","","0.0613","0.0771","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216409","42.179","0.008","5.355","0.001","12.068","0.002","90","","105.688","0.003","90","","2624.2","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","diaquabis{4-[(6-chloropyridin-3-yl)methoxy]benzoato}cadmium(II)","","- C26 H22 Cd Cl2 N2 O8 -","- C26 H22 Cd Cl2 N2 O8 -","- C104 H88 Cd4 Cl8 N8 O32 -","4","0.5","DN2258","Shun-Li Li; Jie Liu; Ying-Ying Liu","Diaquabis{4-[(6-chloropyridin-3-yl)methoxy]benzoato}cadmium(II)","Acta Crystallographica Section E","2007","63","12","m2956","m2956","10.1107/S1600536807055341","","","0.71069","MoKα","","0.0449","0.0377","","","0.0941","0.1069","","","","","","1.089","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216410","13.4008","0.0013","8.488","0.0009","20.112","0.002","90","","106.191","0.007","90","","2196.9","0.4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Poly[(2,3'-dipyridylamine)(tetraacetyl)dinickel(II)]","Poly[(tetraacetyl-κ^2^N:N')dinickel(II)-μ-2,3'-dipyridylamine-κ^2^O:O']","","- C18 H19 N3 Ni2 O8 -","- C18 H19 N3 Ni2 O8 -","- C72 H76 N12 Ni8 O32 -","4","0.5","DN2259","Ling Zhang","<i>catena</i>-Poly[[tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-dinickel(II)]-μ-2,3'-dipyridylamine-κ^2^<i>N</i>:<i>N</i>']","Acta Crystallographica Section E","2007","63","12","m2950","m2950","10.1107/S1600536807055353","","","0.71073","MoKα","","0.1231","0.0541","","","0.1117","0.1323","","","","","","0.999","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216411","8.7567","0.0013","15.6682","0.0017","12.5488","0.0018","90","","106.75","0.016","90","","1648.7","0.4","183","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di-μ-methoxo-bis[aquadimethoxonitrosylmolybdenum(II)]","","- C6 H22 Mo2 N2 O10 -","- C6 H22 Mo2 N2 O10 -","- C24 H88 Mo8 N8 O40 -","4","1","DN2260","Bucher, Jolanta; Blacque, Olivier; Berke, Heinz","Di-μ-methoxo-bis[aquadimethoxonitrosylmolybdenum(II)]","Acta Crystallographica Section E","2007","63","12","m2935","m2936","10.1107/S1600536807055894","","","0.71073","MoKα","","","0.041","","","","0.1278","","","","","","1.107","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216412","20.445","0.003","7.1533","0.0009","18.828","0.003","90","","111.178","0.002","90","","2567.6","0.6","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Diethyl 4,4'-[(1,3-dioxolane-2,2-diyl)bis(propylideneoxy)]dibenzoate","","- C27 H34 O8 -","- C27 H34 O8 -","- C108 H136 O32 -","4","1","DN2261","Lai-Ping Zhang; Zhi-Fang Jia; Guo-Hua Wei; Ying-Ying Liu","Diethyl 4,4'-[(1,3-dioxolane-2,2-diyl)bis(propylideneoxy)]dibenzoate","Acta Crystallographica Section E","2007","63","12","o4674","o4674","10.1107/S1600536807057200","","","0.71073","MoKα","","0.0706","0.0472","","","0.1226","0.1375","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216413","11.4729","0.0011","5.9019","0.0004","12.5093","0.001","90","","107.81","0.01","90","","806.44","0.12","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(4<i>S</i>)-Benzyl 4-benzyl-5-oxo-1,3-oxazolidine-3-carboxylate","","- C18 H17 N O4 -","- C18 H17 N O4 -","- C36 H34 N2 O8 -","2","1","DN2262","Zhang, Xing-Hua; Lin, Kan; Zhao, Yu-Fen","(4<i>S</i>)-Benzyl 4-benzyl-5-oxo-1,3-oxazolidine-3-carboxylate","Acta Crystallographica Section E","2007","63","12","o4767","o4767","10.1107/S1600536807055365","","","0.71073","MoKα","","0.0453","0.0309","","","0.0659","0.0715","","","","","","0.946","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216414","8.708","0.002","35.97","0.01","15.032","0.004","90","","95.952","0.006","90","","4683","2","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N-Bis(2-bromobenzyl)-2,6-diisopropylaniline","","- C26 H29 Br2 N -","- C26 H29 Br2 N -","- C208 H232 Br16 N8 -","8","2","DN2263","Comsa, Carmen; Silvestru, Cristian; Varga, Richard A.","<i>N</i>,<i>N</i>-Bis(2-bromobenzyl)-2,6-diisopropylaniline","Acta Crystallographica Section E","2007","63","12","o4714","o4714","10.1107/S160053680705670X","","","0.71073","MoKα","","0.1027","0.0529","","","0.0999","0.1182","","","","","","1.013","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216415","8.1467","0.0012","15.562","0.002","10.7457","0.0012","90","","121.147","0.008","90","","1165.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(<i>E</i>)-<i>N</i>-(2-Hydroxybenzylidene)isonicotinohydrazide","","- C13 H11 N3 O2 -","- C13 H11 N3 O2 -","- C52 H44 N12 O8 -","4","1","DN2264","Yong-Ji Xu; Shuang Zhao; Sai Bi","(<i>E</i>)-<i>N</i>-(2-Hydroxybenzylidene)isonicotinohydrazide","Acta Crystallographica Section E","2007","63","12","o4633","o4633","10.1107/S1600536807055730","","","0.71073","MoKα","","0.0425","0.0367","","","0.0971","0.1037","","","","","","1.069","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216416","12.476","0.002","7.0786","0.0014","17.929","0.004","90","","103.014","0.003","90","","1542.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(dimethylglyoxime-κ^2^N,N')(3,5-dinitro-2-oxidobenzoato- κ^2^O,O')nickel(II)","","- C11 H12 N4 Ni O10 -","- C11 H12 N4 Ni O10 -","- C44 H48 N16 Ni4 O40 -","4","1","DN2265","Liu, Yin-Qiu","Aqua(dimethylglyoxime-κ^2^<i>N</i>,<i>N</i>')(3,5-dinitro-2-oxidobenzoato-κ^2^<i>O</i>,<i>O</i>')nickel(II)","Acta Crystallographica Section E","2007","63","12","m3002","m3002","10.1107/S1600536807056681","","","0.71073","MoKα","","0.0312","0.0264","","","0.0707","0.0728","","","","","","1.069","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216417","23.7359","0.0013","10.6749","0.0006","11.1128","0.0006","90","","104.149","0.005","90","","2730.3","0.3","120","2","120","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(7Z,7'Z)-2,2-Dimethyl-7,7'-(1,2,4-trithiolane-3,5-diylidene)bis[quinolin- 8(7H)-one] chloroform disolvate","","- C24 H16 Cl6 N2 O2 S3 -","- C24 H16 Cl6 N2 O2 S3 -","- C96 H64 Cl24 N8 O8 S12 -","4","0.5","DN2267","Chojnacki, Jaroslaw; Skop, Patrycja; Pladzyk, Agnieszka; Nycz, Jacek E.","(7<i>Z</i>,7'<i>Z</i>)-2,2-Dimethyl-7,7'-(1,2,4-trithiolane-3,5-diylidene)bis[quinolin-8(7<i>H</i>)-one] chloroform disolvate","Acta Crystallographica Section E","2007","63","12","o4773","o4774","10.1107/S1600536807058217","","","0.71073","MoKα","","0.0648","0.0544","","","0.1161","0.1266","","","","","","1.121","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216418","15.912","0.002","11.4246","0.0015","12.237","0.0016","90","","90","","90","","2224.5","0.5","298","2","298","2","","","","","","","","6","P n n m","-P 2 2n","58","","[6-Phenyl-2,4-bis(2-pyridylamino)-1,3,5-triazine]sulfatonickel(II) dihydrate","","- C19 H19 N7 Ni O6 S -","- C19 H19 N7 Ni O6 S -","- C76 H76 N28 Ni4 O24 S4 -","4","0.5","DN2269","Fu-Min Wang","[6-Phenyl-2,4-bis(2-pyridylamino)-1,3,5-triazine]sulfatonickel(II) dihydrate","Acta Crystallographica Section E","2007","63","12","m2996","m2997","10.1107/S1600536807056772","","","0.71073","MoKα","","0.0444","0.0341","","","0.0864","0.0921","","","","","","1.067","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216419","4.486","0.0015","20.379","0.007","9.497","0.003","90","","94.651","0.004","90","","865.4","0.5","298","2","298","2","","","","","","","","4","P 1 c 1","P -2yc","7","","9-Benzylidene-2,7-dichloro-4-oxiranyl-9<i>H</i>-fluorene","","- C22 H14 Cl2 O -","- C22 H14 Cl2 O -","- C44 H28 Cl4 O2 -","2","1","DN2271","Guo-Wu Rao; Zhi-Yan Hu; Ren-Hua Zheng; Ji-Zhong Yan","9-Benzylidene-2,7-dichloro-4-oxiranyl-9<i>H</i>-fluorene","Acta Crystallographica Section E","2007","63","12","o4786","o4786","10.1107/S1600536807057704","","","0.71073","MoKα","","0.0593","0.0487","","","0.1268","0.148","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216420","6.8715","0.0008","4.0423","0.0005","23.602","0.003","90","","91.058","0.002","90","","655.47","0.14","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-bis(2-bromobenzylidene)hydrazine","","- C14 H10 Br2 N2 -","- C14 H10 Br2 N2 -","- C28 H20 Br4 N4 -","2","0.5","DN2272","Yun-Hua Zheng; Ming-Hua Yang","Redetermination of 1,2-bis(2-bromobenzylidene)hydrazine","Acta Crystallographica Section E","2007","63","12","o4732","o4732","10.1107/S1600536807057911","","","0.71073","MoKα","","0.0545","0.0506","","","0.1284","0.1301","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216421","13.267","0.003","9.2456","0.0018","9.1109","0.0018","90","","109.11","0.03","90","","1056","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(μ~2~-Cyano)-2-[2-methyl(1H-benzo[d]imidazol-1-yl)acetonitrile]copper(I)","","- C11 H9 Cu N4 -","- C11 H9 Cu N4 -","- C44 H36 Cu4 N16 -","4","1","DN2273","Hang, Tian; Fu, Da-Wei; Ye, Qiong","<i>catena</i>-Poly[[[2-(2-methyl-1<i>H</i>-benzimidazol-1-yl)acetonitrile-κ<i>N</i>^3^]copper(I)]-μ-cyanido]","Acta Crystallographica Section E","2007","63","12","m3123","","10.1107/S1600536807059867","","","0.71073","MoKα","","0.1112","0.0587","","","0.1044","0.1205","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216422","3.39","0.0007","12.59","0.003","12.17","0.002","90","","94.18","0.03","90","","518.04","0.19","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Bis(2-pyridinecarboxylic acid <i>N</i>-oxide)nickel(II)","Bis(<i>N</i>-oxido-2-pyridinecarboxylato-κ^2^O,O')nickel(II)","","- C12 H8 N2 Ni O6 -","- C12 H8 N2 Ni O6 -","- C24 H16 N4 Ni2 O12 -","2","0.5","DN2274","Liang-Gui, Wang","Bis(2-pyridinecarboxylato <i>N</i>-oxide-κ^2^<i>O</i>,<i>O</i>')nickel(II)","Acta Crystallographica Section E","2007","63","12","m3168","m3168","10.1107/S1600536807059958","","","0.71073","MoKα","","0.0219","0.0199","","","0.0508","0.0514","","","","","","1.124","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216423","6.395","0.0013","5.079","0.001","19.625","0.004","90","","98.65","0.03","90","","630.2","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]phenol","","- C14 H9 Br N2 O2 -","- C14 H9 Br N2 O2 -","- C28 H18 Br2 N4 O4 -","2","1","DN2275","Li, Hai-lin; Wang, Hai-bo; Yin, Jun; Kang, Si-shun; Zeng, Hai-su","2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]phenol","Acta Crystallographica Section E","2007","63","12","o4697","o4697","10.1107/S1600536807057418","","","0.71073","MoKα","","0.085","0.0473","","","0.098","0.1138","","","","","","0.943","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216424","13.4864","0.0002","24.6003","0.0006","8.8726","0.0002","90","","90","","90","","2943.66","0.11","173","2","173","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","2-Methoxy-<i>N</i>'-(morpholin-4-ylcarbothioyl)benzohydrazide hemihydrate","","- C13 H18 N3 O3.5 S -","- C13 H18 N3 O3.5 S -","- C104 H144 N24 O28 S8 -","8","1","DN2277","Singh, N. K.; Singh, Mamata; Srivastava, Ajay K.; Shrivastav, Anuraag; Sharma, R. K.","2-Methoxy-<i>N</i>'-(morpholin-4-ylcarbonothioyl)benzohydrazide hemihydrate","Acta Crystallographica Section E","2007","63","12","o4895","o4895","10.1107/S1600536807060515","","","0.71073","MoKα","","0.0636","0.0446","","","0.1084","0.1182","","","","","","1.045","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216425","5.915","0.003","11.96","0.006","17.678","0.008","90","","90.427","0.008","90","","1250.6","1.1","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Oxo-N-(2-pyridyl)-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-4-carboxamide","","- C10 H11 N2 O5 P -","- C10 H11 N2 O5 P -","- C40 H44 N8 O20 P4 -","4","1","DN2280","Guo-Feng Chen; Jing Hu; Guo-Chun Ma","1-Oxo-<i>N</i>-(2-pyridyl)-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-4-carboxamide","Acta Crystallographica Section E","2007","63","12","o4894","o4894","10.1107/S160053680706120X","","","0.71073","MoKα","","0.0665","0.0393","","","0.0895","0.1015","","","","","","1.016","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216426","19.178","0.002","27.968","0.003","9.423","0.0013","90","","103.238","0.002","90","","4919.9","1","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[4-Chloro-N'-(3-methoxy-2-oxidobenzylidene)benzohydrazidato]diphenyltin(IV)","","- C27 H21 Cl N2 O3 Sn -","- C27 H21 Cl N2 O3 Sn -","- C216 H168 Cl8 N16 O24 Sn8 -","8","2","DN2284","Jichun Cui; Handong Yin; Yanling Qiao","[4-Chloro-<i>N</i>'-(3-methoxy-2-oxidobenzylidene)benzohydrazidato]diphenyltin(IV)","Acta Crystallographica Section E","2007","63","12","m3189","m3189","10.1107/S1600536807062307","","","0.71073","MoKα","","0.0929","0.0445","","","0.0739","0.0869","","","","","","1.012","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216427","7.7762","0.0016","10.301","0.002","10.744","0.002","79.79","0.03","78.85","0.03","73.64","0.03","803.3","0.3","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","N,N'-(m-Phenylenedimethylidyne)dianiline","","- C20 H16 N2 -","- C20 H16 N2 -","- C40 H32 N4 -","2","1","EM2001","Li-Na Zhu; Shan Gao; Li-Hua Huo","<i>N</i>,<i>N</i>'-(<i>m</i>-Phenylenedimethylidyne)dianiline","Acta Crystallographica Section E","2007","63","12","o4924","o4924","10.1107/S1600536807061818","","","0.71073","MoKα","","0.0572","0.0435","","","0.1225","0.1304","","","","","","1.095","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216428","5.1149","0.0001","11.4001","0.0003","14.4864","0.0004","90","","98.97","0.001","90","","834.38","0.04","100","2","100","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","[Butane-1,4-diylbis(nitrilodiethylidene)]tetraacetonitrile","","- C16 H24 N6 -","- C16 H24 N6 -","- C32 H48 N12 -","2","0.5","ER2046","Meijboom, Reinout","[Butane-1,4-diylbis(nitrilodiethylidene)]tetraacetonitrile","Acta Crystallographica Section E","2007","63","12","o4793","o4793","10.1107/S1600536807058266","","","0.71073","MoKα","","","0.0372","","","","0.0918","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216429","6.696","0.002","9.395","0.003","12.578","0.004","100.262","0.005","104.72","0.005","110.075","0.005","687.4","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>-Cyclohexylcarbonyl-<i>N</i>'-phenylthiourea","","- C14 H18 N2 O S -","- C14 H18 N2 O S -","- C28 H36 N4 O2 S2 -","2","1","EZ2104","Yusof, M. Sukeri M.; Asrab, Siti 'Afifah Tunnur M.; Yamin, Bohari M.","<i>N</i>-Cyclohexylcarbonyl-<i>N</i>'-phenylthiourea","Acta Crystallographica Section E","2007","63","12","o4627","o4627","10.1107/S1600536807055079","","","0.71073","MoKα","","0.0408","0.0346","","","0.0881","0.0918","","","","","","1.066","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216430","10.949","0.002","16.047","0.003","14.456","0.003","90","","101.92","0.03","90","","2485.1","0.9","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(2,2'-bipyridine)(nitrato-κ^2^O,O')cobalt(III) hydroxide nitrate tetrahydrate","","- C20 H25 Co N6 O11 -","- C20 H25 Co N6 O11 -","- C80 H100 Co4 N24 O44 -","4","0.5","EZ2106","Wojciechowska, A.; Daszkiewicz, M.","Reinvestigation of bis(2,2'-bipyridine)(nitrato-κ^2^<i>O</i>,<i>O</i>')cobalt(III) hydroxide nitrate tetrahydrate","Acta Crystallographica Section E","2007","63","12","m2975","m2976","10.1107/S160053680705605X","","","0.71073","MoKα","","0.0484","0.043","","","0.1174","0.1227","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216431","5.229","0.003","11.875","0.006","13.161","0.006","90","","90","","90","","817.2","0.7","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","7-hydroxy-4-methylcoumarin","7-hydroxy-4-methyl-2H-1-Benzopyran-2-one","","- C10 H8 O3 -","- C10 H8 O3 -","- C40 H32 O12 -","4","1","EZ2107","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Xia, Hai-Tao","Redetermination of 7-hydroxy-4-methyl-2<i>H</i>-1-benzopyran-2-one","Acta Crystallographica Section E","2007","63","12","o4643","o4643","10.1107/S1600536807056085","","","0.71073","MoKα","","0.0496","0.0375","","","0.0868","0.0976","","","","","","1.077","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216432","12.4146","0.0002","15.3531","0.0002","30.3448","0.0005","90","","90","","90","","5783.8","0.15","200","2","200","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","ReO(oxalate)2(PPh3)","Triethylammonium bis(oxalato)oxido(triphenylphosphane)rhenate(V)","","- C28 H31 N O9 P Re -","- C28 H31 N O9 P Re -","- C224 H248 N8 O72 P8 Re8 -","8","1","EZ2113","Grimminger, Philipp; Klüfers, Peter","Triethylammonium bis(oxalato)oxido(triphenylphosphane)rhenate(V)","Acta Crystallographica Section E","2007","63","12","m3188","m3188","10.1107/S1600536807061879","","","0.71073","MoKα","","0.0806","0.0334","","","0.0657","0.079","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216433","7.2427","0.0005","11.7111","0.0008","9.0742","0.0006","90","","90.413","0.002","90","","769.65","0.09","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Rubidium potassium hexafluoridozirconate(IV) bis(hydrogen fluoride)","","- F8 H2 K0.4191 Rb1.5829 Zr -","- F8 H2 K0.4171 Rb1.5829 Zr -","- F32 H8 K1.6684 Rb6.3316 Zr4 -","4","1","FI2047","Gerasimenko, A. V.; Didenko, N. A.; Kavun, V. Ya.","Rubidium potassium hexafluoridozirconate(IV) bis(hydrogen fluoride), Rb~2{-~<i>x</i>}K~<i>x~</i>ZrF~6~·2HF (<i>x</i> = 0.4171)","Acta Crystallographica Section E","2007","63","12","i198","i198","10.1107/S1600536807058278","","","0.71073","MoKα","","0.0295","0.026","","","0.0598","0.0607","","","","","","1.063","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216434","7.498","0.003","14.017","0.005","19.455","0.007","107.846","0.004","94.85","0.005","104.759","0.004","1852.5","1.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Aquabis(<i>o</i>-phenylenediamine-κ^2^<i>N</i>,<i>N</i>')(<i>o</i>- phenylenediamine-κ<i>N</i>)zinc(II) bis(<i>p</i>-toluenesulfonate) trihydrate","","- C32 H46 N6 O10 S2 Zn -","- C32 H46 N6 O10 S2 Zn -","- C64 H92 N12 O20 S4 Zn2 -","2","1","FJ2049","Qian, Bao-hua; Ma, Wei-Xing; Lu, Lu-De; Yang, Xu-Jie; Wang, Xin","Aquabis(<i>o</i>-phenylenediamine-κ^2^<i>N</i>,<i>N</i>')(<i>o</i>-phenylenediamine-κ<i>N</i>)zinc(II) bis(<i>p</i>-toluenesulfonate) trihydrate","Acta Crystallographica Section E","2007","63","12","m2930","m2930","10.1107/S1600536807052075","","","0.71073","MoKα","","0.1037","0.0559","","","0.1285","0.1577","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216435","16.9911","0.0004","19.7724","0.0005","28.553","0.0007","90","","90.824","0.001","90","","9591.5","0.4","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5,11,17,23-Tetra-<i>tert</i>-butyl-25,26,27,28-tetramethoxycalix[4]arene tetrahydrofuran solvate","","- C52 H72 O5 -","- C52 H72 O5 -","- C416 H576 O40 -","8","2","FJ2051","Fischer, Conrad; Gruber, Tobias; Seichter, Wilhelm; Weber, Edwin","5,11,17,23-Tetra-<i>tert</i>-butyl-25,26,27,28-tetramethoxycalix[4]arene tetrahydrofuran solvate","Acta Crystallographica Section E","2007","63","12","o4572","o4573","10.1107/S1600536807053925","","","0.71073","MoKα","","0.1826","0.0666","","","0.1573","0.2148","","","","","","1.001","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216436","8.3966","0.001","5.1604","0.0006","13.6211","0.0016","90","","94.666","0.002","90","","588.24","0.12","293","2","293","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","catena-Poly[[silver(I)-μ-1,1'-methylenediimidazole] hexafluoridophosphate]","","- C7 H8 Ag F6 N4 P -","- C7 H8 Ag F6 N4 P -","- C14 H16 Ag2 F12 N8 P2 -","2","0.5","FJ2055","Wu, Ling-Yan; Zhu, Zhu; Jin, Chuan-Ming","<i>catena</i>-Poly[[silver(I)-μ-1,1'-methylenediimidazole] hexafluoridophosphate]","Acta Crystallographica Section E","2007","63","12","m2967","m2967","10.1107/S1600536807053937","","","0.71073","MoKα","","0.0458","0.0363","","","0.0995","0.1043","","","","","","1.071","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216437","7.1729","0.0002","18.6396","0.0006","12.6378","0.0004","90","","104.157","0.003","90","","1638.36","0.09","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[(Z)-(2,5-Dichlorophenyl)iminomethyl]-5-(diethylamino)phenol","","- C17 H18 Cl2 N2 O -","- C17 H18 Cl2 N2 O -","- C68 H72 Cl8 N8 O4 -","4","1","FJ2061","Jasinski, Jerry P.; Butcher, Ray J.; Narayana, B.; Swamy, M. T.; Yathirajan, H. S.","2-[(<i>Z</i>)-(2,5-Dichlorophenyl)iminomethyl]-5-(diethylamino)phenol","Acta Crystallographica Section E","2007","63","12","o4592","o4593","10.1107/S1600536807055791","","","0.71073","MoKα","","0.1164","0.0407","","","0.092","0.1199","","","","","","0.982","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216438","23.956","0.0008","12.667","0.0008","18.356","0.0009","90","","126.593","0.001","90","","4472.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","poly[[bis(μ-1,2-bis{[2-(2-pyridyl)-1H-imidazol-1-yl]methyl}benzene)lead(II)] dithiocyanate]","","- C50 H40 N14 Pb S2 -","- C50 H40 N14 Pb S2 -","- C200 H160 N56 Pb4 S8 -","4","0.5","FJ2062","Rui-Hai Cui; Ya-Qian Lan","Poly[[bis(μ-1,2-bis{[2-(2-pyridyl)-1<i>H</i>-imidazol-1-yl]methyl}benzene)lead(II)] dithiocyanate]","Acta Crystallographica Section E","2007","63","12","m3051","m3051","10.1107/S1600536807057753","","","0.71073","MoKα","","0.0416","0.0337","","","0.0782","0.0804","","","","","","0.99","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216439","5.7613","0.0013","10.672","0.002","11.687","0.003","89.971","0.004","87.442","0.004","79.142","0.004","705","0.3","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","1-(2,4-Dichlorophenyl)-3-pivaloylthiourea","","- C12 H14 Cl2 N2 O S -","- C12 H14 Cl2 N2 O S -","- C24 H28 Cl4 N4 O2 S2 -","2","1","FJ2064","Saeed, Aamer; Flörke, Ulrich","1-(2,4-Dichlorophenyl)-3-pivaloylthiourea","Acta Crystallographica Section E","2007","63","12","o4614","o4614","10.1107/S1600536807055808","","","0.71073","MoKα","","0.034","0.0309","","","0.087","0.0891","","","","","","1.109","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216440","12.331","0.002","12.331","0.002","31.641","0.006","90","","90","","90","","4811.1","1.4","293","2","293","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","Hexa-μ~2~-isopropoxido-κ^12^<i>O</i>:<i>O</i>- hexaisopropoxidotetraaluminium(III)","","- C36 H84 Al4 O12 -","- C36 H84 Al4 O12 -","- C144 H336 Al16 O48 -","4","0.5","FJ2066","Mohammadnezhad, Gholamhossein Sh.; Amini, Mostafa M.; Khavasi, Hamid Reza; Ng, Seik Weng","Hexa-μ~2~-isopropoxido-κ^12^<i>O</i>:<i>O</i>-hexaisopropoxidotetraaluminium(III)","Acta Crystallographica Section E","2007","63","12","m3049","m3049","10.1107/S1600536807057728","","","0.71073","MoKα","","0.0438","0.039","","","0.0952","0.0981","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216441","24.0637","0.00014","14.6142","0.0007","15.1014","0.0007","90","","123.918","0.001","90","","4407","0.3","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diethyl 6-(4-bromophenyl)-1,4-dioxoperhydro-2,3,4a,6,7a- pentaazacyclopenta[cd]indene-2a,7 b-dicarboxylate methanol hemisolvate","","- C19.5 H22 Br N5 O6.5 -","- C19.5 H22 Br N5 O6.5 -","- C156 H176 Br8 N40 O52 -","8","1","FJ2067","Li-Ping Cao; Zhi-Gou Wang; Yan Hu","Diethyl 6-(4-bromophenyl)-1,4-dioxoperhydro-2,3,4a,6,7a-pentaazacyclopenta[<i>cd</i>]indene-2a,7b-dicarboxylate methanol hemisolvate","Acta Crystallographica Section E","2007","63","12","o4740","o4740","10.1107/S1600536807057790","","","0.71073","MoKα","","0.0714","0.0455","","","0.1262","0.1359","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2216442","5.505","0.0011","7.35","0.0015","12.385","0.003","86.27","0.03","81.33","0.03","84.19","0.03","492.22","0.19","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","2-Amino-6-ethoxy-4-methylpyridine-3,5-dicarbonitrile","","- C10 H10 N4 O -","- C10 H10 N4 O -","- C20 H20 N8 O2 -","2","1","FJ2070","Constantin Mamat; Axel Schulz; Alexander Villinger","2-Amino-6-ethoxy-4-methylpyridine-3,5-dicarbonitrile","Acta Crystallographica Section E","2007","63","12","o4936","o4936","10.1107/S1600536807057777","","","0.71073","MoKα","","0.0465","0.0349","","","0.0956","0.1013","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216443","7.5188","0.0006","9.7993","0.0013","30.876","0.003","90","","90","","90","","2274.9","0.4","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1<i>R</i>,4<i>S</i>,8<i>R</i>,9<i>S</i>,12<i>S</i>,13<i>S</i>,14<i>R</i>, 16<i>S</i>,19<i>R</i>)-19-acetoxy-14-hydroxy-7,7-dimethyl-17-methylene- 2,18-dioxo-3,10-dioxapentacyclo[14.2.1.0^1,13^.0^4,12^.0^8,12^]nonadec-9-yl acetate","","- C24 H30 O9 -","- C24 H30 O9 -","- C96 H120 O36 -","4","1","FJ2072","Shi, Hao","(1<i>R</i>,4<i>S</i>,8<i>R</i>,9<i>S</i>,12<i>S</i>,13<i>S</i>,14<i>R</i>,16<i>S</i>,19<i>R</i>)-19-Acetoxy-14-hydroxy-7,7-dimethyl-17-methylene-2,18-dioxo-3,10-dioxapentacyclo[14.2.1.0^1,13^.0^4,12^.0^8,12^]nonadec-9-yl acetate","Acta Crystallographica Section E","2007","63","12","o4800","o4800","10.1107/S1600536807059302","","","0.71073","MoKα","","0.0733","0.0442","","","0.06","0.0635","","","","","","1.157","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216444","9.4233","0.0007","11.2691","0.0008","14.687","0.0011","90","","96.3816","0.0008","90","","1550","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[μ-10,21-Dimethyl-3,6,14,17-tetraazatricyclo[17.3.1.1^8,12^]tetracosa- 1(23),8,10,12(24),19,21-hexaene-23,24-diolato- κ^4^<i>N</i>^3^,<i>N</i>^6^,<i>O</i>^23^,<i>O</i>^24^:κ^4^<i>N</i>^14^, <i>N</i>^17^,<i>O</i>^23^,<i>O</i>^24^]bis(maleato-κ<i>O</i>)zinc(II)","","- C30 H36 N4 O10 Zn2 -","- C30 H36 N4 O10 Zn2 -","- C60 H72 N8 O20 Zn4 -","2","0.5","FJ2073","Jie Liu; Guang-Ju Ping; Quan-Jun Li; Jian-Fang Ma","[μ-10,21-Dimethyl-3,6,14,17-tetraazatricyclo[17.3.1.1^8,12^]tetracosa-1(23),8,10,12(24),19,21-hexaene-23,24-diolato-κ^4^<i>N</i>^3^,<i>N</i>^6^,<i>O</i>^23^,<i>O</i>^24^:κ^4^<i>N</i>^14^,<i>N</i>^17^,<i>O</i>^23^,<i>O</i>^24^]bis(maleato-κ<i>O</i>)zinc(II)","Acta Crystallographica Section E","2007","63","12","m3172","m3173","10.1107/S1600536807060461","","","0.71073","MoKα","","0.0338","0.0293","","","0.0822","0.0849","","","","","","1.06","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216445","11.1738","0.0002","7.8011","0.0001","15.5424","0.0002","90","","90","","90","","1354.8","0.03","292","","292","","","","","","","","","6","P c a 21","P 2c -2ac","29","","sulfatotris(thiourea)zinc(II)","","- C3 H12 N6 O4 S4 Zn -","- C3 H12 N6 O4 S4 Zn -","- C12 H48 N24 O16 S16 Zn4 -","4","1","FJ2074","Krupková, Radmila; Fábry, Jan; Císařová, Ivana; Vaněk, Přemysl","Redetermination of sulfatotris(thiourea)zinc(II)","Acta Crystallographica Section E","2007","63","12","m3177","m3178","10.1107/S1600536807060497","","","0.71073","MoKα","","0.0214","0.0204","","","0.0531","0.0534","","","","","","1.77","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216446","8.7006","0.0004","8.7006","0.0004","14.0732","0.0006","90","","90","","120","","922.62","0.07","291","2","291","2","","","","","","","","5","P 32","P 32","145","","Diethylammonium 2,5-dihydroxybenzenesulfonate","","- C10 H17 N O5 S -","- C10 H17 N O5 S -","- C30 H51 N3 O15 S3 -","3","1","FJ2077","Harrison, William T. A.; Swamy, M. T.; Yathirajan, H. S.; Ashok, M. A.; Narayana, B.","Diethylammonium 2,5-dihydroxybenzenesulfonate","Acta Crystallographica Section E","2007","63","12","o4870","o4870","10.1107/S1600536807060540","","","0.71073","MoKα","","0.0312","0.0287","","","0.0779","0.0789","","","","","","1.08","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2216447","6.8646","0.0009","9.7823","0.0013","9.3277","0.0012","90","","90","","90","","626.37","0.14","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Triethynylphosphine oxide","","- C6 H3 O P -","- C6 H3 O P -","- C24 H12 O4 P4 -","4","0.5","FL2164","Kallamadi, Ramnath; Jackson, John A.; Zeller, Matthias","Triethynylphosphine oxide","Acta Crystallographica Section E","2007","63","12","o4563","o4563","10.1107/S1600536807046600","","","0.71073","MoKα","","0.0302","0.0298","","","0.0838","0.0841","","","","","","1.118","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216448","11.5786","0.0018","5.0624","0.0008","16.259","0.003","90","","107.542","0.002","90","","908.7","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N,N'-[(2,3,5,6-Tetrafluoro-1,4-phenylene)dimethylene]bis(pyridine-3-carboxamide)","","- C20 H14 F4 N4 O2 -","- C20 H14 F4 N4 O2 -","- C40 H28 F8 N8 O4 -","2","0.5","FL2170","Shengchun Chen; Qun Chen; Qi Liu; Chao Li; Mingyang He","<i>N</i>,<i>N</i>'-[(2,3,5,6-Tetrafluoro-1,4-phenylene)dimethylene]bis(pyridine-3-carboxamide)","Acta Crystallographica Section E","2007","63","12","o4550","o4550","10.1107/S1600536807052968","","","0.71073","MoKα","","0.0496","0.0387","","","0.1058","0.1144","","","","","","1.074","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216449","19.785","0.006","7.5085","0.0017","14.458","0.004","90","","132.266","0.004","90","","1589.5","0.8","223","2","223","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1-(<i>N</i>-Cyanoguanyl)-3,5-dimethyl-1,2,4-triazole","","- C6 H8 N6 -","- C6 H8 N6 -","- C48 H64 N48 -","8","1","FL2172","Xiang-Xia Wu; Zhen-Duo Guo","1-(<i>N</i>-Cyanoguanyl)-3,5-dimethyl-1,2,4-triazole","Acta Crystallographica Section E","2007","63","12","o4747","o4747","10.1107/S1600536807057972","","","0.71073","MoKα","","0.054","0.046","","","0.11","0.1141","","","","","","1.146","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216450","7.2282","0.0011","25.147","0.004","5.9639","0.0009","90","","103.598","0.003","90","","1053.7","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Methyl 6-acetyl-l,4-benzodioxine-2-carboxylate","","- C12 H10 O5 -","- C12 H10 O5 -","- C48 H40 O20 -","4","1","FL2173","Ding, Yu; Yao, Guangmin","Methyl 6-acetyl-1,4-benzodioxine-2-carboxylate","Acta Crystallographica Section E","2007","63","12","o4799","o4799","10.1107/S1600536807057601","","","0.71073","MoKα","","0.0749","0.0522","","","0.1212","0.1323","","","","","","0.922","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216451","7.514","0.0013","29.878","0.003","6.8937","0.0012","90","","107.661","0.002","90","","1474.7","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Aminobenzothiazolium toluene-p-sulfonate","","- C14 H14 N2 O3 S2 -","- C14 H14 N2 O3 S2 -","- C56 H56 N8 O12 S8 -","4","1","FL2174","Ma, Wei-Xing; Qian, Bao-Hua; Liu, Qing-Qing; Ge, Hong-Yu; Xu, Xing-You","2-Aminobenzothiazolium toluene-<i>p</i>-sulfonate","Acta Crystallographica Section E","2007","63","12","o4844","o4844","10.1107/S1600536807059922","","","0.71073","MoKα","","0.0838","0.0613","","","0.1521","0.1635","","","","","","1.083","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216452","12.134","0.002","16.931","0.003","7.8643","0.0015","90","","106.655","0.003","90","","1547.9","0.5","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-[4-(3-Chlorobenzyloxy)phenyl]-4,5-dihydrothiazol-2-amine","","- C16 H15 Cl N2 O S -","- C16 H15 Cl N2 O S -","- C64 H60 Cl4 N8 O4 S4 -","4","1","FL2175","Jing Wu; Bao-lei Wang; Hai-Bin Song; Su-Hua Wang; Zheng-Ming Li","<i>N</i>-[4-(3-Chlorobenzyloxy)phenyl]-4,5-dihydrothiazol-2-amine","Acta Crystallographica Section E","2007","63","12","o4649","o4649","10.1107/S1600536807056413","","","0.71073","MoKα","","0.0778","0.047","","","0.1162","0.14","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216453","14.3516","0.0009","21.8695","0.0016","18.499","0.0013","90","","91.024","0.002","90","","5805.2","0.7","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","<i>exo</i>-8,<i>exo</i>-11- Diallylpentacyclo[5.4.0.0^2,6^.0^3,10^.0^5,9^]undecane-<i>endo</i>- 8,<i>endo</i>-11-diol","","- C17 H22 O2 -","- C17 H22 O2 -","- C272 H352 O32 -","16","4","FL2176","Boyle, Grant A.; Govender, Thavendran; Karpoormath, Rajshekhar; Kruger, Hendrik G.","<i>exo</i>-8,<i>exo</i>-11-Diallylpentacyclo[5.4.0.0^2,6^.0^3,10^.0^5,9^]undecane-<i>endo</i>-8,<i>endo</i>-11-diol","Acta Crystallographica Section E","2007","63","12","o4797","o4797","10.1107/S1600536807055699","","","0.71073","MoKα","","0.0661","0.0426","","","0.107","0.1194","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216454","24.69","0.001","7.558","0.0006","11.128","0.0009","90","","92.23","0.001","90","","2075","0.2","273","2","273","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Methyl 4-acetylphenoxyacetate","","- C11 H12 O4 -","- C11 H12 O4 -","- C88 H96 O32 -","8","1","FL2177","Lai-Ping Zhang; Zhi-Fang Jia; Ting-Ting Han; Ying-Ying Liu","Methyl (4-acetylphenoxy)acetate","Acta Crystallographica Section E","2007","63","12","o4731","o4731","10.1107/S1600536807057893","","","0.71069","MoKα","","0.0592","0.047","","","0.132","0.1438","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216455","9.698","0.0003","10.1923","0.0003","12.1248","0.0004","90","","108.57","0.001","90","","1136.08","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(1-Hydroxy-2-oxo-1,2-dihydroacenaphthylen-1-yl)prop-2-enenitrile","","- C15 H9 N O2 -","- C15 H9 N O2 -","- C60 H36 N4 O8 -","4","1","FL2178","M. Nizam Mohideen; P. S. Kannan; A. Subbiah Pandi; E. Ramesh; R. Raghunathan","2-(1-Hydroxy-2-oxo-1,2-dihydroacenaphthylen-1-yl)prop-2-enenitrile","Acta Crystallographica Section E","2007","63","12","o4756","o4756","10.1107/S1600536807057819","","","0.71073","MoKα","","0.0755","0.0515","","","0.1469","0.1689","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216456","12.984","0.003","4.662","0.0009","26.04","0.005","90","","101.97","0.03","90","","1542","0.6","298","2","298","2","","","","","","","","4","I 1 a 1","I -2ya","9","","N'-[4-(Dimethylamino)benzylidene]-3,5-dihydroxybenzohydrazide monohydrate","","- C16 H19 N3 O4 -","- C16 H19 N3 O4 -","- C64 H76 N12 O16 -","4","1","GD2022","Yun-Peng Diao; Jian-Kui Zhang; Shi-Quan Xie; Ting-Guo Kang","<i>N</i>'-[4-(Dimethylamino)benzylidene]-3,5-dihydroxybenzohydrazide monohydrate","Acta Crystallographica Section E","2007","63","12","o4908","o4908","10.1107/S1600536807061132","","","0.71073","MoKα","","0.1274","0.0677","","","0.137","0.1721","","","","","","1.015","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216457","12.465","0.004","24.772","0.008","11.047","0.004","90","","103.007","0.004","90","","3323.6","1.9","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Azido{1-[2-(propylamino)ethyliminomethyl]naphthalen-2-olato}copper(II)","","- C16 H19 Cu N5 O -","- C16 H19 Cu N5 O -","- C128 H152 Cu8 N40 O8 -","8","1","GD2027","Zhu, Chuan-Gao; Wei, Yi-Jun; Wang, Feng-Wu","Azido{1-[2-(propylamino)ethyliminomethyl]naphthalen-2-olato}copper(II)","Acta Crystallographica Section E","2007","63","12","m3197","m3198","10.1107/S1600536807062514","","","0.71073","MoKα","","0.134","0.0687","","","0.1738","0.2138","","","","","","1.014","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216458","5.3212","0.0006","7.3946","0.0009","16.327","0.002","80.487","0.014","81.612","0.014","80.917","0.014","620.91","0.13","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","3-Hydroxy-3-methyl-4-(3-methylquinoxalin-2-yl)butan-2-one","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C28 H32 N4 O4 -","2","1","GG2059","Aloui, Sana; Daoudi, Maria; Larbi, Najib Ben; Hadda, Taibi Ben; Stoeckli-Evans, Helen","3-Hydroxy-3-methyl-4-(3-methylquinoxalin-2-yl)butan-2-one","Acta Crystallographica Section E","2007","63","12","o4930","o4930","10.1107/S1600536807062289","","","0.71073","MoKα","","0.0444","0.0353","","","0.095","0.0984","","","","","","1.027","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216459","28.715","0.014","8.812","0.004","13.522","0.006","90","","115.606","0.018","90","","3086","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[μ-1,2-Bis(salicyloyl)hydrazine(4-)]bis[(ethylenediamine)zinc(II)] bis(dimethylformamide) solvate dihydrate","","- C24 H42 N8 O8 Zn2 -","- C24 H42 N8 O8 Zn2 -","- C96 H168 N32 O32 Zn8 -","4","0.5","GG3120","Wang, Zeng-You; Liu, Shi-Xiong","[μ-1,2-Bis(salicyloyl)hydrazine(4{-})]bis[(ethylenediamine)zinc(II)] dimethylformamide disolvate dihydrate","Acta Crystallographica Section E","2007","63","12","m3105","m3106","10.1107/S1600536807057212","","","0.71073","MoKα","","0.0577","0.0429","","","0.102","0.1104","","","","","","1.029","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216460","10.704","0.0012","11.6806","0.0012","25.7328","0.0016","90","","90","","90","","3217.3","0.5","133","2","133","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","<i>cis</i>-μ-1,4-Diphenyl-1,4-diphosphorinane-κ^2^P:P'- bis[pentacarbonylchromium(0)] deuterochloroform solvate","","- C27 H18 Cl3 Cr2 D O10 P2 -","- C27 H19 Cl3 Cr2 O10 P2 -","- C108 H76 Cl12 Cr8 O40 P8 -","4","1","GG3122","Manfred Fild; Krüger, Oana N.; Silaghi-Dumitrescu, Ioan; Thöne, Carsten; Andreas Weinkauf","<i>cis</i>-μ-1,4-Diphenyl-1,4-diphosphorinane-κ^2^<i>P</i>:<i>P</i>'-bis[pentacarbonylchromium(0)] deuterochloroform solvate","Acta Crystallographica Section E","2007","63","12","m3011","m3011","10.1107/S1600536807057182","","","0.71073","MoKα","","0.0752","0.0516","","","0.1075","0.1151","","","","","","1.055","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2216461","14.785","0.0004","14.785","0.0004","17.7221","0.0009","90","","90","","90","","3874","0.2","293","2","293","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","","Tris(1,2-ethanediamine-κ^2^N,N')cobalt(II) triiodide iodide","","- C6 H24 Co I4 N6 -","- C6 H24 Co I4 N6 -","- C48 H192 Co8 I32 N48 -","8","0.5","GK2101","Du, Jun-Min; Zhang, Zhang-Jin; Lin, Hong-Mei; Li, Wei; Guo, Guo-Cong","Tris(1,2-ethanediamine-κ^2^<i>N</i>,<i>N</i>')cobalt(II) triiodide iodide","Acta Crystallographica Section E","2007","63","12","m3206","m3206","10.1107/S1600536807059971","","","0.71073","MoKα","","0.0172","0.0172","","","0.0442","0.0443","","","","","","0.975","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216462","8.533","0.003","8.813","0.004","9.028","0.004","98.904","0.006","96.978","0.008","90.197","0.007","665.6","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","<i>N</i>-[N-(2-Pyridylmethyl)thiocarbamoyl]benzamide","","- C14 H13 N3 O S -","- C14 H13 N3 O S -","- C28 H26 N6 O2 S2 -","2","1","GK2114","Yamin, Bohari M.; Malik, Zaw Myint","<i>N</i>-[<i>N</i>-(2-Pyridylmethyl)thiocarbamoyl]benzamide","Acta Crystallographica Section E","2007","63","12","o4842","o4842","10.1107/S1600536807057789","","","0.71073","MoKα","","0.062","0.057","","","0.168","0.171","","","","","","1.37","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216463","11.1181","0.0016","11.2882","0.0016","12.4119","0.0017","84.73","0.003","88.689","0.003","79.574","0.003","1525.5","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis{4-chloro-2-[1-(2,4,6-trimethylphenylimino)ethyl]phenolato}nickel(II)","","- C34 H34 Cl2 N2 Ni O2 -","- C34 H34 Cl2 N2 Ni O2 -","- C68 H68 Cl4 N4 Ni2 O4 -","2","1","GK2118","Hung, Wen-Chou; Lin, Chu-Chieh","Bis{4-chloro-2-[1-(2,4,6-trimethylphenylimino)ethyl]phenolato}nickel(II)","Acta Crystallographica Section E","2007","63","12","m3174","m3174","10.1107/S1600536807060680","","","0.71073","MoKα","","0.1081","0.0576","","","0.1373","0.1604","","","","","","1.006","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216464","7.724","0.003","12.01","0.004","17.699","0.006","90","","99.416","0.005","90","","1619.7","1","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Piperazine-1,4-diium bis(piperazin-1-ium) bis(3-carboxylato-4-hydroxybenzenesulfonate) dihydrate","","- C26 H46 N6 O14 S2 -","- C26 H46 N6 O14 S2 -","- C52 H92 N12 O28 S4 -","2","0.5","GK2119","Su, Kun-Mei; Li, Zhen-Huan","Piperazine-1,4-diium bis(piperazin-1-ium) bis(3-carboxylato-4-hydroxybenzenesulfonate) dihydrate","Acta Crystallographica Section E","2007","63","12","o4816","o4816","10.1107/S1600536807059016","","","0.71073","MoKα","","0.046","0.0388","","","0.0973","0.1054","","","","","","1.093","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216465","13.7016","0.0005","23.168","0.0009","8.5695","0.0002","90","","90","","90","","2720.29","0.16","293","2","293","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","Ethyl 3-phenyl-4-[(<i>Z</i>)-3-phenylacryloyl]5-(3,4,5-trimethoxyphenyl)-pyrrolidine-2-carboxylate","","- C31 H33 N O6 -","- C31 H33 N O6 -","- C124 H132 N4 O24 -","4","1","GW2029","P. Ramesh; S. Murugavel; A. Subbiah Pandi; Ramalingam Murugan; S. Sriman Narayanan","Ethyl 3-phenyl-4-[(<i>Z</i>)-3-phenylacryloyl] 5-(3,4,5-trimethoxyphenyl)pyrrolidine-2-carboxylate","Acta Crystallographica Section E","2007","63","12","o4873","o4873","10.1107/S1600536807059776","","","0.71073","MoKα","","0.0501","0.0358","","","0.0898","0.0986","","","","","","1.035","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216466","14.842","0.003","16.283","0.003","19.527","0.004","90","","104.76","0.03","90","","4563.4","1.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[μ-1,2-bis(1<i>H</i>-imidazol-1-ylmethyl)benzene- κ^2^<i>N</i>,<i>N</i>']disilver(I)] bis(4-aminobenzenesulfonate) hexahydrate","","- C40 H52 Ag2 N10 O12 S2 -","- C40 H52 Ag2 N10 O12 S2 -","- C160 H208 Ag8 N40 O48 S8 -","4","0.5","GW2032","Hai-Yan Liu; Hong-Mei Sun; Jian-Fang Ma","Bis[μ-1,2-bis(1<i>H</i>-imidazol-1-ylmethyl)benzene-κ^2^<i>N</i>:<i>N</i>']disilver(I) bis(4-aminobenzenesulfonate) hexahydrate","Acta Crystallographica Section E","2007","63","12","m3109","m3109","10.1107/S1600536807059764","","","0.71073","MoKα","","0.0449","0.0357","","","0.0861","0.0906","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216467","8.4299","0.0013","8.572","0.0014","9.1803","0.0015","70.283","0.003","89.506","0.003","61.056","0.002","536.77","0.15","300","2","300","2","","","","","","","","3","P -1","-P 1","2","","N-(3,5-Dimethylpyrazol-1-ylmethyl)pyridin-2-ylamine","","- C11 H14 N4 -","- C11 H14 N4 -","- C22 H28 N8 -","2","1","HB2504","Benchat, Nour-Eddine; El Kadiri, Sghir; Fontrodona, Xavier; Bardaji, Eduard; El Bali, Brahim","<i>N</i>-(3,5-Dimethylpyrazol-1-ylmethyl)pyridin-2-ylamine","Acta Crystallographica Section E","2007","63","12","o4519","o4519","10.1107/S1600536807039906","","","0.71073","MoKα","","0.0495","0.0447","","","0.1306","0.1364","","","","","","1.061","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2216468","9.4547","0.001","12.4137","0.0013","22.015","0.002","90","","100.414","0.002","90","","2541.3","0.4","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[(dipyrido[3,2-a:2',3'-c]phenazine)cadmium(II)]- μ-biphenyl-2,2'-dicarboxylato]","","- C32 H18 Cd N4 O4 -","- C32 H18 Cd N4 O4 -","- C128 H72 Cd4 N16 O16 -","4","1","HB2577","Xiang-Jun Jin; Wei Fang; Xiao-Ping Li","<i>catena</i>-Poly[[(dipyrido[3,2-<i>a</i>:2',3'-<i>c</i>]phenazine)cadmium(II)]-μ-biphenyl-2,2'-dicarboxylato]","Acta Crystallographica Section E","2007","63","12","m2877","m2877","10.1107/S1600536807052786","","","0.71073","MoKα","","0.0984","0.0471","","","0.0836","0.1014","","","","","","0.954","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216469","16.2692","0.001","17.5649","0.001","13.911","0.0008","90","","112.35","0.003","90","","3676.7","0.4","133","2","133","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","1,1,4,4-Tetrabenzyl-1,4-diphosphinane-1,4-diium dibromide deuterochloroform disolvate","","- C34 H36 Br2 Cl6 D2 P2 -","- C34 H38 Br2 Cl6 P2 -","- C136 H152 Br8 Cl24 P8 -","4","0.5","HB2582","Fild, Manfred; Krüger, Oana N.; Silaghi-Dumitrescu, Ioan; Thöne, Carsten","1,1,4,4-Tetrabenzyl-1,4-diphosphinane-1,4-diium dibromide deuterochloroform disolvate","Acta Crystallographica Section E","2007","63","12","o4525","o4525","10.1107/S1600536807052932","","","0.71073","MoKα","","0.0395","0.032","","","0.0785","0.0829","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216470","6.1995","0.0019","9.416","0.003","11.714","0.003","90","","98.328","0.005","90","","676.6","0.3","294","2","294","2","","","","","","","","4","P 1 21 1","P 2yb","4","","4-{2-[Methyl(2-pyridyl)amino]ethoxy}benzaldehyde","","- C15 H16 N2 O2 -","- C15 H16 N2 O2 -","- C30 H32 N4 O4 -","2","1","HB2594","Hou, Jingli; Zheng, Chao; Li, Hui; Zhang, Xinge; Li, Chaoxing","4-{2-[Methyl(2-pyridyl)amino]ethoxy}benzaldehyde","Acta Crystallographica Section E","2007","63","12","o4875","o4875","10.1107/S1600536807051951","","","0.71073","MoKα","","0.0665","0.0351","","","0.0833","0.1007","","","","","","0.975","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216471","8.3044","0.0017","11.021","0.002","12.746","0.003","89.35","0.03","86.73","0.03","82.49","0.03","1154.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[(4,7-diphenyl-1,10-phenanthroline)lead(II)]-μ-fumarato]","","- C28 H18 N2 O4 Pb -","- C28 H18 N2 O4 Pb -","- C56 H36 N4 O8 Pb2 -","2","1","HB2602","Yan-Bing Yin; Hai-Xia Yu","<i>catena</i>-Poly[[(4,7-diphenyl-1,10-phenanthroline)lead(II)]-μ-fumarato]","Acta Crystallographica Section E","2007","63","12","m2890","m2890","10.1107/S1600536807053743","","","0.71073","MoKα","","0.0487","0.0365","","","0.0579","0.061","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216472","8.99","0.0018","9.033","0.0018","15.445","0.003","83.01","0.03","79.76","0.03","66.54","0.03","1130.4","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-(2-{3-[4-(Dimethylamino)phenyl]-1,2,4-oxadiazol-5-yl}phenoxy)-\ N-(2,6-dimethylphenyl)acetamide","","- C26 H26 N4 O3 -","- C26 H26 N4 O3 -","- C52 H52 N8 O6 -","2","1","HB2606","Zeng, Hai-Su; Wang, Hai-Bo; Kang, Si-Shun; Li, Hai-Lin","2-(2-{3-[4-(Dimethylamino)phenyl]-1,2,4-oxadiazol-5-yl}phenoxy)-<i>N</i>-(2,6-dimethylphenyl)acetamide","Acta Crystallographica Section E","2007","63","12","o4745","o4745","10.1107/S1600536807052270","","","0.71073","MoKα","","0.1236","0.0773","","","0.1447","0.1785","","","","","","1.032","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216473","10.1615","0.0005","10.6255","0.0005","10.8507","0.0006","73.147","0.002","82.174","0.001","88.734","0.001","1110.61","0.1","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Poly[[[bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]- bis[μ~3~-3-(4-carboxylatophenoxy)propionato- κ^5^<i>O</i>,<i>O</i>':O':O'',O''']] 4-hydroxybenzoic acid monohydrate]","","- C47 H40 Cd2 N4 O14 -","- C47 H40 Cd2 N4 O14 -","- C47 H40 Cd2 N4 O14 -","1","0.5","HB2610","Li-Li Kong; Shan Gao; Li-Hua Huo; Ng, Seik Weng","Poly[[[bis[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-bis[μ~3~-3-(4-carboxylatophenoxy)propionato-κ^5^<i>O</i>,<i>O</i>':<i>O</i>':<i>O</i>'',<i>O</i>''']] 4-hydroxybenzoic acid monohydrate]","Acta Crystallographica Section E","2007","63","12","m2938","m2939","10.1107/S1600536807054669","","","0.71073","MoKα","","0.0573","0.0399","","","0.0892","0.1196","","","","","","1.064","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216474","11.3254","0.0015","7.8829","0.001","13.1264","0.0017","90","","100.519","0.002","90","","1152.2","0.3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-Poly[[diaquacopper(II)]-μ-2,2'-bipyridine-3,3'-dicarboxylate]","","- C12 H10 Cu N2 O6 -","- C12 H10 Cu N2 O6 -","- C48 H40 Cu4 N8 O24 -","4","0.5","HB2612","Liang-Gui Wang","<i>catena</i>-Poly[[diaquacopper(II)]-μ-2,2'-bipyridine-3,3'-dicarboxylate]","Acta Crystallographica Section E","2007","63","12","m3155","m3155","10.1107/S1600536807060229","","","0.71073","MoKα","","0.0385","0.0378","","","0.1291","0.13","","","","","","0.864","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216475","9.2246","0.0006","11.6031","0.0008","21.4749","0.0015","90","","95.387","0.001","90","","2288.4","0.3","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(11bR,11cS)-rel-Diethyl 6-bromo-9-methoxy-4,11-dioxo-5,10-dihydro- 1H,3H,4H,11H-2-Oxa-3a,4a,10a,11a-tetraazabenz[f]indeno[2,1,7-ija]azulene- 11b,11c-dicarboxylate","","- C21 H23 Br N4 O8 -","- C21 H23 Br N4 O8 -","- C84 H92 Br4 N16 O32 -","4","1","HB2614","Jing Li; Kunru Wang; Nengfang She","(11b<i>R</i>,11c<i>S</i>)-<i>rel</i>-Diethyl 6-bromo-9-methoxy-4,11-dioxo-5,10-dihydro-1<i>H</i>,3<i>H</i>,4<i>H</i>,11<i>H</i>-2-oxa-3a,4a,10a,11a-tetraazabenz[<i>f</i>]indeno[2,1,7-<i>ija</i>]azulene-11b,11c-dicarboxylate","Acta Crystallographica Section E","2007","63","12","o4579","o4579","10.1107/S1600536807054670","","","0.71073","MoKα","","0.1","0.0586","","","0.1311","0.1429","","","","","","1.082","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216476","23.8527","0.0015","40.936","0.003","5.078","0.0004","90","","90","","90","","4958.3","0.6","173","2","173","2","","","","","","","","5","F d d 2","F 2 -2d","43","","N-(4-Chlorophenyl)-2-nitrobenzamide","","- C13 H9 Cl N2 O3 -","- C13 H9 Cl N2 O3 -","- C208 H144 Cl16 N32 O48 -","16","1","HB2615","Saeed, Aamer; Hussain, Shahid; Bolte, Michael","<i>N</i>-(4-Chlorophenyl)-2-nitrobenzamide","Acta Crystallographica Section E","2007","63","12","o4615","o4615","10.1107/S1600536807055742","","","0.71073","MoKα","","0.0359","0.0342","","","0.0884","0.0896","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216477","6.3368","0.0012","19.163","0.004","12.308","0.002","90","","100.601","0.003","90","","1469.1","0.5","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","{4-Bromo-2-[2-(ethylamino)ethyliminomethyl]phenolato- κ^3^N,N',O}(thiocyanato-κN)copper(II)","","- C12 H14 Br Cu N3 O S -","- C12 H14 Br Cu N3 O S -","- C48 H56 Br4 Cu4 N12 O4 S4 -","4","1","HB2616","Zhou, Zhi; Tang, Rui-Ren","{4-Bromo-2-[2-(ethylamino)ethyliminomethyl]phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>}(thiocyanato-κN)copper(II)","Acta Crystallographica Section E","2007","63","12","m2960","m2960","10.1107/S1600536807056048","","","0.71073","MoKα","","0.1078","0.0613","","","0.1281","0.1477","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216478","20.251","0.005","9.321","0.002","9.053","0.002","90","","115.304","0.002","90","","1544.9","0.6","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichloridobis[2-(ethoxycarbonyl)ethyl-κ^2^C,O]tin(IV)","","- C10 H18 Cl2 O4 Sn -","- C10 H18 Cl2 O4 Sn -","- C40 H72 Cl8 O16 Sn4 -","4","0.5","HB2617","Dong, Yan","Dichloridobis[2-(ethoxycarbonyl)ethyl-κ^2^<i>C</i>,<i>O</i>]tin(IV)","Acta Crystallographica Section E","2007","63","12","m2917","m2917","10.1107/S1600536807053731","","","0.71073","MoKα","","0.0276","0.0243","","","0.0605","0.0628","","","","","","1.071","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216479","10.309","0.002","12.992","0.003","10.6","0.002","90","","100.63","0.03","90","","1395.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Methyl-5-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-ylmethylsulfanyl]- 1,3,4-thiadiazole","","- C13 H12 N4 O S2 -","- C13 H12 N4 O S2 -","- C52 H48 N16 O4 S8 -","4","1","HB2618","Wang, Pin-Liang; Li, Hai-Ling; Kang, Si-Shun; Zeng, Hai-Shu; Wang, Hai-bo","2-Methyl-5-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-ylmethylsulfanyl]-1,3,4-thiadiazole","Acta Crystallographica Section E","2007","63","12","o4586","o4586","10.1107/S1600536807054682","","","0.71073","MoKα","","0.1059","0.0622","","","0.1418","0.1781","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216480","10.1201","0.0001","23.7418","0.0003","7.3346","0.0001","90","","90","","90","","1762.28","0.04","295","2","295","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","catena-poly[μ-5,5'-iminoditetrazolato-κ^3^N,N':N''-bis[triaquazinc(II)] bis[[triaquazinc(II)]-μ-5,5'-iminoditetrazolato-κ^3^N,N':N''] dihydrate]","","- C8 H32 N36 O14 Zn4 -","- C8 H32 N36 O14 Zn4 -","- C16 H64 N72 O28 Zn8 -","2","0.5","HB2619","Liu, Zhao-Qing; Dong, Wen; Ng, Seik Weng","<i>catena</i>-Poly[[μ-5,5'-iminoditetrazolato-κ^3^<i>N</i>,<i>N</i>':<i>N</i>''-bis[triaquazinc(II)]] bis[[triaquazinc(II)]-μ-5,5'-iminoditetrazolato-κ^3^<i>N</i>,<i>N</i>':<i>N</i>''] dihydrate]","Acta Crystallographica Section E","2007","63","12","m2943","m2944","10.1107/S160053680705578X","","","0.71073","MoKα","","0.0213","0.0198","","","0.0536","0.0544","","","","","","1.008","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216481","8.023","0.002","22.903","0.006","11.473","0.003","90","","97.128","0.003","90","","2091.9","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[[[bis(isonicotinamide)copper(II)]-μ-benzene-1,2-dicarboxylato] monohydrate]","","- C20 H18 Cu N4 O7 -","- C20 H18 Cu N4 O7 -","- C80 H72 Cu4 N16 O28 -","4","1","HB2621","Xiao-Guang Zhou","Poly[[[bis(isonicotinamide)copper(II)]-μ-benzene-1,2-dicarboxylato] monohydrate]","Acta Crystallographica Section E","2007","63","12","m3166","m3166","10.1107/S1600536807060217","","","0.71073","MoKα","","0.0558","0.0371","","","0.0799","0.088","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216482","10.1246","0.0006","10.1246","0.0006","29.528","0.003","90","","90","","120","","2621.3","0.3","294","2","294","2","","","","","","","","5","P 61","P 61","169","","Methyl 2-(1,3-dioxoisoindolin-2-yl)-3-(4-iodophenyl)propionate","","- C18 H14 I N O4 -","- C18 H14 I N O4 -","- C108 H84 I6 N6 O24 -","6","1","HB2624","Wu, Zhou; Shen, Peng; Jiang, Shende","(<i>S</i>)-Methyl 2-(1,3-dioxoisoindolin-2-yl)-3-(4-iodophenyl)propionate","Acta Crystallographica Section E","2007","63","12","o4871","o4871","10.1107/S1600536807055766","","","0.71073","MoKα","","0.0472","0.0409","","","0.1038","0.1079","","","","","","1.071","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216483","10.512","0.002","11.486","0.002","7.208","0.0014","90","","94.11","0.03","90","","868.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(3-(Chloromethyl)-1,2,4-oxadiazol-5-yl)pyridine","","- C8 H6 Cl N3 O -","- C8 H6 Cl N3 O -","- C32 H24 Cl4 N12 O4 -","4","1","HB2625","Kang, Si-shun; Li, Hai-Lin; Zeng, Hai-su; Wang, Hai-bo; Wang, Pin-liang","4-[3-(Chloromethyl)-1,2,4-oxadiazol-5-yl]pyridine","Acta Crystallographica Section E","2007","63","12","o4654","o4654","10.1107/S1600536807055559","","","0.71073","MoKα","","0.1279","0.0761","","","0.1632","0.1914","","","","","","0.999","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216484","10.5218","0.0019","11.742","0.002","18.077","0.003","90","","101.281","0.004","90","","2190.2","0.7","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-Poly[[aqua(dipyrido[3,2-a:2',3'-c]phenazine)cobalt(II)]-μ-benzene- 1,4-dicarboxylato]","","- C26 H16 Co N4 O5 -","- C26 H16 Co N4 O5 -","- C104 H64 Co4 N16 O20 -","4","1","HB2627","Fang-Wei; Ze-Min Mei","<i>catena</i>-Poly[[aqua(dipyrido[3,2-<i>a</i>:2',3'-<i>c</i>]phenazine)cobalt(II)]-μ-benzene-1,4-dicarboxylato]","Acta Crystallographica Section E","2007","63","12","m3098","m3099","10.1107/S1600536807056826","","","0.71073","MoKα","","0.0929","0.0469","","","0.1016","0.1143","","","","","","0.879","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216485","7.8872","0.0005","8.1304","0.0005","9.5891","0.0006","94.569","0.001","110.122","0.001","106.957","0.001","541.07","0.06","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","1,5-Dimethyl citrate monohydrate","","- C8 H14 O8 -","- C8 H14 O8 -","- C16 H28 O16 -","2","1","HB2628","Li, Mingjing; Wang, Yong; Ma, Pengtao; Fu, Dexue; Liu, Xiuhua","1,5-Dimethyl citrate monohydrate from <i>Dioscorea opposita</i> Thunb.","Acta Crystallographica Section E","2007","63","12","o4632","o4632","10.1107/S1600536807055535","","","0.71073","MoKα","","0.0389","0.0331","","","0.0858","0.0893","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216486","7.9801","0.0002","9.9993","0.0002","10.0823","0.0002","104.393","0.001","111.091","0.001","104.635","0.001","672.96","0.03","106","2","106","2","","","","","","","","7","P -1","-P 1","2","","[2'-(5-Chloro-2-oxidobenzylidene)benzenesulfonohydrazide- κ^2^<i>N</i>,<i>O</i>][2'-(2-oxidobenzylidene)benzenesulfonohydrazide- κ^2^<i>N</i>,<i>O</i>)]copper(II)","","- C26 H21 Cl Cu N4 O6 S2 -","- C26 H21 Cl Cu N4 O6 S2 -","- C26 H21 Cl Cu N4 O6 S2 -","1","0.5","HB2629","Ali, Hapipah M.; Yusnita, Juahir; Rizal, Mohd. Razali; Ng, Seik Weng","[2'-(5-Chloro-2-oxidobenzylidene)benzenesulfonohydrazide-κ^2^<i>N</i>,<i>O</i>][2'-(2-oxidobenzylidene)benzenesulfonohydrazide-κ^2^<i>N</i>,<i>O</i>]copper(II)","Acta Crystallographica Section E","2007","63","12","m2937","m2937","10.1107/S1600536807055663","","","0.71073","MoKα","","0.0367","0.0307","","","0.0964","0.1143","","","","","","1.197","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216487","7.609","0.0016","20.635","0.004","8.3081","0.0017","90","","115.908","0.003","90","","1173.4","0.4","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,6-dichloro-N-(4-methoxyphenyl)-1,3,5-triazin-2-amine","","- C10 H8 Cl2 N4 O -","- C10 H8 Cl2 N4 O -","- C40 H32 Cl8 N16 O4 -","4","1","HB2630","Tao Zeng; Wan-Zhong Ren","4,6-Dichloro-<i>N</i>-(4-methoxyphenyl)-1,3,5-triazin-2-amine","Acta Crystallographica Section E","2007","63","12","o4622","o4622","10.1107/S1600536807055523","","","0.71073","MoKα","","0.0398","0.0311","","","0.0801","0.0865","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216488","9.5179","0.0013","10.1177","0.0014","13.2038","0.0018","90","","104.039","0.002","90","","1233.5","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[trimethyltin(IV)]-μ-2-thiophene-2-acetato-κ^2^O:O']","","- C9 H14 O2 S Sn -","- C9 H14 O2 S Sn -","- C36 H56 O8 S4 Sn4 -","4","1","HB2631","Hongyun Wang; Handong Yin; Daqi Wang","<i>catena</i>-Poly[[trimethyltin(IV)]-μ-2-thiophene-2-acetato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","12","m2958","m2958","10.1107/S1600536807055651","","","0.71073","MoKα","","0.0554","0.0366","","","0.0998","0.1274","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216489","27.217","0.002","4.0536","0.0017","23.767","0.002","90","","123.553","0.015","90","","2185.2","1","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3-(2-Pyridylmethyleneamino)benzoic acid","","- C13 H10 N2 O2 -","- C13 H10 N2 O2 -","- C104 H80 N16 O16 -","8","1","HB2632","Qiang Wang; Yu-Ying Sun; Da-Qi Wang","3-(2-Pyridylmethyleneamino)benzoic acid","Acta Crystallographica Section E","2007","63","12","o4597","o4597","10.1107/S1600536807055754","","","0.71073","MoKα","","0.1227","0.0617","","","0.121","0.1398","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216490","10.9456","0.0015","7.5287","0.001","22.248","0.002","90","","96.048","0.002","90","","1823.2","0.4","298","2","298","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","Di-μ-chlorido-1:2κ^2^Cl,2:3κ^2^Cl-tetrachlorido-1κCl,2κ^2^Cl,3κCl- bis[N,N''-bis(2-furylmethylene)diethylenetriamine]- 1κ^3^N,N',N'';3κ^3^N,N',N''-tricopper(II)","","- C28 H32 Cl6 Cu3 N6 O4 -","- C28 H32 Cl6 Cu3 N6 O4 -","- C56 H64 Cl12 Cu6 N12 O8 -","2","0.5","HB2633","Qiang Wang; Da-Qi Wang; Yu-Ying Sun","Di-μ-chlorido-1:2κ^2^<i>Cl</i>,2:3κ^2^<i>Cl</i>-tetrachlorido-1κ<i>Cl</i>,2κ^2^<i>Cl</i>,3κ<i>Cl</i>-bis[<i>N</i>,<i>N</i>''-bis(2-furylmethylene)diethylenetriamine]-1κ^3^<i>N</i>,<i>N</i>',<i>N</i>'';3κ^3^<i>N</i>,<i>N</i>',<i>N</i>''-tricopper(II)","Acta Crystallographica Section E","2007","63","12","m3010","m3010","10.1107/S1600536807056838","","","0.71073","MoKα","","0.1011","0.0468","","","0.0782","0.0881","","","","","","0.987","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216491","7.7961","0.0006","19.2676","0.0019","8.8162","0.0007","90","","93.061","0.006","90","","1322.4","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[2-(ethylamino)ethanol-κ^2^N,O]bis(saccharinato-κN)cadmium(II)","","- C22 H30 Cd N4 O8 S2 -","- C22 H30 Cd N4 O8 S2 -","- C44 H60 Cd2 N8 O16 S4 -","2","0.5","HB2635","Yilmaz, Veysel T.; Kazak, Canan","Bis[2-(ethylamino)ethanol-κ^2^<i>N</i>,<i>O</i>]bis(saccharinato-κ<i>N</i>)cadmium(II)","Acta Crystallographica Section E","2007","63","12","m2947","m2947","10.1107/S1600536807056036","","","0.71069","MoKα","","0.08","0.0494","","","0.1256","0.1354","","","","","","0.957","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216492","10.396","0.002","10.302","0.002","9.207","0.0018","90","","98.3","0.03","90","","975.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(Chloromethyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole","","- C9 H6 Cl2 N2 O -","- C9 H6 Cl2 N2 O -","- C36 H24 Cl8 N8 O4 -","4","1","HB2637","Zeng, Hai-Su; Wang, Hai-Bo; Kang, Si-Shun; Li, Hai-Lin","5-(Chloromethyl)-3-(2-chlorophenyl)-1,2,4-oxadiazole","Acta Crystallographica Section E","2007","63","12","o4746","o4746","10.1107/S1600536807056383","","","0.71073","MoKα","","0.0889","0.0545","","","0.1318","0.1465","","","","","","1.021","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216493","7.993","0.0016","12.806","0.003","7.674","0.0015","90","","90.96","0.03","90","","785.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Chlorobenzamidoxime","","- C7 H7 Cl N2 O -","- C7 H7 Cl N2 O -","- C28 H28 Cl4 N8 O4 -","4","1","HB2638","Kang, Si-shun; Zeng, Hai-su; Li, Hai-lin; Wang, Hai-bo; Wang, Pin-liang","4-Chlorobenzamidoxime","Acta Crystallographica Section E","2007","63","12","o4698","o4698","10.1107/S1600536807057273","","","0.71073","MoKα","","0.099","0.0609","","","0.1537","0.179","","","","","","1.092","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2216494","30.6872","0.0017","7.4261","0.0004","17.7703","0.001","90","","90","","90","","4049.6","0.4","298","2","298","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","2-{3-[2-(2,6-Difluorobenzyloxy)phenyl]-1H-pyrazol-1-yl}-4,6-dimethoxypyrimidine","","- C22 H18 F2 N4 O3 -","- C22 H18 F2 N4 O3 -","- C176 H144 F16 N32 O24 -","8","1","HB2639","Yuanxiang Li; Chunping He","2-{3-[2-(2,6-Difluorobenzyloxy)phenyl]-1<i>H</i>-pyrazol-1-yl}-4,6-dimethoxypyrimidine","Acta Crystallographica Section E","2007","63","12","o4856","o4856","10.1107/S1600536807060278","","","0.71073","MoKα","","0.124","0.0632","","","0.1296","0.1516","","","","","","1.042","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216495","14.4091","0.0005","12.8347","0.0004","10.1715","0.0004","90","","99.584","0.004","90","","1854.83","0.12","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","piperidine derivative","1,t-3-Dimethyl-r-2,c-6-diphenylpiperidin-c-4-yl acetate","","- C21 H25 N O2 -","- C21 H25 N O2 -","- C84 H100 N4 O8 -","4","1","HB2640","S. Balamurugan; A. Thiruvalluvar; R. J. Butcher; A. Manimekalai; J. Jayabharathi","1,<i>t</i>-3-Dimethyl-<i>r</i>-2,<i>c</i>-6-diphenylpiperidin-<i>c</i>-4-yl acetate","Acta Crystallographica Section E","2007","63","12","o4826","o4826","10.1107/S1600536807058849","","","0.71073","MoKα","","0.1499","0.0659","","","0.1911","0.2441","","","","","","1.157","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216496","6.7294","0.0007","8.0205","0.0008","13.5187","0.0014","82.149","0.008","80.111","0.008","65.952","0.007","654.61","0.12","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","(3-Aminopyridine-κN^1^)(saccharinato-κN)silver(I)","","- C12 H10 Ag N3 O3 S -","- C12 H10 Ag N3 O3 S -","- C24 H20 Ag2 N6 O6 S2 -","2","1","HB2641","Yilmaz, Veysel T.; Hamamci, Sevim; Kazak, Canan","(3-Aminopyridine-κ<i>N</i>^1^)(saccharinato-κ<i>N</i>)silver(I)","Acta Crystallographica Section E","2007","63","12","m3000","m3000","10.1107/S1600536807057248","","","0.71073","MoKα","","0.0268","0.0232","","","0.0595","0.0607","","","","","","1.039","","","","has coordinates,has Fobs","194596","2020-10-21","18:00:00",""
"2216497","10.727","0.002","10.96","0.002","13.375","0.003","92.85","0.03","108.06","0.03","96.34","0.03","1480","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[(4,7-diphenyl-1,10-phenanthroline)cadmate(II)]- μ-4,4'-oxydibenzoato]","","- C38 H24 Cd N2 O5 -","- C38 H24 Cd N2 O5 -","- C76 H48 Cd2 N4 O10 -","2","1","HB2643","Mao-Liang Xu; Rui Zhou; Ge-Yang Wang","<i>catena</i>-Poly[[(4,7-diphenyl-1,10-phenanthroline)cadmium(II)]-μ-4,4'-oxydibenzoato]","Acta Crystallographica Section E","2007","63","12","m3135","m3135","10.1107/S1600536807060266","","","0.71073","MoKα","","0.0341","0.0286","","","0.0749","0.0779","","","","","","1.167","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216498","11.1774","0.0011","14.3964","0.0012","16.098","0.002","90","","93.572","0.002","90","","2585.4","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methanoltriphenyl(quinoline-2-carboxylato)tin(IV)","","- C29 H25 N O3 Sn -","- C29 H25 N O3 Sn -","- C116 H100 N4 O12 Sn4 -","4","1","HB2644","Hongyun Wang; Handong Yin; Yuying Sun","Methanoltriphenyl(quinoline-2-carboxylato)tin(IV)","Acta Crystallographica Section E","2007","63","12","m2994","m2994","10.1107/S1600536807056851","","","0.71073","MoKα","","0.0518","0.0294","","","0.0748","0.0985","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216499","16.1368","0.0016","12.5371","0.0014","6.2969","0.0004","90","","90","","90","","1273.9","0.2","120","2","120","2","","","","","","","","3","P n a 21","P 2c -2n","33","","2,6-Diphenylpyridine","","- C17 H13 N -","- C17 H13 N -","- C68 H52 N4 -","4","1","HB2646","Rocha, Marisa A.; Low, John Nicolson; Gomes, Ligia R.; Quesada, Antonio; Santos, Luís M. N. B. F.","2,6-Diphenylpyridine","Acta Crystallographica Section E","2007","63","12","o4833","o4833","10.1107/S1600536807058850","","","0.71073","MoKα","","0.0899","0.055","","","0.1321","0.1628","","","","","","1.069","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216500","6.5608","0.0013","6.806","0.0014","8.7799","0.0018","85.88","0.03","70.38","0.03","61.59","0.03","322.98","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1,1'-(p-Phenylene)bis(1H-imidazol-3-ium) hexafluorosilicate(IV)","","- C12 H12 F6 N4 Si -","- C12 H12 F6 N4 Si -","- C12 H12 F6 N4 Si -","1","0.5","HB2649","Li, Hui; Wei, Zhuangwei; Wang, Jian; Han, Qiuping; Han, Shuang","1,1'-(<i>p</i>-Phenylene)bis(1<i>H</i>-imidazol-3-ium) hexafluoridosilicate(IV)","Acta Crystallographica Section E","2007","63","12","o4864","o4864","10.1107/S1600536807058825","","","0.71073","MoKα","","0.0389","0.031","","","0.0774","0.0804","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216501","8.6389","0.0011","9.1819","0.0012","6.9929","0.0009","90","","94.212","0.002","90","","553.19","0.12","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Diaquabis(1<i>H</i>-1,2,4-triazole-3-carboxylato)copper(II)","","- C6 H8 Cu N6 O6 -","- C6 H8 Cu N6 O6 -","- C12 H16 Cu2 N12 O12 -","2","0.5","HB2650","Zhu, Jie; Yin, Xian-Hong; Feng, Yu; Su, Zhi-Xing; Lin, Cui-Wu","Diaquabis(1<i>H</i>-1,2,4-triazole-3-carboxylato)copper(II)","Acta Crystallographica Section E","2007","63","12","m3167","m3167","10.1107/S1600536807060370","","","0.71073","MoKα","","0.0214","0.021","","","0.0634","0.064","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216502","12.4391","0.0006","9.5274","0.0004","23.5683","0.0011","90","","93.347","0.001","90","","2788.4","0.2","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-Di-o-tolylthiourea","","- C15 H16 N2 S -","- C15 H16 N2 S -","- C120 H128 N16 S8 -","8","2","HB2651","Kuan, Fong Sheen; Tiekink, Edward R. T.","<i>N</i>,<i>N</i>'-Di-<i>o</i>-tolylthiourea","Acta Crystallographica Section E","2007","63","12","o4692","o4692","10.1107/S1600536807057364","","","0.71069","MoKα","","0.095","0.06","","","0.146","0.168","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216503","10.093","0.01","10.245","0.01","13.763","0.007","90","","107.811","0.01","90","","1355","2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chloridodimethyl(quinaldato)tin(IV)","","- C12 H12 Cl N O2 Sn -","- C12 H12 Cl N O2 Sn -","- C48 H48 Cl4 N4 O8 Sn4 -","4","1","HB2653","Hongyun Wang; Handong Yin; Daqi Wang","Chloridodimethyl(quinaldato)tin(IV)","Acta Crystallographica Section E","2007","63","12","m3059","m3059","10.1107/S1600536807058229","","","0.71073","MoKα","","0.0456","0.0306","","","0.0761","0.0915","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216504","9.1604","0.0018","10.222","0.002","10.903","0.002","90","","90.68","0.03","90","","1020.9","0.3","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(3-Bromopropoxy)-4-iodobenzene","","- C9 H10 Br I O -","- C9 H10 Br I O -","- C36 H40 Br4 I4 O4 -","4","1","HB2654","Wu, Zhou; Liu, Xuepeng; Shen, Peng; Jiang, Shende","1-(3-Bromopropoxy)-4-iodobenzene","Acta Crystallographica Section E","2007","63","12","o4760","o4760","10.1107/S1600536807058801","","","0.71073","MoKα","","0.0293","0.0248","","","0.0548","0.0555","","","","","","0.994","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216505","4.8564","0.0005","10.224","0.002","12.464","0.001","83.454","0.005","79.372","0.005","79.719","0.008","596.37","0.14","294","","294","","","","","","","","","6","P -1","-P 1","2","8094b","1-(2-Chloroethyl)-2-methylsulfanyl-5-nitro-1H-benzimidazole","","- C10 H10 Cl N3 O2 S -","- C10 H10 Cl N3 O2 S -","- C20 H20 Cl2 N6 O4 S2 -","2","1","HB2655","Goulizan Bi, Severin Dri; Kakou-Yao, Rita; Manh, Tia Gabriel; Tenon, A. Jules; Aycard, Jean Pierre","1-(2-Chloroethyl)-2-methylsulfanyl-5-nitro-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","12","o4798","o4798","10.1107/S1600536807058254","","","0.71073","MoKα","","0.093","0.0556","","0.1151","0.0832","0.1151","","","","","","0.9191","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216506","5.8389","0.0002","21.5704","0.0008","13.2408","0.0004","90","","100.763","0.001","90","","1638.31","0.1","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[bis[μ-1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline- 3-carboxylato]nickel(II)] dihydrate]","","- C32 H38 F2 N6 Ni O8 -","- C32 H34 F2 N6 Ni O8 -","- C64 H68 F4 N12 Ni2 O16 -","2","0.5","HB2657","Wen Xu; Zhe An","Poly[[bis[μ-1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylato]nickel(II)] dihydrate]","Acta Crystallographica Section E","2007","63","12","m3157","m3157","10.1107/S1600536807060813","","","0.71073","MoKα","","0.0375","0.0346","","","0.1044","0.1075","","","","","","0.972","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216507","16.751","0.003","10.686","0.002","8.094","0.0016","90","","97.12","0.03","90","","1437.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Methyl-5-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl}- 1,3,4-thiadiazole","","- C13 H12 N4 O S2 -","- C13 H12 N4 O S2 -","- C52 H48 N16 O4 S8 -","4","1","HB2658","Wang, Pin-liang; Li, Hai-ling; Kang, Si-shun; Zeng, Hai-shu; Wang, Hai-bo","2-Methyl-5-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl}-1,3,4-thiadiazole","Acta Crystallographica Section E","2007","63","12","o4934","o4934","10.1107/S1600536807061338","","","0.71073","MoKα","","0.129","0.0766","","","0.1656","0.2015","","","","","","1.005","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216508","7.1455","0.0003","9.4356","0.0003","10.5282","0.0003","80.565","0.001","79.468","0.001","69.568","0.001","650.1","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","8-(4-Methoxybenzoyl)-2,3,6,7-tetrahydroimidazo[1,2-a]pyridin-5(1H)-one","","- C15 H16 N2 O3 -","- C15 H16 N2 O3 -","- C30 H32 N4 O6 -","2","1","HB2659","Xiong, Yunkui; Li, Hui; Wang, Liben","8-(4-Methoxybenzoyl)-2,3,6,7-tetrahydroimidazo[1,2-<i>a</i>]pyridin-5(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","12","o4935","o4935","10.1107/S1600536807061326","","","0.71069","MoKα","","0.0929","0.0673","","","0.1426","0.1532","","","","","","1.15","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216509","11.471","0.008","11.582","0.009","12.154","0.009","65.296","0.008","84.535","0.009","88.244","0.009","1460.2","1.9","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","1,10-Phenanthrolin-1-ium tetrabromido(1,10-phenanthroline-κ^2^N,N')antimonate(III) dichloromethane solvate","","- C25 H19 Br4 Cl2 N4 Sb -","- C25 H19 Br4 Cl2 N4 Sb -","- C50 H38 Br8 Cl4 N8 Sb2 -","2","1","HB2661","Jun Zhai; Handong Yin; Feng Li; Daqi Wang","1,10-Phenanthrolin-1-ium tetrabromido(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')antimonate(III) dichloromethane solvate","Acta Crystallographica Section E","2007","63","12","m3131","m3131","10.1107/S1600536807060485","","","0.71073","MoKα","","0.076","0.0402","","","0.0982","0.1124","","","","","","1.011","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216510","12.0619","0.0005","14.1934","0.0006","20.381","0.0006","99.28","0.003","100.78","0.003","90.061","0.002","3381","0.2","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","2,4-Bis[1-(trifluoromethylsulfonyl)-1,4-dihydropyridin-4-yl]benzene-1,3,5-triyl tris(trifluoromethanesulfonate)","","- C21 H11 F15 N2 O13 S5 -","- C21 H11 F15 N2 O13 S5 -","- C84 H44 F60 N8 O52 S20 -","4","2","HB2662","Lister, Adam R.; Moratti, Stephen C.; Simpson, Jim","2,4-Bis[1-(trifluoromethylsulfonyl)-1,4-dihydropyridin-4-yl]benzene-1,3,5-triyl tris(trifluoromethanesulfonate)","Acta Crystallographica Section E","2007","63","12","o4858","o4859","10.1107/S1600536807060230","","","0.71073","MoKα","","0.0963","0.0614","","","0.173","0.2121","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216511","6.428","0.002","11.175","0.004","13.241","0.004","71.06","0.004","81.796","0.004","76.924","0.003","873.8","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Bromidobis(morpholine-4-dithiocarboxylato-κ^2^S,S')antimony(III)","","- C10 H16 Br N2 O2 S4 Sb -","- C10 H16 Br N2 O2 S4 Sb -","- C20 H32 Br2 N4 O4 S8 Sb2 -","2","1","HB2665","Yanlong Sun; Yantuan Li; Xin Cui; Xiuting Lang","Bromidobis(morpholine-4-dithiocarboxylato-κ^2^<i>S</i>,<i>S</i>')antimony(III)","Acta Crystallographica Section E","2007","63","12","m3132","m3132","10.1107/S1600536807060382","","","0.71073","MoKα","","0.059","0.0516","","","0.1557","0.1602","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216512","14.8085","0.0011","20.5518","0.0016","12.7062","0.001","90","","90","","90","","3867","0.5","295","2","295","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","1,5-Bis(2,3,4,5-tetrafluorobenzoyl)-1,5-diazacyclooctane","","- C20 H14 F8 N2 O2 -","- C20 H14 F8 N2 O2 -","- C160 H112 F64 N16 O16 -","8","1","HB2666","Dong, Jie; Tian, Lai-Jin; Qu, Yuan","1,5-Bis(2,3,4,5-tetrafluorobenzoyl)-1,5-diazacyclooctane","Acta Crystallographica Section E","2007","63","12","o4850","o4850","10.1107/S1600536807060242","","","0.71073","MoKα","","0.0644","0.0485","","","0.1334","0.1464","","","","","","1.035","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216513","9.783","0.005","18.069","0.009","16.373","0.008","90","","104.399","0.006","90","","2803","2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,7-Bis(diphenylphosphino)-1,7-dicarba-closo-dodecaborane","","- C26 H30 B10 P2 -","- C26 H30 B10 P2 -","- C104 H120 B40 P8 -","4","1","HB2667","Quanchang Wang; Dacheng Li; Daqi Wang","1,7-Bis(diphenylphosphino)-1,7-dicarba-<i>closo</i>-dodecaborane","Acta Crystallographica Section E","2007","63","12","o4918","o4918","10.1107/S1600536807061843","","","0.71073","MoKα","","0.0915","0.0475","","","0.1102","0.1427","","","","","","1.07","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216514","6.9018","0.0012","17.2184","0.0018","7.3063","0.0014","90","","103.003","0.002","90","","846","0.2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2'-[1,1'-(Ethylenedioxydinitrilo)diethylidyne]diphenol","","- C18 H20 N2 O4 -","- C18 H20 N2 O4 -","- C36 H40 N4 O8 -","2","0.5","HG2302","Li Wang; Xueni He; Yinxia Sun; Li Xu","2,2'-[1,1'-(Ethylenedioxydinitrilo)diethylidyne]diphenol","Acta Crystallographica Section E","2007","63","12","o4517","o4517","10.1107/S1600536807047927","","","0.71073","MoKα","","0.0897","0.0575","","","0.1386","0.1753","","","","","","1.068","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216515","11.1875","0.0006","21.4051","0.0015","20.2455","0.0012","90","","100.847","0.001","90","","4761.6","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Poly[[[(1,10-phenanthroline)cadmium(II)]-μ-succnicate-κ^4^O,O,O'O'] hydrate]","","- C48 H44 Cd3 N6 O16 -","- C48 H44 Cd3 N6 O16 -","- C192 H176 Cd12 N24 O64 -","4","0.5","HG2314","Wang, Xiao-Yan; Deng, Xiao-Tao; Wang, Cheng-Gang; Wang, Min","Poly[[tris(1,10-phenanthroline)tris(μ~3~-succinato)tricadmium(II)] tetrahydrate]","Acta Crystallographica Section E","2007","63","12","m2889","m2889","10.1107/S1600536807051665","","","0.71073","MoKα","","0.045","0.0348","","","0.0691","0.0727","","","","","","0.973","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216516","22.918","0.006","6.4588","0.0017","9.261","0.003","90","","99.654","0.004","90","","1351.4","0.7","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Chloro-N-(2,4-dimethylphenyl)benzamide","","- C15 H14 Cl N O -","- C15 H14 Cl N O -","- C60 H56 Cl4 N4 O4 -","4","1","HG2319","Zhou, Bin; Zheng, Peng-Wu","4-Chloro-<i>N</i>-(2,4-dimethylphenyl)benzamide","Acta Crystallographica Section E","2007","63","12","o4630","o4630","10.1107/S1600536807054256","","","0.71073","MoKα","","0.0635","0.0469","","","0.1154","0.1279","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216517","6.563","0.002","18.668","0.004","23.93","0.007","90","","90","","90","","2931.9","1.4","170","2","170","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-(1,5-Dimethylhexyl)-3a,5b,12a,14a-tetramethyl- 2,3,3a,4,5,5a,5b,11,12,13,14,14a-dodecahydro- 1H,12aH-cyclopentano[1,2]phenantreno[7,8-<i>b</i>]indole","","- C35 H51 N -","- C35 H51 N -","- C140 H204 N4 -","4","1","HG2320","López-Rodríguez, Matías; Mazoir, Noureddine; Daoubi, Mourad; Reina, Matías; Benharref, Ahmed","1-(1,5-Dimethylhexyl)-3a,5b,12a,14a-tetramethyl-2,3,3a,4,5,5a,5b,11,12,13,14,14a-dodecahydro-1<i>H</i>,12a<i>H</i>-cyclopenta[1,2]phenanthro[7,8-<i>b</i>]indole","Acta Crystallographica Section E","2007","63","12","o4911","o4911","10.1107/S1600536807053913","","","0.71073","MoKα","","0.0832","0.0746","","","0.1704","0.1757","","","","","","1.137","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216518","10.339","0.002","11.051","0.002","12.358","0.003","90","","90","","90","","1412","0.5","113","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-Chloro-<i>N</i>,<i>N</i>-dicyclohexylacetamide","","- C14 H24 Cl N O -","- C14 H24 Cl N O -","- C56 H96 Cl4 N4 O4 -","4","1","HG2321","Liu, Jian-Fei; Tang, Xiao-Fang; Wen, Yong-Hong","2-Chloro-<i>N</i>,<i>N</i>-dicyclohexylacetamide","Acta Crystallographica Section E","2007","63","12","o4539","o4539","10.1107/S1600536807053366","","","0.71073","MoKα","","0.0472","0.0422","","","0.0919","0.0951","","","","","","1.016","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216519","10.3646","0.0011","10.341","0.0009","15.5884","0.0017","90","","109.721","0.008","90","","1572.8","0.3","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(6-Oxo-3,4-diphenyl-1,6-dihydropyridazin-1-yl)acetic acid","","- C18 H14 N2 O3 -","- C18 H14 N2 O3 -","- C72 H56 N8 O12 -","4","1","HG2323","Abdullah Aydın; Deniz S. Doğruer; Mehmet Akkurt; Orhan Büyükgüngör","2-(6-Oxo-3,4-diphenyl-1,6-dihydropyridazin-1-yl)acetic acid","Acta Crystallographica Section E","2007","63","12","o4522","o4522","10.1107/S1600536807053172","","","0.71073","MoKα","","0.0946","0.0547","","","0.1283","0.1505","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216520","16.2289","0.0011","11.0873","0.0007","16.863","0.0008","90","","111.907","0.004","90","","2815.1","0.3","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(3-Oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrrolo[1,2-<i>c</i>]imidazol-1-yl)- N-phenyl-2-(2,4,6-trimethylphenyl)acetamide ethyl acetate solvate","","- C32 H34 N4 O4 -","- C32 H34 N4 O4 -","- C128 H136 N16 O16 -","4","1","HG2325","Imhof, Wolfgang","<i>N</i>-(3-Oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrrolo[1,2-<i>c</i>]imidazol-1-yl)-<i>N</i>'-phenyl-<i>N</i>-(2,4,6-trimethylphenyl)urea ethyl acetate solvate","Acta Crystallographica Section E","2007","63","12","o4910","o4910","10.1107/S1600536807060928","","","0.71073","MoKα","","0.0651","0.0423","","","0.1049","0.1146","","","","","","0.834","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216521","10.209","0.002","13.87","0.003","13.583","0.003","90","","90","","90","","1923.3","0.7","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","catena-Poly[[bis(1-ethylimidazole-κN^3^)zinc(II)]-μ-phthalato-κ^2^O^1^:O^2^]","","- C18 H18 N4 O4 Zn -","- C18 H18 N4 O4 Zn -","- C72 H72 N16 O16 Zn4 -","4","1","HG2326","Rong-Xun Li; Shao-Xiang Li; Qi-Ye Wu; Guang-Ye Liu; Fa-Qian Liu","<i>catena</i>-Poly[[bis(1-ethylimidazole-κ<i>N</i>^3^)zinc(II)]-μ-phthalato-κ^2^<i>O</i>^1^:<i>O</i>^2^]","Acta Crystallographica Section E","2007","63","12","m2875","m2875","10.1107/S1600536807053159","","","0.71073","MoKα","","0.0858","0.0597","","","0.1622","0.1825","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216522","22.722","0.002","13.201","0.0012","11.6488","0.001","90","","92.478","0.002","90","","3490.8","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","catena-Poly[{di-μ-azido-bis[azido(N,N-diethylethane-1,2-diamine)copper(II)]} [[azido(N,N-diethylethane-1,2-diamine)copper(II)]-μ-azido]]","","- C36 H96 Cu6 N48 -","- C36 H96 Cu6 N48 -","- C72 H192 Cu12 N96 -","2","0.5","HG2329","Yuan, Chun-Lan","<i>catena</i>-Poly[{di-μ-azido-bis[azido(<i>N</i>,<i>N</i>-diethylethane-1,2-diamine)copper(II)]} [[azido(<i>N</i>,<i>N</i>-diethylethane-1,2-diamine)copper(II)]-μ-azido]]","Acta Crystallographica Section E","2007","63","12","m3148","m3149","10.1107/S1600536807061041","","","0.71073","MoKα","","0.0453","0.0335","","","0.0787","0.0844","","","","","","1.018","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2216523","7.241","0.0014","8.392","0.0017","13.154","0.003","82.95","0.03","76.61","0.03","77.34","0.03","756.5","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","μ-Biphenyl-4,4'-dicarboxylato-bis{[2-(piperidin-1-yl)ethanamine]silver(I)} dihydrate","","- C28 H44 Ag2 N4 O6 -","- C28 H44 Ag2 N4 O6 -","- C28 H44 Ag2 N4 O6 -","1","0.5","HG2330","Yuan, Chun-Lan","μ-Biphenyl-4,4'-dicarboxylato-bis{[2-(piperidin-1-yl)ethanamine]silver(I)} dihydrate","Acta Crystallographica Section E","2007","63","12","m3147","m3147","10.1107/S160053680706103X","","","0.71073","MoKα","","0.0504","0.036","","","0.0739","0.0782","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216524","6.839","0.002","7.143","0.003","9.549","0.003","68.233","0.003","85.262","0.003","69.443","0.003","405","0.2","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","6,7-Dihydroxy-4-methylcoumarin","","- C10 H8 O4 -","- C10 H8 O4 -","- C20 H16 O8 -","2","1","HG2332","Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Xia, Hai-Tao","6,7-Dihydroxy-4-methylcoumarin","Acta Crystallographica Section E","2007","63","12","o4785","o4785","10.1107/S1600536807059272","","","0.71073","MoKα","","0.1334","0.095","","","0.2573","0.295","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216525","17.4716","0.001","7.7132","0.0004","19.1252","0.0011","90","","111.543","0.0019","90","","2397.3","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,4'-Bipiperidinium bis(hydrogen chloranilate)","","- C22 H24 Cl4 N2 O8 -","- C22 H24 Cl4 N2 O8 -","- C88 H96 Cl16 N8 O32 -","4","1","HG2333","Gotoh, Kazuma; Ishikawa, Rie; Ishida, Hiroyuki","4,4'-Bipiperidinediium bis(hydrogen chloranilate)","Acta Crystallographica Section E","2007","63","12","o4518","o4518","10.1107/S160053680705386X","","","0.71075","MoKα","","0.054","0.0397","","","0.0831","0.088","","","","","","1.109","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216526","21.176","0.004","7.317","0.002","13.33","0.003","90","","122.2","0.03","90","","1747.7","0.9","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-[4-(1<i>H</i>-Benzimidazol-1-yl)butyl]-1<i>H</i>-benzimidazol-3-ium nitrate","","- C18 H19 N5 O3 -","- C18 H19 N5 O3 -","- C72 H76 N20 O12 -","4","0.5","HG2334","Fu-feng Yan; Zhenping Li","1-[4-(1<i>H</i>-Benzimidazol-1-yl)butyl]-1<i>H</i>-benzimidazol-3-ium nitrate","Acta Crystallographica Section E","2007","63","12","o4710","o4710","10.1107/S1600536807057285","","","0.71073","MoKα","","0.0726","0.0526","","","0.1594","0.1917","","","","","","1.189","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216527","10.5355","0.0003","9.3464","0.0002","21.0493","0.0005","90","","101.52","0.003","90","","2030.95","0.09","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","piperidone","t-3-Benzyl-1-formyl-r-2,c-6-diphenylpiperidin-4-one","","- C25 H23 N O2 -","- C25 H23 N O2 -","- C100 H92 N4 O8 -","4","1","HG2335","A. Thiruvalluvar; S. Balamurugan; R. J. Butcher; A. Manimekalai; J. Jayabharathi","<i>t</i>-3-Benzyl-1-formyl-<i>r</i>-2,<i>c</i>-6-diphenylpiperidin-4-one","Acta Crystallographica Section E","2007","63","12","o4533","o4533","10.1107/S1600536807053846","","","0.71073","MoKα","","0.1067","0.0483","","","0.1221","0.1416","","","","","","1.001","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216529","13.1277","0.0017","4.1085","0.0005","15.419","0.002","90","","114.618","0.002","90","","756.04","0.17","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[1-(pyridin-2-yl-N-oxide)urea]monohydrate","2-Ureidopyridine N-oxide monohydrate","","- C6 H9 N3 O3 -","- C6 H9 N3 O3 -","- C24 H36 N12 O12 -","4","1","HG2337","Liu, Yin-Qiu; Wen, He-Rui","2-Ureidopyridine <i>N</i>-oxide monohydrate","Acta Crystallographica Section E","2007","63","12","o4690","o4690","10.1107/S1600536807055833","","","0.71073","MoKα","","0.0472","0.0336","","","0.0894","0.0923","","","","","","0.902","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216530","19.695","0.002","9.05","0.001","18.986","0.001","90","","119.483","0.005","90","","2945.8","0.5","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Aristolochic acid","8-Methoxy-3,4-methylenedioxy-10-nitrophenanthrene-1-carboxylic acid","","- C17 H11 N O7 -","- C17 H11 N O7 -","- C136 H88 N8 O56 -","8","1","HG2338","Gong, Yanqing; Lu, Yang; Zheng, Qitai","8-Methoxy-3,4-methylenedioxy-10-nitrophenanthrene-1-carboxylic acid","Acta Crystallographica Section E","2007","63","12","o4836","o4836","10.1107/S1600536807058965","","","0.71073","MoKα","","0.0584","0.0507","","","0.1274","0.137","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216531","12.887","0.006","9.298","0.004","18.286","0.006","90","","123.534","0.005","90","","1826.4","1.3","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Benzoyl-1-benzylmethyl-3-phenylguanidine","","- C22 H21 N3 O -","- C22 H21 N3 O -","- C88 H84 N12 O4 -","4","1","HG2339","Murtaza, Ghulam; Said, Muhammad; Rauf, M. Khawar; Ebihara, Masahiro; Badshah, Amin","2-Benzoyl-1-benzylmethyl-3-phenylguanidine","Acta Crystallographica Section E","2007","63","12","o4664","o4664","10.1107/S1600536807055845","","","0.7107","MoKα","","0.0662","0.057","","","0.1019","0.1051","","","","","","1.189","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216532","6.7493","0.0004","9.7335","0.0005","11.9658","0.0006","94.358","0.001","104.696","0.001","104.181","0.001","729.16","0.07","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","[Bis(3-aminopropyl-κN)(2-furylmethyl)amine-κN]dichloridocopper(II)","","- C11 H21 Cl2 Cu N3 O -","- C11 H21 Cl2 Cu N3 O -","- C22 H42 Cl4 Cu2 N6 O2 -","2","1","HG2341","Peng Wang; Xiao-Hui Wang; Huan Liu; Hong Zhou; Zhi-Quan Pan","[Bis(3-aminopropyl-κ<i>N</i>)(2-furylmethyl)amine-κ<i>N</i>]dichloridocopper(II)","Acta Crystallographica Section E","2007","63","12","m3001","m3001","10.1107/S1600536807056061","","","0.71073","MoKα","","0.0294","0.0274","","","0.0743","0.0756","","","","","","1.072","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216533","10.179","0.001","11.414","0.0014","13.424","0.0018","114.745","0.003","102.249","0.002","96.428","0.001","1348.3","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis[3-chloro-6-(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)picolinato]cadmium(II) tetrahydrate","","- C22 H26 Cd Cl2 N6 O8 -","- C22 H26 Cd Cl2 N6 O8 -","- C44 H52 Cd2 Cl4 N12 O16 -","2","1","HG2342","Kai Zhao; Xian-Hong Yin; Yu Feng; Jie Zhu","Bis[3-chloro-6-(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)picolinato]cadmium(II) tetrahydrate","Acta Crystallographica Section E","2007","63","12","m3023","m3023","10.1107/S1600536807055857","","","0.71073","MoKα","","0.0504","0.0368","","","0.0897","0.1008","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216534","7.773","0.002","8.443","0.002","10.472","0.003","78.982","0.005","85.344","0.005","86.869","0.006","671.8","0.3","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","(<i>E</i>)-Ethyl 2-[2-(bromomethyl)phenyl]-2-(methoxyimino)acetate","","- C12 H14 Br N O3 -","- C12 H14 Br N O3 -","- C24 H28 Br2 N2 O6 -","2","1","HG2343","Liang-zhong Xu; Wen-Zhao Bi; Kai Zhou","(<i>E</i>)-Ethyl 2-[2-(bromomethyl)phenyl]-2-(methoxyimino)acetate","Acta Crystallographica Section E","2007","63","12","o4686","o4686","10.1107/S1600536807055869","","","0.71073","MoKα","","0.1452","0.0607","","","0.1413","0.1886","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216535","11.949","0.003","9.152","0.002","12.312","0.003","90","","91.102","0.005","90","","1346.2","0.6","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(2,3-Dimethoxybenzyl)-N-nitroimidazolidin-2-imine","","- C12 H16 N4 O4 -","- C12 H16 N4 O4 -","- C48 H64 N16 O16 -","4","1","HG2345","Liang-Zhong Xu; Zhong-Jie Xu; Wen-Zhao Bi","1-(2,3-Dimethoxybenzyl)-<i>N</i>-nitroimidazolidin-2-imine","Acta Crystallographica Section E","2007","63","12","o4685","o4685","10.1107/S1600536807055870","","","0.71073","MoKα","","0.1156","0.0467","","","0.1103","0.1364","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216536","8.0337","0.0006","10.5159","0.0008","14.6372","0.0011","90.814","0.006","103.78","0.005","102.235","0.006","1170.98","0.16","296","","296","","","","","","","","","4","P -1","-P 1","2","","5-(4-Methylbenzoyl)-4-p-tolyl-1-(1-p-tolylethylideneamino)pyrimidin-2(1H)-one","","- C28 H25 N3 O2 -","- C28 H25 N3 O2 -","- C56 H50 N6 O4 -","2","1","HG2349","Dinçer, Muharrem; Özdemir, Namık; Önal, Zülbiye; Korkusuz, Elif","5-(4-Methylbenzoyl)-4-<i>p</i>-tolyl-1-(1-<i>p</i>-tolylethylideneamino)pyrimidin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","12","o4791","o4792","10.1107/S1600536807059284","","","0.71073","MoKα","","0.0634","0.0441","","","0.1182","0.1273","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216537","8.3413","0.0017","10.652","0.002","22.229","0.004","90","","94.32","0.03","90","","1969.5","0.7","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,5-Bis(2,6-dichlorophenyl)-3-[(1H-1,2,4-triazol-1-yl)methyl]penta-1,4-dien-3-ol","","- C20 H15 Cl4 N3 O -","- C20 H15 Cl4 N3 O -","- C80 H60 Cl16 N12 O4 -","4","1","HG2350","Liang-Zhong Xu; Gong-Sheng Zhang; Xu Yi; Guang-Wei An; Zhong-Jie Xu","1,5-Bis(2,6-dichlorophenyl)-3-[(1<i>H</i>-1,2,4-triazol-1-yl)methyl]penta-1,4-dien-3-ol","Acta Crystallographica Section E","2007","63","12","o4848","o4848","10.1107/S1600536807058898","","","0.71073","MoKα","","0.0387","0.0309","","","0.0768","0.0852","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216538","10.1514","0.0002","8.5268","0.0001","14.7413","0.0003","90","","101.679","0.0007","90","","1249.57","0.04","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[RuCl(CO)(tren)]Cl","Carbonylchlorido[tris(2-aminoethyl)amine]ruthenium(II) chloride","","- C7 H18 Cl2 N4 O Ru -","- C7 H18 Cl2 N4 O Ru -","- C28 H72 Cl8 N16 O4 Ru4 -","4","1","HG2353","Klüfers, Peter; Zangl, Anna","Carbonylchlorido[tris(2-aminoethyl)amine]ruthenium(II) chloride","Acta Crystallographica Section E","2007","63","12","m3061","m3061","10.1107/S1600536807058874","","","0.71073","MoKα","","0.0252","0.0203","","","0.0462","0.0479","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216539","10.8842","0.0005","13.8418","0.0007","15.4048","0.0008","75.839","0.003","69.345","0.002","72.833","0.002","2049.11","0.18","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Di-μ-thiocyanato-bis[bis(tri-<i>p</i>-tolylphosphine)silver(I)] acetonitrile disolvate","","- C90 H90 Ag2 N4 P4 S2 -","- C90 H90 Ag2 N4 P4 S2 -","- C90 H90 Ag2 N4 P4 S2 -","1","0.5","HG2355","Venter, Gertruida J. S.; Meijboom, Reinout; Roodt, Andreas","Di-μ-thiocyanato-bis[bis(tri-<i>p</i>-tolylphosphine)silver(I)] acetonitrile disolvate","Acta Crystallographica Section E","2007","63","12","m3076","m3077","10.1107/S1600536807058837","","","0.71073","MoKα","","","0.0427","","","","0.1212","","","","","","1.033","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216540","6.3549","0.0017","9.598","0.003","21.211","0.006","90","","96.765","0.004","90","","1284.7","0.6","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-[4-(Dimethylamino)benzylideneimino]phenol","","- C15 H16 N2 O -","- C15 H16 N2 O -","- C60 H64 N8 O4 -","4","1","HG2356","Wang, Qiang; Wang, Da-Qi","2-[4-(Dimethylamino)benzylideneimino]phenol","Acta Crystallographica Section E","2007","63","12","o4838","o4838","10.1107/S1600536807058813","","","0.71073","MoKα","","0.0896","0.0451","","","0.1113","0.1385","","","","","","1.009","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216541","8.4735","0.0001","10.1022","0.0001","10.3165","0.0001","91.925","0.001","98.254","0.001","98.388","0.001","863.264","0.016","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","<i>trans</i>-Bis(acetylacetonato)diaquachromium(III) perchlorate monohydrate","","- C10 H20 Cl Cr O11 -","- C10 H20 Cl Cr O11 -","- C20 H40 Cl2 Cr2 O22 -","2","1","HJ3062","Arulsamy, Navamoney; Crawford, Jared L.","<i>trans</i>-Bis(acetylacetonato)diaquachromium(III) perchlorate monohydrate","Acta Crystallographica Section E","2007","63","12","m3128","m3128","10.1107/S1600536807059417","","","0.71073","MoKα","","0.0582","0.0414","","","0.1091","0.1198","","","","","","1.058","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216542","17.693","0.0015","4.505","0.0005","14.6383","0.0012","90","","106.545","0.007","90","","1118.47","0.19","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Methyl 3,4,5-trimethoxybenzoate","","- C11 H14 O5 -","- C11 H14 O5 -","- C44 H56 O20 -","4","1","HK2329","Saeed, Aamer; Khera, Rasheed Ahmad; Bolte, Michael","Methyl 3,4,5-trimethoxybenzoate","Acta Crystallographica Section E","2007","63","12","o4582","o4582","10.1107/S1600536807054384","","","0.71073","MoKα","","0.0461","0.0398","","","0.1104","0.1141","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216543","5.8603","0.0007","7.2525","0.0009","18.875","0.002","89.268","0.01","82.734","0.01","76.045","0.01","772.16","0.16","296","","296","","","","","","","","","4","P -1","-P 1","2","","3-(4-Butylphenylamino)isobenzofuran-1(3H)-one","","- C18 H19 N O2 -","- C18 H19 N O2 -","- C36 H38 N2 O4 -","2","1","HK2339","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","3-(4-Butylphenylamino)isobenzofuran-1(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","12","o4510","o4511","10.1107/S1600536807053226","","","0.71073","MoKα","","0.1273","0.0798","","","0.2258","0.2492","","","","","","1.046","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216544","9.269","0.0019","13.674","0.003","17.075","0.003","88.91","0.03","87.15","0.03","81.07","0.03","2135.1","0.8","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","(4-Carboxybutyl)triphenylphosphonium bromide","","- C23 H24 Br O2 P -","- C23 H24 Br O2 P -","- C92 H96 Br4 O8 P4 -","4","2","HK2349","Wu, Deng-Yu; Li, Fang-Shi; Xia, Jin-Yun; Mao, Nan-Wen; Yao, Hong-Liang","(4-Carboxybutyl)triphenylphosphonium bromide","Acta Crystallographica Section E","2007","63","12","o4532","o4532","10.1107/S1600536807053548","","","0.71073","MoKα","","0.1853","0.0839","","","0.1554","0.1955","","","","","","0.991","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216545","19.4079","0.001","19.4079","0.001","11.525","0.0004","90","","90","","120","","3759.5","0.3","120","2","120","2","","","","","","","","4","R -3 :H","-R 3","148","","3-Hydroxy-4-methoxybenzohydrazide","","- C8 H10 N2 O3 -","- C8 H10 N2 O3 -","- C144 H180 N36 O54 -","18","1","HK2352","Muhammad Hanif; Ghulam Qadeer; Nasim Hasan Rama; Sauli Vuoti; Juho Autio","3-Hydroxy-4-methoxybenzohydrazide","Acta Crystallographica Section E","2007","63","12","o4506","o4506","10.1107/S1600536807053160","","","0.71073","MoKα","","0.0789","0.0448","","","0.0778","0.0868","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216546","7.1697","0.0003","11.1376","0.0004","11.7574","0.0005","67.07","0.002","77.421","0.002","72.948","0.003","820.93","0.06","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","4-(4-Chlorophenyl)-3-(3-methoxyphenethyl)-1H-1,2,4-triazole-5(4H)-thione","","- C17 H16 Cl N3 O S -","- C17 H16 Cl N3 O S -","- C34 H32 Cl2 N6 O2 S2 -","2","1","HK2353","Muhammad Hanif; Ghulam Qadeer; Nasim Hasan Rama; Sauli Vuoti; Juho Autio","4-(4-Chlorophenyl)-3-(3-methoxyphenethyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","12","o4507","o4507","10.1107/S1600536807053329","","","0.71073","MoKα","","0.0728","0.0434","","","0.0985","0.1113","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216547","10.643","0.0012","11.2669","0.0013","18.673","0.002","90","","90","","90","","2239.1","0.4","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Diethyl 5,10-dihydro-6,9-dibromo-4,11-dioxo-cis-1H,3H,4H,11H-2-oxa-3a,4a, 10a,11a-tetraazabenz[f]indeno[2,1,7-ija]azulene-11b,11c-dicarboxylate","","- C20 H20 Br2 N4 O7 -","- C20 H20 Br2 N4 O7 -","- C80 H80 Br8 N16 O28 -","4","1","HK2354","Kunru Wang; Jing Li; Nengfang She","Diethyl 5,10-dihydro-6,9-dibromo-4,11-dioxo-<i>cis</i>-1H,3<i>H</i>,4<i>H</i>,11<i>H</i>-2-oxa-3a,4a,10a,11a-tetraazabenz[<i>f</i>]indeno[2,1,7-<i>ija</i>]azulene-11b,11c-dicarboxylate","Acta Crystallographica Section E","2007","63","12","o4541","o4541","10.1107/S1600536807054438","","","0.71073","MoKα","","0.0584","0.0423","","","0.1005","0.1059","","","","","","1.003","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216549","6.961","0.003","9.19","0.004","11.691","0.005","68.694","0.005","87.316","0.005","84.623","0.005","693.6","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Aqua(6-nitro-1H-benzimidazole)(oxydiacetato)copper(II)","","- C11 H11 Cu N3 O8 -","- C11 H11 Cu N3 O8 -","- C22 H22 Cu2 N6 O16 -","2","1","HK2356","Zhang, Wan-Ju; Li, Yan-Tuan; Wu, Zhi-Yong","Aqua(5-nitro-1<i>H</i>-benzimidazole)(oxydiacetato)copper(II)","Acta Crystallographica Section E","2007","63","12","m2962","m2963","10.1107/S1600536807055225","","","0.71073","MoKα","","0.0419","0.031","","","0.075","0.082","","","","","","1.062","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216551","13.332","0.003","5.149","0.001","14.458","0.003","90","","103.09","0.03","90","","966.7","0.4","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","N-acryloylglycylglycine monohydrate","2-(2-acrylamidoacetamido)acetic acid monohydrate","","- C7 H12 N2 O5 -","- C7 H12 N2 O5 -","- C28 H48 N8 O20 -","4","1","HK2358","Gao, Xiao-feng; Wu, Cong-ren; Wang, Hai-bo; Wang, Jin-tang","<i>N</i>-Acryloylglycylglycine monohydrate","Acta Crystallographica Section E","2007","63","12","o4580","o4580","10.1107/S1600536807054840","","","0.71073","MoKα","","0.0711","0.0527","","","0.1428","0.1627","","","","","","1.031","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216552","14.558","0.003","5.752","0.0012","26.243","0.005","90","","102.56","0.03","90","","2144.9","0.8","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-Carboxy-5-(trifluoromethyl)phenyl acetate","","- C10 H7 F3 O4 -","- C10 H7 F3 O4 -","- C80 H56 F24 O32 -","8","2","HK2360","Zhang, Ren; Wang, Dan; Ma, Chunmei; Li, Zhenjiang","2-Carboxy-5-(trifluoromethyl)phenyl acetate","Acta Crystallographica Section E","2007","63","12","o4609","o4609","10.1107/S1600536807055171","","","0.71073","MoKα","","0.1603","0.0704","","","0.1596","0.2057","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216553","9.738","0.0019","10.717","0.002","13.197","0.003","90","","109.17","0.03","90","","1300.9","0.5","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2-Chlorothiazol-5-yl)methyl 4-nitrophenyl carbonate","","- C11 H7 Cl N2 O5 S -","- C11 H7 Cl N2 O5 S -","- C44 H28 Cl4 N8 O20 S4 -","4","1","HK2361","Wang, Peng; Xu, Hao; Huang, Wen-long","(2-Chlorothiazol-5-yl)methyl 4-nitrophenyl carbonate","Acta Crystallographica Section E","2007","63","12","o4624","o4624","10.1107/S1600536807055420","","","0.71073","MoKα","","0.0935","0.0524","","","0.129","0.159","","","","","","1.019","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216554","4.771","0.001","17.45","0.004","15.277","0.003","90","","90.5","0.03","90","","1271.8","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Benzoylanilinium chloride monohydrate","","- C13 H14 Cl N O2 -","- C13 H14 Cl N O2 -","- C52 H56 Cl4 N4 O8 -","4","1","HK2364","Shui-Ping Deng; Shan Liu; Guang-Liang Song; Hong-Jun Zhu","2-Benzoylanilinium chloride monohydrate","Acta Crystallographica Section E","2007","63","12","o4603","o4603","10.1107/S1600536807055195","","","0.71073","MoKα","","0.1129","0.0676","","","0.1548","0.1744","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216557","7.7723","0.001","9.9453","0.0013","11.8667","0.0016","95.774","0.002","91.581","0.002","98.657","0.002","901.4","0.2","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","N-[2-(4,6-Dimethoxypyrimidin-2-ylcarbonyl)phenyl]benzamide","","- C20 H17 N3 O4 -","- C20 H17 N3 O4 -","- C40 H34 N6 O8 -","2","1","HK2369","Yuanxiang Li; Gang Huang","<i>N</i>-[2-(4,6-Dimethoxypyrimidin-2-ylcarbonyl)phenyl]benzamide","Acta Crystallographica Section E","2007","63","12","o4667","o4667","10.1107/S1600536807056553","","","0.71073","MoKα","","0.0675","0.0489","","","0.1224","0.1319","","","","","","0.983","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216558","8.487","0.0017","16.53","0.003","15.703","0.003","90","","94.47","0.03","90","","2196.3","0.7","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(R,S)-Diethyl {[5-(2,4-dichlorophenyl)-1,3,4-thiadiazol-2-ylamino](phenyl)methyl}phosphonate","","- C19 H20 Cl2 N3 O3 P S -","- C19 H20 Cl2 N3 O3 P S -","- C76 H80 Cl8 N12 O12 P4 S4 -","4","1","HK2370","Yin, Li-He; Wan, Rong; Wu, Wen-Yuan; Wang, Bin; Wang, Jin-Tang","(<i>R</i>,<i>S</i>)-Diethyl {[5-(2,4-dichlorophenyl)-1,3,4-thiadiazol-2-ylamino](phenyl)methyl}phosphonate","Acta Crystallographica Section E","2007","63","12","o4648","o4648","10.1107/S1600536807056632","","","0.71073","MoKα","","0.1114","0.0847","","","0.1292","0.1544","","","","","","1.168","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216559","5.6436","0.0008","16.73","0.002","16.239","0.002","90","","95.193","0.007","90","","1527","0.3","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(4-Chlorophenyl)-3-phenyl-5-(4-pyridyl)-4H-1,2,4-triazole","","- C19 H13 Cl N4 -","- C19 H13 Cl N4 -","- C76 H52 Cl4 N16 -","4","1","HK2371","Jing Hu; Guochun Ma; Guofeng Chen; Wenqin Zhang","4-(4-Chlorophenyl)-3-phenyl-5-(4-pyridyl)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section E","2007","63","12","o4671","o4671","10.1107/S1600536807056747","","","0.7107","MoKα","","0.0582","0.0446","","","0.0971","0.1035","","","","","","1.087","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216560","9.779","0.002","9.807","0.002","19.334","0.004","90","","100.915","0.003","90","","1820.6","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[aquadiphenyltin(IV)]-μ-2,6-pyridinedicarboxylato]","","- C19 H15 N O5 Sn -","- C19 H15 N O5 Sn -","- C76 H60 N4 O20 Sn4 -","4","1","HK2372","Fahui Li; Yantuan Li; Hongyan Zhao; Xiuting Lang","<i>catena</i>-Poly[[aquadiphenyltin(IV)]-μ-2,6-pyridinedicarboxylato]","Acta Crystallographica Section E","2007","63","12","m3207","m3207","10.1107/S1600536807057406","","","0.71073","MoKα","","0.0444","0.0341","","","0.0853","0.0935","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216561","14.868","0.002","4.851","0.002","15.428","0.004","90","","107.7","0.03","90","","1060.1","0.6","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Ethyl 2-(3-methoxyphenyl)acetate","","- C11 H14 O3 -","- C11 H14 O3 -","- C44 H56 O12 -","4","1","HK2373","Ghulam Qadeer; Nasim Hasan Rama; Murat Taş; Okan Zafer Yeşilel","Ethyl 2-(3-methoxyphenyl)acetate","Acta Crystallographica Section E","2007","63","12","o4678","o4678","10.1107/S1600536807057479","","","0.71073","MoKα","","0.1895","0.1453","","","0.4838","0.3454","","","","","","1.082","","","","has coordinates","201974","2020-10-21","18:00:00",""
"2216562","14.0076","0.0008","7.4781","0.0003","14.9916","0.0008","90","","90.536","0.003","90","","1570.3","0.14","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4-(4-chlorophenyl)-3-(3-methoxybenzyl)-1H-1,2,4-triazole-5(4H)-thione","","- C16 H14 Cl N3 O S -","- C16 H14 Cl N3 O S -","- C64 H56 Cl4 N12 O4 S4 -","4","1","HK2374","Muhammad Hanif; Ghulam Qadeer; Nasim Hasan Rama; Sauli Vuoti; Juho Autio","4-(4-Chlorophenyl)-3-(3-methoxybenzyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","12","o4754","o4754","10.1107/S1600536807058394","","","0.71073","MoKα","","0.0636","0.0441","","","0.0996","0.1096","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216563","7.893","0.0003","8.9195","0.0003","13.3491","0.0004","96.514","0.002","98.681","0.002","104.476","0.002","888.25","0.05","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","4-(4-Chlorophenyl)-1-[2-(2,4-dichlorophenoxy)propanoyl]thiosemicarbazide","","- C16 H14 Cl3 N3 O2 S -","- C16 H14 Cl3 N3 O2 S -","- C32 H28 Cl6 N6 O4 S2 -","2","1","HK2375","Muhammad Hanif; Ghulam Qadeer; Nasim Hasan Rama; Sauli Vuoti; Juho Autio","4-(4-Chlorophenyl)-1-[2-(2,4-dichlorophenoxy)propanoyl]thiosemicarbazide","Acta Crystallographica Section E","2007","63","12","o4775","o4775","10.1107/S1600536807059119","","","0.71073","MoKα","","0.0611","0.0422","","","0.091","0.1003","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216564","8.929","0.0004","8.1865","0.0004","10.7583","0.0004","90","","104.127","0.003","90","","762.62","0.06","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-Phenyl-oxazolidin-2-one","3-Phenyloxazolidin-2-one","","- C9 H9 N O2 -","- C9 H9 N O2 -","- C36 H36 N4 O8 -","4","1","HK2376","Betz, Richard; Klüfers, Peter","3-Phenyloxazolidin-2-one","Acta Crystallographica Section E","2007","63","12","o4922","o4922","10.1107/S1600536807061053","","","0.71073","MoKα","","0.0497","0.0386","","","0.0979","0.1056","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216565","13.033","0.0008","4.931","0.0004","14.604","0.001","90","","106.262","0.005","90","","900.99","0.11","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(3-Methoxyphenyl)acetohydrazide","","- C9 H12 N2 O2 -","- C9 H12 N2 O2 -","- C36 H48 N8 O8 -","4","1","HK2377","Muhammad Hanif; Ghulam Qadeer; Nasim Hasan Rama; Muhammad Farman; Ales Ruzicka","2-(3-Methoxyphenyl)acetohydrazide","Acta Crystallographica Section E","2007","63","12","o4828","o4828","10.1107/S1600536807058990","","","0.71073","MoKα","","0.078","0.0518","","","0.1112","0.1301","","","","","","1.137","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216566","5.042","0.0002","17.197","0.0007","7.702","0.0004","90","","93.113","0.004","90","","666.83","0.05","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Hydroxybenzohydrazide","","- C7 H8 N2 O2 -","- C7 H8 N2 O2 -","- C28 H32 N8 O8 -","4","1","HK2378","Muhammad Hanif; Ghulam Qadeer; Nasim Hasan Rama; Muhammad Rafiq; Ales Ruzicka","3-Hydroxybenzohydrazide","Acta Crystallographica Section E","2007","63","12","o4829","o4829","10.1107/S1600536807058989","","","0.71073","MoKα","","0.0447","0.0367","","","0.092","0.0995","","","","","","1.106","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216568","5.885","0.0012","16.231","0.003","21.723","0.004","90","","93.93","0.03","90","","2070.1","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4-chlorophenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine monohydrate","","- C20 H24 Cl N3 O5 -","- C20 H24 Cl N3 O5 -","- C80 H96 Cl4 N12 O20 -","4","1","HK2380","Li, Si-Cun; Xu, Hao; Huang, Wen-Long","<i>N</i>-(4-Chlorophenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine monohydrate","Acta Crystallographica Section E","2007","63","12","o4804","o4804","10.1107/S1600536807059466","","","0.71073","MoKα","","0.1428","0.067","","","0.1485","0.1791","","","","","","0.993","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216569","18.718","0.004","9.924","0.002","9.696","0.002","90","","90","","90","","1801.1","0.6","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,2,4-Trimethyl-2,3-dihydro-1H-1,5-benzodiazepin-5-ium 3,5-dihydroxybenzoate","","- C19 H22 N2 O4 -","- C19 H22 N2 O4 -","- C76 H88 N8 O16 -","4","1","HK2381","Pallepogu Raghavaiah","2,2,4-Trimethyl-2,3-dihydro-1<i>H</i>-1,5-benzodiazepin-5-ium 3,5-dihydroxybenzoate","Acta Crystallographica Section E","2007","63","12","o4909","o4909","10.1107/S1600536807060424","","","0.71073","MoKα","","0.0378","0.0349","","","0.0824","0.0844","","","","","","1.09","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216570","7.894","0.002","9.302","0.002","11.697","0.003","111.518","0.004","98.887","0.004","100.23","0.004","763.4","0.3","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","Methyl N-{2-[(4,6-dimethoxypyrimidin-2-yl)(hydroxy)methyl]phenyl}carbamate","","- C15 H16 N3 O5 -","- C15 H16 N3 O5 -","- C30 H32 N6 O10 -","2","1","HK2382","Yuan-Xiang Li; Dong-Ming Cheng","Methyl <i>N</i>-{2-[(4,6-dimethoxypyrimidin-2-yl)(hydroxy)methyl]phenyl}carbamate","Acta Crystallographica Section E","2007","63","12","o4857","o4857","10.1107/S1600536807060394","","","0.71073","MoKα","","0.1032","0.0636","","","0.1354","0.1487","","","","","","1.011","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216571","20.891","0.004","10.526","0.002","13.581","0.003","90","","128.24","0.03","90","","2345.6","1.3","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3,4-Dibutoxy-<i>N</i>^2^,<i>N</i>^2'^-bis(propan-2-ylidene)thiophene-2,5- dicarbohydrazide","","- C20 H32 N4 O4 S -","- C20 H32 N4 O4 S -","- C80 H128 N16 O16 S4 -","4","0.5","HK2384","Li, Hai-Lin; Kang, Si-Shun; Zeng, Hai-Su; Wang, Hai-Bo","3,4-Dibutoxy-<i>N</i>^2^,<i>N</i>^2'^-bis(propan-2-ylidene)thiophene-2,5-dicarbohydrazide","Acta Crystallographica Section E","2007","63","12","o4762","o4762","10.1107/S160053680705951X","","","0.71073","MoKα","","0.0942","0.0612","","","0.161","0.1887","","","","","","1.016","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216572","8.9617","0.001","9.2179","0.001","9.993","0.0011","78.427","0.009","66.464","0.008","79.54","0.009","736.7","0.15","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","Bis(2,9-dimethyl-1,10-phenanthrolinium) hexachloridoplatinate(IV)","","- C28 H26 Cl6 N4 Pt -","- C28 H26 Cl6 N4 Pt -","- C28 H26 Cl6 N4 Pt -","1","0.5","HK2386","Yousefi, Mohammad; Ahmadi, Roya; Amani, Vahid; Khavasi, Hamid Reza","Bis(2,9-dimethyl-1,10-phenanthrolinium) hexachloridoplatinate(IV)","Acta Crystallographica Section E","2007","63","12","m3114","m3115","10.1107/S1600536807059594","","","0.71073","MoKα","","0.0367","0.0367","","","0.0996","0.0996","","","","","","1.101","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216573","11.61","0.003","7.4556","0.0017","22.085","0.005","90","","102.753","0.004","90","","1864.5","0.8","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2,6-Dimethylphenyl)-3-(3,4,5-tirmethoxybenzoyl)thiourea","","- C19 H22 N2 O4 S -","- C19 H22 N2 O4 S -","- C76 H88 N8 O16 S4 -","4","1","HK2387","Hai-Tang Du; Hai-Jun Du; Ming Lu; Li-Li Sun","1-(2,6-Dimethylphenyl)-3-(3,4,5-trimethoxybenzoyl)thiourea","Acta Crystallographica Section E","2007","63","12","o4827","o4827","10.1107/S1600536807059892","","","0.71073","MoKα","","0.0766","0.0396","","","0.0904","0.1069","","","","","","1.011","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216574","10.275","0.003","14.494","0.004","9.829","0.003","90","","112.612","0.004","90","","1351.3","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(2-Thienyl)-3,4-dihydrobenzo[h]quinolin-2(1H)-one","","- C17 H13 N O S -","- C17 H13 N O S -","- C68 H52 N4 O4 S4 -","4","1","HK2388","Xiaotong Zhu; Shujiang Tu; Dianxiang Zhou","4-(2-Thienyl)-3,4-dihydrobenzo[<i>h</i>]quinolin-2(1<i>H</i>)-one","Acta Crystallographica Section E","2007","63","12","o4907","o4907","10.1107/S1600536807060369","","","0.71073","MoKα","","0.1278","0.0729","","","0.1958","0.2475","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216577","13.539","0.013","9.049","0.009","14.662","0.014","90","","116.609","0.015","90","","1606","3","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(4-nitrophenyl) succinate","","- C16 H12 N2 O8 -","- C16 H12 N2 O8 -","- C64 H48 N8 O32 -","4","0.5","HK2394","Hai-tang Du; Hai-jun Du; Ming Lu; Li-li Sun","Bis(4-nitrophenyl) succinate","Acta Crystallographica Section E","2007","63","12","o4926","o4926","10.1107/S1600536807062058","","","0.71073","MoKα","","0.1296","0.0621","","","0.1524","0.1962","","","","","","1.007","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216578","8.1582","0.0018","6.362","0.0012","18.679","0.003","90","","101.862","0.015","90","","948.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[4,4'-bipyridinium [bis(μ~3~-pyrazole-3,5-dicarboxylato- κ^5^O^5^,N^1^:N^2^,O^3^:O^3^)dicopper(II)]]","","- C20 H12 Cu2 N6 O8 -","- C20 H12 Cu2 N6 O8 -","- C40 H24 Cu4 N12 O16 -","2","0.5","HY2090","Dou, Qing-Qing; He, Yong-Ke; Zhang, Li-Tian; Han, Zheng-Bo","<i>catena</i>-Poly[4,4'-bipyridinium [bis(μ~3~-pyrazole-3,5-dicarboxylato-κ^5^<i>O</i>^5^,<i>N</i>^1^:<i>N</i>^2^,<i>O</i>^3^:<i>O</i>^3^)dicopper(II)]]","Acta Crystallographica Section E","2007","63","12","m2908","m2909","10.1107/S1600536807054864","","","0.71073","MoKα","","0.0276","0.0253","","","0.0696","0.0714","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216579","12.5391","0.0011","8.7406","0.0007","11.3861","0.001","90","","106.319","0.001","90","","1197.63","0.18","292","2","292","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-aqua-bis[(2-amino-4,5-dimethylbenzenesulfonato-κN)aquasilver(I)]","","- C16 H28 Ag2 N2 O10 S2 -","- C16 H28 Ag2 N2 O10 S2 -","- C32 H56 Ag4 N4 O20 S4 -","2","0.5","HY2095","Dong, Xian-Wu; Li, Wei; Li, Yu-Jie","Di-μ-aqua-bis[(2-amino-4,5-dimethylbenzenesulfonato-κ<i>N</i>)aquasilver(I)]","Acta Crystallographica Section E","2007","63","12","m2910","m2910","10.1107/S1600536807053950","","","0.71073","MoKα","","0.0411","0.0307","","","0.0725","0.0744","","","","","","0.917","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216580","14.8048","0.0012","6.8674","0.0006","15.1623","0.0012","90","","90","","90","","1541.6","0.2","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Diaquabis[5-(1<i>H</i>-tetrazol-5-ylamino-κN^4^)tetrazolato- κ<i>N</i>^1^]manganese(II) dihydrate","","- C4 H12 Mn N18 O4 -","- C4 H12 Mn N18 O4 -","- C16 H48 Mn4 N72 O16 -","4","0.5","HY2096","Lin, Jiao-Min; Guan, Yang-Fan; Dong, Wen","Diaquabis[5-(1<i>H</i>-tetrazol-5-ylamino-κ<i>N</i>^4^)tetrazolato-κ<i>N</i>^1^]manganese(II) dihydrate","Acta Crystallographica Section E","2007","63","12","m3017","m3017","10.1107/S1600536807057091","","","0.71073","MoKα","","0.0901","0.0516","","","0.1249","0.1449","","","","","","1.028","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216581","8.777","0.002","10.9763","0.0016","17.981","0.003","90","","103.65","0.014","90","","1683.3","0.5","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","catena-Poly[[(2,2'-bipyridyl-κ^2^N,N')zinc(II)]-μ~3~- (5-hydroxyisophthalato-κ^4^O,O':O'':O''') monohydrate]","","- C18 H14 N2 O6 Zn -","- C18 H14 N2 O6 Zn -","- C72 H56 N8 O24 Zn4 -","4","1","HY2097","Li, Xiao-Feng; An, Yan; Yin, Yan-Sheng","<i>catena</i>-Poly[[[(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')zinc(II)]-μ~3~-(5-hydroxyisophthalato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'':<i>O</i>''')] monohydrate]","Acta Crystallographica Section E","2007","63","12","m3117","m3118","10.1107/S1600536807059880","","","0.71073","MoKα","","0.0587","0.0375","","","0.0912","0.1113","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216582","11.045","0.002","11.361","0.002","12.352","0.003","103.83","0.03","93.54","0.03","96.84","0.03","1487.8","0.6","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[bis(4,4'-bipyridine-κN)cobalt(II)]- μ~3~-4,4'-dicarboxybiphenyl-3,3'-dicarboxylato- κ^4^O^3^,O^3'^:O^3''^:O^3'''^)]","","- C36 H24 Co N4 O8 -","- C36 H24 Co N4 O8 -","- C72 H48 Co2 N8 O16 -","2","1","HY2098","Chao Qin; Xin-Long Wang; En-Bo Wang","<i>catena</i>-Poly[[bis(4,4'-bipyridine-κ<i>N</i>)cobalt(II)]-μ~3~-(4,4'-dicarboxybiphenyl-3,3'-dicarboxylato-κ^4^<i>O</i>^3^,<i>O</i>^3'^:<i>O</i>^3''^:<i>O</i>^3'''^)]","Acta Crystallographica Section E","2007","63","12","m3073","m3074","10.1107/S1600536807058333","","","0.71069","MoKα","","0.0543","0.0411","","","0.117","0.123","","","","","","1.009","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216583","7.852","0.002","8.971","0.002","9.466","0.003","103.224","0.001","101.05","0.002","100.665","0.004","618.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-chlorido-bis[chlorido[2-(2-pyridyl)-1H-benzimidazole]cadmium(II)]","","- C24 H18 Cd2 Cl4 N6 -","- C24 H18 Cd2 Cl4 N6 -","- C24 H18 Cd2 Cl4 N6 -","1","0.5","HY2099","Xia, Chang-Kun; Wu, Wen; Huang, Li-Ying; Xie, Ji-Min","Di-μ-chlorido-bis{chlorido[2-(2-pyridyl)-1<i>H</i>-benzimidazole]cadmium(II)}","Acta Crystallographica Section E","2007","63","12","m2981","m2981","10.1107/S1600536807056188","","","0.71073","MoKα","","0.0241","0.023","","","0.0607","0.0616","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216584","8.559","0.002","8.851","0.002","21.875","0.004","92.05","0.03","99.78","0.03","108.9","0.03","1537.7","0.7","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","Tetraaquabis[2-(3-benzoylphenyl)propanoato-κ<i>O</i>]nickel(II) monohydrate","","- C32 H36 Ni O11 -","- C32 H36 Ni O11 -","- C64 H72 Ni2 O22 -","2","1","IM2040","Zhu-Yan Zhang; Nan Yu; Xiao-Xi Guo; Jiao Pu; Jian-Ping Sun","Tetraaquabis[2-(3-benzoylphenyl)propanoato-κ<i>O</i>]nickel(II) monohydrate","Acta Crystallographica Section E","2007","63","12","m2883","m2883","10.1107/S1600536807052762","","","0.71073","MoKα","","0.1071","0.0531","","","0.1297","0.1743","","","","","","1.14","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216585","6.139","0.001","9.89","0.002","12.658","0.003","72.45","0.03","85.91","0.03","77.12","0.03","714.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-(3-Methoxyphenyl)-5-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]- 1,2,4-oxadiazole","","- C13 H12 N4 O2 S2 -","- C13 H12 N4 O2 S2 -","- C26 H24 N8 O4 S4 -","2","1","IM2042","Wang, Pin-liang; Zeng, Hai-shu; Li, Hai-ling; Kang, Si-shun; Wang, Hai-bo","3-(3-Methoxyphenyl)-5-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1,2,4-oxadiazole","Acta Crystallographica Section E","2007","63","12","o4776","o4776","10.1107/S160053680705934X","","","0.71073","MoKα","","0.0683","0.0464","","","0.1081","0.1276","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216586","7.7355","0.0001","13.2772","0.0002","12.4147","0.0002","90","","104.333","0.002","90","","1235.37","0.03","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aqua(oxydiacetato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')(pyridine-2-carboxamide- κ^2^<i>N</i>^1^,<i>O</i>)copper(II)","","- C10 H12 Cu N2 O7 -","- C10 H12 Cu N2 O7 -","- C40 H48 Cu4 N8 O28 -","4","1","IM2044","Sieroń, Lesław","Aqua(oxydiacetato-κ^3^<i>O</i>,<i>O</i>',<i>O</i>'')(pyridine-2-carboxamide-κ^2^<i>N</i>^1^,<i>O</i>)copper(II)","Acta Crystallographica Section E","2007","63","12","m3087","m3087","10.1107/S1600536807059144","","","0.71073","MoKα","","0.0245","0.0217","","","0.0606","0.0618","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216587","11.7974","0.0004","8.2946","0.0002","14.6706","0.0004","90","","106.273","0.003","90","","1378.07","0.07","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1,2,3-triazole","1-{5-Methyl-1-[8-(trifluoromethyl)quinolin-4-yl]-1<i>H</i>-1,2,3-triazol- 4-yl}ethanone","","- C15 H11 F3 N4 O -","- C15 H11 F3 N4 O -","- C60 H44 F12 N16 O4 -","4","1","IM2045","A. Thiruvalluvar; M. Subramanyam; R. J. Butcher; M. Mahalinga","1-{5-Methyl-1-[8-(trifluoromethyl)quinolin-4-yl]-1<i>H</i>-1,2,3-triazol-4-yl}ethanone","Acta Crystallographica Section E","2007","63","12","o4813","o4814","10.1107/S1600536807059193","","","0.71073","MoKα","","0.0789","0.0427","","","0.1161","0.1261","","","","","","0.963","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216588","11.4761","0.0008","8.8577","0.0003","13.8105","0.0008","90","","106.893","0.005","90","","1343.28","0.13","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(2,4-Dichlorophenyl)-2-nitrobenzamide","","- C13 H8 Cl2 N2 O3 -","- C13 H8 Cl2 N2 O3 -","- C52 H32 Cl8 N8 O12 -","4","1","IM2046","Saeed, Aamer; Hussain, Shahid; Bolte, Michael","<i>N</i>-(2,4-Dichlorophenyl)-2-nitrobenzamide","Acta Crystallographica Section E","2007","63","12","o4843","o4843","10.1107/S160053680705948X","","","0.71073","MoKα","","0.0374","0.0336","","","0.0842","0.0862","","","","","","1.027","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216589","13.0081","0.0009","8.1407","0.0005","13.758","0.001","90","","107.522","0.005","90","","1389.31","0.17","150","2","150","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","3-Benzylidene-8-methoxy-6-methylchroman-4-one","","- C18 H16 O3 -","- C18 H16 O3 -","- C72 H64 O12 -","4","1","IS2223","A. Marx; R. Suresh; Charles Christoper Kanagam; V. Manivannan; Büyükgüngör, Orhan","3-Benzylidene-8-methoxy-6-methylchroman-4-one","Acta Crystallographica Section E","2007","63","12","o4530","o4530","10.1107/S1600536807053019","","","0.71073","MoKα","","0.0604","0.0387","","","0.0924","0.0991","","","","","","1.027","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216590","16.4987","0.0015","17.5642","0.0016","11.8035","0.0011","90","","95.626","0.002","90","","3404","0.5","273","2","273","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(E)-1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-\ [(dimethylamino)methyleneamino]-1H-pyrazole-4-carboxylic acid","","- C14 H11 Cl2 F3 N4 O2 -","- C14 H11 Cl2 F3 N4 O2 -","- C112 H88 Cl16 F24 N32 O16 -","8","1","IS2225","De-Ming Xie; Zhan Shu; Liang Shen; Zhe-Wu Ding; Zhi-Min Jin","(<i>E</i>)-1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]-5-[(dimethylamino)methyleneamino]-1<i>H</i>-pyrazole-4-carboxylic acid","Acta Crystallographica Section E","2007","63","12","o4562","o4562","10.1107/S1600536807053688","","","0.71073","MoKα","","0.0926","0.0787","","","0.183","0.1916","","","","","","1.134","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216591","11.607","0.003","11.607","0.003","14.101","0.004","90","","90","","90","","1899.7","0.9","296","1","296","1","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","9,9-Bis(4-methoxyphenyl)-9<i>H</i>-cyclopenta[2,1-<i>b</i>:3,4- <i>b</i>']dipyridine","","- C25 H20 N2 O2 -","- C25 H20 N2 O2 -","- C100 H80 N8 O8 -","4","0.5","IS2226","Ono, Katsuhiko; Tomura, Masaaki; Saito, Katsuhiro","9,9-Bis(4-methoxyphenyl)-9<i>H</i>-cyclopenta[2,1-<i>b</i>:3,4-<i>b</i>']dipyridine","Acta Crystallographica Section E","2007","63","12","o4612","o4612","10.1107/S1600536807055626","","","0.71073","MoKα","","0.0974","0.091","","","0.1451","0.1469","","","","","","1.439","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216592","16.228","0.0013","6.7102","0.0006","23.772","0.002","90","","100.588","0.001","90","","2544.5","0.4","299","2","299","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","N-{2-Chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6- tetrahydropyrimidinyl]phenyl}-2,2-bis(3-fluorophenoxy)acetamide","","- C26 H17 Cl F5 N3 O5 -","- C26 H17 Cl F5 N3 O5 -","- C104 H68 Cl4 F20 N12 O20 -","4","1","IS2230","Zhi-Gao Tian","<i>N</i>-{2-Chloro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidinyl]phenyl}-2,2-bis(3-fluorophenoxy)acetamide","Acta Crystallographica Section E","2007","63","12","o4596","o4596","10.1107/S1600536807055638","","","0.71073","MoKα","","0.0673","0.0537","","","0.1498","0.163","","","","","","1.032","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216593","12.382","0.003","9.852","0.003","9.481","0.002","90","","92.542","0.004","90","","1155.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Methoxyphenyl)-3-(1H-1,2,4-triazol-1-yl)propan-1-one","","- C12 H13 N3 O2 -","- C12 H13 N3 O2 -","- C48 H52 N12 O8 -","4","1","IS2231","Wei Wang; Hao Luo; Fang Li; Sai Bi","1-(4-Methoxyphenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one","Acta Crystallographica Section E","2007","63","12","o4639","o4639","10.1107/S160053680705564X","","","0.71073","MoKα","","0.0669","0.0481","","","0.1242","0.1375","","","","","","1.034","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216594","10.0178","0.0008","10.2084","0.0008","17.4139","0.0014","90","","104.82","0.001","90","","1721.6","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-(2-Methyl-2-nitro-1-phenylpropyl)-4-phenyl-1,2,3-selenadiazole","","- C18 H17 N3 O2 Se -","- C18 H17 N3 O2 Se -","- C72 H68 N12 O8 Se4 -","4","1","IS2234","A. Marx; V. Manivannan; S. Saravanan; S. Muthusubramanian; B. Sridhar","5-(2-Methyl-2-nitro-1-phenylpropyl)-4-phenyl-1,2,3-selenadiazole","Acta Crystallographica Section E","2007","63","12","o4676","o4676","10.1107/S1600536807057327","","","0.71073","MoKα","","0.0326","0.028","","","0.0731","0.0749","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216595","6.5158","0.0009","20.592","0.003","6.5877","0.0009","90","","107.837","0.002","90","","841.4","0.2","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","3β,5-Dihydroxy-15β,16β-methylene-5β-androst-6-en-17-one","","- C20 H28 O3 -","- C20 H28 O3 -","- C40 H56 O6 -","2","1","IS2235","Wei Zhou; Guang-Xiang Zhong; Wei-Xiao Hu; Chun-Nian Xia","3β,5-Dihydroxy-15β,16β-methylene-5β-androst-6-en-17-one","Acta Crystallographica Section E","2007","63","12","o4707","o4707","10.1107/S1600536807057315","","","0.71073","MoKα","","0.0415","0.0388","","","0.1073","0.1099","","","","","","1.061","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216596","11.6138","0.0017","5.2965","0.0009","12.2946","0.0009","90","","111.745","0.009","90","","702.46","0.17","290","2","290","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Isoquinolinone","Isoquinolin-1(2H)-one","","- C9 H7 N O -","- C9 H7 N O -","- C36 H28 N4 O4 -","4","1","IS2239","Rosica Petrova; Rositsa Titorenkova; Boris Shivachev","Isoquinolin-1(2<i>H</i>)-one","Acta Crystallographica Section E","2007","63","12","o4751","o4751","10.1107/S1600536807057960","","","0.71073","MoKα","","0.0841","0.0423","","","0.1046","0.1228","","","","","","1.007","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216597","14.6943","0.0008","8.7163","0.0006","12.8126","0.001","90","","107.656","0.001","90","","1563.74","0.18","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Isopropyl-2-morpholinobenzofuro[3,2-d]pyrimidin-4(3H)-one","","- C17 H19 N3 O3 -","- C17 H19 N3 O3 -","- C68 H76 N12 O12 -","4","1","IS2240","Yang-Gen Hu; Jun Hu; Hai-Tao Gao","3-Isopropyl-2-morpholinobenzofuro[3,2-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","12","o4735","o4735","10.1107/S1600536807057662","","","0.71073","MoKα","","0.0664","0.0498","","","0.1231","0.1318","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216598","11.2613","0.0004","7.9178","0.0003","10.9061","0.0004","90","","99.261","0.001","90","","959.76","0.06","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Bis(methanesulfonato)dioxouranium(VI) monohydrate","catena-poly[[aquadioxidouranium(VI)]bis(μ-methanesulfonato-κ^2^O:O')]","","- C2 H8 O9 S2 U -","- C2 H8 O9 S2 U -","- C8 H32 O36 S8 U4 -","4","1","IS2245","Andreev, Grigory B.; Budantseva, Nina A.; Tananaev, Ivan G.; Myasoedov, Boris F.","A second polymorph of <i>catena</i>-poly[[aquadioxidouranium(VI)]bis(μ-methanesulfonato-κ^2^<i>O</i>:<i>O</i>')]","Acta Crystallographica Section E","2007","63","12","m3159","m3159","10.1107/S1600536807061016","","","0.71073","MoKα","","0.0246","0.0216","","","0.0529","0.0538","","","","","","1.042","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216599","11.667","0.002","15.686","0.003","24.594","0.005","90","","90","","90","","4500.9","1.5","299","2","299","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Ethyl 1-(2,6-difluorobenzyl)-4-(4,6-dimethoxypyrimidin-2-yl)-2-oxo- 1,2-dihydroquinoline-3-carboxylate","","- C25 H21 F2 N3 O5 -","- C25 H21 F2 N3 O5 -","- C200 H168 F16 N24 O40 -","8","1","IS2246","Yuan-Xiang Li; Di-Zhao Chen; Xiao-Juan Gong","Ethyl 1-(2,6-difluorobenzyl)-4-(4,6-dimethoxypyrimidin-2-yl)-2-oxo-1,2-dihydroquinoline-3-carboxylate","Acta Crystallographica Section E","2007","63","12","o4855","o4855","10.1107/S1600536807060345","","","0.71073","MoKα","","0.0699","0.0532","","","0.1305","0.1402","","","","","","1.036","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2216600","17.873","0.004","17.834","0.004","12.955","0.003","90","","129.48","0.03","90","","3187.2","1.9","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(E)-N'-(5-Bromo-2-hydroxybenzylidene)-4-hydroxybenzohydrazide ethanol solvate","","- C16 H17 Br N2 O4 -","- C16 H17 Br N2 O4 -","- C128 H136 Br8 N16 O32 -","8","1","IS2249","Jing, Zuo-Liang; Yu, Ming; Chen, Xin","(<i>E</i>)-<i>N</i>'-(5-Bromo-2-hydroxybenzylidene)-4-hydroxybenzohydrazide ethanol solvate","Acta Crystallographica Section E","2007","63","12","o4902","o4902","10.1107/S1600536807060667","","","0.71073","MoKα","","0.041","0.0338","","","0.0823","0.0865","","","","","","0.997","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216601","4.3883","0.0002","32.273","0.0013","11.8006","0.0005","90","","92.733","0.003","90","","1669.34","0.12","100","0.1","100","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4,8-Dihydroxy-2,3-dimethoxy-1-(3-methylbut-2-enyl)-9<i>H</i>-xanthen-9-one","","- C20 H20 O6 -","- C20 H20 O6 -","- C80 H80 O24 -","4","1","IS2251","Nawong Boonnak; Suchada Chantrapromma; Hoong-Kun Fun; Chatchanok Karalai","4,8-Dihydroxy-2,3-dimethoxy-1-(3-methylbut-2-enyl)-9<i>H</i>-xanthen-9-one","Acta Crystallographica Section E","2007","63","12","o4903","o4904","10.1107/S1600536807061090","","","0.71073","MoKα","","0.0803","0.0487","","","0.1025","0.1161","","","","","","1.054","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216602","18.626","0.004","42.112","0.008","5.0536","0.001","90","","90","","90","","3963.9","1.4","295","2","295","2","","","","","","","","5","F d d 2","F 2 -2d","43","","[3-(Propenamido)phenyl]boronic acid","","- C9 H10 B N O3 -","- C9 H10 B N O3 -","- C144 H160 B16 N16 O48 -","16","1","KJ2069","Zhang, Dan; Harrington, Laura E.; Tanaka, Hiroo; Pelton, Robert","[3-(Propenamido)phenyl]boronic acid","Acta Crystallographica Section E","2007","63","12","o4628","","10.1107/S1600536807055389","","","0.71073","MoKα","","0.0562","0.0385","","","0.0969","0.1075","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216603","8.7837","0.0009","11.098","0.0012","15.6749","0.0016","90","","102.648","0.001","90","","1490.9","0.3","293","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-N-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene]benzenamine","","- C17 H14 Cl N3 -","- C17 H14 Cl N3 -","- C68 H56 Cl4 N12 -","4","1","KJ2071","Feng-Mei Sun; Li Yang; Xiao-Bao Chen; Zhao-Xun Lian","(<i>E</i>)-<i>N</i>-[(5-Chloro-3-methyl-1-phenyl-1<i>H</i>-pyrazol-4-yl)methylene]aniline","Acta Crystallographica Section E","2007","63","12","o4620","o4620","10.1107/S1600536807055390","","","0.71073","MoKα","","0.0449","0.0344","","","0.0839","0.0909","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216604","25.462","0.005","6.404","0.0013","14.589","0.003","90","","122.83","0.03","90","","1998.9","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5-Chloromethyl-3-(4-methylphenyl)-1,2,4-oxadiazole","","- C10 H9 Cl N2 O -","- C10 H9 Cl N2 O -","- C80 H72 Cl8 N16 O8 -","8","1","KJ2072","Wang, Pin-Liang; Zeng, Hai-Su; Wang, Hai-Bo; Wu, Wen-Yuan","5-Chloromethyl-3-(4-methylphenyl)-1,2,4-oxadiazole","Acta Crystallographica Section E","2007","63","12","o4619","o4619","10.1107/S1600536807056073","","","0.71073","MoKα","","0.0924","0.0567","","","0.1512","0.1816","","","","","","1.024","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216605","9.4575","0.0004","33.8005","0.0015","11.373","0.0005","90","","112.357","0.003","90","","3362.3","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4'-(4-Methylphenyl)-2,2':6',2''-terpyridine","","- C22 H17 N3 -","- C22 H17 N3 -","- C176 H136 N24 -","8","2","KJ2073","Liu, Han-Guo; Yong-Cai Qiu; Jian-Zhong Wu","4'-(4-Methylphenyl)-2,2':6',2''-terpyridine","Acta Crystallographica Section E","2007","63","12","o4876","o4876","10.1107/S1600536807060904","","","0.71073","MoKα","","0.0899","0.0482","","","0.1107","0.1306","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216606","9.4559","0.0003","10.8048","0.0004","18.062","0.0006","90","","90","","90","","1845.38","0.11","180","2","180","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1<i>R</i>,4<i>R</i>,7<i>R</i>,8<i>R</i>,9<i>R</i>)-8-(Benzyloxy)-7- (benzyloxymethyl)-2,5,10-trioxatricyclo[5.2.1.0^4,8^]decan-9-ol","","- C22 H24 O6 -","- C22 H24 O6 -","- C88 H96 O24 -","4","1","KP2133","Sharma, Pawan K.; Nielsen, Poul; Bond, Andrew D.","(1<i>R</i>,4<i>R</i>,7<i>R</i>,8<i>R</i>,9<i>R</i>)-8-Benzyloxy-7-benzyloxymethyl-2,5,10-trioxatricyclo[5.2.1.0^4,8^]decan-9-ol","Acta Crystallographica Section E","2007","63","12","o4537","o4537","10.1107/S1600536807053536","","","0.71073","MoKα","","0.0434","0.03","","","0.0607","0.0629","","","","","","0.965","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216607","8.917","0.0006","21.5098","0.0015","12.8527","0.0009","90","","94.374","0.004","90","","2458","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tetrakis(2,2-bipyridine)-1κ^4^N,N';4κ^4^N,N'- hexa-μ-iodido-1:2κ^4^I:I;2:3κ^4^I:I;3:4κ^4^I:I- 1,4-dicadmium(II)-2,3-disilver(I)(Ag—Ag)","","- C40 H32 Ag2 Cd2 I6 N8 -","- C40 H32 Ag2 Cd2 I6 N8 -","- C80 H64 Ag4 Cd4 I12 N16 -","2","0.5","KP2139","Yan-Si Jiang; Hua-Gang Yao; Long-Jiang Zou; Yong-Lin An","Tetrakis(2,2'-bipyridine)-1κ^4^<i>N</i>,<i>N</i>';4κ^4^<i>N</i>,<i>N</i>'-hexa-μ-iodido-1:2κ^4^<i>I</i>:<i>I</i>;2:3κ^4^<i>I</i>:<i>I</i>;3:4κ^4^<i>I</i>:<i>I</i>-1,4-dicadmium(II)-2,3-disilver(I)","Acta Crystallographica Section E","2007","63","12","m2880","m2880","10.1107/S1600536807052841","","","0.71073","MoKα","","0.0584","0.0443","","","0.1112","0.1207","","","","","","0.997","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216608","9.7086","0.0006","18.1384","0.0012","18.7167","0.0012","90","","92.685","0.001","90","","3292.4","0.4","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Bromo-2,6-bis(<i>N</i>-morpholinylmethyl)benzene","","- C16 H23 Br N2 O2 -","- C16 H23 Br N2 O2 -","- C128 H184 Br8 N16 O16 -","8","2","KP2140","Copolovici, Lucian; Bojan, Vilma; Silvestru, Cristian; Varga, Richard A.","1-Bromo-2,6-bis(<i>N</i>-morpholinylmethyl)benzene","Acta Crystallographica Section E","2007","63","12","o4570","o4570","10.1107/S1600536807051574","","","0.71073","MoKα","","0.0695","0.0505","","","0.0938","0.0997","","","","","","1.068","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216609","9.007","0.002","12.834","0.003","20.139","0.005","79.582","0.016","79.23","0.016","86.698","0.016","2248.6","0.9","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","{2,6-Bis[1-(phenylimino)ethyl]pyridine}dichloridomanganese(II) dichloromethane hemisolvate","","- C21.5 H20 Cl3 Mn N3 -","- C21.5 H20 Cl3 Mn N3 -","- C86 H80 Cl12 Mn4 N12 -","4","2","KP2141","Meng-Ping Guo; Gui-Quan Guo; Hui-Rui Guo; Di-Chang Zhong; Wei-Qiang Zhou","{2,6-Bis[1-(phenylimino)ethyl]pyridine}dichloridomanganese(II) dichloromethane hemisolvate","Acta Crystallographica Section E","2007","63","12","m3025","m3026","10.1107/S1600536807056644","","","0.71073","MoKα","","0.0916","0.0435","","","0.1024","0.1208","","","","","","0.996","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216610","8.2423","0.0016","9.833","0.002","10.631","0.002","88.13","0.03","72.07","0.03","71.9","0.03","777.3","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2-(1H-Benzo[d]-1,2,3-triazol-1-yl)acetonitrile","","- C8 H6 N4 -","- C8 H6 N4 -","- C32 H24 N16 -","4","2","KP2142","Xu, Xiong-Bin; Ye, Qiong","2-(1<i>H</i>-1,2,3-Benzotriazol-1-yl)acetonitrile","Acta Crystallographica Section E","2007","63","12","o4607","","10.1107/S1600536807055547","","","0.71073","MoKα","","0.1015","0.0554","","","0.1176","0.1365","","","","","","1.01","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216611","8.202","0.002","13.223","0.004","21.849","0.006","90","","96.425","0.004","90","","2354.8","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2,2'-Diselenodibenzoic acid N,N-dimethylformamide disolvate","","- C20 H24 N2 O6 Se2 -","- C20 H24 N2 O6 Se2 -","- C80 H96 N8 O24 Se8 -","4","0.5","KP2145","Xu, Ying; Dong, Qing-Chen; Tong, Hong-Bo; Wei, Xue-Hong","2,2'-Diselenodibenzoic acid <i>N</i>,<i>N</i>-dimethylformamide disolvate","Acta Crystallographica Section E","2007","63","12","o4629","","10.1107/S1600536807055493","","","0.71073","MoKα","","0.0493","0.0341","","","0.0829","0.0913","","","","","","1.076","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216612","16.5112","0.0018","10.7135","0.0015","17.975","0.002","90","","66.078","0.002","90","","2906.5","0.6","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[μ-1,2-Bis(2-hydroxybenzoyl)hydrazine(4-)]bis[tripyridinecobalt(II)] bis[trichloridopyridinecobalt(III)]","","- C54 H48 Cl6 Co4 N10 O4 -","- C54 H48 Cl6 Co4 N10 O4 -","- C108 H96 Cl12 Co8 N20 O8 -","2","0.5","KP2146","Yu-Ting Chen; Jian-Min Dou; Da-Cheng Li; Da-Qi Wang; Yue-Hua Zhu","[μ-1,2-Bis(2-hydroxybenzoyl)hydrazine(4‒)]bis[tripyridinecobalt(II)] bis[trichloridopyridinecobalt(III)]","Acta Crystallographica Section E","2007","63","12","m3129","m3130","10.1107/S1600536807059442","","","0.71073","MoKα","","0.1497","0.0635","","","0.131","0.1608","","","","","","0.997","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216613","8.908","0.004","10.59","0.005","18.555","0.008","90","","92.604","0.005","90","","1748.6","1.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichlorido[1-(2-pyridyl)ethanone oximato][1-(2-pyridyl)ethanone oxime]manganese(III)","","- C14 H15 Cl2 Mn N4 O2 -","- C14 H15 Cl2 Mn N4 O2 -","- C56 H60 Cl8 Mn4 N16 O8 -","4","1","KP2148","Jian Zuo; Jianmin Dou; Dacheng Li; Daqi Wang; Yuying Sun","Dichlorido[1-(2-pyridyl)ethanone oximato][1-(2-pyridyl)ethanone oxime]manganese(III)","Acta Crystallographica Section E","2007","63","12","m3183","m3184","10.1107/S1600536807062605","","","0.71073","MoKα","","0.0613","0.0377","","","0.0874","0.1049","","","","","","1","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216614","33.36","0.02","7.365","0.004","11.076","0.008","90","","100.52","0.05","90","","2676","3","293","2","","","","","","","","","","3","C 1 2 1","C 2y","5","glucosilate kaurenoic acid 1.5-hydrate","","","- C26 H45 O10.5 -","- C26 H43 O10.49 -","- C104 H172 O41.96 -","4","1","LH2520","Huertas, Angelica; Vega, Daniel; Rodriguez, Jairo Arbey; Rojas, Carlos; Torrenegra, Ruben; Rodriguez, Oscar","Glucosilate kaurenoic acid sesquihydrate","Acta Crystallographica Section E","2007","63","12","o4880","o4880","10.1107/S1600536807059727","","","0.71073","MoKα","","0.233","0.0706","","","0.1687","0.2192","","","","","","0.995","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216615","16.621","0.0002","16.5696","0.0002","25.4414","0.0003","79.318","0.001","79.064","0.001","61.248","0.001","5995.09","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","[Hydridotris(pyrazol-1-yl)borato-κ^3^N,N',N''][5,10,15,20-tetrakis(4- methylphenyl)porphyrinato-κ^4^N,N',N'',N''']samarium(III) toluene 1.75-solvate","","- C69.25 H60 B N10 Sm -","- C69.25 H60 B N10 Sm -","- C277 H240 B4 N40 Sm4 -","4","2","LH2527","He, Hongshan; He, Guishan; Ng, Seik Weng","[Hydridotris(pyrazol-1-yl)borato-κ^3^<i>N</i>,<i>N</i>',<i>N</i>''][5,10,15,20-tetrakis(4-methylphenyl)porphyrinato-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']samarium(III) toluene 1.75-solvate","Acta Crystallographica Section E","2007","63","12","m2878","m2878","10.1107/S1600536807053354","","","0.71073","MoKα","","0.0465","0.0326","","","0.0813","0.0893","","","","","","1.02","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216616","27.2898","0.0017","27.2898","0.0009","13.3909","0.0009","90","","90","","120","","8636.6","0.8","293","2","292","2","","","","","","","","5","R -3 :H","-R 3","148","","3-Butyl-2-morpholino-5,6,7,8-tetrahydrobenzothieno[2,3-d]pyrimidin-4(3H)-one","","- C18 H25 N3 O2 S -","- C18 H25 N3 O2 S -","- C324 H450 N54 O36 S18 -","18","1","LH2529","Zeng, Xiao-Hua; Wang, Hong-Mei; Zheng, Ai-Hua; Tian, Jia-Hua; He, Ting-Yun","3-Butyl-2-morpholino-5,6,7,8-tetrahydrobenzothieno[2,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one","Acta Crystallographica Section E","2007","63","12","o4840","o4840","10.1107/S1600536807057558","","","0.71073","MoKα","","0.1278","0.0593","","","0.1498","0.1694","","","","","","0.849","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216617","13.352","0.004","5.7576","0.0016","7.266","0.002","90","","104.787","0.006","90","","540.1","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-amino-5-chloropyridine","","- C5 H5 Cl N2 -","- C5 H5 Cl N2 -","- C20 H20 Cl4 N8 -","4","1","LH2530","Pourayoubi, Mehrdad; Ghadimi, Saied; Ebrahimi Valmoozi, Ali Asghar","A redetermination of 2-amino-5-chloropyridine at 100 K","Acta Crystallographica Section E","2007","63","12","o4631","o4631","10.1107/S1600536807055328","","","0.71073","MoKα","","0.0338","0.0273","","","0.0658","0.0708","","","","","","0.992","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216618","10.069","0.002","14.081","0.003","6.9452","0.0014","90","","90","","90","","984.7","0.3","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","julolidine-1,6-dione","","- C12 H11 N O2 -","- C12 H11 N O2 -","- C48 H44 N4 O8 -","4","0.5","LH2533","Wu, Wei-Bing; Wang, Ming-Liang; Ye, Heng-Yun; Sun, Yue-Ming","Julolidine-1,6-dione","Acta Crystallographica Section E","2007","63","12","o4699","o4699","10.1107/S1600536807056802","","","0.71073","MoKα","","0.0932","0.0612","","","0.1468","0.1634","","","","","","1.102","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216619","7.091","0.001","12.465","0.002","15.842","0.003","90","","113.31","0.01","90","","1286","0.4","294","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","2,7,9-Trimethyl-8-oxatetracyclo[5.4.1.1^3,10^.0^5,9^]tridecan-<i>endo</i>-2-ol","","- C15 H24 O2 -","- C15 H24 O2 -","- C60 H96 O8 -","4","1","LH2534","Yue, Weimin; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","2,7,9-Trimethyl-8-oxatetracyclo[5.4.1.1^3,10^.0^5,9^]tridecan-<i>endo</i>-2-ol","Acta Crystallographica Section E","2007","63","12","o4689","o4689","10.1107/S1600536807054207","","","1.54184","CuKα","","","0.041","","","","0.067","","","","","","1.87","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216620","16.0226","0.001","14.0617","0.0009","13.787","0.0009","90","","115.523","0.001","90","","2803.1","0.3","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Diethyl 2,6-bis(4-ethynylphenyl)-4,8-dioxoperhydro- 2,3a,4a,6,7a,8a-hexaaza-cyclopenta[def]fluorene-8b,8c-dicarboxylate","","- C30 H28 N6 O6 -","- C30 H28 N6 O6 -","- C120 H112 N24 O24 -","4","0.5","LH2535","Hu, Sheng-Li; Wang, Shuai; Cao, Liping","Diethyl 2,6-bis(4-ethynylphenyl)-4,8-dioxoperhydro-2,3a,4a,6,7a,8a-hexaaza-cyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","Acta Crystallographica Section E","2007","63","12","o4542","o4542","10.1107/S160053680705458X","","","0.71073","MoKα","","0.0838","0.0527","","","0.1319","0.1466","","","","","","1.051","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2216621","11.6323","0.0012","13.7738","0.001","11.5398","0.0007","90","","90","","90","","1848.9","0.3","294","1","294","1","","","","","","","","4","P n a 21","P 2c -2n","33","","1-Ferrocenylmethyl-2-phenyl-1H-1,3-benzimidazole","","- C24 H20 Fe N2 -","- C24 H20 Fe N2 -","- C96 H80 Fe4 N8 -","4","1","LH2536","Gallagher, John F.; Hanlon, Keith; Howarth, Joshua","1-Ferrocenylmethyl-2-phenyl-1<i>H</i>-1,3-benzimidazole","Acta Crystallographica Section E","2007","63","12","m2882","m2882","10.1107/S1600536807053561","","","0.71073","MolybdenumKα","","0.039","0.0371","","","0.0912","0.0926","","","","","","1.088","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216622","8.573","0.0008","9.712","0.0009","12.099","0.0011","88.845","0.002","71.867","0.001","77.047","0.002","931.65","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Poly[[μ~2~-1,4-bis(3-pyridylmethoxy)benzene-hemi-μ~2~-fumarato-silver(I)] hydrate]","","- C20 H19 Ag N2 O5 -","- C20 H19 Ag N2 O5 -","- C40 H38 Ag2 N4 O10 -","2","1","LH2537","Shun-Li Li; Hong-Ye Bai; Jin Yang","Poly[[μ~2~-1,4-bis(3-pyridylmethoxy)benzene-hemi-μ~2~-fumarato-silver(I)] monohydrate]","Acta Crystallographica Section E","2007","63","12","m2911","m2911","10.1107/S1600536807054591","","","0.71069","MoKα","","0.0405","0.0339","","","0.0955","0.1073","","","","","","1.088","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216623","8.7931","0.001","9.7881","0.0011","10.8602","0.0012","90.01","0.001","107.443","0.001","100.798","0.001","874.36","0.17","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(1H-imidazole-κN^3^)[(2-oxidobenzylideneamino)methanesulfonato-\ κ~2~N,O]zinc(II)","","- C14 H15 N5 O4 S Zn -","- C14 H15 N5 O4 S Zn -","- C28 H30 N10 O8 S2 Zn2 -","2","1","LH2539","Kun-Huan He; Jia-Ming Li; Yi-Min Jiang","Bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)[(2-oxidobenzylideneamino)methanesulfonato-κ^2^<i>N</i>,<i>O</i>]zinc(II)","Acta Crystallographica Section E","2007","63","12","m2992","m2993","10.1107/S1600536807056097","","","0.71073","MoKα","","0.0254","0.0226","","","0.0582","0.06","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216624","10.6273","0.0004","12.9092","0.0005","16.5581","0.0007","90","","107.728","0.001","90","","2163.73","0.15","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2,2'-Bipyridyl)tricarbonyl(di-2-pyridylamine)molybdenum(0)","","- C23 H17 Mo N5 O3 -","- C23 H17 Mo N5 O3 -","- C92 H68 Mo4 N20 O12 -","4","1","LH2540","Muir, Kathleen J.; McQuillan, Geoffrey P.; Harrison, William T. A.","(2,2'-Bipyridyl)tricarbonyl(di-2-pyridylamine)molybdenum(0) revisited","Acta Crystallographica Section E","2007","63","12","m2918","m2918","10.1107/S160053680705461X","","","0.71073","MoKα","","0.03","0.0213","","","0.0582","0.0613","","","","","","1.057","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2216625","6.778","0.005","8.634","0.006","15.704","0.01","90","","90","","90","","919","1.1","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-Methyl-2H-1,2-benzothiazin-4(3H)-one 1,1-dioxide","","- C9 H9 N O3 S -","- C9 H9 N O3 S -","- C36 H36 N4 O12 S4 -","4","1","LH2541","Siddiqui, Waseeq Ahmad; Ahmad, Saeed; Siddiqui, Hamid Latif; Tariq, Muhammad Ilyas; Parvez, Masood","2-Methyl-2<i>H</i>-1,2-benzothiazin-4(3<i>H</i>)-one 1,1-dioxide","Acta Crystallographica Section E","2007","63","12","o4585","o4585","10.1107/S1600536807054736","","","0.71073","MoKα","","0.0724","0.0511","","","0.1133","0.1245","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216626","11.319","0.005","10.705","0.004","18.768","0.008","90","","91.864","0.005","90","","2272.9","1.6","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(μ-2-pyridine-2,6-dicarboxylato)bis[aquadimethyltin(IV)]","","- C18 H22 N2 O10 Sn2 -","- C18 H22 N2 O10 Sn2 -","- C72 H88 N8 O40 Sn8 -","4","0.5","LH2542","Mingqing Yang; Rufen Zhang; Yuying Sun","Bis(μ-2-pyridine-2,6-dicarboxylato)bis[aquadimethyltin(IV)]","Acta Crystallographica Section E","2007","63","12","m2924","m2924","10.1107/S1600536807054980","","","0.71073","MoKα","","0.0582","0.0463","","","0.1129","0.1227","","","","","","1.002","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216627","12.901","0.0004","5.8279","0.0001","14.5705","0.0005","90","","94.505","0.003","90","","1092.11","0.05","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Chalcone","(2E)-3-(4-Fluorophenyl)-1-(thien-2-yl)prop-2-en-1-one","","- C13 H9 F O S -","- C13 H9 F O S -","- C52 H36 F4 O4 S4 -","4","1","LH2543","A. Thiruvalluvar; M. Subramanyam; R. J. Butcher; A. V. Adhikari; S. Wagle","(2<i>E</i>)-3-(4-Fluorophenyl)-1-(thien-2-yl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","12","o4536","o4536","10.1107/S1600536807054992","","","0.71073","MoKα","","0.0817","0.0512","","","0.1422","0.1565","","","","","","1.022","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216628","13.5794","0.0002","13.0497","0.0002","20.5848","0.0003","90","","97.791","0.001","90","","3614.1","0.09","220","2","220","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Poly[[bis[μ~2~-1,3-bis(phenylsulfanyl)propane-κ^2^S:S']silver(I)] hexafluoridoantimonate diethyl ether hemisolvate]","","- C32 H37 Ag F6 O0.5 S4 Sb -","- C30 H32 Ag F6 S4 Sb -","- C120 H128 Ag4 F24 S16 Sb4 -","4","1","LH2544","Awaleh, Mohamed Osman; Badia, Antonnella; Brisse, François","Poly[[bis[μ~2~-1,3-bis(phenylsulfanyl)propane-κ^2^<i>S</i>:<i>S</i>']silver(I)] hexafluoridoantimonate diethyl ether hemisolvate]","Acta Crystallographica Section E","2007","63","12","m3013","m3014","10.1107/S1600536807056371","","","1.54178","CuKα","","0.0575","0.0437","","","0.1092","0.1137","","","","","","0.95","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216629","13.609","0.01","15.399","0.011","12.632","0.009","90","","94.337","0.011","90","","2640","3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(7-amino-2,4-dimethyl-1,8-naphthyridine)dichloridonickel(II) methanol solvate","","- C21 H26 Cl2 N6 Ni O -","- C21 H26 Cl2 N6 Ni O -","- C84 H104 Cl8 N24 Ni4 O4 -","4","0.5","LH2548","Shouwen Jin; Daqi Wang; Ying Sun; Ming Guo","Bis(7-amino-2,4-dimethyl-1,8-naphthyridine)dichloridonickel(II) methanol solvate","Acta Crystallographica Section E","2007","63","12","m3082","m3082","10.1107/S160053680705920X","","","0.71073","MoKα","","0.087","0.0517","","","0.1402","0.1667","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216630","9.2189","0.0018","10.591","0.002","12.226","0.002","97.898","0.002","93.287","0.002","99.948","0.002","1160.6","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[[dichloridodimethyltin(IV)]-μ-thiophene-2-acetato-κ^2^O:O']","","- C8 H11 Cl O2 S Sn -","- C8 H11 Cl O2 S Sn -","- C32 H44 Cl4 O8 S4 Sn4 -","4","2","LH2549","Hongyun Wang; Handong Yin; Daqi Wang","<i>catena</i>-Poly[[chloridodimethyltin(IV)]-μ-thiophene-2-acetato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","12","m3012","m3012","10.1107/S1600536807056784","","","0.71073","MoKα","","0.0405","0.0292","","","0.0751","0.0863","","","","","","1.001","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216631","14.436","0.003","5.385","0.0011","15.061","0.003","90","","116.25","0.03","90","","1050.1","0.5","103","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","3,5-Di-p-toluoyl-1,2-dideoxy-β-1-(imidazol-1-yl)-D-ribofuranose","","- C24 H24 N2 O5 -","- C24 H24 N2 O5 -","- C48 H48 N4 O10 -","2","1","LH2551","Düpre, Nicole; Shen, Wei-Zheng; Sanz Miguel, Pablo J.; Müller, Jens","3,5-Di-<i>p</i>-toluoyl-1,2-dideoxy-β-1-(imidazol-1-yl)-<small>D</small>-ribofuranose","Acta Crystallographica Section E","2007","63","12","o4693","o4693","10.1107/S1600536807056760","","","0.71073","MoKα","","","0.0596","","","","0.1373","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216632","11.371","0.01","8.255","0.008","17.779","0.016","90","","90","","90","","1669","3","298","2","298","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","Bis(pyridine-2-methanol-κ^2^<i>N</i>,<i>O</i>]bis(thiocyanato-κN)cobalt(II)","","- C14 H14 Co N4 O2 S2 -","- C14 H14 Co N4 O2 S2 -","- C56 H56 Co4 N16 O8 S8 -","4","0.5","LH2553","Yu-Peng Pan; Da-Cheng Li; Da-Qi Wang","Bis(pyridine-2-methanol-κ^2^<i>N</i>,<i>O</i>]bis(thiocyanato-κ<i>N</i>)cobalt(II)","Acta Crystallographica Section E","2007","63","12","m3034","m3034","10.1107/S160053680705756X","","","0.71073","MoKα","","0.0773","0.0547","","","0.1477","0.1697","","","","","","1.002","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216633","7.32","0.0019","13.281","0.003","25.002","0.006","90","","92.664","0.003","90","","2428","1","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","s(2,5-di-4-pyridyl-1,3,4-oxadiazole)silver(I) nitrate monohydrate","","- C24 H18 Ag N9 O6 -","- C24 H18 Ag N9 O6 -","- C96 H72 Ag4 N36 O24 -","4","1","LH2554","Zhang, Zhi-Hui; Li, Cheng-Peng; Tian, Yi-Ling; Guo, Ya-Mei","Bis(2,5-di-4-pyridyl-1,3,4-oxadiazole)silver(I) nitrate monohydrate","Acta Crystallographica Section E","2007","63","12","m3044","m3044","10.1107/S1600536807057546","","","0.71073","MoKα","","0.0479","0.0312","","","0.0774","0.0852","","","","","","1.021","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216634","16.8172","0.0015","5.9146","0.0004","16.6777","0.0015","90","","93.501","0.001","90","","1655.8","0.2","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2E)-1-{4-[(1E)-Benzylideneamino]phenyl}-3-phenylprop-2-en-1-one","","- C22 H17 N O -","- C22 H17 N O -","- C88 H68 N4 O4 -","4","1","LH2557","Harrison, William T. A.; H. J. Ravindra; M. R. Suresh Kumar; S. M. Dharmaprakash","(2<i>E</i>)-1-{4-[(1<i>E</i>)-Benzylideneamino]phenyl}-3-phenylprop-2-en-1-one","Acta Crystallographica Section E","2007","63","12","o4675","o4675","10.1107/S160053680705684X","","","0.71073","MoKα","","0.059","0.0385","","","0.0911","0.0997","","","","","","1.018","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216635","12.905","0.004","5.619","0.001","17.161","0.006","90","","102.228","0.017","90","","1216.2","0.6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Oxo-N-phenylisoindoline-2-carboxamide","","- C15 H12 N2 O2 -","- C15 H12 N2 O2 -","- C60 H48 N8 O8 -","4","1","LH2558","Maliha, Bushra; Hussain, Ishtiaq; Siddiqui, Hamid Latif; Tariq, Muhammad Ilyas; Parvez, Masood","1-Oxo-<i>N</i>-phenylisoindoline-2-carboxamide","Acta Crystallographica Section E","2007","63","12","o4728","o4728","10.1107/S1600536807056929","","","0.71073","MoKα","","0.057","0.0384","","","0.0861","0.0972","","","","","","1.018","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216636","5.7521","0.0001","9.0344","0.0002","20.7349","0.0003","95.138","0.0011","96.3386","0.0012","108.464","0.0006","1006.91","0.03","150","","150","","","","","","","","","4","P 1","P 1","1","","Isopropyl 6-amino-2,5-anhydro-6-N-(2,5-anhydro-6-azido-3,6-dideoxy-L-<i>lyxo</i>- hexonyl)-3,6-dideoxy-L-<i>lyxo</i>-hexonate 2.5-hydrate","","- C15 H29 N4 O9.5 -","- C15 H29 N4 O9.5 -","- C30 H58 N8 O19 -","2","2","LH2559","Le Pevelen, Delphine D.; Edwards, Alison A.; Tranter, George E.; Watkin, David J.; Fleet, George W.J.","Isopropyl 6-amino-2,5-anhydro-6-<i>N</i>-(2,5-anhydro-6-azido-3,6-dideoxy-<small>L</small>-<i>lyxo</i>-hexonyl)-3,6-dideoxy-<small>L</small>-<i>lyxo</i>-hexonate 2.5-hydrate","Acta Crystallographica Section E","2007","63","12","o4719","o4720","10.1107/S1600536807056905","","","0.71073","MoKα","","0.0492","0.0411","","0.105","0.0998","0.105","","","","","","0.9767","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216637","10.6978","0.0004","20.2154","0.0007","15.0333","0.0005","90","","107.641","0.001","90","","3098.22","0.19","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<i>cis</i>-Dichlorido[bis(dicyclohexylphosphino)methane-κ^2^P,P']palladium(II) dichloromethane solvate","","- C26 H48 Cl4 P2 Pd -","- C26 H48 Cl4 P2 Pd -","- C104 H192 Cl16 P8 Pd4 -","4","1","LH2561","Mague, Joel T.; Pool, Douglas H.; Fink, Mark J.","<i>cis</i>-Dichlorido[bis(dicyclohexylphosphino)methane-κ^2^<i>P</i>,<i>P</i>']palladium(II) dichloromethane solvate","Acta Crystallographica Section E","2007","63","12","m3083","m3083","10.1107/S1600536807058291","","","0.71073","MoKα","","0.0308","0.0257","","","0.0554","0.0581","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216638","13.9704","0.0016","9.46","0.0011","36.471","0.003","90","","92.273","0.002","90","","4816.2","0.9","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diaqua[(N,N'-dibenzylethane-1,2-diyldiimino)diacetato]cadmium(II) 2.5-hydrate","","- C20 H31 Cd N2 O8.5 -","- C20 H31 Cd N2 O8.5 -","- C160 H248 Cd8 N16 O68 -","8","2","LH2562","Min Zhang; Wumaierjiang, Aimaiti; Xianggao Meng; Xingman Xu","Diaqua[(<i>N</i>,<i>N</i>'-dibenzylethane-1,2-diyldiimino)diacetato]cadmium(II) 2.5-hydrate","Acta Crystallographica Section E","2007","63","12","m3121","m3122","10.1107/S1600536807058771","","","0.71073","MoKα","","0.0664","0.0501","","","0.1117","0.1232","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216639","8.5205","0.0009","8.6624","0.0009","9.4999","0.001","90.386","0.002","112.687","0.001","116.261","0.001","566.66","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[copper(II)-di-μ~2~-1,1-azido-copper(II)-μ~2~-acetato- μ~2~-1,1-azido-μ~2~-(dimethyl sulfoxide)-copper(II)-di-μ~2~-1,1-azido]","","- C8 H18 Cu3 N12 O6 S2 -","- C8 H18 Cu3 N12 O6 S2 -","- C8 H18 Cu3 N12 O6 S2 -","1","0.5","LH2563","Kelan Li; Feihua Luo; Xuegang Song; Zongqiu Hu","<i>catena</i>-Poly[copper(II)-di-μ~2~-1,1-azido-copper(II)-μ~2~-acetato-μ~2~-1,1-azido-μ~2~-(dimethyl sulfoxide)-copper(II)-di-μ~2~-1,1-azido]","Acta Crystallographica Section E","2007","63","12","m3156","m3156","10.1107/S1600536807059247","","","0.71073","MoKα","","0.0379","0.0346","","","0.0929","0.0988","","","","","","1.106","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216640","5.841","0.002","30.421","0.01","10.915","0.004","90","","97.282","0.004","90","","1923.8","1.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Amino-5-(salicylideneamino)-1,3,4-thiadiazole","","- C9 H8 N4 O S -","- C9 H8 N4 O S -","- C72 H64 N32 O8 S8 -","8","2","LH2565","Zhifo Guo; Mingqin Yang; Rufen Zhang; Yuying Sun","2-Amino-5-(salicylideneamino)-1,3,4-thiadiazole","Acta Crystallographica Section E","2007","63","12","o4817","o4817","10.1107/S1600536807059715","","","0.71073","MoKα","","0.1086","0.0477","","","0.0966","0.123","","","","","","1.002","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216641","10.4378","0.0006","11.5537","0.0008","13.1306","0.001","90","","99.395","0.001","90","","1562.25","0.18","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-Chlorido-1:2κ^2^Cl-trichlorido-2κ^3^Cl-[tris(2-aminoethyl)amine-\ 1κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']dimercury(II)","","- C6 H18 Cl4 Hg2 N4 -","- C6 H18 Cl4 Hg2 N4 -","- C24 H72 Cl16 Hg8 N16 -","4","1","LH2568","Da-Qi Wang; Qiang Wang; Jian-Min Dou","μ-Chlorido-1:2κ^2^<i>Cl</i>:<i>Cl</i>-trichlorido-2κ^3^<i>Cl</i>-[tris(2-aminoethyl)amine-1κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']dimercury(II)","Acta Crystallographica Section E","2007","63","12","m3162","m3163","10.1107/S1600536807059983","","","0.71073","MoKα","","0.0496","0.0384","","","0.096","0.1027","","","","","","1.068","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216642","25.1393","0.0014","8.1256","0.0004","26.6925","0.0015","90","","114.248","0.002","90","","4971.5","0.5","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaqua[N,N'-bis(4-methoxybenzyl)-2,2'-(ethane-1,2- diyldiimino)diacetato]nickel(II) sesquihydrate","","- C22 H33 N2 Ni O9.5 -","- C22 H33 N2 Ni O9.5 -","- C176 H264 N16 Ni8 O76 -","8","1","LH2570","Zhang, Min; Song, Xuegang; Su, Ping; Meng, Xianggao","Diaqua[<i>N</i>,<i>N</i>'-bis(4-methoxybenzyl)-2,2'-(ethane-1,2-diyldiimino)diacetato]nickel(II) sesquihydrate","Acta Crystallographica Section E","2007","63","12","m3164","m3164","10.1107/S1600536807060849","","","0.71073","Mokα","","0.052","0.0429","","","0.1282","0.1329","","","","","","1.03","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216643","12.943","0.001","19.2323","0.0015","11.9433","0.0019","90","","107.916","0.002","90","","2828.8","0.5","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-Butylamino-3-(4-fluorophenyl)-6,8-diphenyl-3,5,6,8-tetrahydro- 4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one","","- C31 H28 F N3 O S2 -","- C31 H28 F N3 O S2 -","- C124 H112 F4 N12 O4 S8 -","4","1","LH2571","Wen-jing Li; Rong Li; Wen-Qin Wang; Ying Zhong","2-Butylamino-3-(4-fluorophenyl)-6,8-diphenyl-3,5,6,8-tetrahydro-4<i>H</i>-thiopyrano[4',3':4,5]thieno[2,3-<i>d</i>]pyrimidin-4-one","Acta Crystallographica Section E","2007","63","12","o4869","o4869","10.1107/S1600536807060850","","","0.71073","MoKα","","0.0854","0.0631","","","0.1886","0.2177","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216644","21.8696","0.0012","4.7001","0.0002","16.0494","0.0008","90","","109.009","0.003","90","","1559.74","0.14","200","2","200","2","","","","","","","","4","C 1 2 1","C 2y","5","","Methyl 4,6-<i>O</i>-benzylidene-2,3-dideoxy-3-hydroxyimino-α-D-<i>erythro</i>-\ pyranoside methanol solvate","","- C15 H21 N O6 -","- C15 H21 N O6 -","- C60 H84 N4 O24 -","4","1","LN2001","Davies, Melari; Goette, Sebastian; Klüfers, Peter; Schwarz, Thomas","Methyl 4,6-<i>O</i>-benzylidene-2,3-dideoxy-3-hydroxyimino-α-<small>D</small>-<i>erythro</i>-pyranoside methanol solvate","Acta Crystallographica Section E","2007","63","12","o4765","o4765","10.1107/S1600536807059521","","","0.71073","MoKα","","0.0963","0.0481","","","0.1089","0.1277","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216645","9.0605","0.0019","12.714","0.003","12.45","0.003","90","","102.312","0.004","90","","1401.2","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-Bis[(E)-4-(4-methoxystyryl)pyridine]dinitratocopper(II)","","- C28 H26 Cu N4 O8 -","- C28 H26 Cu N4 O8 -","- C56 H52 Cu2 N8 O16 -","2","0.5","LN2006","Lin Yuan; Xue-Fang Shi","<i>trans</i>-Bis[(<i>E</i>)-4-(4-methoxystyryl)pyridine]dinitratocopper(II)","Acta Crystallographica Section E","2007","63","12","m3119","m3119","10.1107/S1600536807060473","","","0.71073","MoKα","","0.1063","0.0444","","","0.0918","0.1178","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216646","13.5581","0.0007","19.3022","0.0009","7.7028","0.0003","90","","90","","90","","2015.83","0.16","120","2","120","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","(4<i>R</i>,5<i>R</i>)-4,5-Bis{2-[3-(2,6-diisopropylphenyl)-2- thioxoimidazolidin-3-yl]ethyl}-2,2-dimethyl-1,3-dioxolane","","- C39 H58 N4 O2 S2 -","- C39 H58 N4 O2 S2 -","- C78 H116 N8 O4 S4 -","2","0.5","LW2040","Marshall, Colin; Harrison, William T. A.","(4<i>R</i>,5<i>R</i>)-4,5-Bis{2-[3-(2,6-diisopropylphenyl)-2-thioxoimidazolidin-3-yl]ethyl}-2,2-dimethyl-1,3-dioxolane","Acta Crystallographica Section E","2007","63","12","o4503","o4503","10.1107/S1600536807050349","","","0.71073","MoKα","","0.1394","0.0582","","","0.092","0.1103","","","","","","0.933","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216647","8.0287","0.0002","18.9091","0.0003","7.1327","0.0002","90","","108.248","0.002","90","","1028.4","0.04","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Acetylanilinium perchlorate","","- C8 H10 Cl N O5 -","- C8 H10 Cl N O5 -","- C32 H40 Cl4 N4 O20 -","4","1","LW2041","Dominik Cinčić; Branko Kaitner","4-Acetylanilinium perchlorate","Acta Crystallographica Section E","2007","63","12","o4672","o4672","10.1107/S1600536807050751","","","0.71073","MoKα","","0.0504","0.044","","","0.1294","0.137","","","","","","1.122","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216648","6.7201","0.0016","12.069","0.003","12.88","0.003","90","","90","","90","","1044.6","0.4","168","2","168","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(5R)-5,9,9-Trimethyl-5,6,7,8-tetrahydro-5,8-methanoquinoxaline","","- C12 H16 N2 -","- C12 H16 N2 -","- C48 H64 N8 -","4","1","LW2042","Fitchett, Christopher M.; Steel, Peter J.","(5<i>R</i>)-5,9,9-Trimethyl-5,6,7,8-tetrahydro-5,8-methanoquinoxaline: a chiral Mills‒Nixon pyrazine","Acta Crystallographica Section E","2007","63","12","o4899","o4899","10.1107/S1600536807060710","","","0.71073","MoKα","","0.037","0.0345","","","0.0902","0.0924","","","","","","1.125","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216649","8.6963","0.0009","10.3704","0.001","13.0294","0.0013","76.885","0.002","73.233","0.001","84.576","0.001","1095.21","0.19","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","2,6-Diethyl-8b,8c-diphenylperhydro-2,3a,4a,6,7a,8a- hexaazacyclopenta[def]fluorene-4,8-dione","","- C24 H28 N6 O2 -","- C24 H28 N6 O2 -","- C48 H56 N12 O4 -","2","1","LW2043","Juan Li; Yan Hu; Zi-hua Wang","2,6-Diethyl-8b,8c-diphenylperhydro-2,3a,4a,6,7a,8a-hexaazacyclopenta[<i>def</i>]fluorene-4,8-dione","Acta Crystallographica Section E","2007","63","12","o4777","o4777","10.1107/S1600536807058400","","","0.71073","MoKα","","0.0902","0.0605","","","0.1445","0.1636","","","","","","0.986","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216650","14.924","0.003","5.082","0.001","10.784","0.002","90","","98.32","0.03","90","","809.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Methoxybenzamide oxime","","- C8 H10 N2 O2 -","- C8 H10 N2 O2 -","- C32 H40 N8 O8 -","4","1","LW2044","Li, Hai-lin; Zeng, Hai-su; Kang, Si-shun; Wang, Hai-bo","4-Methoxybenzamide oxime","Acta Crystallographica Section E","2007","63","12","o4763","o4763","10.1107/S1600536807059429","","","0.71073","MoKα","","0.1042","0.0737","","","0.1628","0.1998","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216651","21.3211","0.0018","11.0697","0.001","9.2754","0.001","90","","90","","90","","2189.2","0.4","173","2","173","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","[(4-Chlorophenyl)iminomethyl]phenol","","- C13 H10 Cl N O -","- C13 H10 Cl N O -","- C104 H80 Cl8 N8 O8 -","8","1","LW2045","Leela Sundararaman; Ramamurthi Kandasamy; Stoeckli-Evans, Helen; Vasuki Gopalsamy","[(4-Chlorophenyl)iminomethyl]phenol","Acta Crystallographica Section E","2007","63","12","o4805","o4805","10.1107/S1600536807059326","","","0.71073","MoKα","","0.0468","0.0356","","","0.0944","0.0986","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216652","8.567","0.0017","9.462","0.0019","12.626","0.003","110.15","0.03","96.53","0.03","92.35","0.03","951.1","0.4","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","4-(Diphenylmethylene)-3-pentyl-5,6-dihydro-4H-pyrrolo[1,2-e][1,2,3]triazole","","- C23 H25 N3 -","- C23 H25 N3 -","- C46 H50 N6 -","2","1","LW2050","Zhu, Ying-Hong; Li, Shan-Shan; Xu, Ying-Hua; Ma, Chun-An","4-(Diphenylmethylene)-3-pentyl-5,6-dihydro-4<i>H</i>-pyrrolo[1,2-<i>e</i>][1,2,3]triazole","Acta Crystallographica Section E","2007","63","12","o4863","o4863","10.1107/S1600536807060175","","","0.71073","MoKα","","0.0524","0.0437","","","0.1254","0.1316","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216653","8.197","0.002","9.449","0.002","12.655","0.002","90","","106.516","0.003","90","","939.7","0.3","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Piperazindiium bis(3,4,5-trihydroxybenzoate) dihydrate","","- C18 H26 N2 O12 -","- C18 H26 N2 O12 -","- C36 H52 N4 O24 -","2","0.5","LX2020","Su, Kun-Mei; Li, Zhen-huan","Piperazinediium bis(3,4,5-trihydroxybenzoate) dihydrate","Acta Crystallographica Section E","2007","63","12","o4512","o4512","10.1107/S1600536807053020","","","0.71073","MoKα","","0.0477","0.0389","","","0.101","0.1074","","","","","","1.096","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216654","6.367","0.002","10.368","0.003","13.414","0.004","111.451","0.003","91.95","0.003","102.334","0.003","799","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Chloridobis(pyrrolidine-1-dithiocarboxylato- κ^2^<i>S</i>,<i>S</i>')antimony(III)","","- C10 H16 Cl N2 S4 Sb -","- C10 H16 Cl N2 S4 Sb -","- C20 H32 Cl2 N4 S8 Sb2 -","2","1","LX2025","Zhai, Jun; Yin, Handong; Li, Feng; Wang, Daqi","Chloridobis(pyrrolidine-1-dithiocarboxylato-κ^2^<i>S</i>,<i>S</i>')antimony(III)","Acta Crystallographica Section E","2007","63","12","m2871","m2871","10.1107/S1600536807053962","","","0.71073","MoKα","","0.0375","0.0267","","","0.0539","0.0602","","","","","","1.062","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216655","12.86","0.004","3.931","0.001","15.208","0.005","90","","92.968","0.005","90","","767.8","0.4","208","","208","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Amino-4-methylbenzothiazole","","- C8 H8 N2 S -","- C8 H8 N2 S -","- C32 H32 N8 S4 -","4","1","LX2029","Tanke, Robin S.; Foxman, Bruce M.","2-Amino-4-methylbenzothiazole","Acta Crystallographica Section E","2007","63","12","o4718","o4718","10.1107/S1600536807056978","","","0.71073","MoKα","","0.0661","0.0468","","","0.1197","0.133","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216656","7.812","0.003","13.649","0.005","5.711","0.002","90","","90","","90","","608.9","0.4","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","2-Chloro-5-nitropyrimidine","","- C4 H2 Cl N3 O2 -","- C4 H2 Cl N3 O2 -","- C16 H8 Cl4 N12 O8 -","4","1","LX2031","Kang, Jun-Tao; Li, Zhi-Gang; Xu, Jing-Wei; Yang Wei","2-Chloro-5-nitropyrimidine","Acta Crystallographica Section E","2007","63","12","o4815","o4815","10.1107/S1600536807058795","","","0.71073","MoKα","","0.0312","0.0287","","","0.0658","0.0673","","","","","","1.078","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216657","7.3199","0.001","10.2375","0.0015","11.9968","0.0017","66.641","0.002","84.821","0.002","71.477","0.002","781.91","0.19","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","trans-Dipyridinebis[3,3,3-trifluoro-1-(4-methoxybenzoyl)prop-1-en-2- olato]cobalt(II)","","- C32 H26 Co F6 N2 O6 -","- C32 H26 Co F6 N2 O6 -","- C32 H26 Co F6 N2 O6 -","1","0.5","LX2035","Cheng, Hua; Shi, Xiaopeng","<i>trans</i>-Bis(pyridine)bis[3,3,3-trifluoro-1-(4-methoxybenzoyl)prop-1-en-2-olato]cobalt(II)","Acta Crystallographica Section E","2007","63","12","m3182","m3182","10.1107/S160053680706237X","","","0.71073","MoKα","","0.0638","0.0484","","","0.11","0.1166","","","","","","0.974","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216658","8.7042","0.0008","6.8013","0.0005","4.7868","0.0005","90","","90","","90","","283.38","0.04","293","2","293","2","","","","","","","Synthetic","3","P n m a","-P 2ac 2n","62","ferrous sulfate","Iron(II) sulfate","","- Fe O4 S -","- Fe O4 S -","- Fe4 O16 S4 -","4","0.5","MG2037","Weil, Matthias","The high-temperature β modification of iron(II) sulfate","Acta Crystallographica Section E","2007","63","12","i192","i192","10.1107/S160053680705475X","","","0.71073","MoKα","","0.0174","0.0164","","","0.0439","0.0444","","","","","","1.147","","","","has coordinates,has Fobs","282548","2023-04-10","20:38:56",""
"2216659","5.9718","0.0002","5.9718","0.0002","4.7939","0.0002","90","","90","","120","","148.057","0.009","296","2","296","2","","","","","","","","3","P -3 m 1","-P 3 2""","164","rubidium hexafluoridoiridate(IV)","Rubidium hexafluoridoiridate(IV)","","- F6 Ir Rb2 -","- F6 Ir Rb2 -","- F6 Ir Rb2 -","1","0.0833333","MG2039","Smolentsev, Anton I.; Gubanov, Alexander I.; Naumov, Dmitry Yu.; Danilenko, Andrey M.","Rubidium hexafluoridoiridate(IV)","Acta Crystallographica Section E","2007","63","12","i200","i200","10.1107/S1600536807059995","","","0.71073","MoKα","","0.0092","0.0092","","","0.0243","0.0243","","","","","","1.206","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216660","6.2421","0.0003","6.2421","0.0003","5.0084","0.0005","90","","90","","120","","169","0.02","296","2","296","2","","","","","","","","3","P -3 m 1","-P 3 2""","164","cesium hexafluoroiridate (IV)","Cesium hexafluoridoiridate(IV)","","- Cs2 F6 Ir -","- Cs2 F6 Ir -","- Cs2 F6 Ir -","1","0.0833333","MG2040","Smolentsev, Anton I.; Gubanov, Alexander I.; Naumov, Dmitry Yu.; Danilenko, Andrey M.","Caesium hexafluoridoiridate(IV)","Acta Crystallographica Section E","2007","63","12","i201","i201","10.1107/S160053680706000X","","","0.71073","MoKα","","0.0135","0.0134","","","0.0283","0.0284","","","","","","1.055","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216661","9.5404","0.0013","9.5404","0.0013","20.3472","0.0019","90","","90","","120","","1603.9","0.3","295","2","293","2","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","digallium(III) tris[tellurate(IV)] trihydrate","","- Ga2 H6 O12 Te3 -","- Ga2 H6 O12 Te3 -","- Ga12 H36 O72 Te18 -","6","0.333333","MG2042","Weil, Matthias; Stöger, Berthold","Ga~2~(TeO~3~)~3~(H~2~O)~3~","Acta Crystallographica Section E","2007","63","12","i202","i202","10.1107/S1600536807060011","","","0.71073","MoKα","","0.02","0.0199","","","0.04","0.04","","","","","","1.159","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216662","13.065","0.008","9.861","0.004","22.731","0.009","90","","90","","90","","2929","2","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","Bis(glycine) calcium(II) diiodide trihydrate","catena-Poly[[[triaquacalcium(II)]-di-μ-glycine-κ^4^O:O'] diiodide]","","- C4 H16 Ca I2 N2 O7 -","- C4 H16 Ca I2 N2 O7 -","- C32 H128 Ca8 I16 N16 O56 -","8","2","NC2061","S. Natarajan; G. Shanmugam; S. A. Martin Britto Dhas; S. Athimoolam","<i>catena</i>-Poly[[[triaquacalcium(II)]-di-μ-glycine-κ^4^<i>O</i>:<i>O</i>'] diiodide]","Acta Crystallographica Section E","2007","63","12","m2897","m2898","10.1107/S1600536807051884","","","0.71073","MoKα","","0.0283","0.0202","","","0.0544","0.0569","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216663","7.16","0.004","14.541","0.008","18.733","0.01","90","","90","","90","","1950.4","1.9","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3β-Acetoxy-5-hydroxy-15β,16β-methylene-5β-androst-6-en-17-one","","- C22 H30 O4 -","- C22 H30 O4 -","- C88 H120 O16 -","4","1","NC2066","Wei Zhou; Guang-Xiang Zhong; Wei-Xiao Hu; Chun-Nian Xia","3β-Acetoxy-5-hydroxy-15β,16β-methylene-5β-androst-6-en-17-one","Acta Crystallographica Section E","2007","63","12","o4653","o4653","10.1107/S1600536807056000","","","0.71073","MoKα","","0.0694","0.0587","","","0.1428","0.1504","","","","","","1.17","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216664","13.9501","0.0003","6.8696","0.0001","21.8409","0.0004","90","","90","","90","","2093.05","0.07","292","2","292","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Poly[di-μ~4~-benzene-1,4-dicarboxylato-μ~6~-succinato-dieuropium(III)]","","- C10 H6 Eu O6 -","- C10 H6 Eu O6 -","- C80 H48 Eu8 O48 -","8","1","NC2067","Qin He; Bao-Jun Huang","Poly[di-μ~4~-benzene-1,4-dicarboxylato-μ~6~-succinato-dieuropium(III)]","Acta Crystallographica Section E","2007","63","12","m2922","m2922","10.1107/S1600536807054414","","","0.71073","MoKα","","0.0207","0.0159","","","0.0389","0.0397","","","","","","1.104","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216665","12.1286","0.0004","10.2211","0.0004","20.0589","0.0007","90","","95.159","0.001","90","","2476.58","0.15","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1'-Methyl-4'-phenylacenaphthene-1-spiro-2'-pyrrolidine-3'-spiro-3''-\ benzo[g]chroman-2,4''-dione","","- C34 H25 N O3 -","- C34 H25 N O3 -","- C136 H100 N4 O12 -","4","1","NC2069","Augustine, A. P. T; Ramkumar, V.; Charles C. Kanakam","1'-Methyl-4'-phenylacenaphthene-1-spiro-2'-pyrrolidine-3'-spiro-3''-benzo[<i>g</i>]chroman-2,4''-dione","Acta Crystallographica Section E","2007","63","12","o4717","o4717","10.1107/S1600536807056796","","","0.71073","MoKα","","0.0724","0.0451","","","0.1301","0.1549","","","","","","0.921","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216666","14.051","0.003","8.2084","0.0016","13.979","0.003","90","","103.8","0.03","90","","1565.7","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[aqua(4,4'-bipyridine-κN)manganese(II)]-μ-imidazole-4,5- dicarboxylato-κ^4^N^3^,O^4^:O^4'^,O^5^]","","- C15 H12 Mn N4 O5 -","- C15 H12 Mn N4 O5 -","- C60 H48 Mn4 N16 O20 -","4","1","NC2070","Chao Qin; En-Bo Wang","<i>catena</i>-Poly[[aqua(4,4'-bipyridine-κ<i>N</i>)manganese(II)]-μ-imidazole-4,5-dicarboxylato-κ^4^<i>N</i>^3^,<i>O</i>^4^:<i>O</i>^4'^,<i>O</i>^5^]","Acta Crystallographica Section E","2007","63","12","m2876","m2876","10.1107/S1600536807054141","","","0.71073","MoKα","","0.0324","0.0282","","","0.0725","0.074","","","","","","1.084","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216667","11.296","0.002","11.764","0.002","12.398","0.003","66.95","0.03","87.62","0.03","61.97","0.03","1317.4","0.7","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Bis(μ-4-carboxybenzene-1,2-dicarboxylato)- 1:2κ^3^O^3^,O^4^:O^3^;1:2κ^3^O^3^:O^3^,O^4^- bis[1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(piperazin-1-yl)quinoline-3- carboxylato-κ^2^<i>O</i>,<i>O</i>'] dizinc(II) hexahydrate","","- C50 H56 F2 N6 O24 Zn2 -","- C50 H56 F2 N6 O24 Zn2 -","- C50 H56 F2 N6 O24 Zn2 -","1","0.5","NC2071","Jun Hong","Bis(μ-4-carboxybenzene-1,2-dicarboxylato)-1:2κ^3^<i>O</i>^3^,<i>O</i>^4^:<i>O</i>^3^;1:2κ^3^<i>O</i>^3^:<i>O</i>^3^,<i>O</i>^4^-bis[1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(piperazin-1-yl)quinoline-3-carboxylato-κ^2^<i>O</i>,<i>O</i>']dizinc(II) hexahydrate","Acta Crystallographica Section E","2007","63","12","m2965","m2965","10.1107/S1600536807055274","","","0.71073","MoKα","","0.0415","0.0352","","","0.0965","0.1044","","","","","","1.015","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216668","7.3157","0.0004","22.3708","0.001","10.3849","0.0006","90","","103.571","0.005","90","","1652.12","0.15","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-Diethylamino-2-[(Z)-(4-methyl-3-nitrophenyl)iminomethyl]phenol","","- C18 H21 N3 O3 -","- C18 H21 N3 O3 -","- C72 H84 N12 O12 -","4","1","NC2072","Sarojini, B. K.; Narayana, B.; Mustafa, K.; Yathirajan, H. S.; Bolte, Michael","5-Diethylamino-2-[(<i>Z</i>)-(4-methyl-3-nitrophenyl)iminomethyl]phenol","Acta Crystallographica Section E","2007","63","12","o4782","o4782","10.1107/S1600536807058734","","","0.71073","MoKα","","0.0729","0.0663","","","0.1861","0.1919","","","","","","0.973","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216669","7.979","0.001","14.099","0.002","15.685","0.003","90","","90","","90","","1764.5","0.5","299","2","299","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","4-Bromo-<i>N</i>-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>- pyrazol-4-yl)benzenesulfonamide","","- C17 H16 Br N3 O3 S -","- C17 H16 Br N3 O3 S -","- C68 H64 Br4 N12 O12 S4 -","4","1","NC2074","Silva, Luiz Everson da; Sousa Jr, Paulo Teixeira de; Maciel, Eduardo Nunes; Foro, Sabine; Dall'Oglio, Evandro Luiz","4-Bromo-<i>N</i>-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","12","o4820","o4820","10.1107/S1600536807058758","","","1.5418","CuKα","","0.0493","0.047","","","0.1176","0.1199","","","","","","1.122","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216670","7.2178","0.0012","10.7965","0.0019","14.9","0.003","111.057","0.002","90.539","0.002","100.584","0.002","1061.5","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis[benzyl(methyl)ammonium] tetrasulfidotungstate(VI)","","- C16 H24 N2 S4 W -","- C16 H24 N2 S4 W -","- C32 H48 N4 S8 W2 -","2","1","NC2077","Srinivasan, Bikshandarkoil R.; Girkar, Siddhali V.; Raghavaiah, Pallepogu","Bis[benzyl(methyl)ammonium] tetrasulfidotungstate(VI)","Acta Crystallographica Section E","2007","63","12","m3100","m3101","10.1107/S1600536807058746","","","0.71073","MoKα","","0.019","0.0176","","","0.0428","0.0434","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216671","9.1226","0.0009","11.4153","0.0011","22.52","0.002","90","","96.109","0.001","90","","2331.9","0.4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(2-aminopyridine-κN^1^)bis(benzoato-κO^2^)cadmium(II)","","- C24 H22 Cd N4 O4 -","- C24 H22 Cd N4 O4 -","- C96 H88 Cd4 N16 O16 -","4","1","NC2078","Di-Chang Zhong; Gui-Quan Guo; Ji-Hua Deng; Rong-Hua Zhu; Yi-Bin Zhou","Bis(2-aminopyridine-κ<i>N</i>^1^)bis(benzoato-κ^2^<i>O</i>,<i>O</i>')cadmium(II)","Acta Crystallographica Section E","2007","63","12","m3091","m3092","10.1107/S1600536807059181","","","0.71073","MoKα","","0.0265","0.0221","","","0.0546","0.0574","","","","","","1.04","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216672","8.009","0.002","10.697","0.003","11.201","0.005","102.17","0.03","92.23","0.02","108.69","0.03","882.7","0.6","299","2","299","2","","","","","","","","6","P -1","-P 1","2","","2,5-Dichloro<i>N</i>-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>- pyrazol-4-yl)benzenesulfonamide","","- C17 H15 Cl2 N3 O3 S -","- C17 H15 Cl2 N3 O3 S -","- C34 H30 Cl4 N6 O6 S2 -","2","1","NC2079","Silva, Luiz Everson da; Sousa Jr, Paulo Teixeira de; Silva, Virgínia Cláudia da; Ribeiro, Tereza Auxiliadora Nascimento; Foro, Sabine; Dall'Oglio, Evandro Luiz","2,5-Dichloro-<i>N</i>-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","12","o4821","o4821","10.1107/S1600536807059004","","","1.5418","CuKα","","0.1043","0.096","","","0.258","0.2704","","","","","","1.201","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216673","9.6","0.005","10.447","0.005","27.338","0.005","88.654","0.005","86.151","0.005","89.858","0.005","2735","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Bis{<i>N</i>-[(dimethylamino)dimethylsilyl]-2,6-dimethylanilido-κ^2^<i>N</i>, <i>N</i>'}zinc(II)","","- C24 H42 N4 Si2 Zn -","- C24 H42 N4 Si2 Zn -","- C96 H168 N16 Si8 Zn4 -","4","2","NG2346","Chen, Juan; Cao, Ke-Ning; Guo, Jianping","Bis{<i>N</i>-[(dimethylamino)dimethylsilyl]-2,6-dimethylanilido-κ^2^<i>N</i>,<i>N</i>'}zinc(II)","Acta Crystallographica Section E","2007","63","12","m3112","m3112","10.1107/S1600536807052440","","","0.71069","MoKα","","0.1039","0.0635","","","0.1494","0.1612","","","","","","0.901","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216674","8.952","0.0003","10.0667","0.0003","15.3855","0.0007","108.391","0.002","92.198","0.002","112.888","0.001","1191.35","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Tetraethylammonium bromidotricarbonyl[3,5,7-tribromotropolonato(1-)- κ^2^<i>O</i>,<i>O</i>']rhenate(I)","","- C18 H22 Br4 N O5 Re -","- C18 H22 Br4 N O5 Re -","- C36 H44 Br8 N2 O10 Re2 -","2","1","NG2352","Schutte, Marietjie; Visser, Hendrik G.; Steyl, Gideon","Tetraethylammonium bromidotricarbonyl[3,5,7-tribromotropolonato(1‒)-κ^2^<i>O</i>,<i>O</i>']rhenate(I)","Acta Crystallographica Section E","2007","63","12","m3195","m3196","10.1107/S1600536807053457","","","0.71073","MoKα","","0.0202","0.017","","","0.0357","0.0367","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216675","9.5134","0.0013","15.206","0.002","15.369","0.002","115.042","0.002","103.692","0.002","92.069","0.002","1933.5","0.4","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","Dichlorido(η^5^-cyclopentadienyl)[<i>N</i>-(2,6-dimethylphenyl)-<i>N</i>'- ({(2,6-dimethylphenyl)[imino(phenyl)methyl- κN]amino}dimethylsilyl)benzamidinato-κ^2^<i>N</i>,<i>N</i>']zirconium(IV) dichloromethane monosolvate","","- C38 H42 Cl4 N4 Si Zr -","- C38 H42 Cl4 N4 Si Zr -","- C76 H84 Cl8 N8 Si2 Zr2 -","2","1","NG2353","Li, Jing; Bai, Sheng-Di","Dichlorido(η^5^-cyclopentadienyl)[<i>N</i>-(2,6-dimethylphenyl)-<i>N</i>'-({(2,6-dimethylphenyl)[imino(phenyl)methyl-κ<i>N</i>]amino}dimethylsilyl)benzamidinato-κ^2^<i>N</i>,<i>N</i>']zirconium(IV) dichloromethane solvate","Acta Crystallographica Section E","2007","63","12","m3111","m3111","10.1107/S1600536807054268","","","0.71073","MoKα","","0.0458","0.0421","","","0.0996","0.102","","","","","","1.092","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216676","9.4681","0.0004","10.5333","0.0005","19.5749","0.0009","100.552","0.002","91.904","0.002","107.43","0.002","1822.98","0.15","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","Chloridobis[2-(4-fluoroanilino)troponato- κ^2^<i>N</i>,<i>O</i>](triphenylphosphine-κP)rhodium(III)","","- C44 H33 Cl F2 N2 O2 P Rh -","- C44 H33 Cl F2 N2 O2 P Rh -","- C88 H66 Cl2 F4 N4 O4 P2 Rh2 -","2","1","NG2354","Steyl, Gideon","Chloridobis[2-(4-fluoroanilino)troponato-κ^2^<i>N</i>,<i>O</i>](triphenylphosphine-κ<i>P</i>)rhodium(III)","Acta Crystallographica Section E","2007","63","12","m2968","m2969","10.1107/S1600536807053755","","","0.71073","MoKα","","0.0286","0.025","","","0.0609","0.0641","","","","","","1.052","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216677","20.301","0.002","6.9037","0.0008","7.3463","0.0008","90","","90","","90","","1029.6","0.19","296","2","296","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","2<i>H</i>,10<i>H</i>-1,4-Dioxepino[5',6':4,5]thieno[3,2- <i>e</i>][1,4]dioxepine-5,7(3<i>H</i>,9<i>H</i>)-dione","","- C10 H8 O6 S -","- C10 H8 O6 S -","- C40 H32 O24 S4 -","4","0.5","NG2356","Tomura, Masaaki; Ono, Katsuhiko; Kaiden, Masanori; Tsukamoto, Kenichi; Saito, Katsuhiro","2<i>H</i>,10<i>H</i>-1,4-Dioxepino[5',6':4,5]thieno[3,2-<i>e</i>][1,4]dioxepine-5,7(3<i>H</i>,9<i>H</i>)-dione","Acta Crystallographica Section E","2007","63","12","o4568","o4569","10.1107/S1600536807054001","","","0.7107","MoKα","","0.0679","0.0656","","","0.1493","0.1506","","","","","","1.121","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216678","17.8591","0.0013","15.4533","0.0011","19.5649","0.0014","90","","90","","90","","5399.6","0.7","292","2","292","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Diethyl 2,6-bis(3-methylphenyl)-4,8-dioxo-2,6,3a,4a,7a,8a- hexaazaperhydrocyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","","- C28 H32 N6 O6 -","- C28 H32 N6 O6 -","- C224 H256 N48 O48 -","8","1","NG2358","Guo-Dong Yin; Zi-Hua Wang; Jing Qin","Diethyl 2,6-bis(3-methylphenyl)-4,8-dioxo-2,6,3a,4a,7a,8a-hexaazaperhydrocyclopenta[<i>def</i>]fluorene-8b,8c-dicarboxylate","Acta Crystallographica Section E","2007","63","12","o4577","o4577","10.1107/S1600536807054803","","","0.71073","MoKα","","0.0795","0.0573","","","0.124","0.1362","","","","","","1.054","","","","has coordinates,has disorder,has Fobs","176432","2020-10-21","18:00:00",""
"2216679","7.5695","0.0009","12.0686","0.0013","9.1636","0.0007","90","","101.637","0.009","90","","819.92","0.15","290","2","290","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","<i>N</i>,<i>N</i>'-Bis(2,3-dichlorobenzylidene)ethylenediamine","","- C16 H12 Cl4 N2 -","- C16 H12 Cl4 N2 -","- C32 H24 Cl8 N4 -","2","0.5","NG2359","Khaniani, Yeganeh; Badiei, Alireza; Mohammadi Ziarani, Ghodsi; Abbasi, Alireza","<i>N</i>,<i>N</i>'-Bis(2,3-dichlorobenzylidene)ethylenediamine","Acta Crystallographica Section E","2007","63","12","o4616","o4616","10.1107/S1600536807055122","","","0.71073","MoKα","","0.1315","0.0371","","","0.0568","0.0679","","","","","","0.83","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216680","8.6809","0.0003","21.318","0.0009","21.7316","0.001","87.828","0.004","84.745","0.004","88.372","0.003","4000.6","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","(1,2-Dimethoxyethane-κO)bis(tri-<i>tert</i>-butoxysilanethiolato- κ^2^O,S)chromium(II)","","- C28 H64 Cr O8 S2 Si2 -","- C28 H64 Cr O8 S2 Si2 -","- C112 H256 Cr4 O32 S8 Si8 -","4","2","NG2360","Ciborska, Anna; Baranowska, Katarzyna; Wojnowski, Wiesław","(1,2-Dimethoxyethane-κ<i>O</i>)bis(tri-<i>tert</i>-butoxysilanethiolato-κ^2^<i>O</i>,<i>S</i>)chromium(II)","Acta Crystallographica Section E","2007","63","12","m2972","m2972","10.1107/S1600536807055614","","","0.71073","MoKα","","0.0397","0.0346","","","0.0936","0.097","","","","","","1.137","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216681","7.4564","0.0015","11.172","0.002","19.633","0.004","90","","90","","90","","1635.5","0.6","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2-(1,3-Dioxolan-2-yl)phenol","","- C9 H10 O3 -","- C9 H10 O3 -","- C72 H80 O24 -","8","1","NG2361","Kretz, Tonia; Lerner, Hans-Wolfram; Bolte, Michael","2-(1,3-Dioxolan-2-yl)phenol","Acta Crystallographica Section E","2007","63","12","o4684","o4684","10.1107/S1600536807056103","","","0.71073","MoKα","","0.1105","0.0489","","","0.0798","0.0932","","","","","","0.855","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216682","7.029","0.0003","7.0968","0.0002","12.1706","0.0004","85.419","0.002","75.096","0.002","84.064","0.002","582.64","0.04","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","(<i>E</i>)-4-(Nicotinoylhydrazono)pentanoic acid","","- C11 H13 N3 O3 -","- C11 H13 N3 O3 -","- C22 H26 N6 O6 -","2","1","NG2363","Yong-Tao Wang; Gui-Mei Tang; Jian-Chao Yu; Wen-Tao Yu; Jian-Dong Fan","(<i>E</i>)-4-(Nicotinoylhydrazono)pentanoic acid","Acta Crystallographica Section E","2007","63","12","o4655","o4655","10.1107/S1600536807056449","","","0.71073","MoKα","","0.0581","0.0379","","","0.0997","0.1178","","","","","","1.049","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216683","12.968","0.005","25.868","0.005","9.24","0.005","90","","90","","90","","3100","2","293","2","100","2","","","","","","","","6","C m c a","-C 2ac 2","64","","dipotassium di-μ~2~-hydroxido-bis{[<i>N</i>,<i>N</i>- bis(carboxylatomethyl)leucinato- κ^4^<i>N</i>,<i>O</i>,<i>O</i>',<i>O</i>'']cobaltate(III)} tetrahydrate","","- C20 H36 Co2 K2 N2 O18 -","- C20 H28 Co2 K2 N2 O18 -","- C80 H112 Co8 K8 N8 O72 -","4","","NG2364","Visser, Hendrik G.; Purcell, Walter; Muller, Alfred; Janse van Rensburg, J. Marthinus; Molosia, Phillip","Racemic dipotassium di-μ~2~-hydroxido-bis{[<i>N</i>,<i>N</i>-bis(carboxylatomethyl)leucinato-κ^4^<i>N</i>,<i>O</i>,<i>O</i>',<i>O</i>'']cobaltate(III)} tetrahydrate","Acta Crystallographica Section E","2007","63","12","m2998","m2999","10.1107/S1600536807056437","","","0.71073","MoKα","","","0.0542","","","","0.1334","","","","","","1.238","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216684","9.6365","0.0019","17.14","0.003","8.4144","0.0017","90","","90.68","0.03","90","","1389.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Poly[(μ~3~-acetylenedicarboxylato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'': <i>O</i>''')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]","","- C16 H8 Cd N2 O4 -","- C16 H8 Cd N2 O4 -","- C64 H32 Cd4 N8 O16 -","4","1","NG2365","Huan-Yu Wang; Shan Gao; Li-Hua Huo; Jing-Gui Zhao","Poly[(μ~3~-acetylenedicarboxylato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>'':<i>O</i>''')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]","Acta Crystallographica Section E","2007","63","12","m2995","m2995","10.1107/S1600536807057340","","","0.71073","MoKα","","0.0261","0.023","","","0.0562","0.0582","","","","","","1.116","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216685","9.8095","0.0002","19.429","0.0005","23.1842","0.0006","90","","94.355","0.002","90","","4405.89","0.18","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(μ-4,4'-Bipyridyl-κ^2^N:N')bis[bis(tri-tert- butoxysilanethiolato-κ^2^S,O)cadmium(II)] toluene disolvate","","- C72 H132 Cd2 N2 O12 S4 Si4 -","- C72 H132 Cd2 N2 O12 S4 Si4 -","- C144 H264 Cd4 N4 O24 S8 Si8 -","2","0.5","NG2366","Dołęga, Anna; Baranowska, Katarzyna; Pladzyk, Agnieszka","(μ-4,4'-Bipyridyl-κ^2^<i>N</i>:<i>N</i>')bis[bis(tri-<i>tert</i>-butoxysilanethiolato-κ^2^<i>S</i>,<i>O</i>)cadmium(II)] toluene disolvate","Acta Crystallographica Section E","2007","63","12","m3072","m3072","10.1107/S1600536807057947","","","0.71073","MoKα","","0.0333","0.0273","","","0.0711","0.0815","","","","","","1.169","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216686","7.5345","0.0015","9.2112","0.0018","18.524","0.004","88.12","0.03","84.29","0.03","76.38","0.03","1243.2","0.5","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[[diaqua(1,10-phenanthroline-κ^2^N,N')cobalt(II)]-μ-trans- stilbene-4,4'-dicarboxylato-κ^2^O:O']","","- C28 H22 Co N2 O6 -","- C28 H22 Co N2 O6 -","- C56 H44 Co2 N4 O12 -","2","1","NG2367","Huan-Yu Wang; Shan Gao; Li-Hua Huo; Jing-Gui Zhao","<i>catena</i>-Poly[[diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-μ-<i>trans</i>-stilbene-4,4'-dicarboxylato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","12","m3046","m3047","10.1107/S1600536807057959","","","0.71073","MoKα","","0.0566","0.0434","","","0.1353","0.1417","","","","","","1.014","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216687","7.1993","0.0002","7.0922","0.0002","12.6033","0.0003","90","","100.674","0.001","90","","632.38","0.03","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<i>trans</i>-tetrabromidobis(dimethyl sulfide-κS)platinum(IV)","","- C4 H12 Br4 Pt S2 -","- C4 H12 Br4 Pt S2 -","- C8 H24 Br8 Pt2 S4 -","2","0.5","NG2369","Muller, Alfred; Meijboom, Reinout","Low-temperature redetermination of <i>trans</i>-tetrabromidobis(dimethyl sulfide-κ<i>S</i>)platinum(IV)","Acta Crystallographica Section E","2007","63","12","m3075","m3075","10.1107/S1600536807058321","","","0.71073","MoKα","","","0.019","","","","0.048","","","","","","1.252","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216688","8.942","0.001","12.3257","0.0016","12.7431","0.0014","68.629","0.012","87.576","0.01","83.212","0.01","1298.8","0.3","175","","175","","","","","","","","","6","P -1","-P 1","2","","Bis(μ-trifluoromethanesulfonato-κ^2^<i>O</i>:<i>O</i>')bis[aqua\ (1,4,7,10,13,16-hexaoxacyclooctadecane-κ^6^<i>O</i>)barium(II)] bis(trifluoromethanesulfonate)","","- C28 H52 Ba2 F12 O26 S4 -","- C28 H52 Ba2 F12 O26 S4 -","- C28 H52 Ba2 F12 O26 S4 -","1","0.5","NG2370","C. Arnal-Hérault; A. van der Lee; M. Barboiu; Y. M. Legrand","Bis(μ-trifluoromethanesulfonato-κ^2^<i>O</i>:<i>O</i>')bis[aqua(1,4,7,10,13,16-hexaoxacyclooctadecane-κ^6^<i>O</i>)barium(II)] bis(trifluoromethanesulfonate)","Acta Crystallographica Section E","2007","63","12","m3151","m3152","10.1107/S1600536807060564","","","0.71073","MoKα","","0.043","0.0234","","0.0268","0.022","0.022","","","","","","1.11","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216689","9.875","0.001","12.3662","0.0012","21.7093","0.0019","90","","90","","90","","2651.1","0.4","200","2","200","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","Bis-1,1'-cycloheptyl-1,1'-diol","Bi-1,1'-cycloheptane-1,1'-diol","","- C14 H26 O2 -","- C14 H26 O2 -","- C112 H208 O16 -","8","1","NG2371","Betz, Richard; Klüfers, Peter","Bi-1,1'-cycloheptane-1,1'-diol","Acta Crystallographica Section E","2007","63","12","o4752","o4752","10.1107/S1600536807058345","","","0.71073","MoKα","","0.0661","0.0518","","","0.1174","0.1271","","","","","","1.159","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216690","9.1296","0.0018","9.4443","0.0019","11.57","0.002","100.77","0.03","107.28","0.03","97.99","0.03","915.5","0.4","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","2-Phenylimidazo[4,5-<i>f</i>][1,10]phenanthroline-1,10-diium dichloride dihydrate","","- C19 H18 Cl2 N4 O2 -","- C19 H18 Cl2 N4 O2 -","- C38 H36 Cl4 N8 O4 -","2","1","NG2372","Yu, Ying-Hui; Su, Yu; Shi, Ai-E; Hou, Guang-Feng","2-Phenylimidazo[4,5-<i>f</i>][1,10]phenanthroline-1,10-diium dichloride dihydrate","Acta Crystallographica Section E","2007","63","12","o4847","o4847","10.1107/S1600536807058904","","","0.71073","MoKα","","0.0598","0.0427","","","0.1219","0.1395","","","","","","1.018","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216691","8.822","0.005","17.782","0.005","13.798","0.005","90","0.005","103.027","0.005","90","0.005","2108.8","1.5","150","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Acetylacetonato-κ^2^<i>O</i>,<i>O</i>')carbonyl[2- (diphenylphosphino)pyridine-κ<i>P</i>]rhodium(I)","","- C23 H21 N O3 P Rh -","- C23 H21 N O3 P Rh -","- C92 H84 N4 O12 P4 Rh4 -","4","1","NG2373","Coetzee, Michael; Purcell, Walter; Visser, Hendrik G.; Venter, Johan A.","(Acetylacetonato-κ^2^<i>O</i>,<i>O</i>')carbonyl[2-(diphenylphosphino)pyridine-κ<i>P</i>]rhodium(I)","Acta Crystallographica Section E","2007","63","12","m3165","m3165","10.1107/S1600536807058886","","","0.71069","MoKα","","","0.026","","","","0.0647","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216692","7.7825","0.0016","8.4697","0.0017","8.7952","0.0018","90.97","0.03","110.17","0.03","106.65","0.03","517","0.2","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Diaqua(4-oxidopyridinium-3-sulfonato-κ^2^<i>O</i>,<i>O</i>')cobaltate(II) hexahydrate","","- C10 H24 Co N2 O16 S2 -","- C10 H24 Co N2 O16 S2 -","- C10 H24 Co N2 O16 S2 -","1","0.5","NG2374","Zhi-Biao Zhu; Shan Gao; Li-Hua Huo; Hui Zhao","Diaquabis(4-oxidopyridinium-3-sulfonato-κ^2^<i>O</i>,<i>O</i>')cobalt(II) hexahydrate","Acta Crystallographica Section E","2007","63","12","m3126","m3127","10.1107/S1600536807059338","","","0.71073","MoKα","","0.0333","0.0302","","","0.0977","0.1147","","","","","","1.193","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216693","14.3548","0.0009","8.4141","0.0005","19.6562","0.0013","90","","108.123","0.005","90","","2256.4","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(1<i>Z</i>)-1-(4-Methoxyphenyl)ethan-1-one thiosemicarbazone","","- C10 H13 N3 O S -","- C10 H13 N3 O S -","- C80 H104 N24 O8 S8 -","8","2","NG2375","Narayana, B.; Sunil, K.; Sarojini, B. K.; Yathirajan, H. S.; Bolte, Michael","(1<i>Z</i>)-1-(4-Methoxyphenyl)ethan-1-one thiosemicarbazone","Acta Crystallographica Section E","2007","63","12","o4834","o4835","10.1107/S1600536807059788","","","0.71073","MoKα","","0.0952","0.0789","","","0.2347","0.2401","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216694","7.3813","0.0015","10.654","0.002","16.385","0.003","98.77","0.03","101.17","0.03","104.11","0.03","1198.7","0.5","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","Di-μ-aqua-κ^2^O:O-di-4-formylbenzoato-κO-bis[aqua(2,2'-bipyridine- κ^2^N,N')cobalt(II)] bis(4-formylbenzoate)","","- C52 H44 Co2 N4 O16 -","- C52 H44 Co2 N4 O16 -","- C52 H44 Co2 N4 O16 -","1","0.5","NG2376","Zhao-Peng Deng; Shan Gao; Li-Hua Huo; Hui Zhao","Di-μ-aqua-bis[aqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(4-formylbenzoato-κ<i>O</i>)cobalt(II)] bis(4-formylbenzoate)","Acta Crystallographica Section E","2007","63","12","m3124","m3125","10.1107/S160053680705979X","","","0.71073","MoKα","","0.0503","0.0436","","","0.1331","0.1471","","","","","","1.078","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216695","20.324","0.004","12.057","0.002","7.4706","0.0016","90","","90","","90","","1830.6","0.6","173","2","173","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","<i>catena</i>-Poly[[[diaquacopper(II)]-μ-pyridine-2,4-dicarboxylato- κ^3^N,O^2^:O^4^] 0.625-hydrate]","","- C7 H8.25 Cu N O6.625 -","- C7 H8.25 Cu N O6.625 -","- C56 H66 Cu8 N8 O53 -","8","1","NG2377","Martin, David P.; LaDuca, Robert L.","<i>catena</i>-Poly[[[diaquacopper(II)]-μ-pyridine-2,4-dicarboxylato-κ^3^<i>N</i>,<i>O</i>^2^:<i>O</i>^4^] 0.625-hydrate]","Acta Crystallographica Section E","2007","63","12","m3203","m3203","10.1107/S1600536807061946","","","0.71073","MoKα","","0.0692","0.0406","","","0.091","0.0992","","","","","","1.086","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2216696","15.443","0.003","11.484","0.002","16.046","0.003","90","","104.284","0.018","90","","2757.7","0.9","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N,N'-Dimethyl-N,N'-bis[2-(2-pyridyl)ethyl](p-phenylenedimethylene)diammonium bis(perchlorate)","","- C24 H32 Cl2 N4 O8 -","- C24 H32 Cl2 N4 O7.996 -","- C96 H128 Cl8 N16 O31.984 -","4","1","NG2378","Yisgedu, Teshome B.; Tesema, Yohannes T.; Gultneh, Yilma; Butcher, Ray J.","<i>N</i>,<i>N</i>'-Dimethyl-<i>N</i>,<i>N</i>'-bis[2-(2-pyridyl)ethyl](<i>p</i>-phenylenedimethylene)diammonium bis(perchlorate)","Acta Crystallographica Section E","2007","63","12","o4891","o4892","10.1107/S1600536807060576","","","0.71073","MoKα","","0.1977","0.0586","","","0.1203","0.1716","","","","","","0.951","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216697","15.444","0.0003","11.777","0.0002","27.2069","0.0005","90","","100.482","0.001","90","","4865.92","0.15","100","0.1","100","0.1","","","","","","","","5","P 1 21 1","P 2yb","4","","Dibutylbis[4-(methylamino)benzoato-κ^2^<i>O</i>,<i>O</i>']tin(IV)","","- C24 H34 N2 O4 Sn -","- C24 H34 N2 O4 Sn -","- C192 H272 N16 O32 Sn8 -","8","4","NG2382","Yip Foo Win; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun; Tengku Sifzizul Tengku-Muhammad","Dibutylbis[4-(methylamino)benzoato-κ^2^<i>O</i>,<i>O</i>']tin(IV)","Acta Crystallographica Section E","2007","63","12","m3199","m3200","10.1107/S1600536807062411","","","0.71073","MoKα","","0.0355","0.0293","","","0.0569","0.0603","","","","","","1.044","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216698","6.9237","0.0005","11.1007","0.0007","15.1376","0.0009","90","","106.507","0.003","90","","1115.49","0.13","297","2","297","2","","","","","","","","5","P 1 c 1","P -2yc","7","","2-[(<i>E</i>)-2-(4-Hydroxy-3-methoxyphenyl)ethenyl]-1-methylquinolinium 4-methylbenzenesulfonate","","- C26 H25 N O5 S -","- C26 H25 N O5 S -","- C52 H50 N2 O10 S2 -","2","1","NG2386","Suchada Chantrapromma; Boonwasana Jindawong; Hoong-Kun Fun","2-[(<i>E</i>)-2-(4-Hydroxy-3-methoxyphenyl)ethenyl]-1-methylquinolinium 4-methylbenzenesulfonate","Acta Crystallographica Section E","2007","63","12","o4928","o4929","10.1107/S1600536807061922","","","0.71073","MoKα","","0.0303","0.0298","","","0.077","0.0779","","","","","","1.067","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216699","14.2037","0.0016","5.8647","0.0008","15.9022","0.0016","90","","91.111","0.009","90","","1324.4","0.3","100","1","100","1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(<i>E</i>,<i>E</i>)-4,4'-Bis[dimethyl(styryl)silyl]biphenyl","","- C32 H34 Si2 -","- C32 H34 Si2 -","- C64 H68 Si4 -","2","0.5","NG2387","Majchrzak, Mariusz; Marciniec, Bogdan; Kubicki, Maciej","(<i>E</i>,<i>E</i>)-4,4'-Bis[dimethyl(styryl)silyl]biphenyl","Acta Crystallographica Section E","2007","63","12","o4932","o4932","10.1107/S1600536807061405","","","0.71073","MoKα","","0.0929","0.0398","","","0.0598","0.0653","","","","","","0.876","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216700","6.5631","0.0007","8.2864","0.0009","19.872","0.002","90","","90","","90","","1080.7","0.2","291","2","291","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1R,3S)-1,2,2-Trimethylcyclopentane-1,3-diammonium sulfate","","- C8 H20 N2 O4 S -","- C8 H20 N2 O4 S -","- C32 H80 N8 O16 S4 -","4","1","NG2395","Chu, Zhao-Lian; Fan, Ying; Huang, Wei; Liu, Jian-Lan","(1<i>R</i>,3<i>S</i>)-1,2,2-Trimethylcyclopentane-1,3-diammonium sulfate","Acta Crystallographica Section E","2007","63","12","o4927","o4927","10.1107/S1600536807061958","","","0.71073","MoKα","","0.0359","0.0353","","","0.091","0.0916","","","","","","1.08","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216701","11.5497","0.0006","8.6735","0.0004","12.1645","0.0006","90","","90.241","0.0012","90","","1218.58","0.1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-Bis(dimorpholinomethyl)benzene","","- C24 H38 N4 O4 -","- C24 H38 N4 O4 -","- C48 H76 N8 O8 -","2","0.5","OM2163","Wang, Dan; Liu, Shixiong","1,4-Bis(dimorpholinomethyl)benzene","Acta Crystallographica Section E","2007","63","12","o4604","o4604","10.1107/S1600536807047836","","","0.71073","MoKα","","0.0764","0.0454","","","0.1229","0.1322","","","","","","0.947","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216702","7.1898","0.0014","8.3807","0.0017","14.784","0.003","90","","99.76","0.03","90","","877.9","0.3","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,3-bis(2-ethylphenylimino)butane","2,3-Bis(2-ethylphenylimino)butane","","- C20 H24 N2 -","- C20 H24 N2 -","- C40 H48 N4 -","2","0.5","OM2165","Martins, Roberto S.; Filgueiras, Carlos A. L.; Visentin, Lorenzo do C.; Bordinhão, Jairo; Ferreira, Leonardo C.","2,3-Bis(2-ethylphenylimino)butane","Acta Crystallographica Section E","2007","63","12","o4544","o4544","10.1107/S1600536807049367","","","0.71073","MoKα","","0.0515","0.0424","","","0.1227","0.1308","","","","","","1.112","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216703","13.5877","0.0003","31.1809","0.0007","13.724","0.0003","90","","106.873","0.001","90","","5564.2","0.2","100","1","100","1","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","1,7,16,30,36,47-Hexakis(perfluoroisopropyl)- 1,7,16,30,36,47-hexahydro(C~60~‒I~h~)[5,6]fullerene","","- C78 F42 -","- C78 F42 -","- C312 F168 -","4","1","OM2171","Shustova, Natalia B.; Kuvychko, Igor V.; Boltalina, Olga V.; Strauss, Steven H.","1,7,16,30,36,47-Hexakis(perfluoroisopropyl)-1,7,16,30,36,47-hexahydro(C~60~‒<i>I~h~</i>)[5,6]fullerene","Acta Crystallographica Section E","2007","63","12","o4575","o4575","10.1107/S1600536807053895","","","0.71073","MoKα","","0.1085","0.052","","","0.1103","0.1331","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216704","8.3898","0.0001","22.1418","0.0004","8.6374","0.0001","90","","101.756","0.001","90","","1570.87","0.04","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl 5-(ethoxycarbonyl)-3-phenyl-1<i>H</i>-pyrazole-1-acetate","","- C16 H18 N2 O4 -","- C16 H18 N2 O4 -","- C64 H72 N8 O16 -","4","1","OM2172","Dong, Wen-Liang; Ge, Yan-Qing; Xia, Yong; Zhao, Bao-Xiang","Ethyl 5-(ethoxycarbonyl)-3-phenyl-1<i>H</i>-pyrazole-1-acetate","Acta Crystallographica Section E","2007","63","12","o4701","o4701","10.1107/S1600536807057339","","","0.71073","MoKα","","0.0676","0.0436","","","0.111","0.1264","","","","","","1.027","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216705","7.238","0.0005","14.356","0.0009","14.629","0.0009","90","","90.098","0.001","90","","1520.08","0.17","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-poly[[dibenzyldichloridotin(IV)]-μ-1,4-bis(pyridin-3-ylmethoxy)benzene]","","- C32 H30 Cl2 N2 O2 Sn -","- C32 H30 Cl2 N2 O2 Sn -","- C64 H60 Cl4 N4 O4 Sn2 -","2","0.5","OM2174","Shun-Li Li; Jie Liu; Jian-Fang Ma","An organotin coordination polymer formed from 1,4-bis(pyridin-3-ylmethoxy)benzene and dibenzyldichlorostannane","Acta Crystallographica Section E","2007","63","12","m3050","m3050","10.1107/S1600536807057613","","","0.71069","MoKα","","0.0295","0.026","","","0.0601","0.0621","","","","","","1.061","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216706","22.2891","0.0004","7.0516","0.0001","23.4565","0.0004","90","","117.711","0.002","90","","3263.89","0.11","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","r-2,c-6-Bis(3-fluorophenyl)t-3,t-5-dimethylpiperidin-4-one","","- C19 H17 F2 N O -","- C19 H17 F2 N O -","- C152 H136 F16 N8 O8 -","8","1","OM2176","R. Ramachandran; P. Parthiban; Adinarayana Doddi; V. Ramkumar; S. Kabilan","<i>r</i>-2,<i>c</i>-6-Bis(3-fluorophenyl)-<i>t</i>-3,<i>t</i>-5-dimethylpiperidin-4-one","Acta Crystallographica Section E","2007","63","12","o4559","o4559","10.1107/S1600536807054165","","","0.71073","MoKα","","0.057","0.0472","","","0.1459","0.1614","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216707","6.024","0.002","11.593","0.003","14.095","0.006","90","","97.72","0.03","90","","975.4","0.6","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-(2-Carboxyethyl)morpholin-4-ium chloride","","- C7 H14 Cl N O3 -","- C7 H14 Cl N O3 -","- C28 H56 Cl4 N4 O12 -","4","1","OM2177","Mazur, Liliana; Pitucha, Monika; Rzaczynska, Zofia","4-(2-Carboxyethyl)morpholin-4-ium chloride","Acta Crystallographica Section E","2007","63","12","o4576","o4576","10.1107/S1600536807053676","","","0.71073","MoKα","","0.1626","0.0541","","","0.103","0.133","","","","","","0.973","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216708","10.4185","0.0014","10.9689","0.0014","14.3844","0.0019","70.599","0.002","81.174","0.002","63.298","0.002","1385.1","0.3","150","2","150","2","","","","","","","","6","P 1","P 1","1","","Tris(1,10-phenanthrolinium) tris(pyridine-2,6-dicarboxylato)yttriumate dimethyl sulfoxide pentahydrate","","- C59 H52 N9 O18 S Y -","- C59 H52 N9 O18 S Y -","- C59 H52 N9 O18 S Y -","1","1","OM2178","Soleimannejad, Janet; Aghabozorg, Hossein; Nakhjavan, Bahar; Attar Gharamaleki, Jafar; Ramezanipour, Farshid","Tris(1,10-phenanthrolinium) tris(pyridine-2,6-dicarboxylato)yttriate(III) dimethyl sulfoxide solvate pentahydrate","Acta Crystallographica Section E","2007","63","12","m3170","m3171","10.1107/S1600536807060047","","","0.71073","MoKα","","0.0848","0.0544","","","0.1142","0.1309","","","","","","1.001","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216709","13.7672","0.0012","10.2603","0.0011","21.6094","0.0013","90","","94.498","0.005","90","","3043","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Sesqui(piperazinediium) (5-carboxypyridine-2-carboxylato)bis(pyridine-2,5-dicarboxylato)cadmate(II) trihydrate","","- C54 H68 Cd2 N12 O30 -","- C54 H68 Cd2 N12 O30 -","- C108 H136 Cd4 N24 O60 -","2","0.5","OM2179","Aghabozorg, Hossein; Derikvand, Zohreh; Nemati, Andya; Ghadermazi, Mohammad; Attar Gharamaleki, Jafar","Sesqui(piperazinediium) (5-carboxypyridine-2-carboxylato)bis(pyridine-2,5-dicarboxylato)cadmate(II) trihydrate","Acta Crystallographica Section E","2007","63","12","m3140","m3141","10.1107/S1600536807060606","","","0.71073","MoKα","","0.0367","0.0279","","","0.0641","0.0695","","","","","","1.047","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2216710","9.4568","0.0003","14.6356","0.0007","24.0095","0.0008","90","","91.391","0.003","90","","3322.1","0.2","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(2,6-Diisopropylphenyl)-6-[(2,6- diisopropylphenyl)(methacryloyl)aminocarbonyl]pyridine-2-carboximidoyl chloride","","- C35 H42 Cl N3 O2 -","- C35 H42 Cl N3 O2 -","- C140 H168 Cl4 N12 O8 -","4","1","OM2180","Aydın, Aslıhan; Dinçer, Muharrem; Dayan, Osman; Çetinkaya, Bekir","<i>N</i>-(2,6-Diisopropylphenyl)-6-[(2,6-diisopropylphenyl)(methacryloyl)aminocarbonyl]pyridine-2-carboximidoyl chloride","Acta Crystallographica Section E","2007","63","12","o4538","o4538","10.1107/S1600536807053901","","","0.71073","MoKα","","0.0682","0.0462","","","0.1326","0.1422","","","","","","1.058","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216711","10.868","0.002","8.047","0.0016","29.209","0.006","90","","90","","90","","2554.5","0.9","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","5-Bromo-N'-(4-hydroxybenzylidene)nicotinohydrazide","","- C13 H10 Br N3 O2 -","- C13 H10 Br N3 O2 -","- C104 H80 Br8 N24 O16 -","8","1","OM2183","Chun-Bao Tang","5-Bromo-<i>N</i>'-(4-hydroxybenzylidene)nicotinohydrazide","Acta Crystallographica Section E","2007","63","12","o4841","o4841","10.1107/S1600536807060552","","","0.71073","MoKα","","0.0562","0.0384","","","0.0851","0.0934","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216712","9.856","0.002","14.492","0.003","15.714","0.003","90","","90","","90","","2244.5","0.8","153","2","153","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1,3,7-trideacetylkhivorin","14,15β:21,23-diepoxy-1α,3α,7α-trihydroxy-4,4,8-trimethyl-D-homo-24- nor-17-oxochola-20,22-diene-16-one","","- C26 H36 O7 -","- C26 H36 O7 -","- C104 H144 O28 -","4","1","PK2059","Huaping Zhang; Don VanDerveer; Xi Wang; Feng Chen; Michael J. Wargovich","1,3,7-Trideacetylkhivorin","Acta Crystallographica Section E","2007","63","12","o4599","o4599","10.1107/S1600536807055110","","","0.71073","MoKα","","0.0387","0.0366","","","0.0912","0.0944","","","","","","1.071","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216713","14.101","0.004","10.369","0.003","23.627","0.006","90","","90","","90","","3454.6","1.7","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Diaquabis{2-[2-(isopropylammonio)ethyliminomethyl]-6-methoxyphenolato}nickel(II) dinitrate dihydrate","","- C26 H48 N6 Ni O14 -","- C26 H48 N6 Ni O14 -","- C104 H192 N24 Ni4 O56 -","4","0.5","PK2060","Ying-Zhen Wang; Lan-Lan Li; Yong-Qing Su; Cong Li","Diaquabis{2-[2-(isopropylammonio)ethyliminomethyl]-6-methoxyphenolato}nickel(II) dinitrate dihydrate","Acta Crystallographica Section E","2007","63","12","m2945","m2946","10.1107/S1600536807055092","","","0.71073","MoKα","","0.0572","0.0401","","","0.0971","0.1075","","","","","","1.02","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216714","13.509","0.0005","15.0743","0.0006","14.1788","0.0004","90","","110.547","0.001","90","","2703.67","0.17","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[5,10,15,20-Tetrakis(2,6-dimethoxyphenyl)porphyrinato]zinc(II) dichloromethane tetrasolvate","","- C56 H52 Cl8 N4 O8 Zn -","- C56 H52 Cl8 N4 O8 Zn -","- C112 H104 Cl16 N8 O16 Zn2 -","2","0.5","PK2062","Conrad, Diane; DeCoskey, Jennifer; Mock, Samantha; Noll, Bruce C.; Petrovic, Jelena; Zovinka, Edward P.","[5,10,15,20-Tetrakis(2,6-dimethoxyphenyl)porphyrinato]zinc(II) dichloromethane tetrasolvate","Acta Crystallographica Section E","2007","63","12","m3058","m3058","10.1107/S1600536807058138","","","0.71073","MoKα","","0.0371","0.0322","","","0.0845","0.0871","","","","","","1.051","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216715","5.745","0.0002","5.745","0.0002","21.3883","0.001","90","","90","","120","","611.35","0.04","296","2","296","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","","tribarium dichromium octaoxide","","- Ba3 Cr2 O8 -","- Ba3 Cr2 O8 -","- Ba9 Cr6 O24 -","3","0.0833333","PK2063","Aczel, Adam A.; Dabkowska, Hanna A.; Britten, James F.; Harrington, Laura E.; Luke, Graeme M.","Barium chromium oxide, Ba~3~Cr~2~O~8~, as grown by the traveling solvent floating-zone technique","Acta Crystallographica Section E","2007","63","12","i196","i196","10.1107/S1600536807057583","","","0.71073","MoKα","","0.0282","0.0209","","","0.0488","0.0511","","","","","","1.072","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216716","7.5246","0.0013","9.866","0.004","10.821","0.004","65.61","0.04","79.43","0.02","70.76","0.02","689.7","0.5","150","","150","","","","","","","","","4","P -1","-P 1","2","Urea DMF solvate (3/1)","Urea N,N-dimethylformamide (3/1)","","- C6 H19 N7 O4 -","- C6 H19 N7 O4 -","- C12 H38 N14 O8 -","2","1","PK2065","Fernandes, Philippe; Florence, Alastair J.; Fabbiani, Francesca; David, William I. F.; Shankland, Kenneth","Urea‒<i>N,N</i>-dimethylformamide (3/1)","Acta Crystallographica Section E","2007","63","12","o4861","o4861","10.1107/S1600536807059934","","","0.71073","MoKα","","0.0529","0.0388","","0.1047","0.099","0.1047","","","","","","0.9752","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216717","10.707","0.004","7.367","0.004","24.127","0.009","90","","90.908","0.014","90","","1902.9","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis{4-[4-(dimethylamino)styryl]-1-ethylpyridinium} di-μ-iodido-bis[iodidocuprate(II)]","","- C34 H42 Cu2 I4 N4 -","- C34 H42 Cu2 I4 N4 -","- C68 H84 Cu4 I8 N8 -","2","0.5","PV2032","Yang-Feng Liu; Jian-Zhong Chen; Chang-Cang Huang","Bis{4-[4-(dimethylamino)styryl]-1-ethylpyridinium} di-μ-iodido-bis[iodidocuprate(II)]","Acta Crystallographica Section E","2007","63","12","m2957","m2957","10.1107/S160053680705074X","","","0.71073","MoKα","","0.0438","0.034","","","0.07","0.0805","","","","","","1.053","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216718","17.207","0.017","14.742","0.015","13.87","0.014","90","","94.65","0.018","90","","3507","6","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","<i>N</i>-(2-Bromobenzyl)-2,6-diisopropylaniline","","- C19 H24 Br N -","- C19 H24 Br N -","- C152 H192 Br8 N8 -","8","2","PV2038","Cristea, Adina; Varga, Richard A.; Silvestru, Cristian","<i>N</i>-(2-Bromobenzyl)-2,6-diisopropylaniline","Acta Crystallographica Section E","2007","63","12","o4528","o4529","10.1107/S1600536807052907","","","0.71073","MoKα","","0.0968","0.0467","","","0.1089","0.1341","","","","","","1.033","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216719","7.9218","0.0016","7.6237","0.0015","34.325","0.007","90","","93.67","0.03","90","","2068.8","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di-μ-nitrato-κ^3^O,O':O'';κ^3^O:O',O''-bis[bis(3-nitrobenzohydrazide- κ^2^N',O)cadmium(II)] dinitrate","","- C14 H14 Cd N8 O12 -","- C14 H14 Cd N8 O12 -","- C56 H56 Cd4 N32 O48 -","4","1","PV2040","Chundak, S. Yu.; Lukachinec, L. Yu.; Daszkiewicz, M.","Di-μ-nitrato-κ^3^<i>O</i>,<i>O</i>':<i>O</i>'';κ^3^<i>O</i>:<i>O</i>',<i>O</i>''-bis[bis(3-nitrobenzohydrazide-κ^2^<i>N</i>',<i>O</i>)cadmium(II)] dinitrate","Acta Crystallographica Section E","2007","63","12","m2893","m2893","10.1107/S1600536807053792","","","0.71073","MoKα","","0.086","0.0409","","","0.0546","0.0638","","","","","","0.935","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216720","13.2524","0.0004","13.5607","0.0004","19.7271","0.0006","90","","95.588","0.001","90","","3528.35","0.18","101","2","101","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(Acetylacetonato)aqua(2,2',2''-terpyridine)chromium(III) bis(perchlorate) dihydrate hexamethylphosphoramide solvate","","- C26 H42 Cl2 Cr N6 O14 P -","- C26 H42 Cl2 Cr N6 O14 P -","- C104 H168 Cl8 Cr4 N24 O56 P4 -","4","1","PV2041","Cloete, Nicoline; Visser, Hendrik G.","(Acetylacetonato)aqua(2,2',2''-terpyridine)chromium(III) bis(perchlorate) dihydrate hexamethylphosphoramide solvate","Acta Crystallographica Section E","2007","63","12","m3069","m3070","10.1107/S1600536807056176","","","0.71073","MoKα","","","0.0299","","","","0.08","","","","","","1.021","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2216721","6.60966","0.00014","17.0902","0.0004","20.1206","0.0005","90","","90","","90","","2272.83","0.09","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-)-(1<i>S</i>,4<i>S</i>,6<i>R</i>,8<i>R</i>)-[11,11-Dimethyl-5-(4-\ tolylsulfonyl)-3-oxa-5-azatricyclo[6.2.1.0^1,6^]undec-4-yl](phenyl)methanone","","- C25 H29 N O4 S -","- C25 H29 N O4 S -","- C100 H116 N4 O16 S4 -","4","1","PV2042","Kwang-Youn Ko; Hoseop Yun","({-})-(1<i>S</i>,4<i>S</i>,6<i>R</i>,8<i>R</i>)-[11,11-Dimethyl-5-(4-tolylsulfonyl)-3-oxa-5-azatricyclo[6.2.1.0^1,6^]undec-4-yl](phenyl)methanone","Acta Crystallographica Section E","2007","63","12","o4712","o4712","10.1107/S1600536807056917","","","0.71073","MoKα","","","0.0317","","","","0.0907","","","","","","1.072","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216722","7.2781","0.0002","9.5338","0.0002","20.4017","0.0005","90","","90","","90","","1415.63","0.06","93","2","93","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(3-Diacetylamino-2-methoxy-5-methylphenyl)acetamide","","- C14 H18 N2 O4 -","- C14 H18 N2 O4 -","- C56 H72 N8 O16 -","4","1","PV2043","Polson, Matthew I. J.; Steel, Peter J.","<i>N</i>-(3-Diacetylamino-2-methoxy-5-methylphenyl)acetamide","Acta Crystallographica Section E","2007","63","12","o4796","o4796","10.1107/S1600536807058308","","","0.71073","MoKα","","0.0264","0.0241","","","0.0613","0.063","","","","","","1.028","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216723","5.9753","0.0004","9.9177","0.0007","18.1925","0.0013","84.632","0.006","88.618","0.006","81.088","0.005","1060.37","0.13","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","6-Bromo-2,4-bis(3-methoxyphenyl)-3,4-dihydro-2H-1,3-naphthoxazine","","- C26 H22 Br N O3 -","- C26 H22 Br N O3 -","- C52 H44 Br2 N2 O6 -","2","1","PV2044","Sarojini, B. K.; Narayana, B.; Mayekar, Anil N.; Yathirajan, H. S.; Bolte, Michael","6-Bromo-2,4-bis(3-methoxyphenyl)-3,4-dihydro-2<i>H</i>-1,3-naphthoxazine","Acta Crystallographica Section E","2007","63","12","o4739","o4739","10.1107/S1600536807057832","","","0.71073","MoKα","","0.0368","0.0323","","","0.0833","0.0858","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216724","12.4982","0.0012","13.1542","0.0014","15.236","0.002","90","","107.413","0.002","90","","2390.1","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","trans-Tetrakis(pyridine-κN)bis(thiocyanato-κN)manganese","","- C22 H20 Mn N6 S2 -","- C22 H20 Mn N6 S2 -","- C88 H80 Mn4 N24 S8 -","4","0.5","PV2046","Hua Yang; Yuting Chen; Dacheng Li; Daqi Wang","<i>trans</i>-Tetrakis(pyridine-κ<i>N</i>)bis(thiocyanato-κ<i>N</i>)manganese(II)","Acta Crystallographica Section E","2007","63","12","m3186","m3186","10.1107/S1600536807062459","","","0.71073","MoKα","","0.0451","0.0316","","","0.0762","0.0895","","","","","","1.001","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216725","31.3356","0.0017","6.7952","0.0003","24.31","0.0013","90","","113.542","0.004","90","","4745.5","0.4","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Desipraminium picrate","","- C24 H25 N5 O7 -","- C24 H25 N5 O7 -","- C192 H200 N40 O56 -","8","1","PV2047","Swamy, M. T.; Ashok, M. A.; Yathirajan, H. S.; Narayana, B.; Bolte, Michael","Desipraminium picrate","Acta Crystallographica Section E","2007","63","12","o4919","o4919","10.1107/S1600536807062393","","","0.71073","MoKα","","0.0525","0.0443","","","0.1202","0.1251","","","","","","1.043","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216726","7.0896","0.0006","15.9772","0.001","10.1193","0.0007","90","","107.559","0.004","90","","1092.83","0.14","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(μ-4-formyl-2-methoxyphenolato)bis[aquachloridozinc(II)] dihydrate","","- C16 H22 Cl2 O10 Zn2 -","- C16 H22 Cl2 O10 Zn2 -","- C32 H44 Cl4 O20 Zn4 -","2","0.5","RK2052","Hang-Ming Guo; Hui-Duo Xian; Guo-Liang Zhao","Bis(μ-4-formyl-2-methoxyphenolato)bis[aquachloridozinc(II)] dihydrate","Acta Crystallographica Section E","2007","63","12","m3008","m3008","10.1107/S1600536807056589","","","0.71073","MoKα","","","0.03","","","0.0822","0.0875","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216727","9.0814","0.0008","11.6889","0.001","22.685","0.002","90","","90","","90","","2408","0.4","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","fpg","Boc-Phe-D-Pro-Gly-OMe monohydrate","","- C22 H33 N3 O7 -","- C22 H33 N3 O7 -","- C88 H132 N12 O28 -","4","1","RK2053","Doi, Mitsunobu; Ichimiya, Yuko; Asano, Akiko","β-Turn structure of a tripeptide <i>N</i>-(<i>tert</i>-butoxycarbonyl)-Phe-<small>D</small>-Pro-Gly methyl ester monohydrate","Acta Crystallographica Section E","2007","63","12","o4691","o4691","10.1107/S1600536807056693","","","0.71073","MoKα","","0.0634","0.0595","","","0.1738","0.1769","","","","","","1.107","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216728","17.421","0.004","9.5509","0.0019","9.6729","0.0019","90","","90","","90","","1609.4","0.6","150","2","150","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","N-Benzylthioformamide","","- C8 H9 N S -","- C8 H9 N S -","- C64 H72 N8 S8 -","8","1","RK2054","Śmiszek-Lindert, Wioleta; Nowak, Maria; Kusz, Joachim","<i>N</i>-Benzylthioformamide","Acta Crystallographica Section E","2007","63","12","o4587","o4587","10.1107/S1600536807053767","","","0.71073","MoKα","","0.0579","0.0369","","","0.0966","0.1016","","","","","","1","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216729","7.97","0.004","17.647","0.009","11.838","0.004","90","","99.062","0.016","90","","1644.2","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetraaquabis(2-methoxybenzaldehyde isonicotinoylhydrazone)zinc dinitrate","","- C28 H34 N8 O14 Zn -","- C28 H34 N8 O14 Zn -","- C56 H68 N16 O28 Zn2 -","2","0.5","RK2055","Gao, Shaokang; Fu, Zhongwu; Wang, Zengyou","Tetraaquabis(2-methoxybenzaldehyde isonicotinoylhydrazone)zinc dinitrate","Acta Crystallographica Section E","2007","63","12","m3004","m3005","10.1107/S1600536807057236","","","0.71073","MoKα","","0.0544","0.0413","","","0.093","0.1011","","","","","","1.054","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216730","13.5507","0.0003","6.7094","0.0001","19.4638","0.0004","90","","102.463","0.001","90","","1727.89","0.06","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Porphyrin","2,3,12,13-Tetramethyl-5,10,15,20-tetraphenylporphyrin","","- C48 H38 N4 -","- C48 H38 N4 -","- C96 H76 N8 -","2","0.5","RK2056","P. Bhyrappa; K. Karunanithi; B. Varghese","2,3,12,13-Tetramethyl-5,10,15,20-tetraphenylporphyrin","Acta Crystallographica Section E","2007","63","12","o4755","o4755","10.1107/S1600536807058242","","","0.71073","MoKα","","0.1256","0.076","","","0.1458","0.1648","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216731","7.7633","0.0019","10.597","0.004","15.14","0.004","90","","108.136","0.019","90","","1183.7","0.6","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Tetraaquatetraureaneodymium(III) triiodide","","- C4 H24 I3 N8 Nd O8 -","- C4 H24 I3 N8 Nd O8 -","- C8 H48 I6 N16 Nd2 O16 -","2","0.5","RK2058","Ludmila Yu. Alikberova; Dmitry V. Albov; Denis V. Golubev; Valery V. Kravchenko; Nataliya S. Rukk","Tetraaquatetraureaneodymium(III) triiodide","Acta Crystallographica Section E","2007","63","12","m3078","m3078","10.1107/S1600536807058643","","","0.71073","MoKα","","0.0545","0.0345","","","0.0644","0.0696","","","","","","0.997","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216732","7.2064","0.0006","13.8208","0.0011","19.3825","0.0015","90","","100.608","0.002","90","","1897.5","0.3","297","2","297","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[Bis(1H-benzimidazol-2-ylmethyl)amine- κ^3^N,N',N'']dichlorido(methanol)manganese(II)","","- C17 H19 Cl2 Mn N5 O -","- C17 H19 Cl2 Mn N5 O -","- C68 H76 Cl8 Mn4 N20 O4 -","4","1","RK2061","Zhang, Hang; Wumaierjiang, Aimaiti; Meng, Xiang-Gao","[Bis(1<i>H</i>-benzimidazol-2-ylmethyl)amine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']dichlorido(methanol)manganese(II)","Acta Crystallographica Section E","2007","63","12","m3116","m3116","10.1107/S1600536807058783","","","0.71073","Mokα","","0.0929","0.0519","","","0.1132","0.1291","","","","","","0.953","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216733","16.074","0.006","10.209","0.004","18.736","0.007","90","","112.117","0.004","90","","2848.3","1.9","203","2","203","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Dichloridobis{N-[(dimethylamino)dimethylsilyl]-2,6-dimethylanilido- κ^2^<i>N</i>,<i>N</i>'}hafnium(IV)","","- C24 H42 Cl2 Hf N4 Si2 -","- C24 H42 Cl2 Hf N4 Si2 -","- C96 H168 Cl8 Hf4 N16 Si8 -","4","0.5","RK2062","Chen, Juan; Cao, Ke-Ning; Guo, Jianping","Dichloridobis{<i>N</i>-[(dimethylamino)dimethylsilyl]-2,6-dimethylanilido-κ^2^<i>N</i>,<i>N</i>'}hafnium(IV)","Acta Crystallographica Section E","2007","63","12","m3107","m3107","10.1107/S1600536807059569","","","0.71073","MoKα","","0.0326","0.0314","","","0.0801","0.081","","","","","","1.034","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216734","15.1732","0.001","7.5493","0.0005","16.3452","0.0012","90","","105.494","0.007","90","","1804.3","0.2","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","piperidine derivative","2-[2,6-Bis(2-chlorophenyl)piperidin-4-ylidene]malononitrile","","- C20 H15 Cl2 N3 -","- C20 H15 Cl2 N3 -","- C80 H60 Cl8 N12 -","4","1","RK2063","S. Balamurugan; A. Thiruvalluvar; R. J. Butcher; A. Manimekalai; J. Jayabharathi","2-[2,6-Bis(2-chlorophenyl)piperidin-4-ylidene]malononitrile","Acta Crystallographica Section E","2007","63","12","o4853","o4853","10.1107/S1600536807060059","","","0.71073","MoKα","","0.1672","0.0409","","","0.0866","0.1238","","","","","","0.889","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216735","9.205","0.003","20.667","0.007","10.071","0.003","90","","115.707","0.005","90","","1726.3","1","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-{3-[3-(2,2-Dimethylpropionyl)thioureido]propyl}-2,2-dimethylpropionamide","","- C14 H27 N3 O2 S -","- C14 H27 N3 O2 S -","- C56 H108 N12 O8 S4 -","4","1","RK2065","Yusof, M. Sukeri M.; Ayob, Noor Adila Che; Yamin, Bohari M.","<i>N</i>-{3-[3-(2,2-Dimethylpropionyl)thioureido]propyl}-2,2-dimethylpropionamide","Acta Crystallographica Section E","2007","63","12","o4860","o4860","10.1107/S1600536807059946","","","0.71073","MoKα","","0.1015","0.0597","","","0.1381","0.1532","","","","","","1.041","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216736","12.482","0.003","25.285","0.005","8.6938","0.0017","90","","105.78","0.03","90","","2640.4","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","irbesartan bromide sesquihydrate","2-n-Butyl-3-[2'-(1H-tetrazol-5-yl)biphenyl-4-ylmethyl]- 1-azonia-3-azaspiro[4.4]non-1-en-4-one bromide sesquihydrate","","- C50 H64 Br2 N12 O5 -","- C50 H64 Br2 N12 O5 -","- C100 H128 Br4 N24 O10 -","2","0.5","RN2028","Wang, Lin; Zhou, Li-Na; Bao, Ying; Wang, Jing-Kang","2-<i>n</i>-Butyl-3-[2'-(1<i>H</i>-tetrazol-5-yl)biphenyl-4-ylmethyl]-1-azonia-3-azaspiro[4.4]non-1-en-4-one bromide sesquihydrate","Acta Crystallographica Section E","2007","63","12","o4933","o4933","10.1107/S1600536807061156","","","0.71073","MoKα","","0.0773","0.0492","","","0.1378","0.15","","","","","","1.043","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216737","8.081","0.003","8.833","0.003","12.279","0.004","80.37","0.03","73.68","0.02","77.41","0.03","815.7","0.5","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-hydroxybenzamide","","- C18 H17 N3 O3 -","- C18 H17 N3 O3 -","- C36 H34 N6 O6 -","2","1","RN2030","Qing-Hua Wang; Guo-Cong Guo; Li-Zhen Cai; Hong-Xu Guo; Ming-Li Chen","<i>N</i>-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1<i>H</i>-pyrazol-4-yl)-2-hydroxybenzamide","Acta Crystallographica Section E","2007","63","12","o4802","o4802","10.1107/S1600536807059570","","","0.71073","MoKα","","0.1336","0.0587","","","0.1269","0.172","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216738","6.2745","0.0007","14.6008","0.0015","14.0154","0.0011","90","","94.39","0.03","90","","1280.2","0.2","298","2","298","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","6-Methyl-3-p-tolyl-3,4-dihydroquinazoline","","- C16 H16 N2 -","- C16 H16 N2 -","- C64 H64 N8 -","4","1","RT2006","Tian, Wen-Wen; Dong, Su-Lan; Xu, Jia-Ying; Ding, Shan; Wang, Jin-Tang","6-Methyl-3-<i>p</i>-tolyl-3,4-dihydroquinazoline","Acta Crystallographica Section E","2007","63","12","o4734","o4734","10.1107/S1600536807057534","","","0.71073","MoKα","","0.1382","0.0757","","","0.1688","0.2003","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216739","9.486","0.002","11.49","0.003","16.322","0.004","90","","106.076","0.003","90","","1709.4","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[tetraaquamanganese(II)]-μ-6,6'-dihydroxy-3,3'- diazenediyldibenzoato-κ^2^O:O']","","- C14 H16 Mn N2 O10 -","- C14 H16 Mn N2 O10 -","- C56 H64 Mn4 N8 O40 -","4","1","RT2011","Tan, Yu-Hui; Huang, Zhi-Qin; Chen, Shao-Hu; Xie, Xiao-Bin; Xia, Li-Bin","<i>catena</i>-Poly[[tetraaquamanganese(II)]-μ-6,6'-dihydroxy-3,3'-diazenediyldibenzoato-κ^2^<i>O</i>:<i>O</i>']","Acta Crystallographica Section E","2007","63","12","m2948","m2949","10.1107/S1600536807055717","","","0.71073","MoKα","","0.038","0.0327","","","0.1008","0.1022","","","","","","1.546","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216740","5.795","0.002","6.076","0.002","6.441","0.003","91.97","0.03","111.59","0.04","101.82","0.03","204.9","0.15","298","","298","","","","","","","","","3","P -1","-P 1","2","","2,5-Dihydroxy-2,5-dimethylcyclohexane-1,4-dione","","- C8 H12 O4 -","- C8 H12 O4 -","- C8 H12 O4 -","1","0.5","RZ2164","Nikolaenko, Igor V.; Bazzicalupi, Carla; Grimmer, Craig; Bhagwandin, Ashen","2,5-Dihydroxy-2,5-dimethylcyclohexane-1,4-dione","Acta Crystallographica Section E","2007","63","12","o4703","o4703","10.1107/S1600536807047708","","","0.71073","MoKα","","0.0581","0.0349","","","0.0763","0.0828","","","","","","0.892","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216742","8.5905","0.0009","14.8361","0.0016","20.905","0.002","90","","90","","90","","2664.3","0.5","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","catena-Poly[[[5-(2-pyridyl)tetrazolato-κ^2^N^1^,N^5^]copper(II)]-μ- 5-(2-pyridyl)tetrazolato-κ^2^N^1^,N^5^:N^3^]","","- C12 H8 Cu N10 -","- C12 H8 Cu N10 -","- C96 H64 Cu8 N80 -","8","1","RZ2170","Qiu, Yu-E; Jin, Mei-Fang; Zhang, Xiu-Ling","<i>catena</i>-Poly[[[5-(2-pyridyl)tetrazolato-κ^2^<i>N</i>^1^,<i>N</i>^5^]copper(II)]-μ-5-(2-pyridyl)tetrazolato-κ^2^<i>N</i>^1^,<i>N</i>^5^:<i>N</i>^3^]","Acta Crystallographica Section E","2007","63","12","m2894","m2894","10.1107/S1600536807053597","","","0.71073","MoKα","","0.0343","0.0249","","","0.0609","0.0662","","","","","","1.049","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216743","11.2424","0.0002","15.3773","0.0004","10.932","0.0002","90","","110.902","0.001","90","","1765.53","0.07","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ethyl 1-(2,4-dichlorophenyl)-5-phenyl-1<i>H</i>-pyrazole-3-carboxylate","","- C18 H14 Cl2 N2 O2 -","- C18 H14 Cl2 N2 O2 -","- C72 H56 Cl8 N8 O8 -","4","1","RZ2172","Machado, Pablo; T. Campos, Patrick; A. Rosa, Fernanda; A. P. Martins, Marcos","Ethyl 1-(2,4-dichlorophenyl)-5-phenyl-1<i>H</i>-pyrazole-3-carboxylate","Acta Crystallographica Section E","2007","63","12","o4741","o4741","10.1107/S1600536807057042","","","0.71073","MoKα","","0.0825","0.0553","","","0.1732","0.2025","","","","","","1.101","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216744","10.886","0.007","9.526","0.006","21.734","0.014","90","","102.672","0.012","90","","2199","2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-Diethyl-1,1'-(4-oxoheptane-1,7-diyl)di-1H-benzimidazole","","- C25 H30 N4 O -","- C25 H30 N4 O -","- C100 H120 N16 O4 -","4","1","RZ2173","Lai-Ping Zhang; Jian-Fang Ma; Zhi-Fang Jia; Guo-Hua Wei","2,2'-Diethyl-1,1'-(4-oxoheptane-1,7-diyl)di-1<i>H</i>-benzimidazole","Acta Crystallographica Section E","2007","63","12","o4831","o4831","10.1107/S1600536807059685","","","0.71069","MoKα","","0.1025","0.0482","","","0.1075","0.1299","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216745","15.882","0.003","25.123","0.004","14.133","0.003","90","","100.882","0.018","90","","5537.7","1.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3,5-Bis[4-(diethylamino)benzylidene]-1,1-dimethyl-4-oxopiperidinium iodide","","- C29 H40 I N3 O -","- C29 H40 I N3 O -","- C232 H320 I8 N24 O8 -","8","2","RZ2174","Vladimir N. Nesterov; Sergey S. Sarkisov; Michael J. Curley; Augustine Urbas; Tania Ruiz","3,5-Bis[4-(diethylamino)benzylidene]-1,1-dimethyl-4-oxopiperidinium iodide: a prospective biophotonic material","Acta Crystallographica Section E","2007","63","12","o4784","o4784","10.1107/S1600536807058667","","","0.71073","MoKα","","0.0416","0.0378","","","0.087","0.0894","","","","","","1.019","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216746","11.496","0.0015","7.74","0.0016","13.609","0.003","90","","103.14","0.003","90","","1179.2","0.4","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","<i>catena</i>-Poly[[[bis(benzoato-κ<i>O</i>)copper(II)]-μ-1,1'- (3-oxapentane-1,5-diyl)diimidazole] monohydrate]","","- C24 H26 Cu N4 O6 -","- C24 H26 Cu N4 O6 -","- C48 H52 Cu2 N8 O12 -","2","0.5","RZ2175","Guo-Hua Wei; Jie Liu; Hong-Ye Bai; Jin Yang","<i>catena</i>-Poly[[[bis(benzoato-κ<i>O</i>)copper(II)]-μ-1,1'-(3-oxapentane-1,5-diyl)diimidazole] monohydrate]","Acta Crystallographica Section E","2007","63","12","m3146","m3146","10.1107/S160053680705996X","","","0.71073","MoKα","","0.0647","0.0458","","","0.1161","0.1234","","","","","","1.096","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216747","18.5985","0.0014","10.571","0.0008","12.0814","0.001","90","","95.105","0.001","90","","2365.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Ferrocenyl-3-(4-n-octoxylphenyl)propane-1,3-dione","","- C27 H32 Fe O3 -","- C27 H32 Fe O3 -","- C108 H128 Fe4 O12 -","4","1","SF3061","Shang, Yadong; Li, Baoguo; Hu, Ruijue; Su, Yongsheng; Tang, Qun","1-Ferrocenyl-3-(4-<i>n</i>-octoxylphenyl)propane-1,3-dione","Acta Crystallographica Section E","2007","63","12","m3020","m3020","10.1107/S1600536807057005","","","0.71073","MoKα","","0.0499","0.0398","","","0.0992","0.103","","","","","","0.964","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216748","9.8972","0.0005","19.9625","0.0011","7.4737","0.0004","90","","107.18","0.002","90","","1410.72","0.13","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(2,4-Difluorophenyl)-2-(N-methylcarbamoyl)phenyl acetate","","- C16 H13 F2 N O3 -","- C16 H13 F2 N O3 -","- C64 H52 F8 N4 O12 -","4","1","SG2190","Guang-Xiang Zhong; Jian Li; Ren-Hua Zheng; Kun Zhao","4-(2,4-Difluorophenyl)-2-(<i>N</i>-methylcarbamoyl)phenyl acetate","Acta Crystallographica Section E","2007","63","12","o4583","o4583","10.1107/S1600536807052361","","","0.71073","MoKα","","0.0552","0.0436","","","0.1208","0.1302","","","","","","1.048","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216749","20.207","0.003","11.7918","0.0013","14.3531","0.0016","90","","129.875","0.002","90","","2624.7","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[3-chloro-6-(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl-κN^2^)picolinato- κ^2^N,O]cobalt(II) 2.5-hydrate","","- C22 H23 Cl2 Co N6 O6.5 -","- C22 H23 Cl2 Co N6 O6.5 -","- C88 H92 Cl8 Co4 N24 O26 -","4","0.5","SG2193","Kai Zhao; Xian-Hong Yin; Yu Feng; Jie Zhu","Bis[3-chloro-6-(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl-κ<i>N</i>^2^)picolinato-κ^2^<i>N</i>,<i>O</i>]cobalt(II) 2.5-hydrate","Acta Crystallographica Section E","2007","63","12","m3024","m3024","10.1107/S1600536807050623","","","0.71073","MoKα","","0.0564","0.0408","","","0.1125","0.1295","","","","","","1.093","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216750","9.8071","0.0009","10.8388","0.0012","12.6766","0.0016","71.334","0.002","74.505","0.002","84.772","0.003","1230.2","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis[6-(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl-κN^2^)picolinato-κ^2^N,O]zinc(II) trihydrate","","- C22 H26 N6 O7 Zn -","- C22 H26 N6 O7 Zn -","- C44 H52 N12 O14 Zn2 -","2","1","SG2196","Xian-Hong Yin; Kai Zhao; Yu Feng; Jie Zhu","Bis[6-(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl-κ<i>N</i>^2^)picolinato-κ^2^<i>N</i>,<i>O</i>]zinc(II) trihydrate","Acta Crystallographica Section E","2007","63","12","m2926","m2926","10.1107/S1600536807054608","","","0.71073","MoKα","","0.0614","0.0417","","","0.113","0.1247","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216751","18.422","0.004","7.339","0.0015","11.797","0.002","90","","107.92","0.03","90","","1517.6","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Chloro-N'-[4-(dimethylamino)benzylidene]nicotinohydrazide monohydrate","","- C15 H17 Cl N4 O2 -","- C15 H17 Cl N4 O2 -","- C60 H68 Cl4 N16 O8 -","4","1","SG2197","Feng Zhi","6-Chloro-<i>N</i>'-[4-(dimethylamino)benzylidene]nicotinohydrazide monohydrate","Acta Crystallographica Section E","2007","63","12","o4722","o4722","10.1107/S160053680705800X","","","0.71073","MoKα","","0.0959","0.0585","","","0.1381","0.1546","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216752","9.5579","0.001","7.0127","0.0008","24.231","0.003","90","","90","","90","","1624.1","0.3","100","2","100","2","100","","","","","","","5","C m c a","-C 2ac 2","64","","Sodium benzenesulfonothioate","","- C6 H5 Na O2 S2 -","- C6 H5 Na O2 S2 -","- C48 H40 Na8 O16 S16 -","8","","SG2202","Rothenberger, Alexander; Langer, Robert","Sodium benzenesulfonothioate","Acta Crystallographica Section E","2007","63","12","m3093","m3093","10.1107/S1600536807059065","","","0.71073","MoKα","","0.0429","0.0323","","","0.0748","0.0786","","","","","","1.051","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216753","11.775","0.0006","12.4122","0.0006","32.621","0.002","90","","90","","90","","4767.7","0.4","134","2","134","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","tetra-tertiary butyl chromocene","Bis(η^5^-1,3-di-tert-butylcyclopentadienyl)chromium(II)","","- C26 H42 Cr -","- C26 H42 Cr -","- C208 H336 Cr8 -","8","1","SG2205","Schultz, Madeleine","Bis(η^5^-1,3-di-<i>tert</i>-butylcyclopentadienyl)chromium(II)","Acta Crystallographica Section E","2007","63","12","m3085","m3085","10.1107/S1600536807059491","","","0.71073","MoKα","","0.0966","0.0435","","","0.0985","0.1138","","","","","","1.022","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216754","17.972","0.002","4.5618","0.0006","14.303","0.002","90","","90","","90","","1172.6","0.3","298","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","3-Chloro-6-(3,5-dimethyl-1H-pyrazol-1-yl)picolinic acid","","- C11 H10 Cl N3 O2 -","- C11 H10 Cl N3 O2 -","- C44 H40 Cl4 N12 O8 -","4","1","SG2207","Kai, Zhao; Xian-Hong Yin; Yu Feng; Yue Zhuang; Fei-Long Hu","3-Chloro-6-(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)picolinic acid","Acta Crystallographica Section E","2007","63","12","o4801","o4801","10.1107/S160053680705903X","","","0.71073","MoKα","","0.0486","0.0414","","","0.1078","0.1138","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216755","13.1258","0.0013","10.8384","0.001","10.585","0.001","90","","106.597","0.002","90","","1443.1","0.2","295","","295","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","μ-Glycine-κ^2^<i>O</i>:<i>O'</i>-di-μ-sulfido- bis[(glycinato-κ^2^<i>N</i>,<i>O</i>)oxidomolybdenum(V)]","","- C6 H13 Mo2 N3 O8 S2 -","- C6 H13 Mo2 N3 O8 S2 -","- C24 H52 Mo8 N12 O32 S8 -","4","1","SI2039","Li, Ya Min; Li, Yong Hong; Zhai, Cui Ping","μ-Glycine-κ^2^<i>O</i>:<i>O</i>'-di-μ-sulfido-bis[(glycinato-κ^2^<i>N</i>,<i>O</i>)oxidomolybdenum(V)]","Acta Crystallographica Section E","2007","63","12","m2931","m2931","10.1107/S1600536807054761","","","0.71073","MoKα","","","0.0869","","","0.1545","0.1779","","","","","","1.109","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216756","3.9689","0.0002","15.1778","0.0008","16.5995","0.0008","90","","95.083","0.003","90","","996.01","0.09","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-amino-4,6-dimethyl pyrimidine terephthalic acid","2-amino-4,6-dimethylpyrimidine‒terephthalic acid (2/1)","","- C20 H24 N6 O4 -","- C20 H24 N6 O4 -","- C40 H48 N12 O8 -","2","0.5","SI2041","Periasamy Devi; Packianathan Thomas Muthiah","Hydrogen-bonding patterns in the cocrystal 2-amino-4,6-dimethylpyrimidine‒terephthalic acid (2/1)","Acta Crystallographica Section E","2007","63","12","o4822","o4823","10.1107/S1600536807059703","","","0.71073","MoKα","","0.0572","0.0416","","","0.1147","0.1231","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216757","13.9896","0.0002","6.8923","0.0001","21.8748","0.0003","90","","90","","90","","2109.18","0.05","291","2","291","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Poly[di-μ~4~-benzene-1,4-dicarboxylato-μ~6~-succinato-disamarium(III)]","","- C20 H12 O12 Sm2 -","- C20 H12 O12 Sm2 -","- C80 H48 O48 Sm8 -","4","0.5","SI2044","Qin He; Bao-Jun Huang","Poly[di-μ~4~-benzene-1,4-dicarboxylato-μ~6~-succinato-disamarium(III)]","Acta Crystallographica Section E","2007","63","12","m2923","m2923","10.1107/S1600536807055006","","","0.71073","MoKα","","0.0303","0.0209","","","0.0438","0.0465","","","","","","1.026","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216758","16.515","0.001","14.3026","0.0009","5.728","0.0003","90","","91.284","0.005","90","","1352.66","0.14","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Chalcone","(2E)-3-(4-Chlorophenyl)-1-[4-(methylsulfanyl)phenyl]prop-2-en-1-one","","- C16 H13 Cl O S -","- C16 H13 Cl O S -","- C64 H52 Cl4 O4 S4 -","4","1","SI2045","A. Thiruvalluvar; M. Subramanyam; R. J. Butcher; A. V. Adhikari; T. Karabasanagouda","(2<i>E</i>)-3-(4-Chlorophenyl)-1-[4-(methylsulfanyl)phenyl]prop-2-en-1-one","Acta Crystallographica Section E","2007","63","12","o4716","o4716","10.1107/S1600536807056656","","","0.71073","MoKα","","0.0858","0.0352","","","0.0702","0.0772","","","","","","0.859","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216759","7.278","0.0002","14.3556","0.0003","10.7002","0.0002","90","","99.433","0.001","90","","1102.84","0.04","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-[3-(1<i>H</i>-Indol-2-yl)-2-furyl]ethanone","","- C14 H11 N O2 -","- C14 H11 N O2 -","- C56 H44 N4 O8 -","4","2","SI2046","Fernandes, Manuel A.; de Koning, Charles B.; Perry, Christopher B.; Pelly, Stephen C.","1-[3-(1<i>H</i>-Indol-2-yl)-2-furyl]ethanone","Acta Crystallographica Section E","2007","63","12","o4695","o4696","10.1107/S1600536807057431","","","0.71073","MoKα","","0.0511","0.0364","","","0.0922","0.0999","","","","","","1.057","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216760","8.1354","0.0016","9.477","0.0019","10.094","0.002","84.66","0.03","67.17","0.03","65.36","0.03","649.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","<i>catena</i>-Poly[[bis(pyridine-κN)nickel(II)]-di-μ-azido-κ^4^N^1^:N^3^- [bis(pyridine-κN)nickel(II)]-di-μ-azido-κ^4^N^1^:N^1^]","","- C10 H10 N8 Ni -","- C10 H10 N8 Ni -","- C20 H20 N16 Ni2 -","2","1","SI2051","Song, Wei-Chao; Zhang, Ming-Jian; Tao, Ying; Li, Jian-Rong","<i>catena</i>-Poly[[bis(pyridine-κ<i>N</i>)nickel(II)]-di-μ-azido-κ^4^<i>N</i>^1^:<i>N</i>^3^-[bis(pyridine-κ<i>N</i>)nickel(II)]-di-μ-azido-κ^4^<i>N</i>^1^:<i>N</i>^1^]","Acta Crystallographica Section E","2007","63","12","m3062","m3062","10.1107/S1600536807058485","","","0.71073","MoKα","","0.0743","0.0605","","","0.1563","0.1636","","","","","","1.075","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216761","6.6413","0.0008","10.1222","0.0013","12.2397","0.0015","87.23","0.01","75.462","0.009","73.142","0.01","761.97","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Zeise's dimer","Di-μ-chlorido-bid[chlorido(η^2^-ethene)platinum(II)]","","- C4 H8 Cl4 Pt2 -","- C4 H8 Cl4 Pt2 -","- C12 H24 Cl12 Pt6 -","3","1.5","SI2052","Boag, Neil M.; Ravetz, Megan S.","Di-μ-chlorido-bis[chlorido(η^2^-ethene)platinum(II)]","Acta Crystallographica Section E","2007","63","12","m3103","m3104","10.1107/S1600536807059636","","","0.71073","MoKα","","0.0774","0.054","","","","0.1402","","","","","","1.077","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216762","35.062","0.005","5.3648","0.0006","13.488","0.002","90","","98.994","0.006","90","","2505.9","0.6","113","2","113","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","4-(4-n-propylcyclohexyl)phenol","","- C15 H22 O -","- C15 H22 O -","- C120 H176 O8 -","8","1","SJ2360","Hui-Xin Zhang; Bao-Hua Tang; Xiu-Hong Jin","4-(4-<i>n</i>-Propylcyclohexyl)phenol","Acta Crystallographica Section E","2007","63","12","o4520","o4520","10.1107/S1600536807046120","","","0.7107","MoKα","","0.0718","0.0578","","","0.1221","0.1298","","","","","","1.131","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216763","8.9356","0.0018","14.226","0.003","16.988","0.003","90","","92.34","0.03","90","","2157.7","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(E)-4-[4-(Dimethylamino)styryl]-1-isopropylpyridinium diiodidoargentate(I)","","- C18 H23 Ag I2 N2 -","- C18 H23 Ag I2 N2 -","- C72 H92 Ag4 I8 N8 -","4","1","SJ2367","Yang-Feng Liu; Min Lin; Chang-Cang Huang; Jian-Zhong Chen","(<i>E</i>)-4-[4-(Dimethylamino)styryl]-1-isopropylpyridinium diiodidoargentate(I)","Acta Crystallographica Section E","2007","63","12","m2970","m2970","10.1107/S1600536807048441","","","0.71073","MoKα","","0.0924","0.0534","","","0.1622","0.1842","","","","","","1.1","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2216764","7.478","0.0006","15.822","0.002","12.6372","0.0013","90","","94.149","0.009","90","","1491.3","0.3","296","","296","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","(6Z)-3-Diethylamino-6-(3-hydroxyanilinomethylene)cyclohexa-2,4-dien-1-one","","- C17 H20 N2 O2 -","- C17 H20 N2 O2 -","- C68 H80 N8 O8 -","4","1","SJ2389","Jasinski, Jerry P.; Butcher, Ray J.; Narayana, B.; Swamy, M. T.; Yathirajan, H. S.","(6<i>Z</i>)-3-Diethylamino-6-(3-hydroxyanilinomethylene)cyclohexa-2,4-dien-1-one","Acta Crystallographica Section E","2007","63","12","o4566","o4567","10.1107/S1600536807053652","","","0.71073","MoKα","","0.2058","0.0826","","","0.2054","0.2699","","","","","","1.019","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216765","21.876","0.006","10.652","0.003","14.12","0.004","90","","95.398","0.006","90","","3275.7","1.6","120","2","120","2","","","","","","","","5","C 1 2 1","C 2y","5","","(4S,5S)-4,5-Bis(3-cyclohexyl-2-thioxobenzimidazol-1-ylmethyl)-2,2-dimethyl-\ 1,3-dioxolane","","- C33 H42 N4 O2 S2 -","- C33 H42 N4 O2 S2 -","- C132 H168 N16 O8 S8 -","4","1","SJ2390","Marshall, Colin; Harrison, William T. A.","(4<i>S</i>,5<i>S</i>)-4,5-Bis(3-cyclohexyl-2-thioxobenzimidazol-1-ylmethyl)-2,2-dimethyl-1,3-dioxolane from synchrotron data","Acta Crystallographica Section E","2007","63","12","o4502","o4502","10.1107/S1600536807053342","","","0.6871","synchrotron","","0.08","0.0549","","","0.1174","0.1284","","","","","","0.996","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216766","10.1223","0.0012","9.6013","0.0011","21.003","0.003","90","","93.826","0.002","90","","2036.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(5,7-Dibromoquinolin-8-yloxy)-<i>N</i>,<i>N</i>-diphenylacetamide","","- C23 H16 Br2 N2 O2 -","- C23 H16 Br2 N2 O2 -","- C92 H64 Br8 N8 O8 -","4","1","SJ2391","Sai Bi; Xiao-Hui Wu; Xiao-Fang Tang; Yong-Hong Wen","2-(5,7-Dibromoquinolin-8-yloxy)-<i>N</i>,<i>N</i>-diphenylacetamide","Acta Crystallographica Section E","2007","63","12","o4521","o4521","10.1107/S160053680705369X","","","0.71073","MoKα","","0.0976","0.0499","","","0.093","0.1103","","","","","","0.962","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216767","20.247","0.005","10.764","0.003","15.973","0.004","90","","105.462","0.003","90","","3355.1","1.5","291","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(2-amino-1-benzylpyridinium) bis(2,2-dicyanoethene-1,1-dithiolato- κ^2^<i>S</i>,<i>S'</i>)nickelate(II)","","- C32 H26 N8 Ni S4 -","- C32 H26 N8 Ni S4 -","- C128 H104 N32 Ni4 S16 -","4","0.5","SJ2392","Yong Hou; Qian Huang; Hongrong Zuo; Chunlin Ni","Bis(2-amino-1-benzylpyridinium) bis(2,2-dicyanoethene-1,1-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(II)","Acta Crystallographica Section E","2007","63","12","m2903","m2903","10.1107/S1600536807053834","","","0.71073","MoKα","","0.0936","0.0455","","","0.1274","0.1511","","","","","","1.05","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216768","9.558","0.005","19.788","0.005","14.608","0.005","90","","103.67","0.005","90","","2684.6","1.8","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Carbonyl(5-chloroquinolin-8-olato-κ^2^N,O)[tris(4-chlorophenyl)phosphine- κP]rhodium(I)","","- C28 H17 Cl4 N O2 P Rh -","- C28 H17 Cl4 N O2 P Rh -","- C112 H68 Cl16 N4 O8 P4 Rh4 -","4","1","SJ2393","Janse van Rensburg, J. Marthinus; Muller, Alfred; Roodt, Andreas","Carbonyl(5-chloroquinolin-8-olato-κ^2^<i>N</i>,<i>O</i>)[tris(4-chlorophenyl)phosphine-κ<i>P</i>]rhodium(I)","Acta Crystallographica Section E","2007","63","12","m3015","m3016","10.1107/S1600536807056152","","","0.71073","MoKα","","","0.0362","","","","0.0679","","","","","","0.881","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216769","9.331","0.009","13.136","0.008","13.614","0.009","95.63","0.04","103.87","0.05","91.64","0.04","1610","2","400","2","400","2","","","","","","","","3","P -1","-P 1","2","","trans-1,2-Difluoro-3,4,5,6,7,8-hexaphenyltricyclo[4.2.0.0^2,5^]octa-3,7-diene","","- C44 H30 F2 -","- C44 H30 F2 -","- C88 H60 F4 -","2","1","SJ2394","Deepak Chopra; K.Nagarajan; J.D. Roberts; T. N. Guru Row","<i>trans</i>-1,2-Difluoro-3,4,5,6,7,8-hexaphenyltricyclo[4.2.0.0^2,5^]octa-3,7-diene","Acta Crystallographica Section E","2007","63","12","o4557","o4557","10.1107/S1600536807054281","","","0.71073","MoKα","","0.1161","0.0759","","","0.2156","0.241","","","","","","1.1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216770","23.4332","0.0006","16.3878","0.0004","14.2963","0.0004","90","","93.988","0.001","90","","5476.8","0.2","100","0.1","100","0.1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","{4,4'-dimethoxy-2,2'-[propane-1,2-diylbis(nitrilomethylidyne)]diphenolato}methanol(pyridine)manganese(III) hexafluorophosphate‒{4,4'-dimethoxy-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}methanol(pyridine)manganese(III) hexafluorophosphate (1/1)","","- C49 H56 F12 Mn2 N6 O10 P2 -","- C49 H56 F12 Mn2 N6 O10 P2 -","- C196 H224 F48 Mn8 N24 O40 P8 -","4","0.5","SJ2395","Mohammad Hossein Habibi; Elham Askari; Suchada Chantrapromma; Hoong-Kun Fun","The cocrystal {4,4'-dimethoxy-2,2'-[propane-1,2-diylbis(nitrilomethylidyne)]diphenolato}methanol(pyridine)manganese(III) hexafluoridophosphate‒{4,4'-dimethoxy-2,2'-[ethane-1,2-diylbis(nitrilomethylidyne)]diphenolato}methanol(pyridine)manganese(III) hexafluoridophosphate (1/1)","Acta Crystallographica Section E","2007","63","12","m2905","m2906","10.1107/S1600536807053883","","","0.71073","MoKα","","0.0595","0.0493","","","0.1311","0.1381","","","","","","1.044","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216771","7.985","0.003","8.594","0.003","11.02","0.004","87.801","0.006","76.688","0.007","65.18","0.005","666.5","0.4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","2,4-Dibromo-6-(4-bromophenyliminomethyl)phenol","","- C13 H8 Br3 N O -","- C13 H8 Br3 N O -","- C26 H16 Br6 N2 O2 -","2","1","SJ2397","Guo, Ming-Lin; Zhang, Li","2,4-Dibromo-6-(4-bromophenyliminomethyl)phenol","Acta Crystallographica Section E","2007","63","12","o4558","o4558","10.1107/S1600536807054335","","","0.71073","MoKα","","0.1076","0.0664","","","0.168","0.1985","","","","","","0.981","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216772","19.158","0.004","14.956","0.003","19.598","0.004","90","","108.785","0.004","90","","5316.2","1.9","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[1-(3-cyanobenzyl)triphenylphosphonium] bis(1,2-dicyanoethene-1,2- dithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(II)","","- C60 H42 N6 Ni P2 S4 -","- C60 H42 N6 Ni P2 S4 -","- C240 H168 N24 Ni4 P8 S16 -","4","1","SJ2398","Chun-lin Ni; Jia-rong Zhou; Yong Hou","Bis[1-(3-cyanobenzyl)triphenylphosphonium] bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickelate(II)","Acta Crystallographica Section E","2007","63","12","m2904","m2904","10.1107/S160053680705430X","","","0.71073","MoKα","","0.0898","0.0614","","","0.1309","0.1391","","","","","","1.09","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216773","7.7509","0.0018","9.182","0.002","12.563","0.003","73.058","0.003","76.442","0.003","71.7","0.003","801.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","3-(Benzotriazol-1-yl)-2,2-dibromo-1-(2-chlorophenyl)propan-1-one","","- C15 H10 Br2 Cl N3 O -","- C15 H10 Br2 Cl N3 O -","- C30 H20 Br4 Cl2 N6 O2 -","2","1","SJ2399","Ying-Jie Zhu; Meng Wang; Jian-Li Bi; Fang Li","3-(Benzotriazol-1-yl)-2,2-dibromo-1-(2-chlorophenyl)propan-1-one","Acta Crystallographica Section E","2007","63","12","o4548","o4548","10.1107/S1600536807054700","","","0.71073","MoKα","","0.0335","0.0269","","","0.0676","0.0709","","","","","","1.044","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216774","10.94","0.002","13.673","0.003","8.69","0.0017","90","","92.88","0.03","90","","1298.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Bromo-N'-(2-hydroxybenzylidene)nicotinohydrazide","","- C13 H10 Br N3 O2 -","- C13 H10 Br N3 O2 -","- C52 H40 Br4 N12 O8 -","4","1","SJ2400","Chun-Bao Tang","5-Bromo-<i>N</i>'-(2-hydroxybenzylidene)nicotinohydrazide","Acta Crystallographica Section E","2007","63","12","o4545","o4545","10.1107/S1600536807054712","","","0.71073","MoKα","","0.1165","0.0573","","","0.113","0.1366","","","","","","1.004","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216775","9.5567","0.0006","12.0442","0.0011","14.8593","0.0015","76.025","0.011","75.445","0.009","76.22","0.008","1577.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","1-spiro-2'-pyrrolidine-3'-spiro-3''-piperidine-2,4''-dione","4-(4-Chlorophenyl)-5-phenylpyrrolo-(spiro[2.2'']-acenaphthene- 1''-one)-spiro[3.3']-5'-(4-chlorophenylmethylidene)-1'- methyltetrahydro-4'-(1H)-pyridinone","","- C39 H30 Cl2 N2 O2 -","- C39 H30 Cl2 N2 O2 -","- C78 H60 Cl4 N4 O4 -","2","1","SJ2401","S. Athimoolam; R. Ranjith Kumar; K. Vijaya; R. Sayee Kannan; S. Perumal","5''-(4-Chlorobenzylidene)-4'-(4-chlorophenyl)-1''-methyl-5'-phenylacenaphthene-1-spiro-2'-pyrrolidine-3'-spiro-3''-piperidine-2,4''-dione","Acta Crystallographica Section E","2007","63","12","o4635","o4636","10.1107/S1600536807055109","","","0.71073","MoKα","","0.0929","0.0484","","","0.1192","0.1424","","","","","","1.015","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216776","14.3347","0.0003","9.6644","0.0002","15.6369","0.0003","90","","100.865","0.001","90","","2127.45","0.08","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[5,10,15,20-Tetrakis(4-methoxyphenyl)porphinato]zinc(II) tetrachloroethane solvate","","- C50 H38 Cl4 N4 O4 Zn -","- C50 H38 Cl4 N4 O4 Zn -","- C100 H76 Cl8 N8 O8 Zn2 -","2","0.5","SJ2403","Puttaiah Bhyrappa; Karuppaiah Karunanithi; Babu Varghese","[5,10,15,20-Tetrakis(4-methoxyphenyl)porphinato]zinc(II) 1,1,2,2-tetrachloroethane solvate","Acta Crystallographica Section E","2007","63","12","m3201","m3202","10.1107/S1600536807058941","","","0.71073","MoKα","","0.0389","0.035","","","0.0896","0.0931","","","","","","1.077","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216777","7.437","0.002","10.045","0.003","14.299","0.004","98.397","0.004","92.789","0.004","98.676","0.003","1041.9","0.5","293","2","298","2","","","","","","","","5","P -1","-P 1","2","","N'-(3,3,7,7-Tetramethyl-1,5-dioxaspiro[5,5]undecane-8-ylidene)- p-toluenesulfonohydrazide","","- C20 H30 N2 O4 S -","- C20 H30 N2 O4 S -","- C40 H60 N4 O8 S2 -","2","1","SJ2404","Zhu, Xiaolei; Zou, Liwei; Xu, Yongting; Han, Jing; Zhang, Chenglu","<i>N</i>'-(3,3,7,7-Tetramethyl-1,5-dioxaspiro[5,5]undecane-8-ylidene)-<i>p</i>-toluenesulfonohydrazide","Acta Crystallographica Section E","2007","63","12","o4931","o4931","10.1107/S160053680705893X","","","0.71073","MoKα","","0.0524","0.0442","","","0.1191","0.1268","","","","","","1.036","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216778","11.062","0.0013","10.2689","0.0013","8.0586","0.0008","90","","90","","90","","915.41","0.18","296","","296","","","","","","","","","5","P c a 21","P 2c -2ac","29","N-(2-fluorophenyl)succinimide","1-(2-fluorophenyl)pyrrolidine-2,5-dione","","- C10 H8 F N O2 -","- C10 H8 F N O2 -","- C40 H32 F4 N4 O8 -","4","1","SJ2405","Odabas̨oǧlu, Mustafa; Büyükgüngör, Orhan","A redetermination of 1-(2-fluorophenyl)pyrrolidine-2,5-dione","Acta Crystallographica Section E","2007","63","12","o4669","o4670","10.1107/S1600536807056140","","","0.71073","MoKα","","0.0376","0.0324","","","0.0925","0.0952","","","","","","1.062","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216779","6.827","0.005","20.732","0.009","14.071","0.008","90","","93.68","0.02","90","","1987","2","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(4R,5R)-2,2-Dimethyl-4,5-bis[2-(3-methyl-2-thioxo-2,3-dihydro-1H- imidazol-2-yl)ethyl]-1,3-dioxolane","","- C17 H26 N4 O2 S2 -","- C17 H26 N4 O2 S2 -","- C68 H104 N16 O8 S8 -","4","2","SJ2406","Marshall, Colin; Harrison, William T. A.","(4<i>R</i>,5<i>R</i>)-2,2-Dimethyl-4,5-bis[2-(3-methyl-2-thioxo-2,3-dihydro-1<i>H</i>-imidazol-2-yl)ethyl]-1,3-dioxolane","Acta Crystallographica Section E","2007","63","12","o4878","o4878","10.1107/S160053680706148X","","","0.71073","MoKα","","0.2048","0.0968","","","0.2032","0.2405","","","","","","1.014","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216780","11.32","0.004","13.354","0.005","14.754","0.005","110.776","0.007","101.261","0.006","97.88","0.007","1992.7","1.2","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","Bis[2-(4-bromobenzyl)isoquinolinium] bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickel(II)","","- C40 H26 Br2 N6 Ni S4 -","- C40 H26 Br2 N6 Ni S4 -","- C80 H52 Br4 N12 Ni2 S8 -","2","1","SJ2407","Ai-Qun Zhou; Jia-Rong Zhou; Chun-Lin Ni","Bis[2-(4-bromobenzyl)isoquinolinium] bis(1,2-dicyanoethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')nickel(II)","Acta Crystallographica Section E","2007","63","12","m2980","m2980","10.1107/S1600536807055821","","","0.71073","MoKα","","0.1198","0.0655","","","0.1387","0.1472","","","","","","1.036","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216781","8.5734","0.0005","9.7735","0.0007","11.0781","0.0009","109.03","0.011","100.769","0.015","103.813","0.016","815.96","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 6-amino-2-(chloromethyl)-5-cyano-4-o-tolyl-4H-pyran-3-carboxylate","","- C17 H17 Cl N2 O3 -","- C17 H17 Cl N2 O3 -","- C34 H34 Cl2 N4 O6 -","2","1","SJ2408","S. Athimoolam; N. Savitha Devi; S. Asath Bahadur; R. Sayee Kannan; S. Perumal","Ethyl 6-amino-2-(chloromethyl)-5-cyano-4-<i>o</i>-tolyl-4<i>H</i>-pyran-3-carboxylate","Acta Crystallographica Section E","2007","63","12","o4680","o4681","10.1107/S160053680705581X","","","0.71073","MoKα","","0.0728","0.0411","","","0.1037","0.1311","","","","","","1.059","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216782","11.0539","0.0009","20.906","0.0016","11.2905","0.0009","90","","101.667","0.001","90","","2555.2","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(μ-4-hydroxybenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(2,9-dimethyl-1,10- phenanthroline-κ^2^<i>N</i>,<i>N</i>')(4-hydroxybenzoato- κ^2^<i>O</i>,<i>O</i>')lead(II)]","","- C56 H44 N4 O12 Pb2 -","- C56 H44 N4 O12 Pb2 -","- C112 H88 N8 O24 Pb4 -","2","0.5","SJ2410","Zhao, Pei-Zheng; Xuan, Xiao-Peng; Tang, Qing-Hu","Bis(μ-4-hydroxybenzoato-κ^2^<i>O</i>:<i>O</i>')bis[(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(4-hydroxybenzoato-κ^2^<i>O</i>,<i>O</i>')lead(II)]","Acta Crystallographica Section E","2007","63","12","m3042","m3043","10.1107/S1600536807057868","","","0.71073","MoKα","","0.0238","0.0184","","","0.0408","0.0423","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216783","13.3435","0.0003","13.3741","0.0003","15.9408","0.0003","90","","96.166","0.001","90","","2828.29","0.1","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(2,2'-bipyridine)[5,5'-iminobis(tetrazolato)]nickel(II) hexahydrate","","- C22 H29 N13 Ni O6 -","- C22 H29 N13 Ni O6 -","- C88 H116 N52 Ni4 O24 -","4","1","SJ2411","Liu, Xing-Ping; Zhang, Chi","Bis(2,2'-bipyridine)[5,5'-iminobis(tetrazolato)]nickel(II) hexahydrate","Acta Crystallographica Section E","2007","63","12","m3063","m3064","10.1107/S1600536807058370","","","0.71073","MoKα","","0.037","0.028","","","0.0699","0.0747","","","","","","1.031","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216784","5.259","0.001","16.342","0.001","8.143","0.001","90","","97.939","0.001","90","","693.12","0.16","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Poly[μ~6~-benzene-1,2,4,5-tetracarboxylato- κ^6^O^1^:O^2^:O^2'^:O^4^:O^5^:O^5'^-bis[diaquazinc(II)]]","","- C10 H10 O12 Zn2 -","- C10 H10 O12 Zn2 -","- C20 H20 O24 Zn4 -","2","0.5","SJ2412","Wang, Jun; Lu, Lu; Yang, Bin; Zhao, Bao-Zhong; Ng, Seik Weng","Poly[μ~6~-benzene-1,2,4,5-tetracarboxylato-κ^6^<i>O</i>^1^:<i>O</i>^2^:<i>O</i>^2'^:<i>O</i>^4^:<i>O</i>^5^:<i>O</i>^5'^-bis[diaquazinc(II)]]","Acta Crystallographica Section E","2007","63","12","m2986","m2986","10.1107/S1600536807056164","","","0.71073","MoKα","","0.0254","0.0242","","","0.0647","0.0656","","","","","","1.056","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216785","4.94","0.001","8.075","0.0016","18.598","0.004","101.98","0.03","90.88","0.03","98.93","0.03","716.1","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","6-Chloro-<i>N</i>'-(3,5-dibromo-2-hydroxybenzylidene)nicotinohydrazide","","- C13 H8 Br2 Cl N3 O2 -","- C13 H8 Br2 Cl N3 O2 -","- C26 H16 Br4 Cl2 N6 O4 -","2","1","SJ2413","Shan-Shan Huang; Qin Zhou; Yun-Peng Diao","6-Chloro-<i>N</i>'-(3,5-dibromo-2-hydroxybenzylidene)nicotinohydrazide","Acta Crystallographica Section E","2007","63","12","o4659","o4659","10.1107/S1600536807056395","","","0.71073","MoKα","","0.0847","0.0456","","","0.0891","0.1033","","","","","","0.954","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216786","6.898","0.0013","7.2012","0.0014","12.8","0.002","100.28","0.003","93.084","0.003","111.459","0.003","577.31","0.18","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","Piperazine-1,4-diium bis(3-carboxy-4-hydroxybenzenesulfonate) dihydrate","","- C18 H26 N2 O14 S2 -","- C18 H26 N2 O14 S2 -","- C18 H26 N2 O14 S2 -","1","0.5","SJ2414","Zhen-Huan Li; Kun-Mei, Su","Piperazine-1,4-diium bis(3-carboxy-4-hydroxybenzenesulfonate) dihydrate","Acta Crystallographica Section E","2007","63","12","o4744","o4744","10.1107/S1600536807057856","","","0.71073","MoKα","","0.0402","0.0348","","","0.0973","0.1036","","","","","","1.037","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216787","17.6356","0.0014","8.4593","0.0006","9.3809","0.0006","90","","90","","90","","1399.49","0.17","296","","296","","","","","","","","","5","P c a 21","P 2c -2ac","29","","4-Methyl-N-(3-oxo-1,3-dihydroisobenzofuran-1-yl)benzenesulfonamide","","- C15 H13 N O4 S -","- C15 H13 N O4 S -","- C60 H52 N4 O16 S4 -","4","1","SJ2415","Odabaşoğlu, Mustafa; Büyükgüngör, Orhan","4-Methyl-<i>N</i>-(3-oxo-1,3-dihydroisobenzofuran-1-yl)benzenesulfonamide","Acta Crystallographica Section E","2007","63","12","o4730","o4730","10.1107/S1600536807057595","","","0.71073","MoKα","","0.0504","0.0414","","","0.1056","0.1102","","","","","","0.976","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216788","14.078","0.0008","14.2074","0.0008","16.9442","0.001","90","","95.488","0.001","90","","3373.5","0.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(2,2'-Bipyridine-κ^2^<i>N</i>,N')(4'-ferrocenyl-2,2':6',2''-terpyridine- κ^3^<i>N</i>,N',N'')copper(II) bis(tetrafluoridoborate)","","- C35 H27 B2 Cu F8 Fe N5 -","- C35 H27 B2 Cu F8 Fe N5 -","- C140 H108 B8 Cu4 F32 Fe4 N20 -","4","1","SJ2416","Tang, Si-Ping; Kuang, Dai-Zhi","(2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')(4'-ferrocenyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')copper(II) bis(tetrafluoridoborate)","Acta Crystallographica Section E","2007","63","12","m3007","m3007","10.1107/S1600536807056991","","","0.71073","MoKα","","0.0801","0.059","","","0.1519","0.1633","","","","","","1.045","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216789","11.659","0.001","10.219","0.001","17.585","0.002","90","","102.272","0.003","90","","2047.3","0.4","139","2","139","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis{2'-[(5-chloro-1<i>H</i>-3-indolyl)methylene]-2-(1<i>H</i>-3- indolyl)acetohydrazido-κ^2^<i>N</i>,<i>O</i>}nickel(II) dimethyl sulfoxide disolvate","","- C42 H40 Cl2 N8 Ni O4 S2 -","- C42 H40 Cl2 N8 Ni O4 S2 -","- C84 H80 Cl4 N16 Ni2 O8 S4 -","2","0.5","SJ2417","Ali, Hapipah M.; Nazzatush, S. Jamaludin; Rizal, Mohd. Razali; Ng, Seik Weng","Bis{2'-[(5-chloro-1<i>H</i>-3-indolyl)methylene]-2-(1<i>H</i>-3-indolyl)acetohydrazido-κ^2^<i>N</i>,<i>O</i>}nickel(II) dimethyl sulfoxide disolvate","Acta Crystallographica Section E","2007","63","12","m3033","m3033","10.1107/S1600536807056966","","","0.71073","MoKα","","0.1534","0.0488","","","0.1115","0.198","","","","","","0.99","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216790","13.0563","0.0015","6.9804","0.0006","14.6138","0.0017","90","","106.237","0.003","90","","1278.8","0.2","169","2","169","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Infectopyrone","5-(4-methoxy-5-methyl-6-oxo-6H-pyran-2-yl)-3-methylhexa-2,4-dienoic acid","","- C14 H16 O5 -","- C14 H16 O5 -","- C56 H64 O20 -","4","1","SJ2418","Bloor, Stephen J.; Crump, Douglas R.; Gainsford, Graeme J.","5-(4-Methoxy-5-methyl-6-oxo-6<i>H</i>-pyran-2-yl)-3-methylhexa-2,4-dienoic acid","Acta Crystallographica Section E","2007","63","12","o4702","o4702","10.1107/S160053680705698X","","","0.71073","MoKα","","0.1399","0.0586","","","0.1251","0.1556","","","","","","0.996","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216791","7.1442","0.0014","11.147","0.002","14.726","0.003","90","","90","","90","","1172.7","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","4-(Phenylhydrazonomethyl)benzonitrile","","- C14 H11 N3 -","- C14 H11 N3 -","- C56 H44 N12 -","4","1","SJ2419","Wang, Guo-Xi; Ye, Heng-Yun","4-(Phenylhydrazonomethyl)benzonitrile","Acta Crystallographica Section E","2007","63","12","o4750","o4750","10.1107/S1600536807057984","","","0.71073","MoKα","","0.1033","0.0578","","","0.141","0.1702","","","","","","1.086","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216792","8.1521","0.0004","8.2671","0.0004","8.687","0.0004","104.585","0.002","99.92","0.002","97.62","0.002","548.52","0.05","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","5-Iodo-2-methyl-3-methylsulfinyl-1-benzofuran","","- C10 H9 I O2 S -","- C10 H9 I O2 S -","- C20 H18 I2 O4 S2 -","2","1","SJ2426","Choi, Hong Dae; Seo, Pil Ja; Son, Byeng Wha; Lee, Uk","5-Iodo-2-methyl-3-methylsulfinyl-1-benzofuran","Acta Crystallographica Section E","2007","63","12","o4811","o4811","10.1107/S1600536807059259","","","0.71073","MoKα","","0.0315","0.0279","","","0.0638","0.0663","","","","","","1.076","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216793","10.2622","0.001","29.432","0.003","9.6869","0.0011","90","","114.331","0.002","90","","2665.9","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chloridobis((<i>E</i>)-2-{(Z)-[(4- hydroxyphenyl)(oxido)methylene]hydrazono}propanoato)bismuth(III) pentahydrate","","- C20 H28 Bi Cl N4 O13 -","- C20 H28 Bi Cl N4 O13 -","- C80 H112 Bi4 Cl4 N16 O52 -","4","1","SJ2427","Jun Zhai; Handong Yin; Feng Li; Daqi Wang","Chloridobis((<i>E</i>)-2-{(Z)-[(4-hydroxyphenyl)(oxido)methylene]hydrazono}propanoato)bismuth(III) pentahydrate","Acta Crystallographica Section E","2007","63","12","m3066","m3066","10.1107/S1600536807059740","","","0.71073","MoKα","","0.0554","0.041","","","0.1","0.1058","","","","","","1.014","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216794","20.249","0.002","9.2011","0.0011","13.1621","0.0016","90","","126.193","0.001","90","","1979.1","0.4","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[2-(cyclopropyliminomethyl)-6-methoxyphenolato]cobalt(II)","","- C22 H24 Co N2 O4 -","- C22 H24 Co N2 O4 -","- C88 H96 Co4 N8 O16 -","4","0.5","SJ2429","San-Jun Peng; Cong-Shan Zhou","Bis[2-(cyclopropyliminomethyl)-6-methoxyphenolato]cobalt(II)","Acta Crystallographica Section E","2007","63","12","m3185","m3185","10.1107/S1600536807061880","","","0.71073","MoKα","","0.0325","0.03","","","0.0819","0.0834","","","","","","1.093","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216795","6.9062","0.0005","11.8955","0.0008","9.6702","0.0007","90","","106.402","0.001","90","","762.1","0.09","130","","130","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N,N'-bis(2-acetylphenyl) ethanediamide","","- C18 H16 N2 O4 -","- C18 H16 N2 O4 -","- C36 H32 N4 O8 -","2","0.5","SJ2430","Brewer, Greg A.; Jasinski, Jerry P.; Butcher, Ray J.; Scheidt, W. Robert","<i>N</i>,<i>N</i>'-Bis(2-acetylphenyl)ethanediamide","Acta Crystallographica Section E","2007","63","12","o4887","o4888","10.1107/S1600536807060527","","","0.71073","MoKα","","0.0413","0.0385","","","0.108","0.1105","","","","","","1.116","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216796","3.9567","0.0004","12.3429","0.0012","15.3884","0.0015","87.622","0.002","83.998","0.002","86.662","0.002","745.66","0.13","170","","170","","","","","","","","","4","P -1","-P 1","2","","N,N'-bis(2-acetylphenyl)ethanediamide","","- C18 H16 N2 O4 -","- C18 H16 N2 O4 -","- C36 H32 N4 O8 -","2","1","SJ2431","Brewer, Greg A.; Jasinski, Jerry P.; Butcher, Ray J.; Scheidt, W. Robert","<i>N</i>,<i>N</i>'-Bis(2-acetylphenyl)ethanediamide, a second polymorph","Acta Crystallographica Section E","2007","63","12","o4889","o4889","10.1107/S1600536807060539","","","0.71073","MoKα","","0.0535","0.0423","","","0.1068","0.1126","","","","","","0.962","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216797","12.2614","0.0015","15.6668","0.0018","18.697","0.002","90","","90","","90","","3591.6","0.7","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Guidongnin A","(3aR,4R,4'aS,5'R,7'S,7aR,9'R,9'aS)-5',9'-dihydroxy-7a-methyl-8'- methyleneperhydrospiro[isobenzofuran-4(1H),4'(3'H)- [1H-7,9a]methanocyclohepta[c]pyran]-1',3(3aH)-dione","","- C20 H26 O6 -","- C20 H26 O6 -","- C160 H208 O48 -","8","2","SJ2433","Shi, Hao","Guidongnin A, a natural diterpenoid","Acta Crystallographica Section E","2007","63","12","o4890","o4890","10.1107/S1600536807060965","","","0.71073","MoKα","","0.1301","0.0776","","","0.2127","0.2368","","","","","","1.099","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216798","11.4284","0.0002","13.8093","0.0002","14.5937","0.0002","109.911","0.001","98.168","0.001","92.601","0.001","2132.6","0.06","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","7-Chloro-3-ethyl-9,9-dimethyl-2-tosyl-2,3,3a,4,9,9a-hexahydro- 1H-pyrrolo[3,4-b]quinoline","","- C22 H27 Cl N2 O2 S -","- C22 H27 Cl N2 O2 S -","- C88 H108 Cl4 N8 O8 S4 -","4","2","SJ2437","D. Sudha; K. Chinnakali; M. Jayagobi; R. Raghunathan; Hoong-Kun Fun","7-Chloro-3-ethyl-9,9-dimethyl-2-tosyl-2,3,3a,4,9,9a-hexahydro-1<i>H</i>-pyrrolo[3,4-<i>b</i>]quinoline","Acta Crystallographica Section E","2007","63","12","o4912","o4913","10.1107/S1600536807061351","","","0.71073","MoKα","","0.104","0.0596","","","0.1528","0.195","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216799","12.2105","0.0008","7.5497","0.0005","22.4197","0.0015","90","","90.404","0.001","90","","2066.7","0.2","100","0.1","100","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Chlorido{4,4'-dimethoxy-2,2'-[1,2- phenylenebis(nitrilomethylidyne)]diphenolato}methanolmanganese(III)","","- C23 H22 Cl Mn N2 O5 -","- C23 H22 Cl Mn N2 O5 -","- C92 H88 Cl4 Mn4 N8 O20 -","4","1","SJ2438","Naser Eltaher Eltayeb; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun; Kamarulazizi Ibrahim","Chlorido{4,4'-dimethoxy-2,2'-[1,2-phenylenebis(nitrilomethylidyne)]diphenolato}methanolmanganese(III)","Acta Crystallographica Section E","2007","63","12","m3193","m3194","10.1107/S1600536807061363","","","0.71073","MoKα","","0.0608","0.0442","","","0.1027","0.1125","","","","","","1.051","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216800","9.5843","0.0002","13.2007","0.0002","20.3414","0.0003","90","","115.55","0.001","90","","2321.91","0.07","100","0.1","100","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","7-Chloro-3-ethyl-10-phenyl-2-tosylpyrrolo[3,4-b]quinoline","","- C26 H27 Cl N2 O2 S -","- C26 H27 Cl N2 O2 S -","- C104 H108 Cl4 N8 O8 S4 -","4","1","SJ2445","D. Sudha; K. Chinnakali; M. Jayagobi; R. Raghunathan; Hoong-Kun Fun","7-Chloro-3-ethyl-10-phenyl-2-tosylpyrrolo[3,4-<i>b</i>]quinoline","Acta Crystallographica Section E","2007","63","12","o4914","o4915","10.1107/S1600536807062356","","","0.71073","MoKα","","0.0512","0.0392","","","0.1018","0.1085","","","","","","1.035","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216801","6.7544","0.0007","8.224","0.0009","11.404","0.0013","90","","90","","90","","633.47","0.12","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2,5-Dihydroxybenzaldehyde","","- C7 H6 O3 -","- C7 H6 O3 -","- C28 H24 O12 -","4","1","SU2016","Kretz, Tonia; Lerner, Hans-Wolfram; Bolte, Michael","2,5-Dihydroxybenzaldehyde","Acta Crystallographica Section E","2007","63","12","o4673","o4673","10.1107/S160053680705595X","","","0.71073","MoKα","","0.0332","0.0315","","","0.0828","0.0838","","","","","","1.107","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216802","9.5733","0.0013","9.5493","0.0013","16.039","0.002","90","","105.236","0.002","90","","1414.7","0.3","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,4-Dibromo-6-[(4-methylpiperazin-1-yl)iminomethyl]phenol","","- C12 H15 Br2 N3 O -","- C12 H15 Br2 N3 O -","- C48 H60 Br8 N12 O4 -","4","1","SU2017","Ming-Lin, Guo; You-Nong, Qiu","2,4-Dibromo-6-[(4-methylpiperazin-1-yl)iminomethyl]phenol","Acta Crystallographica Section E","2007","63","12","o4641","","10.1107/S1600536807055705","","","0.71073","MoKα","","0.0651","0.0448","","","0.1205","0.1337","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216803","10.6144","0.0012","11.2212","0.0013","11.7323","0.0014","90","","105.16","0.002","90","","1348.8","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","<i>catena</i>-Poly[[[2-[(2- methylaminoethylimino)methyl]-4-nitrophenolato]copper(II)]-μ-thiocyanato]","","- C11 H12 Cu N4 O3 S -","- C11 H12 Cu N4 O3 S -","- C44 H48 Cu4 N16 O12 S4 -","4","1","SU2018","Zhang, Ping","<i>catena</i>-Poly[[[2-[(2-methylaminoethylimino)methyl]-4-nitrophenolato]copper(II)]-μ-thiocyanato]","Acta Crystallographica Section E","2007","63","12","m3040","m3040","10.1107/S1600536807057716","","","0.71073","MoKα","","0.0594","0.0372","","","0.0871","0.0966","","","","","","1.013","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216804","7.244","0.0014","19.693","0.004","21.128","0.004","90","","90.98","0.03","90","","3013.6","1","298","2","298","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","Di-μ-thocyanato-bis{2-bromo-4-chloro-6-[(2- methylaminoethylimino)methyl]phenolatocopper(II)}","","- C22 H22 Br2 Cl2 Cu2 N6 O2 S2 -","- C22 H22 Br2 Cl2 Cu2 N6 O2 S2 -","- C88 H88 Br8 Cl8 Cu8 N24 O8 S8 -","4","0.5","SU2019","Zhang, Ping","Di-μ-thocyanato-bis{2-bromo-4-chloro-6-[(2-methylaminoethylimino)methyl]phenolatocopper(II)}","Acta Crystallographica Section E","2007","63","12","m3041","m3041","10.1107/S160053680705773X","","","0.71073","MoKα","","0.0897","0.048","","","0.0995","0.1146","","","","","","0.992","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216805","40.733","0.009","5.431","0.001","8.266","0.003","90","","97.34","0.02","90","","1813.6","0.8","161","2","161","2","","","","","","","","3","C 1 2 1","C 2y","5","","1,13-diphenyl-2,4,6,8,10,12-hexaoxatridecane","","- C19 H24 O6 -","- C19 H24 O6 -","- C76 H96 O24 -","4","1","SU2020","Bats, Jan W.; Miculka, Christian; Noe, Christian R.","Redetermination of 1,13-diphenyl-2,4,6,8,10,12-hexaoxatridecane at 161K","Acta Crystallographica Section E","2007","63","12","o4757","o4757","10.1107/S1600536807057741","","","1.5418","CuKα","","0.0319","0.0306","","","0.0805","0.0815","","","","","","1.103","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216806","6.9994","0.0001","11.6876","0.0002","17.9748","0.0003","104.12","0.001","100.975","0.001","95.901","0.001","1382.63","0.04","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","4,4'-Bipyridindiium triaquabis(pyridine-2,6-dicarboxylato)strontium(II) trihydrate","","- C24 H28 N4 O14 Sr -","- C24 H28 N4 O14 Sr -","- C48 H56 N8 O28 Sr2 -","2","1","SU2021","Soleimannejad, Janet; Aghabozorg, Hossein; Shabnam Hooshman; Adams, Harry","4,4'-Bipyridinediium triaquabis(pyridine-2,6-dicarboxylato)strontium(II) trihydrate","Acta Crystallographica Section E","2007","63","12","m3089","m3090","10.1107/S1600536807058722","","","0.71073","MoKα","","0.0329","0.0267","","","0.0674","0.0739","","","","","","1.065","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216807","21.896","0.003","21.896","0.003","14.059","0.002","90","","90","","90","","6740.4","1.6","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Ethyl [(n-butylammonio)(2-hydroxyphenyl)methyl]phosphonate","","- C13 H22 N O4 P -","- C13 H22 N O4 P -","- C208 H352 N16 O64 P16 -","16","1","SU2022","Zhang, Xiaoyan; Ge, Chunhua; Zhang, Xiangdong; Liu, Qitao","Ethyl [(<i>n</i>-butylammonio)(2-hydroxyphenyl)methyl]phosphonate","Acta Crystallographica Section E","2007","63","12","o4778","o4778","10.1107/S1600536807059168","","","0.71073","MoKα","","0.1138","0.0697","","","0.2121","0.2425","","","","","","1.035","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216808","7.0047","0.0003","14.9489","0.0006","8.7301","0.0003","90","","99.692","0.002","90","","901.1","0.06","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","<i>trans</i>-[RuCl~2~(bipy)~2~]","i>trans</i>-Bis(2,2'-bipyridine)dichloridoruthenium(II)","","- C20 H16 Cl2 N4 Ru -","- C20 H16 Cl2 N4 Ru -","- C40 H32 Cl4 N8 Ru2 -","2","0.5","SU2023","Klüfers, Peter; Zangl, Anna","<i>trans</i>-Bis(2,2'-bipyridine)dichloridoruthenium(II)","Acta Crystallographica Section E","2007","63","12","m3088","m3088","10.1107/S1600536807058680","","","0.71073","MoKα","","0.0367","0.0259","","","0.0537","0.0577","","","","","","1.057","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216809","9.8843","0.0015","12.3457","0.0019","13.815","0.002","76.635","0.018","70.676","0.017","73.847","0.017","1509.9","0.4","183","2","","","","","","","","","","7","P -1","-P 1","2","","Bis[2,6-bis(dipiperidin-1-ylphosphanyloxy)phenyl]bromidopalladium(II)","","- C26 H43 Br N4 O2 P2 Pd -","- C26 H43 Br N4 O2 P2 Pd -","- C52 H86 Br2 N8 O4 P4 Pd2 -","2","1","SU2024","Bolliger, Jeanne L.; Blacque, Olivier; Frech, Christian M.","Bis[2,6-bis(dipiperidin-1-ylphosphanyloxy)phenyl]bromidopalladium(II)","Acta Crystallographica Section E","2007","63","12","m3086","m3086","10.1107/S1600536807059405","","","0.71073","MoKα","","","0.0242","","","","0.065","","","","","","1.018","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216810","11.982","0.002","9.5097","0.0018","19.546","0.004","90","","103.695","0.002","90","","2163.9","0.7","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dimethyl[2-oxido-1-naphthaldehyde (4-hydroxylbenzoyl)hydrazonato]tin(IV) dichloromethane solvate","","- C21 H20 Cl2 N2 O3 Sn -","- C21 H20 Cl2 N2 O3 Sn -","- C84 H80 Cl8 N8 O12 Sn4 -","4","1","SU2025","Jichun Cui; Handong Yin; Yanling Qiao","Dimethyl[2-oxido-1-naphthaldehyde (4-hydroxylbenzoyl)hydrazonato]tin(IV) dichloromethane solvate","Acta Crystallographica Section E","2007","63","12","m3138","m3138","10.1107/S1600536807060102","","","0.71073","MoKα","","0.044","0.029","","","0.0723","0.0871","","","","","","1","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216811","9.0426","0.001","9.409","0.003","12.26","0.003","108.89","0.02","91.454","0.013","91.817","0.016","985.7","0.4","203","","203","","","","","","","","","4","P -1","-P 1","2","","5-Hydroxy-4-methyl-4-azatricyclo[5.2.2.0^2,6^]undec-8-en-3-one","","- C11 H15 N O2 -","- C11 H15 N O2 -","- C44 H60 N4 O8 -","4","2","TK2206","Butcher, Ray J.; Jasinski, Jerry P.; Benjamin, Ellis; Hijji, Yousef M.; Benjamin, Earl","5-Hydroxy-4-methyl-4-azatricyclo[5.2.2.0^2,6^]undec-8-en-3-one","Acta Crystallographica Section E","2007","63","12","o4565","o4565","10.1107/S1600536807053779","","","0.71073","MoKα","","0.141","0.044","","","0.072","0.084","","","","","","0.73","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216812","25.457","0.002","11.697","0.002","14.231","0.003","90","","106.808","0.0016","90","","4056.5","1.1","291","2","291","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","5-(4-Chlorophenyl)-6-ethoxycarbonyl-3,7-dimethyl-5H- thiazolo[3,2-a]pyrimidin-8-ium bromide","","- C17 H18 Br Cl N2 O2 S -","- C17 H18 Br Cl N2 O2 S -","- C136 H144 Br8 Cl8 N16 O16 S8 -","8","1","TK2207","Tongming Shang","5-(4-Chlorophenyl)-6-ethoxycarbonyl-3,7-dimethyl-5<i>H</i>-thiazolo[3,2-<i>a</i>]pyrimidin-8-ium bromide","Acta Crystallographica Section E","2007","63","12","o4623","o4623","10.1107/S1600536807053780","","","0.71073","MoKα","","0.064","0.044","","","0.09","0.094","","","","","","1.04","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216813","6.3799","0.0003","20.3789","0.0011","14.4125","0.0008","90","","101.269","0.001","90","","1837.72","0.17","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Bromo-6-phenylhydrazono-β-lapachone","","- C21 H19 Br N2 O2 -","- C21 H19 Br N2 O2 -","- C84 H76 Br4 N8 O8 -","4","1","TK2208","Carlos Eduardo M. Carvalho; Antonio V. Pinto; Harrison, William T. A.","3-Bromo-6-phenylhydrazono-β-lapachone","Acta Crystallographica Section E","2007","63","12","o4504","o4504","10.1107/S1600536807053810","","","0.71073","MoKα","","0.072","0.035","","","0.072","0.079","","","","","","0.85","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216814","5.8316","0.001","19.691","0.007","14.623","0.002","90","","98.953","0.013","90","","1658.7","0.7","297","2","297","2","","","","","","","","5","C 1 m 1","C -2y","8","Dipotassium 4,4'-biphenyldisulfonate dihyrate","dipotassium biphenyl-4,4'-disulfonate dihydrate","","- C12 H12 K2 O8 S2 -","- C12 H12 K2 O8 S2 -","- C48 H48 K8 O32 S8 -","4","1","TK2210","Graham Smith; Urs D. Wermuth; Peter C. Healy","Dipotassium biphenyl-4,4'-disulfonate dihydrate: a coordination polymer","Acta Crystallographica Section E","2007","63","12","m3056","m3057","10.1107/S1600536807056930","","","0.71073","MoKα","","0.033","0.031","","","0.078","0.083","","","","","","0.88","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216815","6.5998","0.0013","7.6711","0.0016","26.547","0.005","90","","91.318","0.007","90","","1343.7","0.5","273","2","273","2","","","","","","","","3","P 1 21 1","P 2yb","4","","7-Hydroxy-4',5'-methylenedioxypterocarpan hemihydrate","","- C16 H13 O5.5 -","- C16 H13 O5.5 -","- C64 H52 O22 -","4","2","TK2211","Qing Chen; Qi-Long Zhang; Yun-Qian Zhang; Bi-Xue Zhu; Xiao-Sheng Yang","7-Hydroxy-4',5'-methylenedioxypterocarpan hemihydrate","Acta Crystallographica Section E","2007","63","12","o4893","o4893","10.1107/S160053680705965X","","","0.71073","MoKα","","0.034","0.031","","","0.076","0.078","","","","","","1.06","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216816","11.0635","0.0017","12.5197","0.0019","14.174","0.002","64.652","0.003","87.539","0.003","68.087","0.003","1630","0.4","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","1,4-Dimethoxy-13b,l3c-diphenyl-6H,13H-5,7,12,13b,13c,14-Hexahydro- 5a,6a,l2a,13a-tetraazabenz[5,6]azuleno[2,1,8-ija]benz[f]azulene-6,13-dione chloroform solvate","","- C35 H31 Cl3 N4 O4 -","- C35 H31 Cl3 N4 O4 -","- C70 H62 Cl6 N8 O8 -","2","1","TK2212","Wang, Yu-Zhou; Wang, Zhi-Guo; Li, Lin","1,4-Dimethoxy-13b,13c-diphenyl-6<i>H</i>,13<i>H</i>-5,7,12,13b,13c,14-hexahydro-5a,6a,12a,13a-tetraazabenz[5,6]azuleno[2,1,8-<i>ija</i>]benz[<i>f</i>]azulene-6,13-dione chloroform solvate","Acta Crystallographica Section E","2007","63","12","o4711","o4711","10.1107/S1600536807057108","","","0.71073","MoKα","","0.124","0.063","","","0.125","0.154","","","","","","0.96","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216817","28.0291","0.0006","8.6245","0.0002","35.6763","0.0007","90","","110.244","0.0005","90","","8091.5","0.3","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tris(ethyl carbazate-κ^2^N,O)cobalt(II) dinitrate","","- C9 H24 Co N8 O12 -","- C9 H24 Co N8 O12 -","- C144 H384 Co16 N128 O192 -","16","4","TK2213","Srinivasan, Krishnan; Govindarajan, Subbaiah; Harrison, William T. A.","Redetermination of tris(ethyl carbazate-κ^2^<i>N</i>,<i>O</i>)cobalt(II) dinitrate","Acta Crystallographica Section E","2007","63","12","m3028","m3029","10.1107/S1600536807055584","","","0.71073","MoKα","","0.0584","0.037","","","0.0822","0.0907","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216818","10.55376","0.00012","10.55376","0.00012","10.55376","0.00012","90","","90","","90","","1175.5","0.02","298","","298","","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","Potassium calcium diniobium hexaoxide fluoride","","- Ca F K Nb2 O6 -","- Ca F K Nb2 O6 -","- Ca8 F8 K8 Nb16 O48 -","8","0.0416667","WM2150","Chung-Yul Yoo; Seung-Joo Kim","KCaNb~2~O~6~F from a combined synchrotron X-ray and neutron powder diffraction study","Acta Crystallographica Section E","2007","63","12","i203","i204","10.1107/S1600536807060436","","neutron","1.8348","Neutron","","","","","","","","","","1.57","","","","","","","has coordinates","176787","2020-10-21","18:00:00",""
"2216819","7.2689","0.001","7.2689","0.001","4.4205","0.0009","90","","90","","120","","202.27","0.06","293","2","293","2","","","","","","","","3","P -6 2 m","P -6 -2","189","","Yttrium magnesium gallide","","- Ga Mg Y -","- Ga Mg Y -","- Ga3 Mg3 Y3 -","3","0.25","WM2155","Sahlberg, Martin; Gustafsson, Torbjörn; Andersson, Yvonne","YMgGa","Acta Crystallographica Section E","2007","63","12","i195","i195","10.1107/S160053680705413X","","","0.56085","AgKα","","0.0379","0.0351","","","0.0832","0.0882","","","","","","1.152","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216820","7.315","0.004","14.843","0.008","45.24","0.02","90","","90.258","0.009","90","","4912","4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","diethylammonium tetrachloridocuprate(II)","diethylammonium tetrachloridocuprate(II)","","- C8 H24 Cl4 Cu N2 -","- C8 H24 Cl4 Cu N2 -","- C96 H288 Cl48 Cu12 N24 -","12","3","WM2156","Christoph E. Strasser; Stephanie Cronje; Helgard G. Raubenheimer","The low-temperature phase of diethylammonium tetrachloridocuprate(II)","Acta Crystallographica Section E","2007","63","12","m2915","m2916","10.1107/S1600536807054098","","","0.71073","MoKα","","0.0571","0.0453","","","0.105","0.111","","","","","","1.086","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216821","9.91473","0.00007","9.91473","0.00007","9.91473","0.00007","90","","90","","90","","974.636","0.012","293","2","293","2","","","","","","","Synthetic","5","P 21 3","P 2ac 2ab 3","198","","dipotassium iron(III) tin(IV) tris(orthophosphate)","","- Fe K2 O12 P3 Sn -","- Fe1.0002 K2 O12 P3 Sn0.9998 -","- Fe4.0008 K8 O48 P12 Sn3.9992 -","4","0.333333","WM2157","Zatovsky, Igor V.; Yatskin, Michael M.; Baumer, Vyacheslav N.; Slobodyanik, Nikolay S.; Shishkin, Oleg V.","Langbeinite-related K~2~FeSn(PO~4~)~3~ from single-crystal data","Acta Crystallographica, Section E","2007","63","12","i199","i199","10.1107/S1600536807058588","","","0.71073","MoKα","","0.0261","0.0209","","","0.0418","0.0445","","","","","","1.1","","","","has coordinates","282068","2023-03-26","10:12:40",""
"2216822","3.8585","0.0007","3.8585","0.0007","9.189","0.002","90","","90","","90","","136.81","0.05","293","2","293","2","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","Lutetium(III) oxide iodide","","- I Lu O -","- I Lu O -","- I2 Lu2 O2 -","2","0.125","WM2159","Zimmermann, Sina; Meyer, Gerd","Lutetium(III) oxide iodide","Acta Crystallographica Section E","2007","63","12","i193","","10.1107/S160053680705283X","","","0.71073","MoKα","","0.0349","0.0338","","","0.0929","0.0941","","","","","","1.201","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216823","7.6208","0.0012","12.6407","0.0015","7.8998","0.0012","90","","101.559","0.013","90","","745.57","0.19","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","dicerium pentathiosilicate","","- La2 S5 Si -","- La2 S5 Si -","- La8 S20 Si4 -","4","1","WM2163","Daszkiewicz, M.; Gulay, L. D.; Ruda, I. R.; Marchuk, O. V.; Pietraszko, A.","La~2~SiS~5~","Acta Crystallographica Section E","2007","63","12","i197","i197","10.1107/S1600536807058606","","","0.71073","MoKα","","0.0359","0.023","","","0.0385","0.0403","","","","","","0.966","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216824","4.784","0.002","21.69","0.002","13.773","0.009","90","","93.425","0.004","90","","1426.6","1.1","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-(3-Chlorophenyl)-1-(2-methylimidazo[1,2-a]pyridin-3-yl)prop-2-en-1-one","","- C17 H13 Cl N2 O -","- C17 H13 Cl N2 O -","- C68 H52 Cl4 N8 O4 -","4","1","WN2207","Bibila Mayaya Bisseyou, Yvon; Soro, Adama P.; Sissouma, Drissa; Giorgi, Michel; Ebby, N'dédé","3-(3-Chlorophenyl)-1-(2-methylimidazo[1,2-<i>a</i>]pyridin-3-yl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","12","o4758","o4759","10.1107/S1600536807050404","","","0.7107","MoKα","","0.0647","0.0467","","0.097","0.0907","0.0907","","","","","","0.8781","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216825","15.364","0.001","17.006","0.001","18.908","0.001","90","","90","","90","","4940.3","0.5","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","4-[2-(Dibenzylaminomethyl)-1H-benzimidazol-1-ylmethyl]benzonitrile","","- C30 H26 N4 -","- C30 H26 N4 -","- C240 H208 N32 -","8","1","WN2213","Guang-Ju Ping; Ying-Ying Liu; Ting-Ting Han; Jian-Fang Ma","4-[2-(Dibenzylaminomethyl)-1<i>H</i>-benzimidazol-1-ylmethyl]benzonitrile","Acta Crystallographica Section E","2007","63","12","o4508","o4508","10.1107/S1600536807053573","","","0.71069","MoKα","","0.0666","0.0401","","","0.1025","0.1197","","","","","","1.011","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216826","24.7027","0.0007","10.2685","0.0003","19.6195","0.0005","90","","109.554","0.001","90","","4689.7","0.2","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-1-Ethyl-4,4,10-trimethyl-2-tosyl-1,2,3,3a,4,11b-hexahydro-11H- pyrrolo[3,4-c]pyrano[5,6-c]quinolin-11-one","","- C26 H30 N2 O4 S -","- C26 H30 N2 O4 S -","- C208 H240 N16 O32 S8 -","8","2","WN2215","K. Chinnakali; D. Sudha; M. Jayagopi; R. Raghunathan; Hoong-Kun Fun","<i>trans</i>-1-Ethyl-4,4,10-trimethyl-2-tosyl-1,2,3,3a,4,11b-hexahydro-11<i>H</i>-pyrrolo[3,4-<i>c</i>]pyrano[5,6-<i>c</i>]quinolin-11-one","Acta Crystallographica Section E","2007","63","12","o4650","o4651","10.1107/S1600536807054906","","","0.71073","MoKα","","0.1047","0.0669","","","0.1375","0.1662","","","","","","1.025","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216827","9.8942","0.0013","9.6703","0.0013","21.152","0.003","90","","93.107","0.002","90","","2020.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(5,7-Dichloroquinolin-8-yloxy)-<i>N</i>,<i>N</i>-diphenylacetamide","","- C23 H16 Cl2 N2 O2 -","- C23 H16 Cl2 N2 O2 -","- C92 H64 Cl8 N8 O8 -","4","1","WN2216","Jun Wan; Yan An; Xiao-Fang Tang; Yong-Hong Wen","2-(5,7-Dichloroquinolin-8-yloxy)-<i>N</i>,<i>N</i>-diphenylacetamide","Acta Crystallographica Section E","2007","63","12","o4598","o4598","10.1107/S1600536807055055","","","0.71073","MoKα","","0.0599","0.0471","","","0.1198","0.1304","","","","","","1.038","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216828","8.584","0.0017","5.3725","0.0011","33.904","0.007","90","","91.757","0.003","90","","1562.8","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-Phenethyl 3-(3,4-dihydroxy-5-nitrophenyl)acrylate","","- C17 H15 N O6 -","- C17 H15 N O6 -","- C68 H60 N4 O24 -","4","1","WN2218","Chun-Nian Xia; Wei-Xiao Hu; Wei Zhou","(<i>E</i>)-Phenethyl 3-(3,4-dihydroxy-5-nitrophenyl)acrylate","Acta Crystallographica Section E","2007","63","12","o4795","o4795","10.1107/S160053680705859X","","","0.71073","MoKα","","0.0719","0.0433","","","0.1106","0.1238","","","","","","1.064","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216829","8.7569","0.0002","12.0237","0.0004","8.5351","0.0003","90","","114.777","0.002","90","","815.94","0.05","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","<i>ortho</i>-Iodo-benzylbromide","1-Bromomethyl-2-iodobenzene","","- C7 H6 Br I -","- C7 H6 Br I -","- C28 H24 Br4 I4 -","4","1","XU2334","Betz, Richard; Klüfers, Peter","1-Bromomethyl-2-iodobenzene","Acta Crystallographica Section E","2007","63","12","o4753","o4753","10.1107/S1600536807058151","","","0.71073","MoKα","","0.036","0.0243","","","0.0521","0.056","","","","","","1.088","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216830","24.042","0.003","13.0193","0.0018","7.2678","0.0014","90","","94.934","0.002","90","","2266.5","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{Bis[2-(3,4-methylenedioxybenzylamino)ethyl]amine}dichloridozinc(II) hemihydrate","","- C20 H26 Cl2 N3 O4.5 Zn -","- C20 H26 Cl2 N3 O4.5 Zn -","- C80 H104 Cl8 N12 O18 Zn4 -","4","1","XU2337","Han, Li-Jun; Yang, Shu-Ping; Wang, Da-Qi; Xia, Hai-Tao","{Bis[2-(3,4-methylenedioxybenzylamino)ethyl]amine}dichloridozinc(II) hemihydrate","Acta Crystallographica Section E","2007","63","12","m2929","m2929","10.1107/S1600536807054931","","","0.71073","MoKα","","0.1352","0.104","","","0.2627","0.2767","","","","","","1.122","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216831","9.722","0.0005","10.838","0.0005","12.174","0.0006","90.882","0.0009","110.074","0.0009","92.221","0.0009","1203.34","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-Phenyl-N-{4-[5-(2-phenyl-3-pyridyl)-1,3,4-oxadiazol-2-yl]phenyl}aniline","","- C31 H22 N4 O -","- C31 H22 N4 O -","- C62 H44 N8 O2 -","2","1","XU2340","Li-Ping Han; Bin Li; Jie Liu; Qing-Chun Liu","<i>N</i>-Phenyl-<i>N</i>-{4-[5-(2-phenyl-3-pyridyl)-1,3,4-oxadiazol-2-yl]phenyl}aniline","Acta Crystallographica Section E","2007","63","12","o4780","o4780","10.1107/S1600536807058382","","","0.71069","MoKα","","0.0917","0.0519","","","0.112","0.1331","","","","","","1.016","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216832","11.752","0.004","8.172","0.005","23.524","0.003","90","","90","","90","","2259.2","1.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","[(1-Carboxycyclohexyl)(carboxymethyl)ammonio]acetate","","- C11 H17 N O6 -","- C11 H17 N O6 -","- C88 H136 N8 O48 -","8","1","XU2345","Sheng-Dong Zhang; Jian-Xin Li; Quan-Liang Zhang; Wen-Juan Duan; Xi-Guang Du","[(1-Carboxycyclohexyl)(carboxymethyl)ammonio]acetate","Acta Crystallographica Section E","2007","63","12","o4794","o4794","10.1107/S1600536807057807","","","0.71069","MoKα","","0.0657","0.0454","","","0.1198","0.1279","","","","","","1.052","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216833","16.28","0.002","6.2848","0.0009","11.1016","0.0015","90","","112.81","0.002","90","","1047","0.2","187","2","187","2","","","","","","","","4","C 1 2 1","C 2y","5","","(S)-2,3,5,10,11,11a-Hexahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-3,11-dione","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C48 H48 N8 O8 -","4","1","XU2346","Mao-Sheng Cheng; Chao Ma; Jing-Hong Liu; Yu Sha; Qing-He Wang","(<i>S</i>)-2,3,5,10,11,11a-Hexahydro-1<i>H</i>-pyrrolo[2,1-<i>c</i>][1,4]benzodiazepine-3,11-dione","Acta Crystallographica Section E","2007","63","12","o4605","o4605","10.1107/S1600536807054979","","","0.71073","MoKα","","0.0368","0.0355","","","0.0917","0.0929","","","","","","1.171","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216834","7.3646","0.0007","8.1772","0.0008","13.329","0.001","97.905","0.002","100.352","0.002","109.296","0.002","728.32","0.11","295","2","295","2","","","","","","","","4","P 1","P 1","1","","(R*)-(-)-3-[4-(Benzyloxy)benzoylmethyl] 5-ethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","","- C32 H30 N2 O8 -","- C32 H30 N2 O8 -","- C32 H30 N2 O8 -","1","1","XU2347","Wu, Xiao-Yun; Hu, Ai-Xi; Cao, Gao","(<i>R</i>*)-({-})-3-[4-(Benzyloxy)benzoylmethyl] 5-ethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate","Acta Crystallographica Section E","2007","63","12","o4578","o4578","10.1107/S1600536807054785","","","0.71073","MoKα","","0.0903","0.0454","","","0.1099","0.1435","","","","","","1.019","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216835","11.3757","0.0005","10.9074","0.0004","14.147","0.0004","90","","110.644","0.002","90","","1642.64","0.11","200","2","200","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","3-ethoxycarbonyl-4-methyl-pyrrole","Ethyl 4-methyl-1H-pyrrole-3-carboxylate","","- C8 H11 N O2 -","- C8 H11 N O2 -","- C64 H88 N8 O16 -","8","1","XU2348","Kerscher, Tobias; Klüfers, Peter; Kügel, Wolfgang; Müller, Christina","Ethyl 4-methyl-1<i>H</i>-pyrrole-3-carboxylate","Acta Crystallographica Section E","2007","63","12","o4779","o4779","10.1107/S160053680705831X","","","0.71073","MoKα","","0.0591","0.0447","","","0.1159","0.1241","","","","","","1.064","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216836","11.964","0.008","12.647","0.005","12.793","0.004","90","","90","","90","","1935.7","1.6","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","15β,16β-Methylene-3-oxo-17α-pregna-4-ene-21,17-carbolactone","","- C23 H30 O3 -","- C23 H30 O3 -","- C92 H120 O12 -","4","1","XU2349","Wei Zhou; Wei-Xiao Hu; Chun-Nian Xia","15β,16β-Methylene-3-oxo-17α-pregn-4-ene-21,17-carbolactone","Acta Crystallographica Section E","2007","63","12","o4584","o4584","10.1107/S1600536807054773","","","0.71073","MoKα","","0.0936","0.0374","","","0.0903","0.1094","","","","","","1.03","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216837","5.9852","0.0009","7.0349","0.001","12.7012","0.0019","90","","100.668","0.002","90","","525.54","0.13","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,3,5,6-Tetrachlorobenzene-1,4-dicarboxylic acid","","- C8 H2 Cl4 O4 -","- C8 H2 Cl4 O4 -","- C16 H4 Cl8 O8 -","2","0.5","XU2352","Qun Chen; Yingmei Xie; Chao Li; Mingyang He; Shengchun Chen","2,3,5,6-Tetrachlorobenzene-1,4-dicarboxylic acid","Acta Crystallographica Section E","2007","63","12","o4549","o4549","10.1107/S1600536807053822","","","0.71073","MoKα","","0.0254","0.0242","","","0.0628","0.0638","","","","","","1.01","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216838","8.383","0.0017","10.75","0.002","10.95","0.002","101.92","0.03","104.71","0.03","111.51","0.03","837.3","0.4","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","1,3,5-Tri-2-pyridylpentane-1,5-dione","","- C20 H17 N3 O2 -","- C20 H17 N3 O2 -","- C40 H34 N6 O4 -","2","1","XU2353","Fang-Fang Jian; Jian-Hui Wang; Xiang-Yan Yang; Yong-Xiang Wei","1,3,5-Tri-2-pyridylpentane-1,5-dione","Acta Crystallographica Section E","2007","63","12","o4846","o4846","10.1107/S1600536807058953","","","0.71073","MoKα","","0.0592","0.0436","","","0.1019","0.113","","","","","","1.037","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216839","21.94","0.002","5.0674","0.0004","23.314","0.003","90","","96.598","0.009","90","","2574.9","0.5","100","1","100","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","(2E)-3-(4-Methoxyphenyl)-1-(3-methyl-2-thienyl)prop-2-en-1-one","","- C15 H14 O2 S -","- C15 H14 O2 S -","- C120 H112 O16 S8 -","8","1","XU2354","Sarojini, B. K.; Yathirajan, H. S.; Narayana, B.; Swamy, M. T.; Kubicki, Maciej","(2<i>E</i>)-3-(4-Methoxyphenyl)-1-(3-methyl-2-thienyl)prop-2-en-1-one","Acta Crystallographica Section E","2007","63","12","o4688","o4688","10.1107/S1600536807057480","","","0.71073","MoKα","","0.0924","0.0589","","","0.1167","0.13","","","","","","1.115","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216840","13.418","0.006","14.989","0.004","18.126","0.005","90","","90","","90","","3646","2","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(2S*,3S*,4R*,5R*,7R*,9S*,11S*,15R*)-5,15-diacetoxy-14- oxolathyra-6(17),12(E)-diene-3,7-diyl dibenzoate","","","- C38 H42 O9 -","- C38 H42 O9 -","- C152 H168 O36 -","4","1","XU2355","Wei Jiao; Zhi-hua Mao; Run-hua Lu","<i>Euphorbia</i> Factor <i>L</i>~2~: an ester of 7-hydroxylathyrol","Acta Crystallographica Section E","2007","63","12","o4613","o4613","10.1107/S1600536807055900","","","0.71073","MoKα","","0.1918","0.0541","","","0.131","0.1714","","","","","","0.91","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216841","14.556","0.004","5.54","0.002","18.194","0.006","90","","95.12","0.03","90","","1461.3","0.8","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 2-hydroxy-3-(2-nitrophenyl)-2-(2-oxocyclopentyl)propanoate","","- C15 H17 N O6 -","- C15 H17 N O6 -","- C60 H68 N4 O24 -","4","1","XU2357","He, Long","Methyl 2-hydroxy-3-(2-nitrophenyl)-2-(2-oxocyclopentyl)propanoate","Acta Crystallographica Section E","2007","63","12","o4595","o4595","10.1107/S1600536807055912","","","0.71073","MoKα","","0.2237","0.076","","","0.1785","0.2202","","","","","","0.908","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216842","9.7701","0.0003","19.138","0.0006","9.8933","0.0003","90","","105.834","0.001","90","","1779.66","0.1","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","O-2-Naphthyl diphenylthiophosphinate","","- C22 H17 O P S -","- C22 H17 O P S -","- C88 H68 O4 P4 S4 -","4","1","XU2358","Mague, Joel T.; Punji, Benudhar; Ganesamoorthy, Chelladurai; Balakrishna, Maravanji S.","<i>O</i>-2-Naphthyl diphenylthiophosphinate","Acta Crystallographica Section E","2007","63","12","o4644","o4644","10.1107/S1600536807056127","","","0.71073","MoKα","","0.0369","0.032","","","0.0799","0.0837","","","","","","1.051","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216843","9.949","0.0008","19.044","0.002","9.9552","0.0008","90","","105.672","0.001","90","","1816.1","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","O-2-Naphthyl diphenylselenophosphinate","","- C22 H17 O P Se -","- C22 H17 O P Se -","- C88 H68 O4 P4 Se4 -","4","1","XU2359","Mague, Joel T.; Punji, Benudhar; Ganesamoorthy, Chelladurai; Balakrishna, Maravanji S.","<i>O</i>-2-Naphthyl diphenylselenophosphinate","Acta Crystallographica Section E","2007","63","12","o4645","o4645","10.1107/S1600536807056334","","","0.71073","MoKα","","0.044","0.0333","","","0.0846","0.0909","","","","","","1.043","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216844","11.4552","0.0012","8.2233","0.0014","11.5627","0.0014","90","","98.904","0.012","90","","1076.1","0.3","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl 3-cyclohexylidenedithiocarbazate","","- C8 H14 N2 S2 -","- C8 H14 N2 S2 -","- C32 H56 N8 S8 -","4","1","XU2360","Yu-Liang Tian; Shan-Heng Wang; Shang Shan; Xu-Chun Fu","Methyl 3-cyclohexylidenedithiocarbazate","Acta Crystallographica Section E","2007","63","12","o4656","o4656","10.1107/S1600536807056401","","","0.71073","MoKα","","0.0717","0.0348","","","0.0919","0.1331","","","","","","1.085","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216845","6.1408","0.0003","13.0272","0.0007","22.7381","0.0012","90","","91.891","0.001","90","","1818","0.16","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(4-Hydroxyphenyl)-7-(phenylsulfonyl)-4H-chromen-4-one","","- C21 H14 O6 S -","- C21 H14 O6 S -","- C84 H56 O24 S4 -","4","1","XU2361","You Peng; Ze-Yuan Deng; Shao-Jie Lang; Dong-Mei Xiong","3-(4-Hydroxyphenyl)-7-(phenylsulfonyl)-4<i>H</i>-chromen-4-one","Acta Crystallographica Section E","2007","63","12","o4787","o4787","10.1107/S1600536807057844","","","0.71073","MoKα","","0.0867","0.0464","","","0.1254","0.1449","","","","","","1.071","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216846","6.664","0.003","8.224","0.003","18.106","0.007","92.269","0.006","99.42","0.005","98.624","0.006","965.8","0.7","291","2","298","2","","","","","","","","5","P -1","-P 1","2","","3-(2,4-Dichlorophenyl)-1-phenyl-2,3-dihydro-1H-naphtho[1,2-e][1,3]oxazine","","- C24 H17 Cl2 N O -","- C24 H17 Cl2 N O -","- C48 H34 Cl4 N2 O2 -","2","1","XU2366","Yin, Zhi-Gang; Qian, Heng-Yu; Chen Yu-Zhen; Feng Yu-Li","3-(2,4-Dichlorophenyl)-1-phenyl-2,3-dihydro-1<i>H</i>-naphtho[1,2-<i>e</i>][1,3]oxazine","Acta Crystallographica Section E","2007","63","12","o4781","o4781","10.1107/S160053680705787X","","","0.71073","MoKα","","0.051","0.0466","","","0.1028","0.1042","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216847","23.309","0.002","7.2258","0.0006","25.315","0.002","90","","91.793","0.002","90","","4261.6","0.6","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","rac-bis{[1-(9,9-dioxo-10H-phenothiazin-10-yl)-2-propyl]dimethylammonium} terephthalate trihydrate","","- C42 H52 N4 O11 S2 -","- C42 H52 N4 O11 S2 -","- C168 H208 N16 O44 S8 -","4","0.5","XU2369","Zhu, Dong-Xia; Sun, Wei; Yang, Gui-Fu; Ng, Seik Weng","<i>rac</i>-Bis{[1-(9,9-dioxo-10<i>H</i>-phenothiazin-10-yl)-2-propyl]dimethylammonium} terephthalate trihydrate","Acta Crystallographica Section E","2007","63","12","o4830","o4830","10.1107/S1600536807058916","","","0.71073","MoKα","","0.0813","0.0485","","","0.1331","0.1606","","","","","","1.023","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216848","7.3604","0.0012","9.4157","0.0014","28.6294","0.0019","90","","90","","90","","1984.1","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2,2'-Dimethylbutane-1,4-diyldipyridinium dibromide dihydrate","","- C16 H26 Br2 N2 O2 -","- C16 H26 Br2 N2 O2 -","- C64 H104 Br8 N8 O8 -","4","1","XU2371","Xin Xiao; Ming-Qiang Wu; Yun-Qian Zhang; Sai-Feng Xue; Zhu Tao","2,2'-Dimethylbutane-1,4-diyldipyridinium dibromide dihydrate","Acta Crystallographica Section E","2007","63","12","o4897","o4897","10.1107/S1600536807060448","","","0.71073","MoKα","","0.0414","0.0327","","","0.0769","0.0794","","","","","","1.078","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216849","11.9413","0.0009","7.0455","0.0005","14.2092","0.0009","90","","109.904","0.002","90","","1124.04","0.14","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Bis(4-formylbenzoato-κO)bis(1H-imidazole-κN^3^)zinc(II)","","- C22 H18 N4 O6 Zn -","- C22 H18 N4 O6 Zn -","- C44 H36 N8 O12 Zn2 -","2","1","XU2375","Deng, Zhao-Peng; Gao, Shan; Ng, Seik Weng","Bis(4-formylbenzoato-κ<i>O</i>)bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc(II)","Acta Crystallographica Section E","2007","63","12","m3113","m3113","10.1107/S1600536807059296","","","0.71073","MoKα","","0.0936","0.0399","","","0.0891","0.1499","","","","","","1.134","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216850","14.3753","0.0011","9.8665","0.0008","14.6565","0.0012","90","","114.256","0.001","90","","1895.3","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(E)-2-[4-tert-Butyl-5-(2-chlorobenzyl)thiazol-2-yliminomethyl]phenol","","- C21 H21 Cl N2 O S -","- C21 H21 Cl N2 O S -","- C84 H84 Cl4 N8 O4 S4 -","4","1","XU2378","Gao Cao; Ying-Qi Mang; Ai-Xi Hu","(<i>E</i>)-2-[4-<i>tert</i>-Butyl-5-(2-chlorobenzyl)thiazol-2-yliminomethyl]phenol","Acta Crystallographica Section E","2007","63","12","o4862","o4862","10.1107/S1600536807060321","","","0.71073","MoKα","","0.0991","0.0507","","","0.1163","0.1413","","","","","","1.029","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216851","8.2308","0.0008","13.558","0.0012","23.2279","0.0018","90","","90","","90","","2592.1","0.4","291","2","291","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","9α,11-Epoxy-7α-(methoxycarbonyl)-3-oxo-17α-pregn-4-ene-21,17-carbolactone dioxane solvate","","- C28 H38 O8 -","- C28 H38 O8 -","- C112 H152 O32 -","4","1","XU2379","Lu-Zhuang Xu; Qian Yang; Jing-Jing Nie","Eplerenone 1,4-dioxane solvate","Acta Crystallographica Section E","2007","63","12","o4898","o4898","10.1107/S1600536807060199","","","0.71073","MoKα","","0.0967","0.0653","","","0.1826","0.2086","","","","","","1.065","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216852","8.6995","0.001","10.0545","0.0012","12.8146","0.0015","81.019","0.001","82.697","0.001","80.347","0.001","1085.6","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-[2-(<i>N</i>,<i>N</i>-Dimethylamino)phenyl]-3,3,4,4,5,5-hexafluoro- 1-(2-methyl-5-phenyl-3-thienyl)cyclopent-1-ene","","- C24 H19 F6 N S -","- C24 H19 F6 N S -","- C48 H38 F12 N2 S2 -","2","1","ZL2061","Congbin, Fan; Tianshe, Yang; Qidong, Tu; Gang, Liu","2-[2-(<i>N</i>,<i>N</i>-Dimethylamino)phenyl]-3,3,4,4,5,5-hexafluoro-1-(2-methyl-5-phenyl-3-thienyl)cyclopent-1-ene","Acta Crystallographica Section E","2007","63","12","o4721","o4721","10.1107/S1600536807056899","","","0.71073","MoKα","","0.0485","0.0374","","","0.0926","0.1009","","","","","","1.027","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216853","4.943","0.0002","27.969","0.005","19.042","0.005","90","","93.295","0.005","90","","2628.2","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,4-Bis[1-(pyridin-4-ylmethyl)-1H-benzimidazol-2-yl]butane dihydrate","","- C30 H32 N6 O2 -","- C30 H32 N6 O2 -","- C120 H128 N24 O8 -","4","1","ZL2075","Shun-Li Li; Jie Liu; Jian-Fang Ma","1,4-Bis[1-(pyridin-4-ylmethyl)-1<i>H</i>-benzimidazol-2-yl]butane dihydrate","Acta Crystallographica Section E","2007","63","12","o4509","o4509","10.1107/S1600536807053949","","","0.71069","MoKα","","0.1719","0.0596","","","0.1079","0.1368","","","","","","0.997","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216854","12.16","0.003","16.809","0.004","9.441","0.002","90","","111.459","0.004","90","","1795.9","0.7","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(4-Methoxybenzenethiolato-κS)oxido[2,2'-(propylimino)bis(ethanethiolato)- κ^3^S,N,S']rhenium(V)","","- C14 H22 N O2 Re S3 -","- C14 H22 N O2 Re S3 -","- C56 H88 N4 O8 Re4 S12 -","4","1","ZL2076","Werner Kraus; Franziska Emmerling; Bernhard Noll; Steffi Noll; Hans-Jürgen Pietzsch","(4-Methoxybenzenethiolato-κ<i>S</i>)oxido[2,2'-(propylimino)bis(ethanethiolato)-κ^3^<i>S</i>,<i>N</i>,<i>S</i>']rhenium(V)","Acta Crystallographica Section E","2007","63","12","m3018","m3018","10.1107/S1600536807056814","","","0.71073","MoKα","","0.0579","0.0348","","","0.0738","0.0775","","","","","","0.892","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216855","7.414","0.0004","21.259","0.001","13.0036","0.0007","90","","92.595","0.003","90","","2047.45","0.18","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3-Oxoandrost-4-en-17β-yl 1H-imidazole-1-carboxylate","","- C23 H30 N2 O3 -","- C23 H30 N2 O3 -","- C92 H120 N8 O12 -","4","2","ZL2077","Ramos Silva, Manuela; Matos Beja, Ana; Moreira, Vânia M.; Santos, Rita C.; Salvador, Jorge A. R.","3-Oxoandrost-4-en-17β-yl 1<i>H</i>-imidazole-1-carboxylate","Acta Crystallographica Section E","2007","63","12","o4824","o4824","10.1107/S1600536807057625","","","0.71073","MoKα","","0.0997","0.0586","","","0.1525","0.185","","","","","","1.056","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216856","13.2647","0.0003","14.3741","0.0003","13.5323","0.0003","90","","103.944","0.001","90","","2504.14","0.1","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Poly[diaquatris(m~4~-benzene-1,3-dicarboxylato)diterbium(III)]","","- C24 H16 O14 Tb2 -","- C24 H16 O14 Tb2 -","- C96 H64 O56 Tb8 -","4","1","ZL2078","Rong-Hua, Zeng","Poly[diaquatris(μ~4~-benzene-1,3-dicarboxylato)diterbium(III)]","Acta Crystallographica Section E","2007","63","12","m3110","m3110","10.1107/S1600536807057765","","","0.71073","MoKα","","0.0594","0.0343","","","0.0636","0.0728","","","","","","1.023","","","","has coordinates,has disorder,has Fobs","176787","2020-10-21","18:00:00",""
"2216857","9.2058","0.0014","9.2663","0.0014","11.3877","0.0017","109.983","0.002","94.781","0.002","90.201","0.003","909.2","0.2","100","","100","","","","","","","","","5","P -1","-P 1","2","","N'-[Bis(benzylsulfanyl)methylene]-2-furohydrazide","","- C20 H18 N2 O2 S2 -","- C20 H18 N2 O2 S2 -","- C40 H36 N4 O4 S4 -","2","1","ZL2079","Butcher, Ray J.; Jasinski, Jerry P.; Kushawaha, K. S.,; Bharty, M. K.; Singh, N. K.","<i>N</i>'-[Bis(benzylsulfanyl)methylene]-2-furohydrazide","Acta Crystallographica Section E","2007","63","12","o4590","o4591","10.1107/S1600536807055080","","","0.71073","MoKα","","0.0369","0.0349","","","0.0908","0.0921","","","","","","1.053","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2216858","10.8284","0.0002","9.8002","0.0002","9.8846","0.0001","90","","113.774","0.001","90","","959.95","0.03","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Poly[[triaquasesqui-μ~2~-oxalato-terbium(III)] methanol solvate]","","- C4 H10 O10 Tb -","- C4 H10 O10 Tb -","- C16 H40 O40 Tb4 -","4","1","ZL2080","Rong-Hua, Zeng; Han-Guo, Liu","Poly[[triaquasesqui-μ~2~-oxalato-terbium(III)] methanol solvate]","Acta Crystallographica Section E","2007","63","12","m2925","m2925","10.1107/S1600536807055043","","","0.71073","MoKα","","0.0289","0.0221","","","0.0434","0.0457","","","","","","1.056","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2216859","5.8445","0.0001","19.2032","0.0003","12.3216","0.0002","90","","90","","90","","1382.89","0.04","296","2","296","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Dichloridobis(pyridine-3-carbaldehyde-κN)zinc(II)","","- C12 H10 Cl2 N2 O2 Zn -","- C12 H10 Cl2 N2 O2 Zn -","- C48 H40 Cl8 N8 O8 Zn4 -","4","0.5","ZL2084","Yinghua Li; Zhihui Liu; Hong Deng","Dichloridobis(pyridine-3-carbaldehyde-κ<i>N</i>)zinc(II)","Acta Crystallographica Section E","2007","63","12","m3065","m3065","10.1107/S1600536807057881","","","0.71073","MoKα","","0.0282","0.0218","","","0.0569","0.0607","","","","","","1.047","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2216860","6.7998","0.0013","7.9208","0.0016","8.5874","0.0018","90","","90","","90","","462.52","0.16","286","2","286","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","[^2^H~3~]Sarcosine","methyl[^2^H~3~]ammoniobenzoate","","- C3 H4 D3 N O2 -","- C3 H4 D3 N O2 -","- C12 H16 D12 N4 O8 -","4","1","ZL2085","Trzebiatowska-Gusowska, Monika; Gagor, Anna","[^2^H~3~]Sarcosine","Acta Crystallographica Section E","2007","63","12","o4694","o4694","10.1107/S1600536807057443","","","0.71073","MoKα","","0.0388","0.0277","","","0.0686","0.0745","","","","","","0.96","","","","has coordinates,has Fobs","209451","2020-10-21","18:00:00",""
"2216861","5.8203","0.0005","15.6178","0.001","19.4161","0.0016","90","","104.466","0.006","90","","1709","0.2","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-Methyl-5-(4-methylbenzoyl)-4-(4-methylphenyl)pyrimidine-2(1H)-thione","","- C20 H18 N2 O S -","- C20 H18 N2 O S -","- C80 H72 N8 O4 S4 -","4","1","ZL2088","Dinçer, Muharrem; Koca, İrfan; Yıldırım, İsmail; Özdemir, Namık","1-Methyl-5-(4-methylbenzoyl)-4-(4-methylphenyl)pyrimidine-2(1<i>H</i>)-thione","Acta Crystallographica Section E","2007","63","12","o4789","o4790","10.1107/S1600536807057923","","","0.71073","MoKα","","0.0631","0.0386","","","0.0994","0.1074","","","","","","1.008","","","","has coordinates,has Fobs","201974","2020-10-21","18:00:00",""
"2300119","6.88","","11.91","","18.6","","90","","90","","90","","1524.1","","","","","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","","","?","- C64 H128 -","- C64 H128 -","","","DB5009","Immirzi, Attilio; Alfano, Davide; Tedesco, Consiglia","New solutions to the problems of chain orientation and chain continuity in structure analysis of fibrous polymers. A reconsideration of the structure of polyisobutene","Journal of Applied Crystallography","2007","40","1","10","15","10.1107/S0021889806044955","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300120","8.446","0.001","9.123","0.001","11.779","0.002","72.26","0.01","80.94","0.01","67.33","0.01","796.8","0.2","23","1","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 Fe2 N12 S8 -","- C24 H22 Fe2 N12 S8 -","- C24 H22 Fe2 N12 S8 -","1","0.5","DB5014","Trzop, Elzbieta; Buron-Le Cointe, Marylise; Cailleau, Hervé; Toupet, Loïc; Molnar, Gabor; Bousseksou, Azzedine; Gaspar, Ana B.; Real, José Antonio; Collet, Eric","Structural investigation of the photoinduced spin conversion in the dinuclear compound {[Fe(bt)(NCS)~2~]~2~(bpym)}: toward controlled multi-stepped molecular switches","Journal of Applied Crystallography","2007","40","1","158","164","10.1107/S002188980605028X","","","0.71069","MoKα","","0.0623","0.0365","","","0.086","0.0903","","","","","","0.918","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2300121","8.6103","0.0007","9.2628","0.0008","11.9305","0.0009","72.903","0.007","80.057","0.007","66.911","0.008","834.84","0.13","180","1","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 Fe2 N12 S8 -","- C24 H22 Fe2 N12 S8 -","- C24 H22 Fe2 N12 S8 -","1","0.5","DB5014","Trzop, Elzbieta; Buron-Le Cointe, Marylise; Cailleau, Hervé; Toupet, Loïc; Molnar, Gabor; Bousseksou, Azzedine; Gaspar, Ana B.; Real, José Antonio; Collet, Eric","Structural investigation of the photoinduced spin conversion in the dinuclear compound {[Fe(bt)(NCS)~2~]~2~(bpym)}: toward controlled multi-stepped molecular switches","Journal of Applied Crystallography","2007","40","1","158","164","10.1107/S002188980605028X","","","0.71069","MoKα","","0.1371","0.0387","","","0.0635","0.0727","","","","","","0.619","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2300122","8.727","0.001","9.385","0.002","12.041","0.002","73.04","0.02","79.43","0.01","66.6","0.02","863.1","0.3","250","1","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 Fe2 N12 S8 -","- C24 H22 Fe2 N12 S8 -","- C24 H22 Fe2 N12 S8 -","1","0.5","DB5014","Trzop, Elzbieta; Buron-Le Cointe, Marylise; Cailleau, Hervé; Toupet, Loïc; Molnar, Gabor; Bousseksou, Azzedine; Gaspar, Ana B.; Real, José Antonio; Collet, Eric","Structural investigation of the photoinduced spin conversion in the dinuclear compound {[Fe(bt)(NCS)~2~]~2~(bpym)}: toward controlled multi-stepped molecular switches","Journal of Applied Crystallography","2007","40","1","158","164","10.1107/S002188980605028X","","","0.71069","MoKα","","0.1747","0.0551","","","0.1385","0.1603","","","","","","0.835","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2300123","8.581","0.002","9.196","0.002","11.948","0.003","73.34","0.02","80.53","0.02","67.24","0.02","831.4","0.4","23","1","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 Fe2 N12 S8 -","- C24 H22 Fe2 N12 S8 -","- C24 H22 Fe2 N12 S8 -","1","0.5","DB5014","Trzop, Elzbieta; Buron-Le Cointe, Marylise; Cailleau, Hervé; Toupet, Loïc; Molnar, Gabor; Bousseksou, Azzedine; Gaspar, Ana B.; Real, José Antonio; Collet, Eric","Structural investigation of the photoinduced spin conversion in the dinuclear compound {[Fe(bt)(NCS)~2~]~2~(bpym)}: toward controlled multi-stepped molecular switches","Journal of Applied Crystallography","2007","40","1","158","164","10.1107/S002188980605028X","","","0.71069","MoKα","","0.0967","0.0648","","","0.1429","0.153","","","","","","1.094","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2300124","8.642","0.001","9.224","0.002","12.05","0.003","73.63","0.02","80.29","0.01","67.25","0.02","848","0.3","23","1","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 Fe2 N12 S8 -","- C24 H22 Fe2 N12 S8 -","- C24 H22 Fe2 N12 S8 -","1","0.5","DB5014","Trzop, Elzbieta; Buron-Le Cointe, Marylise; Cailleau, Hervé; Toupet, Loïc; Molnar, Gabor; Bousseksou, Azzedine; Gaspar, Ana B.; Real, José Antonio; Collet, Eric","Structural investigation of the photoinduced spin conversion in the dinuclear compound {[Fe(bt)(NCS)~2~]~2~(bpym)}: toward controlled multi-stepped molecular switches","Journal of Applied Crystallography","2007","40","1","158","164","10.1107/S002188980605028X","","","0.71069","MoKα","","0.0634","0.0401","","","0.1106","0.1162","","","","","","1.054","","","","has coordinates,has Fobs","219800","2020-10-21","18:00:00",""
"2300125","12.68581","0.00034","8.18939","0.0002","17.7934","0.0005","90","","106.011","0.0029","90","","1776.83","0.09","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","sulindac","2-[6-fluoro-2-methyl-3- [(4-methylsulfinylphenyl)methylidene]inden-1-yl]- acetic acid","","- C20 H17 F O3 S -","- C20 H17 F O3 S -","- C80 H68 F4 O12 S4 -","4","1","","Llinàs, Antonio; Box, Karl J.; Burley, Jonathan C.; Glen, Robert C.; Goodman, Jonathan M.","A new method for the reproducible generation of polymorphs: two forms of sulindac with very different solubilities","Journal of Applied Crystallography","2007","40","2","379","381","10.1107/S0021889807007832","powder diffraction","x-ray","1.78892","CoKα","","","","","","","","0.0749","","1.67","","","","","","","has coordinates,has Fobs","176809","2020-10-21","18:00:00",""
"2300126","21.5111","0.0007","21.5111","0.0007","13.2377","0.0009","90","","90","","90","","6125.4","0.5","298","2","298","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C20 H14 N2 O -","- C20 H14 N2 O -","- C320 H224 N32 O16 -","16","1","KK5009","Zeng, He-Ping; Wang, Ting-Ting; Xu, Dan-Feng; Cai, Yue-Peng; Chen, Dong-Feng","Synthesis, crystal structure and biological activity of 2-[2-(quinolin-2-yl)vinyl]-8-hydroxyquinoline and 2-[2-(quinolin-4-yl)vinyl]-8-hydroxyquinoline","Journal of Applied Crystallography","2007","40","3","471","475","10.1107/S0021889807007704","","","0.71073","MoKα","","0.1103","0.0534","","","0.1359","0.1682","","","","","","1.002","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2300127","10.724","0.0006","8.9019","0.0005","16.1894","0.0008","90","","102.039","0.004","90","","1511.51","0.14","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 N2 O -","- C20 H14 N2 O -","- C80 H56 N8 O4 -","4","1","KK5009","Zeng, He-Ping; Wang, Ting-Ting; Xu, Dan-Feng; Cai, Yue-Peng; Chen, Dong-Feng","Synthesis, crystal structure and biological activity of 2-[2-(quinolin-2-yl)vinyl]-8-hydroxyquinoline and 2-[2-(quinolin-4-yl)vinyl]-8-hydroxyquinoline","Journal of Applied Crystallography","2007","40","3","471","475","10.1107/S0021889807007704","","","0.71073","MoKα","","0.0688","0.043","","","0.1012","0.1163","","","","","","1.05","","","","has coordinates,has Fobs","201980","2020-10-21","18:00:00",""
"2300128","5.174713","0.000029","7.87563","0.00005","6.49517","0.00005","90","","90","","90","","264.705","0.003","300","","","","","","","","","","Formed by reacting MgO with H2SO4 in excess then drying for 24 hr at 400 deg C.","3","C m c m","-C 2c 2","63","magnesium sulfate","alpha-magnesium sulfate","","- Mg O4 S -","- Mg O4 S -","- Mg4 O16 S4 -","4","0.25","DB5013","Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Brand, H. E. A.; Knight, K. S.","Crystal structures and thermal expansion of α-MgSO~4~ and β-MgSO~4~ from 4.2 to 300K by neutron powder diffraction","Journal of Applied Crystallography","2007","40","4","761","770","10.1107/S0021889807029937","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300129","5.168629","0.000033","7.86781","0.00005","6.46674","0.00005","90","","90","","90","","262.975","0.003","4","","","","","","","","","","Formed by reacting MgO with H2SO4 in excess then drying for 24 hr at 400C.","3","C m c m","-C 2c 2","63","magnesium sulfate","alpha-magnesium sulfate","","- Mg O4 S -","- Mg O4 S -","- Mg4 O16 S4 -","4","0.25","DB5013","Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Brand, H. E. A.; Knight, K. S.","Crystal structures and thermal expansion of α-MgSO~4~ and β-MgSO~4~ from 4.2 to 300K by neutron powder diffraction","Journal of Applied Crystallography","2007","40","4","761","770","10.1107/S0021889807029937","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300130","4.74599","0.00007","8.5831","0.0001","6.70934","0.0001","90","","90","","90","","273.307","0.007","300","","","","","","","","","","Sigma Ultra MgSO4 M7506 dried at 400 deg C for 24 hr.","3","P b n m","-P 2c 2ab","62","magnesium sulfate","alpha-magnesium sulfate","","- Mg O4 S -","- Mg O4 S -","- Mg4 O16 S4 -","4","0.5","DB5013","Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Brand, H. E. A.; Knight, K. S.","Crystal structures and thermal expansion of α-MgSO~4~ and β-MgSO~4~ from 4.2 to 300K by neutron powder diffraction","Journal of Applied Crystallography","2007","40","4","761","770","10.1107/S0021889807029937","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300131","4.73431","0.00008","8.58171","0.00012","6.67266","0.00011","90","","90","","90","","271.1","0.007","4","","","","","","","","","","Sigma Ultra MgSO4 M7506 dried at 400 deg C for 24 hr.","3","P b n m","-P 2c 2ab","62","magnesium sulfate","alpha-magnesium sulfate","","- Mg O4 S -","- Mg O4 S -","- Mg4 O16 S4 -","4","0.5","DB5013","Fortes, A. D.; Wood, I. G.; Vočadlo, L.; Brand, H. E. A.; Knight, K. S.","Crystal structures and thermal expansion of α-MgSO~4~ and β-MgSO~4~ from 4.2 to 300K by neutron powder diffraction","Journal of Applied Crystallography","2007","40","4","761","770","10.1107/S0021889807029937","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300132","6.8558","0.0001","6.8558","0.0001","16.9375","0.0001","90","","90","","90","","796.096","","","","","","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","","","- C40 H48 O8 -","- C10 H12 O2 -","- C40 H48 O8 -","4","0.5","HE5379","Brunelli, Michela; Neumann, Marcus A.; Fitch, Andrew N.; Mora, Asiloé J.","Temperature phase changes in solid bicyclo[3.3.1]nonane-2,6-dione and bicyclo[3.3.1]nonane-3,7-dione from powder X-ray diffraction data","Journal of Applied Crystallography","2007","40","4","702","709","10.1107/S0021889807028087","","","","","","","","","","","","","","","","","","","","","has coordinates","208198","2020-10-21","18:00:00",""
"2300133","7.3803","","10.382","","9.7508","","90","","95.359","","90","","743.863","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C34 H48 O8 -","- C8.5 H12 O2 -","- C34 H48 O8 -","4","0.5","HE5379","Brunelli, Michela; Neumann, Marcus A.; Fitch, Andrew N.; Mora, Asiloé J.","Temperature phase changes in solid bicyclo[3.3.1]nonane-2,6-dione and bicyclo[3.3.1]nonane-3,7-dione from powder X-ray diffraction data","Journal of Applied Crystallography","2007","40","4","702","709","10.1107/S0021889807028087","","","","","","","","","","","","","","","","","","","","","has coordinates","208198","2020-10-21","18:00:00",""
"2300134","5.7523","0.0002","5.7523","0.0002","7.0634","0.0003","90","","90","","120","","202.408","0.013","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","?","- Ba3 Nb2 Ni O9 -","- Ba3 Nb2 Ni O9 -","","","HX5056","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300135","4.07307","0.00018","4.07307","0.00018","4.07307","0.00018","90","","90","","90","","67.572","0.009","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.67 Ni0.33 O3 -","- Ba Nb0.67 Ni0.33 O3 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300136","5.7657","0.0003","5.7657","0.0003","7.0444","0.0007","90","","90","","120","","202.81","0.03","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","?","- Ba3 Nb2 Ni O9 -","- Ba3 Nb2 Ni O9 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300137","4.07013","0.00019","4.07013","0.00019","4.07013","0.00019","90","","90","","90","","67.426","0.005","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.67 Ni0.33 O3 -","- Ba Nb0.67 Ni0.33 O3 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300138","5.7532","0.0002","5.7532","0.0002","7.0641","0.0003","90","","90","","120","","202.491","0.013","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","?","- Ba3 Nb2 Ni O9 -","- Ba3 Nb2 Ni O9 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300139","4.07348","0.00019","4.07348","0.00019","4.07348","0.00019","90","","90","","90","","67.592","0.01","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.67 Ni0.33 O3 -","- Ba Nb0.67 Ni0.33 O3 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300140","5.7675","0.0004","5.7675","0.0004","7.0567","0.0009","90","","90","","120","","203.29","0.03","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","?","- Ba3 Nb2 Ni O9 -","- Ba3 Nb2 Ni O9 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300141","4.0712","0.0003","4.0712","0.0003","4.0712","0.0003","90","","90","","90","","67.479","0.013","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.67 Ni0.33 O3 -","- Ba Nb0.67 Ni0.33 O3 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300142","5.7893","0.0005","5.7893","0.0005","7.1158","0.0009","90","","90","","120","","206.54","0.04","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","?","- Ba3 Nb2 O9 Zn -","- Ba3 Nb2 O9 Zn -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300143","4.07045","0.00009","4.07045","0.00009","4.07045","0.00009","90","","90","","90","","67.442","0.005","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.438078 O3 Zn0.561922 -","- Ba Nb0.438078 O3 Zn0.561922 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300144","5.7665","0.0003","5.7665","0.0003","7.058","0.0007","90","","90","","120","","203.25","0.03","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","?","- Ba3 Nb2 O9 Zn -","- Ba3 Nb2 O9 Zn -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300145","4.093113","0.000009","4.093113","0.000009","4.093113","0.000009","90","","90","","90","","68.5743","0.0003","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.679 O3 Zn0.321 -","- Ba Nb0.679 O3 Zn0.321 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300146","4.09518","0.00007","4.09518","0.00007","4.09518","0.00007","90","","90","","90","","68.678","0.002","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.688657 O3 Zn0.34 -","- Ba Nb0.688657 O3 Zn0.34 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300147","4.07207","0.00006","4.07207","0.00006","4.07207","0.00006","90","","90","","90","","67.5221","0.0017","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.67 O3 Zn0.33 -","- Ba Nb0.67 O3 Zn0.33 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300148","5.74601","0.00009","5.74601","0.00009","7.06047","0.00017","90","","90","","120","","201.882","0.007","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","?","- Ba3 Nb2 Ni O9 -","- Ba3 Nb2 Ni O9 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300149","5.762","0.0006","5.762","0.0006","7.0764","0.0009","90","","90","","120","","203.46","0.04","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","?","- Ba3 Nb2 Ni O9 -","- Ba3 Nb2 Ni O9 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300150","5.7645","0.0011","5.7645","0.0011","7.092","0.0018","90","","90","","120","","204.09","0.08","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","?","- Ba3 Nb2 Ni O9 -","- Ba3 Nb2 Ni O9 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300151","4.06541","0.00004","4.06541","0.00004","4.06541","0.00004","90","","90","","90","","67.1913","0.0011","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.67 Ni0.33 O3 -","- Ba Nb0.67 Ni0.33 O3 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300152","4.06857","0.0001","4.06857","0.0001","4.06857","0.0001","90","","90","","90","","67.348","0.003","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.67 Ni0.33 O3 -","- Ba Nb0.67 Ni0.33 O3 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300153","4.07191","0.00009","4.07191","0.00009","4.07191","0.00009","90","","90","","90","","67.514","0.004","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.67 Ni0.33 O3 -","- Ba Nb0.67 Ni0.33 O3 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300154","5.7654","0.001","5.7654","0.001","7.091","0.0016","90","","90","","120","","204.13","0.07","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","?","- Ba3 Nb2 O9 Zn -","- Ba3 Nb2 O9 Zn -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300155","5.74666","0.00005","5.74666","0.00005","7.05943","0.00008","90","","90","","120","","201.898","0.003","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","?","- Ba3 Nb2 O9 Zn -","- Ba3 Nb2 O9 Zn -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300156","5.7462","0.00006","5.7462","0.00006","7.05894","0.00009","90","","90","","120","","201.851","0.004","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","?","- Ba3 Nb2 O9 Zn -","- Ba3 Nb2 O9 Zn -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300158","4.06839634","","4.06839634","","4.06839634","","90","","90","","90","","67.339","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.438078 O3 Zn0.561922 -","- Ba Nb0.438078 O3 Zn0.561922 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300159","4.066","0.00005","4.066","0.00005","4.066","0.00005","90","","90","","90","","67.2206","0.0014","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","?","- Ba Nb0.438078 O3 Zn0.561922 -","- Ba Nb0.438078 O3 Zn0.561922 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300160","5.7981","0.0006","5.7981","0.0006","11.7947","0.0012","90","","90","","120","","343.39","0.06","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","","?","- Ba5 Nb4 O15 -","- Ba5 Nb4 O15 -","","","","Cernik, R. J.; Barwick, M.; Azough, F.; Freer, R.","A synchrotron X-ray study of structural ordering in~the microwave dielectric ceramic system: Ba(Ni~1/3~Nb~2/3~)O~3~‒Ba(Zn~1/3~Nb~2/3~)O~3~","Journal of Applied Crystallography","2007","40","4","749","755","10.1107/S0021889807028051","","","","","","","","","","","","","","","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300161","6.22215","0.00008","6.22215","","11.37072","0.00016","90","","90","","120","","381.241","0.007","","","","","","","","","","","","3","P 63 c m","P 6c -2","185","","","","- Mn O3 Y -","- Mn O3 Y -","- Mn6 O18 Y6 -","6","0.5","KO5041","Jeong, Il-Kyoung; Hur, N.; Proffen, Th.","High-temperature structural evolution of hexagonal multiferroic YMnO~3~ and YbMnO~3~","Journal of Applied Crystallography","2007","40","4","730","734","10.1107/S0021889807025101","powder diffraction","neutron","","","","","","","","","","0.13213","","2.34","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300162","3.63011","0.00004","3.63011","","11.3535","0.00017","90","","90","","120","","129.569","0.002","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Mn O3 Y -","- Mn O3 Y -","- Mn2 O6 Y2 -","2","0.0833333","KO5041","Jeong, Il-Kyoung; Hur, N.; Proffen, Th.","High-temperature structural evolution of hexagonal multiferroic YMnO~3~ and YbMnO~3~","Journal of Applied Crystallography","2007","40","4","730","734","10.1107/S0021889807025101","powder diffraction","neutron","","","","","","","","","","0.25865","","3","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300163","6.132019","0.000033","6.132019","","11.38556","0.00012","90","","90","","120","","370.759","0.004","","","","","","","","","","","","3","P 63 c m","P 6c -2","185","","","","- Mn O3 Yb -","- Mn O3 Yb -","- Mn6 O18 Yb6 -","6","0.5","KO5041","Jeong, Il-Kyoung; Hur, N.; Proffen, Th.","High-temperature structural evolution of hexagonal multiferroic YMnO~3~ and YbMnO~3~","Journal of Applied Crystallography","2007","40","4","730","734","10.1107/S0021889807025101","powder diffraction","neutron","","","","","","","","","","0.11142","","3.21","","","","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300164","10.1545","0.0003","19.0923","0.0006","15.0033","0.0005","90","","91.566","0.003","90","","2907.64","0.16","80","2","80","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 Fe N7 O8 -","- C27 H33 Cl2 Fe N7 O8 -","- C108 H132 Cl8 Fe4 N28 O32 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0454","0.0327","","","0.0993","0.1042","","","","","","1.006","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300165","10.1834","0.0003","19.072","0.0005","15.0304","0.0004","90","","91.467","0.003","90","","2918.21","0.14","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 Fe N7 O8 -","- C27 H33 Cl2 Fe N7 O8 -","- C108 H132 Cl8 Fe4 N28 O32 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0471","0.0338","","","0.1032","0.1079","","","","","","1.003","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300166","10.1952","0.0004","19.0901","0.0007","15.0429","0.0006","90","","91.451","0.004","90","","2926.8","0.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 Fe N7 O8 -","- C27 H33 Cl2 Fe N7 O8 -","- C108 H132 Cl8 Fe4 N28 O32 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0569","0.038","","","0.1153","0.1229","","","","","","1.007","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300167","10.2122","0.0003","19.1179","0.0006","15.0573","0.0005","90","","91.42","0.003","90","","2938.82","0.16","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 Fe N7 O8 -","- C27 H33 Cl2 Fe N7 O8 -","- C108 H132 Cl8 Fe4 N28 O32 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0572","0.0398","","","0.1228","0.1301","","","","","","1.005","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300168","10.2327","0.0004","19.1464","0.0007","15.0753","0.0006","90","","91.402","0.004","90","","2952.7","0.2","190","2","190","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 Fe N7 O8 -","- C27 H33 Cl2 Fe N7 O8 -","- C108 H132 Cl8 Fe4 N28 O32 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0662","0.0452","","","0.1433","0.1555","","","","","","0.999","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300169","10.2747","0.0004","19.2019","0.0006","15.1011","0.0005","90","","91.399","0.003","90","","2978.46","0.18","210","2","210","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 Fe N7 O8 -","- C27 H33 Cl2 Fe N7 O8 -","- C108 H132 Cl8 Fe4 N28 O32 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0711","0.0466","","","0.1441","0.1546","","","","","","1.006","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300170","10.3663","0.0004","19.2603","0.0006","15.1373","0.0005","90","","91.432","0.003","90","","3021.34","0.18","230","2","230","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 Fe N7 O8 -","- C27 H33 Cl2 Fe N7 O8 -","- C108 H132 Cl8 Fe4 N28 O32 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0771","0.0467","","","0.1394","0.1494","","","","","","1","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300171","10.4678","0.0004","19.3228","0.0007","15.1695","0.0006","90","","91.501","0.003","90","","3067.2","0.2","250","2","250","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 Fe N7 O8 -","- C27 H33 Cl2 Fe N7 O8 -","- C108 H132 Cl8 Fe4 N28 O32 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0804","0.044","","","0.1252","0.1338","","","","","","1.004","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300172","10.529","0.0004","19.3683","0.0007","15.1933","0.0006","90","","91.541","0.003","90","","3097.2","0.2","270","2","270","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 Fe N7 O8 -","- C27 H33 Cl2 Fe N7 O8 -","- C108 H132 Cl8 Fe4 N28 O32 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0859","0.0448","","","0.1262","0.1354","","","","","","1.003","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300173","10.5677","0.0005","19.4022","0.0007","15.2137","0.0006","90","","91.564","0.004","90","","3118.2","0.2","290","2","290","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 Fe N7 O8 -","- C27 H33 Cl2 Fe N7 O8 -","- C108 H132 Cl8 Fe4 N28 O32 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0934","0.0467","","","0.1321","0.1417","","","","","","1.007","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300174","10.6005","0.0007","19.4289","0.0011","15.2382","0.001","90","","91.595","0.006","90","","3137.2","0.3","310","2","310","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 Fe N7 O8 -","- C27 H33 Cl2 Fe N7 O8 -","- C108 H132 Cl8 Fe4 N28 O32 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.1047","0.0488","","","0.1407","0.1523","","","","","","1.005","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300175","10.6286","0.0007","19.4535","0.0011","15.2589","0.001","90","","91.626","0.006","90","","3153.7","0.3","330","2","330","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 Fe N7 O8 -","- C27 H33 Cl2 Fe N7 O8 -","- C108 H132 Cl8 Fe4 N28 O32 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.1073","0.0509","","","0.1489","0.1619","","","","","","1.003","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300176","10.3736","0.0003","19.1884","0.0005","15.1122","0.0004","90","","91.885","0.002","90","","3006.5","0.14","80","2","80","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 N7 O8 Zn -","- C27 H33 Cl2 N7 O8 Zn -","- C108 H132 Cl8 N28 O32 Zn4 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0389","0.0271","","","0.0731","0.0754","","","","","","1.001","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300177","10.4189","0.0003","19.2284","0.0005","15.1216","0.0004","90","","91.726","0.002","90","","3028.07","0.14","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 N7 O8 Zn -","- C27 H33 Cl2 N7 O8 Zn -","- C108 H132 Cl8 N28 O32 Zn4 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0458","0.029","","","0.0758","0.0787","","","","","","1","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300178","10.4611","0.0003","19.2701","0.0006","15.132","0.0004","90","","91.596","0.003","90","","3049.22","0.15","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 N7 O8 Zn -","- C27 H33 Cl2 N7 O8 Zn -","- C108 H132 Cl8 N28 O32 Zn4 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0533","0.0313","","","0.0796","0.0831","","","","","","1.005","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300179","10.507","0.0004","19.3169","0.0007","15.1467","0.0006","90","","91.492","0.003","90","","3073.2","0.2","210","2","210","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 N7 O8 Zn -","- C27 H33 Cl2 N7 O8 Zn -","- C108 H132 Cl8 N28 O32 Zn4 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0627","0.0338","","","0.0863","0.0904","","","","","","1.001","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300180","10.5321","0.0004","19.3391","0.0007","15.1543","0.0005","90","","91.468","0.003","90","","3085.63","0.19","230","2","230","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 N7 O8 Zn -","- C27 H33 Cl2 N7 O8 Zn -","- C108 H132 Cl8 N28 O32 Zn4 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0701","0.0367","","","0.0944","0.0995","","","","","","1","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300181","10.5561","0.0004","19.3641","0.0007","15.1621","0.0005","90","","91.441","0.003","90","","3098.3","0.19","250","2","250","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 N7 O8 Zn -","- C27 H33 Cl2 N7 O8 Zn -","- C108 H132 Cl8 N28 O32 Zn4 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0768","0.0381","","","0.0991","0.1045","","","","","","1","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300182","10.5813","0.0004","19.3933","0.0007","15.1756","0.0005","90","","91.429","0.003","90","","3113.16","0.19","270","2","270","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 N7 O8 Zn -","- C27 H33 Cl2 N7 O8 Zn -","- C108 H132 Cl8 N28 O32 Zn4 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.086","0.0406","","","0.1071","0.1136","","","","","","1.009","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300183","10.625","0.002","19.456","0.004","15.22","0.003","90","","91.5","0.03","90","","3145.2","1.1","290","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 N7 O8 Zn -","- C27 H33 Cl2 N7 O8 Zn -","- C108 H132 Cl8 N28 O32 Zn4 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.0933","0.0424","","","0.1145","0.122","","","","","","1.001","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300184","10.6308","0.0005","19.4519","0.0008","15.213","0.0006","90","","91.451","0.004","90","","3144.9","0.2","310","2","310","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 N7 O8 Zn -","- C27 H33 Cl2 N7 O8 Zn -","- C108 H132 Cl8 N28 O32 Zn4 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.1027","0.0447","","","0.1199","0.1274","","","","","","1.004","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300185","10.6541","0.0005","19.4812","0.0008","15.2306","0.0006","90","","91.478","0.004","90","","3160.1","0.2","330","2","330","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Cl2 N7 O8 Zn -","- C27 H33 Cl2 N7 O8 Zn -","- C108 H132 Cl8 N28 O32 Zn4 -","4","1","","Seredyuk, Maksym; Gaspar, Ana B.; Kusz, Joachim; Bednarek, Gabriela; Gütlich, Philipp","Variable-temperature X-ray crystal structure determinations of {Fe[tren(6-Mepy)~3~]}(ClO~4~)~2~ and {Zn[tren(6-Mepy)~3~]}(ClO~4~)~2~ compounds: correlation of the structural data with magnetic and Mössbauer spectroscopy data","Journal of Applied Crystallography","2007","40","6","1135","1145","10.1107/S0021889807048571","","","0.71073","MoKα","","0.1131","0.0466","","","0.1258","0.1335","","","","","","1.021","","","","has coordinates","176809","2020-10-21","18:00:00",""
"2300186","13.1928","0.0004","9.9503","0.0003","17.1498","0.0008","90","","90","","90","","2251.29","0.14","32","2","32","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C26 H16 Fe N6 S2 -","- C26 H16 Fe N6 S2 -","- C104 H64 Fe4 N24 S8 -","4","0.5","DB5028","Legrand, Vincent; Pillet, Sébastien; Weber, Hans-Peter; Souhassou, Mohamed; Létard, Jean-François; Guionneau, Philippe; Lecomte, Claude","On the precision and accuracy of structural analysis of light-induced metastable states","Journal of Applied Crystallography","2007","40","6","1076","1088","10.1107/S0021889807040149","","","0.71073","MoKα","","0.0986","0.045","","","0.0977","0.1083","","","","","","0.908","","","","has coordinates,has Fobs","176809","2020-10-21","18:00:00",""
"2300187","13.185","0.001","9.948","0.001","17.135","0.001","90","","90","","90","","2247.5","0.3","15","2","15","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C26 H16 Fe N6 S2 -","- C26 H16 Fe N6 S2 -","- C104 H64 Fe4 N24 S8 -","4","0.5","","Legrand, Vincent; Pillet, Sébastien; Weber, Hans-Peter; Souhassou, Mohamed; Létard, Jean-François; Guionneau, Philippe; Lecomte, Claude","On the precision and accuracy of structural analysis of light-induced metastable states","Journal of Applied Crystallography","2007","40","6","1076","1088","10.1107/S0021889807040149","","","0.71","synchrotron","","0.0879","0.0642","","","0.1718","0.1995","","","","","","1.066","","","","has coordinates,has Fobs","176809","2020-10-21","18:00:00",""
"2300188","12.762","0.001","10.024","0.001","17.09","0.001","90","","90","","90","","2186.3","0.3","15","2","15","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C26 H16 Fe N6 S2 -","- C26 H16 Fe N6 S2 -","- C104 H64 Fe4 N24 S8 -","4","0.5","","Legrand, Vincent; Pillet, Sébastien; Weber, Hans-Peter; Souhassou, Mohamed; Létard, Jean-François; Guionneau, Philippe; Lecomte, Claude","On the precision and accuracy of structural analysis of light-induced metastable states","Journal of Applied Crystallography","2007","40","6","1076","1088","10.1107/S0021889807040149","","","0.71","synchrotron","","0.0665","0.0488","","","0.1364","0.1482","","","","","","1.034","","","","has coordinates,has Fobs","176809","2020-10-21","18:00:00",""
"4001280","8.155","0.002","13.526","0.006","5.9648","0.0015","90","","90","","90","","657.9","0.4","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- S3 Te Tl2 -","- S3 Te Tl2 -","- S12 Te4 Tl8 -","4","0.5","","Rieger, Franziska; Mudring, Anja-Verena","Synthesis, Structure, and Electronic and Physical Properties of Tl2TeS3, the First Characterized Thallium(I) Thiotellurate(IV)","Chemistry of Materials","2007","19","2","221","","10.1021/cm0526866","","","0.71073","MoKα","","0.1088","0.0541","","","0.0997","0.1136","","","","","","0.891","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001281","4.9407","0.0007","8.5277","0.0006","5.0184","0.0006","90","","109.141","0.015","90","","199.75","0.04","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Li1.33 Mn0.67 O2 -","- Li1.33333 Mn0.666667 O2 -","- Li8 Mn4 O12 -","6","0.75","","Ngala, J. Katana; Alia, Shaun; Dobley, Arthur; Crisostomo, Vincent Mark B.; Suib, Steven L.","Characterization and Electrocatalytic Behavior of Layered Li2MnO3and Its Acid-Treated Form","Chemistry of Materials","2007","19","2","229","","10.1021/cm0616937","powder diffraction","x-ray","1.5406","CuKα~1~","","","","","","","","0.11392","","3.2","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001282","5.0512","0.0012","8.7065","0.0018","4.9045","0.0009","90","","109.196","0.016","90","","203.7","0.08","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Li0.11 Mn0.34 O -","- Li0.106333 Mn0.33762 O -","- Li1.276 Mn4.05144 O12 -","12","1.5","","Ngala, J. Katana; Alia, Shaun; Dobley, Arthur; Crisostomo, Vincent Mark B.; Suib, Steven L.","Characterization and Electrocatalytic Behavior of Layered Li2MnO3and Its Acid-Treated Form","Chemistry of Materials","2007","19","2","229","","10.1021/cm0616937","powder diffraction","x-ray","1.5406","CuKα~1~","","","","","","","","0.12214","","1.98","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001283","10.864","0.002","4.448","0.0009","4.2396","0.0008","90","","90","","90","","204.87","0.07","293","2","293","2","","","","","","","","3","P m n 21","P 2ac -2","31","β-Tin-tetraborate","Tin (II) - tetraborate","","- B4 O7 Sn -","- B4 O7 Sn -","- B8 O14 Sn2 -","2","0.5","","Knyrim, Johanna S.; Schappacher, Falko M.; Pöttgen, Rainer; Schmedt auf der Günne, Jörn; Johrendt, Dirk; Huppertz, Hubert","Pressure-Induced Crystallization and Characterization of the Tin Borate β-SnB4O7","Chemistry of Materials","2007","19","2","254","","10.1021/cm061946w","","","0.71073","MoKα","","0.0155","0.0145","","","0.0322","0.0324","","","","","","1.064","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001284","21.496","0.004","30.23","0.006","25.858","0.005","90","","104.85","0.03","90","","16242","6","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C191.26 H120 Mo6 N8 O19.5 -","- C191.194 H120 Mo5.9996 N8 O19.6102 -","- C764.776 H480 Mo23.9984 N32 O78.4408 -","4","0.5","","Kojima, Takahiko; Harada, Ryosuke; Nakanishi, Tatsuaki; Kaneko, Kenji; Fukuzumi, Shunichi","Porphyrin Nanotubes Based on Self-Assembly of Mo(V)−Dodecaphenylporphyrin Complexes and Inclusion of Mo−Oxo Clusters: Synthesis and Characterization by X-ray Crystallography and Transmission Electron Microscopy","Chemistry of Materials","2007","19","1","51","","10.1021/cm062031k","","","0.71073","MoKα","","0.0638","0.0605","","","0.1298","0.1315","","","","","","1.175","","","","has coordinates,has disorder","286259","2023-09-07","05:54:21",""
"4001285","5.8904","0.0003","7.6297","0.0004","8.154","0.0004","90","","90","","90","","366.46","0.03","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- H2 Na Np O4 -","- H2 Na Np O4 -","- H8 Na4 Np4 O16 -","4","1","","Almond, Philip M.; Skanthakumar, S.; Soderholm, L.; Burns, Peter C.","Cation−Cation Interactions and Antiferromagnetism in Na[Np(V)O2(OH)2]: Synthesis, Structure, and Magnetic Properties","Chemistry of Materials","2007","19","2","280","","10.1021/cm0621040","","","0.71073","MoKα","","0.0161","0.0152","","","0.0349","0.0351","","","","","","1.041","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001286","7.4158","0.0009","4.618","0.0009","7.8577","0.0008","90","","90","","90","","269.1","0.07","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ce Rh Sb -","- Ce Rh Sb -","- Ce4 Rh4 Sb4 -","4","0.5","","Chevalier, B.; Decourt, R.; Heying, B.; Schappacher, F. M.; Rodewald, U. Ch.; Hoffmann, R.-D.; Pöttgen, R.; Eger, R.; Simon, A.","Inducing Magnetism in the Kondo Semiconductor CeRhSb through Hydrogenation: Antiferromagnetic Behavior of the New Hydride CeRhSbH0.2","Chemistry of Materials","2007","19","1","28","","10.1021/cm062168a","","","0.71073","MoKα","","0.0661","0.0434","","","0.0873","0.096","","","","","","1.193","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001287","7.422","0.002","4.625","0.002","7.877","0.002","90","","90","","90","","270.39","0.15","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ce Rh Sb -","- Ce Rh Sb -","- Ce4 Rh4 Sb4 -","4","0.5","","Chevalier, B.; Decourt, R.; Heying, B.; Schappacher, F. M.; Rodewald, U. Ch.; Hoffmann, R.-D.; Pöttgen, R.; Eger, R.; Simon, A.","Inducing Magnetism in the Kondo Semiconductor CeRhSb through Hydrogenation: Antiferromagnetic Behavior of the New Hydride CeRhSbH0.2","Chemistry of Materials","2007","19","1","28","","10.1021/cm062168a","","","0.71073","MoKα","","0.0723","0.0561","","","0.1409","0.1444","","","","","","1.224","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001288","8.1795","0.0015","14.494","0.003","26.543","0.004","90","","97.8","0.013","90","","3117.7","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H28 Br N O -","- C14 H28 Br N O -","- C112 H224 Br8 N8 O8 -","8","2","","Villaescusa, L. A.; Díaz, I.; Barrett, P. A.; Nair, S.; LLoris-Cormano, J. M.; Martínez-Mañez, R.; Tsapatsis, M.; Liu, Z.; Terasaki, O.; Camblor, M. A.","Pure Silica Large Pore Zeolite ITQ-7: Synthetic Strategies, Structure-Directing Effects, and Control and Nature of Structural Disorder","Chemistry of Materials","2007","19","7","1601","","10.1021/cm0622248","","","0.71073","MoKα","","0.1037","0.0581","","0.1958","0.1425","","","","1.085","1.109","1.109","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001289","24.9728","0.0006","24.9728","0.0006","9.8957","0.0002","90","","90","","90","","6171.4","0.2","200","2","200","2","","","","","","","synthesis as described","5","I 4 c m","I 4 -2c","108","","","","- C30 H112 Ge36 N10 O92 -","- C30 H112 Ge36 N10 O92 -","- C60 H224 Ge72 N20 O184 -","2","0.125","","Attfield, Martin P.; Al-Ebini, Yousef; Pritchard, Robin G.; Andrews, Ellen M.; Charlesworth, Richard J.; Hung, Wan; Masheder, Ben J.; Royal, Drew S.","Synthesis and Characterization of a Novel Germanate Material Containing 16-Ring Channels and Templated by a Simple Primary Amine","Chemistry of Materials","2007","19","2","316","","10.1021/cm062241x","","x-ray","0.71073","MoKα","","0.0347","0.027","","","0.0577","0.0598","","","","","","0.973","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001290","16.4891","0.0009","3.9705","0.0002","21.1266","0.0011","90","","90","","90","","1383.16","0.13","193","2","193","2","","","","","","","","3","P n m a","-P 2ac 2n","62","cerium erbium sulfide","","","- Ce3 Er3 S9 -","- Ce3 Er3 S9 -","- Ce12 Er12 S36 -","4","0.5","","Jin, Geng Bang; Choi, Eun Sang; Guertin, Robert P.; Brooks, James S.; Bray, Travis H.; Booth, Corwin H.; Albrecht-Schmitt, Thomas E.","Syntheses, Structure, Magnetism, and Optical Properties of the Ordered Mixed-Lanthanide Sulfides γ-LnLn‘S3(Ln = La, Ce; Ln‘ = Er, Tm, Yb)","Chemistry of Materials","2007","19","3","567","","10.1021/cm062349c","","","0.71073","MoKα","","0.0292","0.027","","","0.0667","0.0675","","","","","","1.108","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001291","16.4591","0.0013","3.9704","0.0003","21.0908","0.0017","90","","90","","90","","1378.27","0.19","193","2","193","2","","","","","","","","3","P n m a","-P 2ac 2n","62","cerium thulium sulfide","","","- Ce3 S9 Tm3 -","- Ce3 S9 Tm3 -","- Ce12 S36 Tm12 -","4","0.5","","Jin, Geng Bang; Choi, Eun Sang; Guertin, Robert P.; Brooks, James S.; Bray, Travis H.; Booth, Corwin H.; Albrecht-Schmitt, Thomas E.","Syntheses, Structure, Magnetism, and Optical Properties of the Ordered Mixed-Lanthanide Sulfides γ-LnLn‘S3(Ln = La, Ce; Ln‘ = Er, Tm, Yb)","Chemistry of Materials","2007","19","3","567","","10.1021/cm062349c","","","0.71073","MoKα","","0.0338","0.03","","","0.0719","0.0735","","","","","","1.071","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001292","16.3678","0.001","3.9562","0.0002","21.0577","0.0012","90","","90","","90","","1363.58","0.13","193","2","193","2","","","","","","","","3","P n m a","-P 2ac 2n","62","cerium ytterbium sulfide","","","- Ce3 S9 Yb3 -","- Ce3 S9 Yb3 -","- Ce12 S36 Yb12 -","4","0.5","","Jin, Geng Bang; Choi, Eun Sang; Guertin, Robert P.; Brooks, James S.; Bray, Travis H.; Booth, Corwin H.; Albrecht-Schmitt, Thomas E.","Syntheses, Structure, Magnetism, and Optical Properties of the Ordered Mixed-Lanthanide Sulfides γ-LnLn‘S3(Ln = La, Ce; Ln‘ = Er, Tm, Yb)","Chemistry of Materials","2007","19","3","567","","10.1021/cm062349c","","","0.71073","MoKα","","0.0297","0.0286","","","0.0798","0.0803","","","","","","1.196","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001293","16.5102","0.001","3.9963","0.0002","21.2597","0.0013","90","","90","","90","","1402.71","0.14","193","2","193","2","","","","","","","","3","P n m a","-P 2ac 2n","62","lanthanum erbium sulfide","","","- Er3 La3 S9 -","- Er3 La3 S9 -","- Er12 La12 S36 -","4","0.5","","Jin, Geng Bang; Choi, Eun Sang; Guertin, Robert P.; Brooks, James S.; Bray, Travis H.; Booth, Corwin H.; Albrecht-Schmitt, Thomas E.","Syntheses, Structure, Magnetism, and Optical Properties of the Ordered Mixed-Lanthanide Sulfides γ-LnLn‘S3(Ln = La, Ce; Ln‘ = Er, Tm, Yb)","Chemistry of Materials","2007","19","3","567","","10.1021/cm062349c","","","0.71073","MoKα","","0.0328","0.0297","","","0.068","0.0692","","","","","","1.088","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001294","16.45","0.0009","3.9877","0.0002","21.2148","0.0012","90","","90","","90","","1391.64","0.13","193","2","193","2","","","","","","","","3","P n m a","-P 2ac 2n","62","lanthanum thulium sulfide","","","- La3 S9 Tm3 -","- La3 S9 Tm3 -","- La12 S36 Tm12 -","4","0.5","","Jin, Geng Bang; Choi, Eun Sang; Guertin, Robert P.; Brooks, James S.; Bray, Travis H.; Booth, Corwin H.; Albrecht-Schmitt, Thomas E.","Syntheses, Structure, Magnetism, and Optical Properties of the Ordered Mixed-Lanthanide Sulfides γ-LnLn‘S3(Ln = La, Ce; Ln‘ = Er, Tm, Yb)","Chemistry of Materials","2007","19","3","567","","10.1021/cm062349c","","","0.71073","MoKα","","0.0338","0.0282","","","0.0727","0.0744","","","","","","1.069","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001295","16.41","0.0013","3.9847","0.0003","21.2015","0.0017","90","","90","","90","","1386.34","0.19","193","2","193","2","","","","","","","","3","P n m a","-P 2ac 2n","62","lanthanum ytterbium sulfide","","","- La3 S9 Yb3 -","- La3 S9 Yb3 -","- La12 S36 Yb12 -","4","0.5","","Jin, Geng Bang; Choi, Eun Sang; Guertin, Robert P.; Brooks, James S.; Bray, Travis H.; Booth, Corwin H.; Albrecht-Schmitt, Thomas E.","Syntheses, Structure, Magnetism, and Optical Properties of the Ordered Mixed-Lanthanide Sulfides γ-LnLn‘S3(Ln = La, Ce; Ln‘ = Er, Tm, Yb)","Chemistry of Materials","2007","19","3","567","","10.1021/cm062349c","","","0.71073","MoKα","","0.0383","0.0328","","","0.066","0.0672","","","","","","1.116","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001296","6.4703","0.0013","12.839","0.0007","20.797","0.004","90","","90","","90","","1727.7","0.5","293","2","293","2","","","","","","","","6","P b n m","-P 2c 2ab","62","","","","- C4 H14 Cl2 I4 N2 Pb -","- C4 H14 Cl2 I4 N2 Pb -","- C16 H56 Cl8 I16 N8 Pb4 -","4","0.5","","Sourisseau, Sebastien; Louvain, Nicolas; Bi, Wenhua; Mercier, Nicolas; Rondeau, David; Boucher, Florent; Buzaré, Jean-Yves; Legein, Christophe","Reduced Band Gap Hybrid Perovskites Resulting from Combined Hydrogen and Halogen Bonding at the Organic−Inorganic Interface","Chemistry of Materials","2007","19","3","600","","10.1021/cm062380e","","x-ray","0.71073","MoKα","","","0.0395","","","","0.0984","","","","","","1.073","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001297","8.7534","0.001","8.747","0.001","12.72","0.002","90","","97.63","0.01","90","","965.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C4 H14 I6 N2 Pb -","- C4 H14 I6 N2 Pb -","- C8 H28 I12 N4 Pb2 -","2","0.5","","Sourisseau, Sebastien; Louvain, Nicolas; Bi, Wenhua; Mercier, Nicolas; Rondeau, David; Boucher, Florent; Buzaré, Jean-Yves; Legein, Christophe","Reduced Band Gap Hybrid Perovskites Resulting from Combined Hydrogen and Halogen Bonding at the Organic−Inorganic Interface","Chemistry of Materials","2007","19","3","600","","10.1021/cm062380e","","x-ray","0.71073","MoKα","","","0.0339","","","","0.072","","","","","","0.961","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001298","9.1263","0.001","9.1429","0.001","21.45","0.002","90","","98.65","0.001","90","","1769.4","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H14 Br2 I4 N2 Pb -","- C4 H14 Br2 I4 N2 Pb -","- C16 H56 Br8 I16 N8 Pb4 -","4","0.5","","Sourisseau, Sebastien; Louvain, Nicolas; Bi, Wenhua; Mercier, Nicolas; Rondeau, David; Boucher, Florent; Buzaré, Jean-Yves; Legein, Christophe","Reduced Band Gap Hybrid Perovskites Resulting from Combined Hydrogen and Halogen Bonding at the Organic−Inorganic Interface","Chemistry of Materials","2007","19","3","600","","10.1021/cm062380e","","x-ray","0.71073","MoKα","","","0.0408","","","","0.1032","","","","","","1.053","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001299","6.4824","0.0003","12.9046","0.0008","21.1409","0.0016","90","","90","","90","","1768.5","0.19","293","2","293","2","","","","","","","","6","P b n m","-P 2c 2ab","62","","","","- C4 H14 Br2 I4 N2 Pb -","- C4 H14 Br2 I4 N2 Pb -","- C16 H56 Br8 I16 N8 Pb4 -","4","0.5","","Sourisseau, Sebastien; Louvain, Nicolas; Bi, Wenhua; Mercier, Nicolas; Rondeau, David; Boucher, Florent; Buzaré, Jean-Yves; Legein, Christophe","Reduced Band Gap Hybrid Perovskites Resulting from Combined Hydrogen and Halogen Bonding at the Organic−Inorganic Interface","Chemistry of Materials","2007","19","3","600","","10.1021/cm062380e","","x-ray","0.71073","MoKα","","0.0621","0.0396","","","0.0816","0.0894","","","","","","1.069","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001300","13.609","0.002","27.181","0.005","13.617","0.003","90","","92.463","0.012","90","","5032.4","1.6","173","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H34 N14 O13 Zn4 -","- C38 H34 N14 O13 Zn4 -","- C152 H136 N56 O52 Zn16 -","4","1","","Park, Hyunsoo; Britten, James F.; Mueller, Ulrich; Lee, JeongYong; Li, Jing; Parise, John B.","Synthesis, Structure Determination, and Hydrogen Sorption Studies of New Metal−Organic Frameworks Using Triazole and Naphthalenedicarboxylic Acid","Chemistry of Materials","2007","19","6","1302","","10.1021/cm0623918","","","0.71073","MoKα","","0.265","0.1033","","","0.2347","0.2742","","","","","","0.942","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001301","30.978","0.006","12.62","0.003","13.339","0.003","90","","90","","90","","5215","2","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C38 H34 N14 O14 Zn4 -","- C38 H34 N14 O14 Zn4 -","- C152 H136 N56 O56 Zn16 -","4","1","","Park, Hyunsoo; Britten, James F.; Mueller, Ulrich; Lee, JeongYong; Li, Jing; Parise, John B.","Synthesis, Structure Determination, and Hydrogen Sorption Studies of New Metal−Organic Frameworks Using Triazole and Naphthalenedicarboxylic Acid","Chemistry of Materials","2007","19","6","1302","","10.1021/cm0623918","","x-ray","0.49594","synchrotron","","0.117","0.1103","","","0.2743","0.2837","","","","","","1.236","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001302","5.566661","0.000021","5.566118","0.000021","7.919158","0.000017","89.9907","0.0019","89.9723","0.0009","89.9962","0.0018","245.373","0.0014","","","","","","","","","","","","4","I -1","-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)","2","","","","- Mg Mo O6 Sr2 -","- Mg Mo O6 Sr2 -","- Mg2 Mo2 O12 Sr4 -","2","","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001303","5.3954","0.0004","5.3954","","12.0264","0.0018","90","","90","","90","","350.09","0.06","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Mo O4 Sr -","- Mo O4 Sr -","- Mo4 O16 Sr4 -","4","0.25","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001304","5.56906","0.00004","5.57039","0.00004","7.92407","0.00005","89.978","0.006","90.01","0.004","90.015","0.0034","245.819","0.003","","","","","","","","","","","","4","I -1","-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)","2","","","","- Mg Mo O6 Sr2 -","- Mg Mo O6.0018 Sr2 -","- Mg2 Mo2 O12.0036 Sr4 -","2","","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","neutron","","","","","","","","","","0.04862","","2.11","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001305","5.569801","0.000016","5.569576","0.000016","7.923807","0.000017","89.9878","0.0012","89.9992","0.0022","90.0048","0.0016","245.808","0.0011","","","","","","","","","","","","4","I -1","-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)","2","","","","- Mg0.5 Mo0.5 O3 Sr -","- Mg0.5 Mo0.5 O3 Sr -","- Mg2 Mo2 O12 Sr4 -","4","","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001306","5.4113","0.0015","5.4113","","12.056","0.006","90","","90","","90","","353","0.2","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- Mo O4 Sr -","- Mo O4 Sr -","- Mo4 O16 Sr4 -","4","0.25","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001307","5.572983","0.000031","5.5775","0.00004","7.92131","0.00004","89.9397","0.0008","90.0234","0.0009","89.9524","0.0007","246.22","0.003","","","","","","","","","","","","4","I -1","-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)","2","","","","- Mg Mo O5.97 Sr2 -","- Mg Mo O5.968 Sr2 -","- Mg2 Mo2 O11.936 Sr4 -","2","","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001308","3.14683","0.0001","3.14683","","3.14683","","90","","90","","90","","31.1616","0.001","","","","","","","","","","","","1","I m -3 m","-I 4 2 3","229","","","","- Mo -","- Mo -","- Mo2 -","2","0.0208333","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001309","4.21214","0.00006","4.21214","","4.21214","","90","","90","","90","","74.7323","0.0011","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001310","3.95288","0.00015","3.95288","","20.437","0.005","90","","90","","90","","319.33","0.08","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- Mg0.14 Mo0.52 O2.15 Sr -","- Mg0.143867 Mo0.5228 O2.15167 Sr -","- Mg0.8632 Mo3.1368 O12.91 Sr6 -","6","0.1875","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001311","4.93095","","4.93095","","4.93095","","90","","90","","90","","119.892","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- O Sr -","- O Sr -","- O4 Sr4 -","4","0.0208333","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001312","5.571514","0.000015","5.57772","0.00004","7.92034","0.00004","89.8921","0.0007","89.987","0.0003","89.923","0.0005","246.135","0.002","","","","","","","","","","","","4","I -1","-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)","2","","","","- Mg0.5 Mo0.5 O3 Sr -","- Mg0.5 Mo0.5 O3 Sr -","- Mg2 Mo2 O12 Sr4 -","4","","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001313","3.146092","0.00003","3.146092","","3.146092","","90","","90","","90","","31.1397","0.0003","","","","","","","","","","","","1","I m -3 m","-I 4 2 3","229","","","","- Mo -","- Mo -","- Mo2 -","2","0.0208333","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001314","4.21041","0.00015","4.21041","","4.21041","","90","","90","","90","","74.64","0.003","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001315","3.938952","0.000008","3.938952","","20.365","0.004","90","","90","","90","","315.97","0.06","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- Mg0.43 Mo1.57 O7 Sr3 -","- Mg0.432 Mo1.568 O7 Sr3 -","- Mg0.864 Mo3.136 O14 Sr6 -","2","0.0625","","Bernuy-Lopez, Carlos; Allix, Mathieu; Bridges, Craig A.; Claridge, John B.; Rosseinsky, Matthew J.","Sr2MgMoO6-δ: Structure, Phase Stability, and Cation Site Order Control of Reduction","Chemistry of Materials","2007","19","5","1035","","10.1021/cm0624116","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001316","3.1932","0.0015","3.1932","0.0015","5.185","0.003","90","","90","","120","","45.79","0.04","100","2","100","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Ga0.96 Mn0.04 N -","- Ga0.96 Mn0.04 N -","- Ga1.92 Mn0.08 N2 -","2","0.166667","","Kaminski, Michal; Podsiadlo, Slawomir; Dominik, Pawel; Wozniak, Krzysztof; Dobrzycki, Lukasz; Jakiela, Rafal; Barcz, Adam; Psoda, Marek; Mizera, Jaroslaw; Bacewicz, Rajmund; Zajac, Marcin; Twardowski, Andrzej","New Chemical Method of Obtaining Thick Ga1-xMnxN Layers: Prospective Spintronic Material","Chemistry of Materials","2007","19","13","3139","","10.1021/cm062459j","","","0.71073","MoKα","","0.0111","0.0084","","","0.0198","0.0201","","","","","","1.32","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001317","7.3803","0.0007","9.1577","0.0008","17.0898","0.0016","90","","90","","90","","1155.04","0.18","193","2","193","2","","","","","","","","5","I m m m","-I 2 2","71","potassium uranyl vanadium phosphate","","","- K3.48 O26 P5 U V4 -","- K3.476 O26 P5 U V4 -","- K6.952 O52 P10 U2 V8 -","2","0.125","","Shvareva, Tatiana Y.; Skanthakumar, S.; Soderholm, L.; Clearfield, Abraham; Albrecht-Schmitt, Thomas E.","Cs±Selective Ion Exchange and Magnetic Ordering in a Three-Dimensional Framework Uranyl Vanadium(IV) Phosphate","Chemistry of Materials","2007","19","2","132","","10.1021/cm062490l","","","0.71073","MoKα","","0.0277","0.0258","","","0.0617","0.0622","","","","","","1.093","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001318","6.42072","0.00012","6.42072","","10.67623","0.00021","90","","90","","90","","440.134","0.012","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","","","- F Na3 O10.37 P2 Ti2 -","- F Na3 O10.3688 P2 Ti2 -","- F2 Na6 O20.7375 P4 Ti4 -","2","0.0625","","Yang, Sihai; Li, Guobao; You, Liping; Tao, Julian; Loong, Chun-K.; Tian, Shujian; Liao, Fuhui; Lin, Jianhua","Na3[Ti2P2O10F]: A New Oxyfluorinated Titanium Phosphate with an Ionic Conductive Property","Chemistry of Materials","2007","19","4","942","","10.1021/cm062513w","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001319","19.403","0.003","5.8078","0.0005","17.032","0.002","90","","113.424","0.015","90","","1761.1","0.4","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(5-bromothioph-2-yl)-2-(2-(5-bromothiophen-2-yl)- 1,3-dioxolan-2-yl)ethyl)-1,3-dioxolane","","- C16 H16 Br2 O4 S2 -","- C16 H16 Br2 O4 S2 -","- C64 H64 Br8 O16 S8 -","4","0.5","","Ellinger, Stefan; Ziener, Ulrich; Thewalt, Ulf; Landfester, Katharina; Möller, Martin","Synthesis and Self-Organization of α,ω-Substituted Oligothiophenes with Long, Branched Alkyl Substituents","Chemistry of Materials","2007","19","5","1070","","10.1021/cm062589s","","","0.71073","MoKα","","0.0498","0.0291","","","0.0541","0.0579","","","","","","0.998","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001320","10.059","0.002","8.225","0.0018","8.6557","0.0019","90","","114.62","0.002","90","","651","0.2","294","2","294","2","","","","","","","see text","4","C 1 2/c 1","-C 2yc","15","","","","- Cd Na2 O8 S2 -","- Cd Na2 O8 S2 -","- Cd4 Na8 O32 S8 -","4","0.5","","Swain, Diptikanta; Guru Row, Tayur N.","Structure, Ionic Conduction and Dielectric Relaxation in a Novel Fast Ion Conductor, Na2Cd(SO4)2","Chemistry of Materials","2007","19","3","347","","10.1021/cm0626637","","","0.71073","MoKα","","0.0184","0.0182","","","0.0466","0.0468","","","","","","1.148","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001321","8.0795","0.0005","23.465","0.0014","13.1145","0.0008","90","","93.062","0.001","90","","2482.8","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1158 cs SKA161 Ir(PhPy)2(OxNO2) xx1","(OC-6-42)-bis(κ^2^(C^2^,N)-2-phenylpyridine) (κ^2^(N,O)-5-nitro-8-quinolinolate)iridium(III)","","- C31 H21 Ir N4 O3 -","- C31 H21 Ir N4 O3 -","- C124 H84 Ir4 N16 O12 -","4","1","","Kappaun, Stefan; Sax, Stefan; Eder, Sabrina; Möller, Kai C.; Waich, Kerstin; Niedermair, Fabian; Saf, Robert; Mereiter, Kurt; Jacob, Josemon; Müllen, Klaus; List, Emil J. W.; Slugovc, Christian","8-Quinolinolates as Ligands for Luminescent Cyclometalated Iridium Complexes","Chemistry of Materials","2007","19","6","1209","","10.1021/cm062666j","","","0.71073","MoKα","","0.0591","0.0485","","","0.1022","0.1083","","","","","","1.052","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001322","7.984","0.002","7.984","0.002","7.688","0.002","90","","90","","120","","424.41","0.19","410","","410","","","","","","","","","3","P 6/m m m","-P 6 2","191","","","","- Ag10 Br3 Te4 -","- Ag9.988 Br3 Te4.026 -","- Ag9.988 Br3 Te4.026 -","1","0.0416667","","Lange, Stefan; Bawohl, Melanie; Wilmer, Dirk; Meyer, Hinrich-Wilhelm; Wiemhöfer, Hans-Dieter; Nilges, T.","Polymorphism, Structural Frustration, and Electrical Properties of the Mixed Conductor Ag10Te4Br3","Chemistry of Materials","2007","19","6","1401","","10.1021/cm062731p","","","0.71073","MoKα","","0.0707","0.0308","","","0.0638","0.0709","","","","1.7","1.7","1.19","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001323","13.748","0.002","13.748","0.002","15.383","0.002","90","","90","","120","","2518","0.6","340","","340","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ag10 Br3 Te4 -","- Ag10.0087 Br3 Te4.00933 -","- Ag60.052 Br18 Te24.056 -","6","0.25","","Lange, Stefan; Bawohl, Melanie; Wilmer, Dirk; Meyer, Hinrich-Wilhelm; Wiemhöfer, Hans-Dieter; Nilges, T.","Polymorphism, Structural Frustration, and Electrical Properties of the Mixed Conductor Ag10Te4Br3","Chemistry of Materials","2007","19","6","1401","","10.1021/cm062731p","","","0.71073","MoKα","","0.1531","0.0369","","","0.0536","0.0696","","","","1.36","1.36","0.82","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001324","15.374","0.001","15.772","0.001","13.715","0.001","90","","90","","90","","3325.6","0.4","","","293","","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Ag10 Br3 Te4 -","- Ag10 Br3 Te4 -","- Ag80 Br24 Te32 -","8","0.5","","Lange, Stefan; Bawohl, Melanie; Wilmer, Dirk; Meyer, Hinrich-Wilhelm; Wiemhöfer, Hans-Dieter; Nilges, T.","Polymorphism, Structural Frustration, and Electrical Properties of the Mixed Conductor Ag10Te4Br3","Chemistry of Materials","2007","19","6","1401","","10.1021/cm062731p","","","0.71073","MoKα","","0.1374","0.058","","","0.0629","0.0688","","","","1.9","1.9","1.25","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001325","15.4004","0.0009","15.6539","0.0012","13.6987","0.0008","90","","90","","90","","3302.4","0.4","223","","223","","","","","","","","","3","C m c 21","C 2c -2","36","","","","- Ag10 Br3 Te4 -","- Ag10 Br3 Te4 -","- Ag80 Br24 Te32 -","8","1","","Lange, Stefan; Bawohl, Melanie; Wilmer, Dirk; Meyer, Hinrich-Wilhelm; Wiemhöfer, Hans-Dieter; Nilges, T.","Polymorphism, Structural Frustration, and Electrical Properties of the Mixed Conductor Ag10Te4Br3","Chemistry of Materials","2007","19","6","1401","","10.1021/cm062731p","","","0.71071","MoKα","","0.0532","0.0346","","","0.0524","0.0541","","","","1.51","1.51","1.27","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001326","21.881","0.011","7.07","0.003","26.967","0.013","90","","90","","90","","4172","3","294","2","294","2","","","","","","","","5","P m n a","-P 2ac 2","53","","","","- C128 H156 Co12 O114 Zn8 -","- C128 H88 Co12 O114 Zn8 -","- C128 H88 Co12 O114 Zn8 -","1","0.125","","Chen, Pang-Kuan; Che, Yun-Xia; Zheng, Ji-Min; Batten, Stuart R.","Heteropolynuclear Metamagnet Showing Spin Canting and Single-Crystal to Single-Crystal Phase Transformation","Chemistry of Materials","2007","19","9","2162","","10.1021/cm062801s","","","0.71073","MoKα","","0.1479","0.126","","","0.2851","0.2947","","","","","","1.319","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001327","6.9872","0.0014","26.781","0.005","21.822","0.004","90","","92.1","0.03","90","","4080.7","1.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C128 H156 Co12 O114 Zn8 -","- C128 H120 Co12 O114 Zn8 -","- C128 H120 Co12 O114 Zn8 -","1","0.25","","Chen, Pang-Kuan; Che, Yun-Xia; Zheng, Ji-Min; Batten, Stuart R.","Heteropolynuclear Metamagnet Showing Spin Canting and Single-Crystal to Single-Crystal Phase Transformation","Chemistry of Materials","2007","19","9","2162","","10.1021/cm062801s","","","0.71073","MoKα","","0.0616","0.0517","","","0.1193","0.1231","","","","","","1.154","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001328","15.3536","0.0004","15.332","0.0004","21.82526","0.00031","90","","90.051","0.005","90","","5137.7","0.2","","","","","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- Bi2 Hf2 O7 -","- Bi2 Hf2 O7 -","- Bi64 Hf64 O224 -","32","16","","Henderson, Stuart J.; Shebanova, Olga; Hector, Andrew L.; McMillan, Paul F.; Weller, Mark T.","Structural Variations in Pyrochlore-Structured Bi2Hf2O7, Bi2Ti2O7and Bi2Hf2-xTixO7Solid Solutions as a Function of Composition and Temperature by Neutron and X-ray Diffraction and Raman Spectroscopy","Chemistry of Materials","2007","19","7","1712","","10.1021/cm062864a","powder diffraction","neutron","","","","","","","","","","0.0286","","1.34","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001329","7.68966","0.000032","7.68966","","10.85169","0.00008","90","","90","","90","","641.67","0.005","","","","","","","","","","","","3","I 41 2 2","I 4bw 2bw","98","","","","- Bi2 Hf2 O7 -","- Bi2 Hf2 O7 -","- Bi8 Hf8 O28 -","4","0.25","","Henderson, Stuart J.; Shebanova, Olga; Hector, Andrew L.; McMillan, Paul F.; Weller, Mark T.","Structural Variations in Pyrochlore-Structured Bi2Hf2O7, Bi2Ti2O7and Bi2Hf2-xTixO7Solid Solutions as a Function of Composition and Temperature by Neutron and X-ray Diffraction and Raman Spectroscopy","Chemistry of Materials","2007","19","7","1712","","10.1021/cm062864a","powder diffraction","neutron","","","","","","","","","","0.09258","","1.24","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001330","10.877908","0.000025","10.877908","","10.877908","","90","","90","","90","","1287.17","0.003","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Bi2 Hf2 O7 -","- Bi2.00004 Hf2 O7 -","- Bi16.0003 Hf16 O56 -","8","0.0416667","","Henderson, Stuart J.; Shebanova, Olga; Hector, Andrew L.; McMillan, Paul F.; Weller, Mark T.","Structural Variations in Pyrochlore-Structured Bi2Hf2O7, Bi2Ti2O7and Bi2Hf2-xTixO7Solid Solutions as a Function of Composition and Temperature by Neutron and X-ray Diffraction and Raman Spectroscopy","Chemistry of Materials","2007","19","7","1712","","10.1021/cm062864a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001331","5.1501","0.0004","5.1852","0.0005","5.3418","0.0005","90","","98.948","0.007","90","","140.91","0.02","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- Hf O2 -","- Hf O2 -","- Hf4 O8 -","4","1","","Henderson, Stuart J.; Shebanova, Olga; Hector, Andrew L.; McMillan, Paul F.; Weller, Mark T.","Structural Variations in Pyrochlore-Structured Bi2Hf2O7, Bi2Ti2O7and Bi2Hf2-xTixO7Solid Solutions as a Function of Composition and Temperature by Neutron and X-ray Diffraction and Raman Spectroscopy","Chemistry of Materials","2007","19","7","1712","","10.1021/cm062864a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001332","5.6963","0.0008","5.6963","0.0008","28.924","0.006","90","","90","","120","","812.8","0.2","293","2","293","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","barium cobalt oxide","","","- Ba6 Co27 O42 -","- Ba2 Co9 O14 -","- Ba6 Co27 O42 -","3","0.0833333","","Ehora, Ghislaine; Daviero-Minaud, Sylvie; Colmont, Marie; André, Gilles; Mentré, Olivier","Ba2Co9O14: New Inorganic Building Blocks with Magnetic Ordering through Super-Super Exchanges Only","Chemistry of Materials","2007","19","9","2180","","10.1021/cm062897q","","","0.71073","MoKα","","0.0509","0.0444","","","0.1096","0.112","","","","","","1.073","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001333","13.0395","0.0014","13.0395","0.0014","13.0346","0.0014","90","","90","","120","","1919.3","0.4","295","2","295","2","","","","","","","","2","R -3 c :H","-R 3 2""c","167","cadmium antimonide (12.7/10)","cadmium antimonide (12.7/10)","","- Cd12.73 Sb10 -","- Cd12.72 Sb10 -","- Cd38.16 Sb30 -","3","0.0833333","","Zelinska, Oksana Ya.; Bie, Haiying; Mar, Arthur","Structure of Cd12.7(1)Sb10","Chemistry of Materials","2007","19","6","1518","","10.1021/cm0629659","","","0.71073","MoKα","","0.0433","0.0371","","","0.0832","0.0848","","","","","","1.317","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001334","11.791","0.002","23.168","0.005","25.506","0.005","90","","103.17","0.03","90","","6784","2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C37.5 H61 Cl12 Mn N11 Nb6 O6 -","- C37.5 H54 Cl12 Mn N11 Nb6 O6 -","- C150 H216 Cl48 Mn4 N44 Nb24 O24 -","4","1","","Zhou, Huajun; Strates, Konstantia C.; Muñoz, Miguel Á.; Little, Kevin J.; Pajerowski, Daniel M.; Meisel, Mark W.; Talham, Daniel R.; Lachgar, Abdessadek","Inorganic Crystal Engineering through Cation Metathesis: One-, Two-, and Three-Dimensional Cluster-Based Coordination Polymers","Chemistry of Materials","2007","19","9","2238","","10.1021/cm063005p","","","0.71073","MoKα","","0.0847","0.0592","","","0.1231","0.1334","","","","","","1.082","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001335","13.1663","0.0017","23.426","0.003","23.615","0.003","90","","90","","90","","7283.7","1.6","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C52 H68 Cl12 Mn2 N12 Nb6 O6 -","- C52 H60 Cl12 Mn2 N12 Nb6 O6 -","- C208 H240 Cl48 Mn8 N48 Nb24 O24 -","4","0.5","","Zhou, Huajun; Strates, Konstantia C.; Muñoz, Miguel Á.; Little, Kevin J.; Pajerowski, Daniel M.; Meisel, Mark W.; Talham, Daniel R.; Lachgar, Abdessadek","Inorganic Crystal Engineering through Cation Metathesis: One-, Two-, and Three-Dimensional Cluster-Based Coordination Polymers","Chemistry of Materials","2007","19","9","2238","","10.1021/cm063005p","","","0.71073","MoKα","","0.1014","0.062","","","0.1082","0.1219","","","","","","1.046","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001336","26.465","0.005","15.578","0.003","21.87","0.004","90","","111.31","0.03","90","","8400","3","193","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C54 H78 Cl12 Mn3 N17 Nb6 O6 -","- C54 H66 Cl12 Mn3 N17 Nb6 O6 -","- C216 H264 Cl48 Mn12 N68 Nb24 O24 -","4","1","","Zhou, Huajun; Strates, Konstantia C.; Muñoz, Miguel Á.; Little, Kevin J.; Pajerowski, Daniel M.; Meisel, Mark W.; Talham, Daniel R.; Lachgar, Abdessadek","Inorganic Crystal Engineering through Cation Metathesis: One-, Two-, and Three-Dimensional Cluster-Based Coordination Polymers","Chemistry of Materials","2007","19","9","2238","","10.1021/cm063005p","","","0.71073","MoKα","","0.1113","0.068","","","0.1335","0.1519","","","","","","1.057","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001337","17.5632","0.0004","17.5632","0.0004","17.5632","0.0004","90","","90","","90","","5417.6","0.2","113","2","113","2","","","","","","","","6","P -4 3 m","P -4 2 3","215","","","","- C9 H54 Al7 N3 O45 P9 -","- C10.5 H22.95 Al7 N3 O44.98 P9 -","- C42 H91.8 Al28 N12 O179.92 P36 -","4","0.166667","","Lu, Ailing; Song, Haibin; Li, Niu; Xiang, Shouhe; Guan, Naijia; Wang, Honggen","Novel Large Aluminophosphite Cage Unit as the Building Blocks To Form a Framework Structure Containing Multidimensional 12-Ring Channels","Chemistry of Materials","2007","19","17","4142","","10.1021/cm063032f","","","0.7107","MoKα","","0.0687","0.0653","","","0.1795","0.183","","","","","","1.131","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001338","11.276","0.0002","8.917","0.001","38.176","0.006","90","","91.96","0.001","90","","3836.3","0.7","295","","295","","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C54 H56 Co N7 O2 S32 -","- C54 H52 Co N7 O2 S32 -","- C108 H104 Co2 N14 O4 S64 -","2","0.5","","Ota, Akira; Ouahab, Lahcène; Golhen, Stéphane; Yoshida, Yukihiro; Maesato, Mitsuhiko; Saito, Gunzi; Świetlik, Roman","Phase Transition from Mott Insulating Phase into the Charge Ordering Phase with Molecular Deformation in Charge-Transfer Salts κ-(ET)4[M(CN)6][N(C2H5)4]·2H2O (M = CoIIIand FeIII)","Chemistry of Materials","2007","19","10","2455","","10.1021/cm063036k","","","0.71069","MoKα","","0.0809","0.0511","","","0.1493","0.178","","","","","","0.98","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001339","11.2307","0.0003","8.8363","0.0002","37.9637","0.001","90","","91.934","0.001","90","","3765.29","0.16","200","","200","","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C54 H56 Co N7 O2 S32 -","- C54 H52 Co N7 O2 S32 -","- C108 H104 Co2 N14 O4 S64 -","2","0.5","","Ota, Akira; Ouahab, Lahcène; Golhen, Stéphane; Yoshida, Yukihiro; Maesato, Mitsuhiko; Saito, Gunzi; Świetlik, Roman","Phase Transition from Mott Insulating Phase into the Charge Ordering Phase with Molecular Deformation in Charge-Transfer Salts κ-(ET)4[M(CN)6][N(C2H5)4]·2H2O (M = CoIIIand FeIII)","Chemistry of Materials","2007","19","10","2455","","10.1021/cm063036k","","","0.71073","MoKα","","0.0995","0.0614","","","0.1422","0.1685","","","","","","1.107","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001340","10.9798","0.0005","8.8047","0.0004","38.5794","0.0018","90","","90.152","0.002","90","","3729.6","0.3","100","2","100","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C54 H56 Co N7 O2 S32 -","- C54 H52 Co N7 O2 S32 -","- C108 H104 Co2 N14 O4 S64 -","2","0.5","","Ota, Akira; Ouahab, Lahcène; Golhen, Stéphane; Yoshida, Yukihiro; Maesato, Mitsuhiko; Saito, Gunzi; Świetlik, Roman","Phase Transition from Mott Insulating Phase into the Charge Ordering Phase with Molecular Deformation in Charge-Transfer Salts κ-(ET)4[M(CN)6][N(C2H5)4]·2H2O (M = CoIIIand FeIII)","Chemistry of Materials","2007","19","10","2455","","10.1021/cm063036k","","","0.71073","MoKα","","0.0908","0.0727","","","0.1984","0.22","","","","","","1.052","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001341","11.261","0.005","8.941","0.005","38.433","0.005","90","0.005","91.463","0.005","90","0.005","3868","3","295","","295","","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C54 H56 Fe N7 O2 S32 -","- C54 H52 Fe N7 O2 S32 -","- C108 H104 Fe2 N14 O4 S64 -","2","0.5","","Ota, Akira; Ouahab, Lahcène; Golhen, Stéphane; Yoshida, Yukihiro; Maesato, Mitsuhiko; Saito, Gunzi; Świetlik, Roman","Phase Transition from Mott Insulating Phase into the Charge Ordering Phase with Molecular Deformation in Charge-Transfer Salts κ-(ET)4[M(CN)6][N(C2H5)4]·2H2O (M = CoIIIand FeIII)","Chemistry of Materials","2007","19","10","2455","","10.1021/cm063036k","","","0.71069","MoKα","","0.0589","0.0403","","","0.1149","0.1463","","","","","","0.984","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001342","11.2203","0.0003","8.8587","0.0003","38.0541","0.0011","90","","91.86","0.009","90","","3780.5","0.2","200","","200","","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C54 H56 Fe N7 O2 S32 -","- C54 H52 Fe N7 O2 S32 -","- C108 H104 Fe2 N14 O4 S64 -","2","0.5","","Ota, Akira; Ouahab, Lahcène; Golhen, Stéphane; Yoshida, Yukihiro; Maesato, Mitsuhiko; Saito, Gunzi; Świetlik, Roman","Phase Transition from Mott Insulating Phase into the Charge Ordering Phase with Molecular Deformation in Charge-Transfer Salts κ-(ET)4[M(CN)6][N(C2H5)4]·2H2O (M = CoIIIand FeIII)","Chemistry of Materials","2007","19","10","2455","","10.1021/cm063036k","","","0.71073","MoKα","","0.0592","0.0412","","","0.1124","0.1402","","","","","","0.975","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001343","11.0498","0.0006","8.8371","0.0006","38.573","0.003","90","","90.142","0.001","90","","3766.6","0.4","106","","106","","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C54 H56 Fe N7 O2 S32 -","- C54 H52 Fe N7 O2 S32 -","- C108 H104 Fe2 N14 O4 S64 -","2","0.5","","Ota, Akira; Ouahab, Lahcène; Golhen, Stéphane; Yoshida, Yukihiro; Maesato, Mitsuhiko; Saito, Gunzi; Świetlik, Roman","Phase Transition from Mott Insulating Phase into the Charge Ordering Phase with Molecular Deformation in Charge-Transfer Salts κ-(ET)4[M(CN)6][N(C2H5)4]·2H2O (M = CoIIIand FeIII)","Chemistry of Materials","2007","19","10","2455","","10.1021/cm063036k","","","0.71073","MoKα","","0.1094","0.0778","","","0.2076","0.2281","","","","","","1.382","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001344","15.808","0.002","20.981","0.003","22.635","0.004","90","","103.635","0.003","90","","7295.7","1.9","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C72 H102 Ca4 O14 -","- C72 H102 Ca4 O14 -","- C288 H408 Ca16 O56 -","4","1","","Boyle, Timothy J.; Hernandez-Sanchez, Bernadette A.; Baros, Christina M.; Brewer, Luke N.; Rodriguez, Mark A.","Influencing the Morphology and Phase of Calcium Ceramic Nanoparticles Based on the Calcium Alkoxide Precursors' Characteristics","Chemistry of Materials","2007","19","8","2016","","10.1021/cm0700091","","","0.71073","MoKα","","0.211","0.0897","","","0.2174","0.286","","","","","","0.992","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001345","12.5656","0.0008","16.0295","0.001","21.1322","0.0014","90","","92.3","0.001","90","","4253","0.5","203","2","203","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C82 H122 Ca4 O15 -","- C78 H114 Ca4 O14 -","- C156 H228 Ca8 O28 -","2","0.5","","Boyle, Timothy J.; Hernandez-Sanchez, Bernadette A.; Baros, Christina M.; Brewer, Luke N.; Rodriguez, Mark A.","Influencing the Morphology and Phase of Calcium Ceramic Nanoparticles Based on the Calcium Alkoxide Precursors' Characteristics","Chemistry of Materials","2007","19","8","2016","","10.1021/cm0700091","","","0.71073","MoKα","","0.069","0.0519","","","0.1424","0.1524","","","","","","1.066","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001346","9.299","0.0013","14.164","0.002","13.927","0.002","90","","101.17","0.003","90","","1799.6","0.4","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H58 Ca O6 -","- C36 H58 Ca O6 -","- C72 H116 Ca2 O12 -","2","0.5","","Boyle, Timothy J.; Hernandez-Sanchez, Bernadette A.; Baros, Christina M.; Brewer, Luke N.; Rodriguez, Mark A.","Influencing the Morphology and Phase of Calcium Ceramic Nanoparticles Based on the Calcium Alkoxide Precursors' Characteristics","Chemistry of Materials","2007","19","8","2016","","10.1021/cm0700091","","","0.71073","MoKα","","0.0634","0.0473","","","0.112","0.1215","","","","","","1.026","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001347","40.75","0.009","16.333","0.004","19.166","0.004","90","","111.12","0.004","90","","11899","5","203","2","203","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C116 H190 Ca3 O17 -","- C112 H182 Ca3 O16 -","- C448 H728 Ca12 O64 -","4","0.5","","Boyle, Timothy J.; Hernandez-Sanchez, Bernadette A.; Baros, Christina M.; Brewer, Luke N.; Rodriguez, Mark A.","Influencing the Morphology and Phase of Calcium Ceramic Nanoparticles Based on the Calcium Alkoxide Precursors' Characteristics","Chemistry of Materials","2007","19","8","2016","","10.1021/cm0700091","","","0.71073","MoKα","","0.1312","0.0686","","","0.1593","0.1836","","","","","","0.973","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001348","19.951","0.008","14.435","0.006","21.707","0.009","90","","99.677","0.007","90","","6163","4","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C64 H100 Ca2 O8 -","- C64 H100 Ca2 O8 -","- C256 H400 Ca8 O32 -","4","1","","Boyle, Timothy J.; Hernandez-Sanchez, Bernadette A.; Baros, Christina M.; Brewer, Luke N.; Rodriguez, Mark A.","Influencing the Morphology and Phase of Calcium Ceramic Nanoparticles Based on the Calcium Alkoxide Precursors' Characteristics","Chemistry of Materials","2007","19","8","2016","","10.1021/cm0700091","","","0.71073","MoKα","","0.092","0.0578","","","0.1172","0.1333","","","","","","1.05","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001349","21.576","0.003","9.778","0.0013","19.013","0.003","90","","90","","90","","4011.2","1","203","2","203","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C40 H66 Ca O5 -","- C40 H66 Ca O5 -","- C160 H264 Ca4 O20 -","4","1","","Boyle, Timothy J.; Hernandez-Sanchez, Bernadette A.; Baros, Christina M.; Brewer, Luke N.; Rodriguez, Mark A.","Influencing the Morphology and Phase of Calcium Ceramic Nanoparticles Based on the Calcium Alkoxide Precursors' Characteristics","Chemistry of Materials","2007","19","8","2016","","10.1021/cm0700091","","","0.71073","MoKα","","0.0792","0.051","","","0.101","0.1127","","","","","","1.003","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001350","9.8317","0.0015","14.02","0.002","19.104","0.003","90","","95.659","0.003","90","","2620.5","0.7","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C56 H84 Ca2 O4 -","- C56 H84 Ca2 O4 -","- C112 H168 Ca4 O8 -","2","0.5","","Boyle, Timothy J.; Hernandez-Sanchez, Bernadette A.; Baros, Christina M.; Brewer, Luke N.; Rodriguez, Mark A.","Influencing the Morphology and Phase of Calcium Ceramic Nanoparticles Based on the Calcium Alkoxide Precursors' Characteristics","Chemistry of Materials","2007","19","8","2016","","10.1021/cm0700091","","","0.71073","MoKα","","0.0609","0.0472","","","0.1145","0.1241","","","","","","1.033","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001351","12.2051","0.0015","12.8757","0.0016","15.8624","0.0019","93.792","0.002","90.235","0.002","103.998","0.002","2412.9","0.5","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H62 Ca O6 Si2 -","- C52 H62 Ca O6 Si2 -","- C104 H124 Ca2 O12 Si4 -","2","1","","Boyle, Timothy J.; Hernandez-Sanchez, Bernadette A.; Baros, Christina M.; Brewer, Luke N.; Rodriguez, Mark A.","Influencing the Morphology and Phase of Calcium Ceramic Nanoparticles Based on the Calcium Alkoxide Precursors' Characteristics","Chemistry of Materials","2007","19","8","2016","","10.1021/cm0700091","","","0.71073","MoKα","","0.1048","0.062","","","0.1317","0.1505","","","","","","1.029","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001352","15.269","0.002","15.269","0.002","10.336","0.003","90","","90","","120","","2086.9","0.7","293","2","293","2","","","","","","","","8","P 63 m c","P 6c -2c","186","","","","- C12 H40 Al0.57 Cr0.1 N2 O16 P4 Zn2 -","- C12 Al0.57 Cr0.0966667 N2 O16.02 P4 Zn2 -","- C36 Al1.71 Cr0.29 N6 O48.06 P12 Zn6 -","3","0.25","","Yang, Yali; Li, Niu; Song, Haibin; Wang, Honggen; Chen, Wenbin; Xiang, Shouhe","Metal Phosphite Containing 24-Ring Channels with 10-Ring Windows","Chemistry of Materials","2007","19","8","1889","","10.1021/cm070026q","","","0.71073","MoKα","","0.0565","0.0486","","","0.1405","0.1518","","","","","","1.143","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4001353","10.086","0.002","17.585","0.005","10.811","0.003","90","","111.538","0.007","90","","1783.6","0.8","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetrakis-tert-butylthiolatobistrimethylphosphinetetracopper(I)","","- C22 H54 Cu4 P2 S4 -","- C22 H54 Cu4 P2 S4 -","- C44 H108 Cu8 P4 S8 -","2","0.5","","Schneider, Sven; Dzudza, Alma; Raudaschl-Sieber, Gabriele; Marks, Tobin J.","Copper(I)tert-Butylthiolato Clusters as Single-Source Precursors for High-Quality Chalcocite Thin Films: Precursor Chemistry in Solution and the Solid State","Chemistry of Materials","2007","19","11","2768","","10.1021/cm0700504","","","0.71073","MoKα","","0.0593","0.0397","","","0.089","0.0968","","","","","","1.068","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001354","8.8065","0.0006","11.6863","0.0008","19.7851","0.0014","90","","96.134","0.001","90","","2024.5","0.2","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetrakis-tert-butylthiolatobistriethylphosphinetetracopper(I)","","- C28 H66 Cu4 P2 S4 -","- C28 H66 Cu4 P2 S4 -","- C56 H132 Cu8 P4 S8 -","2","0.5","","Schneider, Sven; Dzudza, Alma; Raudaschl-Sieber, Gabriele; Marks, Tobin J.","Copper(I)tert-Butylthiolato Clusters as Single-Source Precursors for High-Quality Chalcocite Thin Films: Precursor Chemistry in Solution and the Solid State","Chemistry of Materials","2007","19","11","2768","","10.1021/cm0700504","","","0.71073","MoKα","","0.0302","0.0275","","","0.0732","0.075","","","","","","1.036","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001355","18.353","0.004","18.319","0.004","20.182","0.005","90","","94.346","0.004","90","","6766","3","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakistrimethylphosphinecopper(I)hexakis-tert-butylthiolatopentacuprate(I)","","- C40 H58 Cu6 O P4 S6 -","- C40 H98 Cu6 O P4 S6 -","- C160 H392 Cu24 O4 P16 S24 -","4","1","","Schneider, Sven; Dzudza, Alma; Raudaschl-Sieber, Gabriele; Marks, Tobin J.","Copper(I)tert-Butylthiolato Clusters as Single-Source Precursors for High-Quality Chalcocite Thin Films: Precursor Chemistry in Solution and the Solid State","Chemistry of Materials","2007","19","11","2768","","10.1021/cm0700504","","","0.71073","MoKα","","0.1205","0.0756","","","0.2053","0.2351","","","","","","1.024","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4001356","10.7396","0.001","10.7984","0.001","20.278","0.002","90","","93.61","0.002","90","","2347","0.4","153","2","153","2","","","","","","","","5","P 1 n 1","P -2yac","7","","Hexakis-tert-butylthiolatobistrimethylphosphinehexacopper(I)","","- C30 H72 Cu6 P2 S6 -","- C30 H72 Cu6 P2 S6 -","- C60 H144 Cu12 P4 S12 -","2","1","","Schneider, Sven; Dzudza, Alma; Raudaschl-Sieber, Gabriele; Marks, Tobin J.","Copper(I)tert-Butylthiolato Clusters as Single-Source Precursors for High-Quality Chalcocite Thin Films: Precursor Chemistry in Solution and the Solid State","Chemistry of Materials","2007","19","11","2768","","10.1021/cm0700504","","","0.71073","MoKα","","0.0438","0.0334","","","0.0738","0.0777","","","","","","0.991","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001357","14.509","0.002","14.509","0.002","19.946","0.003","77.194","0.002","77.194","0.002","61.54","","3566.5","0.9","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","Octakis-tert-butylthiolatobistrimethylphosphineoctacopper(I)","","- C52 H106 Cu8 P2 S8 -","- C52 H106 Cu8 P2 S8 -","- C104 H212 Cu16 P4 S16 -","2","1","","Schneider, Sven; Dzudza, Alma; Raudaschl-Sieber, Gabriele; Marks, Tobin J.","Copper(I)tert-Butylthiolato Clusters as Single-Source Precursors for High-Quality Chalcocite Thin Films: Precursor Chemistry in Solution and the Solid State","Chemistry of Materials","2007","19","11","2768","","10.1021/cm0700504","","","0.71073","MoKα","","0.0421","0.0287","","","0.0643","0.0672","","","","","","0.969","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001358","39.063","0.01","5.3131","0.0013","9.677","0.002","90","","94.6","0.004","90","","2001.9","0.8","120","","120","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[AlPO4(OH)](NH3C2H4C6H5)","","- C32 H52 Al4 N4 O20 P4 -","- C32 H52 Al4 N4 O20 P4 -","- C64 H104 Al8 N8 O40 P8 -","2","0.25","","Dorner, Robert W.; Deifallah, Malek; Coombes, David S.; Catlow, C. R. A.; Corà, Furio","Synthesis and Structure Determination of a Novel Layered Aluminophosphate Material Templated with 1-Phenylethylamine: [AlPO4(OH)](NH3C2H4C6H5)","Chemistry of Materials","2007","19","9","2261","","10.1021/cm070106u","","","0.6869","synchrotron","","0.107","0.0632","","0.1281","0.0721","0.0721","","","","","","1.7119","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001359","7.6053","0.0005","41.913","0.003","11.0306","0.0007","90","","90.078","0.001","90","","3516.1","0.4","203","2","203","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3,2':5',2'':5'',2''':5''',3''''-quinquethiophene","","- C20 H12 S5 -","- C20 H12 S5 -","- C160 H96 S40 -","8","2","","Chisaka, Jiro; Lu, Ming; Nagamatsu, Shuichi; Chikamatsu, Masayuki; Yoshida, Yuji; Goto, Midori; Azumi, Reiko; Yamashita, Masafumi; Yase, Kiyoshi","Structure and Electrical Properties of Unsubstituted Oligothiophenes End-Capped at the β-Position","Chemistry of Materials","2007","19","10","2694","","10.1021/cm0701658","","","0.71073","MoKα","","0.054","0.0471","","","0.1312","0.1402","","","","","","1.068","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001360","22.447","0.002","7.7159","0.0007","5.9918","0.0006","90","","91.434","0.002","90","","1037.45","0.17","183","2","183","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3,2':5',2'':5'',2''':5''',2'''':5'''',3'''''-sexithiophene","","- C24 H14 S6 -","- C24 H14 S6 -","- C48 H28 S12 -","2","0.5","","Chisaka, Jiro; Lu, Ming; Nagamatsu, Shuichi; Chikamatsu, Masayuki; Yoshida, Yuji; Goto, Midori; Azumi, Reiko; Yamashita, Masafumi; Yase, Kiyoshi","Structure and Electrical Properties of Unsubstituted Oligothiophenes End-Capped at the β-Position","Chemistry of Materials","2007","19","10","2694","","10.1021/cm0701658","","","0.71073","MoKα","","0.0485","0.0438","","","0.1376","0.1511","","","","","","1.114","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001361","4.96524","0.00006","7.96358","0.0001","5.7484","0.00005","90","","90","","90","","227.298","0.004","","","","","","","","","","","","3","P m c n","-P 2n 2a","62","","","","- C Ca O3 -","- C Ca O3 -","- C4 Ca4 O12 -","4","0.5","","Pokroy, B.; Fieramosca, J. S.; Von Dreele, R. B.; Fitch, A. N.; Caspi, E. N.; Zolotoyabko, E.","Atomic Structure of Biogenic Aragonite","Chemistry of Materials","2007","19","13","3244","","10.1021/cm070187u","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001362","3.0287","0.0006","3.0287","","3.0287","","90","","90","","90","","27.782","0.006","","","","","","","","","","","","1","I m -3 m","-I 4 2 3","229","","","","- V -","- V -","- V2 -","2","0.0208333","","Pokroy, B.; Fieramosca, J. S.; Von Dreele, R. B.; Fitch, A. N.; Caspi, E. N.; Zolotoyabko, E.","Atomic Structure of Biogenic Aragonite","Chemistry of Materials","2007","19","13","3244","","10.1021/cm070187u","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001363","4.96259","0.00005","7.96782","0.00008","5.74186","0.00004","90","","90","","90","","227.039","0.004","","","","","","","","","","","","3","P m c n","-P 2n 2a","62","","","","- C Ca O3 -","- C Ca O3 -","- C4 Ca4 O12 -","4","0.5","","Pokroy, B.; Fieramosca, J. S.; Von Dreele, R. B.; Fitch, A. N.; Caspi, E. N.; Zolotoyabko, E.","Atomic Structure of Biogenic Aragonite","Chemistry of Materials","2007","19","13","3244","","10.1021/cm070187u","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001364","3.0267","0.0005","3.0267","","3.0267","","90","","90","","90","","27.727","0.005","","","","","","","","","","","","1","I m -3 m","-I 4 2 3","229","","","","- V -","- V -","- V2 -","2","0.0208333","","Pokroy, B.; Fieramosca, J. S.; Von Dreele, R. B.; Fitch, A. N.; Caspi, E. N.; Zolotoyabko, E.","Atomic Structure of Biogenic Aragonite","Chemistry of Materials","2007","19","13","3244","","10.1021/cm070187u","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001365","5.652","","5.652","","18.828","","90","","90","","120","","520.882","","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","- Ba2 Co3.667 Ga0.667 O8.667 -","- Ba2 Co3.66667 Ga0.666667 O8.66667 -","- Ba6 Co11 Ga2 O26 -","3","0.25","","Pelloquin, D.; Pérez, O.; Martinet, G.; Hébert, S.; Maignan, A.","The Oxide Ba6Ga2Co11O26: A New Close-Packed Stacking Derived from the Hexagonal Perovskite","Chemistry of Materials","2007","19","10","2658","","10.1021/cm0702823","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001366","10.343","0.0002","10.343","0.0002","9.756","0.0003","90","","90","","120","","903.85","0.04","150","2","150","2","","","","","","","","4","P 63","P 6c","173","","","","- C12 H27 S3 Sb -","- C12 H27 S3 Sb -","- C24 H54 S6 Sb2 -","2","0.333333","","Castro, Jorge Rodriguez-; Dale, Phillip; Mahon, Mary F.; Molloy, Kieran C.; Peter, Laurie M.","Deposition of Antimony Sulfide Thin Films from Single-Source Antimony Thiolate Precursors","Chemistry of Materials","2007","19","13","3219","","10.1021/cm070405j","","","0.71073","MoKα","","0.0637","0.0339","","","0.0702","0.0792","","","","","","1.063","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001367","12.081","0.007","5.645","0.002","23.804","0.012","90","","103.45","0.02","90","","1578.8","1.3","293","1","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- K Mn O4 V -","- K Mn O4 V -","- K16 Mn16 O64 V16 -","16","4","","Yahia, H. Ben; Gaudin, E.; Lee, C.; Whangbo, M.-H.; Darriet, J.","Structural and Magnetic Properties of a New Type of Ordered Oxygen-Deficient Perovskite, KMnVO4","Chemistry of Materials","2007","19","23","5563","","10.1021/cm070452b","","","0.71069","MoKα","","0.0304","0.0304","","","0.0733","0.0733","","","","1.31","1.31","1.31","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001368","4.6807","0.0008","8.334","0.0013","18.206","0.003","86.392","0.003","83.962","0.003","88.2","0.003","704.6","0.2","153","2","153","2","","","","","","","","5","P -1","-P 1","2","ndi-8br2","N,N'-bis(n-octyl)-2,6-dibromonaphthalene-1,4:5,8-tetracarboxylicdiimide","","- C30 H36 Br2 N2 O4 -","- C30 H36 Br2 N2 O4 -","- C30 H36 Br2 N2 O4 -","1","0.5","","Jones, Brooks A.; Facchetti, Antonio; Marks, Tobin J.; Wasielewski, Michael R.","Cyanonaphthalene Diimide Semiconductors for Air-Stable, Flexible, and Optically Transparent n-Channel Field-Effect Transistors","Chemistry of Materials","2007","19","11","2703","","10.1021/cm0704579","","","0.71073","MoKα","","0.0501","0.0399","","","0.0969","0.1019","","","","","","1.002","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001369","5.6683","0.0005","5.6683","0.0005","14.277","0.003","90","","90","","120","","397.26","0.1","293","2","293","2","","","","","","","","4","P -6 m 2","P -6 2","187","barium cobalt oxyfluorure","","","- Ba6 Co6 F O16 -","- Ba6 Co6 F O15.99 -","- Ba6 Co6 F O15.99 -","1","0.0833333","","Ehora, Ghislaine; Renard, Catherine; Daviero-Minaud, Sylvie; Mentré, Olivier","New BaCoO3-δPolytypes by Rational Substitution of O2-for F-","Chemistry of Materials","2007","19","12","2924","","10.1021/cm070576o","","","0.71073","MoKα","","0.0164","0.016","","","0.0346","0.0348","","","","","","1.194","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001370","5.6878","0.0005","5.6878","0.0005","23.701","0.005","90","","90","","120","","664.03","0.16","293","2","293","2","","","","","","","","4","P 63/m m c","-P 6c 2c","194","barium cobalt oxyfluorure","","","- Ba5 Co5 F O13 -","- Ba10 Co10 F2 O25.98 -","- Ba10 Co10 F2 O25.98 -","1","0.0416667","","Ehora, Ghislaine; Renard, Catherine; Daviero-Minaud, Sylvie; Mentré, Olivier","New BaCoO3-δPolytypes by Rational Substitution of O2-for F-","Chemistry of Materials","2007","19","12","2924","","10.1021/cm070576o","","","0.71073","MoKα","","0.0392","0.0275","","","0.0574","0.0601","","","","","","1.263","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001371","27.5001","0.0004","11.99777","0.00018","7.25373","0.00011","90","","90","","90","","2393.29","0.06","298","","298","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C6 H18 N2 O21 P6 Pr2 -","- C6 H18 N2 O21 P6 Pr2 -","- C24 H72 N8 O84 P24 Pr8 -","4","0.5","","Cunha-Silva, Luís; Mafra, Luís; Ananias, Duarte; Carlos, Luís D.; Rocha, João; Almeida Paz, Filipe A.","Photoluminescent Lanthanide−Organic 2D Networks: A Combined Synchrotron Powder X-ray Diffraction and Solid-State NMR Study","Chemistry of Materials","2007","19","14","3527","","10.1021/cm070596q","powder diffraction","","","X-ray","","","","","","","","","5.6443","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001372","9.0682","0.0002","9.5114","0.0003","14.0066","0.0004","74.975","0.002","86.534","0.002","82.725","0.002","1156.91","0.06","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H15 Na Nd3 O25 P -","- C9 H15 Na Nd3 O25 P -","- C18 H30 Na2 Nd6 O50 P2 -","2","1","","Huang, Ya-Ling; Huang, Meow-Yu; Chan, Tsung-Han; Chang, Bor-Chen; Lii, Kwang-Hwa","Synthesis, Structural Characterization, and Luminescence Properties of Lanthanide Oxalatophosphonates: Na[M3(H2O)4(C2O4)4(CH3PO3)]·2H2O (M = Nd and Pr)","Chemistry of Materials","2007","19","13","3232","","10.1021/cm070602i","","","0.71073","MoKα","","0.0227","0.0172","","","0.0348","0.0353","","","","","","0.902","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001373","9.1254","0.0011","9.5493","0.0012","14.0728","0.0017","75.086","0.002","86.611","0.002","82.545","0.002","1174.6","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H15 Na O25 P Pr3 -","- C9 H3 Na O25 P Pr3 -","- C18 H6 Na2 O50 P2 Pr6 -","2","1","","Huang, Ya-Ling; Huang, Meow-Yu; Chan, Tsung-Han; Chang, Bor-Chen; Lii, Kwang-Hwa","Synthesis, Structural Characterization, and Luminescence Properties of Lanthanide Oxalatophosphonates: Na[M3(H2O)4(C2O4)4(CH3PO3)]·2H2O (M = Nd and Pr)","Chemistry of Materials","2007","19","13","3232","","10.1021/cm070602i","","","0.71073","MoKα","","0.0385","0.0308","","","0.0663","0.0681","","","","","","0.981","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001374","21.697","0.008","8.534","0.003","14.165","0.006","90","","90","","90","","2622.8","1.7","100","","","","","","","","","","","6","P c c a","-P 2a 2ac","54","","","","- C18 H30 Cl2 N4 Ni O12 -","- C18 H30 Cl2 N4 Ni O12 -","- C72 H120 Cl8 N16 Ni4 O48 -","4","0.5","","Okazawa, Atsushi; Nogami, Takashi; Ishida, Takayuki","tert-Butyl 2-Pyridyl Nitroxide Available as a Paramagnetic Chelate Ligand for Strongly Exchange-Coupled Metal−Radical Compounds","Chemistry of Materials","2007","19","11","2733","","10.1021/cm070698g","","","0.71069","MoKα","","","0.054","","","","0.0667","","","","","","1.016","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001375","6.176","0.003","20.503","0.01","9.516","0.004","90","","104.33","0.04","90","","1167.5","1","90","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H26 Cl2 Cu N4 O10 -","- C18 H26 Cl2 Cu N4 O10 -","- C36 H52 Cl4 Cu2 N8 O20 -","2","0.5","","Okazawa, Atsushi; Nogami, Takashi; Ishida, Takayuki","tert-Butyl 2-Pyridyl Nitroxide Available as a Paramagnetic Chelate Ligand for Strongly Exchange-Coupled Metal−Radical Compounds","Chemistry of Materials","2007","19","11","2733","","10.1021/cm070698g","","","0.71069","MoKα","","","0.0592","","","","0.1085","","","","","","1.475","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001376","14.8704","0.0003","7.6902","0.0002","10.6506","0.0003","90","","102.57","0.002","90","","1188.77","0.05","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Mn2C8H10O12","","","- C8 H10 Mn2 O12 -","- C8 H10 Mn2 O12 -","- C32 H40 Mn8 O48 -","4","1","","Wang, Xin-Yi; Sevov, Slavi C.","A Manganese Carboxylate with Geometrically Frustrated Magnetic Layers of Novel Topology","Chemistry of Materials","2007","19","15","3763","","10.1021/cm070713h","","","0.71073","MoKα","","0.0602","0.0555","","","0.1366","0.1418","","","","","","1.142","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001377","10.5567","0.0018","6.3046","0.0011","10.8182","0.0018","90","","95.092","0.002","90","","717.2","0.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H6 Cu2 N20 -","- C4 H6 Cu2 N20 -","- C8 H12 Cu4 N40 -","2","0.5","","Liu, Pei-Pei; Cheng, Ai-Ling; Liu, Na; Sun, Wei-Wei; Gao, En-Qing","Toward Tuning the Bulk Magnetic Behaviors of Metal−Azido Materials by Organic Pillars","Chemistry of Materials","2007","19","11","2724","","10.1021/cm0708416","","","0.71073","MoKα","","0.0324","0.0259","","","0.0627","0.0658","","","","","","1.073","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001378","11.859","0.002","6.3786","0.0011","10.7701","0.0018","90","","95.931","0.002","90","","810.3","0.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H10 Cu2 N20 -","- C6 H10 Cu2 N20 -","- C12 H20 Cu4 N40 -","2","0.5","","Liu, Pei-Pei; Cheng, Ai-Ling; Liu, Na; Sun, Wei-Wei; Gao, En-Qing","Toward Tuning the Bulk Magnetic Behaviors of Metal−Azido Materials by Organic Pillars","Chemistry of Materials","2007","19","11","2724","","10.1021/cm0708416","","","0.71073","MoKα","","0.0524","0.0423","","","0.0929","0.0976","","","","","","1.049","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001379","6.244","0.004","6.244","0.004","18.479","0.019","90","","90","","120","","623.9","0.9","175","5","175","5","","","","","","","","4","P 63/m","-P 6c","176","Nickel Chromium Phosphorus Sulfide","","","- Cr2 Ni3 P2 Se9 -","- Cr2 Ni3.0001 P2 Se9 -","- Cr4 Ni6.0002 P4 Se18 -","2","0.166667","","McGuire, Michael A.; DiSalvo, Francis J.","Ni3Cr2P2Q9(Q = S, Se): New Quaternary Transition Metal Chalcogenides with a Unique Layered Structure","Chemistry of Materials","2007","19","18","4600","","10.1021/cm070849f","","","0.71073","MoKα","","0.042","0.0235","","","0.0342","0.0356","","","","","","0.805","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001380","12.238","0.005","12.238","0.005","12.398","0.005","90","","90","","90","","1856.8","1.3","123","2","123","","","","","","","","","8","P -4","P -4","81","catena-(tetrakis(4,4'-Disulfo-2,2'-bipyridine N,N'-dioxide)- di-aqua-hexa-sodium-samarium chloride clathrate hydrate)","catena-(tetrakis(4,4'-Disulfo-2,2'-bipyridine N,N'-dioxide)- di-aqua-hexa-sodium-samarium chloride clathrate hydrate)","","- C40 H24 Cl N8 Na6 O46 S8 Sm -","- C40 H24 Cl N8 Na6 O46 S8 Sm -","- C40 H24 Cl N8 Na6 O46 S8 Sm -","1","0.25","","Chandler, Brett D.; Yu, Joanne O.; Cramb, David T.; Shimizu, George K. H.","Series of Lanthanide-Alkali Metal-Organic Frameworks Exhibiting Luminescence and Permanent Microporosity","Chemistry of Materials","2007","19","18","4467","","10.1021/cm070930i","","x-ray","0.71069","MoKα","","0.1012","0.0764","","","0.1952","0.213","","","","","","1.028","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4001381","12.265","0.005","12.265","0.005","12.421","0.005","90","","90","","90","","1868.5","1.3","123","2","123","2","","","","","","","","8","P -4","P -4","81","catena-(tetrakis(4,4'-Disulfo-2,2'-bipyridine N,N'-dioxide)- di-aqua-hexa-sodium-europium chloride clathrate hydrate)","catena-(tetrakis(4,4'-Disulfo-2,2'-bipyridine N,N'-dioxide)- di-aqua-hexa-sodium-europium chloride clathrate hydrate)","","- C40 H24 Cl Eu N8 Na6 O48 S8 -","- C40 H24 Cl Eu N8 Na6 O48 S8 -","- C40 H24 Cl Eu N8 Na6 O48 S8 -","1","0.25","","Chandler, Brett D.; Yu, Joanne O.; Cramb, David T.; Shimizu, George K. H.","Series of Lanthanide-Alkali Metal-Organic Frameworks Exhibiting Luminescence and Permanent Microporosity","Chemistry of Materials","2007","19","18","4467","","10.1021/cm070930i","","x-ray","0.71069","MoKα","","0.061","0.0554","","","0.1426","0.1482","","","","","","1.055","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001382","12.234","0.005","12.234","0.005","12.373","0.005","90","","90","","90","","1851.9","1.3","123","2","123","","","","","","","","","8","P -4","P -4","81","catena-(tetrakis(4,4'-Disulfo-2,2'-bipyridine N,N'-dioxide)- di-aqua-hexa-sodium-gadolinium chloride clathrate hydrate)","catena-(tetrakis(4,4'-Disulfo-2,2'-bipyridine N,N'-dioxide)- di-aqua-hexa-sodium-gadolinium chloride clathrate hydrate)","","- C40 H24 Cl Gd N8 Na6 O48 S8 -","- C40 H24 Cl Gd N8 Na6 O48 S8 -","- C40 H24 Cl Gd N8 Na6 O48 S8 -","1","0.25","","Chandler, Brett D.; Yu, Joanne O.; Cramb, David T.; Shimizu, George K. H.","Series of Lanthanide-Alkali Metal-Organic Frameworks Exhibiting Luminescence and Permanent Microporosity","Chemistry of Materials","2007","19","18","4467","","10.1021/cm070930i","","x-ray","0.71069","MoKα","","0.0743","0.0648","","","0.1527","0.1689","","","","","","1.061","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4001383","12.245","0.005","12.245","0.005","12.407","0.005","90","","90","","90","","1860.3","1.3","123","2","123","2","","","","","","","","8","P -4","P -4","81","catena-(tetrakis(4,4'-Disulfo-2,2'-bipyridine N,N'-dioxide)- di-aqua-hexa-sodium-terbium chloride clathrate hydrate)","catena-(tetrakis(4,4'-Disulfo-2,2'-bipyridine N,N'-dioxide)- di-aqua-hexa-sodium-terbium chloride clathrate hydrate)","","- C40 H24 Cl N8 Na6 O46 S8 Tb -","- C40 H24 Cl N8 Na6 O46 S8 Tb -","- C40 H24 Cl N8 Na6 O46 S8 Tb -","1","0.25","","Chandler, Brett D.; Yu, Joanne O.; Cramb, David T.; Shimizu, George K. H.","Series of Lanthanide-Alkali Metal-Organic Frameworks Exhibiting Luminescence and Permanent Microporosity","Chemistry of Materials","2007","19","18","4467","","10.1021/cm070930i","","x-ray","0.71069","MoKα","","0.0591","0.0528","","","0.1401","0.158","","","","","","1.194","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001384","12.213","0.005","12.213","0.005","12.345","0.005","90","","90","","90","","1841.3","1.3","123","2","123","","","","","","","","","8","P -4","P -4","81","catena-(tetrakis(4,4'-Disulfo-2,2'-bipyridine N,N'-dioxide)- di-aqua-hexa-sodium-dysprosium chloride clathrate hydrate)","catena-(tetrakis(4,4'-Disulfo-2,2'-bipyridine N,N'-dioxide)- di-aqua-hexa-sodium-dysprosium chloride clathrate hydrate)","","- C40 H24 Cl Dy N8 Na6 O47 S8 -","- C40 H24 Cl Dy N8 Na6 O47 S8 -","- C40 H24 Cl Dy N8 Na6 O47 S8 -","1","0.25","","Chandler, Brett D.; Yu, Joanne O.; Cramb, David T.; Shimizu, George K. H.","Series of Lanthanide-Alkali Metal-Organic Frameworks Exhibiting Luminescence and Permanent Microporosity","Chemistry of Materials","2007","19","18","4467","","10.1021/cm070930i","","","0.71069","MoKα","","0.045","0.0405","","","0.1034","0.1061","","","","","","1.053","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001385","14.2604","0.0002","10.1663","0.0002","10.5637","0.0002","90","","91.803","0.001","90","","1530.72","0.05","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H24 Cl2 Cu7 O28 -","- C16 H24 Cl2 Cu7 O28 -","- C32 H48 Cl4 Cu14 O56 -","2","0.5","","Wang, Xin-Yi; Scancella, Michael; Sevov, Slavi C.","Studies of the Mechanism of a Single-Crystal-to-Single-Crystal Reversible Dehydration of a Copper Carboxylate Framework","Chemistry of Materials","2007","19","18","4506","","10.1021/cm071005z","","","0.71073","MoKα","","0.0332","0.0252","","","0.0616","0.0638","","","","","","1.075","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001386","14.2291","0.0002","10.0388","0.0002","10.3413","0.0002","90","","92.449","0.001","90","","1475.83","0.05","100","2","293","2","","","","","","","","5","P 1 c 1","P -2yc","7","CuTHFTC-dehy-RT","","","- C16 H12 Cl2 Cu7 O24.37 -","- C16 H12 Cl2 Cu7 O24.37 -","- C32 H24 Cl4 Cu14 O48.74 -","2","1","","Wang, Xin-Yi; Scancella, Michael; Sevov, Slavi C.","Studies of the Mechanism of a Single-Crystal-to-Single-Crystal Reversible Dehydration of a Copper Carboxylate Framework","Chemistry of Materials","2007","19","18","4506","","10.1021/cm071005z","","","0.71073","MoKα","","0.0369","0.0335","","","0.0836","0.0907","","","","","","1.143","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001387","14.1851","0.0002","10.0601","0.0002","10.2537","0.0002","90","","92.262","0.001","90","","1462.1","0.05","100","2","100","2","","","","","","","","5","P 1 c 1","P -2yc","7","CuTHF65","","","- C16 H14 Cl2 Cu7 O24 -","- C16 H14 Cl2 Cu7 O24 -","- C32 H28 Cl4 Cu14 O48 -","2","1","","Wang, Xin-Yi; Scancella, Michael; Sevov, Slavi C.","Studies of the Mechanism of a Single-Crystal-to-Single-Crystal Reversible Dehydration of a Copper Carboxylate Framework","Chemistry of Materials","2007","19","18","4506","","10.1021/cm071005z","","","0.71073","MoKα","","0.0275","0.0257","","","0.0578","0.0584","","","","","","1.109","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001388","14.119","0.003","10.043","0.002","10.21","0.002","90","","92.16","0.03","90","","1446.7","0.5","100","2","100","2","","","","","","","","5","P 1 c 1","P -2yc","7","Cu-THF-105","","","- C16 H14 Cl2 Cu7 O23 -","- C16 H14 Cl2 Cu7 O23 -","- C32 H28 Cl4 Cu14 O46 -","2","1","","Wang, Xin-Yi; Scancella, Michael; Sevov, Slavi C.","Studies of the Mechanism of a Single-Crystal-to-Single-Crystal Reversible Dehydration of a Copper Carboxylate Framework","Chemistry of Materials","2007","19","18","4506","","10.1021/cm071005z","","","0.71073","MoKα","","0.0247","0.023","","","0.0565","0.0574","","","","","","1.039","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001389","14.2238","0.0003","10.1417","0.0002","10.5474","0.0003","90","","91.795","0.001","90","","1520.75","0.06","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","CuTHFRe","","","- C16 H20 Cl2 Cu7 O28 -","- C16 H20 Cl2 Cu7 O28 -","- C32 H40 Cl4 Cu14 O56 -","2","0.5","","Wang, Xin-Yi; Scancella, Michael; Sevov, Slavi C.","Studies of the Mechanism of a Single-Crystal-to-Single-Crystal Reversible Dehydration of a Copper Carboxylate Framework","Chemistry of Materials","2007","19","18","4506","","10.1021/cm071005z","","","0.71073","MoKα","","0.0312","0.0228","","","0.0563","0.0586","","","","","","1.081","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001390","14.1601","0.0003","10.0452","0.0002","10.2294","0.0002","90","","92.258","0.001","90","","1453.91","0.05","100","2","100","2","","","","","","","","6","P 1 c 1","P -2yc","7","CuTHFTC-dehy-NH3","","","- C16 H14 Cl2 Cu7 N O23 -","- C16 H14 Cl2 Cu7 N O23 -","- C32 H28 Cl4 Cu14 N2 O46 -","2","1","","Wang, Xin-Yi; Scancella, Michael; Sevov, Slavi C.","Studies of the Mechanism of a Single-Crystal-to-Single-Crystal Reversible Dehydration of a Copper Carboxylate Framework","Chemistry of Materials","2007","19","18","4506","","10.1021/cm071005z","","","0.71073","MoKα","","0.0317","0.0288","","","0.0641","0.0649","","","","","","1.1","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001391","7.2596","0.0008","21.786","0.002","38.904","0.004","90","","90","","90","","6153","1.1","293","2","","","","","","","","","","3","F 2 d d","F -2d 2","43","","","","- O45 P9 V12 -","- O45 P9 V12 -","- O360 P72 V96 -","8","0.5","","Benser, Ernst; Glaum, Robert; Dross, Thomas; Hibst, Hartmut","VIIIVIV3O3(PO4)3: A Novel Vanadium Phosphate for Selective Oxidation of Light Hydrocarbons","Chemistry of Materials","2007","19","17","4341","","10.1021/cm071036u","","x-ray","0.71073","MoKα","","","0.0315","","","","0.0663","","","","","","1.184","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001392","8.694","0.003","15.491","0.004","20.569","0.006","90","","90","","90","","2770.2","1.4","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C28 H30 F4 N8 O4 -","- C28 H30 F4 N8 O4 -","- C112 H120 F16 N32 O16 -","4","0.5","","Murata, Hidenori; Mague, Joel T.; Aboaku, Safo; Yoshioka, Naoki; Lahti, Paul M.","An Organic Radical Solid Solution with Strong Ferromagnetic Exchange","Chemistry of Materials","2007","19","17","4111","","10.1021/cm0711459","","","0.71073","MoKα","","0.0839","0.0663","","","0.1541","0.1638","","","","","","1.136","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001393","17.638","0.004","9.4889","0.0019","26.369","0.005","90","","115.47","0.03","90","","3984.3","1.7","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C30 H82.9 In5 N5 O1.45 S19 Sb6 -","- C24.82 H58.2 In5 N3.97 O1.46 S19 Sb6 -","- C49.64 H116.4 In10 N7.94 O2.92 S38 Sb12 -","2","0.5","","Ding, Nan; Kanatzidis, Mercouri G.","Permeable Layers with Large Windows in [(CH3CH2CH2)2NH2]5In5Sb6S19·1.45 H2O: High Ion-Exchange Capacity, Size Discrimination, and Selectivity for Cs Ions","Chemistry of Materials","2007","19","16","3867","","10.1021/cm071179g","","","0.71073","MoKα","","0.0768","0.0584","","","0.1547","0.1655","","","","","","1.096","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001394","13.6835","0.0014","19.981","0.002","6.7535","0.0007","90","","94.514","0.002","90","","1840.7","0.3","273","2","273","2","","","","","","","","3","C 1 c 1","C -2yc","9","","Calcium catena-polyphosphate","","- Ca O6 P2 -","- Ca O6 P2 -","- Ca16 O96 P32 -","16","4","","Weil, Matthias; Puchberger, Michael; Schmedt auf der Günne, Jörn; Weber, Johannes","Synthesis, Crystal Structure, and Characterization (Vibrational and Solid-State31P MAS NMR Spectroscopy) of the High-Temperature Modification of Calciumcatena-Polyphosphate(V)","Chemistry of Materials","2007","19","21","5067","","10.1021/cm071239i","","","0.71073","MoKα","","0.0672","0.0561","","","0.1205","0.1263","","","","","","1","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001395","6.4509","0.0007","15.3058","0.0015","9.4335","0.0009","90","","101.176","0.002","90","","913.76","0.16","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H5 B N4 -","- C8 H5 B N4 -","- C32 H20 B4 N16 -","4","1","","Chizmeshya, A. V. G.; Ritter, C. J.; Groy, T. L.; Tice, J. B.; Kouvetakis, J.","Synthesis of Molecular Adducts of Beryllium, Boron, and Gallium Cyanides: Theoretical and Experimental Correlations between Solid-State and Molecular Analogues","Chemistry of Materials","2007","19","24","5890","","10.1021/cm071275h","","","0.71073","MoKα","","0.0644","0.0497","","","0.121","0.1286","","","","","","1.025","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001396","13.261","0.0009","7.6398","0.0005","21.3062","0.0014","90","","90","","90","","2158.6","0.2","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C9 H6 B N5 -","- C9 H6 B N5 -","- C72 H48 B8 N40 -","8","1","","Chizmeshya, A. V. G.; Ritter, C. J.; Groy, T. L.; Tice, J. B.; Kouvetakis, J.","Synthesis of Molecular Adducts of Beryllium, Boron, and Gallium Cyanides: Theoretical and Experimental Correlations between Solid-State and Molecular Analogues","Chemistry of Materials","2007","19","24","5890","","10.1021/cm071275h","","","0.71073","MoKα","","0.1","0.047","","","0.0968","0.1175","","","","","","0.81","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001397","17.3571","0.0012","8.5357","0.0006","8.0293","0.0006","90","","90","","90","","1189.58","0.15","173","2","173","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C12 H10 Be N4 -","- C12 H10 Be N4 -","- C48 H40 Be4 N16 -","4","1","","Chizmeshya, A. V. G.; Ritter, C. J.; Groy, T. L.; Tice, J. B.; Kouvetakis, J.","Synthesis of Molecular Adducts of Beryllium, Boron, and Gallium Cyanides: Theoretical and Experimental Correlations between Solid-State and Molecular Analogues","Chemistry of Materials","2007","19","24","5890","","10.1021/cm071275h","","","0.71073","MoKα","","0.0562","0.0326","","","0.0505","0.0544","","","","","","0.856","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001398","7.558","0.004","8.286","0.004","12.763","0.006","77.809","0.01","75.389","0.01","71.894","0.01","727.4","0.6","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H10 Ga N5 -","- C13 H10 Ga N5 -","- C26 H20 Ga2 N10 -","2","1","","Chizmeshya, A. V. G.; Ritter, C. J.; Groy, T. L.; Tice, J. B.; Kouvetakis, J.","Synthesis of Molecular Adducts of Beryllium, Boron, and Gallium Cyanides: Theoretical and Experimental Correlations between Solid-State and Molecular Analogues","Chemistry of Materials","2007","19","24","5890","","10.1021/cm071275h","","","0.71073","MoKα","","0.0493","0.0382","","","0.0869","0.0915","","","","","","1.004","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001399","10.673","0.003","10.673","0.003","4.099","0.002","90","","90","","120","","404.4","0.3","273","2","273","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C3 H3 Ce0.9 Gd0.1 O6 -","- C3 H3 Ce0.9 Gd0.1 O6 -","- C9 H9 Ce2.7 Gd0.3 O18 -","3","0.166667","","Go, Yong Bok; Jacobson, Allan J.","Solid Solution Precursors to Gadolinia-Doped Ceria Prepared via a Low-Temperature Solution Route","Chemistry of Materials","2007","19","19","4702","","10.1021/cm071310k","","","0.71073","MoKα","","0.0117","0.0117","","","0.0292","0.0292","","","","","","1.134","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001400","8.5501","0.0002","7.3054","0.0002","5.0045","0.0001","90","","90","","90","","312.591","0.013","298","","298","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","cerium gadolinium carbonato hydroxide","","- C H Ce0.9 Gd0.1 O4 -","- C Ce0.9 Gd0.1 O4 -","- C4 Ce3.6 Gd0.4 O16 -","4","1","","Go, Yong Bok; Jacobson, Allan J.","Solid Solution Precursors to Gadolinia-Doped Ceria Prepared via a Low-Temperature Solution Route","Chemistry of Materials","2007","19","19","4702","","10.1021/cm071310k","powder diffraction","x-ray","1.54178","CuKα","","","","","","","","0.03063","","1.73","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001401","8.9475","0.0006","9.5099","0.0007","16.9616","0.0012","90","","90","","90","","1443.26","0.18","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C3 H16 Ce1.8 Gd0.2 O17 -","- C3 H16 Ce1.801 Gd0.199 O17 -","- C12 H64 Ce7.204 Gd0.796 O68 -","4","0.5","","Go, Yong Bok; Jacobson, Allan J.","Solid Solution Precursors to Gadolinia-Doped Ceria Prepared via a Low-Temperature Solution Route","Chemistry of Materials","2007","19","19","4702","","10.1021/cm071310k","","","0.71073","MoKα","","0.0404","0.0197","","","0.0353","0.0388","","","","","","0.893","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001402","5.2771","0.0011","9.1476","0.0018","10.804","0.002","90","","99.19","0.03","90","","514.84","0.18","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","Ferrous Tainiolite","Ferrous Tainiolite","","- Cs0.986 F2 Fe2.025 Li0.975 O10 Si4 -","- Cs0.986 F2 Fe2.025 Li0.975 O10 Si4 -","- Cs1.972 F4 Fe4.05 Li1.95 O20 Si8 -","2","0.25","","Mariychuk, Ruslan; Baumgartner, Alexander; Wagner, Friedrich E.; Lerf, Anton; Dubbe, Andreas; Moos, Ralf; Breu, Josef","Synthesis, Structure, and Electric Conductivity of Ferrous Tainiolite and Its Oxidative Conversion into Coarse-Grained Swellable Smectite","Chemistry of Materials","2007","19","22","5377","","10.1021/cm0713778","","","0.71073","MoKα","","0.0381","0.0365","","","0.0883","0.0896","","","","","","1.108","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001403","14.3071","0.0006","6.9965","0.0003","11.451","0.0005","90","","90","","90","","1146.24","0.09","163","2","163","2","","","","","","","","6","C m c m","-C 2c 2","63","","","","- C4 H4 Co N2 O10 V4 -","- C4 H4 Co N2 O10 V4 -","- C16 H16 Co4 N8 O40 V16 -","4","0.25","","Khan, M. Ishaque; Yohannes, Elizabeth; Golub, Vladimir O.; O'Connor, Charles J.; Doedens, Robert J.","Mixed-Valence and Neutral Framework Inorganic−Organic Hybrid Materials: Synthesis, Characterization, and Magnetic Properties of [{Co(N(CH)4N)}(V2O5)2] and [{Co(N(CH)4N)}V2O6]","Chemistry of Materials","2007","19","20","4890","","10.1021/cm071415n","","","0.71073","MoKα","","0.0385","0.0381","","","0.1017","0.1019","","","","","","1.308","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001404","10.2524","0.0008","11.5653","0.0009","7.4719","0.0006","90","","90","","90","","885.96","0.12","163","2","163","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C4 H4 Co N2 O6 V2 -","- C4 H4 Co N2 O6 V2 -","- C16 H16 Co4 N8 O24 V8 -","4","0.5","","Khan, M. Ishaque; Yohannes, Elizabeth; Golub, Vladimir O.; O'Connor, Charles J.; Doedens, Robert J.","Mixed-Valence and Neutral Framework Inorganic−Organic Hybrid Materials: Synthesis, Characterization, and Magnetic Properties of [{Co(N(CH)4N)}(V2O5)2] and [{Co(N(CH)4N)}V2O6]","Chemistry of Materials","2007","19","20","4890","","10.1021/cm071415n","","","0.71073","MoKα","","0.0199","0.0182","","","0.0541","0.0547","","","","","","1.245","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001405","21.4829","0.001","4.6185","0.0002","8.8453","0.0004","90","","100.362","0.001","90","","863.31","0.07","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C2 H4 F2 O6 Pb2 S2 -","- C2 H4 F2 O6 Pb2 S2 -","- C8 H16 F8 O24 Pb8 S8 -","4","0.5","","Rogow, David L.; Zapeda, Gustavo; Swanson, Claudia H.; Fan, Xiaojuan; Oliver, Allen G.; Oliver, Scott R. J.","A Metal−Organic Framework Containing Cationic Inorganic Layers: Pb2F2[C2H4(SO3)2]","Chemistry of Materials","2007","19","19","4658","","10.1021/cm071429t","","","0.71073","MoKα","","0.0883","0.0587","","","0.1297","0.1394","","","","","","1.017","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001406","8.5463","0.0003","13.4903","0.0005","16.9043","0.0006","69.533","0.001","89.581","0.001","86.715","0.001","1822.74","0.11","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H38 N6 O32 P8 Zn6 -","- C8 H38 N6 O32 P8 Zn6 -","- C16 H76 N12 O64 P16 Zn12 -","2","1","","Chang, Wen-Ming; Cheng, Ming-Yu; Liao, Yueh-Chun; Chang, Ming-Chung; Wang, Sue-Lein","Template Effect of Chain-Type Polyamines on Pore Augmentation: Five Open-Framework Zinc Phosphates with 16-Ring Channels","Chemistry of Materials","2007","19","25","6114","","10.1021/cm071462f","","","0.71073","MoKα","","0.0298","0.0268","","","0.0721","0.0732","","","","","","1.063","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001407","8.2558","0.0004","8.5393","0.0004","13.5627","0.0006","87.244","0.001","81.731","0.001","80.492","0.001","932.92","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H19 N3 O16 P4 Zn3 -","- C4 H19 N3 O16 P4 Zn3 -","- C8 H38 N6 O32 P8 Zn6 -","2","1","","Chang, Wen-Ming; Cheng, Ming-Yu; Liao, Yueh-Chun; Chang, Ming-Chung; Wang, Sue-Lein","Template Effect of Chain-Type Polyamines on Pore Augmentation: Five Open-Framework Zinc Phosphates with 16-Ring Channels","Chemistry of Materials","2007","19","25","6114","","10.1021/cm071462f","","","0.71073","MoKα","","0.0379","0.0351","","","0.0955","0.0975","","","","","","1.053","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001408","8.4552","0.0007","10.0614","0.0008","12.8218","0.001","109.012","0.001","90.922","0.002","91.298","0.002","1030.68","0.14","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H22 N3 O17.5 P4 Zn3 -","- C4 H13 N3 O17.5 P4 Zn3 -","- C8 H26 N6 O35 P8 Zn6 -","2","1","","Chang, Wen-Ming; Cheng, Ming-Yu; Liao, Yueh-Chun; Chang, Ming-Chung; Wang, Sue-Lein","Template Effect of Chain-Type Polyamines on Pore Augmentation: Five Open-Framework Zinc Phosphates with 16-Ring Channels","Chemistry of Materials","2007","19","25","6114","","10.1021/cm071462f","","","0.71073","MoKα","","0.0361","0.0296","","","0.0894","0.0914","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001409","16.0829","0.0008","16.0829","0.0008","29.805","0.002","90","","90","","90","","7709.4","0.7","293","2","293","2","","","","","","","","6","I -4 2 d","I -4 2bw","122","","","","- C4 H18.5 N2.5 O13.5 P3 Zn2.5 -","- C2 H3 N1.996 O13 P3 Zn2.5 -","- C32 H48 N31.936 O208 P48 Zn40 -","16","1","","Chang, Wen-Ming; Cheng, Ming-Yu; Liao, Yueh-Chun; Chang, Ming-Chung; Wang, Sue-Lein","Template Effect of Chain-Type Polyamines on Pore Augmentation: Five Open-Framework Zinc Phosphates with 16-Ring Channels","Chemistry of Materials","2007","19","25","6114","","10.1021/cm071462f","","","0.71073","MoKα","","0.0543","0.0488","","","0.1459","0.1489","","","","","","1.118","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001410","13.0907","0.0002","11.9219","0.0002","22.7569","0.0003","90","","96.062","0.001","90","","3531.72","0.09","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","CoEnOx-BPDS-H2O","","","- C24 H47 Co2 N8 O17.5 S2 -","- C24 H47 Co2 N8 O17.5 S2 -","- C96 H188 Co8 N32 O70 S8 -","4","2","","Wang, Xin-Yi; Sevov, Slavi C.","Hydrogen-Bonded Host Frameworks of Cationic Metal Complexes and Anionic Disulfonate Linkers: Effects of the Guest Molecules and the Charge of the Metal Complex","Chemistry of Materials","2007","19","20","4906","","10.1021/cm071480x","","","0.71073","MoKα","","0.0429","0.0384","","","0.0935","0.0985","","","","","","1.057","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001411","6.3228","0.0001","11.9946","0.0002","26.4024","0.0004","90","","91.402","0.001","90","","2001.74","0.06","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","CoEnOx-BPDS-DMF","","","- C30 H54 Co2 N10 O16 S2 -","- C30 H54 Co2 N10 O16 S2 -","- C60 H108 Co4 N20 O32 S4 -","2","0.5","","Wang, Xin-Yi; Sevov, Slavi C.","Hydrogen-Bonded Host Frameworks of Cationic Metal Complexes and Anionic Disulfonate Linkers: Effects of the Guest Molecules and the Charge of the Metal Complex","Chemistry of Materials","2007","19","20","4906","","10.1021/cm071480x","","","0.71073","MoKα","","0.0305","0.0279","","","0.0692","0.0707","","","","","","1.043","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4001412","7.7782","0.0016","10.31","0.002","18.272","0.004","99.69","0.03","94.23","0.04","90.1","0.03","1440.3","0.5","100","2","100","2","","","","","","","","6","P 1","P 1","1","CoEnOx-BPDS-pnp","","","- C42 H69 Co2 N11 O30 S2 -","- C42 H55 Co2 N11 O30 S2 -","- C42 H55 Co2 N11 O30 S2 -","1","1","","Wang, Xin-Yi; Sevov, Slavi C.","Hydrogen-Bonded Host Frameworks of Cationic Metal Complexes and Anionic Disulfonate Linkers: Effects of the Guest Molecules and the Charge of the Metal Complex","Chemistry of Materials","2007","19","20","4906","","10.1021/cm071480x","","","0.71073","MoKα","","0.0433","0.0402","","","0.1117","0.1186","","","","","","1.113","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001413","11.781","0.002","12.915","0.003","17.417","0.004","89.52","0.04","73.11","0.03","89.75","0.03","2535.6","1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","CoEnOx-BPDS-Acpy","","","- C38 H68 Co2 N10 O23 S2 -","- C38 H48.646 Co2 N10 O23 S2 -","- C76 H97.292 Co4 N20 O46 S4 -","2","1","","Wang, Xin-Yi; Sevov, Slavi C.","Hydrogen-Bonded Host Frameworks of Cationic Metal Complexes and Anionic Disulfonate Linkers: Effects of the Guest Molecules and the Charge of the Metal Complex","Chemistry of Materials","2007","19","20","4906","","10.1021/cm071480x","","","0.71073","MoKα","","0.0553","0.0451","","","0.1242","0.1323","","","","","","1.042","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001414","38.284","0.007","10.1952","0.0018","15.276","0.003","90","","110.18","0.01","90","","5596.4","1.8","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","CoEnOx-BPDS-dmapy","","","- C38 H80 Co2 N12 O24 S2 -","- C38 H60 Co2 N12 O24 S2 -","- C152 H240 Co8 N48 O96 S8 -","4","0.5","","Wang, Xin-Yi; Sevov, Slavi C.","Hydrogen-Bonded Host Frameworks of Cationic Metal Complexes and Anionic Disulfonate Linkers: Effects of the Guest Molecules and the Charge of the Metal Complex","Chemistry of Materials","2007","19","20","4906","","10.1021/cm071480x","","","0.71073","MoKα","","0.0804","0.073","","","0.1889","0.1984","","","","","","1.294","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001415","11.7217","0.0008","18.1519","0.0013","26.4208","0.0019","70.693","0.003","89.401","0.003","87.117","0.003","5298.6","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","CoEnOx-BPDS-Hdmapy","","","- C74 H144 Co4 N20 O50 S6 -","- C74 H106.028 Co4 N20 O50 S6 -","- C148 H212.056 Co8 N40 O100 S12 -","2","1","","Wang, Xin-Yi; Sevov, Slavi C.","Hydrogen-Bonded Host Frameworks of Cationic Metal Complexes and Anionic Disulfonate Linkers: Effects of the Guest Molecules and the Charge of the Metal Complex","Chemistry of Materials","2007","19","20","4906","","10.1021/cm071480x","","","0.71073","MoKα","","0.0427","0.0369","","","0.1023","0.109","","","","","","1.043","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001416","5.914","0.01","12.19","0.02","23.72","0.03","89.06","0.06","97.98","0.07","97.16","0.07","1680","5","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H10 F6 N4 S4 -","- C24 H10 F6 N4 S4 -","- C72 H30 F18 N12 S12 -","3","1.5","","Mamada, Masashi; Nishida, Jun-ichi; Kumaki, Daisuke; Tokito, Shizuo; Yamashita, Yoshiro","n-Type Organic Field-Effect Transistors with High Electron Mobilities Based on Thiazole−Thiazolothiazole Conjugated Molecules","Chemistry of Materials","2007","19","22","5404","","10.1021/cm071505s","","","0.7107","MoKα","","","0.0534","","","","0.1085","","","","","","0.869","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001417","8.43","0.01","13.05","0.02","16.35","0.03","93.22","0.06","101.18","0.05","103.56","0.05","1706","5","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H10 F6 N4 S4 -","- C24 H10 F6 N4 S4 -","- C72 H30 F18 N12 S12 -","3","1.5","","Mamada, Masashi; Nishida, Jun-ichi; Kumaki, Daisuke; Tokito, Shizuo; Yamashita, Yoshiro","n-Type Organic Field-Effect Transistors with High Electron Mobilities Based on Thiazole−Thiazolothiazole Conjugated Molecules","Chemistry of Materials","2007","19","22","5404","","10.1021/cm071505s","","","0.7107","MoKα","","","0.0422","","","","0.084","","","","","","0.989","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001418","9.405","0.002","9.405","0.002","10.41","0.002","90","","90","","120","","797.4","0.3","300","","300","","","","","","","","","3","R -3","-R 3","148","Chevrel phase","zinc dihydroxide divanadate dihydrate","","- Cu2.97 Mo18 S24 -","- Cu2.9718 Mo18 S24 -","- Cu2.9718 Mo18 S24 -","1","","","Levi, E.; Mitelman, A.; Aurbach, D.; Brunelli, M.","Structural Mechanism of the Phase Transitions in the Mg−Cu−Mo6S8System Probed by ex Situ Synchrotron X-ray Diffraction","Chemistry of Materials","2007","19","21","5131","","10.1021/cm0715489","powder diffraction","","0.35008","Synchrotron","","","","","","","","","3.9623","1.962","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001419","9.52","0.002","9.52","0.002","10.314","0.002","90","","90","","120","","809.5","0.3","300","","300","","","","","","","","","3","R -3","-R 3","148","Chevrel phase","zinc dihydroxide divanadate dihydrate","","- Cu4.23 Mo18 S24 -","- Cu4.22406 Mo18 S24 -","- Cu4.22406 Mo18 S24 -","1","","","Levi, E.; Mitelman, A.; Aurbach, D.; Brunelli, M.","Structural Mechanism of the Phase Transitions in the Mg−Cu−Mo6S8System Probed by ex Situ Synchrotron X-ray Diffraction","Chemistry of Materials","2007","19","21","5131","","10.1021/cm0715489","powder diffraction","","0.35008","Synchrotron","","","","","","","","","5.397","0.549","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001420","9.47","0.002","9.47","0.002","10.377","0.002","90","","90","","120","","805.9","0.3","300","","300","","","","","","","","","4","R -3","-R 3","148","Chevrel phase","zinc dihydroxide divanadate dihydrate","","- Cu3.37 Mg0.25 Mo18 S24 -","- Cu3.366 Mg0.252 Mo18 S24 -","- Cu3.366 Mg0.252 Mo18 S24 -","1","","","Levi, E.; Mitelman, A.; Aurbach, D.; Brunelli, M.","Structural Mechanism of the Phase Transitions in the Mg−Cu−Mo6S8System Probed by ex Situ Synchrotron X-ray Diffraction","Chemistry of Materials","2007","19","21","5131","","10.1021/cm0715489","powder diffraction","","0.35008","Synchrotron","","","","","","","","","5.397","1.738","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001421","9.548","0.002","9.548","0.002","10.375","0.002","90","","90","","120","","819.1","0.3","300","","300","","","","","","","","","4","R -3","-R 3","148","Chevrel phase","zinc dihydroxide divanadate dihydrate","","- Cu4.37 Mg0.22 Mo18 S24 -","- Cu4.36878 Mg0.2079 Mo18 S24 -","- Cu4.36878 Mg0.2079 Mo18 S24 -","1","","","Levi, E.; Mitelman, A.; Aurbach, D.; Brunelli, M.","Structural Mechanism of the Phase Transitions in the Mg−Cu−Mo6S8System Probed by ex Situ Synchrotron X-ray Diffraction","Chemistry of Materials","2007","19","21","5131","","10.1021/cm0715489","powder diffraction","","0.35008","Synchrotron","","","","","","","","","5.4966","1.98","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001422","9.534","0.002","9.534","0.002","10.431","0.002","90","","90","","120","","821.1","0.3","300","","300","","","","","","","","","4","R -3","-R 3","148","Chevrel phase","zinc dihydroxide divanadate dihydrate","","- Cu1.6 Mg2.09 Mo18 S24 -","- Cu1.602 Mg2.088 Mo18 S24 -","- Cu1.602 Mg2.088 Mo18 S24 -","1","","","Levi, E.; Mitelman, A.; Aurbach, D.; Brunelli, M.","Structural Mechanism of the Phase Transitions in the Mg−Cu−Mo6S8System Probed by ex Situ Synchrotron X-ray Diffraction","Chemistry of Materials","2007","19","21","5131","","10.1021/cm0715489","powder diffraction","","0.35008","Synchrotron","","","","","","","","","3.3731","1.98","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001423","9.516","0.002","9.516","0.002","10.46","0.002","90","","90","","120","","820.3","0.3","300","","300","","","","","","","","","4","R -3","-R 3","148","Chevrel phase","zinc dihydroxide divanadate dihydrate","","- Cu2.86 Mg1.31 Mo18 S24 -","- Cu2.862 Mg1.314 Mo18 S24 -","- Cu2.862 Mg1.314 Mo18 S24 -","1","","","Levi, E.; Mitelman, A.; Aurbach, D.; Brunelli, M.","Structural Mechanism of the Phase Transitions in the Mg−Cu−Mo6S8System Probed by ex Situ Synchrotron X-ray Diffraction","Chemistry of Materials","2007","19","21","5131","","10.1021/cm0715489","powder diffraction","","0.35008","Synchrotron","","","","","","","","","4.4882","1.98","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001424","9.594","0.002","9.594","0.002","10.435","0.002","90","","90","","120","","831.8","0.3","300","","300","","","","","","","","","4","R -3","-R 3","148","Chevrel phase","zinc dihydroxide divanadate dihydrate","","- Cu3.02 Mg2.27 Mo18 S24 -","- Cu3.0276 Mg2.2752 Mo18 S24 -","- Cu3.0276 Mg2.2752 Mo18 S24 -","1","","","Levi, E.; Mitelman, A.; Aurbach, D.; Brunelli, M.","Structural Mechanism of the Phase Transitions in the Mg−Cu−Mo6S8System Probed by ex Situ Synchrotron X-ray Diffraction","Chemistry of Materials","2007","19","21","5131","","10.1021/cm0715489","powder diffraction","","0.35008","Synchrotron","","","","","","","","","3.6866","1.768","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001425","9.724","0.002","9.724","0.002","10.392","0.002","90","","90","","120","","851","0.3","300","","300","","","","","","","","","4","R -3","-R 3","148","Chevrel phase","zinc dihydroxide divanadate dihydrate","","- Cu4.66 Mg3.31 Mo18 S24 -","- Cu4.662 Mg3.312 Mo18 S24 -","- Cu4.662 Mg3.312 Mo18 S24 -","1","","","Levi, E.; Mitelman, A.; Aurbach, D.; Brunelli, M.","Structural Mechanism of the Phase Transitions in the Mg−Cu−Mo6S8System Probed by ex Situ Synchrotron X-ray Diffraction","Chemistry of Materials","2007","19","21","5131","","10.1021/cm0715489","powder diffraction","","0.35008","Synchrotron","","","","","","","","","4.6739","1.789","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001426","9.705","0.002","9.705","0.002","10.405","0.002","90","","90","","120","","848.7","0.3","300","","300","","","","","","","","","4","R -3","-R 3","148","Chevrel phase","zinc dihydroxide divanadate dihydrate","","- Cu1.21 Mg5.4 Mo18 S24 -","- Cu1.20006 Mg5.4 Mo18 S24 -","- Cu1.20006 Mg5.4 Mo18 S24 -","1","","","Levi, E.; Mitelman, A.; Aurbach, D.; Brunelli, M.","Structural Mechanism of the Phase Transitions in the Mg−Cu−Mo6S8System Probed by ex Situ Synchrotron X-ray Diffraction","Chemistry of Materials","2007","19","21","5131","","10.1021/cm0715489","powder diffraction","","0.35008","Synchrotron","","","","","","","","","3.7278","1.789","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001427","9.448","0.002","9.448","0.002","10.392","0.002","90","","90","","120","","803.4","0.3","300","","300","","","","","","","","","4","R -3","-R 3","148","Chevrel phase","zinc dihydroxide divanadate dihydrate","","- Cu3.06 Mg0.2 Mo18 S24 -","- Cu3.06 Mg0.198 Mo18 S24 -","- Cu3.06 Mg0.198 Mo18 S24 -","1","","","Levi, E.; Mitelman, A.; Aurbach, D.; Brunelli, M.","Structural Mechanism of the Phase Transitions in the Mg−Cu−Mo6S8System Probed by ex Situ Synchrotron X-ray Diffraction","Chemistry of Materials","2007","19","21","5131","","10.1021/cm0715489","powder diffraction","","0.35008","Synchrotron","","","","","","","","","5.5699","0.4856","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001428","9.462","0.002","9.462","0.002","10.434","0.002","90","","90","","120","","809","0.3","300","","300","","","","","","","","","4","R -3","-R 3","148","Chevrel phase","zinc dihydroxide divanadate dihydrate","","- Cu2.56 Mg0.77 Mo18 S24 -","- Cu2.556 Mg0.774 Mo18 S24 -","- Cu2.556 Mg0.774 Mo18 S24 -","1","","","Levi, E.; Mitelman, A.; Aurbach, D.; Brunelli, M.","Structural Mechanism of the Phase Transitions in the Mg−Cu−Mo6S8System Probed by ex Situ Synchrotron X-ray Diffraction","Chemistry of Materials","2007","19","21","5131","","10.1021/cm0715489","powder diffraction","","0.35008","Synchrotron","","","","","","","","","5.4032","0.8","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001429","11.6162","0.0005","17.0136","0.0008","18.6513","0.0009","90","","92.615","0.004","90","","3682.3","0.3","295","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C41 H41 Cl N4 O -","- C41 H41 Cl N4 O -","- C164 H164 Cl4 N16 O4 -","4","1","","Bouit, Pierre-Antoine; Wetzel, Guillaume; Berginc, Gérard; Loiseaux, Brigitte; Toupet, Loïc; Feneyrou, Patrick; Bretonnière, Yann; Kamada, Kenji; Maury, Olivier; Andraud, Chantal","Near IR Nonlinear Absorbing Chromophores with Optical Limiting Properties at Telecommunication Wavelengths","Chemistry of Materials","2007","19","22","5325","","10.1021/cm071557h","","","0.71069","MoKα","","0.1437","0.0573","","","0.1623","0.1813","","","","","","0.812","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001430","18","0.02","18","0.02","18.46","0.02","90","","90","","120","","5180","10","153","2","","","","","","","","","","8","R -3 :H","-R 3","148","","","","- C24 H66 Co N6 O46 P S6 W12 -","- C24 H66 Co N6 O46 P S6 W12 -","- C72 H198 Co3 N18 O138 P3 S18 W36 -","3","0.166667","","Uchida, Sayaka; Hikichi, Shiro; Akatsuka, Takeo; Tanaka, Toshiyuki; Kawamoto, Ryosuke; Lesbani, Aldes; Nakagawa, Yoshinao; Uehara, Kazuhiro; Mizuno, Noritaka","Preparation of Monodispersed Nanoparticles by Electrostatic Assembly of Keggin-Type Polyoxometalates and 1,4,7-Triazacyclononane-Based Transition-Metal Complexes","Chemistry of Materials","2007","19","19","4694","","10.1021/cm071565y","","","0.7107","MoKα","","","0.1103","","","","0.2293","","","","","","1.203","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001431","6.196","0.004","15.428","0.011","9.697","0.007","90","","94.494","0.012","90","","924.1","1.1","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","Tyr-Aib-Ala","Tyrosyl-alpha-aminoisobutyryl-alanine monohydrate","","- C16 H25 N3 O6 -","- C16 H23 N3 O6 -","- C32 H46 N6 O12 -","2","1","","Bose, Partha Pratim; Das, Apurba Kr.; Hegde, Raghurama P.; Shamala, Narayanaswami; Banerjee, Arindam","pH-Sensitive Nanostructural Transformation of a Synthetic Self-Assembling Water-Soluble Tripeptide: Nanotube to Nanovesicle","Chemistry of Materials","2007","19","25","6150","","10.1021/cm0716147","","","0.71073","MoKα","","0.1511","0.0829","","","0.1707","0.1951","","","","","","0.926","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001432","23.211","0.003","7.7363","0.0007","12.7856","0.0018","90","","99.276","0.017","90","","2265.9","0.5","293","2","293","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","Cp2Co, Ni(tfadt)2","","","- C18 H10 Co F6 N2 Ni S4 -","- C18 H10 Co F6 N2 Ni S4 -","- C72 H40 Co4 F24 N8 Ni4 S16 -","4","0.5","","Jeannin, Olivier; Clérac, Rodolphe; Fourmigué, Marc","Phase Competition and Weak Hydrogen Bonding in the Giant Hysteresis of an S = 1/2 Nickel Dithiolene Complex: Combined Structural and Magnetic Studies","Chemistry of Materials","2007","19","24","5946","","10.1021/cm071652q","","","0.71073","MoKα","","0.1162","0.0423","","","0.0999","0.1197","","","","","","0.92","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4001433","23.18","0.003","7.7477","0.0005","12.7587","0.0011","90","","99.309","0.012","90","","2261.2","0.4","293","2","293","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","Cp2Co, Ni(tfadt)2)","","","- C18 H10 Co F6 N2 Ni S4 -","- C18 H10 Co F6 N2 Ni S4 -","- C72 H40 Co4 F24 N8 Ni4 S16 -","4","0.5","","Jeannin, Olivier; Clérac, Rodolphe; Fourmigué, Marc","Phase Competition and Weak Hydrogen Bonding in the Giant Hysteresis of an S = 1/2 Nickel Dithiolene Complex: Combined Structural and Magnetic Studies","Chemistry of Materials","2007","19","24","5946","","10.1021/cm071652q","","","0.71073","MoKα","","0.0734","0.0457","","","0.1233","0.1388","","","","","","1.033","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001434","12.3208","0.0014","12.6666","0.0012","15.3798","0.0016","82.475","0.012","67.071","0.012","80.971","0.013","2176.7","0.4","198","2","198","2","","","","","","","","7","P -1","-P 1","2","Cp2Co, Ni(tfadt)2","","","- C18 H10 Co F6 N2 Ni S4 -","- C18 H10 Co F6 N2 Ni S4 -","- C72 H40 Co4 F24 N8 Ni4 S16 -","4","2","","Jeannin, Olivier; Clérac, Rodolphe; Fourmigué, Marc","Phase Competition and Weak Hydrogen Bonding in the Giant Hysteresis of an S = 1/2 Nickel Dithiolene Complex: Combined Structural and Magnetic Studies","Chemistry of Materials","2007","19","24","5946","","10.1021/cm071652q","","","0.71073","MoKα","","0.0693","0.0419","","","0.1128","0.1521","","","","","","1.028","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001435","12.2269","0.0016","12.7554","0.0015","14.8842","0.0018","78.428","0.014","70.997","0.014","79.285","0.014","2131.9","0.5","140","2","140","2","","","","","","","","7","P -1","-P 1","2","Cp2Co, Ni(tfadt)2","","","- C18 H10 Co F6 N2 Ni S4 -","- C18 H10 Co F6 N2 Ni S4 -","- C72 H40 Co4 F24 N8 Ni4 S16 -","4","2","","Jeannin, Olivier; Clérac, Rodolphe; Fourmigué, Marc","Phase Competition and Weak Hydrogen Bonding in the Giant Hysteresis of an S = 1/2 Nickel Dithiolene Complex: Combined Structural and Magnetic Studies","Chemistry of Materials","2007","19","24","5946","","10.1021/cm071652q","","","0.71073","MoKα","","0.0824","0.0423","","","0.1029","0.1402","","","","","","0.997","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001436","7.8202","0.0011","11.5705","0.0018","12.77","0.0017","74.115","0.017","82.87","0.016","76.892","0.017","1080","0.3","170","2","170","2","","","","","","","","7","P -1","-P 1","2","Cp2Co, Ni(tfadt)2)","","","- C18 H10 Co F6 N2 Ni S4 -","- C18 H10 Co F6 N2 Ni S4 -","- C36 H20 Co2 F12 N4 Ni2 S8 -","2","1","","Jeannin, Olivier; Clérac, Rodolphe; Fourmigué, Marc","Phase Competition and Weak Hydrogen Bonding in the Giant Hysteresis of an S = 1/2 Nickel Dithiolene Complex: Combined Structural and Magnetic Studies","Chemistry of Materials","2007","19","24","5946","","10.1021/cm071652q","","","0.71073","MoKα","","0.1058","0.0651","","","0.1652","0.1891","","","","","","0.917","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4001437","7.859","0.005","11.601","0.005","12.792","0.005","74.405","0.005","83.095","0.005","76.063","0.005","1088.3","0.9","200","2","200","2","","","","","","","","7","P -1","-P 1","2","Cp2Co, Ni(tfadt)2","","","- C18 H10 Co F6 N2 Ni S4 -","- C18 H10 Co F6 N2 Ni S4 -","- C36 H20 Co2 F12 N4 Ni2 S8 -","2","1","","Jeannin, Olivier; Clérac, Rodolphe; Fourmigué, Marc","Phase Competition and Weak Hydrogen Bonding in the Giant Hysteresis of an S = 1/2 Nickel Dithiolene Complex: Combined Structural and Magnetic Studies","Chemistry of Materials","2007","19","24","5946","","10.1021/cm071652q","","","0.71073","MoKα","","0.1145","0.0652","","","0.1646","0.1879","","","","","","0.923","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4001438","12.333","0.002","12.6886","0.0018","15.462","0.002","82.416","0.017","66.981","0.017","80.951","0.018","2192.6","0.6","210","2","210","2","","","","","","","","7","P -1","-P 1","2","Cp2Co, Ni(tfadt)2","","","- C18 H10 Co F6 N2 Ni S4 -","- C18 H10 Co F6 N2 Ni S4 -","- C72 H40 Co4 F24 N8 Ni4 S16 -","4","2","","Jeannin, Olivier; Clérac, Rodolphe; Fourmigué, Marc","Phase Competition and Weak Hydrogen Bonding in the Giant Hysteresis of an S = 1/2 Nickel Dithiolene Complex: Combined Structural and Magnetic Studies","Chemistry of Materials","2007","19","24","5946","","10.1021/cm071652q","","","0.71073","MoKα","","0.1538","0.0727","","","0.1786","0.1988","","","","","","0.988","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4001439","10.3522","0.0005","10.3522","0.0005","4.1784","0.0005","90","","90","","90","","447.79","0.06","293","2","293","2","","","","","","","","4","P 4/m","-P 4","83","","","","- Co4 Dy7 Ge12 In -","- Co4 Dy7 Ge12 In -","- Co4 Dy7 Ge12 In -","1","0.125","","Chondroudi, Maria; Balasubramanian, Mahalingam; Welp, Ulrich; Kwok, Wai-K.; Kanatzidis, Mercouri G.","Mixed Valency in Yb7Co4InGe12: A Novel Intermetallic Compound Stabilized in Liquid Indium","Chemistry of Materials","2007","19","19","4769","","10.1021/cm071687q","","","0.71073","MoKα","","0.0336","0.0258","","","0.0552","0.058","","","","","","1.138","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001440","10.357","0.003","10.357","0.003","4.1538","0.0015","90","","90","","90","","445.6","0.2","293","2","293","2","","","","","","","","4","P 4/m","-P 4","83","","","","- Co4 Ge12 Ho7 In -","- Co4 Ge12 Ho7 In -","- Co4 Ge12 Ho7 In -","1","0.125","","Chondroudi, Maria; Balasubramanian, Mahalingam; Welp, Ulrich; Kwok, Wai-K.; Kanatzidis, Mercouri G.","Mixed Valency in Yb7Co4InGe12: A Novel Intermetallic Compound Stabilized in Liquid Indium","Chemistry of Materials","2007","19","19","4769","","10.1021/cm071687q","","","0.71073","MoKα","","0.0496","0.0464","","","0.1141","0.1152","","","","","","1.299","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001441","10.2937","0.0007","10.2937","0.0007","4.1518","0.0005","90","","90","","90","","439.93","0.07","293","2","293","2","","","","","","","","4","P 4/m","-P 4","83","","","","- Co4 Ge12 In Yb7 -","- Co4 Ge12 In Yb7 -","- Co4 Ge12 In Yb7 -","1","0.125","","Chondroudi, Maria; Balasubramanian, Mahalingam; Welp, Ulrich; Kwok, Wai-K.; Kanatzidis, Mercouri G.","Mixed Valency in Yb7Co4InGe12: A Novel Intermetallic Compound Stabilized in Liquid Indium","Chemistry of Materials","2007","19","19","4769","","10.1021/cm071687q","","","0.71073","MoKα","","0.0332","0.0304","","","0.071","0.0723","","","","","","1.126","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001442","21.3215","0.0006","12.6721","0.0004","13.4677","0.0004","90","","121.974","0.002","90","","3086.76","0.17","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H36 Cu2 N2 O8 -","- C30 H36 Cu2 N2 O8 -","- C120 H144 Cu8 N8 O32 -","4","0.5","","Zhang, Jian; Yao, Yuan-Gen; Bu, Xianhui","Comparative Study of Homochiral and Racemic Chiral Metal-Organic Frameworks Built from Camphoric Acid","Chemistry of Materials","2007","19","21","5083","","10.1021/cm071689a","","","0.71073","MoKα","","0.1332","0.0658","","","0.1505","0.1832","","","","","","1.037","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001443","21.2692","0.0016","12.5647","0.0006","13.4995","0.001","90","","121.843","0.002","90","","3064.7","0.4","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C30 H36 Cu2 N2 O8 -","- C30 H36 Cu2 N2 O8 -","- C120 H144 Cu8 N8 O32 -","4","1","","Zhang, Jian; Yao, Yuan-Gen; Bu, Xianhui","Comparative Study of Homochiral and Racemic Chiral Metal-Organic Frameworks Built from Camphoric Acid","Chemistry of Materials","2007","19","21","5083","","10.1021/cm071689a","","","0.71073","MoKα","","","0.0402","","","0.1085","0.1112","","","","","","1.03","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001444","7.7316","0.0009","11.6883","0.0012","17.2033","0.0018","90","","101.228","0.004","90","","1524.9","0.3","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H36 N2 O8 Zn2 -","- C30 H36 N2 O8 Zn2 -","- C60 H72 N4 O16 Zn4 -","2","0.5","","Zhang, Jian; Yao, Yuan-Gen; Bu, Xianhui","Comparative Study of Homochiral and Racemic Chiral Metal-Organic Frameworks Built from Camphoric Acid","Chemistry of Materials","2007","19","21","5083","","10.1021/cm071689a","","","0.71073","MoKα","","","0.0521","","","0.1487","0.1614","","","","","","1.053","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001445","7.7559","0.0019","11.598","0.003","17.588","0.005","90","","102.64","0.002","90","","1543.7","0.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C30 H36 N2 O8 Zn2 -","- C30 H36 N2 O8 Zn2 -","- C60 H72 N4 O16 Zn4 -","2","1","","Zhang, Jian; Yao, Yuan-Gen; Bu, Xianhui","Comparative Study of Homochiral and Racemic Chiral Metal-Organic Frameworks Built from Camphoric Acid","Chemistry of Materials","2007","19","21","5083","","10.1021/cm071689a","","","0.71073","MoKα","","","0.0328","","","0.0865","0.1045","","","","","","1.086","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001446","9.5125","0.0003","11.3212","0.0003","18.4446","0.0004","104.879","0.002","92.208","0.002","95.825","0.002","1905.52","0.09","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H43 Cd2 N3 O8 -","- C38 H43 Cd2 N3 O8 -","- C76 H86 Cd4 N6 O16 -","2","1","","Zhang, Jian; Yao, Yuan-Gen; Bu, Xianhui","Comparative Study of Homochiral and Racemic Chiral Metal-Organic Frameworks Built from Camphoric Acid","Chemistry of Materials","2007","19","21","5083","","10.1021/cm071689a","","","0.71073","MoKα","","0.0771","0.0444","","","0.1004","0.1274","","","","","","0.937","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001447","18.8494","0.0007","10.8373","0.0004","19.0705","0.0007","90","","102.786","0.002","90","","3799.1","0.2","273","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C76 H86 Cd4 N6 O16 -","- C76 H86 Cd4 N6 O16 -","- C152 H172 Cd8 N12 O32 -","2","1","","Zhang, Jian; Yao, Yuan-Gen; Bu, Xianhui","Comparative Study of Homochiral and Racemic Chiral Metal-Organic Frameworks Built from Camphoric Acid","Chemistry of Materials","2007","19","21","5083","","10.1021/cm071689a","","","0.71073","MoKα","","0.0493","0.0352","","","0.0655","0.0699","","","","","","0.904","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001448","17.9391","0.0003","17.9391","0.0003","38.4446","0.0013","90","","90","","120","","10714.4","0.4","150","2","150","2","","","","","","","","8","P 63 2 2","P 6c 2c","182","","","","- C221 H192 Ag5 Cl0 F15 N24 O15 S5 -","- C220.98 H192 Ag5 F14.94 N24 O14.94 S5.01 -","- C441.96 H384 Ag10 F29.88 N48 O29.88 S10.02 -","2","0.166667","","Zhang, Xue-Li; Guo, Cui-Ping; Yang, Qing-Yuan; Lu, Tong-Bu; Tong, Ye-Xiang; Su, Cheng-Yong","Discrete Chiral Single-Crystal Microtubes Assembled with Honeycomb Coordination Networks Showing Structural Diversity and Borromean Topology in One Single Crystal","Chemistry of Materials","2007","19","19","4630","","10.1021/cm071767u","","","1.54187","CuKα","","0.1121","0.0678","","","0.1449","0.1587","","","","","","1.01","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001449","17.9074","0.0004","17.9074","0.0004","38.5402","0.0017","90","","90","","120","","10703.1","0.6","150","2","150","2","","","","","","","","8","P 63 2 2","P 6c 2c","182","","","","- C221 H192 Ag5 Cl0 F15 N24 O15 S5 -","- C220.98 H192 Ag5 F14.94 N24 O14.94 S5.01 -","- C441.96 H384 Ag10 F29.88 N48 O29.88 S10.02 -","2","0.166667","","Zhang, Xue-Li; Guo, Cui-Ping; Yang, Qing-Yuan; Lu, Tong-Bu; Tong, Ye-Xiang; Su, Cheng-Yong","Discrete Chiral Single-Crystal Microtubes Assembled with Honeycomb Coordination Networks Showing Structural Diversity and Borromean Topology in One Single Crystal","Chemistry of Materials","2007","19","19","4630","","10.1021/cm071767u","","","1.54187","CuKα","","0.1115","0.0757","","","0.1649","0.1791","","","","","","1.015","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001450","7.524","0.0011","7.524","0.0011","14.746","0.003","90","","90","","120","","722.9","0.2","100","2","100","2","","","","","","","","6","P -6 2 c","P -6c -2c","190","","","","- C8 H30 Al4 Ge6 N6 O20 -","- C7.96 Al4.028 Ge5.972 N6.02 O20 -","- C7.96 Al4.028 Ge5.972 N6.02 O20 -","1","0.0833333","","Shi, Lei; Christensen, Kirsten E.; Jansson, Kjell; Sun, Junliang; Zou, Xiaodong","Synthesis and Characterization of an Aluminogermanate SU-46 with a Zeolite Structure","Chemistry of Materials","2007","19","24","5973","","10.1021/cm071790f","","","0.71073","MoKα","","0.0315","0.0251","","","0.0636","0.0647","","","","","","1.062","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001451","17.1841","0.0009","12.4648","0.0007","6.7661","0.0004","90","","90","","90","","1449.27","0.14","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H13 N5 O2 -","- C17 H13 N5 O2 -","- C68 H52 N20 O8 -","4","1","","Kim, Tae Ho; Seo, Joobeom; Lee, Soo Jin; Lee, Shim Sung; Kim, Jineun; Jung, Jong Hwa","Strongly Fluorescent Hydrogel as a Blue-Emitting Nanomaterial: An Approach toward Understanding Fluorescence−Structure Relationship","Chemistry of Materials","2007","19","24","5815","","10.1021/cm701880e","","","0.71073","MoKα","","0.0817","0.0718","","","0.1438","0.1478","","","","","","1.215","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4001452","7.6293","0.0009","8.9099","0.0011","12.3769","0.0015","72.542","0.002","72.226","0.002","77.396","0.002","756.81","0.16","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H14 N4 O2 -","- C18 H14 N4 O2 -","- C36 H28 N8 O4 -","2","1","","Kim, Tae Ho; Seo, Joobeom; Lee, Soo Jin; Lee, Shim Sung; Kim, Jineun; Jung, Jong Hwa","Strongly Fluorescent Hydrogel as a Blue-Emitting Nanomaterial: An Approach toward Understanding Fluorescence−Structure Relationship","Chemistry of Materials","2007","19","24","5815","","10.1021/cm701880e","","","0.71073","MoKα","","0.1303","0.0728","","","0.1299","0.1478","","","","","","1.023","","","","has coordinates","288253","2023-12-12","14:36:09",""
"4001453","8.92","0.0018","11.111","0.002","11.748","0.002","110.96","0.03","100.17","0.03","94.53","0.03","1057.3","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H18 N7 O9 -","- C18 H18 N7 O9 -","- C36 H36 N14 O18 -","2","1","","Kim, Tae Ho; Seo, Joobeom; Lee, Soo Jin; Lee, Shim Sung; Kim, Jineun; Jung, Jong Hwa","Strongly Fluorescent Hydrogel as a Blue-Emitting Nanomaterial: An Approach toward Understanding Fluorescence−Structure Relationship","Chemistry of Materials","2007","19","24","5815","","10.1021/cm701880e","","","0.82657","synchrotron","","0.1455","0.1307","","","0.378","0.4041","","","","","","2.03","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001454","6.9716","0.0009","7.0279","0.0009","9.4593","0.0013","90","","99.188","0.002","90","","457.52","0.1","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Ammonium tungsten tellurite","","- H8 N2 O8 Te2 W -","- N2 O8 Te2 W -","- N4 O16 Te4 W2 -","2","1","","Kim, Jun-Ho; Baek, Jaewook; Halasyamani, P. Shiv","(NH4)2Te2WO8: A New Polar Oxide with Second-Harmonic Generating, Ferroelectric, and Pyroelectric Properties","Chemistry of Materials","2007","19","23","5637","","10.1021/cm7019334","","","0.71073","MoKα","","0.0359","0.0318","","","0.0597","0.0607","","","","","","0.922","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001455","19.767","0.002","7.6608","0.001","14.602","0.002","90","","111.66","0.006","90","","2055.1","0.4","90","","90","","","","","","","","local laboratory","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H27 B11 O3 S -","- C12 H27 B11 O3 S -","- C48 H108 B44 O12 S4 -","4","1","","Hao, Erhong; Fabre, Bruno; Fronczek, Frank R.; Vicente, M. Graça H.","Syntheses and Electropolymerization of Carboranyl-Functionalized Pyrroles and Thiophenes","Chemistry of Materials","2007","19","25","6195","","10.1021/cm701935n","","","0.71073","MoKα","","0.071","0.044","","","0.105","0.115","","","","","","1.034","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001456","17.049","0.003","7.9948","0.0011","12.027","0.002","90","","103.844","0.007","90","","1591.7","0.4","115","","115","","","","","","","","local laboratory","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H19 B10 I -","- C10 H19 B10 I -","- C40 H76 B40 I4 -","4","1","","Hao, Erhong; Fabre, Bruno; Fronczek, Frank R.; Vicente, M. Graça H.","Syntheses and Electropolymerization of Carboranyl-Functionalized Pyrroles and Thiophenes","Chemistry of Materials","2007","19","25","6195","","10.1021/cm701935n","","","0.71073","MoKα","","0.028","0.025","","","0.064","0.061","","","","","","1.037","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4001457","18.803","0.003","7.8137","0.0012","12.159","0.002","90","","101.279","0.007","90","","1751.9","0.5","90","","90","","","","","","","","local laboratory","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H22 B10 S -","- C14 H22 B10 S -","- C56 H88 B40 S4 -","4","1","","Hao, Erhong; Fabre, Bruno; Fronczek, Frank R.; Vicente, M. Graça H.","Syntheses and Electropolymerization of Carboranyl-Functionalized Pyrroles and Thiophenes","Chemistry of Materials","2007","19","25","6195","","10.1021/cm701935n","","","0.71073","MoKα","","0.064","0.046","","","0.109","0.119","","","","","","1.022","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001458","20.998","0.004","4.026","0.0008","12.149","0.002","90","","119","0.03","90","","898.3","0.4","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Cadimum Antimony Selenobromide","","","- Br2 Cd Sb2 Se3 -","- Br2 Cd Sb2 Se3 -","- Br8 Cd4 Sb8 Se12 -","4","0.5","","Wang, Lei; Hwu, Shiou-Jyh","A New Series of Chalcohalide Semiconductors with Composite CdBr2/Sb2Se3Lattices: Synthesis and Characterization of CdSb2Se3Br2and Indium Derivatives InSb2S4X (X = Cl and Br) and InM2Se4Br (M = Sb and Bi)","Chemistry of Materials","2007","19","25","6212","","10.1021/cm701995d","","","0.71073","MoKα","","0.059","0.0566","","","0.133","0.1357","","","","","","1.142","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001459","19.877","0.004","3.852","0.0008","11.484","0.002","90","","117.75","0.03","90","","778.2","0.3","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Indium Antimony Sulfochloride","","","- Cl In S4 Sb2 -","- Cl In S4 Sb2 -","- Cl4 In4 S16 Sb8 -","4","0.5","","Wang, Lei; Hwu, Shiou-Jyh","A New Series of Chalcohalide Semiconductors with Composite CdBr2/Sb2Se3Lattices: Synthesis and Characterization of CdSb2Se3Br2and Indium Derivatives InSb2S4X (X = Cl and Br) and InM2Se4Br (M = Sb and Bi)","Chemistry of Materials","2007","19","25","6212","","10.1021/cm701995d","","","0.71073","MoKα","","0.0325","0.0303","","","0.0726","0.0739","","","","","","1.158","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001460","20.177","0.004","3.867","0.0008","11.66","0.002","90","","119.13","0.03","90","","794.7","0.4","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Indium Antimony Sulfobromide","","","- Br In S4 Sb2 -","- Br In S4 Sb2 -","- Br4 In4 S16 Sb8 -","4","0.5","","Wang, Lei; Hwu, Shiou-Jyh","A New Series of Chalcohalide Semiconductors with Composite CdBr2/Sb2Se3Lattices: Synthesis and Characterization of CdSb2Se3Br2and Indium Derivatives InSb2S4X (X = Cl and Br) and InM2Se4Br (M = Sb and Bi)","Chemistry of Materials","2007","19","25","6212","","10.1021/cm701995d","","","0.71073","MoKα","","0.062","0.0496","","","0.0985","0.1038","","","","","","1.116","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001461","20.772","0.004","4.002","0.0008","11.939","0.002","90","","118.14","0.03","90","","875.2","0.4","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Indium Antimony Selenobromide","","","- Br In Sb2 Se4 -","- Br In Sb2 Se4 -","- Br4 In4 Sb8 Se16 -","4","0.5","","Wang, Lei; Hwu, Shiou-Jyh","A New Series of Chalcohalide Semiconductors with Composite CdBr2/Sb2Se3Lattices: Synthesis and Characterization of CdSb2Se3Br2and Indium Derivatives InSb2S4X (X = Cl and Br) and InM2Se4Br (M = Sb and Bi)","Chemistry of Materials","2007","19","25","6212","","10.1021/cm701995d","","","0.71073","MoKα","","0.0704","0.0555","","","0.1211","0.1269","","","","","","1.13","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001462","20.832","0.004","4.114","0.0008","11.958","0.002","90","","118.15","0.03","90","","903.6","0.4","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Indium Bismuth Selenobromide","","","- Bi2 Br In Se4 -","- Bi2 Br In Se4 -","- Bi8 Br4 In4 Se16 -","4","0.5","","Wang, Lei; Hwu, Shiou-Jyh","A New Series of Chalcohalide Semiconductors with Composite CdBr2/Sb2Se3Lattices: Synthesis and Characterization of CdSb2Se3Br2and Indium Derivatives InSb2S4X (X = Cl and Br) and InM2Se4Br (M = Sb and Bi)","Chemistry of Materials","2007","19","25","6212","","10.1021/cm701995d","","","0.71073","MoKα","","0.0278","0.0263","","","0.0595","0.0604","","","","","","1.202","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001463","5.3143","0.0002","8.208","0.0003","12.725","0.0006","90","","90.192","0.004","90","","555.06","0.04","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","strontium zinc diphosphate","strontium zinc diphosphate","","- O7 P2 Sr Zn -","- O7 P2 Sr Zn -","- O28 P8 Sr4 Zn4 -","4","1","","Höppe, Henning A.; Daub, Michael; Bröhmer, Manuel C.","Coactivation of α-Sr(PO3)2and SrM(P2O7) (M = Zn, Sr) with Eu2+and Mn2+","Chemistry of Materials","2007","19","25","6358","","10.1021/cm702292x","","","0.71073","MoKα","","0.0649","0.035","","","0.0645","0.0701","","","","","","1.018","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001464","8.814","0.002","8.591","0.002","27.644","0.005","90","","90","","90","","2093.2","0.8","273.2","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C8 H24 I4 N2 Sn -","- C8 I4 N2 Sn -","- C32 I16 N8 Sn4 -","4","0.5","","Takahashi, Yukari; Obara, Rena; Nakagawa, Kohei; Nakano, Masayuki; Tokita, Jun-ya; Inabe, Tamotsu","Tunable Charge Transport in Soluble Organic‒Inorganic Hybrid Semiconductors","Chemistry of Materials","2007","19","25","6312","","10.1021/cm702405c","","","0.7107","MoKα","","","0.0709","","","","0.1715","","","","","","1.666","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001465","8.9315","0.0007","26.023","0.003","8.4082","0.0007","90","","90","","90","","1954.3","0.3","128.2","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C8 H24 I4 N2 Sn -","- C8 I4 N2 Sn -","- C32 I16 N8 Sn4 -","4","0.5","","Takahashi, Yukari; Obara, Rena; Nakagawa, Kohei; Nakano, Masayuki; Tokita, Jun-ya; Inabe, Tamotsu","Tunable Charge Transport in Soluble Organic‒Inorganic Hybrid Semiconductors","Chemistry of Materials","2007","19","25","6312","","10.1021/cm702405c","","","0.7107","MoKα","","","0.1081","","","","0.2642","","","","","","1.965","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001466","12.648","0.001","12.225","0.001","20.605","0.002","90","","97.434","0.002","90","","3159.2","0.5","273.2","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C5 H16 I4 N2 Sn -","- C5 I4 N2 Sn -","- C40 I32 N16 Sn8 -","8","1","","Takahashi, Yukari; Obara, Rena; Nakagawa, Kohei; Nakano, Masayuki; Tokita, Jun-ya; Inabe, Tamotsu","Tunable Charge Transport in Soluble Organic‒Inorganic Hybrid Semiconductors","Chemistry of Materials","2007","19","25","6312","","10.1021/cm702405c","","","0.7107","MoKα","","","0.062","","","","0.2183","","","","","","1.834","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001467","32.299","0.004","6.1042","0.0007","6.1378","0.0007","90","","93.961","0.004","90","","1207.2","0.2","203.2","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C16 H24 I4 N2 Sn -","- C16 I4 N2 Sn -","- C32 I8 N4 Sn2 -","2","0.25","","Takahashi, Yukari; Obara, Rena; Nakagawa, Kohei; Nakano, Masayuki; Tokita, Jun-ya; Inabe, Tamotsu","Tunable Charge Transport in Soluble Organic‒Inorganic Hybrid Semiconductors","Chemistry of Materials","2007","19","25","6312","","10.1021/cm702405c","","","0.7107","MoKα","","","0.0341","","","","0.1043","","","","","","1.622","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001468","36.695","0.001","8.5068","0.0003","8.7454","0.0002","90","","90","","90","","2729.94","0.14","293.2","","","","","","","","","","","6","C m c a","-C 2ac 2","64","","","","- C16 H32 I4 N2 O4 Sn -","- C16 I4 N2 O4 Sn -","- C64 I16 N8 O16 Sn4 -","4","","","Takahashi, Yukari; Obara, Rena; Nakagawa, Kohei; Nakano, Masayuki; Tokita, Jun-ya; Inabe, Tamotsu","Tunable Charge Transport in Soluble Organic‒Inorganic Hybrid Semiconductors","Chemistry of Materials","2007","19","25","6312","","10.1021/cm702405c","","","0.7107","MoKα","","","0.0506","","","","0.1348","","","","","","1.758","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001469","8.95","0.001","8.392","0.001","15.393","0.002","90","","92.268","0.003","90","","1155.2","0.2","295.2","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C8 H22 I6 N2 Sn -","- C8 I6 N2 Sn -","- C16 I12 N4 Sn2 -","2","0.5","","Takahashi, Yukari; Obara, Rena; Nakagawa, Kohei; Nakano, Masayuki; Tokita, Jun-ya; Inabe, Tamotsu","Tunable Charge Transport in Soluble Organic‒Inorganic Hybrid Semiconductors","Chemistry of Materials","2007","19","25","6312","","10.1021/cm702405c","","","0.7107","MoKα","","","0.0734","","","","0.174","","","","","","1.926","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001470","8.8871","0.0003","9.2148","0.0003","24.1897","0.0009","90","","90","","90","","1980.96","0.12","273.2","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C8 H20 I4 N2 O4 Sn -","- C8 I4 N2 O4 Sn -","- C32 I16 N8 O16 Sn4 -","4","0.5","","Takahashi, Yukari; Obara, Rena; Nakagawa, Kohei; Nakano, Masayuki; Tokita, Jun-ya; Inabe, Tamotsu","Tunable Charge Transport in Soluble Organic‒Inorganic Hybrid Semiconductors","Chemistry of Materials","2007","19","25","6312","","10.1021/cm702405c","","","0.7107","MoKα","","","0.0492","","","","0.1457","","","","","","1.613","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001471","6.4411","0.0004","20.729","0.001","12.7965","0.0008","90","","95.6","0.002","90","","1700.4","0.17","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H16 I4 N2 Sn -","- C7 I4 N2 Sn -","- C28 I16 N8 Sn4 -","4","1","","Takahashi, Yukari; Obara, Rena; Nakagawa, Kohei; Nakano, Masayuki; Tokita, Jun-ya; Inabe, Tamotsu","Tunable Charge Transport in Soluble Organic‒Inorganic Hybrid Semiconductors","Chemistry of Materials","2007","19","25","6312","","10.1021/cm702405c","","","0.7107","MoKα","","","0.0573","","","","0.1177","","","","","","1.432","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001472","8.731","0.0004","25.416","0.001","9.5516","0.0006","90","","90","","90","","2119.57","0.18","293.2","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C10 H10 I6 N2 Sn -","- C10 I6 N2 Sn -","- C40 I24 N8 Sn4 -","4","0.5","","Takahashi, Yukari; Obara, Rena; Nakagawa, Kohei; Nakano, Masayuki; Tokita, Jun-ya; Inabe, Tamotsu","Tunable Charge Transport in Soluble Organic‒Inorganic Hybrid Semiconductors","Chemistry of Materials","2007","19","25","6312","","10.1021/cm702405c","","","0.7107","MoKα","","","0.0548","","","","0.1497","","","","","","1.957","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001473","6.377","0.003","14.534","0.007","12.919","0.007","90","","94.683","0.011","90","","1193.4","1","296.1","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 S4 -","- C12 H12 S4 -","- C48 H48 S16 -","4","1","","Takahashi, Yukihiro; Hasegawa, Tatsuo; Horiuchi, Sachio; Kumai, Reiji; Tokura, Yoshinori; Saito, Gunji","High Mobility Organic Field-Effect Transistor Based on Hexamethylenetetrathiafulvalene with Organic Metal Electrodes","Chemistry of Materials","2007","19","26","6382","","10.1021/cm702690w","","","0.688","synchrotron","","","0.0571","","","","0.0687","","","","","","0.999","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4001901","2.8724","0.0007","2.8724","0.0007","14.495","0.003","90","","90","","120","","103.57","0.04","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Lithium Manganese Oxide (0.78/0.85/2)","","- Li0.78 Mn0.85 O2 -","- Li0.78 Mn0.85 O2 -","- Li2.34 Mn2.55 O6 -","3","0.0833333","","Armstrong, A. Robert; Paterson, Allan J.; Dupré, Nicolas; Grey, Clare P.; Bruce, Peter G.","Structural evolution of layered Li~x~Mn~y~O~2~: combined neutron, NMR, and electrochemical study","Chemistry of Materials","2007","19","5","1016","1023","10.1021/cm0621747","","","","","","0.0151","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4001902","2.8752","0.0012","2.8752","0.0012","14.391","0.005","90","","90","","120","","103.03","0.07","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Lithium Manganese Oxide (1.07/0.76/2)","","- Li1.07 Mn0.76 O2 -","- Li1.07 Mn0.76 O2 -","- Li3.21 Mn2.28 O6 -","3","0.0833333","","Armstrong, A. Robert; Paterson, Allan J.; Dupré, Nicolas; Grey, Clare P.; Bruce, Peter G.","Structural evolution of layered Li~x~Mn~y~O~2~: combined neutron, NMR, and electrochemical study","Chemistry of Materials","2007","19","5","1016","1023","10.1021/cm0621747","","","","","","0.0194","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4001903","2.8752","0.0008","2.8752","0.0008","14.425","0.003","90","","90","","120","","103.27","0.05","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Lithium Manganese Oxide (0.80/0.81/2)","","- Li0.8 Mn0.81 O2 -","- Li0.8 Mn0.81 O2 -","- Li2.4 Mn2.43 O6 -","3","0.0833333","","Armstrong, A. Robert; Paterson, Allan J.; Dupré, Nicolas; Grey, Clare P.; Bruce, Peter G.","Structural evolution of layered Li~x~Mn~y~O~2~: combined neutron, NMR, and electrochemical study","Chemistry of Materials","2007","19","5","1016","1023","10.1021/cm0621747","","","","","","0.0179","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4001904","2.8756","0.001","2.8756","0.001","14.332","0.004","90","","90","","120","","102.63","0.06","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Lithium Manganese Oxide (0.96/0.79/2)","","- Li0.96 Mn0.79 O2 -","- Li0.96 Mn0.79 O2 -","- Li2.88 Mn2.37 O6 -","3","0.0833333","","Armstrong, A. Robert; Paterson, Allan J.; Dupré, Nicolas; Grey, Clare P.; Bruce, Peter G.","Structural evolution of layered Li~x~Mn~y~O~2~: combined neutron, NMR, and electrochemical study","Chemistry of Materials","2007","19","5","1016","1023","10.1021/cm0621747","","","","","","0.0104","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4001905","2.88","0.002","2.88","0.002","14.347","0.005","90","","90","","120","","103.06","0.11","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Lithium Manganese Oxide (0.96/0.74/2)","","- Li0.96 Mn0.74 O2 -","- Li0.96 Mn0.74 O2 -","- Li2.88 Mn2.22 O6 -","3","0.0833333","","Armstrong, A. Robert; Paterson, Allan J.; Dupré, Nicolas; Grey, Clare P.; Bruce, Peter G.","Structural evolution of layered Li~x~Mn~y~O~2~: combined neutron, NMR, and electrochemical study","Chemistry of Materials","2007","19","5","1016","1023","10.1021/cm0621747","","","","","","0.0164","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4001998","6.1264","0.0004","6.1264","0.0004","5.6914","0.0004","90","","90","","120","","185","0.02","295","2","295","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","neodymium chromium trigermanide","neodymium chromium germanide (1/1/3)","","- Cr Ge3 Nd -","- Cr Ge3 Nd -","- Cr2 Ge6 Nd2 -","2","0.0833333","","Bie, Haiying; Zelinska, Oksana Ya.; Tkachuk, Andriy V.; Mar, Arthur","Structures and Physical Properties of Rare-Earth Chromium Germanides RECrGe3(RE = La−Nd, Sm)","Chemistry of Materials","2007","19","18","4613","","10.1021/cm071276+","","","0.71073","MoKα","","0.0235","0.0235","","","0.0636","0.0636","","","","","","1.064","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001999","6.1416","0.0006","6.1416","0.0006","5.7039","0.0005","90","","90","","120","","186.32","0.03","295","2","295","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","praseodymium chromium trigermanide","praseodymium chromium germanide (1/1/3)","","- Cr Ge3 Pr -","- Cr Ge3 Pr -","- Cr2 Ge6 Pr2 -","2","0.0833333","","Bie, Haiying; Zelinska, Oksana Ya.; Tkachuk, Andriy V.; Mar, Arthur","Structures and Physical Properties of Rare-Earth Chromium Germanides RECrGe3(RE = La−Nd, Sm)","Chemistry of Materials","2007","19","18","4613","","10.1021/cm071276+","","","0.71073","MoKα","","0.0323","0.0323","","","0.0748","0.0748","","","","","","1.334","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002000","6.15","0.002","6.15","0.002","5.7222","0.0019","90","","90","","120","","187.43","0.11","295","2","295","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","cerium chromium trigermanide","cerium chromium germanide (1/1/3)","","- Ce Cr Ge3 -","- Ce Cr Ge3 -","- Ce2 Cr2 Ge6 -","2","0.0833333","","Bie, Haiying; Zelinska, Oksana Ya.; Tkachuk, Andriy V.; Mar, Arthur","Structures and Physical Properties of Rare-Earth Chromium Germanides RECrGe3(RE = La−Nd, Sm)","Chemistry of Materials","2007","19","18","4613","","10.1021/cm071276+","","","0.71073","MoKα","","0.0278","0.0278","","","0.0698","0.0698","","","","","","1.079","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002001","6.2004","0.0007","6.2004","0.0007","5.766","0.0006","90","","90","","120","","191.98","0.04","295","2","295","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","lanthanum chromium trigermanide","lanthanum chromium germanide (1/1/3)","","- Cr Ge3 La -","- Cr Ge3 La -","- Cr2 Ge6 La2 -","2","0.0833333","","Bie, Haiying; Zelinska, Oksana Ya.; Tkachuk, Andriy V.; Mar, Arthur","Structures and Physical Properties of Rare-Earth Chromium Germanides RECrGe3(RE = La−Nd, Sm)","Chemistry of Materials","2007","19","18","4613","","10.1021/cm071276+","","","0.71073","MoKα","","0.0252","0.0235","","","0.0511","0.0521","","","","","","1.299","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002002","10.237","0.004","11.17","0.004","8.139","0.004","90","","91.51","0.02","90","","930.3","0.7","200","2","200","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","Bis(N-n-butylpyrrolo[3,4-d])TTF","","","- C18 H22 N2 S4 -","- C18 H22 N2 S4 -","- C36 H44 N4 S8 -","2","0.5","","Doi, Iori; Miyazaki, Eigo; Takimiya, Kazuo; Kunugi, Yoshihito","Development ofN-Alkyl-Substituted Bis(pyrrolo[3,4-d])tetrathiafulvalenes as Organic Semiconductors for Solution-Processible Field-Effect Transistors","Chemistry of Materials","2007","19","22","5230","","10.1021/cm070956+","","","0.71069","MoKα","","0.0605","0.0444","","","0.1081","0.1168","","","","","","1.085","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002003","9.929","0.004","10.846","0.005","12.603","0.003","90","","92.511","0.001","90","","1355.9","0.9","200","2","200","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","Bis(N-n-octylpyrrolo[3,4-d])TTF","","","- C26 H38 N2 S4 -","- C26 H38 N2 S4 -","- C52 H76 N4 S8 -","2","0.5","","Doi, Iori; Miyazaki, Eigo; Takimiya, Kazuo; Kunugi, Yoshihito","Development ofN-Alkyl-Substituted Bis(pyrrolo[3,4-d])tetrathiafulvalenes as Organic Semiconductors for Solution-Processible Field-Effect Transistors","Chemistry of Materials","2007","19","22","5230","","10.1021/cm070956+","","","0.71069","MoKα","","0.0419","0.0339","","","0.096","0.1016","","","","","","1.021","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002004","4.659","0.004","7.68","0.008","23.82","0.02","80.75","0.03","83.92","0.03","85.96","0.03","835.3","1.3","200.2","","200","2","","","","","","","","4","P -1","-P 1","2","Bis(N-n-dodecylpyrrolo[3,4-d])TTF","","","- C34 H54 N2 S4 -","- C34 H54 N2 S4 -","- C34 H54 N2 S4 -","1","0.5","","Doi, Iori; Miyazaki, Eigo; Takimiya, Kazuo; Kunugi, Yoshihito","Development ofN-Alkyl-Substituted Bis(pyrrolo[3,4-d])tetrathiafulvalenes as Organic Semiconductors for Solution-Processible Field-Effect Transistors","Chemistry of Materials","2007","19","22","5230","","10.1021/cm070956+","","","0.71069","MoKα","","0.136","0.0827","","","0.2211","0.2749","","","","","","0.801","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002005","5.394","0.003","7.502","0.003","26.92","0.002","92.34","0.02","94.06","0.02","103.68","0.02","1053.9","0.7","200","2","200","2","","","","","","","","4","P -1","-P 1","2","Bis(N-n-cetylpyrrolo[3,4-d])TTF","","","- C42 H70 N2 S4 -","- C42 H70 N2 S4 -","- C42 H70 N2 S4 -","1","0.5","","Doi, Iori; Miyazaki, Eigo; Takimiya, Kazuo; Kunugi, Yoshihito","Development ofN-Alkyl-Substituted Bis(pyrrolo[3,4-d])tetrathiafulvalenes as Organic Semiconductors for Solution-Processible Field-Effect Transistors","Chemistry of Materials","2007","19","22","5230","","10.1021/cm070956+","","","0.71069","MoKα","","0.0852","0.0564","","","0.1556","0.1777","","","","","","0.928","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002006","19.879","0.011","17.167","0.008","25.55","0.01","90","","112.315","0.003","90","","8066","7","90.1","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C32 H48 N Ni S8 Se4 -","- C32 H48 N Ni S8 Se4 -","- C256 H384 N8 Ni8 S64 Se32 -","8","2","","Fujiwara, Emiko; Yamamoto, Kimiko; Shimamura, Mina; Zhou, Biao; Kobayashi, Akiko; Takahashi, Kazuyuki; Okano, Yoshinori; Cui, Hengbo; Kobayashi, Hayao","(nBu4N)[Ni(dmstfdt)2]: A Planar Nickel Coordination Complex with an Extended-TTF Ligand Exhibiting Metallic Conduction, Metal‒Insulator Transition, and Weak Ferromagnetism","Chemistry of Materials","2007","19","3","553","","10.1021/cm062131q","","","0.7107","MoKα","","","0.1","","","","0.131","","","","","","1.344","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002007","42.18","0.05","5.898","0.007","19.17","0.03","90","","99.78","0.06","90","","4700","11","93.2","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H14 F6 N2 S2 Se -","- C28 H14 F6 N2 S2 Se -","- C224 H112 F48 N16 S16 Se8 -","8","1","","Kono, Takahiro; Kumaki, Daisuke; Nishida, Jun-ichi; Sakanoue, Tomo; Kakita, Motoyasu; Tada, Hirokazu; Tokito, Shizuo; Yamashita, Yoshiro","High-Performance and Light-Emitting n-Type Organic Field-Effect Transistors Based on Dithienylbenzothiadiazole and Related Heterocycles","Chemistry of Materials","2007","19","6","1218","","10.1021/cm062889+","","","0.7107","MoKα","","","0.0354","","","","0.087","","","","","","0.801","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002008","40.89","0.05","6.142","0.009","19.32","0.02","90","","100.44","0.05","90","","4772","10","93.2","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H16 F6 N2 S2 -","- C30 H16 F6 N2 S2 -","- C240 H128 F48 N16 S16 -","8","1","","Kono, Takahiro; Kumaki, Daisuke; Nishida, Jun-ichi; Sakanoue, Tomo; Kakita, Motoyasu; Tada, Hirokazu; Tokito, Shizuo; Yamashita, Yoshiro","High-Performance and Light-Emitting n-Type Organic Field-Effect Transistors Based on Dithienylbenzothiadiazole and Related Heterocycles","Chemistry of Materials","2007","19","6","1218","","10.1021/cm062889+","","","0.7107","MoKα","","","0.0498","","","","0.1137","","","","","","0.854","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002009","7.308","0.0004","9.315","0.0005","3.498","0.0002","90","","90","","90","","238.12","0.02","298","2","298","2","","","","","","","","4","C m m m","-C 2 2","65","","","","- Al B4 Si Yb -","- Al B4 Yb -","- Al4 B16 Yb4 -","4","0.25","","Macaluso, Robin T.; Nakatsuji, Satoru; Kuga, Kentaro; Thomas, Evan Lyle; Machida, Yo; Maeno, Yoshiteru; Fisk, Zachary; Chan, Julia Y.","Crystal Structure and Physical Properties of Polymorphs of LnAlB4(Ln = Yb, Lu)","Chemistry of Materials","2007","19","8","1918","","10.1021/cm062244+","","","0.71073","MoKα","","0.0568","0.0568","","","0.1227","0.1227","","","","","","1.151","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002010","7.289","0.0003","9.286","0.0005","3.504","0.0002","90","","90","","90","","237.17","0.02","298","2","298","2","","","","","","","","3","C m m m","-C 2 2","65","","","","- Al1.33 B5.33 Lu1.33 -","- Al1.33333 B5.33333 Lu1.33333 -","- Al4 B16 Lu4 -","3","0.1875","","Macaluso, Robin T.; Nakatsuji, Satoru; Kuga, Kentaro; Thomas, Evan Lyle; Machida, Yo; Maeno, Yoshiteru; Fisk, Zachary; Chan, Julia Y.","Crystal Structure and Physical Properties of Polymorphs of LnAlB4(Ln = Yb, Lu)","Chemistry of Materials","2007","19","8","1918","","10.1021/cm062244+","","","0.71073","MoKα","","0.041","0.041","","","0.0986","0.0986","","","","","","1.185","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002011","5.905","0.0001","11.444","0.0002","3.51","0.0004","90","","90","","90","","237.19","0.03","299","2","299","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al1.33 B5.33 Lu1.33 -","- Al1.33333 B5.33333 Lu1.33333 -","- Al4 B16 Lu4 -","3","0.375","","Macaluso, Robin T.; Nakatsuji, Satoru; Kuga, Kentaro; Thomas, Evan Lyle; Machida, Yo; Maeno, Yoshiteru; Fisk, Zachary; Chan, Julia Y.","Crystal Structure and Physical Properties of Polymorphs of LnAlB4(Ln = Yb, Lu)","Chemistry of Materials","2007","19","8","1918","","10.1021/cm062244+","","","0.71073","MoKα","","0.0257","0.0249","","","0.0624","0.063","","","","","","1.234","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002012","5.922","0.0002","11.473","0.0003","3.506","0.0005","90","","90","","90","","238.21","0.04","298","2","298","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Al B4 Yb -","- Al B4 Yb -","- Al4 B16 Yb4 -","4","0.5","","Macaluso, Robin T.; Nakatsuji, Satoru; Kuga, Kentaro; Thomas, Evan Lyle; Machida, Yo; Maeno, Yoshiteru; Fisk, Zachary; Chan, Julia Y.","Crystal Structure and Physical Properties of Polymorphs of LnAlB4(Ln = Yb, Lu)","Chemistry of Materials","2007","19","8","1918","","10.1021/cm062244+","","","0.71073","MoKα","","0.0573","0.053","","","0.1368","0.1423","","","","","","0.996","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002174","19.541","0.009","8.661","0.003","26.66","0.011","90.715","0.007","110.509","0.009","92.601","0.007","4220","3","293.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H48 N Ni S8 Se4 -","- C32 H48 N Ni S8 Se4 -","- C128 H192 N4 Ni4 S32 Se16 -","4","2","","Fujiwara, Emiko; Yamamoto, Kimiko; Shimamura, Mina; Zhou, Biao; Kobayashi, Akiko; Takahashi, Kazuyuki; Okano, Yoshinori; Cui, Hengbo; Kobayashi, Hayao","(nBu4N)[Ni(dmstfdt)2]: A Planar Nickel Coordination Complex with an Extended-TTF Ligand Exhibiting Metallic Conduction, Metal‒Insulator Transition, and Weak Ferromagnetism","Chemistry of Materials","2007","19","3","553","","10.1021/cm062131q","","","0.7107","MoKα","","","0.061","","","","0.07","","","","","","1.131","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4002363","5.6791","","5.6791","","35.345","","90","","90","","120","","987.228","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- Ba Mn O2.99 -","- Ba Mn O2.985 -","- Ba15 Mn15 O44.775 -","15","0.416667","","Adkin, J.J.; Hayward, M.A.","Ba Mn O(3-x) revisited: a structural and magnetic study","Chemistry of Materials (1,1989-)","2007","19","","755","762","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4002364","5.6736","","5.6736","","18.755","","90","","90","","120","","522.836","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ba Mn O2.95 -","- Ba Mn O2.94975 -","- Ba8 Mn8 O23.598 -","8","0.333333","","Adkin, J.J.; Hayward, M.A.","Ba Mn O(3-x) revisited: a structural and magnetic study","Chemistry of Materials (1,1989-)","2007","19","","755","762","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4002365","5.6547","","5.6547","","23.1936","","90","","90","","120","","642.27","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ba Mn O2.91 -","- Ba Mn O2.9154 -","- Ba10 Mn10 O29.154 -","10","0.416667","","Adkin, J.J.; Hayward, M.A.","Ba Mn O(3-x) revisited: a structural and magnetic study","Chemistry of Materials (1,1989-)","2007","19","","755","762","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4002366","5.6397","","5.6397","","20.8973","","90","","90","","120","","575.616","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Ba0.875 Sr0.125 Mn O3.00","","- Ba0.875 Mn O3 Sr0.125 -","- Ba0.874 Mn O3 Sr0.126 -","- Ba7.866 Mn9 O27 Sr1.134 -","9","0.25","","Adkin, J.J.; Hayward, M.A.","Ba Mn O(3-x) revisited: a structural and magnetic study","Chemistry of Materials (1,1989-)","2007","19","","755","762","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002367","5.6445","","5.6445","","13.9565","","90","","90","","120","","385.086","","","","","","","","","","","","","3","P -6 m 2","P -6 2","187","","","","- Ba Mn O2.92 -","- Ba Mn O2.9215 -","- Ba6 Mn6 O17.529 -","6","0.5","","Adkin, J.J.; Hayward, M.A.","Ba Mn O(3-x) revisited: a structural and magnetic study","Chemistry of Materials (1,1989-)","2007","19","","755","762","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4002381","10.4782","","13.3831","","7.294","","90","","90","","90","","1022.84","","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Rb2 Zr (Si3 O9) (H2 O)","","- H2 O10 Rb2 Si3 Zr -","- O10 Rb2 Si3 Zr -","- O40 Rb8 Si12 Zr4 -","4","1","","Fewox, C.S.; Kirumakki, S.R.; Clearfield, A.","Structural and mechanistic investigation of rubidium ion exchange in potassium zirconium trisilicate","Chemistry of Materials (1,1989-)","2007","19","","384","392","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002383","5.085","","8.774","","9.468","","90","","90","","90","","422.422","","","","","","","","","","","","","2","P n a 21","P 2c -2n","33","","","","- Fe2 O3 -","- Fe2 O3 -","- Fe16 O24 -","8","2","","Gich, M.; Frontera, C.; Ritter, C.; Roig, A.; Nogues, J.; Taboada, E.; Molins, E.; Macedo, W.A.A.; Ardisson, J.D.; Hardy, V.; Rechenberg, H.R.; Sort, J.; Skumryev, V.","High- and low-temperature crystal and magnetic structure of epsilon-Fe2 O3 and their correlation to its magnetic properties","Chemistry of Materials (1,1989-)","2007","18","","3889","3897","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4002384","11.002","","7.588","","5.425","","90","","90","","90","","452.896","","","","","","","","","","","","","4","P n m 21","P 2bc -2bc","31","","","","- Bi0.53 Ca0.47 Mn O3 -","- Bi0.53 Ca0.47 Mn O3 -","- Bi4.24 Ca3.76 Mn8 O24 -","8","2","","Giot, M.; Hervieu, M.; Perez, O.; Malo, S.; Beran, P.; Roussel, P.; Raveau, B.; Nevriva, M.; Knizek, K.","Bi(1-x) Ca(x) Mn O3 (x = 0.4 and 0.45): X-ray single-crystal and electron microscopy study","Chemistry of Materials (1,1989-)","2007","18","","3225","3236","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4002385","5.484","","7.669","","5.403","","90","","90","","90","","227.233","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Bi0.58 Ca0.42 Mn O3 -","- Bi0.58 Ca0.42 Mn O3 -","- Bi2.32 Ca1.68 Mn4 O12 -","4","0.5","","Giot, M.; Beran, P.; Perez, O.; Malo, S.; Nevriva, M.; Knizek, K.; Raveau, B.; Hervieu, M.; Roussel, P.","Bi(1-x) Ca(x) Mn O3 (x = 0.4 and 0.45): X-ray single-crystal and electron microscopy study","Chemistry of Materials (1,1989-)","2007","18","","3225","3236","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4002395","7.8711","","31.9057","","7.8762","","90","","90.08","","90","","1977.97","","","","","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","La5.84 Mg4 Ta2 W2 O24","","- La5.84 Mg4 O24 Ta2 W2 -","- La5.84 Mg4 O24 Ta2 W2 -","- La23.36 Mg16 O96 Ta8 W8 -","4","0.5","","Khalyavin, D.D.; Lopes, A.B.; Mantas, P.Q.; Senos, A.M.R.","Crystal structure of La6 Mg4 Ta2 W2 O24 oxide: A representative of a novel A(3n) B'(2n) B''(2n) O(12n) homologous series with n = 2","Chemistry of Materials (1,1989-)","2007","18","","3843","3849","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002401","6.2219","","6.2134","","8.7667","","90","","90","","90","","338.913","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(Ba0.97 La0.03) (Ce0.87 Y0.13) O2.91","","- Ba0.97 Ce0.87 La0.03 O2.91 Y0.13 -","- Ba0.97 Ce0.87 La0.03 O2.91 Y0.13 -","- Ba3.88 Ce3.48 La0.12 O11.64 Y0.52 -","4","0.5","","Kruth, A.; Davies, R.A.; Islam, M.S.; Irvine, J.T.S.","Combined neutron diffraction and atomistic modeling studies of structure, defects, and water incorporation in doped barium cerate perovskites","Chemistry of Materials (1,1989-)","2007","19","","1239","1248","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002402","6.1953","","6.199","","8.7567","","90","","90","","90","","336.298","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(Ba0.90 La0.10) (Ce0.80 Y0.20) O2.83","","- Ba0.9 Ce0.8 La0.1 O2.83 Y0.2 -","- Ba0.9 Ce0.8 La0.1 O2.83 Y0.2 -","- Ba3.6 Ce3.2 La0.4 O11.32 Y0.8 -","4","0.5","","Kruth, A.; Davies, R.A.; Islam, M.S.; Irvine, J.T.S.","Combined neutron diffraction and atomistic modeling studies of structure, defects, and water incorporation in doped barium cerate perovskites","Chemistry of Materials (1,1989-)","2007","19","","1239","1248","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4002415","5.69348","","5.69348","","28.5751","","90","","90","","120","","802.184","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ba (Mn0.42 Co0.58) O2.83","","- Ba Co0.58 Mn0.42 O2.83 -","- Ba Co0.578 Mn0.422 O2.83333 -","- Ba12 Co6.936 Mn5.064 O34 -","12","0.5","","Miranda, L.; Ramirez-Castellanos, J.; Varela, A.; Gonzalez-Calbet, J.; Parras, M.; Hernando, M.; Fernandez-Diaz, M.T.; Hernandez, M.G.","Structural chemistry and magnetic properties of the Ba Mn0.4 Co0.6 O2.83 hexagonal perovskite","Chemistry of Materials (1,1989-)","2007","19","","1503","1508","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002418","3.4009","","2.7895","","7.0762","","90","","90","","90","","67.131","","","","","","","","","","","","","2","P 1","P 1","1","","","","- Al2 O3 -","- Al2 O3 -","- Al4 O6 -","2","2","","Paglia, G.; Bozin, E.S.; Billinge, S.J.L.","Fine-scale nanostructure in gamma - Al2 O3","Chemistry of Materials (1,1989-)","2007","18","","3242","3248","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4002422","5.5212","","7.808","","5.5464","","90","","90","","90","","239.103","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","La0.8 Sr0.2 Fe0.8 Cr0.2 O3","","- Cr0.2 Fe0.8 La0.8 O3 Sr0.2 -","- Cr0.2 Fe0.8 La0.8 O3 Sr0.2 -","- Cr0.8 Fe3.2 La3.2 O12 Sr0.8 -","4","0.5","","Ramos, T.; Carvalho, M.D.; Cruz, M.M.; Ferreira, L.P.; Godinho, M.","Structural and magnetic characterization of the series La(1-x) Sr(x) Fe0.8 Cr0.2 O(3-delta) (x = 0.2, 0.4, 0.6, and 0.8)","Chemistry of Materials (1,1989-)","2007","18","","3860","3865","","","","","","","","","","","","","","","","","","","","","","has coordinates","151514","2020-10-21","18:00:00",""
"4002423","5.52","","5.52","","13.416","","90","","90","","120","","354.023","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","La0.6 Sr0.4 Fe0.8 Cr0.2 O3","","- Cr0.2 Fe0.8 La0.6 O3 Sr0.4 -","- Cr0.2 Fe0.8 La0.6 O3 Sr0.4 -","- Cr1.2 Fe4.8 La3.6 O18 Sr2.4 -","6","0.166667","","Ramos, T.; Carvalho, M.D.; Ferreira, L.P.; Godinho, M.; Cruz, M.M.","Structural and magnetic characterization of the series La(1-x) Sr(x) Fe0.8 Cr0.2 O(3-delta) (x = 0.2, 0.4, 0.6, and 0.8)","Chemistry of Materials (1,1989-)","2007","18","","3860","3865","","","","","","","","","","","","","","","","","","","","","","has coordinates","151515","2020-10-21","18:00:00",""
"4002424","5.4973","","5.4973","","13.4088","","90","","90","","120","","350.929","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","La0.4 Sr0.6 Fe0.8 Cr0.2 O3","","- Cr0.2 Fe0.8 La0.4 O3 Sr0.6 -","- Cr0.2 Fe0.8 La0.4 O3 Sr0.6 -","- Cr1.2 Fe4.8 La2.4 O18 Sr3.6 -","6","0.166667","","Ramos, T.; Ferreira, L.P.; Carvalho, M.D.; Cruz, M.M.; Godinho, M.","Structural and magnetic characterization of the series La(1-x) Sr(x) Fe0.8 Cr0.2 O(3-delta) (x = 0.2, 0.4, 0.6, and 0.8)","Chemistry of Materials (1,1989-)","2007","18","","3860","3865","","","","","","","","","","","","","","","","","","","","","","has coordinates","151516","2020-10-21","18:00:00",""
"4002425","5.5057","","5.5057","","13.4796","","90","","90","","120","","353.861","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","La0.2 Sr0.8 Fe0.8 Cr0.2 O3","","- Cr0.2 Fe0.8 La0.2 O3 Sr0.8 -","- Cr0.2 Fe0.8 La0.2 O3 Sr0.8 -","- Cr1.2 Fe4.8 La1.2 O18 Sr4.8 -","6","0.166667","","Ramos, T.; Carvalho, M.D.; Ferreira, L.P.; Cruz, M.M.; Godinho, M.","Structural and magnetic characterization of the series La(1-x) Sr(x) Fe0.8 Cr0.2 O(3-delta) (x = 0.2, 0.4, 0.6, and 0.8)","Chemistry of Materials (1,1989-)","2007","18","","3860","3865","","","","","","","","","","","","","","","","","","","","","","has coordinates","151517","2020-10-21","18:00:00",""
"4002430","12.741","","10.2211","","6.2239","","90","","90","","90","","810.52","","","","","","","","","","","","","5","P n n a","-P 2a 2bc","52","","K Al P O4 (O H)","","- Al H K O5 P -","- Al K O5 P -","- Al8 K8 O40 P8 -","8","1","","Vaughan, D.E.W.; Yennawar, H.P.; Perrotta, J.","Synthesis and structure of an aluminophosphate built from 3-rings","Chemistry of Materials (1,1989-)","2007","18","","3611","3615","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4022583","9.2673","0.001","11.443","0.001","14.65","0.002","85.49","0.05","89.08","0.05","76.81","0.05","1507.9","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H39 B N2 -","- C36 H39 B N2 -","- C72 H78 B2 N4 -","2","1","","Christine Goze; Gilles Ulrich; Raymond Ziessel","Tetrahedral Boron Chemistry for the Preparation of Highly Efficient ""Cascatelle"" Devices","Journal of Organic Chemistry","2007","72","","313","322","10.1021/jo060984w","","","0.71073","MoKα","","0.0951","0.0606","","","0.1666","0.1912","","","","","","1.048","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022584","31.0049","0.0005","9.3906","0.0001","28.4999","0.0005","90","","108.753","0.005","90","","7857.4","0.2","173","","173","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C54 H43 B N2 -","- C54 H43 B N2 -","- C432 H344 B8 N16 -","8","1","","Christine Goze; Gilles Ulrich; Raymond Ziessel","Tetrahedral Boron Chemistry for the Preparation of Highly Efficient ""Cascatelle"" Devices","Journal of Organic Chemistry","2007","72","","313","322","10.1021/jo060984w","","","0.71073","Mo-Kα","","0.162","0.095","","0.214","","0.099","","","1.47","","","1.029","","","","has coordinates","178404","2020-10-21","18:00:00",""
"4022585","9.771","0.004","16.391","0.006","24.532","0.009","90","","90","","90","","3929","3","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H47 Cl N8 O12 -","- C33 H47 Cl N8 O12 -","- C132 H188 Cl4 N32 O48 -","4","1","","Eric D. Miller; Christopher A. Kauffman; Paul R. Jensen; William Fenical","Piperazimycins: Cytotoxic Hexadepsipeptides from a Marine-Derived Bacterium of the Genus Streptomyces","Journal of Organic Chemistry","2007","72","","323","330","10.1021/jo061064g","","","0.71073","MoKα","","0.1914","0.1539","","","0.3918","0.4114","","","","","","1.413","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022586","8.9139","0.0008","11.0167","0.0008","14.87","0.001","74.492","0.003","89.882","0.002","89.904","0.002","1407.1","0.2","113.2","","","","","","","","","","","3","P 1","P 1","1","","","","- C35 H32 O5 -","- C35 H32 O5 -","- C70 H64 O10 -","2","2","","Toshiaki Shimasaki; Shin-ichiro Kato; Keiko Ideta; Kenta Goto; Teruo Shinmyozu","Synthesis and Structural and Photoswitchable Properties of Novel Chiral Host Molecules: Axis Chiral 2,2'-Dihydroxy-1,1'-binaphthyl-Appended stiff-Stilbene","Journal of Organic Chemistry","2007","72","","1073","1087","10.1021/jo061127v","","","0.7107","MoKα","","","0.044","","","","0.1176","","","","","","1.248","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022587","14.2464","0.0011","10.128","0.0007","19.6361","0.0016","90","","100.435","0.0019","90","","2786.4","0.4","113.2","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C70 H88 O8 -","- C70 H68 O8 -","- C140 H136 O16 -","2","1","","Toshiaki Shimasaki; Shin-ichiro Kato; Keiko Ideta; Kenta Goto; Teruo Shinmyozu","Synthesis and Structural and Photoswitchable Properties of Novel Chiral Host Molecules: Axis Chiral 2,2'-Dihydroxy-1,1'-binaphthyl-Appended stiff-Stilbene","Journal of Organic Chemistry","2007","72","","1073","1087","10.1021/jo061127v","","","0.7107","MoKα","","","0.0722","","","","0.2043","","","","","","0.974","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4022588","11.073","0.003","6.2528","0.0019","13.753","0.005","90","","96.555","0.014","90","","946","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H22 N O4 -","- C21 H22 N O4 -","- C42 H44 N2 O8 -","2","1","","Jian-Liang Ye; Pei-Qiang Huang; Xin Lu","Mechanism for the Regioselective Asymmetric Addition of Grignard Reagents to Malimides: A Computational Exploration","Journal of Organic Chemistry","2007","72","","35","42","10.1021/jo0613683","","","0.71073","MoKα","","0.0809","0.0522","","","0.1195","0.1329","","","","","","1.004","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022589","4.7318","0.0005","11.6928","0.0013","20.242","0.002","90","","90.192","0.002","90","","1120","0.2","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","p-Cresyl 2-O-benzyl-3,5-di-O-benzylidene-1-thio-/a/-D-arabinofuranoside","","- C26 H26 O4 S -","- C26 H26 O4 S -","- C52 H52 O8 S2 -","2","1","","David Crich; Christian Marcus Pedersen; Albert A. Bowers; Donald J. Wink","On the Use of 3,5-O-Benzylidene and 3,5-O-(Di-tert-butylsilylene)-2-O-benzylarabinothiofuranosides and Their Sulfoxides as Glycosyl Donors for the Synthesis of β-Arabinofuranosides: Importance of the Activation Method","Journal of Organic Chemistry","2007","72","","1553","1565","10.1021/jo061440x","","","0.71073","MoKα","","0.0769","0.0462","","","0.0752","0.0823","","","","","","0.856","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022590","6.5659","0.0019","8.378","0.002","37.112","0.003","90","","90","","90","","2041.5","0.8","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H32 O3 Si -","- C17 H32 O3 Si -","- C68 H128 O12 Si4 -","4","1","","Yang Li; Jian-Peng Feng; Wen-Hua Wang; Jie Chen; Xiao-Ping Cao","Total Synthesis and Correct Absolute Configuration of Malyngamide U","Journal of Organic Chemistry","2007","72","","2344","2350","10.1021/jo061456n","","","0.71073","MoKα","","0.1292","0.0588","","","0.1574","0.1994","","","","","","1.011","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022591","8.178","0.008","10.255","0.009","15.209","0.01","84.98","0.05","83.95","0.05","87.84","0.05","1263","1.9","293","2","293","2","","","","","","","","5","P 1","P 1","1","THYMIDIN02","3'-N-sulfamate analogue of Thymidylyl(3'-5')thymidine (Compound 1)","","- C20 H27 N5 O11 S -","- C20 H27 N5 O11 S -","- C40 H54 N10 O22 S2 -","2","2","","Céline Moriou; Martial Thomas; Marie-Thérèse Adeline; Marie-Thérèse Martin; Angèle Chiaroni; Sylvie Pochet; Jean-Louis Fourrey; Alain Favre; Pascale Clivio","Crystal Structure and Photochemical Behavior in Solution of the 3'-N-Sulfamate Analogue of Thymidylyl(3'-5')thymidine","Journal of Organic Chemistry","2007","72","","43","50","10.1021/jo061488a","","","0.71073","MoKα","","0.0809","0.057","","","0.0977","0.1057","","","","","","1.085","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022592","18.7206","0.0003","10.7971","0.0002","14.0675","0.0002","90","","131.441","0.001","90","","2131.55","0.07","100","2","100","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","Compound 13","4,4'-di-tert-butyl-o-terphenyl","","- C26 H30 -","- C26 H30 -","- C104 H120 -","4","0.5","","Benjamin T. King; Jiří Kroulík; Charles R. Robertson; Pawel Rempala; Cameron L. Hilton; Justin D. Korinek; Lisa M. Gortari","Controlling the Scholl Reaction","Journal of Organic Chemistry","2007","72","","2279","2288","10.1021/jo061515x","","","0.71073","MoKα","","0.0529","0.0466","","","0.1277","0.1334","","","","","","1.047","","","","has coordinates","178404","2020-10-21","18:00:00",""
"4022593","12.6177","0.0003","10.3795","0.0003","30.5808","0.0008","90","","90","","90","","4005.03","0.18","100","2","100","2","","","","","","","","2","P b c a","-P 2ac 2ab","61","Compound 14","2,11-di-tert-butyltriphenylene","","- C26 H28 -","- C26 H28 -","- C208 H224 -","8","1","","Benjamin T. King; Jiří Kroulík; Charles R. Robertson; Pawel Rempala; Cameron L. Hilton; Justin D. Korinek; Lisa M. Gortari","Controlling the Scholl Reaction","Journal of Organic Chemistry","2007","72","","2279","2288","10.1021/jo061515x","","","0.71073","MoKα","","0.0722","0.0546","","","0.1357","0.1423","","","","","","1.032","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022594","46.614","0.004","19.4909","0.0017","8.7318","0.0008","90","","95.801","0.002","90","","7892.6","1.2","100","2","100","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","Compound 15","2,11-di-tert-butyltriphenylene-6,6'dimer","","- C52 H54 -","- C52 H54 -","- C416 H432 -","8","1","","Benjamin T. King; Jiří Kroulík; Charles R. Robertson; Pawel Rempala; Cameron L. Hilton; Justin D. Korinek; Lisa M. Gortari","Controlling the Scholl Reaction","Journal of Organic Chemistry","2007","72","","2279","2288","10.1021/jo061515x","","","0.71073","MoKα","","0.1116","0.1006","","","0.2843","0.2875","","","","","","1.077","","","","has coordinates,has disorder","178404","2020-10-21","18:00:00",""
"4022595","8.6605","0.0007","10.4742","0.0009","31.79","0.003","90","","90","","90","","2883.7","0.4","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","Compound 17","2,7-dimethoxytriphenylene","","- C20 H16 O2 -","- C20 H16 O2 -","- C160 H128 O16 -","8","1","","Benjamin T. King; Jiří Kroulík; Charles R. Robertson; Pawel Rempala; Cameron L. Hilton; Justin D. Korinek; Lisa M. Gortari","Controlling the Scholl Reaction","Journal of Organic Chemistry","2007","72","","2279","2288","10.1021/jo061515x","","","0.71073","MoKα","","0.0482","0.0406","","","0.1132","0.1174","","","","","","1.062","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022596","17.6107","0.0011","8.7374","0.0006","13.5527","0.0009","90","","120.615","0.001","90","","1794.7","0.2","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Compound 18","3,3'',5,5'' tetramethoxyorthoterphenyl","","- C22 H22 O4 -","- C22 H22 O4 -","- C88 H88 O16 -","4","0.5","","Benjamin T. King; Jiří Kroulík; Charles R. Robertson; Pawel Rempala; Cameron L. Hilton; Justin D. Korinek; Lisa M. Gortari","Controlling the Scholl Reaction","Journal of Organic Chemistry","2007","72","","2279","2288","10.1021/jo061515x","","","0.71073","MoKα","","0.0441","0.0424","","","0.1217","0.1238","","","","","","1.011","","","","has coordinates","178404","2020-10-21","18:00:00",""
"4022597","13.1978","0.0004","8.2816","0.0002","15.7125","0.0005","90","","96.601","0.001","90","","1705.97","0.09","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Compound 19","2,4,5,7-tetramethoxytriphenylene","","- C22 H20 O4 -","- C22 H20 O4 -","- C88 H80 O16 -","4","1","","Benjamin T. King; Jiří Kroulík; Charles R. Robertson; Pawel Rempala; Cameron L. Hilton; Justin D. Korinek; Lisa M. Gortari","Controlling the Scholl Reaction","Journal of Organic Chemistry","2007","72","","2279","2288","10.1021/jo061515x","","","0.71073","MoKα","","0.047","0.0431","","","0.1229","0.1272","","","","","","1.015","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022598","9.5585","0.0007","12.5269","0.001","13.6945","0.0011","100.386","0.002","101.97","0.001","108.123","0.001","1470.7","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","Compound 21","1-(4-methoxyterphenyl)-2-methoxy triphenylene","","- C39 H30 Cl2 O2 -","- C39 H30 Cl2 O2 -","- C78 H60 Cl4 O4 -","2","1","","Benjamin T. King; Jiří Kroulík; Charles R. Robertson; Pawel Rempala; Cameron L. Hilton; Justin D. Korinek; Lisa M. Gortari","Controlling the Scholl Reaction","Journal of Organic Chemistry","2007","72","","2279","2288","10.1021/jo061515x","","","0.71073","MoKα","","0.072","0.0494","","","0.1311","0.1396","","","","","","1.048","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022599","9.9015","0.0002","11.0754","0.0002","14.8755","0.0003","110.807","0.001","98.424","0.001","95.284","0.001","1490.01","0.05","100","2","100","2","","","","","","","","3","P -1","-P 1","2","Compound 23","2,2'',4'3,2'5-tetramethoxy-1,1',2'1'',5'',1'3,3'3,1'4,2'4,1'5-sexiphenyl","","- C40 H34 O4 -","- C40 H34 O4 -","- C80 H68 O8 -","2","1","","Benjamin T. King; Jiří Kroulík; Charles R. Robertson; Pawel Rempala; Cameron L. Hilton; Justin D. Korinek; Lisa M. Gortari","Controlling the Scholl Reaction","Journal of Organic Chemistry","2007","72","","2279","2288","10.1021/jo061515x","","","0.71073","MoKα","","0.079","0.0474","","","0.108","0.1178","","","","","","0.996","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022600","13.1711","0.0013","9.779","0.001","11.8797","0.0012","90","","100.312","0.002","90","","1505.4","0.3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Compound 28","2,2""-dinitro-[1,1';2',1""]-terphenyl","","- C18 H12 N2 O4 -","- C18 H12 N2 O4 -","- C72 H48 N8 O16 -","4","0.5","","Benjamin T. King; Jiří Kroulík; Charles R. Robertson; Pawel Rempala; Cameron L. Hilton; Justin D. Korinek; Lisa M. Gortari","Controlling the Scholl Reaction","Journal of Organic Chemistry","2007","72","","2279","2288","10.1021/jo061515x","","","0.71073","MoKα","","0.0563","0.0457","","","0.1225","0.1319","","","","","","1.039","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022601","16.6974","0.0009","9.9231","0.0006","10.2577","0.0006","90","","117.882","0.001","90","","1502.3","0.15","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Compound 29","3,3""-dinitro-[1,1';2',1""]-terphenyl","","- C18 H12 N2 O4 -","- C18 H12 N2 O4 -","- C72 H48 N8 O16 -","4","0.5","","Benjamin T. King; Jiří Kroulík; Charles R. Robertson; Pawel Rempala; Cameron L. Hilton; Justin D. Korinek; Lisa M. Gortari","Controlling the Scholl Reaction","Journal of Organic Chemistry","2007","72","","2279","2288","10.1021/jo061515x","","","0.71073","MoKα","","0.0526","0.0476","","","0.1347","0.1383","","","","","","1.064","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022602","6.362","0.003","16.675","0.007","10.895","0.005","90","","94.64","0.04","90","","1152","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H15 N O2 -","- C14 H15 N O2 -","- C56 H60 N4 O8 -","4","1","","Guillaume Bélanger; Myriam April; Étienne Dauphin; Stéphanie Roy","Effect of Substitution on the Intramolecular 1,3-Dipolar Cycloaddition of Alkene Tethered Münchnones","Journal of Organic Chemistry","2007","72","","1104","1111","10.1021/jo061556t","","","0.71073","MoKα","","0.0621","0.0391","","","0.0925","0.1007","","","","","","1.04","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022603","20.05","0.001","20.05","0.001","7.09","0.002","90","","90","","90","","2850.1","0.8","198","2","198","2","","","","","","","synthesis as described","4","P 42/n :2","-P 4bc","86","","","","- C16 H23 N O -","- C16 H23 N O -","- C128 H184 N8 O8 -","8","1","","Guillaume Bélanger; Myriam April; Étienne Dauphin; Stéphanie Roy","Effect of Substitution on the Intramolecular 1,3-Dipolar Cycloaddition of Alkene Tethered Münchnones","Journal of Organic Chemistry","2007","72","","1104","1111","10.1021/jo061556t","","x-ray","1.54176","cukα","","0.1763","0.0907","","","0.2324","0.2793","","","","","","0.969","","","","has coordinates,has disorder","189836","2020-10-21","18:00:00",""
"4022604","13.2339","0.0004","13.8249","0.0007","12.6481","0.0006","90","","116.948","0.005","90","","2062.8","0.2","174","","174","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H24 B I N2 O2 -","- C21 H24 B I N2 O2 -","- C84 H96 B4 I4 N8 O8 -","4","1","","Chouaib Tahtaoui; Cécile Thomas; François Rohmer; Philippe Klotz; Guy Duportail; Yves Mély; Dominique Bonnet; Marcel Hibert","Convenient Method To Access New 4,4-Dialkoxy- and 4,4-Diaryloxy-diaza-s-indacene Dyes: Synthesis and Spectroscopic Evaluation","Journal of Organic Chemistry","2007","72","","269","272","10.1021/jo061567m","","","0.71073","Mo-Kα","","0.052","0.028","","0.078","","0.033","","","2.474","","","1.054","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022605","8.339","0.006","9.815","0.007","11.245","0.008","74.619","0.009","87.713","0.01","80.552","0.01","875.3","1.1","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H16 N2 O3 S -","- C20 H16 N2 O3 S -","- C40 H32 N4 O6 S2 -","2","1","","Yunkou Wu; Xiaojun Peng; Jiangli Fan; Shang Gao; Maozhong Tian; Jianzhang Zhao; Shiguo Sun","Fluorescence Sensing of Anions Based on Inhibition of Excited-State Intramolecular Proton Transfer","Journal of Organic Chemistry","2007","72","","62","70","10.1021/jo061634c","","","0.71073","MoKα","","0.0392","0.0358","","","0.0996","0.1024","","","","","","1.087","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022606","3.999","0.0004","11.1539","0.0011","12.225","0.001","71.924","0.005","89.51","0.008","81.01","0.005","511.55","0.08","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H11 N O2 -","- C12 H11 N O2 -","- C24 H22 N2 O4 -","2","1","","Lasri, Jamal; Charmier, M. Adília Januário; Haukka, Matti; Pombeiro, Armando J. L.","Stereospecific Synthesis of Polysubstituted E-Olefins by Reaction of Acyclic Nitrones with Free and Platinum(II) Coordinated Organonitriles","Journal of Organic Chemistry","2007","72","3","750","755","10.1021/jo061659b","","","0.71073","MoKα","","0.0638","0.0491","","","0.12","0.1322","","","","","","1.039","","","","has coordinates","275745","2022-06-02","09:28:25",""
"4022607","9.3767","0.0006","20.656","0.003","6.6342","0.0005","90","","92.122","0.005","90","","1284.1","0.2","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H26 Cl4 N4 O2 Pt -","- C22 H26 Cl4 N4 O2 Pt -","- C44 H52 Cl8 N8 O4 Pt2 -","2","0.5","","Lasri, Jamal; Charmier, M. Adília Januário; Haukka, Matti; Pombeiro, Armando J. L.","Stereospecific Synthesis of Polysubstituted E-Olefins by Reaction of Acyclic Nitrones with Free and Platinum(II) Coordinated Organonitriles","Journal of Organic Chemistry","2007","72","3","750","755","10.1021/jo061659b","","","","","","0.051","","","","","","","","","","","","","","","has coordinates","275746","2022-06-02","10:18:49",""
"4022608","10.4913","0.0005","7.4193","0.0003","21.3289","0.001","90","","95.36","0.002","90","","1652.94","0.13","150","2","150","2","","","","","","","Synthesized by the authors. See text","4","C 1 2 1","C 2y","5","","","","- C14 H22 N2 O6 -","- C14 H22 N2 O6 -","- C56 H88 N8 O24 -","4","1","","Mallem H. V. Ramana Rao; Eulàlia Pinyol; William D. Lubell","Rigid Dipeptide Mimics: Synthesis of Enantiopure C6-Functionalized Pyrrolizidinone Amino Acids","Journal of Organic Chemistry","2007","72","","736","743","10.1021/jo0616761","","","1.54178","CuKα","","0.0596","0.0411","","","0.1056","0.123","","","","","","1.022","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022609","9.474","0.004","11.504","0.005","16.118","0.007","90","","90","","90","","1756.8","1.3","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(R,R,S)-5h","(3R,6R,9S)-1-Aza-3-tert-butoxycarbonylamino-9-methoxycarbonyl- 5-oxa-2-oxobicyclo[4.3.0]nonane.","","- C14 H22 N2 O6 -","- C14 H22 N2 O6 -","- C56 H88 N8 O24 -","4","1","","Wen-Hua Chiou; Nobihiro Mizutani; Iwao Ojima","Highly Efficient Synthesis of Azabicyclo[x.y.0]alkane Amino Acids and Congeners by Means of Rh-Catalyzed Cyclohydrocarbonylation","Journal of Organic Chemistry","2007","72","","1871","1882","10.1021/jo061692y","","","0.71073","MoKα","","0.3102","0.0786","","","0.1768","0.2326","","","","","","0.678","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022610","8.856","0.0018","10.534","0.002","17.443","0.004","90","","90","","90","","1627.2","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(S,S,R)-5h","(3S,6S,9R)-1-Aza-3-tert-butoxycarbonylamino-9-methoxycarbonyl- 5-oxa-2-oxobicyclo[4.3.0]nonane","","- C14 H22 N2 O6 -","- C14 H22 N2 O6 -","- C56 H88 N8 O24 -","4","1","","Wen-Hua Chiou; Nobihiro Mizutani; Iwao Ojima","Highly Efficient Synthesis of Azabicyclo[x.y.0]alkane Amino Acids and Congeners by Means of Rh-Catalyzed Cyclohydrocarbonylation","Journal of Organic Chemistry","2007","72","","1871","1882","10.1021/jo061692y","","","0.71073","MoKα","","0.2408","0.0522","","","0.0997","0.1337","","","","","","0.676","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022611","10.05","0.008","6.229","0.005","12.106","0.009","90","","101.78","0.013","90","","741.9","1","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","(S,S,S)-5j","(3S,6S,9S)-1-Aza-3-tert-butoxycarbonylamino-9-methyl- 5-oxa-2-oxobicyclo[4.3.0]nonane","","- C13 H21 N2 O4 -","- C13 H22 N2 O4 -","- C26 H44 N4 O8 -","2","1","","Wen-Hua Chiou; Nobihiro Mizutani; Iwao Ojima","Highly Efficient Synthesis of Azabicyclo[x.y.0]alkane Amino Acids and Congeners by Means of Rh-Catalyzed Cyclohydrocarbonylation","Journal of Organic Chemistry","2007","72","","1871","1882","10.1021/jo061692y","","","0.71073","MoKα","","0.189","0.1406","","","0.3364","0.372","","","","","","1.171","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022612","12.907","0.003","17.163","0.003","13.244","0.003","90","","106.09","0.03","90","","2818.9","1","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C73 H78 Cl2 -","- C73 H78 Cl2 -","- C146 H156 Cl4 -","2","0.5","","Mihaiela Stuparu; Volker Gramlich; Amnon Stanger; A. Dieter Schlüter","Double-Stranded Cycles: Toward C~84~'s Belt Region","Journal of Organic Chemistry","2007","72","","424","430","10.1021/jo0617114","","","1.54178","CuKα","","0.1117","0.0611","","","0.1482","0.1905","","","","","","1.067","","","","has coordinates,has disorder","178405","2020-10-21","18:00:00",""
"4022613","11.689","0.001","9.363","0.001","11.234","0.001","90","","99.153","0.007","90","","1213.8","0.2","296.2","","","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C25 H31 Cl2 N3 Zn -","- C49 H61 Cl4 N5 Zn -","- C98 H122 Cl8 N10 Zn2 -","2","0.5","","Jun'ichi Uenishi; Sachiko Aburatani; Taro Takami","Stereocomplexity and Stereoselective Synthesis of Triamine Molecules Bearing Four Chiral Carbon Centers: Stereodifferentiated Preparation of All 10 Stereoisomers of 2,6-Bis[1-(1-phenylethylamino)ethyl]pyridines","Journal of Organic Chemistry","2007","72","","132","138","10.1021/jo061729e","","","1.5418","CuKα","","","0.0242","","","","0.0683","","","","","","1.141","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022614","7.794","0.004","10.842","0.005","8.651","0.004","90","","115.448","0.007","90","","660.2","0.5","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H15 Br O3 -","- C14 H15 Br O3 -","- C28 H30 Br2 O6 -","2","1","","Douglass F. Taber; Jiang-lin Liang","Single Enantiomer Epoxides by Bromomandelation of Prochiral Alkenes","Journal of Organic Chemistry","2007","72","","431","434","10.1021/jo061818r","","","0.71073","MoKα","","0.0315","0.0308","","","0.0797","0.0801","","","","","","1.03","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022615","8.8455","0.0008","12.1404","0.0011","10.2121","0.0009","90","","101.764","0.001","90","","1073.62","0.17","90","","90","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H27 F3 O4 -","- C23 H27 F3 O4 -","- C46 H54 F6 O8 -","2","1","","Takashi Nagamine; Kohei Inomata; Yasuyuki Endo; Leo A. Paquette","Amino Acid Mediated Intramolecular Asymmetric Aldol Reaction to Construct a New Chiral Bicyclic Enedione Containing a Seven-Membered Ring: Remarkable Inversion of Enantioselectivity Compared to the Six-Membered Ring","Journal of Organic Chemistry","2007","72","","123","131","10.1021/jo061824n","","","0.71073","MoKα","","0.0296","0.0279","","","0.0713","0.0721","","","","","","1.097","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022616","17.339","0.001","19.36","0.002","17.462","0.002","90","","117.007","0.003","90","","5222.5","0.9","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H15 N7 O2 -","- C11 H15 N7 O2 -","- C176 H240 N112 O32 -","16","4","","Ali Asadi; Brian O. Patrick; David M. Perrin","Janus-AT Bases: Synthesis, Self-Assembly, and Solid State Structures","Journal of Organic Chemistry","2007","72","","466","475","10.1021/jo061840k","","","0.71069","MoKα","","0.1103","0.0617","","","0.1549","0.1847","","","","","","1.026","","","","has coordinates,has disorder","201982","2020-10-21","18:00:00",""
"4022617","6.3387","0.0007","9.724","0.001","15.889","0.002","84.087","0.007","79.926","0.007","88.509","0.006","959.1","0.19","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H24 N6 O6 -","- C15 H24 N6 O6 -","- C30 H48 N12 O12 -","2","1","","Ali Asadi; Brian O. Patrick; David M. Perrin","Janus-AT Bases: Synthesis, Self-Assembly, and Solid State Structures","Journal of Organic Chemistry","2007","72","","466","475","10.1021/jo061840k","","","0.71073","MoKα","","0.1016","0.0664","","","0.2038","0.2326","","","","","","1.084","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022618","29.633","0.002","17.158","0.001","12.5526","0.0009","90","","90","","90","","6382.3","0.7","173","2","173","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C26 H38 Cl2 N10 O10 -","- C25.3345 H36.668 Cl0.99 N10 O10 -","- C202.676 H293.344 Cl7.92 N80 O80 -","8","1","","Ali Asadi; Brian O. Patrick; David M. Perrin","Janus-AT Bases: Synthesis, Self-Assembly, and Solid State Structures","Journal of Organic Chemistry","2007","72","","466","475","10.1021/jo061840k","","","0.71069","MoKα","","0.1957","0.1001","","","0.2299","0.276","","","","","","1.075","","","","has coordinates,has disorder","178405","2020-10-21","18:00:00",""
"4022619","7.0091","0.0006","20.9279","0.0019","7.8304","0.0006","90","","103.635","0.003","90","","1116.24","0.16","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H13 N3 O2 S -","- C10 H13 N3 O2 S -","- C40 H52 N12 O8 S4 -","4","1","","Ali Asadi; Brian O. Patrick; David M. Perrin","Janus-AT Bases: Synthesis, Self-Assembly, and Solid State Structures","Journal of Organic Chemistry","2007","72","","466","475","10.1021/jo061840k","","","0.71073","MoKα","","0.0522","0.046","","","0.1247","0.1298","","","","","","1.045","","","","has coordinates,has disorder","178405","2020-10-21","18:00:00",""
"4022620","10.2805","0.0005","8.8859","0.0004","15.8645","0.0006","90","","91.645","0.003","90","","1448.65","0.11","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C11 H13 N3 O2 S2 -","- C11.98 H9.325 N3.5 O2 S2 -","- C47.92 H37.3 N14 O8 S8 -","4","1","","Ali Asadi; Brian O. Patrick; David M. Perrin","Janus-AT Bases: Synthesis, Self-Assembly, and Solid State Structures","Journal of Organic Chemistry","2007","72","","466","475","10.1021/jo061840k","","","0.71073","MoKα","","0.0566","0.0464","","","0.1219","0.1299","","","","","","1.035","","","","has coordinates,has disorder","178405","2020-10-21","18:00:00",""
"4022621","27.312","0.002","8.6717","0.0005","15.2589","0.0008","90","","113.221","0.001","90","","3321.2","0.4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H20 N4 O4 S -","- C14 H20 N4 O4 S -","- C112 H160 N32 O32 S8 -","8","1","","Ali Asadi; Brian O. Patrick; David M. Perrin","Janus-AT Bases: Synthesis, Self-Assembly, and Solid State Structures","Journal of Organic Chemistry","2007","72","","466","475","10.1021/jo061840k","","","0.71069","MoKα","","0.0506","0.0403","","","0.1122","0.1192","","","","","","1.047","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022622","8.2512","0.0007","9.1811","0.0009","10.7071","0.001","111.582","0.005","92.748","0.005","107.574","0.005","707.39","0.11","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H22 S2 -","- C15 H22 S2 -","- C30 H44 S4 -","2","1","","Mingqian He; Feixia Zhang","Synthesis and Structure of Alkyl-Substituted Fused Thiophenes Containing up to Seven Rings","Journal of Organic Chemistry","2007","72","","442","451","10.1021/jo061853y","","","0.71073","MoKα","","0.0418","0.0299","","","0.0842","0.089","","","","","","0.998","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022623","34.99","0.002","6.9313","0.0004","12.8425","0.0008","90","","93.083","0.004","90","","3110.1","0.3","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C32 H44 S5 -","- C32 H44 S5 -","- C128 H176 S20 -","4","0.5","","Mingqian He; Feixia Zhang","Synthesis and Structure of Alkyl-Substituted Fused Thiophenes Containing up to Seven Rings","Journal of Organic Chemistry","2007","72","","442","451","10.1021/jo061853y","","","0.71073","MoKα","","0.0493","0.0355","","","0.0966","0.1052","","","","","","1.037","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022624","7.7717","0.0016","9.131","0.0018","11.152","0.002","104.5","0.03","106.54","0.03","96.84","0.03","718.8","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H16 O2 S -","- C17 H16 O2 S -","- C34 H32 O4 S2 -","2","1","","Lingling Peng; Xiu Zhang; Shiwei Zhang; Jianbo Wang","Au-Catalyzed Reaction of Propargylic Sulfides and Dithioacetals","Journal of Organic Chemistry","2007","72","","1192","1197","10.1021/jo0618674","","","0.71073","MoKα","","0.0755","0.0559","","","0.1653","0.1767","","","","","","1.111","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022625","7.0996","0.0008","10.1818","0.0011","13.5661","0.0014","81.598","0.008","81.18","0.008","69.988","0.008","905.9","0.2","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H20 N2 O2 -","- C24 H20 N2 O2 -","- C48 H40 N4 O4 -","2","1","","Elizabeth Malamidou-Xenikaki; Spyros Spyroudis; Maria Tsanakopoulou; Harald Krautscheid","Reactivity of Indanedioneketene Dimer with Amines","Journal of Organic Chemistry","2007","72","","502","508","10.1021/jo061879p","","","0.71073","MoKα","","0.0571","0.0469","","","0.1227","0.1294","","","","","","1.031","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022626","7.3809","0.0004","12.7529","0.0008","22.3545","0.0015","90","","91.037","0.008","90","","2103.8","0.2","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H17 N O6 -","- C27 H17 N O6 -","- C108 H68 N4 O24 -","4","1","","Elizabeth Malamidou-Xenikaki; Spyros Spyroudis; Maria Tsanakopoulou; Harald Krautscheid","Reactivity of Indanedioneketene Dimer with Amines","Journal of Organic Chemistry","2007","72","","502","508","10.1021/jo061879p","","","0.71073","MoKα","","0.0541","0.0308","","","0.0704","0.0742","","","","","","0.814","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022627","9.25","","13.014","","12.342","","90","","103.11","","90","","1447","","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C29 H40 B N2 O2 P -","- C29 H40 B N2 O2 P -","- C58 H80 B2 N4 O4 P2 -","2","1","","Marek Stankevič; K. Michał Pietrusiewicz","Resolution and Stereochemistry of tert-Butylphenylphosphinous Acid-Borane","Journal of Organic Chemistry","2007","72","","816","822","10.1021/jo061896e","","","1.54184","CuKα","","0.0461","0.0461","","","0.1274","0.1274","","","","","","1.058","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022628","11.0128","0.0011","9.9609","0.001","18.4801","0.0018","90","","102.407","0.002","90","","1979.9","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H21 Cl -","- C25 H21 Cl -","- C100 H84 Cl4 -","4","1","","Yun-Peng Zhang; Jian-Mei Lu; Guang-Cai Xu; Min Shi","Lewis-Acid-Catalyzed Rearrangement of Arylvinylidenecyclopropanes: Significant Influence of Substituents and Electronic Nature of Aryl Groups","Journal of Organic Chemistry","2007","72","","509","516","10.1021/jo061899r","","","0.71073","MoKα","","0.1408","0.0456","","","0.0972","0.117","","","","","","0.729","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022629","12.8662","0.0004","13.0458","0.0004","13.6776","0.0004","74.466","0.002","68.535","0.002","82.989","0.002","2057.77","0.11","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H59 N7 O5 -","- C39 H59 N7 O5 -","- C78 H118 N14 O10 -","2","1","","Monika Mazik; Hüseyin Cavga","Molecular Recognition of N-Acetylneuraminic Acid with Acyclic Benzimidazolium- and Aminopyridine/guanidinium-Based Receptors","Journal of Organic Chemistry","2007","72","","831","838","10.1021/jo061901e","","","0.71073","MoKα","","0.0732","0.0478","","","0.1075","0.1204","","","","","","1.014","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022630","5.2387","0.0007","34.215","0.005","6.2694","0.0008","90","","109.54","0.003","90","","1059","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","gamma-lactones","","","- C11 H16 O4 -","- C11 H16 O4 -","- C44 H64 O16 -","4","1","","Md. Merajuddin Baag; Vedavati G. Puranik; Narshinha P. Argade","Facile Chemo-, Regio-, and Diastereoselective Approach to cis-3,5-Disubstituted γ-Butyrolactones and Fused γ-Butyrolactones","Journal of Organic Chemistry","2007","72","","1009","1012","10.1021/jo0619128","","","0.71073","MoKα","","0.1258","0.0807","","","0.1436","0.1595","","","","","","1.159","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022631","8.4006","0.0006","16.4634","0.0012","10.1115","0.0008","90","","113.356","0.001","90","","1283.86","0.17","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","gamma-lactones","","","- C14 H16 O4 -","- C14 H16 O4 -","- C56 H64 O16 -","4","2","","Md. Merajuddin Baag; Vedavati G. Puranik; Narshinha P. Argade","Facile Chemo-, Regio-, and Diastereoselective Approach to cis-3,5-Disubstituted γ-Butyrolactones and Fused γ-Butyrolactones","Journal of Organic Chemistry","2007","72","","1009","1012","10.1021/jo0619128","","","0.71073","MoKα","","0.1158","0.0672","","","0.1493","0.1711","","","","","","0.924","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022632","6.5347","0.0006","7.0844","0.0007","11.655","0.0011","90","","96.388","0.007","90","","536.21","0.09","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C10 H10 F2 N2 O4 -","- C10 H10 F2 N2 O4 -","- C20 H20 F4 N4 O8 -","2","1","","Ireneusz Nowak; John F. Cannon; Morris J. Robins","Addition of Difluorocarbene to 3',4'-Unsaturated Nucleosides: Synthesis of 2'-Deoxy Analogues with a 2-Oxabicyclo[3.1.0]hexane Framework","Journal of Organic Chemistry","2007","72","","532","537","10.1021/jo061965p","","","0.71073","MoKα","","0.0419","0.0349","","","0.085","0.0883","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022633","6.4528","0.0005","9.5514","0.0007","20.5093","0.0018","90","","90","","90","","1264.06","0.17","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C10 H12 Br F2 N3 O3 -","- C10 H12 Br F2 N3 O3 -","- C40 H48 Br4 F8 N12 O12 -","4","1","","Ireneusz Nowak; John F. Cannon; Morris J. Robins","Addition of Difluorocarbene to 3',4'-Unsaturated Nucleosides: Synthesis of 2'-Deoxy Analogues with a 2-Oxabicyclo[3.1.0]hexane Framework","Journal of Organic Chemistry","2007","72","","532","537","10.1021/jo061965p","","","0.71073","MoKα","","0.0563","0.0437","","","0.1046","0.1122","","","","","","1.033","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022634","26.324","0.005","11.919","0.001","17.271","0.003","90","","92.69","0.01","90","","5413","1","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H43 N O3 -","- C26 H43 N O3 -","- C208 H344 N8 O24 -","8","1","","Pascale Cividino; Sandrine Py; Philippe Delair; Andrew E. Greene","1-(2,4,6-Triisopropylphenyl)ethylamine: A New Chiral Auxiliary for the Asymmetric Synthesis of γ-Amino Acid Derivatives","Journal of Organic Chemistry","2007","72","","485","493","10.1021/jo061976i","","","1.5418","CuKα","","0.0692","0.0692","","0.1155","","0.1155","","","1.977","","","1.977","","","","has coordinates","193994","2020-10-21","18:00:00",""
"4022635","11.4084","0.0009","13.9228","0.0004","18.075","0.001","90","","90","","90","","2870.9","0.2","293","","293","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C27 H47 N O3 -","- C27 H47 N O3 -","- C108 H188 N4 O12 -","4","1","","Pascale Cividino; Sandrine Py; Philippe Delair; Andrew E. Greene","1-(2,4,6-Triisopropylphenyl)ethylamine: A New Chiral Auxiliary for the Asymmetric Synthesis of γ-Amino Acid Derivatives","Journal of Organic Chemistry","2007","72","","485","493","10.1021/jo061976i","","","0.7107","MoKα","","0.0701","0.0701","","0.0822","","0.0822","","","1.887","","","1.887","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022636","8.199","0.002","16.132","0.003","19.52","0.004","90","","91.19","0.02","90","","2581.2","0.8","293","","293","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C26 H45 N O3 -","- C26 H45 N O3 -","- C104 H180 N4 O12 -","4","1","","Pascale Cividino; Sandrine Py; Philippe Delair; Andrew E. Greene","1-(2,4,6-Triisopropylphenyl)ethylamine: A New Chiral Auxiliary for the Asymmetric Synthesis of γ-Amino Acid Derivatives","Journal of Organic Chemistry","2007","72","","485","493","10.1021/jo061976i","","","1.5418","CuKα","","0.0617","0.0617","","0.0779","","0.0779","","","1.988","","","1.988","","","","has coordinates","193994","2020-10-21","18:00:00",""
"4022637","10.859","0.008","24.85","0.02","10.985","0.003","90","","112.56","0.04","90","","2737","3","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H45 N O3 -","- C26 H45 N O3 -","- C104 H180 N4 O12 -","4","1","","Pascale Cividino; Sandrine Py; Philippe Delair; Andrew E. Greene","1-(2,4,6-Triisopropylphenyl)ethylamine: A New Chiral Auxiliary for the Asymmetric Synthesis of γ-Amino Acid Derivatives","Journal of Organic Chemistry","2007","72","","485","493","10.1021/jo061976i","","","1.5418","CuKα","","0.0767","0.0767","","0.117","","0.117","","","1.979","","","1.979","","","","has coordinates","193994","2020-10-21","18:00:00",""
"4022638","9.927","0.003","31.615","0.01","12.614","0.004","90","","108.654","0.006","90","","3751","2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C70 H6 O S4 -","- C70 H6 O S4 -","- C280 H24 O4 S16 -","4","1","","Shih-Ching Chuang; Michael Sander; Thibaut Jarrosson; Scott James; Eugene Rozumov; Saeed I. Khan; Yves Rubin","Approaches to Open Fullerenes: Synthesis and Kinetic Stability of Diels-Alder Adducts of Substituted Isobenzofurans and C~60~","Journal of Organic Chemistry","2007","72","","2716","2723","10.1021/jo061986j","","","0.71073","MoKα","","0.059","0.0395","","","0.1008","0.1099","","","","","","1.051","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022639","20.31","0.004","20.105","0.003","27.042","0.005","90","","99.637","0.003","90","","10887","3","100","2","100","2","","","","","","","","4","C 1 m 1","C -2y","8","","","","- C391 H66 Cl18 O10 -","- C391 H66 Cl18 O10 -","- C782 H132 Cl36 O20 -","2","0.5","","Michael Sander; Thibaut Jarrosson; Shih-Ching Chuang; Saeed I. Khan; Yves Rubin","Approaches to Open Fullerenes: Synthesis and Thermal Stability of cis-1 Bis(isobenzofuran) Diels-Alder Adducts of C~60~","Journal of Organic Chemistry","2007","72","","2724","2731","10.1021/jo061987b","","","0.71073","MoKα","","0.1476","0.0569","","","0.1129","0.1396","","","","","","0.883","","","","has coordinates,has disorder","178405","2020-10-21","18:00:00",""
"4022640","8.7136","0.0008","17.8622","0.0016","16.2167","0.0015","90","","101.555","0.002","90","","2472.9","0.4","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H34 N4 O2 -","- C28 H34 N4 O2 -","- C112 H136 N16 O8 -","4","2","","Jonathan Clayden; Loïc Lemiègre; Madeleine Helliwell","Synthesis and Stacked Conformations of Symmetrical and Unsymmetrical Oligo-ureas of Metaphenylenediamine","Journal of Organic Chemistry","2007","72","","2302","2308","10.1021/jo061989w","","","0.71073","MoKα","","0.0819","0.0525","","","0.1298","0.1529","","","","","","1.024","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022641","7.989","0.0005","8.2057","0.0005","26.808","0.0017","87.394","0.001","88.309","0.001","72.692","0.001","1675.86","0.18","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H44 N6 O3 -","- C37 H44 N6 O3 -","- C74 H88 N12 O6 -","2","1","","Jonathan Clayden; Loïc Lemiègre; Madeleine Helliwell","Synthesis and Stacked Conformations of Symmetrical and Unsymmetrical Oligo-ureas of Metaphenylenediamine","Journal of Organic Chemistry","2007","72","","2302","2308","10.1021/jo061989w","","","0.71073","MoKα","","0.0667","0.0444","","","0.0979","0.1053","","","","","","0.956","","","","has coordinates,has disorder","178405","2020-10-21","18:00:00",""
"4022642","22.896","0.008","7.392","0.003","13.105","0.005","90","","110.634","0.005","90","","2075.5","1.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H26 N4 O2 -","- C24 H26 N4 O2 -","- C96 H104 N16 O8 -","4","0.5","","Jonathan Clayden; Loïc Lemiègre; Madeleine Helliwell","Synthesis and Stacked Conformations of Symmetrical and Unsymmetrical Oligo-ureas of Metaphenylenediamine","Journal of Organic Chemistry","2007","72","","2302","2308","10.1021/jo061989w","","","0.71073","MoKα","","0.0448","0.0366","","","0.0988","0.1016","","","","","","1.082","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022643","13.3864","0.0019","8.7037","0.0013","23.48","0.003","90","","95.709","0.002","90","","2722.2","0.7","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H38 N4 O2 -","- C30 H38 N4 O2 -","- C120 H152 N16 O8 -","4","0.5","","Jonathan Clayden; Loïc Lemiègre; Madeleine Helliwell","Synthesis and Stacked Conformations of Symmetrical and Unsymmetrical Oligo-ureas of Metaphenylenediamine","Journal of Organic Chemistry","2007","72","","2302","2308","10.1021/jo061989w","","","0.71073","MoKα","","0.059","0.0426","","","0.1003","0.1056","","","","","","0.974","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022644","13.691","0.014","46.59","0.05","8.981","0.009","90","","90","","90","","5729","10","100","2","100","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C32 H42 N4 O2 -","- C32 H42 N4 O2 -","- C256 H336 N32 O16 -","8","0.5","","Jonathan Clayden; Loïc Lemiègre; Madeleine Helliwell","Synthesis and Stacked Conformations of Symmetrical and Unsymmetrical Oligo-ureas of Metaphenylenediamine","Journal of Organic Chemistry","2007","72","","2302","2308","10.1021/jo061989w","","","0.71073","MoKα","","0.1313","0.0989","","","0.2481","0.2718","","","","","","1.043","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022645","17.549","0.002","6.9388","0.0009","21.924","0.003","90","","90","","90","","2669.7","0.6","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C30 H38 N4 O2 -","- C30 H38 N4 O2 -","- C120 H152 N16 O8 -","4","1","","Jonathan Clayden; Loïc Lemiègre; Madeleine Helliwell","Synthesis and Stacked Conformations of Symmetrical and Unsymmetrical Oligo-ureas of Metaphenylenediamine","Journal of Organic Chemistry","2007","72","","2302","2308","10.1021/jo061989w","","","0.71073","MoKα","","0.1902","0.0507","","","0.0648","0.0939","","","","","","0.602","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022646","21.969","0.017","6.777","0.005","17.569","0.011","90","","111.03","0.06","90","","2442","3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H34 N4 O2 -","- C28 H34 N4 O2 -","- C112 H136 N16 O8 -","4","0.5","","Jonathan Clayden; Loïc Lemiègre; Madeleine Helliwell","Synthesis and Stacked Conformations of Symmetrical and Unsymmetrical Oligo-ureas of Metaphenylenediamine","Journal of Organic Chemistry","2007","72","","2302","2308","10.1021/jo061989w","","","0.71073","MoKα","","0.0697","0.0621","","","0.1929","0.205","","","","","","1.11","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022647","14.7672","0.0017","7.5714","0.0009","21.772","0.003","90","","103.97","0.002","90","","2362.3","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H25 N3 O7 -","- C25 H25 N3 O7 -","- C100 H100 N12 O28 -","4","1","","Hui-Ping Yi; Jiang Wu; Kui-Ling Ding; Xi-Kui Jiang; Zhan-Ting Li","Hydrogen Bonding-Induced Aromatic Oligoamide Foldamers as Spherand Analogues to Accelerate the Hydrolysis of Nitro-Substituted Anisole in Aqueous Media","Journal of Organic Chemistry","2007","72","","870","877","10.1021/jo0619940","","","0.71073","MoKα","","0.0981","0.0479","","","0.0987","0.1096","","","","","","0.79","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022648","6.922","0.0007","24.095","0.002","8.9581","0.0008","90","","110.844","0.002","90","","1396.3","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 N2 O5 -","- C15 H14 N2 O5 -","- C60 H56 N8 O20 -","4","1","","Hui-Ping Yi; Jiang Wu; Kui-Ling Ding; Xi-Kui Jiang; Zhan-Ting Li","Hydrogen Bonding-Induced Aromatic Oligoamide Foldamers as Spherand Analogues to Accelerate the Hydrolysis of Nitro-Substituted Anisole in Aqueous Media","Journal of Organic Chemistry","2007","72","","870","877","10.1021/jo0619940","","","0.71073","MoKα","","0.0704","0.0482","","","0.1219","0.1326","","","","","","0.941","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022649","8.0199","0.0015","24.58","0.005","11.3","0.002","90","","90.1","0.005","90","","2227.4","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H23 N3 O7 -","- C24 H23 N3 O7 -","- C96 H92 N12 O28 -","4","1","","Hui-Ping Yi; Jiang Wu; Kui-Ling Ding; Xi-Kui Jiang; Zhan-Ting Li","Hydrogen Bonding-Induced Aromatic Oligoamide Foldamers as Spherand Analogues to Accelerate the Hydrolysis of Nitro-Substituted Anisole in Aqueous Media","Journal of Organic Chemistry","2007","72","","870","877","10.1021/jo0619940","","","0.71073","MoKα","","0.1668","0.0516","","","0.0901","0.1224","","","","","","0.887","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022650","16.6121","0.0008","16.6121","0.0008","25.705","0.002","90","","90","","120","","6143.3","0.7","163","2","163","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C13 H24 O3 -","- C13 H24 O3 -","- C234 H432 O54 -","18","1","","Stacie A. Calad; Jelena Ćirakovč; K. A. Woerpel","Synthesis of (\±)-epi-Stegobinone Utilizing Silacyclopropanes as Synthetic Intermediates","Journal of Organic Chemistry","2007","72","","1027","1030","10.1021/jo0620011","","","0.71073","MoKα","","0.0423","0.0359","","","0.0963","0.1043","","","","","","1.056","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022651","3.5647","0.0008","10.192","0.002","10.679","0.002","109.196","0.004","98.77","0.004","95.216","0.004","357.98","0.14","93","2","93","2","","","100","","","","Isolated by Reinheimer et al. from the reaction of 2-chloro-3-nitropyridine and two equivalents of hydroxide","5","P -1","-P 1","2","","3-pentenenitrile, 2-nitro-5-oxo-, ion(-1), sodium","","- C5 H5 N2 Na O4 -","- C5 H5 N2 Na O4 -","- C10 H10 N4 Na2 O8 -","2","1","","LeRoy W. Haynes; Virginia B. Pett","Structures of the Intermediates Formed in the Ring-Opening Reaction of 2-Chloro-3-nitropyridine","Journal of Organic Chemistry","2007","72","","633","635","10.1021/jo062003l","","x-ray","0.71073","MoKα","","0.08","0.0528","","","0.1243","0.1357","","","","","","1.074","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022652","7.1454","0.0001","6.9176","0.0001","10.0029","0.0002","90","","98.292","0.001","90","","489.265","0.014","100","2","100","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","","","- C10 H8 Br N O3 -","- C10 H8 Br N O3 -","- C20 H16 Br2 N2 O6 -","2","1","","Aitor Landa; Bo Richter; Rasmus Lyng Johansen; Anna Minkkilä; Karl Anker Jørgensen","Bisoxazoline-Lewis Acid-Catalyzed Direct-Electron Demand oxo-Hetero-Diels-Alder Reactions of N-Oxy-pyridine Aldehyde and Ketone Derivatives","Journal of Organic Chemistry","2007","72","","240","245","10.1021/jo062012u","","x-ray","0.71073","MoKα","","0.0342","0.0274","","","0.0494","0.0508","","","","","","1.054","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022653","8.7776","0.0004","19.952","0.005","16.671","0.001","90","","90.949","0.005","90","","2919.3","0.8","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H22 F6 O2 S3 -","- C32 H22 F6 O2 S3 -","- C128 H88 F24 O8 S12 -","4","1","","Tomoyuki Okuyama; Yutaka Tani; Kentaro Miyake; Yasushi Yokoyama","Chiral Helicenoid Diarylethene with Large Change in Specific Optical Rotation by Photochromism","Journal of Organic Chemistry","2007","72","","1634","1638","10.1021/jo0620213","","","1.5418","CuKα","","","0.0668","","","","0.2146","","","","","","1.055","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022654","11.016","0.002","24.201","0.003","11.349","0.002","90","","109.05","0.01","90","","2860","0.8","296.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C35 H18 F6 S4 -","- C35 H18 F6 S4 -","- C140 H72 F24 S16 -","4","1","","Tomoyuki Okuyama; Yutaka Tani; Kentaro Miyake; Yasushi Yokoyama","Chiral Helicenoid Diarylethene with Large Change in Specific Optical Rotation by Photochromism","Journal of Organic Chemistry","2007","72","","1634","1638","10.1021/jo0620213","","","0.7107","MoKα","","","0.062","","","","0.2215","","","","","","1.092","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022655","12.1162","0.0019","7.5984","0.0012","15.339","0.003","90","","110.262","0.003","90","","1324.8","0.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 F2 O6 -","- C12 H16 F2 O6 -","- C48 H64 F8 O24 -","4","1","","Jonathan A. L. Miles; Lisa Mitchell; Jonathan M. Percy; Kuldip Singh; E. Uneyama","Total Syntheses of Conformationally Locked Difluorinated Pentopyranose Analogues and a Pentopyranosyl Phosphate Mimetic","Journal of Organic Chemistry","2007","72","","1575","1587","10.1021/jo0620258","","","0.71073","MoKα","","0.0542","0.0428","","","0.0978","0.1034","","","","","","1.019","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4022656","9.9359","0.0015","11.1641","0.0017","13.13","0.002","78.181","0.003","86.925","0.003","88.75","0.003","1423.4","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H18 F2 O4 -","- C15 H18 F2 O4 -","- C60 H72 F8 O16 -","4","2","","Jonathan A. L. Miles; Lisa Mitchell; Jonathan M. Percy; Kuldip Singh; E. Uneyama","Total Syntheses of Conformationally Locked Difluorinated Pentopyranose Analogues and a Pentopyranosyl Phosphate Mimetic","Journal of Organic Chemistry","2007","72","","1575","1587","10.1021/jo0620258","","","0.71073","MoKα","","0.1002","0.0571","","","0.0924","0.1055","","","","","","0.959","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4022657","7.24","0.002","9.607","0.003","13.226","0.004","98.732","0.005","102.59","0.005","100.713","0.005","864.2","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 F2 O5 -","- C18 H22 F2 O5 -","- C36 H44 F4 O10 -","2","1","","Jonathan A. L. Miles; Lisa Mitchell; Jonathan M. Percy; Kuldip Singh; E. Uneyama","Total Syntheses of Conformationally Locked Difluorinated Pentopyranose Analogues and a Pentopyranosyl Phosphate Mimetic","Journal of Organic Chemistry","2007","72","","1575","1587","10.1021/jo0620258","","","0.71073","MoKα","","0.0554","0.0455","","","0.1179","0.124","","","","","","1.018","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4022658","15.5415","0.0019","6.6332","0.0008","13.9404","0.0017","90","","106.126","0.002","90","","1380.6","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 F2 O4 -","- C15 H18 F2 O4 -","- C60 H72 F8 O16 -","4","1","","Jonathan A. L. Miles; Lisa Mitchell; Jonathan M. Percy; Kuldip Singh; E. Uneyama","Total Syntheses of Conformationally Locked Difluorinated Pentopyranose Analogues and a Pentopyranosyl Phosphate Mimetic","Journal of Organic Chemistry","2007","72","","1575","1587","10.1021/jo0620258","","","0.71073","MoKα","","0.105","0.0514","","","0.0661","0.0785","","","","","","0.844","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022659","10.3624","0.0014","6.6363","0.0009","11.0444","0.0015","90","","112.613","0.002","90","","701.11","0.16","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H18 F2 O4 -","- C15 H18 F2 O4 -","- C30 H36 F4 O8 -","2","1","","Jonathan A. L. Miles; Lisa Mitchell; Jonathan M. Percy; Kuldip Singh; E. Uneyama","Total Syntheses of Conformationally Locked Difluorinated Pentopyranose Analogues and a Pentopyranosyl Phosphate Mimetic","Journal of Organic Chemistry","2007","72","","1575","1587","10.1021/jo0620258","","","0.71073","MoKα","","0.0561","0.0406","","","0.0586","0.0622","","","","","","0.917","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022660","10.209","0.002","9.5116","0.0018","11.486","0.002","90","","95.826","0.003","90","","1109.6","0.4","297","2","297","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H26 Br N3 O5 -","- C19 H26 Br N3 O5 -","- C38 H52 Br2 N6 O10 -","2","1","","Pranjal K. Baruah; N. K. Sreedevi; Rajesh Gonnade; Sapna Ravindranathan; Krishnan Damodaran; Hans-Jörg Hofmann; Gangadhar J. Sanjayan","Enforcing Periodic Secondary Structures in Hybrid Peptides: A Novel Hybrid Foldamer Containing Periodic γ-Turn Motifs","Journal of Organic Chemistry","2007","72","","636","639","10.1021/jo062032w","","","0.71073","MoKα","","0.0567","0.0418","","","0.0961","0.1032","","","","","","1.016","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022661","8.387","0.003","8.079","0.003","14.455","0.005","90","","103.605","0.007","90","","952","0.6","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H18 O8 -","- C20 H18 O8 -","- C40 H36 O16 -","2","1","","Sengodagounder Muthusamy; Boopathy Gnanaprakasam; Eringathodi Suresh","New Approach to the Synthesis of Macrocyclic Tetralactones via Ring-Closing Metathesis Using Grubbs' First-Generation Catalyst","Journal of Organic Chemistry","2007","72","","1495","1498","10.1021/jo062043p","","","0.71073","MoKα","","0.1524","0.0718","","","0.1406","0.1725","","","","","","1.013","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022662","13.988","0.009","7.942","0.005","21.663","0.013","90","","94.826","0.014","90","","2398","3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H22 O8 -","- C28 H22 O8 -","- C112 H88 O32 -","4","1","","Sengodagounder Muthusamy; Boopathy Gnanaprakasam; Eringathodi Suresh","New Approach to the Synthesis of Macrocyclic Tetralactones via Ring-Closing Metathesis Using Grubbs' First-Generation Catalyst","Journal of Organic Chemistry","2007","72","","1495","1498","10.1021/jo062043p","","","0.71073","MoKα","","0.1697","0.0865","","","0.1936","0.2438","","","","","","1.012","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022663","8.257","0.005","15.255","0.01","16.79","0.011","90","","90","","90","","2115","2","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H24 O3 S2 -","- C23 H24 O3 S2 -","- C92 H96 O12 S8 -","4","1","","Yolanda Arroyo; J. Félix Rodríguez; Mercedes Santos; M. Ascensión Sanz Tejedor; José Luis García Ruano","Asymmetric Synthesis of β-Hydroxy Sulfides Controlled by Remote Sulfoxides","Journal of Organic Chemistry","2007","72","","1035","1038","10.1021/jo062053q","","","0.71073","MoKα","","0.0377","0.0326","","","0.0842","0.0867","","","","","","1.065","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022664","11.194","0.002","8.995","0.002","17.869","0.003","90","","92.509","0.01","90","","1797.5","0.6","150","2","150","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","Paquette 1500","","","- C38 H54 O4 Si -","- C38 H54 O4 Si -","- C76 H108 O8 Si2 -","2","1","","Leo A. Paquette; Yang Hu; Andreas Luxenburger; Raynauld L. Bishop","Studies toward the Total Synthesis of Dumsin. 2. A Second Generation Approach Resulting in Enantioselective Construction of a Functionalized ABC Subunit of the Tetranortriterpenoid Insect Antifeedant","Journal of Organic Chemistry","2007","72","","209","222","10.1021/jo062068o","","x-ray","0.71073","MoKα","","0.0711","0.0522","","","0.1256","0.1362","","","","","","1.041","","","","has coordinates,has disorder","178405","2020-10-21","18:00:00",""
"4022665","11.408","0.004","6.736","0.002","12.4","0.004","90","","107.562","0.005","90","","908.5","0.5","125","2","125","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H25 N O2 -","- C21 H25 N O2 -","- C42 H50 N2 O4 -","2","1","","Laura J. Marshall; Mark D. Roydhouse; Alexandra M. Z. Slawin; John C. Walton","Effect of Chain Length on Radical to Carbanion Cyclo-Coupling of Bromoaryl Alkyl-Linked Oxazolines: 1,3-Areneotropic Migration of Oxazolines","Journal of Organic Chemistry","2007","72","","898","911","10.1021/jo0620720","","","0.71073","MoKα","","0.1311","0.0625","","","0.1111","0.1293","","","","","","0.886","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022666","8.588","0.002","10.0389","0.0019","10.8881","0.0013","115.888","0.016","98.06","0.02","92.69","0.02","830","0.3","93","2","93","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H23 N O -","- C21 H23 N O -","- C42 H46 N2 O2 -","2","1","","Laura J. Marshall; Mark D. Roydhouse; Alexandra M. Z. Slawin; John C. Walton","Effect of Chain Length on Radical to Carbanion Cyclo-Coupling of Bromoaryl Alkyl-Linked Oxazolines: 1,3-Areneotropic Migration of Oxazolines","Journal of Organic Chemistry","2007","72","","898","911","10.1021/jo0620720","","","0.71073","MoKα","","0.0519","0.0462","","","0.1198","0.1257","","","","","","1.074","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022667","12.9895","0.0012","11.579","0.001","11.5517","0.0011","90","","93.777","0.003","90","","1733.7","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H23 N O -","- C22 H23 N O -","- C88 H92 N4 O4 -","4","1","","Laura J. Marshall; Mark D. Roydhouse; Alexandra M. Z. Slawin; John C. Walton","Effect of Chain Length on Radical to Carbanion Cyclo-Coupling of Bromoaryl Alkyl-Linked Oxazolines: 1,3-Areneotropic Migration of Oxazolines","Journal of Organic Chemistry","2007","72","","898","911","10.1021/jo0620720","","","1.54178","CuKα","","0.0481","0.0406","","","0.0939","0.0982","","","","","","1.078","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022668","7.2553","0.0003","18.2486","0.0006","25.7308","0.0009","90","","90","","90","","3406.7","0.2","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C22 H23 N O -","- C22 H23 N O -","- C176 H184 N8 O8 -","8","1","","Laura J. Marshall; Mark D. Roydhouse; Alexandra M. Z. Slawin; John C. Walton","Effect of Chain Length on Radical to Carbanion Cyclo-Coupling of Bromoaryl Alkyl-Linked Oxazolines: 1,3-Areneotropic Migration of Oxazolines","Journal of Organic Chemistry","2007","72","","898","911","10.1021/jo0620720","","","1.54178","CuKα","","0.0455","0.0446","","","0.1162","0.1174","","","","","","0.974","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022669","7.9324","0.0007","10.3812","0.0009","10.6069","0.0009","90","","96.848","0.002","90","","867.22","0.13","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3B-acetoxy-4A,5A,7A,11B-H-eudesman-6A,12-diyl-S(R)-cyclic-sulfite","","- C17 H28 O5 S -","- C17 H28 O5 S -","- C34 H56 O10 S2 -","2","1","","Andrés García-Granados; Andrés Parra; Francisco Rivas; Alejandro J. Segovia","Seven-Membered Cyclic Sulfite Eudesmane Derivatives: Partial Synthesis, Structural Determination, and Enzymatic Resolution","Journal of Organic Chemistry","2007","72","","643","646","10.1021/jo0620866","","","0.71073","MoKα","","0.0392","0.0375","","","0.0925","0.0943","","","","","","1.056","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022670","8.6727","0.0005","9.3435","0.0005","11.1483","0.0006","90","","91.375","0.001","90","","903.12","0.09","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3B-acetoxy-4A,5A,7A,11B-H-eudesman-6A,12-diyl-S(S)-cyclic-sulfite","","- C17 H28 O5 S -","- C17 H28 O5 S -","- C34 H56 O10 S2 -","2","1","","Andrés García-Granados; Andrés Parra; Francisco Rivas; Alejandro J. Segovia","Seven-Membered Cyclic Sulfite Eudesmane Derivatives: Partial Synthesis, Structural Determination, and Enzymatic Resolution","Journal of Organic Chemistry","2007","72","","643","646","10.1021/jo0620866","","","0.71073","MoKα","","0.0423","0.0414","","","0.1107","0.1116","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022671","17.308","0.004","7.7442","0.0015","7.4721","0.0015","90","","90","","90","","1001.5","0.3","150","1","150","1","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C8.5 H11 Cl N2 O2 -","- C8 H10 N2 O2 -","- C32 H40 N8 O8 -","4","1","","Nanyan Fu; Annette D. Allen; Shinjiro Kobayashi; Thomas T. Tidwell; Sinisa Vukovic; Selvananthan Arumugam; Vladimir V. Popik; Masaaki Mishima","Amino Substituted Bisketenes: Generation, Structure, and Reactivity","Journal of Organic Chemistry","2007","72","","1951","1956","10.1021/jo062090h","","","0.71073","MoKα","","0.1289","0.1131","","","0.2972","0.3128","","","","","","1.114","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022672","6.576","0.004","7.356","0.004","26.19","0.02","90","","90","","90","","1266.6","1.3","193.1","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 O4 -","- C14 H14 O4 -","- C56 H56 O16 -","4","1","","Yoshihito Kayaki; Masafumi Yamamoto; Takao Ikariya","Stereoselective Formation of α-Alkylidene Cyclic Carbonates via Carboxylative Cyclization of Propargyl Alcohols in Supercritical Carbon Dioxide","Journal of Organic Chemistry","2007","72","","647","649","10.1021/jo062094m","","","0.7107","MoKα","","","0.057","","","","0.203","","","","","","0.947","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022673","5.6636","0.0006","17.462","0.0017","16.2007","0.0013","90","","101.992","0.008","90","","1567.2","0.3","140","1","140","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Compound 1","","","- C19 H16 Br O P -","- C19 H16 Br O P -","- C76 H64 Br4 O4 P4 -","4","1","","Sean P. Bew; Rebecca A. Brimage; David L. Hughes; Laurent Legentil; Sunil V. Sharma; Martin A. Wilson","Expedient Synthesis of Substituted (Diphenylphosphinoylmethyl)benzenes","Journal of Organic Chemistry","2007","72","","2655","2658","10.1021/jo062114k","","","0.71073","Mo-Kα","","0.0443","0.0277","","","0.0659","0.069","","","","","","0.963","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022674","10.7984","0.0008","11.0899","0.0015","12.0246","0.0014","100.058","0.01","94.189","0.008","114.106","0.01","1277.4","0.2","140","1","140","1","","","","","","","","4","P -1","-P 1","2","Compound 5","","","- C32 H28 O2 P2 -","- C32 H28 O2 P2 -","- C64 H56 O4 P4 -","2","1","","Sean P. Bew; Rebecca A. Brimage; David L. Hughes; Laurent Legentil; Sunil V. Sharma; Martin A. Wilson","Expedient Synthesis of Substituted (Diphenylphosphinoylmethyl)benzenes","Journal of Organic Chemistry","2007","72","","2655","2658","10.1021/jo062114k","","","0.71073","Mo-Kα","","0.0943","0.0444","","","0.0762","0.0853","","","","","","0.904","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022675","14.196","0.005","9.713","0.005","15.483","0.005","90","0.005","90","0.005","90","0.005","2134.9","1.5","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Ethyl-4-acetyl-3-(methylthio)pyrrole-2-carboxylate","","- C10 H13 N O3 S -","- C10 H13 N O3 S -","- C80 H104 N8 O24 S8 -","8","1","","N. C. Misra; K. Panda; H. Ila; H. Junjappa","An Efficient Highly Regioselective Synthesis of 2,3,4-Trisubstituted Pyrroles by Cycloaddition of Polarized Ketene S,S- and N,S- Acetals with Activated Methylene Isocyanides","Journal of Organic Chemistry","2007","72","","1246","1251","10.1021/jo062139j","","x-ray","0.71069","MoKα","","0.0391","0.0368","","","0.0936","0.0952","","","","","","1.066","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022676","9.592","0.005","10.049","0.005","16.587","0.005","102.764","0.005","100.327","0.005","100.046","0.005","1495.4","1.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Ethyl-4-nitro-3-piperidinopyrrole-2-carboxylate","","- C25 H35 Cl3 N6 O8 -","- C25 H35 Cl3 N6 O8 -","- C50 H70 Cl6 N12 O16 -","2","1","","N. C. Misra; K. Panda; H. Ila; H. Junjappa","An Efficient Highly Regioselective Synthesis of 2,3,4-Trisubstituted Pyrroles by Cycloaddition of Polarized Ketene S,S- and N,S- Acetals with Activated Methylene Isocyanides","Journal of Organic Chemistry","2007","72","","1246","1251","10.1021/jo062139j","","x-ray","0.71069","MoKα","","0.0807","0.055","","","0.1029","0.1405","","","","","","1.099","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022677","10.574","0.005","23.386","0.005","7.047","0.005","90","0.005","106.919","0.005","90","0.005","1667.2","1.5","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","4'-(4-Chloro-phenyl)-5-methylsulfanyl-2-phenyl-[4,5']bioxazolyl","","- C19 H13 Cl N2 O2 S -","- C19 H13 Cl N2 O2 S -","- C76 H52 Cl4 N8 O8 S4 -","4","1","","N. C. Misra; K. Panda; H. Ila; H. Junjappa","An Efficient Highly Regioselective Synthesis of 2,3,4-Trisubstituted Pyrroles by Cycloaddition of Polarized Ketene S,S- and N,S- Acetals with Activated Methylene Isocyanides","Journal of Organic Chemistry","2007","72","","1246","1251","10.1021/jo062139j","","","0.71069","MoKα","","0.0919","0.0602","","","0.1368","0.1982","","","","","","1.566","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022678","5.715","0.0002","11.6127","0.0004","26.4797","0.0009","90","","95.257","0.003","90","","1749.98","0.1","120","2","120","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C14 H19 F3 N2 O3 S2 -","- C14 H19 F3 N2 O3 S2 -","- C56 H76 F12 N8 O12 S8 -","4","2","","Dorota Gryko; Magdalena Zimnicka; Radosław Lipiński","Brønsted Acids as Additives for the Direct Asymmetric Aldol Reaction Catalyzed by L-Prolinethioamides. Direct Evidence for Enamine-Iminium Catalysis","Journal of Organic Chemistry","2007","72","","964","970","10.1021/jo062149k","","","0.71073","MoKα","","0.0528","0.0295","","","0.0593","0.062","","","","","","0.839","","","","has coordinates,has disorder","178405","2020-10-21","18:00:00",""
"4022679","8.7619","0.0009","9.4939","0.0009","10.2874","0.0012","90","","98.502","0.009","90","","846.35","0.15","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C15 H19 F3 N2 O2 S -","- C15 H19 F3 N2 O2 S -","- C30 H38 F6 N4 O4 S2 -","2","1","","Dorota Gryko; Magdalena Zimnicka; Radosław Lipiński","Brønsted Acids as Additives for the Direct Asymmetric Aldol Reaction Catalyzed by L-Prolinethioamides. Direct Evidence for Enamine-Iminium Catalysis","Journal of Organic Chemistry","2007","72","","964","970","10.1021/jo062149k","","","0.71073","MoKα","","0.0234","0.0206","","","0.0504","0.051","","","","","","0.985","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022680","9.801","0.002","8.2176","0.0016","11.755","0.002","90","","112.62","0.03","90","","873.9","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 O8 -","- C18 H18 O8 -","- C36 H36 O16 -","2","0.5","","Thomas Rahn; Van T. H. Nguyen; T. H. Tam Dang; Zafar Ahmed; Karen Methling; Michael Lalk; Christine Fischer; Anke Spannenberg; Peter Langer","Synthesis of 1,3,5-Tricarbonyl Derivatives by Condensation of 1,3-Bis(silyl enol ethers) with Acid Chlorides","Journal of Organic Chemistry","2007","72","","1957","1961","10.1021/jo062153w","","","0.71073","MoKα","","0.057","0.0367","","","0.096","0.1017","","","","","","0.92","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022681","5.709","0.0006","7.647","0.0007","34.415","0.003","90","","90","","90","","1502.5","0.3","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 O7 -","- C16 H22 O7 -","- C64 H88 O28 -","4","1","","Marie-Christine Matos; Paul V. Murphy","Synthesis of Macrolide-Saccharide Hybrids by Ring-Closing Metathesis of Precursors Derived from Glycitols and Benzoic Acids","Journal of Organic Chemistry","2007","72","","1803","1806","10.1021/jo062159l","","","0.71073","MoKα","","0.0424","0.0402","","","0.0975","0.0995","","","","","","1.093","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022682","37.875","0.003","7.1179","0.0005","6.4111","0.0004","90","","90.101","0.001","90","","1728.4","0.2","100","2","100","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C34 H50 O17 -","- C34 H48 O17 -","- C68 H96 O34 -","2","0.5","","Marie-Christine Matos; Paul V. Murphy","Synthesis of Macrolide-Saccharide Hybrids by Ring-Closing Metathesis of Precursors Derived from Glycitols and Benzoic Acids","Journal of Organic Chemistry","2007","72","","1803","1806","10.1021/jo062159l","","","0.71073","MoKα","","0.0458","0.0419","","","0.1067","0.1114","","","","","","1.073","","","","has coordinates,has disorder","178405","2020-10-21","18:00:00",""
"4022683","5.5956","0.0005","12.3776","0.0011","13.8471","0.0013","90","","90","","90","","959.05","0.15","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H9 N3 O S -","- C9 H9 N3 O S -","- C36 H36 N12 O4 S4 -","4","1","","Sivaramakrishnan Muthukrishnan; Sarah M. Mandel; John C. Hackett; Pradeep N. D. Singh; Christopher M. Hadad; Jeanette A. Krause; Anna D. Gudmundsdóttir","Competition between α-Cleavage and Energy Transfer in α-Azidoacetophenones","Journal of Organic Chemistry","2007","72","","2757","2768","10.1021/jo062160k","","","0.71073","MoKα","","0.0454","0.0304","","","0.0675","0.0748","","","","","","1.057","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022684","8.027","0.005","13.87","0.011","36.175","0.014","90","","90","","90","","4028","4","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C26 H26 O3 -","- C26 H26 O3 -","- C208 H208 O24 -","8","1","","Sengodagounder Muthusamy; Janagiraman Krishnamurthi; Srinivasarao Arulananda Babu; Eringathodi Suresh","Anomalous Reaction of Rh~2~(OAc)~4~-Generated Transient Carbonyl Ylides: Chemoselective Synthesis of Epoxy-Bridged Tetrahydropyranone, Oxepanone, Oxocinone, and Oxoninone Ring Systems","Journal of Organic Chemistry","2007","72","","1252","1262","10.1021/jo0621726","","","0.7107","","","0.1388","0.0741","","","0.1885","0.2134","","","","","","1.048","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022685","12.844","0.005","14.204","0.005","13.953","0.003","90","","101.11","0.02","90","","2497.8","1.4","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C29 H28 Cl2 O3 -","- C29 H28 Cl2 O3 -","- C116 H112 Cl8 O12 -","4","1","","Sengodagounder Muthusamy; Janagiraman Krishnamurthi; Srinivasarao Arulananda Babu; Eringathodi Suresh","Anomalous Reaction of Rh~2~(OAc)~4~-Generated Transient Carbonyl Ylides: Chemoselective Synthesis of Epoxy-Bridged Tetrahydropyranone, Oxepanone, Oxocinone, and Oxoninone Ring Systems","Journal of Organic Chemistry","2007","72","","1252","1262","10.1021/jo0621726","","","0.7107","","","0.0689","0.0397","","","0.1059","0.1134","","","","","","1.051","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022686","12.512","0.005","14.172","0.005","13.4","0.007","90","","96.73","0.04","90","","2359.7","1.8","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C27 H26 Cl2 O3 -","- C27 H26 Cl2 O3 -","- C108 H104 Cl8 O12 -","4","1","","Sengodagounder Muthusamy; Janagiraman Krishnamurthi; Srinivasarao Arulananda Babu; Eringathodi Suresh","Anomalous Reaction of Rh~2~(OAc)~4~-Generated Transient Carbonyl Ylides: Chemoselective Synthesis of Epoxy-Bridged Tetrahydropyranone, Oxepanone, Oxocinone, and Oxoninone Ring Systems","Journal of Organic Chemistry","2007","72","","1252","1262","10.1021/jo0621726","","","0.7093","Mokα","","0.0792","0.0522","","","0.15","0.1607","","","","","","1.011","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022687","6.794","0.002","13.029","0.005","15.484","0.004","104.35","0.03","102.48","0.02","104.49","0.04","1227.8","0.7","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C31 H30 O3 -","- C31 H30 O3 -","- C62 H60 O6 -","2","1","","Sengodagounder Muthusamy; Janagiraman Krishnamurthi; Srinivasarao Arulananda Babu; Eringathodi Suresh","Anomalous Reaction of Rh~2~(OAc)~4~-Generated Transient Carbonyl Ylides: Chemoselective Synthesis of Epoxy-Bridged Tetrahydropyranone, Oxepanone, Oxocinone, and Oxoninone Ring Systems","Journal of Organic Chemistry","2007","72","","1252","1262","10.1021/jo0621726","","","0.7093","MoKα","","0.0861","0.0617","","","0.1965","0.213","","","","","","1.005","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022688","40.222","0.016","18.798","0.007","10.308","0.005","90","","90","","90","","7794","6","293","2","293","2","","","","","","","","3","F d d 2","F 2 -2d","43","","","","- C25 H24 O3 -","- C25 H24 O3 -","- C400 H384 O48 -","16","1","","Sengodagounder Muthusamy; Janagiraman Krishnamurthi; Srinivasarao Arulananda Babu; Eringathodi Suresh","Anomalous Reaction of Rh~2~(OAc)~4~-Generated Transient Carbonyl Ylides: Chemoselective Synthesis of Epoxy-Bridged Tetrahydropyranone, Oxepanone, Oxocinone, and Oxoninone Ring Systems","Journal of Organic Chemistry","2007","72","","1252","1262","10.1021/jo0621726","","","0.7093","MoKα","","0.121","0.0697","","","0.2041","0.2612","","","","","","0.96","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022689","8.961","0.008","21.599","0.003","20.543","0.007","90","","90","","90","","3976","4","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C38 H30 Br8 -","- C38 H30 Br8 -","- C152 H120 Br32 -","4","0.5","","Ritesh Nandy; Mahadevan Subramoni; Babu Varghese; Sethuraman Sankararaman","Intramolecular π-Stacking Interaction in a Rigid Molecular Hinge Substituted with 1-(Pyrenylethynyl) Units","Journal of Organic Chemistry","2007","72","","938","944","10.1021/jo062173y","","","0.71073","MoKα","","0.2364","0.0541","","","0.1425","0.2121","","","","","","0.96","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022690","8.0839","0.0017","13.697","0.003","7.4042","0.0016","90","","90","","90","","819.8","0.3","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","try","","","- C7 H6 Cl2 N2 O -","- C7 H6 Cl2 N2 O -","- C28 H24 Cl8 N8 O4 -","4","1","","Jo Alen; Liliana Dobrzańska; Wim M. De Borggraeve; Frans Compernolle","Synthesis of 2(1H)-Pyrazinone Phosphonates via an Arbuzov-type Reaction","Journal of Organic Chemistry","2007","72","","1055","1057","10.1021/jo062176a","","","0.71073","MoKα","","0.0667","0.0586","","","0.1066","0.1094","","","","","","1.213","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022691","9.9446","0.0008","9.985","0.0008","11.1069","0.0008","83.49","0.001","71.078","0.001","60.611","0.001","907.62","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 Br N O -","- C22 H22 Br N O -","- C44 H44 Br2 N2 O2 -","2","1","","Lei Zhang; Helena C. Malinakova","Copper-Catalyzed Multicomponent Cascade Process for the Synthesis of Hexahydro-1H-isoindolones","Journal of Organic Chemistry","2007","72","","1484","1487","10.1021/jo0621773","","","0.71073","MoKα","","0.0432","0.035","","","0.0819","0.0834","","","","","","0.969","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022692","8.6239","0.0006","9.7771","0.0007","12.6087","0.0009","103.987","0.001","98.481","0.001","113.074","0.001","913.47","0.11","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 Br N O -","- C22 H22 Br N O -","- C44 H44 Br2 N2 O2 -","2","1","","Lei Zhang; Helena C. Malinakova","Copper-Catalyzed Multicomponent Cascade Process for the Synthesis of Hexahydro-1H-isoindolones","Journal of Organic Chemistry","2007","72","","1484","1487","10.1021/jo0621773","","","0.71073","MoKα","","0.0351","0.0315","","","0.0874","0.0885","","","","","","1.059","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022693","10.0143","0.0008","18.0289","0.0013","13.7693","0.0012","90","","110.838","0.009","90","","2323.4","0.4","298","","","","","","","","","","Local laboratory","6","P 1 21 1","P 2yb","4","","","","- C48 H55 B N4 O7 S2 -","- C48 H55 B N4 O7 S2 -","- C96 H110 B2 N8 O14 S4 -","2","1","","Jan Blid; Olaf Panknin; Pavel Tuzina; Peter Somfai","Lewis Acid Mediated Asymmetric [2,3]-Sigmatropic Rearrangement of Allylic Amines. Scope and Mechanistic Investigation","Journal of Organic Chemistry","2007","72","","1294","1300","10.1021/jo062178v","","","0.71073","MoKα","","0.105","0.056","","","0.096","0.117","","","","","","1.21","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022694","7.2921","0.0006","10.466","0.0009","13.7176","0.0012","90.3","0.02","99.22","0.02","107.86","0.02","981.92","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H21 N O7 S -","- C19 H21 N O7 S -","- C38 H42 N2 O14 S2 -","2","1","","Marie-Laure Teyssot; Anh-Tuan Lormier; Isabelle Chataigner; Serge R. Piettre","Cross-Diels-Alder Reactions of 6-Oxo-1-Sulfonyl-1,6-Dihydropyridine-3-Carboxylates","Journal of Organic Chemistry","2007","72","","2364","2373","10.1021/jo062186b","","","0.71073","MoKα","","0.0564","0.0415","","","0.0982","0.1037","","","","","","0.938","","","","has coordinates","178405","2020-10-21","18:00:00",""
"4022695","25.8232","0.0013","8.6831","0.0004","27.969","0.0014","90","","105.377","0.001","90","","6046.9","0.5","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C27 H37 N O9 S Si -","- C27 H37 N O9 S Si -","- C216 H296 N8 O72 S8 Si8 -","8","1","","Marie-Laure Teyssot; Anh-Tuan Lormier; Isabelle Chataigner; Serge R. Piettre","Cross-Diels-Alder Reactions of 6-Oxo-1-Sulfonyl-1,6-Dihydropyridine-3-Carboxylates","Journal of Organic Chemistry","2007","72","","2364","2373","10.1021/jo062186b","","","0.71073","MoKα","","0.0688","0.0445","","","0.1128","0.1224","","","","","","0.915","","","","has coordinates,has disorder","178405","2020-10-21","18:00:00",""
"4022696","9.9667","0.0008","11.6617","0.0009","13.5269","0.0011","90","","90","","90","","1572.2","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H19 N O4 S -","- C16 H19 N O4 S -","- C64 H76 N4 O16 S4 -","4","1","","Paul Evans","The Double Reduction of Cyclic Sulfonamides for the Synthesis of (4S-Phenylpyrrolidin-2R-yl)methanol and 2S-Methyl-4S-phenylpyrrolidine","Journal of Organic Chemistry","2007","72","","1830","1833","10.1021/jo062189o","","","0.71073","MoKα","","0.0407","0.0381","","","0.0953","0.0975","","","","","","1.053","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022697","8.9647","0.001","9.7275","0.0011","12.0253","0.0013","90","","90","","90","","1048.7","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H13 N O2 S -","- C11 H13 N O2 S -","- C44 H52 N4 O8 S4 -","4","1","","Paul Evans","The Double Reduction of Cyclic Sulfonamides for the Synthesis of (4S-Phenylpyrrolidin-2R-yl)methanol and 2S-Methyl-4S-phenylpyrrolidine","Journal of Organic Chemistry","2007","72","","1830","1833","10.1021/jo062189o","","","0.71073","MoKα","","0.0319","0.0309","","","0.0778","0.079","","","","","","1.065","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022698","17.7606","0.0017","10.0435","0.0009","20.3393","0.0019","90","","90","","90","","3628.1","0.6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C24 H19 N O -","- C24 H19 N O -","- C192 H152 N8 O8 -","8","1","","Xiyuan Yuan; Xiaobing Xu; Xiaobo Zhou; Jiwei Yuan; Lugen Mai; Yanzhong Li","Copper-Catalyzed Double N-Alkenylation of Amides: An Efficient Synthesis of Di- or Trisubstituted N-Acylpyrroles","Journal of Organic Chemistry","2007","72","","1510","1513","10.1021/jo062194s","","","0.71073","MoKα","","0.0917","0.0541","","","0.1258","0.1392","","","","","","0.915","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022699","28.098","0.002","17.5203","0.0017","15.2068","0.0012","90","","107.25","0.01","90","","7149.3","1.1","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","9,10-Bis[4,5-bis(2-hydroxyethylthio)-1,3-dithiol-2-ylidene]-9,10 -dihydroanthracene, methanol solvate","","- C30.5 H38 O6.5 S8 -","- C30.3 H35.17 O6.29 S8 -","- C242.4 H281.36 O50.32 S64 -","8","1","","Christian A. Christensen; Andrei S. Batsanov; Martin R. Bryce","Thiolated π-Extended Tetrathiafulvalenes: Versatile Multifunctional π-Systems","Journal of Organic Chemistry","2007","72","","1301","1308","10.1021/jo062199p","","","0.71073","MoKα","","0.1178","0.0878","","","0.2815","0.3032","","","","","","1.389","","","","has coordinates,has disorder","178405","2020-10-21","18:00:00",""
"4022700","28.049","0.004","17.779","0.002","14.054","0.002","90","","104.92","0.01","90","","6772.2","1.6","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","9,10-Bis[4,5-bis(2-hydroxyethylthio)-1,3-dithiol-2-ylidene]-9,10 -dihydroanthracene, acetonitrile solvate","","- C31 H32.5 N1.5 O4 S8 -","- C30.6 H28 N0.5 O4 S8 -","- C244.8 H224 N4 O32 S64 -","8","1","","Christian A. Christensen; Andrei S. Batsanov; Martin R. Bryce","Thiolated π-Extended Tetrathiafulvalenes: Versatile Multifunctional π-Systems","Journal of Organic Chemistry","2007","72","","1301","1308","10.1021/jo062199p","","","0.71073","MoKα","","0.1407","0.0741","","","0.1978","0.233","","","","","","1.347","","","","has coordinates,has disorder","178406","2020-10-21","18:00:00",""
"4022701","12.795","0.002","13.393","0.002","18.509","0.003","90","","103.89","0.01","90","","3079","0.8","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","cis-1-(5',5"")-{9,10-Bis(4-methylthio-1,3-dithiol-2-ylidene) -9,10-dihydroanthracene}-2,8-dithiacyclo-octaphane, dichloromethane monosolvate","","- C28 H26 Cl2 S8 -","- C28 H26 Cl2 S8 -","- C112 H104 Cl8 S32 -","4","1","","Christian A. Christensen; Andrei S. Batsanov; Martin R. Bryce","Thiolated π-Extended Tetrathiafulvalenes: Versatile Multifunctional π-Systems","Journal of Organic Chemistry","2007","72","","1301","1308","10.1021/jo062199p","","","0.71073","MoKα","","0.0342","0.0303","","","0.0785","0.0809","","","","","","1.066","","","","has coordinates,has disorder","178406","2020-10-21","18:00:00",""
"4022702","12.668","0.002","15.949","0.003","17.336","0.003","91.89","0.01","90.39","0.01","109.02","0.01","3309","1","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","cis-1-(5',5"")-{9,10-Bis(4-methylthio-1,3-dithiol-2-ylidene) -9,10-dihydroanthracene}-2,8-dithiacyclo-octaphane, dichloromethane sesquisolvate","","- C28.5 H27 Cl3 S8 -","- C28.5 H26.5 Cl3 S8 -","- C114 H106 Cl12 S32 -","4","2","","Christian A. Christensen; Andrei S. Batsanov; Martin R. Bryce","Thiolated π-Extended Tetrathiafulvalenes: Versatile Multifunctional π-Systems","Journal of Organic Chemistry","2007","72","","1301","1308","10.1021/jo062199p","","","0.71073","MoKα","","0.0596","0.0509","","","0.1181","0.124","","","","","","1.094","","","","has coordinates,has disorder","178406","2020-10-21","18:00:00",""
"4022703","5.9299","0.0008","8.176","0.001","27.17","0.003","90","","90","","90","","1317.3","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C18 H16 O -","- C18 H16 O -","- C72 H64 O4 -","4","1","","Long-Wu Ye; Xiu-Li Sun; Chuan-Ying Li; Yong Tang","Tetrahydrothiophene-Catalyzed Synthesis of Benzo[n.1.0] Bicycloalkanes","Journal of Organic Chemistry","2007","72","","1335","1340","10.1021/jo062209m","","","0.71073","MoKα","","0.0576","0.0407","","","0.0702","0.075","","","","","","0.883","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022704","9.59","0.02","10.15","0.02","10.58","0.04","90","","100.32","0.07","90","","1013","5","123.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H27 Fe N Si -","- C22 H27 Fe N Si -","- C44 H54 Fe2 N2 Si2 -","2","1","","Shin-ichi Fukuzawa; Masahisa Yamamoto; Satoshi Kikuchi","Unexpected 1,5-Dilithiation of Chiral o-TMS Blocked (Dimethylamino)phenylmethylferrocene: An Alternative Approach to Chiral Ferrocenyl 1,5-Diphosphanes","Journal of Organic Chemistry","2007","72","","1514","1517","10.1021/jo062210l","","","0.7107","MoKα","","","0.064","","","","0.066","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022705","11.807","0.013","16.361","0.015","18.45","0.03","90","","98.07","0.03","90","","3528","8","123.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C43 H39 Fe N P2 -","- C43 H39 Fe N P2 -","- C172 H156 Fe4 N4 P8 -","4","2","","Shin-ichi Fukuzawa; Masahisa Yamamoto; Satoshi Kikuchi","Unexpected 1,5-Dilithiation of Chiral o-TMS Blocked (Dimethylamino)phenylmethylferrocene: An Alternative Approach to Chiral Ferrocenyl 1,5-Diphosphanes","Journal of Organic Chemistry","2007","72","","1514","1517","10.1021/jo062210l","","","0.7107","MoKα","","","0.0386","","","","0.0392","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022706","7.8209","0.0003","16.504","0.0007","9.119","0.0003","90","","112.812","0.0008","90","","1084.98","0.07","113.2","","","","","","","","","","","2","P 1 21/a 1","-P 2yab","14","","","","- C30 H34 -","- C30 H34 -","- C60 H68 -","2","0.5","","Masahiko Shibahara; Motonori Watanabe; Tetsuo Iwanaga; Keiko Ideta; Teruo Shinmyozu","Synthesis, Structure, and Transannular π-π Interaction of Multilayered [3.3]Metacyclophanes","Journal of Organic Chemistry","2007","72","","2865","2877","10.1021/jo062220m","","","0.7107","MoKα","","","0.0435","","","","0.1235","","","","","","1.682","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022707","29.2281","","11.349","0.0001","29.134","","90","","18.4827","0.0002","90","","3063.67","0.05","123.2","","","","","","","","","","","2","P 1 21/a 1","-P 2yab","14","","","","- C42 H48 -","- C42 H48 -","- C168 H192 -","4","1","","Masahiko Shibahara; Motonori Watanabe; Tetsuo Iwanaga; Keiko Ideta; Teruo Shinmyozu","Synthesis, Structure, and Transannular π-π Interaction of Multilayered [3.3]Metacyclophanes","Journal of Organic Chemistry","2007","72","","2865","2877","10.1021/jo062220m","","","0.7107","MoKα","","","0.0424","","","","0.1215","","","","","","1.399","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022708","17.369","0.0008","7.6235","0.0005","23.486","0.001","90","","96.969","0.002","90","","3086.9","0.3","113.2","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C42 H44 O2 -","- C42 H44 O2 -","- C168 H176 O8 -","4","0.5","","Masahiko Shibahara; Motonori Watanabe; Tetsuo Iwanaga; Keiko Ideta; Teruo Shinmyozu","Synthesis, Structure, and Transannular π-π Interaction of Multilayered [3.3]Metacyclophanes","Journal of Organic Chemistry","2007","72","","2865","2877","10.1021/jo062220m","","","0.7107","MoKα","","","0.0501","","","","0.1343","","","","","","1.179","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022709","22.9354","0.0003","11.1015","0.0002","24.1439","0.0004","90","","94.5235","0.0006","90","","6128.3","0.2","113.2","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C42 H40 O4 -","- C42 H40 O4 -","- C336 H320 O32 -","8","1","","Masahiko Shibahara; Motonori Watanabe; Tetsuo Iwanaga; Keiko Ideta; Teruo Shinmyozu","Synthesis, Structure, and Transannular π-π Interaction of Multilayered [3.3]Metacyclophanes","Journal of Organic Chemistry","2007","72","","2865","2877","10.1021/jo062220m","","","0.7107","MoKα","","","0.0421","","","","0.1171","","","","","","1.233","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022710","8.0516","0.0003","8.2455","0.0003","25.6436","0.0008","90","","90","","90","","1702.47","0.1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H22 N2 O2 -","- C17 H22 N2 O2 -","- C68 H88 N8 O8 -","4","1","","François Couty; Olivier David; Bénédicte Larmanjat; Jérôme Marrot","Strained Azetidinium Ylides: New Reagents for Cyclopropanation","Journal of Organic Chemistry","2007","72","","1058","1061","10.1021/jo062221e","","","0.71073","MoKα","","0.0692","0.0454","","","0.1193","0.1408","","","","","","1.08","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022711","10.094","0.0005","12.5122","0.0004","13.8767","0.0007","90","","90","","90","","1752.6","0.14","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H24 N2 O -","- C19 H24 N2 O -","- C76 H96 N8 O4 -","4","1","","François Couty; Olivier David; Bénédicte Larmanjat; Jérôme Marrot","Strained Azetidinium Ylides: New Reagents for Cyclopropanation","Journal of Organic Chemistry","2007","72","","1058","1061","10.1021/jo062221e","","","0.71073","MoKα","","0.0918","0.05","","","0.1271","0.1531","","","","","","1.007","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022712","8.5497","0.0003","13.0555","0.0005","15.7323","0.0007","90","","90","","90","","1756.05","0.12","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H24 N2 O2 -","- C18 H24 N2 O2 -","- C72 H96 N8 O8 -","4","1","","François Couty; Olivier David; Bénédicte Larmanjat; Jérôme Marrot","Strained Azetidinium Ylides: New Reagents for Cyclopropanation","Journal of Organic Chemistry","2007","72","","1058","1061","10.1021/jo062221e","","","0.71073","MoKα","","0.1036","0.0445","","","0.1011","0.1235","","","","","","1.028","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022713","13.1383","0.0005","13.138","","43.66","0.002","90","","90","","90","","7536.4","0.5","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H28 N2 O2 -","- C24 H28 N2 O2 -","- C288 H336 N24 O24 -","12","3","","François Couty; Olivier David; Bénédicte Larmanjat; Jérôme Marrot","Strained Azetidinium Ylides: New Reagents for Cyclopropanation","Journal of Organic Chemistry","2007","72","","1058","1061","10.1021/jo062221e","","","0.71073","MoKα","","0.2596","0.083","","","0.2095","0.2814","","","","","","0.868","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022714","10.063","0.005","10.356","0.005","12.085","0.006","90","","111.333","0.007","90","","1173.1","1","153","2","153","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C26 H30 Cl N3 -","- C26 H30 Cl N3 -","- C52 H60 Cl2 N6 -","2","0.5","","Laura D. Shirtcliff; Michael M. Haley; Rainer Herges","CuCl-Induced Formation and Migration of Isoindazolyl Carbenoids","Journal of Organic Chemistry","2007","72","","2411","2418","10.1021/jo0622274","","","0.71073","MoKα","","0.1687","0.0715","","","0.1227","0.156","","","","","","0.973","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022715","16.1958","0.0013","11.0313","0.0009","16.4263","0.0013","90","","111.492","0.002","90","","2730.7","0.4","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H34 Cl N3 -","- C32 H34 Cl N3 -","- C128 H136 Cl4 N12 -","4","1","","Laura D. Shirtcliff; Michael M. Haley; Rainer Herges","CuCl-Induced Formation and Migration of Isoindazolyl Carbenoids","Journal of Organic Chemistry","2007","72","","2411","2418","10.1021/jo0622274","","","0.71073","MoKα","","0.1056","0.0551","","","0.0961","0.1155","","","","","","1.027","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022716","8.9925","0.0014","14.746","0.002","17.638","0.003","78.435","0.003","83.065","0.003","74.484","0.002","2202.2","0.6","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","","","- C48 H60 O6 -","- C48 H60 O6 -","- C96 H120 O12 -","2","1","","Ramavarma Luxmi Varma; Viswanathan Bhagavathy Ganga; Eringathodi Suresh","Photochemical Rearrangement of Calix[4]arene-Derived Bis(spirodienones): Formation of a New Macrocycle","Journal of Organic Chemistry","2007","72","","1017","1019","10.1021/jo062231f","","","0.71073","MoKα","","0.0915","0.0722","","","0.2004","0.217","","","","","","1.034","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022717","6.2474","0.0015","10.004","0.002","10.834","0.003","104.949","0.004","105.72","0.004","96.757","0.004","616.8","0.3","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H11 I O -","- C15 H11 I O -","- C30 H22 I2 O2 -","2","1","","Shilpa A. Worlikar; Tanay Kesharwani; Tuanli Yao; Richard C. Larock","Synthesis of 3,4-Disubstituted 2H-Benzopyrans through C-C Bond Formation via Electrophilic Cyclization","Journal of Organic Chemistry","2007","72","","1347","1353","10.1021/jo062234s","","","0.71073","MoKα","","0.0328","0.0305","","","0.0875","0.0918","","","","","","1.034","","","","has coordinates,has disorder","178406","2020-10-21","18:00:00",""
"4022718","5.0184","0.0007","7.3717","0.001","18.44","0.002","90","","90","","90","","682.18","0.16","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4-methylcarboxy2-methyl-3-sydnone N-oxide","","- C5 H6 N2 O5 -","- C5 H6 N2 O5 -","- C20 H24 N8 O20 -","4","1","","D. Scott Bohle; Lindsey E. McQuade; Inna Perepichka; Lijuan Zhang","Methylation of Sydnone N-Oxides: Kinetic and Thermodynamic Control in the Alkylation Site of an Electron-Rich Heterocycle","Journal of Organic Chemistry","2007","72","","3625","3631","10.1021/jo062235k","","","0.71073","MoKα","","0.0608","0.0603","","","0.1333","0.1341","","","","","","0.97","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022719","31.445","0.01","4.8418","0.0016","9.487","0.003","90","","98.57","0.005","90","","1428.2","0.8","100","2","373","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","4-methylcarboxysydnoneN-oxide","","","- C5 H6 N2 O5 -","- C5 H6 N2 O5 -","- C40 H48 N16 O40 -","8","1","","D. Scott Bohle; Lindsey E. McQuade; Inna Perepichka; Lijuan Zhang","Methylation of Sydnone N-Oxides: Kinetic and Thermodynamic Control in the Alkylation Site of an Electron-Rich Heterocycle","Journal of Organic Chemistry","2007","72","","3625","3631","10.1021/jo062235k","","","0.71073","MoKα","","0.107","0.0404","","","0.0553","0.0675","","","","","","0.928","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022720","11.187","0.006","36.661","0.018","12.087","0.006","90","","106.921","0.009","90","","4742","4","123","2","123","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C48 H40 Cl6 N O2 P3 Pd -","- C48 H40 Cl6 N O2 P3 Pd -","- C192 H160 Cl24 N4 O8 P12 Pd4 -","4","2","","Weicheng Zhang; Xumu Zhang","Highly Enantioselective Hydrogenation of α-Dehydroamino Esters and Itaconates with Triphosphorous Bidentate Ligands and the Unprecedented Solvent Effect Thereof","Journal of Organic Chemistry","2007","72","","1020","1023","10.1021/jo0622429","","","0.71073","MoKα","","0.0913","0.0692","","","0.1354","0.1475","","","","","","1.022","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022721","7.7309","0.0003","9.8742","0.0004","10.3592","0.0004","63.33","0.001","85.655","0.001","72.561","0.001","672.57","0.05","180","1","180","1","","","","","","","","5","P 1","P 1","1","","","","- C14 H14 Br2 N2 O -","- C14 H14 Br2 N2 O -","- C28 H28 Br4 N4 O2 -","2","2","","Costa Metallinos; Travis Dudding; Josh Zaifman; Jennifer L. Chaytor; Nicholas J. Taylor","An Experimental and Theoretical Study of the Asymmetric Lithiation of 1,2,3,5,6,7-Hexahydro-3a,4a-diazacyclopenta[def]phenanthren-4-one","Journal of Organic Chemistry","2007","72","","957","963","10.1021/jo062244t","","","0.71073","MoKα","","0.0283","0.0259","","","0.0484","0.0487","","","","","","1.3","","","","has coordinates,has disorder","178406","2020-10-21","18:00:00",""
"4022722","9.3503","0.0003","9.8156","0.0003","9.7374","0.0005","90","","116.441","0.001","90","","800.2","0.05","153","2","153","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H21 N O2 S -","- C17 H21 N O2 S -","- C34 H42 N2 O4 S2 -","2","1","","Zhiyan Huang; Hongshan Lai; Yong Qin","Syntheses of Novel Chiral Sulfinamido Ligands and Their Applications in Diethylzinc Additions to Aldehydes","Journal of Organic Chemistry","2007","72","","1373","1378","10.1021/jo062249q","","","0.71073","MoKα","","0.0228","0.0224","","","0.0603","0.0606","","","","","","1.007","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022723","12.934","0.007","5.96","0.003","16.38","0.009","90","","94.928","0.002","90","","1258","1.1","173.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H31 N O3 S2 -","- C27 H31 N O3 S2 -","- C54 H62 N2 O6 S4 -","2","1","","Akio Kamimura; Hidenori Okawa; Yuki Morisaki; Shingo Ishikawa; Hidemitsu Uno","Asymmetric Thio-Michael/Nucleophilic Addition Domino Reaction with Chiral N-Sulfinimines","Journal of Organic Chemistry","2007","72","","3569","3572","10.1021/jo062251h","","","0.7107","MoKα","","0.0538","0.0478","","","0.1278","0.1349","","","","","","1.054","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4022724","10.09","0.006","8.726","0.005","14.035","0.009","90","","92.408","0.014","90","","1234.6","1.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H33 N O3 S2 -","- C24 H33 N O3 S2 -","- C48 H66 N2 O6 S4 -","2","1","","Akio Kamimura; Hidenori Okawa; Yuki Morisaki; Shingo Ishikawa; Hidemitsu Uno","Asymmetric Thio-Michael/Nucleophilic Addition Domino Reaction with Chiral N-Sulfinimines","Journal of Organic Chemistry","2007","72","","3569","3572","10.1021/jo062251h","","","0.7107","MoKα","","0.0815","0.0674","","","0.1617","0.1791","","","","","","1.004","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022725","5.148","0.002","10.506","0.005","27.52","0.012","90","","90","","90","","1488.4","1.1","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H10 O S4 -","- C15 H10 O S4 -","- C60 H40 O4 S16 -","4","1","","Yao-Peng Zhao; Li-Zhu Wu; Gang Si; Yan Liu; Hai Xue; Li-Ping Zhang; Chen-Ho Tung","Synthesis, Spectroscopic, Electrochemical and Pb^2+^-Binding Studies of Tetrathiafulvalene Acetylene Derivatives","Journal of Organic Chemistry","2007","72","","3632","3639","10.1021/jo0622577","","","0.71073","MoKα","","0.0435","0.0332","","","0.0752","0.0801","","","","","","1.076","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022726","10.342","0.003","8.616","0.003","22.954","0.008","90","","94.343","0.005","90","","2039.3","1.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H42 Cl2 N2 O6 -","- C42 H34 Cl2 N2 O4 -","- C84 H68 Cl4 N4 O8 -","2","0.5","","Zhenzhen Dong; Xiaozhong Liu; Glenn P. A. Yap; Joseph M. Fox","Two-Dimensional Scaffolds for the Parallel Alignment of Rod-Shaped Conjugated Molecules","Journal of Organic Chemistry","2007","72","","617","625","10.1021/jo062261i","","","0.71073","MoKα","","0.0573","0.0523","","","0.1442","0.1486","","","","","","1.052","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022727","5.925","0.003","8.413","0.004","12.849","0.007","71.28","0.006","82.247","0.005","80.09","0.005","595.4","0.5","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H28 N2 O4 -","- C30 H28 N2 O4 -","- C30 H28 N2 O4 -","1","0.5","","Zhenzhen Dong; Xiaozhong Liu; Glenn P. A. Yap; Joseph M. Fox","Two-Dimensional Scaffolds for the Parallel Alignment of Rod-Shaped Conjugated Molecules","Journal of Organic Chemistry","2007","72","","617","625","10.1021/jo062261i","","","0.71073","MoKα","","0.0758","0.0558","","","0.1335","0.1445","","","","","","1.045","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022728","14.719","0.002","15.941","0.003","34.242","0.005","90","","97.345","0.003","90","","7968","2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C81 H93 Cl2 N9 O14 -","- C81 H91 Cl2 N9 O14 -","- C324 H364 Cl8 N36 O56 -","4","1","","Zhenzhen Dong; Xiaozhong Liu; Glenn P. A. Yap; Joseph M. Fox","Two-Dimensional Scaffolds for the Parallel Alignment of Rod-Shaped Conjugated Molecules","Journal of Organic Chemistry","2007","72","","617","625","10.1021/jo062261i","","","0.71073","MoKα","","0.1043","0.0839","","","0.2336","0.245","","","","","","1.619","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022729","6.3813","0.0003","9.4373","0.0004","16.948","0.0009","89.7","0.002","81.267","0.003","87.576","0.003","1007.91","0.08","160","1","160","1","","","","","","","","3","P 1","P 1","1","","","","- C21 H32 O5 -","- C21 H32 O5 -","- C42 H64 O10 -","2","2","","Martin A. Lovchik; Andreas Goeke; Georg Fráter","Cyclobutanones through S~N~i' Ring Closure, a Mechanistic Study","Journal of Organic Chemistry","2007","72","","2427","2433","10.1021/jo062264v","","","0.71073","MoKα","","0.0562","0.0482","","","0.1277","0.1344","","","","","","1.092","","","","has coordinates,has disorder","178406","2020-10-21","18:00:00",""
"4022730","8.2145","0.0019","11.706","0.003","23.345","0.004","75.906","0.017","85.643","0.017","71.19","0.03","2061","0.8","294.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C22 H26 N3 O3 -","- C22 H26 N3 O3 -","- C88 H104 N12 O12 -","4","2","","Shin'ichi Nakatsuji; Masahiro Fujino; Satoko Hasegawa; Hiroki Akutsu; Jun-ichi Yamada; Vladimir S. Gurman; Andrey Kh.Vorobiev","Azobenzene Derivatives Carrying a Nitroxide Radical","Journal of Organic Chemistry","2007","72","","2021","2029","10.1021/jo062266f","","","0.71069","MoKα","","","0.0462","","","","0.0621","","","","","","1.106","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022731","5.773","0.002","11.72","0.002","30.012","0.002","90","","93.34","0.02","90","","2027.2","0.8","296.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H26 N3 O3 -","- C22 H26 N3 O3 -","- C88 H104 N12 O12 -","4","1","","Shin'ichi Nakatsuji; Masahiro Fujino; Satoko Hasegawa; Hiroki Akutsu; Jun-ichi Yamada; Vladimir S. Gurman; Andrey Kh.Vorobiev","Azobenzene Derivatives Carrying a Nitroxide Radical","Journal of Organic Chemistry","2007","72","","2021","2029","10.1021/jo062266f","","","0.71069","MoKα","","","0.055","","","","0.0694","","","","","","1.118","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022732","5.973","0.006","42.691","0.009","12.856","0.007","90","","100.52","0.07","90","","3223","3","303.2","","303.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C33 H48 N3 O4 -","- C33 H48 N3 O4 -","- C132 H192 N12 O16 -","4","1","","Shin'ichi Nakatsuji; Masahiro Fujino; Satoko Hasegawa; Hiroki Akutsu; Jun-ichi Yamada; Vladimir S. Gurman; Andrey Kh.Vorobiev","Azobenzene Derivatives Carrying a Nitroxide Radical","Journal of Organic Chemistry","2007","72","","2021","2029","10.1021/jo062266f","","","0.7107","MoK'a","","0.0611","0.061","","0.056","","0.056","","","1.957","","","1.96","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022733","6.675","0.0007","11.85","0.002","20.811","0.002","75.756","0.008","81.813","0.003","75.557","0.002","1539.3","0.4","296.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C32 H46 N3 O4 -","- C32 H46 N3 O4 -","- C64 H92 N6 O8 -","2","1","","Shin'ichi Nakatsuji; Masahiro Fujino; Satoko Hasegawa; Hiroki Akutsu; Jun-ichi Yamada; Vladimir S. Gurman; Andrey Kh.Vorobiev","Azobenzene Derivatives Carrying a Nitroxide Radical","Journal of Organic Chemistry","2007","72","","2021","2029","10.1021/jo062266f","","","0.71069","MoKα","","","0.1563","","","","0.1137","","","","","","1.207","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022734","8.998","0.003","34.477","0.003","11.1675","0.0004","90","","105.724","0.0008","90","","3334.6","1.3","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H47 N4 O6 -","- C33 H47 N4 O6 -","- C132 H188 N16 O24 -","4","1","","Shin'ichi Nakatsuji; Masahiro Fujino; Satoko Hasegawa; Hiroki Akutsu; Jun-ichi Yamada; Vladimir S. Gurman; Andrey Kh.Vorobiev","Azobenzene Derivatives Carrying a Nitroxide Radical","Journal of Organic Chemistry","2007","72","","2021","2029","10.1021/jo062266f","","","0.71069","MoKα","","0.2757","0.121","","0.1048","0.0816","0.0816","","","","","","1.1299","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022735","22.169","0.004","6.512","0.0013","28.437","0.006","90","","95.994","0.004","90","","4082.8","1.4","293","2","293","2","","","","","","","synthesis","4","P 1 21 1","P 2yb","4","","","","- C26 H39 N2 O7 -","- C26 H39 N2 O7 -","- C156 H234 N12 O42 -","6","3","","Josep Comelles; Àlex Pericas; Marcial Moreno-Mañas; Adelina Vallribera; Galí Drudis-Solé; Agusti Lledos; Teodor Parella; Anna Roglans; Santiago García-Granda; Laura Roces-Fernández","Highly Enantioselective Electrophilic Amination and Michael Addition of Cyclic β-Ketoesters Induced by Lanthanides and (S,S)-ip-pybox: The Mechanism","Journal of Organic Chemistry","2007","72","","2077","2087","10.1021/jo0622678","","","0.71073","MoKα","","0.1985","0.1026","","","0.1732","0.2108","","","","","","1.073","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022736","9.1937","0.0005","11.5288","0.0006","12.5921","0.0007","87.648","0.001","80.507","0.001","71.088","0.001","1245.22","0.12","293","2","293","2","","","","","","","synthesis","4","P 1","P 1","1","","","","- C21 H31 N5 O6 -","- C21 H31 N5 O6 -","- C42 H62 N10 O12 -","2","2","","Josep Comelles; Àlex Pericas; Marcial Moreno-Mañas; Adelina Vallribera; Galí Drudis-Solé; Agusti Lledos; Teodor Parella; Anna Roglans; Santiago García-Granda; Laura Roces-Fernández","Highly Enantioselective Electrophilic Amination and Michael Addition of Cyclic β-Ketoesters Induced by Lanthanides and (S,S)-ip-pybox: The Mechanism","Journal of Organic Chemistry","2007","72","","2077","2087","10.1021/jo0622678","","","0.71073","MoKα","","0.1531","0.0889","","","0.1868","0.218","","","","","","1.051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4022737","27.8483","0.001","5.3181","0.0002","11.8833","0.0004","90","","101.357","0.002","90","","1725.46","0.11","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(4-chlorobutyl)-2-cyanocyclopentyl 4-nitrobenzoate","","- C17 H19 Cl N2 O4 -","- C17 H19 Cl N2 O4 -","- C68 H76 Cl4 N8 O16 -","4","1","","Fraser F. Fleming; Viet Anh Vu; Brian C. Shook; Moshfiqur Rahman; Omar W. Steward","Metalated Nitriles: Chelation-Controlled Cyclizations to cis and trans Hydrindanes and Decalins","Journal of Organic Chemistry","2007","72","","1431","1436","10.1021/jo062270r","","","0.71073","MoKα","","0.1417","0.0681","","","0.0848","0.0908","","","","","","1.919","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022738","11.604","0.0005","13.281","0.0006","10.782","0.0005","90","","111.354","0.002","90","","1547.57","0.12","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","7a-cyanooctahydro-1-H-inden-1-yl 4-nitrobenzoate","","- C17 H18 N2 O4 -","- C17 H18 N2 O4 -","- C68 H72 N8 O16 -","4","1","","Fraser F. Fleming; Viet Anh Vu; Brian C. Shook; Moshfiqur Rahman; Omar W. Steward","Metalated Nitriles: Chelation-Controlled Cyclizations to cis and trans Hydrindanes and Decalins","Journal of Organic Chemistry","2007","72","","1431","1436","10.1021/jo062270r","","","0.71073","MoKα","","0.0463","0.0318","","","0.072","0.0778","","","","","","0.981","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022739","12.709","0.0005","13.4048","0.0005","16.4736","0.0006","67.77","0.001","70.213","0.001","74.126","0.001","2410.16","0.16","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C52 H52 Cl3 N4 O8 S2 -","- C52.5 H52.5 Cl1.5 N4 O8 S2 -","- C105 H105 Cl3 N8 O16 S4 -","2","1","","I-Ting Ho; Gene-Hsiang Lee; Wen-Sheng Chung","Synthesis of Upper-Rim Allyl- and p-Methoxyphenylazocalix[4]arenes and Their Efficiencies in Chromogenic Sensing of Hg^2+^ Ion","Journal of Organic Chemistry","2007","72","","2434","2442","10.1021/jo062280s","","","0.71073","MoKα","","0.1059","0.0865","","","0.1933","0.2048","","","","","","1.126","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022740","7.191","0.002","32.813","0.01","8.726","0.003","90","","90.048","0.006","90","","2059","1.1","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H27 Br O6 -","- C19 H22 Br O6 -","- C76 H88 Br4 O24 -","4","2","","Yoshio Nakai; Masatoshi Kawahata; Kentaro Yamaguchi; Kei Takeda","Stereocontrolled Construction of Seven-Membered Carbocycles Using a Combination of Brook Rearrangement-Mediated [3 + 4] Annulation and Epoxysilane Rearrangement","Journal of Organic Chemistry","2007","72","","1379","1387","10.1021/jo062282c","","","0.71073","MoKα","","0.2017","0.0521","","","0.1174","0.162","","","","","","0.793","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022741","16.5954","0.0015","16.5954","0.0015","8.2166","0.0011","90","","90","","90","","2262.9","0.4","298","2","298","2","","","","","","","","4","I -4","I -4","82","","","","- C11.25 H16.25 Cl0.75 O -","- C11.25 H16 Cl0.75 O -","- C90 H128 Cl6 O8 -","8","1","","Daniele Casarini; Lodovico Lunazzi; Michele Mancinelli; Andrea Mazzanti","Conformation and Stereodynamics of Symmetrically Ortho-Disubstituted Aryl Carbinols and Aryl Ethers","Journal of Organic Chemistry","2007","72","","998","1004","10.1021/jo062289u","","","0.71073","MoKα","","0.0502","0.0449","","","0.1213","0.127","","","","","","1.065","","","","has coordinates,has disorder","178406","2020-10-21","18:00:00",""
"4022742","12.2331","0.0007","12.2331","0.0007","27.5112","0.0012","90","","90","","120","","3565.4","0.3","143","1","143","1","","","","","","","","3","R -3 :H","-R 3","148","","","","- C9 H15 O -","- C9 H15 O -","- C162 H270 O18 -","18","1","","Gary A. Molander; Barbara Czakó; Michael Rheam","Construction of Bicyclic Ring Systems via a Transannular SmI~2~-Mediated Ketone-Olefin Cyclization Strategy","Journal of Organic Chemistry","2007","72","","1755","1764","10.1021/jo062292d","","","0.71073","MoKα","","0.051","0.0476","","","0.1168","0.1197","","","","","","1.05","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022743","15.694","0.002","15.694","0.002","8.2592","0.0012","90","","90","","90","","2034.2","0.5","143","1","143","1","","","","","","","","3","I -4","I -4","82","","","","- C11 H20 O -","- C11 H20 O -","- C88 H160 O8 -","8","1","","Gary A. Molander; Barbara Czakó; Michael Rheam","Construction of Bicyclic Ring Systems via a Transannular SmI~2~-Mediated Ketone-Olefin Cyclization Strategy","Journal of Organic Chemistry","2007","72","","1755","1764","10.1021/jo062292d","","","0.71069","MoKα","","0.1153","0.106","","","0.3133","0.3359","","","","","","1.401","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022744","9.4928","0.0006","8.228","0.0005","9.8444","0.0006","90","","111.506","0.001","90","","715.38","0.08","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H15 N O2 S2 -","- C14 H15 N O2 S2 -","- C28 H30 N2 O4 S4 -","2","1","","Michael Harmata; Pinguan Zheng; Chaofeng Huang; Maria G. Gomes; Weijiang Ying; Kanok-On Ranyanil; Gayatri Balan; Nathan L. Calkins","Expedient Synthesis of Sulfinamides from Sulfonyl Chlorides","Journal of Organic Chemistry","2007","72","","683","685","10.1021/jo062296i","","","0.71073","MoKα","","0.0356","0.0314","","","0.078","0.0804","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022745","46.587","0.007","5.9312","0.0009","10.3447","0.0015","90","","94.075","0.002","90","","2851.2","0.7","100","2","100","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C33 H50 O2 -","- C33 H50 O2 -","- C132 H200 O8 -","4","1","","Paromita Debroy; Ruchi Shukla; Sergey V. Lindeman; Rajendra Rathore","Preparation of Chiral Cholestanofluorene and Its Electron-Rich Derivatives for Isolation of a Stable Cation-Radical Salt","Journal of Organic Chemistry","2007","72","","1765","1769","10.1021/jo062300q","","","0.71073","MoKα","","0.0487","0.0441","","","0.1153","0.1192","","","","","","1.033","","","","has coordinates,has disorder","178406","2020-10-21","18:00:00",""
"4022746","11.0432","0.0016","7.7364","0.0011","15.73","0.002","90","","105.382","0.002","90","","1295.7","0.3","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C27 H46 Br2 -","- C27 H46 Br2 -","- C54 H92 Br4 -","2","1","","Paromita Debroy; Ruchi Shukla; Sergey V. Lindeman; Rajendra Rathore","Preparation of Chiral Cholestanofluorene and Its Electron-Rich Derivatives for Isolation of a Stable Cation-Radical Salt","Journal of Organic Chemistry","2007","72","","1765","1769","10.1021/jo062300q","","","0.71073","MoKα","","0.0498","0.037","","","0.0918","0.0965","","","","","","0.977","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022747","8.0272","0.0008","13.8028","0.0014","27.746","0.003","90","","90","","90","","3074.2","0.5","100","2","100","2","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","","","- C39 H54 -","- C39 H54 -","- C156 H216 -","4","1","","Paromita Debroy; Ruchi Shukla; Sergey V. Lindeman; Rajendra Rathore","Preparation of Chiral Cholestanofluorene and Its Electron-Rich Derivatives for Isolation of a Stable Cation-Radical Salt","Journal of Organic Chemistry","2007","72","","1765","1769","10.1021/jo062300q","","","0.71073","MoKα","","0.06","0.0488","","","0.1192","0.1272","","","","","","1.024","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022748","5.423","0.005","11.41","0.005","10.664","0.005","90","0.005","100.34","0.005","90","0.005","649.1","0.7","100","2","100","2","","","","","","","","4","P 1 c 1","P -2yc","7","pentaleno[b]indole","5,6a-Dimethyl-6,6a,7,8,9,9a-hexahydropentaleno[2,1-b]indol-6,7-dione","","- C16 H15 N O2 -","- C16 H15 N O2 -","- C32 H30 N2 O4 -","2","1","","A. K. Yadav; S. Peruncheralathan; H. Ila; H. Junjappa","Domino Carbocationic Rearrangement of α-[Bis(methylthio)methylene]alkyl-2-(3/2-indolyl)) Cyclopropyl Ketones","Journal of Organic Chemistry","2007","72","","1388","1394","10.1021/jo062302a","","x-ray","0.71069","MoKα","","0.2754","0.0576","","","0.0862","0.1304","","","","","","1.054","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022749","7.861","0.005","16.669","0.005","12.262","0.005","90","0.005","100.449","0.005","90","0.005","1580.1","1.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5-Methyl-6,11-bis(methylthio)-5,6,7,8-tetrahydro-cycloocta[b]indol-9-one","","- C17 H19 N O S2 -","- C17 H19 N O S2 -","- C68 H76 N4 O4 S8 -","4","1","","A. K. Yadav; S. Peruncheralathan; H. Ila; H. Junjappa","Domino Carbocationic Rearrangement of α-[Bis(methylthio)methylene]alkyl-2-(3/2-indolyl)) Cyclopropyl Ketones","Journal of Organic Chemistry","2007","72","","1388","1394","10.1021/jo062302a","","","0.71069","MoKα","","0.1006","0.0667","","","0.154","0.2034","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022750","14.782","0.005","9.962","0.005","17.144","0.005","90","","90","","90","","2524.6","1.7","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4,9a-dimethyl-1,2,3,3a,9,9a-hexahydropentaleno[1,2-b]indol-1,9-dione","","- C16 H15 N O2 -","- C16 H15 N O2 -","- C128 H120 N8 O16 -","8","1","","A. K. Yadav; S. Peruncheralathan; H. Ila; H. Junjappa","Domino Carbocationic Rearrangement of α-[Bis(methylthio)methylene]alkyl-2-(3/2-indolyl)) Cyclopropyl Ketones","Journal of Organic Chemistry","2007","72","","1388","1394","10.1021/jo062302a","","","0.71069","MoKα","","0.0832","0.0579","","","0.13","0.1485","","","","","","1.066","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022751","7.4907","0.0004","13.1495","0.0008","18.5332","0.0012","90","","90","","90","","1825.5","0.19","173","2","173","2","","","","","","","synthesis as described","4","P b c a","-P 2ac 2ab","61","","","","- C11 H11 N O2 -","- C11 H11 N O2 -","- C88 H88 N8 O16 -","8","1","","Philip J. Parsons; Alexander J. Waters; Daryl S. Walter; Johnathan Board","A New Route to Highly Functionalized Heterocyclic Rings","Journal of Organic Chemistry","2007","72","","1395","1398","10.1021/jo062305n","","x-ray","0.71073","MoKα","","0.0552","0.0424","","","0.101","0.1094","","","","","","1.065","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022752","12.7887","0.0013","5.8349","0.0006","12.9579","0.0013","90","","98.292","0.005","90","","956.82","0.17","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H13 N O2 -","- C11 H13 N O2 -","- C44 H52 N4 O8 -","4","1","","Philip J. Parsons; Alexander J. Waters; Daryl S. Walter; Johnathan Board","A New Route to Highly Functionalized Heterocyclic Rings","Journal of Organic Chemistry","2007","72","","1395","1398","10.1021/jo062305n","","x-ray","0.71073","MoKα","","0.1029","0.064","","","0.1258","0.1444","","","","","","1.089","","","","has coordinates,has disorder","178406","2020-10-21","18:00:00",""
"4022753","17.5244","0.0014","7.44","0.0005","12.9055","0.001","90","","129.607","0.003","90","","1296.36","0.17","173","2","173","2","","","","","","","synthesis as described","4","C 1 c 1","C -2yc","9","","","","- C13 H16 O3 Si -","- C13 H16 O3 Si -","- C52 H64 O12 Si4 -","4","1","","Philip J. Parsons; Alexander J. Waters; Daryl S. Walter; Johnathan Board","A New Route to Highly Functionalized Heterocyclic Rings","Journal of Organic Chemistry","2007","72","","1395","1398","10.1021/jo062305n","","x-ray","0.71073","MoKα","","0.0624","0.0576","","","0.1554","0.1648","","","","","","0.846","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022754","11.0822","0.001","12.3187","0.0009","14.3552","0.0012","78.825","0.004","81.987","0.004","71.987","0.004","1821.7","0.3","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C18 H21 N O5 Si -","- C18 H21 N O5 Si -","- C72 H84 N4 O20 Si4 -","4","2","","Philip J. Parsons; Alexander J. Waters; Daryl S. Walter; Johnathan Board","A New Route to Highly Functionalized Heterocyclic Rings","Journal of Organic Chemistry","2007","72","","1395","1398","10.1021/jo062305n","","x-ray","0.71073","MoKα","","0.1387","0.0742","","","0.1475","0.1743","","","","","","1.03","","","","has coordinates,has disorder","178406","2020-10-21","18:00:00",""
"4022755","9.207","0.0006","11.4137","0.0008","11.9039","0.0008","62.674","0.001","88.685","0.001","81.265","0.001","1096.89","0.13","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","14-chloro-7,7-dimethyl-6,7,7a,8,14b,17-hexahydro-5H-benzo[5,6] pyrrolizino[2,1-c]naphtho[2,3-h]quinoline-5,17-dione","","- C28 H21 Cl N2 O2 -","- C28 H21 Cl N2 O2 -","- C56 H42 Cl2 N4 O4 -","2","1","","Vikram Gaddam; Rajagopal Nagarajan","A New Entry to Polycyclic Indole Derivatives via Intramolecular Imino Diels-Alder Reaction: Observation of Unexpected Reaction","Journal of Organic Chemistry","2007","72","","3573","3576","10.1021/jo062321k","","","0.71073","MoKα","","0.058","0.0448","","","0.1121","0.1203","","","","","","1.026","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022756","11.9652","0.0014","23.078","0.003","17.208","0.002","90","","102.416","0.002","90","","4640.8","0.9","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","12,14-dichloro-7,7-dimethyl-6,7,7a,8,14b,17-hexahydro-5H-benzo[5,6] pyrrolizino[2,1-c]naphtho[2,3-h]quinoline-5,17-dione","","- C56 H40 Cl4 N4 O4 -","- C56 H40 Cl4 N4 O4 -","- C224 H160 Cl16 N16 O16 -","4","1","","Vikram Gaddam; Rajagopal Nagarajan","A New Entry to Polycyclic Indole Derivatives via Intramolecular Imino Diels-Alder Reaction: Observation of Unexpected Reaction","Journal of Organic Chemistry","2007","72","","3573","3576","10.1021/jo062321k","","","0.71073","MoKα","","0.2182","0.0653","","","0.0951","0.1329","","","","","","0.926","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022757","21.701","0.007","13.626","0.005","7.846","0.003","90","","98.523","0.006","90","","2294.2","1.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","12-bromo-14-chloro-7,7-dimethyl-6,7,7a,8,14b,17-hexahydro-5H-benzo[5,6] pyrrolizino[2,1-c]naphtho[2,3-h]quinoline-5,17-dione","","- C28 H20 Br Cl N2 O2 -","- C28 H20 Br Cl N2 O2 -","- C112 H80 Br4 Cl4 N8 O8 -","4","1","","Vikram Gaddam; Rajagopal Nagarajan","A New Entry to Polycyclic Indole Derivatives via Intramolecular Imino Diels-Alder Reaction: Observation of Unexpected Reaction","Journal of Organic Chemistry","2007","72","","3573","3576","10.1021/jo062321k","","","0.71073","MoKα","","0.1124","0.0521","","","0.0985","0.1177","","","","","","0.976","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022758","8.1746","0.0003","15.193","0.0005","9.8516","0.0003","90","","107.469","0.001","90","","1167.11","0.07","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H11 N3 O4 S -","- C9 H11 N3 O4 S -","- C36 H44 N12 O16 S4 -","4","1","","Mohammad Movassaghi; Omar K. Ahmad","N-Isopropylidene-N'-2-nitrobenzenesulfonyl Hydrazine, a Reagent for Reduction of Alcohols via the Corresponding Monoalkyl Diazenes","Journal of Organic Chemistry","2007","72","","1838","1841","10.1021/jo062325p","","","0.71073","MoKα","","0.031","0.0299","","","0.0848","0.0858","","","","","","1.06","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022759","10.602","0.002","10.735","0.002","11.281","0.002","77.344","0.003","67.507","0.003","83.509","0.003","1156.8","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H27 Cl N2 O2 -","- C26 H27 Cl N2 O2 -","- C52 H54 Cl2 N4 O4 -","2","1","","Dhevalapally B. Ramachary; Kinthada Ramakumar; Vidadala V. Narayana","Organocatalytic Cascade Reactions Based on Push-Pull Dienamine Platform: Synthesis of Highly Substituted Anilines","Journal of Organic Chemistry","2007","72","","1458","1463","10.1021/jo0623639","","","0.71073","MoKα","","0.0603","0.0497","","","0.1308","0.1387","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022760","10.9755","0.0012","8.2031","0.0009","16.2285","0.0018","90","","107.064","0.002","90","","1396.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 N O3 -","- C16 H17 N O3 -","- C64 H68 N4 O12 -","4","1","","Dhevalapally B. Ramachary; Kinthada Ramakumar; Vidadala V. Narayana","Organocatalytic Cascade Reactions Based on Push-Pull Dienamine Platform: Synthesis of Highly Substituted Anilines","Journal of Organic Chemistry","2007","72","","1458","1463","10.1021/jo0623639","","","0.71073","MoKα","","0.064","0.0516","","","0.1326","0.1404","","","","","","1.028","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022761","7.3962","0.0019","24.731","0.006","6.9611","0.0017","90","","111.789","0.005","90","","1182.3","0.5","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H7 Br2 N3 O3 -","- C10 H7 Br2 N3 O3 -","- C40 H28 Br8 N12 O12 -","4","1","","Kathryn M. Evans; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; Nicholas J. Westwood","An Improved Understanding of the Reaction of Bis(bromomethyl)quinoxaline 1-N-Oxides with Amines Using Substituent Effects","Journal of Organic Chemistry","2007","72","","3186","3193","10.1021/jo062380y","","","0.71073","MoKα","","0.036","0.0304","","","0.0666","0.069","","","","","","1.079","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022762","7.483","0.002","7.6916","0.0019","10.345","0.003","100.412","0.009","93.102","0.005","95.459","0.01","581.4","0.3","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H7 Br3 N2 O -","- C10 H7 Br3 N2 O -","- C20 H14 Br6 N4 O2 -","2","1","","Kathryn M. Evans; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; Nicholas J. Westwood","An Improved Understanding of the Reaction of Bis(bromomethyl)quinoxaline 1-N-Oxides with Amines Using Substituent Effects","Journal of Organic Chemistry","2007","72","","3186","3193","10.1021/jo062380y","","","0.71073","MoKα","","0.0299","0.0273","","","0.0667","0.0678","","","","","","0.739","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022763","7.4673","0.0016","7.8862","0.0017","10.833","0.002","86.162","0.014","88.275","0.013","65.97","0.011","581.4","0.2","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H7 Br3 N2 O -","- C10 H7 Br3 N2 O -","- C20 H14 Br6 N4 O2 -","2","1","","Kathryn M. Evans; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; Nicholas J. Westwood","An Improved Understanding of the Reaction of Bis(bromomethyl)quinoxaline 1-N-Oxides with Amines Using Substituent Effects","Journal of Organic Chemistry","2007","72","","3186","3193","10.1021/jo062380y","","","0.71073","MoKα","","0.112","0.1077","","","0.2714","0.2762","","","","","","0.883","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022764","7.314","0.0013","7.7055","0.0011","11.226","0.003","87.946","0.015","89.412","0.013","72.355","0.01","602.5","0.2","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H7 Br2 N3 O3 -","- C10 H7 Br2 N3 O3 -","- C20 H14 Br4 N6 O6 -","2","1","","Kathryn M. Evans; Alexandra M. Z. Slawin; Tomas Lebl; Douglas Philp; Nicholas J. Westwood","An Improved Understanding of the Reaction of Bis(bromomethyl)quinoxaline 1-N-Oxides with Amines Using Substituent Effects","Journal of Organic Chemistry","2007","72","","3186","3193","10.1021/jo062380y","","","0.71073","MoKα","","0.0314","0.027","","","0.0709","0.0739","","","","","","1.048","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022765","10.628","0.002","12","0.002","14.657","0.003","69.313","0.014","84.535","0.016","64.991","0.015","1581.6","0.6","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H24 F9 N5 O2 -","- C32 H24 F9 N5 O2 -","- C64 H48 F18 N10 O4 -","2","1","","Andreas Schmidt; Tobias Habeck; Anika Sabine Lindner; Bohdan Snovydovych; Jan Christoph Namyslo; Arnold Adam; Mimoza Gjikaj","Translation of Pseudo-Cross-Conjugation into Chemistry: Cycloadditions of Mesomeric Betaines to the New Ring System Spiro[indazole-3,3'-pyrrole]","Journal of Organic Chemistry","2007","72","","2236","2239","10.1021/jo062391r","","","0.71073","MoKα","","0.0927","0.0859","","","0.1413","0.1167","","","","","","1.03","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022766","9.6272","0.0009","8.7501","0.0006","30.305","0.002","90","","90.34","0.01","90","","2552.8","0.3","290","2","290","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C26 H34 O8 -","- C26 H34 O8 -","- C104 H136 O32 -","4","2","","James D. White; Laura Quaranta; Guoqiang Wang","Studies on the Synthesis of (-)-Gymnodimine. Subunit Synthesis and Coupling","Journal of Organic Chemistry","2007","72","","1717","1728","10.1021/jo062396o","","","1.54184","CuKα","","0.0491","0.0445","","","0.1235","0.1299","","","","","","1.033","","","","has coordinates,has disorder","178406","2020-10-21","18:00:00",""
"4022767","9.4202","0.0008","6.8832","0.0006","12.5381","0.0009","90","","101.54","0.009","90","","796.55","0.11","290","2","290","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C16 H22 O6 -","- C16 H22 O6 -","- C32 H44 O12 -","2","1","","James D. White; Laura Quaranta; Guoqiang Wang","Studies on the Synthesis of (-)-Gymnodimine. Subunit Synthesis and Coupling","Journal of Organic Chemistry","2007","72","","1717","1728","10.1021/jo062396o","","","1.54184","CuKα","","0.0334","0.0331","","","0.0874","0.0878","","","","","","1.078","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022768","9.378","0.0011","10.968","0.0012","13.966","0.001","90","","90","","90","","1436.5","0.3","293","2","290","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H20 O5 -","- C15 H20 O5 -","- C60 H80 O20 -","4","1","","James D. White; Laura Quaranta; Guoqiang Wang","Studies on the Synthesis of (-)-Gymnodimine. Subunit Synthesis and Coupling","Journal of Organic Chemistry","2007","72","","1717","1728","10.1021/jo062396o","","","1.54184","CuKα","","0.037","0.034","","","0.091","0.0933","","","","","","1.055","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022769","13.927","0.003","9.874","0.002","15.389","0.004","90","","96.09","0.005","90","","2104.3","0.8","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H28 N2 O6 -","- C22 H28 N2 O6 -","- C88 H112 N8 O24 -","4","1","","Keith J. Winstanley; David K. Smith","Ortho-Substituted Catechol Derivatives: The Effect of Intramolecular Hydrogen-Bonding Pathways on Chloride Anion Recognition","Journal of Organic Chemistry","2007","72","","2803","2815","10.1021/jo0623989","","","0.71073","MoKα","","0.0683","0.0421","","","0.0992","0.1109","","","","","","1.01","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022770","11.9823","0.0006","10.0231","0.0004","11.6468","0.0006","90","","93.332","0.002","90","","1396.41","0.11","150","1","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C64 H68 N4 O8 -","4","1","","Lily Yu; Akos Kokai; Andrei K. Yudin","Preparation and Reactivity of Versatile α-Amino Ketones","Journal of Organic Chemistry","2007","72","","1737","1741","10.1021/jo062401o","","","0.71073","MoKα","","0.0685","0.0438","","","0.1035","0.118","","","","","","1.031","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022771","8.425","0.0006","12.571","0.001","20.335","0.0019","90","","91.167","0.007","90","","2153.2","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","11-Methyl-8-spiroepoxy-tricyclo[5.2.2.01,5]undec-3,10-dien-9-one","","","- C26 H27 O4 -","- C26 H27 O4 -","- C104 H108 O16 -","4","1","","Vishwakarma Singh; G. D. Praveena; Kapil Karki; Shaikh M. Mobin","Cycloaddition of Cyclohexa-2,4-dienones, Ring-Closing Metathesis, and Photochemical Reactions: A Common Stereoselective Approach to Duprezianane, Polyquinane and Sterpurane Frameworks","Journal of Organic Chemistry","2007","72","","2058","2067","10.1021/jo062416m","","","0.71073","MoKα","","0.3346","0.0666","","","0.1012","0.15","","","","","","0.911","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022772","6.6133","0.0003","19.6445","0.0008","16.8723","0.0007","90","","90.272","0.002","90","","2191.94","0.16","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23.5 H19.5 Cl2.5 N2 O2 S -","- C23.5 H19.5 Cl2.5 N2 O2 S -","- C94 H78 Cl10 N8 O8 S4 -","4","1","","Mateo Alajarín; José Cabrera; Aurelia Pastor; Pilar Sánchez-Andrada; Delia Bautista","Diels-Alder Reactions of 4-Alkenylthiazoles: A New Approach to Thiazole Functionalization","Journal of Organic Chemistry","2007","72","","2097","2105","10.1021/jo062417e","","","0.71073","MoKα","","0.0438","0.0387","","","0.0894","0.092","","","","","","1.071","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4022773","13.266","0.0006","13.1031","0.0006","19.4948","0.0009","90","","93.459","0.002","90","","3382.5","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H31 Cl4 N3 O4 S -","- C35 H31 Cl4 N3 O4 S -","- C140 H124 Cl16 N12 O16 S4 -","4","1","","Mateo Alajarín; José Cabrera; Aurelia Pastor; Pilar Sánchez-Andrada; Delia Bautista","Diels-Alder Reactions of 4-Alkenylthiazoles: A New Approach to Thiazole Functionalization","Journal of Organic Chemistry","2007","72","","2097","2105","10.1021/jo062417e","","","0.71073","MoKα","","0.0581","0.0487","","","0.1066","0.1111","","","","","","1.093","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022774","7.4571","0.0015","8.4721","0.0017","22.88","0.005","90","","90","","90","","1445.5","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 N O5 -","- C14 H19 N O5 -","- C56 H76 N4 O20 -","4","1","","Xiao-Ping Jiang; Ying Cheng; Gao-Feng Shi; Zhi-Mei Kang","A Versatile Strategy for Divergent and Diastereoselective Synthesis of Natural Product-Like Polyhydroxylated Indolizidines","Journal of Organic Chemistry","2007","72","","2212","2215","10.1021/jo0624290","","","0.71073","MoKα","","0.0822","0.0679","","","0.1701","0.1792","","","","","","0.974","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022775","6.7769","0.0014","9.5119","0.0019","11.533","0.002","90","","92.86","0.03","90","","742.5","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H21 N O5 -","- C14 H21 N O5 -","- C28 H42 N2 O10 -","2","1","","Xiao-Ping Jiang; Ying Cheng; Gao-Feng Shi; Zhi-Mei Kang","A Versatile Strategy for Divergent and Diastereoselective Synthesis of Natural Product-Like Polyhydroxylated Indolizidines","Journal of Organic Chemistry","2007","72","","2212","2215","10.1021/jo0624290","","","0.71073","MoKα","","0.0649","0.0495","","","0.1172","0.1232","","","","","","1.091","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022776","11.003","0.002","5.9276","0.0012","13.224","0.003","90","","108.59","0.03","90","","817.4","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H21 N O7 -","- C15 H21 N O7 -","- C30 H42 N2 O14 -","2","1","","Xiao-Ping Jiang; Ying Cheng; Gao-Feng Shi; Zhi-Mei Kang","A Versatile Strategy for Divergent and Diastereoselective Synthesis of Natural Product-Like Polyhydroxylated Indolizidines","Journal of Organic Chemistry","2007","72","","2212","2215","10.1021/jo0624290","","","0.71073","MoKα","","0.0732","0.0465","","","0.0912","0.0973","","","","","","1.091","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022777","9.6256","0.0019","9.795","0.002","14.391","0.003","90","","90","","90","","1356.8","0.5","113","2","113","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H19 N O6 -","- C13 H19 N O6 -","- C52 H76 N4 O24 -","4","1","","Xiao-Ping Jiang; Ying Cheng; Gao-Feng Shi; Zhi-Mei Kang","A Versatile Strategy for Divergent and Diastereoselective Synthesis of Natural Product-Like Polyhydroxylated Indolizidines","Journal of Organic Chemistry","2007","72","","2212","2215","10.1021/jo0624290","","","0.7107","MoKα","","0.0403","0.0364","","","0.0857","0.0876","","","","","","1.029","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022778","8.2","0.0005","9.7577","0.0006","34.842","0.002","90","","90","","90","","2787.8","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H29 N O12 S -","- C25 H29 N O12 S -","- C100 H116 N4 O48 S4 -","4","1","","David Crich; Wenju Li","O-Sialylation with N-Acetyl-5-N,4-O-Carbonyl-Protected Thiosialoside Donors in Dichloromethane: Facile and Selective Cleavage of the Oxazolidinone Ring","Journal of Organic Chemistry","2007","72","","2387","2391","10.1021/jo062431r","","","0.71073","MoKα","","0.0549","0.0462","","","0.1173","0.1232","","","","","","1.043","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022779","13.3486","0.0015","7.963","0.0009","13.8757","0.0015","90","","93.676","0.002","90","","1471.9","0.3","297","2","297","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Cyclobutaindene","","","- C18 H20 O4 -","- C18 H20 O4 -","- C72 H80 O16 -","4","1","","Mukulesh Mondal; Vedavati G. Puranik; Narshinha P. Argade","A Facile Phenol-Driven Intramolecular Diastereoselective Thermal/Base-Catalyzed Dipolar [2 + 2] Annulation Reactions: An Easy Access to Complex Bioactive Natural and Unnatural Benzopyran Congeners","Journal of Organic Chemistry","2007","72","","2068","2076","10.1021/jo0624344","","","0.71073","MoKα","","0.1036","0.0501","","","0.1043","0.1259","","","","","","1.01","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022780","10.1385","0.0007","11.8567","0.0008","13.1736","0.0009","90","","97.779","0.001","90","","1569.01","0.19","297","2","297","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","BiCyclononane","","","- C18 H20 O4 -","- C18 H20 O4 -","- C72 H80 O16 -","4","1","","Mukulesh Mondal; Vedavati G. Puranik; Narshinha P. Argade","A Facile Phenol-Driven Intramolecular Diastereoselective Thermal/Base-Catalyzed Dipolar [2 + 2] Annulation Reactions: An Easy Access to Complex Bioactive Natural and Unnatural Benzopyran Congeners","Journal of Organic Chemistry","2007","72","","2068","2076","10.1021/jo0624344","","","0.71073","MoKα","","0.0513","0.0398","","","0.1027","0.1091","","","","","","1.023","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022781","18.687","0.006","7.638","0.002","19.331","0.006","90","","117.134","0.004","90","","2455.5","1.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","beta-aminosulfide","","","- C22 H32 N2 O4 S3 -","- C22 H32 N2 O4 S3 -","- C88 H128 N8 O16 S12 -","4","0.5","","Devarajulu Sureshkumar; Thanikachalam Gunasundari; Venkataraman Ganesh; Srinivasan Chandrasekaran","Regio- and Stereospecific Synthesis of β-Sulfonamidodisulfides and β-Sulfonamidosulfides from Aziridines using Tetrathiomolybdate as a Sulfur Transfer Reagent","Journal of Organic Chemistry","2007","72","","2106","2117","10.1021/jo0624389","","","0.71073","MoKα","","0.0668","0.0596","","","0.1746","0.1796","","","","","","1.079","","","","has coordinates","271679","2022-01-02","08:39:52",""
"4022782","20.34","0.003","10.8569","0.0016","14.721","0.002","90","","126.919","0.003","90","","2599","0.7","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","beta-aminodisulfide","","","- C22 H32 N2 O4 S4 -","- C22 H32 N2 O4 S4 -","- C88 H128 N8 O16 S16 -","4","0.5","","Devarajulu Sureshkumar; Thanikachalam Gunasundari; Venkataraman Ganesh; Srinivasan Chandrasekaran","Regio- and Stereospecific Synthesis of β-Sulfonamidodisulfides and β-Sulfonamidosulfides from Aziridines using Tetrathiomolybdate as a Sulfur Transfer Reagent","Journal of Organic Chemistry","2007","72","","2106","2117","10.1021/jo0624389","","","0.71073","MoKα","","0.0682","0.0544","","","0.1486","0.1561","","","","","","1.072","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022783","20.599","0.006","10.696","0.003","14.655","0.004","90","","128.617","0.004","90","","2522.6","1.2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","beta-aminodisulfide","","","- C22 H32 N2 O6 S4 -","- C22 H32 N2 O6 S4 -","- C88 H128 N8 O24 S16 -","4","0.5","","Devarajulu Sureshkumar; Thanikachalam Gunasundari; Venkataraman Ganesh; Srinivasan Chandrasekaran","Regio- and Stereospecific Synthesis of β-Sulfonamidodisulfides and β-Sulfonamidosulfides from Aziridines using Tetrathiomolybdate as a Sulfur Transfer Reagent","Journal of Organic Chemistry","2007","72","","2106","2117","10.1021/jo0624389","","","0.71073","MoKα","","0.1023","0.0901","","","0.2712","0.2832","","","","","","1.057","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022784","17.075","0.005","9.416","0.003","20.892","0.005","90","","112.666","0.01","90","","3099.6","1.5","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","beta-aminodisulfie","","","- C13 H20 N O2 S2 -","- C13 H20 N O2 S2 -","- C104 H160 N8 O16 S16 -","8","1","","Devarajulu Sureshkumar; Thanikachalam Gunasundari; Venkataraman Ganesh; Srinivasan Chandrasekaran","Regio- and Stereospecific Synthesis of β-Sulfonamidodisulfides and β-Sulfonamidosulfides from Aziridines using Tetrathiomolybdate as a Sulfur Transfer Reagent","Journal of Organic Chemistry","2007","72","","2106","2117","10.1021/jo0624389","","","0.71073","MoKα","","0.1082","0.0764","","","0.1782","0.1938","","","","","","1.061","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022785","11.7857","0.0013","12.073","0.0013","12.246","0.0013","84.446","0.002","83.35","0.002","61.36","0.002","1517.3","0.3","273","2","296","2","","","","","","","","5","P -1","-P 1","2","beta-aminodisulfie","","","- C26 H40 N2 O4 S4 -","- C26 H40 N2 O4 S4 -","- C52 H80 N4 O8 S8 -","2","1","","Devarajulu Sureshkumar; Thanikachalam Gunasundari; Venkataraman Ganesh; Srinivasan Chandrasekaran","Regio- and Stereospecific Synthesis of β-Sulfonamidodisulfides and β-Sulfonamidosulfides from Aziridines using Tetrathiomolybdate as a Sulfur Transfer Reagent","Journal of Organic Chemistry","2007","72","","2106","2117","10.1021/jo0624389","","","0.71073","MoKα","","0.0574","0.0426","","","0.1049","0.111","","","","","","1.047","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022786","8.875","0.0016","11.612","0.002","15.488","0.003","82.465","0.004","86.737","0.004","74.056","0.004","1521.1","0.5","296","2","296","2","","","","","","","see text","5","P -1","-P 1","2","beta-aminodisulfide","N1-(1S*,2S*)-2-[((1S*,2S*)-1,3-dimethyl-2-[(4- methylphenyl) sulfonyl]aminobutyl)disulfanyl]-1-isopropylpropyl-4-methyl-1-benzenesulfonamide","","- C26 H40 N2 O4 S4 -","- C26 H40 N2 O4 S4 -","- C52 H80 N4 O8 S8 -","2","1","","Devarajulu Sureshkumar; Thanikachalam Gunasundari; Venkataraman Ganesh; Srinivasan Chandrasekaran","Regio- and Stereospecific Synthesis of β-Sulfonamidodisulfides and β-Sulfonamidosulfides from Aziridines using Tetrathiomolybdate as a Sulfur Transfer Reagent","Journal of Organic Chemistry","2007","72","","2106","2117","10.1021/jo0624389","","","0.71073","MoKα","","0.1424","0.0617","","","0.0937","0.1093","","","","","","0.935","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022787","18.658","0.006","18.402","0.006","16.909","0.006","90","","108.062","0.006","90","","5520","3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","beta-aminodisulfide","","","- C24 H32 N2 O4 S4 -","- C24 H32 N2 O4 S4 -","- C192 H256 N16 O32 S32 -","8","2","","Devarajulu Sureshkumar; Thanikachalam Gunasundari; Venkataraman Ganesh; Srinivasan Chandrasekaran","Regio- and Stereospecific Synthesis of β-Sulfonamidodisulfides and β-Sulfonamidosulfides from Aziridines using Tetrathiomolybdate as a Sulfur Transfer Reagent","Journal of Organic Chemistry","2007","72","","2106","2117","10.1021/jo0624389","","","0.71073","MoKα","","0.281","0.1142","","","0.2252","0.2819","","","","","","0.984","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022788","12.48","0.006","5.868","0.003","25.332","0.012","90","","93.888","0.009","90","","1850.8","1.5","298","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Acetylaziridine","","","- C17 H21 N O6 S -","- C17 H21 N O6 S -","- C68 H84 N4 O24 S4 -","4","1","","Devarajulu Sureshkumar; Thanikachalam Gunasundari; Venkataraman Ganesh; Srinivasan Chandrasekaran","Regio- and Stereospecific Synthesis of β-Sulfonamidodisulfides and β-Sulfonamidosulfides from Aziridines using Tetrathiomolybdate as a Sulfur Transfer Reagent","Journal of Organic Chemistry","2007","72","","2106","2117","10.1021/jo0624389","","","0.71073","MoKα","","0.1116","0.0799","","","0.181","0.1962","","","","","","1.099","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022789","9.3282","0.0019","9.979","0.002","11.563","0.002","95.399","0.003","103.227","0.003","111.406","0.003","956.6","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","beta-aminosulfie","","","- C18 H20 Cl N O2 S2 -","- C18 H20 Cl N O2 S2 -","- C36 H40 Cl2 N2 O4 S4 -","2","1","","Devarajulu Sureshkumar; Thanikachalam Gunasundari; Venkataraman Ganesh; Srinivasan Chandrasekaran","Regio- and Stereospecific Synthesis of β-Sulfonamidodisulfides and β-Sulfonamidosulfides from Aziridines using Tetrathiomolybdate as a Sulfur Transfer Reagent","Journal of Organic Chemistry","2007","72","","2106","2117","10.1021/jo0624389","","","0.71073","MoKα","","0.2155","0.166","","","0.3387","0.365","","","","","","1.219","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022790","7.7176","0.0016","10.25","0.002","13.69","0.003","97.226","0.004","101.746","0.004","93.587","0.004","1047.5","0.4","273","2","296","2","","","","","","","","6","P -1","-P 1","2","beta-aminosulfide","","","- C19 H24 Cl N O2 S2 -","- C19 H24 Cl N O2 S2 -","- C38 H48 Cl2 N2 O4 S4 -","2","1","","Devarajulu Sureshkumar; Thanikachalam Gunasundari; Venkataraman Ganesh; Srinivasan Chandrasekaran","Regio- and Stereospecific Synthesis of β-Sulfonamidodisulfides and β-Sulfonamidosulfides from Aziridines using Tetrathiomolybdate as a Sulfur Transfer Reagent","Journal of Organic Chemistry","2007","72","","2106","2117","10.1021/jo0624389","","","0.71073","MoKα","","0.1336","0.0599","","","0.1198","0.14","","","","","","0.925","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022791","7.18","0.0014","9.64","0.0019","16.14","0.003","90","","102.4","0.03","90","","1091.1","0.4","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","beta-aminosulfide","","","- C22 H22 N2 O4 S2 -","- C22 H22 N2 O4 S2 -","- C44 H44 N4 O8 S4 -","2","1","","Devarajulu Sureshkumar; Thanikachalam Gunasundari; Venkataraman Ganesh; Srinivasan Chandrasekaran","Regio- and Stereospecific Synthesis of β-Sulfonamidodisulfides and β-Sulfonamidosulfides from Aziridines using Tetrathiomolybdate as a Sulfur Transfer Reagent","Journal of Organic Chemistry","2007","72","","2106","2117","10.1021/jo0624389","","","0.71073","MoKα","","0.0553","0.0451","","","0.1299","0.1469","","","","","","1.231","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022792","7.5015","0.0015","15.005","0.003","24.7939","0.0015","90","","90","","90","","2790.8","0.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","steroid","","","- C29 H47 O5 -","- C29 H47 O5 -","- C116 H188 O20 -","4","1","","Marcin Górecki; Ewa Jabłońska; Anna Kruszewska; Suszczyńska; Zofia Urbańczyk-Lipkowska; Michael Gerards; Jacek W. Morzycki; Wojciech J. Szczepek; Jadwiga Frelek","Practical Method for the Absolute Configuration Assignment of tert/tert 1,2-Diols Using Their Complexes with Mo~2~(OAc)~4~","Journal of Organic Chemistry","2007","72","","2906","2916","10.1021/jo062445x","","","1.54178","CuKα","","0.2357","0.062","","","0.1354","0.1873","","","","","","0.99","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022793","7.1281","0.001","18.856","0.003","10.036","0.002","90","","93.1","0.03","90","","1347","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C28 H48 O5 -","- C28 H47 O5 -","- C56 H94 O10 -","2","1","","Marcin Górecki; Ewa Jabłońska; Anna Kruszewska; Suszczyńska; Zofia Urbańczyk-Lipkowska; Michael Gerards; Jacek W. Morzycki; Wojciech J. Szczepek; Jadwiga Frelek","Practical Method for the Absolute Configuration Assignment of tert/tert 1,2-Diols Using Their Complexes with Mo~2~(OAc)~4~","Journal of Organic Chemistry","2007","72","","2906","2916","10.1021/jo062445x","","","1.54178","CuKα","","0.2078","0.0526","","","0.1073","0.1468","","","","","","1.014","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022794","21.186","0.002","7.5405","0.001","12.8359","0.0012","90","","119.475","0.008","90","","1785.2","0.3","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C19 H31 O3.5 -","- C19 H31 O3.5 -","- C76 H124 O14 -","4","1","","Marcin Górecki; Ewa Jabłońska; Anna Kruszewska; Suszczyńska; Zofia Urbańczyk-Lipkowska; Michael Gerards; Jacek W. Morzycki; Wojciech J. Szczepek; Jadwiga Frelek","Practical Method for the Absolute Configuration Assignment of tert/tert 1,2-Diols Using Their Complexes with Mo~2~(OAc)~4~","Journal of Organic Chemistry","2007","72","","2906","2916","10.1021/jo062445x","","","1.54178","CuKα","","0.1331","0.0505","","","0.1474","0.1815","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022795","5.7422","0.0008","13.106","0.002","22.274","0.003","90","","90","","90","","1676.3","0.4","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H15 N O6 S -","- C17 H15 N O6 S -","- C68 H60 N4 O24 S4 -","4","1","","Stephen C. Pelly; Sameshnee Govender; Manuel A. Fernandes; Hans-Günther Schmalz; Charles B. de Koning","Stereoselective Syntheses of the 2-Isopropenyl-2,3-dihydrobenzofuran Nucleus: Potential Chiral Building Blocks for the Syntheses of Tremetone, Hydroxytremetone, and Rotenone","Journal of Organic Chemistry","2007","72","","2857","2864","10.1021/jo062447h","","","0.71073","MoKα","","0.0502","0.0382","","","0.0916","0.0974","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022796","8.3398","0.0001","8.3398","0.0001","37.0388","0.0009","90","","90","","90","","2576.13","0.08","173","2","173","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C14 H12 Cr O4 -","- C14 H12 Cr O4 -","- C112 H96 Cr8 O32 -","8","1","","Stephen C. Pelly; Sameshnee Govender; Manuel A. Fernandes; Hans-Günther Schmalz; Charles B. de Koning","Stereoselective Syntheses of the 2-Isopropenyl-2,3-dihydrobenzofuran Nucleus: Potential Chiral Building Blocks for the Syntheses of Tremetone, Hydroxytremetone, and Rotenone","Journal of Organic Chemistry","2007","72","","2857","2864","10.1021/jo062447h","","","0.71073","MoKα","","0.0281","0.0261","","","0.0657","0.0665","","","","","","1.089","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022797","16.262","0.002","10.0367","0.0014","7.5255","0.0009","90","","90","","90","","1228.3","0.3","158","2","158","2","","","","","","","","2","P n a 21","P 2c -2n","33","","1-(2-ethynyl-1-phenylcyclopropyl)benzene","","- C17 H14 -","- C17 H14 -","- C68 H56 -","4","1","","Michael Schmittel; Atul A. Mahajan; Götz Bucher; Jan W. Bats","Thermal C^2^-C^6^ Cyclization of Enyne-Allenes. Experimental Evidence for a Stepwise Mechanism and for an Unusual Thermal Silyl Shift","Journal of Organic Chemistry","2007","72","","2166","2173","10.1021/jo062448+","","","0.71073","MoKα","","0.0576","0.0423","","","0.0913","0.0989","","","","","","1.135","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022798","27.611","0.006","10.9289","0.0018","35.287","0.008","90","","110.669","0.01","90","","9963","3","183","2","183","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C53 H51 Br2 N Si -","- C59.71 H51 Br2 N Si -","- C477.68 H408 Br16 N8 Si8 -","8","1","","Michael Schmittel; Atul A. Mahajan; Götz Bucher; Jan W. Bats","Thermal C^2^-C^6^ Cyclization of Enyne-Allenes. Experimental Evidence for a Stepwise Mechanism and for an Unusual Thermal Silyl Shift","Journal of Organic Chemistry","2007","72","","2166","2173","10.1021/jo062448+","","","0.71073","MoKα","","0.2023","0.1131","","","0.1772","0.2056","","","","","","1.2","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022799","16.65","0.003","10.1806","0.0019","16.742","0.003","90","","118.77","0.003","90","","2487.6","0.8","197","2","197","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H39 I2 N4 P -","- C18 H39 I2 N4 P -","- C72 H156 I8 N16 P4 -","4","1","","Jesudoss V. Kingston; John G. Verkade","Synthesis and Characterization of R~2~PN=P(^i^BuNCH~2~CH~2~)~3~N: A New Bulky Electron-Rich Phosphine for Efficient Pd-Assisted Suzuki-Miyaura Cross-Coupling Reactions","Journal of Organic Chemistry","2007","72","","2816","2822","10.1021/jo062452l","","","0.71073","MoKα","","0.0363","0.0267","","","0.0721","0.0848","","","","","","0.769","","","","has coordinates","178406","2020-10-21","18:00:00",""
"4022800","20.503","0.004","11.297","0.002","18.369","0.004","90","","90","","90","","4254.6","1.4","193","2","193","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C18 H39 N5 P -","- C18 H39 N5 P -","- C144 H312 N40 P8 -","8","2","","Jesudoss V. Kingston; John G. Verkade","Synthesis and Characterization of R~2~PN=P(^i^BuNCH~2~CH~2~)~3~N: A New Bulky Electron-Rich Phosphine for Efficient Pd-Assisted Suzuki-Miyaura Cross-Coupling Reactions","Journal of Organic Chemistry","2007","72","","2816","2822","10.1021/jo062452l","","","0.71073","MoKα","","0.0405","0.0343","","","0.0895","0.095","","","","","","1.029","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022801","10.0374","0.0018","10.3404","0.0019","16.234","0.003","89.909","0.003","86.599","0.003","66.722","0.003","1544.6","0.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H57 N5 P2 -","- C26 H57 N5 P2 -","- C52 H114 N10 P4 -","2","1","","Jesudoss V. Kingston; John G. Verkade","Synthesis and Characterization of R~2~PN=P(^i^BuNCH~2~CH~2~)~3~N: A New Bulky Electron-Rich Phosphine for Efficient Pd-Assisted Suzuki-Miyaura Cross-Coupling Reactions","Journal of Organic Chemistry","2007","72","","2816","2822","10.1021/jo062452l","","","0.71073","MoKα","","0.0666","0.049","","","0.1299","0.1468","","","","","","1.008","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022802","9.843","0.002","19.5","0.004","19.388","0.004","90","","96.28","0.005","90","","3698.8","1.5","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C38 H37 I2 N4 O2 Rh -","- C38 H36.5 I2 N4 O2 Rh -","- C152 H146 I8 N16 O8 Rh4 -","4","2","","Qin Xu; Xingxing Gu; Sijia Liu; Qinyu Dou; Min Shi","The Use of Chiral BINAM NHC-Rh(III) Complexes in Enantioselective Hydrosilylation of 3-Oxo-3-arylpropionic Acid Methyl or Ethyl Esters","Journal of Organic Chemistry","2007","72","","2240","2242","10.1021/jo062453d","","","0.71073","MoKα","","0.1202","0.1014","","","0.2643","0.2781","","","","","","1.019","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022803","13.8942","0.0007","8.4501","0.0004","25.2995","0.0013","90","","98.539","0.003","90","","2937.4","0.3","193","","193","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C37 H27 Br O4 -","- C37 H27 Br O4 -","- C148 H108 Br4 O16 -","4","2","","Ken Tanaka; Takeshi Suda; Keiichi Noguchi; Masao Hirano","Catalytic [2 + 2 + 2] and Thermal [4 + 2] Cycloaddition of 1,2-Bis(arylpropiolyl)benzenes","Journal of Organic Chemistry","2007","72","","2243","2246","10.1021/jo0624546","","","1.54187","CuKα","","0.1011","0.0695","","","0.2001","0.2333","","","","","","1.035","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022804","11.064","0.002","38.215","0.008","12.976","0.003","90","","104.53","0.03","90","","5310.8","1.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C57 H47 Cl9 N2 O4 -","- C57 H46 Cl9 N2 O4 -","- C228 H184 Cl36 N8 O16 -","4","1","","Yongjun Li; Haiyan Zheng; Yuliang Li; Shu Wang; Ziyu Wu; Peng Liu; Zengqiang Gao; Huibiao Liu; Daoben Zhu","Photonic Logic Gates Based on Control of FRET by a Solvatochromic Perylene Bisimide","Journal of Organic Chemistry","2007","72","","2878","2885","10.1021/jo0624748","","","0.9","synchrotronX-ray(3W1AbeamlineofBSRF)","","0.1011","0.0936","","","0.3288","0.3481","","","","","","1.024","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022805","9.3997","0.0007","10.0174","0.0008","17.1329","0.0014","90","","92.718","0.004","90","","1611.4","0.2","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(cyclohex-1-en-1-yl)diphenyl phosphine borane","","- C18 H22 B P -","- C18 H22 B P -","- C72 H88 B4 P4 -","4","2","","Delphine Julienne; Jean-François Lohier; Olivier Delacroix; Annie-Claude Gaumont","Palladium-Catalyzed C-P Coupling Reactions between Vinyl Triflates and Phosphine-Boranes: Efficient Access to Vinylphosphine-Boranes","Journal of Organic Chemistry","2007","72","","2247","2250","10.1021/jo062482o","","","0.71073","MoKα","","0.0738","0.0499","","","0.1304","0.1515","","","","","","1.061","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022806","9.44","0.0004","10.0459","0.0004","20.4407","0.0008","90","","90","","90","","1938.46","0.14","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","((1R,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-en-2-yl)diphenylphosphineborane","","- C22 H28 B P -","- C22 H28 B P -","- C88 H112 B4 P4 -","4","1","","Delphine Julienne; Jean-François Lohier; Olivier Delacroix; Annie-Claude Gaumont","Palladium-Catalyzed C-P Coupling Reactions between Vinyl Triflates and Phosphine-Boranes: Efficient Access to Vinylphosphine-Boranes","Journal of Organic Chemistry","2007","72","","2247","2250","10.1021/jo062482o","","","0.71073","MoKα","","0.0338","0.031","","","0.0842","0.0908","","","","","","1.12","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022807","15.4488","0.0003","12.4809","0.0002","19.826","0.0004","90","","98.374","0.001","90","","3781.99","0.12","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(1,1-diphenylprop-1-en-2-yl)methylphenylphosphine-borane","","- C22 H24 B P -","- C22 H24 B P -","- C176 H192 B8 P8 -","8","1","","Delphine Julienne; Jean-François Lohier; Olivier Delacroix; Annie-Claude Gaumont","Palladium-Catalyzed C-P Coupling Reactions between Vinyl Triflates and Phosphine-Boranes: Efficient Access to Vinylphosphine-Boranes","Journal of Organic Chemistry","2007","72","","2247","2250","10.1021/jo062482o","","","0.71073","MoKα","","0.0735","0.0469","","","0.1292","0.1541","","","","","","1.049","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022808","14.826","0.014","15.207","0.014","16.194","0.012","107.58","0.017","111.65","0.02","97.296","0.013","3116","5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H66 Cl6 N8 O4 -","- C64 H66 Cl6 N8 O4 -","- C128 H132 Cl12 N16 O8 -","2","1","","Evgeny A. Katayev; Nikolay V. Boev; Victor N. Khrustalev; Yuri A. Ustynyuk; I. G. Tananaev; Jonathan L. Sessler","Bipyrrole- and Dipyrromethane-Based Amido-imine Hybrid Macrocycles. New Receptors for Oxoanions","Journal of Organic Chemistry","2007","72","","2886","2896","10.1021/jo0624849","","","0.71073","MoKα","","0.0953","0.0686","","","0.1633","0.181","","","","","","1.026","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022809","14.1044","0.0019","14.891","0.002","18.791","0.003","89.975","0.005","76.025","0.005","88.303","0.005","3828.1","1","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C72.5 H85.5 Cl4.5 N8 O5 S3 -","- C72.5 H85.5 Cl4.5 N8 O5 S3 -","- C145 H171 Cl9 N16 O10 S6 -","2","1","","Evgeny A. Katayev; Nikolay V. Boev; Victor N. Khrustalev; Yuri A. Ustynyuk; I. G. Tananaev; Jonathan L. Sessler","Bipyrrole- and Dipyrromethane-Based Amido-imine Hybrid Macrocycles. New Receptors for Oxoanions","Journal of Organic Chemistry","2007","72","","2886","2896","10.1021/jo0624849","","","0.71073","MoKα","","0.1858","0.0973","","","0.2073","0.2399","","","","","","1.003","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4022810","16.94","0.03","32.91","0.04","13.758","0.018","90","","95.16","0.02","90","","7640","18","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C68.5 H71.5 Cl10.5 N8 O6 S -","- C68.5 H71.5 Cl10.5 N8 O6 S -","- C274 H286 Cl42 N32 O24 S4 -","4","1","","Evgeny A. Katayev; Nikolay V. Boev; Victor N. Khrustalev; Yuri A. Ustynyuk; I. G. Tananaev; Jonathan L. Sessler","Bipyrrole- and Dipyrromethane-Based Amido-imine Hybrid Macrocycles. New Receptors for Oxoanions","Journal of Organic Chemistry","2007","72","","2886","2896","10.1021/jo0624849","","","0.71073","MoKα","","0.2351","0.0765","","","0.1584","0.2035","","","","","","0.792","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4022811","13.6128","0.0017","14.7819","0.0019","19.996","0.003","95.734","0.005","103.59","0.005","110.139","0.005","3599.1","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C77 H92 N8 O6 S4 -","- C77 H92 N8 O6 S4 -","- C154 H184 N16 O12 S8 -","2","1","","Evgeny A. Katayev; Nikolay V. Boev; Victor N. Khrustalev; Yuri A. Ustynyuk; I. G. Tananaev; Jonathan L. Sessler","Bipyrrole- and Dipyrromethane-Based Amido-imine Hybrid Macrocycles. New Receptors for Oxoanions","Journal of Organic Chemistry","2007","72","","2886","2896","10.1021/jo0624849","","","0.71073","MoKα","","0.2172","0.0792","","","0.1368","0.1598","","","","","","1.005","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022812","14.0652","0.0012","14.3088","0.0012","17.4459","0.0015","87.15","0.002","75.536","0.001","76.178","0.002","3301.2","0.5","187","2","187","2","","","","","","","","4","P -1","-P 1","2","","","","- C109 H56 Co N4 -","- C109 H56 Co N4 -","- C218 H112 Co2 N8 -","2","1","","Min Zheng; Fangfang Li; Zujin Shi; Xiang Gao; Karl M. Kadish","Electrosynthesis and Characterization of 1,2-Dibenzyl C~60~: A Revisit","Journal of Organic Chemistry","2007","72","","2538","2542","10.1021/jo062486t","","","0.71073","MoKα","","0.1245","0.0886","","","0.2228","0.2552","","","","","","1.029","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022813","7.51","0.02","8.08","0.02","12.98","0.02","80.83","0.07","83.69","0.08","87.54","0.06","773","3","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H24 Cl10 Ir2 Sn2 -","- C16 H24 Cl10 Ir2 Sn2 -","- C16 H24 Cl10 Ir2 Sn2 -","1","0.5","","Susmita Podder; Joyanta Choudhury; Sujit Roy","Secondary Benzylation with Benzyl Alcohols Catalyzed by A High-Valent Heterobimetallic Ir-Sn Complex","Journal of Organic Chemistry","2007","72","","3129","3132","10.1021/jo0625094","","","0.71073","MoKα","","0.0538","0.0476","","","0.1199","0.1225","","","","","","1.036","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4022814","14.1327","0.0004","10.9042","0.0003","17.7449","0.0006","90","","93.3188","0.0011","90","","2730.01","0.14","200","2","200","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H38 N2 O7 Si -","- C23 H38 N2 O7 Si -","- C92 H152 N8 O28 Si4 -","4","2","","Antonio Manetto; Dimitris Georganakis; Leondios Leondiadis; Thanasis Gimisis; Peter Mayer; Thomas Carell; Chryssostomos Chatgilialoglu","Independent Generation of C5'-Nucleosidyl Radicals in Thymidine and 2'-Deoxyguanosine","Journal of Organic Chemistry","2007","72","","3659","3666","10.1021/jo062518c","","","0.71073","MoKα","","0.0839","0.0621","","","0.1636","0.1774","","","","","","1.06","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022815","13.7345","0.0012","16.8989","0.0016","17.6432","0.0017","90","","90","","90","","4095","0.7","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C23 H22 N2 O5 -","- C23 H22 N2 O5 -","- C184 H176 N16 O40 -","8","1","","Jing Wu; Fang Fang; Wen-Ya Lu; Jun-Li Hou; Chuang Li; Zong-Quan Wu; Xi-Kui Jiang; Zhan-Ting Li; Yi-Hua Yu","Dynamic [2]Catenanes Based on a Hydrogen Bonding-Mediated Bis-Zinc Porphyrin Foldamer Tweezer: A Case Study","Journal of Organic Chemistry","2007","72","","2897","2905","10.1021/jo062523g","","","0.71073","MoKα","","0.0969","0.0459","","","0.093","0.1053","","","","","","0.835","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022816","10.5861","0.0008","14.5692","0.0012","14.5369","0.0012","90","","100.128","0.002","90","","2207.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H26 N2 O7 -","- C24 H26 N2 O7 -","- C96 H104 N8 O28 -","4","1","","Jing Wu; Fang Fang; Wen-Ya Lu; Jun-Li Hou; Chuang Li; Zong-Quan Wu; Xi-Kui Jiang; Zhan-Ting Li; Yi-Hua Yu","Dynamic [2]Catenanes Based on a Hydrogen Bonding-Mediated Bis-Zinc Porphyrin Foldamer Tweezer: A Case Study","Journal of Organic Chemistry","2007","72","","2897","2905","10.1021/jo062523g","","","0.71073","MoKα","","0.077","0.0397","","","0.0797","0.0879","","","","","","0.809","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022817","6.9541","0.0011","7.3175","0.0012","25.34","0.004","88.147","0.002","87.342","0.002","74.155","0.002","1238.9","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","06092a","","","- C25 H30 Br N O6 -","- C25 H30 Br N O6 -","- C50 H60 Br2 N2 O12 -","2","1","","Aleksey I. Gerasyuto; Richard P. Hsung","An Intramolecular aza-[3 + 3] Annulation Approach to Azaphenalene Alkaloids. Total Synthesis of Myrrhine","Journal of Organic Chemistry","2007","72","","2476","2484","10.1021/jo062533h","","","0.71073","MoKα","","0.0693","0.0549","","","0.1129","0.1167","","","","","","1.155","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022818","8.1872","0.0014","15.038","0.003","20.491","0.004","90","","90","","90","","2522.8","0.7","273","2","273","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H13 Br O2 -","- C13 H13 Br O2 -","- C104 H104 Br8 O16 -","8","1","","Ireneusz Nowak; Morris J. Robins","Trifluoromethylation of Alkenyl Bromides and Iodides (Including 5-Iodouracils) with (CF~3~)~2~Hg and Cu (""Trifluoromethylcopper"")","Journal of Organic Chemistry","2007","72","","2678","2681","10.1021/jo062544a","","","0.71073","MoKα","","0.0638","0.0375","","","0.0898","0.1074","","","","","","1.022","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022819","10.244","0.003","4.5021","0.0014","33.041","0.009","90","","97.034","0.008","90","","1512.3","0.8","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","3,4-dimethoxy-1-nitrobenzo[c]phenanthrene (7aNO2)","3,4-dimethoxy-1-nitrobenzo[c]phenanthrene","","- C20 H15 N O4 -","- C20 H15 N O4 -","- C80 H60 N4 O16 -","4","1","","Cédric Brulé; Kenneth K. Laali; Takao Okazaki; Mahesh K. Lakshman","Structure/Reactivity Relationships in the Benzo[c]phenanthrene Skeleton: Stable Ion and Electrophilic Substitution (Nitration, Bromination) Study of Substituted Analogues, Novel Carbocations and Substituted Derivatives","Journal of Organic Chemistry","2007","72","","3232","3241","10.1021/jo0625453","","","0.71073","MoKα","","0.0605","0.0398","","","0.1055","0.1324","","","","","","0.771","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022820","8.115","0.003","18.042","0.006","9.525","0.003","90","","90","","90","","1394.7","0.8","130","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C16 H18 O4 -","- C16 H18 O4 -","- C64 H72 O16 -","4","0.5","","Yit Wooi Goh; Stephen M. Danczak; Tang Kuan Lim; Jonathan M. White","Manifestations of the Alder-Rickert Reaction in the Structures of Bicyclo[2.2.2]octadiene and Bicyclo[2.2.2]octene Derivatives","Journal of Organic Chemistry","2007","72","","2929","2935","10.1021/jo0625610","","","0.71073","MoKα","","0.0614","0.0587","","","0.1624","0.1637","","","","","","1.162","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022821","7.8118","0.0008","18.6118","0.0018","19.9122","0.0019","90","","90","","90","","2895.1","0.5","130","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C17 H18 O5 -","- C17 H18 O5 -","- C136 H144 O40 -","8","1","","Yit Wooi Goh; Stephen M. Danczak; Tang Kuan Lim; Jonathan M. White","Manifestations of the Alder-Rickert Reaction in the Structures of Bicyclo[2.2.2]octadiene and Bicyclo[2.2.2]octene Derivatives","Journal of Organic Chemistry","2007","72","","2929","2935","10.1021/jo0625610","","","0.71073","MoKα","","0.0699","0.0479","","","0.1171","0.1256","","","","","","1.002","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022822","10.348","0.003","7.9547","0.0018","14.484","0.004","90","","100.102","0.005","90","","1173.8","0.5","130","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 O3 -","- C14 H16 O3 -","- C56 H64 O12 -","4","1","","Yit Wooi Goh; Stephen M. Danczak; Tang Kuan Lim; Jonathan M. White","Manifestations of the Alder-Rickert Reaction in the Structures of Bicyclo[2.2.2]octadiene and Bicyclo[2.2.2]octene Derivatives","Journal of Organic Chemistry","2007","72","","2929","2935","10.1021/jo0625610","","","0.71073","MoKα","","0.1639","0.0526","","","0.0992","0.1166","","","","","","0.732","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022823","8.2293","0.0009","17.9162","0.0019","9.5373","0.001","90","","90","","90","","1406.2","0.3","130","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C16 H18 O4 -","- C16 H18 O4 -","- C64 H72 O16 -","4","0.5","","Yit Wooi Goh; Stephen M. Danczak; Tang Kuan Lim; Jonathan M. White","Manifestations of the Alder-Rickert Reaction in the Structures of Bicyclo[2.2.2]octadiene and Bicyclo[2.2.2]octene Derivatives","Journal of Organic Chemistry","2007","72","","2929","2935","10.1021/jo0625610","","","0.71073","MoKα","","0.0404","0.0359","","","0.1015","0.1043","","","","","","1.031","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022824","8.337","0.0006","14.6301","0.0011","10.1018","0.0008","90","","106.14","0.001","90","","1183.56","0.15","130","2","130","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 O3 -","- C14 H18 O3 -","- C56 H72 O12 -","4","1","","Yit Wooi Goh; Stephen M. Danczak; Tang Kuan Lim; Jonathan M. White","Manifestations of the Alder-Rickert Reaction in the Structures of Bicyclo[2.2.2]octadiene and Bicyclo[2.2.2]octene Derivatives","Journal of Organic Chemistry","2007","72","","2929","2935","10.1021/jo0625610","","","0.71073","MoKα","","0.0417","0.0367","","","0.0968","0.0995","","","","","","1.06","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022825","11.497","0.005","10.691","0.005","16.431","0.005","90","0.005","92.002","0.005","90","0.005","2018.4","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 N2 O2 S -","- C24 H22 N2 O2 S -","- C96 H88 N8 O8 S4 -","4","1","","Shikha Gandhi; Alakesh Bisai; B. A. Bhanu Prasad; Vinod K. Singh","Studies on the Reaction of Aziridines with Nitriles and Carbonyls: Synthesis of Imidazolines and Oxazolidines","Journal of Organic Chemistry","2007","72","","2133","2142","10.1021/jo062564c","","","0.71069","MoKα","","0.2373","0.0634","","","0.0981","0.1091","","","","","","1.02","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022826","17.156","0.003","11.5476","0.0018","22.209","0.003","90","","90","","90","","4400","1.2","294","2","294","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C26 H30 O5 -","- C26 H30 O5 -","- C208 H240 O40 -","8","1","","Raşit Çalişkan; Mohamed Fadelalla Ali; Ertan Şahin; William H. Watson; Metin Balci","Unusual Manganese(III)-Mediated Oxidative Free Radical Additions of 1,3-Dicarbonyl Compounds to Benzonorbornadiene and 7-Heterobenzonorbornadienes: Mechanistic Studies","Journal of Organic Chemistry","2007","72","","3353","3359","10.1021/jo0625711","","","0.71073","MoKα","","0.0468","0.0318","","","0.0785","0.0841","","","","","","0.99","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022827","17.283","0.002","22.136","0.003","7.4999","0.0009","90","","90","","90","","2869.2","0.6","213","2","213","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","","","- C18 H20 O3 -","- C18 H18 O3 -","- C144 H144 O24 -","8","1","","Raşit Çalişkan; Mohamed Fadelalla Ali; Ertan Şahin; William H. Watson; Metin Balci","Unusual Manganese(III)-Mediated Oxidative Free Radical Additions of 1,3-Dicarbonyl Compounds to Benzonorbornadiene and 7-Heterobenzonorbornadienes: Mechanistic Studies","Journal of Organic Chemistry","2007","72","","3353","3359","10.1021/jo0625711","","","0.71073","MoKα","","0.1131","0.0619","","","0.102","0.118","","","","","","1.041","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022828","9.7608","0.0005","20.7728","0.0008","9.7588","0.0005","90","","113.587","0.01","90","","1813.37","0.19","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H23 N O4 -","- C21 H23 N O4 -","- C84 H92 N4 O16 -","4","1","","Raşit Çalişkan; Mohamed Fadelalla Ali; Ertan Şahin; William H. Watson; Metin Balci","Unusual Manganese(III)-Mediated Oxidative Free Radical Additions of 1,3-Dicarbonyl Compounds to Benzonorbornadiene and 7-Heterobenzonorbornadienes: Mechanistic Studies","Journal of Organic Chemistry","2007","72","","3353","3359","10.1021/jo0625711","","x-ray","0.71073","MoKα","","0.1435","0.0895","","","0.179","0.2055","","","","","","1.101","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022829","7.2244","0.0012","11.634","0.002","16.513","0.003","81.619","0.003","84.219","0.003","89.985","0.003","1366","0.4","193","2","193","2","","","","","","","","4","P 1","P 1","1","2,3-Dibenzyl-1-oxo-2,3,3a,4,8,8a-hexahydro-1h-2,4a-diaza-s-indacine- 4,5,6-tricarboxylic acid 4-ethyl ester 5,6-dimethylester (3S, 3aR, 4R, 8aR)","","","- C31 H32 N2 O7 -","- C31 H32 N2 O7 -","- C62 H64 N4 O14 -","2","2","","William V. Murray; David Francois; Amy Maden; Ignatius Turchi","An Azomethine Ylide Approach to Complex Alkaloid-like Heterocycles","Journal of Organic Chemistry","2007","72","","3097","3099","10.1021/jo062579a","","","0.71073","MoKα","","0.102","0.0666","","","0.119","0.1329","","","","","","0.883","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022830","9.2495","0.0018","8.9167","0.0018","26.294","0.005","90","","90.39","0.03","90","","2168.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 O4 Si -","- C24 H24 O4 Si -","- C96 H96 O16 Si4 -","4","1","","Junhui Liu; Xiaohua Sun; Mikihiro Miyazaki; Lantao Liu; Congyang Wang; Zhenfeng Xi","Synthesis of Multiply Substituted Alkylidene Silacyclohexadiene Derivatives via Palladium-Catalyzed Insertion of Alkynes into Alkylidene Silacyclobutenes","Journal of Organic Chemistry","2007","72","","3137","3140","10.1021/jo062583m","","","0.71073","MoKα","","0.0761","0.0468","","","0.1093","0.1192","","","","","","1.017","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022831","11.2389","0.0011","11.9684","0.001","14.7992","0.0013","90","","90","","90","","1990.7","0.3","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Compound-29a","","","- C22 H19 N3 O4 S -","- C22 H19 N3 O4 S -","- C88 H76 N12 O16 S4 -","4","1","","Carl J. Lovely; Hongwang Du; Rasapalli Sivappa; Manojkumar R. Bhandari; Yong He; H. V. Rasika Dias","Preparation and Diels-Alder Chemistry of 4-Vinylimidazoles","Journal of Organic Chemistry","2007","72","","3741","3749","10.1021/jo0626008","","","0.71073","MoKα","","0.0374","0.0319","","","0.0755","0.0791","","","","","","1.049","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022832","9.2165","0.0018","15.144","0.003","20.742","0.004","90","","101.92","0.02","90","","2832.5","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Compound-31f","","","- C33 H28 N4 O4 -","- C33 H28 N4 O4 -","- C132 H112 N16 O16 -","4","1","","Carl J. Lovely; Hongwang Du; Rasapalli Sivappa; Manojkumar R. Bhandari; Yong He; H. V. Rasika Dias","Preparation and Diels-Alder Chemistry of 4-Vinylimidazoles","Journal of Organic Chemistry","2007","72","","3741","3749","10.1021/jo0626008","","","0.71073","MoKα","","0.0754","0.0439","","","0.0993","0.1146","","","","","","1.003","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022833","20.938","0.006","9.3858","0.0018","13.54","0.002","90","","93.114","0.017","90","","2657","1","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Compound-33e","","","- C32 H26 N4 O5 -","- C32 H26 N4 O5 -","- C128 H104 N16 O20 -","4","1","","Carl J. Lovely; Hongwang Du; Rasapalli Sivappa; Manojkumar R. Bhandari; Yong He; H. V. Rasika Dias","Preparation and Diels-Alder Chemistry of 4-Vinylimidazoles","Journal of Organic Chemistry","2007","72","","3741","3749","10.1021/jo0626008","","","0.71073","MoKα","","0.0588","0.0482","","","0.1253","0.1329","","","","","","1.076","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022834","7.8332","0.0004","19.6684","0.0009","9.8075","0.0005","90","","113.35","0.001","90","","1387.26","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Compound-39e","","","- C16 H18 N2 O2 -","- C16 H18 N2 O2 -","- C64 H72 N8 O8 -","4","1","","Carl J. Lovely; Hongwang Du; Rasapalli Sivappa; Manojkumar R. Bhandari; Yong He; H. V. Rasika Dias","Preparation and Diels-Alder Chemistry of 4-Vinylimidazoles","Journal of Organic Chemistry","2007","72","","3741","3749","10.1021/jo0626008","","","0.71073","MoKα","","0.0423","0.0401","","","0.1052","0.1078","","","","","","1.02","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022835","12.5202","0.0018","16.7045","0.0019","11.4429","0.0017","90","","113.381","0.01","90","","2196.7","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Compound-51","","","- C26 H22 N4 O4 -","- C26 H22 N4 O4 -","- C104 H88 N16 O16 -","4","1","","Carl J. Lovely; Hongwang Du; Rasapalli Sivappa; Manojkumar R. Bhandari; Yong He; H. V. Rasika Dias","Preparation and Diels-Alder Chemistry of 4-Vinylimidazoles","Journal of Organic Chemistry","2007","72","","3741","3749","10.1021/jo0626008","","","0.71073","MoKα","","0.0453","0.0352","","","0.0859","0.0917","","","","","","1.026","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022836","12.7244","0.0017","6.5787","0.0009","8.8078","0.0012","90","","102.61","0.01","90","","719.52","0.17","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,3-diiodopropionic acid","","- C3 H4 I2 O2 -","- C3 H4 I2 O2 -","- C12 H16 I8 O8 -","4","1","","Andrei S. Batsanov; Jonathan P. Knowles; Andrew Whiting","Mechanistic Studies on the Heck-Mizoroki Cross-Coupling Reaction of a Hindered Vinylboronate Ester as a Key Approach to Developing a Highly Stereoselective Synthesis of a C1-C7 Z,Z,E-Triene Synthon for Viridenomycin","Journal of Organic Chemistry","2007","72","","2525","2532","10.1021/jo0626010","","","0.71073","MoKα","","0.0207","0.0181","","","0.0442","0.0451","","","","","","1.104","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022837","14.8647","0.0016","15.086","0.003","15.349","0.003","100.494","0.015","98.176","0.011","111.896","0.013","3055.9","0.8","140","2","140","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H50 B5 N5 O10 -","- C60 H50 B5 N5 O10 -","- C120 H100 B10 N10 O20 -","2","1","","Nicolas Christinat; Rosario Scopelliti; Kay Severin","Multicomponent Assembly of Boron-Based Dendritic Nanostructures","Journal of Organic Chemistry","2007","72","","2192","2200","10.1021/jo062607p","","","0.71073","MoKα","","0.2455","0.0802","","","0.1725","0.2234","","","","","","0.765","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022838","13.2245","0.0019","14.709","0.002","17.609","0.003","71.844","0.015","81.373","0.013","83.91","0.013","3211.5","0.9","140","2","140","2","","","","","","","","6","P -1","-P 1","2","","","","- C73 H53 B5 F5 N5 O10 -","- C73 H52 B5 F5 N5 O10 -","- C146 H104 B10 F10 N10 O20 -","2","1","","Nicolas Christinat; Rosario Scopelliti; Kay Severin","Multicomponent Assembly of Boron-Based Dendritic Nanostructures","Journal of Organic Chemistry","2007","72","","2192","2200","10.1021/jo062607p","","","0.71073","MoKα","","0.2529","0.0858","","","0.2085","0.2743","","","","","","0.861","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022839","24.05","0.005","25.72","0.003","16.369","0.004","90","","90.566","0.014","90","","10125","3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C49.25 H66 B5 N5 O10 -","- C49.26 H60 B5 N5 O10 -","- C394.08 H480 B40 N40 O80 -","8","2","","Nicolas Christinat; Rosario Scopelliti; Kay Severin","Multicomponent Assembly of Boron-Based Dendritic Nanostructures","Journal of Organic Chemistry","2007","72","","2192","2200","10.1021/jo062607p","","","0.71073","MoKα","","0.1386","0.0962","","","0.2435","0.291","","","","","","1.026","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022840","15.9647","0.0019","16.2747","0.0018","19.192","0.002","112.104","0.008","101.901","0.009","94.52","0.009","4452.9","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C94.5 H73 B5 Cl6 N10 O10 -","- C94.5 H73.01 B5 Cl6 N10 O10 -","- C189 H146.02 B10 Cl12 N20 O20 -","2","1","","Nicolas Christinat; Rosario Scopelliti; Kay Severin","Multicomponent Assembly of Boron-Based Dendritic Nanostructures","Journal of Organic Chemistry","2007","72","","2192","2200","10.1021/jo062607p","","","0.71073","MoKα","","0.1972","0.1268","","","0.3497","0.4102","","","","","","1.556","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022841","8.6668","0.0003","10.8196","0.0003","25.2951","0.0008","90","","97.941","0.002","90","","2349.21","0.13","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H29 N O7 -","- C27 H29 N O7 -","- C108 H116 N4 O28 -","4","1","","Albert Padwa; Hongjun Zhang","Synthesis of Some Members of the Hydroxylated Phenanthridone Subclass of the Amaryllidaceae Alkaloid Family","Journal of Organic Chemistry","2007","72","","2570","2582","10.1021/jo0626111","","","1.54178","CuKα","","0.0554","0.0403","","","0.098","0.103","","","","","","1.018","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022842","6.9293","0.0008","7.5038","0.0011","10.7401","0.0011","90","","93.891","0.007","90","","557.16","0.12","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C10 H10 F2 N2 O5 -","- C10 H10 F2 N2 O5 -","- C20 H20 F4 N4 O10 -","2","1","","Ireneusz Nowak; Morris J. Robins","Synthesis of 3'-Deoxynucleosides with 2-Oxabicyclo[3.1.0]hexane Sugar Moieties: Addition of Difluorocarbene to a 3',4'-Unsaturated Uridine Derivative and 1,2-Dihydrofurans Derived from D- and L-Xylose","Journal of Organic Chemistry","2007","72","","3319","3325","10.1021/jo062614d","","","0.71073","MoKα","","0.0424","0.0346","","","0.083","0.0877","","","","","","1.043","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022843","6.2374","0.0004","9.8577","0.001","18.1082","0.0014","90","","90","","90","","1113.41","0.16","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H11 F2 N3 O4 -","- C10 H11 F2 N3 O4 -","- C40 H44 F8 N12 O16 -","4","1","","Ireneusz Nowak; Morris J. Robins","Synthesis of 3'-Deoxynucleosides with 2-Oxabicyclo[3.1.0]hexane Sugar Moieties: Addition of Difluorocarbene to a 3',4'-Unsaturated Uridine Derivative and 1,2-Dihydrofurans Derived from D- and L-Xylose","Journal of Organic Chemistry","2007","72","","3319","3325","10.1021/jo062614d","","","0.71073","MoKα","","0.0327","0.0276","","","0.0688","0.0712","","","","","","1.139","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022844","8.4892","0.0011","8.8035","0.0012","20.054","0.003","90","","93","0.002","90","","1496.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H24 N3 O2 Pd0.5 -","- C11 H24 N3 O2 Pd0.5 -","- C44 H96 N12 O8 Pd2 -","4","1","","Shenghai Li; Yingjie Lin; Jungang Cao; Suobo Zhang","Guanidine/Pd(OAc)~2~-Catalyzed Room Temperature Suzuki Cross-Coupling Reaction in Aqueous Media under Aerobic Conditions","Journal of Organic Chemistry","2007","72","","4067","4072","10.1021/jo0626257","","","0.71073","MoKα","","0.0894","0.0518","","","0.1152","0.1316","","","","","","1.029","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022845","7.9118","0.0007","9.4898","0.0008","11.6979","0.001","86.396","0.001","77.9","0.001","71.556","0.001","814.66","0.12","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H15 Br N2 O3 -","- C17 H15 Br N2 O3 -","- C34 H30 Br2 N4 O6 -","2","1","","Cyril Poriel; Mathilde Lachia; Claire Wilson; James R. Davies; Christopher J. Moody","Oxidative Rearrangement of Indoles: A New Approach to the EFHG-Tetracyclic Core of Diazonamide A","Journal of Organic Chemistry","2007","72","","2978","2987","10.1021/jo062627r","","","0.71073","MoKα","","0.04","0.0336","","","0.0816","0.0849","","","","","","1.051","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022846","11.2623","0.0007","18.3286","0.0012","25.5214","0.0016","90","","90","","90","","5268.2","0.6","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C30 H31 N O7 -","- C30 H31 N O7 -","- C240 H248 N8 O56 -","8","1","","Cyril Poriel; Mathilde Lachia; Claire Wilson; James R. Davies; Christopher J. Moody","Oxidative Rearrangement of Indoles: A New Approach to the EFHG-Tetracyclic Core of Diazonamide A","Journal of Organic Chemistry","2007","72","","2978","2987","10.1021/jo062627r","","","0.71073","MoKα","","0.0634","0.0427","","","0.1008","0.1078","","","","","","0.957","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022847","7.4974","0.0007","8.7395","0.0008","11.8235","0.0011","88.206","0.001","75.981","0.001","68.022","0.001","695.5","0.11","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H15 N O3 -","- C17 H15 N O3 -","- C34 H30 N2 O6 -","2","1","","Cyril Poriel; Mathilde Lachia; Claire Wilson; James R. Davies; Christopher J. Moody","Oxidative Rearrangement of Indoles: A New Approach to the EFHG-Tetracyclic Core of Diazonamide A","Journal of Organic Chemistry","2007","72","","2978","2987","10.1021/jo062627r","","","0.71073","MoKα","","0.0617","0.0577","","","0.1546","0.1585","","","","","","0.983","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022848","12.1908","0.0004","20.4085","0.0009","8.11","0.0003","90","","90","","90","","2017.74","0.13","200","2","200","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C29 H22 O -","- C29 H22 O -","- C116 H88 O4 -","4","1","","Mark A. Forman; Caitlin Moran; Joseph P. Herres; Jason Stairs; Emily Chopko; Anthony Pozzessere; Michael Kerrigan; Carisa Kelly; Lisa Lowchyj; Kerry Salandria; Annemarie Gallo; Elizabeth Loutzenhiser","Generation and Reactions of Pentacyclo[4.3.0.0^2,4^.0^3,8^.0^5,7^]non-4-ene","Journal of Organic Chemistry","2007","72","","2996","3005","10.1021/jo0626313","","","0.71069","MoKα","","0.0392","0.0361","","0.0786","0.0766","","","","1.148","1.151","1.151","","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022849","5.7996","0.0009","11.9907","0.0016","41.103","0.005","90","","90","","90","","2858.4","0.7","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H26 N4 O14 -","- C26 H26 N4 O14 -","- C104 H104 N16 O56 -","4","1","","Douglass F. Taber; Jean-Michel Joerger","Preparation of the 5/5-Spiroketal of the Ritterazines","Journal of Organic Chemistry","2007","72","","3454","3457","10.1021/jo0626461","","","0.71073","MoKα","","0.0485","0.0385","","","0.0821","0.0873","","","","","","1.064","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022850","12.69","0.017","13.607","0.017","15.42","0.019","110.49","0.01","109.04","0.01","98.58","0.01","2251","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H50.5 Cl5 N8 O8 -","- C36 H45 Cl5 N8 O8 -","- C72 H90 Cl10 N16 O16 -","2","1","","Carla Cruz; Rita Delgado; Michael G. B. Drew; Vítor Félix","Evaluation of the Binding Ability of a Novel Dioxatetraazamacrocyclic Receptor that Contains Two Phenanthroline Units: Selective Uptake of Carboxylate Anions","Journal of Organic Chemistry","2007","72","","4023","4034","10.1021/jo062653p","","","0.71073","MoKα","","0.1481","0.1133","","","0.2289","0.2433","","","","","","1.166","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022851","13.557","0.0018","15.5423","0.0018","20.862","0.003","90","0.01","96.51","0.011","90","0.01","4367.3","1","150","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H50.25 Br5 N8 O7.5 -","- C36 H45 Br5 N8 O7.5 -","- C144 H180 Br20 N32 O30 -","4","1","","Carla Cruz; Rita Delgado; Michael G. B. Drew; Vítor Félix","Evaluation of the Binding Ability of a Novel Dioxatetraazamacrocyclic Receptor that Contains Two Phenanthroline Units: Selective Uptake of Carboxylate Anions","Journal of Organic Chemistry","2007","72","","4023","4034","10.1021/jo062653p","","","0.71073","MoKα","","0.2147","0.0574","","","0.1204","0.1396","","","","","","0.74","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022852","10.798","0.003","16.267","0.005","13.239","0.003","90","","106.329","0.015","90","","2231.6","1.1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H23 N O4 S2 -","- C24 H23 N O4 S2 -","- C96 H92 N4 O16 S8 -","4","1","","Jovina M. Sorbetti; Kristen N. Clary; Danica A. Rankic; Jeremy E. Wulff; Masood Parvez; Thomas G. Back","Aza-Morita-Baylis-Hillman Reactions and Cyclizations of Conjugated Dienes Activated by Sulfone, Ester, and Keto Groups","Journal of Organic Chemistry","2007","72","","3326","3331","10.1021/jo062655+","","","0.71073","MoKα","","0.0665","0.042","","","0.0973","0.1101","","","","","","1.023","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022853","8.39","0.004","10.134","0.004","11.986","0.005","99.1","0.02","104.52","0.02","105.71","0.02","921.3","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H18 N2 O5 S -","- C19 H18 N2 O5 S -","- C38 H36 N4 O10 S2 -","2","1","","Jovina M. Sorbetti; Kristen N. Clary; Danica A. Rankic; Jeremy E. Wulff; Masood Parvez; Thomas G. Back","Aza-Morita-Baylis-Hillman Reactions and Cyclizations of Conjugated Dienes Activated by Sulfone, Ester, and Keto Groups","Journal of Organic Chemistry","2007","72","","3326","3331","10.1021/jo062655+","","","0.71073","MoKα","","0.0707","0.0458","","","0.1042","0.1169","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022854","12.779","0.008","10.326","0.004","15.405","0.009","90","","94.06","0.02","90","","2027.7","1.9","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 N O3 S -","- C24 H21 N O3 S -","- C96 H84 N4 O12 S4 -","4","1","","Jovina M. Sorbetti; Kristen N. Clary; Danica A. Rankic; Jeremy E. Wulff; Masood Parvez; Thomas G. Back","Aza-Morita-Baylis-Hillman Reactions and Cyclizations of Conjugated Dienes Activated by Sulfone, Ester, and Keto Groups","Journal of Organic Chemistry","2007","72","","3326","3331","10.1021/jo062655+","","","0.71073","MoKα","","0.0733","0.0469","","","0.1035","0.1183","","","","","","1.028","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022855","8.988","0.002","19.159","0.006","14.801","0.004","90","","103.307","0.012","90","","2480.2","1.3","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H33 B F2 N2 O6 -","- C25 H33 B F2 N2 O6 -","- C100 H132 B4 F8 N8 O24 -","4","1","","Hiromitsu Maeda; Yukio Kusunose; Yuta Mihashi; Tadashi Mizoguchi","BF~2~ Complexes of β-Tetraethyl-Substituted Dipyrrolyldiketones as Anion Receptors: Potential Building Subunits for Oligomeric Systems","Journal of Organic Chemistry","2007","72","","2612","2616","10.1021/jo062660d","","","0.71075","MoKα","","0.0462","0.0387","","","0.1039","0.1096","","","","","","1.078","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022856","16.581","","20.907","","9.078","","90","","95.87","","90","","3130.5","","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 Cl12 N3 O6 -","- C19 Cl12 N3 O7.794 -","- C76 Cl48 N12 O31.176 -","4","0.5","","Josep Lluís Torres; Anna Carreras; Aurora Jiménez; Enric Brillas; Xavier Torrelles; Jordi Rius; Luis Juliá","Reducing Power of Simple Polyphenols by Electron-Transfer Reactions Using a New Stable Radical of the PTM Series, Tris(2,3,5,6-tetrachloro-4-nitrophenyl)methyl Radical","Journal of Organic Chemistry","2007","72","","3750","3756","10.1021/jo062665a","","","0.71073","MoKα","","0.0924","0.0776","","0.2723","0.2598","","","","1.12","1.228","1.228","","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022857","10.5415","0.0007","12.4658","0.0008","13.8618","0.0009","90","","90","","90","","1821.6","0.2","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H26 N2 O -","- C22 H26 N2 O -","- C88 H104 N8 O4 -","4","1","","Alexander F. Pozharskii; Alexander V. Degtyarev; Oksana V. Ryabtsova; Valery A. Ozeryanskii; Mikhail E. Kletskii; Zoya A. Starikova; Lucjan Sobczyk; Alexander Filarowski","2-α-Hydroxyalkyl- and 2,7-Di(α-hydroxyalkyl) -1,8-bis(dimethylamino)naphthalenes: Stabilization of Nonconventional In/Out Conformers of ""Proton Sponges"" via N···H-O Intramolecular Hydrogen Bonding. A Remarkable Kind of Tandem Nitrogen Inversion","Journal of Organic Chemistry","2007","72","","3006","3019","10.1021/jo062667v","","","0.71073","MoKα","","0.0358","0.034","","","0.0873","0.089","","","","","","1.001","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022858","26.1078","0.0017","8.7845","0.0006","44.836","0.003","90","","105.842","0.001","90","","9892.4","1.1","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C29 H31.5 N2.5 O2 -","- C29 H31.5 N2.5 O2 -","- C464 H504 N40 O32 -","16","2","","Alexander F. Pozharskii; Alexander V. Degtyarev; Oksana V. Ryabtsova; Valery A. Ozeryanskii; Mikhail E. Kletskii; Zoya A. Starikova; Lucjan Sobczyk; Alexander Filarowski","2-α-Hydroxyalkyl- and 2,7-Di(α-hydroxyalkyl) -1,8-bis(dimethylamino)naphthalenes: Stabilization of Nonconventional In/Out Conformers of ""Proton Sponges"" via N···H-O Intramolecular Hydrogen Bonding. A Remarkable Kind of Tandem Nitrogen Inversion","Journal of Organic Chemistry","2007","72","","3006","3019","10.1021/jo062667v","","","0.71073","MoKα","","0.1534","0.0582","","","0.0734","0.0919","","","","","","1.009","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4022859","19.757","0.004","8.9547","0.0016","21.234","0.004","90","","90","","90","","3756.6","1.2","120","2","120","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C20 H30 N2 O2 -","- C20 H30 N2 O2 -","- C160 H240 N16 O16 -","8","1","","Alexander F. Pozharskii; Alexander V. Degtyarev; Oksana V. Ryabtsova; Valery A. Ozeryanskii; Mikhail E. Kletskii; Zoya A. Starikova; Lucjan Sobczyk; Alexander Filarowski","2-α-Hydroxyalkyl- and 2,7-Di(α-hydroxyalkyl) -1,8-bis(dimethylamino)naphthalenes: Stabilization of Nonconventional In/Out Conformers of ""Proton Sponges"" via N···H-O Intramolecular Hydrogen Bonding. A Remarkable Kind of Tandem Nitrogen Inversion","Journal of Organic Chemistry","2007","72","","3006","3019","10.1021/jo062667v","","","0.71073","MoKα","","0.0863","0.0508","","","0.0893","0.0982","","","","","","1.008","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022860","7.19","0.0005","7.699","0.0005","24.8499","0.0012","90","","90.146","0.003","90","","1375.58","0.15","100","1","100","1","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","","","- C14 H17 Cl N2 O -","- C14 H17 Cl N2 O -","- C56 H68 Cl4 N8 O4 -","4","2","","Dario Perdicchia; Karl Anker Jørgensen","Asymmetric Aza-Michael Reactions Catalyzed by Cinchona Alkaloids","Journal of Organic Chemistry","2007","72","","3565","3568","10.1021/jo0626717","","x-ray","0.71073","MoKα","","0.0605","0.0477","","","0.1169","0.1217","","","","","","1.035","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022861","9.7474","0.0012","14.4829","0.0014","15.887","0.002","90.737","0.005","98.14","0.006","97.005","0.005","2202.6","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2R*,3R*,4S*,5S*)-2-methoxycarbonyl-3-(4-methoxyphenyl)-5- (4-methylphenyl)-4-nitropyrrolidine","","- C22 H24 N2 O6 -","- C22 H24 N2 O6 -","- C88 H96 N8 O24 -","4","2","","Ana Arrieta; Dorleta Otaegui; Aizpea Zubia; Fernando P. Cossío; Ángel Díaz-Ortiz; Antonio de la Hoz; M. Antonia Herrero; Pilar Prieto; Concepción Foces-Foces; José L. Pizarro; María I. Arriortúa","Solvent-Free Thermal and Microwave-Assisted [3 + 2] Cycloadditions between Stabilized Azomethine Ylides and Nitrostyrenes. An Experimental and Theoretical Study","Journal of Organic Chemistry","2007","72","","4313","4322","10.1021/jo062672z","","","0.71073","MoKα","","0.1019","0.0816","","","0.2069","0.2208","","","","","","1.088","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022862","22.9892","0.0007","14.185","0.0007","11.4255","0.0011","90","","90.157","0.0019","90","","3725.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H32 N12 O4 -","- C42 H32 N12 O4 -","- C168 H128 N48 O16 -","4","1","","Hai-Bo Yang; De-Xian Wang; Qi-Qiang Wang; Mei-Xiang Wang","Efficient Functionalizations of Heteroatom-Bridged Calix[2]arene[2]triazines on the Larger Rim","Journal of Organic Chemistry","2007","72","","3757","3763","10.1021/jo070001a","","","0.71073","MoKα","","0.1596","0.0606","","","0.1502","0.1905","","","","","","0.75","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022863","7.7348","0.0008","9.2886","0.001","16.28","0.0017","90","","101.646","0.002","90","","1145.6","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H15 F O2 S -","- C12 H15 F O2 S -","- C48 H60 F4 O8 S4 -","4","1","","Weike Su; Jiuxi Chen; Huayue Wu; Can Jin","A General and Efficient Method for the Selective Synthesis of β-Hydroxy Sulfides and β-Hydroxy Sulfoxides Catalyzed by Gallium(III) Triflate","Journal of Organic Chemistry","2007","72","","4524","4527","10.1021/jo0700124","","","0.71073","MoKα","","0.0714","0.0628","","","0.1248","0.1293","","","","","","1.228","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022864","5.76","0.0013","7.7918","0.0018","12.005","0.003","75.975","0.004","89.036","0.004","87.63","0.004","522.3","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H10 Cl F O2 S -","- C9 H10 Cl F O2 S -","- C18 H20 Cl2 F2 O4 S2 -","2","1","","Weike Su; Jiuxi Chen; Huayue Wu; Can Jin","A General and Efficient Method for the Selective Synthesis of β-Hydroxy Sulfides and β-Hydroxy Sulfoxides Catalyzed by Gallium(III) Triflate","Journal of Organic Chemistry","2007","72","","4524","4527","10.1021/jo0700124","","","0.71073","MoKα","","0.0756","0.0631","","","0.1361","0.1434","","","","","","1.153","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022865","5.5752","0.0008","17.573","0.003","12.2136","0.0018","90","","93.249","0.003","90","","1194.7","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H16 O3 S -","- C12 H16 O3 S -","- C48 H64 O12 S4 -","4","1","","Weike Su; Jiuxi Chen; Huayue Wu; Can Jin","A General and Efficient Method for the Selective Synthesis of β-Hydroxy Sulfides and β-Hydroxy Sulfoxides Catalyzed by Gallium(III) Triflate","Journal of Organic Chemistry","2007","72","","4524","4527","10.1021/jo0700124","","","0.71073","MoKα","","0.0982","0.0906","","","0.1718","0.175","","","","","","1.35","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022866","6.1101","0.0002","16.2044","0.0005","9.8807","0.0003","90","","95.641","0.002","90","","973.56","0.05","294","2","294","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","","","- C20 H19 Cl N O3 -","- C20 H19 Cl N O3 -","- C40 H38 Cl2 N2 O6 -","2","1","","Mark Bell; Thomas B. Poulsen; Karl Anker Jørgensen","Organocatalytic Enantioselective Nucleophilic Vinylic Substitution by α-Substituted-α-Cyanoacetates under Phase-Transfer Conditions","Journal of Organic Chemistry","2007","72","","3053","3056","10.1021/jo070024p","","x-ray","0.71073","MoKα","","0.0637","0.0441","","","0.1125","0.1208","","","","","","0.952","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022867","14.8016","0.0008","10.8598","0.0005","24.891","0.001","90","","90","","90","","4001","0.4","153.1","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H22 N2 O4 S -","- C24 H22 N2 O4 S -","- C192 H176 N16 O32 S8 -","8","1","","Yoko Murakami; Noriyuki Yoshimoto; Nobutaka Fujieda; Kei Ohkubo; Tatsuhiko Hasegawa; Kenji Kano; Shunichi Fukuzumi; Shinobu Itoh","Model Studies of 6,7-Indolequinone Cofactors of Quinoprotein Amine Dehydrogenases","Journal of Organic Chemistry","2007","72","","3369","3380","10.1021/jo0700272","","","0.7107","MoKα","","","0.033","","","","0.045","","","","","","1.018","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022868","8.87","0.01","11.09","0.01","14.48","0.02","90","","98.38","0.06","90","","1408","3","153.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H16 N2 O2 -","- C17 H16 N2 O2 -","- C68 H64 N8 O8 -","4","1","","Yoko Murakami; Noriyuki Yoshimoto; Nobutaka Fujieda; Kei Ohkubo; Tatsuhiko Hasegawa; Kenji Kano; Shunichi Fukuzumi; Shinobu Itoh","Model Studies of 6,7-Indolequinone Cofactors of Quinoprotein Amine Dehydrogenases","Journal of Organic Chemistry","2007","72","","3369","3380","10.1021/jo0700272","","","0.7107","MoKα","","","0.045","","","","0.061","","","","","","1.187","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022869","7.258","0.0015","12.171","0.002","17.846","0.003","74.797","0.016","89.679","0.016","79.18","0.016","1492.6","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","cs523","","","- C33 H37 N O12 -","- C33 H37 N O12 -","- C66 H74 N2 O24 -","2","1","","Harry W. Gibson; Hong Wang; Carla Slebodnick; Joseph Merola; W. Scott Kassel; Arnold L. Rheingold","Isomeric 2,6-Pyridino-Cryptands Based on Dibenzo-24-crown-8","Journal of Organic Chemistry","2007","72","","3381","3393","10.1021/jo070030l","","x-ray","1.54178","CuKα","","0.0768","0.0569","","","0.1427","0.1562","","","","","","1.04","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022870","18.588","0.003","7.3111","0.0011","23.438","0.004","90","","109.717","0.015","90","","2998.5","0.8","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","cs649","","","- C33 H37 N O12 -","- C33 H37 N O12 -","- C132 H148 N4 O48 -","4","1","","Harry W. Gibson; Hong Wang; Carla Slebodnick; Joseph Merola; W. Scott Kassel; Arnold L. Rheingold","Isomeric 2,6-Pyridino-Cryptands Based on Dibenzo-24-crown-8","Journal of Organic Chemistry","2007","72","","3381","3393","10.1021/jo070030l","","x-ray","0.71073","MoKα","","0.1442","0.0649","","","0.1519","0.207","","","","","","0.975","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022871","7.8913","0.0004","14.053","0.0007","14.1863","0.0007","81.884","0.001","79.67","0.001","89.428","0.001","1532.02","0.13","100","2","100","2","","","","","","","","4","P -1","-P 1","2","gib65","","","- C33 H37 N O12 -","- C33 H37 N O12 -","- C66 H74 N2 O24 -","2","1","","Harry W. Gibson; Hong Wang; Carla Slebodnick; Joseph Merola; W. Scott Kassel; Arnold L. Rheingold","Isomeric 2,6-Pyridino-Cryptands Based on Dibenzo-24-crown-8","Journal of Organic Chemistry","2007","72","","3381","3393","10.1021/jo070030l","","","0.71073","MoKα","","0.0425","0.0389","","","0.0973","0.0999","","","","","","1.051","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022872","10.545","0.003","13.057","0.003","19.973","0.006","80.93","0.02","75.01","0.03","71.65","0.02","2512.7","1.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","cs537","","","- C47 H55 F12 N3 O14 P2 -","- C47 H54 F12 N3 O14 P2 -","- C94 H108 F24 N6 O28 P4 -","2","1","","Harry W. Gibson; Hong Wang; Carla Slebodnick; Joseph Merola; W. Scott Kassel; Arnold L. Rheingold","Isomeric 2,6-Pyridino-Cryptands Based on Dibenzo-24-crown-8","Journal of Organic Chemistry","2007","72","","3381","3393","10.1021/jo070030l","","x-ray","1.54178","CuKα","","0.0956","0.0683","","","0.1708","0.1841","","","","","","1.072","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022873","14.0661","0.0012","19.6477","0.0015","37.765","0.002","90","","90","","90","","10437","1.3","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","cs641","","","- C48.5 H58 F12 N3 O14.5 P2 -","- C48.5 H58 F12 N3 O14.5 P2 -","- C388 H464 F96 N24 O116 P16 -","8","1","","Harry W. Gibson; Hong Wang; Carla Slebodnick; Joseph Merola; W. Scott Kassel; Arnold L. Rheingold","Isomeric 2,6-Pyridino-Cryptands Based on Dibenzo-24-crown-8","Journal of Organic Chemistry","2007","72","","3381","3393","10.1021/jo070030l","","x-ray","0.71073","MoKα","","0.1694","0.1285","","","0.3295","0.3604","","","","","","1.284","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4022874","9.6495","0.0017","10.9594","0.0015","17.261","0.003","93.1","0.012","95.003","0.014","97.215","0.013","1800.1","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","cs613","","","- C33 H41 F6 N2 O12 P -","- C33 H41 F6 N2 O12 P -","- C66 H82 F12 N4 O24 P2 -","2","1","","Harry W. Gibson; Hong Wang; Carla Slebodnick; Joseph Merola; W. Scott Kassel; Arnold L. Rheingold","Isomeric 2,6-Pyridino-Cryptands Based on Dibenzo-24-crown-8","Journal of Organic Chemistry","2007","72","","3381","3393","10.1021/jo070030l","","x-ray","0.71073","MoKα","","0.0909","0.0493","","","0.1114","0.1259","","","","","","0.939","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022875","10.0938","0.0009","13.8315","0.0012","15.2862","0.0013","82.623","0.007","76.595","0.007","73.262","0.008","1983.7","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","cs617","","","- C34 H42 Cl3 F6 N2 O12 P -","- C34 H42 Cl3 F6 N2 O12 P -","- C68 H84 Cl6 F12 N4 O24 P2 -","2","1","","Harry W. Gibson; Hong Wang; Carla Slebodnick; Joseph Merola; W. Scott Kassel; Arnold L. Rheingold","Isomeric 2,6-Pyridino-Cryptands Based on Dibenzo-24-crown-8","Journal of Organic Chemistry","2007","72","","3381","3393","10.1021/jo070030l","","x-ray","0.71073","MoKα","","0.0638","0.0472","","","0.1238","0.1345","","","","","","1.067","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022876","10.5112","0.0015","12.934","0.002","14.7845","0.0019","79.34","0.013","87.826","0.011","66.575","0.015","1811.1","0.5","100","2","100","2","","","","","","","","7","P -1","-P 1","2","cs609","","","- C33 H37 F6 K N O12 P -","- C33 H37 F6 K N O12 P -","- C66 H74 F12 K2 N2 O24 P2 -","2","1","","Harry W. Gibson; Hong Wang; Carla Slebodnick; Joseph Merola; W. Scott Kassel; Arnold L. Rheingold","Isomeric 2,6-Pyridino-Cryptands Based on Dibenzo-24-crown-8","Journal of Organic Chemistry","2007","72","","3381","3393","10.1021/jo070030l","","x-ray","0.71073","MoKα","","0.1362","0.0626","","","0.1011","0.1228","","","","","","0.925","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022877","9.4151","0.001","10.1706","0.0011","19.062","0.002","91.942","0.009","90.385","0.009","98.19","0.009","1805.5","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","cs629","","","- C33 H37 F6 K N O12 P -","- C33 H37 F6 K N O12 P -","- C66 H74 F12 K2 N2 O24 P2 -","2","1","","Harry W. Gibson; Hong Wang; Carla Slebodnick; Joseph Merola; W. Scott Kassel; Arnold L. Rheingold","Isomeric 2,6-Pyridino-Cryptands Based on Dibenzo-24-crown-8","Journal of Organic Chemistry","2007","72","","3381","3393","10.1021/jo070030l","","x-ray","0.71073","MoKα","","0.0817","0.0503","","","0.1184","0.1365","","","","","","1.012","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022878","20.275","0.001","19.9664","0.0008","24.5479","0.001","90","","114.013","0.001","90","","9077.4","0.7","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C90.5 H105.75 F12 N7.25 O17 P2 -","- C90.5 H105.75 F12 N7.25 O17 P2 -","- C362 H423 F48 N29 O68 P8 -","4","1","","Tao Han; Qian-Shou Zong; Chuan-Feng Chen","Complexation of Triptycene-Based Cylindrical Macrotricyclic Polyether toward Diquaternary Salts: Ion-Controlled Binding and Release of the Guests","Journal of Organic Chemistry","2007","72","","3108","3111","10.1021/jo070035i","","","0.7107","MoKα","","0.088","0.0681","","","0.1824","0.2006","","","","","","1.075","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4022879","17.996","0.003","18.364","0.003","28.784","0.003","90","","91.452","0.007","90","","9509","2","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C94 H106 F12 N8 O16 P2 -","- C94 H106 F12 N8 O16 P2 -","- C376 H424 F48 N32 O64 P8 -","4","1","","Tao Han; Qian-Shou Zong; Chuan-Feng Chen","Complexation of Triptycene-Based Cylindrical Macrotricyclic Polyether toward Diquaternary Salts: Ion-Controlled Binding and Release of the Guests","Journal of Organic Chemistry","2007","72","","3108","3111","10.1021/jo070035i","","","0.7107","MoKα","","0.1534","0.1259","","","0.3263","0.3444","","","","","","1.116","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022880","7.72","0.02","26.56","0.08","9.43","0.04","90","","89.8","0.2","90","","1933","11","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H17 Cr N O5 -","- C21 H17 Cr N O6 -","- C84 H68 Cr4 N4 O24 -","4","2","","Ken Kamikawa; Shunsuke Kinoshita; Masaru Furusyo; Shin Takemoto; Hiroyuki Matsuzaka; Motokazu Uemura","Stereoselective Synthesis of Both Enantiomers of N-Aryl Indoles with Axially Chiral N-C Bonds","Journal of Organic Chemistry","2007","72","","3394","3402","10.1021/jo0700427","","","0.71075","MoKα","","0.1976","0.1026","","","0.2551","0.3137","","","","","","0.949","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022881","14.681","0.002","14.7727","0.0019","37.15","0.006","90","","90","","90","","8057","2","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C22 H19 Cr N O5 -","- C22 H19 Cr N O5 -","- C352 H304 Cr16 N16 O80 -","16","2","","Ken Kamikawa; Shunsuke Kinoshita; Masaru Furusyo; Shin Takemoto; Hiroyuki Matsuzaka; Motokazu Uemura","Stereoselective Synthesis of Both Enantiomers of N-Aryl Indoles with Axially Chiral N-C Bonds","Journal of Organic Chemistry","2007","72","","3394","3402","10.1021/jo0700427","","","0.71075","MoKα","","0.1656","0.0597","","","0.1239","0.1602","","","","","","0.891","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022882","16.371","0.003","7.3063","0.0012","17.618","0.003","90","","108.702","0.008","90","","1996","0.6","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H19 Cr N O5 -","- C22 H19 Cr N O5 -","- C88 H76 Cr4 N4 O20 -","4","1","","Ken Kamikawa; Shunsuke Kinoshita; Masaru Furusyo; Shin Takemoto; Hiroyuki Matsuzaka; Motokazu Uemura","Stereoselective Synthesis of Both Enantiomers of N-Aryl Indoles with Axially Chiral N-C Bonds","Journal of Organic Chemistry","2007","72","","3394","3402","10.1021/jo0700427","","","0.71075","MoKα","","0.0993","0.0544","","","0.1279","0.1452","","","","","","0.959","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022883","10.906","0.005","7.759","0.003","14.372","0.009","90","","107.04","0.02","90","","1162.9","0.1","296.1","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C24 H27 Cr N O3 Si -","- C24 H24 Cr N O3 Si -","- C48 H48 Cr2 N2 O6 Si2 -","2","1","","Ken Kamikawa; Shunsuke Kinoshita; Masaru Furusyo; Shin Takemoto; Hiroyuki Matsuzaka; Motokazu Uemura","Stereoselective Synthesis of Both Enantiomers of N-Aryl Indoles with Axially Chiral N-C Bonds","Journal of Organic Chemistry","2007","72","","3394","3402","10.1021/jo0700427","","","0.7107","MoKα","","","0.033","","","","0.037","","","","","","1.522","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022884","8.3367","0.0004","15.6339","0.0006","32.1238","0.0013","90","","90","","90","","4186.9","0.3","113","2","113","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C53 H39 Cl3 O4 -","- C53 H39 Cl3 O4 -","- C212 H156 Cl12 O16 -","4","1","","Cheng Wang; Lingyun Zhu; Junfeng Xiang; Yanxin Yu; Deqing Zhang; Zhigang Shuai; Daoben Zhu","Chiral Molecular Switches Based on Binaphthalene Molecules with Anthracene Moieties: CD Signal Due to Interchromophoric Exciton Coupling and Modulation of the CD Spectrum","Journal of Organic Chemistry","2007","72","","4306","4312","10.1021/jo070044r","","","0.7107","MoKα","","0.0616","0.0498","","","0.1137","0.1215","","","","","","1.067","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022885","11.3184","0.0004","13.7588","0.0004","15.7957","0.0006","84.63","0.001","80.456","0.001","83.949","0.002","2404.99","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H80 O6 Si2 -","- C42 H79 O6 Si2 -","- C84 H158 O12 Si4 -","2","1","","Julien Bourdron; Laurent Commeiras; Gérard Audran; Nicolas Vanthuyne; J. C. Hubaud; Jean-Luc Parrain","First Total Synthesis and Assignment of the Stereochemistry of Crispatenine","Journal of Organic Chemistry","2007","72","","3770","3775","10.1021/jo070045j","","","0.71073","MoKα","","0.2714","0.1726","","","0.376","0.4404","","","","","","1.027","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022886","7.5703","0.0008","7.9949","0.0004","21.228","0.002","80.323","0.01","88.66","0.01","82.94","0.01","1256.9","0.2","173.2","","173.2","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H26 Cl4 O4 -","- C26 H26 Cl4 O4 -","- C52 H52 Cl8 O8 -","2","1","","Masayuki Inoue; Nayoung Lee; Satoshi Kasuya; Takaaki Sato; Masahiro Hirama; Miyako Moriyama; Yoshiyasu Fukuyama","Total Synthesis and Bioactivity of an Unnatural Enantiomer of Merrilactone A: Development of an Enantioselective Desymmetrization Strategy","Journal of Organic Chemistry","2007","72","","3065","3075","10.1021/jo0700474","","","0.7107","MoKα","","","0.0375","","","","0.0369","","","","","","0.465","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022887","10.51","0.003","11.488","0.004","20.74","0.006","90","","90","","90","","2504.1","1.3","173.1","","173.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H26 Cl4 O4 -","- C26 H26 Cl4 O4 -","- C104 H104 Cl16 O16 -","4","1","","Masayuki Inoue; Nayoung Lee; Satoshi Kasuya; Takaaki Sato; Masahiro Hirama; Miyako Moriyama; Yoshiyasu Fukuyama","Total Synthesis and Bioactivity of an Unnatural Enantiomer of Merrilactone A: Development of an Enantioselective Desymmetrization Strategy","Journal of Organic Chemistry","2007","72","","3065","3075","10.1021/jo0700474","","","0.7107","MoKα","","","0.028","","","","0.069","","","","","","1.003","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022888","21.277","0.004","10.565","0.002","11.624","0.002","90","","90","","90","","2613","0.9","143","1","143","1","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C13 H19 N O3 -","- C13 H19 N O3 -","- C104 H152 N8 O24 -","8","1","","Grant R. Krow; Qiuli Huang; Steven W. Szczepanski; Fredrick H. Hausheer; Patrick J. Carroll","Stereoselectivity in Diels-Alder Reactions of Diene-Substituted N-Alkoxycarbonyl-1,2-dihydropyridines","Journal of Organic Chemistry","2007","72","","3458","3466","10.1021/jo0700575","","","0.7107","MoKα","","0.0543","0.0495","","","0.1327","0.1368","","","","","","1.113","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022889","15.599","0.002","12.4777","0.0018","17.832","0.002","90","","94.005","0.002","90","","3462.3","0.8","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H34 Cl2 N4 O2 -","- C38 H34 Cl2 N4 O2 -","- C152 H136 Cl8 N16 O8 -","4","1","","Ying Cheng; Lan-Qing Cheng","Interaction of β-Lactam Carbenes with Aryl Isonitriles: An Unprecedented Rearrangement of 2-Azetidinonylidene Indoles to δ-Carbolinones","Journal of Organic Chemistry","2007","72","","2625","2630","10.1021/jo0700631","","","0.71073","MoKα","","0.0943","0.0447","","","0.1034","0.1244","","","","","","1.008","","","","has coordinates","178407","2020-10-21","18:00:00",""
"4022890","8.9918","0.0014","16.947","0.003","24.121","0.004","90","","96.109","0.002","90","","3654.8","1","113","2","113","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39 H34 Br2 Cl2 N4 O3.5 -","- C39 H34 Br2 Cl2 N4 O3.5 -","- C156 H136 Br8 Cl8 N16 O14 -","4","1","","Ying Cheng; Lan-Qing Cheng","Interaction of β-Lactam Carbenes with Aryl Isonitriles: An Unprecedented Rearrangement of 2-Azetidinonylidene Indoles to δ-Carbolinones","Journal of Organic Chemistry","2007","72","","2625","2630","10.1021/jo0700631","","","0.7107","MoKα","","0.0689","0.0538","","","0.1409","0.1513","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022891","8.2163","0.0016","11.515","0.002","15.049","0.003","77.71","0.03","74.76","0.03","80.39","0.03","1333","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H25 Cl2 N3 O3 -","- C30 H25 Cl2 N3 O3 -","- C60 H50 Cl4 N6 O6 -","2","1","","Ying Cheng; Lan-Qing Cheng","Interaction of β-Lactam Carbenes with Aryl Isonitriles: An Unprecedented Rearrangement of 2-Azetidinonylidene Indoles to δ-Carbolinones","Journal of Organic Chemistry","2007","72","","2625","2630","10.1021/jo0700631","","","0.71073","MoKα","","0.0901","0.0492","","","0.1327","0.1495","","","","","","0.998","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022892","9.378","0.003","9.474","0.003","12.814","0.004","74.499","0.004","73.807","0.005","64.67","0.005","973.8","0.5","294","2","294","2","","","","","","","","5","P 1","P 1","1","","","","- C39 H30 Cl6 N4 O4 -","- C39 H30 Cl6 N4 O4 -","- C39 H30 Cl6 N4 O4 -","1","1","","Ying Cheng; Lan-Qing Cheng","Interaction of β-Lactam Carbenes with Aryl Isonitriles: An Unprecedented Rearrangement of 2-Azetidinonylidene Indoles to δ-Carbolinones","Journal of Organic Chemistry","2007","72","","2625","2630","10.1021/jo0700631","","","0.71073","MoKα","","0.0865","0.0408","","","0.0923","0.1142","","","","","","1.011","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022893","16.622","0.0002","9.368","0.0001","20.258","0.0003","90","","114.806","0.0009","90","","2863.42","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H19 N O3 -","- C16 H19 N O3 -","- C128 H152 N8 O24 -","8","2","","J. Carreras; A. Avenoza; J. H. Busto; J. M. Peregrina","Synthesis of Azabicyclo[2.2.n]alkane Systems as Analogues of 3-[1-Methyl-2-(S)-pyrrolidinyl-methoxy]pyridine (A-84543)","Journal of Organic Chemistry","2007","72","","3112","3115","10.1021/jo0700732","","","0.71073","MoKα","","0.0697","0.048","","","0.1089","0.1198","","","","","","1.049","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022894","6.22","0.0002","9.038","0.0004","8.042","0.0003","90","","93.32","0.0018","90","","451.33","0.03","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C8 H13 N O3 S -","- C8 H13 N O3 S -","- C16 H26 N2 O6 S2 -","2","1","","J. Carreras; A. Avenoza; J. H. Busto; J. M. Peregrina","Synthesis of Azabicyclo[2.2.n]alkane Systems as Analogues of 3-[1-Methyl-2-(S)-pyrrolidinyl-methoxy]pyridine (A-84543)","Journal of Organic Chemistry","2007","72","","3112","3115","10.1021/jo0700732","","","0.71073","MoKα","","0.0334","0.031","","","0.0769","0.0793","","","","","","1.068","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022895","13.162","0.007","8.015","0.004","18.976","0.007","90","","108.408","0.011","90","","1899.3","1.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 B N O4 -","- C20 H22 B N O4 -","- C80 H88 B4 N4 O16 -","4","1","","Alexander Oehlke; Alexander A. Auer; Ina Jahre; Bernhard Walfort; Tobias Rüffer; Petra Zoufalá; Heinrich Lang; Stefan Spange","Nitro-Substituted Stilbeneboronate Pinacol Esters and Their Fluoro-Adducts. Fluoride Ion Induced Polarity Enhancement of Arylboronate Esters","Journal of Organic Chemistry","2007","72","","4328","4339","10.1021/jo070084v","","","0.71073","MoKα","","0.071","0.0423","","","0.1048","0.1267","","","","","","1.034","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022896","7.0791","0.0015","8.5022","0.0019","18.497","0.004","79.652","0.004","79.306","0.004","79.706","0.004","1064","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H20 B N3 O8 -","- C20 H20 B N3 O8 -","- C40 H40 B2 N6 O16 -","2","1","","Alexander Oehlke; Alexander A. Auer; Ina Jahre; Bernhard Walfort; Tobias Rüffer; Petra Zoufalá; Heinrich Lang; Stefan Spange","Nitro-Substituted Stilbeneboronate Pinacol Esters and Their Fluoro-Adducts. Fluoride Ion Induced Polarity Enhancement of Arylboronate Esters","Journal of Organic Chemistry","2007","72","","4328","4339","10.1021/jo070084v","","","0.71073","MoKα","","0.1059","0.0597","","","0.1612","0.1959","","","","","","1.067","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022897","13.7068","0.0018","7.4595","0.0008","38.371","0.005","90","","90","","90","","3923.3","0.8","100","","100","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C20 H21 B N2 O6 -","- C20 H21 B N2 O6 -","- C160 H168 B8 N16 O48 -","8","2","","Alexander Oehlke; Alexander A. Auer; Ina Jahre; Bernhard Walfort; Tobias Rüffer; Petra Zoufalá; Heinrich Lang; Stefan Spange","Nitro-Substituted Stilbeneboronate Pinacol Esters and Their Fluoro-Adducts. Fluoride Ion Induced Polarity Enhancement of Arylboronate Esters","Journal of Organic Chemistry","2007","72","","4328","4339","10.1021/jo070084v","","","1.54184","CuKα","","0.0371","0.0318","","","0.0775","0.0829","","","","","","1.06","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022898","33.335","0.005","33.343","0.004","6.1898","0.0008","90","","90","","90","","6879.9","1.6","100","","100","","","","","","","","","4","P 42/n :2","-P 4bc","86","","","","- C20 H23 B O2 -","- C20 H23 B O2 -","- C320 H368 B16 O32 -","16","2","","Alexander Oehlke; Alexander A. Auer; Ina Jahre; Bernhard Walfort; Tobias Rüffer; Petra Zoufalá; Heinrich Lang; Stefan Spange","Nitro-Substituted Stilbeneboronate Pinacol Esters and Their Fluoro-Adducts. Fluoride Ion Induced Polarity Enhancement of Arylboronate Esters","Journal of Organic Chemistry","2007","72","","4328","4339","10.1021/jo070084v","","","1.54184","CuKα","","0.0596","0.041","","","0.099","0.1133","","","","","","1.051","","","","has coordinates,has disorder","178407","2020-10-21","18:00:00",""
"4022899","9.085","0.0009","9.085","0.0009","20.973","0.003","90","","90","","120","","1499.2","0.3","293","2","293","2","","","","","","","","5","P 65","P 65","170","","2-(2'-imidazolium)phenyl hydrogen phosphate","","- C9 H9 N2 O4 P -","- C9 H9 N2 O4 P -","- C54 H54 N12 O24 P6 -","6","1","","Tiago A. S. Brandão; Elisa S. Orth; Willian R. Rocha; Adailton J. Bortoluzzi; Clifford A. Bunton; Faruk Nome","Intramolecular General Acid Catalysis of the Hydrolysis of 2-(2'-Imidazolium)phenyl Phosphate, and Bond Length-Reactivity Correlations for Reactions of Phosphate Monoester Monoanions","Journal of Organic Chemistry","2007","72","","3800","3807","10.1021/jo070090r","","","0.71069","MoKα","","0.0454","0.0289","","","0.0671","0.0726","","","","","","1.041","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022900","11.7899","0.0012","12.046","0.0013","23.093","0.003","90","","90","","90","","3279.7","0.6","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C34 H38 F2 N2 O3 S2 -","- C34 H38 F2 N2 O3 S2 -","- C136 H152 F8 N8 O12 S8 -","4","1","","Jun Liu; Ya Li; Jinbo Hu","Stereoselective Synthesis of Di- and Monofluoromethylated Vicinal Ethylenediamines with Di- and Monofluoromethyl Sulfones","Journal of Organic Chemistry","2007","72","","3119","3121","10.1021/jo070094w","","","0.71073","MoKα","","0.1355","0.0574","","","0.0716","0.0878","","","","","","0.87","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022901","12.8346","0.0005","12.8346","0.0005","40.285","0.002","90","","90","","90","","6636","0.5","293","2","293","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C34 H38 F2 N2 O3 S2 -","- C34 H38 F2 N2 O3 S2 -","- C272 H304 F16 N16 O24 S16 -","8","1","","Jun Liu; Ya Li; Jinbo Hu","Stereoselective Synthesis of Di- and Monofluoromethylated Vicinal Ethylenediamines with Di- and Monofluoromethyl Sulfones","Journal of Organic Chemistry","2007","72","","3119","3121","10.1021/jo070094w","","","0.71073","MoKα","","0.0849","0.0466","","","0.0852","0.0957","","","","","","0.882","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022902","14.5299","0.0013","12.4665","0.0011","19.2638","0.0017","90","","106.777","0.002","90","","3340.9","0.5","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C34 H39 F N2 O3 S2 -","- C34 H39 F N2 O3 S2 -","- C136 H156 F4 N8 O12 S8 -","4","2","","Jun Liu; Ya Li; Jinbo Hu","Stereoselective Synthesis of Di- and Monofluoromethylated Vicinal Ethylenediamines with Di- and Monofluoromethyl Sulfones","Journal of Organic Chemistry","2007","72","","3119","3121","10.1021/jo070094w","","","0.71073","MoKα","","0.1083","0.0661","","","0.1615","0.1773","","","","","","0.865","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022903","25.36","0.014","10.164","0.006","9.526","0.005","90","","91.66","0.03","90","","2454","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 N2 O4 S4 -","- C24 H20 N2 O4 S4 -","- C96 H80 N8 O16 S16 -","4","1","","Sergio Andrés Pérez Guarín; Marie Bourgeaux; Stéphane Dufresne; W. G. Skene","Photophysical, Crystallographic, and Electrochemical Characterization of Symmetric and Unsymmetric Self-Assembled Conjugated Thiopheno Azomethines","Journal of Organic Chemistry","2007","72","","2631","2643","10.1021/jo070100o","","","1.54178","CuKα","","0.3798","0.2229","","","0.4734","0.5617","","","","","","1.095","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022904","12.32","0.003","13.408","0.003","14.101","0.003","86.89","0.008","87.282","0.006","84.369","0.006","2312.6","0.8","113","2","113","2","","","","","","","","3","P -1","-P 1","2","","","","- C60 H66 O6 -","- C60 H66 O6 -","- C120 H132 O12 -","2","1","","Zhongtao Li; Nigel T. Lucas; Zhaohui Wang; Daoben Zhu","Facile Synthesis of Janus ""Double-Concave"" Tribenzo[a,g,m]coronenes","Journal of Organic Chemistry","2007","72","","3917","3920","10.1021/jo0701029","","","0.7107","MoKα","","0.08","0.0538","","","0.1293","0.1464","","","","","","1.006","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022905","13.2555","0.0016","12.7977","0.0015","30.54","0.004","90","","93.444","0.001","90","","5171.4","1.1","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C60 H60 Cl6 O6 -","- C60 H60 Cl6 O6 -","- C240 H240 Cl24 O24 -","4","1","","Zhongtao Li; Nigel T. Lucas; Zhaohui Wang; Daoben Zhu","Facile Synthesis of Janus ""Double-Concave"" Tribenzo[a,g,m]coronenes","Journal of Organic Chemistry","2007","72","","3917","3920","10.1021/jo0701029","","","0.7107","MoKα","","0.0507","0.0423","","","0.0986","0.1043","","","","","","1.102","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022906","28.2853","0.0012","32.5755","0.0008","51.646","0.002","90","","90","","90","","47587","3","100","2","100","2","","","","","","","synthesis as described","7","P c a 21","P 2c -2ac","29","","","","- C266.67 H220 Cl40 I2.67 N5.33 O32 P10.67 -","- C266.5 H204.233 Cl39.5 I2.66667 N5.33333 O32 P10.6667 -","- C1599 H1225.4 Cl237 I16 N32 O192 P64 -","6","1.5","","Rita De Zorzi; Béatrice Dubessy; Jean-Christophe Mulatier; Silvano Geremia; Lucio Randaccio; Jean-Pierre Dutasta","Structure of a 4:1:4 Supramolecular Assembly of Neutral TiiiiPO Cavitands and Tetrakis(N-methylpyridinium)porphyrin Iodide","Journal of Organic Chemistry","2007","72","","4528","4531","10.1021/jo070109q","","","0.9","synchrotron","","0.1574","0.1302","","","0.3195","0.3519","","","","","","1.446","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022907","10.026","0.003","10.294","0.003","10.483","0.003","98.859","0.009","115.168","0.009","91.022","0.007","963.3","0.5","250","2","250","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H15 Cl2 N5 O S -","- C19 H15 Cl2 N5 O S -","- C38 H30 Cl4 N10 O2 S2 -","2","1","","Nikolai M. Evdokimov; Artem S. Kireev; Andrey A. Yakovenko; Mikhail Yu. Antipin; Igor V. Magedov; Alexander Kornienko","One-Step Synthesis of Heterocyclic Privileged Medicinal Scaffolds by a Multicomponent Reaction of Malononitrile with Aldehydes and Thiols","Journal of Organic Chemistry","2007","72","","3443","3453","10.1021/jo070114u","","","0.71073","MoKα","","0.0926","0.0521","","","0.0858","0.0955","","","","","","1","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022908","9.882","0.002","11.409","0.002","14.987","0.003","103.72","0.01","95.62","0.02","108.65","0.01","1527.46","0.59","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C38 H32 O5 -","- C38 H32 O5 -","- C76 H64 O10 -","2","1","","Li-Ping Zhang; Yong-Min Liang; Xiu-Cheng Wei; Dong-Liang Cheng","A New Unusual Natural Pigment from Selaginella sinensis and Its Noticeable Physicochemical Properties","Journal of Organic Chemistry","2007","72","","3921","3924","10.1021/jo0701177","","","0.71073","MoKα","","0.0649","0.0369","","","0.0885","0.0951","","","","","","0.921","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022909","11.6107","0.0011","5.6461","0.0005","14.452","0.0013","90","","95.483","0.002","90","","943.07","0.15","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","MAGJZ01","","","- C21 H26 N2 O3 -","- C21 H26 N2 O3 -","- C42 H52 N4 O6 -","2","1","","Jianguang Zhou; Nabi A. Magomedov","Explorations on the Asymmetric Total Synthesis of Isoschizogamine","Journal of Organic Chemistry","2007","72","","3808","3815","10.1021/jo070144x","","","0.71073","MoKα","","0.1521","0.0884","","","0.1326","0.1493","","","","","","1.074","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022910","8.714","0.0003","9.3235","0.0003","13.3131","0.0005","99.666","0.001","93.009","0.001","114.726","0.001","959.37","0.06","568","2","568","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H33 Ag Cl P -","- C18 H33 Ag Cl P -","- C36 H66 Ag2 Cl2 P2 -","2","1","","Giovanni Occhipinti; Vidar R. Jensen; Hans-René Bjørsvik","Green and Efficient Synthesis of Bidentate Schiff Base Ru Catalysts for Olefin Metathesis","Journal of Organic Chemistry","2007","72","","3561","3564","10.1021/jo070164z","","","0.71073","MoKα","","0.0259","0.0216","","","0.0539","0.0564","","","","","","1.061","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022911","10.7307","0.0015","18.003","0.003","9.4773","0.0014","90","","113.798","0.007","90","","1675.2","0.4","100","2","100","2","","","","","cooled to 269 K","","synthesized","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 N4 O3 -","- C17 H22 N4 O3 -","- C68 H88 N16 O12 -","4","1","","Brian S. Bodnar; Marvin J. Miller","Reactions of Nitroso Hetero-Diels-Alder Cycloadducts with Azides: Stereoselective Formation of Triazolines and Aziridines","Journal of Organic Chemistry","2007","72","","3929","3932","10.1021/jo0701987","","x-ray","0.71073","MoKα","","0.0555","0.0404","","","0.1027","0.1116","","","","","","1.033","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022912","5.6782","0.0002","12.3245","0.0004","12.3822","0.0004","108.048","0.002","102.326","0.002","90.219","0.002","802.61","0.05","100","2","100","2","","","","","cooled to 277 K","","synthesized","4","P -1","-P 1","2","","","","- C17 H22 N4 O3 -","- C17 H22 N4 O3 -","- C34 H44 N8 O6 -","2","1","","Brian S. Bodnar; Marvin J. Miller","Reactions of Nitroso Hetero-Diels-Alder Cycloadducts with Azides: Stereoselective Formation of Triazolines and Aziridines","Journal of Organic Chemistry","2007","72","","3929","3932","10.1021/jo0701987","","x-ray","0.71073","MoKα","","0.0457","0.0394","","","0.1046","0.1103","","","","","","1.076","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022913","18.0383","0.0003","18.0383","0.0003","11.9993","0.0003","90","","90","","120","","3381.25","0.12","160","1","160","1","","","","","","","","5","P 32","P 32","145","","","","- C17 H20 Cl N O -","- C17 H20 Cl N O -","- C153 H180 Cl9 N9 O9 -","9","3","","Giuseppe Borsato; Anthony Linden; Ottorino De Lucchi; Vittorio Lucchini; David Wolstenholme; Alfonso Zambon","Chiral Polycyclic Ketones via Desymmetrization of Dihaloolefins","Journal of Organic Chemistry","2007","72","","4272","4275","10.1021/jo070222g","","","0.71073","MoKα","","0.0754","0.0517","","","0.1141","0.1282","","","","","","1.067","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022914","9.3588","0.0002","12.2372","0.0002","19.5081","0.0003","90","","90","","90","","2234.18","0.07","160","1","160","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H24 Cl3 N O3 -","- C23 H24 Cl3 N O3 -","- C92 H96 Cl12 N4 O12 -","4","1","","Giuseppe Borsato; Anthony Linden; Ottorino De Lucchi; Vittorio Lucchini; David Wolstenholme; Alfonso Zambon","Chiral Polycyclic Ketones via Desymmetrization of Dihaloolefins","Journal of Organic Chemistry","2007","72","","4272","4275","10.1021/jo070222g","","","0.71073","MoKα","","0.0558","0.039","","","0.0832","0.091","","","","","","1.053","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022915","10.5116","0.0009","11.2613","0.001","19.5145","0.0018","78.166","0.001","82.396","0.001","64.257","0.001","2034.1","0.3","150","2","150","2","","","","","","","","4","P 1","P 1","1","","","","- C29 H39 Br O3 -","- C29 H39 Br O3 -","- C87 H117 Br3 O9 -","3","3","","Vincent Rodeschini; Nigel S. Simpkins; Claire Wilson","Kinetic Resolution in a Bridgehead Lithiation Mediated by a Chiral Bis-lithium Amide: Assignment of the Absolute Configuration of Clusianone","Journal of Organic Chemistry","2007","72","","4265","4267","10.1021/jo070225t","","","0.71073","MoKα","","0.0485","0.0406","","","0.0966","0.1006","","","","","","0.988","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022916","13.008","0.003","24.042","0.004","17.079","0.003","90","","106.986","0.007","90","","5108.4","1.7","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C61 H64 Cl3 O2 -","- C61 H65 Cl3 O2 -","- C244 H260 Cl12 O8 -","4","1","","Hassan Al-Saraierh; David O. Miller; Paris E. Georghiou","Photochemical Cycloisomerizations via 7-exo-dig Reactions on a Calix[4]arene Scaffold","Journal of Organic Chemistry","2007","72","","4532","4535","10.1021/jo070236m","","","0.7107","MoKα","","0.2157","0.1636","","","0.3557","0.3895","","","","","","1.177","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022917","8.0289","0.0009","10.8466","0.0012","12.11","0.0014","108.761","0.002","93.792","0.002","95.396","0.002","988.95","0.19","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H18 Br N O4 S -","- C19 H18 Br N O4 S -","- C38 H36 Br2 N2 O8 S2 -","2","1","","Ruwei Shen; Xian Huang","Reaction of 2,3-Allenoates with TsNBr~2~ in the Presence of Base: A Facile Highly Stereoselective Synthesis of (1E,2E)-3-Bromo-4-oxo-N'-tosyl-2-alkenoxylimidic Acid Ethyl Esters","Journal of Organic Chemistry","2007","72","","3961","3964","10.1021/jo070239z","","","0.71073","MoKα","","0.0663","0.0463","","","0.1089","0.1153","","","","","","0.875","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022918","8.8562","0.0015","18.118","0.003","14.055","0.002","90","","99.855","0.003","90","","2221.9","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 Br N O4 S -","- C24 H22 Br N O4 S -","- C96 H88 Br4 N4 O16 S4 -","4","1","","Ruwei Shen; Xian Huang","Reaction of 2,3-Allenoates with TsNBr~2~ in the Presence of Base: A Facile Highly Stereoselective Synthesis of (1E,2E)-3-Bromo-4-oxo-N'-tosyl-2-alkenoxylimidic Acid Ethyl Esters","Journal of Organic Chemistry","2007","72","","3961","3964","10.1021/jo070239z","","","0.71073","MoKα","","0.1057","0.0607","","","0.1261","0.1372","","","","","","0.841","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022919","8.379","0.005","17.493","0.005","17.621","0.005","90","0.005","90","0.005","90","0.005","2582.8","1.9","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H12 O2 S2 -","- C14 H12 O2 S2 -","- C112 H96 O16 S16 -","8","2","","Jun Liu; Mang Wang; Bing Li; Qun Liu; Yulong Zhao","A Divergent Synthesis of Functionalized Unsaturated δ-Lactones from α-Alkenoyl-α-carboxyl Ketene Dithioacetals","Journal of Organic Chemistry","2007","72","","4401","4405","10.1021/jo0702488","","","0.71069","MoKα","","0.1274","0.0624","","","0.103","0.1261","","","","","","0.989","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022920","25.454","0.003","11.0665","0.0014","18.796","0.002","90","","103.541","0.002","90","","5147.5","1.1","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H40 Cl8 N2 O5 -","- C56 H40 Cl8 N2 O5 -","- C224 H160 Cl32 N8 O20 -","4","0.5","","Chun Zhang; Chuan-Feng Chen","Triptycene-Based Expanded Oxacalixarenes: Synthesis, Structure, and Tubular Assemblies in the Solid State","Journal of Organic Chemistry","2007","72","","3880","3888","10.1021/jo0702490","","","0.71073","MoKα","","0.1232","0.0609","","","0.1631","0.2018","","","","","","1.01","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022921","8.7116","0.0017","9.7063","0.0019","13.761","0.003","95.19","0.03","93.16","0.03","96.43","0.03","1149","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H30 Cl8 N2 O4 -","- C52 H30 Cl8 N2 O4 -","- C52 H30 Cl8 N2 O4 -","1","0.5","","Chun Zhang; Chuan-Feng Chen","Triptycene-Based Expanded Oxacalixarenes: Synthesis, Structure, and Tubular Assemblies in the Solid State","Journal of Organic Chemistry","2007","72","","3880","3888","10.1021/jo0702490","","","0.71073","MoKα","","0.1136","0.0729","","","0.1867","0.2136","","","","","","1.033","","","","has coordinates,has disorder","205842","2020-10-21","18:00:00",""
"4022922","41.277","0.015","19.829","0.006","29.101","0.01","90","","119.396","0.004","90","","20752","12","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46 H24 Cl2 N6 O4 -","- C46 H24 Cl2 N6 O4 -","- C552 H288 Cl24 N72 O48 -","12","1.5","","Chun Zhang; Chuan-Feng Chen","Triptycene-Based Expanded Oxacalixarenes: Synthesis, Structure, and Tubular Assemblies in the Solid State","Journal of Organic Chemistry","2007","72","","3880","3888","10.1021/jo0702490","","","0.7107","MoKα","","0.1716","0.0835","","","0.2176","0.2605","","","","","","0.971","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022923","12.1813","0.0039","15.6261","0.0051","15.9368","0.0049","63.269","0.006","77.693","0.006","86.662","0.007","2644.6","","","","","","","","","","","","","2","P -1","-P 1","2","","","","- C120 Cl4 -","- C120 Cl4 -","- C120 Cl4 -","","","","Chun Zhang; Chuan-Feng Chen","Triptycene-Based Expanded Oxacalixarenes: Synthesis, Structure, and Tubular Assemblies in the Solid State","Journal of Organic Chemistry","2007","72","","3880","3888","10.1021/jo0702490","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4022924","13.4226","0.0009","13.4226","0.0009","13.1399","0.0018","90","","90","","90","","2367.4","0.4","120","2","120","2","","","","","","","","4","P 41","P 4w","76","","","","- C27 H33 Br O2 -","- C27 H33 Br O2 -","- C108 H132 Br4 O8 -","4","1","","Douglass F. Taber; M. Inthikhab Sikkander; Pierre H. Storck","Enantioselective Synthesis of (+)-Majusculone","Journal of Organic Chemistry","2007","72","","4098","4101","10.1021/jo070257g","","","0.71073","MoKα","","0.113","0.0601","","","0.1133","0.1306","","","","","","1.013","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022925","10.962","0.005","9.459","0.004","19.286","0.003","90","","108.524","0.018","90","","1896.2","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H19 N3 O6 -","- C20 H19 N3 O6 -","- C80 H76 N12 O24 -","4","1","","Teresa M. V. D. Pinho e Melo; Cláudio M. Nunes; Maria I. L. Soares; José A. Paixão; Ana Matos Beja; Manuela Ramos Silva","Chemistry of Diazafulvenium Methides in the Synthesis of Functionalized Pyrazoles","Journal of Organic Chemistry","2007","72","","4406","4415","10.1021/jo070265x","","","1.5418","CuKα","","0.0737","0.0438","","","0.1498","0.1634","","","","","","1.157","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022926","21.1387","0.0009","5.0292","0.0002","14.2143","0.0006","90","","124.921","0.002","90","","1239.04","0.09","100","","100","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C32 H24 N2 O2 -","- C32 H24 N2 O2 -","- C64 H48 N4 O4 -","2","0.5","","Karl B. Lindsay; Francesc Ferrando; Kasper L. Christensen; Jacob Overgaard; Tomàs Roca; M.-Lluïsa Bennasar; Troels Skrydstrup","SmI~2~-Promoted Radical Addition Reactions with N-(2-Indolylacyl)oxazolidinones: Synthesis of Bisindole Compounds","Journal of Organic Chemistry","2007","72","","4181","4188","10.1021/jo070273d","","","0.71073","MoKα","","","0.06","","","","0.047","","","","","","1.13","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022927","10.6371","0.0013","10.8663","0.0013","15.4189","0.0018","82.063","0.006","72.625","0.006","72.781","0.006","1622.2","0.3","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C38 H29 Cl2 N3 O8 -","- C38 H29 Cl2 N3 O8 -","- C76 H58 Cl4 N6 O16 -","2","1","","Karl B. Lindsay; Francesc Ferrando; Kasper L. Christensen; Jacob Overgaard; Tomàs Roca; M.-Lluïsa Bennasar; Troels Skrydstrup","SmI~2~-Promoted Radical Addition Reactions with N-(2-Indolylacyl)oxazolidinones: Synthesis of Bisindole Compounds","Journal of Organic Chemistry","2007","72","","4181","4188","10.1021/jo070273d","","x-ray","0.71073","MoKα","","0.0636","0.048","","","0.1248","0.1328","","","","","","1.107","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022928","13.717","0.002","5.1567","0.0009","18.788","0.003","90","","104.187","0.006","90","","1288.4","0.4","100","2","100","2","","","","","","","synthesis as described","4","P 1 2/n 1","-P 2yac","13","","","","- C34 H24 N2 O6 -","- C34 H24 N2 O6 -","- C68 H48 N4 O12 -","2","0.5","","Karl B. Lindsay; Francesc Ferrando; Kasper L. Christensen; Jacob Overgaard; Tomàs Roca; M.-Lluïsa Bennasar; Troels Skrydstrup","SmI~2~-Promoted Radical Addition Reactions with N-(2-Indolylacyl)oxazolidinones: Synthesis of Bisindole Compounds","Journal of Organic Chemistry","2007","72","","4181","4188","10.1021/jo070273d","","","0.71073","MoKα","","0.0935","0.0487","","","0.1358","0.2043","","","","","","0.762","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022929","11.702","0.004","15.52","0.005","6.3747","0.0018","90","","102.619","0.01","90","","1129.8","0.6","100","2","100","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H22 N2 O2 -","- C32 H22 N2 O2 -","- C64 H44 N4 O4 -","2","0.5","","Karl B. Lindsay; Francesc Ferrando; Kasper L. Christensen; Jacob Overgaard; Tomàs Roca; M.-Lluïsa Bennasar; Troels Skrydstrup","SmI~2~-Promoted Radical Addition Reactions with N-(2-Indolylacyl)oxazolidinones: Synthesis of Bisindole Compounds","Journal of Organic Chemistry","2007","72","","4181","4188","10.1021/jo070273d","","x-ray","0.71073","MoKα","","0.1225","0.0635","","","0.1332","0.1528","","","","","","1.005","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022930","11.1159","0.0006","13.2673","0.0007","11.7064","0.0007","90","","111.224","0.001","90","","1609.34","0.15","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H38 N2 O2 P2 -","- C40 H38 N2 O2 P2 -","- C80 H76 N4 O4 P4 -","2","0.5","","Gloria Ruiz-Gómez; María José Iglesias; Manuel Serrano-Ruiz; Santiago García-Granda; Andrés Francesch; Fernando López-Ortiz; Carmen Cuevas","Double Dearomatization of Bis(diphenylphosphinamides) through Anionic Cyclization. A Facile Route of Accessing Multifunctional Systems with Antitumor Properties","Journal of Organic Chemistry","2007","72","","3790","3799","10.1021/jo070276q","","","0.71073","MoKα","","0.0509","0.0417","","","0.1008","0.1048","","","","","","1.007","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022931","9.546","0.001","14.9535","0.0016","12.3925","0.0012","90","","100.319","0.002","90","","1740.4","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H42 N2 O2 P2 -","- C42 H42 N2 O2 P2 -","- C84 H84 N4 O4 P4 -","2","0.5","","Gloria Ruiz-Gómez; María José Iglesias; Manuel Serrano-Ruiz; Santiago García-Granda; Andrés Francesch; Fernando López-Ortiz; Carmen Cuevas","Double Dearomatization of Bis(diphenylphosphinamides) through Anionic Cyclization. A Facile Route of Accessing Multifunctional Systems with Antitumor Properties","Journal of Organic Chemistry","2007","72","","3790","3799","10.1021/jo070276q","","","0.71069","MoKα","","0.1372","0.0611","","","0.0735","0.0928","","","","","","0.804","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022932","13.9441","0.0005","7.5494","0.0003","14.9398","0.0005","90","","105.557","0.002","90","","1515.09","0.1","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(rac)-1","","","- C16 H12 F3 N3 O2 -","- C16 H12 F3 N3 O2 -","- C64 H48 F12 N12 O8 -","4","1","","Alan R. Katritzky; Prabhu P. Mohapatra; Dmytro Fedoseyenko; Matthew Duncton; Peter J. Steel","1-Benzotriazol-1-yl-3,3,3-trifluoro-2-methoxy-2-phenylpropan-1-ones: Mosher-Bt Reagents","Journal of Organic Chemistry","2007","72","","4268","4271","10.1021/jo070278a","","","0.71073","MoKα","","0.0592","0.042","","","0.1119","0.1237","","","","","","1.028","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022933","8.458","0.002","16.354","0.007","17.991","0.007","90","","90","","90","","2488.6","1.6","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H31 N O4 S -","- C28 H31 N O4 S -","- C112 H124 N4 O16 S4 -","4","1","","Huimin Zhai; Masood Parvez; Thomas G. Back","A Highly Stereoselective Synthesis of (-)-(ent)-Julifloridine from the Cyclization of an Alanine-Derived Chloroamine with an Acetylenic Sulfone","Journal of Organic Chemistry","2007","72","","3853","3858","10.1021/jo0703101","","","0.71073","MoKα","","0.0634","0.0451","","","0.0954","0.1046","","","","","","1.032","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022934","9.0989","0.0008","10.8894","0.0009","15.5127","0.0013","90","","96.359","0.003","90","","1527.6","0.2","90","2","90","2","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C18 H19 N O2 S -","- C18 H19 N O2 S -","- C72 H76 N4 O8 S4 -","4","2","","Eric S. Sherman; Peter H. Fuller; Dhanalakshmi Kasi; Sherry R. Chemler","Pyrrolidine and Piperidine Formation via Copper(II) Carboxylate-Promoted Intramolecular Carboamination of Unactivated Olefins: Diastereoselectivity and Mechanism","Journal of Organic Chemistry","2007","72","","3896","3905","10.1021/jo070321u","","","0.71073","MoKα","","0.0383","0.0344","","","0.0695","0.0709","","","","","","1.539","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022935","11.0885","0.0013","6.3626","0.0008","25.563","0.003","90","","100.547","0.005","90","","1773.1","0.4","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-Cyclohexylmethyl-8-methyl-2,3,10,10a-tetrahydro-1H-pyrrolo[1,2-b] [1,2]benzothiazine 5,5-dioxide","","- C19 H27 N O2 S -","- C19 H27 N O2 S -","- C76 H108 N4 O8 S4 -","4","1","","Eric S. Sherman; Peter H. Fuller; Dhanalakshmi Kasi; Sherry R. Chemler","Pyrrolidine and Piperidine Formation via Copper(II) Carboxylate-Promoted Intramolecular Carboamination of Unactivated Olefins: Diastereoselectivity and Mechanism","Journal of Organic Chemistry","2007","72","","3896","3905","10.1021/jo070321u","","","0.71073","MoKα","","0.0604","0.0395","","","0.0872","0.0961","","","","","","1.009","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022936","7.849","0.0002","14.1571","0.0003","27.1001","0.0006","90","","90","","90","","3011.34","0.12","90","2","90","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H23 N O2 S -","- C15 H23 N O2 S -","- C120 H184 N8 O16 S8 -","8","2","","Eric S. Sherman; Peter H. Fuller; Dhanalakshmi Kasi; Sherry R. Chemler","Pyrrolidine and Piperidine Formation via Copper(II) Carboxylate-Promoted Intramolecular Carboamination of Unactivated Olefins: Diastereoselectivity and Mechanism","Journal of Organic Chemistry","2007","72","","3896","3905","10.1021/jo070321u","","","0.71073","MoKα","","0.0453","0.035","","","0.0769","0.0813","","","","","","1.049","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022937","7.2556","0.0009","10.8856","0.0014","31.743","0.004","90","","90","","90","","2507.1","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H41 Co O2 -","- C29 H41 Co O2 -","- C116 H164 Co4 O8 -","4","1","","Miguel A. Sierra; M. Rosario Torres; María C. de la Torre; Elsa Álvaro","Synthesis of Terpene and Steroid Dimers and Trimers Having Cyclobutadienyl-Co and Aromatic Tethers","Journal of Organic Chemistry","2007","72","","4213","4219","10.1021/jo0703698","","","0.71073","MoKα","","0.1259","0.0502","","","0.0759","0.0908","","","","","","0.838","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022938","11.8062","0.0014","12.4626","0.0016","18.529","0.003","90","","108.153","0.003","90","","2590.6","0.6","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C30 H41 Co O3 -","- C30 H41 Co O3 -","- C120 H164 Co4 O12 -","4","2","","Miguel A. Sierra; M. Rosario Torres; María C. de la Torre; Elsa Álvaro","Synthesis of Terpene and Steroid Dimers and Trimers Having Cyclobutadienyl-Co and Aromatic Tethers","Journal of Organic Chemistry","2007","72","","4213","4219","10.1021/jo0703698","","","0.71073","MoKα","","0.2493","0.0606","","","0.0789","0.1194","","","","","","0.714","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022939","11.1809","0.0014","8.245","0.001","12.1335","0.0015","90","","93.074","0.002","90","","1116.9","0.2","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H27 N O5 S2 -","- C24 H27 N O5 S2 -","- C48 H54 N2 O10 S4 -","2","1","","William H. Pearson; Jeffrey E. Kropf; Allison L. Choy; Ill Young Lee; Jeff W. Kampf","Approach to the Homoerythrina Alkaloids Using a Tandem N-Alkylation/Azomethine Ylide Cycloaddition","Journal of Organic Chemistry","2007","72","","4135","4148","10.1021/jo0703799","","","0.71073","MoKα","","0.0426","0.0362","","","0.0884","0.0918","","","","","","1.041","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022940","10.7047","0.0016","11.8402","0.0018","13.007","0.002","71.189","0.003","88.891","0.003","82.856","0.003","1548.1","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H30 Cl2 N4 O11 S -","- C27 H30 Cl2 N4 O11 S -","- C54 H60 Cl4 N8 O22 S2 -","2","1","","William H. Pearson; Jeffrey E. Kropf; Allison L. Choy; Ill Young Lee; Jeff W. Kampf","Approach to the Homoerythrina Alkaloids Using a Tandem N-Alkylation/Azomethine Ylide Cycloaddition","Journal of Organic Chemistry","2007","72","","4135","4148","10.1021/jo0703799","","","0.71073","MoKα","","0.0615","0.0485","","","0.134","0.1427","","","","","","1.058","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022941","20.6299","0.0018","19.1236","0.0017","13.9795","0.0012","90","","108.259","0.001","90","","5237.5","0.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C56 H82 Cl2 N4 -","- C56 H82 Cl2 N4 -","- C224 H328 Cl8 N16 -","4","1","","Rodolphe Jazzar; Jean-Baptiste Bourg; Rian D. Dewhurst; Bruno Donnadieu; Guy Bertrand","Intramolecular ""Hydroiminiumation and -amidiniumation"" of Alkenes: A Convenient, Flexible, and Scalable Route to Cyclic Iminium and Imidazolinium Salts","Journal of Organic Chemistry","2007","72","","3492","3499","10.1021/jo0703909","","","0.71073","MoKα","","0.0692","0.0587","","","0.1462","0.1522","","","","","","1.083","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022942","17.326","0.002","8.5078","0.001","21.213","0.003","90","","101.369","0.002","90","","3065.6","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H41 Cl4 N2 -","- C29 H41 Cl4 N2 -","- C116 H164 Cl16 N8 -","4","1","","Rodolphe Jazzar; Jean-Baptiste Bourg; Rian D. Dewhurst; Bruno Donnadieu; Guy Bertrand","Intramolecular ""Hydroiminiumation and -amidiniumation"" of Alkenes: A Convenient, Flexible, and Scalable Route to Cyclic Iminium and Imidazolinium Salts","Journal of Organic Chemistry","2007","72","","3492","3499","10.1021/jo0703909","","","0.71073","MoKα","","0.0717","0.0553","","","0.145","0.1571","","","","","","1.037","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022943","10.5761","0.0007","16.3822","0.001","19.6147","0.0012","90","","90","","90","","3398.4","0.4","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H44 Cl7 N -","- C28 H44 Cl7 N -","- C112 H176 Cl28 N4 -","4","1","","Rodolphe Jazzar; Jean-Baptiste Bourg; Rian D. Dewhurst; Bruno Donnadieu; Guy Bertrand","Intramolecular ""Hydroiminiumation and -amidiniumation"" of Alkenes: A Convenient, Flexible, and Scalable Route to Cyclic Iminium and Imidazolinium Salts","Journal of Organic Chemistry","2007","72","","3492","3499","10.1021/jo0703909","","","0.71073","MoKα","","0.0577","0.0381","","","0.0744","0.0813","","","","","","1.015","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022944","12.532","0.003","20.341","0.005","27.856","0.007","90","","94.927","0.006","90","","7074","3","100","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C80 H84 Cl4 N2 P2 Pd2 -","- C80 H84 Cl4 N2 P2 Pd2 -","- C320 H336 Cl16 N8 P8 Pd8 -","4","1","","Rodolphe Jazzar; Jean-Baptiste Bourg; Rian D. Dewhurst; Bruno Donnadieu; Guy Bertrand","Intramolecular ""Hydroiminiumation and -amidiniumation"" of Alkenes: A Convenient, Flexible, and Scalable Route to Cyclic Iminium and Imidazolinium Salts","Journal of Organic Chemistry","2007","72","","3492","3499","10.1021/jo0703909","","","0.71073","MoKα","","0.0814","0.0519","","","0.122","0.1392","","","","","","0.996","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022945","9.7028","0.0013","11.6954","0.001","13.7099","0.0014","90","","90","","90","","1555.8","0.3","293","2","293","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H23 N O2 -","- C18 H23 N O2 -","- C72 H92 N4 O8 -","4","1","","Mercedes Amat; Oscar Lozano; Carmen Escolano; Elies Molins; Joan Bosch","Enantioselective Synthesis of 3,3-Disubstituted Piperidine Derivatives by Enolate Dialkylation of Phenylglycinol-Derived Oxazolopiperidone Lactams","Journal of Organic Chemistry","2007","72","","4431","4439","10.1021/jo070397q","","x-ray","0.71073","MoKα","","0.0725","0.0426","","","0.1181","0.1318","","","","","","1.015","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022946","7.66","0.003","12.669","0.003","8.927","0.003","90","","104.57","0.03","90","","838.5","0.5","294","2","294","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C18 H25 N O2 -","- C18 H25 N O2 -","- C36 H50 N2 O4 -","2","1","","Mercedes Amat; Oscar Lozano; Carmen Escolano; Elies Molins; Joan Bosch","Enantioselective Synthesis of 3,3-Disubstituted Piperidine Derivatives by Enolate Dialkylation of Phenylglycinol-Derived Oxazolopiperidone Lactams","Journal of Organic Chemistry","2007","72","","4431","4439","10.1021/jo070397q","","x-ray","0.71073","MoKα","","0.0692","0.0507","","","0.1503","0.1652","","","","","","1.065","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022947","6.5457","0.0013","13.684","0.002","20.332","0.009","90","","90","","90","","1821.2","0.9","294","2","294","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H25 N O2 -","- C22 H25 N O2 -","- C88 H100 N4 O8 -","4","1","","Mercedes Amat; Oscar Lozano; Carmen Escolano; Elies Molins; Joan Bosch","Enantioselective Synthesis of 3,3-Disubstituted Piperidine Derivatives by Enolate Dialkylation of Phenylglycinol-Derived Oxazolopiperidone Lactams","Journal of Organic Chemistry","2007","72","","4431","4439","10.1021/jo070397q","","x-ray","0.71073","MoKα","","0.0608","0.0449","","","0.1106","0.1204","","","","","","1.069","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022948","9.493","0.006","8.884","0.007","11.272","0.006","90","","103.89","0.05","90","","922.8","1.1","294","2","294","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C22 H27 N O2 -","- C22 H27 N O2 -","- C44 H54 N2 O4 -","2","1","","Mercedes Amat; Oscar Lozano; Carmen Escolano; Elies Molins; Joan Bosch","Enantioselective Synthesis of 3,3-Disubstituted Piperidine Derivatives by Enolate Dialkylation of Phenylglycinol-Derived Oxazolopiperidone Lactams","Journal of Organic Chemistry","2007","72","","4431","4439","10.1021/jo070397q","","x-ray","0.71073","MoKα","","0.0656","0.0422","","","0.1007","0.1134","","","","","","1.067","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022949","7.057","0.005","7.913","0.005","13.254","0.009","98.052","0.011","94.34","0.011","108.759","0.011","688.1","0.8","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H9 Cl F2 O2 S -","- C14 H9 Cl F2 O2 S -","- C28 H18 Cl2 F4 O4 S2 -","2","1","","Jeremy P. Scott; David R. Lieberman; Olivier M. Beureux; Karel M. J. Brands; Antony J. Davies; Andrew W. Gibson; Deborah C. Hammond; Chris J. McWilliams; Gavin W. Stewart; Robert D. Wilson; Ulf-H. Dolling","A Practical Synthesis of a γ-Secretase Inhibitor","Journal of Organic Chemistry","2007","72","","4149","4155","10.1021/jo070407n","","","0.71073","MoKα","","0.0555","0.0468","","","0.1213","0.1264","","","","","","0.959","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022950","15.45","0.01","10.49","0.007","10.828","0.007","90","","90","","90","","1755","2","298","2","298","2","","","","","","","","6","P c a 21","P 2c -2ac","29","jrc0831n","","","- C18 H15 Cl F2 O3 S -","- C18 H15 Cl F2 O3 S -","- C72 H60 Cl4 F8 O12 S4 -","4","1","","Jeremy P. Scott; David R. Lieberman; Olivier M. Beureux; Karel M. J. Brands; Antony J. Davies; Andrew W. Gibson; Deborah C. Hammond; Chris J. McWilliams; Gavin W. Stewart; Robert D. Wilson; Ulf-H. Dolling","A Practical Synthesis of a γ-Secretase Inhibitor","Journal of Organic Chemistry","2007","72","","4149","4155","10.1021/jo070407n","","","0.71073","MoKα","","0.0622","0.0515","","","0.1173","0.1225","","","","","","0.958","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022951","24.474","0.001","7.66","0.001","26.684","0.001","90","","90.496","0.001","90","","5002.3","0.7","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,4-bis-([1-(4-ethynylphenyl)ethenylsulfinyl]methyl)benzene","","- C57 H45 Cl3 O4 S4 -","- C57 H45 Cl3 O4 S4 -","- C228 H180 Cl12 O16 S16 -","4","1","","Maria Chiara Aversa; Anna Barattucci; Paola Bonaccorsi; Cristina Faggi; Teresa Papalia","Thiacyclophane Cages and Related Bi- and Tripodal Molecules via Transient Polysulfenic Acids","Journal of Organic Chemistry","2007","72","","4486","4496","10.1021/jo070449b","","","1.54178","CuKα","","0.0702","0.0442","","","0.1116","0.1231","","","","","","0.935","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022952","10.787","0.001","13.238","0.001","14.494","0.001","90","0.005","92.81","0.006","90","0.005","2067.2","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Meso-1,12-dimethylene-2,11-dithia[3.3]metacyclophane 2,11-dioxide","","- C19 H17 Cl3 O2 S2 -","- C19 H17 Cl3 O2 S2 -","- C76 H68 Cl12 O8 S8 -","4","1","","Maria Chiara Aversa; Anna Barattucci; Paola Bonaccorsi; Cristina Faggi; Teresa Papalia","Thiacyclophane Cages and Related Bi- and Tripodal Molecules via Transient Polysulfenic Acids","Journal of Organic Chemistry","2007","72","","4486","4496","10.1021/jo070449b","","","0.71069","MoKα","","0.0854","0.0636","","","0.143","0.1569","","","","","","1.161","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022953","11.5256","0.001","7.2982","0.0004","33.073","0.003","90","","96.248","0.003","90","","2765.5","0.4","200","2","200","2","","","","","","","chemical synthesis","3","C 1 2 1","C 2y","5","","2alpha,3beta-(3'-oxocyclohexano)-5beta-cholestane","","- C31 H52 O -","- C31 H52 O -","- C124 H208 O4 -","4","1","","Qiuling Song; Douglas M. Ho; Robert A. Pascal Jr.","The Supertristeroids: Large, Chiral, Molecular Bowls Prepared by Trimerization of Pentacyclic Steroidal Ketones","Journal of Organic Chemistry","2007","72","","4449","4453","10.1021/jo070458k","","","0.71073","MoKα","","0.0805","0.0639","","0.1217","","0.1142","","","1.125","","","1.154","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022954","11.3299","0.0007","7.5129","0.0004","32.62","0.002","90","","91.18","0.002","90","","2776","0.3","200","2","200","2","","","","","","","chemical synthesis","3","C 1 2 1","C 2y","5","","4alpha,3beta-(3'-oxocyclohexano)-5beta-cholestane","","- C31 H52 O -","- C31 H52 O -","- C124 H208 O4 -","4","1","","Qiuling Song; Douglas M. Ho; Robert A. Pascal Jr.","The Supertristeroids: Large, Chiral, Molecular Bowls Prepared by Trimerization of Pentacyclic Steroidal Ketones","Journal of Organic Chemistry","2007","72","","4449","4453","10.1021/jo070458k","","","0.71073","MoKα","","0.0606","0.0478","","0.13","","0.1046","","","1.071","","","1.099","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022955","12.5645","0.0005","6.7283","0.0003","33.721","0.002","90","","91.284","0.002","90","","2850","0.2","200","2","200","2","","","","","","","chemical synthesis","3","C 1 2 1","C 2y","5","","2alpha,3alpha-(3'-oxocyclohexano)-5beta-cholestane","","- C31 H52 O -","- C31 H52 O -","- C124 H208 O4 -","4","1","","Qiuling Song; Douglas M. Ho; Robert A. Pascal Jr.","The Supertristeroids: Large, Chiral, Molecular Bowls Prepared by Trimerization of Pentacyclic Steroidal Ketones","Journal of Organic Chemistry","2007","72","","4449","4453","10.1021/jo070458k","","","0.71073","MoKα","","0.0927","0.07","","0.2034","","0.186","","","1.026","","","1.11","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022956","30.363","0.008","11.064","0.003","8.571","0.002","90","","101.599","0.015","90","","2820.4","1.2","153","2","153","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C33 H39 Al O5 -","- C33 H39 Al O5 -","- C132 H156 Al4 O20 -","4","1","","Christopher R. Graves; Hongying Zhou; Charlotte L. Stern; SonBinh T. Nguyen","A Mechanistic Investigation of the Asymmetric Meerwein-Schmidt-Ponndorf-Verley Reduction Catalyzed by BINOL/AlMe~3~-Structure, Kinetics, and Enantioselectivity","Journal of Organic Chemistry","2007","72","","9121","9133","10.1021/jo070563u","","","0.71073","MoKα","","0.0511","0.0419","","","0.1064","0.113","","","","","","1.044","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022957","26.568","0.0009","6.663","0.0002","12.383","0.0005","90","","107.242","0.002","90","","2093.56","0.13","200","2","200","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C18 H27 N O6 V -","- C18 H27 N O6 V -","- C72 H108 N4 O24 V4 -","4","1","","Chien-Tien Chen; Sampada Bettigeri; Shiue-Shien Weng; Vijay D. Pawar; Ya-Hui Lin; Cheng-Yuan Liu; Way-Zen Lee","Asymmetric Aerobic Oxidation of α-Hydroxy Acid Derivatives by C~4~-Symmetric, Vanadate-Centered, Tetrakisvanadyl(V) Clusters Derived from N-Salicylidene-α-aminocarboxylates","Journal of Organic Chemistry","2007","72","","8175","8185","10.1021/jo070575f","","","0.71073","MoKα","","0.0742","0.0601","","","0.1592","0.1764","","","","","","1.061","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022958","32.065","0.0003","6.57","0.0005","12.411","0.0008","90","0.002","104.904","0.002","90","0.002","2526.6","0.3","200","2","200","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C22 H36 N O6 V -","- C22 H36 N O6 V -","- C88 H144 N4 O24 V4 -","4","1","","Chien-Tien Chen; Sampada Bettigeri; Shiue-Shien Weng; Vijay D. Pawar; Ya-Hui Lin; Cheng-Yuan Liu; Way-Zen Lee","Asymmetric Aerobic Oxidation of α-Hydroxy Acid Derivatives by C~4~-Symmetric, Vanadate-Centered, Tetrakisvanadyl(V) Clusters Derived from N-Salicylidene-α-aminocarboxylates","Journal of Organic Chemistry","2007","72","","8175","8185","10.1021/jo070575f","","","0.71073","MoKα","","0.1089","0.0664","","","0.1516","0.1804","","","","","","1.012","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022959","14.294","0.003","14.681","0.003","51.888","0.01","90","","90","","90","","10889","4","200","2","200","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C84 H132 K N4 O25 V5 -","- C84 H132 K N4 O25 V5 -","- C336 H528 K4 N16 O100 V20 -","4","1","","Chien-Tien Chen; Sampada Bettigeri; Shiue-Shien Weng; Vijay D. Pawar; Ya-Hui Lin; Cheng-Yuan Liu; Way-Zen Lee","Asymmetric Aerobic Oxidation of α-Hydroxy Acid Derivatives by C~4~-Symmetric, Vanadate-Centered, Tetrakisvanadyl(V) Clusters Derived from N-Salicylidene-α-aminocarboxylates","Journal of Organic Chemistry","2007","72","","8175","8185","10.1021/jo070575f","","","0.71073","MoKα","","0.141","0.0845","","","0.2018","0.2267","","","","","","1.003","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022960","7.15","0.0002","13.955","0.0003","17.42","0.0005","105.406","0.001","90.71","0.001","93.463","0.0013","1671.89","0.08","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H21 N5 O3 -","- C17 H21 N5 O3 -","- C68 H84 N20 O12 -","4","2","","Dimitri M. Khramov; Christopher W. Bielawski","Donor-Acceptor Triazenes: Synthesis, Characterization, and Study of Their Electronic and Thermal Properties","Journal of Organic Chemistry","2007","72","","9407","9417","10.1021/jo070789x","","","0.71073","MoKα","","0.2166","0.0563","","","0.0922","0.121","","","","","","1.059","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022961","8.9005","0.0004","7.5544","0.0003","25.4468","0.0012","90","","90.197","0.002","90","","1710.98","0.13","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H18 N6 O4 -","- C17 H18 N6 O4 -","- C68 H72 N24 O16 -","4","1","","Dimitri M. Khramov; Christopher W. Bielawski","Donor-Acceptor Triazenes: Synthesis, Characterization, and Study of Their Electronic and Thermal Properties","Journal of Organic Chemistry","2007","72","","9407","9417","10.1021/jo070789x","","","0.71073","MoKα","","0.1916","0.0527","","","0.0831","0.106","","","","","","1.063","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022962","6.7593","0.0003","11.8068","0.0005","12.3651","0.0005","95.814","0.003","102.092","0.002","100.095","0.002","940.16","0.07","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H15 Cl3 N6 O2 -","- C16 H15 Cl3 N6 O2 -","- C32 H30 Cl6 N12 O4 -","2","1","","Dimitri M. Khramov; Christopher W. Bielawski","Donor-Acceptor Triazenes: Synthesis, Characterization, and Study of Their Electronic and Thermal Properties","Journal of Organic Chemistry","2007","72","","9407","9417","10.1021/jo070789x","","","0.71073","MoKα","","0.1815","0.0671","","","0.1274","0.1514","","","","","","1.121","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022963","22.4468","0.0007","22.4468","0.0007","5.7427","0.0003","90","","90","","90","","2893.5","0.2","153","2","153","2","","","","","","","","4","I -4","I -4","82","","","","- C15 H17 N5 O -","- C15 H17 N5 O -","- C120 H136 N40 O8 -","8","1","","Dimitri M. Khramov; Christopher W. Bielawski","Donor-Acceptor Triazenes: Synthesis, Characterization, and Study of Their Electronic and Thermal Properties","Journal of Organic Chemistry","2007","72","","9407","9417","10.1021/jo070789x","","","0.71073","MoKα","","0.0859","0.0493","","","0.106","0.1133","","","","","","1.164","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022964","11.0544","0.0018","11.8606","0.0019","16.316","0.003","90","","108.798","0.002","90","","2025.2","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 Cl N O2 -","- C26 H22 Cl N O2 -","- C104 H88 Cl4 N4 O8 -","4","1","","Bradley O. Ashburn; Rich G. Carter","Diels-Alder Approach to Tetra-ortho-Substituted Biaryls Employing Propargylic Tertiary Alcohols as Dienophiles","Journal of Organic Chemistry","2007","72","","10220","10223","10.1021/jo070812e","","","0.71073","MoKα","","0.0486","0.0439","","","0.1218","0.126","","","","","","1.031","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022965","11.2204","0.0018","11.4675","0.0019","51.151","0.008","90","","90","","90","","6581.6","1.9","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H40 Cl N O4 -","- C37 H40 Cl N O4 -","- C296 H320 Cl8 N8 O32 -","8","2","","Bradley O. Ashburn; Rich G. Carter","Diels-Alder Approach to Tetra-ortho-Substituted Biaryls Employing Propargylic Tertiary Alcohols as Dienophiles","Journal of Organic Chemistry","2007","72","","10220","10223","10.1021/jo070812e","","","0.71073","MoKα","","0.0555","0.0447","","","0.1023","0.1101","","","","","","1.016","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022966","17.9792","0.0002","19.2948","0.0003","30.509","0.0005","90","","90","","90","","10583.7","0.3","150","2","150","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","RajanBabu 1379","","","- C107.5 H126 N4 O6 Y2 -","- C107.5 H126 N4 O6 Y2 -","- C430 H504 N16 O24 Y8 -","4","1","","Biswajit Saha; Mei-Huey Lin; T. V. RajanBabu","Exceptionally Active Yttrium-Salen Complexes for the Catalyzed Ring Opening of Epoxides by TMSCN and TMSN~3~","Journal of Organic Chemistry","2007","72","","8648","8655","10.1021/jo071076h","","x-ray","0.71073","MoKα","","0.0803","0.0697","","","0.1877","0.1923","","","","","","1.091","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4022967","9.553","0.002","13.694","0.002","13.427","0.002","90","","98.886","0.007","90","","1735.4","0.5","298.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H58 Cl2 Cu2 P2 -","- C28 H58 Cl2 Cu2 P2 -","- C56 H116 Cl4 Cu4 P4 -","2","0.5","","Taichi Miyaji; Zhenfeng Xi; Masamichi Ogasawara; Kiyohiko Nakajima; Tamotsu Takahashi","Alkenylzirconocene-Mediated Preparation of Alkenylphosphines","Journal of Organic Chemistry","2007","72","","8737","8740","10.1021/jo071089v","","","0.7107","MoKα","","","0.0437","","","","0.0574","","","","","","1.586","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022968","14.335","0.001","9.7073","0.0006","18.188","0.001","90","","111.392","0.003","90","","2356.6","0.3","298.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H62 Cl2 Cu2 P2 -","- C48 H62 Cl2 Cu2 P2 -","- C96 H124 Cl4 Cu4 P4 -","2","0.5","","Taichi Miyaji; Zhenfeng Xi; Masamichi Ogasawara; Kiyohiko Nakajima; Tamotsu Takahashi","Alkenylzirconocene-Mediated Preparation of Alkenylphosphines","Journal of Organic Chemistry","2007","72","","8737","8740","10.1021/jo071089v","","","0.7107","MoKα","","","0.0488","","","","0.069","","","","","","1.701","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022969","7.698","0.0012","10.0638","0.0015","14.166","0.002","90","","90","","90","","1097.4","0.3","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H13 N5 O3 -","- C10 H13 N5 O3 -","- C40 H52 N20 O12 -","4","1","","Morris J. Robins; Ireneusz Nowak; Stanislaw F. Wnuk; Fritz Hansske; Danuta Madej","Deoxygenative [1,2]-Hydride Shift Rearrangements in Nucleoside and Sugar Chemistry: Analogy with the [1,2]-Electron Shift in the Deoxygenation of Ribonucleotides by Ribonucleotide Reductase","Journal of Organic Chemistry","2007","72","","8216","8221","10.1021/jo071102b","","","0.71073","MoKα","","0.0381","0.0362","","","0.0962","0.0982","","","","","","1.055","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022970","10.032","0.002","10.872","0.002","15.664","0.003","72.558","0.004","79.736","0.004","76.935","0.004","1576.4","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H18 B F2 N O2 -","- C18 H18 B F2 N O2 -","- C72 H72 B4 F8 N4 O8 -","4","2","","Scott Grecian; Pankaj Desai; Craig Mossman; Jennifer L. Poutsma; Jeffrey Aubé","Reactions of Cyclopropanone Acetals with Alkyl Azides: Carbonyl Addition versus Ring-Opening Pathways","Journal of Organic Chemistry","2007","72","","9439","9447","10.1021/jo0711034","","","0.71073","MoKα","","0.0562","0.0438","","","0.103","0.11","","","","","","1.006","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022971","6.666","0.002","7.178","0.002","24.391","0.005","90","","92.68","0.01","90","","1165.8","0.5","293.2","","293.2","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","?","- C13 H10 O5 -","- C52 H40 O20 -","4","1","","Jinhua Song; Yi Xiong Lei; Zvi Rappoport","The First Solid Enols of Anhydrides. Structure, Properties, and Enol/Anhydride Equilibria","Journal of Organic Chemistry","2007","72","","9152","9162","10.1021/jo071206m","","","0.7107","MoKalpha","","","0.076","","","0.095","","","","","1.72","1.72","","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022972","7.678","0.0008","6.5331","0.0007","8.0416","0.0009","90","","94.255","0.002","90","","402.26","0.08","295","1","295","1","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C8 H8 O5 -","- C8 H8 O5 -","- C16 H16 O10 -","2","0.5","","Jinhua Song; Yi Xiong Lei; Zvi Rappoport","The First Solid Enols of Anhydrides. Structure, Properties, and Enol/Anhydride Equilibria","Journal of Organic Chemistry","2007","72","","9152","9162","10.1021/jo071206m","","","0.71073","MoKα","","0.0662","0.0557","","","0.1455","0.1545","","","","","","1.057","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022973","9.2019","0.0009","10.7344","0.0011","11.9302","0.0012","105.856","0.002","94.312","0.002","114.198","0.002","1010.18","0.18","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C9 H8 O8 -","- C9 H8 O8 -","- C36 H32 O32 -","4","2","","Jinhua Song; Yi Xiong Lei; Zvi Rappoport","The First Solid Enols of Anhydrides. Structure, Properties, and Enol/Anhydride Equilibria","Journal of Organic Chemistry","2007","72","","9152","9162","10.1021/jo071206m","","","0.71073","MoKα","","0.0687","0.0498","","","0.1134","0.1227","","","","","","1.03","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022974","5.191","0.003","11.306","0.007","27.188","0.016","90","","90","","90","","1595.6","1.7","103","2","103","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H21 N O2 S -","- C17 H20 N O2 S -","- C68 H80 N4 O8 S4 -","4","1","","Ryo Tanaka; Koji Nakano; Kyoko Nozaki","Synthesis of α-Heteroarylpropanoic Acid via Asymmetric Hydroformylation Catalyzed by Rh(I)-(R,S)-BINAPHOS and the Subsequent Oxidation","Journal of Organic Chemistry","2007","72","","8671","8676","10.1021/jo0712190","","","0.7107","MoKα","","0.0553","0.05","","","0.0976","0.0999","","","","","","1.115","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022975","10.0589","0.0019","8.5302","0.001","10.443","0.002","90","0.0019","116.249","0.002","90","0.0019","803.6","0.3","103","2","103","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H15 I O2 S -","- C18 H15 I O2 S -","- C36 H30 I2 O4 S2 -","2","1","","Ryo Tanaka; Koji Nakano; Kyoko Nozaki","Synthesis of α-Heteroarylpropanoic Acid via Asymmetric Hydroformylation Catalyzed by Rh(I)-(R,S)-BINAPHOS and the Subsequent Oxidation","Journal of Organic Chemistry","2007","72","","8671","8676","10.1021/jo0712190","","","0.7107","MoKα","","0.0218","0.0214","","","0.0533","0.0535","","","","","","1.031","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022976","8.3157","0.001","9.2369","0.0014","12.748","0.002","80.999","0.012","71.729","0.011","75.395","0.012","896.6","0.2","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H21 N3 O6 -","- C17 H21 N3 O6 -","- C34 H42 N6 O12 -","2","1","","Florian Seeliger; Stefan T. A. Berger; Grygoriy Y. Remennikov; Kurt Polborn; Herbert Mayr","Electrophilicity of 5-Benzylidene-1,3-dimethylbarbituric and -thiobarbituric Acids","Journal of Organic Chemistry","2007","72","","9170","9180","10.1021/jo071273g","","","0.71073","MoKα","","0.0701","0.0486","","0.1313","0.116","","","","1.082","1.128","1.128","","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022977","16.913","0.004","7.8644","0.0011","18.636","0.002","90","","95.354","0.012","90","","2468.1","0.7","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H32 N2 O5 Si -","- C23 H32 N2 O5 Si -","- C92 H128 N8 O20 Si4 -","4","1","","Florian Seeliger; Stefan T. A. Berger; Grygoriy Y. Remennikov; Kurt Polborn; Herbert Mayr","Electrophilicity of 5-Benzylidene-1,3-dimethylbarbituric and -thiobarbituric Acids","Journal of Organic Chemistry","2007","72","","9170","9180","10.1021/jo071273g","","","0.71073","MoKα","","0.0766","0.0486","","0.1456","0.1242","","","","1.076","1.117","1.117","","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4022978","8.0472","0.0002","8.8718","0.0001","12.4711","0.0008","74.642","0.011","77.243","0.011","61.931","0.008","752.72","0.05","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H14 N2 -","- C22 H14 N2 -","- C44 H28 N4 -","2","1","","Jonathan H. Chong; Mark J. MacLachlan","Synthesis and Structural Investigation of New Triptycene-Based Ligands: En Route to Shape-Persistent Dendrimers and Macrocycles with Large Free Volume","Journal of Organic Chemistry","2007","72","","8683","8690","10.1021/jo701297q","","","0.71069","MoKα","","0.058","0.0468","","","0.1115","0.1202","","","","","","1.063","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022979","12.0429","0.001","12.7446","0.0012","12.579","0.001","90","","96.992","0.004","90","","1916.3","0.3","173","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H14 N6 -","- C26 H14 N6 -","- C104 H56 N24 -","4","1","","Jonathan H. Chong; Mark J. MacLachlan","Synthesis and Structural Investigation of New Triptycene-Based Ligands: En Route to Shape-Persistent Dendrimers and Macrocycles with Large Free Volume","Journal of Organic Chemistry","2007","72","","8683","8690","10.1021/jo701297q","","","0.71073","MoKα","","0.076","0.0416","","","0.0924","0.1053","","","","","","1.007","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022980","30.05","0.004","8.5056","0.0008","17.79","0.003","90","","93.173","0.005","90","","4539.9","1","173","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C29 H18.5 N7.5 -","- C29 H18.5 N7.5 -","- C232 H148 N60 -","8","1","","Jonathan H. Chong; Mark J. MacLachlan","Synthesis and Structural Investigation of New Triptycene-Based Ligands: En Route to Shape-Persistent Dendrimers and Macrocycles with Large Free Volume","Journal of Organic Chemistry","2007","72","","8683","8690","10.1021/jo701297q","","","0.71073","MoKα","","0.0764","0.0397","","","0.0916","0.1071","","","","","","1.028","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022981","7.9981","0.0018","8.416","0.002","15.052","0.003","74.06","0.014","85.804","0.014","64.404","0.01","877.4","0.3","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C26 H16 N2 -","- C26 H16 N2 -","- C52 H32 N4 -","2","1","","Jonathan H. Chong; Mark J. MacLachlan","Synthesis and Structural Investigation of New Triptycene-Based Ligands: En Route to Shape-Persistent Dendrimers and Macrocycles with Large Free Volume","Journal of Organic Chemistry","2007","72","","8683","8690","10.1021/jo701297q","","","0.71073","MoKα","","0.1113","0.0777","","","0.2223","0.2468","","","","","","1.089","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022982","10.188","0.004","11.488","0.004","12.96","0.005","83.02","0.03","76.48","0.03","83.77","0.02","1458.8","0.9","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C42 H27 N3 -","- C42 H27 N3 -","- C84 H54 N6 -","2","1","","Jonathan H. Chong; Mark J. MacLachlan","Synthesis and Structural Investigation of New Triptycene-Based Ligands: En Route to Shape-Persistent Dendrimers and Macrocycles with Large Free Volume","Journal of Organic Chemistry","2007","72","","8683","8690","10.1021/jo701297q","","","0.71073","MoKα","","0.1835","0.0882","","","0.1994","0.2365","","","","","","1.051","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022983","20.034","0.003","8.3663","0.0011","35.981","0.006","90","","98.168","0.007","90","","5969.5","1.6","173","1","173","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H21 Cu I N3 -","- C33 H21 Cu I N3 -","- C264 H168 Cu8 I8 N24 -","8","1","","Jonathan H. Chong; Mark J. MacLachlan","Synthesis and Structural Investigation of New Triptycene-Based Ligands: En Route to Shape-Persistent Dendrimers and Macrocycles with Large Free Volume","Journal of Organic Chemistry","2007","72","","8683","8690","10.1021/jo701297q","","","0.71073","MoKα","","0.1025","0.0773","","","0.1737","0.1819","","","","","","1.167","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4022984","9.133","0.015","17.51","0.03","27.99","0.05","90","","90","","90","","4476","13","273","2","300","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Imidazolium-pyridino cholaphane","deoxycholic acid based imidazolium bromide salt","","- C42 H57 Br2 N5 O10 -","- C42 H57 Br2 N5 O10 -","- C168 H228 Br8 N20 O40 -","4","1","","Vijay K. Khatri; Mamta Chahar; K. Pavani; Pramod S. Pandey","Bile Acid-Based Cyclic Bisbenzimidazolium Receptors for Anion Recognition: Highly Improved Receptors for Fluoride and Chloride Ions","Journal of Organic Chemistry","2007","72","","10224","10226","10.1021/jo701341r","","","0.71073","MoKα","","0.1771","0.1003","","","0.2197","0.2748","","","","","","0.956","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022985","32.158","0.009","8.977","0.003","11.478","0.003","90","","90","","90","","3313.7","1.6","108","2","108","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C37 H36 N3 O5 -","- C34 H29 N3 O5 -","- C136 H116 N12 O20 -","4","1","","Drew R. Bobeck; Don L. Warner; Edwin Vedejs","Internal Azomethine Ylide Cycloaddition Methodology for Access to the Substitution Pattern of Aziridinomitosene A","Journal of Organic Chemistry","2007","72","","8506","8518","10.1021/jo7013559","","","0.71073","MoKα","","0.1054","0.0928","","","0.2662","0.2744","","","","","","1.339","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022986","17.5611","0.0011","17.5611","0.0011","19.507","0.0018","90","","90","","120","","5209.8","0.7","133","2","133","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C39 H45 N3 O3 -","- C39 H45 N3 O3 -","- C234 H270 N18 O18 -","6","0.333333","","Monika Mazik; Arno C. Buthe","Oxime-Based Receptors for Mono- and Disaccharides","Journal of Organic Chemistry","2007","72","","8319","8326","10.1021/jo701370g","","","0.71073","MoKα","","0.0839","0.0618","","","0.149","0.1587","","","","","","1.061","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022987","16.8041","0.0011","13.6025","0.0008","16.8563","0.0011","90","","90.073","0.004","90","","3853","0.4","133","2","133","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H41 Cl6 N3 O3 -","- C38 H41 Cl6 N3 O3 -","- C152 H164 Cl24 N12 O12 -","4","1","","Monika Mazik; Arno C. Buthe","Oxime-Based Receptors for Mono- and Disaccharides","Journal of Organic Chemistry","2007","72","","8319","8326","10.1021/jo701370g","","","0.71073","MoKα","","0.0784","0.05","","","0.1183","0.1449","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022988","9.453","","9.564","","21.897","","90","","90","","90","","1979.7","","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H23 N O4 S -","- C20 H23 N O4 S -","- C80 H92 N4 O16 S4 -","4","1","","Indrajit Das; Tarun K. Pal; Tanmaya Pathak","Diastereoselective Michael Initiated Ring Closure on Vinyl Sulfone-Modified Carbohydrates: A Stereospecific and General Route to α-Substituted Cyclopropanes","Journal of Organic Chemistry","2007","72","","9181","9189","10.1021/jo701378d","","","0.71073","MoKα","","0.0895","0.0455","","","0.0984","0.1134","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022989","8.347","","13.4","","8.915","","90","","101.62","","90","","976.7","","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H22 O8 S -","- C18 H22 O8 S -","- C36 H44 O16 S2 -","2","1","","Indrajit Das; Tarun K. Pal; Tanmaya Pathak","Diastereoselective Michael Initiated Ring Closure on Vinyl Sulfone-Modified Carbohydrates: A Stereospecific and General Route to α-Substituted Cyclopropanes","Journal of Organic Chemistry","2007","72","","9181","9189","10.1021/jo701378d","","","0.71073","MoKα","","0.047","0.0363","","","0.0907","0.0966","","","","","","1.043","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022990","5.231","","7.429","","16.812","","90","","90","","90","","653.3","","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C7 H8 O3 -","- C7 H8 O3 -","- C28 H32 O12 -","4","1","","Indrajit Das; Tarun K. Pal; Tanmaya Pathak","Diastereoselective Michael Initiated Ring Closure on Vinyl Sulfone-Modified Carbohydrates: A Stereospecific and General Route to α-Substituted Cyclopropanes","Journal of Organic Chemistry","2007","72","","9181","9189","10.1021/jo701378d","","","0.71073","MoKα","","0.1267","0.0956","","","0.2431","0.2634","","","","","","1.213","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022991","5.617","","13.796","","21.594","","90","","90","","90","","1673.3","","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H20 O6 S -","- C12.8 H16 O4.8 S0.8 -","- C64 H80 O24 S4 -","5","1.25","","Indrajit Das; Tarun K. Pal; Tanmaya Pathak","Diastereoselective Michael Initiated Ring Closure on Vinyl Sulfone-Modified Carbohydrates: A Stereospecific and General Route to α-Substituted Cyclopropanes","Journal of Organic Chemistry","2007","72","","9181","9189","10.1021/jo701378d","","","0.71073","MoKα","","0.0603","0.0401","","","0.1269","0.1493","","","","","","0.773","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022992","16.2324","0.0011","5.6544","0.0004","18.3459","0.0012","90","","115.587","0.003","90","","1518.73","0.18","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H16 N2 O2 -","- C19 H16 N2 O2 -","- C76 H64 N8 O8 -","4","1","","Sylvie Pailloux; Iris Binyamin; Lorraine M. Deck; Brian M. Rapko; Benjamin P. Hay; Eileen N. Duesler; Robert T. Paine","Oxidation Reactivity Channels for 2-(Pyridin-2-yl)-N,N-diphenylacetamides","Journal of Organic Chemistry","2007","72","","9195","9202","10.1021/jo701408y","","","0.71073","MoKα","","0.0608","0.0439","","","0.0925","0.1018","","","","","","0.945","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022993","9.8097","0.0011","16.7962","0.0018","17.0633","0.0019","90","","105","0.006","90","","2715.6","0.5","208","2","208","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C33 H27 N3 O3 -","- C33 H27 N3 O3 -","- C132 H108 N12 O12 -","4","1","","Sylvie Pailloux; Iris Binyamin; Lorraine M. Deck; Brian M. Rapko; Benjamin P. Hay; Eileen N. Duesler; Robert T. Paine","Oxidation Reactivity Channels for 2-(Pyridin-2-yl)-N,N-diphenylacetamides","Journal of Organic Chemistry","2007","72","","9195","9202","10.1021/jo701408y","","","0.71073","MoKα","","0.1278","0.0546","","","0.1314","0.1624","","","","","","0.998","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022994","6.107","0.0003","16.1821","0.0008","15.2318","0.0007","90","","92.612","0.002","90","","1503.7","0.13","223","2","223","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C38 H32 N4 O5 -","- C38 H32 N4 O5 -","- C76 H64 N8 O10 -","2","1","","Sylvie Pailloux; Iris Binyamin; Lorraine M. Deck; Brian M. Rapko; Benjamin P. Hay; Eileen N. Duesler; Robert T. Paine","Oxidation Reactivity Channels for 2-(Pyridin-2-yl)-N,N-diphenylacetamides","Journal of Organic Chemistry","2007","72","","9195","9202","10.1021/jo701408y","","","0.71073","MoKα","","0.0685","0.0536","","","0.1445","0.161","","","","","","1.069","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022995","15.9783","0.0016","6.2843","0.0007","32.044","0.003","90","","101.218","0.005","90","","3156.2","0.6","233","2","233","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H18 N2 O -","- C20 H18 N2 O -","- C160 H144 N16 O8 -","8","1","","Sylvie Pailloux; Iris Binyamin; Lorraine M. Deck; Brian M. Rapko; Benjamin P. Hay; Eileen N. Duesler; Robert T. Paine","Oxidation Reactivity Channels for 2-(Pyridin-2-yl)-N,N-diphenylacetamides","Journal of Organic Chemistry","2007","72","","9195","9202","10.1021/jo701408y","","","0.71073","MoKα","","0.0653","0.0502","","","0.1233","0.132","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022996","10.7259","0.0006","18.5233","0.001","17.1998","0.0009","90","","94.687","0.003","90","","3405.8","0.3","233","2","233","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 N2 O3 -","- C20 H18 N2 O3 -","- C160 H144 N16 O24 -","8","2","","Sylvie Pailloux; Iris Binyamin; Lorraine M. Deck; Brian M. Rapko; Benjamin P. Hay; Eileen N. Duesler; Robert T. Paine","Oxidation Reactivity Channels for 2-(Pyridin-2-yl)-N,N-diphenylacetamides","Journal of Organic Chemistry","2007","72","","9195","9202","10.1021/jo701408y","","","0.71073","MoKα","","0.113","0.0573","","","0.1487","0.1791","","","","","","1.033","","","","has coordinates","178408","2020-10-21","18:00:00",""
"4022997","9.6324","0.0002","12.4812","0.0003","14.0456","0.0003","90","","90","","90","","1688.62","0.06","233","2","233","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H16 N2 O2 -","- C20 H16 N2 O2 -","- C80 H64 N8 O8 -","4","1","","Sylvie Pailloux; Iris Binyamin; Lorraine M. Deck; Brian M. Rapko; Benjamin P. Hay; Eileen N. Duesler; Robert T. Paine","Oxidation Reactivity Channels for 2-(Pyridin-2-yl)-N,N-diphenylacetamides","Journal of Organic Chemistry","2007","72","","9195","9202","10.1021/jo701408y","","","0.71073","MoKα","","0.0513","0.0392","","","0.1031","0.1131","","","","","","1.062","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022998","10.1537","0.001","11.5135","0.0013","12.8787","0.0012","90","","98.021","0.009","90","","1490.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H16 N2 O -","- C19 H16 N2 O -","- C76 H64 N8 O4 -","4","1","","Sylvie Pailloux; Iris Binyamin; Lorraine M. Deck; Brian M. Rapko; Benjamin P. Hay; Eileen N. Duesler; Robert T. Paine","Oxidation Reactivity Channels for 2-(Pyridin-2-yl)-N,N-diphenylacetamides","Journal of Organic Chemistry","2007","72","","9195","9202","10.1021/jo701408y","","","0.71073","MoKα","","0.0655","0.0372","","","0.0786","0.0963","","","","","","1.02","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4022999","9.7206","0.001","16.6521","0.0011","17.1319","0.0014","90","","104.408","0.009","90","","2685.9","0.4","292","2","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C33 H27 N3 O2 -","- C33 H27 N3 O2 -","- C132 H108 N12 O8 -","4","1","","Sylvie Pailloux; Iris Binyamin; Lorraine M. Deck; Brian M. Rapko; Benjamin P. Hay; Eileen N. Duesler; Robert T. Paine","Oxidation Reactivity Channels for 2-(Pyridin-2-yl)-N,N-diphenylacetamides","Journal of Organic Chemistry","2007","72","","9195","9202","10.1021/jo701408y","","","0.71073","MoKα","","0.0705","0.0426","","","0.0979","0.1096","","","","","","1.018","","","","has coordinates,has disorder","178408","2020-10-21","18:00:00",""
"4023000","9.1976","0.0009","9.2334","0.0009","11.9364","0.0012","105.374","0.002","90.475","0.002","102.84","0.002","950.55","0.16","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H42 N2 O3 P2 -","- C48 H42 N2 O3 P2 -","- C48 H42 N2 O3 P2 -","1","0.5","","Lee J. Higham; Jimmy Muldoon; P. Gabriel Kelly; David M. Corr; Helge Müller-Bunz; Declan G. Gilheany","A Re-Evaluation of the Electrophilic Substitution Reactions of the Ramirez Ylide","Journal of Organic Chemistry","2007","72","","8780","8785","10.1021/jo7014104","","","0.71073","MoKα","","0.0502","0.0461","","","0.1149","0.1191","","","","","","1.071","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023001","12.8311","0.0009","8.9989","0.0006","23.3818","0.0016","90","","95.3","0.001","90","","2688.3","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H26.5 Cl2.5 O4 P -","- C30 H26.5 Cl2.5 O4 P -","- C120 H106 Cl10 O16 P4 -","4","1","","Lee J. Higham; Jimmy Muldoon; P. Gabriel Kelly; David M. Corr; Helge Müller-Bunz; Declan G. Gilheany","A Re-Evaluation of the Electrophilic Substitution Reactions of the Ramirez Ylide","Journal of Organic Chemistry","2007","72","","8780","8785","10.1021/jo7014104","","","0.71073","MoKα","","0.0895","0.0838","","","0.2269","0.2318","","","","","","1.05","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4023002","9.8445","0.0009","9.9154","0.0009","10.6813","0.0009","106.488","0.002","101.268","0.002","98.87","0.002","955.8","0.15","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H19 O2 P -","- C25 H19 O2 P -","- C50 H38 O4 P2 -","2","1","","Lee J. Higham; Jimmy Muldoon; P. Gabriel Kelly; David M. Corr; Helge Müller-Bunz; Declan G. Gilheany","A Re-Evaluation of the Electrophilic Substitution Reactions of the Ramirez Ylide","Journal of Organic Chemistry","2007","72","","8780","8785","10.1021/jo7014104","","","0.71073","MoKα","","0.0495","0.0423","","","0.1069","0.1119","","","","","","1.06","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023003","9.4476","0.0008","11.1704","0.001","11.3355","0.001","90.788","0.002","104.985","0.001","106.178","0.001","1105.08","0.17","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H22 N O2 P -","- C28 H22 N O2 P -","- C56 H44 N2 O4 P2 -","2","1","","Lee J. Higham; Jimmy Muldoon; P. Gabriel Kelly; David M. Corr; Helge Müller-Bunz; Declan G. Gilheany","A Re-Evaluation of the Electrophilic Substitution Reactions of the Ramirez Ylide","Journal of Organic Chemistry","2007","72","","8780","8785","10.1021/jo7014104","","","0.71073","MoKα","","0.0434","0.0392","","","0.1018","0.1047","","","","","","1.033","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023004","24.875","0.007","12.734","0.004","15.011","0.004","90","","105.595","0.005","90","","4580","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H18 N3 P -","- C28 H18 N3 P -","- C224 H144 N24 P8 -","8","1","","Lee J. Higham; Jimmy Muldoon; P. Gabriel Kelly; David M. Corr; Helge Müller-Bunz; Declan G. Gilheany","A Re-Evaluation of the Electrophilic Substitution Reactions of the Ramirez Ylide","Journal of Organic Chemistry","2007","72","","8780","8785","10.1021/jo7014104","","","0.71073","MoKα","","0.048","0.0432","","","0.1185","0.1239","","","","","","1.03","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023005","15.5448","0.0004","23.8432","0.0006","29.1057","0.0007","90","","96.448","0.001","90","","10719.4","0.5","100","2","100","2","","","","","","","synthesized","6","P 1 21/n 1","-P 2yn","14","","","","- C110 H136 Cl2 F4 N14 O4 -","- C104 H122 Cl2 F4 N14 O4 -","- C416 H488 Cl8 F16 N56 O16 -","4","1","","Kenichi Calderon-Kawasaki; Sumith Kularatne; Yue Hu Li; Bruce C. Noll; W. Robert Scheidt; Dennis H. Burns","Synthesis of Urea Picket Porphyrins and Their Use in the Elucidation of the Role Buried Solvent Plays in the Selectivity and Stoichiometry of Anion Binding Receptors","Journal of Organic Chemistry","2007","72","","9081","9087","10.1021/jo701443c","","x-ray","0.71073","MoKα","","0.1003","0.0687","","","0.1819","0.1952","","","","","","1.036","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023006","49.4376","0.0011","15.8172","0.0004","27.3399","0.0006","90","","91.361","0.001","90","","21372.8","0.9","100","2","100","2","","","","","","","synthesized","7","C 1 2/c 1","-C 2yc","15","","","","- C109.32 H138.08 Cl2 F4 N14 O12 P2 -","- C105 H126 Cl2 F4 N14 O12 P2 -","- C840 H1008 Cl16 F32 N112 O96 P16 -","8","1","","Kenichi Calderon-Kawasaki; Sumith Kularatne; Yue Hu Li; Bruce C. Noll; W. Robert Scheidt; Dennis H. Burns","Synthesis of Urea Picket Porphyrins and Their Use in the Elucidation of the Role Buried Solvent Plays in the Selectivity and Stoichiometry of Anion Binding Receptors","Journal of Organic Chemistry","2007","72","","9081","9087","10.1021/jo701443c","","x-ray","0.71073","MoKα","","0.0702","0.0508","","","0.1427","0.1519","","","","","","1.115","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023007","26.76","0.006","5.9051","0.0012","16.435","0.003","90","","112.993","0.003","90","","2390.7","0.8","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22 H32 N8 O2 -","- C22 H32 N8 O2 -","- C88 H128 N32 O8 -","4","0.5","","Joe B. Gilroy; Steve D. J. McKinnon; Pierre Kennepohl; Mark S. Zsombor; Michael J. Ferguson; Laurence K. Thompson; Robin G. Hicks","Probing Electronic Communication in Stable Benzene-Bridged Verdazyl Diradicals","Journal of Organic Chemistry","2007","72","","8062","8069","10.1021/jo7014449","","","0.71073","MoKα","","0.0879","0.0589","","","0.1459","0.1661","","","","","","1.122","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023008","25.546","0.003","9.3143","0.0009","21.518","0.002","90","","106.528","0.002","90","","4908.6","0.8","193","2","193","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C22 H32 N8 O2 -","- C22 H32 N8 O2 -","- C176 H256 N64 O16 -","8","1","","Joe B. Gilroy; Steve D. J. McKinnon; Pierre Kennepohl; Mark S. Zsombor; Michael J. Ferguson; Laurence K. Thompson; Robin G. Hicks","Probing Electronic Communication in Stable Benzene-Bridged Verdazyl Diradicals","Journal of Organic Chemistry","2007","72","","8062","8069","10.1021/jo7014449","","","0.71073","MoKα","","0.0608","0.0462","","","0.1245","0.1376","","","","","","1.037","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023009","9.1318","0.0001","12.317","0.0002","11.1035","0.0002","90","","101.569","0.001","90","","1223.51","0.03","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C24 H31 B N O3 P -","- C24 H31 B N O3 P -","- C48 H62 B2 N2 O6 P2 -","2","1","","Michel (Massoud S.) Stephan; Damjan Šterk; Barbara Modec; Barbara Mohar","Study of the Reaction of Bulky Aryllithium Reagents with 3,4-Dimethyl-2,5-diphenyl-1,3,2-oxazaphospholidine-2-borane Derived from Ephedrine","Journal of Organic Chemistry","2007","72","","8010","8018","10.1021/jo7014505","","","0.71073","MoKα","","0.054","0.0386","","","0.0869","0.0945","","","","","","1.051","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023010","9.284","0.0001","19.3628","0.0002","24.2448","0.0003","90","","90","","90","","4358.35","0.08","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C44 H56 B2 Fe N2 O2 P2 -","- C44 H56 B2 Fe N2 O2 P2 -","- C176 H224 B8 Fe4 N8 O8 P8 -","4","1","","Michel (Massoud S.) Stephan; Damjan Šterk; Barbara Modec; Barbara Mohar","Study of the Reaction of Bulky Aryllithium Reagents with 3,4-Dimethyl-2,5-diphenyl-1,3,2-oxazaphospholidine-2-borane Derived from Ephedrine","Journal of Organic Chemistry","2007","72","","8010","8018","10.1021/jo7014505","","","0.71073","MoKα","","0.0586","0.0415","","","0.0925","0.101","","","","","","1.064","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023011","6.9398","0.0001","8.8621","0.0001","27.4006","0.0004","90","","90","","90","","1685.17","0.04","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H21 B N O P -","- C16 H21 B N O P -","- C64 H84 B4 N4 O4 P4 -","4","1","","Michel (Massoud S.) Stephan; Damjan Šterk; Barbara Modec; Barbara Mohar","Study of the Reaction of Bulky Aryllithium Reagents with 3,4-Dimethyl-2,5-diphenyl-1,3,2-oxazaphospholidine-2-borane Derived from Ephedrine","Journal of Organic Chemistry","2007","72","","8010","8018","10.1021/jo7014505","","","0.71073","MoKα","","0.0526","0.0421","","","0.1084","0.1158","","","","","","1.066","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023012","7.6191","0.0001","12.9465","0.0001","28.2622","0.0003","90","","90","","90","","2787.8","0.05","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C28 H40 B N2 O2 P -","- C28 H40 B N2 O2 P -","- C112 H160 B4 N8 O8 P4 -","4","1","","Michel (Massoud S.) Stephan; Damjan Šterk; Barbara Modec; Barbara Mohar","Study of the Reaction of Bulky Aryllithium Reagents with 3,4-Dimethyl-2,5-diphenyl-1,3,2-oxazaphospholidine-2-borane Derived from Ephedrine","Journal of Organic Chemistry","2007","72","","8010","8018","10.1021/jo7014505","","","0.71073","MoKα","","0.0484","0.0405","","","0.1136","0.1193","","","","","","1.139","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023013","9.4914","0.0004","10.2968","0.0008","10.8371","0.0007","91.932","0.001","110.34","0.002","104.274","0.001","954.08","0.1","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","","","- C26 H20 O2 -","- C26 H20 O2 -","- C52 H40 O4 -","2","1","","Hsu-Kai Chang; Yen-Chen Liao; Rai-Shung Liu","Diversity in Platinum-Catalyzed Hydrative Cyclization of Trialkyne Substrates To Form Tetracyclic Ketones","Journal of Organic Chemistry","2007","72","","8139","8141","10.1021/jo701458b","","","0.71073","MoKα","","0.1172","0.0664","","","0.1683","0.2076","","","","","","1.041","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023014","6.0745","0.0003","10.601","0.0005","9.9223","0.0005","90","","104.882","0.002","90","","617.52","0.05","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(3S,4S,E)-3-(methylthio)-3-nitro-4-styryl-4,5-dihydro-3H-pyrazole","","- C12 H13 N3 O2 S -","- C12 H13 N3 O2 S -","- C24 H26 N6 O4 S2 -","2","1","","Lara Bianchi; Gianluca Giorgi; Massimo Maccagno; Giovanni Petrillo; Valeria Rocca; Fernando Sancassan; Carlo Scapolla; Elda Severi; Cinzia Tavani","Butadienic Building Blocks from 2-Nitrothiophene as Precursors of Nitrogen Heterocycles: Intriguing Dichotomic Behavior","Journal of Organic Chemistry","2007","72","","9067","9073","10.1021/jo701460k","","","0.71073","MoKα","","0.0586","0.0408","","","0.0788","0.0849","","","","","","1.039","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023015","10.9868","0.0012","8.2206","0.0009","20.436","0.002","90","","91.189","0.009","90","","1845.4","0.3","180","","180","","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H19 N O3 -","- C24 H19 N O3 -","- C96 H76 N4 O12 -","4","1","","Grégory Franc; Serge Mazères; Cédric-Olivier Turrin; Laure Vendier; Carine Duhayon; Anne-Marie Caminade; Jean-Pierre Majoral","Synthesis and Properties of Dendrimers Possessing the Same Fluorophore(s) Located Either Peripherally or Off-Center","Journal of Organic Chemistry","2007","72","","8707","8715","10.1021/jo701462f","","","0.71073","MoKα","","0.0597","0.0362","","","0.0766","0.0836","","","","","","0.924","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023016","14.6454","0.0016","5.8952","0.0009","21.063","0.002","90","","101.058","0.009","90","","1784.8","0.4","180","","180","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H19 N O2 -","- C24 H19 N O2 -","- C96 H76 N4 O8 -","4","1","","Grégory Franc; Serge Mazères; Cédric-Olivier Turrin; Laure Vendier; Carine Duhayon; Anne-Marie Caminade; Jean-Pierre Majoral","Synthesis and Properties of Dendrimers Possessing the Same Fluorophore(s) Located Either Peripherally or Off-Center","Journal of Organic Chemistry","2007","72","","8707","8715","10.1021/jo701462f","","","0.71073","MoKα","","0.1545","0.0723","","0.1463","0.0781","0.0781","","","","","","1.5231","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023017","8.95","0.005","10.125","0.006","10.704","0.005","90.434","0.004","94.258","0.008","111.215","0.006","901.1","0.8","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H21 N O2 S -","- C20 H18 N O2 S -","- C40 H36 N2 O4 S2 -","2","1","","Deepak Kumar Barange; T. C. Nishad; N. Kumara Swamy; Venkanna Bandameedi; Dinesh Kumar; Bukkapattanam R. Sreekanth; K. Vyas; Manojit Pal","A Remarkable Accelerating Effect of Ag-Salt on Intramolecular Cyclization of o-(1-Alkynyl)benzenesulfonamides","Journal of Organic Chemistry","2007","72","","8547","8550","10.1021/jo701470h","","","0.7107","MoKα","","","0.0611","","","","0.0779","","","","","","1.092","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4023018","9.173","0.003","9.411","0.003","10.685","0.003","66.37","0.012","69.458","0.012","73.57","0.01","780.3","0.4","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H19 N O2 S -","- C18 H19 N O2 S -","- C36 H38 N2 O4 S2 -","2","1","","Deepak Kumar Barange; T. C. Nishad; N. Kumara Swamy; Venkanna Bandameedi; Dinesh Kumar; Bukkapattanam R. Sreekanth; K. Vyas; Manojit Pal","A Remarkable Accelerating Effect of Ag-Salt on Intramolecular Cyclization of o-(1-Alkynyl)benzenesulfonamides","Journal of Organic Chemistry","2007","72","","8547","8550","10.1021/jo701470h","","","0.7107","MoKα","","","0.042","","","","0.047","","","","","","1.165","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023019","10.041","0.003","20.673","0.005","11.1","0.003","90","","112.97","0.02","90","","2121","1","296.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H26 O4 -","- C25 H26 O4 -","- C100 H104 O16 -","4","1","","Shinichi Saito; Shinsuke Komagawa; Isao Azumaya; Manami Masuda","Nickel-Catalyzed Intermolecular [3 + 2 + 2] Cocyclization of Ethyl Cyclopropylideneacetate and Alkynes. Synthesis of Seven-Membered Carbocycles","Journal of Organic Chemistry","2007","72","","9114","9120","10.1021/jo7014714","","","1.5418","CuKα","","","0.0434","","","","0.0712","","","","","","1.437","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023020","9.7502","0.0009","10.4517","0.001","10.5257","0.001","90","","92.547","0.001","90","","1071.57","0.18","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C28 H24 O2 -","- C28 H24 O2 -","- C56 H48 O4 -","2","1","","Moloy Banerjee; Susanna J. Emond; Sergey V. Lindeman; Rajendra Rathore","Practical Synthesis of Unsymmetrical Tetraarylethylenes and Their Application for the Preparation of [Triphenylethylene-Spacer-Triphenylethylene] Triads","Journal of Organic Chemistry","2007","72","","8054","8061","10.1021/jo701474y","","","0.71073","MoKα","","0.0491","0.0451","","","0.1139","0.117","","","","","","1.027","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023021","5.8309","0.0002","15.9227","0.0005","20.984","0.0006","90","","90","","90","","1948.23","0.11","100","2","100","2","","","","","","","","3","P n n m","-P 2 2n","58","","","","- C48 H38 Cl4 -","- C48 H38 Cl4 -","- C96 H76 Cl8 -","2","0.25","","Moloy Banerjee; Susanna J. Emond; Sergey V. Lindeman; Rajendra Rathore","Practical Synthesis of Unsymmetrical Tetraarylethylenes and Their Application for the Preparation of [Triphenylethylene-Spacer-Triphenylethylene] Triads","Journal of Organic Chemistry","2007","72","","8054","8061","10.1021/jo701474y","","","1.54178","CuKα","","0.0768","0.0748","","","0.1717","0.1728","","","","","","1.044","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023022","44.5922","0.0014","9.3105","0.0003","30.31","0.0009","90","","123.942","0.001","90","","10439.7","0.6","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C65.1 H62.2 Cl0.2 -","- C65.095 H62.19 Cl0.19 -","- C520.76 H497.52 Cl1.52 -","8","1","","Moloy Banerjee; Susanna J. Emond; Sergey V. Lindeman; Rajendra Rathore","Practical Synthesis of Unsymmetrical Tetraarylethylenes and Their Application for the Preparation of [Triphenylethylene-Spacer-Triphenylethylene] Triads","Journal of Organic Chemistry","2007","72","","8054","8061","10.1021/jo701474y","","","1.54178","CuKα","","0.0966","0.0558","","","0.1221","0.1371","","","","","","1.033","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4023023","8.4574","0.0013","15.167","0.002","19.34","0.003","90","","90","","90","","2480.8","0.6","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H13 N O3 -","- C14 H13 N O3 -","- C112 H104 N8 O24 -","8","1","","Bor-Cherng Hong; Ming-Fun Wu; Hsing-Chang Tseng; Guo-Fong Huang; Cheng-Feng Su; Ju-Hsiou Liao","Organocatalytic Asymmetric Robinson Annulation of α,β-Unsaturated Aldehydes: Applications to the Total Synthesis of (+)-Palitantin","Journal of Organic Chemistry","2007","72","","8459","8471","10.1021/jo701477v","","","0.71073","MoKα","","0.2428","0.1066","","","0.1846","0.2313","","","","","","1.056","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023024","5.2691","0.0011","14.262","0.003","21.962","0.004","90","","90","","90","","1650.3","0.6","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H17 F4 N O4 -","- C17 H17 F4 N O4 -","- C68 H68 F16 N4 O16 -","4","1","","Santos Fustero; Begoña Fernández; Juan F. Sanz-Cervera; Natalia Mateu; Silvia Mosulén; Rodrigo J. Carbajo; Antonio Pineda-Lucena; Carmen Ramírez de Arellano","Asymmetric Synthesis of Fluorinated Amino Macrolactones through Ring-Closing Metathesis","Journal of Organic Chemistry","2007","72","","8716","8723","10.1021/jo701484w","","","0.71073","MoKα","","0.2087","0.1818","","","0.4354","0.4479","","","","","","2.495","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023025","5.1217","0.001","13.763","0.003","22.709","0.005","90","","90","","90","","1600.8","0.6","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H19 F2 N O4 -","- C17 H19 F2 N O4 -","- C68 H76 F8 N4 O16 -","4","1","","Santos Fustero; Begoña Fernández; Juan F. Sanz-Cervera; Natalia Mateu; Silvia Mosulén; Rodrigo J. Carbajo; Antonio Pineda-Lucena; Carmen Ramírez de Arellano","Asymmetric Synthesis of Fluorinated Amino Macrolactones through Ring-Closing Metathesis","Journal of Organic Chemistry","2007","72","","8716","8723","10.1021/jo701484w","","","0.71073","MoKα","","0.0624","0.0385","","","0.0735","0.0806","","","","","","1.025","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023026","7.3223","0.0019","16.257","0.004","15.537","0.004","90","","101.432","0.004","90","","1812.8","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C H Cl N O -","- C3.47826 H3.13043 Cl0.173913 N0.173913 O0.347826 -","- C80 H72 Cl4 N4 O8 -","23","5.75","","Tao Xiong; Qian Zhang; Zhiguo Zhang; Qun Liu","A Divergent Synthesis of γ-Iminolactones, Dihydroquinolin-2-ones, and γ-Lactames from β-Hydroxymethylcyclopropanylamides","Journal of Organic Chemistry","2007","72","","8005","8009","10.1021/jo701495s","","","0.71073","MoKα","","0.0887","0.0424","","","0.1069","0.1364","","","","","","0.694","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023027","10.819","0.0007","9.8363","0.0007","18.3221","0.0012","90","","92.424","0.002","90","","1948.1","0.2","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H17 I O3 -","- C22 H17 I O3 -","- C88 H68 I4 O12 -","4","1","","Chia-Wen Li; Cheng-I Wang; Hsin-Yi Liao; Rupsha Chaudhuri; Rai-Shung Liu","Synthesis of Dibenzo[g,p]chrysenes from Bis(biaryl)acetylenes via Sequential ICl-Induced Cyclization and Mizoroki-Heck Coupling","Journal of Organic Chemistry","2007","72","","9203","9207","10.1021/jo701504m","","","0.71073","MoKα","","0.1659","0.0362","","","0.0564","0.0685","","","","","","0.52","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023028","6.2709","0.0004","17.9596","0.001","18.5642","0.0012","90","","90","","90","","2090.8","0.2","173","2","173","2","","","","","","","synthesis as described","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H32 O5 -","- C21 H32 O5 -","- C84 H128 O20 -","4","1","","Philip J. Parsons; Lewis Pennicott; James Eshelby; Matthias Goessman; Adrian Highton; Peter Hitchcock","A Total Synthesis of Galbonolide B","Journal of Organic Chemistry","2007","72","","9387","9390","10.1021/jo701509r","","x-ray","0.71073","MoKα","","0.0904","0.0661","","","0.173","0.2048","","","","","","1.069","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023029","7.9754","0.0005","15.9305","0.0014","6.9063","0.0005","90","","115.199","0.004","90","","793.96","0.11","120","","120","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H10 O4 -","- C8 H10 O4 -","- C32 H40 O16 -","4","1","","Amie M. Richardson; Chun-Hsing Chen; Barry B. Snider","Synthesis of Methyl 1-Hydroxy-6-oxo-2-cyclohexenecarboxylate, a Component of Salicortin and Tremulacin, and the Monomer of Idesolide","Journal of Organic Chemistry","2007","72","","8099","8102","10.1021/jo701512w","","","0.71073","MoKα","","0.0484","0.0387","","0.1025","0.0991","0.1025","","","","","","0.9901","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023030","11.8332","0.0006","13.9286","0.0007","17.0327","0.0006","84.775","0.002","83.451","0.002","76.16","0.002","2702.1","0.2","220","2","220","2","","","","","","","Synthesized by the authors. See text","5","P -1","-P 1","2","","","","- C49 H76 N4 O9 S3 -","- C49 H76 N4 O9 S3 -","- C98 H152 N8 O18 S6 -","2","1","","Marie Bourgeaux; W. G. Skene","Photophysics and Electrochemistry of Conjugated Oligothiophenes Prepared by Using Azomethine Connections","Journal of Organic Chemistry","2007","72","","8882","8892","10.1021/jo701515j","","","1.54178","CuKα","","0.1306","0.115","","","0.364","0.3754","","","","","","1.134","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023031","11.13","0.004","13.871","0.005","17.619","0.006","73.23","0.03","77.02","0.03","65.93","0.03","2360.1","1.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","5,10,15,20-tetratolyl-22,24-dioxadiazuliporphyrinogen","","- C61 H49 Cl3 O2 -","- C61 H49 Cl3 O2 -","- C122 H98 Cl6 O4 -","2","1","","Natasza Sprutta; Marta Siczek; Lechosław Latos-Grażyński; Miłosz Pawlicki; Ludmiła Szterenberg; Tadeusz Lis","Dioxadiazuliporphyrin: A Near-IR Redox Switchable Chromophore","Journal of Organic Chemistry","2007","72","","9501","9509","10.1021/jo7015218","","","0.71073","MoKα","","0.0794","0.0631","","","0.173","0.1846","","","","","","1.06","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023032","12.592","0.005","12.7","0.005","17.466","0.007","75.9","0.04","83.9","0.04","67.09","0.04","2495.1","1.7","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","5,10,15,20-tetratolyl-22,24-dioxadiazuliporphyrin","","- C69 H53 O2 -","- C69 H53 O2 -","- C138 H106 O4 -","2","1","","Natasza Sprutta; Marta Siczek; Lechosław Latos-Grażyński; Miłosz Pawlicki; Ludmiła Szterenberg; Tadeusz Lis","Dioxadiazuliporphyrin: A Near-IR Redox Switchable Chromophore","Journal of Organic Chemistry","2007","72","","9501","9509","10.1021/jo7015218","","","1.5418","CuKα","","0.1011","0.043","","","0.0639","0.0701","","","","","","0.859","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023033","10.2118","0.0008","12.0005","0.001","13.2831","0.0011","87.9668","0.0015","74.7962","0.0015","88.7667","0.0016","1569.7","0.2","100","2","100","2","","","","","","","Lash laboratory","3","P -1","-P 1","2","","2^3^-<i>tert</i>-butyl-8,12,13,17-tetraethyl-7,18-dimethylazuliporphyrin","","- C40 H45 N3 -","- C40 H45 N3 -","- C80 H90 N6 -","2","1","","Timothy D. Lash; Jessica A. El-Beck; Gregory M. Ferrence","Syntheses and Reactivity of meso-Unsubstituted Azuliporphyrins Derived from 6-tert-Butyl- and 6-Phenylazulene","Journal of Organic Chemistry","2007","72","","8402","8415","10.1021/jo701523s","","x-ray","0.71073","MoKα","","0.1256","0.064","","","0.1509","0.1777","","","","","","1.023","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023034","13.416","0.0007","13.416","0.0007","8.1117","0.0005","90","","90","","120","","1264.41","0.12","293","2","293","2","","","","","","","","3","P 31","P 31","144","2,6-di(quinolin-8-yl)pyridine","","","- C23 H15 N3 -","- C23 H15 N3 -","- C69 H45 N9 -","3","1","","Michael Jäger; Lars Eriksson; Jonas Bergquist; Olof Johansson","Synthesis and Characterization of 2,6-Di(quinolin-8-yl)pyridines. New Ligands for Bistridentate Ru^II^ Complexes with Microsecond Luminescent Lifetimes","Journal of Organic Chemistry","2007","72","","10227","10230","10.1021/jo7015373","","","0.71073","MoKα","","0.0413","0.032","","","0.0726","0.0763","","","","","","0.995","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023035","7.5535","0.0011","21.7257","0.0019","11.1055","0.0017","90","","104.193","0.018","90","","1766.8","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","4-amino-2,6-di(quinolin-8-yl)pyridine","","","- C23 H16 N4 -","- C23 H16 N4 -","- C92 H64 N16 -","4","1","","Michael Jäger; Lars Eriksson; Jonas Bergquist; Olof Johansson","Synthesis and Characterization of 2,6-Di(quinolin-8-yl)pyridines. New Ligands for Bistridentate Ru^II^ Complexes with Microsecond Luminescent Lifetimes","Journal of Organic Chemistry","2007","72","","10227","10230","10.1021/jo7015373","","","0.71073","MoKα","","0.2379","0.0824","","","0.171","0.2264","","","","","","0.769","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023036","8.2923","0.0006","9.8389","0.0007","11.8651","0.0008","67.29","0.002","71.557","0.001","83.485","0.001","847.08","0.1","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C3 H3 N O3 S -","- C3 H3 N O3 S -","- C18 H18 N6 O18 S6 -","6","3","","Sonia Torrico Vallejos; Mauricio F. Erben; Helge Willner; Roland Boese; Carlos O. Della Védova","Preparation and Properties of Methoxycarbonylsulfenyl Isocyanate, CH~3~OC(O)SNCO","Journal of Organic Chemistry","2007","72","","9074","9080","10.1021/jo701543g","","","0.71073","MoKα","","0.0311","0.0285","","","0.0778","0.0801","","","","","","1.032","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023037","8.3073","0.0004","10.3617","0.0005","20.5313","0.0009","90","","90","","90","","1767.29","0.14","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H30 O4 -","- C21 H30 O4 -","- C84 H120 O16 -","4","1","","Bryson W. Katona; Nigam P. Rath; Shrikant Anant; William F. Stenson; Douglas F. Covey","Enantiomeric Deoxycholic Acid: Total Synthesis, Characterization, and Preliminary Toxicity toward Colon Cancer Cell Lines","Journal of Organic Chemistry","2007","72","","9298","9307","10.1021/jo701559q","","","0.71073","MoKα","","0.047","0.04","","","0.0882","0.092","","","","","","1.026","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023038","7.4035","0.0005","11.2369","0.0008","10.9184","0.0008","90","","97.113","0.003","90","","901.34","0.11","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C21 H30 O4 -","- C21 H30 O4 -","- C42 H60 O8 -","2","1","","Bryson W. Katona; Nigam P. Rath; Shrikant Anant; William F. Stenson; Douglas F. Covey","Enantiomeric Deoxycholic Acid: Total Synthesis, Characterization, and Preliminary Toxicity toward Colon Cancer Cell Lines","Journal of Organic Chemistry","2007","72","","9298","9307","10.1021/jo701559q","","","0.71073","MoKα","","0.0405","0.0348","","","0.0779","0.0812","","","","","","1.037","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023039","14.676","0.003","7.4129","0.0017","17.361","0.004","90","","103.458","0.007","90","","1836.8","0.8","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C21 H34 O2 -","- C21 H34 O2 -","- C84 H136 O8 -","4","2","","Bryson W. Katona; Nigam P. Rath; Shrikant Anant; William F. Stenson; Douglas F. Covey","Enantiomeric Deoxycholic Acid: Total Synthesis, Characterization, and Preliminary Toxicity toward Colon Cancer Cell Lines","Journal of Organic Chemistry","2007","72","","9298","9307","10.1021/jo701559q","","","0.71073","MoKα","","0.079","0.0597","","","0.1342","0.1462","","","","","","1.015","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023040","9.7145","0.0012","7.7115","0.0009","14.613","0.002","90","","94.9","0.008","90","","1090.7","0.2","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H38 O4 -","- C25 H38 O4 -","- C50 H76 O8 -","2","1","","Bryson W. Katona; Nigam P. Rath; Shrikant Anant; William F. Stenson; Douglas F. Covey","Enantiomeric Deoxycholic Acid: Total Synthesis, Characterization, and Preliminary Toxicity toward Colon Cancer Cell Lines","Journal of Organic Chemistry","2007","72","","9298","9307","10.1021/jo701559q","","","0.71073","MoKα","","0.1008","0.053","","","0.093","0.1094","","","","","","1.003","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023041","11.144","0.002","12.339","0.003","18.422","0.004","104.47","0.03","101.85","0.03","102.7","0.03","2300.3","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H27 Cl O2 -","- C27 H27 Cl O2 -","- C108 H108 Cl4 O8 -","4","2","","Yan-Chao Wu; Li Liu; Yu-Liang Liu; Dong Wang; Yong-Jun Chen","TFA-Mediated Tandem Friedel-Crafts Alkylation/Cyclization/Hydrogen Transfer Process for the Synthesis of Flavylium Compounds","Journal of Organic Chemistry","2007","72","","9383","9386","10.1021/jo7015604","","","0.71073","MoKα","","0.1554","0.068","","","0.1566","0.181","","","","","","1.065","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023042","11.473","0.003","16.216","0.005","8.311","0.002","90","","90","","90","","1546.2","0.7","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C21 H16 O -","- C21 H16 O -","- C84 H64 O4 -","4","1","","Yan-Chao Wu; Li Liu; Yu-Liang Liu; Dong Wang; Yong-Jun Chen","TFA-Mediated Tandem Friedel-Crafts Alkylation/Cyclization/Hydrogen Transfer Process for the Synthesis of Flavylium Compounds","Journal of Organic Chemistry","2007","72","","9383","9386","10.1021/jo7015604","","","0.71073","MoKα","","0.0987","0.0426","","","0.0771","0.0952","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023043","6.5694","0.0019","7.825","0.002","9.863","0.003","76.478","0.004","78.156","0.004","82.191","0.004","480.4","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H8 F3 N O -","- C10 H8 F3 N O -","- C20 H16 F6 N2 O2 -","2","1","","Zengxue Wang; Wen Wan; Haizhen Jiang; Jian Hao","One-Pot Cyclization of 2-Aminophenethyl Alcohols: A Novel and Direct Approach to the Synthesis of N-Acyl Indolines","Journal of Organic Chemistry","2007","72","","9364","9367","10.1021/jo701566v","","","0.71073","MoKα","","0.1087","0.0553","","","0.1334","0.159","","","","","","1.033","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023044","7.2404","0.0009","10.3639","0.0014","12.95","0.0017","71.853","0.002","85.126","0.003","75.511","0.003","894","0.2","273","2","273","2","","","","","","","","2","P -1","-P 1","2","","","","- C28 H20 -","- C28 H20 -","- C56 H40 -","2","1","","Arindam Das; Hsuan-Hung Liao; Rai-Shung Liu","Platinum-Catalyzed Chemoselectively Hydrative Dimerization of 2-Alkynyl-1-acetylbenzenes for One-Pot Facile Synthesis of Chrysene Derivatives","Journal of Organic Chemistry","2007","72","","9214","9218","10.1021/jo701580r","","","0.71073","MoKα","","0.0781","0.0526","","","0.1219","0.1326","","","","","","0.914","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023045","18.328","0.014","5.544","0.004","27.29","0.02","90","","96.845","0.014","90","","2753","4","294","2","294","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C40 H32 -","- C40 H32 -","- C160 H128 -","4","1","","Arindam Das; Hsuan-Hung Liao; Rai-Shung Liu","Platinum-Catalyzed Chemoselectively Hydrative Dimerization of 2-Alkynyl-1-acetylbenzenes for One-Pot Facile Synthesis of Chrysene Derivatives","Journal of Organic Chemistry","2007","72","","9214","9218","10.1021/jo701580r","","","0.71073","MoKα","","0.3892","0.0416","","","0.0417","0.0796","","","","","","0.56","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023046","8.037","0.002","9.317","0.002","31.679","0.007","90","","96.341","0.004","90","","2357.6","1","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H25 N O7 -","- C25 H25 N O7 -","- C100 H100 N4 O28 -","4","1","","Kailiang Wang; Qingmin Wang; Runqiu Huang","Efficient Synthesis of a New Structural Phenanthro[9,10,3',4']indolizidine Starting from Pyrrole","Journal of Organic Chemistry","2007","72","","8416","8421","10.1021/jo701590p","","","0.71073","MoKα","","0.0879","0.0459","","","0.122","0.1442","","","","","","1.052","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023047","6.2166","0.0006","14.528","0.003","14.394","0.003","90","","86.519","0.01","90","","1297.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","allenene","","- C14 H15 N O2 S -","- C14 H15 N O2 S -","- C56 H60 N4 O8 S4 -","4","1","","So Hee Sim; Sang Ick Lee; Junhyeok Seo; Young Keun Chung","Mercury(II) Triflate-Catalyzed Cycloisomerization of Allenynes to Allenenes","Journal of Organic Chemistry","2007","72","","9818","9821","10.1021/jo701591e","","","0.71069","MoKα","","0.1425","0.0639","","","0.1446","0.1791","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023048","7.7412","0.0015","9.4702","0.0019","15.071","0.003","96.07","0.03","102.1","0.03","97.26","0.03","1061.6","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H26 N2 O5 -","- C22 H26 N2 O5 -","- C44 H52 N4 O10 -","2","1","","Hanns Martin Kaiser; Ivo Zenz; Wei Fun Lo; Anke Spannenberg; Kristin Schröder; Haijun Jiao; Dirk Gördes; Matthias Beller; Man Kin Tse","Preparation of Novel Unsymmetrical Bisindoles under Solvent-Free Conditions: Synthesis, Crystal Structures, and Mechanistic Aspects","Journal of Organic Chemistry","2007","72","","8847","8858","10.1021/jo7016026","","","0.71073","MoKα","","0.0711","0.0407","","","0.0885","0.0948","","","","","","0.82","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023049","9.5642","0.0006","27.4004","0.0019","11.5292","0.0006","90","","99.372","0.005","90","","2981","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H33 N3 O7 S -","- C29 H33 N3 O7 S -","- C116 H132 N12 O28 S4 -","4","1","","Hanns Martin Kaiser; Ivo Zenz; Wei Fun Lo; Anke Spannenberg; Kristin Schröder; Haijun Jiao; Dirk Gördes; Matthias Beller; Man Kin Tse","Preparation of Novel Unsymmetrical Bisindoles under Solvent-Free Conditions: Synthesis, Crystal Structures, and Mechanistic Aspects","Journal of Organic Chemistry","2007","72","","8847","8858","10.1021/jo7016026","","","0.71073","MoKα","","0.0871","0.0532","","","0.1415","0.1517","","","","","","0.917","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023050","8.6278","0.0017","12.338","0.003","13.931","0.003","81.54","0.03","80.18","0.03","76.03","0.03","1409.2","0.5","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H32 N4 O7 S -","- C28 H32 N4 O7 S -","- C56 H64 N8 O14 S2 -","2","1","","Hanns Martin Kaiser; Ivo Zenz; Wei Fun Lo; Anke Spannenberg; Kristin Schröder; Haijun Jiao; Dirk Gördes; Matthias Beller; Man Kin Tse","Preparation of Novel Unsymmetrical Bisindoles under Solvent-Free Conditions: Synthesis, Crystal Structures, and Mechanistic Aspects","Journal of Organic Chemistry","2007","72","","8847","8858","10.1021/jo7016026","","","0.71073","MoKα","","0.045","0.033","","","0.0863","0.0886","","","","","","1.05","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023051","10.3736","0.0004","11.465","0.0005","13.1802","0.0005","88.041","0.003","71.034","0.003","68.628","0.003","1374.19","0.1","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H31 N3 O7 S -","- C28 H31 N3 O7 S -","- C56 H62 N6 O14 S2 -","2","1","","Hanns Martin Kaiser; Ivo Zenz; Wei Fun Lo; Anke Spannenberg; Kristin Schröder; Haijun Jiao; Dirk Gördes; Matthias Beller; Man Kin Tse","Preparation of Novel Unsymmetrical Bisindoles under Solvent-Free Conditions: Synthesis, Crystal Structures, and Mechanistic Aspects","Journal of Organic Chemistry","2007","72","","8847","8858","10.1021/jo7016026","","","0.71073","MoKα","","0.0513","0.0379","","","0.0947","0.0979","","","","","","1.024","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023052","13.641","0.003","16.424","0.003","12.005","0.002","90","","94.29","0.03","90","","2682.1","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H30 N4 O5 S -","- C29 H26 N4 O5 S -","- C116 H104 N16 O20 S4 -","4","1","","Hanns Martin Kaiser; Ivo Zenz; Wei Fun Lo; Anke Spannenberg; Kristin Schröder; Haijun Jiao; Dirk Gördes; Matthias Beller; Man Kin Tse","Preparation of Novel Unsymmetrical Bisindoles under Solvent-Free Conditions: Synthesis, Crystal Structures, and Mechanistic Aspects","Journal of Organic Chemistry","2007","72","","8847","8858","10.1021/jo7016026","","","0.71073","MoKα","","0.0879","0.0424","","","0.0816","0.0901","","","","","","0.81","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023053","12.698","0.003","8.0757","0.0016","17.149","0.003","90","","102.88","0.03","90","","1714.3","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H19 N3 O2 -","- C21 H19 N3 O2 -","- C84 H76 N12 O8 -","4","1","","Hanns Martin Kaiser; Ivo Zenz; Wei Fun Lo; Anke Spannenberg; Kristin Schröder; Haijun Jiao; Dirk Gördes; Matthias Beller; Man Kin Tse","Preparation of Novel Unsymmetrical Bisindoles under Solvent-Free Conditions: Synthesis, Crystal Structures, and Mechanistic Aspects","Journal of Organic Chemistry","2007","72","","8847","8858","10.1021/jo7016026","","","0.71073","MoKα","","0.0597","0.0322","","","0.0637","0.0679","","","","","","0.811","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023054","39.056","0.0018","12.115","0.0005","11.669","0.0005","90","","90","","90","","5521.3","0.4","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C35 H30 N O P -","- C35 H30 N O P -","- C280 H240 N8 O8 P8 -","8","2","","Gloria Ruiz-Gómez; María José Iglesias; Manuel Serrano-Ruiz; Fernando López-Ortiz","Dearomatizing Anionic Cyclization of N-Alkyl-N-benzyl(dinaphthyl)phosphinamides. A Facile Route to γ-(Amino)dihydronaphthalenylphosphinic Acids","Journal of Organic Chemistry","2007","72","","9704","9712","10.1021/jo701607s","","","0.71069","MoKα","","0.1155","0.0484","","","0.0853","0.1221","","","","","","0.835","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023055","21.149","0.009","19.342","0.009","11.087","0.005","90","","95.463","0.013","90","","4515","3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 N O P -","- C28 H24 N O P -","- C224 H192 N8 O8 P8 -","8","2","","Gloria Ruiz-Gómez; María José Iglesias; Manuel Serrano-Ruiz; Fernando López-Ortiz","Dearomatizing Anionic Cyclization of N-Alkyl-N-benzyl(dinaphthyl)phosphinamides. A Facile Route to γ-(Amino)dihydronaphthalenylphosphinic Acids","Journal of Organic Chemistry","2007","72","","9704","9712","10.1021/jo701607s","","","0.71073","MoKα","","0.1129","0.0503","","","0.0996","0.1357","","","","","","0.839","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023056","8.839","0.003","19.75","0.007","22.287","0.007","90","","97.521","0.015","90","","3857","2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C60 H84 I4 N8 O30 -","- C60 H84 I4 N8 O30 -","- C120 H168 I8 N16 O60 -","2","1","","Alicia Boto; Dácil Hernández; Rosendo Hernández; Eleuterio Álvarez","One-Pot Synthesis of Acyclic Nucleosides from Carbohydrate Derivatives, by Combination of Tandem and Sequential Reactions","Journal of Organic Chemistry","2007","72","","9523","9532","10.1021/jo701608p","","","0.71073","MoKα","","0.197","0.0873","","","0.1893","0.236","","","","","","1","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023057","7.2301","0.0002","17.5814","0.0008","19.1174","0.0008","90","","90","","90","","2430.11","0.16","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H25 N3 O8 -","- C26 H25 N3 O8 -","- C104 H100 N12 O32 -","4","1","","Alicia Boto; Dácil Hernández; Rosendo Hernández; Eleuterio Álvarez","One-Pot Synthesis of Acyclic Nucleosides from Carbohydrate Derivatives, by Combination of Tandem and Sequential Reactions","Journal of Organic Chemistry","2007","72","","9523","9532","10.1021/jo701608p","","","0.71073","MoKα","","0.079","0.042","","","0.0855","0.0982","","","","","","1.023","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023058","8.1672","0.0003","13.4581","0.0006","31.873","0.0012","90","","90","","90","","3503.3","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 I N2 O7 -","- C14 H19 I N2 O7 -","- C112 H152 I8 N16 O56 -","8","2","","Alicia Boto; Dácil Hernández; Rosendo Hernández; Eleuterio Álvarez","One-Pot Synthesis of Acyclic Nucleosides from Carbohydrate Derivatives, by Combination of Tandem and Sequential Reactions","Journal of Organic Chemistry","2007","72","","9523","9532","10.1021/jo701608p","","","0.71073","MoKα","","0.0896","0.0531","","","0.1012","0.1126","","","","","","0.989","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023059","15.9578","0.0007","6.217","0.0004","17.4652","0.001","90","","101.03","0.002","90","","1700.71","0.16","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H21 N3 O5 -","- C16 H21 N3 O5 -","- C64 H84 N12 O20 -","4","2","","Alicia Boto; Dácil Hernández; Rosendo Hernández; Eleuterio Álvarez","One-Pot Synthesis of Acyclic Nucleosides from Carbohydrate Derivatives, by Combination of Tandem and Sequential Reactions","Journal of Organic Chemistry","2007","72","","9523","9532","10.1021/jo701608p","","","0.71073","MoKα","","0.0993","0.0462","","","0.1242","0.159","","","","","","1.088","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023060","25.843","0.002","13.9239","0.0011","28.316","0.002","90","","116.791","0.001","90","","9095.4","1.2","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H28 N2 O2 -","- C26 H28 N2 O2 -","- C416 H448 N32 O32 -","16","2","","Paul R. Blakemore; Selena D. Milicevic; Lev N. Zakharov","Enzymatic Resolution of 7,7'-Dihydroxy-8,8'-biquinolyl Dipentanoate and Its Conversion to 2,2'-Di-tert-butyl-7,7'-dihydroxy-8,8'-biquinolyl","Journal of Organic Chemistry","2007","72","","9368","9371","10.1021/jo701611u","","","0.71073","MoKα","","0.0621","0.0488","","","0.1259","0.1376","","","","","","1.026","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023061","9.6812","0.001","14.3823","0.001","15.626","0.002","90","","97.944","0.004","90","","2154.9","0.4","150","2","150","2","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","Paquette 1456","","","- C24 H38 O6 -","- C24 H38 O6 -","- C96 H152 O24 -","4","1","","David G. Hilmey; Barry D. Davis; Judith C. Gallucci; Jennifer S. Brodbelt; Leo A. Paquette","X-ray Crystallographic and Mass Spectrometric Probing of the Conformational and Ionophoric Properties of Stereoisomeric Hexatetrahydrofuranylhexane Segments","Journal of Organic Chemistry","2007","72","","9088","9101","10.1021/jo7016229","","x-ray","0.71073","MoKα","","0.0618","0.0433","","","0.1081","0.1161","","","","","","1.055","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023062","10.6475","0.001","8.5764","0.001","12.78","0.002","90","","113.614","0.007","90","","1069.3","0.2","150","2","150","2","","","","","","","synthesis as described","3","P 1 21 1","P 2yb","4","Paquette 1422","","","- C24 H38 O6 -","- C24 H38 O6 -","- C48 H76 O12 -","2","1","","David G. Hilmey; Barry D. Davis; Judith C. Gallucci; Jennifer S. Brodbelt; Leo A. Paquette","X-ray Crystallographic and Mass Spectrometric Probing of the Conformational and Ionophoric Properties of Stereoisomeric Hexatetrahydrofuranylhexane Segments","Journal of Organic Chemistry","2007","72","","9088","9101","10.1021/jo7016229","","x-ray","0.71073","MoKα","","0.0524","0.0448","","","0.1141","0.1193","","","","","","1.059","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023063","10.9912","0.001","13.996","0.002","14.35","0.002","90","","106.475","0.006","90","","2116.8","0.5","150","2","150","2","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","Paquette 1432","","","- C24 H38 O6 -","- C24 H38 O6 -","- C96 H152 O24 -","4","1","","David G. Hilmey; Barry D. Davis; Judith C. Gallucci; Jennifer S. Brodbelt; Leo A. Paquette","X-ray Crystallographic and Mass Spectrometric Probing of the Conformational and Ionophoric Properties of Stereoisomeric Hexatetrahydrofuranylhexane Segments","Journal of Organic Chemistry","2007","72","","9088","9101","10.1021/jo7016229","","x-ray","0.71073","MoKα","","0.075","0.0474","","","0.1183","0.1294","","","","","","1.075","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023064","11.9083","0.001","14.174","0.001","13.367","0.002","90","","109.92","0.004","90","","2121.2","0.4","150","2","150","2","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","Paquette 1418","","","- C24 H38 O6 -","- C24 H38 O6 -","- C96 H152 O24 -","4","1","","David G. Hilmey; Barry D. Davis; Judith C. Gallucci; Jennifer S. Brodbelt; Leo A. Paquette","X-ray Crystallographic and Mass Spectrometric Probing of the Conformational and Ionophoric Properties of Stereoisomeric Hexatetrahydrofuranylhexane Segments","Journal of Organic Chemistry","2007","72","","9088","9101","10.1021/jo7016229","","x-ray","0.71073","MoKα","","0.0777","0.0512","","","0.1308","0.1445","","","","","","1.052","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023065","12.194","0.002","14.252","0.002","12.946","0.002","90","","109.525","0.008","90","","2120.6","0.6","150","2","150","2","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","Paquette 1437","","","- C24 H38 O6 -","- C24 H38 O6 -","- C96 H152 O24 -","4","1","","David G. Hilmey; Barry D. Davis; Judith C. Gallucci; Jennifer S. Brodbelt; Leo A. Paquette","X-ray Crystallographic and Mass Spectrometric Probing of the Conformational and Ionophoric Properties of Stereoisomeric Hexatetrahydrofuranylhexane Segments","Journal of Organic Chemistry","2007","72","","9088","9101","10.1021/jo7016229","","x-ray","0.71073","MoKα","","0.0789","0.0491","","","0.1144","0.1269","","","","","","1.051","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023066","11.961","0.001","14.4933","0.001","13.1231","0.001","90","","110.603","0.004","90","","2129.4","0.3","150","2","150","2","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","Paquette 1438","","","- C24 H38 O6 -","- C24 H38 O6 -","- C96 H152 O24 -","4","1","","David G. Hilmey; Barry D. Davis; Judith C. Gallucci; Jennifer S. Brodbelt; Leo A. Paquette","X-ray Crystallographic and Mass Spectrometric Probing of the Conformational and Ionophoric Properties of Stereoisomeric Hexatetrahydrofuranylhexane Segments","Journal of Organic Chemistry","2007","72","","9088","9101","10.1021/jo7016229","","x-ray","0.71073","MoKα","","0.0601","0.0431","","","0.1088","0.1164","","","","","","1.05","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023067","17.16","0.002","8.8142","0.001","14.308","0.002","90","","96.688","0.005","90","","2149.3","0.5","150","2","150","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","Paquette 1442","","","- C24 H38 O6 -","- C24 H38 O6 -","- C96 H152 O24 -","4","1","","David G. Hilmey; Barry D. Davis; Judith C. Gallucci; Jennifer S. Brodbelt; Leo A. Paquette","X-ray Crystallographic and Mass Spectrometric Probing of the Conformational and Ionophoric Properties of Stereoisomeric Hexatetrahydrofuranylhexane Segments","Journal of Organic Chemistry","2007","72","","9088","9101","10.1021/jo7016229","","x-ray","0.71073","MoKα","","0.0778","0.047","","","0.1117","0.1231","","","","","","1.039","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023068","9.0254","0.0008","10.636","0.001","11.5572","0.001","90","","95.432","0.001","90","","1104.44","0.17","294","2","294","2","","","","","","","","4","P 1 n 1","P -2yac","7","","","","- C25 H30 N2 O5 -","- C25 H30 N2 O5 -","- C50 H60 N4 O10 -","2","1","","Hai-Long Wei; Ze-Yi Yan; Yan-Ning Niu; Gao-Qiang Li; Yong-Min Liang","New Light on an Old Story: Facile and Efficient Synthesis of 1,3-Diaryl-5-spirohexahydro- pyrimidines via a Six-Molecule, Three-Component Mannich-Type Reaction","Journal of Organic Chemistry","2007","72","","8600","8603","10.1021/jo7016235","","","0.71073","MoKα","","0.0544","0.04","","","0.1082","0.1228","","","","","","0.827","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023069","11.6015","0.0018","13.783","0.002","19.737","0.003","98.258","0.002","104.045","0.002","105.721","0.002","2872.2","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H65 F12 N3 O14 P2 -","- C49 H59 F12 N3 O14 P2 -","- C98 H118 F24 N6 O28 P4 -","2","1","","Jinqiang Zhang; Feihe Huang; Ning Li; Hong Wang; Harry W. Gibson; Peter Gantzel; Arnold L. Rheingold","Paraquat Substituent Effect on Complexation with a Dibenzo-24-crown-8-Based Cryptand","Journal of Organic Chemistry","2007","72","","8935","8938","10.1021/jo701653q","","","0.71073","MoKα","","0.0946","0.0756","","","0.2125","0.226","","","","","","1.144","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023070","12.4297","0.0012","14.388","0.0014","15.8418","0.0015","95.354","0.002","90.6","0.002","108.356","0.002","2674.9","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H57 F12 N3 O13 P2 -","- C51 H57 F12 N3 O13 P2 -","- C102 H114 F24 N6 O26 P4 -","2","1","","Jinqiang Zhang; Feihe Huang; Ning Li; Hong Wang; Harry W. Gibson; Peter Gantzel; Arnold L. Rheingold","Paraquat Substituent Effect on Complexation with a Dibenzo-24-crown-8-Based Cryptand","Journal of Organic Chemistry","2007","72","","8935","8938","10.1021/jo701653q","","","0.71073","MoKα","","0.061","0.0461","","","0.1186","0.1282","","","","","","1.026","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023071","5.7476","0.0016","10.267","0.003","29.264","0.008","90","","90","","90","","1726.8","0.8","203","2","203","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H18 O2 S -","- C22 H18 O2 S -","- C88 H72 O8 S4 -","4","1","","Hong Cao; Wen-Jing Xiao; Howard Alper","Dramatic Effects of Ionic Liquids on the Palladium-Catalyzed Cyclocarbonylation of Enynols with Thiols","Journal of Organic Chemistry","2007","72","","8562","8564","10.1021/jo701675e","","","0.71073","MoKα","","0.0592","0.044","","","0.109","0.1177","","","","","","1.026","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023072","10.7984","0.0002","10.7984","0.0002","11.9281","0.0002","90","","90","","90","","1390.88","0.04","100","2","100","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C8 H8 N2 -","- C8 H8 N2 -","- C64 H64 N16 -","8","0.5","","Sanjeev K. Dey; David A. Lightner","1,1'-Bipyrroles: Synthesis and Stereochemistry","Journal of Organic Chemistry","2007","72","","9395","9397","10.1021/jo7016789","","","0.71073","MoKα","","0.037","0.0352","","","0.1065","0.1091","","","","","","1.074","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023073","10.754","0.004","11.152","0.004","15.233","0.005","90","","90","","90","","1826.8","1.1","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H20 Br N O3 -","- C20 H20 Br N O3 -","- C80 H80 Br4 N4 O12 -","4","1","","Jamie L. Zigterman; Jacqueline C. S. Woo; Shawn D. Walker; Jason S. Tedrow; Christopher J. Borths; Emilio E. Bunel; Margaret M. Faul","Highly Selective Rhodium-Catalyzed Conjugate Addition Reactions of 4-Oxobutenamides","Journal of Organic Chemistry","2007","72","","8870","8876","10.1021/jo701682c","","","0.71073","MoKα","","0.0392","0.0316","","","0.0736","0.0766","","","","","","0.996","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023074","6.436","0.002","11.263","0.004","24.913","0.009","90","","90","","90","","1806","1.1","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H20 Br N O3 -","- C20 H20 Br N O3 -","- C80 H80 Br4 N4 O12 -","4","1","","Jamie L. Zigterman; Jacqueline C. S. Woo; Shawn D. Walker; Jason S. Tedrow; Christopher J. Borths; Emilio E. Bunel; Margaret M. Faul","Highly Selective Rhodium-Catalyzed Conjugate Addition Reactions of 4-Oxobutenamides","Journal of Organic Chemistry","2007","72","","8870","8876","10.1021/jo701682c","","","0.71073","MoKα","","0.0746","0.0538","","","0.1175","0.127","","","","","","1.058","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023075","10.207","0.002","15.353","0.003","18.652","0.004","90","","90","","90","","2922.9","1","193","2","193","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C31 H40 B F4 P2 Rh -","- C31 H40 B F4 P2 Rh -","- C124 H160 B4 F16 P8 Rh4 -","4","1","","Jamie L. Zigterman; Jacqueline C. S. Woo; Shawn D. Walker; Jason S. Tedrow; Christopher J. Borths; Emilio E. Bunel; Margaret M. Faul","Highly Selective Rhodium-Catalyzed Conjugate Addition Reactions of 4-Oxobutenamides","Journal of Organic Chemistry","2007","72","","8870","8876","10.1021/jo701682c","","","0.71073","MoKα","","0.0366","0.0297","","","0.0665","0.0692","","","","","","1.02","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023076","8.2521","0.0002","26.0932","0.001","42.7518","0.0015","90","","92.152","0.002","90","","9199","0.5","120","2","120","2","","","","","","","Gareth Bates","5","P 1 21/n 1","-P 2yn","14","","","","- C92 H146 Cl3 N11 O5 -","- C92 H146 Cl3 N11 O5 -","- C368 H584 Cl12 N44 O20 -","4","1","","Gareth W. Bates; Triyanti; Mark E. Light; Markus Albrecht; Philip A. Gale","2,7-Functionalized Indoles as Receptors for Anions","Journal of Organic Chemistry","2007","72","","8921","8927","10.1021/jo701702p","","","0.71073","MoKα","","0.1833","0.0836","","","0.1909","0.2441","","","","","","0.959","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023077","8.3464","0.0003","10.5112","0.0003","13.0482","0.0004","76.453","0.002","85.668","0.002","84.522","0.002","1106.12","0.06","120","2","120","2","","","","","","","Gareth Bates","5","P -1","-P 1","2","","","","- C24 H24 N4 O3 S -","- C24 H24 N4 O3 S -","- C48 H48 N8 O6 S2 -","2","1","","Gareth W. Bates; Triyanti; Mark E. Light; Markus Albrecht; Philip A. Gale","2,7-Functionalized Indoles as Receptors for Anions","Journal of Organic Chemistry","2007","72","","8921","8927","10.1021/jo701702p","","","0.71073","MoKα","","0.0728","0.0476","","","0.1082","0.1215","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023078","7.6003","0.0002","12.0848","0.0004","12.5665","0.0004","83.469","0.002","78.876","0.002","71.766","0.002","1073.89","0.06","120","2","120","2","","","","","","","Gareth Bates","5","P -1","-P 1","2","","","","- C24 H23 N3 O3 S -","- C24 H23 N3 O3 S -","- C48 H46 N6 O6 S2 -","2","1","","Gareth W. Bates; Triyanti; Mark E. Light; Markus Albrecht; Philip A. Gale","2,7-Functionalized Indoles as Receptors for Anions","Journal of Organic Chemistry","2007","72","","8921","8927","10.1021/jo701702p","","","0.71073","MoKα","","0.0782","0.0585","","","0.1195","0.1322","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023079","8.5044","0.0002","12.4661","0.0004","16.052","0.0005","91.946","0.001","99.404","0.002","109.096","0.002","1579.53","0.08","120","2","120","2","","","","","","","Gareth Bates","5","P 1","P 1","1","","","","- C68 H100 N6 O5 S -","- C68 H100 N6 O5 S -","- C68 H100 N6 O5 S -","1","1","","Gareth W. Bates; Triyanti; Mark E. Light; Markus Albrecht; Philip A. Gale","2,7-Functionalized Indoles as Receptors for Anions","Journal of Organic Chemistry","2007","72","","8921","8927","10.1021/jo701702p","","","0.71073","MoKα","","0.0842","0.0542","","","0.1176","0.13","","","","","","1.049","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023080","9.8982","0.0005","10.0741","0.0004","11.599","0.0006","76.08","0.003","88.484","0.002","87.099","0.002","1121.07","0.09","120","2","120","2","","","","","","","Gareth Bates","5","P -1","-P 1","2","","","","- C25 H25 N3 O3 S -","- C25 H25 N3 O3 S -","- C50 H50 N6 O6 S2 -","2","1","","Gareth W. Bates; Triyanti; Mark E. Light; Markus Albrecht; Philip A. Gale","2,7-Functionalized Indoles as Receptors for Anions","Journal of Organic Chemistry","2007","72","","8921","8927","10.1021/jo701702p","","","0.71073","MoKα","","0.1174","0.05","","","0.0976","0.1167","","","","","","1.019","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023081","23.6704","0.0005","9.3018","0.0002","16.9937","0.0003","90","","98.944","0.001","90","","3696.13","0.13","120","2","120","2","","","","","","","Gareth Bates","4","C 1 2/c 1","-C 2yc","15","","","","- C23 H19 N3 O2 -","- C23 H19 N3 O2 -","- C184 H152 N24 O16 -","8","1","","Gareth W. Bates; Triyanti; Mark E. Light; Markus Albrecht; Philip A. Gale","2,7-Functionalized Indoles as Receptors for Anions","Journal of Organic Chemistry","2007","72","","8921","8927","10.1021/jo701702p","","","0.71073","MoKα","","0.0832","0.0507","","","0.1134","0.129","","","","","","1.042","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023082","7.2975","0.0007","9.7288","0.0009","11.1396","0.0011","90","","90","","90","","790.87","0.13","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","compound 8g (RS-300, 1237)","(-)-(1R,2R,6R,7S)-4,8-Dioxa-tricyclo[5.2.2.0^2,6^]undecan-9-one","","- C9 H12 O3 -","- C9 H12 O3 -","- C36 H48 O12 -","4","1","","Radka Snajdrova; Ingbert Braun; Thorsten Bach; Kurt Mereiter; Marko D. Mihovilovic","Biooxidation of Bridged Cycloketones Using Baeyer-Villiger Monooxygenases of Various Bacterial Origin","Journal of Organic Chemistry","2007","72","","9597","9603","10.1021/jo701704x","","","0.71073","MoKα","","0.0357","0.0345","","","0.0891","0.0906","","","","","","1.061","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023083","6.2699","0.0014","6.4057","0.0014","22.715","0.005","90","","90","","90","","912.3","0.4","163","2","163","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H11 N O6 -","- C8 H11 N O6 -","- C32 H44 N4 O24 -","4","1","","Jamie L. Cohen; A. Richard Chamberlin","Diastereoselective Synthesis of Glutamate-Appended Oxolane Rings: Synthesis of (S)-(+)-Lycoperdic Acid","Journal of Organic Chemistry","2007","72","","9240","9247","10.1021/jo7017137","","","0.71073","MoKα","","0.05","0.0421","","","0.1022","0.1104","","","","","","1.048","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023084","7.547","0.002","14.366","0.004","15.884","0.005","96.597","0.006","93.047","0.006","90.073","0.006","1708.4","0.9","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H18 O2 -","- C22 H18 O2 -","- C88 H72 O8 -","4","2","","Guijie Li; Shaolin Zhou; Guowei Su; Yuanhong Liu; Peng George Wang","Improved Synthesis of Aryl-Substituted Anthracenes and Heteroacenes","Journal of Organic Chemistry","2007","72","","9830","9833","10.1021/jo7017334","","","0.71073","MoKα","","0.1739","0.1222","","","0.3569","0.3803","","","","","","1.1","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023085","9.5009","0.0015","9.2869","0.0015","10.3122","0.0017","90","","102.262","0.003","90","","889.1","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C24 H14 S2 -","- C24 H14 S2 -","- C48 H28 S4 -","2","1","","Guijie Li; Shaolin Zhou; Guowei Su; Yuanhong Liu; Peng George Wang","Improved Synthesis of Aryl-Substituted Anthracenes and Heteroacenes","Journal of Organic Chemistry","2007","72","","9830","9833","10.1021/jo7017334","","","0.71073","MoKα","","0.0787","0.0709","","","0.1821","0.1908","","","","","","0.993","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023086","7.2006","0.0007","6.1942","0.0006","18.1343","0.0019","90","","94.042","0.003","90","","806.81","0.14","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 B F2 N O -","- C8 H8 B F2 N O -","- C32 H32 B4 F8 N4 O4 -","4","1","","Alexander D. Dilman; Dmitry E. Arkhipov; Vitalij V. Levin; Pavel A. Belyakov; Alexander A. Korlyukov; Marina I. Struchkova; Vladimir A. Tartakovsky","Trifluoromethylation of Salicyl Aldimines","Journal of Organic Chemistry","2007","72","","8604","8607","10.1021/jo701734d","","","0.71073","MoKα","","0.0628","0.0415","","","0.0993","0.1094","","","","","","1.044","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4023087","16.2097","0.0018","8.0929","0.0008","21.989","0.002","90","","94.95","0.002","90","","2873.8","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C43 H21 Cl O2 -","- C43 H21 Cl O2 -","- C172 H84 Cl4 O8 -","4","1","","Yu-Hsuan Wang; Novruz G. Akhmedov; Jeffrey L. Petersen; Kung K. Wang","Construction of Unusual and Congested Polycyclic Structures via Benzannulated Enediynyl Alcohols Derived from Truxenone","Journal of Organic Chemistry","2007","72","","9604","9608","10.1021/jo701736y","","","0.71073","MoKα","","0.0907","0.0509","","","0.1269","0.1499","","","","","","1.019","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023088","8.0255","0.0007","15.4718","0.0015","16.9075","0.0016","91.457","0.002","99.299","0.002","90.126","0.002","2071.1","0.3","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","","","- C59 H32 O3 -","- C59 H32 O3 -","- C118 H64 O6 -","2","1","","Yu-Hsuan Wang; Novruz G. Akhmedov; Jeffrey L. Petersen; Kung K. Wang","Construction of Unusual and Congested Polycyclic Structures via Benzannulated Enediynyl Alcohols Derived from Truxenone","Journal of Organic Chemistry","2007","72","","9604","9608","10.1021/jo701736y","","","0.71073","MoKα","","0.2199","0.0708","","","0.1432","0.191","","","","","","0.914","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023089","15.8932","0.0011","16.4553","0.0011","17.6576","0.0011","89.152","0.001","84.07","0.001","78.997","0.001","4508.7","0.5","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C62.5 H38 Cl3 O -","- C59.5 H31 Cl3 O -","- C238 H124 Cl12 O4 -","4","2","","Yu-Hsuan Wang; Novruz G. Akhmedov; Jeffrey L. Petersen; Kung K. Wang","Construction of Unusual and Congested Polycyclic Structures via Benzannulated Enediynyl Alcohols Derived from Truxenone","Journal of Organic Chemistry","2007","72","","9604","9608","10.1021/jo701736y","","","0.71073","MoKα","","0.1591","0.0654","","","0.1444","0.1698","","","","","","0.814","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4023090","15.1872","0.0017","16.2849","0.0018","23.826","0.002","90","","104.304","0.002","90","","5710","1.1","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C78 H48 Cl2 O2 -","- C75 H40 Cl2 O -","- C300 H160 Cl8 O4 -","4","1","","Yu-Hsuan Wang; Novruz G. Akhmedov; Jeffrey L. Petersen; Kung K. Wang","Construction of Unusual and Congested Polycyclic Structures via Benzannulated Enediynyl Alcohols Derived from Truxenone","Journal of Organic Chemistry","2007","72","","9604","9608","10.1021/jo701736y","","","0.71073","MoKα","","0.2261","0.0745","","","0.1699","0.205","","","","","","0.767","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023091","13.1629","0.0005","12.1018","0.0004","33.8984","0.0012","90","","96.627","0.001","90","","5363.8","0.3","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C56 H47 Cl4 F3 O6 P2 Pd S -","- C56 H47 Cl4 F3 O6 P2 Pd S -","- C224 H188 Cl16 F12 O24 P8 Pd4 S4 -","4","1","","Ana Minatti; Xiaolai Zheng; Stephen L. Buchwald","Synthesis of Chiral 3-Substituted Indanones via an Enantioselective Reductive-Heck Reaction","Journal of Organic Chemistry","2007","72","","9253","9258","10.1021/jo701741y","","","0.71073","MoKα","","0.067","0.049","","","0.1102","0.1193","","","","","","1.061","","","","has coordinates,has disorder","178409","2020-10-21","18:00:00",""
"4023092","7.001","0.0002","12.2264","0.0003","7.3355","0.0002","90","","92.6343","0.0018","90","","627.23","0.03","160","1","160","1","","","","","","","","3","P 1 21 1","P 2yb","4","auricularin","","","- C15 H18 O3 -","- C15 H18 O3 -","- C30 H36 O6 -","2","1","","Anastasia Karioti; Helen Skaltsa; Anthony Linden; Remo Perozzo; Reto Brun; Deniz Tasdemir","Anthecularin: A Novel Sesquiterpene Lactone from Anthemis auriculata with Antiprotozoal Activity","Journal of Organic Chemistry","2007","72","","8103","8106","10.1021/jo701751w","","","0.71073","MoKα","","0.0468","0.0432","","","0.1002","0.1037","","","","","","1.123","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023093","18.417","0.003","20.223","0.003","21.134","0.003","101.472","0.004","109.674","0.002","114.633","0.001","6185.7","1.7","113","2","113","2","","","","","","","","2","P -1","-P 1","2","","","","- C136 H94 -","- C136 H94 -","- C272 H188 -","2","1","","Chun Zhang; Chuan-Feng Chen","Synthesis and Structure of A Triptycene-Based Nanosized Molecular Cage","Journal of Organic Chemistry","2007","72","","9339","9341","10.1021/jo7017526","","","0.7107","MoKα","","0.2579","0.1505","","","0.3849","0.4404","","","","","","1.091","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023094","11.7549","0.0011","12.055","0.0011","16.4347","0.0015","100.452","0.002","109.624","0.002","99.259","0.002","2094.4","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H31 N O2 -","- C23 H31 N O2 -","- C92 H124 N4 O8 -","4","2","","Anne-Marie L. Hogan; Donal F. O'Shea","Carbolithiation of o-Amino-(E)-Stilbenes: Diastereoselective Electrophile Substitution with Applications to Quinoline Synthesis","Journal of Organic Chemistry","2007","72","","9557","9571","10.1021/jo7017679","","","0.71073","MoKα","","0.0534","0.0399","","","0.0934","0.0993","","","","","","1.028","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023095","19.9518","0.0016","12.7312","0.001","8.8934","0.0007","90","","90","","90","","2259","0.3","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C24 H31 N O4 -","- C24 H31 N O4 -","- C96 H124 N4 O16 -","4","1","","Anne-Marie L. Hogan; Donal F. O'Shea","Carbolithiation of o-Amino-(E)-Stilbenes: Diastereoselective Electrophile Substitution with Applications to Quinoline Synthesis","Journal of Organic Chemistry","2007","72","","9557","9571","10.1021/jo7017679","","","0.71073","MoKα","","0.045","0.042","","","0.1014","0.1033","","","","","","1.04","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023096","9.5778","0.0007","11.0329","0.0008","10.1225","0.0007","90","","110.243","0.001","90","","1003.58","0.12","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H29 N -","- C25 H29 N -","- C50 H58 N2 -","2","1","","Anne-Marie L. Hogan; Donal F. O'Shea","Carbolithiation of o-Amino-(E)-Stilbenes: Diastereoselective Electrophile Substitution with Applications to Quinoline Synthesis","Journal of Organic Chemistry","2007","72","","9557","9571","10.1021/jo7017679","","","0.71073","MoKα","","0.0419","0.0406","","","0.1015","0.1028","","","","","","1.058","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023097","12.3364","0.0018","16.782","0.003","10.5661","0.0016","90","","105.645","0.003","90","","2106.4","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H31 N O3 -","- C24 H31 N O3 -","- C96 H124 N4 O12 -","4","1","","Anne-Marie L. Hogan; Donal F. O'Shea","Carbolithiation of o-Amino-(E)-Stilbenes: Diastereoselective Electrophile Substitution with Applications to Quinoline Synthesis","Journal of Organic Chemistry","2007","72","","9557","9571","10.1021/jo7017679","","","0.71073","MoKα","","0.0606","0.0523","","","0.1329","0.14","","","","","","1.052","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023098","10.8918","0.0009","15.3765","0.0013","22.5143","0.0018","90","","94.425","0.002","90","","3759.4","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H27 N O3 -","- C22 H27 N O3 -","- C176 H216 N8 O24 -","8","2","","Anne-Marie L. Hogan; Donal F. O'Shea","Carbolithiation of o-Amino-(E)-Stilbenes: Diastereoselective Electrophile Substitution with Applications to Quinoline Synthesis","Journal of Organic Chemistry","2007","72","","9557","9571","10.1021/jo7017679","","","0.71073","MoKα","","0.0519","0.0458","","","0.1177","0.1222","","","","","","1.028","","","","has coordinates","178409","2020-10-21","18:00:00",""
"4023099","10.2966","0.0013","6.4115","0.0008","10.7707","0.0014","90","","98.091","0.002","90","","703.97","0.15","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H15 N O8 S -","- C12 H15 N O8 S -","- C24 H30 N2 O16 S2 -","2","1","","Alessandra Cordeiro; María Luisa Jimeno; Miguel A. Maestro; María-José Camarasa; Ernesto Quesada; Ana San-Félix","Synthesis of Highly Condensed Polycyclic Carbohydrates by Reaction of a Spirocyclic Enamino Sulfonate Derived from D-Xylofuranose with Bifunctional Reagents","Journal of Organic Chemistry","2007","72","","9713","9721","10.1021/jo701775a","","","0.71073","MoKα","","0.0825","0.0523","","","0.0946","0.1038","","","","","","1.022","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023100","6.3666","0.0004","15.3404","0.0009","17.1852","0.0013","90","","90","","90","","1678.41","0.19","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C72 H84 N4 O16 -","4","1","","Sha Lou; Peng Dai; Scott E. Schaus","Asymmetric Mannich Reaction of Dicarbonyl Compounds with α-Amido Sulfones Catalyzed by Cinchona Alkaloids and Synthesis of Chiral Dihydropyrimidones","Journal of Organic Chemistry","2007","72","","9998","10008","10.1021/jo701777g","","","0.71073","MoKα","","0.0455","0.0331","","","0.0785","0.0835","","","","","","1.018","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023101","7.1077","0.0007","23.996","0.002","9.9653","0.0009","90","","105.838","0.002","90","","1635.1","0.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","07197a","","","- C36 H44 N2 O3 Si -","- C36 H44 N2 O3 Si -","- C72 H88 N4 O6 Si2 -","2","1","","Zhenlei Song; Richard P. Hsung; Ting Lu; Andrew G. Lohse","Studies on a Urea-Directed Stork-Crabtree Hydrogenation. Synthesis of the C1-C9 Subunit of (+)-Zincophorin","Journal of Organic Chemistry","2007","72","","9722","9731","10.1021/jo7017922","","","0.71073","MoKα","","0.0531","0.04","","","0.0859","0.0911","","","","","","1.04","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023102","6.0607","0.0008","15.52","0.002","20.018","0.003","90","","90","","90","","1883","0.4","95","2","95","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","cmc0546b","","","- C20 H30 N2 O3 -","- C20 H30 N2 O3 -","- C80 H120 N8 O12 -","4","1","","Zhenlei Song; Richard P. Hsung; Ting Lu; Andrew G. Lohse","Studies on a Urea-Directed Stork-Crabtree Hydrogenation. Synthesis of the C1-C9 Subunit of (+)-Zincophorin","Journal of Organic Chemistry","2007","72","","9722","9731","10.1021/jo7017922","","","0.49594","synchrotron","","0.0463","0.044","","","0.1211","0.1228","","","","","","1.128","","","","has coordinates,has disorder","178410","2020-10-21","18:00:00",""
"4023103","9.8192","0.0006","9.8192","0.0006","24.526","0.003","90","","90","","120","","2047.9","0.3","173","2","173","2","","","","","","","","3","P 32 2 1","P 32 2""","154","07009a","","","- C13 H22 O3 -","- C13 H22 O3 -","- C78 H132 O18 -","6","1","","Zhenlei Song; Richard P. Hsung; Ting Lu; Andrew G. Lohse","Studies on a Urea-Directed Stork-Crabtree Hydrogenation. Synthesis of the C1-C9 Subunit of (+)-Zincophorin","Journal of Organic Chemistry","2007","72","","9722","9731","10.1021/jo7017922","","","0.71073","MoKα","","0.0343","0.0312","","","0.0817","0.0836","","","","","","1.083","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023104","6.6268","0.0002","11.6519","0.0005","13.942","0.0006","90","","90","","90","","1076.53","0.07","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C11 H17 O2 -","- C11 H18 O2 -","- C44 H72 O8 -","4","1","","Ryan M. Moslin; Timothy F. Jamison","Total Synthesis of (+)-Acutiphycin","Journal of Organic Chemistry","2007","72","","9736","9745","10.1021/jo701821h","","","0.71073","MoKα","","0.0354","0.0343","","","0.0903","0.0921","","","","","","1.098","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023105","11.609","0.0006","16.6719","0.0009","24.1579","0.0014","90","","90","","90","","4675.6","0.4","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C47 H72 O8 Si -","- C47 H72 O8 Si -","- C188 H288 O32 Si4 -","4","1","","Ryan M. Moslin; Timothy F. Jamison","Total Synthesis of (+)-Acutiphycin","Journal of Organic Chemistry","2007","72","","9736","9745","10.1021/jo701821h","","","0.71073","MoKα","","0.0533","0.0464","","","0.1278","0.1352","","","","","","1.041","","","","has coordinates,has disorder","178410","2020-10-21","18:00:00",""
"4023106","18.707","0.005","37.206","0.009","11.35","0.003","90","","90","","90","","7900","3","211","2","211","2","","","","","","","","3","F d d 2","F 2 -2d","43","","","","- C25 H30 O -","- C25 H30 O -","- C400 H480 O16 -","16","1","","Steve Arns; Marie-Eve Lebrun; Christiane M. Grisé; Irina Denissova; Louis Barriault","Diastereoselective Construction of Quaternary Carbons Directed via Macrocyclic Ring Conformation: Formal Synthesis of (-)-Mesembrine","Journal of Organic Chemistry","2007","72","","9314","9322","10.1021/jo701833v","","","0.71073","MoKα","","0.0412","0.0376","","","0.0934","0.0954","","","","","","1.006","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023107","10.7576","0.0019","9.7166","0.0017","16.691","0.003","90","","91.551","0.003","90","","1744","0.5","209","2","209","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H25 O2 -","- C20 H25 O2 -","- C80 H100 O8 -","4","1","","Steve Arns; Marie-Eve Lebrun; Christiane M. Grisé; Irina Denissova; Louis Barriault","Diastereoselective Construction of Quaternary Carbons Directed via Macrocyclic Ring Conformation: Formal Synthesis of (-)-Mesembrine","Journal of Organic Chemistry","2007","72","","9314","9322","10.1021/jo701833v","","","0.71073","MoKα","","0.0713","0.0567","","","0.1598","0.1699","","","","","","1.049","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023108","9.3625","0.0006","15.8704","0.001","29.0242","0.0019","90","","90","","90","","4312.6","0.5","291","2","291","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C44 H58 Mo N2 O4 -","- C44 H58 Mo N2 O4 -","- C176 H232 Mo4 N8 O16 -","4","1","","Hongwei Yang; Hongsong Wang; Chengjian Zhu","Enantioselective Pinacol Coupling of Aryl Aldehydes Catalyzed by Chiral Salan-Mo(IV) Complexes","Journal of Organic Chemistry","2007","72","","10029","10034","10.1021/jo701842r","","","0.71073","MoKα","","0.0743","0.0615","","","0.1267","0.1299","","","","","","1.027","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023109","7.553","0.001","10.746","0.002","13.435","0.002","90","","90","","90","","1090.4","0.25","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H12 O4 S -","- C10 H12 O4 S -","- C40 H48 O16 S4 -","4","1","","Xiao-Ying Xu; Zhuo Tang; Yan-Zhao Wang; Shi-Wei Luo; Lin-Feng Cun; Liu-Zhu Gong","Asymmetric Organocatalytic Direct Aldol Reactions of Ketones with α-Keto Acids and Their Application to the Synthesis of 2-Hydroxy-γ-butyrolactones","Journal of Organic Chemistry","2007","72","","9905","9913","10.1021/jo701868t","","","0.71073","MoKα","","0.0478","0.0359","","","0.0826","0.086","","","","","","1.024","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023110","5.63","0.003","6.028","0.003","17.632","0.01","90","","92.56","0.002","90","","597.7","0.6","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H13 N O5 -","- C12 H13 N O5 -","- C24 H26 N2 O10 -","2","1","","Xiao-Ying Xu; Zhuo Tang; Yan-Zhao Wang; Shi-Wei Luo; Lin-Feng Cun; Liu-Zhu Gong","Asymmetric Organocatalytic Direct Aldol Reactions of Ketones with α-Keto Acids and Their Application to the Synthesis of 2-Hydroxy-γ-butyrolactones","Journal of Organic Chemistry","2007","72","","9905","9913","10.1021/jo701868t","","","0.71073","MoKα","","0.0425","0.0379","","","0.0974","0.1046","","","","","","0.52","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023111","4.6829","0.0017","9.907","0.004","25.146","0.009","90","","90","","90","","1166.6","0.7","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H17 N O3 -","- C13 H17 N O3 -","- C52 H68 N4 O12 -","4","1","","Xiang Zhou; Wen-Jun Liu; Jian-Liang Ye; Pei-Qiang Huang","Complementary Stereocontrolled Approaches to 2-Pyrrolidinones Bearing a Vicinal Amino Diol Subunit with Three Continuous Chiral Centers: A Formal Asymmetric Synthesis of (-)-Detoxinine","Journal of Organic Chemistry","2007","72","","8904","8909","10.1021/jo7018784","","","0.71073","MoKα","","0.0674","0.0627","","","0.1457","0.1486","","","","","","1.103","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023112","12.749","0.003","7.451","0.002","13.531","0.002","90","","100.77","0.02","90","","1262.7","0.5","293.1","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C26 H30 Cl F3 N2 O4 -","- C26 H30 Cl F3 N2 O4 -","- C52 H60 Cl2 F6 N4 O8 -","2","1","","Denise Andersen; Thomas Storz; Pingli Liu; Xin Wang; Leping Li; Pingchen Fan; Xiaoqi Chen; Alan Allgeier; Alain Burgos; Jason Tedrow; Jean Baum; Ying Chen; Rich Crockett; Liang Huang; Rashid Syed; Robert D. Larsen; Mike Martinelli","Stereoselective Synthesis of a MCHr1 Antagonist","Journal of Organic Chemistry","2007","72","","9648","9655","10.1021/jo701894v","","","1.5418","CuKα","","","0.085","","","","0.257","","","","","","1.106","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023113","9.0909","0.0003","10.0236","0.0004","19.1774","0.0008","90","","95.1256","0.0007","90","","1740.5","0.1","273.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H24 O2 -","- C21 H24 O2 -","- C84 H96 O8 -","4","1","","Srinivasarao Arulananda Babu; Makoto Yasuda; Akio Baba","Diastereoselective Production of Homoallylic Alcohols Bearing Quaternary Centers from γ-Substituted Allylic Indiums and Ketones","Journal of Organic Chemistry","2007","72","","10264","10267","10.1021/jo701899j","","","0.7107","MoKα","","","0.125","","","","0.2265","","","","","","1.791","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4023114","10.967","0.002","14.081","0.003","10.481","0.003","90.3","0.02","102.78","0.02","71.53","0.02","1493.6","0.7","296.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C15 H20 O4 -","- C15 H20 O4 -","- C60 H80 O16 -","4","2","","Srinivasarao Arulananda Babu; Makoto Yasuda; Akio Baba","Diastereoselective Production of Homoallylic Alcohols Bearing Quaternary Centers from γ-Substituted Allylic Indiums and Ketones","Journal of Organic Chemistry","2007","72","","10264","10267","10.1021/jo701899j","","","0.7107","MoKα","","","0.0559","","","","0.1692","","","","","","1.246","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4023115","11.6","0.03","5.75","0.02","28.99","0.03","90","","100.8","0.2","90","","1900","8","296.2","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H24 O4 -","- C21 H24 O4 -","- C84 H96 O16 -","4","1","","Srinivasarao Arulananda Babu; Makoto Yasuda; Akio Baba","Diastereoselective Production of Homoallylic Alcohols Bearing Quaternary Centers from γ-Substituted Allylic Indiums and Ketones","Journal of Organic Chemistry","2007","72","","10264","10267","10.1021/jo701899j","","","0.7107","MoKα","","","0.1446","","","","0.2888","","","","","","3.776","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4023116","7.2837","0.0002","9.1986","0.0004","29.44","0.001","90","","91.581","0.002","90","","1971.7","0.1","273.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H24 O4 -","- C21 H24 O4 -","- C84 H96 O16 -","4","1","","Srinivasarao Arulananda Babu; Makoto Yasuda; Akio Baba","Diastereoselective Production of Homoallylic Alcohols Bearing Quaternary Centers from γ-Substituted Allylic Indiums and Ketones","Journal of Organic Chemistry","2007","72","","10264","10267","10.1021/jo701899j","","","0.7107","MoKα","","","0.1513","","","","0.2826","","","","","","2.771","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4023117","11.248","0.007","11.808","0.007","14.733","0.009","76.391","0.011","83.722","0.01","71.785","0.01","1805","2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C50 H35 F -","- C50 H35 F -","- C100 H70 F2 -","2","1","","Angshuman R. Choudhury; Deepak Chopra; Tayur N. Guru Row; Kuppuswamy Nagarajan; John D. Roberts","Chemistry of 1-Fluoro-2,3,4-triphenylcyclobutadiene Dimers","Journal of Organic Chemistry","2007","72","","9732","9735","10.1021/jo701900k","","","0.71073","MoKα","","0.1316","0.0608","","","0.1085","0.1313","","","","","","0.994","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023118","11.1899","0.0016","11.7329","0.0017","13.374","0.002","70.931","0.003","82.481","0.003","70.186","0.002","1560.9","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C44 H30 O -","- C44 H30 O -","- C88 H60 O2 -","2","1","","Angshuman R. Choudhury; Deepak Chopra; Tayur N. Guru Row; Kuppuswamy Nagarajan; John D. Roberts","Chemistry of 1-Fluoro-2,3,4-triphenylcyclobutadiene Dimers","Journal of Organic Chemistry","2007","72","","9732","9735","10.1021/jo701900k","","","0.71073","MoKα","","0.1162","0.0617","","","0.1299","0.1528","","","","","","1.025","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023119","9.295","0.004","13.104","0.005","13.543","0.006","95.98","0.007","104.223","0.006","91.859","0.007","1587.4","1.1","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C44 H30 F2 -","- C44 H30 F2 -","- C88 H60 F4 -","2","1","","Angshuman R. Choudhury; Deepak Chopra; Tayur N. Guru Row; Kuppuswamy Nagarajan; John D. Roberts","Chemistry of 1-Fluoro-2,3,4-triphenylcyclobutadiene Dimers","Journal of Organic Chemistry","2007","72","","9732","9735","10.1021/jo701900k","","","0.71073","MoKα","","0.0804","0.064","","","0.2348","0.245","","","","","","1.123","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023120","11.297","0.002","11.788","0.002","13.35","0.003","71.565","0.003","85.639","0.004","69.7","0.003","1580.8","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C44 H30 F2 -","- C44 H30 F2 -","- C88 H60 F4 -","2","1","","Angshuman R. Choudhury; Deepak Chopra; Tayur N. Guru Row; Kuppuswamy Nagarajan; John D. Roberts","Chemistry of 1-Fluoro-2,3,4-triphenylcyclobutadiene Dimers","Journal of Organic Chemistry","2007","72","","9732","9735","10.1021/jo701900k","","","0.71073","MoKα","","0.0999","0.068","","","0.1323","0.1445","","","","","","1.163","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023121","11.3057","0.0017","12.2798","0.0018","13.153","0.002","100.175","0.002","111.872","0.003","103.078","0.002","1580.4","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C44 H30 O -","- C44 H30 O -","- C88 H60 O2 -","2","1","","Angshuman R. Choudhury; Deepak Chopra; Tayur N. Guru Row; Kuppuswamy Nagarajan; John D. Roberts","Chemistry of 1-Fluoro-2,3,4-triphenylcyclobutadiene Dimers","Journal of Organic Chemistry","2007","72","","9732","9735","10.1021/jo701900k","","","0.71073","MoKα","","0.1238","0.0795","","","0.1411","0.1572","","","","","","1.164","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023122","10.021","0.01","5.522","0.003","26.62","0.03","90","","101.39","0.06","90","","1444","2","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,1-Dimethylethyl rel-(2S,3R)-3-(2-phenylethyl)-2-aziridinecarboxylate","","- C15 H21 N O2 -","- C15 H21 N O2 -","- C60 H84 N4 O8 -","4","1","","David M. Hodgson; Philip G. Humphreys; Steven M. Miles; Christopher A. J. Brierley; John G. Ward","Dimerization and Isomerization Reactions of α-Lithiated Terminal Aziridines","Journal of Organic Chemistry","2007","72","","10009","10021","10.1021/jo701901t","","","0.71073","MoKα","","0.0615","0.0524","","","0.138","0.1444","","","","","","1.096","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023123","6.2355","0.0002","12.8291","0.0006","10.4457","0.0004","90","","95.364","0.003","90","","831.95","0.06","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H13 N O2 S -","- C6 H13 N O2 S -","- C24 H52 N4 O8 S4 -","4","1","","David M. Hodgson; Philip G. Humphreys; Steven M. Miles; Christopher A. J. Brierley; John G. Ward","Dimerization and Isomerization Reactions of α-Lithiated Terminal Aziridines","Journal of Organic Chemistry","2007","72","","10009","10021","10.1021/jo701901t","","","0.71073","MoKα","","0.0574","0.0338","","0.054","0.0421","0.0421","","","","","","1.0756","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023124","12.0205","0.0002","9.4","0.0002","12.7518","0.0003","90","","112.657","0.001","90","","1329.67","0.05","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","5","P 1 21 1","P 2yb","4","","(2E,1S,4S)-N,N'-bis-(tert-butylsulfonyl)-1,4-dicyclohexyl-but-2-ene-1,4-diamine","","- C24 H46 N2 O4 S2 -","- C24 H46 N2 O4 S2 -","- C48 H92 N4 O8 S4 -","2","1","","David M. Hodgson; Philip G. Humphreys; Steven M. Miles; Christopher A. J. Brierley; John G. Ward","Dimerization and Isomerization Reactions of α-Lithiated Terminal Aziridines","Journal of Organic Chemistry","2007","72","","10009","10021","10.1021/jo701901t","","","0.71073","MoKα","","0.0479","0.0347","","0.0475","0.0344","0.0344","","","","","","1.1186","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023125","10.2056","0.0002","10.8445","0.0002","27.121","0.0004","90","","90","","90","","3001.61","0.09","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H44 N2 O7 S2 -","- C27 H44 N2 O7 S2 -","- C108 H176 N8 O28 S8 -","4","1","","David M. Hodgson; Philip G. Humphreys; Steven M. Miles; Christopher A. J. Brierley; John G. Ward","Dimerization and Isomerization Reactions of α-Lithiated Terminal Aziridines","Journal of Organic Chemistry","2007","72","","10009","10021","10.1021/jo701901t","","","0.71073","MoKα","","0.0794","0.0386","","0.0813","0.0416","0.0416","","","","","","1.0555","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023126","11.7827","0.0005","6.0089","0.0002","16.0233","0.0007","90","","91.4596","0.0014","90","","1134.1","0.08","150","","150","","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","N-((1RS,2RS,5SR)-bicyclo[3.1.0]hexan-2-yl)-2-methylpropane-2-sulfonamide","","- C10 H19 N O2 S -","- C10 H19 N O2 S -","- C40 H76 N4 O8 S4 -","4","1","","David M. Hodgson; Philip G. Humphreys; Steven M. Miles; Christopher A. J. Brierley; John G. Ward","Dimerization and Isomerization Reactions of α-Lithiated Terminal Aziridines","Journal of Organic Chemistry","2007","72","","10009","10021","10.1021/jo701901t","","","0.71073","MoKα","","0.0596","0.0575","","0.1666","0.1636","0.1666","","","","","","1.0606","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4023127","22.0101","0.0006","6.2216","0.0002","9.5931","0.0003","90","","90","","90","","1313.66","0.07","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","5","P n a 21","P 2c -2n","33","","","","- C12 H23 N O2 S -","- C12 H23 N O2 S -","- C48 H92 N4 O8 S4 -","4","1","","David M. Hodgson; Philip G. Humphreys; Steven M. Miles; Christopher A. J. Brierley; John G. Ward","Dimerization and Isomerization Reactions of α-Lithiated Terminal Aziridines","Journal of Organic Chemistry","2007","72","","10009","10021","10.1021/jo701901t","","","0.71073","MoKα","","0.0425","0.03","","0.0458","0.0309","0.0309","","","","","","1.1147","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023128","9.3233","0.0001","12.3917","0.0001","13.5635","0.0001","71.724","0.001","88.535","0.001","85.606","0.001","1483.59","0.02","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H15 N7 -","- C16 H15 N7 -","- C64 H60 N28 -","4","2","","Brendan J. Liddle; James R. Gardinier","A Practical Synthesis of Tris(pyrazolyl)methylaryls","Journal of Organic Chemistry","2007","72","","9794","9797","10.1021/jo701924w","","","1.54178","CuKα","","0.0321","0.0302","","","0.0751","0.0765","","","","","","1.031","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023129","8.4381","0.0001","11.6736","0.0001","15.5291","0.0002","90","","102.655","0.001","90","","1492.5","0.03","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H15 N7 -","- C16 H15 N7 -","- C64 H60 N28 -","4","1","","Brendan J. Liddle; James R. Gardinier","A Practical Synthesis of Tris(pyrazolyl)methylaryls","Journal of Organic Chemistry","2007","72","","9794","9797","10.1021/jo701924w","","","1.54178","CuKα","","0.0301","0.0299","","","0.0764","0.0766","","","","","","1.018","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023130","7.2161","0.0012","8.5279","0.0013","12.8078","0.0019","76.386","0.007","87.519","0.007","81.803","0.007","758.2","0.2","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","","","- C19 H16 O3 -","- C19 H16 O3 -","- C38 H32 O6 -","2","1","","Lian-Biao Zhao; Zheng-Hui Guan; Yao Han; Yong-Xin Xie; Sheng He; Yong-Min Liang","Copper-Catalyzed [4 + 1] Cycloadditions of α,β-Acetylenic Ketones with Diazoacetates to Form Trisubstituted Furans","Journal of Organic Chemistry","2007","72","","10276","10278","10.1021/jo7019465","","","0.71073","MoKα","","0.0577","0.0408","","","0.101","0.1128","","","","","","1.061","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023131","14.559","0.003","8.4147","0.0015","15.738","0.003","90","","107.481","0.003","90","","1839","0.6","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H13 N3 S3 -","- C21 H13 N3 S3 -","- C84 H52 N12 S12 -","4","2","","Birdella D. Kenney; Michael Breslav; Rosie Chang; Roland Glaser; Bruce D. Harris; Cynthia A. Maryanoff; John Mills; Armin Roessler; Brigitte Segmuller; Frank J. Villani, Jr.","Methodology for the Preparation of 2-Argininylbenzothiazole","Journal of Organic Chemistry","2007","72","","9798","9801","10.1021/jo7019543","","","0.71073","MoKα","","0.0621","0.0519","","","0.1219","0.1268","","","","","","1.045","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023132","13.194","0.007","7.575","0.003","9.979","0.002","90","","100.2","0.02","90","","981.6","0.7","298","2","298","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C7 H10 O4 S2 -","- C7 H10 O4 S2 -","- C28 H40 O16 S8 -","4","1","","Flavio Cermola; Annalisa Guaragna; Maria Rosaria Iesce; Giovanni Palumbo; Raffaella Purcaro; Maria Rubino; Angela Tuzi","New Insight into the Reaction of Singlet Oxygen with Sulfur-Containing Cyclic Alkenes: Dye-Sensitized Photooxygenation of 5,6-Dihydro-1,4-dithiins","Journal of Organic Chemistry","2007","72","","10075","10080","10.1021/jo701983v","","x-ray","0.71069","MoKα","","0.0689","0.0397","","","0.0908","0.0996","","","","","","1.045","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023133","16.004","0.007","16.004","0.007","7.492","0.002","90","","90","","90","","1918.9","1.3","296","2","296","2","","","","","","","","4","P -4 21 c","P -4 2n","114","","","","- C7 H10 O4 S2 -","- C7 H10 O4 S2 -","- C56 H80 O32 S16 -","8","1","","Flavio Cermola; Annalisa Guaragna; Maria Rosaria Iesce; Giovanni Palumbo; Raffaella Purcaro; Maria Rubino; Angela Tuzi","New Insight into the Reaction of Singlet Oxygen with Sulfur-Containing Cyclic Alkenes: Dye-Sensitized Photooxygenation of 5,6-Dihydro-1,4-dithiins","Journal of Organic Chemistry","2007","72","","10075","10080","10.1021/jo701983v","","","0.71069","MoKα","","0.0615","0.0356","","","0.0775","0.0852","","","","","","1.003","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023134","6.051","0.006","23.735","0.002","10.436","0.003","90","","119.725","0.008","90","","1301.6","1.3","566","2","25","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H13 N O3 S2 -","- C12 H13 N O3 S2 -","- C48 H52 N4 O12 S8 -","4","1","","Flavio Cermola; Annalisa Guaragna; Maria Rosaria Iesce; Giovanni Palumbo; Raffaella Purcaro; Maria Rubino; Angela Tuzi","New Insight into the Reaction of Singlet Oxygen with Sulfur-Containing Cyclic Alkenes: Dye-Sensitized Photooxygenation of 5,6-Dihydro-1,4-dithiins","Journal of Organic Chemistry","2007","72","","10075","10080","10.1021/jo701983v","","x-ray","0.71073","MoKα","","0.0838","0.0445","","","0.0888","0.0998","","","","","","1.017","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023135","7.6835","0.0006","14.492","0.002","12.632","0.003","90","","105.505","0.008","90","","1355.4","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 N O3 S2 -","- C13 H15 N O3 S2 -","- C52 H60 N4 O12 S8 -","4","1","","Flavio Cermola; Annalisa Guaragna; Maria Rosaria Iesce; Giovanni Palumbo; Raffaella Purcaro; Maria Rubino; Angela Tuzi","New Insight into the Reaction of Singlet Oxygen with Sulfur-Containing Cyclic Alkenes: Dye-Sensitized Photooxygenation of 5,6-Dihydro-1,4-dithiins","Journal of Organic Chemistry","2007","72","","10075","10080","10.1021/jo701983v","","x-ray","0.71073","MoKα","","0.0468","0.031","","","0.0795","0.0847","","","","","","1.057","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023136","9.253","0.002","11.5508","0.0008","12.831","0.003","90","","90","","90","","1371.4","0.4","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H15 N O3 S2 -","- C13 H15 N O3 S2 -","- C52 H60 N4 O12 S8 -","4","1","","Flavio Cermola; Annalisa Guaragna; Maria Rosaria Iesce; Giovanni Palumbo; Raffaella Purcaro; Maria Rubino; Angela Tuzi","New Insight into the Reaction of Singlet Oxygen with Sulfur-Containing Cyclic Alkenes: Dye-Sensitized Photooxygenation of 5,6-Dihydro-1,4-dithiins","Journal of Organic Chemistry","2007","72","","10075","10080","10.1021/jo701983v","","x-ray","0.71073","MoKα","","0.1106","0.0552","","","0.1006","0.1163","","","","","","0.97","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023137","9.704","0.005","10.628","0.005","18.515","0.005","104.398","0.005","99.597","0.005","101.921","0.005","1761.1","1.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C23 H18 N2 -","- C23 H18 N2 -","- C92 H72 N8 -","4","2","","Stéphane Diring; Pascal Retailleau; Raymond Ziessel","A Rational Protocol for the Synthesis of Arylated Bipyridine Ligands via a Cycloaddition Pathway","Journal of Organic Chemistry","2007","72","","10181","10193","10.1021/jo7019866","","","0.71069","MoKα","","0.0788","0.0484","","","0.1242","0.1433","","","","","","1.025","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023138","11.306","0.001","7.374","0.001","41.368","0.005","90","","92.87","0.002","90","","3444.5","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C23 H18 N2 -","- C23 H18 N2 -","- C184 H144 N16 -","8","2","","Stéphane Diring; Pascal Retailleau; Raymond Ziessel","A Rational Protocol for the Synthesis of Arylated Bipyridine Ligands via a Cycloaddition Pathway","Journal of Organic Chemistry","2007","72","","10181","10193","10.1021/jo7019866","","","0.7107","MoKα","","0.0813","0.0459","","","0.1068","0.133","","","","","","1.038","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023139","15.161","0.005","25.72","0.005","10.503","0.005","90","0.005","107.245","0.005","90","0.005","3911","2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C44 H54 N4 -","- C44 H54 N4 -","- C176 H216 N16 -","4","1","","Stéphane Diring; Pascal Retailleau; Raymond Ziessel","A Rational Protocol for the Synthesis of Arylated Bipyridine Ligands via a Cycloaddition Pathway","Journal of Organic Chemistry","2007","72","","10181","10193","10.1021/jo7019866","","","0.71069","MoKα","","0.1214","0.083","","","0.2397","0.2815","","","","","","1.04","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023140","8.169","0.001","12.543","0.002","14.364","0.002","90","","90","","90","","1471.9","0.4","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C16 H10 Cl I N2 Pt -","- C16 H10 Cl I N2 Pt -","- C64 H40 Cl4 I4 N8 Pt4 -","4","1","","Stéphane Diring; Pascal Retailleau; Raymond Ziessel","A Rational Protocol for the Synthesis of Arylated Bipyridine Ligands via a Cycloaddition Pathway","Journal of Organic Chemistry","2007","72","","10181","10193","10.1021/jo7019866","","","0.7107","MoKα","","0.0513","0.0302","","","0.0725","0.0842","","","","","","1.091","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023141","22.19","0.002","16.363","0.001","13.666","0.001","90","","122.334","0.002","90","","4192.6","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H17 I N2 Pt -","- C25 H17 I N2 Pt -","- C200 H136 I8 N16 Pt8 -","8","1","","Stéphane Diring; Pascal Retailleau; Raymond Ziessel","A Rational Protocol for the Synthesis of Arylated Bipyridine Ligands via a Cycloaddition Pathway","Journal of Organic Chemistry","2007","72","","10181","10193","10.1021/jo7019866","","","0.7107","MoKα","","0.049","0.0323","","","0.0832","0.0887","","","","","","1.305","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023142","9.9888","0.0004","15.1872","0.0006","27.0849","0.0012","90","","100.294","0.001","90","","4042.7","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H16 N2 S2 -","- C26 H16 N2 S2 -","- C208 H128 N16 S16 -","8","2","","Jean Bouffard; Robert F. Eaton; Peter Müller; Timothy M. Swager","Iptycene-Derived Pyridazines and Phthalazines","Journal of Organic Chemistry","2007","72","","10166","10180","10.1021/jo702000d","","","0.71073","MoKα","","0.0547","0.0446","","","0.1116","0.1194","","","","","","1.03","","","","has coordinates,has disorder","178410","2020-10-21","18:00:00",""
"4023143","21.0801","0.0008","13.9059","0.0006","16.299","0.0006","90","","90","","90","","4777.9","0.3","100","2","100","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C30 H20 N2 O4 S2 -","- C30 H20 N2 O4 S2 -","- C240 H160 N16 O32 S16 -","8","1","","Jean Bouffard; Robert F. Eaton; Peter Müller; Timothy M. Swager","Iptycene-Derived Pyridazines and Phthalazines","Journal of Organic Chemistry","2007","72","","10166","10180","10.1021/jo702000d","","","0.71073","MoKα","","0.0442","0.0382","","","0.0998","0.1051","","","","","","1.037","","","","has coordinates,has disorder","178410","2020-10-21","18:00:00",""
"4023144","14.5625","0.0007","10.0487","0.0005","14.4914","0.0007","90","","114.652","0.001","90","","1927.31","0.16","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H16 F2 N2 O -","- C25 H16 F2 N2 O -","- C100 H64 F8 N8 O4 -","4","1","","Jean Bouffard; Robert F. Eaton; Peter Müller; Timothy M. Swager","Iptycene-Derived Pyridazines and Phthalazines","Journal of Organic Chemistry","2007","72","","10166","10180","10.1021/jo702000d","","","0.71073","MoKα","","0.0464","0.0421","","","0.1155","0.1207","","","","","","1.028","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023145","26.0086","0.0009","8.1958","0.0003","19.5052","0.0007","90","","119.245","0.001","90","","3627.8","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C46 H42 N4 O4 -","- C46 H42 N4 O4 -","- C184 H168 N16 O16 -","4","0.5","","Jean Bouffard; Robert F. Eaton; Peter Müller; Timothy M. Swager","Iptycene-Derived Pyridazines and Phthalazines","Journal of Organic Chemistry","2007","72","","10166","10180","10.1021/jo702000d","","","0.71073","MoKα","","0.0489","0.045","","","0.1239","0.1286","","","","","","1.039","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023146","11.7138","0.0018","15.935","0.002","21.192","0.003","90","","101.38","0.003","90","","3877.9","0.9","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C48 H30 Cl4 N4 -","- C48 H30 Cl4 N4 -","- C192 H120 Cl16 N16 -","4","0.5","","Jean Bouffard; Robert F. Eaton; Peter Müller; Timothy M. Swager","Iptycene-Derived Pyridazines and Phthalazines","Journal of Organic Chemistry","2007","72","","10166","10180","10.1021/jo702000d","","","0.71073","MoKα","","0.0414","0.0372","","","0.0974","0.1008","","","","","","1.047","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023147","19.1978","0.0005","19.1978","0.0005","22.0008","0.0012","90","","90","","90","","8108.5","0.5","100","2","100","2","","","","","","","","4","I -4","I -4","82","","","","- C51.41 H41.17 N4 O2 -","- C51.419 H41.181 N4 O2 -","- C411.352 H329.448 N32 O16 -","8","1","","Jean Bouffard; Robert F. Eaton; Peter Müller; Timothy M. Swager","Iptycene-Derived Pyridazines and Phthalazines","Journal of Organic Chemistry","2007","72","","10166","10180","10.1021/jo702000d","","","0.71073","MoKα","","0.0564","0.0467","","","0.1178","0.1251","","","","","","1.023","","","","has coordinates,has disorder","178410","2020-10-21","18:00:00",""
"4023148","17.25","0.002","17.25","0.002","9.5313","0.0019","90","","90","","120","","2456.3","0.7","293","2","293","2","","","","","","","","5","P 65","P 65","170","","","","- C15 H18 Cl N O4 -","- C15 H18 Cl N O4 -","- C90 H108 Cl6 N6 O24 -","6","1","","Sanzhong Luo; Long Zhang; Xueling Mi; Yupu Qiao; Jin-Pei Cheng","Functionalized Chiral Ionic Liquid Catalyzed Enantioselective Desymmetrizations of Prochiral Ketones via Asymmetric Michael Addition Reaction","Journal of Organic Chemistry","2007","72","","9350","9352","10.1021/jo7020357","","","0.71073","MoKα","","0.14","0.0349","","","0.0569","0.0719","","","","","","0.549","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023149","10.5802","0.0003","32.2764","0.0008","7.6175","0.0002","90","","103.974","0.001","90","","2524.32","0.12","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 Fe N O6 P -","- C28 H26 Fe N O6 P -","- C112 H104 Fe4 N4 O24 P4 -","4","1","","Tasneem A. Siddiquee; Julie M. Lukesh; Sergey Lindeman; William A. Donaldson","Synthesis of Cyclopropanes via Organoiron Methodology: Preparation of rac-Dysibetaine CPa","Journal of Organic Chemistry","2007","72","","9802","9803","10.1021/jo7020604","","","1.54178","CuKα","","0.0313","0.0304","","","0.0796","0.0802","","","","","","1.048","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023150","9.3258","0.0004","16.764","0.0011","15.4111","0.0008","90","","93.006","0.003","90","","2406","0.2","300","2","300","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H27 N O5 -","- C27 H27 N O5 -","- C108 H108 N4 O20 -","4","1","","Avedis Karadeolian; Michael A. Kerr","Examination of Homo-[3 + 2]-Dipolar Cycloaddition: Mechanistic Insight into Regio- and Diastereoselectivity","Journal of Organic Chemistry","2007","72","","10251","10253","10.1021/jo702073w","","","0.71073","MoKα","","0.1757","0.0643","","","0.1763","0.2218","","","","","","0.943","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023151","15.482","0.0004","9.2541","0.0003","17.6066","0.0007","90","","96.144","0.002","90","","2508.04","0.14","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H29 N O5 -","- C28 H29 N O5 -","- C112 H116 N4 O20 -","4","1","","Avedis Karadeolian; Michael A. Kerr","Examination of Homo-[3 + 2]-Dipolar Cycloaddition: Mechanistic Insight into Regio- and Diastereoselectivity","Journal of Organic Chemistry","2007","72","","10251","10253","10.1021/jo702073w","","","0.71073","MoKα","","0.098","0.0616","","","0.1508","0.17","","","","","","1.033","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023152","20.505","0.0008","12.7125","0.0004","19.7289","0.0006","90","","115.362","0.002","90","","4647.1","0.3","301","2","301","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H27 N O5 -","- C27 H27 N O5 -","- C216 H216 N8 O40 -","8","2","","Avedis Karadeolian; Michael A. Kerr","Examination of Homo-[3 + 2]-Dipolar Cycloaddition: Mechanistic Insight into Regio- and Diastereoselectivity","Journal of Organic Chemistry","2007","72","","10251","10253","10.1021/jo702073w","","","0.71073","MoKα","","0.125","0.0562","","","0.1545","0.1826","","","","","","1.052","","","","has coordinates,has disorder","178410","2020-10-21","18:00:00",""
"4023153","10.5658","0.0007","11.1733","0.0004","11.7745","0.0006","69.202","0.003","75.052","0.002","74.595","0.003","1231.95","0.11","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H29 N O5 -","- C28 H29 N O5 -","- C56 H58 N2 O10 -","2","1","","Avedis Karadeolian; Michael A. Kerr","Examination of Homo-[3 + 2]-Dipolar Cycloaddition: Mechanistic Insight into Regio- and Diastereoselectivity","Journal of Organic Chemistry","2007","72","","10251","10253","10.1021/jo702073w","","","0.71073","MoKα","","0.0979","0.0552","","","0.1392","0.1599","","","","","","1.062","","","","has coordinates","178410","2020-10-21","18:00:00",""
"4023938","17.006","0.003","9.2753","0.0016","17.1","0.004","90","","105.239","0.005","90","","2602.4","0.9","143","1","143","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H17 N O -","- C17 H17 N O -","- C136 H136 N8 O8 -","8","2","","Amos B. Smith, III; László Kürti; Akin H. Davulcu; Young Shin Cho; Kazuyuki Ohmoto","Indole Diterpene Synthetic Studies: Development of a Second-Generation Synthetic Strategy for (+)-Nodulisporic Acids A and B","Journal of Organic Chemistry","2007","72","","4611","4620","10.1021/jo062423a","","","0.71069","MoKα","","0.1253","0.1162","","","0.3065","0.324","","","","","","1.348","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023939","6.9258","0.0008","8.8531","0.0011","17.129","0.002","90","","90","","90","","1050.3","0.2","143","1","143","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C14 H15 N -","- C14 H15 N -","- C56 H60 N4 -","4","1","","Amos B. Smith, III; László Kürti; Akin H. Davulcu; Young Shin Cho; Kazuyuki Ohmoto","Indole Diterpene Synthetic Studies: Development of a Second-Generation Synthetic Strategy for (+)-Nodulisporic Acids A and B","Journal of Organic Chemistry","2007","72","","4611","4620","10.1021/jo062423a","","","0.71069","MoKα","","0.0771","0.0593","","","0.1492","0.1699","","","","","","1.062","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023940","9.0004","0.0008","6.8284","0.0006","15.7613","0.0014","90","","90","","90","","968.66","0.15","143","1","143","1","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C13 H13 N -","- C13 H13 N -","- C52 H52 N4 -","4","0.5","","Amos B. Smith, III; László Kürti; Akin H. Davulcu; Young Shin Cho; Kazuyuki Ohmoto","Indole Diterpene Synthetic Studies: Development of a Second-Generation Synthetic Strategy for (+)-Nodulisporic Acids A and B","Journal of Organic Chemistry","2007","72","","4611","4620","10.1021/jo062423a","","","0.71069","MoKα","","0.0514","0.0371","","","0.0911","0.1013","","","","","","0.962","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023941","18.451","0.003","8.185","0.001","13.7757","0.0017","90","","101.249","0.004","90","","2040.4","0.4","143","1","143","1","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C27 H29 N O -","- C27 H29 N O -","- C108 H116 N4 O4 -","4","1","","Amos B. Smith, III; László Kürti; Akin H. Davulcu; Young Shin Cho; Kazuyuki Ohmoto","Indole Diterpene Synthetic Studies: Development of a Second-Generation Synthetic Strategy for (+)-Nodulisporic Acids A and B","Journal of Organic Chemistry","2007","72","","4611","4620","10.1021/jo062423a","","","0.71069","MoKα","","0.0346","0.0313","","","0.0708","0.0724","","","","","","0.993","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023942","9.616","0.004","11.27","0.005","11.587","0.005","69.052","0.007","83.86","0.007","73.52","0.007","1124.5","0.9","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 N2 O4 S2 -","- C24 H22 N2 O4 S2 -","- C48 H44 N4 O8 S4 -","2","1","","Yu-Long Zhao; Wei Zhang; Shuang Wang; Qun Liu","Ethynyl Ketene-S,S-acetals: The Highly Reactive Electron-Rich Dienophiles and Applications in the Synthesis of 4-Functionalized Quinolines via a One-Pot Three-Component Reaction","Journal of Organic Chemistry","2007","72","","4985","4988","10.1021/jo070069q","","","0.71073","MoKα","","0.1071","0.0623","","","0.139","0.1649","","","","","","1.014","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023943","13.0227","0.0008","9.1344","0.0006","14.7121","0.0009","90","","94.405","0.002","90","","1744.9","0.19","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C34 H56 O7 Si -","- C34 H56 O7 Si -","- C68 H112 O14 Si2 -","2","1","","Martin Juhl; Rune Monrad; Inger Søtofte; David Tanner","Toward the Synthesis of Norzoanthamine: Complete Fragment Assembly","Journal of Organic Chemistry","2007","72","","4644","4654","10.1021/jo070165r","","","0.71073","MoKα","","0.0996","0.0826","","","0.204","0.217","","","","","","1.06","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023944","6.8902","0.0005","15.6556","0.0012","40.494","0.003","90","","90","","90","","4368.2","0.6","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C47 H54 N2 O13 -","- C47 H54 N2 O13 -","- C188 H216 N8 O52 -","4","1","","Martin Juhl; Rune Monrad; Inger Søtofte; David Tanner","Toward the Synthesis of Norzoanthamine: Complete Fragment Assembly","Journal of Organic Chemistry","2007","72","","4644","4654","10.1021/jo070165r","","","1.54178","CuKα","","0.104","0.0758","","","0.18","0.2139","","","","","","1.203","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023945","8.7254","0.0004","8.8412","0.0004","14.6943","0.0007","90","","90","","90","","1133.56","0.09","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H20 O2 -","- C12 H20 O2 -","- C48 H80 O8 -","4","1","","Martin Juhl; Rune Monrad; Inger Søtofte; David Tanner","Toward the Synthesis of Norzoanthamine: Complete Fragment Assembly","Journal of Organic Chemistry","2007","72","","4644","4654","10.1021/jo070165r","","","0.71073","MoKα","","0.0471","0.0455","","","0.1238","0.1256","","","","","","1.168","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023946","19.788","0.0009","9.6912","0.0005","21.0268","0.0012","90","","115.297","0.002","90","","3645.6","0.3","293","","293","","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H19 N O4 -","- C21 H19 N O4 -","- C168 H152 N8 O32 -","8","2","","Hidenori Murata; Paul M. Lahti","Synthesis and Oxidation of Triarylamine Derivatives Bearing Hydrogen-Bonding Groups","Journal of Organic Chemistry","2007","72","","4974","4977","10.1021/jo070318a","","x-ray","0.71073","MoKα","","0.1139","0.069","","","0.183","0.2243","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4023947","9.6333","0.0002","10.7971","0.0002","12.4742","0.0003","91.891","0.001","108.254","0.001","93.919","0.001","1227.26","0.05","293","","293","","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C22 H19 N O6 -","- C26 H19 N O7 -","- C52 H38 N2 O14 -","2","1","","Hidenori Murata; Paul M. Lahti","Synthesis and Oxidation of Triarylamine Derivatives Bearing Hydrogen-Bonding Groups","Journal of Organic Chemistry","2007","72","","4974","4977","10.1021/jo070318a","","x-ray","0.71073","MoKα","","0.1332","0.0688","","","0.2076","0.2456","","","","","","1.042","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4023948","6.74","0.0005","8.9687","0.0007","16.8973","0.0011","90.839","0.004","82.749","0.004","86.109","0.004","1010.7","1","293","","293","","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C22 H19 N O6 -","- C22 H19 N O6 -","- C44 H38 N2 O12 -","2","1","","Hidenori Murata; Paul M. Lahti","Synthesis and Oxidation of Triarylamine Derivatives Bearing Hydrogen-Bonding Groups","Journal of Organic Chemistry","2007","72","","4974","4977","10.1021/jo070318a","","x-ray","0.71069","MoKα","","0.1109","0.0674","","","0.1851","0.2226","","","","","","1.042","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023949","8.5226","0.0009","9.5572","0.001","13.0166","0.0014","79.425","0.002","84.405","0.002","72.404","0.002","992.5","0.3","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H32 O3 -","- C22 H32 O3 -","- C44 H64 O6 -","2","1","","Nadia M. Ahmad; Vincent Rodeschini; Nigel S. Simpkins; Simon E. Ward; Alexander J. Blake","Synthesis of Polyprenylated Acylphloroglucinols Using Bridgehead Lithiation: The Total Synthesis of Racemic Clusianone and a Formal Synthesis of Racemic Garsubellin A","Journal of Organic Chemistry","2007","72","","4803","4815","10.1021/jo070388h","","","0.71073","MoKα","","0.0636","0.0522","","","0.1484","0.1569","","","","","","1.064","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023950","7.786","0.002","8.516","0.002","14.74","0.003","77.603","0.004","81.969","0.004","85.596","0.004","944","0.6","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H28 O3 -","- C20 H28 O3 -","- C40 H56 O6 -","2","1","","Nadia M. Ahmad; Vincent Rodeschini; Nigel S. Simpkins; Simon E. Ward; Alexander J. Blake","Synthesis of Polyprenylated Acylphloroglucinols Using Bridgehead Lithiation: The Total Synthesis of Racemic Clusianone and a Formal Synthesis of Racemic Garsubellin A","Journal of Organic Chemistry","2007","72","","4803","4815","10.1021/jo070388h","","","0.71073","MoKα","","0.0656","0.0393","","","0.0966","0.107","","","","","","0.97","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023951","11.975","0.003","20.307","0.004","23.856","0.005","90","","90","","90","","5801","2","98","2","98","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C65 H76 N4 O8 -","- C65 H76 N4 O8 -","- C260 H304 N16 O32 -","4","0.5","","Zi-Bo Li; Jing Lin; Michal Sabat; Marilise Hyacinth; Lin Pu","Enantioselective Fluorescent Recognition of Chiral Acids by Cyclohexane-1,2-diamine-Based Bisbinaphthyl Molecules","Journal of Organic Chemistry","2007","72","","4905","4916","10.1021/jo0704715","","","0.71073","MoKα","","0.0762","0.0522","","","0.0991","0.1069","","","","","","0.982","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023952","7.9953","0.0002","11.2264","0.0003","31.0421","0.0011","90","","90","","90","","2786.29","0.14","293","2","293","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","1-Benzoyl-2(S)-phenyl-2,3-dihydro-4(H)-pyrimidin-4-one","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C136 H112 N16 O16 -","8","2","","Blanca R. Díaz-Sánchez; Martín A. Iglesias-Arteaga; Roberto Melgar-Fernández; Eusebio Juaristi","Synthesis of 2-Substituted-5-halo-2,3-dihydro-4(H)-pyrimidin-4-ones and Their Derivatization Utilizing the Sonogashira Coupling Reaction in the Enantioselective Synthesis of α-Substituted β-Amino Acids","Journal of Organic Chemistry","2007","72","","4822","4825","10.1021/jo0705115","","","0.71073","MoKα","","0.1295","0.0444","","","0.0661","0.0847","","","","","","0.983","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023953","14.4454","0.0004","7.211","0.0002","14.2431","0.0005","90","","105.992","0.001","90","","1426.23","0.08","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","1-Benzoyl-2(S)-iso-propyl-5-bromo-2,3-dihydro-4(H)-pyrimidin-4-one","","- C14 H15 Br N2 O2 -","- C14 H15 Br N2 O2 -","- C56 H60 Br4 N8 O8 -","4","1","","Blanca R. Díaz-Sánchez; Martín A. Iglesias-Arteaga; Roberto Melgar-Fernández; Eusebio Juaristi","Synthesis of 2-Substituted-5-halo-2,3-dihydro-4(H)-pyrimidin-4-ones and Their Derivatization Utilizing the Sonogashira Coupling Reaction in the Enantioselective Synthesis of α-Substituted β-Amino Acids","Journal of Organic Chemistry","2007","72","","4822","4825","10.1021/jo0705115","","","0.71073","MoKα","","0.0447","0.0405","","","0.0987","0.1022","","","","","","1.082","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023954","10.13","0.003","26.145","0.007","11.359","0.003","90","","110.101","0.001","90","","2825.2","1.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-Benzoyl-2(S)-iso-propyl-5-phenylethynyl-2,3-dihydro-4(H)-pyrimidin-4-one","","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","- C132 H120 N12 O12 -","6","3","","Blanca R. Díaz-Sánchez; Martín A. Iglesias-Arteaga; Roberto Melgar-Fernández; Eusebio Juaristi","Synthesis of 2-Substituted-5-halo-2,3-dihydro-4(H)-pyrimidin-4-ones and Their Derivatization Utilizing the Sonogashira Coupling Reaction in the Enantioselective Synthesis of α-Substituted β-Amino Acids","Journal of Organic Chemistry","2007","72","","4822","4825","10.1021/jo0705115","","","0.71073","MoKα","","0.1445","0.0474","","","0.0949","0.1321","","","","","","0.858","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023955","11.8446","0.0007","8.893","0.0005","12.8025","0.0008","90","","105.522","0.001","90","","1299.35","0.13","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 Cl2 N4 -","- C14 H10 Cl2 N4 -","- C56 H40 Cl8 N16 -","4","1","","Weibing Lu; Sujata Sengupta; Jeffrey L. Petersen; Novruz G. Akhmedov; Xiaodong Shi","Mitsunobu Coupling of Nucleobases and Alcohols: An Efficient, Practical Synthesis for Novel Nonsugar Carbon Nucleosides","Journal of Organic Chemistry","2007","72","","5012","5015","10.1021/jo070515+","","","0.71073","MoKα","","0.0444","0.0411","","","0.1136","0.1175","","","","","","1.058","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023956","13.9531","0.0011","11.995","0.0009","14.7956","0.0012","90","","90","","90","","2476.3","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H11 Cl N4 -","- C14 H11 Cl N4 -","- C112 H88 Cl8 N32 -","8","1","","Weibing Lu; Sujata Sengupta; Jeffrey L. Petersen; Novruz G. Akhmedov; Xiaodong Shi","Mitsunobu Coupling of Nucleobases and Alcohols: An Efficient, Practical Synthesis for Novel Nonsugar Carbon Nucleosides","Journal of Organic Chemistry","2007","72","","5012","5015","10.1021/jo070515+","","","0.71073","MoKα","","0.0563","0.0405","","","0.1065","0.1191","","","","","","1.03","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023957","8.4703","0.001","17.6304","0.0019","6.9442","0.0007","90","","102.628","0.001","90","","1011.93","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 Cl2 N4 -","- C8 H8 Cl2 N4 -","- C32 H32 Cl8 N16 -","4","1","","Weibing Lu; Sujata Sengupta; Jeffrey L. Petersen; Novruz G. Akhmedov; Xiaodong Shi","Mitsunobu Coupling of Nucleobases and Alcohols: An Efficient, Practical Synthesis for Novel Nonsugar Carbon Nucleosides","Journal of Organic Chemistry","2007","72","","5012","5015","10.1021/jo070515+","","","0.71073","MoKα","","0.0554","0.0486","","","0.1356","0.1416","","","","","","1.107","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023958","17.4807","0.0015","11.8848","0.001","14.4491","0.0012","90","","105.444","0.002","90","","2893.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 Cl2 N4 -","- C15 H12 Cl2 N4 -","- C120 H96 Cl16 N32 -","8","2","","Weibing Lu; Sujata Sengupta; Jeffrey L. Petersen; Novruz G. Akhmedov; Xiaodong Shi","Mitsunobu Coupling of Nucleobases and Alcohols: An Efficient, Practical Synthesis for Novel Nonsugar Carbon Nucleosides","Journal of Organic Chemistry","2007","72","","5012","5015","10.1021/jo070515+","","","0.71073","MoKα","","0.0844","0.0459","","","0.1045","0.1225","","","","","","0.996","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023959","7.5555","0.0012","12.711","0.002","14.92","0.003","98.359","0.003","103.597","0.003","97.752","0.003","1356.5","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H10 Cl2 N4 -","- C14 H10 Cl2 N4 -","- C56 H40 Cl8 N16 -","4","2","","Weibing Lu; Sujata Sengupta; Jeffrey L. Petersen; Novruz G. Akhmedov; Xiaodong Shi","Mitsunobu Coupling of Nucleobases and Alcohols: An Efficient, Practical Synthesis for Novel Nonsugar Carbon Nucleosides","Journal of Organic Chemistry","2007","72","","5012","5015","10.1021/jo070515+","","","0.71073","MoKα","","0.1005","0.0618","","","0.1611","0.1865","","","","","","1.032","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023960","3.9928","0.0003","20.724","0.0014","11.2562","0.0008","90","","98.975","0.001","90","","920.01","0.11","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H4 Cl2 N4 -","- C8 H4 Cl2 N4 -","- C32 H16 Cl8 N16 -","4","1","","Weibing Lu; Sujata Sengupta; Jeffrey L. Petersen; Novruz G. Akhmedov; Xiaodong Shi","Mitsunobu Coupling of Nucleobases and Alcohols: An Efficient, Practical Synthesis for Novel Nonsugar Carbon Nucleosides","Journal of Organic Chemistry","2007","72","","5012","5015","10.1021/jo070515+","","","0.71073","MoKα","","0.0472","0.0438","","","0.1194","0.124","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023961","26.452","0.0018","7.8096","0.0006","15.395","0.0011","90","","125.151","0.001","90","","2600.3","0.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C11 H17 N7 -","- C11 H17 N7 -","- C88 H136 N56 -","8","1","","Weibing Lu; Sujata Sengupta; Jeffrey L. Petersen; Novruz G. Akhmedov; Xiaodong Shi","Mitsunobu Coupling of Nucleobases and Alcohols: An Efficient, Practical Synthesis for Novel Nonsugar Carbon Nucleosides","Journal of Organic Chemistry","2007","72","","5012","5015","10.1021/jo070515+","","","0.71073","MoKα","","0.0594","0.0513","","","0.143","0.1525","","","","","","1.053","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023962","11.0197","0.0004","5.7705","0.0002","16.742","0.0006","90","","105.061","0.002","90","","1028.04","0.06","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H38 O3 -","- C22 H38 O3 -","- C44 H76 O6 -","2","1","","Izabella Jastrzebska; Jamie B. Scaglione; Gregory T. DeKoster; Nigam P. Rath; Douglas F. Covey","Palladium-Catalyzed Potassium Enoxyborate Alkylation of Enantiopure Hajos-Parrish Indenone To Construct Rearranged Steroid Ring Systems","Journal of Organic Chemistry","2007","72","","4837","4843","10.1021/jo070530e","","","0.71073","MoKα","","0.0962","0.0513","","","0.0943","0.1015","","","","","","1.023","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023963","9.699","0.0005","6.4806","0.0003","11.9721","0.0005","90","","100.592","0.003","90","","739.69","0.06","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C18 H26 O2 -","- C18 H26 O2 -","- C36 H52 O4 -","2","1","","Izabella Jastrzebska; Jamie B. Scaglione; Gregory T. DeKoster; Nigam P. Rath; Douglas F. Covey","Palladium-Catalyzed Potassium Enoxyborate Alkylation of Enantiopure Hajos-Parrish Indenone To Construct Rearranged Steroid Ring Systems","Journal of Organic Chemistry","2007","72","","4837","4843","10.1021/jo070530e","","","0.71073","MoKα","","0.0514","0.0392","","","0.0816","0.0869","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023964","11.2709","0.0003","15.7446","0.0005","25.9223","0.0007","90","","90","","90","","4600.1","0.2","160","1","160","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C54 H52 N4 O4 Zn -","- C54 H52 N4 O4 Zn -","- C216 H208 N16 O16 Zn4 -","4","1","","Adeeb Al-Sheikh Ali; Ronald E. Benson; Sascha Blumentritt; T. Stanley Cameron; Anthony Linden; David Wolstenholme; Alison Thompson","Asymmetric Synthesis of Mono- and Dinuclear Bis(dipyrrinato) Complexes","Journal of Organic Chemistry","2007","72","","4947","4952","10.1021/jo070569j","","","0.71073","MoKα","","0.0664","0.046","","","0.0952","0.1036","","","","","","1.076","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023965","6.7635","0.0011","7.3462","0.0012","20.098","0.003","94.91","0.002","90.027","0.002","100.399","0.002","978.5","0.3","223","2","223","2","","","","","","","","6","P -1","-P 1","2","jrc2681n","","","- C21 H20 Cl F2 O2 S -","- C21 H20 Cl F2 O2 S -","- C42 H40 Cl2 F4 O4 S2 -","2","1","","Antony J. Davies; Jeremy P. Scott; Brian C. Bishop; Karel M. J. Brands; Sarah E. Brewer; Jimmy O. DaSilva; Peter G. Dormer; Ulf-H. Dolling; Andrew D. Gibb; Deborah C. Hammond; David R. Lieberman; Michael Palucki; Joseph F. Payack","A Novel Crystallization-Induced Diastereomeric Transformation Based on a Reversible Carbon-Sulfur Bond Formation. Application to the Synthesis of a γ-Secretase Inhibitor","Journal of Organic Chemistry","2007","72","","4864","4871","10.1021/jo0705925","","","0.71073","MoKα","","0.0836","0.0509","","","0.1175","0.1376","","","","","","1.018","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023966","27.617","0.012","9.77","0.004","14.938","0.006","90","","96.238","0.012","90","","4007","3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H21 Cl F2 O2 S -","- C21 H21 Cl F2 O2 S -","- C168 H168 Cl8 F16 O16 S8 -","8","1","","Antony J. Davies; Jeremy P. Scott; Brian C. Bishop; Karel M. J. Brands; Sarah E. Brewer; Jimmy O. DaSilva; Peter G. Dormer; Ulf-H. Dolling; Andrew D. Gibb; Deborah C. Hammond; David R. Lieberman; Michael Palucki; Joseph F. Payack","A Novel Crystallization-Induced Diastereomeric Transformation Based on a Reversible Carbon-Sulfur Bond Formation. Application to the Synthesis of a γ-Secretase Inhibitor","Journal of Organic Chemistry","2007","72","","4864","4871","10.1021/jo0705925","","","0.71073","MoKα","","0.0809","0.053","","","0.1316","0.1475","","","","","","1.049","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023967","11.3719","0.001","17.364","0.002","16.532","0.003","90","","99.11","0.005","90","","3223.4","0.7","150","2","150","2","","","","","","","synthesis as described","4","C 1 c 1","C -2yc","9","Fraenkel 1469","","","- C32 H58 Li2 N2 -","- C32 H58 Li2 N2 -","- C128 H232 Li8 N8 -","4","1","","Gideon Fraenkel; Xiao Chen; Judith Gallucci; Yan Lu","Structural Distortions and Dynamic Behavior of the Elusive ""L""-Shaped cis-Bicyclo[3.3.0]octenyllithium: X-ray Crystallographic and NMR Studies","Journal of Organic Chemistry","2007","72","","4961","4965","10.1021/jo0706022","","x-ray","0.71073","MoKα","","0.0635","0.0544","","","0.1396","0.1471","","","","","","1.051","","","","has coordinates,has disorder","178418","2020-10-21","18:00:00",""
"4023968","6.953","0.003","7.622","0.003","20.585","0.007","90","","92.578","0.006","90","","1089.9","0.7","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 O2 -","- C13 H14 O2 -","- C52 H56 O8 -","4","1","","Dhevalapally B. Ramachary; Mamillapalli Kishor","Organocatalytic Sequential One-Pot Double Cascade Asymmetric Synthesis of Wieland-Miescher Ketone Analogues from a Knoevenagel/Hydrogenation/Robinson Annulation Sequence: Scope and Applications of Organocatalytic Biomimetic Reductions","Journal of Organic Chemistry","2007","72","","5056","5068","10.1021/jo070277i","","","0.71073","MoKα","","0.0986","0.068","","","0.1753","0.1966","","","","","","1.045","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023969","10.194","0.003","13.671","0.003","22.72","0.006","90","","90","","90","","3166.1","1.4","298","2","298","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C19 H20 O2 -","- C19 H20 O2 -","- C152 H160 O16 -","8","1","","Dhevalapally B. Ramachary; Mamillapalli Kishor","Organocatalytic Sequential One-Pot Double Cascade Asymmetric Synthesis of Wieland-Miescher Ketone Analogues from a Knoevenagel/Hydrogenation/Robinson Annulation Sequence: Scope and Applications of Organocatalytic Biomimetic Reductions","Journal of Organic Chemistry","2007","72","","5056","5068","10.1021/jo070277i","","","0.71073","MoKα","","0.1118","0.0787","","","0.1496","0.1617","","","","","","1.178","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023970","21.065","0.011","5.735","0.003","24.155","0.013","90","","108.357","0.008","90","","2770","3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H17 Cl O2 -","- C15 H17 Cl O2 -","- C120 H136 Cl8 O16 -","8","1","","Dhevalapally B. Ramachary; Mamillapalli Kishor","Organocatalytic Sequential One-Pot Double Cascade Asymmetric Synthesis of Wieland-Miescher Ketone Analogues from a Knoevenagel/Hydrogenation/Robinson Annulation Sequence: Scope and Applications of Organocatalytic Biomimetic Reductions","Journal of Organic Chemistry","2007","72","","5056","5068","10.1021/jo070277i","","","0.71073","MoKα","","0.074","0.0515","","","0.1197","0.1319","","","","","","1.032","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023971","7.1427","0.0007","13.7344","0.0013","13.9747","0.0014","90","","90","","90","","1370.9","0.2","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H18 O2 -","- C17 H18 O2 -","- C68 H72 O8 -","4","1","","Dhevalapally B. Ramachary; Mamillapalli Kishor","Organocatalytic Sequential One-Pot Double Cascade Asymmetric Synthesis of Wieland-Miescher Ketone Analogues from a Knoevenagel/Hydrogenation/Robinson Annulation Sequence: Scope and Applications of Organocatalytic Biomimetic Reductions","Journal of Organic Chemistry","2007","72","","5056","5068","10.1021/jo070277i","","","0.71073","MoKα","","0.0404","0.0343","","","0.0832","0.0873","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023972","13.7063","0.0019","13.7063","0.0019","22.371","0.005","90","","90","","90","","4202.6","1.2","133","2","133","2","","","","","","","","4","I -4","I -4","82","","","","- C20 H32 N O3.5 -","- C20 H32 N O3.5 -","- C160 H256 N8 O28 -","8","1","","Frank Surup; Oliver Wagner; Jan von Frieling; Michael Schleicher; Stefanie Oess; Peter Müller; Stephanie Grond","The Iromycins, a New Family of Pyridone Metabolites from Streptomyces sp. I. Structure, NOS Inhibitory Activity, and Biosynthesis","Journal of Organic Chemistry","2007","72","","5085","5090","10.1021/jo0703303","","","0.71073","MoKα","","0.0685","0.0628","","","0.1752","0.1812","","","","","","1.118","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4023973","11.835","0.01","6.627","0.005","13.806","0.012","90","0.004","102.793","0.004","90","0.004","1055.9","1.5","103","2","103","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C30 H20 N2 -","- C30 H20 N2 -","- C60 H40 N4 -","2","0.5","","Keiko Kawaguchi; Koji Nakano; Kyoko Nozaki","Synthesis of Ladder-Type π-Conjugated Heteroacenes via Palladium-Catalyzed Double N-Arylation and Intramolecular O-Arylation","Journal of Organic Chemistry","2007","72","","5119","5128","10.1021/jo070427p","","","0.7107","MoKα","","0.0583","0.0494","","","0.1055","0.1103","","","","","","1.218","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023974","13.802","0.011","5.824","0.005","7.345","0.006","90","","97.723","0.013","90","","585.1","0.8","103","2","103","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H10 O2 -","- C18 H10 O2 -","- C36 H20 O4 -","2","0.5","","Keiko Kawaguchi; Koji Nakano; Kyoko Nozaki","Synthesis of Ladder-Type π-Conjugated Heteroacenes via Palladium-Catalyzed Double N-Arylation and Intramolecular O-Arylation","Journal of Organic Chemistry","2007","72","","5119","5128","10.1021/jo070427p","","","0.7107","MoKα","","0.0422","0.0316","","","0.0716","0.076","","","","","","1.126","","","","has coordinates,has disorder","178418","2020-10-21","18:00:00",""
"4023975","11.0547","0.0007","8.6515","0.0004","17.2969","0.0013","90","","106.756","0.003","90","","1584.03","0.17","150","1","150","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H16 F N O2 S -","- C17 H16 F N O2 S -","- C68 H64 F4 N4 O8 S4 -","4","1","","Yuan-Qing Fang; Josephine Yuen; Mark Lautens","A General Modular Method of Azaindole and Thienopyrrole Synthesis via Pd-Catalyzed Tandem Couplings of gem-Dichloroolefins","Journal of Organic Chemistry","2007","72","","5152","5160","10.1021/jo070460b","","","0.71073","MoKα","","0.1185","0.0546","","","0.1276","0.1552","","","","","","1.029","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023976","9.9355","0.0011","8.8757","0.0011","23.088","0.003","90","","94.968","0.003","90","","2028.4","0.4","298","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Phenyl 2,4,6-tri-O-acetyl-3-azido-3-deoxy-/b/-D-thiomannopyranoside","","- C18 H21 N3 O7 S -","- C18 H21 N3 O7 S -","- C72 H84 N12 O28 S4 -","4","2","","David Crich; Huadong Xu","Direct Stereocontrolled Synthesis of 3-Amino-3-deoxy-β-Mannopyranosides: Importance of the Nitrogen Protecting Group on Stereoselectivity","Journal of Organic Chemistry","2007","72","","5183","5192","10.1021/jo070473p","","","0.71073","MoKα","","0.283","0.1037","","","0.0899","0.1236","","","","","","0.97","","","","has coordinates","278158","2022-09-26","15:28:11",""
"4023977","7.9728","0.0004","9.5086","0.0005","29.1573","0.0016","90","","90","","90","","2210.4","0.2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Phenyl 3-azido-3-deoxy-4,6-O-[1-cyano-2-(2-iodophenyl)]ethylidene-/a/- D-thiomannopyranoside","","- C21 H19 I N4 O4 S -","- C21 H19 I N4 O4 S -","- C84 H76 I4 N16 O16 S4 -","4","1","","David Crich; Huadong Xu","Direct Stereocontrolled Synthesis of 3-Amino-3-deoxy-β-Mannopyranosides: Importance of the Nitrogen Protecting Group on Stereoselectivity","Journal of Organic Chemistry","2007","72","","5183","5192","10.1021/jo070473p","","","0.71073","MoKα","","0.0637","0.0501","","","0.1107","0.1226","","","","","","1.065","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023978","9.562","0.007","9.57","0.004","17.69","0.009","90","","90","","90","","1618.8","1.6","293","2","293","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H22 N2 O2 -","- C18 H22 N2 O2 -","- C72 H88 N8 O8 -","4","1","","Mercedes Amat; María M. M. Santos; Oriol Bassas; Núria Llor; Carmen Escolano; Arantxa Gómez-Esqué; Elies Molins; Steven M. Allin; Vickie McKee; Joan Bosch","Straightforward Methodology for the Enantioselective Synthesis of Benzo[a]- and Indolo[2,3-a]quinolizidines","Journal of Organic Chemistry","2007","72","","5193","5201","10.1021/jo070539g","","x-ray","0.71073","MoKα","","0.2221","0.0627","","","0.0901","0.1235","","","","","","0.999","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023979","5.243","0.003","8.952","0.004","32.676","0.013","90","","90","","90","","1533.8","1.3","294","2","294","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H22 N2 O2 -","- C18 H22 N2 O2 -","- C72 H88 N8 O8 -","4","1","","Mercedes Amat; María M. M. Santos; Oriol Bassas; Núria Llor; Carmen Escolano; Arantxa Gómez-Esqué; Elies Molins; Steven M. Allin; Vickie McKee; Joan Bosch","Straightforward Methodology for the Enantioselective Synthesis of Benzo[a]- and Indolo[2,3-a]quinolizidines","Journal of Organic Chemistry","2007","72","","5193","5201","10.1021/jo070539g","","x-ray","0.71073","MoKα","","0.0957","0.0559","","","0.1725","0.2019","","","","","","1.091","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023980","6.0352","0.0005","9.1035","0.0007","33.275","0.003","90","","90","","90","","1828.2","0.3","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H25 N O6 -","- C19 H25 N O6 -","- C76 H100 N4 O24 -","4","1","","Mercedes Amat; María M. M. Santos; Oriol Bassas; Núria Llor; Carmen Escolano; Arantxa Gómez-Esqué; Elies Molins; Steven M. Allin; Vickie McKee; Joan Bosch","Straightforward Methodology for the Enantioselective Synthesis of Benzo[a]- and Indolo[2,3-a]quinolizidines","Journal of Organic Chemistry","2007","72","","5193","5201","10.1021/jo070539g","","","0.71073","MoKα","","0.0516","0.0408","","","0.0992","0.1065","","","","","","1.102","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023981","9.2845","0.0007","5.924","0.0005","16.6375","0.0013","90","","91.433","0.001","90","","914.8","0.13","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H25 N O6 -","- C19 H25 N O6 -","- C38 H50 N2 O12 -","2","1","","Mercedes Amat; María M. M. Santos; Oriol Bassas; Núria Llor; Carmen Escolano; Arantxa Gómez-Esqué; Elies Molins; Steven M. Allin; Vickie McKee; Joan Bosch","Straightforward Methodology for the Enantioselective Synthesis of Benzo[a]- and Indolo[2,3-a]quinolizidines","Journal of Organic Chemistry","2007","72","","5193","5201","10.1021/jo070539g","","","0.71073","MoKα","","0.0399","0.0328","","","0.0797","0.0838","","","","","","1.091","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023982","7.1963","0.0012","14.2686","0.0013","16.3513","0.001","90","","90","","90","","1679","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H25 N O4 -","- C18 H25 N O4 -","- C72 H100 N4 O16 -","4","1","","Mercedes Amat; María M. M. Santos; Oriol Bassas; Núria Llor; Carmen Escolano; Arantxa Gómez-Esqué; Elies Molins; Steven M. Allin; Vickie McKee; Joan Bosch","Straightforward Methodology for the Enantioselective Synthesis of Benzo[a]- and Indolo[2,3-a]quinolizidines","Journal of Organic Chemistry","2007","72","","5193","5201","10.1021/jo070539g","","x-ray","0.71073","MoKα","","0.1002","0.0451","","","0.1257","0.1492","","","","","","1.019","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023983","8.875","0.001","9.841","0.001","23.762","0.002","90","","90","","90","","2075.3","0.4","293","2","293","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H29 N O6 -","- C21 H29 N O6 -","- C84 H116 N4 O24 -","4","1","","Mercedes Amat; María M. M. Santos; Oriol Bassas; Núria Llor; Carmen Escolano; Arantxa Gómez-Esqué; Elies Molins; Steven M. Allin; Vickie McKee; Joan Bosch","Straightforward Methodology for the Enantioselective Synthesis of Benzo[a]- and Indolo[2,3-a]quinolizidines","Journal of Organic Chemistry","2007","72","","5193","5201","10.1021/jo070539g","","x-ray","0.71073","MoKα","","0.1836","0.056","","","0.1419","0.1889","","","","","","1.004","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023984","8.227","0.003","28.911","0.009","8.895","0.003","90","","114.81","0.03","90","","1920.4","1.1","294","2","294","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C20 H24 N2 O4 -","- C20 H24 N2 O4 -","- C80 H96 N8 O16 -","4","2","","Mercedes Amat; María M. M. Santos; Oriol Bassas; Núria Llor; Carmen Escolano; Arantxa Gómez-Esqué; Elies Molins; Steven M. Allin; Vickie McKee; Joan Bosch","Straightforward Methodology for the Enantioselective Synthesis of Benzo[a]- and Indolo[2,3-a]quinolizidines","Journal of Organic Chemistry","2007","72","","5193","5201","10.1021/jo070539g","","x-ray","0.71073","MoKα","","0.1165","0.0612","","","0.1624","0.2041","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023985","7.459","0.0018","6.823","0.003","15.722","0.004","90","","98.726","0.019","90","","790.9","0.4","294","2","294","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C18 H22 N2 O2 -","- C18 H22 N2 O2 -","- C36 H44 N4 O4 -","2","1","","Mercedes Amat; María M. M. Santos; Oriol Bassas; Núria Llor; Carmen Escolano; Arantxa Gómez-Esqué; Elies Molins; Steven M. Allin; Vickie McKee; Joan Bosch","Straightforward Methodology for the Enantioselective Synthesis of Benzo[a]- and Indolo[2,3-a]quinolizidines","Journal of Organic Chemistry","2007","72","","5193","5201","10.1021/jo070539g","","x-ray","0.71073","MoKα","","0.0745","0.0529","","","0.1291","0.141","","","","","","1.071","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023986","7.6664","0.0012","13.2571","0.0019","18.826","0.004","90","","90","","90","","1913.3","0.6","294","2","294","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H26 N2 O4 -","- C21 H26 N2 O4 -","- C84 H104 N8 O16 -","4","1","","Mercedes Amat; María M. M. Santos; Oriol Bassas; Núria Llor; Carmen Escolano; Arantxa Gómez-Esqué; Elies Molins; Steven M. Allin; Vickie McKee; Joan Bosch","Straightforward Methodology for the Enantioselective Synthesis of Benzo[a]- and Indolo[2,3-a]quinolizidines","Journal of Organic Chemistry","2007","72","","5193","5201","10.1021/jo070539g","","x-ray","0.71073","MoKα","","0.0548","0.0435","","","0.1173","0.1242","","","","","","1.084","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023987","8.3762","0.0011","8.4699","0.0011","10.7986","0.0014","72.614","0.002","88.855","0.003","87.956","0.003","730.61","0.16","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","5,15-Diallyl-10,20-ditolylporphyrin","","- C40 H34 N4 -","- C40 H34 N4 -","- C40 H34 N4 -","1","0.5","","Sabine Horn; Natalia N. Sergeeva; Mathias O. Senge","Conversion of Ni(II)-Allylporphyrins to α,β-Unsaturated Formylporphyrins via a Nickel-Promoted Reaction","Journal of Organic Chemistry","2007","72","","5414","5417","10.1021/jo070550g","","","0.71073","MoKα","","0.0839","0.051","","","0.1098","0.1232","","","","","","1.016","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023988","13.1375","0.0007","6.3757","0.0002","21.8859","0.001","90","","122.711","0.002","90","","1542.45","0.12","298","","","","","","","","","","Synthesis","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 N O4 -","- C18 H17 N O4 -","- C72 H68 N4 O16 -","4","1","","Pohmakotr, Manat; Thamapipol, Sirinporn; Tuchinda, Patoomratana; Prabpai, Samran; Kongsaeree, Palangpon; Reutrakul, Vichai","Morita-Baylis-Hillman Reaction of Masked 5-Alkylidene-2-cyclopentenones: General Entry to 5-Alkylidene-2-(hydroxyalkyl)-2-cyclopentenones","Journal of Organic Chemistry","2007","72","14","5418","5420","10.1021/jo0705566","","","0.71073","MoKα","","0.0775","0.0531","","","0.1291","0.145","","","","","","1.02","","","","has coordinates","178226","2020-10-21","18:00:00",""
"4023989","6.8199","0.0002","10.4955","0.0005","22.5277","0.001","90","","105.663","0.003","90","","1552.61","0.11","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 N O4 -","- C18 H17 N O4 -","- C72 H68 N4 O16 -","4","1","","Pohmakotr, Manat; Thamapipol, Sirinporn; Tuchinda, Patoomratana; Prabpai, Samran; Kongsaeree, Palangpon; Reutrakul, Vichai","Morita-Baylis-Hillman Reaction of Masked 5-Alkylidene-2-cyclopentenones: General Entry to 5-Alkylidene-2-(hydroxyalkyl)-2-cyclopentenones","Journal of Organic Chemistry","2007","72","14","5418","5420","10.1021/jo0705566","","","0.71073","MoKα","","0.0738","0.0477","","","0.1259","0.145","","","","","","1.002","","","","has coordinates","178226","2020-10-21","18:00:00",""
"4023990","11.5196","0.0015","11.3782","0.0016","23.977","0.003","90","","90","","90","","3142.7","0.7","193","2","193","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H19 Cl N4 -","- C18 H19 Cl N4 -","- C144 H152 Cl8 N32 -","8","1","","Zhidong Ma; Cynthia S. Day; Ulrich Bierbach","Unexpected Reactivity of the 9-Aminoacridine Chromophore in Guanidylation Reactions","Journal of Organic Chemistry","2007","72","","5387","5390","10.1021/jo0705972","","","0.71073","MoKα","","0.0666","0.0448","","","0.1016","0.1086","","","","","","0.91","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023991","9.03","0.009","11.573","0.012","16.754","0.017","90","","94.79","0.016","90","","1745","3","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H19 N7 -","- C21 H19 N7 -","- C84 H76 N28 -","4","1","","Zhidong Ma; Cynthia S. Day; Ulrich Bierbach","Unexpected Reactivity of the 9-Aminoacridine Chromophore in Guanidylation Reactions","Journal of Organic Chemistry","2007","72","","5387","5390","10.1021/jo0705972","","","0.71073","MoKα","","0.0723","0.0512","","","0.1172","0.1243","","","","","","0.981","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023992","11.1235","0.0012","20.633","0.002","7.1005","0.0008","90","","111.158","0.002","90","","1519.8","0.3","193","2","193","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C17 H17 Br N4 -","- C17 H17 Br N4 -","- C68 H68 Br4 N16 -","4","1","","Zhidong Ma; Cynthia S. Day; Ulrich Bierbach","Unexpected Reactivity of the 9-Aminoacridine Chromophore in Guanidylation Reactions","Journal of Organic Chemistry","2007","72","","5387","5390","10.1021/jo0705972","","","0.71073","MoKα","","0.0511","0.0484","","","0.1171","0.1193","","","","","","1.031","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023993","10.6146","0.0017","14.791","0.002","11.0425","0.0017","90","","116.943","0.002","90","","1545.5","0.4","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H22 N2 O4 S -","- C12 H22 N2 O4 S -","- C48 H88 N8 O16 S4 -","4","1","","Zhidong Ma; Cynthia S. Day; Ulrich Bierbach","Unexpected Reactivity of the 9-Aminoacridine Chromophore in Guanidylation Reactions","Journal of Organic Chemistry","2007","72","","5387","5390","10.1021/jo0705972","","","0.71073","MoKα","","0.0642","0.0453","","","0.1078","0.1184","","","","","","1.017","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023994","8.1233","0.0017","16.267","0.004","17.002","0.004","109.081","0.004","100.725","0.004","94.547","0.004","2062.3","0.8","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H50 N14 O13 -","- C37 H50 N14 O13 -","- C74 H100 N28 O26 -","2","1","","Zhidong Ma; Cynthia S. Day; Ulrich Bierbach","Unexpected Reactivity of the 9-Aminoacridine Chromophore in Guanidylation Reactions","Journal of Organic Chemistry","2007","72","","5387","5390","10.1021/jo0705972","","","0.71073","MoKα","","0.1057","0.056","","","0.095","0.1088","","","","","","0.869","","","","has coordinates","178418","2020-10-21","18:00:00",""
"4023995","11.783","0.002","16.808","0.003","18.441","0.004","90","","93.81","0.03","90","","3644.3","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H26 Cl2 N6 O9 -","- C37 H26 Cl2 N6 O9 -","- C148 H104 Cl8 N24 O36 -","4","1","","Bao-Yong Hou; De-Xian Wang; Hai-Bo Yang; Qi-Yu Zheng; Mei-Xiang Wang","Synthesis and Structure of Upper-Rim 1,3-Alternate Tetraoxacalix[2]arene[2]triazine Azacrowns and Change of Cavity in Response to Fluoride Anion","Journal of Organic Chemistry","2007","72","","5218","5226","10.1021/jo0706168","","","0.71073","MoKα","","0.1474","0.0657","","","0.1635","0.2006","","","","","","0.971","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023996","24.154","0.005","13.507","0.003","18.307","0.004","90","","119.35","0.03","90","","5206","1.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C48 H50 N8 O14 -","- C48 H50 N8 O14 -","- C192 H200 N32 O56 -","4","0.5","","Bao-Yong Hou; De-Xian Wang; Hai-Bo Yang; Qi-Yu Zheng; Mei-Xiang Wang","Synthesis and Structure of Upper-Rim 1,3-Alternate Tetraoxacalix[2]arene[2]triazine Azacrowns and Change of Cavity in Response to Fluoride Anion","Journal of Organic Chemistry","2007","72","","5218","5226","10.1021/jo0706168","","","0.71073","MoKα","","0.4487","0.2236","","","0.5351","0.6645","","","","","","1.471","","","","has coordinates,has disorder","178418","2020-10-21","18:00:00",""
"4023997","9.333","0.0003","11.141","0.0005","11.281","0.0005","90","","93.341","0.003","90","","1170.99","0.08","223","2","223","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H30 N2 O12 -","- C20 H30 N2 O12 -","- C40 H60 N4 O24 -","2","1","","Gonzalo Jiménez-Osés; Carlos Aydillo; Jesús H. Busto; María M. Zurbano; Jesús M. Peregrina; Alberto Avenoza","Role of the Countercation in Diastereoselective Alkylations of Pyramidalized Bicyclic Serine Enolates. An Easy Approach to α-Benzylserine","Journal of Organic Chemistry","2007","72","","5399","5402","10.1021/jo070656b","","","0.71073","MoKα","","0.1193","0.0597","","","0.13","0.1607","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023998","9.3175","0.0003","11.1152","0.0003","11.2197","0.0004","90","","93.417","0.0015","90","","1159.91","0.06","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H30 N2 O12 -","- C20 H30 N2 O12 -","- C40 H60 N4 O24 -","2","1","","Gonzalo Jiménez-Osés; Carlos Aydillo; Jesús H. Busto; María M. Zurbano; Jesús M. Peregrina; Alberto Avenoza","Role of the Countercation in Diastereoselective Alkylations of Pyramidalized Bicyclic Serine Enolates. An Easy Approach to α-Benzylserine","Journal of Organic Chemistry","2007","72","","5399","5402","10.1021/jo070656b","","","0.71073","MoKα","","0.0699","0.0458","","","0.0971","0.1072","","","","","","1.024","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4023999","25.589","0.003","7.6701","0.0008","25.394","0.003","90","","109.309","0.0019","90","","4703.7","0.9","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26.5 H31 B2 Cl N2 -","- C26.5 H31 B2 Cl N2 -","- C212 H248 B16 Cl8 N16 -","8","1","","Cory A. Jaska; Warren E. Piers; Robert McDonald; Masood Parvez","Synthesis, Characterization, and Fluorescence Behavior of Twisted and Planar B~2~N~2~-Quaterphenyl Analogues","Journal of Organic Chemistry","2007","72","","5234","5243","10.1021/jo0706574","","","0.71073","MoKα","","0.1358","0.0723","","","0.1789","0.2148","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024000","9.901","0.002","12.982","0.006","15.803","0.007","90","","90","","90","","2031.2","1.4","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H20 B2 Cl2 N2 -","- C21 H20 B2 Cl2 N2 -","- C84 H80 B8 Cl8 N8 -","4","1","","Cory A. Jaska; Warren E. Piers; Robert McDonald; Masood Parvez","Synthesis, Characterization, and Fluorescence Behavior of Twisted and Planar B~2~N~2~-Quaterphenyl Analogues","Journal of Organic Chemistry","2007","72","","5234","5243","10.1021/jo0706574","","","0.71073","MoKα","","0.0753","0.0457","","","0.0944","0.1082","","","","","","1.032","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024001","11.601","0.005","11.924","0.006","13.14","0.005","90","","97.31","0.03","90","","1802.9","1.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H25 B Cl N Si -","- C16 H25 B Cl N Si -","- C64 H100 B4 Cl4 N4 Si4 -","4","1","","Cory A. Jaska; Warren E. Piers; Robert McDonald; Masood Parvez","Synthesis, Characterization, and Fluorescence Behavior of Twisted and Planar B~2~N~2~-Quaterphenyl Analogues","Journal of Organic Chemistry","2007","72","","5234","5243","10.1021/jo0706574","","","0.71073","MoKα","","0.0835","0.0465","","","0.1037","0.1204","","","","","","1.012","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024002","11.683","0.003","20.619","0.004","11.111","0.007","90","","90","","90","","2676.5","1.9","173","2","173","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C36 H26 B2 N2 -","- C36 H26 B2 N2 -","- C144 H104 B8 N8 -","4","0.5","","Cory A. Jaska; Warren E. Piers; Robert McDonald; Masood Parvez","Synthesis, Characterization, and Fluorescence Behavior of Twisted and Planar B~2~N~2~-Quaterphenyl Analogues","Journal of Organic Chemistry","2007","72","","5234","5243","10.1021/jo0706574","","","0.71073","MoKα","","0.06","0.0454","","","0.1188","0.1308","","","","","","1.04","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024003","8.3414","0.0005","8.5092","0.0005","18.2164","0.0011","90","","95.47","0.001","90","","1287.09","0.13","193","2","193","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 O4 -","- C15 H18 O4 -","- C60 H72 O16 -","4","1","","Steven M. Mennen; Scott J. Miller","Development of a Bio-Inspired Acyl-Anion Equivalent Macrocyclization and Synthesis of a trans-Resorcylide Precursor","Journal of Organic Chemistry","2007","72","","5260","5269","10.1021/jo070676d","","","0.71073","MoKα","","0.0598","0.0575","","","0.1363","0.1407","","","","","","1.056","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024004","7.351","0.0015","12.071","0.002","28.875","0.006","90","","90","","90","","2562.2","0.9","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(1R,2S,3R)-methyl 1-cyano-3-(methoxycarbonyloxy)- 2,3-dimethylcyclopentanecarboxylate","","- C12 H17 N O5 -","- C12 H17 N O5 -","- C96 H136 N8 O40 -","8","1","","Fraser F. Fleming; Guoqing Wei; Zhiyu Zhang; Omar W. Steward","Cyclic Oxonitriles: Stereodivergent Grignard Addition-Alkylations","Journal of Organic Chemistry","2007","72","","5270","5275","10.1021/jo070678y","","","0.71073","MoKα","","0.0642","0.0451","","","0.1168","0.1278","","","","","","1.061","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024005","6.9492","0.0004","19.5923","0.0012","11.7429","0.0007","90","","98.627","0.004","90","","1580.72","0.16","273","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(1R,2S,3S)-3-cyano-1,2,3-trimethylcyclopentyl 4-nitrobenzoate","","- C16 H18 N2 O4 -","- C16 H18 N2 O4 -","- C64 H72 N8 O16 -","4","1","","Fraser F. Fleming; Guoqing Wei; Zhiyu Zhang; Omar W. Steward","Cyclic Oxonitriles: Stereodivergent Grignard Addition-Alkylations","Journal of Organic Chemistry","2007","72","","5270","5275","10.1021/jo070678y","","","0.71073","MoKα","","0.0558","0.0439","","","0.116","0.1254","","","","","","1.056","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4024006","7.7823","0.0002","18.2549","0.0004","12.5769","0.0003","90","","98.899","0.001","90","","1765.23","0.07","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(1S,2S,3S)-3-allyl-3-cyano-1,2-dimethyl cyclopentyl 4-nitrobenzoate","","- C18 H20 N2 O4 -","- C18 H20 N2 O4 -","- C72 H80 N8 O16 -","4","1","","Fraser F. Fleming; Guoqing Wei; Zhiyu Zhang; Omar W. Steward","Cyclic Oxonitriles: Stereodivergent Grignard Addition-Alkylations","Journal of Organic Chemistry","2007","72","","5270","5275","10.1021/jo070678y","","","0.71073","MoKα","","0.1054","0.0494","","","0.136","0.1766","","","","","","0.933","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4024007","7.028","0.003","10.388","0.004","13.769","0.005","103.738","0.005","97.89","0.005","90.954","0.005","966","0.6","273","2","296","2","","","","","","","","4","P -1","-P 1","2","","(1R,2S,3S)3-cyano-1,2-dimethyl-3-pivaloylcyclopentyl 4-nitrobenzoate","","- C20 H24 N2 O5 -","- C20 H24 N2 O5 -","- C40 H48 N4 O10 -","2","1","","Fraser F. Fleming; Guoqing Wei; Zhiyu Zhang; Omar W. Steward","Cyclic Oxonitriles: Stereodivergent Grignard Addition-Alkylations","Journal of Organic Chemistry","2007","72","","5270","5275","10.1021/jo070678y","","","0.71073","MoKα","","0.0932","0.0647","","","0.1857","0.2137","","","","","","1.051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4024008","8.7348","0.0003","9.4474","0.0003","18.1528","0.0005","90","","90","","90","","1497.99","0.08","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H24 O4 S -","- C14 H24 O4 S -","- C56 H96 O16 S4 -","4","1","","Paweł Chochrek; Jerzy Wicha","Expedited Approach to the Vitamin D trans-Hydrindane Building Block from the Hajos Dione. Comparative Study on Various Methods for the Selective Deoxygenation of One of the Hydroxy Groups in a Diol","Journal of Organic Chemistry","2007","72","","5276","5284","10.1021/jo070685m","","","0.71073","MoKα","","0.0249","0.0231","","","0.0624","0.0629","","","","","","1.088","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024009","11.277","0.001","19.462","0.002","20.233","0.002","83.03","0.01","75.5","0.01","77.46","0.01","4186","0.7","150","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H16 N2 O2 S5 -","- C20 H16 N2 O2 S5 -","- C160 H128 N16 O16 S40 -","8","4","","Dora Demeter; Philippe Blanchard; Magali Allain; Ion Grosu; Jean Roncali","Synthesis and Metal Cation Complexing Properties of Crown-Annelated Terthiophenes Containing 3,4-Ethylenedioxythiophene","Journal of Organic Chemistry","2007","72","","5285","5290","10.1021/jo070699s","","x-ray","0.71073","MoKα","","","0.0589","","","","0.1906","","","","","","1","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024010","12.6281","0.0007","15.8244","0.0014","8.7576","0.0007","90","","90","","90","","1750","0.2","293","2","293","2","","","","","","","synthetised","5","P n a 21","P 2c -2n","33","","(±)-trans-3-t-Butyl-3-methyl-2-(diphenylphosphinoyl)oxaziridine","","- C18 H22 N O2 P -","- C18 H22 N O2 P -","- C72 H88 N4 O8 P4 -","4","1","","Cédric Boudou; Matthieu Bergès; Charlène Sagnes; Jana Sopková-de Oliveira Santos; Stéphane Perrio; Patrick Metzner","trans-(\±)-2-tert-Butyl-3-phenyloxaziridine: A Unique Reagent for the Oxidation of Thiolates into Sulfenates","Journal of Organic Chemistry","2007","72","","5403","5406","10.1021/jo070700n","","","0.71073","MoKα","","0.0883","0.047","","","0.1135","0.1311","","","","","","1.024","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024011","6.433","0.002","10.485","0.004","11.844","0.004","99.779","0.006","99.509","0.006","97.079","0.006","767","0.5","296","2","296","2","","","","","","","","6","P -1","-P 1","2","locked diselenide","","","- C13 H17 N O3 S Se2 -","- C13 H17 N O3 S Se2 -","- C26 H34 N2 O6 S2 Se4 -","2","1","","Devarajulu Sureshkumar; Venkataraman Ganesh; Srinivasan Chandrasekaran","Conformationally Locked Bridged Bicyclic Diselenides: Synthesis, Structure, Se···O Interaction, and Theoretical Studies","Journal of Organic Chemistry","2007","72","","5313","5319","10.1021/jo070705k","","","0.71073","MoKα","","0.0602","0.0387","","","0.0908","0.0971","","","","","","0.995","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024012","14.909","0.01","10.839","0.007","12.948","0.009","90","","94.743","0.01","90","","2085","2","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","locked diselenide","","","- C15 H20 Cl3 N O3 S Se2 -","- C15 H20 Cl3 N O3 S Se2 -","- C60 H80 Cl12 N4 O12 S4 Se8 -","4","1","","Devarajulu Sureshkumar; Venkataraman Ganesh; Srinivasan Chandrasekaran","Conformationally Locked Bridged Bicyclic Diselenides: Synthesis, Structure, Se···O Interaction, and Theoretical Studies","Journal of Organic Chemistry","2007","72","","5313","5319","10.1021/jo070705k","","","0.71073","MoKα","","0.0703","0.0542","","","0.1535","0.1581","","","","","","1.233","","","","has coordinates","258458","2020-10-21","18:00:00",""
"4024013","6.9359","0.0007","10.7681","0.001","17.6827","0.0017","99.317","0.002","92.479","0.002","94.647","0.002","1296.8","0.2","296","2","296","2","","","","","","","","7","P -1","-P 1","2","locked bridged bicyclic diselenide","","","- C21 H35 N O4 S Se2 Si -","- C21 H35 N O4 S Se2 Si -","- C42 H70 N2 O8 S2 Se4 Si2 -","2","1","","Devarajulu Sureshkumar; Venkataraman Ganesh; Srinivasan Chandrasekaran","Conformationally Locked Bridged Bicyclic Diselenides: Synthesis, Structure, Se···O Interaction, and Theoretical Studies","Journal of Organic Chemistry","2007","72","","5313","5319","10.1021/jo070705k","","","0.71073","MoKα","","0.0753","0.0568","","","0.1697","0.1856","","","","","","1.005","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024014","22.522","0.002","6.4039","0.0007","19.181","0.002","90","","108.572","0.002","90","","2622.4","0.5","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","locked brideged bicyclic diselenide","","","- C21 H35 N O4 S Se2 Si -","- C21 H35 N O4 S Se2 Si -","- C84 H140 N4 O16 S4 Se8 Si4 -","4","1","","Devarajulu Sureshkumar; Venkataraman Ganesh; Srinivasan Chandrasekaran","Conformationally Locked Bridged Bicyclic Diselenides: Synthesis, Structure, Se···O Interaction, and Theoretical Studies","Journal of Organic Chemistry","2007","72","","5313","5319","10.1021/jo070705k","","","0.71073","MoKα","","0.0684","0.0413","","","0.0901","0.0974","","","","","","1.012","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024015","7.4659","0.0014","10.0299","0.0019","18.094","0.003","105.316","0.003","90.727","0.003","97.353","0.003","1294.6","0.4","296","2","296","2","","","","","","","","7","P -1","-P 1","2","locked bridged bicyclic diselenide","","","- C21 H34 N O4 S Se2 Si -","- C21 H34 N O4 S Se2 Si -","- C42 H68 N2 O8 S2 Se4 Si2 -","2","1","","Devarajulu Sureshkumar; Venkataraman Ganesh; Srinivasan Chandrasekaran","Conformationally Locked Bridged Bicyclic Diselenides: Synthesis, Structure, Se···O Interaction, and Theoretical Studies","Journal of Organic Chemistry","2007","72","","5313","5319","10.1021/jo070705k","","","0.71073","MoKα","","0.0792","0.0482","","","0.1115","0.1219","","","","","","1.006","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024016","6.306","0.002","12.924","0.004","21.47","0.007","90","","98.349","0.006","90","","1731.2","1","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","locked bridged bicyclic diselenide","","","- C15 H21 N O3 S Se2 -","- C15 H21 N O3 S Se2 -","- C60 H84 N4 O12 S4 Se8 -","4","1","","Devarajulu Sureshkumar; Venkataraman Ganesh; Srinivasan Chandrasekaran","Conformationally Locked Bridged Bicyclic Diselenides: Synthesis, Structure, Se···O Interaction, and Theoretical Studies","Journal of Organic Chemistry","2007","72","","5313","5319","10.1021/jo070705k","","","0.71073","MoKα","","0.0749","0.0519","","","0.1281","0.1383","","","","","","1.043","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024017","6.2232","0.0013","7.9631","0.0016","18.61","0.004","93.496","0.003","97.839","0.003","108.762","0.003","859.6","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","locked diselenide","","","- C15 H21 N O3 S Se2 -","- C15 H21 N O3 S Se2 -","- C30 H42 N2 O6 S2 Se4 -","2","1","","Devarajulu Sureshkumar; Venkataraman Ganesh; Srinivasan Chandrasekaran","Conformationally Locked Bridged Bicyclic Diselenides: Synthesis, Structure, Se···O Interaction, and Theoretical Studies","Journal of Organic Chemistry","2007","72","","5313","5319","10.1021/jo070705k","","","0.71073","MoKα","","0.0724","0.049","","","0.1091","0.1259","","","","","","1.064","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024018","12.618","0.002","10.818","0.0019","13.255","0.002","90","","105.468","0.003","90","","1743.7","0.5","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","locked bridged bicyclic diselenide","","","- C15 H21 N O3 S Se2 -","- C15 H21 N O3 S Se2 -","- C60 H84 N4 O12 S4 Se8 -","4","1","","Devarajulu Sureshkumar; Venkataraman Ganesh; Srinivasan Chandrasekaran","Conformationally Locked Bridged Bicyclic Diselenides: Synthesis, Structure, Se···O Interaction, and Theoretical Studies","Journal of Organic Chemistry","2007","72","","5313","5319","10.1021/jo070705k","","","0.71073","MoKα","","0.0493","0.0332","","","0.0737","0.078","","","","","","1","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024019","12.7759","0.0017","13.2442","0.0018","13.9926","0.0018","65.201","0.002","70.241","0.002","87.15","0.002","2011","0.5","296","2","296","2","","","","","","","","6","P -1","-P 1","2","locked bridged bicyclic diselenide","","","- C17 H25 N O3 S Se2 -","- C17 H25 N O3 S Se2 -","- C68 H100 N4 O12 S4 Se8 -","4","2","","Devarajulu Sureshkumar; Venkataraman Ganesh; Srinivasan Chandrasekaran","Conformationally Locked Bridged Bicyclic Diselenides: Synthesis, Structure, Se···O Interaction, and Theoretical Studies","Journal of Organic Chemistry","2007","72","","5313","5319","10.1021/jo070705k","","","0.71073","MoKα","","0.0841","0.0441","","","0.0886","0.098","","","","","","0.939","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024020","13.041","0.003","14.234","0.003","18.825","0.004","90","","90","","90","","3494.3","1.3","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","acyclic amino diselenide","","","- C26 H40 N2 O4 S2 Se2 -","- C26 H40 N2 O4 S2 Se2 -","- C104 H160 N8 O16 S8 Se8 -","4","1","","Devarajulu Sureshkumar; Venkataraman Ganesh; Srinivasan Chandrasekaran","Conformationally Locked Bridged Bicyclic Diselenides: Synthesis, Structure, Se···O Interaction, and Theoretical Studies","Journal of Organic Chemistry","2007","72","","5313","5319","10.1021/jo070705k","","","0.71073","MoKα","","0.0949","0.0585","","","0.1209","0.1328","","","","","","0.984","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024021","10.6937","0.0008","14.3941","0.0011","23.1336","0.0018","90","","90","","90","","3560.9","0.5","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","cyclic amino diselenide","","","- C34 H38 N2 O6 S2 Se2 -","- C34 H38 N2 O6 S2 Se2 -","- C136 H152 N8 O24 S8 Se8 -","4","1","","Devarajulu Sureshkumar; Venkataraman Ganesh; Srinivasan Chandrasekaran","Conformationally Locked Bridged Bicyclic Diselenides: Synthesis, Structure, Se···O Interaction, and Theoretical Studies","Journal of Organic Chemistry","2007","72","","5313","5319","10.1021/jo070705k","","","0.71073","MoKα","","0.0586","0.0391","","","0.0778","0.083","","","","","","1.005","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024022","8.0203","0.0012","19.603","0.003","7.4796","0.0011","90","","95.03","0.003","90","","1171.4","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H14 O3 -","- C13 H14 O3 -","- C52 H56 O12 -","4","1","","Biao Lu; Bao Wang; Yihua Zhang; Dawei Ma","CuI-Catalyzed Domino Process to 2,3-Disubstituted Benzofurans from 1-Bromo-2-Iodobenzenes and β-Keto Esters","Journal of Organic Chemistry","2007","72","","5337","5341","10.1021/jo070729r","","","0.71073","MoKα","","0.1187","0.059","","","0.1287","0.1477","","","","","","0.897","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024023","7.6149","0.0006","8.552","0.0016","16.5755","0.0019","90","","90","","90","","1079.4","0.3","250","","250","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H15 N O3 -","- C10 H15 N O3 -","- C40 H60 N4 O12 -","4","1","","Arnaud Voituriez; Franck Ferreira; Fabrice Chemla","Short and Efficient Asymmetric Synthesis of (-)-α-Conhydrine","Journal of Organic Chemistry","2007","72","","5358","5361","10.1021/jo070760t","","","0.71073","MoKα","","0.0664","0.0384","","0.0664","0.0452","0.0452","","","","","","1.0739","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024024","8.3168","0.0007","10.6073","0.0005","12.5903","0.0005","113.497","0.004","97.859","0.004","96.784","0.005","990.65","0.1","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","dimethyl 4-tert-butyl-4-[(2,2-dimethylpropanoyl)oxy]-2,5-heptadiynedioate","","- C18 H24 O6 -","- C18 H24 O6 -","- C36 H48 O12 -","2","1","","David Tejedor; Sara López-Tosco; Javier González-Platas; Fernando García-Tellado","Metal-Free Access to Fully Substituted Skipped Diynes. An Efficient Chemodifferentiating A~2~BB' 4CR Manifold","Journal of Organic Chemistry","2007","72","","5454","5456","10.1021/jo070764y","","","0.71073","MoKα","","0.0826","0.0585","","","0.159","0.1804","","","","","","1.014","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024025","11.5494","0.0007","26.2674","0.0017","32.45","0.002","90","","96.146","0.002","90","","9787.8","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","DNUDCC","1,8-Di(1-naphthalenyl)ureayl-3,6-dichloro-carbazole","","- C52 H62 Cl2 N6 O4 -","- C52 H62 Cl2 N6 O4 -","- C416 H496 Cl16 N48 O32 -","8","2","","T. Daniel Thangadurai; N. Jiten Singh; In-Chul Hwang; Jung Woo Lee; R. Prakash Chandran; Kwang S. Kim","2-Dimensional Analytic Approach for Anion Differentiation with Chromofluorogenic Receptors","Journal of Organic Chemistry","2007","72","","5461","5464","10.1021/jo070791o","","","0.71073","MoKα","","0.3114","0.1304","","","0.2754","0.36","","","","","","1.069","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4024026","8.029","0.004","21.941","0.011","22.644","0.011","89.142","0.01","87.969","0.01","83.571","0.011","3961","3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H8 F5 N3 O2 -","- C12 H8 F5 N3 O2 -","- C144 H96 F60 N36 O24 -","12","6","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71073","MoKα","","0.1299","0.0769","","","0.1364","0.1541","","","","","","1.085","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024027","10.093","0.006","12.396","0.005","9.72","0.004","90","","118.31","0.05","90","","1070.6","1","293.2","","293.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","?","- C9 H15 N3 O2 -","- C36 H60 N12 O8 -","4","1","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","1.5418","CuKalpha","","","0.051","","","0.089","","","","","3.19","3.19","","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024028","18.987","0.004","24.295","0.005","9.2123","0.0015","90","","90","","90","","4249.6","1.3","100","2","100","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C11 H11 N3 O2 -","- C11 H11 N3 O2 -","- C176 H176 N48 O32 -","16","1","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71073","MoKα","","0.0428","0.0405","","","0.095","0.0965","","","","","","1.086","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024029","9.8932","0.0017","18.614","0.003","12.621","0.002","90","","103.651","0.003","90","","2258.5","0.7","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H15 N3 O2 -","- C9 H15 N3 O2 -","- C72 H120 N24 O16 -","8","2","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71073","MoKα","","0.0916","0.0878","","","0.1953","0.1975","","","","","","1.223","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024030","18.3407","0.0014","5.3308","0.0004","12.262","0.0009","90","","102.161","0.001","90","","1171.96","0.15","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H13 N3 O3 -","- C12 H13 N3 O3 -","- C48 H52 N12 O12 -","4","1","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71073","MoKα","","0.0644","0.06","","","0.1319","0.1344","","","","","","1.211","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024031","18.235","0.005","5.3898","0.0016","12.383","0.004","90","","102.068","0.005","90","","1190.1","0.6","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H13 N3 O3 -","- C12 H13 N3 O3 -","- C48 H52 N12 O12 -","4","1","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71073","MoKα","","0.1083","0.1012","","","0.1942","0.1977","","","","","","1.279","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024032","15.29","0.01","6.194","0.005","11.358","0.008","90","","101.521","0.012","90","","1054.1","1.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H13 N3 O2 -","- C8 H13 N3 O2 -","- C32 H52 N12 O8 -","4","1","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71073","MoKα","","0.268","0.1198","","","0.2738","0.3431","","","","","","0.99","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024033","21.669","0.006","8.3096","0.0019","12.758","0.003","90","","113.409","0.007","90","","2108.1","0.9","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H4 F5 N3 O2 -","- C10 H4 F5 N3 O2 -","- C80 H32 F40 N24 O16 -","8","1","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71073","MoKα","","0.0405","0.0369","","","0.1027","0.1053","","","","","","1.075","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024034","5.7577","0.0011","21.95","0.004","6.565","0.0013","90","","100.338","0.004","90","","816.2","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H11 N3 O2 -","- C7 H11 N3 O2 -","- C28 H44 N12 O8 -","4","1","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71073","MoKα","","0.0462","0.0409","","","0.1124","0.1164","","","","","","1.042","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024035","9.929","0.004","11.108","0.005","11.655","0.005","90","","108.274","0.007","90","","1220.7","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H17 N3 O2 -","- C10 H17 N3 O2 -","- C40 H68 N12 O8 -","4","1","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71073","MoKα","","0.1236","0.0812","","","0.1746","0.1963","","","","","","1.065","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024036","18.767","0.004","10.205","0.002","5.6858","0.0012","90","","93.557","0.004","90","","1086.8","0.4","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H13 N3 O2 -","- C12 H13 N3 O2 -","- C48 H52 N12 O8 -","4","1","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71073","MoKα","","0.0406","0.0358","","","0.0943","0.0966","","","","","","1.066","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024037","20.498","0.005","9.317","0.003","5.9004","0.0015","90","","93.759","0.005","90","","1124.4","0.5","293","1","293","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H13 N3 O2 -","- C12 H13 N3 O2 -","- C48 H52 N12 O8 -","4","1","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71073","MoKα","","0.0988","0.0716","","","0.1692","0.1867","","","","","","1.113","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024039","13.8073","0.0016","25.597","0.003","14.0108","0.0016","90","","90","","90","","4951.8","1","295","2","295","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C11 H6 F5 N3 O2 -","- C11 H6 F5 N3 O2 -","- C176 H96 F80 N48 O32 -","16","4","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71073","MoKα","","0.0845","0.0796","","","0.1645","0.1668","","","","","","1.297","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024040","16.123","0.005","7.045","0.005","21.453","0.005","90","0.005","106.869","0.005","90","0.005","2331.9","1.9","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C25 H17 F5 N3 O2 -","- C25 H17 F5 N3 O2 -","- C100 H68 F20 N12 O8 -","4","1","","Ahmad Basheer; Hiroshi Yamataka; Salai Cheettu Ammal; Zvi Rappoport","Enols of Substituted Cyanomalonamides","Journal of Organic Chemistry","2007","72","","5297","5312","10.1021/jo070877h","","","0.71069","MoKα","","0.1907","0.1026","","","0.1994","0.2384","","","","","","1.063","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024041","7.926","","13.267","","14.196","","90","","90.08","","90","","1492.6","","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H34 O10 S -","- C28 H34 O10 S -","- C56 H68 O20 S2 -","2","1","","Indrajit Das; Tarun K. Pal; Cheravakkattu G. Suresh; Tanmaya Pathak","Diastereoselective C-C Bond Formation at C-5 of Vinyl Sulfone-Modified Hex-5-enofuranosyl Carbohydrates: Diversity-Oriented Synthesis of Branched-Chain Sugars and Beyond","Journal of Organic Chemistry","2007","72","","5523","5533","10.1021/jo062373+","","","0.71073","MoKα","","0.0817","0.053","","","0.1432","0.1689","","","","","","0.864","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024042","11.111","","13.059","","15.198","","90","","90","","90","","2205.1","","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H28 O8 S -","- C20 H28 O8 S -","- C80 H112 O32 S4 -","4","1","","Indrajit Das; Tarun K. Pal; Cheravakkattu G. Suresh; Tanmaya Pathak","Diastereoselective C-C Bond Formation at C-5 of Vinyl Sulfone-Modified Hex-5-enofuranosyl Carbohydrates: Diversity-Oriented Synthesis of Branched-Chain Sugars and Beyond","Journal of Organic Chemistry","2007","72","","5523","5533","10.1021/jo062373+","","","0.71073","MoKα","","0.0923","0.0473","","","0.145","0.1842","","","","","","0.756","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024043","10.843","","7.3","","11.813","","90","","90.36","","90","","935","","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H21 N O8 S -","- C17 H21 N O8 S -","- C34 H42 N2 O16 S2 -","2","1","","Indrajit Das; Tarun K. Pal; Cheravakkattu G. Suresh; Tanmaya Pathak","Diastereoselective C-C Bond Formation at C-5 of Vinyl Sulfone-Modified Hex-5-enofuranosyl Carbohydrates: Diversity-Oriented Synthesis of Branched-Chain Sugars and Beyond","Journal of Organic Chemistry","2007","72","","5523","5533","10.1021/jo062373+","","","0.71073","MoKα","","0.0413","0.0366","","","0.1623","0.1713","","","","","","0.85","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024044","27.9054","0.0014","27.9054","0.0014","9.5055","0.0005","90","","90","","120","","6410.4","0.6","295","2","295","2","","","","","","","","4","R 3 :H","R 3","146","","","","- C28 H30 O11 S -","- C28 H30 O11 S -","- C252 H270 O99 S9 -","9","1","","Indrajit Das; Tarun K. Pal; Cheravakkattu G. Suresh; Tanmaya Pathak","Diastereoselective C-C Bond Formation at C-5 of Vinyl Sulfone-Modified Hex-5-enofuranosyl Carbohydrates: Diversity-Oriented Synthesis of Branched-Chain Sugars and Beyond","Journal of Organic Chemistry","2007","72","","5523","5533","10.1021/jo062373+","","","0.71073","MoKα","","0.0481","0.0415","","","0.1009","0.1157","","","","","","1.027","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024045","9.341","","10.7","","12.856","","101.34","","93.88","","90.82","","1256.5","","293","2","293","2","","","","","","","","4","P 1","P 1","1","","","","- C22 H26 O11 S -","- C22 H26 O11 S -","- C44 H52 O22 S2 -","2","2","","Indrajit Das; Tarun K. Pal; Cheravakkattu G. Suresh; Tanmaya Pathak","Diastereoselective C-C Bond Formation at C-5 of Vinyl Sulfone-Modified Hex-5-enofuranosyl Carbohydrates: Diversity-Oriented Synthesis of Branched-Chain Sugars and Beyond","Journal of Organic Chemistry","2007","72","","5523","5533","10.1021/jo062373+","","","0.71073","MoKα","","0.1079","0.0505","","","0.1131","0.1329","","","","","","1.048","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024046","7.719","0.003","5.0376","0.0017","15.66","0.005","90","","92.889","0.005","90","","608.1","0.4","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 Cl2 F8 -","- C14 Cl2 F8 -","- C28 Cl4 F16 -","2","0.5","","John F. Tannaci; Masahiro Noji; Jennifer McBee; T. Don Tilley","9,10-Dichlorooctafluoroanthracene as a Building Block for n-Type Organic Semiconductors","Journal of Organic Chemistry","2007","72","","5567","5573","10.1021/jo070404a","","","0.71073","MoKα","","0.059","0.0399","","","0.0952","0.1066","","","","","","1.018","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024047","12.61","0.003","6.7441","0.0019","22.242","0.006","90","","90","","90","","1891.5","0.9","168","2","168","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C26 H10 F8 -","- C26 H10 F8 -","- C104 H40 F32 -","4","0.5","","John F. Tannaci; Masahiro Noji; Jennifer McBee; T. Don Tilley","9,10-Dichlorooctafluoroanthracene as a Building Block for n-Type Organic Semiconductors","Journal of Organic Chemistry","2007","72","","5567","5573","10.1021/jo070404a","","","0.71073","MoKα","","0.0681","0.0428","","","0.0988","0.1145","","","","","","1.048","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024048","9.765","0.005","11.955","0.005","11.725","0.005","90","0.005","98.873","0.005","90","0.005","1352.4","1.1","193","2","193","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C15 F8 O4 -","- C15 F8 O4 -","- C60 F32 O16 -","4","1","","John F. Tannaci; Masahiro Noji; Jennifer McBee; T. Don Tilley","9,10-Dichlorooctafluoroanthracene as a Building Block for n-Type Organic Semiconductors","Journal of Organic Chemistry","2007","72","","5567","5573","10.1021/jo070404a","","","0.71069","MoKα","","0.0366","0.0283","","","0.0689","0.0708","","","","","","0.959","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024049","10.6859","0.0007","11.3239","0.0007","12.033","0.0008","98.383","0.002","107.507","0.002","107.461","0.002","1279.27","0.14","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H25 Cl N2 -","- C35 H25 Cl N2 -","- C70 H50 Cl2 N4 -","2","1","","Mateo Alajarín; Baltasar Bonillo; Pilar Sánchez-Andrada; Ángel Vidal; Delia Bautista","Intramolecular Ketenimine-Ketenimine [2 + 2] and [4 + 2] Cycloadditions","Journal of Organic Chemistry","2007","72","","5863","5866","10.1021/jo0704661","","","0.71073","MoKα","","0.0715","0.0475","","","0.0816","0.0879","","","","","","0.951","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024050","13.5954","0.0009","13.0422","0.0009","16.1307","0.0011","90","","98.497","0.002","90","","2828.8","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C40 H28 N2 O2 -","- C40 H28 N2 O2 -","- C160 H112 N8 O8 -","4","1","","Mateo Alajarín; Baltasar Bonillo; Pilar Sánchez-Andrada; Ángel Vidal; Delia Bautista","Intramolecular Ketenimine-Ketenimine [2 + 2] and [4 + 2] Cycloadditions","Journal of Organic Chemistry","2007","72","","5863","5866","10.1021/jo0704661","","","0.71073","MoKα","","0.1018","0.0581","","","0.0844","0.0967","","","","","","0.911","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024051","14.0033","0.0009","19.9207","0.0012","11.629","0.0007","90","","93.677","0.003","90","","3237.3","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","amine addition","4-((benzyl(methyl)amino)(phenyl)methyl)oxazolidin-2-one","","- C18 H19 N2 O2 -","- C18 H19.855 N2 O2 -","- C144 H158.84 N16 O16 -","8","2","","Renmao Liu; Steven R. Herron; Steven A. Fleming","Copper-Catalyzed Tethered Aziridination of Unsaturated N-Tosyloxy Carbamates","Journal of Organic Chemistry","2007","72","","5587","5591","10.1021/jo0705014","","","0.71073","MoKα","","0.0993","0.0667","","","0.2059","0.2286","","","","","","1.49","","","","has coordinates,has disorder","178419","2020-10-21","18:00:00",""
"4024052","6.8765","0.0013","7.0185","0.0013","28.58","0.005","90","","92.844","0.002","90","","1377.6","0.4","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","amine addition","4-(2-(benzyl(methyl)amino)propan-2-yl)oxazolidin-2-one","","- C14 H20 N2 O2 -","- C14 H20 N2 O2 -","- C56 H80 N8 O8 -","4","1","","Renmao Liu; Steven R. Herron; Steven A. Fleming","Copper-Catalyzed Tethered Aziridination of Unsaturated N-Tosyloxy Carbamates","Journal of Organic Chemistry","2007","72","","5587","5591","10.1021/jo0705014","","","0.71073","MoKα","","0.1055","0.0747","","","0.1963","0.2261","","","","","","1.056","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024053","9.0091","0.0015","15.194","0.004","16.428","0.002","90","","90","","90","","2248.7","0.8","163","2","163","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H17 Cl N4 -","- C9 H17 Cl N4 -","- C72 H136 Cl8 N32 -","8","2","","Deniz Akalay; Gerd Dürner; Jan W. Bats; Michael Bolte; Michael W. Göbel","Synthesis of C~2~-Symmetric Bisamidines: A New Type of Chiral Metal-Free Lewis Acid Analogue Interacting with Carbonyl Groups","Journal of Organic Chemistry","2007","72","","5618","5624","10.1021/jo070534j","","","0.71073","MoKα","","0.0947","0.0461","","","0.0798","0.0937","","","","","","1.019","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024054","13.068","0.005","12.86","0.003","13.187","0.003","90","","111.22","0.03","90","","2065.8","1","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C43 H34 N10 O14 -","- C43 H34 N10 O14 -","- C86 H68 N20 O28 -","2","1","","Deniz Akalay; Gerd Dürner; Jan W. Bats; Michael Bolte; Michael W. Göbel","Synthesis of C~2~-Symmetric Bisamidines: A New Type of Chiral Metal-Free Lewis Acid Analogue Interacting with Carbonyl Groups","Journal of Organic Chemistry","2007","72","","5618","5624","10.1021/jo070534j","","","0.71073","MoKα","","0.1305","0.05","","","0.0689","0.0843","","","","","","1.025","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024055","9.4491","0.0008","17.214","0.003","14.6652","0.0016","90","","102.537","0.008","90","","2328.5","0.5","159","2","159","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H13 F6 N4 P -","- C7 H13 F6 N4 P -","- C56 H104 F48 N32 P8 -","8","2","","Deniz Akalay; Gerd Dürner; Jan W. Bats; Michael Bolte; Michael W. Göbel","Synthesis of C~2~-Symmetric Bisamidines: A New Type of Chiral Metal-Free Lewis Acid Analogue Interacting with Carbonyl Groups","Journal of Organic Chemistry","2007","72","","5618","5624","10.1021/jo070534j","","","0.71073","MoKα","","0.0565","0.0424","","","0.0981","0.1065","","","","","","1.089","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024056","8.3429","0.0012","10.1851","0.0011","11.0769","0.0018","90","","92.149","0.012","90","","940.6","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H13 Cl N4 -","- C7 H13 Cl N4 -","- C28 H52 Cl4 N16 -","4","1","","Deniz Akalay; Gerd Dürner; Jan W. Bats; Michael Bolte; Michael W. Göbel","Synthesis of C~2~-Symmetric Bisamidines: A New Type of Chiral Metal-Free Lewis Acid Analogue Interacting with Carbonyl Groups","Journal of Organic Chemistry","2007","72","","5618","5624","10.1021/jo070534j","","","0.71073","MoKα","","0.0335","0.0314","","","0.08","0.0814","","","","","","1.116","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024057","11.3159","0.0018","7.5465","0.0012","21.013","0.003","90","","90","","90","","1794.4","0.5","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C10 H11 N3 -","- C10 H11 N3 -","- C80 H88 N24 -","8","1","","Brendan J. Liddle; Rosalice M. Silva; Tyler J. Morin; Felipe P. Macedo; Ruchi Shukla; Sergey V. Lindeman; James R. Gardinier","BORAZANs: Tunable Fluorophores Based on 2-(Pyrazolyl)aniline Chelates of Diphenylboron","Journal of Organic Chemistry","2007","72","","5637","5646","10.1021/jo0705420","","","0.71073","MoKα","","0.0496","0.0435","","","0.122","0.1271","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024058","12.5847","0.0009","15.0987","0.0011","9.6289","0.0007","90","","98.961","0.001","90","","1807.3","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 B N3 O -","- C22 H20 B N3 O -","- C88 H80 B4 N12 O4 -","4","1","","Brendan J. Liddle; Rosalice M. Silva; Tyler J. Morin; Felipe P. Macedo; Ruchi Shukla; Sergey V. Lindeman; James R. Gardinier","BORAZANs: Tunable Fluorophores Based on 2-(Pyrazolyl)aniline Chelates of Diphenylboron","Journal of Organic Chemistry","2007","72","","5637","5646","10.1021/jo0705420","","","0.71073","MoKα","","0.0595","0.0465","","","0.124","0.1316","","","","","","1.075","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024059","12.7082","0.0012","15.4722","0.0014","9.3613","0.0009","90","","97.495","0.001","90","","1824.9","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 B N3 -","- C22 H20 B N3 -","- C88 H80 B4 N12 -","4","1","","Brendan J. Liddle; Rosalice M. Silva; Tyler J. Morin; Felipe P. Macedo; Ruchi Shukla; Sergey V. Lindeman; James R. Gardinier","BORAZANs: Tunable Fluorophores Based on 2-(Pyrazolyl)aniline Chelates of Diphenylboron","Journal of Organic Chemistry","2007","72","","5637","5646","10.1021/jo0705420","","","0.71073","MoKα","","0.0624","0.0468","","","0.1281","0.139","","","","","","1.068","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024060","13.315","0.004","15.279","0.004","9.319","0.002","90","","92.567","0.004","90","","1894","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H17 B F3 N3 -","- C22 H17 B F3 N3 -","- C88 H68 B4 F12 N12 -","4","1","","Brendan J. Liddle; Rosalice M. Silva; Tyler J. Morin; Felipe P. Macedo; Ruchi Shukla; Sergey V. Lindeman; James R. Gardinier","BORAZANs: Tunable Fluorophores Based on 2-(Pyrazolyl)aniline Chelates of Diphenylboron","Journal of Organic Chemistry","2007","72","","5637","5646","10.1021/jo0705420","","","0.71073","MoKα","","0.0983","0.054","","","0.127","0.1443","","","","","","1.031","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024061","13.5897","0.0002","14.3599","0.0002","9.2557","0.0002","90","","90","","90","","1806.22","0.05","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C22 H17 B N4 -","- C22 H17 B N4 -","- C88 H68 B4 N16 -","4","1","","Brendan J. Liddle; Rosalice M. Silva; Tyler J. Morin; Felipe P. Macedo; Ruchi Shukla; Sergey V. Lindeman; James R. Gardinier","BORAZANs: Tunable Fluorophores Based on 2-(Pyrazolyl)aniline Chelates of Diphenylboron","Journal of Organic Chemistry","2007","72","","5637","5646","10.1021/jo0705420","","","1.54178","CuKα","","0.0267","0.0251","","","0.0652","0.0662","","","","","","0.988","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024062","10.563","0.004","9.543","0.004","15.602","0.006","90","","106.986","0.006","90","","1504.2","1","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H9 F9 N2 O -","- C14 H9 F9 N2 O -","- C56 H36 F36 N8 O4 -","4","1","","Hiroyuki Suzuki; Norio Sakai; Ryohei Iwahara; Takayuki Fujiwaka; Mitsunobu Satoh; Akikazu Kakehi; Takeo Konakahara","Novel Synthesis of 7-Fluoro-8-(trifluoromethyl)-1H-1,6-naphthyridin-4-one Derivatives: Intermolecular Cyclization of an N-Silyl-1-azaallyl Anion with Perfluoroalkene and Subsequent Intramolecular Skeletal Transformation of the Resulting Pentasubstituted Pyridines","Journal of Organic Chemistry","2007","72","","5878","5881","10.1021/jo070564m","","","0.71073","MoKα","","0.1315","0.1017","","","0.2729","0.3046","","","","","","0.932","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024063","5.1074","0.0014","17.39","0.005","12.98","0.003","90","","100.79","0.005","90","","1132.5","0.5","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 F4 N2 O -","- C12 H9 F4 N2 O -","- C48 H36 F16 N8 O4 -","4","1","","Hiroyuki Suzuki; Norio Sakai; Ryohei Iwahara; Takayuki Fujiwaka; Mitsunobu Satoh; Akikazu Kakehi; Takeo Konakahara","Novel Synthesis of 7-Fluoro-8-(trifluoromethyl)-1H-1,6-naphthyridin-4-one Derivatives: Intermolecular Cyclization of an N-Silyl-1-azaallyl Anion with Perfluoroalkene and Subsequent Intramolecular Skeletal Transformation of the Resulting Pentasubstituted Pyridines","Journal of Organic Chemistry","2007","72","","5878","5881","10.1021/jo070564m","","","0.71073","MoKα","","0.0727","0.058","","","0.152","0.1625","","","","","","1.088","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024064","20.8895","0.0009","5.2252","0.0002","14.8559","0.0006","90","","131.117","0.002","90","","1221.62","0.09","103","2","103","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","1","","","- C12 H8 N6 O2 S -","- C12 H8 N6 O2 S -","- C48 H32 N24 O8 S4 -","4","0.5","","Alan R. Katritzky; Levan Khelashvili; Khanh N. B. Le; Prabhu P. Mohapatra; Peter J. Steel","Synthesis of o-Sulfamidotriazobenzenes from 1,1'-Sulfonylbis(benzotriazole)","Journal of Organic Chemistry","2007","72","","5805","5808","10.1021/jo0705723","","","0.71073","MoKα","","0.031","0.0263","","","0.0647","0.068","","","","","","1.038","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024065","10.1479","0.0003","10.2295","0.0003","14.7132","0.0004","90","","99.468","0.001","90","","1506.54","0.07","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2a","","","- C14 H21 N5 O2 S -","- C14 H21 N5 O2 S -","- C56 H84 N20 O8 S4 -","4","1","","Alan R. Katritzky; Levan Khelashvili; Khanh N. B. Le; Prabhu P. Mohapatra; Peter J. Steel","Synthesis of o-Sulfamidotriazobenzenes from 1,1'-Sulfonylbis(benzotriazole)","Journal of Organic Chemistry","2007","72","","5805","5808","10.1021/jo0705723","","","0.71073","MoKα","","0.0316","0.0298","","","0.0846","0.0865","","","","","","0.964","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024066","9.093","0.0013","15.335","0.002","17.377","0.003","90","","90.224","0.002","90","","2423.1","0.6","93","2","93","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C55 H56 O12 P2 -","- C55 H56 O12 P2 -","- C110 H112 O24 P4 -","2","1","","Davide Bello; Tashfeen Aslam; Geert Bultynck; Alexandra M. Z. Slawin; H. Llewelyn Roderick; Martin D. Bootman; Stuart J. Conway","Synthesis and Biological Action of Novel 4-Position-Modified Derivatives of D-myo-Inositol 1,4,5-Trisphosphate","Journal of Organic Chemistry","2007","72","","5647","5659","10.1021/jo070611a","","","0.71073","MoKα","","0.0305","0.03","","","0.0766","0.0774","","","","","","0.987","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024067","12.19","0.001","15.244","0.001","17.299","0.001","87.518","0.01","71.966","0.01","82.401","0.01","3029.8","0.4","293","2","293","2","","","","","","","Jonny Slatt, Unit for Organic Chemistry, CNT, Dep. of Biosciences at Novum, Karolinska Institute, Novum Research Park, SE-141 57 Huddinge, Sweden","4","P -1","-P 1","2","","","","- C32 H33 N5 O5 -","- C32 H33 N5 O5 -","- C128 H132 N20 O20 -","4","2","","Niklas Wahlström; Johnny Slätt; Birgitta Stensland; Anne Ertan; Jan Bergman; Tomasz Janosik","Synthetic Applications of Cyanoacetylated Bisindoles: Synthesis of Novel Cycloheptadiindoles, Indolocarbazoles, and Related Aza Analogues","Journal of Organic Chemistry","2007","72","","5886","5889","10.1021/jo0706729","","","0.71073","MoKα","","0.1842","0.0661","","","0.1676","0.2035","","","","","","0.838","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024068","10.4553","0.0009","23.32","0.002","13.9462","0.0012","90","","92.526","0.006","90","","3397","0.5","296.1","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C38 H46 O6 -","- C38 H46 O6 -","- C152 H184 O24 -","4","2","","Masayuki Yamashita; Navnath Dnyanoba Yadav; Takeshi Sawaki; Ikuko Takao; Ikuo Kawasaki; Yasuko Sugimoto; Akemi Miyatake; Kousuke Murai; Ayano Takahara; Ai Kurume; Shunsaku Ohta","Asymmetric Total Synthesis of (-)-Linderol A","Journal of Organic Chemistry","2007","72","","5697","5703","10.1021/jo070682+","","","1.54187","CuKα","","","0.0492","","","","0.147","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024069","8.0442","0.0008","9.0713","0.0009","18.9881","0.0018","90","","91.249","0.006","90","","1385.3","0.2","296.1","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C32 H34 O6 -","- C32 H34 O6 -","- C64 H68 O12 -","2","1","","Masayuki Yamashita; Navnath Dnyanoba Yadav; Takeshi Sawaki; Ikuko Takao; Ikuo Kawasaki; Yasuko Sugimoto; Akemi Miyatake; Kousuke Murai; Ayano Takahara; Ai Kurume; Shunsaku Ohta","Asymmetric Total Synthesis of (-)-Linderol A","Journal of Organic Chemistry","2007","72","","5697","5703","10.1021/jo070682+","","","1.54187","CuKα","","","0.0499","","","","0.1432","","","","","","0.985","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024070","7.4451","0.0001","14.8116","0.0003","16.3139","0.0004","90","","90","","90","","1799","0.06","153","2","153","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H20 N2 O5 S -","- C18 H20 N2 O5 S -","- C72 H80 N8 O20 S4 -","4","1","","Susan A. Garner; Michael J. Krische","Rhodium-Catalyzed Reductive Mannich Coupling of Vinyl Ketones to N-Sulfonylimines Mediated by Hydrogen","Journal of Organic Chemistry","2007","72","","5843","5846","10.1021/jo070779w","","","0.71073","MoKα","","0.0334","0.0287","","","0.0695","0.0729","","","","","","0.981","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024071","10.224","0.005","9.366","0.005","16.942","0.009","90","0","92.86","0.04","90","0","1620.4","1.4","298","2","298","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C38 H52 N2 O2 -","- C38 H52 N2 O2 -","- C76 H104 N4 O4 -","2","1","","Harry W. Gibson; Michael A. G. Berg; Jennifer Clifton Dickson; Pierre R. Lecavalier; Hong Wang; Joseph S. Merola","Diastereomeric Reissert Compounds of Isoquinoline and 6,7-Dimethoxy-3,4-dihydroisoquinoline in Stereoselective Synthesis","Journal of Organic Chemistry","2007","72","","5759","5770","10.1021/jo070786k","","x-ray","0.71073","MoKα","","0.0878","0.0677","","","0.186","0.2183","","","","","","1.1","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024072","9.567","0.002","10.794","0.002","23.003","0.006","90","0","90","0","90","0","2375.3","0.9","298","2","298","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H35 N O3 -","- C25 H35 N O3 -","- C100 H140 N4 O12 -","4","1","","Harry W. Gibson; Michael A. G. Berg; Jennifer Clifton Dickson; Pierre R. Lecavalier; Hong Wang; Joseph S. Merola","Diastereomeric Reissert Compounds of Isoquinoline and 6,7-Dimethoxy-3,4-dihydroisoquinoline in Stereoselective Synthesis","Journal of Organic Chemistry","2007","72","","5759","5770","10.1021/jo070786k","","x-ray","0.71073","MoKα","","0.1008","0.0614","","","0.1667","0.2012","","","","","","1.021","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024073","10.6078","0.0003","11.6253","0.0003","13.1419","0.0003","90","","92.734","0.002","90","","1618.8","0.07","95","2","95","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C17 H22 N2 O3 -","- C17 H22 N2 O3 -","- C68 H88 N8 O12 -","4","2","","Harry W. Gibson; Michael A. G. Berg; Jennifer Clifton Dickson; Pierre R. Lecavalier; Hong Wang; Joseph S. Merola","Diastereomeric Reissert Compounds of Isoquinoline and 6,7-Dimethoxy-3,4-dihydroisoquinoline in Stereoselective Synthesis","Journal of Organic Chemistry","2007","72","","5759","5770","10.1021/jo070786k","","x-ray","0.71073","MoKα","","0.0519","0.0367","","","0.0782","0.0846","","","","","","0.978","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024074","8.633","0.003","9.999","0.003","13.048","0.005","90","0","95.02","0.03","90","0","1122","0.7","298","2","298","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C23 H32 N2 O4 -","- C23 H32 N2 O4 -","- C46 H64 N4 O8 -","2","1","","Harry W. Gibson; Michael A. G. Berg; Jennifer Clifton Dickson; Pierre R. Lecavalier; Hong Wang; Joseph S. Merola","Diastereomeric Reissert Compounds of Isoquinoline and 6,7-Dimethoxy-3,4-dihydroisoquinoline in Stereoselective Synthesis","Journal of Organic Chemistry","2007","72","","5759","5770","10.1021/jo070786k","","x-ray","0.71073","MoKα","","0.0453","0.0402","","","0.0965","0.1016","","","","","","1.061","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024075","13.4677","0.0017","14.3805","0.0015","17.864","0.002","90","","90","","90","","3459.7","0.7","100","2","95","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H24 N2 O3 -","- C18 H24 N2 O3 -","- C144 H192 N16 O24 -","8","2","","Harry W. Gibson; Michael A. G. Berg; Jennifer Clifton Dickson; Pierre R. Lecavalier; Hong Wang; Joseph S. Merola","Diastereomeric Reissert Compounds of Isoquinoline and 6,7-Dimethoxy-3,4-dihydroisoquinoline in Stereoselective Synthesis","Journal of Organic Chemistry","2007","72","","5759","5770","10.1021/jo070786k","","x-ray","0.71073","MoKα","","0.0417","0.0329","","","0.0756","0.0801","","","","","","0.997","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024076","9.395","0.003","11.052","0.004","13.035","0.004","106.77","0.03","91.97","0.03","93.72","0.03","1291.2","0.8","298","2","298","2","","","","","","","synthesis as described","4","P 1","P 1","1","","","","- C26 H38 N2 O4 -","- C26 H38 N2 O4 -","- C52 H76 N4 O8 -","2","2","","Harry W. Gibson; Michael A. G. Berg; Jennifer Clifton Dickson; Pierre R. Lecavalier; Hong Wang; Joseph S. Merola","Diastereomeric Reissert Compounds of Isoquinoline and 6,7-Dimethoxy-3,4-dihydroisoquinoline in Stereoselective Synthesis","Journal of Organic Chemistry","2007","72","","5759","5770","10.1021/jo070786k","","x-ray","0.71073","MoKα","","0.0462","0.0416","","","0.1127","0.1168","","","","","","1.042","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024077","10.1622","0.0003","11.5565","0.0004","16.7153","0.0007","70.356","0.001","73.339","0.001","64.827","0.002","1649.3","0.1","113.2","","","","","","","","","","","2","P -1","-P 1","2","","","","- C22 H24 -","- C22 H24 -","- C88 H96 -","4","2","","Toshiaki Shimasaki; Shin-ichiro Kato; Teruo Shinmyozu","Synthesis, Structural, Spectral, and Photoswitchable Properties of cis- and trans-2,2,2',2'-Tetramethyl-1,1'-indanylindanes","Journal of Organic Chemistry","2007","72","","6251","6254","10.1021/jo0701233","","","0.7107","MoKα","","","0.0544","","","","0.1526","","","","","","1.868","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024078","8.4851","0.0003","8.6692","0.0005","11.7774","0.0005","103.661","0.002","98.748","0.002","99.811","0.003","812.61","0.07","113.2","","","","","","","","","","","2","P -1","-P 1","2","","","","- C22 H24 -","- C22 H24 -","- C44 H48 -","2","1","","Toshiaki Shimasaki; Shin-ichiro Kato; Teruo Shinmyozu","Synthesis, Structural, Spectral, and Photoswitchable Properties of cis- and trans-2,2,2',2'-Tetramethyl-1,1'-indanylindanes","Journal of Organic Chemistry","2007","72","","6251","6254","10.1021/jo0701233","","","0.7107","MoKα","","","0.0577","","","","0.1719","","","","","","2.537","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024079","9.9768","0.0002","11.5045","0.0003","18.2991","0.0005","80.1604","0.0008","76.659","0.002","67.7642","0.0004","1883.52","0.08","113.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H22 Br2 -","- C22 H22 Br2 -","- C88 H88 Br8 -","4","2","","Toshiaki Shimasaki; Shin-ichiro Kato; Teruo Shinmyozu","Synthesis, Structural, Spectral, and Photoswitchable Properties of cis- and trans-2,2,2',2'-Tetramethyl-1,1'-indanylindanes","Journal of Organic Chemistry","2007","72","","6251","6254","10.1021/jo0701233","","","0.7107","MoKα","","","0.0379","","","","0.1048","","","","","","1.105","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024080","8.593","","11.344","","11.883","","104.91","","108.71","","110.08","","938.4","","113","2","113","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H22 Br2 -","- C22 H22 Br2 -","- C44 H44 Br4 -","2","1","","Toshiaki Shimasaki; Shin-ichiro Kato; Teruo Shinmyozu","Synthesis, Structural, Spectral, and Photoswitchable Properties of cis- and trans-2,2,2',2'-Tetramethyl-1,1'-indanylindanes","Journal of Organic Chemistry","2007","72","","6251","6254","10.1021/jo0701233","","","0.71069","MoKα","","0.0436","0.0373","","","0.0978","0.1011","","","","","","1.067","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024081","9.5186","0.0003","12.2793","0.0004","16.6625","0.0007","98.6777","0.0015","97.2329","0.0019","102.827","0.0011","1851.35","0.11","113","2","113","2","","","","","","","","2","P -1","-P 1","2","","","","- C24 H28 -","- C24 H28 -","- C96 H112 -","4","2","","Toshiaki Shimasaki; Shin-ichiro Kato; Teruo Shinmyozu","Synthesis, Structural, Spectral, and Photoswitchable Properties of cis- and trans-2,2,2',2'-Tetramethyl-1,1'-indanylindanes","Journal of Organic Chemistry","2007","72","","6251","6254","10.1021/jo0701233","","","0.71069","MoKα","","0.0696","0.0515","","","0.142","0.1531","","","","","","1.052","","","","has coordinates","209364","2020-10-21","18:00:00",""
"4024082","11.2423","0.001","11.793","0.0011","13.3567","0.001","108.197","0.002","105.652","0.005","108.365","0.002","1457.4","0.2","113","2","113","2","","","","","","","","2","P -1","-P 1","2","","","","- C42 H36 -","- C42 H35.651 -","- C84 H71.302 -","2","1","","Toshiaki Shimasaki; Shin-ichiro Kato; Teruo Shinmyozu","Synthesis, Structural, Spectral, and Photoswitchable Properties of cis- and trans-2,2,2',2'-Tetramethyl-1,1'-indanylindanes","Journal of Organic Chemistry","2007","72","","6251","6254","10.1021/jo0701233","","","0.71069","MoKα","","0.1156","0.0697","","","0.1803","0.2054","","","","","","1.066","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4024083","10.594","0.0002","11.26","0.0003","14.358","0.0003","80.293","0.001","68.793","0.0013","89.138","0.0013","1571.93","0.06","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H35 Br2 N2 O4 -","- C37 H35 Br2 N2 O4 -","- C74 H70 Br4 N4 O8 -","2","1","","Paramasivan Rajasingh; Revital Cohen; Elijah Shirman; Linda J. W. Shimon; Boris Rybtchinski","Selective Bromination of Perylene Diimides under Mild Conditions","Journal of Organic Chemistry","2007","72","","5973","5979","10.1021/jo070367n","","","0.71073","MoKα","","0.0608","0.0517","","","0.1422","0.1477","","","","","","1.063","","","","has coordinates,has disorder","178419","2020-10-21","18:00:00",""
"4024084","45.0275","0.0016","7.2114","0.0003","6.1034","0.0002","90","","95.116","0.002","90","","1973.95","0.13","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C23 H19 F3 N2 O S -","- C23 H19 F3 N2 O S -","- C92 H76 F12 N8 O4 S4 -","4","1","","José Luis García Ruano; Ana M. Martín-Castro; Francisco Tato; Inés Alonso","Stereoselective Quaternization of α-Amino Phenylacetonitriles Mediated by a Remote Sulfinyl Group","Journal of Organic Chemistry","2007","72","","5994","6005","10.1021/jo0705519","","","1.54178","CuKα","","0.0502","0.0436","","","0.1078","0.1125","","","","","","1.071","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024085","9.6663","0.0013","10.7795","0.0014","10.0018","0.0012","90","","97.002","0.005","90","","1034.4","0.2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H20 N2 O3 S2 -","- C22 H20 N2 O3 S2 -","- C44 H40 N4 O6 S4 -","2","1","","José Luis García Ruano; Ana M. Martín-Castro; Francisco Tato; Inés Alonso","Stereoselective Quaternization of α-Amino Phenylacetonitriles Mediated by a Remote Sulfinyl Group","Journal of Organic Chemistry","2007","72","","5994","6005","10.1021/jo0705519","","","1.54178","CuKα","","0.0636","0.0566","","","0.1369","0.1428","","","","","","1.037","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024086","12.5771","0.0007","11.765","0.0006","15.0272","0.0008","90","","92.852","0.002","90","","2220.8","0.2","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C49 H50 Cl2 N4 O2 S2 -","- C49 H50 Cl2 N4 O2 S2 -","- C98 H100 Cl4 N8 O4 S4 -","2","1","","José Luis García Ruano; Ana M. Martín-Castro; Francisco Tato; Inés Alonso","Stereoselective Quaternization of α-Amino Phenylacetonitriles Mediated by a Remote Sulfinyl Group","Journal of Organic Chemistry","2007","72","","5994","6005","10.1021/jo0705519","","","1.54178","CuKα","","0.0528","0.0444","","","0.1081","0.1138","","","","","","1.016","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024087","12.3408","0.0002","12.8642","0.0002","7.746","0.0001","90","","98.089","0.001","90","","1217.48","0.03","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","8-Ethyl-7-hydroxy-9-methyl-6H-benzo[c]chromen-6-one","","- C16 H14 O3 -","- C16 H14 O3 -","- C64 H56 O12 -","4","1","","Ibrar Hussain; Van Thi Hong Nguyen; Mirza Arfan Yawer; Tuan Thanh Dang; Christine Fischer; Helmut Reinke; Peter Langer","Synthesis of Dibenzo[b,d]pyran-6-ones Based on [3 + 3] Cyclizations of 1,3-Bis(silyl enol ethers) with 3-Silyloxy-2-en-1-ones","Journal of Organic Chemistry","2007","72","","6255","6258","10.1021/jo070608r","","","0.71073","MoKα","","0.0508","0.04","","","0.1088","0.1219","","","","","","1.03","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024088","8.8222","0.0014","32.448","0.005","10.488","0.0016","90","","90.097","0.002","90","","3002.3","0.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H17 N O2 -","- C19 H17 N O2 -","- C152 H136 N8 O16 -","8","2","","Howard E. Zimmerman; Oleg D. Mitkin","The Aza-Type-B Photochemical Rearrangement: The Role of a Second Carbonyl in Heterocyclic Photochemistry. Mechanistic and Exploratory Organic Photochemistry","Journal of Organic Chemistry","2007","72","","6091","6096","10.1021/jo0706372","","","0.71073","Mo-Kα","","0.0555","0.0499","","","0.1146","0.1172","","","","","","1.08","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4024089","6.7633","0.0002","13.7539","0.0004","17.2571","0.0004","90","","96.485","0.002","90","","1595.01","0.08","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","3,3,5-Trimehyl-10b-phenyl-2,3-dihydro-10bH-[1,3]oxazolo[2,3-a]isoquinoline","","- C40 H42 N2 O2 -","- C40 H42 N2 O2 -","- C80 H84 N4 O4 -","2","1","","Vito Capriati; Saverio Florio; Renzo Luisi; Filippo Maria Perna","Synthesis of 2,3-Dihydro-10bH-oxazolo[2,3-a]isoquinolines from ortho-Lithiated Phenyloxazolinyloxiranes","Journal of Organic Chemistry","2007","72","","6316","6319","10.1021/jo070708x","","","0.71073","MoKα","","0.0345","0.0314","","","0.0773","0.08","","","","","","1.055","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024090","18.3485","0.0005","16.3317","0.0004","8.575","0.0002","90","","90","","90","","2569.6","0.11","293","2","293","2","","","","","","","","4","I b a 2","I 2 -2c","45","","2,4',4'-Trimethyl-2,3-dihydrospiro(2,3-epoxy-indene-1,2'-[1,3]-oxazolidine)","","- C14 H17 N O2 -","- C14 H17 N O2 -","- C112 H136 N8 O16 -","8","1","","Vito Capriati; Saverio Florio; Renzo Luisi; Filippo Maria Perna","Synthesis of 2,3-Dihydro-10bH-oxazolo[2,3-a]isoquinolines from ortho-Lithiated Phenyloxazolinyloxiranes","Journal of Organic Chemistry","2007","72","","6316","6319","10.1021/jo070708x","","","0.71073","MoKα","","0.0317","0.0301","","","0.0821","0.0837","","","","","","1.104","","","","has coordinates","178419","2020-10-21","18:00:00",""
"4024091","14.697","0.004","8.0055","0.0019","22.71","0.005","90","","91.738","0.005","90","","2670.8","1.1","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H29 N3 O S -","- C32 H29 N3 O S -","- C128 H116 N12 O4 S4 -","4","1","","Jia-Qi Li; Rong-Zhen Liao; Wan-Jian Ding; Ying Cheng","Highly Efficient and Site-Selective [3 + 2] Cycloaddition of Carbene-Derived Ambident Dipoles with Ketenes for a Straightforward Synthesis of Spiro-Pyrrolidones","Journal of Organic Chemistry","2007","72","","6266","6269","10.1021/jo070759u","","","0.71073","MoKα","","0.1117","0.0458","","","0.0959","0.1207","","","","","","0.989","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024092","23.149","0.003","12.4217","0.0011","18.529","0.002","90","","125.65","","90","","4329.6","0.8","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C25 H20 Au Cl P S -","- C25 H20 Au Cl P S -","- C200 H160 Au8 Cl8 P8 S8 -","8","1","","Yoshihiro Matano; Tooru Miyajima; Hiroshi Imahori; Yoshifumi Kimura","Synthesis of 2-Aryl-5-styrylphospholes: Promising Candidates for the Phosphole-Based NLO Chromophores","Journal of Organic Chemistry","2007","72","","6200","6205","10.1021/jo070822f","","","0.7107","MoKα","","0.023","0.0216","","","0.0487","0.0494","","","","","","1.118","","","","has coordinates,has disorder","178419","2020-10-21","18:00:00",""
"4024093","10.342","0.001","7.731","0.001","20.344","0.003","90","","100.453","0.001","90","","1599.5","0.3","150","2","150","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","Paquette 1451","","","- C15 H18 N4 O6 -","- C15 H18 N4 O6 -","- C60 H72 N16 O24 -","4","2","","Emel Adaligil; Barry D. Davis; David G. Hilmey; Young Shen; Jason M. Spruell; Jennifer S. Brodbelt; K. N. Houk; Leo A. Paquette","Synthesis of, and Structural Assignments to the Stereoisomers of Bis (2,2')- and Tris (2,2',2' ')-Tetrahydrofurans: Conformational Features and Ionic Binding Capacities of These Gateway Polycyclic Networks","Journal of Organic Chemistry","2007","72","","6215","6223","10.1021/jo0708238","","x-ray","0.71073","MoKα","","0.0456","0.0371","","","0.0931","0.0978","","","","","","1.031","","","","has coordinates,has disorder","178419","2020-10-21","18:00:00",""
"4024094","16.3542","0.0003","17.9863","0.0003","18.0871","0.0004","66.749","0.001","85.227","0.001","63.118","0.001","4330.46","0.14","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C97 H86 Cl2 N4 O18 -","- C97 H86 Cl2 N4 O18 -","- C194 H172 Cl4 N8 O36 -","2","1","","Seung-Doo Jeong; Seong-Jin Hong; Kee Jong Park; Sihyun Ham; Jonathan L. Sessler; Vincent Lynch; Chang-Hee Lee","Core-Modified, meso-Alkylidenyl Porphyrins and Their Expanded Analogues: A New Family of Nonplanar Porphyrinoids","Journal of Organic Chemistry","2007","72","","6232","6240","10.1021/jo070872k","","","0.71073","MoKα","","0.1919","0.0676","","","0.1406","0.1834","","","","","","0.995","","","","has coordinates,has disorder","178419","2020-10-21","18:00:00",""
"4024095","13.3598","0.0003","18.5652","0.0004","23.1445","0.0006","71.668","0.001","84.352","0.001","77.554","0.001","5318.2","0.2","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C112 H120 N4 O16 S2 -","- C100 H92 N4 O16 S2 -","- C200 H184 N8 O32 S4 -","2","1","","Seung-Doo Jeong; Seong-Jin Hong; Kee Jong Park; Sihyun Ham; Jonathan L. Sessler; Vincent Lynch; Chang-Hee Lee","Core-Modified, meso-Alkylidenyl Porphyrins and Their Expanded Analogues: A New Family of Nonplanar Porphyrinoids","Journal of Organic Chemistry","2007","72","","6232","6240","10.1021/jo070872k","","","0.71073","MoKα","","0.1714","0.0762","","","0.1661","0.1831","","","","","","1.202","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024096","12.5773","0.0013","13.0527","0.0014","14.9394","0.0016","103.581","0.002","103.794","0.002","113.814","0.002","2022.1","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H42 N2 O9 -","- C48 H42 N2 O9 -","- C96 H84 N4 O18 -","2","1","","Seung-Doo Jeong; Seong-Jin Hong; Kee Jong Park; Sihyun Ham; Jonathan L. Sessler; Vincent Lynch; Chang-Hee Lee","Core-Modified, meso-Alkylidenyl Porphyrins and Their Expanded Analogues: A New Family of Nonplanar Porphyrinoids","Journal of Organic Chemistry","2007","72","","6232","6240","10.1021/jo070872k","","","0.71073","MoKα","","0.1533","0.0574","","","0.118","0.1523","","","","","","0.941","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024097","12.1293","0.0007","13.3588","0.0008","13.7337","0.0008","68.826","0.001","83.025","0.001","75.297","0.001","2006","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C47 H41 N3 O9 -","- C47 H41 N3 O9 -","- C94 H82 N6 O18 -","2","1","","Seung-Doo Jeong; Seong-Jin Hong; Kee Jong Park; Sihyun Ham; Jonathan L. Sessler; Vincent Lynch; Chang-Hee Lee","Core-Modified, meso-Alkylidenyl Porphyrins and Their Expanded Analogues: A New Family of Nonplanar Porphyrinoids","Journal of Organic Chemistry","2007","72","","6232","6240","10.1021/jo070872k","","","0.71073","MoKα","","0.1738","0.061","","","0.136","0.1795","","","","","","0.911","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024098","6.5412","0.0006","9.2157","0.0008","20.015","0.002","90","","90","","90","","1206.54","0.19","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-(1,1-dimethylethoxycarbonyl)-(pyrrolidin-2-yl)boronic acid","","- C9 H18 B N O4 -","- C9 H18 B N O4 -","- C36 H72 B4 N4 O16 -","4","1","","Andrei S. Batsanov; Christophe Grosjean; Thorben Schütz; Andrew Whiting","A (-)-Sparteine-Directed Highly Enantioselective Synthesis of Boroproline. Solid- and Solution-State Structure and Properties","Journal of Organic Chemistry","2007","72","","6276","6279","10.1021/jo0708792","","","0.71073","MoKα","","0.0326","0.0295","","","0.0735","0.075","","","","","","1.059","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024099","10.8981","0.001","8.7698","0.0008","10.9656","0.001","90","","91.19","0.01","90","","1047.8","0.2","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(S)-2-{(4S,5S)-4,5-diphenyl-[1,3,2]dioxaborolan-2-yl}- pyrrolidine-1-carboxylic acid tert-butyl ester","","- C23 H28 B N O4 -","- C23 H28 B N O4 -","- C46 H56 B2 N2 O8 -","2","1","","Andrei S. Batsanov; Christophe Grosjean; Thorben Schütz; Andrew Whiting","A (-)-Sparteine-Directed Highly Enantioselective Synthesis of Boroproline. Solid- and Solution-State Structure and Properties","Journal of Organic Chemistry","2007","72","","6276","6279","10.1021/jo0708792","","","0.71073","MoKα","","0.0497","0.0376","","","0.0791","0.084","","","","","","1.042","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024100","9.795","0.0016","8.637","0.0018","9.836","0.0015","90","","103.874","0.012","90","","807.8","0.2","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H22 O4 -","- C18 H24 O4 -","- C36 H48 O8 -","2","1","","Nathalie Lebrasseur; Julien Gagnepain; Aurélie Ozanne-Beaudenon; Jean-Michel Léger; Stéphane Quideau","Efficient Access to Orthoquinols and Their [4 + 2] Cyclodimers via SIBX-Mediated Hydroxylative Phenol Dearomatization","Journal of Organic Chemistry","2007","72","","6280","6283","10.1021/jo0708893","","","1.5418","CuKα","","0.0422","0.0315","","","0.0711","0.078","","","","","","1.053","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024101","6.7731","0.001","8.4962","0.0013","15.1193","0.0019","94.33","0.004","92.99","0.005","111.162","0.005","806.1","0.2","133","2","133","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H24 O4 -","- C18 H24 O4 -","- C36 H48 O8 -","2","1","","Nathalie Lebrasseur; Julien Gagnepain; Aurélie Ozanne-Beaudenon; Jean-Michel Léger; Stéphane Quideau","Efficient Access to Orthoquinols and Their [4 + 2] Cyclodimers via SIBX-Mediated Hydroxylative Phenol Dearomatization","Journal of Organic Chemistry","2007","72","","6280","6283","10.1021/jo0708893","","","1.5418","CuKα","","0.0487","0.0465","","","0.1361","0.143","","","","","","1.057","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024102","8.521","0.002","9.176","0.001","17.747","0.003","90","","90","","90","","1387.6","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H20 O4 -","- C16 H20 O4 -","- C64 H80 O16 -","4","1","","Nathalie Lebrasseur; Julien Gagnepain; Aurélie Ozanne-Beaudenon; Jean-Michel Léger; Stéphane Quideau","Efficient Access to Orthoquinols and Their [4 + 2] Cyclodimers via SIBX-Mediated Hydroxylative Phenol Dearomatization","Journal of Organic Chemistry","2007","72","","6280","6283","10.1021/jo0708893","","","1.5418","CuKα","","0.0412","0.0408","","","0.1088","0.1093","","","","","","1.078","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024103","10.143","0.0006","21.7743","0.0013","8.3134","0.0006","90","","105.954","0.004","90","","1765.3","0.2","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H28 O4 -","- C20 H28 O4 -","- C80 H112 O16 -","4","1","","Nathalie Lebrasseur; Julien Gagnepain; Aurélie Ozanne-Beaudenon; Jean-Michel Léger; Stéphane Quideau","Efficient Access to Orthoquinols and Their [4 + 2] Cyclodimers via SIBX-Mediated Hydroxylative Phenol Dearomatization","Journal of Organic Chemistry","2007","72","","6280","6283","10.1021/jo0708893","","","1.5418","CuKα","","0.0949","0.0859","","","0.2378","0.2414","","","","","","1.064","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024104","17.415","0.003","12.538","0.002","17.415","0.003","90","","113","","90","","3500.2","1.1","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H31 F12 N O2 P2 S2 -","- C32 H31 F12 N O2 P2 S2 -","- C128 H124 F48 N4 O8 P8 S8 -","4","1","","Bing-Jun Zhao; Henry J. Shine; John N. Marx; Cristina Hofmann; Kenton H. Whitmire","Addition of the Phenoxathiin Cation Radical to Alkenes and Nonconjugated Dienes. Formation of (E)- and (Z)-(10-Phenoxathiiniumyl)alkenes and (E)- and (Z)-(10-Phenoxathiiniumyl)dienes on Basic Alumina","Journal of Organic Chemistry","2007","72","","6154","6161","10.1021/jo070898b","","","0.71073","MoKα","","0.0873","0.0582","","","0.1579","0.1795","","","","","","1.055","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024105","8.5232","0.0017","9.801","0.002","11.406","0.002","104.63","0.003","90.817","0.003","106.22","0.003","881.5","0.3","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H15 F6 O P S -","- C16 H15 F6 O P S -","- C32 H30 F12 O2 P2 S2 -","2","1","","Bing-Jun Zhao; Henry J. Shine; John N. Marx; Cristina Hofmann; Kenton H. Whitmire","Addition of the Phenoxathiin Cation Radical to Alkenes and Nonconjugated Dienes. Formation of (E)- and (Z)-(10-Phenoxathiiniumyl)alkenes and (E)- and (Z)-(10-Phenoxathiiniumyl)dienes on Basic Alumina","Journal of Organic Chemistry","2007","72","","6154","6161","10.1021/jo070898b","","","0.71073","MoKα","","0.1509","0.0845","","","0.1978","0.231","","","","","","1.026","","","","has coordinates,has disorder","178420","2020-10-21","18:00:00",""
"4024106","8.083","0.001","11.4021","0.0013","14.4056","0.0017","92.201","0.004","90.443","0.004","104.495","0.005","1284.3","0.3","220","2","220","2","","","","","","","Synthesized by the authors. See text","4","P 1","P 1","1","","","","- C10 H17 N3 O5 -","- C10 H17 N3 O5 -","- C40 H68 N12 O20 -","4","4","","Olivier Loiseleur; Dougal Ritson; Mafalda Nina; Patrick Crowley; Trixie Wagner; Stephen Hanessian","Ring-Modified Analogues and Molecular Dynamics Studies To Probe the Requirements for Fungicidal Activities of Malayamycin A and Its N-Nucleoside Variants","Journal of Organic Chemistry","2007","72","","6353","6363","10.1021/jo070520d","","","1.54178","CuKα","","0.0506","0.0482","","","0.1284","0.1318","","","","","","1.041","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024107","11.23","0.002","13.374","0.003","25.007","0.005","90","","90","","90","","3755.8","1.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15.5 H26.5 N5 O6.25 -","- C15.5 H26.5 N5 O6.25 -","- C124 H212 N40 O50 -","8","2","","Olivier Loiseleur; Dougal Ritson; Mafalda Nina; Patrick Crowley; Trixie Wagner; Stephen Hanessian","Ring-Modified Analogues and Molecular Dynamics Studies To Probe the Requirements for Fungicidal Activities of Malayamycin A and Its N-Nucleoside Variants","Journal of Organic Chemistry","2007","72","","6353","6363","10.1021/jo070520d","","","1.54178","CuKα","","0.051","0.0439","","","0.0943","0.098","","","","","","1.092","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024108","10.7003","0.0017","14.395","0.002","8.1812","0.0013","90","","90","","90","","1260.2","0.4","150","2","150","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C15 H13 N3 O -","- C15 H13 N3 O -","- C60 H52 N12 O4 -","4","1","","Rodney F. Klima; Abhijit V. Jadhav; Pradeep N. D. Singh; Mingxin Chang; Christine Vanos; Jagadis Sankaranarayanan; Mai Vu; Nazarin Ibrahim; Elaine Ross; Shaun McCloskey; Rajesh S. Murthy; Jeanette A. Krause; Bruce S. Ault; Anna D. Gudmundsdóttir","Photoinduced C-N Bond Cleavage in 2-Azido-1,3-diphenyl-propan-1-one Derivatives: Photorelease of Hydrazoic Acid","Journal of Organic Chemistry","2007","72","","6372","6381","10.1021/jo070558q","","","0.71073","MoKα","","0.0606","0.0559","","","0.1295","0.1319","","","","","","1.111","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024109","16.5672","0.0018","5.917","0.0006","23.228","0.003","90","","104.453","0.002","90","","2204.9","0.4","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 O2 -","- C30 H24 O2 -","- C120 H96 O8 -","4","1","","Rodney F. Klima; Abhijit V. Jadhav; Pradeep N. D. Singh; Mingxin Chang; Christine Vanos; Jagadis Sankaranarayanan; Mai Vu; Nazarin Ibrahim; Elaine Ross; Shaun McCloskey; Rajesh S. Murthy; Jeanette A. Krause; Bruce S. Ault; Anna D. Gudmundsdóttir","Photoinduced C-N Bond Cleavage in 2-Azido-1,3-diphenyl-propan-1-one Derivatives: Photorelease of Hydrazoic Acid","Journal of Organic Chemistry","2007","72","","6372","6381","10.1021/jo070558q","","","0.71073","MoKα","","0.1313","0.0665","","","0.1228","0.1419","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024110","12.273","0.003","21.104","0.005","12.788","0.003","90","","101.141","0.004","90","","3249.8","1.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H33 Cl6 N -","- C34 H33 Cl6 N -","- C136 H132 Cl24 N4 -","4","1","","Ling Zhou; Tao-Xiang Zhang; Bing-Rui Li; Xiao-Ping Cao; Dietmar Kuck","C~3v~-Symmetrical Tribenzotriquinacenes Extended by Six C~1~-Functional Groups and the First Triquinacene-Based Tris(dithiametacyclophanes)","Journal of Organic Chemistry","2007","72","","6382","6389","10.1021/jo070565e","","","0.71073","MoKα","","0.1091","0.058","","","0.1385","0.1773","","","","","","1.018","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024111","10.1378","0.0004","11.5653","0.0004","12.6616","0.0005","75.685","0.002","79.458","0.002","68.905","0.002","1334.77","0.09","294","2","294","2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H36 O8 -","- C32 H35 O8 -","- C64 H70 O16 -","2","1","","Ling Zhou; Tao-Xiang Zhang; Bing-Rui Li; Xiao-Ping Cao; Dietmar Kuck","C~3v~-Symmetrical Tribenzotriquinacenes Extended by Six C~1~-Functional Groups and the First Triquinacene-Based Tris(dithiametacyclophanes)","Journal of Organic Chemistry","2007","72","","6382","6389","10.1021/jo070565e","","","0.71073","MoKα","","0.0851","0.0616","","","0.1736","0.1952","","","","","","1.212","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024112","15.031","0.0006","12.7781","0.0005","9.6823","0.0004","90","","90","","90","","1859.66","0.13","294","2","294","2","","","","","","","","4","P m n 21","P 2ac -2","31","","","","- C39 H50 Cl2 S6 -","- C39 H50 Cl2 S6 -","- C78 H100 Cl4 S12 -","2","0.5","","Ling Zhou; Tao-Xiang Zhang; Bing-Rui Li; Xiao-Ping Cao; Dietmar Kuck","C~3v~-Symmetrical Tribenzotriquinacenes Extended by Six C~1~-Functional Groups and the First Triquinacene-Based Tris(dithiametacyclophanes)","Journal of Organic Chemistry","2007","72","","6382","6389","10.1021/jo070565e","","","0.71073","MoKα","","0.0684","0.0627","","","0.171","0.1766","","","","","","1.057","","","","has coordinates,has disorder","178420","2020-10-21","18:00:00",""
"4024113","11.5676","0.0009","11.7065","0.0009","17.1424","0.0015","80.568","0.004","83.11","0.004","82.016","0.004","2256.5","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C43 H50 Cl6 S6 -","- C43 H50 Cl6 S6 -","- C86 H100 Cl12 S12 -","2","1","","Ling Zhou; Tao-Xiang Zhang; Bing-Rui Li; Xiao-Ping Cao; Dietmar Kuck","C~3v~-Symmetrical Tribenzotriquinacenes Extended by Six C~1~-Functional Groups and the First Triquinacene-Based Tris(dithiametacyclophanes)","Journal of Organic Chemistry","2007","72","","6382","6389","10.1021/jo070565e","","","0.71073","MoKα","","0.0797","0.057","","","0.1326","0.1498","","","","","","0.988","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024114","7.51","0.005","12.824","0.005","13.261","0.007","73.61","0.03","78.8","0.03","87.33","0.03","1201.9","1.1","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Compound 2a","4-Methoxy-10,11-dihydrocyclohepta[c]chromene-6,9-dione, compound 2a","","- C15 H12 O4 -","- C15 H12 O4 -","- C60 H48 O16 -","4","2","","Marie Varin; Angéle Chiaroni; Jean-Yves Lallemand; Bogdan Iorga; Catherine Guillou","A New Access to Dihydrotropones through Ring Expansion of Spirocyclohexadienones: Synthesis and Mechanism","Journal of Organic Chemistry","2007","72","","6421","6426","10.1021/jo070594p","","","0.71073","MoKα","","0.0779","0.0486","","","0.1101","0.1272","","","","","","1.024","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024115","15.5426","0.0008","8.5151","0.0004","17.1816","0.0008","90","","90","","90","","2273.93","0.19","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","compound (6)","6-Hydroxy-2,2,5,8-tetramethylchroman","","- C13 H18 O2 -","- C13 H18 O2 -","- C104 H144 O16 -","8","1","","Anjan Patel; Falk Liebner; Thomas Netscher; Kurt Mereiter; Thomas Rosenau","Vitamin E Chemistry. Nitration of Non-α-tocopherols: Products and Mechanistic Considerations","Journal of Organic Chemistry","2007","72","","6504","6512","10.1021/jo0706832","","","0.71073","MoKα","","0.0463","0.042","","","0.1161","0.1209","","","","","","1.052","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024116","22.4807","0.0012","10.3086","0.0005","22.0953","0.0012","90","","114.706","0.001","90","","4651.8","0.4","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","compound (7)","6-Hydroxy-2,2,5,8-tetramethylchroman","","- C13 H18 O2 -","- C13 H18 O2 -","- C208 H288 O32 -","16","2","","Anjan Patel; Falk Liebner; Thomas Netscher; Kurt Mereiter; Thomas Rosenau","Vitamin E Chemistry. Nitration of Non-α-tocopherols: Products and Mechanistic Considerations","Journal of Organic Chemistry","2007","72","","6504","6512","10.1021/jo0706832","","","0.71073","MoKα","","0.0554","0.0462","","","0.1225","0.1309","","","","","","1.02","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024117","16.2752","0.0014","11.8402","0.001","8.8053","0.0008","90","","97.757","0.002","90","","1681.3","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","compound (8a)","4-Nitro-benzoic acid 2,2,8-trimethyl-chroman-6-yl ester","","- C19 H19 N O5 -","- C19 H19 N O5 -","- C76 H76 N4 O20 -","4","1","","Anjan Patel; Falk Liebner; Thomas Netscher; Kurt Mereiter; Thomas Rosenau","Vitamin E Chemistry. Nitration of Non-α-tocopherols: Products and Mechanistic Considerations","Journal of Organic Chemistry","2007","72","","6504","6512","10.1021/jo0706832","","","0.71073","MoKα","","0.0525","0.0429","","","0.1144","0.1231","","","","","","1.026","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024118","8.8349","0.0013","7.2041","0.0011","19.113","0.003","90","","94.448","0.003","90","","1212.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","compound (14)","6-Hydroxy-7-nitro-2,2,5,8-tetramethylchroman","","- C13 H17 N O4 -","- C13 H17 N O4 -","- C52 H68 N4 O16 -","4","1","","Anjan Patel; Falk Liebner; Thomas Netscher; Kurt Mereiter; Thomas Rosenau","Vitamin E Chemistry. Nitration of Non-α-tocopherols: Products and Mechanistic Considerations","Journal of Organic Chemistry","2007","72","","6504","6512","10.1021/jo0706832","","","0.71073","MoKα","","0.0656","0.043","","","0.1033","0.1146","","","","","","0.929","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024119","11.139","0.005","16.477","0.007","7.087","0.003","90","","90","","90","","1300.8","0.9","297","2","297","2","","","","","","","","4","P n a 21","P 2c -2n","33","compound (16)","6-Hydroxy-5-nitro-2,2,7,8-tetramethylchroman","","- C13 H17 N O4 -","- C12.992 H17 N O4 -","- C51.968 H68 N4 O16 -","4","1","","Anjan Patel; Falk Liebner; Thomas Netscher; Kurt Mereiter; Thomas Rosenau","Vitamin E Chemistry. Nitration of Non-α-tocopherols: Products and Mechanistic Considerations","Journal of Organic Chemistry","2007","72","","6504","6512","10.1021/jo0706832","","","0.71073","MoKα","","0.1635","0.0489","","","0.0956","0.1303","","","","","","0.776","","","","has coordinates,has disorder","178420","2020-10-21","18:00:00",""
"4024120","6.7561","0.0014","9.35","0.0019","9.6965","0.0019","108.101","0.004","91.717","0.004","96.312","0.004","577.4","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","compound (23)","6-Hydroxy-5-nitro-2,2,8-trimethylchroman","","- C12 H15 N O4 -","- C12 H15 N O4 -","- C24 H30 N2 O8 -","2","1","","Anjan Patel; Falk Liebner; Thomas Netscher; Kurt Mereiter; Thomas Rosenau","Vitamin E Chemistry. Nitration of Non-α-tocopherols: Products and Mechanistic Considerations","Journal of Organic Chemistry","2007","72","","6504","6512","10.1021/jo0706832","","","0.71073","MoKα","","0.0659","0.0495","","","0.1267","0.137","","","","","","1.06","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024121","10.4534","0.0008","14.3766","0.0011","9.4672","0.0007","90","","114.346","0.002","90","","1296.25","0.17","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","compound (25)","6-Hydroxy-5,7-dinitro-2,2,8-trimethylchroman","","- C12 H14 N2 O6 -","- C12 H14 N2 O6 -","- C48 H56 N8 O24 -","4","1","","Anjan Patel; Falk Liebner; Thomas Netscher; Kurt Mereiter; Thomas Rosenau","Vitamin E Chemistry. Nitration of Non-α-tocopherols: Products and Mechanistic Considerations","Journal of Organic Chemistry","2007","72","","6504","6512","10.1021/jo0706832","","","0.71073","MoKα","","0.0475","0.0409","","","0.118","0.1232","","","","","","1.069","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024122","10.332","0.002","6.883","0.001","10.983","0.002","90","","116.71","0.02","90","","697.7","0.2","293","2","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C15 H7 N3 S2 -","- C15 H7 N3 S2 -","- C30 H14 N6 S4 -","2","0.5","","Silvia Alías; Raquel Andreu; María Jesús Blesa; Santiago Franco; Javier Garín; Aurora Gragera; Jesús Orduna; Pilar Romero; Belén Villacampa; Magali Allain","Synthesis, Structure, and Optical Properties of 1,4-Dithiafulvene-Based Nonlinear Optic-phores","Journal of Organic Chemistry","2007","72","","6440","6446","10.1021/jo070694v","","x-ray","0.71073","MoKα","","","0.0411","","","","0.0878","","","","","","0.88","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024123","12.432","0.0002","16.2601","0.0003","17.7369","0.0003","74.3751","0.0009","83.9217","0.0009","74.2005","0.0008","3320.44","0.1","173.1","","","","","","","","","","","4","P 1","P 1","1","","","","- C36 H32 O8 S4 -","- C36 H32 O8 S4 -","- C144 H128 O32 S16 -","4","4","","Takanori Shibata; Hiroshi Kurokawa; Kazumasa Kanda","Enantioselective Intramolecular [2 + 2 + 2] Cycloaddition of Enediynes for the Synthesis of Chiral Cyclohexa-1,3-dienes","Journal of Organic Chemistry","2007","72","","6521","6525","10.1021/jo070762d","","","1.54187","CuKα","","","0.0482","","","","0.0556","","","","","","6.39","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024124","9.968","0.001","18.833","0.003","18.415","0.003","90","","95.555","0.003","90","","3440.8","0.9","193","2","193","2","","","","","","","Lash laboratory","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H33 N3 Ni O2 -","- C48 H33 N3 Ni O2 -","- C192 H132 N12 Ni4 O8 -","4","1","","Timothy D. Lash; Joseph T. Szymanski; Gregory M. Ferrence","Tetraaryldimethoxybenziporphyrins. At the Edge of Carbaporphyrinoid Aromaticity","Journal of Organic Chemistry","2007","72","","6481","6492","10.1021/jo070947k","","x-ray","0.71073","MoKα","","0.084","0.0676","","","0.1895","0.2066","","","","","","1.034","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024125","8.1386","0.0003","10.7325","0.0004","15.5997","0.0006","90","","90","","90","","1362.6","0.09","93","2","93","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","12a","","","- C13 H17 N O2 S -","- C13 H17 N O2 S -","- C52 H68 N4 O8 S4 -","4","1","","Alan R. Katritzky; Niveen M. Khashab; Danniebelle N. Haase; Megumi Yoshioka; Ion Ghiviriga; Peter J. Steel","C-Aminoimidoylation and C-Thiocarbamoylation of Esters, Sulfones, and Ketones","Journal of Organic Chemistry","2007","72","","6742","6748","10.1021/jo070545c","","","0.71073","MoKα","","0.0248","0.0244","","","0.0665","0.0669","","","","","","1.078","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024126","14.3023","0.0004","5.775","0.0002","17.5354","0.0005","90","","112.69","0.001","90","","1336.26","0.07","93","2","93","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","19a","","","- C14 H13 N O S2 -","- C14 H13 N O S2 -","- C56 H52 N4 O4 S8 -","4","1","","Alan R. Katritzky; Niveen M. Khashab; Danniebelle N. Haase; Megumi Yoshioka; Ion Ghiviriga; Peter J. Steel","C-Aminoimidoylation and C-Thiocarbamoylation of Esters, Sulfones, and Ketones","Journal of Organic Chemistry","2007","72","","6742","6748","10.1021/jo070545c","","","0.71073","MoKα","","0.0293","0.0284","","","0.0752","0.0758","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024127","10.6521","0.0009","12.8865","0.0011","25.943","0.002","95.385","0.005","91.957","0.005","100.719","0.005","3478.7","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H94 N8 O7 S3 -","- C74 H94 N8 O7 S3 -","- C148 H188 N16 O14 S6 -","2","1","","Simona Curreli; Eduardo C. Escudero-Adán; Jordi Benet-Buchholz; Arjan W. Kleij","Facile Isolation of Bisimines Based on 3,3'-Diaminobenzidine: Direct Access to Unsymmetrical Bimetallic Salphen Building Blocks","Journal of Organic Chemistry","2007","72","","7018","7021","10.1021/jo070696f","","","0.71073","MoKα","","0.1392","0.0884","","","0.2244","0.2661","","","","","","0.991","","","","has coordinates,has disorder","178420","2020-10-21","18:00:00",""
"4024128","9.5658","0.0014","8.8883","0.0013","17.097","0.003","90","","91.981","0.002","90","","1452.7","0.4","100","2","273","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H17 F -","- C20 H17 F -","- C80 H68 F4 -","4","1","","Guan-You Lin; Chun-Yao Yang; Rai-Shung Liu","Gold-Catalyzed Synthesis of Bicyclo[4.3.0]nonadiene Derivatives via Tandem 6-endo-dig/Nazarov Cyclization of 1,6-Allenynes","Journal of Organic Chemistry","2007","72","","6753","6757","10.1021/jo0707939","","","0.71073","MoKα","","0.0584","0.0488","","","0.1312","0.139","","","","","","1.064","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024129","17.086","0.005","38.818","0.012","11.632","0.004","90","","96.54","0.005","90","","7665","4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C44 H52 N3 -","- C41 H45 N3 -","- C328 H360 N24 -","8","2","","Eric L. Spitler; Sean P. McClintock; Michael M. Haley","Dynamic Proton-Induced Emission Switching in Donor-Functionalized Dehydrobenzopyrid[15]annulenes","Journal of Organic Chemistry","2007","72","","6692","6699","10.1021/jo070827c","","","0.71073","MoKα","","0.159","0.0981","","","0.2457","0.2805","","","","","","1.041","","","","has coordinates,has disorder","178420","2020-10-21","18:00:00",""
"4024130","9.182","0.002","14.218","0.004","14.92","0.004","75.347","0.004","82.272","0.004","76.899","0.004","1829.2","0.8","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C43 H49 N3 O -","- C41 H45 N3 -","- C82 H90 N6 -","2","1","","Eric L. Spitler; Sean P. McClintock; Michael M. Haley","Dynamic Proton-Induced Emission Switching in Donor-Functionalized Dehydrobenzopyrid[15]annulenes","Journal of Organic Chemistry","2007","72","","6692","6699","10.1021/jo070827c","","","0.71073","MoKα","","0.0604","0.0488","","","0.1403","0.1498","","","","","","1.051","","","","has coordinates,has disorder","178420","2020-10-21","18:00:00",""
"4024131","7.3056","0.0014","9.6015","0.0018","15.749","0.003","90","","101.937","0.003","90","","1080.8","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H26 N6 O2 -","- C22 H26 N6 O2 -","- C44 H52 N12 O4 -","2","0.5","","Philip C. Haussmann; Saeed I. Khan; J. Fraser Stoddart","Equilibrating Dynamic [2]Rotaxanes","Journal of Organic Chemistry","2007","72","","6708","6713","10.1021/jo0708590","","","0.71073","MoKα","","0.0677","0.0413","","","0.1005","0.1122","","","","","","0.949","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4024132","12.407","0.006","8.095","0.004","15.533","0.007","90","","95.256","0.008","90","","1553.6","1.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Mesityl-O-S(O)(CF3)=N-SO2CF3 (3g)","","","- C11 H11 F6 N O4 S2 -","- C11 H11 F6 N O4 S2 -","- C44 H44 F24 N4 O16 S8 -","4","1","","Kenneth K. Laali; Takao Okazaki; Scott D. Bunge","N-(Trifluoromethylsulfonyl)aryloxytrifluoromethylsulfoximines [ArO-SO(CF~3~)=NTf and N-Aryltriflimides Ar-N(Tf)~2~ by Thermal and Photolytic Dediazoniation of [ArN~2~][BF~4~] in [BMIM][Tf~2~N] Ionic Liquid: Exploiting the Ambident Nucleophilic Character of a ""Nonnucleophilic"" Anion","Journal of Organic Chemistry","2007","72","","6758","6762","10.1021/jo0708801","","","0.71073","MoKα","","0.1252","0.0816","","","0.205","0.2362","","","","","","1.035","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024133","16.126","0.003","21.227","0.003","16.074","0.004","90","","90","","90","","5502.2","1.9","297","2","297","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C24 H35 N3 O8 -","- C24 H35 N3 O8 -","- C192 H280 N24 O64 -","8","1","","Deekonda Srinivas; Rajesh Gonnade; Sapna Ravindranathan; Gangadhar J. Sanjayan","Conformationally Constrained Aliphatic-Aromatic Amino-Acid-Conjugated Hybrid Foldamers with Periodic β-Turn Motifs","Journal of Organic Chemistry","2007","72","","7022","7025","10.1021/jo0709044","","","0.71073","MoKα","","0.1093","0.0695","","","0.1492","0.1653","","","","","","1.074","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024134","9.0593","0.0009","12.9316","0.0013","15.2798","0.0015","113.073","0.002","95.164","0.002","98.212","0.002","1608.9","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C78 H90 N4 S2 -","- C78 H90 N4 S2 -","- C78 H90 N4 S2 -","1","0.5","","Martina Hauck; Jan Schönhaber; Anthony J. Zucchero; Kenneth I. Hardcastle; Thomas J. J. Müller; Uwe H. F. Bunz","Phenothiazine Cruciforms: Synthesis and Metallochromic Properties","Journal of Organic Chemistry","2007","72","","6714","6725","10.1021/jo070922l","","","0.71073","MoKα","","0.0926","0.0712","","","0.1704","0.1837","","","","","","1.083","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024135","7.1887","0.0001","7.5136","0.0001","9.5782","0.0001","90","","96.1275","0.0009","90","","514.392","0.011","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C10 H12 Cl N O3 -","- C10 H12 Cl N O3 -","- C20 H24 Cl2 N2 O6 -","2","1","","Nicolas Joubert; Radek Pohl; Blanka Klepetářová; Michal Hocek","Modular and Practical Synthesis of 6-Substituted Pyridin-3-yl C-Nucleosides","Journal of Organic Chemistry","2007","72","","6797","6805","10.1021/jo0709504","","","1.54184","CuKα","","0.029","0.0288","","0.0328","0.0327","0.0327","","","","","","0.9217","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024136","5.6723","0.0001","10.6767","0.0001","19.435","0.0001","90","","90","","90","","1177.01","0.02","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H18 N2 O3 -","- C12 H18 N2 O3 -","- C48 H72 N8 O12 -","4","1","","Nicolas Joubert; Radek Pohl; Blanka Klepetářová; Michal Hocek","Modular and Practical Synthesis of 6-Substituted Pyridin-3-yl C-Nucleosides","Journal of Organic Chemistry","2007","72","","6797","6805","10.1021/jo0709504","","","1.54184","CuKα","","0.0401","0.034","","0.044","0.0374","0.0374","","","","","","1.098","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024137","9.1592","0.0004","10.477","0.0004","12.342","0.0005","90","","90.81","0.001","90","","1184.23","0.08","163","2","163","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 N2 O -","- C14 H16 N2 O -","- C56 H64 N8 O4 -","4","1","","Claudia L. Molina; Chun P. Chow; Kenneth J. Shea","Intramolecular N-Acylazo Diels-Alder Reaction: Regio- and Stereoselective Synthesis of Bridgehead Bicyclic 1,2-Diazines","Journal of Organic Chemistry","2007","72","","6816","6823","10.1021/jo070978f","","","0.71073","MoKα","","0.0401","0.0347","","","0.0861","0.0905","","","","","","1.023","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024138","8.9659","0.0008","13.189","0.0012","10.8474","0.001","90","","100.93","0.002","90","","1259.4","0.2","163","2","163","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 N2 O -","- C15 H18 N2 O -","- C60 H72 N8 O4 -","4","1","","Claudia L. Molina; Chun P. Chow; Kenneth J. Shea","Intramolecular N-Acylazo Diels-Alder Reaction: Regio- and Stereoselective Synthesis of Bridgehead Bicyclic 1,2-Diazines","Journal of Organic Chemistry","2007","72","","6816","6823","10.1021/jo070978f","","","0.71073","MoKα","","0.0418","0.0356","","","0.0891","0.0949","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024139","21.341","0.002","9.6458","0.0007","13.273","0.001","90","","90","","90","","2732.2","0.4","296.2","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H37 N O2 -","- C31 H37 N O2 -","- C124 H148 N4 O8 -","4","1","","Hideko Koshima; Michitaro Fukano; Hidehiro Uekusa","Diastereospecific Photocyclization of a Isopropylbenzophenone Derivative in Crystals and the Morphological Changes","Journal of Organic Chemistry","2007","72","","6786","6791","10.1021/jo071005i","","","1.5418","CuK'a","","","0.092","","","","0.2123","","","","","","1.201","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024140","10.1187","0.0015","9.4944","0.0014","14.032","0.002","90","","97.056","0.008","90","","1337.8","0.3","296.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C31 H37 N O2 -","- C31 H37 N O2 -","- C62 H74 N2 O4 -","2","1","","Hideko Koshima; Michitaro Fukano; Hidehiro Uekusa","Diastereospecific Photocyclization of a Isopropylbenzophenone Derivative in Crystals and the Morphological Changes","Journal of Organic Chemistry","2007","72","","6786","6791","10.1021/jo071005i","","","1.54178","CuK'a","","","0.0542","","","","0.1711","","","","","","1.258","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024141","11.125","0.0008","11.125","0.0008","22.9386","0.0019","90","","90","","90","","2839","0.4","296.1","","","","","","","","","","","4","P 41","P 4w","76","","","","- C31 H37 N O2 -","- C31 H37 N O2 -","- C124 H148 N4 O8 -","4","1","","Hideko Koshima; Michitaro Fukano; Hidehiro Uekusa","Diastereospecific Photocyclization of a Isopropylbenzophenone Derivative in Crystals and the Morphological Changes","Journal of Organic Chemistry","2007","72","","6786","6791","10.1021/jo071005i","","","1.54187","CuK'a","","","0.0625","","","","0.189","","","","","","1.268","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024142","12.434","0.002","16.122","0.003","12.667","0.002","90","","104.923","0.004","90","","2453.6","0.8","213","2","213","2","","","","","","","","5","P 1 21 1","P 2yb","4","inv-CB6","inv-CB6","","- C36 H56.4 Cl N24 O21.7 -","- C36 H56.428 Cl N24 O21.714 -","- C72 H112.856 Cl2 N48 O43.428 -","2","1","","Simin Liu; Kimoon Kim; Lyle Isaacs","Mechanism of the Conversion of Inverted CB[6] to CB[6]","Journal of Organic Chemistry","2007","72","","6840","6847","10.1021/jo071034t","","","0.71073","MoKα","","0.0649","0.0431","","","0.0998","0.1129","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024143","10.4389","0.0018","16.491","0.003","22.816","0.004","90","","90","","90","","3927.8","1.2","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C39 H34 Cl4 O4 P2 Pd Ru -","- C39 H34 Cl4 O4 P2 Pd Ru -","- C156 H136 Cl16 O16 P8 Pd4 Ru4 -","4","1","","Delong Liu; Fang Xie; Wanbin Zhang","Novel C~2~-Symmetric Planar Chiral Diphosphine Ligands and Their Application in Pd-Catalyzed Asymmetric Allylic Substitutions","Journal of Organic Chemistry","2007","72","","6992","6997","10.1021/jo0711440","","","0.71073","MoKα","","0.0459","0.0385","","","0.0732","0.0757","","","","","","0.935","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024144","10.0342","0.0006","20.4049","0.0012","42.599","0.003","90","","90","","90","","8722","0.9","293","2","293","2","","","","","","","","7","C 2 2 21","C 2c 2","20","","","","- C41 H36 Cl6 O4 P2 Pd Ru -","- C41 H36 Cl5.5 O4 P2 Pd Ru -","- C328 H288 Cl44 O32 P16 Pd8 Ru8 -","8","1","","Delong Liu; Fang Xie; Wanbin Zhang","Novel C~2~-Symmetric Planar Chiral Diphosphine Ligands and Their Application in Pd-Catalyzed Asymmetric Allylic Substitutions","Journal of Organic Chemistry","2007","72","","6992","6997","10.1021/jo0711440","","","0.71073","MoKα","","0.0945","0.0673","","","0.1258","0.1399","","","","","","1.019","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024145","10.5308","0.0005","10.5308","0.0005","35.165","0.002","90","","90","","90","","3899.7","0.4","293","2","293","2","","","","","","","","7","P 43","P 4cw","78","","","","- C39 H34 Cl4 Fe O4 P2 Pd -","- C39 H34 Cl4 Fe O4 P2 Pd -","- C156 H136 Cl16 Fe4 O16 P8 Pd4 -","4","1","","Delong Liu; Fang Xie; Wanbin Zhang","Novel C~2~-Symmetric Planar Chiral Diphosphine Ligands and Their Application in Pd-Catalyzed Asymmetric Allylic Substitutions","Journal of Organic Chemistry","2007","72","","6992","6997","10.1021/jo0711440","","","0.71073","MoKα","","0.06","0.0468","","","0.1021","0.1161","","","","","","0.915","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024146","10.4928","0.0006","17.4542","0.001","21.2109","0.0013","90","","91.888","0.001","90","","3882.5","0.4","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C40.5 H37 Cl3 Fe O4 P2 Pd -","- C40.5 H37 Cl3 Fe O4 P2 Pd -","- C162 H148 Cl12 Fe4 O16 P8 Pd4 -","4","2","","Delong Liu; Fang Xie; Wanbin Zhang","Novel C~2~-Symmetric Planar Chiral Diphosphine Ligands and Their Application in Pd-Catalyzed Asymmetric Allylic Substitutions","Journal of Organic Chemistry","2007","72","","6992","6997","10.1021/jo0711440","","","0.71073","MoKα","","0.0694","0.0502","","","0.1101","0.1336","","","","","","0.969","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024147","23.419","0.004","11.296","0.002","12.658","0.002","90","","90","","90","","3348.5","1","165","2","165","2","","","","","","","","8","P 21 21 2","P 2 2ab","18","","","","- C34 H28 Ag F3 N O5 P S2 -","- C34 H28 Ag F3 N O5 P S2 -","- C136 H112 Ag4 F12 N4 O20 P4 S8 -","4","1","","Medha N. Kamat; Nigam P. Rath; Alexei V. Demchenko","Versatile Synthesis and Mechanism of Activation of S-Benzoxazolyl Glycosides","Journal of Organic Chemistry","2007","72","","6938","6946","10.1021/jo0711844","","","0.71073","MoKα","","0.1412","0.1192","","","0.2748","0.2803","","","","","","1.984","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024148","10.5853","0.0003","14.0278","0.0004","14.5458","0.0004","63.584","0.001","86.746","0.002","72.257","0.002","1834.47","0.09","170","2","170","2","","","","","","","","5","P 1","P 1","1","","","","- C41 H31 N O10 S -","- C41 H31 N O10 S -","- C82 H62 N2 O20 S2 -","2","2","","Medha N. Kamat; Nigam P. Rath; Alexei V. Demchenko","Versatile Synthesis and Mechanism of Activation of S-Benzoxazolyl Glycosides","Journal of Organic Chemistry","2007","72","","6938","6946","10.1021/jo0711844","","","0.71073","MoKα","","0.1256","0.0769","","","0.1891","0.2234","","","","","","1.023","","","","has coordinates,has disorder","178420","2020-10-21","18:00:00",""
"4024149","14.5994","0.0016","6.3161","0.0008","14.6613","0.0017","90","","105.935","0.007","90","","1300","0.3","165","2","165","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C26 H27 N O9 S -","- C26 H27 N O9 S -","- C52 H54 N2 O18 S2 -","2","1","","Medha N. Kamat; Nigam P. Rath; Alexei V. Demchenko","Versatile Synthesis and Mechanism of Activation of S-Benzoxazolyl Glycosides","Journal of Organic Chemistry","2007","72","","6938","6946","10.1021/jo0711844","","","0.71073","MoKα","","0.2833","0.0843","","","0.1149","0.1652","","","","","","1.001","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024150","4.3258","0.0002","8.982","0.0004","8.4721","0.0004","90","","90.594","0.003","90","","329.16","0.03","165","2","165","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C7 H5 N O S -","- C7 H5 N O S -","- C14 H10 N2 O2 S2 -","2","1","","Medha N. Kamat; Nigam P. Rath; Alexei V. Demchenko","Versatile Synthesis and Mechanism of Activation of S-Benzoxazolyl Glycosides","Journal of Organic Chemistry","2007","72","","6938","6946","10.1021/jo0711844","","","0.71073","MoKα","","0.0538","0.0398","","","0.0677","0.0702","","","","","","1.025","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024151","25.5198","0.0008","5.0809","0.0002","20.1359","0.0007","90","","90","","90","","2610.89","0.16","100","2","100","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C9 H10 F3 N O5 S2 -","- C9 H10 F3 N O5 S2 -","- C72 H80 F24 N8 O40 S16 -","8","2","","Medha N. Kamat; Nigam P. Rath; Alexei V. Demchenko","Versatile Synthesis and Mechanism of Activation of S-Benzoxazolyl Glycosides","Journal of Organic Chemistry","2007","72","","6938","6946","10.1021/jo0711844","","","0.71073","MoKα","","0.0462","0.0353","","","0.0697","0.0749","","","","","","1.02","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024152","6.0966","0.0002","15.7561","0.0007","8.7435","0.0003","90","","103.906","0.003","90","","815.27","0.05","100","2","100","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C19 H20 N2 O2 -","- C19 H20 N2 O2 -","- C38 H40 N4 O4 -","2","1","","Jesús López-Cantarero; M. Belén Cid; Thomas B. Poulsen; Marco Bella; José Luis García Ruano; Karl Anker Jørgensen","Intriguing Behavior of Cinchona Alkaloids in the Enantioselective Organocatalytic Hydroxyamination of α-Substituted-α-cyanoacetates","Journal of Organic Chemistry","2007","72","","7062","7065","10.1021/jo071186o","","x-ray","1.54178","CuKα","","0.0304","0.0294","","","0.0713","0.0717","","","","","","1.08","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024153","8.5337","0.0008","12.4631","0.0011","15.9278","0.0014","90","","90","","90","","1694","0.3","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H26 O3 -","- C19 H26 O3 -","- C76 H104 O12 -","4","1","","Xiaomei Wei; Ileana I. Rodríguez; Abimael D. Rodríguez; Charles L. Barnes","Caribenols A and B, Sea Whip Derived Norditerpenes with Novel Tricarbocyclic Skeletons","Journal of Organic Chemistry","2007","72","","7386","7389","10.1021/jo070649n","","","0.71073","MoKα","","0.0416","0.0337","","","0.0747","0.0779","","","","","","1.059","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024154","6.6822","0.0008","7.4362","0.001","16.416","0.003","90","","99.948","0.017","90","","803.4","0.2","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H23 N O5 -","- C18 H23 N O5 -","- C36 H46 N2 O10 -","2","1","","Subhankar Tripathi; Biswajit G. Roy; Michael G. B. Drew; Basudeb Achari; Sukhendu B. Mandal","Synthesis of Oxepane Ring Containing Monocyclic, Conformationally Restricted Bicyclic and Spirocyclic Nucleosides from D-Glucose: A Cycloaddition Approach","Journal of Organic Chemistry","2007","72","","7427","7430","10.1021/jo070846m","","","0.71073","MoKα","","0.0607","0.041","","","0.0839","0.0916","","","","","","0.907","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024155","5.6097","0.0005","18.1997","0.0013","21.936","0.002","90","","90","","90","","2239.5","0.3","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H31 N O6 -","- C26 H31 N O6 -","- C104 H124 N4 O24 -","4","1","","Subhankar Tripathi; Biswajit G. Roy; Michael G. B. Drew; Basudeb Achari; Sukhendu B. Mandal","Synthesis of Oxepane Ring Containing Monocyclic, Conformationally Restricted Bicyclic and Spirocyclic Nucleosides from D-Glucose: A Cycloaddition Approach","Journal of Organic Chemistry","2007","72","","7427","7430","10.1021/jo070846m","","","0.71073","MoKα","","0.0852","0.0616","","","0.1158","0.1216","","","","","","1.084","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024156","14.549","0.002","8.871","0.001","15.167","0.003","90","","118.49","0.003","90","","1720.5","0.5","293","2","293","2","","","","","","","firstly synthesized","4","P 1 21/n 1","-P 2yn","14","trans 5,6,7,8-tetrahydro-6,8-diphenylisoquinoline hydrochloride","trans 5,6,7,8-tetrahydro-6,8-diphenylisoquinoline hydrochloride","","- C21 H20 Cl N -","- C21 H20 Cl N -","- C84 H80 Cl4 N4 -","4","1","","Konstantin Yu. Koltunov; G.K. Surya Prakash; Golam Rasul; George A. Olah","Superacidic Activation of Quinoline and Isoquinoline; Their Reactions with Cyclohexane and Benzene","Journal of Organic Chemistry","2007","72","","7394","7397","10.1021/jo070875x","","","0.71073","MoKα","","0.1734","0.0503","","","0.0941","0.1191","","","","","","0.797","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4024157","10.342","0.0005","7.9843","0.0003","11.1511","0.0005","90","","109.152","0.002","90","","869.82","0.07","293","2","293","2","","","","","","","firstly synthesized","4","P 1 21 1","P 2yb","4","trans 5,6,7,8-tetrahydro-5,7-diphenylquinoline hydrochloride","trans 5,6,7,8-tetrahydro-5,7-diphenylquinoline hydrochloride","","- C21 H20 Cl N -","- C21 H20 Cl N -","- C42 H40 Cl2 N2 -","2","1","","Konstantin Yu. Koltunov; G.K. Surya Prakash; Golam Rasul; George A. Olah","Superacidic Activation of Quinoline and Isoquinoline; Their Reactions with Cyclohexane and Benzene","Journal of Organic Chemistry","2007","72","","7394","7397","10.1021/jo070875x","","","0.71073","MoKα","","0.0345","0.0303","","","0.0753","0.0771","","","","","","1.106","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024158","12.706","0.002","15.1141","0.0015","13.0214","0.0017","90","","97.3","0.02","90","","2480.3","0.6","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C45.8 H59.6 Cl3.6 O4 S4 -","- C45.8 H59.6 Cl3.6 O4 S4 -","- C91.6 H119.2 Cl7.2 O8 S8 -","2","0.5","","Hana Dvořáková; Jan Lang; Jiří Vlach; Jan Sýkora; Michal Čajan; Michal Himl; Michaela Pojarová; Ivan Stibor; Pavel Lhoták","Partially O-Alkylated Thiacalix[4]arenes: Synthesis, Molecular and Crystal Structures, Conformational Behavior","Journal of Organic Chemistry","2007","72","","7157","7166","10.1021/jo070927i","","","1.54184","CuKα","","0.0791","0.0663","","0.0908","0.0822","0.0822","","","","","","1.0958","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4024159","8.779","0.0003","9.018","0.0003","10.071","0.0004","103.771","0.0015","105.148","0.0017","109.517","0.0018","677.42","0.05","150","","150","","","","","","","","?","4","P -1","-P 1","2","","","","- C30 H28 O4 S4 -","- C30 H28 O4 S4 -","- C30 H28 O4 S4 -","1","0.5","","Hana Dvořáková; Jan Lang; Jiří Vlach; Jan Sýkora; Michal Čajan; Michal Himl; Michaela Pojarová; Ivan Stibor; Pavel Lhoták","Partially O-Alkylated Thiacalix[4]arenes: Synthesis, Molecular and Crystal Structures, Conformational Behavior","Journal of Organic Chemistry","2007","72","","7157","7166","10.1021/jo070927i","","","0.71073","MoKα","","0.0345","0.0291","","0.0439","0.0385","0.0385","","","","","","1.0212","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024160","10.516","0.0002","18.8366","0.0003","31.7909","0.0006","90.1202","0.0006","94.7055","0.0008","94.91","0.0008","6252.8","0.19","150","","150","","","","","","","","?","4","P -1","-P 1","2","","","","- C33 H33.25 O4 S4 -","- C33 H33.25 O4 S4 -","- C264 H266 O32 S32 -","8","4","","Hana Dvořáková; Jan Lang; Jiří Vlach; Jan Sýkora; Michal Čajan; Michal Himl; Michaela Pojarová; Ivan Stibor; Pavel Lhoták","Partially O-Alkylated Thiacalix[4]arenes: Synthesis, Molecular and Crystal Structures, Conformational Behavior","Journal of Organic Chemistry","2007","72","","7157","7166","10.1021/jo070927i","","","0.71073","MoKα","","0.082","0.0438","","0.072","0.0504","0.0504","","","","","","1.0933","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024161","8.9805","0.0004","9.2539","0.0005","9.8518","0.0007","66.037","0.005","74.034","0.005","62.74","0.004","661.06","0.07","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H12 O2 S2 -","- C14 H12 O2 S2 -","- C28 H24 O4 S4 -","2","1","","Hana Dvořáková; Jan Lang; Jiří Vlach; Jan Sýkora; Michal Čajan; Michal Himl; Michaela Pojarová; Ivan Stibor; Pavel Lhoták","Partially O-Alkylated Thiacalix[4]arenes: Synthesis, Molecular and Crystal Structures, Conformational Behavior","Journal of Organic Chemistry","2007","72","","7157","7166","10.1021/jo070927i","","","1.5418","CuKα","","0.0858","0.0826","","0.0782","0.0744","0.0744","","","","","","1.113","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024162","10.006","0.002","20.624","0.002","20.815","0.002","90","","99.552","0.01","90","","4236.1","1","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H52 O4 S4 -","- C42 H52 O4 S4 -","- C168 H208 O16 S16 -","4","1","","Hana Dvořáková; Jan Lang; Jiří Vlach; Jan Sýkora; Michal Čajan; Michal Himl; Michaela Pojarová; Ivan Stibor; Pavel Lhoták","Partially O-Alkylated Thiacalix[4]arenes: Synthesis, Molecular and Crystal Structures, Conformational Behavior","Journal of Organic Chemistry","2007","72","","7157","7166","10.1021/jo070927i","","","1.5418","CuKα","","0.1603","0.0715","","0.0901","0.0594","0.0594","","","","","","1.2258","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024163","35.611","0.0007","35.611","0.0007","11.908","0.0002","90","","90","","120","","13077.9","0.4","150","","150","","","","","","","","","4","R -3 :H","-R 3","148","","","","- C30 H28 O4 S4 -","- C30 H28 O4 S4 -","- C540 H504 O72 S72 -","18","1","","Hana Dvořáková; Jan Lang; Jiří Vlach; Jan Sýkora; Michal Čajan; Michal Himl; Michaela Pojarová; Ivan Stibor; Pavel Lhoták","Partially O-Alkylated Thiacalix[4]arenes: Synthesis, Molecular and Crystal Structures, Conformational Behavior","Journal of Organic Chemistry","2007","72","","7157","7166","10.1021/jo070927i","","","0.71073","MoKα","","0.0842","0.0524","","0.0857","0.0594","0.0594","","","","","","1.1035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024164","22.8552","0.001","19.5516","0.001","22.5968","0.001","90","","114.36","0.01","90","","9198.5","1","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C46 H62 O4 S4 -","- C46 H62 O4 S4 -","- C368 H496 O32 S32 -","8","1","","Hana Dvořáková; Jan Lang; Jiří Vlach; Jan Sýkora; Michal Čajan; Michal Himl; Michaela Pojarová; Ivan Stibor; Pavel Lhoták","Partially O-Alkylated Thiacalix[4]arenes: Synthesis, Molecular and Crystal Structures, Conformational Behavior","Journal of Organic Chemistry","2007","72","","7157","7166","10.1021/jo070927i","","","1.5418","CuKα","","0.0922","0.0747","","0.0665","0.0637","0.0637","","","","","","1.0343","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024165","6.6245","0.0006","6.8299","0.0007","17.4479","0.0018","90","","90","","90","","789.42","0.14","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C8 H9 O4 -","- C8 H9 O4 -","- C32 H36 O16 -","4","1","","Taedong Ok; Aram Jeon; Joohee Lee; Jung Hak Lim; Chang Seop Hong; Hee-Seung Lee","Enantiomerically Pure Synthesis of β-Substituted γ-Butyrolactones: A Key Intermediate to Concise Synthesis of Pregabalin","Journal of Organic Chemistry","2007","72","","7390","7393","10.1021/jo0709605","","","0.71073","MoKα","","0.0424","0.04","","","0.1125","0.1153","","","","","","1.074","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024166","6.934","0.0002","9.632","0.0003","17.3308","0.0005","90","","90","","90","","1157.49","0.06","298","","298","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H10 N O4 -","- C13 H10 N O4 -","- C52 H40 N4 O16 -","4","1","","Taedong Ok; Aram Jeon; Joohee Lee; Jung Hak Lim; Chang Seop Hong; Hee-Seung Lee","Enantiomerically Pure Synthesis of β-Substituted γ-Butyrolactones: A Key Intermediate to Concise Synthesis of Pregabalin","Journal of Organic Chemistry","2007","72","","7390","7393","10.1021/jo0709605","","","0.71073","MoKα","","0.0557","0.0508","","","0.1298","0.1351","","","","","","1.092","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024167","11.0966","0.0003","12.1982","0.0004","19.3775","0.0007","90","","94.928","0.002","90","","2613.21","0.15","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 N2 O4 S -","- C28 H30 N2 O4 S -","- C112 H120 N8 O16 S4 -","4","1","","Loránd Kiss; Sven Mangelinckx; Reijo Sillanpää; Ferenc Fülöp; Norbert De Kimpe","An Easy Stereoselective Access to β,γ-Aziridino α-Amino Ester Derivatives via Mannich Reaction of Benzophenone Imines of Glycine Esters with N-Sulfonyl α-Chloroaldimines","Journal of Organic Chemistry","2007","72","","7199","7206","10.1021/jo0710634","","x-ray","0.71073","MoKα","","0.0869","0.056","","","0.1049","0.1181","","","","","","1.068","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024168","10.8141","0.0006","25.3685","0.0015","9.6924","0.0003","90","","107.649","0.003","90","","2533.8","0.2","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H28 N2 O4 S -","- C27 H28 N2 O4 S -","- C108 H112 N8 O16 S4 -","4","1","","Loránd Kiss; Sven Mangelinckx; Reijo Sillanpää; Ferenc Fülöp; Norbert De Kimpe","An Easy Stereoselective Access to β,γ-Aziridino α-Amino Ester Derivatives via Mannich Reaction of Benzophenone Imines of Glycine Esters with N-Sulfonyl α-Chloroaldimines","Journal of Organic Chemistry","2007","72","","7199","7206","10.1021/jo0710634","","x-ray","0.71073","MoKα","","0.1089","0.0737","","","0.1324","0.1505","","","","","","1.133","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024169","9.7446","0.0004","10.6546","0.0003","14.6097","0.0005","75.349","0.002","74.192","0.002","80.609","0.002","1404.77","0.08","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C30 H34 N2 O4 S -","- C30 H34 N2 O4 S -","- C60 H68 N4 O8 S2 -","2","1","","Loránd Kiss; Sven Mangelinckx; Reijo Sillanpää; Ferenc Fülöp; Norbert De Kimpe","An Easy Stereoselective Access to β,γ-Aziridino α-Amino Ester Derivatives via Mannich Reaction of Benzophenone Imines of Glycine Esters with N-Sulfonyl α-Chloroaldimines","Journal of Organic Chemistry","2007","72","","7199","7206","10.1021/jo0710634","","x-ray","0.71073","MoKα","","0.1031","0.061","","","0.1031","0.1192","","","","","","1.074","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024170","10.8515","0.0003","12.6958","0.0005","20.1106","0.0006","90","","93.351","0.002","90","","2765.87","0.16","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H34 N2 O4 S -","- C30 H34 N2 O4 S -","- C120 H136 N8 O16 S4 -","4","1","","Loránd Kiss; Sven Mangelinckx; Reijo Sillanpää; Ferenc Fülöp; Norbert De Kimpe","An Easy Stereoselective Access to β,γ-Aziridino α-Amino Ester Derivatives via Mannich Reaction of Benzophenone Imines of Glycine Esters with N-Sulfonyl α-Chloroaldimines","Journal of Organic Chemistry","2007","72","","7199","7206","10.1021/jo0710634","","x-ray","0.71073","MoKα","","0.1324","0.0732","","","0.1161","0.1367","","","","","","1.08","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024171","17.3631","0.0009","8.6187","0.0003","19.3747","0.001","90","","116.673","0.002","90","","2590.8","0.2","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 N2 O4 S -","- C28 H30 N2 O4 S -","- C112 H120 N8 O16 S4 -","4","1","","Loránd Kiss; Sven Mangelinckx; Reijo Sillanpää; Ferenc Fülöp; Norbert De Kimpe","An Easy Stereoselective Access to β,γ-Aziridino α-Amino Ester Derivatives via Mannich Reaction of Benzophenone Imines of Glycine Esters with N-Sulfonyl α-Chloroaldimines","Journal of Organic Chemistry","2007","72","","7199","7206","10.1021/jo0710634","","x-ray","0.71073","MoKα","","0.1068","0.0646","","","0.1181","0.1356","","","","","","1.039","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024172","20.291","","15.783","","8.674","","90","","95.82","","90","","2763.55","","","","","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","?","- C108 O24 -","- C108 O24 -","","","","Alexander O. Terent'ev; Maxim M. Platonov; Eduard J. Sonneveld; Rene Peschar; Vladimir V. Chernyshev; Zoya A. Starikova; Gennady I. Nikishin","New Preparation of 1,2,4,5,7,8-Hexaoxonanes","Journal of Organic Chemistry","2007","72","","7237","7243","10.1021/jo071072c","","","","","","","","","","","","","","","","","","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024173","20.526","0.015","12.282","0.011","12.551","0.012","90","","92.17","0.05","90","","3162","5","295","2","295","2","","","","","","","The title compound was synthesized in the Institute of Organic Chemistry Russian Academy of Sciences, Moscow, Russia.","3","C 1 2/c 1","-C 2yc","15","","","","- C32 H58 O6 -","- C32 H58 O6 -","- C128 H232 O24 -","4","0.5","","Alexander O. Terent'ev; Maxim M. Platonov; Eduard J. Sonneveld; Rene Peschar; Vladimir V. Chernyshev; Zoya A. Starikova; Gennady I. Nikishin","New Preparation of 1,2,4,5,7,8-Hexaoxonanes","Journal of Organic Chemistry","2007","72","","7237","7243","10.1021/jo071072c","powder diffraction","","1.5406","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024174","11.072","0.009","11.854","0.009","16.489","0.012","90","","103.18","0.04","90","","2107","3","295","2","295","2","","","","","","","The title compound was synthesized in the Institute of Organic Chemistry Russian Academy of Sciences, Moscow, Russia.","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H34 O6 -","- C22 H34 O6 -","- C88 H136 O24 -","4","1","","Alexander O. Terent'ev; Maxim M. Platonov; Eduard J. Sonneveld; Rene Peschar; Vladimir V. Chernyshev; Zoya A. Starikova; Gennady I. Nikishin","New Preparation of 1,2,4,5,7,8-Hexaoxonanes","Journal of Organic Chemistry","2007","72","","7237","7243","10.1021/jo071072c","powder diffraction","","1.5406","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024175","12.815","0.007","13.032","0.008","6.332","0.003","95.38","0.03","92.33","0.03","73.67","0.02","1010.2","1","295","2","295","2","","","","","","","The title compound was synthesized in the Institute of Organic Chemistry Russian Academy of Sciences, Moscow, Russia.","3","P -1","-P 1","2","","","","- C22 H34 O6 -","- C22 H34 O6 -","- C44 H68 O12 -","2","1","","Alexander O. Terent'ev; Maxim M. Platonov; Eduard J. Sonneveld; Rene Peschar; Vladimir V. Chernyshev; Zoya A. Starikova; Gennady I. Nikishin","New Preparation of 1,2,4,5,7,8-Hexaoxonanes","Journal of Organic Chemistry","2007","72","","7237","7243","10.1021/jo071072c","powder diffraction","","1.5406","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024176","14.64","0.006","14.217","0.006","10.196","0.004","90","","92.542","0.007","90","","2120.2","1.4","120","2","120","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C19 H31 Cl3 O6 -","- C19 H31 Cl3 O6 -","- C76 H124 Cl12 O24 -","4","1","","Alexander O. Terent'ev; Maxim M. Platonov; Eduard J. Sonneveld; Rene Peschar; Vladimir V. Chernyshev; Zoya A. Starikova; Gennady I. Nikishin","New Preparation of 1,2,4,5,7,8-Hexaoxonanes","Journal of Organic Chemistry","2007","72","","7237","7243","10.1021/jo071072c","","","0.71073","MoKα","","0.0338","0.032","","","0.0856","0.0871","","","","","","1.009","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024177","21.414","0.004","23.166","0.004","24.601","0.005","88.98","0.005","78.128","0.005","84.935","0.005","11896","4","120","0.2","120","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C111 H114 N21 O10 P -","- C111 H114 N21 O10 P -","- C444 H456 N84 O40 P4 -","4","2","","Evgeny A. Katayev; Jonathan L. Sessler; Victor N. Khrustalev; Yuri A. Ustynyuk","Synthetic Model of the Phosphate Binding Protein: Solid-State Structure and Solution-Phase Anion Binding Properties of a Large Oligopyrrolic Macrocycle","Journal of Organic Chemistry","2007","72","","7244","7252","10.1021/jo071106g","","","0.71073","MoKα","","0.2392","0.0996","","","0.1596","0.1837","","","","","","0.988","","","","has coordinates,has disorder","178420","2020-10-21","18:00:00",""
"4024178","7.9747","0.0003","15.2901","0.0006","10.4868","0.0004","90.01","","99.03","","90","","1262.86","0.08","173","","173","","","","","","","","","6","P 1","P 1","1","PdCl2(t-Bu-QuinoxP*)","[(R,R)-2,3-bis((tert-butyl)methylphosphino)quinoxaline]dichloropalladium","","- C38 H60 Cl8 N4 P4 Pd2 -","- C19 H30 Cl4 N2 P2 Pd -","- C38 H60 Cl8 N4 P4 Pd2 -","2","2","","Tsuneo Imamoto; Miwako Nishimura; Aya Koide; Kazuhiro Yoshida","t-Bu-QuinoxP* Ligand: Applications in Asymmetric Pd-Catalyzed Allylic Substitution and Ru-Catalyzed Hydrogenation","Journal of Organic Chemistry","2007","72","","7413","7416","10.1021/jo071192k","","","0.71073","MoKα","","0.0201","0.0198","","","0.0503","0.0504","","","","","","1.099","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024179","48.051","0.007","9.5884","0.0013","29.886","0.004","90","","91.057","0.003","90","","13767","3","113","2","113","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C152 H186 N2 O41 -","- C152 H184 N2 O41 -","- C608 H736 N8 O164 -","4","0.5","","Tao Han; Chuan-Feng Chen","Selective Templated Complexation of a Cylindrical Macrotricyclic Host with Neutral Guests: Three Cation-Controlled Switchable Processes","Journal of Organic Chemistry","2007","72","","7287","7293","10.1021/jo071195x","","","0.7107","MoKα","","0.1249","0.0942","","","0.255","0.2895","","","","","","1.085","","","","has coordinates,has disorder","178420","2020-10-21","18:00:00",""
"4024180","11.892","0.006","15.745","0.007","22.822","0.011","99.818","0.01","93.828","0.006","97.213","0.009","4160","3","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","","","- C80.5 H95.75 Cl2 Li2 N3.25 O30 -","- C80.5 H95 Cl2 Li2 N3.25 O30 -","- C161 H190 Cl4 Li4 N6.5 O60 -","2","1","","Tao Han; Chuan-Feng Chen","Selective Templated Complexation of a Cylindrical Macrotricyclic Host with Neutral Guests: Three Cation-Controlled Switchable Processes","Journal of Organic Chemistry","2007","72","","7287","7293","10.1021/jo071195x","","","0.7107","MoKα","","0.1993","0.1604","","","0.4303","0.4592","","","","","","1.609","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4024181","12.137","0.003","16.202","0.004","23.478","0.006","76.116","0.009","86.728","0.011","76.863","0.01","4364.6","1.9","113","","113","","","","","","","","","7","P -1","-P 1","2","","","","- C78 H83 F12 K2 N O18 P2 -","- C78 H83 F12 K2 N O18 P2 -","- C156 H166 F24 K4 N2 O36 P4 -","2","1","","Tao Han; Chuan-Feng Chen","Selective Templated Complexation of a Cylindrical Macrotricyclic Host with Neutral Guests: Three Cation-Controlled Switchable Processes","Journal of Organic Chemistry","2007","72","","7287","7293","10.1021/jo071195x","","","0.7107","MoKα","","0.1967","0.1436","","0.1711","0.1673","0.1673","","","","","","1.1576","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024182","29.938","0.003","29.938","0.003","17.0369","0.0016","90","","90","","120","","13224","2","113","2","113","2","","","","","","","","6","P -3","-P 3","147","","","","- C80 H100.17 F12 N2 O17.08 P2 -","- C80 H99 F12 N2 O17.0933 P2 -","- C480 H594 F72 N12 O102.56 P12 -","6","1","","Tao Han; Chuan-Feng Chen","Selective Templated Complexation of a Cylindrical Macrotricyclic Host with Neutral Guests: Three Cation-Controlled Switchable Processes","Journal of Organic Chemistry","2007","72","","7287","7293","10.1021/jo071195x","","","0.7107","MoKα","","0.0834","0.076","","","0.2017","0.2127","","","","","","1.062","","","","has coordinates,has disorder","178420","2020-10-21","18:00:00",""
"4024183","6.7373","0.0008","12.9144","0.0009","14.3355","0.0009","90","","101.895","0.004","90","","1220.52","0.18","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","13","2-(tris-methylsulfanyl-methyl)-3-methyl-pyridine","","- C10 H15 N S3 -","- C10 H15 N S3 -","- C40 H60 N4 S12 -","4","1","","Victor Mamane; Emmanuel Aubert; Yves Fort","The Methyl Group as a Source of Structural Diversity in Heterocyclic Chemistry: Side Chain Functionalization of Picolines and Related Heterocycles","Journal of Organic Chemistry","2007","72","","7294","7300","10.1021/jo071209z","","","0.71073","MoKα","","0.0344","0.0267","","","0.0708","0.0735","","","","","","1.07","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024184","8.2196","0.0004","10.2735","0.0007","13.857","0.0011","92.479","0.004","106.581","0.004","111.661","0.004","1027.68","0.12","100","2","100","2","","","","","","","","4","P -1","-P 1","2","25","2-(tris-phenylsulfanyl-methyl)-pyridine","","- C24 H19 N S3 -","- C24 H19 N S3 -","- C48 H38 N2 S6 -","2","1","","Victor Mamane; Emmanuel Aubert; Yves Fort","The Methyl Group as a Source of Structural Diversity in Heterocyclic Chemistry: Side Chain Functionalization of Picolines and Related Heterocycles","Journal of Organic Chemistry","2007","72","","7294","7300","10.1021/jo071209z","","","0.71073","MoKα","","0.0324","0.0291","","","0.0765","0.078","","","","","","1.064","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024185","11.384","0.0013","10.6382","0.0012","20.331","0.002","90","","90.589","0.002","90","","2462.1","0.5","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H35 Br O3 -","- C27 H35 Br O3 -","- C108 H140 Br4 O12 -","4","2","","Amy L. Lane; Elizabeth P. Stout; Mark E. Hay; Anne C. Prusak; Kenneth Hardcastle; Craig R. Fairchild; Scott G. Franzblau; Karine Le Roch; Jacques Prudhomme; William Aalbersberg; Julia Kubanek","Callophycoic Acids and Callophycols from the Fijian Red Alga Callophycus serratus","Journal of Organic Chemistry","2007","72","","7343","7351","10.1021/jo071210y","","","0.71073","MoKα","","0.1197","0.0647","","","0.1042","0.1179","","","","","","1","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024186","9.0332","0.0009","23.745","0.002","11.0309","0.0011","90","","103.957","0.001","90","","2296.2","0.4","273","2","273","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-[2'-(1-Hydroxy-1-isopropyl-2-methyl-propyl)-biphenyl-2-yl] -2,4-dimethyl-pentan-3-ol","","- C26 H38 O2 -","- C26 H38 O2 -","- C104 H152 O8 -","4","1","","Daniele Casarini; Lodovico Lunazzi; Michele Mancinelli; Andrea Mazzanti; Carlo Rosini","Structure, Conformation, Stereodynamics, Dimer Formation, and Absolute Configuration of Axially Chiral Atropisomers of Hindered Biphenyl Carbinols","Journal of Organic Chemistry","2007","72","","7667","7676","10.1021/jo701481m","","","0.71073","MoKα","","0.0555","0.0484","","","0.1639","0.1699","","","","","","1.729","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024187","8.9223","0.001","11.0696","0.0012","11.9651","0.0014","67.507","0.008","74.357","0.009","72.459","0.009","1025","0.2","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H21 N3 O6 -","- C22 H21 N3 O6 -","- C44 H42 N6 O12 -","2","1","","Vadim S. Korotkov; Oleg V. Larionov; Anja Hofmeister; Jörg Magull; Armin de Meijere","GaCl~3~-Catalyzed Insertion of Diazene Derivatives into the Cyclopropane Ring","Journal of Organic Chemistry","2007","72","","7504","7510","10.1021/jo0704816","","","0.71073","MoKα","","0.0651","0.0376","","","0.0713","0.077","","","","","","1.005","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024188","9.1054","0.0004","15.0233","0.0009","15.1878","0.0007","90","","99.518","0.003","90","","2048.99","0.18","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H21 N3 O6 -","- C22 H21 N3 O6 -","- C88 H84 N12 O24 -","4","1","","Vadim S. Korotkov; Oleg V. Larionov; Anja Hofmeister; Jörg Magull; Armin de Meijere","GaCl~3~-Catalyzed Insertion of Diazene Derivatives into the Cyclopropane Ring","Journal of Organic Chemistry","2007","72","","7504","7510","10.1021/jo0704816","","","0.71073","MoKα","","0.0421","0.0313","","","0.0802","0.0837","","","","","","1.013","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024189","11.0013","0.0008","9.2305","0.0006","21.613","0.0002","90","","91.697","0.007","90","","2193.8","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H25 N O3 -","- C25 H25 N O3 -","- C100 H100 N4 O12 -","4","2","","José M. Concellón; Virginia del Solar; Santiago García-Granda; M. Rosario Díaz","Totally Selective Reaction of CO~2~ with Enantiopure Amino Epoxides under Mild Reaction Conditions. Synthesis and Synthetic Applications of Enantiopure (4R,1'S)- or (4S,1'S)-4-(1-Aminoalkyl)-2-oxo-1,3-dioxolanes","Journal of Organic Chemistry","2007","72","","7567","7573","10.1021/jo070829x","","","1.5418","CuKα","","0.1231","0.0637","","","0.1423","0.1871","","","","","","1.024","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024190","7.67","0.003","9.846","0.004","11.078","0.005","103.439","0.007","91.449","0.009","111.541","0.008","751.2","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H19 N O2 -","- C18 H19 N O2 -","- C36 H38 N2 O4 -","2","1","","Bin Yan; Yebing Zhou; Hao Zhang; Jingjin Chen; Yuanhong Liu","Highly Efficient Synthesis of Functionalized Indolizines and Indolizinones by Copper-Catalyzed Cycloisomerizations of Propargylic Pyridines","Journal of Organic Chemistry","2007","72","","7783","7786","10.1021/jo070983j","","","0.71073","MoKα","","0.1447","0.0982","","","0.2541","0.2849","","","","","","0.929","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024191","6.1721","0.0004","8.3012","0.0006","17.1703","0.0012","100.228","0.001","96.551","0.001","104.693","0.001","825.66","0.1","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H11 F5 N O6 P -","- C12 H11 F5 N O6 P -","- C24 H22 F10 N2 O12 P2 -","2","1","","Jinhua Song; Hiroshi Yamataka; Zvi Rappoport","Dialkoxyphosphinyl-Substituted Enols of Carboxamides","Journal of Organic Chemistry","2007","72","","7605","7624","10.1021/jo0710679","","","0.71073","MoKα","","0.0508","0.048","","","0.1293","0.1314","","","","","","1.09","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024192","12.259","0.003","15.159","0.004","9.95","0.003","90","","111.936","0.004","90","","1715.1","0.8","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 F3 N O6 P -","- C13 H15 F3 N O6 P -","- C52 H60 F12 N4 O24 P4 -","4","1","","Jinhua Song; Hiroshi Yamataka; Zvi Rappoport","Dialkoxyphosphinyl-Substituted Enols of Carboxamides","Journal of Organic Chemistry","2007","72","","7605","7624","10.1021/jo0710679","","","0.71073","MoKα","","0.146","0.0979","","","0.1959","0.2196","","","","","","1.162","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024193","8.4942","0.0007","18.7298","0.0015","19.7636","0.0016","67.141","0.001","86.272","0.001","84.659","0.001","2883.3","0.4","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H16 F6 N O7 P -","- C15 H16 F6 N O7 P -","- C90 H96 F36 N6 O42 P6 -","6","3","","Jinhua Song; Hiroshi Yamataka; Zvi Rappoport","Dialkoxyphosphinyl-Substituted Enols of Carboxamides","Journal of Organic Chemistry","2007","72","","7605","7624","10.1021/jo0710679","","","0.71073","MoKα","","0.1158","0.066","","","0.1598","0.1799","","","","","","0.979","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024194","7.083","0.001","16.715","0.002","14.637","0.002","90","","96.001","0.003","90","","1723.4","0.4","295","1","295","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H16 F6 N O6 P -","- C11 H16 F6 N O6 P -","- C44 H64 F24 N4 O24 P4 -","4","1","","Jinhua Song; Hiroshi Yamataka; Zvi Rappoport","Dialkoxyphosphinyl-Substituted Enols of Carboxamides","Journal of Organic Chemistry","2007","72","","7605","7624","10.1021/jo0710679","","","0.71073","MoKα","","0.1121","0.0958","","","0.1908","0.1985","","","","","","1.323","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024195","16.428","0.003","11.695","0.002","8.0881","0.0015","90","","100.953","0.003","90","","1525.7","0.5","295","1","295","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H21 N O7 P2 -","- C9 H21 N O7 P2 -","- C36 H84 N4 O28 P8 -","4","1","","Jinhua Song; Hiroshi Yamataka; Zvi Rappoport","Dialkoxyphosphinyl-Substituted Enols of Carboxamides","Journal of Organic Chemistry","2007","72","","7605","7624","10.1021/jo0710679","","","0.71073","MoKα","","0.0858","0.0637","","","0.1623","0.1734","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024196","12.2816","0.0012","18.3529","0.0018","9.2776","0.0009","90","","107.517","0.002","90","","1994.2","0.3","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 F6 N O6 P -","- C14 H14 F6 N O6 P -","- C56 H56 F24 N4 O24 P4 -","4","1","","Jinhua Song; Hiroshi Yamataka; Zvi Rappoport","Dialkoxyphosphinyl-Substituted Enols of Carboxamides","Journal of Organic Chemistry","2007","72","","7605","7624","10.1021/jo0710679","","","0.71073","MoKα","","0.1444","0.1092","","","0.261","0.2847","","","","","","1.14","","","","has coordinates","178420","2020-10-21","18:00:00",""
"4024197","11.7792","0.0007","13.4173","0.0009","8.3445","0.0005","90","","90","","90","","1318.81","0.14","295","2","295","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C11 H16 N O5 P -","- C11 H16 N O5 P -","- C44 H64 N4 O20 P4 -","4","1","","Jinhua Song; Hiroshi Yamataka; Zvi Rappoport","Dialkoxyphosphinyl-Substituted Enols of Carboxamides","Journal of Organic Chemistry","2007","72","","7605","7624","10.1021/jo0710679","","","0.71073","MoKα","","0.1041","0.0534","","","0.056","0.0649","","","","","","0.854","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024198","11.1322","0.0006","9.4331","0.0005","25.1364","0.0015","90","","90","","90","","2639.6","0.3","293","1","293","1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C10 H9 F5 N O4 P -","- C10 H9 F5 N O4 P -","- C80 H72 F40 N8 O32 P8 -","8","1","","Jinhua Song; Hiroshi Yamataka; Zvi Rappoport","Dialkoxyphosphinyl-Substituted Enols of Carboxamides","Journal of Organic Chemistry","2007","72","","7605","7624","10.1021/jo0710679","","","0.71073","MoKα","","0.1034","0.0805","","","0.1607","0.1725","","","","","","1.26","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024199","14.792","0.002","3.8691","0.0008","21.435","0.005","90","","106.12","0.02","90","","1178.53","","100","","100","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-difluoro-benzo[c]phenanthrene","","- C18 H10 F2 -","- C18 H10 F2 -","- C72 H40 F8 -","4","1","","Suyeal Bae; Heduck Mah; Surendrakumar Chaturvedi; Tamara Musafia Jeknic; William M. Baird; Amy K. Katz; H. L. Carrell; Jenny P. Glusker; Takao Okazaki; Kenneth K. Laali; Barbara Zajc; Mahesh K. Lakshman","Synthetic, Crystallographic, Computational, and Biological Studies of 1,4-Difluorobenzo[c]phenanthrene and Its Metabolites","Journal of Organic Chemistry","2007","72","","7625","7633","10.1021/jo071145s","","","0.71073","MoKa","","0.061","0.048","","0.103","0.102","","0.083","","1.712","1.858","1.858","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024200","7.681","0.006","8.366","0.005","21.16","0.02","90","","98.34","0.05","90","","1345.3","2","100","","100","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","1,4-difluoro-benzo[c]phenanthrene-9,10-dihydrodiol","","- C18 H12 F2 O2 -","- C18 H12 F2 O2 -","- C72 H48 F8 O8 -","4","1","","Suyeal Bae; Heduck Mah; Surendrakumar Chaturvedi; Tamara Musafia Jeknic; William M. Baird; Amy K. Katz; H. L. Carrell; Jenny P. Glusker; Takao Okazaki; Kenneth K. Laali; Barbara Zajc; Mahesh K. Lakshman","Synthetic, Crystallographic, Computational, and Biological Studies of 1,4-Difluorobenzo[c]phenanthrene and Its Metabolites","Journal of Organic Chemistry","2007","72","","7625","7633","10.1021/jo071145s","","","0.71073","MoKa","","0.16","0.089","","0.165","0.157","","0.112","","2.016","2.435","2.435","2.435","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4024201","7.814","0.007","8.174","0.002","20.263","0.002","90","","94.6","0.02","90","","1290.1","1.2","100","2","100","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","3,4-dihydrodiol-benzo[c]phenanthrene","","- C18 H14 O2 -","- C18 H14 O2 -","- C72 H56 O8 -","4","1","","Suyeal Bae; Heduck Mah; Surendrakumar Chaturvedi; Tamara Musafia Jeknic; William M. Baird; Amy K. Katz; H. L. Carrell; Jenny P. Glusker; Takao Okazaki; Kenneth K. Laali; Barbara Zajc; Mahesh K. Lakshman","Synthetic, Crystallographic, Computational, and Biological Studies of 1,4-Difluorobenzo[c]phenanthrene and Its Metabolites","Journal of Organic Chemistry","2007","72","","7625","7633","10.1021/jo071145s","","","0.71073","MoKα","","0.1116","0.0614","","","0.0949","0.1029","","","","","","1.608","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024202","12.7203","0.0011","45.428","0.004","11.6976","0.0006","90","","91.788","0.005","90","","6756.3","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C70 H81 Cl8 N O7 -","- C70 H81 Cl8 N O7 -","- C280 H324 Cl32 N4 O28 -","4","1","","Amel Ben Othman; Jeong Won Lee; Jia-Sheng Wu; Jong Seung Kim; Rym Abidi; Pierre Thuéry; Jean Marc Strub; Alain Van Dorsselaer; Jacques Vicens","Calix[4]arene-Based, Hg^2+^-Induced Intramolecular Fluorescence Resonance Energy Transfer Chemosensor","Journal of Organic Chemistry","2007","72","","7634","7640","10.1021/jo071226o","","","0.71073","MoKα","","0.135","0.0854","","","0.2417","0.2705","","","","","","1.094","","","","has coordinates","178421","2020-10-21","18:00:00",""
"4024203","7.601","0.005","7.577","0.005","26.341","0.005","90","","94.107","0.005","90","","1513.2","1.4","293","2","293","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 O -","- C20 H18 O -","- C80 H72 O4 -","4","1","","Jose M. Antelo Miguez; Luis Angel Adrio; Antonio Sousa-Pedrares; Jose M. Vila; King Kuok (Mimi) Hii","A Practical and General Synthesis of Unsymmetrical Terphenyls","Journal of Organic Chemistry","2007","72","","7771","7774","10.1021/jo701308b","","","0.71069","MoKα","","0.1175","0.0819","","","0.2257","0.2499","","","","","","1.13","","","","has coordinates","277840","2022-09-14","18:34:00",""
"4024204","8.82","0.003","11.774","0.005","13.6","0.007","101.089","0.018","106.943","0.016","104.443","0.015","1253.7","1","298","1","","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H29 N O7 -","- C28 H29 N O7 -","- C56 H58 N2 O14 -","2","1","","Sun-Liang Cui; Jun Wang; Xu-Feng Lin; Yan-Guang Wang","Domino Reaction of 3-(2-Formylphenoxy)propenoates and Amines: A Novel Synthesis of 1,4-Dihydropyridines from Salicaldehydes, Ethyl Propiolate, and Amines","Journal of Organic Chemistry","2007","72","","7779","7782","10.1021/jo7013593","","","0.71075","MoKα","","","0.0505","","","","0.1375","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024205","8.25","0.002","13.256","0.004","16.975","0.005","90","","92.084","0.004","90","","1855.2","0.9","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H17 Cl F3 N O2 -","- C19 H17 Cl F3 N O2 -","- C76 H68 Cl4 F12 N4 O8 -","4","1","","Dmitry Shabashov; Olafs Daugulis","Palladium-Catalyzed Anilide ortho-Arylation and Subsequent One-Pot Cyclization to Phenanthridines","Journal of Organic Chemistry","2007","72","","7720","7725","10.1021/jo701387m","","","0.71073","MoKα","","0.0686","0.0422","","","0.1067","0.1236","","","","","","0.93","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024206","8.378","0.002","10.646","0.002","16.16","0.003","86.01","0.003","89.132","0.003","88.626","0.003","1437.2","0.5","223","2","223","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H17 N -","- C20 H17 N -","- C80 H68 N4 -","4","2","","Dmitry Shabashov; Olafs Daugulis","Palladium-Catalyzed Anilide ortho-Arylation and Subsequent One-Pot Cyclization to Phenanthridines","Journal of Organic Chemistry","2007","72","","7720","7725","10.1021/jo701387m","","","0.71073","MoKα","","0.0737","0.065","","","0.2053","0.214","","","","","","1.032","","","","has coordinates","178421","2020-10-21","18:00:00",""
"4024207","12.7902","0.001","5.0003","0.0004","18.5981","0.0014","90","","109.263","0.001","90","","1122.85","0.15","571","2","571","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","biphenyl-2,2'-diyldimethanol","","- C14 H14 O2 -","- C14 H14 O2 -","- C56 H56 O8 -","4","1","","Daniele Casarini; Lodovico Lunazzi; Michele Mancinelli; Andrea Mazzanti; Carlo Rosini","Structure, Conformation, Stereodynamics, Dimer Formation, and Absolute Configuration of Axially Chiral Atropisomers of Hindered Biphenyl Carbinols","Journal of Organic Chemistry","2007","72","","7667","7676","10.1021/jo701481m","","","0.71073","MoKα","","0.0509","0.0421","","","0.124","0.1291","","","","","","1.105","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024208","8.9963","0.0013","9.9418","0.0014","10.2139","0.0014","118.026","0.001","95.944","0.002","101.472","0.002","769.52","0.19","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","2,2'-(biphenyl-2,2'-diyl)dipropan-2-ol","","- C18 H22 O2 -","- C18 H22 O2 -","- C36 H44 O4 -","2","1","","Daniele Casarini; Lodovico Lunazzi; Michele Mancinelli; Andrea Mazzanti; Carlo Rosini","Structure, Conformation, Stereodynamics, Dimer Formation, and Absolute Configuration of Axially Chiral Atropisomers of Hindered Biphenyl Carbinols","Journal of Organic Chemistry","2007","72","","7667","7676","10.1021/jo701481m","","","0.71073","MoKα","","0.0484","0.0413","","","0.126","0.1316","","","","","","1.121","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4024209","9.7091","0.0004","9.8972","0.0003","15.0704","0.0005","76.163","0.0019","77.145","0.002","78.022","0.0018","1352.55","0.08","110","","110","","","","","","","","","6","P -1","-P 1","2","","ZnC-Br7T10","","- C30 H24 Br Cl3 N4 Zn -","- C30 H24 Br Cl3 N4 Zn -","- C60 H48 Br2 Cl6 N8 Zn2 -","2","1","","Chinnasamy Muthiah; Marcin Ptaszek; Tien M. Nguyen; Kyle M. Flack; Jonathan S. Lindsey","Two Complementary Routes to 7-Substituted Chlorins. Partial Mimics of Chlorophyll b","Journal of Organic Chemistry","2007","72","","7736","7749","10.1021/jo701500d","","","0.71073","MolybdenumKα","","0.072","0.043","","0.043","","0.042","","","","","","1.2","","","","has coordinates","192276","2020-10-21","18:00:00",""
"4028897","7.5353","0.0003","21.1912","0.0016","22.4218","0.0009","90","","90","","90","","3580.4","0.3","170","2","170","2","","","","","","","","5","P c 21 n","P -2n -2ac","33","","","","- C18 H18 N2 O6 S -","- C18 H18 N2 O6 S -","- C144 H144 N16 O48 S8 -","8","2","","Declerck, Valérie; Allouchi, Hassan; Martinez, Jean; Lamaty, Frédéric","2-Trimethylsilylethanesulfonyl (SES) versus Tosyl (Ts) Protecting Group in the Preparation of Nitrogen-Containing Five-Membered Rings. A Novel Route for the Synthesis of Substituted Pyrrolines and Pyrrolidines","The Journal of Organic Chemistry","2007","72","4","1518","1521","10.1021/jo062239p","","","0.71073","MoKα","","0.0908","0.0725","","","0.1826","0.1892","","","","","","1.064","","","","has coordinates","178467","2020-10-21","18:00:00",""
"4029620","12.4543","0.0004","12.4735","0.0005","12.4773","0.0004","66.229","0.001","66.251","0.002","85.637","0.001","1615.04","0.1","213.1","","","","","","","","","","","3","P 1","P 1","1","","","","- C36 H50 O4 -","- C36 H50 O4 -","- C72 H100 O8 -","2","2","","Mori, Tadashi; Grimme, Stefan; Inoue, Yoshihisa","A combined experimental and theoretical study on the conformation of multiarmed chiral aryl ethers.","The Journal of organic chemistry","2007","72","18","6998","7010","10.1021/jo071216n","","","0.7107","MoKα","","","0.074","","","","0.09","","","","","","2.235","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4029621","11.9777","0.0003","19.4202","0.0004","19.8808","0.0006","90","","92.996","0.0007","90","","4618.1","0.2","213.1","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C51 H72 O6 -","- C51 H72 O6 -","- C204 H288 O24 -","4","2","","Mori, Tadashi; Grimme, Stefan; Inoue, Yoshihisa","A combined experimental and theoretical study on the conformation of multiarmed chiral aryl ethers.","The Journal of organic chemistry","2007","72","18","6998","7010","10.1021/jo071216n","","","0.7107","MoKα","","","0.076","","","","0.09","","","","","","1.069","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4029737","5.3485","0.0005","7.4424","0.0007","33.559","0.003","90","","90","","90","","1335.8","0.2","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H11 N O2 S -","- C16 H11 N O2 S -","- C64 H44 N4 O8 S4 -","4","1","","Singh, Marjit W.; Karmakar, Anirban; Barooah, Nilotpal; Baruah, Jubaraj B.","Variations in product in reactions of naphthoquinone with primary amines.","Beilstein journal of organic chemistry","2007","3","1","10","","10.1186/1860-5397-3-10","","","0.71073","MoKα","","0.0961","0.0461","","","0.1007","0.1352","","","","","","1.038","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029744","4.3029","0.0008","12.249","0.002","23.927","0.006","90","","90","","90","","1261.1","0.4","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H12 N2 O2 -","- C16 H12 N2 O2 -","- C64 H48 N8 O8 -","4","1","","Singh, Marjit W.; Karmakar, Anirban; Barooah, Nilotpal; Baruah, Jubaraj B.","Variations in product in reactions of naphthoquinone with primary amines.","Beilstein journal of organic chemistry","2007","3","1","10","","10.1186/1860-5397-3-10","","","0.71073","MoKα","","0.1538","0.0681","","","0.1446","0.1795","","","","","","0.885","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029749","3.8313","0.0005","12.5135","0.0018","14.2512","0.0019","112.212","0.009","93.326","0.011","93.864","0.011","628.52","0.15","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H11 N O3 -","- C16 H11 N O3 -","- C32 H22 N2 O6 -","2","1","","Singh, Marjit W.; Karmakar, Anirban; Barooah, Nilotpal; Baruah, Jubaraj B.","Variations in product in reactions of naphthoquinone with primary amines.","Beilstein journal of organic chemistry","2007","3","1","10","","10.1186/1860-5397-3-10","","","0.71073","MoKα","","0.1295","0.0669","","","0.1804","0.212","","","","","","1.047","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029755","5.4646","0.0011","11.742","0.002","13.204","0.002","69.478","0.011","85.113","0.011","85.709","0.012","789.7","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H24 N2 O -","- C18 H24 N2 O -","- C36 H48 N4 O2 -","2","1","","Singh, Marjit W.; Karmakar, Anirban; Barooah, Nilotpal; Baruah, Jubaraj B.","Variations in product in reactions of naphthoquinone with primary amines.","Beilstein journal of organic chemistry","2007","3","1","10","","10.1186/1860-5397-3-10","","","0.71073","MoKα","","0.176","0.0785","","","0.2076","0.2846","","","","","","0.892","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029759","11.7463","0.0003","9.5792","0.0002","17.6727","0.0004","90","","99.284","0.002","90","","1962.49","0.08","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H14 N2 O3 -","- C24 H20 N2 O3 -","- C96 H80 N8 O12 -","4","1","","Singh, Marjit W.; Karmakar, Anirban; Barooah, Nilotpal; Baruah, Jubaraj B.","Variations in product in reactions of naphthoquinone with primary amines.","Beilstein journal of organic chemistry","2007","3","1","10","","10.1186/1860-5397-3-10","","","0.71073","MoKα","","0.0833","0.0477","","","0.1359","0.163","","","","","","0.976","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029764","10.5103","0.0016","7.5216","0.0012","24.079","0.004","90","","93.496","0.003","90","","1900","0.5","193","2","193","2","","","","","","","Na2CO3/MeOH treatment of salvinorin A from Salvia divinorum leaves","3","P 1 21 1","P 2yb","4","8-epi-salvinorin B","(2S,4aS,6aR,7R,9S,10aS,10bR)-methyl 2-(3-furanyl)-dodecahydro-9-hydroxy-6a,10b-dimethyl-4,10-dioxo- 2H-naphtho[2,1-c]pyran-7-carboxylate","","- C21 H26 O7 -","- C21 H26 O7 -","- C84 H104 O28 -","4","2","","Munro, Thomas A.; Duncan, Katharine K.; Staples, Richard J.; Xu, Wei; Liu-Chen, Lee-Yuan; Béguin, Cécile; Carlezon, Jr, William A; Cohen, Bruce M.","8-epi-Salvinorin B: crystal structure and affinity at the kappa opioid receptor.","Beilstein journal of organic chemistry","2007","3","1","1","","10.1186/1860-5397-3-1","","","0.71073","MoKα","","0.0481","0.0427","","","0.0934","0.0962","","","","","","1.01","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"4029772","14.3618","0.001","7.5472","0.0006","18.9922","0.0014","90","","91.838","0.004","90","","2057.5","0.3","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","melamine + uracil","","","- C7 H10 N8 O2 -","- C7 H10 N8 O2 -","- C56 H80 N64 O16 -","8","1","","Thomas, Reji; Kulkarni, G. U.","A hydrogen-bonded channel structure formed by a complex of uracil and melamine.","Beilstein journal of organic chemistry","2007","3","1","17","","10.1186/1860-5397-3-17","","","0.71073","MoKα","","0.0443","0.0373","","","0.1053","0.1089","","","","","","1.043","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4031249","9.8213","","11.5149","","13.5301","","102.83","","97.107","","111.836","","1348.43","","","","","","","","","","","","","5","P -1","-P 1","2","","((((C H3)3 Si)2 Si O)2)2 Zn3 (C H3)2","","- C26 H78 O4 Si12 Zn3 -","- C26 H78 O4 Si12 Zn3 -","- C26 H78 O4 Si12 Zn3 -","1","0.5","","Krempner, C.; Weichert, K.; Reinke, H.","Synthesis and structure of cyclic trinuclear zinc disiloxides","European Journal of Inorganic Chemistry","2007","2007","","1067","1071","","","","","","","","","","","","","","","","","","","","","","has coordinates","151158","2020-10-21","18:00:00",""
"4031250","13.9735","","14.1182","","18.5569","","81.709","","68.877","","65.284","","3102.01","","","","","","","","","","","","","5","P -1","-P 1","2","","((C H3)2 Si (((C H3)3 Si)2 Si O)2)2 Zn3 (C H3)2","","- C30 H90 O4 Si14 Zn3 -","- C30 H90 O4 Si14 Zn3 -","- C60 H180 O8 Si28 Zn6 -","2","1","","Krempner, C.; Reinke, H.; Weichert, K.","Synthesis and structure of cyclic trinuclear zinc disiloxides","European Journal of Inorganic Chemistry","2007","2007","","1067","1071","","","","","","","","","","","","","","","","","","","","","","has coordinates","151159","2020-10-21","18:00:00",""
"4031252","10.4557","","9.8265","","10.9323","","90","","90","","90","","1123.22","","","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Na Mn (O3 P C H (O H) C O2)","","- C2 H2 Mn Na O6 P -","- C2 H2 Mn Na O6 P -","- C16 H16 Mn8 Na8 O48 P8 -","8","1","","Lai Zhuzhi; Fu Ruibiao; Hu Shengmin; Wu Xintao","Syntheses, crystal structures, thermal stabilities, and magnetic and luminescent properties of 3D heterometal phosphonates: Na M [O3 P C H (O H) C O2] (M = Mn, Fe, Co, Zn)","European Journal of Inorganic Chemistry","2007","2007","","5439","5446","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031253","10.1998","","9.689","","10.7943","","90","","90","","90","","1066.76","","","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Na Co (O3 P C H (O H) C O2)","","- C2 H2 Co Na O6 P -","- C2 H2 Co Na O6 P -","- C16 H16 Co8 Na8 O48 P8 -","8","1","","Lai Zhuzhi; Fu Ruibiao; Hu Shengmin; Wu Xintao","Syntheses, crystal structures, thermal stabilities, and magnetic and luminescent properties of 3D heterometal phosphonates: Na M [O3 P C H (O H) C O2] (M = Mn, Fe, Co, Zn)","European Journal of Inorganic Chemistry","2007","2007","","5439","5446","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031254","10.1365","","9.6893","","10.7942","","90","","90","","90","","1060.16","","","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Na Zn (O3 P C H (O H) C O2)","","- C2 H2 Na O6 P Zn -","- C2 H2 Na O6 P Zn -","- C16 H16 Na8 O48 P8 Zn8 -","8","1","","Lai Zhuzhi; Hu Shengmin; Fu Ruibiao; Wu Xintao","Syntheses, crystal structures, thermal stabilities, and magnetic and luminescent properties of 3D heterometal phosphonates: Na M [O3 P C H (O H) C O2] (M = Mn, Fe, Co, Zn)","European Journal of Inorganic Chemistry","2007","2007","","5439","5446","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031255","5.74644","","5.74644","","24.0433","","90","","90","","120","","687.579","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ba (Mn0.4 Fe0.6) O2.73","","- Ba Fe0.6 Mn0.4 O2.73 -","- Ba Fe0.5998 Mn0.4002 O2.7296 -","- Ba10 Fe5.998 Mn4.002 O27.296 -","10","0.416667","","Miranda, L.; Ramirez-Castellanos, J.; Hernando, M.; Varela, A.; Parras, M.; Gonzalez-Calbet, J.M.","Structural chemistry of a new 10H hexagonal perovskite: Ba Mn0.4 Fe0.6 O2.73","European Journal of Inorganic Chemistry","2007","2007","","2129","2135","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031256","7.2793","","8.506","","5.621","","90","","90","","90","","348.04","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","Ho Fe0.92 Mn1.08 O4.74","","- Fe0.92 Ho Mn1.08 O4.74 -","- Fe0.92 Ho Mn1.08 O4.75 -","- Fe3.68 Ho4 Mn4.32 O19 -","4","0.5","","Munoz, A.; Alonso, J.A.; Martinez-Lope, M.J.; Martinez, J.L.","Synthesis and study of the crystallographic and magnetic structure of Ho Fe Mn O3","European Journal of Inorganic Chemistry","2007","2007","","1972","1979","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031257","12.377","","11.038","","15.24","","90","","91.92","","90","","2080.88","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(Mo2 O5 (O S (C H3)2)6) (Mo6 O19)","","- C12 H36 Mo8 O30 S6 -","- C12 H36 Mo8 O30 S6 -","- C24 H72 Mo16 O60 S12 -","2","0.5","","Pedrosa M.R.; Aguado, R.; Diez V.; Escribano, J.; Arnaiz, F.J.; Sanz, R.","Unprecedented rearrangement of molybdenum(VI) oxide to (mu2-oxido)-bis[dioxidomolybdenum(VI)] hexamolybdate","European Journal of Inorganic Chemistry","2007","2007","","3952","3954","","","","","","","","","","","","","","","","","","","","","","has coordinates","151483","2020-10-21","18:00:00",""
"4031278","10.7632","","10.7632","","10.7632","","90","","90","","90","","1246.88","","","","","","","","","","","","","6","F m -3 m","-F 4 2 3","225","","Mn (Mn0.2 Cr0.8 (C N)6) (H2 O)4","","- C6 H8 Cr0.8 Mn1.2 N6 O4 -","- C6 H8.01595 Cr0.8 Mn1.2 N6 O3.99798 -","- C24 H32.0638 Cr3.2 Mn4.8 N24 O15.9919 -","4","0.0208333","","Shen Xiaoping; Li Yizhi; Guo Guocong; Xu Zheng; Song You","Single-Crystal Structure and Magnetic Behavior of a Molecule-Based Ferrimagnet Mn[Mn0.2Cr0.8(CN)6]·4H2O","European Journal of Inorganic Chemistry","2007","2007","","1698","1702","","","","","","","","","","","","","","","","","","","","","","has coordinates","152034","2020-10-21","18:00:00",""
"4063237","12.047","0.002","15.28","0.003","16.888","0.003","90","","101.172","0.003","90","","3049.8","1","120","2","120","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H33 Mo2 O7 P W -","- C29 H33 Mo2 O7 P W -","- C116 H132 Mo8 O28 P4 W4 -","4","1","","Celedonio M. Alvarez; M. Angeles Alvarez; M. Esther García; Alberto Ramos; Miguel A. Ruiz; Claudia Graiff; Antonio Tiripicchio","Reactivity of the Unsaturated Hydride [Mo2(5η-C5H5)2(μ-H)(μ-PCy2)(CO)2] toward 17- and 16-Electron Metal Carbonyl Fragments: Rational Synthesis of Electron-Deficient Heterometallic Clusters","Organometallics","2007","26","","321","331","10.1021/om060826v","","x-ray","0.71073","MoKα","","0.0452","0.0235","","","0.0433","0.0526","","","","","","1.199","","","","has coordinates","277847","2022-09-14","22:28:06",""
"4063238","9.9059","0.0018","22.193","0.004","13.832","0.002","90","","100.521","0.003","90","","2989.7","0.9","120","2","120","2","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","","","","- C32 H40 Mn Mo2 O4 P -","- C32 H40 Mn Mo2 O4 P -","- C128 H160 Mn4 Mo8 O16 P4 -","4","2","","Celedonio M. Alvarez; M. Angeles Alvarez; M. Esther García; Alberto Ramos; Miguel A. Ruiz; Claudia Graiff; Antonio Tiripicchio","Reactivity of the Unsaturated Hydride [Mo2(5η-C5H5)2(μ-H)(μ-PCy2)(CO)2] toward 17- and 16-Electron Metal Carbonyl Fragments: Rational Synthesis of Electron-Deficient Heterometallic Clusters","Organometallics","2007","26","","321","331","10.1021/om060826v","","x-ray","0.71073","MoKα","","0.0886","0.0444","","","0.0644","0.0776","","","","","","1.115","","","","has coordinates","277847","2022-09-14","22:28:06",""
"4063239","18.725","0.005","16.262","0.005","17.103","0.005","90","","107.51","0.05","90","","4967","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H27 Fe Mo O6 P -","- C23 H27 Fe Mo O6 P -","- C184 H216 Fe8 Mo8 O48 P8 -","8","2","","Celedonio M. Alvarez; M. Angeles Alvarez; M. Esther García; Alberto Ramos; Miguel A. Ruiz; Claudia Graiff; Antonio Tiripicchio","Reactivity of the Unsaturated Hydride [Mo2(5η-C5H5)2(μ-H)(μ-PCy2)(CO)2] toward 17- and 16-Electron Metal Carbonyl Fragments: Rational Synthesis of Electron-Deficient Heterometallic Clusters","Organometallics","2007","26","","321","331","10.1021/om060826v","","","0.71073","MoKα","","0.079","0.0356","","","0.078","0.0898","","","","","","0.808","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063240","9.969","0.001","10.286","0.001","11.985","0.001","80.957","0.003","86.821","0.003","75.278","0.003","1173.7","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H26 Br2 N4 O -","- C25 H26 Br2 N4 O -","- C50 H52 Br4 N8 O2 -","2","1","","Murray V. Baker; David H. Brown; Valerie J. Hesler; Brian W. Skelton; Allan H. White","Synthesis of a Bis(N-heterocyclic carbene)palladium Complex via Oxidative Addition of a C-C Bond in a Biimidazolium Ion","Organometallics","2007","26","","250","252","10.1021/om0610546","","","0.71073","MoKα","","0.093","0.045","","0.114","","0.114","","","1.038","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4063241","9.2022","0.0005","15.0505","0.0008","11.0279","0.0006","90","","104.603","0.001","90","","1478","0.14","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H16 I2 N4 -","- C10 H16 I2 N4 -","- C40 H64 I8 N16 -","4","1","","Murray V. Baker; David H. Brown; Valerie J. Hesler; Brian W. Skelton; Allan H. White","Synthesis of a Bis(N-heterocyclic carbene)palladium Complex via Oxidative Addition of a C-C Bond in a Biimidazolium Ion","Organometallics","2007","26","","250","252","10.1021/om0610546","","","0.71073","MoKα","","0.029","0.025","","","0.056","0.062","","","1.046","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4063242","38.434","0.002","48.007","0.003","12.708","0.0007","90","","90","","90","","23448","2","150","2","150","2","","","","","","","","8","F d d 2","F 2 -2d","43","","","","- C65.8 H58.6 B Br Cl3.6 N4 P Pd -","- C65.801 H58.602 B Br Cl3.602 N4 P Pd -","- C1052.82 H937.632 B16 Br16 Cl57.632 N64 P16 Pd16 -","16","1","","Murray V. Baker; David H. Brown; Valerie J. Hesler; Brian W. Skelton; Allan H. White","Synthesis of a Bis(N-heterocyclic carbene)palladium Complex via Oxidative Addition of a C-C Bond in a Biimidazolium Ion","Organometallics","2007","26","","250","252","10.1021/om0610546","","","0.71073","MoKα","","0.0499","0.0367","","","0.084","0.0905","","","","","","1.05","","","","has coordinates","201913","2020-10-21","18:00:00",""
"4063245","10.9946","0.0005","16.3024","0.0007","16.053","0.0007","90","","102.311","0.002","90","","2811.1","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H42 F6 Fe P4 Si -","- C21 H42 F6 Fe P4 Si -","- C84 H168 F24 Fe4 P16 Si4 -","4","1","","Andrew R. Battle; Peter G. Edwards; Robert Haigh; David E. Hibbs; Dongmei Li; Sam M. Liddiard; Paul D. Newman","Synthesis and Characterization of Iron(II) Complexes of 10- and 11-Membered Triphosphamacrocycles","Organometallics","2007","26","","377","386","10.1021/om060798g","","","0.71073","MoKα","","0.0814","0.0591","","","0.1183","0.129","","","","","","1.061","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063246","42.467","0.006","42.467","0.006","9.69","0.002","90","","90","","120","","15134","4","293","2","150","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C24 H38 F6 Fe P4 -","- C24 H38 F6 Fe P4 -","- C432 H684 F108 Fe18 P72 -","18","1","","Andrew R. Battle; Peter G. Edwards; Robert Haigh; David E. Hibbs; Dongmei Li; Sam M. Liddiard; Paul D. Newman","Synthesis and Characterization of Iron(II) Complexes of 10- and 11-Membered Triphosphamacrocycles","Organometallics","2007","26","","377","386","10.1021/om060798g","","","0.71073","MoKα","","0.1045","0.0771","","","0.2155","0.2286","","","","","","1.08","","","","has coordinates,has disorder","178527","2020-10-21","18:00:00",""
"4063247","9.031","0.0002","15.233","0.0003","19.733","0.0004","90","","90","","90","","2714.65","0.1","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H36 F6 Fe P4 -","- C25 H36 F6 Fe P4 -","- C100 H144 F24 Fe4 P16 -","4","1","","Andrew R. Battle; Peter G. Edwards; Robert Haigh; David E. Hibbs; Dongmei Li; Sam M. Liddiard; Paul D. Newman","Synthesis and Characterization of Iron(II) Complexes of 10- and 11-Membered Triphosphamacrocycles","Organometallics","2007","26","","377","386","10.1021/om060798g","","","0.71073","MoKα","","0.0602","0.0403","","","0.0875","0.0955","","","","","","1.065","","","","has coordinates","120119","2020-10-21","18:00:00",""
"4063248","17.049","0.003","10.321","0.002","14.731","0.003","90","","106.4","0.03","90","","2486.6","0.9","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H37 Hf P Si2 -","- C21 H37 Hf P Si2 -","- C84 H148 Hf4 P4 Si8 -","4","1","","Torsten Beweries; Vladimir V. Burlakov; Marc A. Bach; Perdita Arndt; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Complexation of Bis(trimethylsilyl)acetylene by Decamethylhafnocene To Give the Hafnacyclopropene Cp*2Hf(η2-Me3SiC2SiMe3): An Unusually Strong Metal-Alkyne Interaction","Organometallics","2007","26","","247","249","10.1021/om0609259","","","0.71073","MoKα","","0.0302","0.019","","","0.0328","0.034","","","","","","0.902","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063249","9.1752","0.0005","10.2781","0.0006","17.3302","0.001","79.114","0.005","75.599","0.004","72.852","0.004","1500.75","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H48 Hf Si2 -","- C28 H48 Hf Si2 -","- C56 H96 Hf2 Si4 -","2","1","","Torsten Beweries; Vladimir V. Burlakov; Marc A. Bach; Perdita Arndt; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Complexation of Bis(trimethylsilyl)acetylene by Decamethylhafnocene To Give the Hafnacyclopropene Cp*2Hf(η2-Me3SiC2SiMe3): An Unusually Strong Metal-Alkyne Interaction","Organometallics","2007","26","","247","249","10.1021/om0609259","","","0.71073","MoKα","","0.0323","0.0232","","","0.0419","0.0429","","","","","","0.947","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063253","24.772","0.009","9.545","0.003","28.6","0.01","90","","111.08","0.009","90","","6310","4","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 F21 I Ir P -","- C23 H24 F21 I Ir P -","- C184 H192 F168 I8 Ir8 P8 -","8","2","","Cheryl J. Bourgeois; Hui Huang; Roman B. Larichev; Lev N. Zakharov; Arnold L. Rheingold; Russell P. Hughes","Variable-Temperature NMR Determination of the Barriers to Rotation about the Ir-C σ-Bond in a Series of Primary Perfluoroalkyl Iridium Complexes [IrCp*{(CF2)nCF3}(PMe3)2]+X- [n =1, 2, 3, 5, 7, 9, 11; X =I, OTf]","Organometallics","2007","26","","264","271","10.1021/om060822q","","","0.71073","MoKα","","0.0722","0.0615","","","0.181","0.1933","","","","","","1.101","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063254","21.236","0.003","8.7661","0.001","20.491","0.002","90","","94.16","0.002","90","","3804.4","0.8","208","2","208","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H37 F21 I Ir O2 P2 -","- C26 H37 F21 I Ir O2 P2 -","- C104 H148 F84 I4 Ir4 O8 P8 -","4","1","","Cheryl J. Bourgeois; Hui Huang; Roman B. Larichev; Lev N. Zakharov; Arnold L. Rheingold; Russell P. Hughes","Variable-Temperature NMR Determination of the Barriers to Rotation about the Ir-C σ-Bond in a Series of Primary Perfluoroalkyl Iridium Complexes [IrCp*{(CF2)nCF3}(PMe3)2]+X- [n =1, 2, 3, 5, 7, 9, 11; X =I, OTf]","Organometallics","2007","26","","264","271","10.1021/om060822q","","","0.71073","MoKα","","0.0555","0.0371","","","0.0856","0.097","","","","","","1.03","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063255","14.187","0.003","8.671","0.0017","15.227","0.003","90","","97.669","0.003","90","","1856.4","0.6","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 F5 Ir O2 -","- C17 H22 F5 Ir O2 -","- C68 H88 F20 Ir4 O8 -","4","1","","Cheryl J. Bourgeois; Hui Huang; Roman B. Larichev; Lev N. Zakharov; Arnold L. Rheingold; Russell P. Hughes","Variable-Temperature NMR Determination of the Barriers to Rotation about the Ir-C σ-Bond in a Series of Primary Perfluoroalkyl Iridium Complexes [IrCp*{(CF2)nCF3}(PMe3)2]+X- [n =1, 2, 3, 5, 7, 9, 11; X =I, OTf]","Organometallics","2007","26","","264","271","10.1021/om060822q","","","0.71073","MoKα","","0.026","0.0234","","","0.0649","0.066","","","","","","1.039","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063264","10.031","0.013","11.34","0.02","24.499","0.008","90","","90","","90","","2787","6","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C30 H37 N2 P Pd -","- C30 H37 N2 P Pd -","- C120 H148 N8 P4 Pd4 -","4","1","","Andreas A. Danopoulos; Nikolaos Tsoureas; Stuart A. Macgregor; Christopher Smith","Phosphine- and Pyridine-Functionalized N-Heterocyclic Carbene Methyl and Allyl Complexes of Palladium. Unexpected Regiospecificity of the Protonation Reaction of the Dimethyl Complexes","Organometallics","2007","26","","253","263","10.1021/om0608408","","","0.71073","MoKα","","0.0785","0.0483","","","0.0852","0.0959","","","","","","1.028","","","","has coordinates","277847","2022-09-14","22:28:06",""
"4063265","10.408","0.006","12.139","0.007","17.357","0.011","90","","105.97","0.04","90","","2108","2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H31 N3 Pd -","- C23 H31 N3 Pd -","- C92 H124 N12 Pd4 -","4","1","","Andreas A. Danopoulos; Nikolaos Tsoureas; Stuart A. Macgregor; Christopher Smith","Phosphine- and Pyridine-Functionalized N-Heterocyclic Carbene Methyl and Allyl Complexes of Palladium. Unexpected Regiospecificity of the Protonation Reaction of the Dimethyl Complexes","Organometallics","2007","26","","253","263","10.1021/om0608408","","","0.71073","MoKα","","0.1204","0.1037","","","0.2363","0.2443","","","","","","1.188","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063266","10.936","0.014","27.06","0.03","13.47","0.04","90","","107.64","0.19","90","","3799","13","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H52 N6 Pd -","- C42 H52 N6 Pd -","- C168 H208 N24 Pd4 -","4","1","","Andreas A. Danopoulos; Nikolaos Tsoureas; Stuart A. Macgregor; Christopher Smith","Phosphine- and Pyridine-Functionalized N-Heterocyclic Carbene Methyl and Allyl Complexes of Palladium. Unexpected Regiospecificity of the Protonation Reaction of the Dimethyl Complexes","Organometallics","2007","26","","253","263","10.1021/om0608408","","","0.71073","MoKα","","0.0507","0.0363","","","0.0749","0.0798","","","","","","1.047","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063267","13.149","0.002","14.181","0.002","15.6998","0.0017","115.11","0.012","90.856","0.013","114.148","0.016","2355","0.8","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H50 B N3 Pd -","- C48 H50 B N3 Pd -","- C96 H100 B2 N6 Pd2 -","2","1","","Andreas A. Danopoulos; Nikolaos Tsoureas; Stuart A. Macgregor; Christopher Smith","Phosphine- and Pyridine-Functionalized N-Heterocyclic Carbene Methyl and Allyl Complexes of Palladium. Unexpected Regiospecificity of the Protonation Reaction of the Dimethyl Complexes","Organometallics","2007","26","","253","263","10.1021/om0608408","","","0.71073","MoKα","","0.0989","0.068","","","0.1597","0.1735","","","","","","1.056","","","","has coordinates,has disorder","277847","2022-09-14","22:28:06",""
"4063268","16.07","0.003","16.422","0.003","19.758","0.004","90","","112.77","0.03","90","","4808","1.9","120","2","120","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C57 H60 B N2 P Pd -","- C57 H60 B N2 P Pd -","- C228 H240 B4 N8 P4 Pd4 -","4","1","","Andreas A. Danopoulos; Nikolaos Tsoureas; Stuart A. Macgregor; Christopher Smith","Phosphine- and Pyridine-Functionalized N-Heterocyclic Carbene Methyl and Allyl Complexes of Palladium. Unexpected Regiospecificity of the Protonation Reaction of the Dimethyl Complexes","Organometallics","2007","26","","253","263","10.1021/om0608408","","","0.71073","MoKα","","0.0618","0.0417","","","0.0829","0.0897","","","","","","0.997","","","","has coordinates,has disorder","178527","2020-10-21","18:00:00",""
"4063269","24.5559","0.0008","19.7453","0.0007","25.285","0.008","90","","97.34","0.001","90","","12159","4","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C59 H45 B F24 N4 Pd -","- C59 H45 B F24 N4 Pd -","- C472 H360 B8 F192 N32 Pd8 -","8","2","","Andreas A. Danopoulos; Nikolaos Tsoureas; Stuart A. Macgregor; Christopher Smith","Phosphine- and Pyridine-Functionalized N-Heterocyclic Carbene Methyl and Allyl Complexes of Palladium. Unexpected Regiospecificity of the Protonation Reaction of the Dimethyl Complexes","Organometallics","2007","26","","253","263","10.1021/om0608408","","","0.71073","MoKα","","0.1526","0.0786","","","0.1731","0.2053","","","","","","1.031","","","","has coordinates,has disorder","178527","2020-10-21","18:00:00",""
"4063276","16.2295","0.0004","14.5556","0.0003","20.1968","0.0005","90","","113.134","0.001","90","","4387.44","0.18","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C42 H59 B Cl2 F4 N2 Pt -","- C42 H59 B Cl2 F4 N2 Pt -","- C168 H236 B4 Cl8 F16 N8 Pt4 -","4","1","","Tom G. Driver; Travis J. Williams; Jay A. Labinger; John E. Bercaw","C-H Bond Activation by Dicationic Platinum(II) Complexes","Organometallics","2007","26","","294","301","10.1021/om060792r","","","0.71073","MoKα","","0.1167","0.0428","","","0.0733","0.0842","","","","","","1.429","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4063278","11.8485","0.0016","17.045","0.003","24.126","0.005","90","","91.376","0.011","90","","4871","1.5","200","2","200","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C51 H69 Ga N4 Ti3 -","- C51 H69 Ga N4 Ti3 -","- C204 H276 Ga4 N16 Ti12 -","4","1","","María García-Castro; Avelino Martín; Miguel Mena; Carlos Yélamos","Group 13 and 14 Alkyl Derivatives of the Imido-Nitrido Metalloligand [{Ti(η5-C5Me5)(μ-NH)}3(μ3-N)]","Organometallics","2007","26","","408","416","10.1021/om060895+","","x-ray","0.71073","MoKα","","0.0752","0.0444","","","0.0974","0.1106","","","","","","0.912","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063279","11.841","0.0017","17.0019","0.0015","24.252","0.003","90","","91.442","0.011","90","","4880.9","1","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C51 H69 In N4 Ti3 -","- C51 H69 In N4 Ti3 -","- C204 H276 In4 N16 Ti12 -","4","1","","María García-Castro; Avelino Martín; Miguel Mena; Carlos Yélamos","Group 13 and 14 Alkyl Derivatives of the Imido-Nitrido Metalloligand [{Ti(η5-C5Me5)(μ-NH)}3(μ3-N)]","Organometallics","2007","26","","408","416","10.1021/om060895+","","x-ray","0.71073","MoKα","","0.0715","0.0398","","","0.0787","0.0902","","","","","","0.944","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063280","11.1348","0.0011","23.6","0.003","15.1156","0.0014","90","","101.559","0.008","90","","3891.5","0.7","200","2","200","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H57 Al N4 Si Ti3 -","- C34 H57 Al N4 Si Ti3 -","- C136 H228 Al4 N16 Si4 Ti12 -","4","1","","María García-Castro; Avelino Martín; Miguel Mena; Carlos Yélamos","Group 13 and 14 Alkyl Derivatives of the Imido-Nitrido Metalloligand [{Ti(η5-C5Me5)(μ-NH)}3(μ3-N)]","Organometallics","2007","26","","408","416","10.1021/om060895+","","x-ray","0.71073","MoKα","","0.0925","0.0543","","","0.1265","0.1487","","","","","","1.041","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063281","18.467","0.005","11.32","0.005","20.25","0.005","90","0.005","103.73","0.005","90","0.005","4112","2","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H59 Al Cl2 N4 Ti3 -","- C38 H59 Al Cl2 N4 Ti3 -","- C152 H236 Al4 Cl8 N16 Ti12 -","4","1","","María García-Castro; Avelino Martín; Miguel Mena; Carlos Yélamos","Group 13 and 14 Alkyl Derivatives of the Imido-Nitrido Metalloligand [{Ti(η5-C5Me5)(μ-NH)}3(μ3-N)]","Organometallics","2007","26","","408","416","10.1021/om060895+","","x-ray","0.71069","MoKα","","0.0759","0.0478","","","0.1086","0.1241","","","","","","1.056","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063282","11.512","0.0009","12.0957","0.0008","13.315","0.0017","95.601","0.009","100.525","0.008","98.434","0.007","1788.3","0.3","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C33 H56 N4 Sn Ti3 -","- C33 H56 N4 Sn Ti3 -","- C66 H112 N8 Sn2 Ti6 -","2","1","","María García-Castro; Avelino Martín; Miguel Mena; Carlos Yélamos","Group 13 and 14 Alkyl Derivatives of the Imido-Nitrido Metalloligand [{Ti(η5-C5Me5)(μ-NH)}3(μ3-N)]","Organometallics","2007","26","","408","416","10.1021/om060895+","","x-ray","0.71073","MoKα","","0.0725","0.0519","","","0.1263","0.139","","","","","","1.093","","","","has coordinates","277847","2022-09-14","22:28:06",""
"4063283","11.029","0.002","17.9117","0.0019","19.7803","0.0013","111.658","0.008","90.192","0.009","102.22","0.011","3535.1","0.8","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C33 H56 Ge N4 Ti3 -","- C33 H56 Ge N4 Ti3 -","- C132 H224 Ge4 N16 Ti12 -","4","2","","María García-Castro; Avelino Martín; Miguel Mena; Carlos Yélamos","Group 13 and 14 Alkyl Derivatives of the Imido-Nitrido Metalloligand [{Ti(η5-C5Me5)(μ-NH)}3(μ3-N)]","Organometallics","2007","26","","408","416","10.1021/om060895+","","x-ray","0.71073","MoKα","","0.0874","0.0565","","","0.1405","0.1677","","","","","","0.982","","","","has coordinates","277847","2022-09-14","22:28:06",""
"4063287","19.3265","0.0007","10.2203","0.0003","27.9288","0.0009","90","","109.598","0.002","90","","5197","0.3","213","","213","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C61 H55 Fe2 O7 P Ru2 -","- C61 H55 Fe2 O7 P Ru2 -","- C244 H220 Fe8 O28 P4 Ru8 -","4","1","","Gou Higashihara; Masako Terada; Akiko Inagaki; Munetaka Akita","C-C Coupling of a Permetalated Ethene, (μ4-C=C)Ru2(FeCp*)2(CO)10, with Alkynes, and Isolation of a Labile MeCN Adduct, (μ4-C\δb C)Ru2(FeCp*)2(CO)8(NCMe)2","Organometallics","2007","26","","439","444","10.1021/om0609160","","","0.7107","MoKα","","","0.0418","","","","0.125","","","","","","0.852","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4063288","17.875","0.002","19.581","0.002","14.3792","0.0008","101.1","0.005","97.559","0.004","85.12","0.002","4886.7","0.7","213","","213","","","","","","","","","7","P -1","-P 1","2","","","","- C51 H48 Cl2 Fe2 O8 Ru2 Si -","- C51 H47 Cl2 Fe2 O8 Ru2 Si -","- C204 H188 Cl8 Fe8 O32 Ru8 Si4 -","4","2","","Gou Higashihara; Masako Terada; Akiko Inagaki; Munetaka Akita","C-C Coupling of a Permetalated Ethene, (μ4-C=C)Ru2(FeCp*)2(CO)10, with Alkynes, and Isolation of a Labile MeCN Adduct, (μ4-C\δb C)Ru2(FeCp*)2(CO)8(NCMe)2","Organometallics","2007","26","","439","444","10.1021/om0609160","","","0.7107","MoKα","","","0.0837","","","","0.2055","","","","","","0.86","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4063289","30.9399","0.0004","11.5905","0.0002","40.1255","0.0006","90","","113.399","0.0009","90","","13206","0.4","213","","213","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C70 H64 Cl2 Fe2 O7 Ru2 Si2 -","- C70 H62 Cl2 Fe2 O7 Ru2 Si2 -","- C560 H496 Cl16 Fe16 O56 Ru16 Si16 -","8","1","","Gou Higashihara; Masako Terada; Akiko Inagaki; Munetaka Akita","C-C Coupling of a Permetalated Ethene, (μ4-C=C)Ru2(FeCp*)2(CO)10, with Alkynes, and Isolation of a Labile MeCN Adduct, (μ4-C\δb C)Ru2(FeCp*)2(CO)8(NCMe)2","Organometallics","2007","26","","439","444","10.1021/om0609160","","","0.7107","MoKα","","","0.0487","","","","0.1364","","","","","","0.721","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4063290","11.292","0.008","13.849","0.007","27.36","0.02","90","","94.49","0.03","90","","4265","4","213","","213","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H44 Fe2 N2 O8 Ru2 -","- C41 H36 Fe2 N2 O8 Ru2 -","- C164 H144 Fe8 N8 O32 Ru8 -","4","1","","Gou Higashihara; Masako Terada; Akiko Inagaki; Munetaka Akita","C-C Coupling of a Permetalated Ethene, (μ4-C=C)Ru2(FeCp*)2(CO)10, with Alkynes, and Isolation of a Labile MeCN Adduct, (μ4-C\δb C)Ru2(FeCp*)2(CO)8(NCMe)2","Organometallics","2007","26","","439","444","10.1021/om0609160","","","0.7107","MoKα","","","0.0726","","","","0.2201","","","","","","0.89","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4063291","14.707","0.007","11.346","0.005","20.62","0.01","90","","90.57","0.02","90","","3440","2","213","","213","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C34 H34 Fe2 O10 Ru2 -","- C34 H34 Fe2 O10 Ru2 -","- C136 H136 Fe8 O40 Ru8 -","4","1","","Gou Higashihara; Masako Terada; Akiko Inagaki; Munetaka Akita","C-C Coupling of a Permetalated Ethene, (μ4-C=C)Ru2(FeCp*)2(CO)10, with Alkynes, and Isolation of a Labile MeCN Adduct, (μ4-C\δb C)Ru2(FeCp*)2(CO)8(NCMe)2","Organometallics","2007","26","","439","444","10.1021/om0609160","","","0.7107","MoKα","","","0.0408","","","","0.1086","","","","","","0.987","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4063318","10.863","0.002","20.08","0.004","14.337","0.003","90","","95.899","0.004","90","","3110.9","1.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H33 Cl4 N3 P2 Ru -","- C30 H33 Cl4 N3 P2 Ru -","- C120 H132 Cl16 N12 P8 Ru4 -","4","1","","Charles A. Mebi; Radhika P. Nair; Brian J. Frost","pH-Dependent Selective Transfer Hydrogenation of α,β-Unsaturated Carbonyls in Aqueous Media Utilizing Half-Sandwich Ruthenium(II) Complexes","Organometallics","2007","26","","429","438","10.1021/om060892x","","","0.71073","MoKα","","0.0699","0.0554","","","0.1398","0.1455","","","","","","1.019","","","","has coordinates","178528","2020-10-21","18:00:00",""
"4063319","17.0102","0.0006","9.5281","0.0003","19.0872","0.0007","90","","115.603","0.001","90","","2789.8","0.17","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H36 Cl N3 P2 Ru -","- C32 H36 Cl N3 P2 Ru -","- C128 H144 Cl4 N12 P8 Ru4 -","4","1","","Charles A. Mebi; Radhika P. Nair; Brian J. Frost","pH-Dependent Selective Transfer Hydrogenation of α,β-Unsaturated Carbonyls in Aqueous Media Utilizing Half-Sandwich Ruthenium(II) Complexes","Organometallics","2007","26","","429","438","10.1021/om060892x","","","0.71073","MoKα","","0.0663","0.0364","","","0.0721","0.0759","","","","","","0.811","","","","has coordinates","178528","2020-10-21","18:00:00",""
"4063320","18.2731","0.0008","17.523","0.0008","6.9254","0.0003","90","","90","","90","","2217.51","0.17","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C20 H33 Cl N6 P2 Ru -","- C20 H33 Cl N6 P2 Ru -","- C80 H132 Cl4 N24 P8 Ru4 -","4","1","","Charles A. Mebi; Radhika P. Nair; Brian J. Frost","pH-Dependent Selective Transfer Hydrogenation of α,β-Unsaturated Carbonyls in Aqueous Media Utilizing Half-Sandwich Ruthenium(II) Complexes","Organometallics","2007","26","","429","438","10.1021/om060892x","","x-ray","0.71073","MoKα","","0.0417","0.0345","","","0.0729","0.0761","","","","","","1.033","","","","has coordinates","130149","2020-10-21","18:00:00",""
"4063321","16.9997","0.0009","9.6556","0.0005","18.9784","0.001","90","","115.722","0.001","90","","2806.5","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H34 Cl N3 P2 Ru -","- C33 H34 Cl N3 P2 Ru -","- C132 H136 Cl4 N12 P8 Ru4 -","4","1","","Charles A. Mebi; Radhika P. Nair; Brian J. Frost","pH-Dependent Selective Transfer Hydrogenation of α,β-Unsaturated Carbonyls in Aqueous Media Utilizing Half-Sandwich Ruthenium(II) Complexes","Organometallics","2007","26","","429","438","10.1021/om060892x","","x-ray","0.71073","MoKα","","0.0692","0.0403","","","0.0866","0.0934","","","","","","0.983","","","","has coordinates","178528","2020-10-21","18:00:00",""
"4063322","14.0277","0.001","11.7222","0.0008","26.5468","0.0019","90","","95.688","0.001","90","","4343.7","0.5","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H48 Cl5 N6 P3 Ru Sn -","- C40 H48 Cl5 N6 P3 Ru Sn -","- C160 H192 Cl20 N24 P12 Ru4 Sn4 -","4","1","","Charles A. Mebi; Radhika P. Nair; Brian J. Frost","pH-Dependent Selective Transfer Hydrogenation of α,β-Unsaturated Carbonyls in Aqueous Media Utilizing Half-Sandwich Ruthenium(II) Complexes","Organometallics","2007","26","","429","438","10.1021/om060892x","","","0.71073","MoKα","","0.1542","0.0641","","","0.1045","0.1221","","","","","","0.904","","","","has coordinates","178528","2020-10-21","18:00:00",""
"4063323","9.6416","0.0004","11.0933","0.0005","12.6741","0.0006","99.445","0.001","102.099","0.001","96.181","0.001","1293.24","0.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H33 N3 P2 Ru -","- C29 H33 N3 P2 Ru -","- C58 H66 N6 P4 Ru2 -","2","1","","Charles A. Mebi; Radhika P. Nair; Brian J. Frost","pH-Dependent Selective Transfer Hydrogenation of α,β-Unsaturated Carbonyls in Aqueous Media Utilizing Half-Sandwich Ruthenium(II) Complexes","Organometallics","2007","26","","429","438","10.1021/om060892x","","","0.71073","MoKα","","0.0344","0.0288","","","0.0696","0.0714","","","","","","1.068","","","","has coordinates","178528","2020-10-21","18:00:00",""
"4063324","9.9727","0.0007","10.4488","0.0007","15.4665","0.0013","95.481","0.001","90.699","0.001","117.465","0.001","1420.58","0.18","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H35 N3 P2 Ru -","- C33 H35 N3 P2 Ru -","- C66 H70 N6 P4 Ru2 -","2","1","","Charles A. Mebi; Radhika P. Nair; Brian J. Frost","pH-Dependent Selective Transfer Hydrogenation of α,β-Unsaturated Carbonyls in Aqueous Media Utilizing Half-Sandwich Ruthenium(II) Complexes","Organometallics","2007","26","","429","438","10.1021/om060892x","","","0.71073","MoKα","","0.0886","0.0548","","","0.1228","0.1378","","","","","","1.004","","","","has coordinates,has disorder","178528","2020-10-21","18:00:00",""
"4063328","13.118","0.006","12.472","0.005","15.82","0.008","90","","111.22","0.02","90","","2412.8","1.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H29 Cl2 N Si2 Ti -","- C20 H29 Cl2 N Si2 Ti -","- C80 H116 Cl8 N4 Si8 Ti4 -","4","1","","Cristina Ramos; Pascual Royo; Maurizio Lanfranchi; Maria A. Pellinghelli; Antonio Tiripicchio","[(Allylsilyl)(η-amidosilyl)-η5-cyclopentadienyl] Group 4 Metal Complexes: Synthesis, Reactivity, and Olefin Polymerization","Organometallics","2007","26","","445","454","10.1021/om060900+","","","0.71073","MoKα","","0.0818","0.0572","","","0.1497","0.165","","","","","","0.981","","","","has coordinates,has disorder","178528","2020-10-21","18:00:00",""
"4063329","25.8","0.012","11.597","0.008","20.893","0.01","90","","128.79","0.02","90","","4873","5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H34 Cl N Si2 Zr -","- C21 H34 Cl N Si2 Zr -","- C168 H272 Cl8 N8 Si16 Zr8 -","8","1","","Cristina Ramos; Pascual Royo; Maurizio Lanfranchi; Maria A. Pellinghelli; Antonio Tiripicchio","[(Allylsilyl)(η-amidosilyl)-η5-cyclopentadienyl] Group 4 Metal Complexes: Synthesis, Reactivity, and Olefin Polymerization","Organometallics","2007","26","","445","454","10.1021/om060900+","","","0.71073","MoKα","","0.077","0.0334","","","0.0707","0.0807","","","","","","0.913","","","","has coordinates","178528","2020-10-21","18:00:00",""
"4063330","25.784","0.012","11.589","0.006","20.647","0.01","90","","127.95","0.02","90","","4865","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H34 Cl Hf N Si2 -","- C21 H34 Cl Hf N Si2 -","- C168 H272 Cl8 Hf8 N8 Si16 -","8","1","","Cristina Ramos; Pascual Royo; Maurizio Lanfranchi; Maria A. Pellinghelli; Antonio Tiripicchio","[(Allylsilyl)(η-amidosilyl)-η5-cyclopentadienyl] Group 4 Metal Complexes: Synthesis, Reactivity, and Olefin Polymerization","Organometallics","2007","26","","445","454","10.1021/om060900+","","","0.71073","MoKα","","0.0542","0.0351","","","0.0767","0.0858","","","","","","1.015","","","","has coordinates","178528","2020-10-21","18:00:00",""
"4063331","7.4995","0.0006","11.8983","0.001","13.9878","0.0012","90","","90","","90","","1248.15","0.18","133","2","133","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C14 H16 Ge Ti -","- C14 H16 Ge Ti -","- C56 H64 Ge4 Ti4 -","4","0.5","","Matthias Tamm; Andreas Kunst; Thomas Bannenberg; Sören Randoll; Peter G. Jones","Synthesis and Reactivity of Silicon- and Germanium-Bridged ansa-Cycloheptatrienyl-Cyclopentadienyl Titanium Complexes","Organometallics","2007","26","","417","424","10.1021/om060928l","","","0.71073","MoKα","","0.0287","0.0217","","","0.055","0.0588","","","","","","1.156","","","","has coordinates","277847","2022-09-14","22:28:06",""
"4063332","16.114","0.003","18.939","0.003","25.987","0.005","90","","98.317","0.004","90","","7847","2","153","2","153","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C51 H48 O4 P2 -","- C49.75 H36 O4 P2 -","- C398 H288 O32 P16 -","8","2","","Xianghua Yu; Tobin J. Marks","Organophosphine Oxide/Sulfide-Substituted Lanthanide Binaphtholate Catalysts for Enantioselective Hydroamination/Cyclization","Organometallics","2007","26","","365","376","10.1021/om0607999","","","0.71073","MoKα","","0.1719","0.07","","","0.126","0.1489","","","","","","1.001","","","","has coordinates","178528","2020-10-21","18:00:00",""
"4063333","8.7568","0.0009","17.2784","0.0017","9.5484","0.001","90","","104.529","0.002","90","","1398.5","0.2","153","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C30 H36 O4 P2 -","- C30 H36 O4 P2 -","- C60 H72 O8 P4 -","2","1","","Xianghua Yu; Tobin J. Marks","Organophosphine Oxide/Sulfide-Substituted Lanthanide Binaphtholate Catalysts for Enantioselective Hydroamination/Cyclization","Organometallics","2007","26","","365","376","10.1021/om0607999","","","0.71073","MoKα","","0.0695","0.0508","","","0.1241","0.1369","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4063334","11.5165","0.0015","11.7891","0.0015","16.411","0.002","108.081","0.002","101.365","0.002","90.766","0.002","2069.9","0.5","153","2","153","2","","","","","","","","4","P 1","P 1","1","","","","- C45 H60 O4 P2 -","- C45 H60 O4 P2 -","- C90 H120 O8 P4 -","2","2","","Xianghua Yu; Tobin J. Marks","Organophosphine Oxide/Sulfide-Substituted Lanthanide Binaphtholate Catalysts for Enantioselective Hydroamination/Cyclization","Organometallics","2007","26","","365","376","10.1021/om0607999","","","0.71073","MoKα","","0.0695","0.0535","","","0.137","0.1514","","","","","","1.013","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4063335","31.7444","0.0016","31.7444","0.0016","25.393","0.003","90","","90","","120","","22160","3","153","2","293","2","","","","","","","","5","P 63","P 6c","173","","","","- C180 H150 La2 O12 P6 -","- C138 H102 La2 O12 P6 -","- C828 H612 La12 O72 P36 -","6","1","","Xianghua Yu; Tobin J. Marks","Organophosphine Oxide/Sulfide-Substituted Lanthanide Binaphtholate Catalysts for Enantioselective Hydroamination/Cyclization","Organometallics","2007","26","","365","376","10.1021/om0607999","","","0.71073","MoKα","","0.1699","0.0586","","","0.1193","0.1386","","","","","","0.7","","","","has coordinates","178528","2020-10-21","18:00:00",""
"4072436","11.3333","0.0013","9.0086","0.001","15.1704","0.0018","90","","101.477","0.002","90","","1517.9","0.3","173","2","173","2","","","","","","","","4","P 1 n 1","P -2yac","7","","","","- C37 H38 Ge O4 -","- C37 H38 Ge O4 -","- C74 H76 Ge2 O8 -","2","1","","Ech-Cherif El Kettani, Sakina; Lazraq, Mohamed; Ranaivonjatovo, Henri; Escudié, Jean; Gornitzka, Heinz; Ouhsaine, Fatima","Versatile Reactivity of the Germene Mes2GeCR2toward Esters and Related Carbonyl Derivatives","Organometallics","2007","26","15","3729","","10.1021/om060917s","","","0.71073","MoKα","","0.0301","0.0283","","","0.07","0.0712","","","","","","1.043","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072437","11.4843","0.0007","21.4191","0.0013","11.6183","0.0007","90","","103.808","0.001","90","","2775.3","0.3","133","2","133","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C35 H32 Ge O3 -","- C35 H32 Ge O3 -","- C140 H128 Ge4 O12 -","4","1","","Ech-Cherif El Kettani, Sakina; Lazraq, Mohamed; Ranaivonjatovo, Henri; Escudié, Jean; Gornitzka, Heinz; Ouhsaine, Fatima","Versatile Reactivity of the Germene Mes2GeCR2toward Esters and Related Carbonyl Derivatives","Organometallics","2007","26","15","3729","","10.1021/om060917s","","","0.71073","MoKα","","0.0338","0.0284","","","0.0712","0.0738","","","","","","1.039","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072438","9.861","0.002","10.976","0.002","15.163","0.003","108.034","0.004","91.282","0.005","108.565","0.005","1466","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H38 Ge O2 -","- C37 H38 Ge O2 -","- C74 H76 Ge2 O4 -","2","1","","Ech-Cherif El Kettani, Sakina; Lazraq, Mohamed; Ranaivonjatovo, Henri; Escudié, Jean; Gornitzka, Heinz; Ouhsaine, Fatima","Versatile Reactivity of the Germene Mes2GeCR2toward Esters and Related Carbonyl Derivatives","Organometallics","2007","26","15","3729","","10.1021/om060917s","","","0.71073","MoKα","","0.0886","0.0584","","","0.1118","0.1241","","","","","","1.004","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072439","9.672","0.0002","17.937","0.0005","10.592","0.0003","90","","116.492","0.0012","90","","1644.62","0.08","153","2","153","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C35 H52 Cl N2 Rh -","- C35 H52 Cl N2 Rh -","- C70 H104 Cl2 N4 Rh2 -","2","1","","Rosen, Evelyn L.; Sanderson, Matthew D.; Saravanakumar, Shanmuganathan; Bielawski, Christopher W.","Synthesis and Study of the First N-Aryl Acyclic Diaminocarbene and Its Transition-Metal Complexes","Organometallics","2007","26","24","5774","","10.1021/om7007925","","","0.71073","MoKα","","0.1066","0.0685","","","0.1464","0.1636","","","","","","1.114","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072440","32.8293","0.0005","8.9223","0.0001","25.9432","0.0006","90","","95.836","0.001","90","","7559.7","0.2","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H47 Br N4 O5.5 -","- C39 H47 Br N4 O5.5 -","- C312 H376 Br8 N32 O44 -","8","1","","Rosen, Evelyn L.; Sanderson, Matthew D.; Saravanakumar, Shanmuganathan; Bielawski, Christopher W.","Synthesis and Study of the First N-Aryl Acyclic Diaminocarbene and Its Transition-Metal Complexes","Organometallics","2007","26","24","5774","","10.1021/om7007925","","","0.71073","MoKα","","0.0783","0.0466","","","0.1021","0.1134","","","","","","1.093","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072441","10.6234","0.0003","10.8976","0.0004","13.5789","0.0005","103.348","0.0015","103.838","0.0018","106.646","0.0017","1384.63","0.09","153","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H43 I N2 O -","- C27 H41 I N2 O -","- C54 H82 I2 N4 O2 -","2","1","","Rosen, Evelyn L.; Sanderson, Matthew D.; Saravanakumar, Shanmuganathan; Bielawski, Christopher W.","Synthesis and Study of the First N-Aryl Acyclic Diaminocarbene and Its Transition-Metal Complexes","Organometallics","2007","26","24","5774","","10.1021/om7007925","","","0.71073","MoKα","","0.0674","0.0434","","","0.0953","0.1067","","","","","","1.064","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4072442","9.589","0.004","15.738","0.008","7.515","0.004","90","","94.401","0.011","90","","1130.8","1","180","2","180","2","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C22 H22 Cl2 F2 N4 Pt -","- C22 H22 Cl2 F2 N4 Pt -","- C44 H44 Cl4 F4 N8 Pt2 -","2","1","","Newman, Christopher P.; Deeth, Robert J.; Clarkson, Guy J.; Rourke, Jonathan P.","Synthesis of Mixed NHC/L Platinum(II) Complexes: Restricted Rotation of the NHC Group","Organometallics","2007","26","25","6225","","10.1021/om700671y","","","0.71073","MoKα","","0.0923","0.0886","","","0.2123","0.2191","","","","","","1.723","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072443","9.8204","0.0008","12.5661","0.001","20.7877","0.0017","97.024","0.002","91.985","0.002","91.27","0.002","2543.6","0.4","180","2","180","2","","","","","","","","8","P -1","-P 1","2","","","","- C13 H17 Cl2 F N2 O Pt S -","- C13 H17 Cl2 F N2 O Pt S -","- C78 H102 Cl12 F6 N12 O6 Pt6 S6 -","6","3","","Newman, Christopher P.; Deeth, Robert J.; Clarkson, Guy J.; Rourke, Jonathan P.","Synthesis of Mixed NHC/L Platinum(II) Complexes: Restricted Rotation of the NHC Group","Organometallics","2007","26","25","6225","","10.1021/om700671y","","","0.71073","MoKα","","0.0642","0.0396","","","0.0825","0.0893","","","","","","0.972","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072444","7.8123","0.0011","10.1259","0.0015","11.3338","0.0016","91.66","0.003","98.459","0.004","99.046","0.003","874.5","0.2","180","2","180","2","","","","","","","","8","P -1","-P 1","2","","","","- C13 H17 Br Cl2 N2 O Pt S -","- C13 H17 Br Cl2 N2 O Pt S -","- C26 H34 Br2 Cl4 N4 O2 Pt2 S2 -","2","1","","Newman, Christopher P.; Deeth, Robert J.; Clarkson, Guy J.; Rourke, Jonathan P.","Synthesis of Mixed NHC/L Platinum(II) Complexes: Restricted Rotation of the NHC Group","Organometallics","2007","26","25","6225","","10.1021/om700671y","","","0.71073","MoKα","","0.0626","0.0448","","","0.0949","0.1005","","","","","","1.009","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072445","14.3923","0.0015","10.9389","0.0011","32.773","0.003","90","","91.177","0.002","90","","5158.6","0.9","180","2","180","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48.25 H42.25 Cl5.75 F N2 P2 Pt -","- C48.25 H42.25 Cl5.75 F N2 P2 Pt -","- C193 H169 Cl23 F4 N8 P8 Pt4 -","4","1","","Newman, Christopher P.; Deeth, Robert J.; Clarkson, Guy J.; Rourke, Jonathan P.","Synthesis of Mixed NHC/L Platinum(II) Complexes: Restricted Rotation of the NHC Group","Organometallics","2007","26","25","6225","","10.1021/om700671y","","","0.71073","MoKα","","0.1456","0.0707","","","0.1375","0.1633","","","","","","1.026","","","","has coordinates,has disorder","178613","2020-10-21","18:00:00",""
"4072446","9.69","0.003","11.996","0.004","14.311","0.005","90","","92.554","0.008","90","","1661.9","1","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H34 Cl4 N4 Pt -","- C34 H34 Cl4 N4 Pt -","- C68 H68 Cl8 N8 Pt2 -","2","0.5","","Newman, Christopher P.; Deeth, Robert J.; Clarkson, Guy J.; Rourke, Jonathan P.","Synthesis of Mixed NHC/L Platinum(II) Complexes: Restricted Rotation of the NHC Group","Organometallics","2007","26","25","6225","","10.1021/om700671y","","","0.71073","MoKα","","0.0443","0.0264","","","0.0597","0.0635","","","","","","0.976","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072447","17.658","0.003","8.2098","0.0013","25.878","0.004","90","","109.532","0.002","90","","3535.6","1","98","2","98","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C19 H30 Zr -","- C19 H30 Zr -","- C152 H240 Zr8 -","8","2","","Klamo, Sara B.; Wendt, Ola F.; Henling, Larry M.; Day, Michael W.; Bercaw, John E.","Dialkyl and Methyl-Alkyl Zirconocenes: Synthesis and Characterization of Zirconocene-Alkyls That Model the Polymeryl Chain in Alkene Polymerizations","Organometallics","2007","26","12","3018","","10.1021/om0601302","","","0.71073","MoKα","","0.0991","0.0571","","","0.0876","0.0958","","","","","","1.217","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4072448","9.7467","0.0004","25.9839","0.0012","10.2031","0.0005","90","","116.671","0.001","90","","2309.07","0.18","98","2","98","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H42 Zr -","- C25 H42 Zr -","- C100 H168 Zr4 -","4","1","","Klamo, Sara B.; Wendt, Ola F.; Henling, Larry M.; Day, Michael W.; Bercaw, John E.","Dialkyl and Methyl-Alkyl Zirconocenes: Synthesis and Characterization of Zirconocene-Alkyls That Model the Polymeryl Chain in Alkene Polymerizations","Organometallics","2007","26","12","3018","","10.1021/om0601302","","","0.71073","MoKα","","0.0305","0.0247","","","0.0475","0.048","","","","","","2.059","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4072449","9.9621","0.0005","26.8264","0.0013","10.4769","0.0005","90","","116.302","0.001","90","","2510","0.2","98","2","98","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H42 Si2 Zr -","- C23 H42 Si2 Zr -","- C92 H168 Si8 Zr4 -","4","1","","Klamo, Sara B.; Wendt, Ola F.; Henling, Larry M.; Day, Michael W.; Bercaw, John E.","Dialkyl and Methyl-Alkyl Zirconocenes: Synthesis and Characterization of Zirconocene-Alkyls That Model the Polymeryl Chain in Alkene Polymerizations","Organometallics","2007","26","12","3018","","10.1021/om0601302","","","0.71073","MoKα","","0.0362","0.0302","","","0.0514","0.0518","","","","","","2.088","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4072450","8.9772","0.0002","13.5673","0.0004","17.2242","0.0005","101.626","0.001","104.356","0.001","100.419","0.001","1930.85","0.09","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H31 Cl Zr -","- C20 H31 Cl Zr -","- C80 H124 Cl4 Zr4 -","4","2","","Klamo, Sara B.; Wendt, Ola F.; Henling, Larry M.; Day, Michael W.; Bercaw, John E.","Dialkyl and Methyl-Alkyl Zirconocenes: Synthesis and Characterization of Zirconocene-Alkyls That Model the Polymeryl Chain in Alkene Polymerizations","Organometallics","2007","26","12","3018","","10.1021/om0601302","","","0.71073","MoKα","","0.0668","0.039","","","0.0748","0.0786","","","","","","1.157","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4072451","12.5674","0.0014","8.5789","0.001","16.8698","0.0018","90","","99.724","0.011","90","","1792.7","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H24 Ir O P S3 -","- C13 H24 Ir O1.003 P S3.003 -","- C52 H96 Ir4 O4.012 P4 S12.012 -","4","1","","Shaver, Alan; El Mouatassim, Bouchra; Mortini, Florent; Bélanger-Gariépy, Francine; Lough, Alan","Reactions of (η5-C5Me5)Ir(PMe3)(SH)2and (η5-C5Me5)Ir(PMe3)(SH)(H) with Thionylaniline (PhNSO) to Give Novel Iridium S3O and S2O Complexes","Organometallics","2007","26","17","4229","","10.1021/om060399l","","","0.71073","MoKα","","0.0399","0.029","","","0.0606","0.064","","","","","","1.082","","","","has coordinates,has disorder","178613","2020-10-21","18:00:00",""
"4072452","12.4173","0.0002","13.3048","0.0002","14.1418","0.0002","90","","103.355","0.007","90","","2273.18","0.09","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H30 Ir P S3 -","- C20 H30 Ir P S3 -","- C80 H120 Ir4 P4 S12 -","4","1","","Shaver, Alan; El Mouatassim, Bouchra; Mortini, Florent; Bélanger-Gariépy, Francine; Lough, Alan","Reactions of (η5-C5Me5)Ir(PMe3)(SH)2and (η5-C5Me5)Ir(PMe3)(SH)(H) with Thionylaniline (PhNSO) to Give Novel Iridium S3O and S2O Complexes","Organometallics","2007","26","17","4229","","10.1021/om060399l","","","0.71073","MoKα","","0.0396","0.0272","","","0.0566","0.068","","","","","","1.067","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072453","8.8659","0.0008","12.3044","0.001","13.2239","0.0011","79.312","0.005","83.152","0.006","81.035","0.006","1394.2","0.2","220","2","220","2","","","","","","","Synthesized by the authors. See text","7","P -1","-P 1","2","","","","- C22 H35 Cl2 Ir N P S3 -","- C22 H35 Cl2 Ir N P S3 -","- C44 H70 Cl4 Ir2 N2 P2 S6 -","2","1","","Shaver, Alan; El Mouatassim, Bouchra; Mortini, Florent; Bélanger-Gariépy, Francine; Lough, Alan","Reactions of (η5-C5Me5)Ir(PMe3)(SH)2and (η5-C5Me5)Ir(PMe3)(SH)(H) with Thionylaniline (PhNSO) to Give Novel Iridium S3O and S2O Complexes","Organometallics","2007","26","17","4229","","10.1021/om060399l","","","1.54178","CuKα","","0.03","0.0282","","","0.0753","0.0784","","","","","","1.069","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072454","15.9591","0.0001","15.3955","0.0001","16.192","0.0002","90","","90","","90","","3978.35","0.06","220","2","220","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H26 Ir O P S2 -","- C18 H26 Ir O P S2 -","- C144 H208 Ir8 O8 P8 S16 -","8","1","","Shaver, Alan; El Mouatassim, Bouchra; Mortini, Florent; Bélanger-Gariépy, Francine; Lough, Alan","Reactions of (η5-C5Me5)Ir(PMe3)(SH)2and (η5-C5Me5)Ir(PMe3)(SH)(H) with Thionylaniline (PhNSO) to Give Novel Iridium S3O and S2O Complexes","Organometallics","2007","26","17","4229","","10.1021/om060399l","","","1.54178","CuKα","","0.034","0.0305","","","0.08","0.0821","","","","","","1.087","","","","has coordinates,has disorder","178613","2020-10-21","18:00:00",""
"4072455","8.277","0.0001","10.0979","0.0002","14.5981","0.0002","77.063","0.001","80.045","0.001","82.608","0.001","1166.09","0.03","220","2","220","2","","","","","","","Synthesized by the authors. See text","6","P -1","-P 1","2","","","","- C21 H33 Ir N P S2 -","- C21 H33 Ir N P S2 -","- C42 H66 Ir2 N2 P2 S4 -","2","1","","Shaver, Alan; El Mouatassim, Bouchra; Mortini, Florent; Bélanger-Gariépy, Francine; Lough, Alan","Reactions of (η5-C5Me5)Ir(PMe3)(SH)2and (η5-C5Me5)Ir(PMe3)(SH)(H) with Thionylaniline (PhNSO) to Give Novel Iridium S3O and S2O Complexes","Organometallics","2007","26","17","4229","","10.1021/om060399l","","","1.54178","CuKα","","0.0471","0.0418","","","0.1069","0.1288","","","","","","1.095","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072456","15.29","0.003","9.2867","0.0015","23.385","0.004","90","","103.103","0.002","90","","3234.1","1","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H46 Cl2 Hf -","- C37 H46 Cl2 Hf -","- C148 H184 Cl8 Hf4 -","4","1","","Irwin, Levi J.; Zeits, Paul D.; Reibenspies, Joseph H.; Miller, Stephen A.","Diffuse Diffraction from Parallel/Antiparallel Metallocene Pillars","Organometallics","2007","26","5","1129","","10.1021/om060435g","","","0.71073","MoKα","","0.0213","0.0178","","","0.0434","0.0452","","","","","","1.032","","","","has coordinates,has disorder","178613","2020-10-21","18:00:00",""
"4072457","15.275","0.003","9.2653","0.0013","23.356","0.004","90","","103.343","0.008","90","","3216.3","1","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H46 Cl2 Zr -","- C37 H46 Cl2 Zr -","- C148 H184 Cl8 Zr4 -","4","1","","Irwin, Levi J.; Zeits, Paul D.; Reibenspies, Joseph H.; Miller, Stephen A.","Diffuse Diffraction from Parallel/Antiparallel Metallocene Pillars","Organometallics","2007","26","5","1129","","10.1021/om060435g","","","0.71073","MoKα","","0.1061","0.0634","","","0.1263","0.1461","","","","","","1.004","","","","has coordinates,has disorder","178613","2020-10-21","18:00:00",""
"4072458","29.775","0.005","15.007","0.002","7.3342","0.0012","90","","90","","90","","3277.2","0.9","110","2","110","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C39 H52 Hf -","- C39 H52 Hf -","- C156 H208 Hf4 -","4","1","","Irwin, Levi J.; Zeits, Paul D.; Reibenspies, Joseph H.; Miller, Stephen A.","Diffuse Diffraction from Parallel/Antiparallel Metallocene Pillars","Organometallics","2007","26","5","1129","","10.1021/om060435g","","","0.71073","MoKα","","0.0847","0.083","","","0.1852","0.1866","","","","","","1.056","","","","has coordinates,has disorder","178613","2020-10-21","18:00:00",""
"4072459","29.75","0.006","14.98","0.003","7.3554","0.0017","90","","90","","90","","3278","1.2","110","2","110","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C39 H52 Zr -","- C39 H52 Zr -","- C156 H208 Zr4 -","4","1","","Irwin, Levi J.; Zeits, Paul D.; Reibenspies, Joseph H.; Miller, Stephen A.","Diffuse Diffraction from Parallel/Antiparallel Metallocene Pillars","Organometallics","2007","26","5","1129","","10.1021/om060435g","","","1.54178","CuKα","","0.1029","0.0858","","","0.1692","0.1785","","","","","","1.008","","","","has coordinates,has disorder","178613","2020-10-21","18:00:00",""
"4072460","16.6127","0.0015","11.2422","0.001","23.855","0.002","90","","105.807","0.002","90","","4286.8","0.7","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H62 Cl2 Zr -","- C52 H62 Cl2 Zr -","- C208 H248 Cl8 Zr4 -","4","1","","Irwin, Levi J.; Zeits, Paul D.; Reibenspies, Joseph H.; Miller, Stephen A.","Diffuse Diffraction from Parallel/Antiparallel Metallocene Pillars","Organometallics","2007","26","5","1129","","10.1021/om060435g","","","0.71073","MoKα","","0.0671","0.0554","","","0.1331","0.1443","","","","","","1.105","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072461","26.234","0.007","16.479","0.005","6.3671","0.0018","90","","90","","90","","2752.6","1.4","110","2","110","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C32 H37 Mn O3 -","- C32 H37 Mn O3 -","- C128 H148 Mn4 O12 -","4","1","","Irwin, Levi J.; Zeits, Paul D.; Reibenspies, Joseph H.; Miller, Stephen A.","Diffuse Diffraction from Parallel/Antiparallel Metallocene Pillars","Organometallics","2007","26","5","1129","","10.1021/om060435g","","","0.71073","MoKα","","0.0934","0.073","","","0.1706","0.1845","","","","","","1.036","","","","has coordinates,has disorder","178613","2020-10-21","18:00:00",""
"4072462","5.7601","0.0015","16.182","0.004","24.356","0.006","90","","92.95","0.004","90","","2267.2","1","110","2","110","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C29 H38 -","- C29 H38 -","- C116 H152 -","4","1","","Irwin, Levi J.; Zeits, Paul D.; Reibenspies, Joseph H.; Miller, Stephen A.","Diffuse Diffraction from Parallel/Antiparallel Metallocene Pillars","Organometallics","2007","26","5","1129","","10.1021/om060435g","","","0.71073","MoKα","","0.0898","0.0654","","","0.1479","0.1588","","","","","","1.058","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4072463","10.706","0.002","18.611","0.003","19.692","0.003","108.239","0.002","103.011","0.003","104.461","0.002","3406.6","1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H51 N6 O3 Ti -","- C30 H51 N6 O3 Ti -","- C120 H204 N24 O12 Ti4 -","4","2","","Jones, Natalie A.; Liddle, Stephen T.; Wilson, Claire; Arnold, Polly L.","Titanium(III) Alkoxy-N-heterocyclic Carbenes and a Safe, Low-Cost Route to TiCl3(THF)3","Organometallics","2007","26","3","755","","10.1021/om060486d","","","0.71073","MoKα","","0.101","0.0583","","","0.112","0.125","","","","","","0.95","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072464","19.9362","0.0009","8.0691","0.0004","14.8652","0.0007","90","","98.263","0.002","90","","2366.5","0.19","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C9 H17 Au Cl N -","- C9 H17 Au Cl N -","- C72 H136 Au8 Cl8 N8 -","8","1","","Elbjeirami, Oussama; Yockel, Scott; Campana, Charles F.; Wilson, Angela K.; Omary, Mohammad A.","Photophysics and Bonding in Neutral Gold(I) Organometallic Complexes with an Extended Aurophilic Supramolecular Structure","Organometallics","2007","26","10","2550","","10.1021/om060524t","","","0.71073","MoKα","","0.0203","0.0162","","","0.0407","0.0433","","","","","","1.053","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072465","12.486","0.005","13.689","0.005","39.421","0.005","90","0.005","92.643","0.005","90","0.005","6731","4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H90 F11 N6 P Ti3 -","- C54 H90 F11 N6 P Ti3 -","- C216 H360 F44 N24 P4 Ti12 -","4","1","","Ferreira, M. João; Matos, Inês; Ascenso, José R.; Duarte, M. Teresa; Marques, M. Mercês; Wilson, Claire; Martins, Ana M.","Alkylation, Cation Formation, and Insertion Reactions in Titanium Tris(ketimide) Complexes","Organometallics","2007","26","1","119","","10.1021/om060554w","","","0.71069","MoKα","","0.1905","0.0945","","","0.2153","0.2476","","","","","","1","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072466","11.7679","0.001","19.8939","0.0018","17.5605","0.0016","90","","99.372","0.007","90","","4056.2","0.6","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C38 H68 N4 Ti -","- C38 H68 N4 Ti -","- C152 H272 N16 Ti4 -","4","1","","Ferreira, M. João; Matos, Inês; Ascenso, José R.; Duarte, M. Teresa; Marques, M. Mercês; Wilson, Claire; Martins, Ana M.","Alkylation, Cation Formation, and Insertion Reactions in Titanium Tris(ketimide) Complexes","Organometallics","2007","26","1","119","","10.1021/om060554w","","","0.71073","MoKα","","0.1195","0.0961","","","0.1988","0.2183","","","","","","1.069","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072467","13.4803","0.0009","14.9598","0.0009","18.767","0.001","90","","98.342","0.001","90","","3744.6","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H39 B N7 O P Ru -","- C40 H39 B N7 O P Ru -","- C160 H156 B4 N28 O4 P4 Ru4 -","4","1","","Yuan, Ping; Yin, Jun; Yu, Guang-ao; Hu, Quanyuan; Liu, Sheng Hua","Synthesis and Second-Order NLO Properties of Donor‒Acceptor σ-Alkenyl Ruthenium Complexes","Organometallics","2007","26","1","196","","10.1021/om0605736","","","0.71073","MoKα","","0.0647","0.0497","","","0.1202","0.1275","","","","","","1.047","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072468","15.3762","0.0002","13.8246","0.0002","32.2115","0.0005","90","","95.036","0.0004","90","","6820.76","0.17","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C70 H79 Cl2 F6 P5 Ru2 -","- C70 H79 Cl2 F6 P5 Ru2 -","- C280 H316 Cl8 F24 P20 Ru8 -","4","1","","Liu, Chung-Wei; Lin, Ying-Chih; Huang, Shou-Ling; Cheng,; Liu, Yi-Hung; Wang, Yu","Preparation of Dinuclear Vinylidene Complexes and Their New Deprotonation Reactions","Organometallics","2007","26","14","3431","","10.1021/om060641o","","","0.71073","MoKα","","0.0734","0.0597","","","0.1679","0.1879","","","","","","1.1","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072469","9.2924","0.0002","21.0916","0.0004","27.4615","0.0004","90","","90.185","0.001","90","","5382.19","0.17","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C47 H78 F6 N P5 Ru2 -","- C47 H78 F6 N P5 Ru2 -","- C188 H312 F24 N4 P20 Ru8 -","4","1","","Liu, Chung-Wei; Lin, Ying-Chih; Huang, Shou-Ling; Cheng,; Liu, Yi-Hung; Wang, Yu","Preparation of Dinuclear Vinylidene Complexes and Their New Deprotonation Reactions","Organometallics","2007","26","14","3431","","10.1021/om060641o","","","0.71073","MoKα","","0.098","0.0612","","","0.1554","0.1774","","","","","","1.089","","","","has coordinates,has disorder","178613","2020-10-21","18:00:00",""
"4072470","10.075","0.01","15.148","0.004","19.533","0.007","84.67","0.03","79.2","0.05","83.55","0.04","2902","3","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C27 H28 F6 Fe N O P Pd S -","- C27 H28 F6 Fe N O P Pd S -","- C108 H112 F24 Fe4 N4 O4 P4 Pd4 S4 -","4","2","","López, Concepción; Pérez, Sonia; Solans, Xavier; Font-Bardía, Mercè; Roig, Anna; Molins, Elies; van Leeuwen, Piet W. N. M.; van Strijdonck, Gino P. F.","Heterodimetallic Palladium(II) Complexes with Bidentate (N,S) or Terdentate (C,N,S)-Ferrocenyl Ligands. The Effect of the Ligand Donor Atoms on the Regioselectivity of the Allylic Alkylation of Cinnamyl Acetate","Organometallics","2007","26","3","571","","10.1021/om060647d","","","0.71073","MoKα","","0.2259","0.0508","","","0.1243","0.1675","","","","","","0.919","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072471","9.78","0.001","10.513","0.001","22.371","0.001","90","","90","","90","","2300.1","0.3","293","2","293","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C21 H22 F6 Fe N P Pd S -","- C21 H22 F6 Fe N P Pd S -","- C84 H88 F24 Fe4 N4 P4 Pd4 S4 -","4","1","","López, Concepción; Pérez, Sonia; Solans, Xavier; Font-Bardía, Mercè; Roig, Anna; Molins, Elies; van Leeuwen, Piet W. N. M.; van Strijdonck, Gino P. F.","Heterodimetallic Palladium(II) Complexes with Bidentate (N,S) or Terdentate (C,N,S)-Ferrocenyl Ligands. The Effect of the Ligand Donor Atoms on the Regioselectivity of the Allylic Alkylation of Cinnamyl Acetate","Organometallics","2007","26","3","571","","10.1021/om060647d","","","0.71069","MoKα","","0.0441","0.039","","0.1334","0.1059","","","","1.226","0.997","0.997","","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072472","15.981","0.004","7.099","0.001","18.389","0.005","90","","96.084","0.005","90","","2074.5","0.8","150.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H28 Cl3 O2 Si2 Ta -","- C12 H28 Cl3 O2 Si2 Ta -","- C48 H112 Cl12 O8 Si8 Ta4 -","4","1","","Oshiki, Toshiyuki; Yamada, Atsushi; Kawai, Kimio; Arimitsu, Hirotaka; Takai, Kazuhiko","Alkyne Exchange Reactions of Silylalkyne Complexes of Tantalum: Mechanistic Investigation and Its Application in the Preparation of New Tantalum Complexes Having Functional Alkynes (PhC⋮CR (R = COOMe, CONMe2))","Organometallics","2007","26","1","173","","10.1021/om060659z","","","0.7107","MoKa","","","0.045","","","","0.1198","","","","","","1.547","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072473","12.434","0.002","7.4721","0.0006","18.098","0.003","90","","90.206","0.002","90","","1681.4","0.4","150.2","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C10 H22 Cl3 O2 Si Ta -","- C10 H22 Cl3 O2 Si Ta -","- C40 H88 Cl12 O8 Si4 Ta4 -","4","2","","Oshiki, Toshiyuki; Yamada, Atsushi; Kawai, Kimio; Arimitsu, Hirotaka; Takai, Kazuhiko","Alkyne Exchange Reactions of Silylalkyne Complexes of Tantalum: Mechanistic Investigation and Its Application in the Preparation of New Tantalum Complexes Having Functional Alkynes (PhC⋮CR (R = COOMe, CONMe2))","Organometallics","2007","26","1","173","","10.1021/om060659z","","","0.7107","MoK´a","","","0.0763","","","","0.2453","","","","","","2.824","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072474","9.515","0.002","13.757","0.003","15.565","0.002","90","","95.475","0.01","90","","2028.1","0.7","150.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H22 Cl3 N2 Si Ta -","- C16 H22 Cl3 N2 Si Ta -","- C64 H88 Cl12 N8 Si4 Ta4 -","4","1","","Oshiki, Toshiyuki; Yamada, Atsushi; Kawai, Kimio; Arimitsu, Hirotaka; Takai, Kazuhiko","Alkyne Exchange Reactions of Silylalkyne Complexes of Tantalum: Mechanistic Investigation and Its Application in the Preparation of New Tantalum Complexes Having Functional Alkynes (PhC⋮CR (R = COOMe, CONMe2))","Organometallics","2007","26","1","173","","10.1021/om060659z","","","0.7107","MoK´a","","","0.0932","","","","0.258","","","","","","1.908","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072475","7.6198","0.0004","8.043","0.0003","20.365","0.002","94.342","0.006","90.295","0.004","116","0.01","1117.53","0.16","150.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C16 H34 Cl3 O2 Si Ta -","- C16 H34 Cl3 O2 Si Ta -","- C32 H68 Cl6 O4 Si2 Ta2 -","2","1","","Oshiki, Toshiyuki; Yamada, Atsushi; Kawai, Kimio; Arimitsu, Hirotaka; Takai, Kazuhiko","Alkyne Exchange Reactions of Silylalkyne Complexes of Tantalum: Mechanistic Investigation and Its Application in the Preparation of New Tantalum Complexes Having Functional Alkynes (PhC⋮CR (R = COOMe, CONMe2))","Organometallics","2007","26","1","173","","10.1021/om060659z","","","0.7107","MoK´a","","","0.0386","","","","0.1959","","","","","","1.949","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072476","8.838","0.002","19.349","0.002","10.576","0.002","90","","90.54","0.02","90","","1808.5","0.6","293.2","","","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C14 H18 Cl3 O4 Ta -","- C14 H18 Cl3 O4 Ta -","- C56 H72 Cl12 O16 Ta4 -","4","1","","Oshiki, Toshiyuki; Yamada, Atsushi; Kawai, Kimio; Arimitsu, Hirotaka; Takai, Kazuhiko","Alkyne Exchange Reactions of Silylalkyne Complexes of Tantalum: Mechanistic Investigation and Its Application in the Preparation of New Tantalum Complexes Having Functional Alkynes (PhC⋮CR (R = COOMe, CONMe2))","Organometallics","2007","26","1","173","","10.1021/om060659z","","","0.7107","MoKa","","","0.0483","","","","0.1249","","","","","","1.923","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072477","9.6872","0.0013","14.333","0.002","24.351","0.004","90","","90","","90","","3381.1","0.9","93","2","93","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C31 H41 Cl2 N4 O P Ru S -","- C31 H41 Cl2 N4 O P Ru S -","- C124 H164 Cl8 N16 O4 P4 Ru4 S4 -","4","1","","Clarke, Matthew L.; Díaz-Valenzuela, M. Belén; Slawin, Alexandra M. Z.","Hydrogenation of Aldehydes, Esters, Imines, and Ketones Catalyzed by a Ruthenium Complex of a Chiral Tridentate Ligand","Organometallics","2007","26","1","16","","10.1021/om060673b","","","0.71073","MoKα","","0.0531","0.042","","","0.0683","0.0735","","","","","","1.133","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072478","7.848","0.002","8.247","0.002","11.934","0.003","97.593","0.005","103.025","0.004","101.416","0.005","724.9","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H14 Fe O3 -","- C17 H14 Fe O3 -","- C34 H28 Fe2 O6 -","2","1","","Chen, Qian; Li, Chaozhong","Activation of the Vinylic C−Cl Bond by Complexation of Fe(CO)3: Palladium-Catalyzed Coupling Reactions of (η4-Chlorodiene)tricarbonyliron Complexes†","Organometallics","2007","26","1","223","","10.1021/om0606800","","","0.71073","MoKα","","0.0755","0.0462","","","0.0911","0.1275","","","","","","0.828","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072479","12.603","0.002","5.9947","0.0011","17.106","0.003","90","","100.032","0.003","90","","1272.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 Fe O4 -","- C13 H12 Fe O4 -","- C52 H48 Fe4 O16 -","4","1","","Chen, Qian; Li, Chaozhong","Activation of the Vinylic C−Cl Bond by Complexation of Fe(CO)3: Palladium-Catalyzed Coupling Reactions of (η4-Chlorodiene)tricarbonyliron Complexes†","Organometallics","2007","26","1","223","","10.1021/om0606800","","","0.71073","MoKα","","0.0673","0.0461","","","0.1118","0.1188","","","","","","0.898","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072480","10.1662","0.0005","15.3421","0.0007","21.4861","0.001","90","","94.79","0.001","90","","3339.5","0.3","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C24 H44 Al Cl4 Mo N O2 P2 -","- C24 H44 Al Cl4 Mo N O2 P2 -","- C96 H176 Al4 Cl16 Mo4 N4 O8 P8 -","4","1","","Sterenberg, Brian T.; Senturk, Ozan Sanli; Udachin, Konstantin A.; Carty, Arthur J.","Reactivity of Terminal, Electrophilic Phosphinidene Complexes of Molybdenum and Tungsten. Nucleophilic Addition at Phosphorus and P−P Bond Forming Reactions with Phosphines and Diphosphines","Organometallics","2007","26","4","925","","10.1021/om060685x","","","0.71073","MoKα","","0.0295","0.0238","","","0.0591","0.0619","","","","","","1.02","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072481","10.1589","0.0005","26.0275","0.0014","12.6512","0.0007","90","","94.252","0.001","90","","3335.9","0.3","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C24 H44 Al Cl4 N O2 P2 W -","- C24 H44 Al Cl4 N O2 P2 W -","- C96 H176 Al4 Cl16 N4 O8 P8 W4 -","4","1","","Sterenberg, Brian T.; Senturk, Ozan Sanli; Udachin, Konstantin A.; Carty, Arthur J.","Reactivity of Terminal, Electrophilic Phosphinidene Complexes of Molybdenum and Tungsten. Nucleophilic Addition at Phosphorus and P−P Bond Forming Reactions with Phosphines and Diphosphines","Organometallics","2007","26","4","925","","10.1021/om060685x","","","0.71073","MoKα","","0.0291","0.0246","","","0.0641","0.066","","","","","","1.086","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072482","17.6501","0.0009","16.4751","0.0008","35.5604","0.0018","90","","90","","90","","10340.5","0.9","173","2","173","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C54 H71 B Mo N O2 P3 -","- C54 H71 B Mo N O2 P3 -","- C432 H568 B8 Mo8 N8 O16 P24 -","8","1","","Sterenberg, Brian T.; Senturk, Ozan Sanli; Udachin, Konstantin A.; Carty, Arthur J.","Reactivity of Terminal, Electrophilic Phosphinidene Complexes of Molybdenum and Tungsten. Nucleophilic Addition at Phosphorus and P−P Bond Forming Reactions with Phosphines and Diphosphines","Organometallics","2007","26","4","925","","10.1021/om060685x","","","0.71073","MoKα","","0.0716","0.0388","","","0.101","0.1125","","","","","","1","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072483","8.2179","0.0005","14.9997","0.0008","27.3285","0.0015","90","","93.159","0.001","90","","3363.6","0.3","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C23 H43 Al Cl4 N O2 P3 W -","- C23 H43 Al Cl4 N O2 P3 W -","- C92 H172 Al4 Cl16 N4 O8 P12 W4 -","4","1","","Sterenberg, Brian T.; Senturk, Ozan Sanli; Udachin, Konstantin A.; Carty, Arthur J.","Reactivity of Terminal, Electrophilic Phosphinidene Complexes of Molybdenum and Tungsten. Nucleophilic Addition at Phosphorus and P−P Bond Forming Reactions with Phosphines and Diphosphines","Organometallics","2007","26","4","925","","10.1021/om060685x","","","0.71073","MoKα","","0.0302","0.0236","","","0.0578","0.06","","","","","","1.022","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072484","8.7257","0.0004","12.0445","0.0005","16.6316","0.0008","97.141","0.001","98.075","0.001","94.52","0.001","1708.91","0.13","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C24 H45 Al Cl4 Mo N O2 P3 -","- C24 H45 Al Cl4 Mo N O2 P3 -","- C48 H90 Al2 Cl8 Mo2 N2 O4 P6 -","2","1","","Sterenberg, Brian T.; Senturk, Ozan Sanli; Udachin, Konstantin A.; Carty, Arthur J.","Reactivity of Terminal, Electrophilic Phosphinidene Complexes of Molybdenum and Tungsten. Nucleophilic Addition at Phosphorus and P−P Bond Forming Reactions with Phosphines and Diphosphines","Organometallics","2007","26","4","925","","10.1021/om060685x","","","0.71073","MoKα","","0.0517","0.0367","","","0.0918","0.0978","","","","","","1.016","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072485","8.6986","0.0009","12.0265","0.0009","16.6578","0.0013","96.86","0.002","98.118","0.002","94.601","0.001","1704.4","0.3","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C24 H45 Al Cl4 N O2 P3 W -","- C24 H45 Al Cl4 N O2 P3 W -","- C48 H90 Al2 Cl8 N2 O4 P6 W2 -","2","1","","Sterenberg, Brian T.; Senturk, Ozan Sanli; Udachin, Konstantin A.; Carty, Arthur J.","Reactivity of Terminal, Electrophilic Phosphinidene Complexes of Molybdenum and Tungsten. Nucleophilic Addition at Phosphorus and P−P Bond Forming Reactions with Phosphines and Diphosphines","Organometallics","2007","26","4","925","","10.1021/om060685x","","","0.71073","MoKα","","0.0579","0.0532","","","0.1388","0.1406","","","","","","1.202","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072486","8.462","0.0008","14.075","0.0014","25.811","0.003","90","","92.329","0.013","90","","3071.6","0.6","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C42 H74 Al2 Cl8 N2 O4 P4 W2 -","- C42 H74 Al2 Cl8 N2 O4 P4 W2 -","- C84 H148 Al4 Cl16 N4 O8 P8 W4 -","2","0.5","","Sterenberg, Brian T.; Senturk, Ozan Sanli; Udachin, Konstantin A.; Carty, Arthur J.","Reactivity of Terminal, Electrophilic Phosphinidene Complexes of Molybdenum and Tungsten. Nucleophilic Addition at Phosphorus and P−P Bond Forming Reactions with Phosphines and Diphosphines","Organometallics","2007","26","4","925","","10.1021/om060685x","","","0.71073","MoKα","","0.0464","0.0328","","","0.0876","0.0925","","","","","","1.023","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072487","10.8217","0.0007","13.4765","0.0009","23.2393","0.0015","90","","97.568","0.001","90","","3359.7","0.4","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C23 H45 Al Cl4 Mo N O P3 -","- C23 H45 Al Cl4 Mo N O P3 -","- C92 H180 Al4 Cl16 Mo4 N4 O4 P12 -","4","1","","Sterenberg, Brian T.; Senturk, Ozan Sanli; Udachin, Konstantin A.; Carty, Arthur J.","Reactivity of Terminal, Electrophilic Phosphinidene Complexes of Molybdenum and Tungsten. Nucleophilic Addition at Phosphorus and P−P Bond Forming Reactions with Phosphines and Diphosphines","Organometallics","2007","26","4","925","","10.1021/om060685x","","","0.71073","MoKα","","0.0297","0.0227","","","0.054","0.057","","","","","","1.025","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072488","12.5431","0.0003","8.8949","0.0002","29.0676","0.0007","90","","99.748","0.001","90","","3196.24","0.13","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H35 N3 O3 Si2 -","- C36 H35 N3 O3 Si2 -","- C144 H140 N12 O12 Si8 -","4","1","","Wagler, Jörg","A Disilane with a Hypercoordinate Silicon Atom: Coordination of an Imine Ligand versus Si−Si Bond Splitting","Organometallics","2007","26","1","155","","10.1021/om060698a","","","0.71073","MoKα","","0.0564","0.0393","","","0.1089","0.1171","","","","","","1.076","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072489","8.3473","0.0003","12.1119","0.0005","14.451","0.0006","76.46","0.001","86.513","0.001","83.449","0.001","1410.26","0.1","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H33 N3 O Si2 -","- C31 H33 N3 O Si2 -","- C62 H66 N6 O2 Si4 -","2","1","","Wagler, Jörg","A Disilane with a Hypercoordinate Silicon Atom: Coordination of an Imine Ligand versus Si−Si Bond Splitting","Organometallics","2007","26","1","155","","10.1021/om060698a","","","0.71073","MoKα","","0.0437","0.0345","","","0.0909","0.0942","","","","","","1.084","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072490","10.1667","0.0012","10.609","0.0012","11.4683","0.001","116.999","0.002","92.598","0.003","97.476","0.003","1085.1","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H22 Cl N O4 Si -","- C23 H22 Cl N O4 Si -","- C46 H44 Cl2 N2 O8 Si2 -","2","1","","Wagler, Jörg","A Disilane with a Hypercoordinate Silicon Atom: Coordination of an Imine Ligand versus Si−Si Bond Splitting","Organometallics","2007","26","1","155","","10.1021/om060698a","","","0.71073","MoKα","","0.0555","0.0381","","","0.1048","0.1105","","","","","","1.092","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072491","11.427","0.004","12.338","0.004","15.599","0.005","90","","110.56","0.03","90","","2059.2","1.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","trifluoroacetate-(2-(1,10-phenanthroline)-ferrocenyl)-palladium(II)","","- C24 H15 F3 Fe N2 O2 Pd -","- C24 H15 F3 Fe N2 O2 Pd -","- C96 H60 F12 Fe4 N8 O8 Pd4 -","4","1","","Durand, Jérôme; Gladiali, Serafino; Erre, Giulia; Zangrando, Ennio; Milani, Barbara","Palladium Chemistry of 2-Ferrocenyl-1,10-phenanthroline Ligand","Organometallics","2007","26","4","810","","10.1021/om060703a","","","0.71073","Mokα","","0.0485","0.0353","","","0.0942","0.0987","","","","","","1.025","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072492","10.105","0.003","22.529","0.005","11.948","0.004","90","","96.86","0.03","90","","2700.6","1.4","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","acetonitrile-(2-(1,10-phenanthroline)-ferrocenyl)-palladium(II) exafluorophosphate dichloromethane solvate","","- C25 H20 Cl2 F6 Fe N3 P Pd -","- C25 H20 Cl2 F6 Fe N3 P Pd -","- C100 H80 Cl8 F24 Fe4 N12 P4 Pd4 -","4","1","","Durand, Jérôme; Gladiali, Serafino; Erre, Giulia; Zangrando, Ennio; Milani, Barbara","Palladium Chemistry of 2-Ferrocenyl-1,10-phenanthroline Ligand","Organometallics","2007","26","4","810","","10.1021/om060703a","","","1.54178","CuKα","","0.0784","0.0611","","","0.1584","0.1709","","","","","","1.056","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072493","10.708","0.003","10.965","0.004","17.713","0.004","102.76","0.03","90.78","0.03","98.74","0.02","2002.4","1.1","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","triphenylphosphine-(2-(1,10-phenanthroline)-ferrocenyl)-palladium(II) trifluoroacetate dichloromethane solvate","","- C43 H32 Cl2 F3 Fe N2 O2 P Pd -","- C43 H30 Cl2 F3 Fe N2 O2 P Pd -","- C86 H60 Cl4 F6 Fe2 N4 O4 P2 Pd2 -","2","1","","Durand, Jérôme; Gladiali, Serafino; Erre, Giulia; Zangrando, Ennio; Milani, Barbara","Palladium Chemistry of 2-Ferrocenyl-1,10-phenanthroline Ligand","Organometallics","2007","26","4","810","","10.1021/om060703a","","","0.71073","Mokα","","0.1107","0.0731","","","0.2034","0.2367","","","","","","0.914","","","","has coordinates,has disorder","178613","2020-10-21","18:00:00",""
"4072494","16.3661","0.0018","14.0839","0.001","19.494","0.002","90","","109.278","0.013","90","","4241.4","0.8","180","","180","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H46 Cu2 I2 N10 -","- C40 H46 Cu2 I2 N10 -","- C160 H184 Cu8 I8 N40 -","4","0.5","","Ouali, Armelle; Taillefer, Marc; Spindler, Jean-F.; Jutand, Anny","Precatalysts Involved in Copper-Catalyzed Arylations of Nucleophiles","Organometallics","2007","26","1","65","","10.1021/om060706n","","","0.71073","MoKα","","0.0404","0.0285","","0.0336","0.0333","0.0333","","","","","","1.0822","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072495","14.797","0.004","22.555","0.007","17.371","0.005","90","","109.84","0.005","90","","5453","3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 Au N3 P -","- C26 H21 Au N3 P -","- C208 H168 Au8 N24 P8 -","8","2","","Partyka, David V.; Updegraff, James B.; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.","Carbon−Gold Bond Formation through [3 + 2] Cycloaddition Reactions of Gold(I) Azides and Terminal Alkynes","Organometallics","2007","26","1","183","","10.1021/om0607200","","","0.71073","MoKα","","0.0599","0.042","","","0.1009","0.1074","","","","","","1.024","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072496","12.8693","0.0003","12.8693","0.0003","14.655","0.0008","90","","90","","90","","2427.14","0.15","260","2","260","2","","","","","","","","6","P 43","P 4cw","78","","","","- C26 H20 Au F N3 P -","- C26 H20 Au F N3 P -","- C104 H80 Au4 F4 N12 P4 -","4","1","","Partyka, David V.; Updegraff, James B.; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.","Carbon−Gold Bond Formation through [3 + 2] Cycloaddition Reactions of Gold(I) Azides and Terminal Alkynes","Organometallics","2007","26","1","183","","10.1021/om0607200","","","0.71073","MoKα","","0.0253","0.0225","","","0.0529","0.0541","","","","","","1.075","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072497","13.0753","0.0008","13.0753","0.0008","13.0705","0.0012","90","","90","","90","","2234.6","0.3","100","2","100","2","","","","","","","","5","P 43","P 4cw","78","","","","- C24 H25 Au N3 P -","- C24 H25 Au N3 P -","- C96 H100 Au4 N12 P4 -","4","1","","Partyka, David V.; Updegraff, James B.; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.","Carbon−Gold Bond Formation through [3 + 2] Cycloaddition Reactions of Gold(I) Azides and Terminal Alkynes","Organometallics","2007","26","1","183","","10.1021/om0607200","","","0.71073","MoKα","","0.0653","0.0382","","","0.0713","0.0757","","","","","","0.827","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072498","13.7355","0.0005","13.7355","0.0005","12.5315","0.0009","90","","90","","90","","2364.2","0.2","100","2","100","2","","","","","","","","5","P 43","P 4cw","78","","","","- C27 H23 Au N3 P -","- C27 H23 Au N3 P -","- C108 H92 Au4 N12 P4 -","4","1","","Partyka, David V.; Updegraff, James B.; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.","Carbon−Gold Bond Formation through [3 + 2] Cycloaddition Reactions of Gold(I) Azides and Terminal Alkynes","Organometallics","2007","26","1","183","","10.1021/om0607200","","","0.71073","MoKα","","0.0334","0.0321","","","0.0805","0.0815","","","","","","1.144","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072499","9.603","0.002","9.672","0.002","19.325","0.004","92.6","0.02","100.11","0.03","90.25","0.02","1765.1","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Moris-100 (Florina)","","","- C31 H54 N2 O6 Ti -","- C31 H54 N2 O6 Ti -","- C62 H108 N4 O12 Ti2 -","2","1","","Gornshtein, Florina; Kapon, Moshe; Botoshansky, Mark; Eisen, Moris S.","Titanium and Zirconium Complexes for Polymerization of Propylene and Cyclic Esters","Organometallics","2007","26","3","497","","10.1021/om060723c","","","0.71073","MoKα","","0.2005","0.0595","","","0.1119","0.1383","","","","","","0.726","","","","has coordinates","178613","2020-10-21","18:00:00",""
"4072500","9.652","0.0006","15.445","0.0009","17.105","0.0013","90","","93.967","0.003","90","","2543.8","0.3","230","0.1","230","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H38 N2 O6 Ti -","- C20 H38 N2 O6 Ti -","- C80 H152 N8 O24 Ti4 -","4","0.5","","Gornshtein, Florina; Kapon, Moshe; Botoshansky, Mark; Eisen, Moris S.","Titanium and Zirconium Complexes for Polymerization of Propylene and Cyclic Esters","Organometallics","2007","26","3","497","","10.1021/om060723c","","","0.71073","MoKα","","0.0565","0.0393","","","0.096","0.0999","","","","","","0.991","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072501","17.742","0.005","18.117","0.009","20.848","0.012","90","","99.46","0.04","90","","6610","5","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H36 Co P Si -","- C42 H36 Co P Si -","- C336 H288 Co8 P8 Si8 -","8","2","","Agenet, Nicolas; Mirebeau, Jean-Hugues; Petit, Marc; Thouvenot, René; Gandon, Vincent; Malacria, Max; Aubert, Corinne","Synthesis of 4:5-Benzo-1-cobalta-2-silacyclopentenes and their Reactions with Alkynes and Alkenes: An Expedient Route to Silicon-Containing Polycyclic Frameworks","Organometallics","2007","26","4","819","","10.1021/om0607245","","","0.71073","MoKα","","0.2233","0.0831","","0.1561","0.0785","0.0785","","","","","","1.1635","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072502","9.6526","0.0004","10.6303","0.0008","11.3573","0.0007","100.878","0.005","96.738","0.005","113.755","0.004","1022.95","0.12","250","","250","","","","","","","","","3","P -1","-P 1","2","","","","- C26 H26 Si -","- C26 H26 Si -","- C52 H52 Si2 -","2","1","","Agenet, Nicolas; Mirebeau, Jean-Hugues; Petit, Marc; Thouvenot, René; Gandon, Vincent; Malacria, Max; Aubert, Corinne","Synthesis of 4:5-Benzo-1-cobalta-2-silacyclopentenes and their Reactions with Alkynes and Alkenes: An Expedient Route to Silicon-Containing Polycyclic Frameworks","Organometallics","2007","26","4","819","","10.1021/om0607245","","","0.71073","MoKα","","0.0621","0.0373","","0.0636","0.0434","0.0434","","","","","","1.0692","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072503","26.054","0.004","26.054","0.004","21.715","0.004","90","","90","","90","","14740","4","253","2","253","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C40 H31 N2 O0.5 Pt S2 -","- C39.976 H29.972 N2 O0.5 Pt S1.996 -","- C639.616 H479.552 N32 O8 Pt16 S31.936 -","16","1","","Lee, Jason Ka-Wai; Ko, Chi-Chiu; Wong, Keith Man-Chung; Zhu, Nianyong; Yam, Vivian Wing-Wah","A Photochromic Platinum(II) Bis(alkynyl) Complex Containing a Versatile 5,6-Dithienyl-1,10-phenanthroline","Organometallics","2007","26","1","12","","10.1021/om060731t","","","0.71073","MoKα","","0.0779","0.0455","","","0.1265","0.1316","","","","","","0.956","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4072504","13.979","0.002","11.9196","0.0017","15.071","0.002","90","","99.7","0.002","90","","2475.3","0.6","98","2","98","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H25 Cl2 O7 P S -","- C23 H25 Cl2 O7 P S -","- C92 H100 Cl8 O28 P4 S4 -","4","1","","Liu, Shengsheng; Borkar, Sachin; Newsham, David; Yennawar, Hemant; Sen, Ayusman","Synthesis of Palladium Complexes with an Anionic Pσim O Chelate and Their Use in Copolymerization of Ethene with Functionalized Norbornene Derivatives: Unusual Functionality Tolerance","Organometallics","2007","26","1","210","","10.1021/om0607402","","","0.71073","MoKα","","0.0419","0.0372","","","0.1004","0.1036","","","","","","1.07","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4072505","10.8667","0.0011","17.0383","0.0018","11.808","0.0013","90","","95.365","0.002","90","","2176.7","0.4","108","2","108","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 O5 P Pd S -","- C23 H22 O5 P Pd S -","- C92 H88 O20 P4 Pd4 S4 -","4","1","","Liu, Shengsheng; Borkar, Sachin; Newsham, David; Yennawar, Hemant; Sen, Ayusman","Synthesis of Palladium Complexes with an Anionic Pσim O Chelate and Their Use in Copolymerization of Ethene with Functionalized Norbornene Derivatives: Unusual Functionality Tolerance","Organometallics","2007","26","1","210","","10.1021/om0607402","","","0.71073","MoKα","","0.048","0.0403","","","0.1083","0.1134","","","","","","1.066","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072506","15.6185","0.0012","8.4258","0.0007","16.7041","0.0013","90","","94.785","0.001","90","","2190.6","0.3","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H33 B4 Si2 Y -","- C15 H33 B4 Si2 Y -","- C60 H132 B16 Si8 Y4 -","4","1","","Wang, Jianhui; Zheng, Chong; Canseco-Melchor, Graciela; Hilby, Daniel J.; Maguire, John A.; Hosmane, Narayan S.","Chemistry of C-Trimethylsilyl-Substituted Heterocarboranes. 33. Synthesis of Mixed-Ligand Metallacarboranes of Yttrium and Lanthanides Derived from Open η5-Pentadiene and C2B4-Carborane: A Synthetic and Structural Investigation","Organometallics","2007","26","3","577","","10.1021/om060751v","","","0.71073","MoKα","","0.0947","0.094","","","0.1805","0.1807","","","","","","1.616","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072507","15.7007","0.0015","8.4042","0.0008","16.8002","0.0016","90","","94.898","0.002","90","","2208.7","0.4","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H33 B4 Gd Si2 -","- C15 H33 B4 Gd Si2 -","- C60 H132 B16 Gd4 Si8 -","4","1","","Wang, Jianhui; Zheng, Chong; Canseco-Melchor, Graciela; Hilby, Daniel J.; Maguire, John A.; Hosmane, Narayan S.","Chemistry of C-Trimethylsilyl-Substituted Heterocarboranes. 33. Synthesis of Mixed-Ligand Metallacarboranes of Yttrium and Lanthanides Derived from Open η5-Pentadiene and C2B4-Carborane: A Synthetic and Structural Investigation","Organometallics","2007","26","3","577","","10.1021/om060751v","","","0.71073","MoKα","","0.0382","0.0371","","","0.0701","0.0703","","","","","","1.574","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072508","15.686","0.004","8.425","0.002","16.778","0.004","90","","94.812","0.004","90","","2209.5","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H33 B4 Si2 Tb -","- C15 H33 B4 Si2 Tb -","- C60 H132 B16 Si8 Tb4 -","4","1","","Wang, Jianhui; Zheng, Chong; Canseco-Melchor, Graciela; Hilby, Daniel J.; Maguire, John A.; Hosmane, Narayan S.","Chemistry of C-Trimethylsilyl-Substituted Heterocarboranes. 33. Synthesis of Mixed-Ligand Metallacarboranes of Yttrium and Lanthanides Derived from Open η5-Pentadiene and C2B4-Carborane: A Synthetic and Structural Investigation","Organometallics","2007","26","3","577","","10.1021/om060751v","","","0.71073","MoKα","","0.039","0.0375","","","0.0766","0.0772","","","","","","1.335","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072509","8.388","0.002","11.686","0.003","14.244","0.004","72.634","0.004","73.37","0.004","76.35","0.004","1259.4","0.6","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H27 B4 Gd Si2 -","- C15 H27 B4 Gd Si2 -","- C30 H54 B8 Gd2 Si4 -","2","1","","Wang, Jianhui; Zheng, Chong; Canseco-Melchor, Graciela; Hilby, Daniel J.; Maguire, John A.; Hosmane, Narayan S.","Chemistry of C-Trimethylsilyl-Substituted Heterocarboranes. 33. Synthesis of Mixed-Ligand Metallacarboranes of Yttrium and Lanthanides Derived from Open η5-Pentadiene and C2B4-Carborane: A Synthetic and Structural Investigation","Organometallics","2007","26","3","577","","10.1021/om060751v","","","0.71073","MoKα","","0.0665","0.0608","","","0.178","0.1823","","","","","","1.176","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072510","15.5736","0.0017","8.4389","0.0009","16.6439","0.0018","90","","94.683","0.002","90","","2180.1","0.4","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H33 B4 Er Si2 -","- C15 H33 B4 Er Si2 -","- C60 H132 B16 Er4 Si8 -","4","1","","Wang, Jianhui; Zheng, Chong; Canseco-Melchor, Graciela; Hilby, Daniel J.; Maguire, John A.; Hosmane, Narayan S.","Chemistry of C-Trimethylsilyl-Substituted Heterocarboranes. 33. Synthesis of Mixed-Ligand Metallacarboranes of Yttrium and Lanthanides Derived from Open η5-Pentadiene and C2B4-Carborane: A Synthetic and Structural Investigation","Organometallics","2007","26","3","577","","10.1021/om060751v","","","0.71073","MoKα","","0.0393","0.0362","","","0.0889","0.0908","","","","","","1.161","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072511","18.253","0.002","12.8793","0.0015","16.5441","0.0019","90","","110.847","0.002","90","","3634.7","0.7","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H27 B4 Si Y -","- C13 H27 B4 Si Y -","- C104 H216 B32 Si8 Y8 -","8","1","","Wang, Jianhui; Zheng, Chong; Canseco-Melchor, Graciela; Hilby, Daniel J.; Maguire, John A.; Hosmane, Narayan S.","Chemistry of C-Trimethylsilyl-Substituted Heterocarboranes. 33. Synthesis of Mixed-Ligand Metallacarboranes of Yttrium and Lanthanides Derived from Open η5-Pentadiene and C2B4-Carborane: A Synthetic and Structural Investigation","Organometallics","2007","26","3","577","","10.1021/om060751v","","","0.71073","MoKα","","0.0494","0.0436","","","0.0918","0.0934","","","","","","1.263","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072512","18.324","0.002","12.8915","0.0014","16.5424","0.0018","90","","110.961","0.002","90","","3649.1","0.7","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H27 B4 Si Tb -","- C13 H27 B4 Si Tb -","- C104 H216 B32 Si8 Tb8 -","8","1","","Wang, Jianhui; Zheng, Chong; Canseco-Melchor, Graciela; Hilby, Daniel J.; Maguire, John A.; Hosmane, Narayan S.","Chemistry of C-Trimethylsilyl-Substituted Heterocarboranes. 33. Synthesis of Mixed-Ligand Metallacarboranes of Yttrium and Lanthanides Derived from Open η5-Pentadiene and C2B4-Carborane: A Synthetic and Structural Investigation","Organometallics","2007","26","3","577","","10.1021/om060751v","","","0.71073","MoKα","","0.0435","0.0433","","","0.0977","0.0978","","","","","","1.454","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072513","18.272","0.003","12.886","0.002","16.553","0.003","90","","110.903","0.002","90","","3640.9","1.1","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H27 B4 Dy Si -","- C13 H27 B4 Dy Si -","- C104 H216 B32 Dy8 Si8 -","8","1","","Wang, Jianhui; Zheng, Chong; Canseco-Melchor, Graciela; Hilby, Daniel J.; Maguire, John A.; Hosmane, Narayan S.","Chemistry of C-Trimethylsilyl-Substituted Heterocarboranes. 33. Synthesis of Mixed-Ligand Metallacarboranes of Yttrium and Lanthanides Derived from Open η5-Pentadiene and C2B4-Carborane: A Synthetic and Structural Investigation","Organometallics","2007","26","3","577","","10.1021/om060751v","","","0.71073","MoKα","","0.0279","0.0272","","","0.0587","0.059","","","","","","1.359","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072514","18.2086","0.0016","12.8584","0.0011","16.5389","0.0015","90","","110.813","0.001","90","","3619.6","0.6","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H27 B4 Ho Si -","- C13 H27 B4 Ho Si -","- C104 H216 B32 Ho8 Si8 -","8","1","","Wang, Jianhui; Zheng, Chong; Canseco-Melchor, Graciela; Hilby, Daniel J.; Maguire, John A.; Hosmane, Narayan S.","Chemistry of C-Trimethylsilyl-Substituted Heterocarboranes. 33. Synthesis of Mixed-Ligand Metallacarboranes of Yttrium and Lanthanides Derived from Open η5-Pentadiene and C2B4-Carborane: A Synthetic and Structural Investigation","Organometallics","2007","26","3","577","","10.1021/om060751v","","","0.71073","MoKα","","0.019","0.0188","","","0.0467","0.0468","","","","","","1.286","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072515","18.164","0.003","12.869","0.002","16.553","0.003","90","","110.61","0.003","90","","3621.7","1.1","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H27 B4 Er Si -","- C13 H27 B4 Er Si -","- C104 H216 B32 Er8 Si8 -","8","1","","Wang, Jianhui; Zheng, Chong; Canseco-Melchor, Graciela; Hilby, Daniel J.; Maguire, John A.; Hosmane, Narayan S.","Chemistry of C-Trimethylsilyl-Substituted Heterocarboranes. 33. Synthesis of Mixed-Ligand Metallacarboranes of Yttrium and Lanthanides Derived from Open η5-Pentadiene and C2B4-Carborane: A Synthetic and Structural Investigation","Organometallics","2007","26","3","577","","10.1021/om060751v","","","0.71073","MoKα","","0.0484","0.0471","","","0.128","0.1292","","","","","","1.167","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072516","17.988","0.002","12.8355","0.0014","16.5444","0.0018","90","","110.297","0.002","90","","3582.7","0.7","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H27 B4 Lu Si -","- C13 H27 B4 Lu Si -","- C104 H216 B32 Lu8 Si8 -","8","1","","Wang, Jianhui; Zheng, Chong; Canseco-Melchor, Graciela; Hilby, Daniel J.; Maguire, John A.; Hosmane, Narayan S.","Chemistry of C-Trimethylsilyl-Substituted Heterocarboranes. 33. Synthesis of Mixed-Ligand Metallacarboranes of Yttrium and Lanthanides Derived from Open η5-Pentadiene and C2B4-Carborane: A Synthetic and Structural Investigation","Organometallics","2007","26","3","577","","10.1021/om060751v","","","0.71073","MoKα","","0.0485","0.0483","","","0.1085","0.1086","","","","","","1.455","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072517","13.9506","0.0007","18.7248","0.0011","21.1365","0.0013","90","","107.004","0.005","90","","5280","0.5","140","2","140","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H53 Cl3 F6 P4 Ru -","- C54 H53 Cl3 F6 P4 Ru -","- C216 H212 Cl12 F24 P16 Ru4 -","4","1","","Chaplin, Adrian B.; Fellay, Céline; Laurenczy, Gábor; Dyson, Paul J.","Mechanistic Studies on the Formation of η2-Diphosphine (η6-p-cymene)ruthenium(II) Compounds","Organometallics","2007","26","3","586","","10.1021/om060752n","","","0.71073","MoKα","","0.0966","0.0733","","","0.2201","0.2396","","","","","","1.061","","","","has coordinates,has disorder","178614","2020-10-21","18:00:00",""
"4072518","9.736","0.0019","11.657","0.002","21.649","0.004","100.32","0.03","99.4","0.03","98.34","0.03","2346","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H51 Cl F6 P4 Ru -","- C54 H51 Cl F6 P4 Ru -","- C108 H102 Cl2 F12 P8 Ru2 -","2","1","","Chaplin, Adrian B.; Fellay, Céline; Laurenczy, Gábor; Dyson, Paul J.","Mechanistic Studies on the Formation of η2-Diphosphine (η6-p-cymene)ruthenium(II) Compounds","Organometallics","2007","26","3","586","","10.1021/om060752n","","","0.71073","MoKα","","0.046","0.0326","","","0.0652","0.0706","","","","","","1.11","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072519","16.067","0.003","16.14","0.003","21.951","0.004","90","","100.06","0.03","90","","5604.8","1.9","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C57 H59 Cl5 F6 P4 Ru -","- C57 H59 Cl5 F6 P4 Ru -","- C228 H236 Cl20 F24 P16 Ru4 -","4","1","","Chaplin, Adrian B.; Fellay, Céline; Laurenczy, Gábor; Dyson, Paul J.","Mechanistic Studies on the Formation of η2-Diphosphine (η6-p-cymene)ruthenium(II) Compounds","Organometallics","2007","26","3","586","","10.1021/om060752n","","","0.71073","MoKα","","0.0834","0.0624","","","0.1471","0.1612","","","","","","1.119","","","","has coordinates,has disorder","178614","2020-10-21","18:00:00",""
"4072520","11.162","0.002","30.243","0.006","11.176","0.002","90","","91.33","0.03","90","","3771.7","1.2","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C37 H38 Cl3 F6 P3 Ru -","- C37 H38 Cl3 F6 P3 Ru -","- C148 H152 Cl12 F24 P12 Ru4 -","4","2","","Chaplin, Adrian B.; Fellay, Céline; Laurenczy, Gábor; Dyson, Paul J.","Mechanistic Studies on the Formation of η2-Diphosphine (η6-p-cymene)ruthenium(II) Compounds","Organometallics","2007","26","3","586","","10.1021/om060752n","","","0.71073","MoKα","","0.0223","0.0211","","","0.0465","0.047","","","","","","1.119","","","","has coordinates,has disorder","178614","2020-10-21","18:00:00",""
"4072521","20.734","0.001","12.02","0.001","20.224","0.001","90","","117.8","0.01","90","","4458.5","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[2-[1-[[2,6-di(1-methylethyl)phenyl]amino-κN]-2-phenylethyl] phenolato(2-)-κO][2-[[[2,6-di(1-methylethyl)phenyl]imino-κN]methyl] phenolato-κO](phenylmethyl)titanium(IV)","","- C52 H58 N2 O2 Ti -","- C52 H58 N2 O2 Ti -","- C208 H232 N8 O8 Ti4 -","4","1","","Axenov, Kirill V.; Klinga, Martti; Lehtonen, Olli; Koskela, Harri T.; Leskelä, Markku; Repo, Timo","Hafnium Bis(phenoxyimino) Dibenzyl Complexes and Their Activation toward Olefin Polymerization","Organometallics","2007","26","6","1444","","10.1021/om060753f","","","0.71073","MoKα","","0.1464","0.0693","","","0.1317","0.1589","","","","","","1.024","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072522","14.608","0.002","15.646","0.002","15.844","0.002","89.03","0.01","65.96","0.01","73.39","0.01","3148.6","0.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","bis[2-[[(phenylmethyl)imino-kN]methyl]-4,6-di(1-methyl-1-phenylethyl) phenolato-kO]bis(phenylmethyl)hafnium(IV)","","- C78 H78 Hf N2 O2 -","- C78 H78 Hf N2 O2 -","- C156 H156 Hf2 N4 O4 -","2","1","","Axenov, Kirill V.; Klinga, Martti; Lehtonen, Olli; Koskela, Harri T.; Leskelä, Markku; Repo, Timo","Hafnium Bis(phenoxyimino) Dibenzyl Complexes and Their Activation toward Olefin Polymerization","Organometallics","2007","26","6","1444","","10.1021/om060753f","","","0.71073","MoKα","","0.0839","0.0485","","","0.1015","0.1165","","","","","","1.042","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072523","30.721","0.006","19.795","0.004","22.751","0.005","90","","95.02","0.03","90","","13782","5","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis[2-[[(pentafluorophenyl)imino-κN]methyl]-4,6-di(1-methyl- 1-phenylethyl)phenolato-κO]bis(phenylmethyl)hafnium(IV)","","- C76 H64 F10 Hf N2 O2 -","- C76 H64 F10 Hf N2 O2 -","- C608 H512 F80 Hf8 N16 O16 -","8","1","","Axenov, Kirill V.; Klinga, Martti; Lehtonen, Olli; Koskela, Harri T.; Leskelä, Markku; Repo, Timo","Hafnium Bis(phenoxyimino) Dibenzyl Complexes and Their Activation toward Olefin Polymerization","Organometallics","2007","26","6","1444","","10.1021/om060753f","","","0.71073","MoKα","","0.1199","0.0704","","","0.1645","0.1919","","","","","","0.984","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072524","25.253","0.002","9.487","0.001","22.63","0.002","90","","90","","90","","5421.6","0.9","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","bis[2,4-di(1,1-dimethyl-1-ethyl)-6-[[(pentafluorophenyl)imino-κN] methyl]-phenolato-κO]bis(phenylmethyl)hafnium(IV)","","- C54 H55 F10 Hf N2 O3.5 -","- C54 H55 F10 Hf N2 O3.5 -","- C216 H220 F40 Hf4 N8 O14 -","4","0.5","","Axenov, Kirill V.; Klinga, Martti; Lehtonen, Olli; Koskela, Harri T.; Leskelä, Markku; Repo, Timo","Hafnium Bis(phenoxyimino) Dibenzyl Complexes and Their Activation toward Olefin Polymerization","Organometallics","2007","26","6","1444","","10.1021/om060753f","","","0.71073","MoKα","","0.072","0.049","","","0.1037","0.1093","","","","","","1.18","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4072525","13.951","0.007","15.198","0.005","26.005","0.01","90","","100.69","0.04","90","","5418","4","295","","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C55.5 H63 Cl3 Ir3 N3 O6 -","- C55.5 H63 Cl3 Ir3 N3 O6 -","- C222 H252 Cl12 Ir12 N12 O24 -","4","1","","Mimassi, L.; Cordier, C.; Guyard-Duhayon, C.; Mann, B. E.; Amouri, H.","Chiral Supramolecular Triangular Hosts: Anion Metathesis, Solution Behavior, and High Stability of the Metal Configuration","Organometallics","2007","26","4","860","","10.1021/om060756s","","","0.71073","MoKα","","0.1014","0.0414","","0.1058","0.0474","0.0474","","","","","","1.1139","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072526","18.816","0.004","22.695","0.006","23.105","0.008","90","","90","","90","","9867","5","180","","180","","","","","","","","?","8","P 21 21 21","P 2ac 2ab","19","","","","- C85 H82 Cl17 Li N3 O14.5 P Rh3 -","- C85 H77 Cl17 Li N3 O14.5 P Rh3 -","- C340 H308 Cl68 Li4 N12 O58 P4 Rh12 -","4","1","","Mimassi, L.; Cordier, C.; Guyard-Duhayon, C.; Mann, B. E.; Amouri, H.","Chiral Supramolecular Triangular Hosts: Anion Metathesis, Solution Behavior, and High Stability of the Metal Configuration","Organometallics","2007","26","4","860","","10.1021/om060756s","","","0.71073","MoKα","","0.146","0.0809","","0.1623","0.085","0.085","","","","","","1.1145","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072527","9.8932","0.001","18.3752","0.0019","14.1285","0.0014","90","","90.911","0.002","90","","2568.1","0.5","193","2","193","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H38 B F4 N P Rh -","- C25 H38 B F4 N P Rh -","- C100 H152 B4 F16 N4 P4 Rh4 -","4","1","","Cipot, Judy; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","Cationic and Formally Zwitterionic Rhodium(I) and Iridium(I) Derivatives of a P,N-Substituted Indene: A Comparative Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","3","594","","10.1021/om060758c","","","0.71073","MoKα","","0.0558","0.051","","","0.139","0.1415","","","","","","1.147","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072528","15.7732","0.0011","8.2243","0.0006","20.9941","0.0015","90","","91.6882","0.0014","90","","2722.2","0.3","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H40 Cl3 N P Rh -","- C26 H40 Cl3 N P Rh -","- C104 H160 Cl12 N4 P4 Rh4 -","4","1","","Cipot, Judy; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","Cationic and Formally Zwitterionic Rhodium(I) and Iridium(I) Derivatives of a P,N-Substituted Indene: A Comparative Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","3","594","","10.1021/om060758c","","","0.71073","MoKα","","0.0359","0.0328","","","0.085","0.0874","","","","","","1.019","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072529","9.9608","0.0006","20.2706","0.0012","14.0988","0.0009","90","","103.575","0.001","90","","2767.2","0.3","193","2","193","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C26 H38 F3 Ir N O3 P S -","- C26 H38 F3 Ir N O3 P S -","- C104 H152 F12 Ir4 N4 O12 P4 S4 -","4","1","","Cipot, Judy; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","Cationic and Formally Zwitterionic Rhodium(I) and Iridium(I) Derivatives of a P,N-Substituted Indene: A Comparative Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","3","594","","10.1021/om060758c","","","0.71073","MoKα","","0.0556","0.0315","","","0.0589","0.0654","","","","","","1.002","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072530","14.5348","0.0012","9.9545","0.0009","18.5063","0.0016","90","","91.1816","0.0012","90","","2677","0.4","193","2","193","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C25 H38 F6 Ir N P2 -","- C25 H38 F6 Ir N P2 -","- C100 H152 F24 Ir4 N4 P8 -","4","1","","Cipot, Judy; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","Cationic and Formally Zwitterionic Rhodium(I) and Iridium(I) Derivatives of a P,N-Substituted Indene: A Comparative Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","3","594","","10.1021/om060758c","","","0.71073","MoKα","","0.0361","0.029","","","0.0706","0.074","","","","","","1.088","","","","has coordinates,has disorder","178614","2020-10-21","18:00:00",""
"4072531","9.7054","0.0006","16.985","0.001","14.5743","0.0009","90","","109.392","0.001","90","","2266.2","0.2","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H37 N P Rh -","- C25 H37 N P Rh -","- C100 H148 N4 P4 Rh4 -","4","1","","Cipot, Judy; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","Cationic and Formally Zwitterionic Rhodium(I) and Iridium(I) Derivatives of a P,N-Substituted Indene: A Comparative Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","3","594","","10.1021/om060758c","","","0.71073","MoKα","","0.0396","0.0329","","","0.0825","0.0861","","","","","","1.083","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072532","9.6714","0.0005","16.9783","0.0009","14.508","0.0007","90","","109.418","0.0007","90","","2246.8","0.2","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H37 Ir N P -","- C25 H37 Ir N P -","- C100 H148 Ir4 N4 P4 -","4","1","","Cipot, Judy; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","Cationic and Formally Zwitterionic Rhodium(I) and Iridium(I) Derivatives of a P,N-Substituted Indene: A Comparative Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","3","594","","10.1021/om060758c","","","0.71073","MoKα","","0.0194","0.0174","","","0.0419","0.0426","","","","","","1.086","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072533","9.438","0.0004","10.755","0.0007","9.71","0.0006","90","","102.118","0.003","90","","963.66","0.1","173","2","173","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C18 H26 Cl N O P Rh -","- C18 H26 Cl N O P Rh -","- C36 H52 Cl2 N2 O2 P2 Rh2 -","2","1","","Cipot, Judy; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","Cationic and Formally Zwitterionic Rhodium(I) and Iridium(I) Derivatives of a P,N-Substituted Indene: A Comparative Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","3","594","","10.1021/om060758c","","","0.71073","MoKα","","0.0491","0.0398","","","0.0795","0.0849","","","","","","1.078","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072539","9.0546","0.0011","15.272","0.002","20.203","0.003","90","","90","","90","","2793.7","0.6","180","2","180","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H40 Hf N4 O -","- C29 H40 Hf N4 O -","- C116 H160 Hf4 N16 O4 -","4","1","","Gott, Andrew L.; Coles, Stuart R.; Clarke, Adam J.; Clarkson, Guy J.; Scott, Peter","Chiral Alkoxide-Functionalized Guanidinates from Ring-Opening Rearrangement of Aminooxazolinate Complexes","Organometallics","2007","26","1","136","","10.1021/om0607649","","","1.54178","CuKα","","0.0282","0.0262","","","0.0589","0.0596","","","","","","1.016","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072540","14.4265","0.0003","12.751","0.0005","11.5855","0.0005","90","","106.64","0.03","90","","2041.9","0.3","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H26 Fe Si -","- C22 H26 Fe Si -","- C88 H104 Fe4 Si4 -","4","1","","Chan, Wing Yan; Lough, Alan J.; Manners, Ian","Synthesis, Characterization, and Photocontrolled Ring-Opening Polymerization of Sila[1]ferrocenophanes with Multiple Alkyne Substituents","Organometallics","2007","26","5","1217","","10.1021/om060767l","","","0.71073","MoKα","","0.1245","0.0557","","","0.1301","0.1589","","","","","","1.034","","","","has coordinates,has disorder","178614","2020-10-21","18:00:00",""
"4072541","19.0405","0.0005","7.5017","0.0001","23.3594","0.0006","90","","90","","90","","3336.57","0.13","150","1","150","1","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C21 H16 Fe Si -","- C21 H16 Fe Si -","- C168 H128 Fe8 Si8 -","8","2","","Chan, Wing Yan; Lough, Alan J.; Manners, Ian","Synthesis, Characterization, and Photocontrolled Ring-Opening Polymerization of Sila[1]ferrocenophanes with Multiple Alkyne Substituents","Organometallics","2007","26","5","1217","","10.1021/om060767l","","","0.71073","MoKα","","0.0591","0.0384","","","0.0805","0.0895","","","","","","1.017","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072542","8.8609","0.0004","9.3119","0.0004","22.345","0.0008","83.815","0.003","83.552","0.003","85.989","0.002","1818.27","0.13","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C36.5 H20 Co4 Fe O12 Si -","- C36.5 H20 Co4 Fe O12 Si -","- C73 H40 Co8 Fe2 O24 Si2 -","2","1","","Chan, Wing Yan; Lough, Alan J.; Manners, Ian","Synthesis, Characterization, and Photocontrolled Ring-Opening Polymerization of Sila[1]ferrocenophanes with Multiple Alkyne Substituents","Organometallics","2007","26","5","1217","","10.1021/om060767l","","","0.71073","MoKα","","0.1172","0.0521","","","0.1123","0.1402","","","","","","0.991","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4072543","11.245","0.0014","15.5538","0.0019","16.19","0.002","90","","90","","90","","2831.7","0.6","396","2","396","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C136 H96 Cr8 O24 -","- C136 H96 Cr8 O24 -","- C136 H96 Cr8 O24 -","1","0.125","","Coleman, Anthony; Draper, Sylvia M.; Long, Conor; Pryce, Mary T.","Photochemicalcis−transIsomerization ofcis-(η6-1,2-Diphenylethene)Cr(CO)3and the Molecular Structure oftrans-(η6-1,2-Diphenylethene)Cr(CO)3","Organometallics","2007","26","17","4128","","10.1021/om060773h","","","0.71073","MoKα","","0.0512","0.0352","","","0.0836","0.0924","","","","","","1.041","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072544","11.3718","0.0012","20.898","0.002","21.72","0.002","66.805","0.002","88.652","0.002","83.274","0.002","4710.4","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C113 H104 N2 Ni2 O2 P2 -","- C113 H104 N2 Ni2 O2 P2 -","- C226 H208 N4 Ni4 O4 P4 -","2","1","","Chen, Qihui; Yu, Jing; Huang, Jiling","Arene-Bridged Salicylaldimine-Based Binuclear Neutral Nickel(II) Complexes: Synthesis and Ethylene Polymerization Activities","Organometallics","2007","26","3","617","","10.1021/om060778e","","","0.71073","MoKα","","0.1305","0.0742","","","0.163","0.1845","","","","","","0.841","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072545","11.0849","0.0001","14.3306","0.0001","20.1878","0.0001","90","","100.503","0.0003","90","","3153.17","0.04","173","1","173","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H36 Cl N2 Rh -","- C39 H36 Cl N2 Rh -","- C156 H144 Cl4 N8 Rh4 -","4","1","","Baskakov, Denys; Herrmann, Wolfgang A.; Herdtweck, Eberhardt; Hoffmann, Stephan D.","Chiral N-Heterocyclic Carbenes with Restricted Flexibility in Asymmetric Catalysis†","Organometallics","2007","26","3","626","","10.1021/om0607806","","","0.71073","MoKα","","0.0589","0.0452","","","0.1159","0.1236","","","","","","1.032","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072546","8.7505","0.0004","17.5279","0.0008","20.1836","0.001","90","","90","","90","","3095.7","0.3","173","1","173","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C39 H36 Cl N2 Rh -","- C39 H36 Cl N2 Rh -","- C156 H144 Cl4 N8 Rh4 -","4","1","","Baskakov, Denys; Herrmann, Wolfgang A.; Herdtweck, Eberhardt; Hoffmann, Stephan D.","Chiral N-Heterocyclic Carbenes with Restricted Flexibility in Asymmetric Catalysis†","Organometallics","2007","26","3","626","","10.1021/om0607806","","","0.71073","MoKα","","0.0299","0.0275","","","0.0607","0.0625","","","","","","1.099","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072547","5.6811","0.0003","19.689","0.0009","20.2676","0.0008","90","","90","","90","","2267.04","0.18","173","1","173","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H28 N2 -","- C30 H28 N2 -","- C120 H112 N8 -","4","1","","Baskakov, Denys; Herrmann, Wolfgang A.; Herdtweck, Eberhardt; Hoffmann, Stephan D.","Chiral N-Heterocyclic Carbenes with Restricted Flexibility in Asymmetric Catalysis†","Organometallics","2007","26","3","626","","10.1021/om0607806","","","0.71073","MoKα","","0.0288","0.0255","","","0.0615","0.0624","","","","","","1.014","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072548","10.1563","0.0012","20.818","0.002","17.4417","0.0019","90","","99.432","0.002","90","","3637.9","0.7","187","2","187","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30.5 H47 N2 O Si2 Y -","- C30.5 H47 N2 O Si2 Y -","- C122 H188 N8 O4 Si8 Y4 -","4","1","","Yang, Yi; Li, Shihui; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Pyrrolide-Ligated Organoyttrium Complexes. Synthesis, Characterization, and Lactide Polymerization Behavior","Organometallics","2007","26","3","671","","10.1021/om060781y","","","0.71073","MoKα","","0.1597","0.0742","","","0.1672","0.2064","","","","","","0.974","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072549","20.3821","0.0008","19.3542","0.0007","22.0003","0.0009","90","","116.168","0.001","90","","7789.1","0.5","187","2","187","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C66 H88 N4 O P2 Si4 Y2 -","- C66 H88 N4 O P2 Si4 Y2 -","- C264 H352 N16 O4 P8 Si16 Y8 -","4","1","","Yang, Yi; Li, Shihui; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Pyrrolide-Ligated Organoyttrium Complexes. Synthesis, Characterization, and Lactide Polymerization Behavior","Organometallics","2007","26","3","671","","10.1021/om060781y","","","0.71073","MoKα","","0.1033","0.0602","","","0.1989","0.2253","","","","","","1.092","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072550","11.688","0.0007","16.6699","0.001","24.4478","0.0015","90","","100.532","0.001","90","","4683.1","0.5","187","2","187","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C51 H63 N6 Y -","- C51 H63 N6 Y -","- C204 H252 N24 Y4 -","4","1","","Yang, Yi; Li, Shihui; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Pyrrolide-Ligated Organoyttrium Complexes. Synthesis, Characterization, and Lactide Polymerization Behavior","Organometallics","2007","26","3","671","","10.1021/om060781y","","","0.71073","MoKα","","0.0934","0.0496","","","0.0989","0.1128","","","","","","0.965","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072551","11.5198","0.0008","12.3059","0.0009","38.706","0.003","90","","106.323","0.002","90","","5265.9","0.7","187","2","187","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C57 H76 N5 O Y -","- C57 H76 N5 O Y -","- C228 H304 N20 O4 Y4 -","4","1","","Yang, Yi; Li, Shihui; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Pyrrolide-Ligated Organoyttrium Complexes. Synthesis, Characterization, and Lactide Polymerization Behavior","Organometallics","2007","26","3","671","","10.1021/om060781y","","","0.71073","MoKα","","0.0915","0.0508","","","0.11","0.1252","","","","","","0.975","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072552","14.8158","0.0003","17.7164","0.0004","10.5482","0.0003","90","","90","","90","","2768.72","0.12","150","1","150","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C16 H30 F6 O8 Pt2 S2 -","- C16 H30 F6 O8 Pt2 S2 -","- C64 H120 F24 O32 Pt8 S8 -","4","0.5","","Hsieh, Vicki; De Crisci, Antonio G.; Lough, Alan J.; Fekl, Ulrich","Lewis-Acidity of Trimethylplatinum(IV) with Labile Oxygen-Donor Ligands","Organometallics","2007","26","4","938","","10.1021/om060787n","","","0.71073","MoKα","","0.0628","0.0403","","","0.0902","0.102","","","","","","1.022","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072553","10.8683","0.0009","10.4976","0.0008","29.963","0.002","90","","99.796","0.002","90","","3368.7","0.4","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","[Fe(PNP-iPr)(CO)(CH3CN)2](BF4)2.(CH3)2CO","","","- C25 H45 B2 F8 Fe N5 O2 P2 -","- C25 H45 B2 F8 Fe N5 O2 P2 -","- C100 H180 B8 F32 Fe4 N20 O8 P8 -","4","1","","Benito-Garagorri, David; Wiedermann, Julia; Pollak, Martin; Mereiter, Kurt; Kirchner, Karl","Iron(II) Complexes Bearing Tridentate PNP Pincer-Type Ligands as Catalysts for the Selective Formation of 3-Hydroxyacrylates from Aromatic Aldehydes and Ethyldiazoacetate","Organometallics","2007","26","1","217","","10.1021/om060802o","","","0.71073","MoKα","","0.0474","0.0374","","","0.092","0.098","","","","","","1.055","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072554","9.6583","0.0005","14.5653","0.0007","20.2207","0.001","90","","90","","90","","2844.6","0.2","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","[Fe(PNP-iPr)(Cl)2].(C2H5)2O","","","- C21 H43 Cl2 Fe N3 O P2 -","- C21 H43 Cl2 Fe N3 O P2 -","- C84 H172 Cl8 Fe4 N12 O4 P8 -","4","1","","Benito-Garagorri, David; Wiedermann, Julia; Pollak, Martin; Mereiter, Kurt; Kirchner, Karl","Iron(II) Complexes Bearing Tridentate PNP Pincer-Type Ligands as Catalysts for the Selective Formation of 3-Hydroxyacrylates from Aromatic Aldehydes and Ethyldiazoacetate","Organometallics","2007","26","1","217","","10.1021/om060802o","","","0.71073","MoKα","","0.0433","0.0403","","","0.1096","0.1127","","","","","","1.045","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072555","9.767","0.001","12.913","0.001","13.741","0.001","84.13","0.01","77.98","0.01","85.77","0.01","1683.7","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","dichloro(N,N'-(6,6'-Dimethylbiphenyl-2,2'-diyl)bis((2-pyridyl)methyl)diimine) manganese(II) tris(dichloromethane) solvate","","- C29 H28 Cl8 Mn N4 -","- C29 H28 Cl8 Mn N4 -","- C58 H56 Cl16 Mn2 N8 -","2","1","","Yliheikkilä, Katariina; Axenov, Kirill; Räisänen, Minna T.; Klinga, Martti; Lankinen, Mikko P.; Kettunen, Mika; Leskelä, Markku; Repo, Timo","Manganese(II) Complexes in Ethene Polymerization","Organometallics","2007","26","4","980","","10.1021/om0608105","","","0.71073","MoKα","","0.1389","0.0948","","","0.2289","0.2471","","","","","","1.488","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072556","9.249","0.002","27.1","0.004","11.653","0.002","90","","107.78","0.03","90","","2781.3","1","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","dichloro(N,N'-di(quinoline-2-methylene)diiminocyclohexane)manganese(II) dichloromethane","","- C27 H26 Cl4 Mn N4 -","- C27 H26 Cl4 Mn N4 -","- C108 H104 Cl16 Mn4 N16 -","4","2","","Yliheikkilä, Katariina; Axenov, Kirill; Räisänen, Minna T.; Klinga, Martti; Lankinen, Mikko P.; Kettunen, Mika; Leskelä, Markku; Repo, Timo","Manganese(II) Complexes in Ethene Polymerization","Organometallics","2007","26","4","980","","10.1021/om0608105","","","0.71073","MoKα","","0.1071","0.0555","","","0.0989","0.1142","","","","","","1.016","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072557","9.9823","0.0009","11.4566","0.001","23.248","0.002","90","","95.353","0.002","90","","2647.1","0.4","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H43 B Ni S3 -","- C24 H43 B Ni S3 -","- C96 H172 B4 Ni4 S12 -","4","1","","DuPont, Julie A.; Coxey, Michael B.; Schebler, Peter J.; Incarvito, Christopher D.; Dougherty, William G.; Yap, Glenn P. A.; Rheingold, Arnold L.; Riordan, Charles G.","High-Spin Organocobalt(II) Complexes in a Thioether Coordination Environment","Organometallics","2007","26","4","971","","10.1021/om0608253","","","0.71073","MoKα","","0.0737","0.0423","","","0.0881","0.0992","","","","","","1","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072558","9.7856","0.0002","21.6045","0.0004","12.6512","0.0002","90","","99.1316","0.0005","90","","2640.73","0.08","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H41 B Co S3 -","- C22 H41 B Co S3 -","- C88 H164 B4 Co4 S12 -","4","1","","DuPont, Julie A.; Coxey, Michael B.; Schebler, Peter J.; Incarvito, Christopher D.; Dougherty, William G.; Yap, Glenn P. A.; Rheingold, Arnold L.; Riordan, Charles G.","High-Spin Organocobalt(II) Complexes in a Thioether Coordination Environment","Organometallics","2007","26","4","971","","10.1021/om0608253","","","0.71073","MoKα","","0.0648","0.0499","","","0.1156","0.1216","","","","","","1.757","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072559","15.262","0.004","10.502","0.002","19.279","0.004","90","","105.982","0.004","90","","2970.6","1.1","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H45 B Co S3 -","- C28 H45 B Co S3 -","- C112 H180 B4 Co4 S12 -","4","1","","DuPont, Julie A.; Coxey, Michael B.; Schebler, Peter J.; Incarvito, Christopher D.; Dougherty, William G.; Yap, Glenn P. A.; Rheingold, Arnold L.; Riordan, Charles G.","High-Spin Organocobalt(II) Complexes in a Thioether Coordination Environment","Organometallics","2007","26","4","971","","10.1021/om0608253","","","0.71073","MoKα","","0.1106","0.0804","","","0.1905","0.2072","","","","","","1.152","","","","has coordinates,has disorder","178614","2020-10-21","18:00:00",""
"4072560","9.6191","0.001","22.827","0.002","12.4369","0.0013","90","","99.575","0.002","90","","2692.8","0.5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H43 B Co S3 -","- C24 H43 B Co S3 -","- C96 H172 B4 Co4 S12 -","4","1","","DuPont, Julie A.; Coxey, Michael B.; Schebler, Peter J.; Incarvito, Christopher D.; Dougherty, William G.; Yap, Glenn P. A.; Rheingold, Arnold L.; Riordan, Charles G.","High-Spin Organocobalt(II) Complexes in a Thioether Coordination Environment","Organometallics","2007","26","4","971","","10.1021/om0608253","","","0.71073","MoKα","","0.0561","0.0375","","","0.0855","0.0923","","","","","","1.004","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072561","11.1858","0.0003","11.4379","0.0003","13.2639","0.0003","111.406","0.001","97.879","0.001","113.333","0.001","1369.75","0.06","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H41 B Co O2 S3 -","- C24 H41 B Co O2 S3 -","- C48 H82 B2 Co2 O4 S6 -","2","1","","DuPont, Julie A.; Coxey, Michael B.; Schebler, Peter J.; Incarvito, Christopher D.; Dougherty, William G.; Yap, Glenn P. A.; Rheingold, Arnold L.; Riordan, Charles G.","High-Spin Organocobalt(II) Complexes in a Thioether Coordination Environment","Organometallics","2007","26","4","971","","10.1021/om0608253","","","0.71073","MoKα","","0.0474","0.0337","","","0.0824","0.0887","","","","","","1.142","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072562","10.4639","0.001","11.1076","0.0011","12.5785","0.0012","79.721","0.002","80.553","0.002","82.265","0.002","1410.6","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H43 B Co O2 S3 -","- C25 H43 B Co O2 S3 -","- C50 H86 B2 Co2 O4 S6 -","2","1","","DuPont, Julie A.; Coxey, Michael B.; Schebler, Peter J.; Incarvito, Christopher D.; Dougherty, William G.; Yap, Glenn P. A.; Rheingold, Arnold L.; Riordan, Charles G.","High-Spin Organocobalt(II) Complexes in a Thioether Coordination Environment","Organometallics","2007","26","4","971","","10.1021/om0608253","","","0.71073","MoKα","","0.0324","0.0296","","","0.0937","0.099","","","","","","1.05","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072563","9.425","0.004","22.87","0.009","14.474","0.007","90","","101.356","0.008","90","","3059","2","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H43 B Co O2 S3 -","- C29 H43 B Co O2 S3 -","- C116 H172 B4 Co4 O8 S12 -","4","1","","DuPont, Julie A.; Coxey, Michael B.; Schebler, Peter J.; Incarvito, Christopher D.; Dougherty, William G.; Yap, Glenn P. A.; Rheingold, Arnold L.; Riordan, Charles G.","High-Spin Organocobalt(II) Complexes in a Thioether Coordination Environment","Organometallics","2007","26","4","971","","10.1021/om0608253","","","0.71073","MoKα","","0.1124","0.0849","","","0.196","0.2091","","","","","","1.199","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072564","10.038","0.013","20.95","0.03","12.78","0.02","90","","101.35","0.03","90","","2635","7","218","2","218","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H38 B Co O2 S3 -","- C23 H38 B Co O2 S3 -","- C92 H152 B4 Co4 O8 S12 -","4","1","","DuPont, Julie A.; Coxey, Michael B.; Schebler, Peter J.; Incarvito, Christopher D.; Dougherty, William G.; Yap, Glenn P. A.; Rheingold, Arnold L.; Riordan, Charles G.","High-Spin Organocobalt(II) Complexes in a Thioether Coordination Environment","Organometallics","2007","26","4","971","","10.1021/om0608253","","","0.71073","MoKα","","0.0823","0.061","","","0.1485","0.1641","","","","","","1.02","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072565","11.6709","0.0008","11.9956","0.0008","19.3848","0.0014","90","","95.593","0.001","90","","2700.9","0.3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C21 H38 B Co N2 O2 S3 -","- C21 H38 B Co N2 O2 S3 -","- C84 H152 B4 Co4 N8 O8 S12 -","4","1","","DuPont, Julie A.; Coxey, Michael B.; Schebler, Peter J.; Incarvito, Christopher D.; Dougherty, William G.; Yap, Glenn P. A.; Rheingold, Arnold L.; Riordan, Charles G.","High-Spin Organocobalt(II) Complexes in a Thioether Coordination Environment","Organometallics","2007","26","4","971","","10.1021/om0608253","","","0.71073","MoKα","","0.0621","0.0399","","","0.0951","0.105","","","","","","1.019","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072566","20.8649","0.001","15.6124","0.0008","14.6317","0.0009","90","","105.547","0.006","90","","4591.9","0.4","203","2","203","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44.5 H58 Cl N2 P2 Si2 Y -","- C44.5 H54 Cl N2 P2 Si2 Y -","- C178 H216 Cl4 N8 P8 Si8 Y4 -","4","1","","Gamer, Michael T.; Roesky, Peter W.; Palard, Isabelle; Le Hellaye, Maude; Guillaume, Sophie M.","In Situ Formation of Bis(phosphinimino)methanide Rare Earth Alkoxide Initiators for the Ring-Opening Polymerization of ε-Caprolactone","Organometallics","2007","26","3","651","","10.1021/om0608307","","","0.56087","AgKα","","0.1479","0.0745","","","0.1531","0.1856","","","","","","1.037","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072567","20.9738","0.0013","15.6568","0.0008","14.6019","0.0009","90","","105.776","0.007","90","","4614.4","0.5","203","2","203","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44.5 H58 Cl N2 P2 Si2 Sm -","- C44.5 H54 Cl N2 P2 Si2 Sm -","- C178 H216 Cl4 N8 P8 Si8 Sm4 -","4","1","","Gamer, Michael T.; Roesky, Peter W.; Palard, Isabelle; Le Hellaye, Maude; Guillaume, Sophie M.","In Situ Formation of Bis(phosphinimino)methanide Rare Earth Alkoxide Initiators for the Ring-Opening Polymerization of ε-Caprolactone","Organometallics","2007","26","3","651","","10.1021/om0608307","","","0.56087","AgKα","","0.0475","0.0367","","","0.094","0.1055","","","","","","1.065","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072568","20.731","0.002","15.4763","0.0016","14.5358","0.0016","90","","105.87","0.008","90","","4485.9","0.8","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44.5 H58 Cl N2 P2 Si2 Yb -","- C44.5 H54 Cl N2 P2 Si2 Yb -","- C178 H216 Cl4 N8 P8 Si8 Yb4 -","4","1","","Gamer, Michael T.; Roesky, Peter W.; Palard, Isabelle; Le Hellaye, Maude; Guillaume, Sophie M.","In Situ Formation of Bis(phosphinimino)methanide Rare Earth Alkoxide Initiators for the Ring-Opening Polymerization of ε-Caprolactone","Organometallics","2007","26","3","651","","10.1021/om0608307","","","0.71073","MoKα","","0.0399","0.0285","","","0.0624","0.0647","","","","","","1.021","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072569","8.74","","12.687","","14.204","","90","","104.17","","90","","1527.08","","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H20 Cl N2 O Pd0.5 -","- C15 H20 Cl N2 O Pd0.5 -","- C60 H80 Cl4 N8 O4 Pd2 -","4","1","","Ray, Lipika; Shaikh, Mobin M.; Ghosh, Prasenjit","Palladium(II) and Gold(I) Complexes of a New O-Functionalized N-Heterocyclic Carbene Ligand: Synthesis, Structures, and Catalytic Application","Organometallics","2007","26","4","958","","10.1021/om060834b","","","0.7093","MoKα","","0.0721","0.0492","","","0.1337","0.145","","","","","","1.066","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072570","16.5313","0.0019","11.2567","0.0018","17.275","0.007","90","","99.65","0.02","90","","3169.2","1.4","150","2","150","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C15 H20 Au Cl N2 O -","- C15 H20 Au Cl N2 O -","- C120 H160 Au8 Cl8 N16 O8 -","8","1","","Ray, Lipika; Shaikh, Mobin M.; Ghosh, Prasenjit","Palladium(II) and Gold(I) Complexes of a New O-Functionalized N-Heterocyclic Carbene Ligand: Synthesis, Structures, and Catalytic Application","Organometallics","2007","26","4","958","","10.1021/om060834b","","","0.71073","MoKα","","0.0199","0.0172","","","0.0422","0.0429","","","","","","1.084","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072571","18.763","0.004","20.181","0.004","25.127","0.005","90","","104.52","0.03","90","","9211","3","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C109.6 H98.4 Li4 N4 P4 -","- C107.6 H84 Li4 N4 P4 -","- C430.4 H336 Li16 N16 P16 -","4","0.5","","Ruiz Gómez, Gloria; Fernández, Ignacio; López Ortiz, Fernando; Price, Richard D.; Davidson, Matthew G.; Mahon, Mary F.; Howard, Judith A. K.","A Tetrameric Lithiated Phosphazene Containing a Lithium Atom Bound Exclusively to Four sp3-Hybridized Carbanionic Centers: A Key Intermediate for Understanding Structure−Reactivity Relationships of Phosphazenyllithium Compounds","Organometallics","2007","26","3","514","","10.1021/om0608354","","","0.71073","MoKα","","0.1598","0.0999","","","0.2391","0.2622","","","","","","1.062","","","","has coordinates,has disorder","178614","2020-10-21","18:00:00",""
"4072572","14.7578","0.0007","15.198","0.0007","20.8733","0.001","90","","90","","90","","4681.7","0.4","100","2","100","2","","","","","","","synthesis as described","7","P c a b","-P 2bc 2ac","61","","","","- C23 H37 N O S Si Ti -","- C23 H37 N O S Si Ti -","- C184 H296 N8 O8 S8 Si8 Ti8 -","8","1","","Lian, Bing; Thomas, Christophe M.; Navarro, Christophe; Carpentier, Jean-François","“Constrained Geometry” Titanium Complexes: Exceptionally Robust Systems for Living Polymerization of Methacrylates at High Temperature and Model Studies toward Chain Transfer Polymerization with Thiols","Organometallics","2007","26","1","187","","10.1021/om060838g","","x-ray","0.71073","MoKα","","0.0502","0.0402","","","0.0991","0.1037","","","","","","1.066","","","","has coordinates,has disorder","178614","2020-10-21","18:00:00",""
"4072573","13.714","0.003","14.086","0.003","14.814","0.003","90","","103.48","0.03","90","","2782.9","1.1","220","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H80 Br2 N4 Ni2 -","- C56 H80 Br2 N4 Ni2 -","- C112 H160 Br4 N8 Ni4 -","2","0.5","","Meinhard, Dieter; Reuter, Peter; Rieger, Bernhard","Activation of Polymerization Catalysts: Synthesis and Characterization of Novel Dinuclear Nickel(I) Diimine Complexes","Organometallics","2007","26","3","751","","10.1021/om060842s","","","0.71073","MoKα","","0.0814","0.0418","","","0.0804","0.0892","","","","","","0.88","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072574","13.156","0.003","16.357","0.003","16.792","0.003","90","","101.86","0.03","90","","3536.4","1.3","220","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C64 H96 Br4 Mg N4 Ni2 O2 -","- C64 H96 Br4 Mg N4 Ni2 O2 -","- C128 H192 Br8 Mg2 N8 Ni4 O4 -","2","0.5","","Meinhard, Dieter; Reuter, Peter; Rieger, Bernhard","Activation of Polymerization Catalysts: Synthesis and Characterization of Novel Dinuclear Nickel(I) Diimine Complexes","Organometallics","2007","26","3","751","","10.1021/om060842s","","","0.71073","MoKα","","0.1088","0.0498","","","0.1094","0.1303","","","","","","0.755","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072575","76.294","0.006","18.2792","0.0011","19.1459","0.001","90","","94.152","0.007","90","","26631","3","203","2","203","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","[Ru6(p-PriC6H4Me)6(tpt)2Cl6][O3SCF3]6","","- C105 H114 Cl6 F18 N12 O19 Ru6 S6 -","- C105 H114 Cl6 F18 N12 O19 Ru6 S6 -","- C840 H912 Cl48 F144 N96 O152 Ru48 S48 -","8","1","","Govindaswamy, Padavattan; Süss-Fink, Georg; Therrien, Bruno","Self-Assembled Chloro-Bridged (Arene)ruthenium Metallo-Prisms: Synthesis and Molecular Structure of Cationic Complexes of the Type [Ru6(η6-arene)6(μ3-tpt-κN)2(μ-Cl)6]6+(tpt = 2,4,6-tris(pyridinyl)-1,3,5-triazine)","Organometallics","2007","26","4","915","","10.1021/om060843k","","","0.71073","MoKα","","0.1016","0.0546","","","0.139","0.1537","","","","","","0.902","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072576","23.8695","0.0014","17.233","0.0008","35.282","0.002","90","","93.499","0.007","90","","14486","1.4","203","2","203","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","[Ru6(C6Me6)6(tpt)2Cl6][O3SCF3]6","","- C114 H132 Cl6 F18 N12 O18 Ru6 S6 -","- C108 H132 Cl6 N12 Ru6 -","- C432 H528 Cl24 N48 Ru24 -","4","1","","Govindaswamy, Padavattan; Süss-Fink, Georg; Therrien, Bruno","Self-Assembled Chloro-Bridged (Arene)ruthenium Metallo-Prisms: Synthesis and Molecular Structure of Cationic Complexes of the Type [Ru6(η6-arene)6(μ3-tpt-κN)2(μ-Cl)6]6+(tpt = 2,4,6-tris(pyridinyl)-1,3,5-triazine)","Organometallics","2007","26","4","915","","10.1021/om060843k","","","0.71073","MoKα","","0.1069","0.051","","","0.1188","0.1321","","","","","","0.749","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072577","13.1582","0.0007","32.575","0.0017","33.7963","0.0014","90","","97.394","0.004","90","","14365.6","1.2","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","[Ru6(C6Me6)6(3-tpt)2Cl6][O3SCF3]6","","- C114 H132 Cl6 F18 N12 O18 Ru6 S6 -","- C112 H132 Cl6 F12 N12 O12 Ru6 S4 -","- C448 H528 Cl24 F48 N48 O48 Ru24 S16 -","4","1","","Govindaswamy, Padavattan; Süss-Fink, Georg; Therrien, Bruno","Self-Assembled Chloro-Bridged (Arene)ruthenium Metallo-Prisms: Synthesis and Molecular Structure of Cationic Complexes of the Type [Ru6(η6-arene)6(μ3-tpt-κN)2(μ-Cl)6]6+(tpt = 2,4,6-tris(pyridinyl)-1,3,5-triazine)","Organometallics","2007","26","4","915","","10.1021/om060843k","","","0.71073","MoKα","","0.1284","0.0584","","","0.1127","0.1346","","","","","","0.911","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072578","15.8524","0.0007","25.8552","0.0012","33.6161","0.0015","90","","90.602","0.001","90","","13777.4","1.1","158","2","158","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C105 H162 Cl2 O44 Os6 Si14 -","- C105 H156 Cl2 O44 Os6 Si14 -","- C420 H624 Cl8 O176 Os24 Si56 -","4","0.5","","Lucenti, Elena; Feher, Frank J.; Ziller, Joseph W.","Synthesis and Characterization of Osmium-Containing Silsesquioxanes: High-Yield Routes to {Os3(CO)10(μ-H)[(μ-O)Si7O10(c-C6H11)7]} and the New Clusters {Os3(CO)10(μ-H)[(μ-O)Si7O9(OH)2(c-C6H11)7]}, {[Os3(CO)10(μ-H)]2(μ-O)2Si7O9(OH)(c-C6H11)7}, {Os3(CO)10(μ-H)[(μ-O)Si8O11(OH)(c-C6H11)8]}, and {[Os3(CO)10(μ-H)]2(μ-O)2Si8O11(c-C6H11)8}","Organometallics","2007","26","1","75","","10.1021/om060844c","","","0.71073","MoKα","","0.0509","0.0354","","","0.0779","0.0836","","","","","","1.069","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072579","29.3568","0.0018","13.3023","0.0008","24.833","0.0016","90","","106.381","0.001","90","","9304","1","158","2","158","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C70 H94 Cl2 O33 Os6 Si8 -","- C70 H92 Cl2 O33 Os6 Si8 -","- C280 H368 Cl8 O132 Os24 Si32 -","4","0.5","","Lucenti, Elena; Feher, Frank J.; Ziller, Joseph W.","Synthesis and Characterization of Osmium-Containing Silsesquioxanes: High-Yield Routes to {Os3(CO)10(μ-H)[(μ-O)Si7O10(c-C6H11)7]} and the New Clusters {Os3(CO)10(μ-H)[(μ-O)Si7O9(OH)2(c-C6H11)7]}, {[Os3(CO)10(μ-H)]2(μ-O)2Si7O9(OH)(c-C6H11)7}, {Os3(CO)10(μ-H)[(μ-O)Si8O11(OH)(c-C6H11)8]}, and {[Os3(CO)10(μ-H)]2(μ-O)2Si8O11(c-C6H11)8}","Organometallics","2007","26","1","75","","10.1021/om060844c","","","0.71073","MoKα","","0.0907","0.045","","","0.0876","0.1019","","","","","","1.041","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072580","51.535","0.002","12.9064","0.0005","24.7552","0.001","90","","107.874","0.001","90","","15670.7","1.1","163","2","163","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C116 H180 O46 Os6 Si16 -","- C116 O46 Os6 Si16 -","- C464 O184 Os24 Si64 -","4","0.5","","Lucenti, Elena; Feher, Frank J.; Ziller, Joseph W.","Synthesis and Characterization of Osmium-Containing Silsesquioxanes: High-Yield Routes to {Os3(CO)10(μ-H)[(μ-O)Si7O10(c-C6H11)7]} and the New Clusters {Os3(CO)10(μ-H)[(μ-O)Si7O9(OH)2(c-C6H11)7]}, {[Os3(CO)10(μ-H)]2(μ-O)2Si7O9(OH)(c-C6H11)7}, {Os3(CO)10(μ-H)[(μ-O)Si8O11(OH)(c-C6H11)8]}, and {[Os3(CO)10(μ-H)]2(μ-O)2Si8O11(c-C6H11)8}","Organometallics","2007","26","1","75","","10.1021/om060844c","","","0.71073","MoKα","","0.2209","0.0943","","","0.2741","0.3557","","","","","","1.057","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072581","10.4632","0.0011","11.4976","0.0011","13.7306","0.0012","77.195","0.004","83.751","0.004","76.866","0.004","1565.6","0.3","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H36 Mo O7 P2 -","- C30 H36 Mo O7 P2 -","- C60 H72 Mo2 O14 P4 -","2","1","","Streubel, Rainer; Bode, Maren; von Frantzius, Gerd; Hrib, Cristian; Jones, Peter G.; Monsees, Axel","Metal-Directed Synthesis of Complexes Featuring Functional P,C-Cage Ligands: What Are the Intermediates?","Organometallics","2007","26","6","1371","","10.1021/om0608455","","","0.71073","MoKα","","0.0717","0.0398","","","0.0776","0.0846","","","","","","0.894","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072582","6.184","0.0015","11.014","0.004","18.399","0.002","73.172","0.019","81.516","0.017","87.5","0.03","1186.4","0.5","298","2","298","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C20 H18 Mo P S6 W -","- C20 H18 Mo P S6 W -","- C40 H36 Mo2 P2 S12 W2 -","2","1","","Hossain, Md. Munkir; Lin, Hsiu-Mei; Shyu, Shin-Guang","Formation of a Dithiophosphinate Ligand Ph2PS2by Sulfur Insertion into the Metal−Phosphido Bond on Heterobimetallic Phosphido-Bridged Complex Cp(CO)2W(μ-PPh2)Mo(CO)5: A Rare Example of a Neutral Six-Electron Mixed-Metal Cluster with a Mo2WS4Core","Organometallics","2007","26","3","685","","10.1021/om0608509","","x-ray","0.71073","MoKα","","0.061","0.0275","","","0.0577","0.065","","","","","","1.014","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072583","6.7919","0.0014","23.052","0.005","25.445","0.005","90","","90","","90","","3983.8","1.4","298","2","298","2","","","","","","","synthesis as described","5","P c a b","-P 2bc 2ac","61","","","","- C16 H16 O5 S4 W2 -","- C16 H16 O5 S4 W2 -","- C128 H128 O40 S32 W16 -","8","1","","Hossain, Md. Munkir; Lin, Hsiu-Mei; Shyu, Shin-Guang","Formation of a Dithiophosphinate Ligand Ph2PS2by Sulfur Insertion into the Metal−Phosphido Bond on Heterobimetallic Phosphido-Bridged Complex Cp(CO)2W(μ-PPh2)Mo(CO)5: A Rare Example of a Neutral Six-Electron Mixed-Metal Cluster with a Mo2WS4Core","Organometallics","2007","26","3","685","","10.1021/om0608509","","x-ray","0.71073","MoKα","","0.2006","0.0503","","","0.0976","0.128","","","","","","1.02","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072584","28.204","0.006","6.7865","0.0014","18.204","0.004","90","","120.183","0.003","90","","3012","1.1","298","2","298","2","","","","","","","synthesis as described","7","C 1 2 1","C 2y","5","","","","- C23 H21 Mo O5 P S6 W -","- C23 H21 Mo O5 P S6 W -","- C92 H84 Mo4 O20 P4 S24 W4 -","4","1","","Hossain, Md. Munkir; Lin, Hsiu-Mei; Shyu, Shin-Guang","Formation of a Dithiophosphinate Ligand Ph2PS2by Sulfur Insertion into the Metal−Phosphido Bond on Heterobimetallic Phosphido-Bridged Complex Cp(CO)2W(μ-PPh2)Mo(CO)5: A Rare Example of a Neutral Six-Electron Mixed-Metal Cluster with a Mo2WS4Core","Organometallics","2007","26","3","685","","10.1021/om0608509","","x-ray","0.71073","MoKα","","0.1696","0.0558","","","0.132","0.1674","","","","","","1.01","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072585","11.4373","0.0002","11.4761","0.0002","20.4699","0.0004","81.818","0.001","82.954","0.001","75.159","0.001","2560.26","0.08","298","2","298","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C41 H35 Mo2 P3 S10 W -","- C41 H35 Mo2 P3 S10 W -","- C82 H70 Mo4 P6 S20 W2 -","2","1","","Hossain, Md. Munkir; Lin, Hsiu-Mei; Shyu, Shin-Guang","Formation of a Dithiophosphinate Ligand Ph2PS2by Sulfur Insertion into the Metal−Phosphido Bond on Heterobimetallic Phosphido-Bridged Complex Cp(CO)2W(μ-PPh2)Mo(CO)5: A Rare Example of a Neutral Six-Electron Mixed-Metal Cluster with a Mo2WS4Core","Organometallics","2007","26","3","685","","10.1021/om0608509","","x-ray","0.71073","MoKα","","0.0605","0.0356","","","0.1035","0.1507","","","","","","1.102","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072586","17.7428","0.0002","13.2892","0.0002","21.3972","0.0003","90","","90","","90","","5045.19","0.12","150","","150","","","","","","","","synthesis as described","5","P b c a","-P 2ac 2ab","61","","Cp*Ti(N-2,6-C6H3iPr2)Cl(py)","","- C27 H37 Cl N2 Ti -","- C27 H37 Cl N2 Ti -","- C216 H296 Cl8 N16 Ti8 -","8","1","","Owen, Christopher T.; Bolton, Paul D.; Cowley, Andrew R.; Mountford, Philip","Cyclopentadienyl Titanium Imido Compounds and Their Ethylene Polymerization Capability: Control of Molecular Weight Distributions by Imido N-Substituents","Organometallics","2007","26","1","83","","10.1021/om0608556","","","0.71073","MoKα","","0.0616","0.0359","","0.0612","0.041","0.041","","","","","","1.0973","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072587","8.6809","0.0002","9.707","0.0003","13.8311","0.0005","97.8878","0.0012","90.4074","0.0012","111.146","0.0014","1074.7","0.06","150","","150","","","","","","","","synthesis as described","6","P -1","-P 1","2","","Cp*Ti(N-2,6-C6H3Br2)Cl(py)","","- C21 H23 Br2 Cl N2 Ti -","- C21 H23 Br2 Cl N2 Ti -","- C42 H46 Br4 Cl2 N4 Ti2 -","2","1","","Owen, Christopher T.; Bolton, Paul D.; Cowley, Andrew R.; Mountford, Philip","Cyclopentadienyl Titanium Imido Compounds and Their Ethylene Polymerization Capability: Control of Molecular Weight Distributions by Imido N-Substituents","Organometallics","2007","26","1","83","","10.1021/om0608556","","","0.71073","MoKα","","0.046","0.0331","","0.0534","0.0387","0.0387","","","","","","1.0423","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072588","8.4499","0.0002","11.7126","0.0002","13.6175","0.0003","70.3832","0.0009","81.1385","0.0009","70.9648","0.001","1198.58","0.04","150","","150","","","","","","","","synthesis as described","5","P -1","-P 1","2","","Cp*Ti(N-2,6-C6H4tBu)Cl(py)","","- C25 H33 Cl N2 Ti -","- C25 H33 Cl N2 Ti -","- C50 H66 Cl2 N4 Ti2 -","2","1","","Owen, Christopher T.; Bolton, Paul D.; Cowley, Andrew R.; Mountford, Philip","Cyclopentadienyl Titanium Imido Compounds and Their Ethylene Polymerization Capability: Control of Molecular Weight Distributions by Imido N-Substituents","Organometallics","2007","26","1","83","","10.1021/om0608556","","","0.71073","MoKα","","0.0478","0.0349","","0.0466","0.0405","0.0405","","","","","","1.0705","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072589","8.3636","0.0002","11.5408","0.0003","12.7908","0.0004","75.196","0.0009","82.9984","0.001","74.2354","0.0012","1146.89","0.05","150","","150","","","","","","","","synthesis as described","5","P -1","-P 1","2","","Cp*Ti(N-2,6-C6H4iPr)Cl(py)","","- C24 H31 Cl N2 Ti -","- C24 H31 Cl N2 Ti -","- C48 H62 Cl2 N4 Ti2 -","2","1","","Owen, Christopher T.; Bolton, Paul D.; Cowley, Andrew R.; Mountford, Philip","Cyclopentadienyl Titanium Imido Compounds and Their Ethylene Polymerization Capability: Control of Molecular Weight Distributions by Imido N-Substituents","Organometallics","2007","26","1","83","","10.1021/om0608556","","","0.71073","MoKα","","0.0699","0.0368","","0.0711","0.0391","0.0391","","","","","","1.1242","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072590","12.4719","0.0004","19.5247","0.0008","9.6046","0.0003","90","","93.795","0.002","90","","2333.69","0.14","150","","150","","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","Ti(N-2-C6H4CF3)Cl2(py)3","","- C22 H19 Cl2 F3 N4 Ti -","- C22 H19 Cl2 F3 N4 Ti -","- C88 H76 Cl8 F12 N16 Ti4 -","4","0.5","","Owen, Christopher T.; Bolton, Paul D.; Cowley, Andrew R.; Mountford, Philip","Cyclopentadienyl Titanium Imido Compounds and Their Ethylene Polymerization Capability: Control of Molecular Weight Distributions by Imido N-Substituents","Organometallics","2007","26","1","83","","10.1021/om0608556","","","0.71073","MoKα","","0.0541","0.0311","","0.0592","0.0324","0.0324","","","","","","1.1341","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4072591","12.6461","0.0003","16.122","0.0002","15.8418","0.0003","90","","104.136","0.001","90","","3132.03","0.1","143","1","143","1","","","","","","","see text","5","P 1 21/n 1","-P 2yn","14","","not known","","- C33 H27 Cl2 Fe N3 -","- C33 H27 Cl2 Fe N3 -","- C132 H108 Cl8 Fe4 N12 -","4","1","","Kaul, Franz A. R.; Puchta, Gerd T.; Frey, Guido D.; Herdtweck, Eberhardt; Herrmann, Wolfgang A.","Iminopyridine Complexes of 3d Metals for Ethylene Polymerization: Comparative Structural Studies and Ligand Size Controlled Chain Termination","Organometallics","2007","26","4","988","","10.1021/om060857q","","","0.71073","MoKα","","0.0401","0.032","","","0.0712","0.0738","","","","","","1.027","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072592","8.9356","0.0008","15.1674","0.0011","19.541","0.002","90","","101.885","0.011","90","","2591.6","0.4","173","1","173","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H28 Cl4 Fe N2 O -","- C22 H28 Cl4 Fe N2 O -","- C88 H112 Cl16 Fe4 N8 O4 -","4","1","","Kaul, Franz A. R.; Puchta, Gerd T.; Frey, Guido D.; Herdtweck, Eberhardt; Herrmann, Wolfgang A.","Iminopyridine Complexes of 3d Metals for Ethylene Polymerization: Comparative Structural Studies and Ligand Size Controlled Chain Termination","Organometallics","2007","26","4","988","","10.1021/om060857q","","","0.71073","MoKα","","0.087","0.0528","","","0.1295","0.1551","","","","","","0.953","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072593","8.8222","0.0001","15.2586","0.0002","19.5824","0.0002","90","","101.004","0.001","90","","2587.61","0.05","153","1","153","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H28 Cl4 Co N2 O -","- C22 H28 Cl4 Co N2 O -","- C88 H112 Cl16 Co4 N8 O4 -","4","1","","Kaul, Franz A. R.; Puchta, Gerd T.; Frey, Guido D.; Herdtweck, Eberhardt; Herrmann, Wolfgang A.","Iminopyridine Complexes of 3d Metals for Ethylene Polymerization: Comparative Structural Studies and Ligand Size Controlled Chain Termination","Organometallics","2007","26","4","988","","10.1021/om060857q","","","0.71073","MoKα","","0.0268","0.0246","","","0.0591","0.0601","","","","","","1.042","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072594","10.4153","0.0002","16.0983","0.0004","13.4869","0.0002","90","","92.393","0.001","90","","2259.36","0.08","153","","153","1","","","","","","","see text","6","C 1 c 1","C -2yc","9","","not known","","- C21 H26 Br2 N2 Ni O -","- C21 H26 Br2 N2 Ni O -","- C84 H104 Br8 N8 Ni4 O4 -","4","1","","Kaul, Franz A. R.; Puchta, Gerd T.; Frey, Guido D.; Herdtweck, Eberhardt; Herrmann, Wolfgang A.","Iminopyridine Complexes of 3d Metals for Ethylene Polymerization: Comparative Structural Studies and Ligand Size Controlled Chain Termination","Organometallics","2007","26","4","988","","10.1021/om060857q","","","0.71073","MoKα","","0.0202","0.0191","","","0.0434","0.0439","","","","","","1.042","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072595","12.8434","0.0005","18.7067","0.0007","33.6484","0.0012","90","","90","","90","","8084.3","0.5","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C39 H62 N O3 Sc Si2 -","- C39 H62 N O3 Sc Si2 -","- C312 H496 N8 O24 Sc8 Si16 -","8","1","","Marinescu, Smaranda C.; Agapie, Theodor; Day, Michael W.; Bercaw, John E.","Group 3 Dialkyl Complexes with Tetradentate (L, L, N, O; L = N, O, S) Monoanionic Ligands: Synthesis and Reactivity","Organometallics","2007","26","5","1178","","10.1021/om0608612","","","0.71073","MoKα","","0.0693","0.0447","","","0.0693","0.0709","","","","","","2.272","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4072596","18.3292","0.0016","10.1929","0.0008","28.733","0.002","90","","103.571","0.002","90","","5218.2","0.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H76 N3 O Si2 Y -","- C45 H76 N3 O Si2 Y -","- C180 H304 N12 O4 Si8 Y4 -","4","1","","Marinescu, Smaranda C.; Agapie, Theodor; Day, Michael W.; Bercaw, John E.","Group 3 Dialkyl Complexes with Tetradentate (L, L, N, O; L = N, O, S) Monoanionic Ligands: Synthesis and Reactivity","Organometallics","2007","26","5","1178","","10.1021/om0608612","","","0.71073","MoKα","","0.0896","0.064","","","0.1126","0.1151","","","","","","2.059","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4072597","11.364","0.0004","14.2999","0.0005","25.4993","0.0009","90","","100.231","0.001","90","","4077.9","0.2","98","2","98","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39 H62 N O3 Si2 Y -","- C39 H62 N O3 Si2 Y -","- C156 H248 N4 O12 Si8 Y4 -","4","1","","Marinescu, Smaranda C.; Agapie, Theodor; Day, Michael W.; Bercaw, John E.","Group 3 Dialkyl Complexes with Tetradentate (L, L, N, O; L = N, O, S) Monoanionic Ligands: Synthesis and Reactivity","Organometallics","2007","26","5","1178","","10.1021/om0608612","","","0.71073","MoKα","","0.0527","0.0323","","","0.0535","0.0555","","","","","","1.446","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4072598","24.015","0.005","9.998","0.002","18.294","0.004","90","","115.14","0.03","90","","3976.3","1.7","","","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H58 N2 O2 Zn -","- C45 H58 N2 O2 Zn -","- C180 H232 N8 O8 Zn4 -","4","0.5","","Anantharaman, Ganapathi; Elango, Kandasamy","Synthesis and Characterization of NHC-Stabilized Zinc Aryloxide and Zinc Hydroxyaryloxide†","Organometallics","2007","26","4","1089","","10.1021/om060867r","","","0.71073","MoKα","","0.0801","0.0506","","","0.0975","0.1397","","","","","","1.162","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072599","13.1223","0.0012","15.0004","0.0013","17.2102","0.0015","78.166","0.002","68.737","0.002","78.164","0.002","3058","0.5","100","2","373","2","","","","","","","","5","P -1","-P 1","2","","","","- C67 H80 N4 O4 Zn2 -","- C67 H80 N4 O4 Zn2 -","- C134 H160 N8 O8 Zn4 -","2","1","","Anantharaman, Ganapathi; Elango, Kandasamy","Synthesis and Characterization of NHC-Stabilized Zinc Aryloxide and Zinc Hydroxyaryloxide†","Organometallics","2007","26","4","1089","","10.1021/om060867r","","","0.71073","mokα","","0.0835","0.059","","","0.126","0.1378","","","","","","1.017","","","","has coordinates","178614","2020-10-21","18:00:00",""
"4072600","9.9085","0.0002","10.7654","0.0002","24.037","0.0005","90","","96.192","0.002","90","","2549.04","0.09","173.2","","173.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H42 N P Ru -","- C28 H42 N P Ru -","- C112 H168 N4 P4 Ru4 -","4","1","","Faller, J. W.; Fontaine, Philip P.","Stereoselectivity in a Chiral Ruthenium Ethylene Hydride Complex: Evidence of an Agostic Intermediate","Organometallics","2007","26","7","1738","","10.1021/om060868j","","","0.7107","MoKα","","0.069","0.05","","0.066","","0.063","","","1.802","","","2.02","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072601","13.1073","0.0002","22.3257","0.0003","20.0334","0.0003","90","","94.5439","0.0009","90","","5843.94","0.15","173.2","","173.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H41 F6 N P2 Ru -","- C28 H41 F6 N P2 Ru -","- C224 H328 F48 N8 P16 Ru8 -","8","2","","Faller, J. W.; Fontaine, Philip P.","Stereoselectivity in a Chiral Ruthenium Ethylene Hydride Complex: Evidence of an Agostic Intermediate","Organometallics","2007","26","7","1738","","10.1021/om060868j","","","0.7107","MoKα","","0.0658","0.038","","0.044","","0.04","","","1.587","","","1.77","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072602","28.2723","0.0014","4.7091","0.0002","17.1055","0.0009","90","","125.333","0.002","90","","1857.89","0.16","93","2","93","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Pyrrole-2-N-(o-hydroxyphenyl)-carbaldimine","","- C11 H10 N2 O -","- C11 H10 N2 O -","- C88 H80 N16 O8 -","8","1","","Gerlach, Daniela; Brendler, Erica; Heine, Thomas; Wagler, Jörg","Dianion of Pyrrole-2-N-(o-hydroxyphenyl)carbaldimine as an Interesting Tridentate (ONN) Ligand System in Hypercoordinate Silicon Complexes","Organometallics","2007","26","1","234","","10.1021/om060869b","","","0.71073","MoKα","","0.0669","0.0427","","","0.106","0.1147","","","","","","1.041","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072603","5.9727","0.0005","25.413","0.003","8.2155","0.0008","90","","90.328","0.003","90","","1247","0.2","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Pyrrole-2-N-(o-oxyphenyl)-carbaldiminato-silacyclobutane","","- C14 H14 N2 O Si -","- C14 H14 N2 O Si -","- C56 H56 N8 O4 Si4 -","4","2","","Gerlach, Daniela; Brendler, Erica; Heine, Thomas; Wagler, Jörg","Dianion of Pyrrole-2-N-(o-hydroxyphenyl)carbaldimine as an Interesting Tridentate (ONN) Ligand System in Hypercoordinate Silicon Complexes","Organometallics","2007","26","1","234","","10.1021/om060869b","","","0.71073","MoKα","","0.0471","0.0361","","","0.0867","0.0916","","","","","","1.021","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072604","25.2284","0.0006","5.8708","0.0002","16.3026","0.0005","90","","90","","90","","2414.59","0.12","90","2","90","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","Pyrrole-2-N-(o-oxyphenyl)-carbaldiminato-silacyclobutane","","- C14 H14 N2 O Si -","- C14 H14 N2 O Si -","- C112 H112 N16 O8 Si8 -","8","2","","Gerlach, Daniela; Brendler, Erica; Heine, Thomas; Wagler, Jörg","Dianion of Pyrrole-2-N-(o-hydroxyphenyl)carbaldimine as an Interesting Tridentate (ONN) Ligand System in Hypercoordinate Silicon Complexes","Organometallics","2007","26","1","234","","10.1021/om060869b","","","0.71073","MoKα","","0.0479","0.0378","","","0.0983","0.1029","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072605","9.3085","0.0003","16.5473","0.0007","20.5981","0.0009","90","","99.077","0.001","90","","3133","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Pyrrole-2-N-(o-oxyphenyl)-carbaldiminato-methylphenylsilane","","- C18 H16 N2 O Si -","- C18 H16 N2 O Si -","- C144 H128 N16 O8 Si8 -","8","2","","Gerlach, Daniela; Brendler, Erica; Heine, Thomas; Wagler, Jörg","Dianion of Pyrrole-2-N-(o-hydroxyphenyl)carbaldimine as an Interesting Tridentate (ONN) Ligand System in Hypercoordinate Silicon Complexes","Organometallics","2007","26","1","234","","10.1021/om060869b","","","0.71073","MoKα","","0.0637","0.0374","","","0.0978","0.1077","","","","","","1.045","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072606","8.0089","0.0017","12.711","0.003","21.766","0.004","90","","93.152","0.005","90","","2212.5","0.8","123.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H18 N6 Pt -","- C24 H18 N6 Pt -","- C96 H72 N24 Pt4 -","4","1","","Tsuchiya, Kazuhiro; Kondo, Hideo; Nagashima, Hideo","Ring Expansion of a Platinacyclopropane to a Platinacyclopentane by Double Insertion of Isocyanides into Pt−C Bonds","Organometallics","2007","26","4","1044","","10.1021/om0608713","","","0.7107","MoKα","","","0.0251","","","","0.0535","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072607","7.97","0.0013","12.27","0.0019","13.23","0.0019","60.1","0.009","77.1","0.011","79.42","0.012","1089.3","0.3","123.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H18 N6 Pd -","- C24 H18 N6 Pd -","- C48 H36 N12 Pd2 -","2","1","","Tsuchiya, Kazuhiro; Kondo, Hideo; Nagashima, Hideo","Ring Expansion of a Platinacyclopropane to a Platinacyclopentane by Double Insertion of Isocyanides into Pt−C Bonds","Organometallics","2007","26","4","1044","","10.1021/om0608713","","","0.7107","MoKα","","","0.026","","","","0.0768","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072608","7.9194","0.0015","12.358","0.002","12.986","0.002","60.307","0.007","77.067","0.008","79.767","0.009","1072.7","0.3","123.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H18 N6 Ni -","- C24 H18 N6 Ni -","- C48 H36 N12 Ni2 -","2","1","","Tsuchiya, Kazuhiro; Kondo, Hideo; Nagashima, Hideo","Ring Expansion of a Platinacyclopropane to a Platinacyclopentane by Double Insertion of Isocyanides into Pt−C Bonds","Organometallics","2007","26","4","1044","","10.1021/om0608713","","","0.7107","MoKα","","","0.0405","","","","0.1198","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072609","13.507","0.002","43.455","0.007","15.453","0.003","90","","114.322","0.0019","90","","8265","2","123.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H38 Cl2 N8 Pt -","- C43 H37 Cl2 N8 Pt -","- C344 H296 Cl16 N64 Pt8 -","8","2","","Tsuchiya, Kazuhiro; Kondo, Hideo; Nagashima, Hideo","Ring Expansion of a Platinacyclopropane to a Platinacyclopentane by Double Insertion of Isocyanides into Pt−C Bonds","Organometallics","2007","26","4","1044","","10.1021/om0608713","","","0.7107","MoKα","","","0.0602","","","","0.1577","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072610","12.82","0.003","14.237","0.003","21.049","0.004","90","","100.52","0.03","90","","3777.3","1.4","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H26 B F15 Si Zr -","- C41 H26 B F15 Si Zr -","- C164 H104 B4 F60 Si4 Zr4 -","4","1","","Beweries, Torsten; Bach, Marc A.; Burlakov, Vladimir V.; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Synthesis ofansa-Dimethylsilanediyl−dicyclopentadienyl− zirconacyclopent-3-yne, Me2Si(η5-C5H4)2Zr(η4-H2C4H2), and Its Reactions with Ni(0) and B(C6F5)3†","Organometallics","2007","26","1","241","","10.1021/om0608760","","","0.71073","MoKα","","0.0365","0.0282","","","0.0695","0.0717","","","","","","0.981","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072611","10.983","0.002","15.046","0.003","16.135","0.003","66.34","0.03","83.28","0.03","81.07","0.03","2408.2","1","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H56 Ni O P2 Si Zr -","- C56 H56 Ni O P2 Si Zr -","- C112 H112 Ni2 O2 P4 Si2 Zr2 -","2","1","","Beweries, Torsten; Bach, Marc A.; Burlakov, Vladimir V.; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Synthesis ofansa-Dimethylsilanediyl−dicyclopentadienyl− zirconacyclopent-3-yne, Me2Si(η5-C5H4)2Zr(η4-H2C4H2), and Its Reactions with Ni(0) and B(C6F5)3†","Organometallics","2007","26","1","241","","10.1021/om0608760","","","0.71073","MoKα","","0.0454","0.0269","","","0.0542","0.0564","","","","","","0.835","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072612","20.4537","0.001","6.9281","0.0004","21.02","0.0011","90","","94.416","0.004","90","","2969.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H18 Si Zr -","- C16 H18 Si Zr -","- C128 H144 Si8 Zr8 -","8","2","","Beweries, Torsten; Bach, Marc A.; Burlakov, Vladimir V.; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Synthesis ofansa-Dimethylsilanediyl−dicyclopentadienyl− zirconacyclopent-3-yne, Me2Si(η5-C5H4)2Zr(η4-H2C4H2), and Its Reactions with Ni(0) and B(C6F5)3†","Organometallics","2007","26","1","241","","10.1021/om0608760","","","0.71073","MoKα","","0.0533","0.0332","","","0.0731","0.0772","","","","","","1.004","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072613","11.0238","0.0003","12.638","0.0003","15.7638","0.0004","80.211","0.001","76.93","0.002","68.384","0.001","1979.71","0.09","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C88 H106 Na2 O8 Zn2 -","- C88 H106 Na2 O8 Zn2 -","- C88 H106 Na2 O8 Zn2 -","1","0.5","","Baillie, Sharon E.; Hevia, Eva; Kennedy, Alan R.; Mulvey, Robert E.","Synthesis of Mixed Alkali-Metal−Zinc Enolate Complexes Derived from 2,4,6-Trimethylacetophenone: New Inverse Crown Structures","Organometallics","2007","26","1","204","","10.1021/om060878k","","","0.71073","MoKα","","0.063","0.0395","","","0.0828","0.0917","","","","","","1.02","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072614","11.0836","0.0002","20.0998","0.0003","16.3947","0.0003","90","","101.59","0.001","90","","3577.91","0.11","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C80 H94 K2 O6 Zn2 -","- C80 H94 K2 O6 Zn2 -","- C160 H188 K4 O12 Zn4 -","2","0.5","","Baillie, Sharon E.; Hevia, Eva; Kennedy, Alan R.; Mulvey, Robert E.","Synthesis of Mixed Alkali-Metal−Zinc Enolate Complexes Derived from 2,4,6-Trimethylacetophenone: New Inverse Crown Structures","Organometallics","2007","26","1","204","","10.1021/om060878k","","","0.71073","MoKα","","0.0569","0.0344","","","0.0721","0.0801","","","","","","1.017","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072615","19.59","0.003","20.71","0.003","7.1575","0.001","90","","94.768","0.003","90","","2893.8","0.7","123","2","123","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C30 H38 Br3 N4 O -","- C30 H31 Br3 N4 O -","- C120 H124 Br12 N16 O4 -","4","0.5","","Hahn, F. Ekkehardt; Jahnke, Mareike C.; Pape, Tania","Synthesis of Pincer-Type Bis(benzimidazolin-2-ylidene) Palladium Complexes and Their Application in C−C Coupling Reactions","Organometallics","2007","26","1","150","","10.1021/om060882w","","","0.71073","MoKα","","0.0486","0.0374","","","0.085","0.0886","","","","","","1.057","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072616","8.683","0.0001","10.7218","0.0002","15.8253","0.0003","102.434","0.001","94.273","0.001","113.397","0.001","1299.22","0.04","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H33 Br N4 Pd -","- C30 H33 Br N4 Pd -","- C60 H66 Br2 N8 Pd2 -","2","1","","Hahn, F. Ekkehardt; Jahnke, Mareike C.; Pape, Tania","Synthesis of Pincer-Type Bis(benzimidazolin-2-ylidene) Palladium Complexes and Their Application in C−C Coupling Reactions","Organometallics","2007","26","1","150","","10.1021/om060882w","","","1.54178","CuKα","","0.0512","0.0462","","","0.12","0.1221","","","","","","0.999","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072617","5.5666","0.0005","9.0518","0.0007","61.911","0.006","90","","90","","90","","3119.6","0.5","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2,2-Dimethyl-4-phenyl-5-phenylselenyl-2H-imidazole-1-oxide","","- C17 H16 N2 O Se -","- C17 H16 N2 O Se -","- C136 H128 N16 O8 Se8 -","8","2","","Voinov, Maxim A.; Shevelev, Tikhon G.; Rybalova, Tatyana V.; Gatilov, Yury V.; Pervukhina, Natalie V.; Burdukov, Aleksei B.; Grigor'ev, Igor A.","α-Organoelement Nitrones: Synthesis, Properties, and IR and13C NMR Spectral and X-ray Structural Characterization†","Organometallics","2007","26","7","1607","","10.1021/om060883o","","","0.71073","MoKα","","0.0458","0.0416","","","0.1119","0.117","","","","","","1.059","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072618","14.5205","0.001","14.5205","0.001","12.3875","0.0011","90","","90","","90","","2611.8","0.3","296","2","296","2","","","","","","","","6","I -4","I -4","82","","1,2,2,5,5-Pentamethyl-4-chloromercurio-2,5-dihydro-1H-imidazole-3-oxide","","- C8.5 H17 Cl Hg N2 O1.5 -","- C8.5 H15 Cl Hg N2 O1.5 -","- C68 H120 Cl8 Hg8 N16 O12 -","8","1","","Voinov, Maxim A.; Shevelev, Tikhon G.; Rybalova, Tatyana V.; Gatilov, Yury V.; Pervukhina, Natalie V.; Burdukov, Aleksei B.; Grigor'ev, Igor A.","α-Organoelement Nitrones: Synthesis, Properties, and IR and13C NMR Spectral and X-ray Structural Characterization†","Organometallics","2007","26","7","1607","","10.1021/om060883o","","","0.71073","MoKα","","0.049","0.04","","","0.0934","0.0987","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072619","12.4029","0.0008","8.9187","0.0005","17.7928","0.0012","90","","90.994","0.006","90","","1967.9","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,2,2,5,5-Pentamethyl-4-diphenylphosphinoyl-2,5-dihydro-1H- imidazole-3-oxide","","- C20 H25 N2 O2 P -","- C20 H25 N2 O2 P -","- C80 H100 N8 O8 P4 -","4","1","","Voinov, Maxim A.; Shevelev, Tikhon G.; Rybalova, Tatyana V.; Gatilov, Yury V.; Pervukhina, Natalie V.; Burdukov, Aleksei B.; Grigor'ev, Igor A.","α-Organoelement Nitrones: Synthesis, Properties, and IR and13C NMR Spectral and X-ray Structural Characterization†","Organometallics","2007","26","7","1607","","10.1021/om060883o","","","0.71073","MoKα","","0.065","0.0456","","","0.1104","0.123","","","","","","1.021","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072620","23.007","0.002","6.267","0.0006","10.0814","0.0012","90","","90","","90","","1453.6","0.3","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","1,2,2,5,5-Pentamethyl-4-phenylselenyl-2,5-dihydro-1H-imidazole-3-oxide","","- C14 H20 N2 O Se -","- C14 H20 N2 O Se -","- C56 H80 N8 O4 Se4 -","4","1","","Voinov, Maxim A.; Shevelev, Tikhon G.; Rybalova, Tatyana V.; Gatilov, Yury V.; Pervukhina, Natalie V.; Burdukov, Aleksei B.; Grigor'ev, Igor A.","α-Organoelement Nitrones: Synthesis, Properties, and IR and13C NMR Spectral and X-ray Structural Characterization†","Organometallics","2007","26","7","1607","","10.1021/om060883o","","","0.71073","MoKα","","0.0358","0.0316","","","0.0807","0.0838","","","","","","1.128","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072621","6.0014","0.0006","12.5451","0.0013","23.887","0.003","90","","90","","90","","1798.4","0.3","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","5-Diphenylphosphanyl-2,2,4,4-tetramethyl-3,4-dihydro-2H-pyrrole 1-oxide","","- C20 H24 N O P -","- C20 H24 N O P -","- C80 H96 N4 O4 P4 -","4","1","","Voinov, Maxim A.; Shevelev, Tikhon G.; Rybalova, Tatyana V.; Gatilov, Yury V.; Pervukhina, Natalie V.; Burdukov, Aleksei B.; Grigor'ev, Igor A.","α-Organoelement Nitrones: Synthesis, Properties, and IR and13C NMR Spectral and X-ray Structural Characterization†","Organometallics","2007","26","7","1607","","10.1021/om060883o","","","0.71073","MoKα","","0.0574","0.0455","","","0.1136","0.1243","","","","","","1.062","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072622","6.5914","0.0009","27.895","0.004","8.8022","0.0012","90","","92.128","0.015","90","","1617.3","0.4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,2,4,4-Tetramethyl-5-(toluene-4-sulfonyl)-3,4-dihydro-2H-pyrrole 1-oxide","","- C15 H21 N O3 S -","- C15 H21 N O3 S -","- C60 H84 N4 O12 S4 -","4","1","","Voinov, Maxim A.; Shevelev, Tikhon G.; Rybalova, Tatyana V.; Gatilov, Yury V.; Pervukhina, Natalie V.; Burdukov, Aleksei B.; Grigor'ev, Igor A.","α-Organoelement Nitrones: Synthesis, Properties, and IR and13C NMR Spectral and X-ray Structural Characterization†","Organometallics","2007","26","7","1607","","10.1021/om060883o","","","0.71073","MoKα","","0.0593","0.0494","","","0.1346","0.1436","","","","","","1.047","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072623","11.862","0.004","11.552","0.003","13.875","0.005","90","","102.19","0.03","90","","1858.4","1.1","294","2","294","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Bis-(2,2,4,4-tetramethyl-3,4-dihydro-2H-pyrrole-1-oxide-5-yl)-mercurio","","- C16 H28 Hg N2 O2 -","- C16 H28 Hg N2 O2 -","- C64 H112 Hg4 N8 O8 -","4","2","","Voinov, Maxim A.; Shevelev, Tikhon G.; Rybalova, Tatyana V.; Gatilov, Yury V.; Pervukhina, Natalie V.; Burdukov, Aleksei B.; Grigor'ev, Igor A.","α-Organoelement Nitrones: Synthesis, Properties, and IR and13C NMR Spectral and X-ray Structural Characterization†","Organometallics","2007","26","7","1607","","10.1021/om060883o","","","0.71073","MoKα","","0.0619","0.0574","","","0.1642","0.1679","","","","","","1.095","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072624","12.326","0.002","16.382","0.001","18.107","0.002","90","","101.87","0.01","90","","3578.1","0.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H27 Cu F12 N2 O7 P -","- C29 H27 Cu F12 N2 O7 P -","- C116 H108 Cu4 F48 N8 O28 P4 -","4","1","","Voinov, Maxim A.; Shevelev, Tikhon G.; Rybalova, Tatyana V.; Gatilov, Yury V.; Pervukhina, Natalie V.; Burdukov, Aleksei B.; Grigor'ev, Igor A.","α-Organoelement Nitrones: Synthesis, Properties, and IR and13C NMR Spectral and X-ray Structural Characterization†","Organometallics","2007","26","7","1607","","10.1021/om060883o","","","0.71069","MoKα","","0.0808","0.0484","","","0.1129","0.1215","","","","","","0.807","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072625","10.9117","0.0006","12.6771","0.0007","19.9643","0.001","90","","90","","90","","2761.6","0.3","295","2","295","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C27 H36 Au Br N2 -","- C27 H36 Au Br N2 -","- C108 H144 Au4 Br4 N8 -","4","0.5","","de Frémont, Pierre; Singh, Rohit; Stevens, Edwin D.; Petersen, Jeffrey L.; Nolan, Steven P.","Synthesis, Characterization and Reactivity ofN-Heterocyclic Carbene Gold(III) Complexes","Organometallics","2007","26","6","1376","","10.1021/om060887t","","","0.71073","MoKα","","0.0552","0.0321","","","0.0758","0.087","","","","","","1.014","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072626","16.95","0.002","19.403","0.003","20.417","0.003","90","","110.421","0.003","90","","6292.8","1.5","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27.5 H37 Au Br3 Cl N2 -","- C27.5 H37 Au Br3 Cl N2 -","- C220 H296 Au8 Br24 Cl8 N16 -","8","2","","de Frémont, Pierre; Singh, Rohit; Stevens, Edwin D.; Petersen, Jeffrey L.; Nolan, Steven P.","Synthesis, Characterization and Reactivity ofN-Heterocyclic Carbene Gold(III) Complexes","Organometallics","2007","26","6","1376","","10.1021/om060887t","","","0.71073","MoKα","","0.082","0.0495","","","0.0967","0.1283","","","","","","1.073","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072627","10.677","0.002","16.593","0.004","19.306","0.004","90","","99.664","0.004","90","","3371.8","1.2","568","2","568","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H40 Au Br3 Cl2 N2 -","- C28 H40 Au Br3 Cl2 N2 -","- C112 H160 Au4 Br12 Cl8 N8 -","4","1","","de Frémont, Pierre; Singh, Rohit; Stevens, Edwin D.; Petersen, Jeffrey L.; Nolan, Steven P.","Synthesis, Characterization and Reactivity ofN-Heterocyclic Carbene Gold(III) Complexes","Organometallics","2007","26","6","1376","","10.1021/om060887t","","","0.71073","MoKα","","0.0691","0.0589","","","0.0992","0.1069","","","","","","1.097","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072628","8.7226","0.0008","16.047","0.0015","19.7576","0.0018","90","","95.611","0.002","90","","2752.3","0.4","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21.5 H27.01 Au Br3 Cl1.01 N2 -","- C21.53 H27.06 Au Br3 Cl1.06 N2 -","- C86.12 H108.24 Au4 Br12 Cl4.24 N8 -","4","1","","de Frémont, Pierre; Singh, Rohit; Stevens, Edwin D.; Petersen, Jeffrey L.; Nolan, Steven P.","Synthesis, Characterization and Reactivity ofN-Heterocyclic Carbene Gold(III) Complexes","Organometallics","2007","26","6","1376","","10.1021/om060887t","","","0.71073","MoKα","","0.0571","0.049","","","0.1291","0.1332","","","","","","1.095","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072629","10.6845","0.0006","14.2833","0.0008","15.7115","0.0009","90","","90","","90","","2397.7","0.2","568","2","568","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H24 Au Br3 N2 -","- C21 H24 Au Br3 N2 -","- C84 H96 Au4 Br12 N8 -","4","1","","de Frémont, Pierre; Singh, Rohit; Stevens, Edwin D.; Petersen, Jeffrey L.; Nolan, Steven P.","Synthesis, Characterization and Reactivity ofN-Heterocyclic Carbene Gold(III) Complexes","Organometallics","2007","26","6","1376","","10.1021/om060887t","","","0.71073","MoKα","","0.0352","0.03","","","0.0701","0.0724","","","","","","1.092","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072630","15.0878","0.0009","19.9495","0.0013","14.6881","0.0009","90","","90","","90","","4421","0.5","568","2","568","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C15.5 H25 Au Br3 Cl N2 -","- C15.5 H25 Au Br3 Cl N2 -","- C124 H200 Au8 Br24 Cl8 N16 -","8","1","","de Frémont, Pierre; Singh, Rohit; Stevens, Edwin D.; Petersen, Jeffrey L.; Nolan, Steven P.","Synthesis, Characterization and Reactivity ofN-Heterocyclic Carbene Gold(III) Complexes","Organometallics","2007","26","6","1376","","10.1021/om060887t","","","0.71073","MoKα","","0.0514","0.0438","","","0.1339","0.1359","","","","","","1.077","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072631","16.4445","0.0016","11.1131","0.001","12.9782","0.0012","90","","90.044","0.002","90","","2371.8","0.4","568","2","568","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H32 Au Br3 N2 -","- C23 H32 Au Br3 N2 -","- C92 H128 Au4 Br12 N8 -","4","1","","de Frémont, Pierre; Singh, Rohit; Stevens, Edwin D.; Petersen, Jeffrey L.; Nolan, Steven P.","Synthesis, Characterization and Reactivity ofN-Heterocyclic Carbene Gold(III) Complexes","Organometallics","2007","26","6","1376","","10.1021/om060887t","","","0.71073","MoKα","","0.0391","0.0295","","","0.0725","0.0769","","","","","","1.062","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072632","9.2947","0.0005","15.3944","0.0008","12.1528","0.0007","90","","96.746","0.001","90","","1726.86","0.16","571","2","571","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H20 Au Br3 N2 -","- C11 H20 Au Br3 N2 -","- C44 H80 Au4 Br12 N8 -","4","1","","de Frémont, Pierre; Singh, Rohit; Stevens, Edwin D.; Petersen, Jeffrey L.; Nolan, Steven P.","Synthesis, Characterization and Reactivity ofN-Heterocyclic Carbene Gold(III) Complexes","Organometallics","2007","26","6","1376","","10.1021/om060887t","","","0.71073","MoKα","","0.0331","0.0259","","","0.0548","0.0575","","","","","","1.026","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072633","9.7315","0.0001","9.8696","0.0002","17.2896","0.0005","96.0096","0.0011","91.8165","0.0015","92.1069","0.0015","1649.3","0.06","200","","200","","","","","","","","?","5","P -1","-P 1","2","","","","- C38 H30 O4 P2 Ru -","- C38 H30 O4 P2 Ru -","- C76 H60 O8 P4 Ru2 -","2","1","","Hill, Anthony F.; Rae, A. David; Schultz, Madeleine; Willis, Anthony C.","Bis(alkynyl), Metallacyclopentadiene, and Diphenylbutadiyne Complexes of Ruthenium","Organometallics","2007","26","6","1325","","10.1021/om060888l","","","0.71073","MoKα","","0.0485","0.029","","0.0317","0.0285","0.0285","","","","","","1.1076","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072634","17.3068","0.001","13.2544","0.0008","8.1088","0.0005","90","","90","","90","","1860.09","0.19","105","","105","","","","","","","","","4","P n n a","-P 2a 2bc","52","","","","- C20 H18 F6 N2 -","- C20 H18 F6 N2 -","- C80 H72 F24 N8 -","4","0.5","","Lersch, Martin; Krivokapic, Alexander; Tilset, Mats","Synthesis and Structural Characterization of a Fluorinated α-Diimine Platinum(II) Complex","Organometallics","2007","26","7","1581","","10.1021/om060897u","","","0.71073","MoKα","","0.0682","0.0441","","0.0736","0.0482","0.0482","","","","","","1.1095","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072635","8.3808","0.0002","12.9274","0.0002","19.9372","0.0004","90","","100.822","0.001","90","","2121.62","0.07","105","","105","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 Cl2 F6 N2 Pt -","- C20 H18 Cl2 F6 N2 Pt -","- C80 H72 Cl8 F24 N8 Pt4 -","4","1","","Lersch, Martin; Krivokapic, Alexander; Tilset, Mats","Synthesis and Structural Characterization of a Fluorinated α-Diimine Platinum(II) Complex","Organometallics","2007","26","7","1581","","10.1021/om060897u","","","0.71073","MoKα","","0.0332","0.0229","","0.0395","0.0264","0.0264","","","","","","1.0891","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072636","7.1784","0.0012","18.192","0.003","18.014","0.003","90","","93.953","0.003","90","","2346.8","0.7","105","","105","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 Cl2 N2 O4 Pt -","- C22 H24 Cl2 N2 O4 Pt -","- C88 H96 Cl8 N8 O16 Pt4 -","4","1","","Lersch, Martin; Krivokapic, Alexander; Tilset, Mats","Synthesis and Structural Characterization of a Fluorinated α-Diimine Platinum(II) Complex","Organometallics","2007","26","7","1581","","10.1021/om060897u","","","0.71073","MoKα","","0.0238","0.0188","","0.0136","0.013","0.013","","","","","","1.0092","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072637","16.485","0.003","18.169","0.004","7.172","0.0014","90","","90","","90","","2148.1","0.7","105","","105","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C19 H22 Cl4 N2 Pt -","- C19 H22 Cl4 N2 Pt -","- C76 H88 Cl16 N8 Pt4 -","4","0.5","","Lersch, Martin; Krivokapic, Alexander; Tilset, Mats","Synthesis and Structural Characterization of a Fluorinated α-Diimine Platinum(II) Complex","Organometallics","2007","26","7","1581","","10.1021/om060897u","","","0.71073","MoKα","","0.02","0.0152","","0.0224","0.0174","0.0174","","","","","","1.0897","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072638","15.744","0.01","17.892","0.009","18.302","0.009","98.086","0.01","111.634","0.015","104.923","0.013","4469","4","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H115.74 Co6 O66.87 P8 -","- C39 H115.736 Co6 O66.868 P8 -","- C78 H231.472 Co12 O133.736 P16 -","2","1","","Schull, Terence L.; Henley, Leila; Deschamps, Jeffrey R.; Butcher, Ray J.; Maher, Dermot P.; Klug, Christopher A.; Swider-Lyons, Karen; Dressick, Walter J.; Bujoli, Bruno; Greenwood, Andrew E.; Congiardo, Laura K. Byington; Knight, D. Andrew","Organometallic Supramolecular Mixed-Valence Cobalt(I)/Cobalt(II) Aquo Complexes Stabilized with the Water-Soluble Phosphine Ligandp-TPPTP (p-triphenylphosphine triphosphonic acid)","Organometallics","2007","26","9","2272","","10.1021/om060898m","","","0.71073","MoKα","","0.1119","0.0568","","","0.1202","0.1401","","","","","","1.017","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4072639","31.6791","0.0018","22.1307","0.0018","29.632","0.002","90","","119.855","0.002","90","","18017","2","103","1","103","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H53 Co4 O35 P8 -","- C39 H53 Co4 O35 P8 -","- C312 H424 Co32 O280 P64 -","8","1","","Schull, Terence L.; Henley, Leila; Deschamps, Jeffrey R.; Butcher, Ray J.; Maher, Dermot P.; Klug, Christopher A.; Swider-Lyons, Karen; Dressick, Walter J.; Bujoli, Bruno; Greenwood, Andrew E.; Congiardo, Laura K. Byington; Knight, D. Andrew","Organometallic Supramolecular Mixed-Valence Cobalt(I)/Cobalt(II) Aquo Complexes Stabilized with the Water-Soluble Phosphine Ligandp-TPPTP (p-triphenylphosphine triphosphonic acid)","Organometallics","2007","26","9","2272","","10.1021/om060898m","","","0.71073","MoKα","","0.0737","0.0497","","","0.1309","0.1392","","","","","","0.999","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072640","15.0893","0.001","15.3831","0.0011","16.5555","0.0011","95.985","0.001","110.825","0.001","115.298","0.001","3094.5","0.4","292","2","292","2","","","","","","","","5","P -1","-P 1","2","","","","- C63 H57 Co O15 P6 -","- C63 H57 Co O15 P6 -","- C126 H114 Co2 O30 P12 -","2","1","","Schull, Terence L.; Henley, Leila; Deschamps, Jeffrey R.; Butcher, Ray J.; Maher, Dermot P.; Klug, Christopher A.; Swider-Lyons, Karen; Dressick, Walter J.; Bujoli, Bruno; Greenwood, Andrew E.; Congiardo, Laura K. Byington; Knight, D. Andrew","Organometallic Supramolecular Mixed-Valence Cobalt(I)/Cobalt(II) Aquo Complexes Stabilized with the Water-Soluble Phosphine Ligandp-TPPTP (p-triphenylphosphine triphosphonic acid)","Organometallics","2007","26","9","2272","","10.1021/om060898m","","","0.71073","MoKα","","0.067","0.0415","","","0.0988","0.1097","","","","","","1.017","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072641","14.404","0.005","13.017","0.003","13.027","0.004","90","","101.75","0.03","90","","2391.3","1.3","296.2","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C23 H30 Cl2 N2 O3 Ru -","- C23 H29 Cl2 N2 O3 Ru -","- C92 H116 Cl8 N8 O12 Ru4 -","4","1","","Himeda, Yuichiro; Onozawa-Komatsuzaki, Nobuko; Sugihara, Hideki; Kasuga, Kazuyuki","Simultaneous Tuning of Activity and Water Solubility of Complex Catalysts by Acid−Base Equilibrium of Ligands for Conversion of Carbon Dioxide","Organometallics","2007","26","3","702","","10.1021/om060899e","","","0.7107","MoKα","","","0.0332","","","","0.0572","","","","","","1.624","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072642","10.443","0.004","12.753","0.005","12.657","0.005","90","","106.366","0.006","90","","1617.4","1.1","93","2","93","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H46 Cl6 Cr2 N2 P4 -","- C18 H46 Cl6 Cr2 N2 P4 -","- C36 H92 Cl12 Cr4 N4 P8 -","2","0.5","","McGuinness, David S.; Overett, Matthew; Tooze, Robert P.; Blann, Kevin; Dixon, John T.; Slawin, Alexandra M. Z.","Ethylene Tri- and Tetramerization with Borate Cocatalysts: Effects on Activity, Selectivity, and Catalyst Degradation Pathways","Organometallics","2007","26","4","1108","","10.1021/om060906z","","","0.71073","MoKα","","0.061","0.0502","","","0.111","0.1178","","","","","","1.099","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072643","14.919","0.005","17.276","0.006","18.578","0.007","105.737","0.006","102.825","0.006","107.977","0.006","4132","3","198","2","198","2","","","","","","","","6","P -1","-P 1","2","","","","- C100 H98 K N6 O4 Ti2 -","- C100 H98 K N6 O4 Ti2 -","- C200 H196 K2 N12 O8 Ti4 -","2","1","","Nikiforov, Grigory B.; Crewdson, Patrick; Gambarotta, Sandro; Korobkov, Ilia; Budzelaar, Peter H. M.","Reduction of Titanium Supported by aσ-/π-Bonded Tripyrrole Ligand: Ligand C−N Bond Cleavage and Coordination of Olefin and Arene with an Inverse Sandwich Structure","Organometallics","2007","26","1","48","","10.1021/om060908j","","","0.71073","MoKα","","0.0986","0.0625","","","0.151","0.1707","","","","","","1.039","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072644","12.5","0.02","9.136","0.016","20.49","0.03","90","","101.51","0.03","90","","2293","6","200","2","200","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C56 H50 K N3 O2 Ti -","- C56 H50 K N3 O2 Ti -","- C112 H100 K2 N6 O4 Ti2 -","2","1","","Nikiforov, Grigory B.; Crewdson, Patrick; Gambarotta, Sandro; Korobkov, Ilia; Budzelaar, Peter H. M.","Reduction of Titanium Supported by aσ-/π-Bonded Tripyrrole Ligand: Ligand C−N Bond Cleavage and Coordination of Olefin and Arene with an Inverse Sandwich Structure","Organometallics","2007","26","1","48","","10.1021/om060908j","","","0.71073","MoKα","","0.069","0.0527","","","0.1226","0.1322","","","","","","1.003","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072645","8.7267","0.001","9.918","0.0011","15.7027","0.0018","90","","90","","90","","1359.1","0.3","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H16 Cl2 O Ti -","- C13 H16 Cl2 O Ti -","- C52 H64 Cl8 O4 Ti4 -","4","1","","Buil, María L.; Esteruelas, Miguel A.; López, Ana M.; Mateo, A. Concepción; Oñate, Enrique","Preparation and X-ray Structures of Alkyl−Titanium(IV) Complexes Stabilized by Indenyl Ligands with a Pendant Ether or Amine Substituent and Their Use in the Catalytic Hydroamination of Alkynes","Organometallics","2007","26","3","554","","10.1021/om060909b","","","0.71073","MoKα","","0.0844","0.0614","","","0.1069","0.1139","","","","","","1.007","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072646","8.3491","0.0014","8.6636","0.0014","20.133","0.003","90","","90","","90","","1456.3","0.4","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H22 Cl N Ti -","- C15 H22 Cl N Ti -","- C60 H88 Cl4 N4 Ti4 -","4","1","","Buil, María L.; Esteruelas, Miguel A.; López, Ana M.; Mateo, A. Concepción; Oñate, Enrique","Preparation and X-ray Structures of Alkyl−Titanium(IV) Complexes Stabilized by Indenyl Ligands with a Pendant Ether or Amine Substituent and Their Use in the Catalytic Hydroamination of Alkynes","Organometallics","2007","26","3","554","","10.1021/om060909b","","","0.71073","MoKα","","0.0451","0.0343","","","0.0562","0.0584","","","","","","0.904","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072647","8.5922","0.001","11.9683","0.0014","14.5344","0.0016","90","","90","","90","","1494.6","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H25 N Ti -","- C16 H25 N Ti -","- C64 H100 N4 Ti4 -","4","1","","Buil, María L.; Esteruelas, Miguel A.; López, Ana M.; Mateo, A. Concepción; Oñate, Enrique","Preparation and X-ray Structures of Alkyl−Titanium(IV) Complexes Stabilized by Indenyl Ligands with a Pendant Ether or Amine Substituent and Their Use in the Catalytic Hydroamination of Alkynes","Organometallics","2007","26","3","554","","10.1021/om060909b","","","0.71073","MoKα","","0.0515","0.0371","","","0.072","0.0748","","","","","","0.882","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072648","16.511","0.004","8.266","0.002","16.101","0.004","90","","106.441","0.004","90","","2107.6","0.9","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H26 Cl2 P2 Pt -","- C20 H26 Cl2 P2 Pt -","- C80 H104 Cl8 P8 Pt4 -","4","0.5","","Baber, R. Angharad; Haddow, Mairi F.; Middleton, Ann J.; Orpen, A. Guy; Pringle, Paul G.; Haynes, Anthony; Williams, Gary L.; Papp, Rainer","Ligand Stereoelectronic Effects in Complexes of Phospholanes, Phosphinanes, and Phosphepanes and Their Implications for Hydroformylation Catalysis","Organometallics","2007","26","3","713","","10.1021/om060912v","","","0.71073","MoKα","","0.0273","0.0232","","","0.0487","0.0496","","","","","","1.017","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072649","17.157","0.002","9.1406","0.001","14.2928","0.0013","90","","90","","90","","2241.5","0.4","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C22 H30 Cl2 P2 Pt -","- C22 H30 Cl2 P2 Pt -","- C88 H120 Cl8 P8 Pt4 -","4","1","","Baber, R. Angharad; Haddow, Mairi F.; Middleton, Ann J.; Orpen, A. Guy; Pringle, Paul G.; Haynes, Anthony; Williams, Gary L.; Papp, Rainer","Ligand Stereoelectronic Effects in Complexes of Phospholanes, Phosphinanes, and Phosphepanes and Their Implications for Hydroformylation Catalysis","Organometallics","2007","26","3","713","","10.1021/om060912v","","","0.71073","MoKα","","0.0219","0.0203","","","0.0446","0.0452","","","","","","0.865","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072650","20.282","0.005","10.717","0.002","11.804","0.003","90","","109.229","0.004","90","","2422.6","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H34 Cl2 P2 Pt -","- C24 H34 Cl2 P2 Pt -","- C96 H136 Cl8 P8 Pt4 -","4","0.5","","Baber, R. Angharad; Haddow, Mairi F.; Middleton, Ann J.; Orpen, A. Guy; Pringle, Paul G.; Haynes, Anthony; Williams, Gary L.; Papp, Rainer","Ligand Stereoelectronic Effects in Complexes of Phospholanes, Phosphinanes, and Phosphepanes and Their Implications for Hydroformylation Catalysis","Organometallics","2007","26","3","713","","10.1021/om060912v","","","0.71073","MoKα","","0.0365","0.0329","","","0.0783","0.0799","","","","","","1.061","","","","has coordinates","176663","2020-10-21","18:00:00",""
"4072651","22.4","0.005","27.229","0.005","15.047","0.003","90","","90","","90","","9178","3","173","2","173","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C18 H38 Cl2 P2 Pt -","- C18 H38 Cl2 P2 Pt -","- C288 H608 Cl32 P32 Pt16 -","16","1","","Baber, R. Angharad; Haddow, Mairi F.; Middleton, Ann J.; Orpen, A. Guy; Pringle, Paul G.; Haynes, Anthony; Williams, Gary L.; Papp, Rainer","Ligand Stereoelectronic Effects in Complexes of Phospholanes, Phosphinanes, and Phosphepanes and Their Implications for Hydroformylation Catalysis","Organometallics","2007","26","3","713","","10.1021/om060912v","","","0.71073","MoKα","","0.0407","0.0261","","","0.0462","0.0506","","","","","","0.899","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072652","9.0392","0.0006","13.0671","0.0008","9.4358","0.0006","90","","97.346","0.001","90","","1105.37","0.12","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H38 Cl2 P2 Pt -","- C18 H38 Cl2 P2 Pt -","- C36 H76 Cl4 P4 Pt2 -","2","0.5","","Baber, R. Angharad; Haddow, Mairi F.; Middleton, Ann J.; Orpen, A. Guy; Pringle, Paul G.; Haynes, Anthony; Williams, Gary L.; Papp, Rainer","Ligand Stereoelectronic Effects in Complexes of Phospholanes, Phosphinanes, and Phosphepanes and Their Implications for Hydroformylation Catalysis","Organometallics","2007","26","3","713","","10.1021/om060912v","","","0.71073","MoKα","","0.0192","0.0148","","","0.0358","0.0375","","","","","","1.055","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072653","9.1251","0.001","16.8748","0.0018","33.956","0.004","90","","90","","90","","5228.7","1","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H34 I2 P2 Pt -","- C24 H34 I2 P2 Pt -","- C192 H272 I16 P16 Pt8 -","8","1","","Baber, R. Angharad; Haddow, Mairi F.; Middleton, Ann J.; Orpen, A. Guy; Pringle, Paul G.; Haynes, Anthony; Williams, Gary L.; Papp, Rainer","Ligand Stereoelectronic Effects in Complexes of Phospholanes, Phosphinanes, and Phosphepanes and Their Implications for Hydroformylation Catalysis","Organometallics","2007","26","3","713","","10.1021/om060912v","","","0.71073","MoKα","","0.0669","0.0446","","","0.0924","0.1007","","","","","","1.105","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072654","9.8155","0.0011","17.606","0.002","12.2382","0.0014","90","","90","","90","","2114.9","0.4","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C21 H26 Cl O P2 Rh -","- C21 H26 Cl O P2 Rh -","- C84 H104 Cl4 O4 P8 Rh4 -","4","0.5","","Baber, R. Angharad; Haddow, Mairi F.; Middleton, Ann J.; Orpen, A. Guy; Pringle, Paul G.; Haynes, Anthony; Williams, Gary L.; Papp, Rainer","Ligand Stereoelectronic Effects in Complexes of Phospholanes, Phosphinanes, and Phosphepanes and Their Implications for Hydroformylation Catalysis","Organometallics","2007","26","3","713","","10.1021/om060912v","","","0.71073","MoKα","","0.0377","0.0273","","","0.0754","0.0868","","","","","","0.665","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072655","7.6928","0.0006","8.0602","0.0007","8.9062","0.0007","89.406","0.001","88.992","0.001","68.205","0.001","512.68","0.07","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H34 Cl O P2 Rh -","- C17 H34 Cl O P2 Rh -","- C17 H34 Cl O P2 Rh -","1","0.5","","Baber, R. Angharad; Haddow, Mairi F.; Middleton, Ann J.; Orpen, A. Guy; Pringle, Paul G.; Haynes, Anthony; Williams, Gary L.; Papp, Rainer","Ligand Stereoelectronic Effects in Complexes of Phospholanes, Phosphinanes, and Phosphepanes and Their Implications for Hydroformylation Catalysis","Organometallics","2007","26","3","713","","10.1021/om060912v","","","0.71073","MoKα","","0.0371","0.0316","","","0.0767","0.0791","","","","","","1.056","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072656","9.093","0.0014","13.206","0.002","9.4945","0.0014","90","","97.722","0.002","90","","1129.8","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H38 Cl O P2 Rh -","- C19 H38 Cl O P2 Rh -","- C38 H76 Cl2 O2 P4 Rh2 -","2","0.5","","Baber, R. Angharad; Haddow, Mairi F.; Middleton, Ann J.; Orpen, A. Guy; Pringle, Paul G.; Haynes, Anthony; Williams, Gary L.; Papp, Rainer","Ligand Stereoelectronic Effects in Complexes of Phospholanes, Phosphinanes, and Phosphepanes and Their Implications for Hydroformylation Catalysis","Organometallics","2007","26","3","713","","10.1021/om060912v","","","0.71073","MoKα","","0.0285","0.0226","","","0.0453","0.0464","","","","","","1.332","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072657","8.5201","0.0017","12.871","0.003","11.488","0.002","90","","108.41","0.03","90","","1195.3","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H42 Cl O P2 Rh -","- C21 H42 Cl O P2 Rh -","- C42 H84 Cl2 O2 P4 Rh2 -","2","0.5","","Baber, R. Angharad; Haddow, Mairi F.; Middleton, Ann J.; Orpen, A. Guy; Pringle, Paul G.; Haynes, Anthony; Williams, Gary L.; Papp, Rainer","Ligand Stereoelectronic Effects in Complexes of Phospholanes, Phosphinanes, and Phosphepanes and Their Implications for Hydroformylation Catalysis","Organometallics","2007","26","3","713","","10.1021/om060912v","","","0.71073","MoKα","","0.0323","0.0264","","","0.0578","0.0592","","","","","","0.927","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072658","28.7133","0.0008","15.8253","0.0005","21.3589","0.0007","90","","107.398","0.002","90","","9261.4","0.5","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C91 H126 Cl4 N6 O4 Th2 -","- C91 H126 Cl4 N6 O4 Th2 -","- C364 H504 Cl16 N24 O16 Th8 -","4","0.5","","Cruz, Carlos A.; Emslie, David J. H.; Harrington, Laura E.; Britten, James F.; Robertson, Craig M.","Extremely Stable Thorium(IV) Dialkyl Complexes Supported by Rigid Tridentate 4,5-Bis(anilido)xanthene and 2,6-Bis(anilidomethyl)pyridine Ligands","Organometallics","2007","26","3","692","","10.1021/om060914f","","","0.71073","MoKα","","0.1714","0.0705","","","0.1545","0.1928","","","","","","1.003","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072659","16.6445","0.0005","22.5599","0.0007","16.8509","0.0005","90","","107.928","0.002","90","","6020.2","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H92 N2 O Si2 Th -","- C62 H92 N2 O Si2 Th -","- C248 H368 N8 O4 Si8 Th4 -","4","1","","Cruz, Carlos A.; Emslie, David J. H.; Harrington, Laura E.; Britten, James F.; Robertson, Craig M.","Extremely Stable Thorium(IV) Dialkyl Complexes Supported by Rigid Tridentate 4,5-Bis(anilido)xanthene and 2,6-Bis(anilidomethyl)pyridine Ligands","Organometallics","2007","26","3","692","","10.1021/om060914f","","","0.71073","MoKα","","0.1171","0.057","","","0.0894","0.1034","","","","","","1.002","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072660","14.901","0.015","17.895","0.017","21.354","0.016","90","","106.72","0.03","90","","5453","9","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C62 H82 N6 Th -","- C62 H82 N6 Th -","- C248 H328 N24 Th4 -","4","0.5","","Cruz, Carlos A.; Emslie, David J. H.; Harrington, Laura E.; Britten, James F.; Robertson, Craig M.","Extremely Stable Thorium(IV) Dialkyl Complexes Supported by Rigid Tridentate 4,5-Bis(anilido)xanthene and 2,6-Bis(anilidomethyl)pyridine Ligands","Organometallics","2007","26","3","692","","10.1021/om060914f","","","0.71073","MoKα","","0.0963","0.0702","","","0.114","0.1198","","","","","","1.235","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072661","12.35","0.0009","18.3598","0.0013","19.9189","0.0013","90","","101.883","0.003","90","","4419.7","0.5","297","2","297","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H60 N4 O3 Os2 Pd Si4 -","- C30 H60 N4 O3 Os2 Pd Si4 -","- C120 H240 N16 O12 Os8 Pd4 Si16 -","4","1","","Kiefer, Adam M.; Giles, John A.; Shapley, Patricia A.","Synthesis, Structure, and Reactivity of Organometallic Osmium(VI) Hydroxo Compounds","Organometallics","2007","26","8","1881","","10.1021/om060918k","","","0.71073","MoKα","","0.0624","0.0327","","","0.0641","0.0769","","","","","","1.02","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4072662","15.045","0.006","19.289","0.008","22.687","0.009","90","","90","","90","","6584","5","193","2","193","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H60 N2 O2 Os Si2 -","- C24 H60 N2 O2 Os Si2 -","- C192 H480 N16 O16 Os8 Si16 -","8","1","","Kiefer, Adam M.; Giles, John A.; Shapley, Patricia A.","Synthesis, Structure, and Reactivity of Organometallic Osmium(VI) Hydroxo Compounds","Organometallics","2007","26","8","1881","","10.1021/om060918k","","","0.71073","MoKα","","0.1715","0.0697","","","0.0983","0.1191","","","","","","0.993","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072663","6.1509","0.0003","13.5685","0.0006","13.3136","0.0006","90","","90","","90","","1111.13","0.09","198","2","198","2","","","","","","","","3","P b c m","-P 2c 2b","57","","","","- C10 H20 Os -","- C10 H20 Os -","- C40 H80 Os4 -","4","0.5","","Gross, Christopher L.; Girolami, Gregory S.","Synthesis and Characterization of Osmium Polyhydrides. X-ray Crystal Structures of (C5Me5)OsH5and (C5Me5)2Os2H4","Organometallics","2007","26","1","160","","10.1021/om060920b","","","0.71073","MoKα","","0.0342","0.027","","0.066","","0.0622","","","1.148","","","1.153","","","","has coordinates","209531","2020-10-21","18:00:00",""
"4072664","10.098","0.002","8.529","0.002","12.334","0.002","90","","108.72","0.03","90","","1006.1","0.4","198","2","198","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C20 H34 Os2 -","- C20 H34 Os2 -","- C40 H68 Os4 -","2","0.5","","Gross, Christopher L.; Girolami, Gregory S.","Synthesis and Characterization of Osmium Polyhydrides. X-ray Crystal Structures of (C5Me5)OsH5and (C5Me5)2Os2H4","Organometallics","2007","26","1","160","","10.1021/om060920b","","","0.71073","MoKα","","0.0297","0.0246","","","0.0599","0.0631","","","","","","1.077","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072665","9.6412","0.0008","9.6605","0.0008","11.047","0.001","95.998","0.001","108.821","0.001","91.092","0.001","967.04","0.14","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H19 Fe N S -","- C25 H19 Fe N S -","- C50 H38 Fe2 N2 S2 -","2","1","","Zhang, Wen-Wei; Yu, Yong-Guang; Lu, Zhen-Da; Mao, Wei-Li; Li, Yi-Zhi; Meng, Qing-Jin","Ferrocene−Phenothiazine Conjugated Molecules: Synthesis, Structural Characterization, Electronic Properties, and DFT-TDDFT Computational Study","Organometallics","2007","26","4","865","","10.1021/om060923o","","","0.71073","MoKα","","0.0325","0.0301","","","0.0891","0.0908","","","","","","1.053","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072666","19.672","0.002","7.5147","0.0008","20.205","0.002","90","","94.327","0.002","90","","2978.4","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H29 Fe2 N O S -","- C37 H29 Fe2 N O S -","- C148 H116 Fe8 N4 O4 S4 -","4","1","","Zhang, Wen-Wei; Yu, Yong-Guang; Lu, Zhen-Da; Mao, Wei-Li; Li, Yi-Zhi; Meng, Qing-Jin","Ferrocene−Phenothiazine Conjugated Molecules: Synthesis, Structural Characterization, Electronic Properties, and DFT-TDDFT Computational Study","Organometallics","2007","26","4","865","","10.1021/om060923o","","","0.71073","MoKα","","0.0871","0.0566","","","0.1164","0.1225","","","","","","0.964","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072667","25.0827","0.0009","25.0827","","7.83554","0.00024","90","","90","","120","","4269.2","0.2","100","","100","","","","","","","","laboratory preparation","4","R 3 c :H","R 3 -2""c","161","potassium carbazolate","potassium carbazolate","","- C12 H8 K N -","- C12 H8 K N -","- C216 H144 K18 N18 -","18","1","","Dinnebier, Robert; Esbak, Hoda; Olbrich, Falk; Behrens, Ulrich","Structure Determination of Unsolvated Potassium, Rubidium, and Cesium Carbazolates","Organometallics","2007","26","10","2604","","10.1021/om060927t","powder diffraction","x-ray","1.54056","CuKα","","","","","","","","0.09915","","0.9","","","","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072668","24.9084","0.0011","24.9084","","8.1932","0.0004","90","","90","","120","","4402.3","0.3","100","","100","","","","","","","","laboratory preparation","4","R 3 c :H","R 3 -2""c","161","rubidium carbazolate","rubidium carbazolate","","- C12 H8 N Rb -","- C12 H8 N Rb -","- C216 H144 N18 Rb18 -","18","1","","Dinnebier, Robert; Esbak, Hoda; Olbrich, Falk; Behrens, Ulrich","Structure Determination of Unsolvated Potassium, Rubidium, and Cesium Carbazolates","Organometallics","2007","26","10","2604","","10.1021/om060927t","powder diffraction","x-ray","1.54056","CuKα","","","","","","","","0.10108","","0.9","","","","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072669","15.39781","0.0003","12.73728","0.00029","11.38431","0.0002","90","","103.503","0.0013","90","","2171.04","0.08","100","","100","","","","","","","","laboratory preparation","4","I 1 a 1","I -2ya","9","cesium carbazolate","cesium carbazolate","","- C12 H8 Cs N -","- C12 H8 Cs N -","- C96 H64 Cs8 N8 -","8","2","","Dinnebier, Robert; Esbak, Hoda; Olbrich, Falk; Behrens, Ulrich","Structure Determination of Unsolvated Potassium, Rubidium, and Cesium Carbazolates","Organometallics","2007","26","10","2604","","10.1021/om060927t","powder diffraction","x-ray","1.54056","CuKα","","","","","","","","0.09551","","0.89","","","","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072670","19.918","0.004","13.65","0.002","20.532","0.004","90","","115.466","0.008","90","","5039.9","1.6","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C59 H71 B Ru3 -","- C59 H71 B Ru3 -","- C236 H284 B4 Ru12 -","4","1","","Takao, Toshiro; Moriya, Makoto; Suzuki, Hiroharu","Redox-Induced Reversible Rearrangement of a Dimetallaallyl Ligand on the Trinuclear Cluster of Ruthenium. Mechanistic Aspects of Formation of the Face-Capping μ3-C3Ring on the Triruthenium Plane","Organometallics","2007","26","6","1349","","10.1021/om060932x","","","0.71069","MoKα","","0.032","0.028","","","0.0702","0.0721","","","","","","1.03","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072671","11.9434","0.0002","16.1553","0.0003","22.2949","0.0003","90","","96.74","0.0006","90","","4272.05","0.12","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H53 Cl3 F12 P2 Ru3 -","- C36 H53 Cl3 F12 P2 Ru3 -","- C144 H212 Cl12 F48 P8 Ru12 -","4","1","","Takao, Toshiro; Moriya, Makoto; Suzuki, Hiroharu","Redox-Induced Reversible Rearrangement of a Dimetallaallyl Ligand on the Trinuclear Cluster of Ruthenium. Mechanistic Aspects of Formation of the Face-Capping μ3-C3Ring on the Triruthenium Plane","Organometallics","2007","26","6","1349","","10.1021/om060932x","","","0.71069","MoKα","","0.0393","0.0347","","","0.0851","0.0877","","","","","","1.04","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072672","16.5675","0.0001","17.3124","0.0002","35.4645","0.0003","90","","95.586","0.0004","90","","10123.7","0.16","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H71 B O Ru3 -","- C60 H71.5 B O Ru3 -","- C480 H572 B8 O8 Ru24 -","8","2","","Takao, Toshiro; Moriya, Makoto; Suzuki, Hiroharu","Redox-Induced Reversible Rearrangement of a Dimetallaallyl Ligand on the Trinuclear Cluster of Ruthenium. Mechanistic Aspects of Formation of the Face-Capping μ3-C3Ring on the Triruthenium Plane","Organometallics","2007","26","6","1349","","10.1021/om060932x","","","0.71069","MoKα","","0.0715","0.0452","","","0.0884","0.0975","","","","","","1.052","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072673","13.3529","0.0003","13.4802","0.0004","23.1921","0.0006","90","","90","","90","","4174.57","0.19","253","1","253","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C39 H54 Cl2 N4 Ru -","- C39 H54 Cl2 N4 Ru -","- C156 H216 Cl8 N16 Ru4 -","4","1","","Ledoux, Nele; Allaert, Bart; Linden, Anthony; Van Der Voort, Pascal; Verpoort, Francis","Bis-coordination ofN-(Alkyl)-N‘-(2,6-diisopropylphenyl) Heterocyclic Carbenes to Grubbs Catalysts","Organometallics","2007","26","4","1052","","10.1021/om060937u","","","0.71073","MoKα","","0.047","0.0384","","","0.0849","0.089","","","","","","1.136","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072674","20.3461","0.0002","15.7586","0.0002","15.6549","0.0002","90","","101.524","0.0008","90","","4918.18","0.1","160","1","160","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H72 Cl4 N4 Ru -","- C50 H72 Cl4 N4 Ru -","- C200 H288 Cl16 N16 Ru4 -","4","1","","Ledoux, Nele; Allaert, Bart; Linden, Anthony; Van Der Voort, Pascal; Verpoort, Francis","Bis-coordination ofN-(Alkyl)-N‘-(2,6-diisopropylphenyl) Heterocyclic Carbenes to Grubbs Catalysts","Organometallics","2007","26","4","1052","","10.1021/om060937u","","","0.71073","MoKα","","0.0767","0.0488","","","0.1147","0.1261","","","","","","1.111","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072675","10.734","0.0005","11.2427","0.0005","31.3159","0.0015","90","","90","","90","","3779.2","0.3","130","2","130","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C14 H24 F3 N O3 S Si -","- C14 H24 F3 N O3 S Si -","- C112 H192 F24 N8 O24 S8 Si8 -","8","1","","Hassall, Kathryn; Lobachevsky, Sofia; Schiesser, Carl H.; White, Jonathan M.","Carbon−Silicon Hyperconjugation and Strain-Enhanced Hyperconjugation: Structures ofN-Methyl 2- and 4-tert-Butyldimethylsilylmethyl Pyridinium Cations","Organometallics","2007","26","6","1361","","10.1021/om060939e","","","0.71073","MoKα","","0.0435","0.0396","","","0.1054","0.1078","","","","","","1.072","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4072676","8.147","0.005","10.658","0.005","13.759","0.005","77.278","0.005","76.152","0.005","70.892","0.005","1082.9","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(2-Me)C6H4CH2Co(dmgH)2Py","trans-bis(dimethylglyoximato)-ortho-methyl-benzyl-(pyridine)-cobalt(III)","","- C21 H28 Co N5 O4 -","- C21 H28 Co N5 O4 -","- C42 H56 Co2 N10 O8 -","2","1","","Mandal, Debaprasad; Gupta, B. D.","Hindered Rotation Leading to Nonequivalence in 2-Substituted Benzyl Cobaloximes: Structure−Property Relationship†","Organometallics","2007","26","3","658","","10.1021/om060940d","","","0.71073","MoKα","","0.1033","0.0547","","","0.1224","0.1361","","","","","","0.933","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072677","10.0739","0.0014","11.3738","0.0016","12.1513","0.0017","110.607","0.002","100.011","0.002","109.289","0.002","1161.8","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","2-napthyl-Co(dmgH)2Py","2-Napthyl-bis(dimethylglyoximeto)(pyridine)cobalt(III)","","- C24 H28 Co N5 O4 -","- C24 H28 Co N5 O4 -","- C48 H56 Co2 N10 O8 -","2","1","","Mandal, Debaprasad; Gupta, B. D.","Hindered Rotation Leading to Nonequivalence in 2-Substituted Benzyl Cobaloximes: Structure−Property Relationship†","Organometallics","2007","26","3","658","","10.1021/om060940d","","","0.71073","MoKα","","0.1147","0.0897","","","0.2085","0.2241","","","","","","1.04","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072678","10.532","0.0013","11.9152","0.0014","14.7834","0.0017","97.161","0.002","95.269","0.002","112.79","0.002","1677","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","PhCH2Co(dpgH)2Py","trans-bis(diphenylglyoximato)-benzyl-(pyridine)-cobalt(III)","","- C40 H34 Co N5 O4 -","- C40 H34 Co N5 O4 -","- C80 H68 Co2 N10 O8 -","2","1","","Mandal, Debaprasad; Gupta, B. D.","Hindered Rotation Leading to Nonequivalence in 2-Substituted Benzyl Cobaloximes: Structure−Property Relationship†","Organometallics","2007","26","3","658","","10.1021/om060940d","","","0.71073","MoKα","","0.1166","0.0789","","","0.1513","0.1889","","","","","","1.065","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072679","8.946","0.0015","26.515","0.0004","8.198","0.0013","90","","110.657","0.003","90","","1819.6","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","2-Br-C6H4CH2-Co(gH)2Py","trans-bis(glyoximato)-2-bromo-benzyl-(pyridine)-cobalt(III)","","- C16 H17 Br Co N5 O4 -","- C16 H17 Br Co N5 O4 -","- C64 H68 Br4 Co4 N20 O16 -","4","1","","Mandal, Debaprasad; Gupta, B. D.","Hindered Rotation Leading to Nonequivalence in 2-Substituted Benzyl Cobaloximes: Structure−Property Relationship†","Organometallics","2007","26","3","658","","10.1021/om060940d","","","0.71073","MoKα","","0.0783","0.0533","","","0.132","0.1435","","","","","","1.053","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072680","12.4289","0.0008","21.2152","0.0014","19.9599","0.0013","90","","93.345","0.001","90","","5254.1","0.6","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C57 H75 N4 O3 Rh -","- C57 H75 N4 O3 Rh -","- C228 H300 N16 O12 Rh4 -","4","1","","Praetorius, Jeremy M.; Kotyk, Matthew W.; Webb, Jonathan D.; Wang, Ruiyao; Crudden, Cathleen M.","Rhodium N-Heterocyclic Carbene Carboxylato Complexes: Synthesis, Structure Determination, and Catalytic Activity in the Hydroformylation of Alkenes","Organometallics","2007","26","4","1057","","10.1021/om060942y","","","0.71073","MoKα","","0.0438","0.0314","","","0.0832","0.0894","","","","","","1","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072681","9.5386","0.0008","17.4011","0.0015","9.795","0.0009","90","","111.087","0.001","90","","1516.9","0.2","180","2","180","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C31 H39 N2 O4 Rh -","- C31 H39 N2 O4 Rh -","- C62 H78 N4 O8 Rh2 -","2","0.5","","Praetorius, Jeremy M.; Kotyk, Matthew W.; Webb, Jonathan D.; Wang, Ruiyao; Crudden, Cathleen M.","Rhodium N-Heterocyclic Carbene Carboxylato Complexes: Synthesis, Structure Determination, and Catalytic Activity in the Hydroformylation of Alkenes","Organometallics","2007","26","4","1057","","10.1021/om060942y","","","0.71073","MoKα","","0.0299","0.0277","","","0.0716","0.0729","","","","","","1","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072682","9.3708","0.001","10.1136","0.001","10.3753","0.0011","88.223","0.002","84.12","0.002","68.059","0.002","907.25","0.16","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H26 Au Cl N P -","- C17 H26 Au Cl N P -","- C34 H52 Au2 Cl2 N2 P2 -","2","1","","Wile, Bradley M.; McDonald, Robert; Ferguson, Michael J.; Stradiotto, Mark","Au(I) Complexes Supported by Donor-Functionalized Indene Ligands: Synthesis, Characterization, and Catalytic Behavior in Aldehyde Hydrosilylation","Organometallics","2007","26","4","1069","","10.1021/om060948n","","","0.71073","MoKα","","0.0465","0.0444","","","0.1361","0.1373","","","","","","1.222","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072683","15.625","0.002","7.3752","0.001","15.269","0.002","90","","118.454","0.002","90","","1547","0.4","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H21 Au Cl P -","- C15 H21 Au Cl P -","- C60 H84 Au4 Cl4 P4 -","4","1","","Wile, Bradley M.; McDonald, Robert; Ferguson, Michael J.; Stradiotto, Mark","Au(I) Complexes Supported by Donor-Functionalized Indene Ligands: Synthesis, Characterization, and Catalytic Behavior in Aldehyde Hydrosilylation","Organometallics","2007","26","4","1069","","10.1021/om060948n","","","0.71073","MoKα","","0.0233","0.0218","","","0.0555","0.0564","","","","","","1.117","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072684","9.0257","0.0005","20.3683","0.0011","16.1902","0.0009","90","","94.9747","0.0008","90","","2965.2","0.3","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H42 Au Cl P2 -","- C30 H42 Au Cl P2 -","- C120 H168 Au4 Cl4 P8 -","4","1","","Wile, Bradley M.; McDonald, Robert; Ferguson, Michael J.; Stradiotto, Mark","Au(I) Complexes Supported by Donor-Functionalized Indene Ligands: Synthesis, Characterization, and Catalytic Behavior in Aldehyde Hydrosilylation","Organometallics","2007","26","4","1069","","10.1021/om060948n","","","0.71073","MoKα","","0.0186","0.016","","","0.0395","0.0405","","","","","","1.049","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072685","26.567","0.002","9.2095","0.0008","13.1111","0.0012","90","","90","","90","","3207.9","0.5","193","2","193","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C31 H42 Au F3 O3 P2 S -","- C31 H42 Au F3 O3 P2 S -","- C124 H168 Au4 F12 O12 P8 S4 -","4","1","","Wile, Bradley M.; McDonald, Robert; Ferguson, Michael J.; Stradiotto, Mark","Au(I) Complexes Supported by Donor-Functionalized Indene Ligands: Synthesis, Characterization, and Catalytic Behavior in Aldehyde Hydrosilylation","Organometallics","2007","26","4","1069","","10.1021/om060948n","","","0.71073","MoKα","","0.0347","0.0268","","","0.0576","0.06","","","","","","1.074","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072686","15.3893","0.0004","11.8053","0.0003","14.9767","0.0004","90","","107.341","0.001","90","","2597.23","0.12","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H38 Cl N2 Rh -","- C29 H38 Cl N2 Rh -","- C116 H152 Cl4 N8 Rh4 -","4","1","","Blum, Angela P.; Ritter, Tobias; Grubbs, Robert H.","Synthesis of N-Heterocylic Carbene-Containing Metal Complexes from 2-(Pentafluorophenyl)imidazolidines","Organometallics","2007","26","8","2122","","10.1021/om060949f","","","0.71073","MoKα","","0.0687","0.049","","","0.1013","0.1034","","","","","","2.034","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4072687","7.7665","0.001","15.8822","0.0015","6.9241","0.0006","90","","91.663","0.01","90","","853.72","0.16","140","2","140","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 Cl N4 -","- C7 H7 Cl N4 -","- C28 H28 Cl4 N16 -","4","1","","Fei, Zhaofu; Zhao, Dongbin; Pieraccini, Daniela; Ang, Wee Han; Geldbach, Tilmann J.; Scopelliti, Rosario; Chiappe, Cinzia; Dyson, Paul J.","Development of Nitrile-Functionalized Ionic Liquids for C−C Coupling Reactions: Implication of Carbene and Nanoparticle Catalysts","Organometallics","2007","26","7","1588","","10.1021/om060950e","","","0.71073","MoKα","","0.1017","0.0961","","","0.2857","0.2953","","","","","","1.223","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072688","8.2759","0.0013","15.02","0.004","9.024","0.002","90","","104.332","0.017","90","","1086.8","0.4","140","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H7 F6 N4 P -","- C7 H7 F6 N4 P -","- C28 H28 F24 N16 P4 -","4","1","","Fei, Zhaofu; Zhao, Dongbin; Pieraccini, Daniela; Ang, Wee Han; Geldbach, Tilmann J.; Scopelliti, Rosario; Chiappe, Cinzia; Dyson, Paul J.","Development of Nitrile-Functionalized Ionic Liquids for C−C Coupling Reactions: Implication of Carbene and Nanoparticle Catalysts","Organometallics","2007","26","7","1588","","10.1021/om060950e","","","0.71073","MoKα","","0.0763","0.0713","","","0.1915","0.2037","","","","","","1.064","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4072689","5.575","0.0013","11.983","0.003","14.67","0.002","90","","98.534","0.016","90","","969.2","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 B2 F8 N8 -","- C14 H14 B2 F8 N8 -","- C28 H28 B4 F16 N16 -","2","0.5","","Fei, Zhaofu; Zhao, Dongbin; Pieraccini, Daniela; Ang, Wee Han; Geldbach, Tilmann J.; Scopelliti, Rosario; Chiappe, Cinzia; Dyson, Paul J.","Development of Nitrile-Functionalized Ionic Liquids for C−C Coupling Reactions: Implication of Carbene and Nanoparticle Catalysts","Organometallics","2007","26","7","1588","","10.1021/om060950e","","","0.71073","MoKα","","0.052","0.0462","","","0.1161","0.1221","","","","","","1.088","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072690","5.2806","0.0018","11.488","0.004","10.521","0.005","90","","98.96","0.03","90","","630.5","0.4","140","2","140","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C11 H15 Cl N4 -","- C11 H15 Cl N4 -","- C22 H30 Cl2 N8 -","2","1","","Fei, Zhaofu; Zhao, Dongbin; Pieraccini, Daniela; Ang, Wee Han; Geldbach, Tilmann J.; Scopelliti, Rosario; Chiappe, Cinzia; Dyson, Paul J.","Development of Nitrile-Functionalized Ionic Liquids for C−C Coupling Reactions: Implication of Carbene and Nanoparticle Catalysts","Organometallics","2007","26","7","1588","","10.1021/om060950e","","","0.71073","MoKα","","0.0896","0.0619","","","0.1264","0.1382","","","","","","0.902","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072691","8.2657","0.0008","8.9473","0.0006","10.602","0.001","105.391","0.008","93.605","0.008","94.706","0.007","750.48","0.12","140","2","140","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H15 F6 N4 P -","- C11 H15 F6 N4 P -","- C22 H30 F12 N8 P2 -","2","1","","Fei, Zhaofu; Zhao, Dongbin; Pieraccini, Daniela; Ang, Wee Han; Geldbach, Tilmann J.; Scopelliti, Rosario; Chiappe, Cinzia; Dyson, Paul J.","Development of Nitrile-Functionalized Ionic Liquids for C−C Coupling Reactions: Implication of Carbene and Nanoparticle Catalysts","Organometallics","2007","26","7","1588","","10.1021/om060950e","","","0.71073","MoKα","","0.0506","0.041","","","0.1094","0.1139","","","","","","1.086","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4072692","14.3813","0.0014","10.8029","0.0008","14.5861","0.0012","90","","100.679","0.013","90","","2226.8","0.3","140","2","140","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C16 H24 Cl4 N6 Pd -","- C16 H24 Cl4 N6 Pd -","- C64 H96 Cl16 N24 Pd4 -","4","0.5","","Fei, Zhaofu; Zhao, Dongbin; Pieraccini, Daniela; Ang, Wee Han; Geldbach, Tilmann J.; Scopelliti, Rosario; Chiappe, Cinzia; Dyson, Paul J.","Development of Nitrile-Functionalized Ionic Liquids for C−C Coupling Reactions: Implication of Carbene and Nanoparticle Catalysts","Organometallics","2007","26","7","1588","","10.1021/om060950e","","","0.71073","MoKα","","0.0322","0.0219","","","0.0474","0.0494","","","","","","0.985","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072693","8.3277","0.0004","11.3897","0.0008","13.1294","0.0009","90","","104.847","0.005","90","","1203.75","0.13","140","2","140","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 Cl4 N6 Pd -","- C18 H28 Cl4 N6 Pd -","- C36 H56 Cl8 N12 Pd2 -","2","0.5","","Fei, Zhaofu; Zhao, Dongbin; Pieraccini, Daniela; Ang, Wee Han; Geldbach, Tilmann J.; Scopelliti, Rosario; Chiappe, Cinzia; Dyson, Paul J.","Development of Nitrile-Functionalized Ionic Liquids for C−C Coupling Reactions: Implication of Carbene and Nanoparticle Catalysts","Organometallics","2007","26","7","1588","","10.1021/om060950e","","","0.71073","MoKα","","0.0254","0.023","","","0.0632","0.0642","","","","","","1.091","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072694","8.3363","0.0007","8.8898","0.0006","10.6673","0.0011","90.517","0.008","107.26","0.008","113.689","0.007","683.85","0.12","140","2","140","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H30 Cl4 N8 Pd -","- C22 H30 Cl4 N8 Pd -","- C22 H30 Cl4 N8 Pd -","1","0.5","","Fei, Zhaofu; Zhao, Dongbin; Pieraccini, Daniela; Ang, Wee Han; Geldbach, Tilmann J.; Scopelliti, Rosario; Chiappe, Cinzia; Dyson, Paul J.","Development of Nitrile-Functionalized Ionic Liquids for C−C Coupling Reactions: Implication of Carbene and Nanoparticle Catalysts","Organometallics","2007","26","7","1588","","10.1021/om060950e","","","0.71073","MoKα","","0.0276","0.0245","","","0.063","0.0641","","","","","","0.992","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072695","11.3577","0.0008","9.8994","0.0008","12.3556","0.001","90","","113.087","0.007","90","","1277.93","0.18","210","2","210","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H28 Cl2 N8 Pd -","- C22 H28 Cl2 N8 Pd -","- C44 H56 Cl4 N16 Pd2 -","2","0.5","","Fei, Zhaofu; Zhao, Dongbin; Pieraccini, Daniela; Ang, Wee Han; Geldbach, Tilmann J.; Scopelliti, Rosario; Chiappe, Cinzia; Dyson, Paul J.","Development of Nitrile-Functionalized Ionic Liquids for C−C Coupling Reactions: Implication of Carbene and Nanoparticle Catalysts","Organometallics","2007","26","7","1588","","10.1021/om060950e","","","0.71073","MoKα","","0.0299","0.0266","","","0.0674","0.0693","","","","","","1.084","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072696","8.6811","0.0006","15.1172","0.0014","16.2449","0.0016","73.095","0.003","85.004","0.003","77.59","0.004","1991.4","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C46 H55 D3 N3 -","- C46 H55 D3 N3 -","- C92 H110 D6 N6 -","2","1","","Cámpora, Juan; Pérez, Carmen M.; Rodríguez-Delgado, Antonio; Naz, A. Marcos; Palma, Pilar; Álvarez, Eleuterio","Selective Alkylation of 2,6-Diiminopyridine Ligands by Dialkylmanganese Reagents: A “One-Pot” Synthetic Methodology","Organometallics","2007","26","4","1104","","10.1021/om0609517","","","0.71073","MoKα","","0.1307","0.0691","","","0.182","0.2133","","","","","","1.03","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072697","5.832","0.003","5.833","0.003","19.326","0.004","84.71","0.01","84.73","0.01","80.61","0.01","643.9","0.5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","1-tert-Butylazo-1-[1,3]dithiolan-2-ylidene-propan-2-one","","- C10 H16 N2 O S2 -","- C10 H16 N2 O S2 -","- C20 H32 N4 O2 S4 -","2","1","","Ortega-Alfaro, M. Carmen; Alcantara, Olga; Orrala, Manuel; López-Cortés, José G.; Toscano, Ruben A.; Alvarez-Toledano, Cecilio","C−S Bond Activation of Two Novel Asymmetric α-azo-Ketenedithioacetals Using Fe2(CO)9","Organometallics","2007","26","8","1895","","10.1021/om060953r","","","0.71073","MoKα","","0.107","0.0697","","","0.15","0.1699","","","","","","1.025","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072698","10.926","0.001","7.197","0.001","26.184","0.002","90","","98.153","0.001","90","","2038.2","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","8-Acetyl-6,6,10,10,10-pentacarbonyl-7,8-diaza-6,10-diferra-2,5- dithiapentacycle[4.3.0.1^2,5^.0^1,10^.0^6,10^]decan-7,9-diene","","- C15 H16 Fe2 N2 O6 S2 -","- C15 H16 Fe2 N2 O6 S2 -","- C60 H64 Fe8 N8 O24 S8 -","4","1","","Ortega-Alfaro, M. Carmen; Alcantara, Olga; Orrala, Manuel; López-Cortés, José G.; Toscano, Ruben A.; Alvarez-Toledano, Cecilio","C−S Bond Activation of Two Novel Asymmetric α-azo-Ketenedithioacetals Using Fe2(CO)9","Organometallics","2007","26","8","1895","","10.1021/om060953r","","","0.71073","MoKα","","0.0575","0.046","","","0.1008","0.1064","","","","","","1.072","","","","has coordinates","178615","2020-10-21","18:00:00",""
"4072699","7.519","0.001","7.918","0.001","19.177","0.001","97.179","0.002","94.098","0.002","113.176","0.002","1032.2","0.2","298","2","294","2","","","","","","","","6","P -1","-P 1","2","","8-Methyl-6,6,10,10,10-pentacarbonyl-9-tert-butylhydrazono-6,10- diferra-7-oxa-2,5-dithiapentacycle[4.3.0.1^2,5^.0^1,10^.0^6,10^] decan-7,9-diene","","- C15 H16 Fe2 N2 O6 S2 -","- C15 H16 Fe2 N2 O6 S2 -","- C30 H32 Fe4 N4 O12 S4 -","2","1","","Ortega-Alfaro, M. Carmen; Alcantara, Olga; Orrala, Manuel; López-Cortés, José G.; Toscano, Ruben A.; Alvarez-Toledano, Cecilio","C−S Bond Activation of Two Novel Asymmetric α-azo-Ketenedithioacetals Using Fe2(CO)9","Organometallics","2007","26","8","1895","","10.1021/om060953r","","","0.71073","MoKα","","0.0667","0.0501","","","0.1087","0.1161","","","","","","1.059","","","","has coordinates,has disorder","178615","2020-10-21","18:00:00",""
"4072700","7.0547","0.0001","21.9532","0.0003","7.6005","0.0001","90","","109.554","0.0007","90","","1109.23","0.03","173","1","173","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H12 Cl3 N Ti -","- C8 H12 Cl3 N Ti -","- C32 H48 Cl12 N4 Ti4 -","4","1","","Tamm, Matthias; Kunst, Andreas; Stadler, Michael; Herdtweck, Eberhardt","Efficient Direct Synthesis of Tropidinyl Titanium and Zirconium Complexes by Allylic CH-Activation of 8-Methyl-8-azabicyclo[3.2.1]oct-2-ene (Tropidine)","Organometallics","2007","26","3","761","","10.1021/om0609564","","","0.71073","MoKα","","0.0295","0.026","","","0.0619","0.0634","","","","","","1.076","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072701","7.8258","0.0004","8.8461","0.0002","17.3835","0.0007","90","","90","","90","","1203.42","0.08","295","","295","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H11 Fe I O -","- C12 H11 Fe I O -","- C48 H44 Fe4 I4 O4 -","4","1","","Ferber, Benoit; Top, Siden; Herson, Patrick; Jaouen, Gérard","New Ortho-Directing Group for Lithiation: Use of a Methoxy−Imino Auxiliary for the Synthesis of Chiral Ortho-Substituted Acetyl- and Propionylferrocenes","Organometallics","2007","26","7","1686","","10.1021/om0609620","","","0.71073","MoKα","","0.0745","0.0448","","0.0536","0.0508","0.0508","","","","","","1.0514","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072702","9.4236","0.0011","46.204","0.005","15.8959","0.0018","90","","91.749","0.002","90","","6918","1.4","163","2","163","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C43 H44 B Yb -","- C43 H44 B Yb -","- C344 H352 B8 Yb8 -","8","2","","Evans, William J.; Champagne, Timothy M.; Ziller, Joseph W.","Synthesis and Reactivity of Mono(pentamethylcyclopentadienyl) Tetraphenylborate Lanthanide Complexes of Ytterbium and Samarium: Tris(ring) Precursors to (C5Me5)Ln Moieties","Organometallics","2007","26","5","1204","","10.1021/om060963s","","","0.71073","MoKα","","0.0497","0.0415","","","0.0813","0.0841","","","","","","1.281","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072703","17.081","0.003","9.9752","0.0017","18.816","0.003","90","","95.676","0.003","90","","3190.3","0.9","163","2","163","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H41 B Sm -","- C40 H41 B Sm -","- C160 H164 B4 Sm4 -","4","1","","Evans, William J.; Champagne, Timothy M.; Ziller, Joseph W.","Synthesis and Reactivity of Mono(pentamethylcyclopentadienyl) Tetraphenylborate Lanthanide Complexes of Ytterbium and Samarium: Tris(ring) Precursors to (C5Me5)Ln Moieties","Organometallics","2007","26","5","1204","","10.1021/om060963s","","","0.71073","MoKα","","0.0494","0.0326","","","0.078","0.0891","","","","","","1.073","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072704","13.4854","0.0015","16.123","0.0018","14.6003","0.0016","90","","101.97","0.002","90","","3105.4","0.6","163","2","163","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H43 B O Sm -","- C38 H43 B O Sm -","- C152 H172 B4 O4 Sm4 -","4","1","","Evans, William J.; Champagne, Timothy M.; Ziller, Joseph W.","Synthesis and Reactivity of Mono(pentamethylcyclopentadienyl) Tetraphenylborate Lanthanide Complexes of Ytterbium and Samarium: Tris(ring) Precursors to (C5Me5)Ln Moieties","Organometallics","2007","26","5","1204","","10.1021/om060963s","","","0.71073","MoKα","","0.0819","0.0401","","","0.0715","0.0841","","","","","","1.024","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072705","10.7083","0.0011","12.1261","0.0012","29.779","0.003","90","","97.299","0.002","90","","3835.5","0.7","158","2","158","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C49 H48 B N2 Sm -","- C49 H48 B N2 Sm -","- C196 H192 B4 N8 Sm4 -","4","1","","Evans, William J.; Champagne, Timothy M.; Ziller, Joseph W.","Synthesis and Reactivity of Mono(pentamethylcyclopentadienyl) Tetraphenylborate Lanthanide Complexes of Ytterbium and Samarium: Tris(ring) Precursors to (C5Me5)Ln Moieties","Organometallics","2007","26","5","1204","","10.1021/om060963s","","","0.71073","MoKα","","0.0625","0.0432","","","0.0982","0.1052","","","","","","1.17","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072706","31.4168","0.0008","9.4634","0.0003","39.632","0.001","90","","105.751","0.001","90","","11340.5","0.5","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,1,1,2,3,3,4,5,5,6,7,7,7,-Tridecamethyl-2,6-bis(trimethylsilyl)- 4-[2',2'-bis(trimethylsilyl)-1',1',1',3',3'-pentamethyl-trisilanyl]- heptasilane","","- C30 H90 Si14 -","- C30 H90 Si14 -","- C240 H720 Si112 -","8","1","","Krempner, C.; Reinke, H.","An Approach to Dendritic Oligosilanes: Controlling the Conformation through Ring Formation","Organometallics","2007","26","8","2053","","10.1021/om060964k","","","0.71073","MoKα","","0.0457","0.0332","","","0.0745","0.0795","","","","","","1.021","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072707","15.8567","0.0016","19.181","0.002","21.504","0.002","69.222","0.006","77.258","0.005","74.019","0.005","5823.5","1","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","2,2,3,4,4-Pentamethyl-1,1,5,5-tetrakis(trimethylsilyl)-3-[2',2'- bis(trimethylsilyl)-1',1',1',3',3'-pentamethyl-trisilanyl]- 1,2,3,4,5-pentasila-cyclononane","","- C32 H92 Si14 -","- C32 H92 Si14 -","- C128 H368 Si56 -","4","2","","Krempner, C.; Reinke, H.","An Approach to Dendritic Oligosilanes: Controlling the Conformation through Ring Formation","Organometallics","2007","26","8","2053","","10.1021/om060964k","","","0.71073","MoKα","","0.2026","0.0674","","","0.1043","0.1362","","","","","","0.919","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072708","11.14","0.003","13.6774","0.0014","23.659","0.002","90","","92.025","0.018","90","","3602.6","1.1","295","2","295","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C35 H36 B Cl4 F4 Ir N P -","- C35 H36 B Cl4 F4 Ir N P -","- C140 H144 B4 Cl16 F16 Ir4 N4 P4 -","4","1","","Lai, Rung-Yi; Surekha, K.; Hayashi, Akito; Ozawa, Fumiyuki; Liu, Yi-Hong; Peng, Shie-Ming; Liu, Shiuh-Tzung","Intra- and Intermolecular Hydroamination of Alkynes Catalyzed byortho-Metalated Iridium Complexes","Organometallics","2007","26","4","1062","","10.1021/om060965c","","","0.71073","MoKα","","0.108","0.0633","","","0.1274","0.1395","","","","","","1.048","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072709","9.6307","0.0004","11.1069","0.0004","12.9448","0.0005","78.296","0.001","74.905","0.001","87.646","0.001","1308.99","0.09","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H22 Cl3 Ir N O P -","- C27 H22 Cl3 Ir N O P -","- C54 H44 Cl6 Ir2 N2 O2 P2 -","2","1","","Lai, Rung-Yi; Surekha, K.; Hayashi, Akito; Ozawa, Fumiyuki; Liu, Yi-Hong; Peng, Shie-Ming; Liu, Shiuh-Tzung","Intra- and Intermolecular Hydroamination of Alkynes Catalyzed byortho-Metalated Iridium Complexes","Organometallics","2007","26","4","1062","","10.1021/om060965c","","","0.71073","MoKα","","0.0255","0.0229","","","0.0559","0.0567","","","","","","1.05","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072710","8.9245","0.0004","34.7658","0.0016","10.8015","0.0005","90","","110.413","0.001","90","","3140.9","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","compound 2a","","","- C35 H42 B Ir N6 -","- C35 H42 B Ir N6 -","- C140 H168 B4 Ir4 N24 -","4","1","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Mereiter, Kurt","Oxidative Coupling in the Reaction of TpMe2Ir(2,3-dimethylbutadiene) with Diphenylacetylene","Organometallics","2007","26","8","1900","","10.1021/om060967x","","","0.71073","MoKα","","0.0419","0.0291","","","0.0462","0.0484","","","","","","0.997","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072711","11.918","0.006","12.52","0.019","14.069","0.014","90.97","0.02","111.84","0.02","95.65","0.02","1936","4","297","2","297","2","","","","","","","","5","P -1","-P 1","2","compound 3.solv","","","- C37 H45 B Ir N7 -","- C37 H45 B Ir N7 -","- C74 H90 B2 Ir2 N14 -","2","1","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Mereiter, Kurt","Oxidative Coupling in the Reaction of TpMe2Ir(2,3-dimethylbutadiene) with Diphenylacetylene","Organometallics","2007","26","8","1900","","10.1021/om060967x","","","0.71073","MoKα","","0.1128","0.0663","","","0.158","0.1842","","","","","","1.012","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072712","12.9261","0.0006","14.8923","0.0007","18.9635","0.0009","90","","95.263","0.001","90","","3635.1","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","compound 4.solv","","","- C37 H45 B Ir N7 -","- C37 H45 B Ir N7 -","- C148 H180 B4 Ir4 N28 -","4","1","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Mereiter, Kurt","Oxidative Coupling in the Reaction of TpMe2Ir(2,3-dimethylbutadiene) with Diphenylacetylene","Organometallics","2007","26","8","1900","","10.1021/om060967x","","","0.71073","MoKα","","0.0612","0.0528","","","0.1096","0.1124","","","","","","1.185","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072713","10.9918","0.0005","16.7632","0.0007","17.5907","0.0007","90","","90","","90","","3241.2","0.2","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","compound 5","","","- C35 H42 B Ir N6 -","- C35 H42 B Ir N6 -","- C140 H168 B4 Ir4 N24 -","4","1","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Mereiter, Kurt","Oxidative Coupling in the Reaction of TpMe2Ir(2,3-dimethylbutadiene) with Diphenylacetylene","Organometallics","2007","26","8","1900","","10.1021/om060967x","","","0.71073","MoKα","","0.0335","0.028","","","0.0525","0.0541","","","","","","1.018","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072714","13.1046","0.0006","12.717","0.0005","19.0643","0.0007","90","","109.562","0.001","90","","2993.7","0.2","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,5,5-Trimethyl-4,4,6,6-tetrakis(trimethylsilyl)-2-alumina-1,3-dioxa- 4,5,6-trisilacyclohexane","","- C30 H90 Al2 O4 Si14 -","- C30 H90 Al2 O4 Si14 -","- C60 H180 Al4 O8 Si28 -","2","0.5","","Krempner, C.; Reinke, H.; Weichert, K.","Synthesis and Structure of Cyclic Aluminum Disiloxides","Organometallics","2007","26","6","1386","","10.1021/om060969h","","","0.71073","MoKα","","0.0731","0.0491","","","0.119","0.1242","","","","","","0.97","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072715","9.8107","0.0002","14.2245","0.0004","16.1461","0.0004","73.163","0.001","76.374","0.001","74.62","0.001","2048.4","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","(4R*,5R*)-2,4,5-Trimethyl-4,5-bis[tris(trimethylsilyl)silyl]- 2-alumina-1,3-dioxa-4,5-disilacylopentane","","- C42 H126 Al2 O4 Si20 -","- C42 H126 Al2 O4 Si20 -","- C42 H126 Al2 O4 Si20 -","1","0.5","","Krempner, C.; Reinke, H.; Weichert, K.","Synthesis and Structure of Cyclic Aluminum Disiloxides","Organometallics","2007","26","6","1386","","10.1021/om060969h","","","0.71073","MoKα","","0.0456","0.031","","","0.0761","0.0863","","","","","","1.062","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072716","13.4937","0.0003","13.4937","0.0003","35.3988","0.0009","90","","90","","90","","6445.4","0.3","173","2","173","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","Bis[μ~3~-1,1,2,2-tetrakis(trimethylsilyl)disilane-1,2-diolato- 1:2K^2^O;2:3K^2^O']-pentamethyltrialuminium","","- C29 H87 Al3 O4 Si12 -","- C29 H87 Al3 O4 Si12 -","- C116 H348 Al12 O16 Si48 -","4","0.5","","Krempner, C.; Reinke, H.; Weichert, K.","Synthesis and Structure of Cyclic Aluminum Disiloxides","Organometallics","2007","26","6","1386","","10.1021/om060969h","","","0.71073","MoKα","","0.0709","0.0563","","","0.1535","0.1651","","","","","","1.045","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4072717","9.5867","0.0003","13.3815","0.0004","18.9958","0.0005","106.757","0.001","98.152","0.001","94.488","0.001","2291.49","0.12","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","(4R*,5R*)-2,4,5-Trimethyl-4,5-bis[tris(trimethylsilyl)silyl]- 2-alumina-1,3-dioxa-4,5-disilacylopentane-tetrahydrofuranate","","- C25 H71 Al O3 Si10 -","- C25 H71 Al O3 Si10 -","- C50 H142 Al2 O6 Si20 -","2","1","","Krempner, C.; Reinke, H.; Weichert, K.","Synthesis and Structure of Cyclic Aluminum Disiloxides","Organometallics","2007","26","6","1386","","10.1021/om060969h","","","0.71073","MoKα","","0.046","0.0356","","","0.0927","0.1008","","","","","","1.012","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072718","17.864","0.003","17.864","0.003","26.009","0.005","90","","90","","90","","8300","3","293","2","293","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","Hydrogen-(2R*,3R*,7S*,8S*)-2,3,7,8-tetramethyl-2,3,7,8-tetrakis[tris (trimethylsilyl)silyl]-5-aluminata-1,4,6,9-tetraoxa-2,3,7,8-tetrasila- spiro[4.4]nonane","","- C40 H120 Al O4 Si20 -","- C40 H120 Al O4 Si20 -","- C160 H480 Al4 O16 Si80 -","4","0.5","","Krempner, C.; Reinke, H.; Weichert, K.","Synthesis and Structure of Cyclic Aluminum Disiloxides","Organometallics","2007","26","6","1386","","10.1021/om060969h","","","0.71073","MoKα","","0.078","0.0654","","","0.14","0.1455","","","","","","1.134","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072719","36.738","0.007","24.734","0.005","27.013","0.005","90","","121.94","0.03","90","","20830","10","253","2","253","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C96 H103 Au4 Cl4 N4 O5.5 P4 -","- C96 H62 Au4 Cl4 N4 O5.5 P4 -","- C768 H496 Au32 Cl32 N32 O44 P32 -","8","1","","Tang, Hau-San; Zhu, Nianyong; Yam, Vivian Wing-Wah","Tetranuclear Macrocyclic Gold(I) Alkynyl Phosphine Complex Containing Azobenzene Functionalities: A Dual-Input Molecular Logic with Photoswitching Behavior Controllable via Silver(I) Coordination/Decoordination","Organometallics","2007","26","1","22","","10.1021/om0609719","","","0.71069","MoKα","","0.1235","0.0632","","","0.1737","0.2042","","","","","","0.949","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072720","9.0203","0.0003","17.9386","0.0006","15.9726","0.0005","90","","100.601","0.001","90","","2540.44","0.14","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H36 B9 Rh -","- C24 H36 B9 Rh -","- C96 H144 B36 Rh4 -","4","1","","Alekseev, Leonid S.; Dolgushin, Fedor M.; Korlyukov, Alexander A.; Godovikov, Ivan A.; Vorontsov, Evgenii V.; Chizhevsky, Igor T.","Synthesis of 16-Electron (η3-Cyclooctenyl)metallacarboranes of Rhodium(III) and Iridium(III) with the New Sterically Demanding [(4‘-MeC6H4)2C2B9H9]2-Carborane Ligand. Molecular Structures of [3-{(1−3-η3)-C8H13}-1,2-(4‘-MeC6H4)2-3,1,2-pseudocloso-MC2B9H9] (M = Rh, Ir) and [(η6-MeC6H4)Rh(C2B9H9C6H4Me)Rh(η4-C8H12)]2, a Dimeric Byproduct Containing Distorted 13-Vertex {4,9,1,10-Rh2C2B9} Cluster Units","Organometallics","2007","26","15","3868","","10.1021/om0609721","","","0.71073","MoKα","","0.0314","0.0228","","","0.0515","0.0561","","","","","","1.037","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072721","15.7173","0.0007","17.0705","0.0008","18.667","0.0009","90","","90","","90","","5008.4","0.4","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C24 H36 B9 Ir -","- C24 H36 B9 Ir -","- C192 H288 B72 Ir8 -","8","1","","Alekseev, Leonid S.; Dolgushin, Fedor M.; Korlyukov, Alexander A.; Godovikov, Ivan A.; Vorontsov, Evgenii V.; Chizhevsky, Igor T.","Synthesis of 16-Electron (η3-Cyclooctenyl)metallacarboranes of Rhodium(III) and Iridium(III) with the New Sterically Demanding [(4‘-MeC6H4)2C2B9H9]2-Carborane Ligand. Molecular Structures of [3-{(1−3-η3)-C8H13}-1,2-(4‘-MeC6H4)2-3,1,2-pseudocloso-MC2B9H9] (M = Rh, Ir) and [(η6-MeC6H4)Rh(C2B9H9C6H4Me)Rh(η4-C8H12)]2, a Dimeric Byproduct Containing Distorted 13-Vertex {4,9,1,10-Rh2C2B9} Cluster Units","Organometallics","2007","26","15","3868","","10.1021/om0609721","","","0.71073","MoKα","","0.0276","0.019","","","0.0412","0.0444","","","","","","1.034","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072722","12.1862","0.0001","22.2631","0.0002","18.4958","0.0001","90","","108.775","0.0004","90","","4750.94","0.06","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Compound 1","","","- C47 H37 B F24 P Rh -","- C47 H37 B F24 P Rh -","- C188 H148 B4 F96 P4 Rh4 -","4","1","","Douglas, Thomas M.; Molinos, Eduardo; Brayshaw, Simon K.; Weller, Andrew S.","Rhodium Phosphine Olefin Complexes of the Weakly Coordinating Anions [BArF4]-and [1-closo-CB11H6Br6]-. Kinetic versus Thermodynamic Factors in Anion Coordination and Complex Reactivity","Organometallics","2007","26","3","463","","10.1021/om060975d","","","0.71073","MoKα","","0.0538","0.0445","","","0.1114","0.1165","","","","","","1.091","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072723","12.9014","0.0001","13.8202","0.0001","16.3616","0.0002","90","","90","","90","","2917.27","0.05","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Compound 2","","","- C16 H31 B11 Br6 P Rh -","- C16 H31 B11 Br6 P Rh -","- C64 H124 B44 Br24 P4 Rh4 -","4","1","","Douglas, Thomas M.; Molinos, Eduardo; Brayshaw, Simon K.; Weller, Andrew S.","Rhodium Phosphine Olefin Complexes of the Weakly Coordinating Anions [BArF4]-and [1-closo-CB11H6Br6]-. Kinetic versus Thermodynamic Factors in Anion Coordination and Complex Reactivity","Organometallics","2007","26","3","463","","10.1021/om060975d","","","0.71073","MoKα","","0.039","0.0311","","","0.0649","0.068","","","","","","1.034","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072724","15.5902","0.0003","16.2396","0.0004","15.3325","0.0004","90","","113.62","0.001","90","","3556.65","0.15","123","1","123","1","","","","","","","Local laboratory","5","C 1 2/c 1","-C 2yc","15","mbn23","","","- C45 H35 N P2 Pt -","- C45 H35 N P2 Pt -","- C180 H140 N4 P8 Pt4 -","4","0.5","","Berenguer, Jesús R.; Bernechea, María; Lalinde, Elena","Rearrangement or C−H Activation Processes Promoted by Reaction with the Solvate [cis-Pt(C6F5)2(thf)2]","Organometallics","2007","26","5","1161","","10.1021/om060977y","","","0.7107","MoKα","","0.0305","0.0273","","","0.0671","0.0689","","","","","","1.018","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072725","23.6302","0.0002","14.7458","0.0003","28.573","0.0005","90","","150.658","0.001","90","","4878.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","mbn21","","","- C57 H37 F10 P2 Pt2 -","- C57 H37 F10 P2 Pt2 -","- C228 H148 F40 P8 Pt8 -","4","1","","Berenguer, Jesús R.; Bernechea, María; Lalinde, Elena","Rearrangement or C−H Activation Processes Promoted by Reaction with the Solvate [cis-Pt(C6F5)2(thf)2]","Organometallics","2007","26","5","1161","","10.1021/om060977y","","","0.7107","MoKα","","0.1186","0.0504","","","0.0771","0.0938","","","","","","0.999","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072726","23.238","0.0001","14.8","0.0002","28.153","0.0002","90","","149.659","0.0006","90","","4891.03","0.12","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","mbn25","","","- C57 H35 F10 N P2 Pt2 -","- C57 H35 F10 N P2 Pt2 -","- C228 H140 F40 N4 P8 Pt8 -","4","1","","Berenguer, Jesús R.; Bernechea, María; Lalinde, Elena","Rearrangement or C−H Activation Processes Promoted by Reaction with the Solvate [cis-Pt(C6F5)2(thf)2]","Organometallics","2007","26","5","1161","","10.1021/om060977y","","","0.7107","MoKα","","0.0634","0.0344","","","0.062","0.0702","","","","","","1.003","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072727","12.414","0.0003","13.7921","0.0003","17.2697","0.0005","79.742","0.001","74.228","0.001","73.24","0.001","2708.64","0.12","293","2","293","2","","","","","","","","7","P -1","-P 1","2","mbn86","","","- C58 H40 Cl2 F10 O P2 Pt2 -","- C58 H40 Cl2 F10 O P2 Pt2 -","- C116 H80 Cl4 F20 O2 P4 Pt4 -","2","1","","Berenguer, Jesús R.; Bernechea, María; Lalinde, Elena","Rearrangement or C−H Activation Processes Promoted by Reaction with the Solvate [cis-Pt(C6F5)2(thf)2]","Organometallics","2007","26","5","1161","","10.1021/om060977y","","","0.71073","MoKα","","0.0845","0.048","","","0.0995","0.1089","","","","","","1.041","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072728","17.376","0.0002","24.139","0.0002","25.194","0.0002","90","","90","","90","","10567.3","0.17","173","1","173","1","","","","","","","","6","P c a b","-P 2bc 2ac","61","Compound X","","","- C54.5 H38 Cl3 F10 P2 Pt2 -","- C54.5 H38 Cl3 F10 P2 Pt2 -","- C436 H304 Cl24 F80 P16 Pt16 -","8","1","","Berenguer, Jesús R.; Bernechea, María; Lalinde, Elena","Rearrangement or C−H Activation Processes Promoted by Reaction with the Solvate [cis-Pt(C6F5)2(thf)2]","Organometallics","2007","26","5","1161","","10.1021/om060977y","","","0.71073","MoKα","","0.0714","0.0456","","","0.1163","0.1286","","","","","","1.007","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4072729","13.733","0.0005","14.664","0.0005","16.671","0.0007","64.42","0.002","88.728","0.002","64.725","0.002","2683.61","0.19","293","2","293","2","","","","","","","","7","P -1","-P 1","2","Compound X","","","- C55 H40 Cl3 F10 O P2 Pt2 -","- C55 H40 Cl3 F10 O P2 Pt2 -","- C110 H80 Cl6 F20 O2 P4 Pt4 -","2","1","","Berenguer, Jesús R.; Bernechea, María; Lalinde, Elena","Rearrangement or C−H Activation Processes Promoted by Reaction with the Solvate [cis-Pt(C6F5)2(thf)2]","Organometallics","2007","26","5","1161","","10.1021/om060977y","","","0.71073","MoKα","","0.1106","0.0683","","","0.1621","0.1901","","","","","","1.026","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072730","22.4467","0.0001","10.9348","0.0001","24.741","0.0002","90","","116.6","0.0004","90","","5429.92","0.07","173","1","173","1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","Compound X","","","- C63 H44 F10 O2 P2 Pt2 -","- C63 H44 F10 O2 P2 Pt2 -","- C252 H176 F40 O8 P8 Pt8 -","4","1","","Berenguer, Jesús R.; Bernechea, María; Lalinde, Elena","Rearrangement or C−H Activation Processes Promoted by Reaction with the Solvate [cis-Pt(C6F5)2(thf)2]","Organometallics","2007","26","5","1161","","10.1021/om060977y","","","0.71073","MoKα","","0.0479","0.0302","","","0.061","0.0659","","","","","","1.028","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072731","7.8568","0.0005","10.6536","0.0006","14.7322","0.0009","90.327","0.001","96.757","0.001","108.336","0.001","1161.2","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","compound 4b","","","- C20 H34 B Ir N6 O -","- C20 H34 B Ir N6 O -","- C40 H68 B2 Ir2 N12 O2 -","2","1","","Álvarez, Eleuterio; Paneque, Margarita; Petronilho, Ana G.; Poveda, Manuel L.; Santos, Laura L.; Carmona, Ernesto; Mereiter, Kurt","Activation of Aliphatic Ethers by TpMe2Ir Compounds: Multiple C−H Bond Activation and C−C Bond Formation","Organometallics","2007","26","5","1231","","10.1021/om0609822","","","0.71073","MoKα","","0.0216","0.0193","","","0.0463","0.0472","","","","","","1.051","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072732","8.0032","0.0003","25.5968","0.0011","14.006","0.0006","90","","91.226","0.001","90","","2868.6","0.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","compound 6b","","","- C28 H41 B Ir N7 O -","- C28 H41 B Ir N7 O -","- C112 H164 B4 Ir4 N28 O4 -","4","1","","Álvarez, Eleuterio; Paneque, Margarita; Petronilho, Ana G.; Poveda, Manuel L.; Santos, Laura L.; Carmona, Ernesto; Mereiter, Kurt","Activation of Aliphatic Ethers by TpMe2Ir Compounds: Multiple C−H Bond Activation and C−C Bond Formation","Organometallics","2007","26","5","1231","","10.1021/om0609822","","","0.71073","MoKα","","0.0259","0.0188","","","0.0403","0.0425","","","","","","1.032","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072733","8.0551","0.0004","10.9901","0.0005","14.9513","0.0007","82.332","0.001","86.911","0.001","79.531","0.001","1289.32","0.11","100","2","100","2","","","","","","","","6","P -1","-P 1","2","compound 7b","","","- C26 H38 B Ir N6 O -","- C26 H38 B Ir N6 O -","- C52 H76 B2 Ir2 N12 O2 -","2","1","","Álvarez, Eleuterio; Paneque, Margarita; Petronilho, Ana G.; Poveda, Manuel L.; Santos, Laura L.; Carmona, Ernesto; Mereiter, Kurt","Activation of Aliphatic Ethers by TpMe2Ir Compounds: Multiple C−H Bond Activation and C−C Bond Formation","Organometallics","2007","26","5","1231","","10.1021/om0609822","","","0.71073","MoKα","","0.026","0.0245","","","0.0747","0.0758","","","","","","1.065","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072734","11.2973","0.0019","11.654","0.002","12.137","0.002","109.124","0.003","99.71","0.003","102.222","0.003","1425.7","0.4","123","2","123","2","","","","","","","","7","P -1","-P 1","2","compound 8-Cl.Et2O","","","- C26 H37 B Cl Ir N6 O2 -","- C26 H37 B Cl Ir N6 O2 -","- C52 H74 B2 Cl2 Ir2 N12 O4 -","2","1","","Álvarez, Eleuterio; Paneque, Margarita; Petronilho, Ana G.; Poveda, Manuel L.; Santos, Laura L.; Carmona, Ernesto; Mereiter, Kurt","Activation of Aliphatic Ethers by TpMe2Ir Compounds: Multiple C−H Bond Activation and C−C Bond Formation","Organometallics","2007","26","5","1231","","10.1021/om0609822","","","0.71073","MoKα","","0.0345","0.0243","","","0.0494","0.0525","","","","","","1.02","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072735","9.6643","0.0005","13.8792","0.0007","9.9442","0.0005","90","","117.208","0.001","90","","1186.26","0.1","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H30 Br4 Os2 -","- C20 H30 Br4 Os2 -","- C40 H60 Br8 Os4 -","2","0.5","","Gross, Christopher L.; Brumaghim, Julia L.; Girolami, Gregory S.","Synthesis and Reactivity of the Osmium(III) Pentamethylcyclopentadienyl Complex (C5Me5)2Os2Br4. X-ray Crystal Structures of (C5Me5)2Os2Br4, (C5Me5)2Os2(μ-O)Br4, and (C5Me5)2Os2(μ-NPh)2Br2","Organometallics","2007","26","9","2258","","10.1021/om060983u","","","0.71073","MoKα","","0.0939","0.0474","","","0.0945","0.1101","","","","","","0.963","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072736","8.5196","0.0004","13.7702","0.0006","10.8259","0.0005","90","","93.934","0.001","90","","1267.07","0.1","198","2","198","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H30 Br4 O Os2 -","- C20 H30 Br4 O Os2 -","- C40 H60 Br8 O2 Os4 -","2","0.5","","Gross, Christopher L.; Brumaghim, Julia L.; Girolami, Gregory S.","Synthesis and Reactivity of the Osmium(III) Pentamethylcyclopentadienyl Complex (C5Me5)2Os2Br4. X-ray Crystal Structures of (C5Me5)2Os2Br4, (C5Me5)2Os2(μ-O)Br4, and (C5Me5)2Os2(μ-NPh)2Br2","Organometallics","2007","26","9","2258","","10.1021/om060983u","","","0.71073","MoKα","","0.0999","0.0748","","","0.1902","0.2084","","","","","","1.099","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072737","17.9343","0.0001","19.0862","0.0003","8.9428","0.0001","90","","90","","90","","3061.1","0.06","198","2","198","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C32 H40 Br2 N2 Os2 -","- C32 H40 Br2 N2 Os2 -","- C128 H160 Br8 N8 Os8 -","4","0.5","","Gross, Christopher L.; Brumaghim, Julia L.; Girolami, Gregory S.","Synthesis and Reactivity of the Osmium(III) Pentamethylcyclopentadienyl Complex (C5Me5)2Os2Br4. X-ray Crystal Structures of (C5Me5)2Os2Br4, (C5Me5)2Os2(μ-O)Br4, and (C5Me5)2Os2(μ-NPh)2Br2","Organometallics","2007","26","9","2258","","10.1021/om060983u","","","0.71073","MoKα","","0.0484","0.0357","","","0.0848","0.0927","","","","","","1.1","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072738","11.3221","0.0013","11.8585","0.0014","16.4254","0.0019","102.843","0.0016","103.678","0.0017","104.791","0.0016","1975.8","0.4","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H40 Cl6 Fe N2 P2 Ru -","- C38 H40 Cl6 Fe N2 P2 Ru -","- C76 H80 Cl12 Fe2 N4 P4 Ru2 -","2","1","","Ma, Guibin; McDonald, Robert; Ferguson, Michael; Cavell, Ronald G.; Patrick, Brian O.; James, Brian R.; Hu, Thomas Q.","Ruthenium(II) Diphosphine/Diamine/Diimine Complexes and Catalyzed Hydrogen-Transfer to Ketones","Organometallics","2007","26","4","846","","10.1021/om060987z","","","0.71073","MoKα","","0.0595","0.0483","","","0.1277","0.1386","","","","","","1.064","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072739","14.8147","0.0019","14.895","0.002","17.335","0.002","90","","92.937","0.009","90","","3820.2","0.8","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C39 H42 Cl4 Fe N2 P2 Ru -","- C39 H42 Cl4 Fe N2 P2 Ru -","- C156 H168 Cl16 Fe4 N8 P8 Ru4 -","4","1","","Ma, Guibin; McDonald, Robert; Ferguson, Michael; Cavell, Ronald G.; Patrick, Brian O.; James, Brian R.; Hu, Thomas Q.","Ruthenium(II) Diphosphine/Diamine/Diimine Complexes and Catalyzed Hydrogen-Transfer to Ketones","Organometallics","2007","26","4","846","","10.1021/om060987z","","","0.71073","MoKα","","0.1239","0.0638","","","0.1295","0.1642","","","","","","1.032","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072740","13.0207","0.0018","16.928","0.002","19.903","0.003","90","","90","","90","","4386.9","1","193","2","193","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C46 H40 Cl6 Fe N2 P2 Ru -","- C46 H40 Cl6 Fe N2 P2 Ru -","- C184 H160 Cl24 Fe4 N8 P8 Ru4 -","4","1","","Ma, Guibin; McDonald, Robert; Ferguson, Michael; Cavell, Ronald G.; Patrick, Brian O.; James, Brian R.; Hu, Thomas Q.","Ruthenium(II) Diphosphine/Diamine/Diimine Complexes and Catalyzed Hydrogen-Transfer to Ketones","Organometallics","2007","26","4","846","","10.1021/om060987z","","","0.71073","MoKα","","0.0913","0.0619","","","0.1366","0.1516","","","","","","1.062","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072741","13.5384","0.001","12.8507","0.0007","18.1221","0.0012","90","","111.75","0.003","90","","2928.4","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H36 Cl2 N2 P2 Ru -","- C30 H36 Cl2 N2 P2 Ru -","- C120 H144 Cl8 N8 P8 Ru4 -","4","1","","Ma, Guibin; McDonald, Robert; Ferguson, Michael; Cavell, Ronald G.; Patrick, Brian O.; James, Brian R.; Hu, Thomas Q.","Ruthenium(II) Diphosphine/Diamine/Diimine Complexes and Catalyzed Hydrogen-Transfer to Ketones","Organometallics","2007","26","4","846","","10.1021/om060987z","","","0.71069","MoKα","","0.0586","0.0452","","","0.1386","0.1513","","","","","","1.137","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072742","16.0682","0.0005","12.2876","0.0004","42.34","0.001","90","","90","","90","","8359.6","0.4","120","1","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C45 H43 F9 Fe P3 -","- C45 H43 F9 Fe P3 -","- C360 H344 F72 Fe8 P24 -","8","1","","Paul, Frédéric; da Costa, Grégory; Bondon, Arnaud; Gauthier, Nicolas; Sinbandhit, Sourisak; Toupet, Loic; Costuas, Karine; Halet, Jean-François; Lapinte, Claude","Spin Delocalization in Electron-Rich Iron(III) Piano-Stool σ-Acetylides. An Experimental (NMR) and Theoretical (DFT) Investigation","Organometallics","2007","26","4","874","","10.1021/om060989j","","","0.71073","MoKα","","0.109","0.065","","","0.1551","0.1648","","","","","","1.05","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072743","10.6961","0.0004","11.0582","0.0003","20.3047","0.0008","80.01","0.002","86.082","0.002","64.282","0.002","2130.86","0.13","120","1","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C53 H56 Fe P2 -","- C53 H56 Fe P2 -","- C106 H112 Fe2 P4 -","2","1","","Paul, Frédéric; da Costa, Grégory; Bondon, Arnaud; Gauthier, Nicolas; Sinbandhit, Sourisak; Toupet, Loic; Costuas, Karine; Halet, Jean-François; Lapinte, Claude","Spin Delocalization in Electron-Rich Iron(III) Piano-Stool σ-Acetylides. An Experimental (NMR) and Theoretical (DFT) Investigation","Organometallics","2007","26","4","874","","10.1021/om060989j","","","0.71069","MoKα","","0.1132","0.0727","","","0.1808","0.2012","","","","","","1.082","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072744","11.0094","0.0003","15.0407","0.0003","15.8834","0.0003","67.975","0.001","79.233","0.001","74.729","0.001","2340.66","0.09","120","1","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C47.5 H50.5 Cl1.5 F6 Fe P3 -","- C47.5 H50.5 Cl1.5 F6 Fe P3 -","- C95 H101 Cl3 F12 Fe2 P6 -","2","1","","Paul, Frédéric; da Costa, Grégory; Bondon, Arnaud; Gauthier, Nicolas; Sinbandhit, Sourisak; Toupet, Loic; Costuas, Karine; Halet, Jean-François; Lapinte, Claude","Spin Delocalization in Electron-Rich Iron(III) Piano-Stool σ-Acetylides. An Experimental (NMR) and Theoretical (DFT) Investigation","Organometallics","2007","26","4","874","","10.1021/om060989j","","","0.71069","MoKα","","0.1052","0.0814","","","0.2257","0.2511","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072745","9.5078","0.0004","16.2192","0.0006","13.2545","0.0006","90","","106.059","0.003","90","","1964.2","0.14","100","1","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C44 H43 F7 Fe P3 -","- C44 H43 F7 Fe P3 -","- C88 H86 F14 Fe2 P6 -","2","1","","Paul, Frédéric; da Costa, Grégory; Bondon, Arnaud; Gauthier, Nicolas; Sinbandhit, Sourisak; Toupet, Loic; Costuas, Karine; Halet, Jean-François; Lapinte, Claude","Spin Delocalization in Electron-Rich Iron(III) Piano-Stool σ-Acetylides. An Experimental (NMR) and Theoretical (DFT) Investigation","Organometallics","2007","26","4","874","","10.1021/om060989j","","","0.71069","MoKα","","0.053","0.0327","","","0.0679","0.0707","","","","","","0.892","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072746","8.5747","0.0005","11.705","0.0007","19.272","0.001","88.957","0.003","83.951","0.003","79.234","0.002","1889.64","0.19","120","1","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C46 H48 Fe P2 -","- C46 H48 Fe P2 -","- C92 H96 Fe2 P4 -","2","1","","Paul, Frédéric; da Costa, Grégory; Bondon, Arnaud; Gauthier, Nicolas; Sinbandhit, Sourisak; Toupet, Loic; Costuas, Karine; Halet, Jean-François; Lapinte, Claude","Spin Delocalization in Electron-Rich Iron(III) Piano-Stool σ-Acetylides. An Experimental (NMR) and Theoretical (DFT) Investigation","Organometallics","2007","26","4","874","","10.1021/om060989j","","","0.71069","MoKα","","0.1225","0.0871","","","0.2058","0.2361","","","","","","1.139","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072747","12.2998","0.0005","12.8766","0.0005","24.632","0.001","90","","92.053","0.001","90","","3898.7","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[RuCp(CH3CN)2(H2IPri)]PF6, compound 1b","","","- C36 H49 F6 N4 P Ru -","- C36 H49 F6 N4 P Ru -","- C144 H196 F24 N16 P4 Ru4 -","4","1","","Becker, Eva; Stingl, Verena; Dazinger, Georg; Mereiter, Kurt; Kirchner, Karl","Migratory Insertion of Acetylene in N-Heterocyclic Carbene Complexes of Ruthenium: Formation of (Ruthenocenylmethyl)imidazolium Salts","Organometallics","2007","26","6","1531","","10.1021/om060990i","","","0.71073","MoKα","","0.0387","0.0334","","","0.0874","0.0924","","","","","","1.034","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072748","10.3126","0.0009","10.915","0.001","16.9277","0.0015","87.331","0.003","74.758","0.002","75.109","0.002","1776.2","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","[RuCp(eta5-C5H4-CH2-IPri)]PF6, compound 3a","","","- C38 H47 F6 N2 P Ru -","- C38 H47 F6 N2 P Ru -","- C76 H94 F12 N4 P2 Ru2 -","2","1","","Becker, Eva; Stingl, Verena; Dazinger, Georg; Mereiter, Kurt; Kirchner, Karl","Migratory Insertion of Acetylene in N-Heterocyclic Carbene Complexes of Ruthenium: Formation of (Ruthenocenylmethyl)imidazolium Salts","Organometallics","2007","26","6","1531","","10.1021/om060990i","","","0.71073","MoKα","","0.0363","0.0316","","","0.0781","0.081","","","","","","1.035","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072749","10.3582","0.0004","11.0025","0.0005","17.0418","0.0007","87.587","0.001","74.285","0.001","75.231","0.001","1807.06","0.13","173","2","173","2","","","","","","","","6","P -1","-P 1","2","[RuCp(eta5-C5H4-CH2-H2IPri)]PF6, compound 3b","","","- C38 H49 F6 N2 P Ru -","- C38 H49 F6 N2 P Ru -","- C76 H98 F12 N4 P2 Ru2 -","2","1","","Becker, Eva; Stingl, Verena; Dazinger, Georg; Mereiter, Kurt; Kirchner, Karl","Migratory Insertion of Acetylene in N-Heterocyclic Carbene Complexes of Ruthenium: Formation of (Ruthenocenylmethyl)imidazolium Salts","Organometallics","2007","26","6","1531","","10.1021/om060990i","","","0.71073","MoKα","","0.0311","0.0304","","","0.0739","0.0743","","","","","","1.179","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072750","10.3511","0.0015","10.8791","0.0016","17.308","0.002","91.151","0.002","98.372","0.002","111.963","0.002","1782.4","0.4","120","0.1","120","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C32 H53 Mo2 O7 P3 -","- C32 H53 Mo2 O7 P3 -","- C64 H106 Mo4 O14 P6 -","2","1","","Alvarez, M. Angeles; García, M. Esther; Ramos, Alberto; Ruiz, Miguel A.","Reactivity of the Unsaturated Hydride [Mo2(η5-C5H5)2(μ-H)(μ-PCy2)(CO)2] toward P-Donor Bidentate Ligands and Unsaturated N-Containing Organic Molecules","Organometallics","2007","26","6","1461","","10.1021/om060999k","","x-ray","0.71073","MoKα","","0.0871","0.0414","","","0.0694","0.0825","","","","","","1.109","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072751","9.2696","0.0018","10.598","0.002","28.384","0.005","90","","90","","90","","2788.4","0.9","100","0.1","100","2","","","","","","","synthesis as described","6","P 21 21 21","P 2ac 2ab","19","","","","- C31 H38 Mo2 N O2 P -","- C31 H38 Mo2 N O2 P -","- C124 H152 Mo8 N4 O8 P4 -","4","1","","Alvarez, M. Angeles; García, M. Esther; Ramos, Alberto; Ruiz, Miguel A.","Reactivity of the Unsaturated Hydride [Mo2(η5-C5H5)2(μ-H)(μ-PCy2)(CO)2] toward P-Donor Bidentate Ligands and Unsaturated N-Containing Organic Molecules","Organometallics","2007","26","6","1461","","10.1021/om060999k","","x-ray","0.71073","MoKα","","0.082","0.056","","","0.1252","0.1366","","","","","","0.996","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072752","5.1199","0.0008","13.818","0.002","32.194","0.005","90","","90","","90","","2277.6","0.6","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C23 H22 Cl2 N4 O Pd -","- C23 H22 Cl2 N4 O Pd -","- C92 H88 Cl8 N16 O4 Pd4 -","4","1","","Liao, Chuang-Yi; Chan, Kai-Ting; Zeng, Jing-Yao; Hu, Ching-Han; Tu, Cheng-Yi; Lee, Hon Man","Nonchelate and Chelate Complexes of Palladium(II) with N-Heterocyclic Carbene Ligands of Amido Functionality","Organometallics","2007","26","7","1692","","10.1021/om0610041","","x-ray","0.71073","MoKα","","0.0562","0.0355","","","0.0566","0.0606","","","","","","0.94","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072753","16.5525","0.0011","16.4142","0.0011","9.2128","0.0006","90","","97.855","0.001","90","","2479.6","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H24 Cl2 N4 O Pd -","- C27 H24 Cl2 N4 O Pd -","- C108 H96 Cl8 N16 O4 Pd4 -","4","1","","Liao, Chuang-Yi; Chan, Kai-Ting; Zeng, Jing-Yao; Hu, Ching-Han; Tu, Cheng-Yi; Lee, Hon Man","Nonchelate and Chelate Complexes of Palladium(II) with N-Heterocyclic Carbene Ligands of Amido Functionality","Organometallics","2007","26","7","1692","","10.1021/om0610041","","","0.71073","MoKα","","0.045","0.0354","","","0.0893","0.0939","","","","","","1.054","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072754","16.608","0.0004","15.6949","0.0004","14.2159","0.0004","90","","100.24","0.002","90","","3646.51","0.17","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H40 N6 O4 Pd -","- C38 H40 N6 O4 Pd -","- C152 H160 N24 O16 Pd4 -","4","0.5","","Liao, Chuang-Yi; Chan, Kai-Ting; Zeng, Jing-Yao; Hu, Ching-Han; Tu, Cheng-Yi; Lee, Hon Man","Nonchelate and Chelate Complexes of Palladium(II) with N-Heterocyclic Carbene Ligands of Amido Functionality","Organometallics","2007","26","7","1692","","10.1021/om0610041","","x-ray","0.71073","MoKα","","0.0369","0.0264","","","0.0668","0.0729","","","","","","0.812","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072755","9.4419","0.0019","11.375","0.003","12.702","0.003","65.688","0.004","87.358","0.005","69.092","0.005","1153.2","0.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H56 N6 O6 Pd S4 -","- C44 H56 N6 O6 Pd S4 -","- C44 H56 N6 O6 Pd S4 -","1","0.5","","Liao, Chuang-Yi; Chan, Kai-Ting; Zeng, Jing-Yao; Hu, Ching-Han; Tu, Cheng-Yi; Lee, Hon Man","Nonchelate and Chelate Complexes of Palladium(II) with N-Heterocyclic Carbene Ligands of Amido Functionality","Organometallics","2007","26","7","1692","","10.1021/om0610041","","x-ray","0.71073","MoKα","","0.0929","0.068","","","0.1619","0.1788","","","","","","1.001","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072756","10.9128","0.0003","17.8089","0.0005","9.3293","0.0003","90","","110.505","0.002","90","","1698.23","0.09","396","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H38 F2 N6 O4 Pd -","- C38 H38 F2 N6 O4 Pd -","- C76 H76 F4 N12 O8 Pd2 -","2","0.5","","Liao, Chuang-Yi; Chan, Kai-Ting; Zeng, Jing-Yao; Hu, Ching-Han; Tu, Cheng-Yi; Lee, Hon Man","Nonchelate and Chelate Complexes of Palladium(II) with N-Heterocyclic Carbene Ligands of Amido Functionality","Organometallics","2007","26","7","1692","","10.1021/om0610041","","x-ray","0.71073","MoKα","","0.0716","0.0444","","","0.1234","0.134","","","","","","1.087","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072757","9.4368","0.0003","10.2941","0.0003","13.0276","0.0004","70.192","0.002","75.905","0.002","63.195","0.001","1056.51","0.06","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H38 Cl6 N6 O4 Pd -","- C40 H38 Cl6 N6 O4 Pd -","- C40 H38 Cl6 N6 O4 Pd -","1","0.5","","Liao, Chuang-Yi; Chan, Kai-Ting; Zeng, Jing-Yao; Hu, Ching-Han; Tu, Cheng-Yi; Lee, Hon Man","Nonchelate and Chelate Complexes of Palladium(II) with N-Heterocyclic Carbene Ligands of Amido Functionality","Organometallics","2007","26","7","1692","","10.1021/om0610041","","x-ray","0.71073","MoKα","","0.0621","0.0412","","","0.0886","0.0957","","","","","","0.995","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072758","28.8517","0.0014","17.3518","0.0008","19.8506","0.0017","90","","130.484","0.001","90","","7558.6","0.8","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C182 H158 N25 O10 Pd4 -","- C182 H158 N25 O10 Pd4 -","- C364 H316 N50 O20 Pd8 -","2","0.25","","Liao, Chuang-Yi; Chan, Kai-Ting; Zeng, Jing-Yao; Hu, Ching-Han; Tu, Cheng-Yi; Lee, Hon Man","Nonchelate and Chelate Complexes of Palladium(II) with N-Heterocyclic Carbene Ligands of Amido Functionality","Organometallics","2007","26","7","1692","","10.1021/om0610041","","x-ray","0.71073","MoKα","","0.0489","0.0327","","","0.0851","0.0986","","","","","","1.044","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072759","31.688","0.009","31.688","0.009","22.273","0.007","90","","90","","120","","19369","10","150","2","150","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C45 H40 N6 O3 Pd -","- C45 H40 N6 O3 Pd -","- C810 H720 N108 O54 Pd18 -","18","1","","Liao, Chuang-Yi; Chan, Kai-Ting; Zeng, Jing-Yao; Hu, Ching-Han; Tu, Cheng-Yi; Lee, Hon Man","Nonchelate and Chelate Complexes of Palladium(II) with N-Heterocyclic Carbene Ligands of Amido Functionality","Organometallics","2007","26","7","1692","","10.1021/om0610041","","x-ray","0.71073","MoKα","","0.2263","0.0705","","","0.1492","0.2141","","","","","","0.955","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072760","9.0303","0.0002","23.7591","0.0007","15.2864","0.0004","90","","94.88","0.002","90","","3267.84","0.15","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H37 Cl2 N7 O4 Pd -","- C30 H37 Cl2 N7 O4 Pd -","- C120 H148 Cl8 N28 O16 Pd4 -","4","1","","Liao, Chuang-Yi; Chan, Kai-Ting; Zeng, Jing-Yao; Hu, Ching-Han; Tu, Cheng-Yi; Lee, Hon Man","Nonchelate and Chelate Complexes of Palladium(II) with N-Heterocyclic Carbene Ligands of Amido Functionality","Organometallics","2007","26","7","1692","","10.1021/om0610041","","x-ray","0.71073","MoKα","","0.0594","0.0351","","","0.077","0.0845","","","","","","0.996","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072761","8.3775","0.0009","29.923","0.003","9.4386","0.001","90","","94.538","0.002","90","","2358.7","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H25 N5 O4 Pd -","- C24 H25 N5 O4 Pd -","- C96 H100 N20 O16 Pd4 -","4","1","","Liao, Chuang-Yi; Chan, Kai-Ting; Zeng, Jing-Yao; Hu, Ching-Han; Tu, Cheng-Yi; Lee, Hon Man","Nonchelate and Chelate Complexes of Palladium(II) with N-Heterocyclic Carbene Ligands of Amido Functionality","Organometallics","2007","26","7","1692","","10.1021/om0610041","","x-ray","0.71073","MoKα","","0.0512","0.0387","","","0.0815","0.0843","","","","","","1.133","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072762","9.968","0.0002","11.451","0.0004","15.547","0.0005","81.409","0.002","82.347","0.002","76.264","0.0012","1695.65","0.09","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H39 Fe P2 -","- C42 H39 Fe P2 -","- C84 H78 Fe2 P4 -","2","1","","Yen, Yung-Sheng; Lin, Ying-Chih; Liu, Yi-Hung; Wang, Yu","Deprotonation of Iron Vinylidene Complexes Containing a dppe Ligand","Organometallics","2007","26","5","1250","","10.1021/om061005t","","","0.71073","MoKα","","0.1411","0.0516","","","0.1029","0.1336","","","","","","0.971","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072763","10.8452","0.0002","23.4185","0.0004","14.5877","0.0003","90","","104.969","0.0012","90","","3579.23","0.12","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H39 Fe I P2 -","- C42 H39 Fe I P2 -","- C168 H156 Fe4 I4 P8 -","4","1","","Yen, Yung-Sheng; Lin, Ying-Chih; Liu, Yi-Hung; Wang, Yu","Deprotonation of Iron Vinylidene Complexes Containing a dppe Ligand","Organometallics","2007","26","5","1250","","10.1021/om061005t","","","0.71073","MoKα","","0.0851","0.0425","","","0.1225","0.1519","","","","","","0.933","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072764","9.5019","0.0002","10.3879","0.0004","10.5069","0.0003","112.468","0.0016","112.49","0.002","98.281","0.0019","832.75","0.05","295","2","295","2","","","","","","","","5","P 1","P 1","1","","","","- C41 H35 Fe N P2 -","- C41 H35 Fe N P2 -","- C41 H35 Fe N P2 -","1","1","","Yen, Yung-Sheng; Lin, Ying-Chih; Liu, Yi-Hung; Wang, Yu","Deprotonation of Iron Vinylidene Complexes Containing a dppe Ligand","Organometallics","2007","26","5","1250","","10.1021/om061005t","","","0.71073","MoKα","","0.0402","0.0348","","","0.0772","0.0804","","","","","","1.042","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072765","23.398","0.005","17.539","0.005","32.266","0.005","90","0.005","107.938","0.005","90","0.005","12598","5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H29.5 Cl0.5 N2 O5.75 Sn2 -","- C132 H97 Cl2 N8 O23 Sn8 -","- C528 H388 Cl8 N32 O92 Sn32 -","4","1","","Chandrasekhar, Vadapalli; Thirumoorthi, Ramalingam; Azhakar, Ramachandran","New Structural Forms of Organostannoxane Macrocycle Networks","Organometallics","2007","26","1","26","","10.1021/om061010x","","","0.71069","MoKα","","0.13","0.0696","","","0.1512","0.1766","","","","","","1.033","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4072766","13.717","0.002","17.571","0.003","19.095","0.003","96.546","0.004","93.933","0.004","93.317","0.004","4551.5","1.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C100 H89 N8 O11 Sn5 -","- C200 H154 N16 O22 Sn10 -","- C200 H154 N16 O22 Sn10 -","1","0.5","","Chandrasekhar, Vadapalli; Thirumoorthi, Ramalingam; Azhakar, Ramachandran","New Structural Forms of Organostannoxane Macrocycle Networks","Organometallics","2007","26","1","26","","10.1021/om061010x","","","0.71073","MoKα","","0.1428","0.0793","","","0.168","0.2151","","","","","","1.007","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072767","11.4165","0.0006","14.0703","0.0008","19.8779","0.0011","90","","104.413","0.001","90","","3092.6","0.3","134","2","134","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H46 N2 Yb -","- C36 H46 N2 Yb -","- C144 H184 N8 Yb4 -","4","1","","Walter, Marc D.; Berg, David J.; Andersen, Richard A.","Coordination of 1,4-Diazabutadiene Ligands to Decamethylytterbocene: Additional Examples of Spin Coupling in Ytterbocene Complexes","Organometallics","2007","26","9","2296","","10.1021/om0610142","","","0.71069","MoKα","","0.0607","0.0467","","","0.1121","0.1201","","","","","","1","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072768","9.99","0.0009","30.731","0.003","10.4568","0.001","90","","97.978","0.001","90","","3179.2","0.5","144","2","144","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C36 H46 N2 O2 Yb -","- C36 H46 N2 O2 Yb -","- C144 H184 N8 O8 Yb4 -","4","1","","Walter, Marc D.; Berg, David J.; Andersen, Richard A.","Coordination of 1,4-Diazabutadiene Ligands to Decamethylytterbocene: Additional Examples of Spin Coupling in Ytterbocene Complexes","Organometallics","2007","26","9","2296","","10.1021/om0610142","","","0.71069","MoKα","","0.1","0.0542","","","0.1108","0.1261","","","","","","0.988","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072769","16.8549","0.0007","25.3171","0.0011","17.1689","0.0007","90","","107.969","0.001","90","","6968.9","0.5","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C121 H126 Na6 O38 P10 Sn7 -","- C121 H114 Na6 O38 P10 Sn7 -","- C242 H228 Na12 O76 P20 Sn14 -","2","0.5","","Song, Shu-Yan; Ma, Jian-Fang; Yang, Jin; Gao, Li-Li; Su, Zhong-Min","Synthesis of an Organotin Oligomer Containing a Heptanuclear Tin Phosphonate Cluster by Debenzylation Reactions: X-ray Crystal Structure of {Na6(CH3OH)2(H2O)}- {[(BzSn)3(PhPO3)5(μ3-O)(CH3O)]2Bz2Sn}·CH3OH","Organometallics","2007","26","8","2125","","10.1021/om061015u","","","0.71073","MoKα","","0.1697","0.0773","","","0.1393","0.1713","","","","","","1.014","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072770","10.5516","0.0004","27.6809","0.001","9.4129","0.0004","90","","99.062","0.001","90","","2714.98","0.18","198","2","198","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Cp*Os(PPh3)H4][BF4]","","","- C28 H34 B F4 Os P -","- C28 H34 B F4 Os P -","- C112 H136 B4 F16 Os4 P4 -","4","1","","Gross, Christopher L.; Girolami, Gregory S.","Synthesis and NMR Studies of [(C5Me5)Os(L)H2(H2)+] Complexes. Evidence of the Adoption of Different Structures by a Dihydrogen Complex in Solution and the Solid State","Organometallics","2007","26","7","1658","","10.1021/om061017e","","","0.71073","MoKα","","0.057","0.0377","","0.0863","","0.0746","","","1.127","","","1.105","","","","has coordinates","209531","2020-10-21","18:00:00",""
"4072771","8.9295","0.0002","9.7179","0.0001","17.1819","0.0001","94.114","0.001","90.034","0.001","101.369","0.001","1457.79","0.04","199","2","199","2","","","","","","","","6","P -1","-P 1","2","[Cp*Os(PCy3)H4][BF4]","","","- C28 H52 B F4 Os P -","- C28 H52 B F4 Os P -","- C56 H104 B2 F8 Os2 P2 -","2","1","","Gross, Christopher L.; Girolami, Gregory S.","Synthesis and NMR Studies of [(C5Me5)Os(L)H2(H2)+] Complexes. Evidence of the Adoption of Different Structures by a Dihydrogen Complex in Solution and the Solid State","Organometallics","2007","26","7","1658","","10.1021/om061017e","","","0.71073","MoKα","","0.0411","0.033","","","0.0702","0.0752","","","","","","1.081","","","","has coordinates","209531","2020-10-21","18:00:00",""
"4072772","17.6989","0.0007","10.7553","0.0004","17.5032","0.0005","90","","117.217","0.002","90","","2962.96","0.19","183","2","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H47 Ca N O3 Si2 -","- C24 H47 Ca N O3 Si2 -","- C96 H188 Ca4 N4 O12 Si8 -","4","1","","Gärtner, Martin; Görls, Helmar; Westerhausen, Matthias","Heteroleptic Phenylcalcium Derivatives via Metathesis Reactions of PhCa(thf)4I with Potassium Compounds","Organometallics","2007","26","4","1077","","10.1021/om061021q","","","0.71073","MoKα","","0.1174","0.0649","","","0.1623","0.1906","","","","","","1.024","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072773","11.1262","0.0002","12.4878","0.0002","27.3473","0.0005","87.823","0.001","88.844","0.001","86.701","0.001","3790.03","0.11","183","2","183","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H51 Ca O4.5 P -","- C36 H51 Ca O4.5 P -","- C144 H204 Ca4 O18 P4 -","4","2","","Gärtner, Martin; Görls, Helmar; Westerhausen, Matthias","Heteroleptic Phenylcalcium Derivatives via Metathesis Reactions of PhCa(thf)4I with Potassium Compounds","Organometallics","2007","26","4","1077","","10.1021/om061021q","","","0.71073","MoKα","","0.1361","0.0977","","","0.2845","0.3188","","","","","","1.044","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072774","13.4391","0.0006","9.6266","0.0007","14.2774","0.0011","90","","110.187","0.004","90","","1733.6","0.2","183","2","183","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H26 Ca O2 -","- C18 H26 Ca O2 -","- C72 H104 Ca4 O8 -","4","0.5","","Gärtner, Martin; Görls, Helmar; Westerhausen, Matthias","Heteroleptic Phenylcalcium Derivatives via Metathesis Reactions of PhCa(thf)4I with Potassium Compounds","Organometallics","2007","26","4","1077","","10.1021/om061021q","","","0.71073","MoKα","","0.0717","0.0538","","","0.1353","0.1484","","","","","","1.029","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072775","13.5359","0.0008","22.616","0.002","9.1929","0.0008","90","","90","","90","","2814.2","0.4","183","2","183","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C14 H20 Ca O2 -","- C14 H20 Ca O2 -","- C112 H160 Ca8 O16 -","8","0.5","","Gärtner, Martin; Görls, Helmar; Westerhausen, Matthias","Heteroleptic Phenylcalcium Derivatives via Metathesis Reactions of PhCa(thf)4I with Potassium Compounds","Organometallics","2007","26","4","1077","","10.1021/om061021q","","","0.71073","MoKα","","0.0502","0.0461","","","0.1215","0.1246","","","","","","1.061","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072776","26.112","0.005","15.678","0.003","15.041","0.003","90","","90","","90","","6158","2","183","2","183","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C58 H74 Ca2 I N3 O6 -","- C58 H74 Ca2 I N3 O6 -","- C232 H296 Ca8 I4 N12 O24 -","4","0.5","","Gärtner, Martin; Görls, Helmar; Westerhausen, Matthias","Heteroleptic Phenylcalcium Derivatives via Metathesis Reactions of PhCa(thf)4I with Potassium Compounds","Organometallics","2007","26","4","1077","","10.1021/om061021q","","","0.71073","MoKα","","0.1201","0.0844","","","0.2121","0.2319","","","","","","1.014","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072777","13.3626","0.0004","13.9814","0.0003","21.421","0.0006","82.71","0.001","75.234","0.001","64.449","0.001","3490.74","0.16","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","","","- C68 H90 Ca5 O6 -","- C68 H90 Ca5 O6 -","- C136 H180 Ca10 O12 -","2","1","","Gärtner, Martin; Görls, Helmar; Westerhausen, Matthias","Heteroleptic Phenylcalcium Derivatives via Metathesis Reactions of PhCa(thf)4I with Potassium Compounds","Organometallics","2007","26","4","1077","","10.1021/om061021q","","","0.71073","MoKα","","0.1194","0.0736","","","0.1968","0.2321","","","","","","1.011","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072778","20.0449","0.0002","12.031","0.0001","25.3155","0.0002","90","","110.35","","90","","5724.05","0.09","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","cis-dicarbonyl bis(diphenylphosphino)methane(acetyl)methyl osmium(II)","","- C30 H28 O3 Os P2 -","- C30 H28 O3 Os P2 -","- C240 H224 O24 Os8 P16 -","8","1","","Overett, Matthew J.; Su, Hong; Moss, John R.","Reaction Pathways forfac-Os(CO)3(MeCN)Me2with Mono- and Bidentate Ligands","Organometallics","2007","26","5","1256","","10.1021/om061022i","","","0.7107","MoKα","","0.0618","0.0275","","","0.0374","0.0444","","","","","","1.051","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072779","17.0882","0.0001","17.2902","0.0002","12.5953","0.0002","90","","98.5","0.03","90","","3680.5","0.3","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","u-bis(diphenylphosphino)propane bis(dimethyltricarbonyl osmium(II)]","","- C37 H38 O6 Os2 P2 -","- C37 H38 O6 Os2 P2 -","- C148 H152 O24 Os8 P8 -","4","1","","Overett, Matthew J.; Su, Hong; Moss, John R.","Reaction Pathways forfac-Os(CO)3(MeCN)Me2with Mono- and Bidentate Ligands","Organometallics","2007","26","5","1256","","10.1021/om061022i","","","0.71073","MoKα","","0.0552","0.0306","","","0.0511","0.0568","","","","","","1.077","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072780","9.6232","0.0004","11.1381","0.0005","24.2794","0.001","90","","90","","90","","2602.37","0.19","273","2","273","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C27 H29 Cl N O3 P Pd -","- C27 H29 Cl N O3 P Pd -","- C108 H116 Cl4 N4 O12 P4 Pd4 -","4","1","","Doherty, Mark D.; Trudeau, Stéphane; White, Peter S.; Morken, James P.; Brookhart, Maurice","Ethylene Oligomerization Catalyzed by a Unique Phosphine−Oxazoline Palladium(II) Complex. Propagation and Chain Transfer Mechanisms","Organometallics","2007","26","5","1261","","10.1021/om061025v","","","0.71073","MoKα","","0.0438","0.0378","","","0.0867","0.0896","","","","","","1.063","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072781","13.245","0.018","10.76","0.011","17.492","0.012","90","","102.08","0.08","90","","2438","5","271","2","571","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 Cl3 N O P Pd -","- C23 H23 Cl3 N O P Pd -","- C92 H92 Cl12 N4 O4 P4 Pd4 -","4","1","","Doherty, Mark D.; Trudeau, Stéphane; White, Peter S.; Morken, James P.; Brookhart, Maurice","Ethylene Oligomerization Catalyzed by a Unique Phosphine−Oxazoline Palladium(II) Complex. Propagation and Chain Transfer Mechanisms","Organometallics","2007","26","5","1261","","10.1021/om061025v","","","0.71073","MoKα","","0.0399","0.0347","","","0.0821","0.0844","","","","","","1.139","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072782","21.6997","0.0011","12.2426","0.0006","24.9387","0.0013","90","","94.546","0.002","90","","6604.4","0.6","130","2","130","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C74 H90 B O6 Si2 Y -","- C74 H90 B O6 Si2 Y -","- C296 H360 B4 O24 Si8 Y4 -","4","1","","Nakajima, Yumiko; Okuda, Jun","Reactivity of Monocationic Bis(alkyl) and Dicationic Mono(alkyl) Yttrium Complexes toward Ketones and Carbon Dioxide","Organometallics","2007","26","5","1270","","10.1021/om0610290","","","0.71069","MoKα","","0.0891","0.0504","","","0.104","0.1179","","","","","","1.021","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072783","12.4231","0.001","13.6526","0.0011","29.791","0.002","90","","93.001","0.002","90","","5045.9","0.7","130","2","130","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C100 H148 B2 O16 Si4 Y2 -","- C100 H148 B2 O16 Si4 Y2 -","- C200 H296 B4 O32 Si8 Y4 -","2","0.5","","Nakajima, Yumiko; Okuda, Jun","Reactivity of Monocationic Bis(alkyl) and Dicationic Mono(alkyl) Yttrium Complexes toward Ketones and Carbon Dioxide","Organometallics","2007","26","5","1270","","10.1021/om0610290","","","0.71073","MoKα","","0.1008","0.0548","","","0.1242","0.1416","","","","","","1.005","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072784","29.708","0.002","13.3582","0.0011","23.4492","0.0019","90","","92.171","0.002","90","","9299","1.2","130","2","130","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C85 H110 B2 Cl2 F8 O16 Si4 Y2 -","- C85 H110 B2 Cl2 F8 O16 Si4 Y2 -","- C340 H440 B8 Cl8 F32 O64 Si16 Y8 -","4","0.5","","Nakajima, Yumiko; Okuda, Jun","Reactivity of Monocationic Bis(alkyl) and Dicationic Mono(alkyl) Yttrium Complexes toward Ketones and Carbon Dioxide","Organometallics","2007","26","5","1270","","10.1021/om0610290","","","0.71069","MoKα","","0.0973","0.0506","","","0.1151","0.1341","","","","","","1.014","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072785","10.6632","0.0019","23.173","0.004","16.987","0.003","90","","90.103","0.003","90","","4197.5","1.3","123","2","123","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","compound (2)","","","- C34 H45 B Cl3 Ir N6 O14 -","- C34 H45 B Cl3 Ir N6 O14 -","- C136 H180 B4 Cl12 Ir4 N24 O56 -","4","1","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Santos, Laura L.; Álvarez, Eleuterio; Salazar, Verónica; Mereiter, Kurt; Oñate, Enrique","Metallacycloheptatrienes of Iridium(III): Synthesis and Reactivity","Organometallics","2007","26","14","3403","","10.1021/om061036o","","","0.71073","MoKα","","0.0369","0.032","","","0.0686","0.0706","","","","","","1.072","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072786","13.911","0.001","14.533","0.001","16.558","0.001","90","","90","","90","","3347.5","0.4","123","2","123","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","compound (3)","","","- C27 H38.5 B Ir N6 O10.25 -","- C27 H38 B Ir N6 O10.261 -","- C108 H152 B4 Ir4 N24 O41.044 -","4","1","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Santos, Laura L.; Álvarez, Eleuterio; Salazar, Verónica; Mereiter, Kurt; Oñate, Enrique","Metallacycloheptatrienes of Iridium(III): Synthesis and Reactivity","Organometallics","2007","26","14","3403","","10.1021/om061036o","","","0.71073","MoKα","","0.0381","0.0301","","","0.0682","0.0723","","","","","","1.067","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072787","7.9871","0.0005","21.0604","0.0014","21.0566","0.0014","90","","95.072","0.001","90","","3528.1","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","compound (8)","","","- C33 H38 B Ir N6 O9 -","- C33 H38 B Ir N6 O9 -","- C132 H152 B4 Ir4 N24 O36 -","4","1","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Santos, Laura L.; Álvarez, Eleuterio; Salazar, Verónica; Mereiter, Kurt; Oñate, Enrique","Metallacycloheptatrienes of Iridium(III): Synthesis and Reactivity","Organometallics","2007","26","14","3403","","10.1021/om061036o","","","0.71073","MoKα","","0.0523","0.0351","","","0.0623","0.0658","","","","","","0.919","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072788","11.2272","0.0014","18.882","0.002","19.527","0.003","75.816","0.002","78.055","0.002","75.87","0.002","3844","0.9","100","2","100","2","","","","","","","","7","P -1","-P 1","2","compound (11)","","","- C33.25 H40.5 B Cl0.5 Ir N6 O14 -","- C33.25 H40.5 B Cl0.5 Ir N6 O14 -","- C133 H162 B4 Cl2 Ir4 N24 O56 -","4","2","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Santos, Laura L.; Álvarez, Eleuterio; Salazar, Verónica; Mereiter, Kurt; Oñate, Enrique","Metallacycloheptatrienes of Iridium(III): Synthesis and Reactivity","Organometallics","2007","26","14","3403","","10.1021/om061036o","","","0.71073","MoKα","","0.091","0.042","","","0.0661","0.0731","","","","","","0.782","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4072789","10.8289","0.0007","31.296","0.002","11.2884","0.0007","90","","103.605","0.001","90","","3718.3","0.4","100","0.2","100","0.2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","compound (12)","","","- C34 H40 B Cl2 Ir N6 O10 -","- C34 H40 B Cl2 Ir N6 O10 -","- C136 H160 B4 Cl8 Ir4 N24 O40 -","4","1","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Santos, Laura L.; Álvarez, Eleuterio; Salazar, Verónica; Mereiter, Kurt; Oñate, Enrique","Metallacycloheptatrienes of Iridium(III): Synthesis and Reactivity","Organometallics","2007","26","14","3403","","10.1021/om061036o","","","0.71073","MoKα","","0.0699","0.0446","","","0.0905","0.0971","","","","","","0.996","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072790","10.439","0.003","35.341","0.01","17.675","0.005","90","","98.729","0.005","90","","6445","3","297","2","297","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","compound (13)","","","- C30 H36 B Ir N6 O7 -","- C30 H36 B Ir N6 O7 -","- C240 H288 B8 Ir8 N48 O56 -","8","2","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Santos, Laura L.; Álvarez, Eleuterio; Salazar, Verónica; Mereiter, Kurt; Oñate, Enrique","Metallacycloheptatrienes of Iridium(III): Synthesis and Reactivity","Organometallics","2007","26","14","3403","","10.1021/om061036o","","","0.71073","MoKα","","0.052","0.0364","","","0.0699","0.0746","","","","","","1.023","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072791","17.0603","0.0007","9.7334","0.0004","18.5643","0.0007","90","","94.062","0.001","90","","3074.9","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","compound (18)","","","- C27 H38 B Ir N6 O8 -","- C27 H38 B Ir N6 O8 -","- C108 H152 B4 Ir4 N24 O32 -","4","1","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Santos, Laura L.; Álvarez, Eleuterio; Salazar, Verónica; Mereiter, Kurt; Oñate, Enrique","Metallacycloheptatrienes of Iridium(III): Synthesis and Reactivity","Organometallics","2007","26","14","3403","","10.1021/om061036o","","","0.71073","MoKα","","0.0215","0.0195","","","0.043","0.0436","","","","","","1.131","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072792","11.1322","0.0015","14.1435","0.0019","16.532","0.002","90","","102.732","0.002","90","","2538.9","0.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H47 N Ni P2 -","- C23 H47 N Ni P2 -","- C92 H188 N4 Ni4 P8 -","4","1","","Acosta-Ramírez, Alberto; Flores-Gaspar, Areli; Muñoz-Hernández, Miguel; Arévalo, Alma; Jones, William D.; García, Juventino J.","Nickel Complexes Involved in the Isomerization of 2-Methyl-3-butenenitrile","Organometallics","2007","26","7","1712","","10.1021/om061037g","","","0.71073","MoKα","","0.0349","0.0311","","","0.0856","0.0896","","","","","","0.679","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072793","18.886","0.004","10.536","0.002","12.667","0.003","90","","91.843","0.004","90","","2519.2","0.9","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Ni(dtbpe)(2-pentenenitrile)","","","- C23 H46 N Ni P2 -","- C23 H40 N Ni P2 -","- C92 H160 N4 Ni4 P8 -","4","0.5","","Acosta-Ramírez, Alberto; Flores-Gaspar, Areli; Muñoz-Hernández, Miguel; Arévalo, Alma; Jones, William D.; García, Juventino J.","Nickel Complexes Involved in the Isomerization of 2-Methyl-3-butenenitrile","Organometallics","2007","26","7","1712","","10.1021/om061037g","","","0.71073","MoKα","","0.0808","0.0562","","","0.1322","0.143","","","","","","1","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072794","7.4217","0.0018","9.326","0.002","10.718","0.003","93.263","0.004","108.721","0.004","101.016","0.004","684","0.3","100","2","100","2","","","","","","","","5","P 1","P 1","1","JAA25-3","","","- C28 H48 N2 Ni P2 -","- C28 H48 N2 Ni P2 -","- C28 H48 N2 Ni P2 -","1","1","","Acosta-Ramírez, Alberto; Flores-Gaspar, Areli; Muñoz-Hernández, Miguel; Arévalo, Alma; Jones, William D.; García, Juventino J.","Nickel Complexes Involved in the Isomerization of 2-Methyl-3-butenenitrile","Organometallics","2007","26","7","1712","","10.1021/om061037g","","","0.71073","MoKα","","0.0353","0.0346","","","0.0833","0.0837","","","","","","1.062","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072795","33.885","0.006","12.122","0.002","31.117","0.006","90","","110.123","0.002","90","","12001","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H30 Li N2 P -","- C20 H30 Li N2 P -","- C480 H720 Li24 N48 P24 -","24","3","","Wang, Zhong-Xia; Qi, Chun-Yan","Lithium, Magnesium, and Zinc Iminophosphorano(8-quinolyl)methanide Complexes: Syntheses, Characterization, and Activity in ε-Caprolactone Polymerization","Organometallics","2007","26","9","2243","","10.1021/om0610400","","","0.71073","MoKα","","0.1894","0.0695","","","0.1544","0.2052","","","","","","0.988","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072796","7.951","0.009","9.184","0.011","16.791","0.019","95.46","0.02","91.68","0.019","94.724","0.019","1216","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H35 Mg N2 P -","- C22 H35 Mg N2 P -","- C44 H70 Mg2 N4 P2 -","2","1","","Wang, Zhong-Xia; Qi, Chun-Yan","Lithium, Magnesium, and Zinc Iminophosphorano(8-quinolyl)methanide Complexes: Syntheses, Characterization, and Activity in ε-Caprolactone Polymerization","Organometallics","2007","26","9","2243","","10.1021/om0610400","","","0.71073","MoKα","","0.0974","0.0522","","","0.1221","0.1466","","","","","","1.024","","","","has coordinates,has disorder","178616","2020-10-21","18:00:00",""
"4072797","21.705","0.005","9.564","0.002","21.744","0.006","90","","99.302","0.004","90","","4454.4","1.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H30 Cl N2 P Zn -","- C20 H30 Cl N2 P Zn -","- C160 H240 Cl8 N16 P8 Zn8 -","8","2","","Wang, Zhong-Xia; Qi, Chun-Yan","Lithium, Magnesium, and Zinc Iminophosphorano(8-quinolyl)methanide Complexes: Syntheses, Characterization, and Activity in ε-Caprolactone Polymerization","Organometallics","2007","26","9","2243","","10.1021/om0610400","","","0.71073","MoKα","","0.0968","0.049","","","0.122","0.1502","","","","","","1.054","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072798","9.5809","0.0008","14.2373","0.0012","16.3071","0.0014","90","","90","","90","","2224.4","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H33 N2 P Zn -","- C21 H33 N2 P Zn -","- C84 H132 N8 P4 Zn4 -","4","1","","Wang, Zhong-Xia; Qi, Chun-Yan","Lithium, Magnesium, and Zinc Iminophosphorano(8-quinolyl)methanide Complexes: Syntheses, Characterization, and Activity in ε-Caprolactone Polymerization","Organometallics","2007","26","9","2243","","10.1021/om0610400","","","0.71073","MoKα","","0.0362","0.0279","","","0.067","0.07","","","","","","1.01","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072799","14.0317","0.0005","7.0962","0.0003","18.1574","0.0007","90","","110.574","0.001","90","","1692.65","0.11","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H22 Cl Ir O -","- C18 H22 Cl Ir O -","- C72 H88 Cl4 Ir4 O4 -","4","1","","Sridevi, Venugopal Shanmugham; Fan, Wai Yip; Leong, Weng Kee","[Cp*IrCl2]2-Assisted C⋮C Bond Cleavage with Water: An Experimental and Computational Study","Organometallics","2007","26","5","1173","","10.1021/om0610445","","","0.71073","MoKα","","0.0493","0.0463","","","0.0942","0.0955","","","","","","1.292","","","","has coordinates","178616","2020-10-21","18:00:00",""
"4072800","7.5593","0.0005","10.4598","0.0008","13.2612","0.0009","98.916","0.002","103.329","0.002","98.601","0.002","989.07","0.12","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H26 Cl Fe Ir O -","- C22 H26 Cl Fe Ir O -","- C44 H52 Cl2 Fe2 Ir2 O2 -","2","1","","Sridevi, Venugopal Shanmugham; Fan, Wai Yip; Leong, Weng Kee","[Cp*IrCl2]2-Assisted C⋮C Bond Cleavage with Water: An Experimental and Computational Study","Organometallics","2007","26","5","1173","","10.1021/om0610445","","","0.71073","MoKα","","0.0741","0.0676","","","0.1304","0.133","","","","","","1.318","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072801","7.0618","0.0006","10.9572","0.0009","12.0565","0.001","94.249","0.002","105.388","0.002","96.32","0.002","888.78","0.13","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H26 Cl Ir O -","- C18 H26 Cl Ir O -","- C36 H52 Cl2 Ir2 O2 -","2","1","","Sridevi, Venugopal Shanmugham; Fan, Wai Yip; Leong, Weng Kee","[Cp*IrCl2]2-Assisted C⋮C Bond Cleavage with Water: An Experimental and Computational Study","Organometallics","2007","26","5","1173","","10.1021/om0610445","","","0.71073","MoKα","","0.0318","0.0285","","","0.0644","0.0658","","","","","","1.062","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072802","7.6284","0.001","8.0215","0.0011","12.0085","0.0016","77.503","0.002","80.148","0.002","66.855","0.002","656.63","0.15","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H18 Cl Ir O -","- C12 H18 Cl Ir O -","- C24 H36 Cl2 Ir2 O2 -","2","1","","Sridevi, Venugopal Shanmugham; Fan, Wai Yip; Leong, Weng Kee","[Cp*IrCl2]2-Assisted C⋮C Bond Cleavage with Water: An Experimental and Computational Study","Organometallics","2007","26","5","1173","","10.1021/om0610445","","","0.71073","MoKα","","0.0214","0.0202","","","0.0501","0.0508","","","","","","1.049","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072803","11.3769","0.0017","19.318","0.003","15.83","0.002","90","","108.474","0.002","90","","3299.8","0.8","294","2","294","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","TpRu(PPh3)(H2O)(NHC(O)CH3)","","- C30 H32 B Cl2 N7 O2 P Ru -","- C30 H32 B Cl2 N7 O2 P Ru -","- C120 H128 B4 Cl8 N28 O8 P4 Ru4 -","4","1","","Leung, Chung Wing; Zheng, Wenxu; Wang, Dexian; Ng, Siu Man; Yeung, Chi Hung; Zhou, Zhongyuan; Lin, Zhenyang; Lau, Chak Po","Catalytic H/D Exchange between Organic Compounds and D2O with TpRu(PPh3)(CH3CN)H (Tp = hydro(trispyrazolyl)borate). Reaction of TpRu(PPh3)(CH3CN)H with Water to Form Acetamido Complex TpRu(PPh3)(H2O)(NHC(O)CH3)","Organometallics","2007","26","8","1924","","10.1021/om061045x","","","0.71073","MoKα","","0.0463","0.0371","","","0.103","0.1107","","","","","","1.001","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4072804","9.011","0.002","13.302","0.003","21.558","0.005","93.819","0.006","97.112","0.006","99.438","0.006","2519.5","1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H22 N4 O4 Pd S2 -","- C26 H22 N4 O4 Pd S2 -","- C104 H88 N16 O16 Pd4 S8 -","4","2","","Dick, Allison R.; Remy, Matthew S.; Kampf, Jeff W.; Sanford, Melanie S.","Carbon−Nitrogen Bond-Forming Reactions of Palladacycles with Hypervalent Iodine Reagents","Organometallics","2007","26","6","1365","","10.1021/om061052l","","","0.7758","","","0.116","0.0814","","","0.1742","0.1876","","","","","","1.093","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072805","31.742","0.002","9.146","0.0006","19.6641","0.0012","90","","127.054","0.001","90","","4556","0.5","123","2","123","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C25 H20 Cl N3 O2 Pd S -","- C25 H20 Cl N3 O2 Pd S -","- C200 H160 Cl8 N24 O16 Pd8 S8 -","8","1","","Dick, Allison R.; Remy, Matthew S.; Kampf, Jeff W.; Sanford, Melanie S.","Carbon−Nitrogen Bond-Forming Reactions of Palladacycles with Hypervalent Iodine Reagents","Organometallics","2007","26","6","1365","","10.1021/om061052l","","","0.71073","MoKα","","0.0676","0.0375","","","0.0822","0.0942","","","","","","1.029","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072806","8.1996","0.0012","24.564","0.004","15.512","0.002","90","","95.884","0.003","90","","3107.9","0.8","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","compound 4.CH2Cl2","","","- C26 H38 B Cl2 Ir N6 O4 -","- C26 H38 B Cl2 Ir N6 O4 -","- C104 H152 B4 Cl8 Ir4 N24 O16 -","4","1","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Mereiter, Kurt","Reactivity of the Iridium(I) Alkene/Alkyne Complex TpMe2Ir(C2H4)(MeO2CC⋮CCO2Me)","Organometallics","2007","26","13","3120","","10.1021/om061056q","","","0.71073","MoKα","","0.0713","0.0536","","","0.119","0.1269","","","","","","1.043","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072807","13.7032","0.0012","13.935","0.0012","15.1568","0.0014","90","","90","","90","","2894.3","0.4","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","compound 6","","","- C23 H32 B Cl Ir N7 O4 -","- C23 H32 B Cl Ir N7 O4 -","- C92 H128 B4 Cl4 Ir4 N28 O16 -","4","1","","Paneque, Margarita; Posadas, Cristina M.; Poveda, Manuel L.; Rendón, Nuria; Mereiter, Kurt","Reactivity of the Iridium(I) Alkene/Alkyne Complex TpMe2Ir(C2H4)(MeO2CC⋮CCO2Me)","Organometallics","2007","26","13","3120","","10.1021/om061056q","","","0.71073","MoKα","","0.0639","0.0381","","","0.0626","0.068","","","","","","0.996","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072808","25.2082","0.0012","9.8032","0.0005","16.0304","0.0008","90","","90","","90","","3961.4","0.3","100","2","100","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C43 H57 Cl2 F2 N2 P Ru -","- C43 H57 Cl2 F2 N2 P Ru -","- C172 H228 Cl8 F8 N8 P4 Ru4 -","4","1","","Vougioukalakis, Georgios C.; Grubbs, Robert H.","Ruthenium Olefin Metathesis Catalysts Bearing anN-Fluorophenyl-N-Mesityl-Substituted UnsymmetricalN-Heterocyclic Carbene","Organometallics","2007","26","9","2469","","10.1021/om0610593","","","0.71073","MoKα","","0.0864","0.0607","","","0.0978","0.1016","","","","","","1.823","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4072809","17.0577","0.0005","10.1643","0.0003","17.1021","0.0005","90","","113.531","0.001","90","","2718.59","0.14","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 Cl2 F2 N2 O Ru -","- C28 H30 Cl2 F2 N2 O Ru -","- C112 H120 Cl8 F8 N8 O4 Ru4 -","4","1","","Vougioukalakis, Georgios C.; Grubbs, Robert H.","Ruthenium Olefin Metathesis Catalysts Bearing anN-Fluorophenyl-N-Mesityl-Substituted UnsymmetricalN-Heterocyclic Carbene","Organometallics","2007","26","9","2469","","10.1021/om0610593","","","0.71073","MoKα","","0.0702","0.0364","","","0.0662","0.0718","","","","","","1.145","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4072810","18.0911","0.0009","11.561","0.0006","18.9745","0.001","90","","98.248","0.001","90","","3927.5","0.4","187","2","187","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C49 H46 N Ni O2 P -","- C49 H46 N Ni O2 P -","- C196 H184 N4 Ni4 O8 P4 -","4","1","","Hu, Tao; Li, Yan-Guo; Liu, Jing-Yu; Li, Yue-Sheng","Syntheses and Ethylene Polymerization Behavior of Supported Salicylaldimine-Based Neutral Nickel(II) Catalysts","Organometallics","2007","26","10","2609","","10.1021/om061061u","","","0.71073","MoKα","","0.0781","0.0508","","","0.1029","0.1152","","","","","","0.986","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072811","10.109","0.003","34.169","0.01","15.642","0.004","90","","94.89","0.02","90","","5383","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H63 N2 Ni O2 P -","- C62 H63 N2 Ni O2 P -","- C248 H252 N8 Ni4 O8 P4 -","4","1","","Hu, Tao; Li, Yan-Guo; Liu, Jing-Yu; Li, Yue-Sheng","Syntheses and Ethylene Polymerization Behavior of Supported Salicylaldimine-Based Neutral Nickel(II) Catalysts","Organometallics","2007","26","10","2609","","10.1021/om061061u","","","0.71073","MoKα","","0.2587","0.049","","","0.0327","0.0493","","","","","","0.58","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072812","7.3096","0.0003","23.3352","0.0012","19.5945","0.0008","90","","90.374","0.003","90","","3342.2","0.3","110","2","110","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,1'-Bis(N-phenylamino)-ferrocen","","- C22 H20 Fe N2 -","- C22 H20 Fe N2 -","- C176 H160 Fe8 N16 -","8","2","","Siemeling, Ulrich; Auch, Tanja-Corinna; Tomm, Sabine; Fink, Heinrich; Bruhn, Clemens; Neumann, Beate; Stammler, Hans-Georg","Zirconium Chelates of a Bulky Ferrocene-Based Diamido Ligand","Organometallics","2007","26","4","1112","","10.1021/om061063e","","","0.71073","MoKα","","0.0405","0.0253","","","0.0554","0.0578","","","","","","0.901","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072813","10.7844","0.0006","15.6589","0.0009","15.9946","0.0008","90.26","0.004","100.2","0.004","98.973","0.004","2624.4","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","1,1'-Bis(N-(2,4,6-triisopropyl)-amino)-ferrocen)","","- C40 H56 Fe N2 -","- C40 H56 Fe N2 -","- C120 H168 Fe3 N6 -","3","1.5","","Siemeling, Ulrich; Auch, Tanja-Corinna; Tomm, Sabine; Fink, Heinrich; Bruhn, Clemens; Neumann, Beate; Stammler, Hans-Georg","Zirconium Chelates of a Bulky Ferrocene-Based Diamido Ligand","Organometallics","2007","26","4","1112","","10.1021/om061063e","","","0.71073","MoKα","","0.1023","0.0779","","","0.1668","0.1724","","","","","","1.188","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072814","12.2718","0.0009","14.0496","0.001","15.2858","0.001","104.515","0.005","102.502","0.005","95.83","0.006","2456.8","0.3","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C115 H143 Fe2 N4 Zr2 -","- C115 H143 Fe2 N4 Zr2 -","- C115 H143 Fe2 N4 Zr2 -","1","0.5","","Siemeling, Ulrich; Auch, Tanja-Corinna; Tomm, Sabine; Fink, Heinrich; Bruhn, Clemens; Neumann, Beate; Stammler, Hans-Georg","Zirconium Chelates of a Bulky Ferrocene-Based Diamido Ligand","Organometallics","2007","26","4","1112","","10.1021/om061063e","","","0.71073","MoKα","","0.0487","0.0407","","","0.106","0.1093","","","","","","1.017","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072815","18.752","0.0002","9.954","0.0001","25.174","0.0003","90","","96.132","0.0007","90","","4672.03","0.09","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H72 Fe N4 Zr -","- C50 H72 Fe N4 Zr -","- C200 H288 Fe4 N16 Zr4 -","4","1","","Siemeling, Ulrich; Auch, Tanja-Corinna; Tomm, Sabine; Fink, Heinrich; Bruhn, Clemens; Neumann, Beate; Stammler, Hans-Georg","Zirconium Chelates of a Bulky Ferrocene-Based Diamido Ligand","Organometallics","2007","26","4","1112","","10.1021/om061063e","","","0.71073","MoKα","","0.0656","0.0568","","","0.1232","0.1257","","","","","","1.316","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072816","11.5297","0.0004","19.4678","0.0006","29.0284","0.0009","90","","90","","90","","6515.7","0.4","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C34 H54 O2 W -","- C34 H54 O2 W -","- C272 H432 O16 W8 -","8","1","","Tonzetich, Zachary J.; Lam, Yan Choi; Müller, Peter; Schrock, Richard R.","Facile Synthesis of a Tungsten Alkylidyne Catalyst for Alkyne Metathesis","Organometallics","2007","26","3","475","","10.1021/om0610647","","","0.71073","MoKα","","0.029","0.0222","","","0.0523","0.0557","","","","","","1.048","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4072817","9.6032","0.0006","21.6943","0.0013","32.986","0.002","90","","90","","90","","6872.1","0.7","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C70 H73 N3 O6 P2 Si4 -","- C70 H73 N3 O6 P2 Si4 -","- C280 H292 N12 O24 P8 Si16 -","4","1","","Cobley, Christopher J.; Froese, Robert D. J.; Klosin, Jerzy; Qin, Cheng; Whiteker, Gregory T.; Abboud, Khalil A.","Effect of the Dihedral Angle of Biaryl-Bridged Bisphosphite Ligands on Enantioselectivity and Regioselectivity of Asymmetric Hydroformylation","Organometallics","2007","26","12","2986","","10.1021/om061065z","","","0.71073","MoKα","","0.0878","0.0441","","","0.0891","0.0985","","","","","","0.916","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072818","11.158","0.0006","12.801","0.0007","14.2385","0.0008","91.73","0.001","104.682","0.001","100.154","0.001","1930.52","0.18","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H116 O6 P2 Rh2 -","- C84 H116 O6 P2 Rh2 -","- C84 H116 O6 P2 Rh2 -","1","0.5","","Cobley, Christopher J.; Froese, Robert D. J.; Klosin, Jerzy; Qin, Cheng; Whiteker, Gregory T.; Abboud, Khalil A.","Effect of the Dihedral Angle of Biaryl-Bridged Bisphosphite Ligands on Enantioselectivity and Regioselectivity of Asymmetric Hydroformylation","Organometallics","2007","26","12","2986","","10.1021/om061065z","","","0.71073","MoKα","","0.06","0.0441","","","0.0997","0.1067","","","","","","1.019","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072819","13.2638","0.0007","21.4089","0.0011","23.2485","0.0012","90","","90","","90","","6601.7","0.6","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C73 H83 O8 P2 Rh -","- C73 H83 O8 P2 Rh -","- C292 H332 O32 P8 Rh4 -","4","1","","Cobley, Christopher J.; Froese, Robert D. J.; Klosin, Jerzy; Qin, Cheng; Whiteker, Gregory T.; Abboud, Khalil A.","Effect of the Dihedral Angle of Biaryl-Bridged Bisphosphite Ligands on Enantioselectivity and Regioselectivity of Asymmetric Hydroformylation","Organometallics","2007","26","12","2986","","10.1021/om061065z","","","0.71073","MoKα","","0.0501","0.0328","","","0.063","0.0647","","","","","","0.858","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072820","17.472","0.001","25.208","0.002","16.684","0.001","90","","90","","90","","7348.2","0.8","173","2","173","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C79 H103 O10 P2 Rh -","- C73 H91 O8 P2 Rh -","- C292 H364 O32 P8 Rh4 -","4","1","","Cobley, Christopher J.; Froese, Robert D. J.; Klosin, Jerzy; Qin, Cheng; Whiteker, Gregory T.; Abboud, Khalil A.","Effect of the Dihedral Angle of Biaryl-Bridged Bisphosphite Ligands on Enantioselectivity and Regioselectivity of Asymmetric Hydroformylation","Organometallics","2007","26","12","2986","","10.1021/om061065z","","","0.71073","MoKα","","0.0662","0.0418","","","0.0913","0.096","","","","","","0.899","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072821","13.7261","0.0009","21.6693","0.0015","23.917","0.0015","90","","90","","90","","7113.8","0.8","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C77 H75 O8 P2 Rh Si4 -","- C77 H75 O8 P2 Rh Si4 -","- C308 H300 O32 P8 Rh4 Si16 -","4","1","","Cobley, Christopher J.; Froese, Robert D. J.; Klosin, Jerzy; Qin, Cheng; Whiteker, Gregory T.; Abboud, Khalil A.","Effect of the Dihedral Angle of Biaryl-Bridged Bisphosphite Ligands on Enantioselectivity and Regioselectivity of Asymmetric Hydroformylation","Organometallics","2007","26","12","2986","","10.1021/om061065z","","","0.71073","MoKα","","0.1007","0.054","","","0.0843","0.0964","","","","","","0.913","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072822","12.2659","0.0009","28.62","0.002","26.4585","0.0019","90","","100.816","0.001","90","","9123.3","1.1","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C192 H284 O16 P4 Rh2 -","- C162.012 H213.654 O16 P4 Rh2 -","- C324.024 H427.308 O32 P8 Rh4 -","2","1","","Cobley, Christopher J.; Froese, Robert D. J.; Klosin, Jerzy; Qin, Cheng; Whiteker, Gregory T.; Abboud, Khalil A.","Effect of the Dihedral Angle of Biaryl-Bridged Bisphosphite Ligands on Enantioselectivity and Regioselectivity of Asymmetric Hydroformylation","Organometallics","2007","26","12","2986","","10.1021/om061065z","","","0.71073","MoKα","","0.0708","0.0531","","","0.1271","0.1336","","","","","","0.987","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072823","10.6388","0.0002","22.4279","0.0005","14.957","0.0003","90","","92.459","0.001","90","","3565.54","0.13","85","2","85","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C38 H32 Cl2 I Ir O2 P2 S -","- C38 H30 Cl2 I Ir O2 P2 S -","- C152 H120 Cl8 I4 Ir4 O8 P8 S4 -","4","1","","Clark, George R.; Lu, Guo-Liang; Roper, Warren R.; Wright, L. James","Stepwise Reactions of Acetylenes with Iridium Thiocarbonyl Complexes To Produce Isolable Iridacyclobutadienes and Conversion of These to either Cyclopentadienyliridium or Tethered Iridabenzene Complexes","Organometallics","2007","26","9","2167","","10.1021/om061066r","","","0.71073","MoKα","","0.0556","0.0451","","","0.1162","0.1233","","","","","","1.027","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072824","12.0872","0.0003","14.3121","0.0003","12.0945","0.0003","90","","114.59","0.001","90","","1902.52","0.08","85","2","85","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C42 H36 Cl2 I Ir P2 S -","- C42 H36 Cl2 I Ir P2 S -","- C84 H72 Cl4 I2 Ir2 P4 S2 -","2","1","","Clark, George R.; Lu, Guo-Liang; Roper, Warren R.; Wright, L. James","Stepwise Reactions of Acetylenes with Iridium Thiocarbonyl Complexes To Produce Isolable Iridacyclobutadienes and Conversion of These to either Cyclopentadienyliridium or Tethered Iridabenzene Complexes","Organometallics","2007","26","9","2167","","10.1021/om061066r","","","0.71073","MoKα","","0.0419","0.0412","","","0.1079","0.1091","","","","","","0.986","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072825","10.6941","0.0001","12.0101","0.0001","19.9108","0","85.507","0.001","83.165","0.001","80.417","0.001","2499.2","0.03","83","2","83","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H62 Cl3 Ir O3 P2 S -","- C54 H39 Cl3 Ir P2 S -","- C108 H78 Cl6 Ir2 P4 S2 -","2","1","","Clark, George R.; Lu, Guo-Liang; Roper, Warren R.; Wright, L. James","Stepwise Reactions of Acetylenes with Iridium Thiocarbonyl Complexes To Produce Isolable Iridacyclobutadienes and Conversion of These to either Cyclopentadienyliridium or Tethered Iridabenzene Complexes","Organometallics","2007","26","9","2167","","10.1021/om061066r","","","0.71073","MoKα","","0.0831","0.0772","","","0.1894","0.193","","","","","","1.128","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072826","11.9631","0.0002","11.5672","0.0002","17.7181","0.0001","90","","95.758","0.001","90","","2439.45","0.06","83","2","83","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C55 H46 Cl5 Ir P2 S -","- C55 H46 Cl5 Ir P2 S -","- C110 H92 Cl10 Ir2 P4 S2 -","2","1","","Clark, George R.; Lu, Guo-Liang; Roper, Warren R.; Wright, L. James","Stepwise Reactions of Acetylenes with Iridium Thiocarbonyl Complexes To Produce Isolable Iridacyclobutadienes and Conversion of These to either Cyclopentadienyliridium or Tethered Iridabenzene Complexes","Organometallics","2007","26","9","2167","","10.1021/om061066r","","","0.71073","MoKα","","0.0324","0.0313","","","0.0762","0.0771","","","","","","1.018","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072827","9.923","","14.469","0.0001","14.5649","0.0001","91.269","0.001","108.801","0.001","106.762","0.001","1880.14","0.03","83","2","83","2","","","","","","","","6","P -1","-P 1","2","","","","- C88 H70 Cl6 Ir2 P2 S2 -","- C88 H70 Cl6 Ir2 P2 S2 -","- C88 H70 Cl6 Ir2 P2 S2 -","1","0.5","","Clark, George R.; Lu, Guo-Liang; Roper, Warren R.; Wright, L. James","Stepwise Reactions of Acetylenes with Iridium Thiocarbonyl Complexes To Produce Isolable Iridacyclobutadienes and Conversion of These to either Cyclopentadienyliridium or Tethered Iridabenzene Complexes","Organometallics","2007","26","9","2167","","10.1021/om061066r","","","0.71073","MoKα","","0.0231","0.0208","","","0.0501","0.0514","","","","","","1.041","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072828","11.8918","0.0001","13.5695","0.0001","18.9304","0.0002","70.741","0.001","85.553","0.001","65.585","0.001","2619.74","0.05","84","2","84","2","","","","","","","","9","P -1","-P 1","2","","","","- C48 H38 Cl9 D3 I Ir O4 P2 S -","- C48 H38 Cl9 D3 I Ir O4 P2 S -","- C96 H76 Cl18 D6 I2 Ir2 O8 P4 S2 -","2","1","","Clark, George R.; Lu, Guo-Liang; Roper, Warren R.; Wright, L. James","Stepwise Reactions of Acetylenes with Iridium Thiocarbonyl Complexes To Produce Isolable Iridacyclobutadienes and Conversion of These to either Cyclopentadienyliridium or Tethered Iridabenzene Complexes","Organometallics","2007","26","9","2167","","10.1021/om061066r","","","0.71073","MoKα","","0.0348","0.0285","","","0.0644","0.0666","","","","","","1.035","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072829","12.0065","0.0004","19.2784","0.0006","22.4702","0.0008","90","","100.255","0.001","90","","5118","0.3","83","2","83","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C59.5 H52.5 Cl Ir O6 P2 S -","- C59.5 H42 Cl Ir O6 P2 S -","- C238 H168 Cl4 Ir4 O24 P8 S4 -","4","1","","Clark, George R.; Lu, Guo-Liang; Roper, Warren R.; Wright, L. James","Stepwise Reactions of Acetylenes with Iridium Thiocarbonyl Complexes To Produce Isolable Iridacyclobutadienes and Conversion of These to either Cyclopentadienyliridium or Tethered Iridabenzene Complexes","Organometallics","2007","26","9","2167","","10.1021/om061066r","","","0.71073","MoKα","","0.0306","0.0246","","","0.0534","0.0567","","","","","","1.086","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4072830","11.8206","0.0008","12.9648","0.0009","24.4701","0.0017","90","","90","","90","","3750.1","0.4","173","2","173","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C33 H31 Cl2 I3 O P2 Pt Ru -","- C33 H31 Cl2 I3 O P2 Pt Ru -","- C132 H124 Cl8 I12 O4 P8 Pt4 Ru4 -","4","1","","Serra, Daniel; Abboud, Khalil A.; Hilliard, Casie R.; McElwee-White, Lisa","Electronic Interactions in Iron- and Ruthenium-Containing Heterobimetallic Complexes: Structural and Spectroscopic Investigations","Organometallics","2007","26","13","3085","","10.1021/om0610750","","","0.71073","MoKα","","0.0264","0.0246","","","0.0582","0.0587","","","","","","1.054","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072831","13.7016","0.0012","14.9761","0.0013","18.7778","0.0016","90","","99.736","0.001","90","","3797.6","0.6","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C33 H31 Cl4 Fe I3 O P2 Pd -","- C31 H27 Fe I3 O P2 Pd -","- C124 H108 Fe4 I12 O4 P8 Pd4 -","4","1","","Serra, Daniel; Abboud, Khalil A.; Hilliard, Casie R.; McElwee-White, Lisa","Electronic Interactions in Iron- and Ruthenium-Containing Heterobimetallic Complexes: Structural and Spectroscopic Investigations","Organometallics","2007","26","13","3085","","10.1021/om0610750","","","0.71073","MoKα","","0.0812","0.0507","","","0.1201","0.1308","","","","","","0.979","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072832","13.7041","0.0007","14.9191","0.0007","18.9157","0.0009","90","","97.924","0.001","90","","3830.4","0.3","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C33 H31 Cl4 I3 O P2 Pd Ru -","- C31 H27 I3 O P2 Pd Ru -","- C124 H108 I12 O4 P8 Pd4 Ru4 -","4","1","","Serra, Daniel; Abboud, Khalil A.; Hilliard, Casie R.; McElwee-White, Lisa","Electronic Interactions in Iron- and Ruthenium-Containing Heterobimetallic Complexes: Structural and Spectroscopic Investigations","Organometallics","2007","26","13","3085","","10.1021/om0610750","","","0.71073","MoKα","","0.0634","0.0318","","","0.0604","0.0638","","","","","","0.796","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072833","13.7053","0.0009","14.9673","0.0009","18.7364","0.0012","90","","99.602","0.001","90","","3789.6","0.4","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C33 H31 Cl4 Fe I3 O P2 Pt -","- C31 H27 Fe I3 O P2 Pt -","- C124 H108 Fe4 I12 O4 P8 Pt4 -","4","1","","Serra, Daniel; Abboud, Khalil A.; Hilliard, Casie R.; McElwee-White, Lisa","Electronic Interactions in Iron- and Ruthenium-Containing Heterobimetallic Complexes: Structural and Spectroscopic Investigations","Organometallics","2007","26","13","3085","","10.1021/om0610750","","","0.71073","MoKα","","0.0732","0.0447","","","0.0978","0.1035","","","","","","0.899","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072834","10.367","0.003","12.976","0.003","14.7","0.004","100.509","0.004","95.774","0.005","92.632","0.004","1930.3","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H22 N2 O15 Ru7 -","- C33 H22 N2 O15 Ru7 -","- C66 H44 N4 O30 Ru14 -","2","1","","Cabeza, Javier A.; del Río, Ignacio; Fernández-Colinas, José M.; García-Álvarez, Pablo; Miguel, Daniel","Reactivity of Indene, Fluorene, Azulene, and Acenaphthylene with a Basal-Edge-Bridged Square-Pyramidal Hexaruthenium Dihydride","Organometallics","2007","26","6","1414","","10.1021/om061078c","","","0.71073","MoKα","","0.0364","0.0303","","","0.0773","0.0816","","","","","","1.054","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072835","10.443","0.002","20.009","0.005","18.511","0.004","90","","98.114","0.004","90","","3829.2","1.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32.5 H19 Cl0.5 N2 O13 Ru6 -","- C32.5 H19 Cl0.5 N2 O13 Ru6 -","- C130 H76 Cl2 N8 O52 Ru24 -","4","1","","Cabeza, Javier A.; del Río, Ignacio; Fernández-Colinas, José M.; García-Álvarez, Pablo; Miguel, Daniel","Reactivity of Indene, Fluorene, Azulene, and Acenaphthylene with a Basal-Edge-Bridged Square-Pyramidal Hexaruthenium Dihydride","Organometallics","2007","26","6","1414","","10.1021/om061078c","","","0.71073","MoKα","","0.0439","0.0364","","","0.0739","0.0791","","","","","","1.09","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072836","37.447","0.006","10.154","0.0016","18.379","0.003","90","","96.543","0.003","90","","6942.9","1.9","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H22 N2 O13 Ru6 -","- C32 H22 N2 O13 Ru6 -","- C256 H176 N16 O104 Ru48 -","8","1","","Cabeza, Javier A.; del Río, Ignacio; Fernández-Colinas, José M.; García-Álvarez, Pablo; Miguel, Daniel","Reactivity of Indene, Fluorene, Azulene, and Acenaphthylene with a Basal-Edge-Bridged Square-Pyramidal Hexaruthenium Dihydride","Organometallics","2007","26","6","1414","","10.1021/om061078c","","","0.71073","MoKα","","0.04","0.0271","","","0.0642","0.0717","","","","","","1.003","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072837","10.945","0.008","11.011","0.008","15.261","0.011","88.991","0.014","78.875","0.012","86.026","0.014","1800","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H16 Cl2 N2 O12 Ru6 -","- C31 H16 Cl2 N2 O12 Ru6 -","- C62 H32 Cl4 N4 O24 Ru12 -","2","1","","Cabeza, Javier A.; del Río, Ignacio; Fernández-Colinas, José M.; García-Álvarez, Pablo; Miguel, Daniel","Reactivity of Indene, Fluorene, Azulene, and Acenaphthylene with a Basal-Edge-Bridged Square-Pyramidal Hexaruthenium Dihydride","Organometallics","2007","26","6","1414","","10.1021/om061078c","","","0.71073","MoKα","","0.0674","0.0627","","","0.1614","0.1699","","","","","","1.097","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072838","9.978","0.003","10.522","0.004","19.871","0.007","81.9","0.03","79.46","0.03","71.66","0.03","1939.1","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H18 N2 O13.5 Ru7 -","- C33 H18 N2 O13.5 Ru7 -","- C66 H36 N4 O27 Ru14 -","2","1","","Cabeza, Javier A.; del Río, Ignacio; Fernández-Colinas, José M.; García-Álvarez, Pablo; Miguel, Daniel","Reactivity of Indene, Fluorene, Azulene, and Acenaphthylene with a Basal-Edge-Bridged Square-Pyramidal Hexaruthenium Dihydride","Organometallics","2007","26","6","1414","","10.1021/om061078c","","","1.54178","CUKΑ","","0.0406","0.0342","","","0.1029","0.1119","","","","","","1.095","","","","has coordinates","189816","2020-10-21","18:00:00",""
"4072839","9.521","0.006","11.376","0.008","18.859","0.013","73.461","0.011","77.744","0.012","69.587","0.012","1821","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30.6 H21.4 N2 O11 Ru6 S -","- C30.6 H21.4 N2 O11 Ru6 S -","- C61.2 H42.8 N4 O22 Ru12 S2 -","2","1","","Cabeza, Javier A.; del Río, Ignacio; Fernández-Colinas, José M.; García-Álvarez, Pablo; Miguel, Daniel","Reactivity of Indene, Fluorene, Azulene, and Acenaphthylene with a Basal-Edge-Bridged Square-Pyramidal Hexaruthenium Dihydride","Organometallics","2007","26","6","1414","","10.1021/om061078c","","","0.71073","MoKα","","0.0571","0.0461","","","0.1116","0.1235","","","","","","1.131","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072840","17.793","0.004","15.863","0.004","23.31","0.005","90","","90","","90","","6579","3","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C32 H28 F12 Ru Sb2 -","- C32 H28 F12 Ru Sb2 -","- C256 H224 F96 Ru8 Sb16 -","8","1","","Zhu, Bolin; Ellern, Arkady; Sygula, Andrzej; Sygula, Renata; Angelici, Robert J.","η6-Coordination of the Curved Carbon Surface of Corannulene (C20H10) to (η6-arene)M2+(M = Ru, Os)","Organometallics","2007","26","7","1721","","10.1021/om0610795","","","0.71073","MoKα","","0.0905","0.0596","","","0.1521","0.1753","","","","","","1.15","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072841","17.783","0.004","16.056","0.003","23.27","0.005","90","","90","","90","","6644","2","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C33 H30 F12 Ru Sb2 -","- C33 H30 F12 Ru Sb2 -","- C264 H240 F96 Ru8 Sb16 -","8","1","","Zhu, Bolin; Ellern, Arkady; Sygula, Andrzej; Sygula, Renata; Angelici, Robert J.","η6-Coordination of the Curved Carbon Surface of Corannulene (C20H10) to (η6-arene)M2+(M = Ru, Os)","Organometallics","2007","26","7","1721","","10.1021/om0610795","","","0.71073","MoKα","","0.0613","0.04","","","0.0976","0.1157","","","","","","1.029","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072842","18.03","0.004","15.11","0.003","23.476","0.005","90","","90","","90","","6396","2","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C31 H26 F12 Ru Sb2 -","- C31 H26 F12 Ru Sb2 -","- C248 H208 F96 Ru8 Sb16 -","8","1","","Zhu, Bolin; Ellern, Arkady; Sygula, Andrzej; Sygula, Renata; Angelici, Robert J.","η6-Coordination of the Curved Carbon Surface of Corannulene (C20H10) to (η6-arene)M2+(M = Ru, Os)","Organometallics","2007","26","7","1721","","10.1021/om0610795","","","0.71073","MoKα","","0.0419","0.0339","","","0.0815","0.0881","","","","","","1.101","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072843","36.205","0.008","9.51","0.002","25.232","0.006","90","","128.968","0.008","90","","6755","3","183","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C31 H26 Cl2 F12 Os Sb2 -","- C31 H26 Cl2 F12 Os Sb2 -","- C248 H208 Cl16 F96 Os8 Sb16 -","8","1","","Zhu, Bolin; Ellern, Arkady; Sygula, Andrzej; Sygula, Renata; Angelici, Robert J.","η6-Coordination of the Curved Carbon Surface of Corannulene (C20H10) to (η6-arene)M2+(M = Ru, Os)","Organometallics","2007","26","7","1721","","10.1021/om0610795","","","0.71073","MoKα","","0.0974","0.0637","","","0.1846","0.2148","","","","","","1.041","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072844","21.3702","0.0005","18.4998","0.0004","27.0213","0.0006","90","","103.391","0.001","90","","10392.3","0.4","120","1","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C106.25 H111 Cu F6 Fe2 N4 P5 -","- C106.25 H111 Cu F6 Fe2 N4 P5 -","- C425 H444 Cu4 F24 Fe8 N16 P20 -","4","1","","Ghazala, Safaa Ibn; Gauthier, Nicolas; Paul, Frédéric; Toupet, Loic; Lapinte, Claude","New Redox-Active Iron(II) Acetylide Complex Bearing a (2-Pyridyl)aldimine Site. Synthesis and Complexation to Copper(I)","Organometallics","2007","26","9","2308","","10.1021/om061081w","","","0.71073","MoKα","","0.1499","0.0772","","","0.184","0.2335","","","","","","1.008","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072845","21.3913","0.0003","12.0035","0.0002","33.2222","0.0004","90","","90.258","0.001","90","","8530.4","0.2","150","1","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C100.5 H97 Cl Fe2 N4 P4 -","- C100.5 H97 Cl Fe2 N4 P4 -","- C402 H388 Cl4 Fe8 N16 P16 -","4","0.5","","Ghazala, Safaa Ibn; Gauthier, Nicolas; Paul, Frédéric; Toupet, Loic; Lapinte, Claude","New Redox-Active Iron(II) Acetylide Complex Bearing a (2-Pyridyl)aldimine Site. Synthesis and Complexation to Copper(I)","Organometallics","2007","26","9","2308","","10.1021/om061081w","","","0.71069","MoKα","","0.0726","0.0556","","","0.1551","0.1695","","","","","","0.995","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072846","11.7509","0.0009","21.2958","0.0015","17.7264","0.0013","90","","95.055","0.004","90","","4418.7","0.6","108","2","108","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C43 H63 Cl2 F N2 P Ru -","- C43 H63 Cl2 F N2 P Ru -","- C172 H252 Cl8 F4 N8 P4 Ru4 -","4","1","","Macnaughtan, Marisa L.; Johnson, Marc J. A.; Kampf, Jeff W.","Synthesis, Structure, and Olefin Metathesis Activity of Two Ruthenium Monofluoromethylidene Complexes","Organometallics","2007","26","4","780","","10.1021/om061082o","","","0.71073","MoKα","","0.0418","0.0341","","","0.0992","0.1049","","","","","","1.071","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072847","10.8209","0.001","11.0568","0.0011","19.0122","0.0018","98.658","0.006","97.596","0.006","108.308","0.006","2095.6","0.4","180","2","180","2","","","","","","","","5","P -1","-P 1","2","in_paper_4","","","- C50 H53 N2 O2.5 Ti -","- C50 H53 N2 O2.5 Ti -","- C100 H106 N4 O5 Ti2 -","2","1","","Gott, Andrew L.; Clarke, Adam J.; Clarkson, Guy J.; Scott, Peter","Structure−Activity Relationships for Group 4 Biaryl Amidate Complexes in Catalytic Hydroamination/Cyclization of Aminoalkenes","Organometallics","2007","26","7","1729","","10.1021/om061087l","","","1.54178","CuKα","","0.0729","0.0548","","","0.1408","0.154","","","","","","1.051","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4072848","15.5157","0.0012","21.5593","0.0016","18.1187","0.0014","90","","100.58","0.005","90","","5957.8","0.8","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","in_paper_6","","","- C68 H72 N4 O4 Zr2 -","- C68 H72 N4 O4 Zr2 -","- C272 H288 N16 O16 Zr8 -","4","1","","Gott, Andrew L.; Clarke, Adam J.; Clarkson, Guy J.; Scott, Peter","Structure−Activity Relationships for Group 4 Biaryl Amidate Complexes in Catalytic Hydroamination/Cyclization of Aminoalkenes","Organometallics","2007","26","7","1729","","10.1021/om061087l","","","1.54178","CuKα","","0.0463","0.0352","","","0.0845","0.0904","","","","","","1.02","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072849","8.512","0.001","11.989","0.001","15.228","0.001","110.95","0.001","90.33","0.001","100.16","0.001","1424.5","0.2","150","0.1","150","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C35.5 H37 O P Ru -","- C32 H33 O P Ru -","- C64 H66 O2 P2 Ru2 -","2","1","","Carmichael, Duncan; Ricard, Louis; Seeboth, Nicolas","Planar-to-Axial Chirality Relay in Phospharuthenocenes. A Rotationally Hindered 2-(2‘-Diphenylphosphinonaphth-1‘-yl)phospharuthenocene","Organometallics","2007","26","12","2964","","10.1021/om0610905","","","0.71069","MoKα","","0.0426","0.0375","","","0.1025","0.1048","","","","","","1.019","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072850","11.315","0.001","20.571","0.001","19.376","0.001","90","","98.406","0.001","90","","4461.5","0.5","150","0.1","150","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H46 Cl6 P2 Pt Ru -","- C46 H46 Cl6 P2 Pt Ru -","- C184 H184 Cl24 P8 Pt4 Ru4 -","4","1","","Carmichael, Duncan; Ricard, Louis; Seeboth, Nicolas","Planar-to-Axial Chirality Relay in Phospharuthenocenes. A Rotationally Hindered 2-(2‘-Diphenylphosphinonaphth-1‘-yl)phospharuthenocene","Organometallics","2007","26","12","2964","","10.1021/om0610905","","","0.71069","MoKα","","0.0662","0.0418","","","0.0991","0.1075","","","","","","1","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072851","11.711","0.002","10.17","0.002","17.149","0.003","90","","106.34","0.03","90","","1960","0.7","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H27 B2 N2 Na -","- C20 H27 B2 N2 Na -","- C80 H108 B8 N8 Na4 -","4","1","","Ly, Hanh V.; Forster, Taryn D.; Corrente, Andrea M.; Eisler, Dana J.; Konu, Jari; Parvez, Masood; Roesler, Roland","Alkali-Metal Sandwich Complexes of a 1,2-Diaza-3,5-diborolyl Ligand Featuring η1, η2, η3, and η4Coordination Modes","Organometallics","2007","26","7","1750","","10.1021/om061091x","","","0.71073","MoKα","","0.0713","0.0528","","","0.1274","0.1371","","","","","","1.07","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072852","17.466","0.004","9.3578","0.0019","20.269","0.004","90","","90.48","0.03","90","","3312.7","1.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H51 B2 N2 Na O3 -","- C32 H51 B2 N2 Na O3 -","- C128 H204 B8 N8 Na4 O12 -","4","1","","Ly, Hanh V.; Forster, Taryn D.; Corrente, Andrea M.; Eisler, Dana J.; Konu, Jari; Parvez, Masood; Roesler, Roland","Alkali-Metal Sandwich Complexes of a 1,2-Diaza-3,5-diborolyl Ligand Featuring η1, η2, η3, and η4Coordination Modes","Organometallics","2007","26","7","1750","","10.1021/om061091x","","","0.71073","MoKα","","0.1356","0.0593","","","0.1383","0.1727","","","","","","1.016","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072853","6.055","0.001","17.628","0.005","22.867","0.006","90","","96.504","0.016","90","","2425.1","1","173","2","173","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C24 H35 B2 K N2 O -","- C24 H35 B2 K N2 O -","- C96 H140 B8 K4 N8 O4 -","4","1","","Ly, Hanh V.; Forster, Taryn D.; Corrente, Andrea M.; Eisler, Dana J.; Konu, Jari; Parvez, Masood; Roesler, Roland","Alkali-Metal Sandwich Complexes of a 1,2-Diaza-3,5-diborolyl Ligand Featuring η1, η2, η3, and η4Coordination Modes","Organometallics","2007","26","7","1750","","10.1021/om061091x","","","0.71073","MoKα","","0.0421","0.036","","","0.0897","0.0938","","","","","","1.047","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072854","11.852","0.007","6.165","0.002","20.203","0.013","90","","96.06","0.02","90","","1467.9","1.4","173","2","173","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C28 H43 B2 K N2 O2 -","- C28 H43 B2 K N2 O2 -","- C56 H86 B4 K2 N4 O4 -","2","1","","Ly, Hanh V.; Forster, Taryn D.; Corrente, Andrea M.; Eisler, Dana J.; Konu, Jari; Parvez, Masood; Roesler, Roland","Alkali-Metal Sandwich Complexes of a 1,2-Diaza-3,5-diborolyl Ligand Featuring η1, η2, η3, and η4Coordination Modes","Organometallics","2007","26","7","1750","","10.1021/om061091x","","","0.71073","MoKα","","0.0964","0.053","","","0.122","0.1439","","","","","","1.032","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072855","13.5217","0.0013","14.9233","0.0014","23.258","0.002","97.01","0.002","99.872","0.002","101.853","0.002","4464.5","0.7","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C95.5 H106 O2 P4 Rh2 S2 Zr -","- C94.5 H86 O2 P4 Rh2 S2 Zr -","- C189 H172 O4 P8 Rh4 S4 Zr2 -","2","1","","Hernandez-Gruel, Marc A. F.; Lahoz, Fernando J.; Dobrinovich, Isabel T.; Modrego, F. Javier; Oro, Luis A.; Pérez-Torrente, Jesús J.","Reversible Opening of the Triangular Structure of a Sulfido-Bridged ZrRh2Early−Late Heterobimetallic Complex Induced by Bis-(diphenylphosphino)methane","Organometallics","2007","26","10","2616","","10.1021/om061092p","","","0.71073","MoKα","","0.1184","0.0705","","","0.1696","0.1882","","","","","","0.988","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4072856","9.38","0.005","10.174","0.005","10.251","0.005","68.12","0.005","85.68","0.005","79.93","0.005","893.8","0.8","150","0.1","150","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C17 H27 Co O2 P -","- C17 H27 Co O2 P -","- C34 H54 Co2 O4 P2 -","2","1","","Cabon, Yves; Carmichael, Duncan; Forissier, Kareen; Mathey, François; Ricard, Louis; Seeboth, Nicolas","Synthesis of a Cobalt−Phospholyl Half-Sandwich Complex and Its Transformation into a Phosphacobaltocene","Organometallics","2007","26","23","5468","","10.1021/om0610952","","","0.71069","MoKα","","0.0478","0.0379","","","0.0923","0.0968","","","","","","1.001","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072857","9.522","0.002","17.427","0.004","19.654","0.004","83.043","0.004","83.922","0.004","78.551","0.003","3161.7","1.2","203","2","203","2","","","","","","","","7","P -1","-P 1","2","","","","- C30.5 H33 Cl F6 O P2 Ru -","- C30.5 H33 Cl F6 O P2 Ru -","- C122 H132 Cl4 F24 O4 P8 Ru4 -","4","2","","McWilliams, Kevin M.; Ellern, Arkady; Angelici, Robert J.","Synthesis of Cp‘Ru(CO)(L)(η2-olefin)+Complexes and Kinetic Studies of Olefin Substitution","Organometallics","2007","26","7","1665","","10.1021/om061096u","","","0.71073","MoKα","","0.0925","0.0574","","","0.1529","0.1741","","","","","","1.027","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072858","11.3514","0.0005","17.7124","0.0008","29.7652","0.0014","90","","90","","90","","5984.6","0.5","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C30 H44 B Mo2 O2 P -","- C30 H44 B Mo2 O2 P -","- C240 H352 B8 Mo16 O16 P8 -","8","2","","Amor, Inmaculada; García-Vivó, Daniel; García, M. Esther; Ruiz, Miguel A.; Sáez, David; Hamidov, Hayrullo; Jeffery, John C.","Formation of P–H, P–C, and C–H Bonds by Hydride Attack on a Electrophilic Phosphide-Bridged Dimolybdenum Complex. Trapping the Phosphinidene Ligand with Borane","Organometallics","2007","26","3","466","468","10.1021/om061097m","","x-ray","1.5418","CuKα","","0.0394","0.0342","","","0.0784","0.0815","","","","","","0.983","","","","has coordinates","288091","2023-12-06","15:51:22",""
"4072859","12.928","0.001","13.4923","0.001","25.1607","0.0017","86.994","0.003","89.132","0.003","84.163","0.004","4359.8","0.6","143","2","143","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H38 F3 Ir N4 O4 S -","- C36 H38 F3 Ir N4 O4 S -","- C144 H152 F12 Ir4 N16 O16 S4 -","4","2","","Young, Kenneth J. H.; Mironov, Oleg A.; Periana, Roy A.","Stoichiometric Oxy Functionalization and CH Activation Studies of Cyclometalated Iridium(III) 6-Phenyl-2,2‘-Bipyridine Hydrocarbyl Complexes","Organometallics","2007","26","9","2137","","10.1021/om0611002","","","0.71073","MoKα","","0.0948","0.0661","","","0.2116","0.2311","","","","","","1.089","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072860","12.1928","0.0019","13.205","0.002","19.022","0.003","80.32","0.003","74.116","0.002","83.202","0.002","2895.3","0.8","130","2","130","2","","","","","","","","8","P -1","-P 1","2","","","","- C49 H48 Cl9 F3 Ir N5 O5 S -","- C49 H48 Cl9 F3 Ir N5 O5 S -","- C98 H96 Cl18 F6 Ir2 N10 O10 S2 -","2","1","","Young, Kenneth J. H.; Mironov, Oleg A.; Periana, Roy A.","Stoichiometric Oxy Functionalization and CH Activation Studies of Cyclometalated Iridium(III) 6-Phenyl-2,2‘-Bipyridine Hydrocarbyl Complexes","Organometallics","2007","26","9","2137","","10.1021/om0611002","","","0.71073","MoKα","","0.0765","0.068","","","0.1825","0.1898","","","","","","1.046","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072861","29.506","0.0001","12.048","0.0002","22.289","0.0003","90","0.001","128.344","0.001","90","0.001","6214.39","0.16","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H22 F4 Ir N7 O3 -","- C30 H22 F4 Ir N7 O3 -","- C240 H176 F32 Ir8 N56 O24 -","8","1","","Wu, Li-Lan; Yang, Cheng-Hsien; Sun, I-Wen; Chu, Sheng-Yuan; Kao, Po-Ching; Huang, Hsin-Hsuan","Photophysical and Electrochemical Properties of Blue Phosphorescent Iridium(III) Complexes","Organometallics","2007","26","8","2017","","10.1021/om061101u","","","0.71073","MoKα","","0.0563","0.049","","","0.1319","0.1457","","","","","","1.14","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072862","8.8669","0.0002","28.7378","0.0005","11.275","0.0003","90","","103.389","0.001","90","","2794.95","0.11","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H20 F4 Ir N7 O2 -","- C30 H20 F4 Ir N7 O2 -","- C120 H80 F16 Ir4 N28 O8 -","4","1","","Wu, Li-Lan; Yang, Cheng-Hsien; Sun, I-Wen; Chu, Sheng-Yuan; Kao, Po-Ching; Huang, Hsin-Hsuan","Photophysical and Electrochemical Properties of Blue Phosphorescent Iridium(III) Complexes","Organometallics","2007","26","8","2017","","10.1021/om061101u","","","0.71073","MoKα","","0.0934","0.0563","","","0.1215","0.1367","","","","","","1.069","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072863","8.631","0.0002","9.175","0.0002","17.847","0.0005","85.833","0.001","78.008","0.001","82.862","0.001","1370.14","0.06","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H20 F4 Ir N7 O2 -","- C30 H20 F4 Ir N7 O2 -","- C60 H40 F8 Ir2 N14 O4 -","2","1","","Wu, Li-Lan; Yang, Cheng-Hsien; Sun, I-Wen; Chu, Sheng-Yuan; Kao, Po-Ching; Huang, Hsin-Hsuan","Photophysical and Electrochemical Properties of Blue Phosphorescent Iridium(III) Complexes","Organometallics","2007","26","8","2017","","10.1021/om061101u","","","0.71073","MoKα","","0.066","0.0458","","","0.1027","0.1297","","","","","","1.099","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072864","13.0229","0.0004","14.7972","0.0004","14.2666","0.0006","90","","100.6","0.001","90","","2702.29","0.16","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H20 F4 Ir N7 O2 -","- C30 H18 F4 Ir N7 O2 -","- C120 H72 F16 Ir4 N28 O8 -","4","1","","Wu, Li-Lan; Yang, Cheng-Hsien; Sun, I-Wen; Chu, Sheng-Yuan; Kao, Po-Ching; Huang, Hsin-Hsuan","Photophysical and Electrochemical Properties of Blue Phosphorescent Iridium(III) Complexes","Organometallics","2007","26","8","2017","","10.1021/om061101u","","","0.71073","MoKα","","0.0862","0.048","","","0.1192","0.16","","","","","","1.004","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072865","13.0788","0.0007","24.1198","0.0012","15.2094","0.0007","90","","108.2","0.001","90","","4557.9","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C53 H66 N P Pt -","- C53 H64 N P Pt -","- C212 H256 N4 P4 Pt4 -","4","1","","Casas, José M.; Forniés, Juan; Fuertes, Sara; Martín, Antonio; Sicilia, Violeta","New Mono- and Polynuclear Alkynyl Complexes Containing Phenylacetylide as Terminal or Bridging Ligand. X-ray Structures of the Compounds NBu4[Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)2], [Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)(CO)], [{Pt(CH2C6H4P(o-tolyl)2-κC,P)(μ-C⋮CPh)}2], and [{Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)2Cu}2]","Organometallics","2007","26","7","1674","","10.1021/om061102m","","","0.71073","MoKα","","0.0467","0.0319","","","0.0487","0.0506","","","","","","1.007","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072866","12.329","0.0004","12.329","0.0004","39.604","0.002","90","","90","","90","","6020","0.4","100","2","100","2","","","","","","","","5","P 41","P 4w","76","","","","- C74 H60 Cu2 P2 Pt2 -","- C74 H60 Cu2 P2 Pt2 -","- C296 H240 Cu8 P8 Pt8 -","4","1","","Casas, José M.; Forniés, Juan; Fuertes, Sara; Martín, Antonio; Sicilia, Violeta","New Mono- and Polynuclear Alkynyl Complexes Containing Phenylacetylide as Terminal or Bridging Ligand. X-ray Structures of the Compounds NBu4[Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)2], [Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)(CO)], [{Pt(CH2C6H4P(o-tolyl)2-κC,P)(μ-C⋮CPh)}2], and [{Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)2Cu}2]","Organometallics","2007","26","7","1674","","10.1021/om061102m","","","0.71073","MoKα","","0.0194","0.0188","","","0.0454","0.0455","","","","","","1.023","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072867","13.7767","0.0004","7.8071","0.0003","22.3544","0.0006","90","","99.827","0.002","90","","2369.07","0.13","100","2","100","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C58 H50 P2 Pt2 -","- C58 H50 P2 Pt2 -","- C116 H100 P4 Pt4 -","2","0.5","","Casas, José M.; Forniés, Juan; Fuertes, Sara; Martín, Antonio; Sicilia, Violeta","New Mono- and Polynuclear Alkynyl Complexes Containing Phenylacetylide as Terminal or Bridging Ligand. X-ray Structures of the Compounds NBu4[Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)2], [Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)(CO)], [{Pt(CH2C6H4P(o-tolyl)2-κC,P)(μ-C⋮CPh)}2], and [{Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)2Cu}2]","Organometallics","2007","26","7","1674","","10.1021/om061102m","","","0.71073","MoKα","","0.0206","0.018","","","0.0398","0.0407","","","","","","1.072","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072868","23.401","0.004","14.738","0.002","16.089","0.002","90","","101.186","0.003","90","","5443.4","1.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H32 O2 P Pt -","- C33 H32 O2 P Pt -","- C264 H256 O16 P8 Pt8 -","8","1","","Casas, José M.; Forniés, Juan; Fuertes, Sara; Martín, Antonio; Sicilia, Violeta","New Mono- and Polynuclear Alkynyl Complexes Containing Phenylacetylide as Terminal or Bridging Ligand. X-ray Structures of the Compounds NBu4[Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)2], [Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)(CO)], [{Pt(CH2C6H4P(o-tolyl)2-κC,P)(μ-C⋮CPh)}2], and [{Pt(CH2C6H4P(o-tolyl)2-κC,P)(C⋮CPh)2Cu}2]","Organometallics","2007","26","7","1674","","10.1021/om061102m","","","0.71073","MoKα","","0.0305","0.0274","","","0.0726","0.0745","","","","","","1.053","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072869","12.3933","0.0004","15.1408","0.0007","16.126","0.0007","72.2107","0.0018","68.953","0.002","72.576","0.002","2627.06","0.19","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H53 N3 O6 P2 Ru -","- C53 H53 N3 O6 P2 Ru -","- C106 H106 N6 O12 P4 Ru2 -","2","1","","Šmejkal, Tomáš; Breit, Bernhard","Self-Assembled Bidentate Ligands for Ruthenium-Catalyzed Hydration of Nitriles","Organometallics","2007","26","9","2461","","10.1021/om0611047","","","0.71073","MoKα","","0.0661","0.0438","","","0.102","0.1101","","","","","","0.971","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072870","11.712","0.0005","12.349","0.0004","19.231","0.0009","104.207","0.002","98.652","0.0017","106.588","0.002","2510.29","0.19","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H46 N2 O6 P2 Ru -","- C52 H46 N2 O6 P2 Ru -","- C104 H92 N4 O12 P4 Ru2 -","2","1","","Šmejkal, Tomáš; Breit, Bernhard","Self-Assembled Bidentate Ligands for Ruthenium-Catalyzed Hydration of Nitriles","Organometallics","2007","26","9","2461","","10.1021/om0611047","","","0.71073","MoKα","","0.0834","0.0522","","","0.1162","0.1265","","","","","","1.021","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072871","12.511","0.003","18.267","0.004","18.81","0.004","77.87","0.004","70.988","0.003","70.924","0.003","3815.2","1.5","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H63 Al N2 -","- C39 H63 Al N2 -","- C156 H252 Al4 N8 -","4","2","","Li, Xiaofei; Cheng, Xiaoyan; Song, Haibin; Cui, Chunming","Synthesis of HC[(CBut)(NAr)]2Al (Ar = 2,6-Pri2C6H3) and Its Reaction with Isocyanides, a Bulky Azide, and H2O","Organometallics","2007","26","4","1039","","10.1021/om061107j","","","0.71073","MoKα","","0.1265","0.0628","","","0.1555","0.1968","","","","","","1.009","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072872","12.544","0.002","14.444","0.003","18.624","0.003","73.795","0.003","88.767","0.003","83.397","0.003","3218.6","1","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C61 H87 Al N4 -","- C61 H87 Al N4 -","- C122 H174 Al2 N8 -","2","1","","Li, Xiaofei; Cheng, Xiaoyan; Song, Haibin; Cui, Chunming","Synthesis of HC[(CBut)(NAr)]2Al (Ar = 2,6-Pri2C6H3) and Its Reaction with Isocyanides, a Bulky Azide, and H2O","Organometallics","2007","26","4","1039","","10.1021/om061107j","","","0.71073","MoKα","","0.1958","0.0909","","","0.2276","0.2997","","","","","","1.041","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072873","23.748","0.004","8.5153","0.0015","17.376","0.003","90","","108.731","0.003","90","","3327.7","1","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C35 H53 Al N2 -","- C35 H53 Al N2 -","- C140 H212 Al4 N8 -","4","0.5","","Li, Xiaofei; Cheng, Xiaoyan; Song, Haibin; Cui, Chunming","Synthesis of HC[(CBut)(NAr)]2Al (Ar = 2,6-Pri2C6H3) and Its Reaction with Isocyanides, a Bulky Azide, and H2O","Organometallics","2007","26","4","1039","","10.1021/om061107j","","","0.71073","MoKα","","0.0693","0.0438","","","0.1204","0.1435","","","","","","1.042","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072874","14.255","0.002","18.737","0.003","21.076","0.003","90","","91.189","0.002","90","","5628.1","1.4","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C61 H87 Al N4 -","- C61 H87 Al N4 -","- C244 H348 Al4 N16 -","4","1","","Li, Xiaofei; Cheng, Xiaoyan; Song, Haibin; Cui, Chunming","Synthesis of HC[(CBut)(NAr)]2Al (Ar = 2,6-Pri2C6H3) and Its Reaction with Isocyanides, a Bulky Azide, and H2O","Organometallics","2007","26","4","1039","","10.1021/om061107j","","","0.7107","MoKα","","0.0922","0.0673","","","0.1698","0.1878","","","","","","1.085","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072875","12.469","0.002","19.335","0.002","23.561","0.003","90","","105.534","0.006","90","","5472.8","1.3","150.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H94 Li2 O2 Si8 -","- C38 H86 Li2 O Si8 -","- C152 H344 Li8 O4 Si32 -","4","1","","Kira, Mitsuo; Kadowaki, Tomoyuki; Yin, Dongzhu; Sakamoto, Kenkichi; Iwamoto, Takeaki; Kabuto, Chizuko","Synthesis and Structure of Ethynylsilyllithiums","Organometallics","2007","26","20","4890","","10.1021/om0611103","","","0.7107","MoKα","","","0.0818","","","","0.3157","","","","","","0.709","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072876","7.734","0.002","18.713","0.005","11.172","0.003","90","","105.24","0.004","90","","1560","0.7","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","C6 H7 B N9, C6 H11 N2","","","- C12 H18 B N11 -","- C12 H18 B N11 -","- C48 H72 B4 N44 -","4","1","","Zeng, Zhuo; Twamley, Brendan; Shreeve, Jean'ne M.","Structure and Properties of Substituted Imidazolium, Triazolium, and Tetrazolium Poly(1,2,4-triazolyl)borate Salts","Organometallics","2007","26","7","1782","","10.1021/om061113f","","","0.71073","MoKα","","0.0356","0.0323","","","0.076","0.0781","","","","","","1.015","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072877","7.132","0.002","8.872","0.002","10.151","0.002","83.553","0.001","86.668","0.001","86.503","0.001","636.2","0.3","90","2","90","2","","","","","","","","4","P -1","-P 1","2","C4 H6 B N6, C5 H9 N2","","","- C9 H15 B N8 -","- C9 H15 B N8 -","- C18 H30 B2 N16 -","2","1","","Zeng, Zhuo; Twamley, Brendan; Shreeve, Jean'ne M.","Structure and Properties of Substituted Imidazolium, Triazolium, and Tetrazolium Poly(1,2,4-triazolyl)borate Salts","Organometallics","2007","26","7","1782","","10.1021/om061113f","","","0.71073","MoKα","","0.035","0.0321","","","0.0775","0.0803","","","","","","1.078","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4072878","6.2738","0.0014","21.591","0.005","16.124","0.004","90","","100.483","0.005","90","","2147.7","0.9","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H12 Fe2 O8 S2 -","- C20 H12 Fe2 O8 S2 -","- C80 H48 Fe8 O32 S8 -","4","1","","Stanley, Jane L.; Rauchfuss, Thomas B.; Wilson, Scott R.","Studies on the Condensation Pathway to and Properties of Diiron Azadithiolate Carbonyls.","Organometallics","2007","26","8","1907","1911","10.1021/om0611150","","","0.71073","MoKα","","0.2765","0.0829","","","0.0986","0.1359","","","","","","0.949","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072879","8.828","0.003","12.874","0.005","13.045","0.005","97.935","0.006","101.023","0.006","94.432","0.006","1433.1","0.9","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H6 Fe2 O8 S2 -","- C8 H6 Fe2 O8 S2 -","- C32 H24 Fe8 O32 S8 -","4","2","","Stanley, Jane L.; Rauchfuss, Thomas B.; Wilson, Scott R.","Studies on the Condensation Pathway to and Properties of Diiron Azadithiolate Carbonyls.","Organometallics","2007","26","8","1907","1911","10.1021/om0611150","","","0.71073","MoKα","","0.1672","0.0513","","","0.0922","0.102","","","","","","0.63","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072880","8.434","0.002","13.588","0.004","20.825","0.006","90","","101.266","0.006","90","","2340.6","1.1","208","2","208","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H34 O P2 Pt -","- C24 H34 O P2 Pt -","- C96 H136 O4 P8 Pt4 -","4","2","","Scriban, Corina; Glueck, David S.; Golen, James A.; Rheingold, Arnold L.","Platinum-Catalyzed Asymmetric Alkylation of a Secondary Phosphine: Mechanism and Origin of Enantioselectivity","Organometallics","2007","26","7","1788","","10.1021/om061116s","","","0.71073","MoKα","","0.0481","0.0448","","","0.1002","0.1018","","","","","","1.003","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072881","10.701","0.002","13.89","0.003","16.873","0.003","90","","90","","90","","2508","0.8","213","2","213","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H33 Br P2 Pt -","- C24 H33 Br P2 Pt -","- C96 H132 Br4 P8 Pt4 -","4","1","","Scriban, Corina; Glueck, David S.; Golen, James A.; Rheingold, Arnold L.","Platinum-Catalyzed Asymmetric Alkylation of a Secondary Phosphine: Mechanism and Origin of Enantioselectivity","Organometallics","2007","26","7","1788","","10.1021/om061116s","","","0.71073","MoKα","","0.0254","0.0236","","","0.0494","0.0499","","","","","","0.893","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072882","12.9514","0.0016","17.462","0.002","21.291","0.003","90","","90","","90","","4815.1","1.1","213","2","213","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C47 H66 B F4 P3 Pt -","- C47 H66 B F4 P3 Pt -","- C188 H264 B4 F16 P12 Pt4 -","4","1","","Scriban, Corina; Glueck, David S.; Golen, James A.; Rheingold, Arnold L.","Platinum-Catalyzed Asymmetric Alkylation of a Secondary Phosphine: Mechanism and Origin of Enantioselectivity","Organometallics","2007","26","7","1788","","10.1021/om061116s","","","0.71073","MoKα","","0.0247","0.0227","","","0.0494","0.0497","","","","","","0.991","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072883","15.92","0.002","16.545","0.003","40.382","0.006","90","","90","","90","","10636","3","213","2","213","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C49 H65.5 O3 P4 Pt2 -","- C49 H65.5 O3 P4 Pt2 -","- C392 H524 O24 P32 Pt16 -","8","2","","Scriban, Corina; Glueck, David S.; Golen, James A.; Rheingold, Arnold L.","Platinum-Catalyzed Asymmetric Alkylation of a Secondary Phosphine: Mechanism and Origin of Enantioselectivity","Organometallics","2007","26","7","1788","","10.1021/om061116s","","","0.71073","MoKα","","0.0696","0.065","","","0.1828","0.1853","","","","","","1.148","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072884","16.0743","0.0011","19.1","0.0009","21.9454","0.0011","90","","90","","90","","6737.7","0.7","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C40 H46 B Fe2 Li O -","- C40 H46 B Fe2 Li O -","- C320 H368 B8 Fe16 Li8 O8 -","8","1","","Kaufmann, Linda; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Experimental Assessment of the Relative Affinities of Benzene and Ferrocene toward the Li+Cation","Organometallics","2007","26","7","1771","","10.1021/om061117k","","","0.71073","MoKα","","0.1344","0.0633","","","0.1083","0.1281","","","","","","0.927","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072885","7.7169","0.0008","12.3681","0.0009","7.8101","0.0007","90","","101.294","0.008","90","","730.99","0.12","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 B2 Br2 Fe O2 -","- C12 H14 B2 Br2 Fe O2 -","- C24 H28 B4 Br4 Fe2 O4 -","2","0.5","","Kaufmann, Linda; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Experimental Assessment of the Relative Affinities of Benzene and Ferrocene toward the Li+Cation","Organometallics","2007","26","7","1771","","10.1021/om061117k","","","0.71073","MoKα","","0.0303","0.0275","","","0.0642","0.0655","","","","","","1.112","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072886","15.6422","0.0013","18.8747","0.0014","20.159","0.003","90","","90","","90","","5951.8","1.1","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C62 H74 B2 Fe Li2 O2 -","- C62 H74 B2 Fe Li2 O2 -","- C248 H296 B8 Fe4 Li8 O8 -","4","1","","Kaufmann, Linda; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Experimental Assessment of the Relative Affinities of Benzene and Ferrocene toward the Li+Cation","Organometallics","2007","26","7","1771","","10.1021/om061117k","","","0.71073","MoKα","","0.246","0.1477","","","0.3479","0.4106","","","","","","1.101","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072887","12.4841","0.0009","12.6561","0.001","15.5274","0.0014","86.595","0.007","82.632","0.007","87.525","0.006","2427.2","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H68 B Fe2 Li O9 -","- C52 H68 B Fe2 Li O9 -","- C104 H136 B2 Fe4 Li2 O18 -","2","1","","Kaufmann, Linda; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Experimental Assessment of the Relative Affinities of Benzene and Ferrocene toward the Li+Cation","Organometallics","2007","26","7","1771","","10.1021/om061117k","","","0.71073","MoKα","","0.1113","0.0623","","","0.1327","0.1524","","","","","","0.962","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072888","8.6786","0.0014","8.8599","0.0015","11.516","0.002","72.672","0.017","73.845","0.017","83.406","0.017","811.4","0.3","173","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H52 Ga2 Si2 -","- C28 H52 Ga2 Si2 -","- C28 H52 Ga2 Si2 -","1","0.5","","Uhl, Werner; Bock, Henrik R.; Breher, Frank; Claesener, Michael; Haddadpour, Sima; Jasper, Beate; Hepp, Alexander","Hydrogallation of Trimethylsilylethynylbenzenes: Generation of Potential Di- and Tripodal Chelating Lewis Acids","Organometallics","2007","26","9","2363","","10.1021/om061118c","","","0.71073","MoKα","","0.0656","0.058","","","0.1479","0.1562","","","","","","1.048","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072889","17.144","0.007","9.001","0.004","12.23","0.005","90","","101.642","0.007","90","","1848.4","1.3","153","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H60 Ga2 Si2 -","- C32 H60 Ga2 Si2 -","- C64 H120 Ga4 Si4 -","2","0.5","","Uhl, Werner; Bock, Henrik R.; Breher, Frank; Claesener, Michael; Haddadpour, Sima; Jasper, Beate; Hepp, Alexander","Hydrogallation of Trimethylsilylethynylbenzenes: Generation of Potential Di- and Tripodal Chelating Lewis Acids","Organometallics","2007","26","9","2363","","10.1021/om061118c","","","0.71073","MoKα","","0.1038","0.0497","","","0.102","0.119","","","","","","1.007","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072890","13.8729","0.0004","22.0394","0.0007","15.4207","0.0004","90","","100.265","0.002","90","","4639.4","0.2","153","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C39 H75 Ga3 Si3 -","- C39 H75 Ga3 Si3 -","- C156 H300 Ga12 Si12 -","4","1","","Uhl, Werner; Bock, Henrik R.; Breher, Frank; Claesener, Michael; Haddadpour, Sima; Jasper, Beate; Hepp, Alexander","Hydrogallation of Trimethylsilylethynylbenzenes: Generation of Potential Di- and Tripodal Chelating Lewis Acids","Organometallics","2007","26","9","2363","","10.1021/om061118c","","","0.71073","MoKα","","0.1122","0.0568","","","0.1359","0.164","","","","","","1.014","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072891","10.3686","0.0015","15.673","0.002","18.682","0.003","104.741","0.003","100.162","0.004","104.962","0.003","2739.6","0.7","153","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H87 Ga3 Si3 -","- C45 H87 Ga3 Si3 -","- C90 H174 Ga6 Si6 -","2","1","","Uhl, Werner; Bock, Henrik R.; Breher, Frank; Claesener, Michael; Haddadpour, Sima; Jasper, Beate; Hepp, Alexander","Hydrogallation of Trimethylsilylethynylbenzenes: Generation of Potential Di- and Tripodal Chelating Lewis Acids","Organometallics","2007","26","9","2363","","10.1021/om061118c","","","0.71073","MoKα","","0.1094","0.0568","","","0.1159","0.1351","","","","","","0.952","","","","has coordinates,has disorder","178617","2020-10-21","18:00:00",""
"4072892","11.1915","0.0007","17.3864","0.0007","18.9243","0.0009","104.54","0.003","94.546","0.005","90.072","0.005","3552.3","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H58 Mn2 N6 O6 P4 S4 -","- C70 H58 Mn2 N6 O6 P4 S4 -","- C140 H116 Mn4 N12 O12 P8 S8 -","2","1","","Ruiz, Javier; Quesada, Roberto; Vivanco, Marilín; García-Granda, Santiago; Díaz, M. Rosario","Thiocyanogen Insertion into P−C Bonds of Diphosphinomethanide Complexes, Leading to Rare Functionalized Diphosphine and Tetraphosphine Ligands","Organometallics","2007","26","7","1703","","10.1021/om0611195","","","1.5418","CuKα","","0.0732","0.051","","","0.1315","0.142","","","","","","0.926","","","","has coordinates","193981","2020-10-21","18:00:00",""
"4072893","11.2755","0.0004","16.4423","0.0006","21.9661","0.0011","72.807","0.002","77.227","0.002","72.19","0.003","3665.6","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H58 Mn2 N6 O6 P4 S5 -","- C70 H58 Mn2 N6 O6 P4 S5 -","- C140 H116 Mn4 N12 O12 P8 S10 -","2","1","","Ruiz, Javier; Quesada, Roberto; Vivanco, Marilín; García-Granda, Santiago; Díaz, M. Rosario","Thiocyanogen Insertion into P−C Bonds of Diphosphinomethanide Complexes, Leading to Rare Functionalized Diphosphine and Tetraphosphine Ligands","Organometallics","2007","26","7","1703","","10.1021/om0611195","","","1.5418","CuKα","","0.1729","0.0663","","","0.1609","0.2162","","","","","","0.844","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072894","10.5186","0.0007","10.7753","0.0006","15.0216","0.001","93.073","0.005","95.253","0.004","92.24","0.04","1691.32","0.19","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H26 Mn N3 O5 P2 S2 -","- C34 H26 Mn N3 O5 P2 S2 -","- C68 H52 Mn2 N6 O10 P4 S4 -","2","1","","Ruiz, Javier; Quesada, Roberto; Vivanco, Marilín; García-Granda, Santiago; Díaz, M. Rosario","Thiocyanogen Insertion into P−C Bonds of Diphosphinomethanide Complexes, Leading to Rare Functionalized Diphosphine and Tetraphosphine Ligands","Organometallics","2007","26","7","1703","","10.1021/om0611195","","","1.5418","CuKα","","0.0731","0.0664","","","0.2003","0.2068","","","","","","1.106","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072895","11.1806","0.0004","12.5221","0.0006","17.1308","0.0007","102.117","0.003","94.625","0.003","102.178","0.002","2272.53","0.17","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C42 H36 Cl4 Mn N5 O5 P2 S3 -","- C42 H36 Cl4 Mn N5 O5 P2 S3 -","- C84 H72 Cl8 Mn2 N10 O10 P4 S6 -","2","1","","Ruiz, Javier; Quesada, Roberto; Vivanco, Marilín; García-Granda, Santiago; Díaz, M. Rosario","Thiocyanogen Insertion into P−C Bonds of Diphosphinomethanide Complexes, Leading to Rare Functionalized Diphosphine and Tetraphosphine Ligands","Organometallics","2007","26","7","1703","","10.1021/om0611195","","","1.5418","CuKα","","0.0557","0.0507","","","0.1291","0.1394","","","","","","1.011","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072896","12.086","0.003","16.246","0.004","17.986","0.007","89.988","0.014","84.449","0.014","89.98","0.012","3515","1.8","243.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H54 N3 S V -","- C34 H54 N3 S V -","- C136 H216 N12 S4 V4 -","4","1","","Yamada, Junji; Fujiki, Michiya; Nomura, Kotohiro","Synthesis of Various (Arylimido)vanadium(V)−Methyl Complexes Containing Ketimide Ligands and Reactions with Alcohols, Thiols, and Borates: Implications for Unique Reactivity toward Alcohols","Organometallics","2007","26","10","2579","","10.1021/om061121w","","","0.71075","MoKα","","","0.0627","","","","0.122","","","","","","1.002","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4072897","15.606","0.005","15.262","0.004","24.342","0.006","90","","93.897","0.013","90","","5784","3","243.1","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C54 H53 B F20 N3 O V -","- C54 H53 B F20 N3 O V -","- C216 H212 B4 F80 N12 O4 V4 -","4","1","","Yamada, Junji; Fujiki, Michiya; Nomura, Kotohiro","Synthesis of Various (Arylimido)vanadium(V)−Methyl Complexes Containing Ketimide Ligands and Reactions with Alcohols, Thiols, and Borates: Implications for Unique Reactivity toward Alcohols","Organometallics","2007","26","10","2579","","10.1021/om061121w","","","0.71075","MoKα","","","0.0565","","","","0.1632","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072898","14.118","0.0002","14.5423","0.0002","18.3322","0.0002","90","","111.156","0.001","90","","3510.08","0.08","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Platinum(II)bis(diphenylphosphino)propanecis-bis(1-hexenyl)","","- C39 H48 P2 Pt -","- C39 H48 P2 Pt -","- C156 H192 P8 Pt4 -","4","1","","Sivaramakrishna, Akella; Su, Hong; Moss, John R.","Selective Isomerization ofcis-PtL2(1-alkenyl)2tocis-PtL2(2-alkenyl)2Complexes","Organometallics","2007","26","24","5786","","10.1021/om0611249","","","0.71073","MoKα","","0.0514","0.0341","","","0.0595","0.0648","","","","","","1.092","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072899","10.0956","0.0002","12.8451","0.0002","14.5163","0.0003","77.775","0.001","84.714","0.001","70.779","0.001","1736.7","0.06","113","2","113","2","","","","","","","","4","P -1","-P 1","2","","Platinum(II)bis(diphenylphosphino)propanecis-bis(2-hexenyl)","","- C39 H48 P2 Pt -","- C39 H48 P2 Pt -","- C78 H96 P4 Pt2 -","2","1","","Sivaramakrishna, Akella; Su, Hong; Moss, John R.","Selective Isomerization ofcis-PtL2(1-alkenyl)2tocis-PtL2(2-alkenyl)2Complexes","Organometallics","2007","26","24","5786","","10.1021/om0611249","","","0.71073","MoKα","","0.0409","0.033","","","0.0802","0.0841","","","","","","1.065","","","","has coordinates","178617","2020-10-21","18:00:00",""
"4072900","13.962","0.003","14.058","0.002","17.559","0.003","90","","98.762","0.004","90","","3406.2","1.1","193.1","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C28 H39 Cl2 Ir N2 O9 -","- C28 H39 Cl2 Ir N2 O9 -","- C112 H156 Cl8 Ir4 N8 O36 -","4","2","","Nishioka, Takanori; Shibata, Teppei; Kinoshita, Isamu","Sugar-Incorporated N-Heterocyclic Carbene Complexes","Organometallics","2007","26","5","1126","","10.1021/om061128d","","","0.7107","MoKα","","","0.0557","","","","0.0934","","","","","","1.021","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072901","10.5056","0.0015","10.881","0.0015","12.6463","0.0018","96.918","0.002","99.86","0.002","107.204","0.002","1337.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H74 Al2 N2 O6 S2 -","- C46 H70 Al2 N2 O6 S2 -","- C46 H70 Al2 N2 O6 S2 -","1","0.5","","Zhao, Jian; Song, Haibin; Cui, Chunming","Synthesis and Reactions of Aluminum Sulfonamide Alkyls and Hydride","Organometallics","2007","26","8","1947","","10.1021/om0611296","","","0.71073","MoKα","","0.1007","0.0753","","","0.2461","0.2742","","","","","","1.078","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072902","11.1065","0.0014","16.532","0.002","22.444","0.003","89.462","0.002","78.601","0.002","88.062","0.002","4037.4","0.9","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H53 Al N2 O4 S2 -","- C40 H53 Al N2 O4 S2 -","- C160 H212 Al4 N8 O16 S8 -","4","2","","Zhao, Jian; Song, Haibin; Cui, Chunming","Synthesis and Reactions of Aluminum Sulfonamide Alkyls and Hydride","Organometallics","2007","26","8","1947","","10.1021/om0611296","","","0.71073","MoKα","","0.1499","0.054","","","0.1145","0.1523","","","","","","0.985","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072903","30.43","0.006","9.81","0.002","21.25","0.004","90","","126.94","0.008","90","","5070.2","1.8","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52 H65 Al N2 O4 S2 -","- C52 H65 Al N2 O4 S2 -","- C208 H260 Al4 N8 O16 S8 -","4","0.5","","Zhao, Jian; Song, Haibin; Cui, Chunming","Synthesis and Reactions of Aluminum Sulfonamide Alkyls and Hydride","Organometallics","2007","26","8","1947","","10.1021/om0611296","","","0.71073","MoKα","","0.0981","0.0619","","","0.1719","0.2091","","","","","","1.051","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072904","10.2632","0.0017","12.263","0.002","12.986","0.002","89.811","0.003","76.04","0.003","69.851","0.003","1483.3","0.4","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H32 Al I2 N O2 S -","- C26 H32 Al I2 N O2 S -","- C52 H64 Al2 I4 N2 O4 S2 -","2","1","","Zhao, Jian; Song, Haibin; Cui, Chunming","Synthesis and Reactions of Aluminum Sulfonamide Alkyls and Hydride","Organometallics","2007","26","8","1947","","10.1021/om0611296","","","0.71073","MoKα","","0.0887","0.0501","","","0.1388","0.1654","","","","","","1.025","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072905","40.2284","0.0005","40.2284","0.0005","10.693","0.0001","90","","90","","90","","17304.7","0.3","113","2","113","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C46 H53 Al N2 O4 S2 -","- C46 H53 Al N2 O4 S2 -","- C736 H848 Al16 N32 O64 S32 -","16","1","","Zhao, Jian; Song, Haibin; Cui, Chunming","Synthesis and Reactions of Aluminum Sulfonamide Alkyls and Hydride","Organometallics","2007","26","8","1947","","10.1021/om0611296","","","0.7107","MoKα","","0.055","0.0482","","","0.1148","0.1193","","","","","","1.085","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072906","11.27","0.003","11.371","0.003","12.802","0.003","77.355","0.004","75.431","0.004","65.187","0.004","1429.2","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H64 Li2 N2 O8 S2 -","- C54 H64 Li2 N2 O8 S2 -","- C54 H64 Li2 N2 O8 S2 -","1","0.5","","Zhao, Jian; Song, Haibin; Cui, Chunming","Synthesis and Reactions of Aluminum Sulfonamide Alkyls and Hydride","Organometallics","2007","26","8","1947","","10.1021/om0611296","","","0.71073","MoKα","","0.1191","0.062","","","0.1692","0.2138","","","","","","1.035","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072907","46.107","0.003","46.107","0.003","13.1715","0.0012","90","","90","","120","","24249","3","113","2","113","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C58 H67 Al N2 O5 S2 -","- C58 H67 Al N2 O5 S2 -","- C1044 H1206 Al18 N36 O90 S36 -","18","1","","Zhao, Jian; Song, Haibin; Cui, Chunming","Synthesis and Reactions of Aluminum Sulfonamide Alkyls and Hydride","Organometallics","2007","26","8","1947","","10.1021/om0611296","","","0.7107","MoKα","","0.1487","0.1206","","","0.2077","0.2192","","","","","","1.285","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072908","13.4753","0.0008","13.1464","0.0008","21.8713","0.0013","90","","91.061","0.001","90","","3873.9","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H39 Cl4 N P2 Ru -","- C44 H39 Cl4 N P2 Ru -","- C176 H156 Cl16 N4 P8 Ru4 -","4","1","","Zhang, Li; Dang, Li; Wen, Ting Bin; Sung, Herman H.-Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen","Cyclometalation of 2-Vinylpyridine with MCl2(PPh3)3and MHCl(PPh3)3(M = Ru, Os)","Organometallics","2007","26","11","2849","","10.1021/om0611305","","","0.71073","MoKα","","0.0656","0.0568","","","0.1158","0.1192","","","","","","1.085","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072909","9.3139","0.0011","14.6492","0.0018","19.876","0.002","99.525","0.002","97.661","0.002","91.188","0.002","2648.1","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H28 Cl N2 P Ru -","- C32 H28 Cl N2 P Ru -","- C128 H112 Cl4 N8 P4 Ru4 -","4","2","","Zhang, Li; Dang, Li; Wen, Ting Bin; Sung, Herman H.-Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen","Cyclometalation of 2-Vinylpyridine with MCl2(PPh3)3and MHCl(PPh3)3(M = Ru, Os)","Organometallics","2007","26","11","2849","","10.1021/om0611305","","","0.71073","MoKα","","0.0626","0.0447","","","0.0923","0.0982","","","","","","0.953","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072910","9.9664","0.0012","10.2744","0.0013","16.463","0.002","82.292","0.002","82.888","0.002","74.077","0.002","1599.8","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H36 Cl N2 Os P -","- C39 H36 Cl N2 Os P -","- C78 H72 Cl2 N4 Os2 P2 -","2","1","","Zhang, Li; Dang, Li; Wen, Ting Bin; Sung, Herman H.-Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen","Cyclometalation of 2-Vinylpyridine with MCl2(PPh3)3and MHCl(PPh3)3(M = Ru, Os)","Organometallics","2007","26","11","2849","","10.1021/om0611305","","","0.71073","MoKα","","0.0468","0.0381","","","0.0754","0.0777","","","","","","1.04","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072911","11.4371","0.0007","13.5518","0.0008","16.7303","0.001","73.118","0.001","78.738","0.001","74.774","0.001","2374.3","0.2","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C52 H47 B Cl4 F4 N2 Os P2 -","- C52 H47 B Cl4 F4 N2 Os P2 -","- C104 H94 B2 Cl8 F8 N4 Os2 P4 -","2","1","","Zhang, Li; Dang, Li; Wen, Ting Bin; Sung, Herman H.-Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen","Cyclometalation of 2-Vinylpyridine with MCl2(PPh3)3and MHCl(PPh3)3(M = Ru, Os)","Organometallics","2007","26","11","2849","","10.1021/om0611305","","","0.71073","MoKα","","0.0413","0.0339","","","0.0762","0.0783","","","","","","1.004","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072912","18.972","0.0018","23.084","0.003","18.993","0.002","90","","90","","90","","8318","1.6","100","2","100","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C78 H117 Ce3 N6 -","- C78 H117 Ce3 N6 -","- C312 H468 Ce12 N24 -","4","1","","Maynadié, Jérôme; Berthet, Jean-Claude; Thuéry, Pierre; Ephritikhine, Michel","Cyanide Metallocenes of Trivalent f-Elements","Organometallics","2007","26","10","2623","2629","10.1021/om061131x","","","0.71073","MoKα","","0.1675","0.0714","","","0.1362","0.1547","","","","","","0.893","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072913","35.8003","0.0015","12.2794","0.0005","27.5754","0.0013","90","","106.107","0.003","90","","11646.5","0.9","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C53 H76 N5 Na2 O2 U2 -","- C53 H76 N5 Na2 O2 U2 -","- C424 H608 N40 Na16 O16 U16 -","8","1","","Maynadié, Jérôme; Berthet, Jean-Claude; Thuéry, Pierre; Ephritikhine, Michel","Cyanide Metallocenes of Trivalent f-Elements","Organometallics","2007","26","10","2623","2629","10.1021/om061131x","","","0.71073","MoKα","","0.0581","0.0381","","","0.0957","0.1021","","","","","","1.032","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072914","21.8298","0.0004","14.7017","0.0003","20.2229","0.0004","90","","120.987","0.0011","90","","5564","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C55 H102 Ce N5 -","- C55 H102 Ce N5 -","- C220 H408 Ce4 N20 -","4","0.5","","Maynadié, Jérôme; Berthet, Jean-Claude; Thuéry, Pierre; Ephritikhine, Michel","Cyanide Metallocenes of Trivalent f-Elements","Organometallics","2007","26","10","2623","2629","10.1021/om061131x","","","0.71073","MoKα","","0.0183","0.0175","","","0.0469","0.0473","","","","","","1.055","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072915","14.1594","0.0015","20.725","0.002","37.503","0.005","90","","90","","90","","11005","2","95","1","95","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","cmc0431a","","","- C31 H31.5 Cl N O1.25 P Pd -","- C31 H31.5 Cl N O1.25 P Pd -","- C496 H504 Cl16 N16 O20 P16 Pd16 -","16","4","","Mawo, Relindis Y.; Mustakim, Sheikh; Young, Jr., Victor G.; Hoffmann, Mark R.; Smoliakova, Irina P.","Endo-Effect-Driven Regioselectivity in the Cyclopalladation of (S)-2-tert-Butyl-4-phenyl-2-oxazoline","Organometallics","2007","26","7","1801","","10.1021/om061132p","","","0.49594","","","0.053","0.0397","","","0.0836","0.0877","","","","","","1.065","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072916","12.8735","0.0006","8.3211","0.0004","11.1528","0.0005","90","","115.549","0.001","90","","1077.88","0.09","87","2","87","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Mono-bridged ansa chromocene carbonyl","","","- C14 H14 Cr O -","- C14 H14 Cr O -","- C56 H56 Cr4 O4 -","4","1","","Perrotin, Philippe; Shapiro, Pamela J.; Williams, Mark; Twamley, Brendan","In Search of a Versatile Pathway toansa-Chromocene Complexes. Synthesis and Characterization of the Highly Unstableansa-Chromocene Carbonyl Complex Me2C(C5H4)2CrCO","Organometallics","2007","26","7","1823","","10.1021/om061136u","","","0.71073","MoKα","","0.0337","0.0303","","","0.0755","0.0773","","","","","","1.066","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072917","14.3948","0.0008","8.3443","0.0005","15.8022","0.0009","90","","90.894","0.001","90","","1897.84","0.19","185","2","185","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Me2CCp2Mg.2THF","","","- C21 H30 Mg O2 -","- C21 H30 Mg O2 -","- C84 H120 Mg4 O8 -","4","1","","Perrotin, Philippe; Shapiro, Pamela J.; Williams, Mark; Twamley, Brendan","In Search of a Versatile Pathway toansa-Chromocene Complexes. Synthesis and Characterization of the Highly Unstableansa-Chromocene Carbonyl Complex Me2C(C5H4)2CrCO","Organometallics","2007","26","7","1823","","10.1021/om061136u","","","0.71073","MoKα","","0.1289","0.0673","","","0.1385","0.1652","","","","","","1.003","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072918","9.117","0.004","9.932","0.003","13.46","0.01","91.99","0.06","97.13","0.07","112.58","0.03","1112.1","1.1","293.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H30 O2 Pt S2 -","- C20 H30 O2 Pt S2 -","- C40 H60 O4 Pt2 S4 -","2","1","","Yagyu, Takeyoshi; Ohashi, Jun-ichi; Maeda, Masunobu","Monoarylplatinum(II) Complexes with a 2-Phenylpyridyl Ligand and Coordinated Solvent, [Pt(Ar)(Phpy)(solv)] (Phpy = 2-phenylpyridyl; solv = NCCH3, dmso). Preparation from [Pt(Ar)2(solv)2], Structures, and Chemical Properties","Organometallics","2007","26","9","2383","","10.1021/om061137m","","","0.7107","MoKα","","","0.0387","","","","0.0967","","","","","","1.362","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072919","8.5086","0.0002","15.891","0.0007","19.133","0.001","90","","90","","90","","2586.98","0.19","173.2","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H18 F12 O2 Pt S2 -","- C20 H18 F12 O2 Pt S2 -","- C80 H72 F48 O8 Pt4 S8 -","4","1","","Yagyu, Takeyoshi; Ohashi, Jun-ichi; Maeda, Masunobu","Monoarylplatinum(II) Complexes with a 2-Phenylpyridyl Ligand and Coordinated Solvent, [Pt(Ar)(Phpy)(solv)] (Phpy = 2-phenylpyridyl; solv = NCCH3, dmso). Preparation from [Pt(Ar)2(solv)2], Structures, and Chemical Properties","Organometallics","2007","26","9","2383","","10.1021/om061137m","","","0.7107","MoKα","","","0.0248","","","","0.0552","","","","","","0.593","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072920","8.699","0.002","19.281","0.003","23.397","0.004","90","","90","","90","","3924.3","1.3","173.2","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C21 H23 N O Pt S -","- C21 H23 N O Pt S -","- C168 H184 N8 O8 Pt8 S8 -","8","1","","Yagyu, Takeyoshi; Ohashi, Jun-ichi; Maeda, Masunobu","Monoarylplatinum(II) Complexes with a 2-Phenylpyridyl Ligand and Coordinated Solvent, [Pt(Ar)(Phpy)(solv)] (Phpy = 2-phenylpyridyl; solv = NCCH3, dmso). Preparation from [Pt(Ar)2(solv)2], Structures, and Chemical Properties","Organometallics","2007","26","9","2383","","10.1021/om061137m","","","0.7107","MoKα","","","0.0662","","","","0.1276","","","","","","1.087","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072921","9.432","0.005","8.63","0.005","21.46","0.01","90","","100.75","0.04","90","","1716.1","1.6","293.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 N O Pt S -","- C19 H19 N O Pt S -","- C76 H76 N4 O4 Pt4 S4 -","4","1","","Yagyu, Takeyoshi; Ohashi, Jun-ichi; Maeda, Masunobu","Monoarylplatinum(II) Complexes with a 2-Phenylpyridyl Ligand and Coordinated Solvent, [Pt(Ar)(Phpy)(solv)] (Phpy = 2-phenylpyridyl; solv = NCCH3, dmso). Preparation from [Pt(Ar)2(solv)2], Structures, and Chemical Properties","Organometallics","2007","26","9","2383","","10.1021/om061137m","","","0.7107","MoKα","","","0.0355","","","","0.0797","","","","","","1.018","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072922","8.8977","0.0002","19.0682","0.0002","17.1095","0.0004","90","","100.591","0.001","90","","2853.4","0.1","173.2","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H32 F3 N O Pt S -","- C30 H32 F3 N O Pt S -","- C120 H128 F12 N4 O4 Pt4 S4 -","4","1","","Yagyu, Takeyoshi; Ohashi, Jun-ichi; Maeda, Masunobu","Monoarylplatinum(II) Complexes with a 2-Phenylpyridyl Ligand and Coordinated Solvent, [Pt(Ar)(Phpy)(solv)] (Phpy = 2-phenylpyridyl; solv = NCCH3, dmso). Preparation from [Pt(Ar)2(solv)2], Structures, and Chemical Properties","Organometallics","2007","26","9","2383","","10.1021/om061137m","","","0.7107","MoKα","","","0.0306","","","","0.0797","","","","","","0.827","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072923","8.8419","0.0006","10.2442","0.0007","12.442","0.001","103.518","0.003","105.202","0.003","99.25","0.001","1027.38","0.13","173.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C19 H11 F6 I2 N Pt -","- C38 H22 F12 I4 N2 Pt2 -","- C76 H44 F24 I8 N4 Pt4 -","2","1","","Yagyu, Takeyoshi; Ohashi, Jun-ichi; Maeda, Masunobu","Monoarylplatinum(II) Complexes with a 2-Phenylpyridyl Ligand and Coordinated Solvent, [Pt(Ar)(Phpy)(solv)] (Phpy = 2-phenylpyridyl; solv = NCCH3, dmso). Preparation from [Pt(Ar)2(solv)2], Structures, and Chemical Properties","Organometallics","2007","26","9","2383","","10.1021/om061137m","","","0.7107","MoKα","","","0.0267","","","","0.0587","","","","","","0.874","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072924","23.402","0.005","11.5","0.002","28.474","0.006","90","","107.86","0.03","90","","7294","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58 H104 Fe K2 O12 Si6 -","- C58 H104 Fe K2 O12 Si6 -","- C232 H416 Fe4 K8 O48 Si24 -","4","1","","Wagner, Harald; Baumgartner, Judith; Marschner, Christoph","1,1‘-Oligosilylferrocene Compounds","Organometallics","2007","26","7","1762","","10.1021/om061138e","","","0.71073","MoKα","","0.0772","0.0705","","","0.1301","0.133","","","","","","1.311","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072925","10.354","0.002","12.174","0.002","46.891","0.009","93.28","0.03","91.27","0.03","91.24","0.03","5897.9","1.9","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H44 Fe Si6 -","- C22 H44 Fe Si6 -","- C176 H352 Fe8 Si48 -","8","4","","Wagner, Harald; Baumgartner, Judith; Marschner, Christoph","1,1‘-Oligosilylferrocene Compounds","Organometallics","2007","26","7","1762","","10.1021/om061138e","","","0.71073","MoKα","","0.1311","0.0969","","","0.1765","0.1899","","","","","","1.2","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072926","13.692","0.003","18.305","0.004","17.25","0.003","90","","92","0.03","90","","4320.8","1.5","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32.5 H65 Fe Mg O2 Si6 -","- C32.5 H65 Fe Mg O2 Si6 -","- C130 H260 Fe4 Mg4 O8 Si24 -","4","1","","Wagner, Harald; Baumgartner, Judith; Marschner, Christoph","1,1‘-Oligosilylferrocene Compounds","Organometallics","2007","26","7","1762","","10.1021/om061138e","","","0.71073","MoKα","","0.0631","0.048","","","0.1311","0.1377","","","","","","1.066","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072927","10.947","0.002","15.391","0.003","11.461","0.002","90","","107.01","0.03","90","","1846.5","0.7","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C26 H54 Fe O Si6 Zn -","- C26 H54 Fe O Si6 Zn -","- C52 H108 Fe2 O2 Si12 Zn2 -","2","1","","Wagner, Harald; Baumgartner, Judith; Marschner, Christoph","1,1‘-Oligosilylferrocene Compounds","Organometallics","2007","26","7","1762","","10.1021/om061138e","","","0.71073","MoKα","","0.0453","0.042","","","0.0821","0.0833","","","","","","1.077","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072928","16.67","0.003","11.827","0.002","20.571","0.004","90","","113.38","0.03","90","","3722.7","1.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H54 Fe Hf Si6 -","- C32 H54 Fe Hf Si6 -","- C128 H216 Fe4 Hf4 Si24 -","4","1","","Wagner, Harald; Baumgartner, Judith; Marschner, Christoph","1,1‘-Oligosilylferrocene Compounds","Organometallics","2007","26","7","1762","","10.1021/om061138e","","","0.71073","MoKα","","0.0462","0.0421","","","0.0799","0.0814","","","","","","1.242","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072929","8.6754","0.0017","18.203","0.004","9.5236","0.0019","90","","98.71","0.03","90","","1486.6","0.5","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H44 Fe Si6 -","- C22 H44 Fe Si6 -","- C44 H88 Fe2 Si12 -","2","1","","Wagner, Harald; Baumgartner, Judith; Marschner, Christoph","1,1‘-Oligosilylferrocene Compounds","Organometallics","2007","26","7","1762","","10.1021/om061138e","","","0.71073","MoKα","","0.0359","0.0343","","","0.0829","0.0839","","","","","","1.078","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072930","12.3293","0.0017","12.9894","0.0018","18.476","0.003","90","","90","","90","","2958.9","0.8","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C34 H36 Fe P2 Si -","- C34 H36 Fe P2 Si -","- C136 H144 Fe4 P8 Si4 -","4","1","","Kumar, Mukesh; Cervantes-Lee, Francisco; Sharma, Hemant K.; Pannell, Keith H.","Structural and Redox Properties of Novel Spirocyclic 1-Sila-3-ferracyclobutanes, [(η5-C5H4)Fe(L2)CH2SiMe2], L2= P−P (diphosphine)","Organometallics","2007","26","12","3005","","10.1021/om061141y","","","0.71073","MoKα","","0.0691","0.0601","","","0.1218","0.1259","","","","","","1.147","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072931","16.794","0.003","30.921","0.005","15.991","0.003","90","","90","","90","","8304","3","150","2","150","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C44.5 H62.5 N4 Sm -","- C43 H59 N4 Sm -","- C344 H472 N32 Sm8 -","8","1","","Frey, Alistair S. P.; Gardiner, Michael G.; Stringer, Damien N.; Yates, Brian F.; George, Adrian V.; Jensen, Paul; Turner, Peter","Buckling under Strain: Relief of Steric Pressure Occurs Differently for Samarium(III) Porphyrinogen Complexes of the π-Bound Auxiliary Ligands Cyclopentadienyl and Cyclooctatetraenediyl","Organometallics","2007","26","6","1299","","10.1021/om061143i","","","0.71073","MoKα","","0.0665","0.0374","","","0.0843","0.0913","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4072932","19.8414","0.0003","13.6819","0.0002","31.6735","0.0005","90","","99.861","0.001","90","","8471.3","0.2","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C98 H132 N8 Sm2 -","- C98 H132 N8 Sm2 -","- C392 H528 N32 Sm8 -","4","0.5","","Frey, Alistair S. P.; Gardiner, Michael G.; Stringer, Damien N.; Yates, Brian F.; George, Adrian V.; Jensen, Paul; Turner, Peter","Buckling under Strain: Relief of Steric Pressure Occurs Differently for Samarium(III) Porphyrinogen Complexes of the π-Bound Auxiliary Ligands Cyclopentadienyl and Cyclooctatetraenediyl","Organometallics","2007","26","6","1299","","10.1021/om061143i","","","0.71073","MoKα","","0.0384","0.0266","","","0.0568","0.0603","","","","","","1.026","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4072933","5.9353","0.0008","18.965","0.002","16.687","0.004","90","","90.643","0.018","90","","1878.2","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H22 I2 O2 Te -","- C12 H22 I2 O2 Te -","- C48 H88 I8 O8 Te4 -","4","1","","Chauhan, Ashok K. S.; Singh, Puspendra; Kumar, Arun; Srivastava, Ramesh C.; Butcher, Ray J.; Duthie, Andrew","Room-Temperature Insertion of Elemental Tellurium into the Csp3−Br and −I Bonds of α-Bromo- and α-Iodopinacolone","Organometallics","2007","26","8","1955","","10.1021/om061144a","","","1.54178","CuKα","","0.0961","0.0785","","","0.2085","0.2345","","","","","","1.089","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072934","6.3922","0.0003","14.4621","0.0007","19.073","0.0009","90","","94.477","0.001","90","","1757.82","0.14","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Cl2 O Te -","- C16 H18 Cl2 O Te -","- C64 H72 Cl8 O4 Te4 -","4","1","","Chauhan, Ashok K. S.; Singh, Puspendra; Kumar, Arun; Srivastava, Ramesh C.; Butcher, Ray J.; Duthie, Andrew","Room-Temperature Insertion of Elemental Tellurium into the Csp3−Br and −I Bonds of α-Bromo- and α-Iodopinacolone","Organometallics","2007","26","8","1955","","10.1021/om061144a","","","0.71073","MoKα","","0.0398","0.0266","","","0.0634","0.0666","","","","","","1.056","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072935","6.515","0.0012","14.279","0.003","19.049","0.004","90","","93.574","0.003","90","","1768.6","0.6","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Br2 O Te -","- C16 H18 Br2 O Te -","- C64 H72 Br8 O4 Te4 -","4","1","","Chauhan, Ashok K. S.; Singh, Puspendra; Kumar, Arun; Srivastava, Ramesh C.; Butcher, Ray J.; Duthie, Andrew","Room-Temperature Insertion of Elemental Tellurium into the Csp3−Br and −I Bonds of α-Bromo- and α-Iodopinacolone","Organometallics","2007","26","8","1955","","10.1021/om061144a","","","0.71073","MoKα","","0.038","0.033","","","0.0722","0.0742","","","","","","1.001","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072936","9.3437","0.0018","18.924","0.004","20.531","0.004","90","","90","","90","","3630.3","1.3","93","2","93","2","","","","","","","","5","P c a b","-P 2bc 2ac","61","","","","- C16 H18 I2 O Te -","- C16 H18 I2 O Te -","- C128 H144 I16 O8 Te8 -","8","1","","Chauhan, Ashok K. S.; Singh, Puspendra; Kumar, Arun; Srivastava, Ramesh C.; Butcher, Ray J.; Duthie, Andrew","Room-Temperature Insertion of Elemental Tellurium into the Csp3−Br and −I Bonds of α-Bromo- and α-Iodopinacolone","Organometallics","2007","26","8","1955","","10.1021/om061144a","","","0.71073","MoKα","","0.0896","0.0541","","","0.1354","0.1722","","","","","","1.031","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072937","8.683","0.002","9.604","0.002","11.03","0.002","72.785","0.003","81.713","0.006","85.755","0.006","868.9","0.3","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H22 Br2 O Te -","- C15 H22 Br2 O Te -","- C30 H44 Br4 O2 Te2 -","2","1","","Chauhan, Ashok K. S.; Singh, Puspendra; Kumar, Arun; Srivastava, Ramesh C.; Butcher, Ray J.; Duthie, Andrew","Room-Temperature Insertion of Elemental Tellurium into the Csp3−Br and −I Bonds of α-Bromo- and α-Iodopinacolone","Organometallics","2007","26","8","1955","","10.1021/om061144a","","","0.71073","MoKα","","0.063","0.0561","","","0.1499","0.1536","","","","","","1.008","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072938","14.655","0.001","18.22","0.003","14.726","0.002","90","","98.6","0.008","90","","3887.8","0.9","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H21 B Bi F20 N -","- C42 H21 B Bi F20 N -","- C168 H84 B4 Bi4 F80 N4 -","4","1","","Bao, Ming; Hayashi, Teruyuki; Shimada, Shigeru","Cationic Organobismuth Complex with 5,6,7,12-Tetrahydrodibenz[c,f][1,5]azabismocine Framework and Its Coordination Complexes with Neutral Molecules","Organometallics","2007","26","7","1816","","10.1021/om0611453","","","0.7107","MoKα","","","0.024","","","","0.065","","","","","","1.025","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072939","10.083","0.0006","14.748","0.0009","39.812","0.002","90","","92.056","0.001","90","","5916.4","0.6","153","2","153","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C61 H44 B Bi2 Br Cl2 F20 N2 -","- C61 H44 B Bi2 Br Cl2 F20 N2 -","- C244 H176 B4 Bi8 Br4 Cl8 F80 N8 -","4","1","","Bao, Ming; Hayashi, Teruyuki; Shimada, Shigeru","Cationic Organobismuth Complex with 5,6,7,12-Tetrahydrodibenz[c,f][1,5]azabismocine Framework and Its Coordination Complexes with Neutral Molecules","Organometallics","2007","26","7","1816","","10.1021/om0611453","","","0.71069","MoKα","","","0.045","","","","0.0976","","","","","","1.18","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072940","10.0838","0.0005","14.8011","0.0008","39.526","0.002","90","","91.831","0.001","90","","5896.3","0.5","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C61 H44 B Bi2 Cl3 F20 N2 -","- C61 H44 B Bi2 Cl3 F20 N2 -","- C244 H176 B4 Bi8 Cl12 F80 N8 -","4","1","","Bao, Ming; Hayashi, Teruyuki; Shimada, Shigeru","Cationic Organobismuth Complex with 5,6,7,12-Tetrahydrodibenz[c,f][1,5]azabismocine Framework and Its Coordination Complexes with Neutral Molecules","Organometallics","2007","26","7","1816","","10.1021/om0611453","","","0.71069","MoKα","","","0.0414","","","","0.0805","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072941","21.409","0.002","24.581","0.003","15.7085","0.0017","90","","90","","90","","8266.7","1.6","153","2","153","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C44 H25 B Bi F20 N O -","- C44 H25 B Bi F20 N O -","- C352 H200 B8 Bi8 F160 N8 O8 -","8","2","","Bao, Ming; Hayashi, Teruyuki; Shimada, Shigeru","Cationic Organobismuth Complex with 5,6,7,12-Tetrahydrodibenz[c,f][1,5]azabismocine Framework and Its Coordination Complexes with Neutral Molecules","Organometallics","2007","26","7","1816","","10.1021/om0611453","","","0.71069","MoKα","","","0.0441","","","","0.1058","","","","","","1.045","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072942","21.2482","0.0014","15.82","0.0011","24.3741","0.0017","90","","90","","90","","8193.3","1","153","2","153","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C43 H25 B Bi F20 N O -","- C43 H24 B Bi F20 N O -","- C344 H192 B8 Bi8 F160 N8 O8 -","8","1","","Bao, Ming; Hayashi, Teruyuki; Shimada, Shigeru","Cationic Organobismuth Complex with 5,6,7,12-Tetrahydrodibenz[c,f][1,5]azabismocine Framework and Its Coordination Complexes with Neutral Molecules","Organometallics","2007","26","7","1816","","10.1021/om0611453","","","0.71069","MoKα","","","0.0432","","","","0.1281","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072943","16.1503","0.0009","19.368","0.001","13.6021","0.0007","90","","105.552","0.001","90","","4098.9","0.4","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H24 B Bi F20 N2 -","- C44 H24 B Bi F20 N2 -","- C176 H96 B4 Bi4 F80 N8 -","4","1","","Bao, Ming; Hayashi, Teruyuki; Shimada, Shigeru","Cationic Organobismuth Complex with 5,6,7,12-Tetrahydrodibenz[c,f][1,5]azabismocine Framework and Its Coordination Complexes with Neutral Molecules","Organometallics","2007","26","7","1816","","10.1021/om0611453","","","0.71069","MoKα","","","0.0304","","","","0.0745","","","","","","1.019","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072944","21.3142","0.001","15.8821","0.0008","24.2633","0.0012","90","","90","","90","","8213.5","0.7","153","2","153","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C43 H23 B Bi Cl2 F20 N -","- C43 H23 B Bi Cl2 F20 N -","- C344 H184 B8 Bi8 Cl16 F160 N8 -","8","1","","Bao, Ming; Hayashi, Teruyuki; Shimada, Shigeru","Cationic Organobismuth Complex with 5,6,7,12-Tetrahydrodibenz[c,f][1,5]azabismocine Framework and Its Coordination Complexes with Neutral Molecules","Organometallics","2007","26","7","1816","","10.1021/om0611453","","","0.71069","MoKα","","","0.043","","","","0.1129","","","","","","1.067","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072945","17.81","0.07","18.24","0.07","19.05","0.07","90","0.07","114.45","0.07","90","0.07","5634","4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","7b-pyr x 1.5 c6h6","","","- C56 H65 I2 N2 Ni O -","- C56 H56 I2 N2 Ni O -","- C224 H224 I8 N8 Ni4 O4 -","4","1","","Göttker-Schnetmann, Inigo; Wehrmann, Peter; Röhr, Caroline; Mecking, Stefan","Substituent Effects in (κ2-N,O)-Salicylaldiminato Nickel(II)−Methyl Pyridine Polymerization Catalysts: Terphenyls Controlling Polyethylene Microstructures","Organometallics","2007","26","9","2348","","10.1021/om0611498","","","0.7107","MoKα","","0.1066","0.0548","","","0.145","0.16","","","","","","0.889","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072946","10.116","0.003","15.276","0.004","16.317","0.005","85.398","0.005","80.664","0.005","81.1","0.006","2454.2","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","8f-pyr x 1.5 c6h6","","","- C58 H51 N2 Ni O5 -","- C58 H51 N2 Ni O5 -","- C116 H102 N4 Ni2 O10 -","2","1","","Göttker-Schnetmann, Inigo; Wehrmann, Peter; Röhr, Caroline; Mecking, Stefan","Substituent Effects in (κ2-N,O)-Salicylaldiminato Nickel(II)−Methyl Pyridine Polymerization Catalysts: Terphenyls Controlling Polyethylene Microstructures","Organometallics","2007","26","9","2348","","10.1021/om0611498","","","0.7107","MoKα","","0.1403","0.0406","","","0.0724","0.085","","","","","","0.682","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072947","12.4415","0.0005","18.3805","0.0005","21.8617","0.0007","90","","91.0903","0.0014","90","","4998.5","0.3","243.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H62 N2 O8 Ti2 -","- C46 H62 N2 O8 Ti2 -","- C184 H248 N8 O32 Ti8 -","4","1","","Padmanabhan, Sudhakar; Katao, Shouhei; Nomura, Kotohiro","Synthesis and Structure of Titanatranes Containing Tetradentate Trianionic Donor Ligands of the Type [(O-2,4-R2C6H2-6-CH2)2(OCH2CH2)]N3-and Their Use in Catalysis for Ethylene Polymerization","Organometallics","2007","26","7","1616","","10.1021/om0611507","","","0.71075","MoKα","","","0.0606","","","","0.1084","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072948","16.8463","0.0006","17.3301","0.0005","21.5182","0.0006","90","","99.739","0.0009","90","","6191.7","0.3","243.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C63 H90 N2 O10 Ti2 -","- C63 H90 N2 O10 Ti2 -","- C252 H360 N8 O40 Ti8 -","4","1","","Padmanabhan, Sudhakar; Katao, Shouhei; Nomura, Kotohiro","Synthesis and Structure of Titanatranes Containing Tetradentate Trianionic Donor Ligands of the Type [(O-2,4-R2C6H2-6-CH2)2(OCH2CH2)]N3-and Their Use in Catalysis for Ethylene Polymerization","Organometallics","2007","26","7","1616","","10.1021/om0611507","","","0.71075","MoKα","","","0.0486","","","","0.1152","","","","","","1.008","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072949","10.5075","0.0005","29.4993","0.0013","11.6832","0.0008","90","","104.319","0.002","90","","3508.9","0.3","243.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H55 N O4 Ti -","- C35 H55 N O4 Ti -","- C140 H220 N4 O16 Ti4 -","4","1","","Padmanabhan, Sudhakar; Katao, Shouhei; Nomura, Kotohiro","Synthesis and Structure of Titanatranes Containing Tetradentate Trianionic Donor Ligands of the Type [(O-2,4-R2C6H2-6-CH2)2(OCH2CH2)]N3-and Their Use in Catalysis for Ethylene Polymerization","Organometallics","2007","26","7","1616","","10.1021/om0611507","","","0.71075","MoKα","","","0.0588","","","","0.1485","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072950","10.9424","0.0004","12.2541","0.0005","15.0994","0.0006","98.7288","0.0012","106.885","0.001","103.613","0.0013","1829.46","0.13","243.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H57 N O4 Ti -","- C36 H57 N O4 Ti -","- C72 H114 N2 O8 Ti2 -","2","1","","Padmanabhan, Sudhakar; Katao, Shouhei; Nomura, Kotohiro","Synthesis and Structure of Titanatranes Containing Tetradentate Trianionic Donor Ligands of the Type [(O-2,4-R2C6H2-6-CH2)2(OCH2CH2)]N3-and Their Use in Catalysis for Ethylene Polymerization","Organometallics","2007","26","7","1616","","10.1021/om0611507","","","0.71075","MoKα","","","0.0586","","","","0.1151","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072951","8.4595","0.0003","21.2466","0.0007","15.3664","0.0005","90","","100.084","0.0012","90","","2719.22","0.16","243.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H40 Al N O4 Ti -","- C26 H40 Al N O4 Ti -","- C104 H160 Al4 N4 O16 Ti4 -","4","1","","Padmanabhan, Sudhakar; Katao, Shouhei; Nomura, Kotohiro","Synthesis and Structure of Titanatranes Containing Tetradentate Trianionic Donor Ligands of the Type [(O-2,4-R2C6H2-6-CH2)2(OCH2CH2)]N3-and Their Use in Catalysis for Ethylene Polymerization","Organometallics","2007","26","7","1616","","10.1021/om0611507","","","0.71075","MoKα","","","0.0394","","","","0.1219","","","","","","1.009","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072952","16.1827","0.0004","15.6776","0.0004","22.2677","0.0008","90","","90","","90","","5649.4","0.3","243.1","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C27 H42 Al N O4 Ti -","- C27 H42 Al N O4 Ti -","- C216 H336 Al8 N8 O32 Ti8 -","8","1","","Padmanabhan, Sudhakar; Katao, Shouhei; Nomura, Kotohiro","Synthesis and Structure of Titanatranes Containing Tetradentate Trianionic Donor Ligands of the Type [(O-2,4-R2C6H2-6-CH2)2(OCH2CH2)]N3-and Their Use in Catalysis for Ethylene Polymerization","Organometallics","2007","26","7","1616","","10.1021/om0611507","","","0.71075","MoKα","","","0.0441","","","","0.109","","","","","","1.009","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4072953","11.2982","0.0007","13.0684","0.001","16.363","0.002","94.492","0.009","102.001","0.008","97.92","0.006","2326.3","0.4","140","2","140","2","","","","","","","","8","P -1","-P 1","2","3.CH~2~Cl~2~","η^5^-[bis(η^5^-cyclopentadienyl)iron(II)]-\ κ^5^<i>C</i>^1^,<i>C</i>^2^,<i>C</i>^3^,<i>C</i>^4^,C^5^-thallium(I) bis[tris(pentafluorophenyl)boron]amide dichloromethane solvate","","- C47 H14 B2 Cl2 F30 Fe N Tl -","- C47 H14 B2 Cl2 F30 Fe N Tl -","- C94 H28 B4 Cl4 F60 Fe2 N2 Tl2 -","2","1","","Sarazin, Yann; Kaltsoyannis, Nikolas; Wright, Joseph A.; Bochmann, Manfred","Mono(arene) Complexes of Thallium(I) Supported by a Weakly Coordinating Anion","Organometallics","2007","26","7","1811","","10.1021/om061154b","","x-ray","0.71073","MoKα","","0.0851","0.0426","","","0.087","0.0953","","","","","","0.859","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072954","11.4167","0.0008","13.8539","0.0007","33.436","0.002","90","","90.153","0.005","90","","5288.4","0.6","140","2","140","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","4.2CH~2~Cl~2~","(η^6^-Hexamethylbenzene)thallium(I) bis[tris(pentafluorophenyl)boron]amide bis(dichloromethane) solvate","","- C50 H24 B2 Cl4 F30 N Tl -","- C50 H24 B2 Cl4 F30 N Tl -","- C200 H96 B8 Cl16 F120 N4 Tl4 -","4","1","","Sarazin, Yann; Kaltsoyannis, Nikolas; Wright, Joseph A.; Bochmann, Manfred","Mono(arene) Complexes of Thallium(I) Supported by a Weakly Coordinating Anion","Organometallics","2007","26","7","1811","","10.1021/om061154b","","x-ray","0.71073","MoKα","","0.1032","0.0702","","","0.1683","0.1774","","","","","","1.117","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072955","8.2936","0.0007","10.2996","0.0008","10.3432","0.0008","66.992","0.001","75.125","0.001","81.912","0.001","785.18","0.11","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H19 Bi Cl2 N2 -","- C12 H19 Bi Cl2 N2 -","- C24 H38 Bi2 Cl4 N4 -","2","1","","Soran, Albert P.; Silvestru, Cristian; Breunig, Hans J.; Balázs, Gabor; Green, Jennifer C.","Organobismuth(III) Dihalides with T-Shaped Geometry Stabilized by Intramolecular N→Bi Interactions and Related Diorganobismuth(III) Halides","Organometallics","2007","26","5","1196","","10.1021/om0611608","","","0.71073","MoKα","","0.0267","0.0238","","","0.0507","0.0516","","","","","","1.022","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072956","16.177","0.004","11.491","0.003","8.4265","0.0019","90","","90","","90","","1566.4","0.7","297","2","297","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C12 H19 Bi Br2 N2 -","- C12 H19 Bi Br2 N2 -","- C48 H76 Bi4 Br8 N8 -","4","0.5","","Soran, Albert P.; Silvestru, Cristian; Breunig, Hans J.; Balázs, Gabor; Green, Jennifer C.","Organobismuth(III) Dihalides with T-Shaped Geometry Stabilized by Intramolecular N→Bi Interactions and Related Diorganobismuth(III) Halides","Organometallics","2007","26","5","1196","","10.1021/om0611608","","","0.71073","MoKα","","0.0427","0.034","","","0.0828","0.0868","","","","","","1.111","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072957","16.278","0.003","11.848","0.002","8.8883","0.0016","90","","90","","90","","1714.2","0.5","297","2","297","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C12 H19 Bi I2 N2 -","- C12 H19 Bi I2 N2 -","- C48 H76 Bi4 I8 N8 -","4","0.5","","Soran, Albert P.; Silvestru, Cristian; Breunig, Hans J.; Balázs, Gabor; Green, Jennifer C.","Organobismuth(III) Dihalides with T-Shaped Geometry Stabilized by Intramolecular N→Bi Interactions and Related Diorganobismuth(III) Halides","Organometallics","2007","26","5","1196","","10.1021/om0611608","","","0.71073","MoKα","","0.0286","0.0245","","","0.0469","0.0482","","","","","","1.138","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072958","11.984","0.0017","13.3474","0.0019","20.537","0.003","90","","90","","90","","3285","0.8","297","2","297","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C13 H22 Bi I N2 -","- C13 H22 Bi I N2 -","- C104 H176 Bi8 I8 N16 -","8","1","","Soran, Albert P.; Silvestru, Cristian; Breunig, Hans J.; Balázs, Gabor; Green, Jennifer C.","Organobismuth(III) Dihalides with T-Shaped Geometry Stabilized by Intramolecular N→Bi Interactions and Related Diorganobismuth(III) Halides","Organometallics","2007","26","5","1196","","10.1021/om0611608","","","0.71073","MoKα","","0.0632","0.0483","","","0.0918","0.0968","","","","","","1.159","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072959","9.9668","0.0007","17.2075","0.0012","15.5319","0.0011","90","","94.738","0.001","90","","2654.7","0.3","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H38 Bi Cl N4 -","- C24 H38 Bi Cl N4 -","- C96 H152 Bi4 Cl4 N16 -","4","1","","Soran, Albert P.; Silvestru, Cristian; Breunig, Hans J.; Balázs, Gabor; Green, Jennifer C.","Organobismuth(III) Dihalides with T-Shaped Geometry Stabilized by Intramolecular N→Bi Interactions and Related Diorganobismuth(III) Halides","Organometallics","2007","26","5","1196","","10.1021/om0611608","","","0.71073","MoKα","","0.0441","0.031","","","0.0563","0.0596","","","","","","1.043","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072960","23.5233","0.0015","11.0132","0.0008","15.5384","0.0011","90","","130.891","0.001","90","","3043.1","0.4","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C41 H30 O2 Si -","- C41 H30 O2 Si -","- C164 H120 O8 Si4 -","4","0.5","","Liu, Yuxia; Steiner, Stephen A.; Spahn, Cameron W.; Guzei, Ilia A.; Toulokhonova, Irina S.; West, Robert","A Stable, Highly Fluorescent Vinylogous β-Diketonate Silicon Complex","Organometallics","2007","26","6","1306","","10.1021/om061163k","","","0.71073","Mo-Kα","","0.0566","0.0415","","","0.118","0.1275","","","","","","0.954","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072961","18.12","0.003","8.7037","0.0015","24.177","0.004","90","","104.984","0.003","90","","3683.3","1.1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H57 B F4 O2 Os P2 -","- C35 H47 B F4 O2 Os P2 -","- C140 H188 B4 F16 O8 Os4 P8 -","4","1","","Bolaño, Tamara; Castarlenas, Ricardo; Esteruelas, Miguel A.; Oñate, Enrique","Hydride-Carbyne to Carbene Transformation in an Osmium-Acetate-Bis(triisopropylphosphine) System: Influence of the Coordination Mode of the Carboxylate and the Reaction Solvent","Organometallics","2007","26","8","2037","","10.1021/om0611655","","","0.71073","MoKα","","0.0448","0.0311","","","0.0792","0.0821","","","","","","0.906","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072962","20.354","0.002","9.5203","0.0011","23.038","0.003","90","","93.378","0.002","90","","4456.5","0.9","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C42 H69 B F4 N2 O3 Os P2 -","- C42 H69 B F4 N2 O3 Os P2 -","- C168 H276 B4 F16 N8 O12 Os4 P8 -","4","1","","Bolaño, Tamara; Castarlenas, Ricardo; Esteruelas, Miguel A.; Oñate, Enrique","Hydride-Carbyne to Carbene Transformation in an Osmium-Acetate-Bis(triisopropylphosphine) System: Influence of the Coordination Mode of the Carboxylate and the Reaction Solvent","Organometallics","2007","26","8","2037","","10.1021/om0611655","","","0.71073","MoKα","","0.0445","0.0272","","","0.0428","0.0448","","","","","","0.781","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072963","15.785","0.0003","16.3154","0.0004","21.8306","0.0003","90","","90","","90","","5622.22","0.19","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C25 H43 O3 P2 Pd -","- C25 H43 O3 P2 Pd -","- C200 H344 O24 P16 Pd8 -","8","1","","Johansson, Roger; Wendt, Ola F.","Synthesis and Reactivity of (PCP) Palladium Hydroxy Carbonyl and Related Complexes toward CO2and Phenylacetylene","Organometallics","2007","26","9","2426","","10.1021/om0611709","","","0.71073","MoKα","","0.1211","0.0383","","","0.0877","0.093","","","","","","0.911","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072964","30.3983","0.0011","12.8608","0.0007","15.4378","0.0009","90","","111.773","0.004","90","","5604.8","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H44 O2 P2 Pd -","- C25 H44 O2 P2 Pd -","- C200 H352 O16 P16 Pd8 -","8","1","","Johansson, Roger; Wendt, Ola F.","Synthesis and Reactivity of (PCP) Palladium Hydroxy Carbonyl and Related Complexes toward CO2and Phenylacetylene","Organometallics","2007","26","9","2426","","10.1021/om0611709","","","0.71073","MoKα","","0.0908","0.0521","","","0.1801","0.1857","","","","","","1.55","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072965","16.3617","0.0001","16.3617","0.0001","19.3825","0.0003","90","","90","","90","","5188.8","0.09","293","2","293","2","","","","","","","","4","I 41 c d","I 4bw -2c","110","","","","- C24 H44 P2 Pd -","- C24 H44 P2 Pd -","- C192 H352 P16 Pd8 -","8","0.5","","Johansson, Roger; Wendt, Ola F.","Synthesis and Reactivity of (PCP) Palladium Hydroxy Carbonyl and Related Complexes toward CO2and Phenylacetylene","Organometallics","2007","26","9","2426","","10.1021/om0611709","","","0.71073","MoKα","","0.1079","0.0328","","","0.0695","0.0943","","","","","","1.017","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072966","13.151","0.002","17.29","0.005","16.972","0.005","90","","96.502","0.014","90","","3834.3","1.7","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H64 O3 Si6 Yb -","- C26 H64 O3 Si6 Yb -","- C104 H256 O12 Si24 Yb4 -","4","0.5","","Bowman, Lyndsey J.; Izod, Keith; Clegg, William; Harrington, Ross W.","Synthesis and Structures of Ln(II) and Ln(III) Dialkyls Derived from LnI2(Ln = Nd, Tm, Yb)","Organometallics","2007","26","10","2646","","10.1021/om0611711","","","0.71073","MoKα","","0.0266","0.0219","","","0.0582","0.0609","","","","","","1.179","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072967","12.7912","0.0006","16.5615","0.0008","16.8787","0.0008","90","","90","","90","","3575.6","0.3","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H60 O3 Si6 Yb -","- C24 H60 O3 Si6 Yb -","- C96 H240 O12 Si24 Yb4 -","4","1","","Bowman, Lyndsey J.; Izod, Keith; Clegg, William; Harrington, Ross W.","Synthesis and Structures of Ln(II) and Ln(III) Dialkyls Derived from LnI2(Ln = Nd, Tm, Yb)","Organometallics","2007","26","10","2646","","10.1021/om0611711","","","0.6771","synchrotron","","0.0356","0.0324","","","0.0811","0.0822","","","","","","1.048","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072968","23.6067","0.0015","9.6827","0.0006","16.084","0.001","90","","90","","90","","3676.4","0.4","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C25 H63 O4 Si6 Tm -","- C25 H63 O4 Si6 Tm -","- C100 H252 O16 Si24 Tm4 -","4","1","","Bowman, Lyndsey J.; Izod, Keith; Clegg, William; Harrington, Ross W.","Synthesis and Structures of Ln(II) and Ln(III) Dialkyls Derived from LnI2(Ln = Nd, Tm, Yb)","Organometallics","2007","26","10","2646","","10.1021/om0611711","","","0.71073","MoKα","","0.0527","0.049","","","0.0897","0.0907","","","","","","1.372","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072969","9.6513","0.0007","16.9051","0.0012","12.0511","0.0009","90","","107.46","0.001","90","","1875.6","0.2","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H63 Nd O4 Si6 -","- C25 H63 Nd O4 Si6 -","- C50 H126 Nd2 O8 Si12 -","2","1","","Bowman, Lyndsey J.; Izod, Keith; Clegg, William; Harrington, Ross W.","Synthesis and Structures of Ln(II) and Ln(III) Dialkyls Derived from LnI2(Ln = Nd, Tm, Yb)","Organometallics","2007","26","10","2646","","10.1021/om0611711","","","0.6751","synchrotron","","0.0781","0.0526","","","0.1155","0.1299","","","","","","0.985","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072970","8.4095","0.0005","11.8025","0.0008","12.8638","0.001","114.724","0.007","92.134","0.005","96.054","0.005","1148.58","0.15","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H23 Fe2 N3 O5.25 S2 -","- C17 H23 Fe2 N3 O5.25 S2 -","- C34 H46 Fe4 N6 O10.5 S4 -","2","1","","Morvan, Didier; Capon, Jean-François; Gloaguen, Frédéric; Le Goff, Alan; Marchivie, Mathieu; Michaud, François; Schollhammer, Philippe; Talarmin, Jean; Yaouanc, Jean-Jacques; Pichon, Roger; Kervarec, Nelly","N-Heterocyclic Carbene Ligands in Nonsymmetric Diiron Models of Hydrogenase Active Sites","Organometallics","2007","26","8","2042","","10.1021/om061173l","","","0.71073","MoKα","","0.0491","0.0421","","","0.111","0.1169","","","","","","1.046","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072971","12.5655","0.0007","16.9556","0.001","15.7778","0.0009","90","","92.214","0.005","90","","3359","0.3","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H24 Fe4 N4 O10 S4 -","- C25 H24 Fe4 N4 O10 S4 -","- C100 H96 Fe16 N16 O40 S16 -","4","1","","Morvan, Didier; Capon, Jean-François; Gloaguen, Frédéric; Le Goff, Alan; Marchivie, Mathieu; Michaud, François; Schollhammer, Philippe; Talarmin, Jean; Yaouanc, Jean-Jacques; Pichon, Roger; Kervarec, Nelly","N-Heterocyclic Carbene Ligands in Nonsymmetric Diiron Models of Hydrogenase Active Sites","Organometallics","2007","26","8","2042","","10.1021/om061173l","","","0.71073","MoKα","","0.0582","0.0377","","","0.0782","0.0851","","","","","","0.923","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072972","12.5398","0.0007","10.9309","0.0007","14.5834","0.0006","90","","91.601","0.005","90","","1998.19","0.19","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Fe2 N4 O4 S2 -","- C16 H18 Fe2 N4 O4 S2 -","- C64 H72 Fe8 N16 O16 S8 -","4","1","","Morvan, Didier; Capon, Jean-François; Gloaguen, Frédéric; Le Goff, Alan; Marchivie, Mathieu; Michaud, François; Schollhammer, Philippe; Talarmin, Jean; Yaouanc, Jean-Jacques; Pichon, Roger; Kervarec, Nelly","N-Heterocyclic Carbene Ligands in Nonsymmetric Diiron Models of Hydrogenase Active Sites","Organometallics","2007","26","8","2042","","10.1021/om061173l","","","0.71073","MoKα","","0.0594","0.0393","","","0.08","0.0875","","","","","","1.018","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072973","12.8669","0.0005","10.3183","0.0004","15.4042","0.0005","90","","91.751","0.003","90","","2044.18","0.13","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H20 Fe2 N4 O4 S2 -","- C17 H20 Fe2 N4 O4 S2 -","- C68 H80 Fe8 N16 O16 S8 -","4","1","","Morvan, Didier; Capon, Jean-François; Gloaguen, Frédéric; Le Goff, Alan; Marchivie, Mathieu; Michaud, François; Schollhammer, Philippe; Talarmin, Jean; Yaouanc, Jean-Jacques; Pichon, Roger; Kervarec, Nelly","N-Heterocyclic Carbene Ligands in Nonsymmetric Diiron Models of Hydrogenase Active Sites","Organometallics","2007","26","8","2042","","10.1021/om061173l","","","0.71073","MoKα","","0.0418","0.0328","","","0.0798","0.0841","","","","","","1.095","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072974","13.9259","0.0006","13.7185","0.0005","16.7211","0.0006","90","0.003","124.231","0.004","90","0.003","2641.1","0.2","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 B Cl2 F4 Fe2 N4 O4 S2 -","- C17 H21 B Cl2 F4 Fe2 N4 O4 S2 -","- C68 H84 B4 Cl8 F16 Fe8 N16 O16 S8 -","4","1","","Morvan, Didier; Capon, Jean-François; Gloaguen, Frédéric; Le Goff, Alan; Marchivie, Mathieu; Michaud, François; Schollhammer, Philippe; Talarmin, Jean; Yaouanc, Jean-Jacques; Pichon, Roger; Kervarec, Nelly","N-Heterocyclic Carbene Ligands in Nonsymmetric Diiron Models of Hydrogenase Active Sites","Organometallics","2007","26","8","2042","","10.1021/om061173l","","","0.71073","MoKα","","0.0432","0.0403","","","0.1042","0.1068","","","","","","1.053","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072975","12.2863","0.0006","12.5849","0.0007","13.8068","0.0007","81.131","0.001","71.081","0.001","88.542","0.001","1994.67","0.18","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H63 Li Si6 Zn -","- C27 H63 Si6 Zn1.1 -","- C54 H126 Si12 Zn2.2 -","2","1","","Gren, Cameron K.; Hanusa, Timothy P.; Rheingold, Arnold L.","Threefold Cation−π Bonding in Trimethylsilylated Allyl Complexes","Organometallics","2007","26","7","1643","","10.1021/om061174d","","","0.71073","MoKα","","0.0434","0.0364","","","0.097","0.1005","","","","","","1.06","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072976","12.1734","0.0017","12.7745","0.0018","13.9023","0.0019","80.647","0.002","71.666","0.002","88.586","0.002","2024.1","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H63 Na Si6 Zn -","- C27 H63 Na Si6 Zn -","- C54 H126 Na2 Si12 Zn2 -","2","1","","Gren, Cameron K.; Hanusa, Timothy P.; Rheingold, Arnold L.","Threefold Cation−π Bonding in Trimethylsilylated Allyl Complexes","Organometallics","2007","26","7","1643","","10.1021/om061174d","","","0.71073","MoKα","","0.0432","0.0369","","","0.092","0.0955","","","","","","1.082","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072977","11.982","0.002","13.16","0.003","13.942","0.003","79.258","0.003","72.505","0.003","89.654","0.003","2057.1","0.7","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H63 K Si6 Zn -","- C27 H63 K Si6 Zn -","- C54 H126 K2 Si12 Zn2 -","2","1","","Gren, Cameron K.; Hanusa, Timothy P.; Rheingold, Arnold L.","Threefold Cation−π Bonding in Trimethylsilylated Allyl Complexes","Organometallics","2007","26","7","1643","","10.1021/om061174d","","","0.71073","MoKα","","0.0521","0.0441","","","0.1208","0.1266","","","","","","1.071","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072978","13.922","0.004","7.835","0.002","15.145","0.004","90","","90.42","0.005","90","","1652","0.8","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","1-(1,12-dicarba-closo-dodecaboran-2-yl)carbazole","","","- C14 H19 B10 N -","- C14 H19 B10 N -","- C56 H76 B40 N4 -","4","2","","Beletskaya, Irina P.; Bregadze, Vladimir I.; Kabytaev, Kuanysh Z.; Zhigareva, Galina G.; Petrovskii, Pavel V.; Glukhov, Ivan V.; Starikova, Zoya A.","Palladium-Catalyzed Amination of 2-Iodo-para-carborane","Organometallics","2007","26","9","2340","","10.1021/om0611756","","","0.71073","MoKα","","0.11","0.078","","","0.1338","0.1462","","","","","","1.019","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072979","7.1667","0.001","9.1418","0.0012","10.9767","0.0014","86.316","0.003","76.466","0.003","77.876","0.003","683.5","0.16","120","2","120","2","","","","","","","","4","P -1","-P 1","2","1-(1,12-dicarba-closo-dodecaboran-2-yl)benzimidazole","","","- C9 H16 B10 N2 -","- C9 H16 B10 N2 -","- C18 H32 B20 N4 -","2","1","","Beletskaya, Irina P.; Bregadze, Vladimir I.; Kabytaev, Kuanysh Z.; Zhigareva, Galina G.; Petrovskii, Pavel V.; Glukhov, Ivan V.; Starikova, Zoya A.","Palladium-Catalyzed Amination of 2-Iodo-para-carborane","Organometallics","2007","26","9","2340","","10.1021/om0611756","","","0.71073","MoKα","","0.0953","0.0608","","","0.1083","0.1138","","","","","","1.016","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072980","9.8337","0.0019","13.4674","0.0018","10.802","0.002","90","","90.274","0.003","90","","1430.5","0.4","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","1-(1,12-dicarba-closo-dodecaboran-2-yl)indole","","","- C10 H17 B10 N -","- C10 H17 B10 N -","- C40 H68 B40 N4 -","4","2","","Beletskaya, Irina P.; Bregadze, Vladimir I.; Kabytaev, Kuanysh Z.; Zhigareva, Galina G.; Petrovskii, Pavel V.; Glukhov, Ivan V.; Starikova, Zoya A.","Palladium-Catalyzed Amination of 2-Iodo-para-carborane","Organometallics","2007","26","9","2340","","10.1021/om0611756","","","0.71073","MoKα","","0.0669","0.0556","","","0.1164","0.123","","","","","","1.015","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072981","24.445","0.002","13.3462","0.0012","23.753","0.002","90","","104.829","0.002","90","","7491.3","1.1","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","2-hydroxy-1,12-dicarba-closo-dodecaborane","","","- C2 H12 B10 O -","- C2 H12 B10 O -","- C64 H384 B320 O32 -","32","4","","Beletskaya, Irina P.; Bregadze, Vladimir I.; Kabytaev, Kuanysh Z.; Zhigareva, Galina G.; Petrovskii, Pavel V.; Glukhov, Ivan V.; Starikova, Zoya A.","Palladium-Catalyzed Amination of 2-Iodo-para-carborane","Organometallics","2007","26","9","2340","","10.1021/om0611756","","","0.71073","MoKα","","0.1287","0.0547","","","0.0876","0.099","","","","","","1.046","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072982","9.1022","0.0018","19.821","0.004","12.996","0.003","90","","97.21","0.03","90","","2326.1","0.9","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","11b","Bis[N-(benzaldimino)acetimidato-N',O]t-butylchlorosilicon(IV)","","- C22 H27 Cl N4 O2 Si -","- C22 H27 Cl N4 O2 Si -","- C88 H108 Cl4 N16 O8 Si4 -","4","1","","Kalikhman, Inna; Gostevskii, Boris; Kertsnus, Evgenia; Botoshansky, Mark; Tessier, Claire A.; Youngs, Wiley J.; Deuerlein, Stephan; Stalke, Dietmar; Kost, Daniel","Competitive Molecular Rearrangements in Hexacoordinate Cyano-Silicon Dichelates","Organometallics","2007","26","10","2652","","10.1021/om061176y","","","0.71073","MoKα","","0.0654","0.0428","","","0.0972","0.1059","","","","","","1.03","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072983","8.323","0.002","11.282","0.002","11.88","0.002","65.24","0.02","78.28","0.02","87.6","0.02","990.7","0.4","230","1","230","1","","","","","","","","5","P -1","-P 1","2","GB-488 (Beer-Sheva)","","","- C20 H21 N5 O2 Si -","- C20 H21 N5 O2 Si -","- C40 H42 N10 O4 Si2 -","2","1","","Kalikhman, Inna; Gostevskii, Boris; Kertsnus, Evgenia; Botoshansky, Mark; Tessier, Claire A.; Youngs, Wiley J.; Deuerlein, Stephan; Stalke, Dietmar; Kost, Daniel","Competitive Molecular Rearrangements in Hexacoordinate Cyano-Silicon Dichelates","Organometallics","2007","26","10","2652","","10.1021/om061176y","","","0.71073","MoKα","","0.0697","0.0444","","","0.1112","0.1176","","","","","","0.92","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072984","7.4185","0.0014","7.4631","0.0014","7.8493","0.0015","115.855","0.003","98.022","0.003","98.096","0.003","377.2","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","14","Bis[N-isopropylideneimino)acetimidato-N,O]chlorocyanosilicon(IV)","","- C11 H18 Cl N5 O2 Si -","- C11 H18 Cl N5 O2 Si -","- C11 H18 Cl N5 O2 Si -","1","0.5","","Kalikhman, Inna; Gostevskii, Boris; Kertsnus, Evgenia; Botoshansky, Mark; Tessier, Claire A.; Youngs, Wiley J.; Deuerlein, Stephan; Stalke, Dietmar; Kost, Daniel","Competitive Molecular Rearrangements in Hexacoordinate Cyano-Silicon Dichelates","Organometallics","2007","26","10","2652","","10.1021/om061176y","","","0.71073","MoKα","","0.0412","0.0391","","","0.1012","0.1027","","","","","","1.138","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072985","10.598","0.002","12.904","0.003","13.385","0.003","95.03","0.03","105.03","0.03","91.2","0.03","1759.2","0.7","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H43 Br N2 O Pt Si -","- C35 H43 Br N2 O Pt Si -","- C70 H86 Br2 N4 O2 Pt2 Si2 -","2","1","","Poverenov, Elena; Shimon, Linda J. W.; Milstein, David","Quinone Methide Generation Based on acis-(N,N) Platinum Complex","Organometallics","2007","26","9","2178","","10.1021/om061178i","","","0.71073","MoKα","","0.0296","0.0264","","","0.0685","0.0702","","","","","","1.068","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072986","6.877","0.003","13.49","0.005","7.975","0.003","90","","107.903","0.006","90","","704","0.5","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C8 H4 Fe2 O6 S3 -","- C8 H4 Fe2 O6 S3 -","- C16 H8 Fe4 O12 S6 -","2","0.5","","Song, Li-Cheng; Yang, Zhi-Yong; Hua, Yu-Juan; Wang, Hu-Ting; Liu, Yang; Hu, Qing-Mei","Diiron Thiadithiolates as Active Site Models for the Iron-Only Hydrogenases: Synthesis, Structures, and Catalytic H2Production","Organometallics","2007","26","8","2106","","10.1021/om061186z","","","0.71073","MoKα","","0.0326","0.0242","","","0.0538","0.0567","","","","","","1.058","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072987","21.929","0.006","7.5006","0.0018","14.284","0.004","90","","96.078","0.009","90","","2336.2","1.1","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C15 H9 B F4 Fe3 O8 S3 -","- C15 H9 B F4 Fe3 O8 S3 -","- C60 H36 B4 F16 Fe12 O32 S12 -","4","1","","Song, Li-Cheng; Yang, Zhi-Yong; Hua, Yu-Juan; Wang, Hu-Ting; Liu, Yang; Hu, Qing-Mei","Diiron Thiadithiolates as Active Site Models for the Iron-Only Hydrogenases: Synthesis, Structures, and Catalytic H2Production","Organometallics","2007","26","8","2106","","10.1021/om061186z","","","0.7107","MoKα","","0.0571","0.0433","","","0.1118","0.1219","","","","","","1.082","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072988","9.694","0.004","20.457","0.007","12.137","0.004","90","","99.063","0.005","90","","2376.8","1.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 Fe2 N2 O4 S3 -","- C16 H9 Fe2 N2 O4 S3.01 -","- C64 H36 Fe8 N8 O16 S12.04 -","4","1","","Song, Li-Cheng; Yang, Zhi-Yong; Hua, Yu-Juan; Wang, Hu-Ting; Liu, Yang; Hu, Qing-Mei","Diiron Thiadithiolates as Active Site Models for the Iron-Only Hydrogenases: Synthesis, Structures, and Catalytic H2Production","Organometallics","2007","26","8","2106","","10.1021/om061186z","","","0.71073","MoKα","","0.0494","0.0404","","","0.1239","0.1302","","","","","","1.053","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072989","8.4471","0.0008","28.13","0.003","15.0938","0.0014","90","","95.896","0.002","90","","3567.6","0.6","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H44 Cl3 F Ge2 -","- C38 H44 Cl3 F Ge2 -","- C152 H176 Cl12 F4 Ge8 -","4","1","","Nemes, Gabriela; Escudié, Jean; Silaghi-Dumitrescu, Ioan; Ranaivonjatovo, Henri; Silaghi-Dumitrescu, Luminita; Gornitzka, Heinz","New Digermylalkenes and Digermylalkynes: [1,3]-Chlorine Shifts in Organogermanium Chemistry?","Organometallics","2007","26","21","5136","","10.1021/om061188j","","","0.71073","MoKα","","0.0781","0.0442","","","0.0845","0.0947","","","","","","1.012","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072990","34.2689","0.0018","8.7342","0.0004","20.3577","0.0011","90","","108.778","0.002","90","","5769","0.5","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H44 N2 Ti2 -","- C32 H44 N2 Ti2 -","- C256 H352 N16 Ti16 -","8","1","","Hanna, Tamara E.; Bernskoetter, Wesley H.; Bouwkamp, Marco W.; Lobkovsky, Emil; Chirik, Paul J.","Bis(cyclopentadienyl) Titanium Dinitrogen Chemistry: Synthesis and Characterization of a Side-on Bound Haptomer","Organometallics","2007","26","9","2431","","10.1021/om0611913","","","0.71073","MoKα","","0.075","0.0409","","","0.0943","0.1064","","","","","","1.013","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072991","22.5972","0.0017","10.1732","0.0007","16.3098","0.001","90","","95.56","0.003","90","","3731.8","0.4","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C40 H60 N2 Ti2 -","- C40 H60 N2 Ti2 -","- C160 H240 N8 Ti8 -","4","0.5","","Hanna, Tamara E.; Bernskoetter, Wesley H.; Bouwkamp, Marco W.; Lobkovsky, Emil; Chirik, Paul J.","Bis(cyclopentadienyl) Titanium Dinitrogen Chemistry: Synthesis and Characterization of a Side-on Bound Haptomer","Organometallics","2007","26","9","2431","","10.1021/om0611913","","","0.71073","MoKα","","0.049","0.035","","","0.101","0.1076","","","","","","1.05","","","","has coordinates,has disorder","178618","2020-10-21","18:00:00",""
"4072992","16.9449","0.0009","10.5645","0.0004","18.0529","0.001","90","","103.955","0.002","90","","3136.3","0.3","173","2","173","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C52 H92 N2 Si6 Ti2 -","- C52 H92 N2 Si6 Ti2 -","- C104 H184 N4 Si12 Ti4 -","2","0.5","","Hanna, Tamara E.; Bernskoetter, Wesley H.; Bouwkamp, Marco W.; Lobkovsky, Emil; Chirik, Paul J.","Bis(cyclopentadienyl) Titanium Dinitrogen Chemistry: Synthesis and Characterization of a Side-on Bound Haptomer","Organometallics","2007","26","9","2431","","10.1021/om0611913","","","0.71073","MoKα","","0.06","0.0363","","","0.0802","0.0841","","","","","","0.91","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072993","14.2552","0.0016","14.3997","0.0014","24.33","0.002","92.874","0.005","96.817","0.005","111.372","0.004","4594.3","0.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C90 H144 N8 Si4 Ti4 -","- C90 H144 N8 Si4 Ti4 -","- C180 H288 N16 Si8 Ti8 -","2","1","","Hanna, Tamara E.; Bernskoetter, Wesley H.; Bouwkamp, Marco W.; Lobkovsky, Emil; Chirik, Paul J.","Bis(cyclopentadienyl) Titanium Dinitrogen Chemistry: Synthesis and Characterization of a Side-on Bound Haptomer","Organometallics","2007","26","9","2431","","10.1021/om0611913","","","0.71073","MoKα","","0.0801","0.0457","","","0.1194","0.1376","","","","","","1.002","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072994","17.267","0.002","17.974","0.002","18.631","0.003","90","","90","","90","","5782.3","1.3","123","2","123","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C26 H40 I3 P Ru -","- C26 H40 I3 P Ru -","- C208 H320 I24 P8 Ru8 -","8","1","","Caskey, Stephen R.; Stewart, Michael H.; Ahn, Yi Joon; Johnson, Marc J. A.; Rowsell, Jesse L. C.; Kampf, Jeff W.","Synthesis, Structure, and Reactivity of Four-, Five-, and Six-Coordinate Ruthenium Carbyne Complexes","Organometallics","2007","26","8","1912","","10.1021/om061192v","","","0.71073","MoKα","","0.0328","0.0271","","","0.0807","0.0828","","","","","","1.288","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072995","13.721","0.003","17.724","0.004","20.827","0.005","90","","92.642","0.004","90","","5060","2","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H73 Cl6 D4 F P2 Ru -","- C46 H77 Cl6 F P2 Ru -","- C184 H308 Cl24 F4 P8 Ru4 -","4","1","","Caskey, Stephen R.; Stewart, Michael H.; Ahn, Yi Joon; Johnson, Marc J. A.; Rowsell, Jesse L. C.; Kampf, Jeff W.","Synthesis, Structure, and Reactivity of Four-, Five-, and Six-Coordinate Ruthenium Carbyne Complexes","Organometallics","2007","26","8","1912","","10.1021/om061192v","","","0.71073","MoKα","","0.0828","0.0402","","","0.0816","0.095","","","","","","1.01","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072996","11.626","0.004","32.847","0.012","28.253","0.01","90","","99.152","0.006","90","","10652","7","108","2","108","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C93 H156 B2 Cl14 F8 P4 Ru2 -","- C93 H156 B2 Cl14 F8 P4 Ru2 -","- C372 H624 B8 Cl56 F32 P16 Ru8 -","4","1","","Caskey, Stephen R.; Stewart, Michael H.; Ahn, Yi Joon; Johnson, Marc J. A.; Rowsell, Jesse L. C.; Kampf, Jeff W.","Synthesis, Structure, and Reactivity of Four-, Five-, and Six-Coordinate Ruthenium Carbyne Complexes","Organometallics","2007","26","8","1912","","10.1021/om061192v","","","0.71073","MoKα","","0.0853","0.059","","","0.131","0.1431","","","","","","1.16","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072997","9.5265","0.0018","23.609","0.005","11.124","0.002","90","","113.372","0.012","90","","2296.6","0.8","123","2","123","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C45 H74 Cl2 F3 P2 Ru -","- C45 H74 Cl2 F3 P2 Ru -","- C90 H148 Cl4 F6 P4 Ru2 -","2","0.5","","Caskey, Stephen R.; Stewart, Michael H.; Ahn, Yi Joon; Johnson, Marc J. A.; Rowsell, Jesse L. C.; Kampf, Jeff W.","Synthesis, Structure, and Reactivity of Four-, Five-, and Six-Coordinate Ruthenium Carbyne Complexes","Organometallics","2007","26","8","1912","","10.1021/om061192v","","","0.71073","MoKα","","0.0953","0.053","","","0.0969","0.1109","","","","","","1.03","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072998","7.9073","0.0012","11.2735","0.0017","13.256","0.002","98.094","0.002","93.655","0.002","104.019","0.002","1129.2","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H32 B F4 Os P -","- C23 H32 B F4 Os P -","- C46 H64 B2 F8 Os2 P2 -","2","1","","Esteruelas, Miguel A.; Hernández, Yohar A.; López, Ana M.; Oliván, Montserrat; Oñate, Enrique","One-Pot Dehydrogenative Addition of Isopropyl to Alkynes Promoted by Osmium: Formation of γ-(η3-Allyl)-α-Alkenylphosphine Derivatives Starting from a Dihydride−Dihydrogen−Triisopropylphosphine Complex","Organometallics","2007","26","9","2193","","10.1021/om070004d","","","0.71073","MoKα","","0.0375","0.028","","","0.0538","0.0557","","","","","","0.91","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4072999","11.2407","0.0016","12.5147","0.0018","13.4682","0.0019","87.048","0.002","89.732","0.002","87.597","0.002","1890.4","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C47 H56 B Os P -","- C47 H56 B Os P -","- C94 H112 B2 Os2 P2 -","2","1","","Esteruelas, Miguel A.; Hernández, Yohar A.; López, Ana M.; Oliván, Montserrat; Oñate, Enrique","One-Pot Dehydrogenative Addition of Isopropyl to Alkynes Promoted by Osmium: Formation of γ-(η3-Allyl)-α-Alkenylphosphine Derivatives Starting from a Dihydride−Dihydrogen−Triisopropylphosphine Complex","Organometallics","2007","26","9","2193","","10.1021/om070004d","","","0.71073","MoKα","","0.0415","0.0315","","","0.0517","0.0535","","","","","","0.856","","","","has coordinates","178618","2020-10-21","18:00:00",""
"4073000","10.3907","0.0013","13.5621","0.0016","25.866","0.003","90","","100.432","0.002","90","","3584.8","0.7","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C40.25 H47 P2 Ru -","- C39 H44 P2 Ru -","- C156 H176 P8 Ru4 -","4","1","","Derrah, Eric J.; Pantazis, Dimitrios A.; McDonald, Robert; Rosenberg, Lisa","A Highly Reactive Ruthenium Phosphido Complex Exhibiting Ru−P π-Bonding","Organometallics","2007","26","6","1473","","10.1021/om0700056","","","0.71073","MoKα","","0.094","0.0603","","","0.1434","0.1576","","","","","","0.981","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073001","9.8311","0.0012","12.3025","0.0015","15.6685","0.0019","97.7025","0.0017","101.461","0.0017","110.89","0.0016","1691.2","0.4","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H44 O P2 Ru -","- C40 H44 O P2 Ru -","- C80 H88 O2 P4 Ru2 -","2","1","","Derrah, Eric J.; Pantazis, Dimitrios A.; McDonald, Robert; Rosenberg, Lisa","A Highly Reactive Ruthenium Phosphido Complex Exhibiting Ru−P π-Bonding","Organometallics","2007","26","6","1473","","10.1021/om0700056","","","0.71073","MoKα","","0.0345","0.0298","","","0.0752","0.0772","","","","","","1.137","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073002","9.1385","0.0004","10.8856","0.0005","20.1951","0.0008","100.904","0.0007","92.2008","0.0007","107.765","0.0006","1868.68","0.14","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H48 F6 N P3 Ru -","- C39 H48 F6 N P3 Ru -","- C78 H96 F12 N2 P6 Ru2 -","2","1","","Derrah, Eric J.; Pantazis, Dimitrios A.; McDonald, Robert; Rosenberg, Lisa","A Highly Reactive Ruthenium Phosphido Complex Exhibiting Ru−P π-Bonding","Organometallics","2007","26","6","1473","","10.1021/om0700056","","","0.71073","MoKα","","0.0323","0.0286","","","0.0752","0.0816","","","","","","1.091","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073003","11.5039","0.0014","12.0314","0.0014","16.4281","0.0019","81.4603","0.0017","89.8746","0.0017","64.4406","0.0015","2023.6","0.4","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H60 P2 Ru Si -","- C45 H60 P2 Ru Si -","- C90 H120 P4 Ru2 Si2 -","2","1","","Derrah, Eric J.; Pantazis, Dimitrios A.; McDonald, Robert; Rosenberg, Lisa","A Highly Reactive Ruthenium Phosphido Complex Exhibiting Ru−P π-Bonding","Organometallics","2007","26","6","1473","","10.1021/om0700056","","","0.71073","MoKα","","0.0462","0.0315","","","0.0749","0.086","","","","","","1.111","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073004","34.791","0.0013","8.2349","0.0003","13.8927","0.0005","90","","94.727","0.002","90","","3966.7","0.3","150","1","150","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H24 I2 Si Zr -","- C16 H24 I2 Si Zr -","- C128 H192 I16 Si8 Zr8 -","8","1","","Rajapakshe, Asha; Basta, Rehan; Arif, Atta M.; Ernst, Richard D.; Lichtenberger, Dennis L.","Silyl Substitution Effects on Metal−Pentadienyl Bonding: Synthesis, Structure, Photoelectron Spectroscopy, and Electronic Structure of a High-Valent Half-Open Zirconocene","Organometallics","2007","26","11","2867","","10.1021/om070008i","","","0.71073","MoKα","","0.045","0.0312","","","0.0576","0.0626","","","","","","1.114","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073005","9.0696","0.001","13.3537","0.0013","14.4026","0.0015","90","","99.971","0.002","90","","1718","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H24 F6 Fe2 O6 -","- C38 H24 F6 Fe2 O6 -","- C76 H48 F12 Fe4 O12 -","2","0.5","","Zhang, Lei; Sun, Jie; Zhu, Huping; Tsumori, Nobuko; Xu, Qiang; Chen, Jiabi","Thermolytic Products Derived from Thermolysis of Cycloolefin-Coordinated Diiron Bridging Carbene Complexes†","Organometallics","2007","26","10","2630","","10.1021/om070009a","","","0.71073","MoKα","","0.1225","0.0629","","","0.1124","0.1339","","","","","","0.925","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073006","10.6638","0.001","12.03","0.001","16.6822","0.0014","90","","105.89","0.002","90","","2058.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H18 Fe2 O6 -","- C23 H18 Fe2 O6 -","- C92 H72 Fe8 O24 -","4","1","","Zhang, Lei; Sun, Jie; Zhu, Huping; Tsumori, Nobuko; Xu, Qiang; Chen, Jiabi","Thermolytic Products Derived from Thermolysis of Cycloolefin-Coordinated Diiron Bridging Carbene Complexes†","Organometallics","2007","26","10","2630","","10.1021/om070009a","","","0.71073","MoKα","","0.0885","0.0461","","","0.0673","0.0759","","","","","","0.79","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073007","10.054","0.007","10.371","0.007","16.115","0.011","76.906","0.013","77.329","0.011","74.356","0.012","1553.4","1.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H35 Fe2 O5 S -","- C34 H35 Fe2 O5 S -","- C68 H70 Fe4 O10 S2 -","2","1","","Zhang, Lei; Sun, Jie; Zhu, Huping; Tsumori, Nobuko; Xu, Qiang; Chen, Jiabi","Thermolytic Products Derived from Thermolysis of Cycloolefin-Coordinated Diiron Bridging Carbene Complexes†","Organometallics","2007","26","10","2630","","10.1021/om070009a","","","0.71073","MoKα","","0.1069","0.079","","","0.204","0.2253","","","","","","1.022","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073008","7.163","0.003","11.724","0.006","36.548","0.017","90","","90","","90","","3069","2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C19 H14 Fe O3 -","- C19 H14 Fe O3 -","- C152 H112 Fe8 O24 -","8","1","","Zhang, Lei; Sun, Jie; Zhu, Huping; Tsumori, Nobuko; Xu, Qiang; Chen, Jiabi","Thermolytic Products Derived from Thermolysis of Cycloolefin-Coordinated Diiron Bridging Carbene Complexes†","Organometallics","2007","26","10","2630","","10.1021/om070009a","","","0.71073","MoKα","","0.1369","0.0498","","","0.0903","0.1069","","","","","","0.795","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073009","10.3156","0.0007","13.1485","0.0009","19.4451","0.0013","90","","91.235","0.001","90","","2636.8","0.3","87","2","87","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","DHP-Fe(CO)3","","","- C33 H34 Fe O3 -","- C33 H34 Fe O3 -","- C132 H136 Fe4 O12 -","4","1","","Zhang, Rui; Fan, Wei; Twamley, Brendan; Berg, David J.; Mitchell, Reginald H.","Synthesis and Structures of Dimethyldihydropyrene Iron Carbonyl Complexes","Organometallics","2007","26","8","1888","","10.1021/om0700112","","","0.71073","MoKα","","0.041","0.0381","","","0.0971","0.0988","","","","","","1.099","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073010","16.2931","0.0007","18.4265","0.0008","20.346","0.0009","90","","90","","90","","6108.4","0.5","86","2","86","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","DHP-(Fe(CO)3)2","","","- C36 H34 Fe2 O6 -","- C36 H34 Fe2 O6 -","- C288 H272 Fe16 O48 -","8","1","","Zhang, Rui; Fan, Wei; Twamley, Brendan; Berg, David J.; Mitchell, Reginald H.","Synthesis and Structures of Dimethyldihydropyrene Iron Carbonyl Complexes","Organometallics","2007","26","8","1888","","10.1021/om0700112","","","0.71073","MoKα","","0.0414","0.0378","","","0.0916","0.094","","","","","","1.067","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073011","13.053","0.003","10.024","0.002","25.586","0.005","90","","98.12","0.003","90","","3314.2","1.2","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H34 B20 Ru2 S6 -","- C14 H34 B20 Ru2 S6 -","- C56 H136 B80 Ru8 S24 -","4","1","","Wu, De-Hong; Ji, Cheng; Li, Yi-Zhi; Yan, Hong","A Novel Dinuclear Ruthenium(I)/Ruthenium(III) Half-Sandwich Complex Containing Two Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dithiolate Ligands and Its Reactivity with Alkynes†","Organometallics","2007","26","7","1560","","10.1021/om070014e","","","0.71073","MoKαdiffrn_radiation_sourcesealedtube","","0.0686","0.0477","","","0.0924","0.0955","","","","","","1.042","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073012","12.078","0.0016","13.0508","0.0018","13.4696","0.0019","106.665","0.002","97.858","0.002","108.704","0.002","1864.4","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H38 B20 O2 Ru2 S6 -","- C18 H38 B20 O2 Ru2 S6 -","- C36 H76 B40 O4 Ru4 S12 -","2","1","","Wu, De-Hong; Ji, Cheng; Li, Yi-Zhi; Yan, Hong","A Novel Dinuclear Ruthenium(I)/Ruthenium(III) Half-Sandwich Complex Containing Two Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dithiolate Ligands and Its Reactivity with Alkynes†","Organometallics","2007","26","7","1560","","10.1021/om070014e","","","0.71073","MoKα","","0.0932","0.0634","","","0.1409","0.147","","","","","","1.039","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073013","11.722","0.005","13.909","0.005","13.911","0.005","117.938","0.004","98.632","0.005","90.543","0.006","1972.8","1.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H40 B20 Ru2 S6 -","- C22 H40 B20 Ru2 S6 -","- C44 H80 B40 Ru4 S12 -","2","1","","Wu, De-Hong; Ji, Cheng; Li, Yi-Zhi; Yan, Hong","A Novel Dinuclear Ruthenium(I)/Ruthenium(III) Half-Sandwich Complex Containing Two Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dithiolate Ligands and Its Reactivity with Alkynes†","Organometallics","2007","26","7","1560","","10.1021/om070014e","","","0.71073","MoKα","","0.1016","0.0639","","","0.1366","0.1447","","","","","","1","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073014","18.071","0.004","11.112","0.002","14.124","0.003","90","","90","","90","","2836.2","1","103","2","103","2","","","","","","","","5","C m c 21","C 2c -2","36","BzRu(Cl)NacNacMe","","","- C28 H32 Cl4 N2 Ru -","- C28 H32 Cl4 N2 Ru -","- C112 H128 Cl16 N8 Ru4 -","4","0.5","","Phillips, Andrew D.; Laurenczy, Gábor; Scopelliti, Rosario; Dyson, Paul J.","Facile, Thermoreversible Cycloaddition of Small Molecules to a Ruthenium(II) Arene β-Diketiminate","Organometallics","2007","26","5","1120","","10.1021/om070017r","","","0.71073","MoKα","","0.0244","0.0226","","","0.0531","0.0539","","","","","","1.082","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073015","11.6585","0.001","12.3944","0.0016","12.7267","0.0014","111.714","0.011","95.98","0.008","105.253","0.009","1606.1","0.4","140","2","140","2","","","","","","","","8","P -1","-P 1","2","BzRuNacNacMeOTf.CHCl3","","","- C29 H32 Cl3 F3 N2 O3 Ru S -","- C29 H32 Cl3 F3 N2 O3 Ru S -","- C58 H64 Cl6 F6 N4 O6 Ru2 S2 -","2","1","","Phillips, Andrew D.; Laurenczy, Gábor; Scopelliti, Rosario; Dyson, Paul J.","Facile, Thermoreversible Cycloaddition of Small Molecules to a Ruthenium(II) Arene β-Diketiminate","Organometallics","2007","26","5","1120","","10.1021/om070017r","","","0.71073","MoKα","","0.0776","0.0552","","","0.1304","0.1391","","","","","","0.928","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073016","12.3101","0.0008","11.8954","0.0005","21.7605","0.0012","90","","93.802","0.005","90","","3179.5","0.3","140","2","140","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","BzRu(CH2CH2)NacNacMeOTf.CH2Cl2","","","- C31 H37 Cl2 F3 N2 O3 Ru S -","- C31 H37 Cl2 F3 N2 O3 Ru S -","- C124 H148 Cl8 F12 N8 O12 Ru4 S4 -","4","1","","Phillips, Andrew D.; Laurenczy, Gábor; Scopelliti, Rosario; Dyson, Paul J.","Facile, Thermoreversible Cycloaddition of Small Molecules to a Ruthenium(II) Arene β-Diketiminate","Organometallics","2007","26","5","1120","","10.1021/om070017r","","","0.71073","MoKα","","0.0539","0.039","","","0.0942","0.0993","","","","","","0.963","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073017","12.238","0.002","11.914","0.002","21.771","0.004","90","","94.65","0.03","90","","3163.8","1","103","2","103","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","BzRu(CHCH)NacNacMeOTf.CH2Cl2","","","- C31 H35 Cl2 F3 N2 O3 Ru S -","- C31 H35 Cl2 F3 N2 O3 Ru S -","- C124 H140 Cl8 F12 N8 O12 Ru4 S4 -","4","1","","Phillips, Andrew D.; Laurenczy, Gábor; Scopelliti, Rosario; Dyson, Paul J.","Facile, Thermoreversible Cycloaddition of Small Molecules to a Ruthenium(II) Arene β-Diketiminate","Organometallics","2007","26","5","1120","","10.1021/om070017r","","","0.71073","MoKα","","0.0392","0.028","","","0.0582","0.0637","","","","","","1.109","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073018","12.091","0.002","11.916","0.002","21.966","0.004","90","","93.88","0.03","90","","3157.5","0.9","103","2","103","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","BzRu(H)NacNacMe(H)OTf.THF","","","- C32 H41 F3 N2 O4 Ru S -","- C32 H41 F3 N2 O4 Ru S -","- C128 H164 F12 N8 O16 Ru4 S4 -","4","1","","Phillips, Andrew D.; Laurenczy, Gábor; Scopelliti, Rosario; Dyson, Paul J.","Facile, Thermoreversible Cycloaddition of Small Molecules to a Ruthenium(II) Arene β-Diketiminate","Organometallics","2007","26","5","1120","","10.1021/om070017r","","","0.71073","MoKα","","0.037","0.0274","","","0.0504","0.0541","","","","","","1.131","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073019","9.2856","0.0008","10.8254","0.0009","15.0721","0.0013","89.602","0.002","83.26","0.002","75.643","0.001","1457.2","0.2","180","2","180","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H17 P -","- C18 H17 P -","- C72 H68 P4 -","4","2","","Brownie, John H.; Baird, Michael C.; Schmider, Hartmut","New Complexes of Methyldiphenylphosphonium Cyclopentadienylide, Representative of a Class of Ligands Heretofore Much Neglected","Organometallics","2007","26","6","1433","","10.1021/om070018j","","","0.71073","MoKα","","0.0509","0.0377","","","0.1015","0.108","","","","","","1","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073020","9.738","0.002","14.41","0.003","13.927","0.003","90","","108.742","0.004","90","","1850.7","0.7","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H17 Cr O3 P -","- C21 H17 Cr O3 P -","- C84 H68 Cr4 O12 P4 -","4","1","","Brownie, John H.; Baird, Michael C.; Schmider, Hartmut","New Complexes of Methyldiphenylphosphonium Cyclopentadienylide, Representative of a Class of Ligands Heretofore Much Neglected","Organometallics","2007","26","6","1433","","10.1021/om070018j","","","0.71073","MoKα","","0.0613","0.0374","","","0.0672","0.071","","","","","","1","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073021","9.6728","0.0007","14.5246","0.001","14.1801","0.001","90","","108.393","0.001","90","","1890.4","0.2","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H17 Mo O3 P -","- C21 H17 Mo O3 P -","- C84 H68 Mo4 O12 P4 -","4","1","","Brownie, John H.; Baird, Michael C.; Schmider, Hartmut","New Complexes of Methyldiphenylphosphonium Cyclopentadienylide, Representative of a Class of Ligands Heretofore Much Neglected","Organometallics","2007","26","6","1433","","10.1021/om070018j","","","0.71073","MoKα","","0.0381","0.0253","","","0.047","0.0491","","","","","","1","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073022","9.6818","0.0012","14.5322","0.0017","14.1153","0.0017","90","","108.514","0.002","90","","1883.2","0.4","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H17 O3 P W -","- C21 H17 O3 P W -","- C84 H68 O12 P4 W4 -","4","1","","Brownie, John H.; Baird, Michael C.; Schmider, Hartmut","New Complexes of Methyldiphenylphosphonium Cyclopentadienylide, Representative of a Class of Ligands Heretofore Much Neglected","Organometallics","2007","26","6","1433","","10.1021/om070018j","","","0.71073","MoKα","","0.0295","0.027","","","0.0849","0.0864","","","","","","1","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073023","9.3488","0.001","16.539","0.0018","16.6312","0.0018","94.8","0.002","103.058","0.002","90.427","0.002","2495.3","0.5","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C21.5 H18 Cl I2 Mo O3 P -","- C21.5 H18 Cl I2 Mo O3 P -","- C86 H72 Cl4 I8 Mo4 O12 P4 -","4","2","","Brownie, John H.; Baird, Michael C.; Schmider, Hartmut","New Complexes of Methyldiphenylphosphonium Cyclopentadienylide, Representative of a Class of Ligands Heretofore Much Neglected","Organometallics","2007","26","6","1433","","10.1021/om070018j","","","0.71073","MoKα","","0.0832","0.0489","","","0.0996","0.1062","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073024","13.4037","0.0008","16.9491","0.0011","14.0277","0.0009","90","","90.975","0.003","90","","3186.4","0.3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C33 H37 I2 N O2 P Rh -","- C33 H37 I2 N O2 P Rh -","- C132 H148 I8 N4 O8 P4 Rh4 -","4","1","","Best, Jonathan; Wilson, John M.; Adams, Harry; Gonsalvi, Luca; Peruzzini, Maurizio; Haynes, Anthony","Reactivity of Rhodium(I) Iminophosphine Carbonyl Complexes with Methyl Iodide","Organometallics","2007","26","8","1960","","10.1021/om070019b","","","0.71073","MoKα","","0.1425","0.0638","","","0.1407","0.1706","","","","","","1.02","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073025","10.485","0.006","12.409","0.007","12.774","0.007","67.847","0.009","65.925","0.008","87.486","0.01","1393.5","1.4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C25.75 H16 Co Fe Mo O7 P S -","- C25.75 H14 Co Fe Mo O7 P S -","- C51.5 H28 Co2 Fe2 Mo2 O14 P2 S2 -","2","1","","Song, Li-Cheng; Yu, Guang-Ao; Liu, Yang; Yin, Bang-Shao; Zhang, Xiao-Guang; Hu, Qing-Mei","Synthesis and Structural Characterization of the μ-η1:η5-Ph2PC5H4Ligand-Containing Transition-Metal Cluster and Dinuclear Complexes (μ-η1:η5-Ph2PC5H4)(μ3-S)MFeCo(CO)7(M = Mo, W), (μ-η1:η5-Ph2PC5H4)(μ3-RC)MCo2(CO)7(M = Mo, W; R = Me, Ph), and (μ-η1:η5-Ph2PC5H4)CpMo2(CO)5Obtained from the Studied Isolobal Displacement Reactions","Organometallics","2007","26","8","1966","","10.1021/om070020a","","","0.71073","MoKα","","0.0522","0.0352","","","0.086","0.0958","","","","","","1.007","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073026","10.458","0.007","12.428","0.008","12.748","0.009","68.205","0.01","65.845","0.01","87.589","0.012","1391.9","1.6","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C25.75 H16 Co Fe O7 P S W -","- C25.75 H14 Co Fe O7 P S W -","- C51.5 H28 Co2 Fe2 O14 P2 S2 W2 -","2","1","","Song, Li-Cheng; Yu, Guang-Ao; Liu, Yang; Yin, Bang-Shao; Zhang, Xiao-Guang; Hu, Qing-Mei","Synthesis and Structural Characterization of the μ-η1:η5-Ph2PC5H4Ligand-Containing Transition-Metal Cluster and Dinuclear Complexes (μ-η1:η5-Ph2PC5H4)(μ3-S)MFeCo(CO)7(M = Mo, W), (μ-η1:η5-Ph2PC5H4)(μ3-RC)MCo2(CO)7(M = Mo, W; R = Me, Ph), and (μ-η1:η5-Ph2PC5H4)CpMo2(CO)5Obtained from the Studied Isolobal Displacement Reactions","Organometallics","2007","26","8","1966","","10.1021/om070020a","","","0.71073","MoKα","","0.0459","0.0295","","","0.0589","0.064","","","","","","1.009","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073027","10.457","0.003","14.716","0.004","17.43","0.004","90","","101.293","0.004","90","","2630.3","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H17 Co2 Mo O7 P -","- C26 H17 Co2 Mo O7 P -","- C104 H68 Co8 Mo4 O28 P4 -","4","1","","Song, Li-Cheng; Yu, Guang-Ao; Liu, Yang; Yin, Bang-Shao; Zhang, Xiao-Guang; Hu, Qing-Mei","Synthesis and Structural Characterization of the μ-η1:η5-Ph2PC5H4Ligand-Containing Transition-Metal Cluster and Dinuclear Complexes (μ-η1:η5-Ph2PC5H4)(μ3-S)MFeCo(CO)7(M = Mo, W), (μ-η1:η5-Ph2PC5H4)(μ3-RC)MCo2(CO)7(M = Mo, W; R = Me, Ph), and (μ-η1:η5-Ph2PC5H4)CpMo2(CO)5Obtained from the Studied Isolobal Displacement Reactions","Organometallics","2007","26","8","1966","","10.1021/om070020a","","","0.71073","MoKα","","0.0663","0.035","","","0.0725","0.1025","","","","","","1.094","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073028","8.0974","0.0018","17.001","0.004","18.266","0.004","90","","100.351","0.003","90","","2473.6","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H19 Mo2 O5 P -","- C27 H19 Mo2 O5 P -","- C108 H76 Mo8 O20 P4 -","4","1","","Song, Li-Cheng; Yu, Guang-Ao; Liu, Yang; Yin, Bang-Shao; Zhang, Xiao-Guang; Hu, Qing-Mei","Synthesis and Structural Characterization of the μ-η1:η5-Ph2PC5H4Ligand-Containing Transition-Metal Cluster and Dinuclear Complexes (μ-η1:η5-Ph2PC5H4)(μ3-S)MFeCo(CO)7(M = Mo, W), (μ-η1:η5-Ph2PC5H4)(μ3-RC)MCo2(CO)7(M = Mo, W; R = Me, Ph), and (μ-η1:η5-Ph2PC5H4)CpMo2(CO)5Obtained from the Studied Isolobal Displacement Reactions","Organometallics","2007","26","8","1966","","10.1021/om070020a","","","0.71073","MoKα","","0.0294","0.0223","","","0.0563","0.0583","","","","","","1.051","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073029","19.172","0.001","8.978","0.001","40.669","0.003","90","","102.852","0.001","90","","6824.8","1","150","0.1","150","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H58 Dy I -","- C34 H58 Dy I -","- C272 H464 Dy8 I8 -","8","1","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Isolation of Stable Organodysprosium(II) Complexes by Chemical Reduction of Dysprosium(III) Precursors","Organometallics","2007","26","5","1123","","10.1021/om0700213","","","0.71069","MoKα","","0.0601","0.0494","","","0.1317","0.1376","","","","","","1.083","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073030","10.449","0.001","16.391","0.001","19.981","0.001","90","","102.592","0.001","90","","3339.8","0.4","150","0.1","150","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H62 B Dy -","- C34 H62 B Dy -","- C136 H248 B4 Dy4 -","4","0.5","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Isolation of Stable Organodysprosium(II) Complexes by Chemical Reduction of Dysprosium(III) Precursors","Organometallics","2007","26","5","1123","","10.1021/om0700213","","","0.71069","MoKα","","0.0384","0.0332","","","0.0855","0.0889","","","","","","1.057","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073031","13.638","0.001","15.126","0.001","15.707","0.001","66.384","0.001","88.718","0.001","87.166","0.001","2965.2","0.3","150","0.1","150","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C56.5 H98 B Dy K O6 -","- C53 H94 B Dy K O6 -","- C106 H188 B2 Dy2 K2 O12 -","2","1","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Isolation of Stable Organodysprosium(II) Complexes by Chemical Reduction of Dysprosium(III) Precursors","Organometallics","2007","26","5","1123","","10.1021/om0700213","","","0.71069","MoKα","","0.0481","0.0408","","","0.1138","0.1191","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073032","10.348","0.001","15.486","0.001","20.413","0.001","90","","99.348","0.001","90","","3227.7","0.4","150","0.1","150","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H58 Br Dy -","- C34 H58 Br Dy -","- C136 H232 Br4 Dy4 -","4","1","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Isolation of Stable Organodysprosium(II) Complexes by Chemical Reduction of Dysprosium(III) Precursors","Organometallics","2007","26","5","1123","","10.1021/om0700213","","","0.71069","MoKα","","0.053","0.042","","","0.1075","0.1143","","","","","","1.052","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073033","5.776","0.005","21.241","0.005","7.906","0.005","90","","96.346","0.005","90","","964","1.1","150","0.1","150","0.1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C14 H11 -","- C14 H11 -","- C56 H44 -","4","1","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Isolation of Stable Organodysprosium(II) Complexes by Chemical Reduction of Dysprosium(III) Precursors","Organometallics","2007","26","5","1123","","10.1021/om0700213","","","0.71069","MoKα","","0.0588","0.04","","","0.0879","0.0944","","","","","","1.026","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073034","10.439","0.001","12.666","0.001","21.151","0.001","87.689","0.001","82.728","0.001","66.014","0.001","2534.3","0.3","150","0.1","150","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C46 H82 Cl2 Dy K O6 -","- C46 H82 Cl2 Dy K O6 -","- C92 H164 Cl4 Dy2 K2 O12 -","2","1","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Isolation of Stable Organodysprosium(II) Complexes by Chemical Reduction of Dysprosium(III) Precursors","Organometallics","2007","26","5","1123","","10.1021/om0700213","","","0.71069","MoKα","","0.0524","0.0378","","","0.0876","0.093","","","","","","1.015","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073035","13.172","0.001","19.112","0.001","25.098","0.001","90","","97.218","0.001","90","","6268.2","0.6","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58 H0 Br Dy K O6 -","- C58 H106 Br Dy K O6 -","- C232 H424 Br4 Dy4 K4 O24 -","4","1","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Isolation of Stable Organodysprosium(II) Complexes by Chemical Reduction of Dysprosium(III) Precursors","Organometallics","2007","26","5","1123","","10.1021/om0700213","","","0.71069","MoKα","","0.0673","0.0452","","","0.1129","0.1234","","","","","","1.034","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073036","15.0501","0.0007","14.7142","0.0007","17.0825","0.0008","90","","110.517","0.004","90","","3543","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H33 Co O2 P2 -","- C46 H33 Co O2 P2 -","- C184 H132 Co4 O8 P8 -","4","1","","Gibson, Susan E.; Kaufmann, Karina A. C.; Haycock, Peter R.; White, Andrew J. P.; Hardick, David J.; Tozer, Matthew J.","Pendant Alkenes Promote Cobalt−Cobalt Bond Cleavage in (Alkyne)(binap)tetracarbonyldicobalt(0) Complexes","Organometallics","2007","26","7","1578","","10.1021/om070022v","","","0.71073","MoKα","","0.2435","0.0939","","","0.1137","0.1546","","","","","","1.087","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073037","11.2645","0.0002","24.1967","0.0006","19.074","0.0004","90","","103.787","0.001","90","","5049.09","0.19","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","C(Ph2P=N-(2,6-iPr-C6H3))Ca.THF2","","","- C57 H70 Ca N2 O2 P2 -","- C57 H70 Ca N2 O2 P2 -","- C228 H280 Ca4 N8 O8 P8 -","4","1","","Orzechowski, Lars; Harder, Sjoerd","Isolation of an Intermediate in the Catalytic Trimerization of Isocyanates by a Monomeric Calcium Carbene with Chelating Iminophosphorane Substituents","Organometallics","2007","26","9","2144","","10.1021/om070023n","","","0.71073","MoKα","","0.0705","0.0478","","","0.1104","0.121","","","","","","1.021","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073038","12.8306","0.0005","25.8906","0.0009","22.1311","0.0007","90","","93.049","0.002","90","","7341.4","0.4","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","C(Ph2P=N-(2,6-iPr-C6H3))Ca(THF).O=CPh2","","","- C80 H88 Ca N2 O2 P2 -","- C80 H88 Ca N2 O2 P2 -","- C320 H352 Ca4 N8 O8 P8 -","4","1","","Orzechowski, Lars; Harder, Sjoerd","Isolation of an Intermediate in the Catalytic Trimerization of Isocyanates by a Monomeric Calcium Carbene with Chelating Iminophosphorane Substituents","Organometallics","2007","26","9","2144","","10.1021/om070023n","","","0.71073","MoKα","","0.0668","0.0527","","","0.1372","0.1444","","","","","","1.101","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073039","33.0555","0.0009","18.36","0.0005","22.3436","0.0006","90","","101.466","0.002","90","","13289.7","0.6","203","2","203","2","","","","","","","","6","C 1 c 1","C -2yc","9","C(Ph2P=N-(2,6-iPr-C6H3))Ca + 2 Cy-N=C=O","","","- C130 H160 Ca2 N8 O5 P4 -","- C130 H160 Ca2 N8 O5 P4 -","- C520 H640 Ca8 N32 O20 P16 -","4","1","","Orzechowski, Lars; Harder, Sjoerd","Isolation of an Intermediate in the Catalytic Trimerization of Isocyanates by a Monomeric Calcium Carbene with Chelating Iminophosphorane Substituents","Organometallics","2007","26","9","2144","","10.1021/om070023n","","","0.71073","MoKα","","0.0395","0.0374","","","0.1041","0.1055","","","","","","1.094","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073040","17.237","0.004","18.408","0.004","11.175","0.003","90","","104.903","0.014","90","","3426.5","1.4","223","2","223","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C32 H54 Ru3 Zn -","- C32 H49 Ru3 Zn -","- C128 H196 Ru12 Zn4 -","4","0.5","","Ohashi, Masato; Matsubara, Kouki; Suzuki, Hiroharu","Ruthenium Polyhydrido Clusters Having a Bridging Alkylzinc Group, [(η5-C5Me5)Ru(μ-H)]3(μ3-ZnR)n(μ3-H)2-nand [(η5-C5Me5)Ru]2(μ-ZnR)n(μ-H)4-n(R = Me and Et;n= 1 and 2)","Organometallics","2007","26","9","2330","","10.1021/om070024f","","","0.7107","MoKα","","0.0455","0.043","","","0.1188","0.1212","","","","","","1.079","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073041","11.279","0.003","11.279","0.003","16.137","0.005","90","","90","","120","","1777.8","0.9","298","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C32 H54 Ru3 Zn2 -","- C32 H51 Ru3 Zn2 -","- C64 H102 Ru6 Zn4 -","2","0.166667","","Ohashi, Masato; Matsubara, Kouki; Suzuki, Hiroharu","Ruthenium Polyhydrido Clusters Having a Bridging Alkylzinc Group, [(η5-C5Me5)Ru(μ-H)]3(μ3-ZnR)n(μ3-H)2-nand [(η5-C5Me5)Ru]2(μ-ZnR)n(μ-H)4-n(R = Me and Et;n= 1 and 2)","Organometallics","2007","26","9","2330","","10.1021/om070024f","","","0.71069","MoKα","","0.0595","0.0519","","","0.0761","0.0793","","","","","","1.123","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073042","11.1041","0.0007","38.623","0.002","12.8542","0.0008","90","","115.449","0.002","90","","4977.9","0.5","113","2","113","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C47 H77 Al N2 O Si4 -","- C47 H77 Al N2 O Si4 -","- C188 H308 Al4 N8 O4 Si16 -","4","1","","Gao, Yihua; Cheng, Xiaoyan; Song, Haibin; Zhang, Jianying; Cui, Chunming","A Cyclopropenylaluminum Derivative from Hydrolysis and Alcoholysis of an Aluminacyclobutenone","Organometallics","2007","26","6","1308","","10.1021/om070028k","","","0.7107","MoKα","","0.0583","0.0481","","","0.1095","0.1157","","","","","","1.061","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073043","10.247","0.003","10.451","0.003","11.196","0.003","99.367","0.006","107.07","0.004","104.356","0.005","1073.9","0.5","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H8 Al2 F30 O6 -","- C43 Al2 F30 O6 -","- C43 Al2 F30 O6 -","1","0.5","","McGuinness, David S.; Rucklidge, Adam J.; Tooze, Robert P.; Slawin, Alexandra M. Z.","Cocatalyst Influence in Selective Oligomerization: Effect on Activity, Catalyst Stability, and 1-Hexene/1-Octene Selectivity in the Ethylene Trimerization and Tetramerization Reaction","Organometallics","2007","26","10","2561","","10.1021/om070029c","","","0.71073","MoKα","","0.0452","0.0383","","","0.0949","0.099","","","","","","0.973","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073044","10.7382","0.0006","46.564","0.003","17.1024","0.0009","90","","92.971","0.003","90","","8539.9","0.9","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H13 Al F30 O4 -","- C43 H13 Al F30 O4 -","- C344 H104 Al8 F240 O32 -","8","2","","McGuinness, David S.; Rucklidge, Adam J.; Tooze, Robert P.; Slawin, Alexandra M. Z.","Cocatalyst Influence in Selective Oligomerization: Effect on Activity, Catalyst Stability, and 1-Hexene/1-Octene Selectivity in the Ethylene Trimerization and Tetramerization Reaction","Organometallics","2007","26","10","2561","","10.1021/om070029c","","","0.71073","MoKα","","0.1081","0.0913","","","0.1778","0.1856","","","","","","1.174","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073045","14.526","0.003","13.99","0.003","18.153","0.004","90","","92.314","0.01","90","","3686","1.4","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C78 H6 Al2 F60 O6 -","- C78 H6 Al2 F60 O6 -","- C156 H12 Al4 F120 O12 -","2","0.5","","McGuinness, David S.; Rucklidge, Adam J.; Tooze, Robert P.; Slawin, Alexandra M. Z.","Cocatalyst Influence in Selective Oligomerization: Effect on Activity, Catalyst Stability, and 1-Hexene/1-Octene Selectivity in the Ethylene Trimerization and Tetramerization Reaction","Organometallics","2007","26","10","2561","","10.1021/om070029c","","","0.71073","MoKα","","0.182","0.1127","","","0.2462","0.2985","","","","","","1.061","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073046","9.91","0.005","16.63","0.007","16.28","0.007","90","","91.16","0.02","90","","2682","2","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H10 Al F27 O4 -","- C16 H10 Al F27 O4 -","- C64 H40 Al4 F108 O16 -","4","1","","McGuinness, David S.; Rucklidge, Adam J.; Tooze, Robert P.; Slawin, Alexandra M. Z.","Cocatalyst Influence in Selective Oligomerization: Effect on Activity, Catalyst Stability, and 1-Hexene/1-Octene Selectivity in the Ethylene Trimerization and Tetramerization Reaction","Organometallics","2007","26","10","2561","","10.1021/om070029c","","","0.71073","MoKα","","0.2756","0.1457","","","0.3103","0.3827","","","","","","1.076","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073047","8.943","0.002","16.516","0.003","13.919","0.003","90","","106.82","0.03","90","","1967.9","0.8","253","2","253","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H14 Cl N2 O3 Re -","- C21 H14 Cl N2 O3 Re -","- C84 H56 Cl4 N8 O12 Re4 -","4","1","","Zhang, Jiaxin; Chu, Ben Wai-Kin; Zhu, Nianyong; Yam, Vivian Wing-Wah","Synthesis, Characterization, Langmuir−Blodgett Film-Forming Property, and Second-Order Nonlinear Optical Study of Rhenium(I) and Ruthenium(II) Diimine Complexes","Organometallics","2007","26","22","5423","","10.1021/om070030b","","","0.71069","MoKα","","0.053","0.0379","","","0.0947","0.0989","","","","","","0.979","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073048","9.079","0.002","33.972","0.007","12.485","0.003","90","","99.64","0.03","90","","3796.4","1.5","253","2","253","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H30 F12 N6 P2 Ru -","- C38 H30 F12 N6 P2 Ru -","- C152 H120 F48 N24 P8 Ru4 -","4","1","","Zhang, Jiaxin; Chu, Ben Wai-Kin; Zhu, Nianyong; Yam, Vivian Wing-Wah","Synthesis, Characterization, Langmuir−Blodgett Film-Forming Property, and Second-Order Nonlinear Optical Study of Rhenium(I) and Ruthenium(II) Diimine Complexes","Organometallics","2007","26","22","5423","","10.1021/om070030b","","","0.71073","MoKα","","0.068","0.0315","","","0.0598","0.066","","","","","","0.588","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073049","15.9723","0.0005","9.3175","0.0003","19.8226","0.0006","90","","90","","90","","2950.04","0.16","223","2","223","2","","","","","","","","7","P c a 21","P 2c -2ac","29","Platinum ethylene pi-complex","Platinum ethylene pi-complex","","- C13 H13 Cl N2 O3 Pt S -","- C13 H13 Cl N2 O3 Pt S -","- C104 H104 Cl8 N16 O24 Pt8 S8 -","8","2","","Khusnutdinova, Julia R.; Zavalij, Peter Y.; Vedernikov, Andrei N.","Facile Aerobic Oxidation of dpms−Platinum(II) Ethylene Complexes (dpms = di(2-pyridyl)methanesulfonate)","Organometallics","2007","26","9","2402","","10.1021/om070033o","","","0.71073","MoKα","","0.0347","0.0311","","","0.0655","0.0667","","","","","","1","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073050","11.5635","0.001","11.8385","0.0011","18.9809","0.0017","78.965","0.001","80.025","0.001","76.909","0.001","2461","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C90 H160 N4 O6 Si2 Y2 -","- C90 H160 N4 O6 Si2 Y2 -","- C90 H160 N4 O6 Si2 Y2 -","1","0.5","","Liu, Xinli; Shang, Xiaomin; Tang, Tao; Hu, Ninghai; Pei, Fengkui; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Achiral Lanthanide Alkyl Complexes Bearing N,O Multidentate Ligands. Synthesis and Catalysis of Highly Heteroselective Ring-Opening Polymerization ofrac-Lactide","Organometallics","2007","26","10","2747","","10.1021/om0700359","","","0.71073","MoKα","","0.0577","0.0422","","","0.0996","0.1069","","","","","","1.017","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073051","10.932","0.0007","13.8375","0.001","18.5184","0.0012","101.391","0.001","91.103","0.001","102.498","0.001","2675.4","0.3","187","2","187","2","","","","","","","","6","P -1","-P 1","2","","","","- C23.5 H42 N O1.5 Si0.5 Y0.5 -","- C23.5 H42 N O1.5 Si0.5 Y0.5 -","- C94 H168 N4 O6 Si2 Y2 -","4","2","","Liu, Xinli; Shang, Xiaomin; Tang, Tao; Hu, Ninghai; Pei, Fengkui; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Achiral Lanthanide Alkyl Complexes Bearing N,O Multidentate Ligands. Synthesis and Catalysis of Highly Heteroselective Ring-Opening Polymerization ofrac-Lactide","Organometallics","2007","26","10","2747","","10.1021/om0700359","","","0.71073","MoKα","","0.0704","0.0583","","","0.1694","0.1796","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073052","11.5036","0.0007","12.0931","0.0007","19.0909","0.0012","79.711","0.001","79.367","0.001","74.023","0.001","2486.3","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C47 H84 Lu N2 O3 Si -","- C47 H84 Lu N2 O3 Si -","- C94 H168 Lu2 N4 O6 Si2 -","2","1","","Liu, Xinli; Shang, Xiaomin; Tang, Tao; Hu, Ninghai; Pei, Fengkui; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Achiral Lanthanide Alkyl Complexes Bearing N,O Multidentate Ligands. Synthesis and Catalysis of Highly Heteroselective Ring-Opening Polymerization ofrac-Lactide","Organometallics","2007","26","10","2747","","10.1021/om0700359","","","0.71073","MoKα","","0.0389","0.0328","","","0.0772","0.0801","","","","","","1.032","","","","has coordinates","270074","2021-10-24","17:53:43",""
"4073053","12.0297","0.0008","18.0692","0.0012","21.8956","0.0015","90","","104.99","0.001","90","","4597.4","0.5","187","2","187","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H74 N2 O3 Si Y -","- C43 H75 N2 O3 Si Y -","- C172 H300 N8 O12 Si4 Y4 -","4","1","","Liu, Xinli; Shang, Xiaomin; Tang, Tao; Hu, Ninghai; Pei, Fengkui; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Achiral Lanthanide Alkyl Complexes Bearing N,O Multidentate Ligands. Synthesis and Catalysis of Highly Heteroselective Ring-Opening Polymerization ofrac-Lactide","Organometallics","2007","26","10","2747","","10.1021/om0700359","","","0.71073","MoKα","","0.0895","0.0498","","","0.1116","0.1263","","","","","","1.025","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073054","9.6989","0.0015","15.599","0.003","16.787","0.003","85.358","0.003","85.947","0.003","74.225","0.003","2432.9","0.7","187","2","187","2","","","","","","","","6","P -1","-P 1","2","","","","- C45.5 H72.5 N2 O3 Si Y -","- C45.5 H72.5 N2 O3 Si Y -","- C91 H145 N4 O6 Si2 Y2 -","2","1","","Liu, Xinli; Shang, Xiaomin; Tang, Tao; Hu, Ninghai; Pei, Fengkui; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Achiral Lanthanide Alkyl Complexes Bearing N,O Multidentate Ligands. Synthesis and Catalysis of Highly Heteroselective Ring-Opening Polymerization ofrac-Lactide","Organometallics","2007","26","10","2747","","10.1021/om0700359","","","0.71073","MoKα","","0.1674","0.0795","","","0.1633","0.2061","","","","","","0.972","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073055","9.9201","0.0008","18.2643","0.0014","19.523","0.0015","90","","90","","90","","3537.2","0.5","187","2","187","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H53 N2 O Si2 Y -","- C32 H53 N2 O Si2 Y -","- C128 H212 N8 O4 Si8 Y4 -","4","1","","Liu, Xinli; Shang, Xiaomin; Tang, Tao; Hu, Ninghai; Pei, Fengkui; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Achiral Lanthanide Alkyl Complexes Bearing N,O Multidentate Ligands. Synthesis and Catalysis of Highly Heteroselective Ring-Opening Polymerization ofrac-Lactide","Organometallics","2007","26","10","2747","","10.1021/om0700359","","","0.71073","MoKα","","0.0524","0.0346","","","0.0838","0.0912","","","","","","1.023","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073056","8.1087","0.0008","12.016","0.001","17.531","0.002","90","","90","","90","","1708.1","0.3","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(pR)-2-(N,N-di-isopropyl-amido)ferrocenylboronic acid","","- C17 H24 B Fe N O3 -","- C17 H24 B Fe N O3 -","- C68 H96 B4 Fe4 N4 O12 -","4","1","","Batsanov, Andrei S.; Hérault, Damien; Howard, Judith A. K.; Patrick, Leonard G. F.; Probert, Michael R.; Whiting, Andrew","Synthesis and Structure of Planar Chiral, Bifunctional Aminoboronic Acid Ferrocene Derivatives","Organometallics","2007","26","9","2414","","10.1021/om070038l","","","0.71073","MoKα","","0.0215","0.0205","","","0.0523","0.0527","","","","","","1.059","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073057","7.306","0.003","10.185","0.004","15.601","0.006","90","","97.45","0.03","90","","1151.1","0.8","120","2","120","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(pR)-N,N-Diisopropyl-2-(4,4,5,5-tetramethyl-[1,3,2]- dioxaborolan-2-yl)-ferrocencarboxamide","","- C23 H34 B Fe N O3 -","- C23 H34 B Fe N O3 -","- C46 H68 B2 Fe2 N2 O6 -","2","1","","Batsanov, Andrei S.; Hérault, Damien; Howard, Judith A. K.; Patrick, Leonard G. F.; Probert, Michael R.; Whiting, Andrew","Synthesis and Structure of Planar Chiral, Bifunctional Aminoboronic Acid Ferrocene Derivatives","Organometallics","2007","26","9","2414","","10.1021/om070038l","","","0.71073","MoKα","","0.1862","0.1146","","","0.2718","0.3207","","","","","","0.981","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073058","7.1359","0.0004","11.753","0.001","20.11","0.002","90","","90","","90","","1686.6","0.2","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(+)-(pR)-2-{(N,N-diisopropylamino)methyl}ferrocenylboronic acid","","- C17 H26 B Fe N O2 -","- C17 H26 B Fe N O2 -","- C68 H104 B4 Fe4 N4 O8 -","4","1","","Batsanov, Andrei S.; Hérault, Damien; Howard, Judith A. K.; Patrick, Leonard G. F.; Probert, Michael R.; Whiting, Andrew","Synthesis and Structure of Planar Chiral, Bifunctional Aminoboronic Acid Ferrocene Derivatives","Organometallics","2007","26","9","2414","","10.1021/om070038l","","","0.71073","MoKα","","0.0523","0.0381","","","0.0724","0.0752","","","","","","0.9","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073059","10.842","0.001","11.304","0.001","13.971","0.001","90","","90","","90","","1712.3","0.3","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(pR)-N-{[2-(Difluoroborylferrocenyl]methyl}-N,N-diisopropylamine hydrofluoride","","- C17 H25 B F3 Fe N -","- C17 H25 B F3 Fe N -","- C68 H100 B4 F12 Fe4 N4 -","4","1","","Batsanov, Andrei S.; Hérault, Damien; Howard, Judith A. K.; Patrick, Leonard G. F.; Probert, Michael R.; Whiting, Andrew","Synthesis and Structure of Planar Chiral, Bifunctional Aminoboronic Acid Ferrocene Derivatives","Organometallics","2007","26","9","2414","","10.1021/om070038l","","","0.71073","MoKα","","0.0364","0.0304","","","0.0714","0.0738","","","","","","0.987","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073060","8.798","0.005","12.597","0.005","14.237","0.005","113.314","0.005","92.841","0.005","92.544","0.005","1443.7","1.1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C25 H16 Cl3 F3 N3 O6 Re S -","- C25 H16 Cl3 F3 N3 O6 Re S -","- C50 H32 Cl6 F6 N6 O12 Re2 S2 -","2","1","","Coe, Benjamin J.; Curati, Naomi R. M.; Fitzgerald, Emma C.; Coles, Simon J.; Horton, Peter N.; Light, Mark E.; Hursthouse, Michael B.","Syntheses and Properties of Bimetallic Chromophore-Quencher Assemblies Containing Ruthenium(II) and Rhenium(I) Centers","Organometallics","2007","26","9","2318","","10.1021/om070042x","","","0.71069","MoKα","","0.0287","0.0274","","","0.0697","0.0704","","","","","","1.064","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073061","11.4905","0.0002","12.8508","0.0002","19.4117","0.0004","90","","107.22","","90","","2737.89","0.09","120","2","120","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C27 H18 Br F6 N3 O3 P Re -","- C27 H18 Br F6 N3 O3 P Re -","- C108 H72 Br4 F24 N12 O12 P4 Re4 -","4","1","","Coe, Benjamin J.; Curati, Naomi R. M.; Fitzgerald, Emma C.; Coles, Simon J.; Horton, Peter N.; Light, Mark E.; Hursthouse, Michael B.","Syntheses and Properties of Bimetallic Chromophore-Quencher Assemblies Containing Ruthenium(II) and Rhenium(I) Centers","Organometallics","2007","26","9","2318","","10.1021/om070042x","","","0.71073","MoKα","","0.0517","0.0451","","","0.1147","0.1199","","","","","","1.045","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073062","13.4828","0.0016","14.1333","0.0009","16.697","0.003","90","","102.1","0.013","90","","3111","0.7","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C31 H25 F6 N3 O6 P Re -","- C31 H25 F6 N3 O6 P Re -","- C124 H100 F24 N12 O24 P4 Re4 -","4","1","","Coe, Benjamin J.; Curati, Naomi R. M.; Fitzgerald, Emma C.; Coles, Simon J.; Horton, Peter N.; Light, Mark E.; Hursthouse, Michael B.","Syntheses and Properties of Bimetallic Chromophore-Quencher Assemblies Containing Ruthenium(II) and Rhenium(I) Centers","Organometallics","2007","26","9","2318","","10.1021/om070042x","","","0.71073","MoKα","","0.0375","0.0245","","","0.0593","0.0647","","","","","","1.022","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073063","10.529","0.006","12.626","0.007","13.129","0.012","101.79","0.06","106.89","0.07","92.26","0.06","1626","2","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H21 F3 N3 O8 Re S -","- C30 H21 F3 N3 O8 Re S -","- C60 H42 F6 N6 O16 Re2 S2 -","2","1","","Coe, Benjamin J.; Curati, Naomi R. M.; Fitzgerald, Emma C.; Coles, Simon J.; Horton, Peter N.; Light, Mark E.; Hursthouse, Michael B.","Syntheses and Properties of Bimetallic Chromophore-Quencher Assemblies Containing Ruthenium(II) and Rhenium(I) Centers","Organometallics","2007","26","9","2318","","10.1021/om070042x","","","0.71073","MoKα","","0.0772","0.0515","","","0.1196","0.1275","","","","","","1.019","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073064","13.3162","0.0011","14.6911","0.0012","16.745","0.002","64.772","0.008","85.426","0.009","84.519","0.005","2947","0.5","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H42 F6 N9 O10 P Re2 -","- C60 H42 F6 N9 O10 P Re2 -","- C120 H84 F12 N18 O20 P2 Re4 -","2","1","","Coe, Benjamin J.; Curati, Naomi R. M.; Fitzgerald, Emma C.; Coles, Simon J.; Horton, Peter N.; Light, Mark E.; Hursthouse, Michael B.","Syntheses and Properties of Bimetallic Chromophore-Quencher Assemblies Containing Ruthenium(II) and Rhenium(I) Centers","Organometallics","2007","26","9","2318","","10.1021/om070042x","","","0.71073","MoKα","","0.0278","0.0228","","","0.0519","0.0539","","","","","","1.041","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073065","9.361","0.005","9.382","0.005","10.278","0.005","63.061","0.005","82.784","0.005","68.665","0.005","748.7","0.7","130","2","130","2","","","","","","","","5","P -1","-P 1","2","JMHI061","JMHI061","","- C32 H42 Cl2 N2 Ru2 -","- C32 H42 Cl2 N2 Ru2 -","- C32 H42 Cl2 N2 Ru2 -","1","0.5","","Hoover, Jessica M.; DiPasquale, Antonio; Mayer, James M.; Michael, Forrest E.","Synthesis and Reactivity of a Ruthenium(III) Bis(anilide) Dimer by Oxidative Addition of an N,N‘-Disubstituted Hydrazine","Organometallics","2007","26","14","3297","","10.1021/om0700462","","","0.71069","MoKα","","0.084","0.0537","","","0.1086","0.1186","","","","","","1.009","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073066","16.448","0.003","10.956","0.002","19.134","0.004","90","","93.26","0.03","90","","3442.4","1.1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 Cl F6 P3 Ru -","- C36 H40 Cl F6 P3 Ru -","- C144 H160 Cl4 F24 P12 Ru4 -","4","1","","Chaplin, Adrian B.; Dyson, Paul J.","Catalytic Activity of Bis-phosphine Ruthenium(II)−Arene Compounds: Structure−Activity Correlations","Organometallics","2007","26","9","2447","","10.1021/om070050d","","","0.71073","MoKα","","0.0901","0.0641","","","0.1258","0.134","","","","","","1.254","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073067","16.478","0.0013","18.948","0.0014","32.554","0.003","90","","90","","90","","10164.2","1.4","140","2","140","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C51 H54 Cl5 F6 P3 Ru -","- C51 H54 Cl5 F6 P3 Ru -","- C408 H432 Cl40 F48 P24 Ru8 -","8","1","","Chaplin, Adrian B.; Dyson, Paul J.","Catalytic Activity of Bis-phosphine Ruthenium(II)−Arene Compounds: Structure−Activity Correlations","Organometallics","2007","26","9","2447","","10.1021/om070050d","","","0.71073","MoKα","","0.1131","0.0672","","","0.1497","0.17","","","","","","1.079","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073068","24.0009","0.0015","11.517","0.0007","16.6737","0.0011","90","","90","","90","","4608.9","0.5","140","2","140","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C45 H50 Cl5 F6 P3 Ru -","- C45 H50 Cl5 F6 P3 Ru -","- C180 H200 Cl20 F24 P12 Ru4 -","4","1","","Chaplin, Adrian B.; Dyson, Paul J.","Catalytic Activity of Bis-phosphine Ruthenium(II)−Arene Compounds: Structure−Activity Correlations","Organometallics","2007","26","9","2447","","10.1021/om070050d","","","0.71073","MoKα","","0.1092","0.0625","","","0.1282","0.142","","","","","","0.863","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073069","17.438","0.0012","22.146","0.0015","14.634","0.001","90","","103.876","0.006","90","","5486.5","0.7","140","2","140","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C57 H57 Cl5 O2 P2 Ru2 -","- C57 H57 Cl5 O2 P2 Ru2 -","- C228 H228 Cl20 O8 P8 Ru8 -","4","1","","Chaplin, Adrian B.; Dyson, Paul J.","Catalytic Activity of Bis-phosphine Ruthenium(II)−Arene Compounds: Structure−Activity Correlations","Organometallics","2007","26","9","2447","","10.1021/om070050d","","","0.71073","MoKα","","0.1505","0.0467","","","0.0565","0.0783","","","","","","0.754","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073070","18.5441","0.0013","19.977","0.0016","15.0623","0.0012","90","","103.329","0.009","90","","5429.6","0.7","180","","180","","","","","","","","synthesis as described","6","C 1 2/m 1","-C 2y","12","","","","- C53 H17 B2 F30 N2 V -","- C53 H17 B2 F30 N2 V -","- C212 H68 B8 F120 N8 V4 -","4","0.5","","Choukroun, Robert; Lorber, Christian; Vendier, Laure","Reaction of V(C6H6)2with the Borane Adducts of Malononitrile [(C6F5)3B·NCCH2CN·B(C6F5)3] and Water [H2O·B(C6F5)3]","Organometallics","2007","26","14","3604","","10.1021/om070052y","","","0.71073","MoKα","","0.0577","0.0464","","","0.1375","0.1468","","","","","","1.081","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073071","19.351","0.002","12.1862","0.0018","21.235","0.002","90","","100.412","0.009","90","","4925.1","1","180","","180","","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C51 H14 B2 F30 N2 -","- C51 H14 B2 F30 N2 -","- C204 H56 B8 F120 N8 -","4","1","","Choukroun, Robert; Lorber, Christian; Vendier, Laure","Reaction of V(C6H6)2with the Borane Adducts of Malononitrile [(C6F5)3B·NCCH2CN·B(C6F5)3] and Water [H2O·B(C6F5)3]","Organometallics","2007","26","14","3604","","10.1021/om070052y","","","","MoKα","","0.125","0.0604","","","0.1253","0.1535","","","","","","1.03","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073072","10.1275","0.0017","13.566","0.002","29.44","0.005","90","","99.135","0.014","90","","3993.5","1.1","180","","180","","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H14 B2 F25 O V -","- C43 H14 B2 F25 O V -","- C172 H56 B8 F100 O4 V4 -","4","1","","Choukroun, Robert; Lorber, Christian; Vendier, Laure","Reaction of V(C6H6)2with the Borane Adducts of Malononitrile [(C6F5)3B·NCCH2CN·B(C6F5)3] and Water [H2O·B(C6F5)3]","Organometallics","2007","26","14","3604","","10.1021/om070052y","","","","MoKα","","0.1593","0.0575","","","0.1093","0.1398","","","","","","0.889","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073073","11.9438","0.0019","12.909","0.002","15.175","0.002","97.186","0.013","108.126","0.014","111.383","0.015","1993.9","0.6","180","","180","","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C42 H12 B2 F25 O V -","- C42 H12 B2 F25 O V -","- C84 H24 B4 F50 O2 V2 -","2","1","","Choukroun, Robert; Lorber, Christian; Vendier, Laure","Reaction of V(C6H6)2with the Borane Adducts of Malononitrile [(C6F5)3B·NCCH2CN·B(C6F5)3] and Water [H2O·B(C6F5)3]","Organometallics","2007","26","14","3604","","10.1021/om070052y","","","","MoKα","","0.1574","0.0425","","","0.0486","0.0659","","","","","","0.73","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073074","12.128","0.002","31.999","0.009","12.13","0.002","90","0.018","98.012","0.015","90","0.002","4661.5","1.7","293","2","293","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","Cobalt(II) Mesitylglyoxime Pyridine","trans-bis(dimesitylglyoximato)-(pyridine)-cobalt(II)","","- C50 H56 Co N6 O4 -","- C50 H56 Co N6 O4 -","- C200 H224 Co4 N24 O16 -","4","0.5","","Mandal, Debaprasad; Bhuyan, Mouchumi; Laskar, Moitree; Gupta, B. D.","Co−C Bond Homolysis: Reactivity Difference between Alkyl- and Benzylcobaloximes","Organometallics","2007","26","11","2795","","10.1021/om070053q","","","0.71073","MoKα","","0.126","0.0621","","","0.1599","0.1731","","","","","","1.018","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073075","14.217","0.0011","14.3381","0.0011","16.6229","0.0013","112.352","0.001","95.69","0.001","111.594","0.001","2799","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","4CN-PhCH2(O2)Co(dmestgH)2Py","","","- C63 H69 Co N8 O6 -","- C63 H69 Co N8 O6 -","- C126 H138 Co2 N16 O12 -","2","1","","Mandal, Debaprasad; Bhuyan, Mouchumi; Laskar, Moitree; Gupta, B. D.","Co−C Bond Homolysis: Reactivity Difference between Alkyl- and Benzylcobaloximes","Organometallics","2007","26","11","2795","","10.1021/om070053q","","","0.71073","MoKα","","0.1041","0.0748","","","0.1987","0.2195","","","","","","1.043","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073076","5.8909","0.0015","6.2233","0.0015","18.54","0.005","98.641","0.004","92.131","0.004","99.696","0.005","661","0.3","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H38 Ge2 N4 -","- C26 H38 Ge2 N4 -","- C26 H38 Ge2 N4 -","1","0.5","","Zabula, Alexander V.; Hahn, F. Ekkehardt; Pape, Tania; Hepp, Alexander","Preparation and Coordination Chemistry of Bidentate Benzimidazoline-2-germylenes","Organometallics","2007","26","8","1972","","10.1021/om070054i","","","0.71073","MoKα","","0.049","0.0405","","","0.0931","0.0964","","","","","","1.035","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073077","22.904","0.008","19.022","0.007","7.464","0.003","90","","103.719","0.006","90","","3159","2","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C27 H40 Ge2 N4 -","- C27 H40 Ge2 N4 -","- C108 H160 Ge8 N16 -","4","0.5","","Zabula, Alexander V.; Hahn, F. Ekkehardt; Pape, Tania; Hepp, Alexander","Preparation and Coordination Chemistry of Bidentate Benzimidazoline-2-germylenes","Organometallics","2007","26","8","1972","","10.1021/om070054i","","","0.71073","MoKα","","0.0932","0.0646","","","0.1695","0.1831","","","","","","1.102","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073078","16.9549","0.0002","5.7892","0.0001","28.8671","0.0004","90","","97.796","0.001","90","","2807.27","0.07","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H38 Ge2 N4 -","- C30 H38 Ge2 N4 -","- C120 H152 Ge8 N16 -","4","1","","Zabula, Alexander V.; Hahn, F. Ekkehardt; Pape, Tania; Hepp, Alexander","Preparation and Coordination Chemistry of Bidentate Benzimidazoline-2-germylenes","Organometallics","2007","26","8","1972","","10.1021/om070054i","","","1.54178","CuKα","","0.0449","0.0309","","","0.0604","0.0625","","","","","","0.867","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073079","7.3257","0.0003","16.5928","0.0008","33.0186","0.0015","90","","90","","90","","4013.5","0.3","110","2","110","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 Ge2 N4 -","- C20 H26 Ge2 N4 -","- C160 H208 Ge16 N32 -","8","2","","Zabula, Alexander V.; Hahn, F. Ekkehardt; Pape, Tania; Hepp, Alexander","Preparation and Coordination Chemistry of Bidentate Benzimidazoline-2-germylenes","Organometallics","2007","26","8","1972","","10.1021/om070054i","","","1.54178","CuKα","","0.0908","0.0479","","","0.0747","0.0824","","","","","","0.812","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073080","12.5616","0.0016","15.564","0.002","13.4637","0.0018","90","","99.296","0.002","90","","2597.7","0.6","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H40 Ge N4 -","- C27 H40 Ge N4 -","- C108 H160 Ge4 N16 -","4","1","","Zabula, Alexander V.; Hahn, F. Ekkehardt; Pape, Tania; Hepp, Alexander","Preparation and Coordination Chemistry of Bidentate Benzimidazoline-2-germylenes","Organometallics","2007","26","8","1972","","10.1021/om070054i","","","0.71073","MoKα","","0.0691","0.0463","","","0.1014","0.1106","","","","","","1.026","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073081","10.4872","0.0013","12.4823","0.0016","13.8925","0.0017","102.47","0.003","108.32","0.003","98.591","0.003","1638.7","0.4","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H40 Ge2 Mo N4 O4 -","- C31 H40 Ge2 Mo N4 O4 -","- C62 H80 Ge4 Mo2 N8 O8 -","2","1","","Zabula, Alexander V.; Hahn, F. Ekkehardt; Pape, Tania; Hepp, Alexander","Preparation and Coordination Chemistry of Bidentate Benzimidazoline-2-germylenes","Organometallics","2007","26","8","1972","","10.1021/om070054i","","","0.71073","MoKα","","0.0706","0.0487","","","0.0954","0.1026","","","","","","1.015","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073082","8.59","0.003","12.219","0.004","12.467","0.004","113.076","0.007","90.027","0.004","91.807","0.005","1203.1","0.7","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H29 Cl N2 O P Rh -","- C24 H29 Cl N2 O P Rh -","- C48 H58 Cl2 N4 O2 P2 Rh2 -","2","1","","Field, Leslie D.; Messerle, Barbara A.; Vuong, Khuong Q.; Turner, Peter; Failes, Tim","Rhodium(I) and Iridium(I) Complexes with Bidentate Phosphine−Pyrazolyl Ligands: Highly Efficient Catalysts for the Hydroamination Reaction","Organometallics","2007","26","8","2058","","10.1021/om070057v","","","0.71073","MoKα","","0.0273","0.0236","","","0.0637","0.0653","","","","","","1.046","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073083","20.923","0.004","9.3077","0.0016","22.399","0.004","90","","104.074","0.003","90","","4231.2","1.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C51 H53 B Ir N2 P -","- C51 H53 B Ir N2 P -","- C204 H212 B4 Ir4 N8 P4 -","4","1","","Field, Leslie D.; Messerle, Barbara A.; Vuong, Khuong Q.; Turner, Peter; Failes, Tim","Rhodium(I) and Iridium(I) Complexes with Bidentate Phosphine−Pyrazolyl Ligands: Highly Efficient Catalysts for the Hydroamination Reaction","Organometallics","2007","26","8","2058","","10.1021/om070057v","","","0.71073","MoKα","","0.0271","0.0209","","","0.0465","0.0475","","","","","","1.215","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073084","11.2909","0.0018","19.373","0.003","20.89","0.003","90","","90","","90","","4569.4","1.2","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C21 H23 Cl3 Ir N2 O P -","- C21 H23 Cl3 Ir N2 O P -","- C168 H184 Cl24 Ir8 N16 O8 P8 -","8","2","","Field, Leslie D.; Messerle, Barbara A.; Vuong, Khuong Q.; Turner, Peter; Failes, Tim","Rhodium(I) and Iridium(I) Complexes with Bidentate Phosphine−Pyrazolyl Ligands: Highly Efficient Catalysts for the Hydroamination Reaction","Organometallics","2007","26","8","2058","","10.1021/om070057v","","","0.71073","MoKα","","0.0423","0.0351","","","0.0814","0.0832","","","","","","1.028","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073085","12.079","0.0015","10.4534","0.0013","16.206","0.002","90","","102.057","0.002","90","","2001.1","0.4","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 Cl N2 O P Rh -","- C20 H21 Cl N2 O P Rh -","- C80 H84 Cl4 N8 O4 P4 Rh4 -","4","1","","Field, Leslie D.; Messerle, Barbara A.; Vuong, Khuong Q.; Turner, Peter; Failes, Tim","Rhodium(I) and Iridium(I) Complexes with Bidentate Phosphine−Pyrazolyl Ligands: Highly Efficient Catalysts for the Hydroamination Reaction","Organometallics","2007","26","8","2058","","10.1021/om070057v","","","0.71073","MoKα","","0.0232","0.0194","","","0.0528","0.0542","","","","","","1.064","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073086","8.553","0.002","12.153","0.003","12.481","0.004","113.091","0.004","90.348","0.004","91.196","0.004","1193","0.6","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H29 Cl Ir N2 O P -","- C24 H29 Cl Ir N2 O P -","- C48 H58 Cl2 Ir2 N4 O2 P2 -","2","1","","Field, Leslie D.; Messerle, Barbara A.; Vuong, Khuong Q.; Turner, Peter; Failes, Tim","Rhodium(I) and Iridium(I) Complexes with Bidentate Phosphine−Pyrazolyl Ligands: Highly Efficient Catalysts for the Hydroamination Reaction","Organometallics","2007","26","8","2058","","10.1021/om070057v","","","0.71073","Mo-Kα","","0.0174","0.0169","","","0.0446","0.0448","","","","","","1.245","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073087","27.5949","0.0009","10.5989","0.0005","16.8333","0.0009","90","","116.434","0.002","90","","4408.6","0.4","150","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","PhNCNPhIrBr2","1,3bisphenylcarbaldimino-2-phenyliridiumdibromide","","- C22 H18 Br2 Ir N3 -","- C22 H18 Br2 Ir N3 -","- C176 H144 Br16 Ir8 N24 -","8","1","","Oakley, Sarah H.; Coogan, Michael P.; Arthur, Richard J.","Synthesis of Bis(imino)aryl Iridium Pincer Complexes and Demonstration of Catalytic Hydrogen-Transfer Activity","Organometallics","2007","26","9","2285","","10.1021/om070059f","","","0.71073","MoKα","","0.1171","0.0786","","","0.1869","0.2109","","","","","","1.01","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073088","8.3368","0.0002","17.4467","0.0005","18.0171","0.0006","90","","92.337","0.002","90","","2618.4","0.13","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","MesNCNIrBr2","1,3bismesitylcarbaldimino-2-phenyliridiumdibromide","","- C28 H30 Br2 Ir N3 -","- C28 H30 Br2 Ir N3 -","- C112 H120 Br8 Ir4 N12 -","4","1","","Oakley, Sarah H.; Coogan, Michael P.; Arthur, Richard J.","Synthesis of Bis(imino)aryl Iridium Pincer Complexes and Demonstration of Catalytic Hydrogen-Transfer Activity","Organometallics","2007","26","9","2285","","10.1021/om070059f","","","0.71073","MoKα","","0.0846","0.0571","","","0.131","0.1439","","","","","","1.032","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073089","10.632","0.002","13.536","0.003","25.59","0.005","90","","90","0.03","90","","3682.8","1.3","253","2","253","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C29 H25 Cl4 F6 N6 O4 P Re -","- C29 H25 Cl4 F6 N6 O4 P Re -","- C116 H100 Cl16 F24 N24 O16 P4 Re4 -","4","1","","Lo, Kenneth Kam-Wing; Sze, Ka-Shing; Tsang, Keith Hing-Kit; Zhu, Nianyong","Luminescent Tricarbonylrhenium(I) Dipyridoquinoxaline Indole Complexes as Sensitive Probes for Indole-Binding Proteins","Organometallics","2007","26","14","3440","","10.1021/om0700617","","","0.71073","MoKα","","0.0863","0.042","","","0.1079","0.1177","","","","","","0.882","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073090","11.5337","0.0005","12.2438","0.0006","15.7362","0.0007","98.347","0.003","90.241","0.003","104.096","0.002","2130.65","0.17","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","3,3-dihydro-2-methyl-2,4-bis((2,6-diisopropylphenylimino)ethyl) pyridin-2-yl))-1H-1,5-benzodiazepine","","- C48 H56 N6 -","- C48 H56 N6 -","- C96 H112 N12 -","2","1","","Zhang, Shu; Vystorop, Igor; Tang, Zhenghua; Sun, Wen-Hua","Bimetallic (Iron or Cobalt) Complexes Bearing 2-Methyl-2,4-bis(6-iminopyridin-2-yl)-1H-1,5-benzodiazepines for Ethylene Reactivity","Organometallics","2007","26","9","2456","","10.1021/om070062z","","","0.71073","MoKα","","","0.0825","","","0.236","0.2872","","","","","","0.971","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073091","11.198","0.002","16.308","0.003","16.371","0.003","103.77","0.03","91.89","0.03","96.22","0.03","2881.3","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","{3,3-dihydro-2-methyl-2,4-bis((2,6-diisopropylphenylimino)ethyl) pyridin-2-yl))-1H-1,5-benzodiazepine}FeCl2","","- C52 H65 Cl8 Co2 N6 O -","- C52 H65 Cl8 Co2 N6 O -","- C104 H130 Cl16 Co4 N12 O2 -","2","1","","Zhang, Shu; Vystorop, Igor; Tang, Zhenghua; Sun, Wen-Hua","Bimetallic (Iron or Cobalt) Complexes Bearing 2-Methyl-2,4-bis(6-iminopyridin-2-yl)-1H-1,5-benzodiazepines for Ethylene Reactivity","Organometallics","2007","26","9","2456","","10.1021/om070062z","","","0.71073","MoKα","","","0.0726","","","0.1891","0.2216","","","","","","1.01","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073092","9.5909","0.0003","11.2097","0.0003","13.6304","0.0004","66.284","0.002","73.418","0.002","76.76","0.002","1274.92","0.07","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H33 F6 N2 Pd S Sb -","- C22 H33 F6 N2 Pd S Sb -","- C44 H66 F12 N4 Pd2 S2 Sb2 -","2","1","","Roseblade, Stephen J.; Ros, Abel; Monge, David; Alcarazo, Manuel; Álvarez, Eleuterio; Lassaletta, José M.; Fernández, Rosario","Imidazo[1,5-a]pyridin-3-ylidene/Thioether Mixed C/S Ligands and Complexes Thereof§","Organometallics","2007","26","10","2570","","10.1021/om070063r","","","0.71073","MoKα","","0.0929","0.0488","","","0.0976","0.1155","","","","","","1.031","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073093","9.373","0.003","11.268","0.003","17.503","0.004","81.48","0.006","84.441","0.007","84.601","0.005","1813.6","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H104 Ag4 Br4 N8 S4 -","- C60 H104 Ag4 Br4 N8 S4 -","- C60 H104 Ag4 Br4 N8 S4 -","1","0.5","","Roseblade, Stephen J.; Ros, Abel; Monge, David; Alcarazo, Manuel; Álvarez, Eleuterio; Lassaletta, José M.; Fernández, Rosario","Imidazo[1,5-a]pyridin-3-ylidene/Thioether Mixed C/S Ligands and Complexes Thereof§","Organometallics","2007","26","10","2570","","10.1021/om070063r","","","0.71073","MoKα","","0.1117","0.0778","","","0.1826","0.2009","","","","","","1.064","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073094","8.9666","0.0003","9.1795","0.0003","15.8847","0.0005","90","","90.09","0.001","90","","1307.45","0.07","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C21 H37 F6 N2 Pd S Sb -","- C21 H37 F6 N2 Pd S Sb -","- C42 H74 F12 N4 Pd2 S2 Sb2 -","2","1","","Roseblade, Stephen J.; Ros, Abel; Monge, David; Alcarazo, Manuel; Álvarez, Eleuterio; Lassaletta, José M.; Fernández, Rosario","Imidazo[1,5-a]pyridin-3-ylidene/Thioether Mixed C/S Ligands and Complexes Thereof§","Organometallics","2007","26","10","2570","","10.1021/om070063r","","","0.71073","MoKα","","0.015","0.0145","","","0.0367","0.0369","","","","","","1.03","","","","has coordinates,has disorder","178619","2020-10-21","18:00:00",""
"4073095","11.9786","0.0005","22.1371","0.0008","13.5137","0.0005","90","","108.129","0.001","90","","3405.6","0.2","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C30 H40 F6 N2 Rh S Sb -","- C30 H40 F6 N2 Rh S Sb -","- C120 H160 F24 N8 Rh4 S4 Sb4 -","4","2","","Roseblade, Stephen J.; Ros, Abel; Monge, David; Alcarazo, Manuel; Álvarez, Eleuterio; Lassaletta, José M.; Fernández, Rosario","Imidazo[1,5-a]pyridin-3-ylidene/Thioether Mixed C/S Ligands and Complexes Thereof§","Organometallics","2007","26","10","2570","","10.1021/om070063r","","","0.71073","MoKα","","0.0771","0.0603","","","0.1645","0.1754","","","","","","1.047","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073096","49.43","0.003","16.0307","0.0009","12.9022","0.0007","90","","95.569","0.001","90","","10175.4","1","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C45 H55.5 Cl0 F6 N6.5 O6 Os S2 -","- C45 H55.5 F6 N6.5 O6 Os S2 -","- C360 H444 F48 N52 O48 Os8 S16 -","8","1","","Castarlenas, Ricardo; Esteruelas, Miguel A.; Oñate, Enrique","Preparation and Structure of Alkylidene−Osmium and Hydride−Alkylidyne−Osmium Complexes Containing an N-Heterocyclic Carbene Ligand","Organometallics","2007","26","8","2129","","10.1021/om070065b","","","0.71073","MoKα","","0.0872","0.0546","","","0.113","0.1236","","","","","","0.951","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073097","21.64","0.003","10.3091","0.0013","22.299","0.003","90","","115.516","0.002","90","","4489.5","1","100","2","100","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C44 H63 Cl F3 N2 O3 Os P S -","- C44 H63 Cl F3 N2 O3 Os P S -","- C176 H252 Cl4 F12 N8 O12 Os4 P4 S4 -","4","1","","Castarlenas, Ricardo; Esteruelas, Miguel A.; Oñate, Enrique","Preparation and Structure of Alkylidene−Osmium and Hydride−Alkylidyne−Osmium Complexes Containing an N-Heterocyclic Carbene Ligand","Organometallics","2007","26","8","2129","","10.1021/om070065b","","","0.71073","MoKα","","0.0305","0.0226","","","0.0432","0.0446","","","","","","0.901","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073098","20.382","0.004","14.982","0.003","23.225","0.005","90","","106.124","0.011","90","","6813","2","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C67 H78 B F20 N O2 P2 Pd -","- C67 H69 B F20 N O2 P2 Pd -","- C268 H276 B4 F80 N4 O8 P8 Pd4 -","4","1","","Thirupathi, Natesan; Amoroso, Dino; Bell, Andrew; Protasiewicz, John D.","Reactivity Studies of Cationic Palladium(II) Phosphine Carboxylate Complexes with Lewis Bases: Substitution versus Cyclometalation","Organometallics","2007","26","13","3157","","10.1021/om070069g","","","0.71073","MoKα","","0.1421","0.0644","","","0.1237","0.1529","","","","","","1.013","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073099","14.91","0.003","15.0468","0.0019","18.3","0.003","69.387","0.01","67.634","0.012","88.773","0.012","3523.5","1.1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C69 H79 B F20 N2 O2 P2 Pd -","- C69 H79 B F20 N2 O2 P2 Pd -","- C138 H158 B2 F40 N4 O4 P4 Pd2 -","2","1","","Thirupathi, Natesan; Amoroso, Dino; Bell, Andrew; Protasiewicz, John D.","Reactivity Studies of Cationic Palladium(II) Phosphine Carboxylate Complexes with Lewis Bases: Substitution versus Cyclometalation","Organometallics","2007","26","13","3157","","10.1021/om070069g","","","0.71073","MoKα","","0.115","0.0647","","","0.1441","0.1675","","","","","","1.032","","","","has coordinates","178619","2020-10-21","18:00:00",""
"4073100","16.195","0.003","10.44","0.002","17.58","0.004","90","","109.21","0.03","90","","2806.8","1.1","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H45 Cl P2 Pt -","- C28 H45 Cl P2 Pt -","- C112 H180 Cl4 P8 Pt4 -","4","1","","Schwartsburd, Leonid; Poverenov, Elena; Shimon, Linda J. W.; Milstein, David","Naphthyl-Based PCP Platinum Complexes. Nucleophilic Activation of Coordinated CO and Synthesis of a Pt(II) Formyl Complex","Organometallics","2007","26","11","2931","","10.1021/om0700720","","","0.71073","MoKα","","0.0646","0.0384","","","0.0854","0.0925","","","","","","0.99","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073101","12.097","0.002","15.15","0.003","38.514","0.008","90","","90","","90","","7058","2","120","2","120","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C58 H90 B2 F8 O2 P4 Pt2 -","- C58 H90 B2 F8 O2 P4 Pt2 -","- C232 H360 B8 F32 O8 P16 Pt8 -","4","1","","Schwartsburd, Leonid; Poverenov, Elena; Shimon, Linda J. W.; Milstein, David","Naphthyl-Based PCP Platinum Complexes. Nucleophilic Activation of Coordinated CO and Synthesis of a Pt(II) Formyl Complex","Organometallics","2007","26","11","2931","","10.1021/om0700720","","","0.71073","MoKα","","0.0634","0.0549","","","0.1524","0.1579","","","","","","1.059","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073102","11.2187","0.0007","11.8654","0.0008","18.0649","0.0012","94.078","0.002","90.889","0.002","113.353","0.001","2199.6","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C54 H58 N4 Yb -","- C54 H58 N4 Yb -","- C108 H116 N8 Yb2 -","2","1","","Trifonov, Alexander A.; Fedorova, Elena A.; Borovkov, Ivan A.; Fukin, Georgy K.; Baranov, Evguenii V.; Larionova, Joulia; Druzhkov, Nikolai O.","Steric Manipulation of the Reductive Reactivity of Ytterbocenes toward 2-(((2,6-Diisopropylphenyl)imino)methyl)pyridine: Insertion of the NC Bond into the Yb−Indenyl Bond or Oxidative Cleavage of the η5Yb−Cp (Cp = C13H9, Cp*) Bond","Organometallics","2007","26","10","2488","","10.1021/om070073s","","","0.71073","MoKα","","0.0503","0.0357","","","0.0703","0.0735","","","","","","0.952","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073103","18.573","0.0008","18.573","0.0008","25.1943","0.0015","90","","90","","120","","7526.6","0.6","100","2","100","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C54 H66 N6 Yb -","- C54 H66 N6 Yb -","- C324 H396 N36 Yb6 -","6","0.333333","","Trifonov, Alexander A.; Fedorova, Elena A.; Borovkov, Ivan A.; Fukin, Georgy K.; Baranov, Evguenii V.; Larionova, Joulia; Druzhkov, Nikolai O.","Steric Manipulation of the Reductive Reactivity of Ytterbocenes toward 2-(((2,6-Diisopropylphenyl)imino)methyl)pyridine: Insertion of the NC Bond into the Yb−Indenyl Bond or Oxidative Cleavage of the η5Yb−Cp (Cp = C13H9, Cp*) Bond","Organometallics","2007","26","10","2488","","10.1021/om070073s","","","0.71073","MoKα","","0.0365","0.0304","","","0.0824","0.085","","","","","","1.088","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073104","10.8712","0.0005","11.5312","0.0005","17.6163","0.0008","74","0.001","82.13","0.001","71.873","0.001","2014.27","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C46 H59 N4 Yb -","- C46 H59 N4 Yb -","- C92 H118 N8 Yb2 -","2","1","","Trifonov, Alexander A.; Fedorova, Elena A.; Borovkov, Ivan A.; Fukin, Georgy K.; Baranov, Evguenii V.; Larionova, Joulia; Druzhkov, Nikolai O.","Steric Manipulation of the Reductive Reactivity of Ytterbocenes toward 2-(((2,6-Diisopropylphenyl)imino)methyl)pyridine: Insertion of the NC Bond into the Yb−Indenyl Bond or Oxidative Cleavage of the η5Yb−Cp (Cp = C13H9, Cp*) Bond","Organometallics","2007","26","10","2488","","10.1021/om070073s","","","0.71073","MoKα","","0.0356","0.0299","","","0.0701","0.0723","","","","","","1.07","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073105","11.5179","0.0005","19.1156","0.0011","23.1645","0.0011","90","","90","","90","","5100.2","0.4","200","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C46 H37 Cl9 N3 O8 P -","- C46 H37 Cl9 N3 O8 P -","- C184 H148 Cl36 N12 O32 P4 -","4","1","","Constant, Samuel; Frantz, Richard; Müller, Jessica; Bernardinelli, Gérald; Lacour, Jérôme","TRISPHAT-N: A Chiral Hexacoordinated Phosphate Anion with Unique Asymmetric Coordinating Properties","Organometallics","2007","26","9","2141","","10.1021/om070074k","","","0.71073","MoKα","","","0.037","","","","0.034","","","","","","1.65","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073106","14.4833","0.001","19.3609","0.0018","20.7455","0.0013","90","","90","","90","","5817.2","0.8","200","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C45 H20 Cl19 Cu N3 O6 P -","- C45 H20 Cl19 Cu N3 O6 P -","- C180 H80 Cl76 Cu4 N12 O24 P4 -","4","1","","Constant, Samuel; Frantz, Richard; Müller, Jessica; Bernardinelli, Gérald; Lacour, Jérôme","TRISPHAT-N: A Chiral Hexacoordinated Phosphate Anion with Unique Asymmetric Coordinating Properties","Organometallics","2007","26","9","2141","","10.1021/om070074k","","","0.71073","MoKα","","","0.044","","","","0.04","","","","","","1.46","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073107","14.834","0.003","17.7","0.004","18.809","0.004","90","","101.74","0.03","90","","4835.2","1.9","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C54 H78 Sn2 -","- C54 H78 Sn2 -","- C216 H312 Sn8 -","4","1","","Elhamzaoui, Hicham; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan","α,ω-Bis(trialkynyltin) Compounds with a Linear or Cross-Shaped Spacer","Organometallics","2007","26","16","3908","","10.1021/om070078p","","","0.71073","MoKα","","0.0888","0.0814","","","0.1892","0.1944","","","","","","1.12","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073108","8.548","0.002","10.347","0.004","14.667","0.003","96.19","0.02","102.92","0.01","110.07","0.02","1163.2","0.6","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","4,4'-bis(tricyclohexylstannylmethyl)biphenyl","","- C25 H39 Sn -","- C25 H39 Sn -","- C50 H78 Sn2 -","2","1","","Elhamzaoui, Hicham; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan","α,ω-Bis(trialkynyltin) Compounds with a Linear or Cross-Shaped Spacer","Organometallics","2007","26","16","3908","","10.1021/om070078p","","","0.71073","MoKα","","0.1514","0.0797","","","0.1838","0.2089","","","","","","1.054","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073109","6.6057","0.0002","10.4017","0.0003","12.4606","0.0004","99.562","0.002","91.475","0.002","107.792","0.002","801.23","0.04","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H27 O Sn -","- C14 H27 O Sn -","- C28 H54 O2 Sn2 -","2","1","","Elhamzaoui, Hicham; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan","α,ω-Bis(trialkynyltin) Compounds with a Linear or Cross-Shaped Spacer","Organometallics","2007","26","16","3908","","10.1021/om070078p","","","0.71073","MoKα","","0.0361","0.027","","","0.0622","0.0652","","","","","","1.116","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073110","10.696","","11.584","","12.637","","77.07","","71.12","","87.88","","1442.89","","240","2","240","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H51 O Sn -","- C29 H51 O Sn -","- C58 H102 O2 Sn2 -","2","1","","Elhamzaoui, Hicham; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan","α,ω-Bis(trialkynyltin) Compounds with a Linear or Cross-Shaped Spacer","Organometallics","2007","26","16","3908","","10.1021/om070078p","","","0.71073","MoKα","","0.1494","0.0485","","","0.1028","0.125","","","","","","0.83","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073111","7.428","0.0003","9.861","0.0004","16.705","0.0004","83.79","0.002","89.035","0.003","72.043","0.002","1156.99","0.07","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H86 O2 Sn2 -","- C44 H86 O2 Sn2 -","- C44 H86 O2 Sn2 -","1","0.5","","Elhamzaoui, Hicham; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan","α,ω-Bis(trialkynyltin) Compounds with a Linear or Cross-Shaped Spacer","Organometallics","2007","26","16","3908","","10.1021/om070078p","","","0.71073","MoKα","","0.0286","0.023","","","0.0535","0.0559","","","","","","1.098","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073112","7.7368","0.0003","10.8683","0.0005","12.8803","0.0006","110.247","0.004","102.111","0.004","89.552","0.004","991.03","0.08","170","2","170","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H31 O Sn -","- C20 H31 O Sn -","- C40 H62 O2 Sn2 -","2","1","","Elhamzaoui, Hicham; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan","α,ω-Bis(trialkynyltin) Compounds with a Linear or Cross-Shaped Spacer","Organometallics","2007","26","16","3908","","10.1021/om070078p","","","0.71073","MoKα","","0.0455","0.0287","","","0.0693","0.0714","","","","","","0.967","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073113","6.616","0.003","8.932","0.011","10.654","0.008","90.03","0.07","90.44","0.05","99.49","0.05","621","0.9","170","2","170","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H12 Cl3 Sn -","- C10 H12 Cl3 Sn -","- C20 H24 Cl6 Sn2 -","2","1","","Elhamzaoui, Hicham; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan","α,ω-Bis(trialkynyltin) Compounds with a Linear or Cross-Shaped Spacer","Organometallics","2007","26","16","3908","","10.1021/om070078p","","","0.71073","MoKα","","0.0546","0.0468","","","0.1185","0.1248","","","","","","1.135","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073114","8.4073","0.0004","10.5641","0.0008","17.632","0.0009","90","","90.688","0.004","90","","1565.88","0.16","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C11 H18 Cl3 O Sn -","- C11 H18 Cl2.997 O Sn -","- C44 H72 Cl11.988 O4 Sn4 -","4","1","","Elhamzaoui, Hicham; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan","α,ω-Bis(trialkynyltin) Compounds with a Linear or Cross-Shaped Spacer","Organometallics","2007","26","16","3908","","10.1021/om070078p","","","0.71073","MoKα","","0.0424","0.0345","","","0.082","0.0856","","","","","","1.094","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073115","8.4028","0.0001","10.4973","0.0001","26.7764","0.0003","80.0327","0.0007","81.3864","0.0008","83.1463","0.0008","2289.37","0.04","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H68 Cl6 O2 Sn2 -","- C38 H68 Cl6 O2 Sn2 -","- C76 H136 Cl12 O4 Sn4 -","2","1","","Elhamzaoui, Hicham; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan","α,ω-Bis(trialkynyltin) Compounds with a Linear or Cross-Shaped Spacer","Organometallics","2007","26","16","3908","","10.1021/om070078p","","","0.71073","MoKα","","0.0542","0.0371","","","0.0936","0.1457","","","","","","1.195","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073116","8.1292","0.0005","11.3297","0.0006","11.9733","0.0007","114.029","0.006","92.593","0.005","96.61","0.005","995.33","0.11","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H54 O2 Sn2 -","- C40 H54 O2 Sn2 -","- C40 H54 O2 Sn2 -","1","0.5","","Elhamzaoui, Hicham; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan","α,ω-Bis(trialkynyltin) Compounds with a Linear or Cross-Shaped Spacer","Organometallics","2007","26","16","3908","","10.1021/om070078p","","","0.71073","MoKα","","0.0449","0.0327","","","0.0646","0.0672","","","","","","0.95","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073117","8.7063","0.001","11.434","0.0017","18.23","0.003","90","","90","","90","","1814.8","0.5","133.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H18 As2 O8 -","- C14 H18 As2 O8 -","- C56 H72 As8 O32 -","4","1","","Nakahashi, Akiko; Naka, Kensuke; Chujo, Yoshiki","1,4-Dihydro-1,4-diarsinine: Facile Synthesis via Nonvolatile Arsenic Intermediates by Radical Reactions","Organometallics","2007","26","7","1827","","10.1021/om070080g","","","0.71075","MoKα","","","0.0376","","","","0.0906","","","","","","1.008","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073118","10.0732","0.0016","9.013","0.002","17.42","0.003","90","","100.626","0.008","90","","1554.4","0.5","123.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 As2 N2 -","- C16 H16 As2 N2 -","- C64 H64 As8 N8 -","4","1","","Nakahashi, Akiko; Naka, Kensuke; Chujo, Yoshiki","1,4-Dihydro-1,4-diarsinine: Facile Synthesis via Nonvolatile Arsenic Intermediates by Radical Reactions","Organometallics","2007","26","7","1827","","10.1021/om070080g","","","0.71075","MoKα","","","0.0363","","","","0.0893","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073119","12.2271","0.0017","18.577","0.003","18.876","0.002","103.568","0.01","101.002","0.009","97.642","0.005","4019.7","1","173","2","173","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C41 H65 B Ca N2 O -","- C41 H65 B Ca N2 O -","- C164 H260 B4 Ca4 N8 O4 -","4","2","","Barrett, Anthony G. M.; Crimmin, Mark R.; Hill, Michael S.; Hitchcock, Peter B.; Procopiou, Panayiotis A.","Reactions of β-Diketiminate-Stabilized Calcium Amides with 9-Borabicyclo[3.3.1]nonane (9-BBN)","Organometallics","2007","26","16","4076","","10.1021/om070083t","","x-ray","0.71073","MoKα","","0.1404","0.0789","","","0.1382","0.1628","","","","","","1.134","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073120","10.1918","0.0002","27.4592","0.0005","18.0685","0.0002","90","","99.252","0.001","90","","4990.84","0.15","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H24 B N -","- C20 H24 B N -","- C240 H288 B12 N12 -","12","3","","Barrett, Anthony G. M.; Crimmin, Mark R.; Hill, Michael S.; Hitchcock, Peter B.; Procopiou, Panayiotis A.","Reactions of β-Diketiminate-Stabilized Calcium Amides with 9-Borabicyclo[3.3.1]nonane (9-BBN)","Organometallics","2007","26","16","4076","","10.1021/om070083t","","x-ray","0.71073","MoKα","","0.0868","0.0529","","","0.1158","0.1326","","","","","","0.993","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073121","14.079","0.003","22.641","0.005","22.189","0.005","90","","93.219","0.005","90","","7062","3","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C66 H96 O12 Si3 Te3 -","- C66 H96 O12 Si3 Te3 -","- C264 H384 O48 Si12 Te12 -","4","1","","Beckmann, Jens; Bolsinger, Jens","Reactivity of (p-MeOC6H4)2TeO towardt-Bu2Si(OH)2. Synthesis of a 12-Membered Tellurasiloxane Ring,cyclo-[(p-MeOC6H4)2TeOSit-Bu2O]3","Organometallics","2007","26","14","3601","","10.1021/om070084l","","","0.71073","MoKα","","0.075","0.0409","","","0.0905","0.1102","","","","","","1.047","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073122","14.6421","0.0013","12.4541","0.0011","19.7153","0.0017","90","","90","","90","","3595.2","0.5","153","2","153","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C35 H16 Cl2 F19 P2 Rh -","- C35 H16 Cl2 F19 P2 Rh -","- C140 H64 Cl8 F76 P8 Rh4 -","4","1","","Marr, Andrew C.; Nieuwenhuyzen, Mark; Pollock, Ciara L.; Saunders, Graham C.","Synthesis of Piano Stool Complexes Employing the Pentafluorophenyl-Substituted Diphosphine (C6F5)2PCH2P(C6F5)2and the Effect of Phosphine Modifiers on Hydrogen Transfer Catalysis","Organometallics","2007","26","10","2659","","10.1021/om070089i","","","0.71073","MoKα","","0.0705","0.0447","","","0.0856","0.0955","","","","","","1.017","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073123","15.047","0.002","12.572","0.002","21.976","0.004","90","","109.372","0.003","90","","3921.9","1.1","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H16 B Cl3 F24 P2 Ru -","- C35 H16 B Cl3 F24 P2 Ru -","- C140 H64 B4 Cl12 F96 P8 Ru4 -","4","1","","Marr, Andrew C.; Nieuwenhuyzen, Mark; Pollock, Ciara L.; Saunders, Graham C.","Synthesis of Piano Stool Complexes Employing the Pentafluorophenyl-Substituted Diphosphine (C6F5)2PCH2P(C6F5)2and the Effect of Phosphine Modifiers on Hydrogen Transfer Catalysis","Organometallics","2007","26","10","2659","","10.1021/om070089i","","","0.71073","MoKα","","0.147","0.0665","","","0.1452","0.1849","","","","","","1.009","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073124","17.95","0.04","21.6","0.05","9.71","0.02","90","","90","","90","","3765","14","298","2","298","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C35 H17 B Cl F24 Ir P2 -","- C35 B Cl F24 Ir P2 -","- C140 B4 Cl4 F96 Ir4 P8 -","4","0.5","","Marr, Andrew C.; Nieuwenhuyzen, Mark; Pollock, Ciara L.; Saunders, Graham C.","Synthesis of Piano Stool Complexes Employing the Pentafluorophenyl-Substituted Diphosphine (C6F5)2PCH2P(C6F5)2and the Effect of Phosphine Modifiers on Hydrogen Transfer Catalysis","Organometallics","2007","26","10","2659","","10.1021/om070089i","","","0.71073","MoKα","","0.1633","0.1139","","","0.2497","0.2736","","","","","","1.082","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073125","17.933","0.003","9.7034","0.0016","21.676","0.004","90","","90","","90","","3771.9","1.1","298","2","298","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C35 H17 B Cl F24 P2 Rh -","- C35 H17 B Cl F24 P2 Rh -","- C140 H68 B4 Cl4 F96 P8 Rh4 -","4","1","","Marr, Andrew C.; Nieuwenhuyzen, Mark; Pollock, Ciara L.; Saunders, Graham C.","Synthesis of Piano Stool Complexes Employing the Pentafluorophenyl-Substituted Diphosphine (C6F5)2PCH2P(C6F5)2and the Effect of Phosphine Modifiers on Hydrogen Transfer Catalysis","Organometallics","2007","26","10","2659","","10.1021/om070089i","","","0.71073","MoKα","","0.0626","0.0499","","","0.1254","0.1387","","","","","","1.029","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073126","10.44","","11.061","","12.053","","82.9","","67.14","","80.91","","1263.45","","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H2 F20 P2 -","- C25 H2 F20 P2 -","- C50 H4 F40 P4 -","2","1","","Marr, Andrew C.; Nieuwenhuyzen, Mark; Pollock, Ciara L.; Saunders, Graham C.","Synthesis of Piano Stool Complexes Employing the Pentafluorophenyl-Substituted Diphosphine (C6F5)2PCH2P(C6F5)2and the Effect of Phosphine Modifiers on Hydrogen Transfer Catalysis","Organometallics","2007","26","10","2659","","10.1021/om070089i","","","0.71073","MoKα","","0.0648","0.0426","","","0.1035","0.1125","","","","","","1.032","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073127","10.41","0.004","11.037","0.005","18.457","0.007","104.793","0.006","92.372","0.006","104.433","0.006","1973.1","1.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H14 Cl4 F20 P2 Ru2 -","- C34 H14 Cl4 F20 P2 Ru2 -","- C68 H28 Cl8 F40 P4 Ru4 -","2","1","","Marr, Andrew C.; Nieuwenhuyzen, Mark; Pollock, Ciara L.; Saunders, Graham C.","Synthesis of Piano Stool Complexes Employing the Pentafluorophenyl-Substituted Diphosphine (C6F5)2PCH2P(C6F5)2and the Effect of Phosphine Modifiers on Hydrogen Transfer Catalysis","Organometallics","2007","26","10","2659","","10.1021/om070089i","","","0.71073","MoKα","","0.1857","0.0815","","","0.1883","0.2547","","","","","","0.919","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073128","10.5025","0.0006","23.2946","0.0013","13.8088","0.0007","90","","106.838","0.001","90","","3233.5","0.3","293","2","187","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H45 Lu N2 Si2 -","- C31 H45 Lu N2 Si2 -","- C124 H180 Lu4 N8 Si8 -","4","1","","Wang, Baoli; Wang, Dun; Cui, Dongmei; Gao, Wei; Tang, Tao; Chen, Xuesi; Jing, Xiabin","Synthesis of the First Rare Earth Metal Bis(alkyl)s Bearing an Indenyl Functionalized N-Heterocyclic Carbene","Organometallics","2007","26","13","3167","","10.1021/om0700922","","","0.71073","MoKα","","0.0336","0.026","","","0.0598","0.0618","","","","","","0.956","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073129","9.693","0.002","12.446","0.003","15.295","0.003","90","","91.781","0.005","90","","1844.3","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H23 Fe2 N O2 -","- C20 H23 Fe2 N O2 -","- C80 H92 Fe8 N4 O8 -","4","1","","Albano, Vincenzo G.; Busetto, Luigi; Marchetti, Fabio; Monari, Magda; Zacchini, Stefano; Zanotti, Valerio","Alkyne−Isocyanide Coupling in [Fe2(CNMe)(CO)3(Cp)2]: A New Route to Diiron μ-Vinyliminium Complexes†","Organometallics","2007","26","14","3448","","10.1021/om070097z","","","0.71073","MoKα","","0.0687","0.0604","","","0.1499","0.1625","","","","","","1.102","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073130","8.2804","0.0003","12.4402","0.0004","15.0634","0.0005","107.47","0.001","101.819","0.001","91.795","0.001","1441.55","0.09","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H32 F3 Fe2 N O5 S -","- C29 H32 F3 Fe2 N O5 S -","- C58 H64 F6 Fe4 N2 O10 S2 -","2","1","","Albano, Vincenzo G.; Busetto, Luigi; Marchetti, Fabio; Monari, Magda; Zacchini, Stefano; Zanotti, Valerio","Alkyne−Isocyanide Coupling in [Fe2(CNMe)(CO)3(Cp)2]: A New Route to Diiron μ-Vinyliminium Complexes†","Organometallics","2007","26","14","3448","","10.1021/om070097z","","","0.71073","MoKα","","0.0833","0.066","","","0.1931","0.2112","","","","","","1.043","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073131","9.0847","0.0018","35.133","0.007","8.4489","0.0017","90","","115.43","0.03","90","","2435.4","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H25 Cl2 Fe2 N O6 -","- C23 H25 Cl2 Fe2 N O6 -","- C92 H100 Cl8 Fe8 N4 O24 -","4","1","","Albano, Vincenzo G.; Busetto, Luigi; Marchetti, Fabio; Monari, Magda; Zacchini, Stefano; Zanotti, Valerio","Alkyne−Isocyanide Coupling in [Fe2(CNMe)(CO)3(Cp)2]: A New Route to Diiron μ-Vinyliminium Complexes†","Organometallics","2007","26","14","3448","","10.1021/om070097z","","","0.71073","MoKα","","0.0911","0.0817","","","0.1789","0.185","","","","","","1.131","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073132","13.911","0.003","22.709","0.005","17.018","0.003","90","","101.16","0.03","90","","5274","2","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H24 B F4 Fe2 N O2 -","- C28 H24 B F4 Fe2 N O2 -","- C224 H192 B8 F32 Fe16 N8 O16 -","8","2","","Albano, Vincenzo G.; Busetto, Luigi; Marchetti, Fabio; Monari, Magda; Zacchini, Stefano; Zanotti, Valerio","Alkyne−Isocyanide Coupling in [Fe2(CNMe)(CO)3(Cp)2]: A New Route to Diiron μ-Vinyliminium Complexes†","Organometallics","2007","26","14","3448","","10.1021/om070097z","","","0.71073","MoKα","","0.0898","0.061","","","0.166","0.1847","","","","","","1.083","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073133","6.437","0.0003","12.591","0.0005","14.983","0.001","96.361","0.005","92.04","0.005","104.006","0.004","1168.54","0.11","150","1","150","1","","","","","","","synthesized by the authors","6","P -1","-P 1","2","","trichloro-(h5-dimethylfluorosilylcyclopentadienyl)titanum(IV)","","- C7 H10 Cl3 F Si Ti -","- C7 H10 Cl3 F Si Ti -","- C28 H40 Cl12 F4 Si4 Ti4 -","4","2","","Erben, Milan; Merna, Jan; Hermanová, Soňa; Císařová, Ivana; Padělková, Zdeňka; Dušek, Michal","Fluorosilyl-Substituted Cyclopentadienyltitanium(IV) Complexes: Synthesis, Structure, and Styrene Polymerization Behavior#","Organometallics","2007","26","10","2735","","10.1021/om070098r","","x-ray","0.71073","MoKα","","0.0596","0.035","","","0.0893","0.1125","","","","","","1.228","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073134","14.0743","0.0001","26.4287","0.0002","26.6932","0.0002","90","","93.2874","0.0005","90","","9912.61","0.13","150","2","150","2","","","","","","","synthesized by the authors","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H50 F20 Si5 Ti5 -","- C35 H50 F20 Si5 Ti5 -","- C280 H400 F160 Si40 Ti40 -","8","2","","Erben, Milan; Merna, Jan; Hermanová, Soňa; Císařová, Ivana; Padělková, Zdeňka; Dušek, Michal","Fluorosilyl-Substituted Cyclopentadienyltitanium(IV) Complexes: Synthesis, Structure, and Styrene Polymerization Behavior#","Organometallics","2007","26","10","2735","","10.1021/om070098r","","x-ray","0.71073","MoKα","","0.0668","0.0385","","","0.083","0.0929","","","","","","1.076","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073135","8.535","0.007","11.568","0.01","13.079","0.011","66.041","0.011","71.7","0.012","86.735","0.012","1116.7","1.6","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H35 Ag4 F12 N12 O0.5 P2 -","- C28 H34.5 Ag4 F12 N12 O0.5 P2 -","- C28 H34.5 Ag4 F12 N12 O0.5 P2 -","1","0.5","","Zhou, Yongbo; Chen, Wanzhi","Synthesis and Characterization of Square-Planar Tetranuclear Silver and Gold Clusters Supported by a Pyrazole-Linked Bis(N-heterocyclic carbene) Ligand","Organometallics","2007","26","10","2742","","10.1021/om070104j","","","0.71073","MoKα","","0.0607","0.0402","","","0.106","0.121","","","","","","1.071","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073136","8.526","0.0017","11.475","0.002","13.172","0.003","65.11","0.03","71.51","0.03","86.56","0.03","1104.6","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H30 Au4 F12 N12 P2 -","- C26 H30 Au4 F12 N12 P2 -","- C26 H30 Au4 F12 N12 P2 -","1","0.5","","Zhou, Yongbo; Chen, Wanzhi","Synthesis and Characterization of Square-Planar Tetranuclear Silver and Gold Clusters Supported by a Pyrazole-Linked Bis(N-heterocyclic carbene) Ligand","Organometallics","2007","26","10","2742","","10.1021/om070104j","","","0.71073","MoKα","","0.0896","0.0723","","","0.1834","0.1932","","","","","","1.045","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073137","11.6721","0.0017","7.1133","0.001","15.635","0.002","90","","107.503","0.008","90","","1238","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H9 B Cr O4 -","- C13 H9 B Cr O4 -","- C52 H36 B4 Cr4 O16 -","4","1","","Chen, Jinhui; Bajko, Zoltan; Kampf, Jeff W.; Ashe, Arthur J.","1,2-Dihydro-1,2-oxaborine: A Boron−Oxygen Heterocycle Isoelectronic with Benzene","Organometallics","2007","26","7","1563","","10.1021/om070113s","","","0.71073","MoKα","","0.1122","0.0606","","","0.1292","0.1408","","","","","","1.088","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073138","11.289","0.002","12.72","0.002","20.424","0.003","74.693","0.002","78.926","0.003","77.91","0.003","2736.8","0.8","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H23 Bi N2 O6 -","- C32 H23 Bi N2 O6 -","- C128 H92 Bi4 N8 O24 -","4","2","","Stavila, Vitalie; Fettinger, James C.; Whitmire, Kenton H.","Synthesis and Characterization of New Phenylbis(salicylato)bismuth(III) Complexes","Organometallics","2007","26","14","3321","","10.1021/om070115c","","","0.71073","MoKα","","0.1249","0.0446","","","0.0711","0.094","","","","","","0.731","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073139","11.736","0.002","12.08","0.002","14.215","0.003","95.21","0.03","111.15","0.03","113.63","0.03","1655.3","0.9","195","2","195","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H33 Bi N2 O7 -","- C37 H33 Bi N2 O7 -","- C74 H66 Bi2 N4 O14 -","2","1","","Stavila, Vitalie; Fettinger, James C.; Whitmire, Kenton H.","Synthesis and Characterization of New Phenylbis(salicylato)bismuth(III) Complexes","Organometallics","2007","26","14","3321","","10.1021/om070115c","","","0.71073","MoKα","","0.0991","0.0407","","","0.0637","0.0763","","","","","","0.865","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073140","11.221","0.002","11.789","0.002","14.441","0.003","66.93","0.03","89.68","0.03","69.93","0.03","1632.4","0.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H34 Bi N3 O7 -","- C35 H34 Bi N3 O7 -","- C70 H68 Bi2 N6 O14 -","2","1","","Stavila, Vitalie; Fettinger, James C.; Whitmire, Kenton H.","Synthesis and Characterization of New Phenylbis(salicylato)bismuth(III) Complexes","Organometallics","2007","26","14","3321","","10.1021/om070115c","","","0.71073","MoKα","","0.2033","0.0679","","","0.1238","0.1636","","","","","","0.869","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073141","12.037","0.002","14.119","0.003","23.159","0.005","90","","94.55","0.03","90","","3923.5","1.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H29 Bi N2 O9 -","- C34 H29 Bi N2 O9 -","- C136 H116 Bi4 N8 O36 -","4","1","","Stavila, Vitalie; Fettinger, James C.; Whitmire, Kenton H.","Synthesis and Characterization of New Phenylbis(salicylato)bismuth(III) Complexes","Organometallics","2007","26","14","3321","","10.1021/om070115c","","","0.71073","MoKα","","0.0893","0.0415","","","0.101","0.1163","","","","","","0.993","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073142","15.979","0.003","15.472","0.003","12.295","0.003","90","","108.13","0.03","90","","2888.7","1.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H27 Bi N2 O7 -","- C31 H27 Bi N2 O7 -","- C124 H108 Bi4 N8 O28 -","4","1","","Stavila, Vitalie; Fettinger, James C.; Whitmire, Kenton H.","Synthesis and Characterization of New Phenylbis(salicylato)bismuth(III) Complexes","Organometallics","2007","26","14","3321","","10.1021/om070115c","","","0.71073","MoKα","","0.0908","0.0334","","","0.0722","0.0996","","","","","","1.034","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073143","29.085","0.006","31.861","0.006","14.885","0.003","90","","90","","90","","13794","5","298","2","298","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C37 H33 Bi N2 O10 -","- C37 H33 Bi N2 O10 -","- C592 H528 Bi16 N32 O160 -","16","1","","Stavila, Vitalie; Fettinger, James C.; Whitmire, Kenton H.","Synthesis and Characterization of New Phenylbis(salicylato)bismuth(III) Complexes","Organometallics","2007","26","14","3321","","10.1021/om070115c","","","0.71073","MoKα","","0.0569","0.0311","","","0.061","0.071","","","","","","1.031","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073144","11.8148","0.0007","19.6938","0.0012","22.9896","0.0015","90","","98.299","0.001","90","","5293.2","0.6","190","2","190","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H21 Bi N2 O6 -","- C30 H21 Bi N2 O6 -","- C240 H168 Bi8 N16 O48 -","8","2","","Stavila, Vitalie; Fettinger, James C.; Whitmire, Kenton H.","Synthesis and Characterization of New Phenylbis(salicylato)bismuth(III) Complexes","Organometallics","2007","26","14","3321","","10.1021/om070115c","","","0.71073","MoKα","","0.0521","0.0363","","","0.0812","0.087","","","","","","1.098","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073145","12.631","0.0005","15.277","0.0006","13.377","0.0006","90","","102.196","0.002","90","","2523.02","0.18","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C19 H22 F6 N O8 S2 Ta -","- C19 H22 F6 N O8 S2 Ta -","- C76 H88 F24 N4 O32 S8 Ta4 -","4","0.5","","Conde, Ana; Fandos, Rosa; Otero, Antonio; Rodríguez, Ana","Water-Soluble Organometallic Complexes of Tantalum: Can Alkyl and Aqua Ligands Coexist in Its Coordination Sphere?","Organometallics","2007","26","7","1568","","10.1021/om0701165","","","0.71073","MoKα","","0.0493","0.0427","","","0.1131","0.1196","","","","","","1.033","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073146","18.113","0.0005","31.033","0.0009","8.745","0.0016","90","","90","","90","","4915.6","0.9","130","2","130","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C19 H27 F3 N O6 S Ta -","- C19 H27 F3 N O6 S Ta -","- C152 H216 F24 N8 O48 S8 Ta8 -","8","1","","Conde, Ana; Fandos, Rosa; Otero, Antonio; Rodríguez, Ana","Water-Soluble Organometallic Complexes of Tantalum: Can Alkyl and Aqua Ligands Coexist in Its Coordination Sphere?","Organometallics","2007","26","7","1568","","10.1021/om0701165","","","0.71073","MoKα","","0.0651","0.0407","","","0.0925","0.1012","","","","","","1.033","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073147","8.2396","0.0011","15.246","0.002","37.631","0.005","90","","90","","90","","4727.2","1.1","180","2","180","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C18 H27 F3 N O8 S Ta -","- C18 H27 F3 N O8 S Ta -","- C144 H216 F24 N8 O64 S8 Ta8 -","8","1","","Conde, Ana; Fandos, Rosa; Otero, Antonio; Rodríguez, Ana","Water-Soluble Organometallic Complexes of Tantalum: Can Alkyl and Aqua Ligands Coexist in Its Coordination Sphere?","Organometallics","2007","26","7","1568","","10.1021/om0701165","","","0.71073","MoKα","","0.1465","0.0787","","","0.1884","0.2092","","","","","","0.849","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073148","12.3221","0.0006","13.4653","0.0006","18.9223","0.0009","87.364","0.002","79.293","0.002","89.547","0.002","3081.7","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H64 B N2 O5 Ti2 -","- C58 H64 B N2 O5 Ti2 -","- C116 H128 B2 N4 O10 Ti4 -","2","1","","Fandos, Rosa; Gallego, Beatriz; Otero, Antonio; Rodríguez, Ana; Ruiz, María José; Terreros, Pilar; Pastor, Cesar","Cationic Titanium Complexes Containing Alkoxide and Carboxylate Pincer Ligands; Noninnocent Role of the Anionic Moieties in Their Reactivity","Organometallics","2007","26","11","2896","","10.1021/om070119h","","","1.54178","CuKα","","0.0813","0.0532","","","0.1253","0.1351","","","","","","0.886","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073149","9.3403","0.0009","13.8911","0.0013","19.3631","0.0019","90","","92.535","0.005","90","","2509.8","0.4","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C53 H47 B F15 N2 O5 Ti2 -","- C53 H47 B F15 N2 O5 Ti2 -","- C106 H94 B2 F30 N4 O10 Ti4 -","2","1","","Fandos, Rosa; Gallego, Beatriz; Otero, Antonio; Rodríguez, Ana; Ruiz, María José; Terreros, Pilar; Pastor, Cesar","Cationic Titanium Complexes Containing Alkoxide and Carboxylate Pincer Ligands; Noninnocent Role of the Anionic Moieties in Their Reactivity","Organometallics","2007","26","11","2896","","10.1021/om070119h","","","0.71073","MoKα","","0.0879","0.0546","","","0.1229","0.1493","","","","","","0.972","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073150","34.856","0.007","13.879","0.003","15.984","0.003","90","","107.438","0.003","90","","7377","3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H36 Cl2 N4 Ti -","- C40 H36 Cl2 N4 Ti -","- C320 H288 Cl16 N32 Ti8 -","8","1","","Ketterer, Nicole A.; Ziller, Joseph W.; Rheingold, Arnold L.; Heyduk, Alan F.","Imido and Organometallic-Amido Titanium(IV) Complexes of a Chelating Phenanthrenediamide Ligand","Organometallics","2007","26","22","5330","","10.1021/om0701219","","","0.71073","MoKα","","0.128","0.1202","","","0.2976","0.3018","","","","","","1.207","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073151","11.3545","0.0016","12.053","0.0018","16.572","0.002","84.444","0.003","72.678","0.003","69.857","0.002","2032.6","0.5","163","2","163","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H50 Cl N3 Si2 Ti -","- C42 H50 Cl N3 Si2 Ti -","- C84 H100 Cl2 N6 Si4 Ti2 -","2","1","","Ketterer, Nicole A.; Ziller, Joseph W.; Rheingold, Arnold L.; Heyduk, Alan F.","Imido and Organometallic-Amido Titanium(IV) Complexes of a Chelating Phenanthrenediamide Ligand","Organometallics","2007","26","22","5330","","10.1021/om0701219","","","0.71073","MoKα","","0.0551","0.0367","","","0.0887","0.099","","","","","","1.032","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073152","13.634","0.005","20.831","0.007","16.889","0.006","90","","110.676","0.005","90","","4488","3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H55 N5 O Ti -","- C48 H55 N5 O Ti -","- C192 H220 N20 O4 Ti4 -","4","1","","Ketterer, Nicole A.; Ziller, Joseph W.; Rheingold, Arnold L.; Heyduk, Alan F.","Imido and Organometallic-Amido Titanium(IV) Complexes of a Chelating Phenanthrenediamide Ligand","Organometallics","2007","26","22","5330","","10.1021/om0701219","","","0.71073","MoKα","","0.112","0.0667","","","0.151","0.1713","","","","","","1.037","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073153","8.2295","0.0007","9.2912","0.0008","11.3389","0.0012","90","","91.663","0.002","90","","866.63","0.14","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C16 H19 Br N2 O2 Pd -","- C16 H19 Br N2 O2 Pd -","- C32 H38 Br2 N4 O4 Pd2 -","2","1","","Vicente, José; Saura-Llamas, Isabel; García-López, José-Antonio; Calmuschi-Cula, Beatrice; Bautista, Delia","Ortho Palladation and Functionalization ofl-Phenylalanine Methyl Ester†","Organometallics","2007","26","10","2768","","10.1021/om070127y","","","0.71073","MoKα","","0.0381","0.0353","","","0.0786","0.0796","","","","","","1.024","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073154","9.5247","0.0004","10.0175","0.0004","9.8917","0.0004","90","","93.333","0.002","90","","942.21","0.07","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C16 H21 F3 N2 O5 S -","- C16 H21 F3 N2 O5 S -","- C32 H42 F6 N4 O10 S2 -","2","1","","Vicente, José; Saura-Llamas, Isabel; García-López, José-Antonio; Calmuschi-Cula, Beatrice; Bautista, Delia","Ortho Palladation and Functionalization ofl-Phenylalanine Methyl Ester†","Organometallics","2007","26","10","2768","","10.1021/om070127y","","","0.71073","MoKα","","0.0267","0.0265","","","0.0675","0.0677","","","","","","1.079","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073155","9.3942","0.0007","11.5392","0.0009","10.2024","0.0008","90","","99.789","0.002","90","","1089.85","0.15","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C20 H21 F3 N2 O5 S -","- C20 H21 F3 N2 O5 S -","- C40 H42 F6 N4 O10 S2 -","2","1","","Vicente, José; Saura-Llamas, Isabel; García-López, José-Antonio; Calmuschi-Cula, Beatrice; Bautista, Delia","Ortho Palladation and Functionalization ofl-Phenylalanine Methyl Ester†","Organometallics","2007","26","10","2768","","10.1021/om070127y","","","0.71073","MoKα","","0.0431","0.0399","","","0.0954","0.0972","","","","","","1.033","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073156","13.647","0.003","7.1668","0.0015","18.496","0.004","90","","110.722","0.004","90","","1692","0.6","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C8 H25 B9 N2 O Ti -","- C8 H25 B9 N2 O Ti -","- C32 H100 B36 N8 O4 Ti4 -","4","1","","Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei","Synthesis, Structure, and Reactivity of [σ:η1:η5-(OCH2)(Me2NCH2)C2B9H9]Ti(NR2) (R = Me, Et)","Organometallics","2007","26","10","2694","","10.1021/om070128q","","","0.71073","MoKα","","0.0523","0.0415","","","0.1057","0.1157","","","","","","0.934","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073157","14.926","0.003","8.031","0.0016","17.685","0.004","90","","105.44","0.03","90","","2043.4","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H33 B9 N2 O Ti -","- C12 H33 B9 N2 O Ti -","- C48 H132 B36 N8 O4 Ti4 -","4","1","","Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei","Synthesis, Structure, and Reactivity of [σ:η1:η5-(OCH2)(Me2NCH2)C2B9H9]Ti(NR2) (R = Me, Et)","Organometallics","2007","26","10","2694","","10.1021/om070128q","","","0.71073","MoKα","","0.0909","0.0525","","","0.1445","0.1635","","","","","","1.05","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073158","16.458","0.003","14.762","0.003","17.517","0.003","90","","111.771","0.004","90","","3952.3","1.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H55 B9 N4 O S6 Ti -","- C23 H55 B9 N4 O S6 Ti -","- C92 H220 B36 N16 O4 S24 Ti4 -","4","1","","Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei","Synthesis, Structure, and Reactivity of [σ:η1:η5-(OCH2)(Me2NCH2)C2B9H9]Ti(NR2) (R = Me, Et)","Organometallics","2007","26","10","2694","","10.1021/om070128q","","","0.71073","MoKα","","0.0792","0.0447","","","0.1126","0.138","","","","","","1.008","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073159","9.0617","0.0018","12.408","0.003","16.109","0.003","80.89","0.03","86.3","0.03","70.29","0.03","1683.5","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28.5 H46 B9 N5 O Ti -","- C28.5 H45.5 B9 N5 O Ti -","- C57 H91 B18 N10 O2 Ti2 -","2","1","","Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei","Synthesis, Structure, and Reactivity of [σ:η1:η5-(OCH2)(Me2NCH2)C2B9H9]Ti(NR2) (R = Me, Et)","Organometallics","2007","26","10","2694","","10.1021/om070128q","","","0.71073","MoKα","","0.129","0.0608","","","0.1603","0.1891","","","","","","1.017","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073160","9.799","0.002","11.521","0.002","14.453","0.003","100.07","0.03","105.59","0.03","104.93","0.03","1465.4","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H47 B9 N4 O Ti -","- C21 H47 B9 N4 O Ti -","- C42 H94 B18 N8 O2 Ti2 -","2","1","","Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei","Synthesis, Structure, and Reactivity of [σ:η1:η5-(OCH2)(Me2NCH2)C2B9H9]Ti(NR2) (R = Me, Et)","Organometallics","2007","26","10","2694","","10.1021/om070128q","","","0.71073","MoKα","","0.0489","0.0474","","","0.1442","0.1468","","","","","","1.067","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073161","10.108","0.002","16.169","0.003","17.22","0.003","99.89","0.03","95.6","0.03","92.94","0.03","2752.7","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H42 B9 N3 O S Ti -","- C17 H42 B9 N3 O S Ti -","- C68 H168 B36 N12 O4 S4 Ti4 -","4","2","","Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei","Synthesis, Structure, and Reactivity of [σ:η1:η5-(OCH2)(Me2NCH2)C2B9H9]Ti(NR2) (R = Me, Et)","Organometallics","2007","26","10","2694","","10.1021/om070128q","","","0.71073","MoKα","","0.0658","0.0602","","","0.1643","0.1693","","","","","","1.178","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073162","13.9864","0.0014","12.4465","0.0013","16.0656","0.0016","90","","110.291","0.002","90","","2623.2","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H35 B9 N2 O2 Ti -","- C22 H35 B9 N2 O2 Ti -","- C88 H140 B36 N8 O8 Ti4 -","4","1","","Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei","Synthesis, Structure, and Reactivity of [σ:η1:η5-(OCH2)(Me2NCH2)C2B9H9]Ti(NR2) (R = Me, Et)","Organometallics","2007","26","10","2694","","10.1021/om070128q","","","0.71073","MoKα","","0.0931","0.0496","","","0.1119","0.1367","","","","","","1.012","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073163","11.325","0.002","11.754","0.002","18.389","0.004","90","","104.76","0.03","90","","2367.1","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H30 B9 N3 O2 Ti -","- C15 H30 B9 N3 O2 Ti -","- C60 H120 B36 N12 O8 Ti4 -","4","1","","Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei","Synthesis, Structure, and Reactivity of [σ:η1:η5-(OCH2)(Me2NCH2)C2B9H9]Ti(NR2) (R = Me, Et)","Organometallics","2007","26","10","2694","","10.1021/om070128q","","","0.71073","MoKα","","0.0626","0.053","","","0.1531","0.161","","","","","","1.117","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073164","11.9198","0.0013","15.0114","0.0017","15.7476","0.0017","90","","100.65","0.002","90","","2769.2","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H36 B9 N3 O3 Ti -","- C22 H36 B9 N3 O3 Ti -","- C88 H144 B36 N12 O12 Ti4 -","4","1","","Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei","Synthesis, Structure, and Reactivity of [σ:η1:η5-(OCH2)(Me2NCH2)C2B9H9]Ti(NR2) (R = Me, Et)","Organometallics","2007","26","10","2694","","10.1021/om070128q","","","0.71073","MoKα","","0.1205","0.0569","","","0.1412","0.1766","","","","","","0.991","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073165","10.4312","0.001","15.7301","0.0016","12.8253","0.0013","90","","105.789","0.002","90","","2025","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H60 B18 N2 O4 Ti2 -","- C25 H52 B18 N2 O4 Ti2 -","- C50 H104 B36 N4 O8 Ti4 -","2","0.5","","Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei","Synthesis, Structure, and Reactivity of [σ:η1:η5-(OCH2)(Me2NCH2)C2B9H9]Ti(NR2) (R = Me, Et)","Organometallics","2007","26","10","2694","","10.1021/om070128q","","","0.71073","MoKα","","0.0712","0.0443","","","0.1184","0.1392","","","","","","1.059","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073166","15.39","0.003","16.69","0.005","21.375","0.007","90","","90","","90","","5490","3","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C58 H66 Cl2 N2 P2 Ru -","- C46 H50 Cl2 N2 P2 Ru -","- C184 H200 Cl8 N8 P8 Ru4 -","4","1","","Doherty, Simon; Knight, Julian G.; Bell, Adam L.; Harrington, Ross W.; Clegg, William","Asymmetric Hydrogenation of Ketones with Ruthenium Complexes ofrac- and Enantiopure (S,S)-1,2-Bis((diphenylphosphino)methyl)cyclohexane: A Comparative Study withrac- and (R)-BINAP","Organometallics","2007","26","9","2465","","10.1021/om070129i","","","0.71073","MoKα","","0.0511","0.0413","","","0.1092","0.1132","","","","","","1.107","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073167","17.395","0.003","20.404","0.004","20.415","0.004","90","","109.659","0.003","90","","6823","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C75 H58 Cl6 N6 P2 Pt -","- C75 H58 Cl6 N6 P2 Pt -","- C300 H232 Cl24 N24 P8 Pt4 -","4","0.5","","Li, Xiu-Ling; Dai, Feng-Rong; Zhang, Li-Yi; Zhu, Yue-Mei; Peng, Qi; Chen, Zhong-Ning","Sensitization of Lanthanide Luminescence in Heterotrinuclear PtLn2(Ln = Eu, Nd, Yb) Complexes with Terpyridyl-Functionalized Alkynyl by Energy Transfer from a Platinum(II) Alkynyl Chromophore","Organometallics","2007","26","18","4483","","10.1021/om070130h","","","0.71073","MoKα","","0.039","0.0363","","","0.0958","0.0983","","","","","","1.058","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073168","12.6","0.003","22.07","0.005","24.81","0.006","78.22","0.008","77.68","0.006","85.22","0.008","6593","3","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C103.5 H66 Cl Eu2 F36 N6 O14.5 P2 Pt -","- C103.5 H61 Cl Eu2 F36 N6 O14.5 P2 Pt -","- C207 H122 Cl2 Eu4 F72 N12 O29 P4 Pt2 -","2","1","","Li, Xiu-Ling; Dai, Feng-Rong; Zhang, Li-Yi; Zhu, Yue-Mei; Peng, Qi; Chen, Zhong-Ning","Sensitization of Lanthanide Luminescence in Heterotrinuclear PtLn2(Ln = Eu, Nd, Yb) Complexes with Terpyridyl-Functionalized Alkynyl by Energy Transfer from a Platinum(II) Alkynyl Chromophore","Organometallics","2007","26","18","4483","","10.1021/om070130h","","","0.71073","MoKα","","0.0967","0.0711","","","0.1847","0.2189","","","","","","1.1","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073169","12.714","0.007","22.082","0.012","25.136","0.012","78.376","0.016","78.315","0.018","84.879","0.016","6760","6","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C103.5 H62 Cl F36 N6 O12.5 P2 Pt Yb2 -","- C103.5 H61 Cl F36 N6 O12.5 P2 Pt Yb2 -","- C207 H122 Cl2 F72 N12 O25 P4 Pt2 Yb4 -","2","1","","Li, Xiu-Ling; Dai, Feng-Rong; Zhang, Li-Yi; Zhu, Yue-Mei; Peng, Qi; Chen, Zhong-Ning","Sensitization of Lanthanide Luminescence in Heterotrinuclear PtLn2(Ln = Eu, Nd, Yb) Complexes with Terpyridyl-Functionalized Alkynyl by Energy Transfer from a Platinum(II) Alkynyl Chromophore","Organometallics","2007","26","18","4483","","10.1021/om070130h","","","0.71073","MoKα","","0.1265","0.0999","","","0.2637","0.2933","","","","","","1.038","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073170","12.867","0.002","14.027","0.002","17.8","0.003","100.472","0.003","106.307","0.003","90.936","0.004","3024.3","0.8","223","2","223","2","","","","","","","","8","P -1","-P 1","2","","","","- C65 H54 Cl3 F10 Fe2 N2 Ni2 P2 -","- C65 H54 Cl3 F10 Fe2 N2 Ni2 P2 -","- C130 H108 Cl6 F20 Fe4 N4 Ni4 P4 -","2","1","","Weng, Zhiqiang; Teo, Shihui; Liu, Zhi-Pan; Hor, T. S. Andy","A Strange Nickel(I)−Nickel(0) Binuclear Complex and Its Unexpected Ethylene Oligomerization","Organometallics","2007","26","12","2950","","10.1021/om0701322","","","0.71073","MoKα","","0.133","0.0695","","","0.1598","0.1711","","","","","","0.811","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073171","25.027","0.01","9.658","0.004","14.988","0.007","90","","92.606","0.008","90","","3619","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H8 Fe2 N2 O7 S2 -","- C14 H8 Fe2 N2 O7 S2 -","- C112 H64 Fe16 N16 O56 S16 -","8","1","","Song, Li-Cheng; Tang, Ming-Yi; Mei, Shu-Zhen; Huang, Jin-Hua; Hu, Qing-Mei","The Active Site Model for Iron-Only Hydrogenases Coordinatively Bonded to a Metalloporphyrin Photosensitizer","Organometallics","2007","26","7","1575","","10.1021/om070133u","","","0.71073","MoKα","","0.0845","0.0548","","","0.123","0.132","","","","","","1.123","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073172","11.076","0.003","11.521","0.003","27.595","0.007","94.493","0.004","98.338","0.004","107.8","0.004","3289.1","1.5","294","2","294","2","","","","","","","","8","P -1","-P 1","2","","","","- C70 H44 Cl4 Fe2 N6 O7 S2 Zn -","- C70 H44 Cl4 Fe2 N6 O7 S2 Zn -","- C140 H88 Cl8 Fe4 N12 O14 S4 Zn2 -","2","1","","Song, Li-Cheng; Tang, Ming-Yi; Mei, Shu-Zhen; Huang, Jin-Hua; Hu, Qing-Mei","The Active Site Model for Iron-Only Hydrogenases Coordinatively Bonded to a Metalloporphyrin Photosensitizer","Organometallics","2007","26","7","1575","","10.1021/om070133u","","","0.7107","MoKα","","0.1225","0.0657","","","0.1586","0.1955","","","","","","1.009","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073173","8.232","0.003","10.999","0.004","13.091","0.005","109.24","0.005","100.532","0.006","94.429","0.006","1088.1","0.7","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H13 Fe2 N O8 S2 -","- C16 H13 Fe2 N O8 S2 -","- C32 H26 Fe4 N2 O16 S4 -","2","1","","Song, Li-Cheng; Tang, Ming-Yi; Mei, Shu-Zhen; Huang, Jin-Hua; Hu, Qing-Mei","The Active Site Model for Iron-Only Hydrogenases Coordinatively Bonded to a Metalloporphyrin Photosensitizer","Organometallics","2007","26","7","1575","","10.1021/om070133u","","","0.71073","MoKα","","0.0653","0.0392","","","0.091","0.1056","","","","","","0.998","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073174","12.59","0.005","8.383","0.003","20.993","0.006","90","","123.243","0.016","90","","1853.1","1.2","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C31 H32 B2 F8 N4 O7 Ru2 -","- C31 H32 B2 F8 N4 O7 Ru2 -","- C62 H64 B4 F16 N8 O14 Ru4 -","2","0.5","","Patra, Sanjib K.; Bera, Jitendra K.","C−C Bond Forming Reaction through Aldol-Type Addition Mediated by a [Ru2(CO)4]2+Core","Organometallics","2007","26","10","2598","","10.1021/om070139j","","","0.71073","MoKα","","0.1183","0.0833","","","0.1955","0.2143","","","","","","0.982","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073175","23.639","0.003","12.328","0.0014","17.635","0.002","90","","127.424","0.002","90","","4081.4","0.8","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C33 H32 F6 N4 O13 Ru2 S2 -","- C33 H32 F6 N4 O13 Ru2 S2 -","- C132 H128 F24 N16 O52 Ru8 S8 -","4","0.5","","Patra, Sanjib K.; Bera, Jitendra K.","C−C Bond Forming Reaction through Aldol-Type Addition Mediated by a [Ru2(CO)4]2+Core","Organometallics","2007","26","10","2598","","10.1021/om070139j","","","0.71073","MoKα","","0.0603","0.0498","","","0.123","0.129","","","","","","1.046","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073176","9.4518","0.001","15.8721","0.0017","11.5989","0.0012","90","","94.025","0.002","90","","1735.8","0.3","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C30 H30 B2 F8 N4 O6 Ru2 -","- C30 H30 B2 F8 N4 O6 Ru2 -","- C60 H60 B4 F16 N8 O12 Ru4 -","2","1","","Patra, Sanjib K.; Bera, Jitendra K.","C−C Bond Forming Reaction through Aldol-Type Addition Mediated by a [Ru2(CO)4]2+Core","Organometallics","2007","26","10","2598","","10.1021/om070139j","","","0.71073","MoKα","","0.0732","0.057","","","0.0987","0.1053","","","","","","0.99","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073177","25.612","0.005","8.737","0.005","18.469","0.005","90","0.005","121.375","0.005","90","0.005","3529","2","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H14 B2 F8 N4 O6 Ru2 -","- C30 H14 B2 F8 N4 O6 Ru2 -","- C120 H56 B8 F32 N16 O24 Ru8 -","4","0.5","","Patra, Sanjib K.; Bera, Jitendra K.","C−C Bond Forming Reaction through Aldol-Type Addition Mediated by a [Ru2(CO)4]2+Core","Organometallics","2007","26","10","2598","","10.1021/om070139j","","","0.71069","MoKα","","0.0815","0.0575","","","0.1416","0.1552","","","","","","1.041","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073178","13.644","0.004","15.007","0.004","18.454","0.005","90","","100.88","0.005","90","","3710.6","1.8","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H49 Cl2 Cr N3 O0.75 -","- C33 H43 Cl2 Cr N3 -","- C132 H172 Cl8 Cr4 N12 -","4","1","","Vidyaratne, Indu; Scott, Jennifer; Gambarotta, Sandro; Duchateau, Robbert","Reactivity of Chromium Complexes of a Bis(imino)pyridine Ligand: Highly Active Ethylene Polymerization Catalysts Carrying the Metal in a Formally Low Oxidation State","Organometallics","2007","26","13","3201","","10.1021/om0701423","","","0.71073","MoKα","","0.1701","0.08","","","0.1237","0.1498","","","","","","1.009","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073179","28.334","0.012","12.367","0.005","13.407","0.006","90","","90","","90","","4698","3","208","2","208","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C47 H73 Cr Li N3 O3 -","- C47 H73 Cr Li N3 O3 -","- C188 H292 Cr4 Li4 N12 O12 -","4","1","","Vidyaratne, Indu; Scott, Jennifer; Gambarotta, Sandro; Duchateau, Robbert","Reactivity of Chromium Complexes of a Bis(imino)pyridine Ligand: Highly Active Ethylene Polymerization Catalysts Carrying the Metal in a Formally Low Oxidation State","Organometallics","2007","26","13","3201","","10.1021/om0701423","","","0.71073","MoKα","","0.1481","0.0762","","","0.113","0.1334","","","","","","1.012","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073180","8.528","0.019","8.731","0.019","23.05","0.05","95.08","0.04","95.4","0.04","109.66","0.03","1596","6","210","2","210","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H43 Cl Cr N3 -","- C33 H43 Cl Cr N3 -","- C66 H86 Cl2 Cr2 N6 -","2","1","","Vidyaratne, Indu; Scott, Jennifer; Gambarotta, Sandro; Duchateau, Robbert","Reactivity of Chromium Complexes of a Bis(imino)pyridine Ligand: Highly Active Ethylene Polymerization Catalysts Carrying the Metal in a Formally Low Oxidation State","Organometallics","2007","26","13","3201","","10.1021/om0701423","","","0.71073","MoKα","","0.0697","0.0606","","","0.1557","0.1617","","","","","","1.031","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073181","13.217","0.014","17.7","0.02","22.278","0.012","90","","95.46","0.08","90","","5188","9","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50.62 H74.28 Cr Li N3 O3 -","- C46 H69 Cr Li N3 O3 -","- C184 H276 Cr4 Li4 N12 O12 -","4","1","","Vidyaratne, Indu; Scott, Jennifer; Gambarotta, Sandro; Duchateau, Robbert","Reactivity of Chromium Complexes of a Bis(imino)pyridine Ligand: Highly Active Ethylene Polymerization Catalysts Carrying the Metal in a Formally Low Oxidation State","Organometallics","2007","26","13","3201","","10.1021/om0701423","","","0.71073","MoKα","","0.0922","0.0588","","","0.1426","0.158","","","","","","1.005","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073182","14.337","0.017","14.879","0.017","17.38","0.02","90","","98.86","0.02","90","","3663","7","207","2","207","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C35 H49 Al Cl2 Cr N3 -","- C35 H49 Al Cl2 Cr N3 -","- C140 H196 Al4 Cl8 Cr4 N12 -","4","2","","Vidyaratne, Indu; Scott, Jennifer; Gambarotta, Sandro; Duchateau, Robbert","Reactivity of Chromium Complexes of a Bis(imino)pyridine Ligand: Highly Active Ethylene Polymerization Catalysts Carrying the Metal in a Formally Low Oxidation State","Organometallics","2007","26","13","3201","","10.1021/om0701423","","","0.71073","MoKα","","0.1244","0.0736","","","0.1469","0.1696","","","","","","1.031","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073183","27.8","0.3","14.95","0.14","21.6","0.2","90","","126.86","0.15","90","","7183","12","208","2","208","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H48.5 Cr N3 O0.25 -","- C35 H48.5 Cr N3 O0.25 -","- C280 H388 Cr8 N24 O2 -","8","1","","Vidyaratne, Indu; Scott, Jennifer; Gambarotta, Sandro; Duchateau, Robbert","Reactivity of Chromium Complexes of a Bis(imino)pyridine Ligand: Highly Active Ethylene Polymerization Catalysts Carrying the Metal in a Formally Low Oxidation State","Organometallics","2007","26","13","3201","","10.1021/om0701423","","","0.71073","MoKα","","0.1004","0.065","","","0.1507","0.1673","","","","","","1.038","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073184","10.895","0.006","19.206","0.011","23.981","0.014","90","","101.029","0.011","90","","4925","5","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H78 Al2 Cl Cr N3 -","- C52 H78 Al2 Cl Cr N3 -","- C208 H312 Al8 Cl4 Cr4 N12 -","4","1","","Vidyaratne, Indu; Scott, Jennifer; Gambarotta, Sandro; Duchateau, Robbert","Reactivity of Chromium Complexes of a Bis(imino)pyridine Ligand: Highly Active Ethylene Polymerization Catalysts Carrying the Metal in a Formally Low Oxidation State","Organometallics","2007","26","13","3201","","10.1021/om0701423","","","0.71073","MoKα","","0.1065","0.0741","","","0.1626","0.182","","","","","","1.05","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073185","8.307","0.006","13.991","0.009","20.044","0.013","110.425","0.007","95.667","0.009","90","0.009","2171","3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H20 F2 N2 -","- C26 H20 F2 N2 -","- C104 H80 F8 N8 -","4","2","","Zhu, Zhenyu; Wang, Jialiang; Zhang, Zhengxing; Xiang, Xu; Zhou, Xigeng","Metallic Dysprosium Induced Silyl Radical Reactions: Intermolecular Cyclization and Reduction of Alkynes and Imines","Organometallics","2007","26","10","2499","","10.1021/om070148s","","","0.71073","MoKα","","0.2401","0.134","","","0.3184","0.3932","","","","","","1.134","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073186","12.534","0.002","14.6996","0.0012","13.079","0.003","90","","102.279","0.008","90","","2354.6","0.7","150","2","150","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C7 H19 B Na O P -","- C7 H19 B Na O P -","- C56 H152 B8 Na8 O8 P8 -","8","1","","Izod, Keith; Wills, Corinne; Clegg, William; Harrington, Ross W.","Metalation of Trimethylphosphine−Borane. Unexpected Reactivity of a Simple Phosphine−Borane-Stabilized Carbanion toward Siloxanes","Organometallics","2007","26","11","2861","","10.1021/om070150j","","","0.71073","MoKα","","0.0588","0.0388","","","0.1018","0.1147","","","","","","1.119","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073187","19.7951","0.0006","19.7951","0.0006","31.9497","0.0018","90","","90","","90","","12519.4","0.9","120","2","120","2","","","","","","","","7","P 42 b c","P 4c -2ab","106","","","","- C72 H203 B8 Li16 O16 P8 Si8 -","- C72 H203 B8 Li16 O16 P8 Si8 -","- C288 H812 B32 Li64 O64 P32 Si32 -","4","0.5","","Izod, Keith; Wills, Corinne; Clegg, William; Harrington, Ross W.","Metalation of Trimethylphosphine−Borane. Unexpected Reactivity of a Simple Phosphine−Borane-Stabilized Carbanion toward Siloxanes","Organometallics","2007","26","11","2861","","10.1021/om070150j","","","0.6712","synchrotron","","0.0449","0.0393","","","0.1058","0.1105","","","","","","1.028","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073188","20.769","0.004","32.173","0.006","22.143","0.004","90","","110.07","0.03","90","","13897","5","123","2","123","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C115 H126 F27 N12 O35 P12 Pd0 Pt6 S9 -","- C115 H126 F27 N12 O35 P12 Pt6 S9 -","- C230 H252 F54 N24 O70 P24 Pt12 S18 -","2","0.5","","Ghosh, Sushobhan; Batten, Stuart R.; Turner, David R.; Mukherjee, Partha Sarathi","Self-Assembly of a Nanoscopic Platinum(II) Double Square Cage","Organometallics","2007","26","13","3252","","10.1021/om0701571","","","0.71073","MoKα","","0.1935","0.1158","","","0.2912","0.3299","","","","","","0.906","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073189","33.508","0.0002","12.132","0.0002","12.375","0.0006","90","","90","","90","","5030.7","0.3","150","2","150","2","","","","","","","synthesized by the authors","4","P b c n","-P 2n 2ab","60","","","","- C24 H40 Si2 Ti -","- C24 H40 Si2 Ti -","- C192 H320 Si16 Ti8 -","8","1","","Pinkas, Jiří; Lukešová, Lenka; Gyepes, Róbert; Císařová, Ivana; Lönnecke, Peter; Kubišta, Jiří; Horáček, Michal; Mach, Karel","Effect of the Trimethylsilyl Substituent on the Reactivity of Permethyltitanocene","Organometallics","2007","26","13","3100","","10.1021/om070159l","","","0.71073","MoKα","","0.0497","0.0388","","","0.0912","0.096","","","","","","1.08","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073190","8.5124","0.001","9.0457","0.0015","19.055","0.003","95.941","0.014","91.303","0.012","114.724","0.013","1322","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H45 Si2 Ti -","- C25 H45 Si2 Ti -","- C50 H90 Si4 Ti2 -","2","1","","Pinkas, Jiří; Lukešová, Lenka; Gyepes, Róbert; Císařová, Ivana; Lönnecke, Peter; Kubišta, Jiří; Horáček, Michal; Mach, Karel","Effect of the Trimethylsilyl Substituent on the Reactivity of Permethyltitanocene","Organometallics","2007","26","13","3100","","10.1021/om070159l","","","0.71073","MoKα","","0.0542","0.0436","","","0.101","0.107","","","","","","1.193","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073191","9.08","0.006","9.583","0.007","14.339","0.01","80.987","0.012","82.538","0.012","89.766","0.013","1221.7","1.5","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H40 Si2 Ti -","- C24 H40 Si2 Ti -","- C48 H80 Si4 Ti2 -","2","1","","Pinkas, Jiří; Lukešová, Lenka; Gyepes, Róbert; Císařová, Ivana; Lönnecke, Peter; Kubišta, Jiří; Horáček, Michal; Mach, Karel","Effect of the Trimethylsilyl Substituent on the Reactivity of Permethyltitanocene","Organometallics","2007","26","13","3100","","10.1021/om070159l","","","0.71073","MoKα","","0.1799","0.1386","","","0.3803","0.3998","","","","","","1.141","","","","has coordinates","178620","2020-10-21","18:00:00",""
"4073192","9.688","0.002","9.907","0.003","6.989","0.002","90","","106.35","0.02","90","","643.7","0.3","293","","293","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C15 H9 Fe N3 -","- C15 H9 Fe N3 -","- C30 H18 Fe2 N6 -","2","0.5","","Nemykin, Victor N.; Maximov, Alexander Y.; Koposov, Alexey Y.","Mercury-Free Preparation, Characterization, and Molecular Structure of Tricyanovinylferrocene Using an Unusual Reaction between Ferrocene and Tetracyanoethylene","Organometallics","2007","26","13","3138","","10.1021/om070160k","","","0.71073","MoKα","","0.0363","0.0324","","0.0666","0.0597","0.0597","","","","","","1.169","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073193","7.632","0.0015","10.454","0.002","11.228","0.002","90","","90","","90","","895.8","0.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H9 Fe N -","- C11 H9 Fe N -","- C44 H36 Fe4 N4 -","4","1","","Nemykin, Victor N.; Maximov, Alexander Y.; Koposov, Alexey Y.","Mercury-Free Preparation, Characterization, and Molecular Structure of Tricyanovinylferrocene Using an Unusual Reaction between Ferrocene and Tetracyanoethylene","Organometallics","2007","26","13","3138","","10.1021/om070160k","","","0.71073","MoKα","","0.0287","0.0254","","0.0622","0.0607","0.0607","","","","","","0.9419","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073194","6.946","0.0014","9.8","0.002","9.6527","0.0019","90","","106.26","0.03","90","","630.8","0.2","173","","173","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C15 H9 Fe N3 -","- C15 H9 Fe N3 -","- C30 H18 Fe2 N6 -","2","0.5","","Nemykin, Victor N.; Maximov, Alexander Y.; Koposov, Alexey Y.","Mercury-Free Preparation, Characterization, and Molecular Structure of Tricyanovinylferrocene Using an Unusual Reaction between Ferrocene and Tetracyanoethylene","Organometallics","2007","26","13","3138","","10.1021/om070160k","","","0.71073","MoKα","","0.0637","0.0332","","0.0742","0.0625","0.0625","","","","","","0.9384","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073195","9.157","0.0001","23.897","0.0004","20.562","0.0003","90","","92.436","0.001","90","","4495.41","0.11","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H55 F N2 O P2 Ru -","- C52 H55 F N2 O P2 Ru -","- C208 H220 F4 N8 O4 P8 Ru4 -","4","1","","Reade, Steven P.; Nama, Devendrababu; Mahon, Mary F.; Pregosin, Paul S.; Whittlesey, Michael K.","Synthesis and Reactivity of Ru(PPh3)3(CO)HF and the N-Heterocyclic Carbene Derivatives Ru(NHC)(PPh3)2(CO)HF","Organometallics","2007","26","14","3484","","10.1021/om070164p","","","0.71073","MoKα","","0.06","0.0404","","","0.0792","0.0869","","","","","","1.022","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073196","23.592","0.0005","9.965","0.0002","18.088","0.0005","90","","112.962","0.001","90","","3915.44","0.16","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C46 H47 F N2 O P2 Ru -","- C46 H47 F N2 O P2 Ru -","- C184 H188 F4 N8 O4 P8 Ru4 -","4","0.5","","Reade, Steven P.; Nama, Devendrababu; Mahon, Mary F.; Pregosin, Paul S.; Whittlesey, Michael K.","Synthesis and Reactivity of Ru(PPh3)3(CO)HF and the N-Heterocyclic Carbene Derivatives Ru(NHC)(PPh3)2(CO)HF","Organometallics","2007","26","14","3484","","10.1021/om070164p","","","0.71073","MoKα","","0.0544","0.0428","","","0.0917","0.0949","","","","","","1.253","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073197","11.11","0.0016","11.5756","0.0017","15.568","0.002","99.996","0.003","100.958","0.003","109.545","0.002","1790.5","0.4","223","2","223","2","","","","","","","","8","P -1","-P 1","2","Pt-complex","di-Pt-complex tetra-fluoroborate methanolate","","- C27.625 H39.5 B F4 N4 O11.625 Pt2 S2 -","- C27.63 H33 B F4 N4 O11.63 Pt2 S2 -","- C55.26 H66 B2 F8 N8 O23.26 Pt4 S4 -","2","1","","Khusnutdinova, Julia R.; Zavalij, Peter Y.; Vedernikov, Andrei N.","C−O Coupling of LPtIVMe(OH)X Complexes in Water (X =18OH, OH, OMe; L = di(2-pyridyl)methane sulfonate)","Organometallics","2007","26","14","3466","","10.1021/om070165h","","","0.71073","MoKα","","0.0545","0.0321","","","0.0657","0.0712","","","","","","1","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073198","8.457","0.003","24.941","0.009","8.718","0.003","90","","107.501","0.006","90","","1753.7","1.1","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Pt-complex","Pt-complex methanolate","","- C14 H20 N2 O6 Pt S -","- C14 H20 N2 O6 Pt S -","- C56 H80 N8 O24 Pt4 S4 -","4","1","","Khusnutdinova, Julia R.; Zavalij, Peter Y.; Vedernikov, Andrei N.","C−O Coupling of LPtIVMe(OH)X Complexes in Water (X =18OH, OH, OMe; L = di(2-pyridyl)methane sulfonate)","Organometallics","2007","26","14","3466","","10.1021/om070165h","","","0.71073","MoKα","","0.0514","0.0359","","","0.075","0.0787","","","","","","1","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073199","11.3558","0.001","11.5175","0.001","15.3258","0.0014","111.306","0.001","106.321","0.002","96.637","0.002","1738.3","0.3","220","2","220","2","","","","","","","","8","P -1","-P 1","2","Pt(II)-Pt(IV)-BF4-complex","Pt(II)-Pt(IV)-BF4-complex","","- C23 H35 B F4 N4 O14 Pt2 S2 -","- C23 H23 B F4 N4 O14 Pt2 S2 -","- C46 H46 B2 F8 N8 O28 Pt4 S4 -","2","1","","Khusnutdinova, Julia R.; Zavalij, Peter Y.; Vedernikov, Andrei N.","C−O Coupling of LPtIVMe(OH)X Complexes in Water (X =18OH, OH, OMe; L = di(2-pyridyl)methane sulfonate)","Organometallics","2007","26","14","3466","","10.1021/om070165h","","","0.71073","MoKα","","0.065","0.0514","","","0.1199","0.1282","","","","","","1","","","","has coordinates,has disorder","178620","2020-10-21","18:00:00",""
"4073200","12.834","0.001","14.251","0.001","15.433","0.001","73.61","0.001","77.837","0.001","85.641","0.001","2646.8","0.3","150","0.1","150","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C28.5 H29 Cl Cr N O3 Rh -","- C28.5 H29 Cl Cr N O3 Rh -","- C114 H116 Cl4 Cr4 N4 O12 Rh4 -","4","2","","Scheeren, Carla; Maasarani, Fida; Hijazi, Akram; Djukic, Jean-Pierre; Pfeffer, Michel; Zarić, Snežana D.; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective “Electrophilic” Cyclometalation of Planar-Prochiral (η6-Arene)tricarbonylchromium Complexes with Asymmetric Metal Centers: pseudo-T-4 [Cp*RhCl2]2and [Cp*IrCl2]2","Organometallics","2007","26","14","3336","","10.1021/om070170l","","","0.71069","MoKα","","0.0503","0.0381","","","0.104","0.1105","","","","","","1.075","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073201","35.086","0.005","11.191","0.005","15.171","0.005","90","","105.962","0.005","90","","5727","3","150","0.1","150","0.1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C26.5 H28 Cl4 Cr Ir N O3 -","- C26.5 H28 Cl4 Cr Ir N O3 -","- C212 H224 Cl32 Cr8 Ir8 N8 O24 -","8","1","","Scheeren, Carla; Maasarani, Fida; Hijazi, Akram; Djukic, Jean-Pierre; Pfeffer, Michel; Zarić, Snežana D.; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective “Electrophilic” Cyclometalation of Planar-Prochiral (η6-Arene)tricarbonylchromium Complexes with Asymmetric Metal Centers: pseudo-T-4 [Cp*RhCl2]2and [Cp*IrCl2]2","Organometallics","2007","26","14","3336","","10.1021/om070170l","","","0.71069","MoKα","","0.0356","0.0285","","","0.0715","0.0745","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073202","18.278","0.01","9.313","0.005","19.002","0.01","90","","103.093","0.01","90","","3150","3","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Sc{C5Me4SiMe(C4H3O-2)}(CH2SiMe3)2(THF)]","[Sc{C5Me4SiMe(C4H3O-2)}(CH2SiMe3)2(THF)]","","- C27 H47 O2 Sc Si3 -","- C27 H47 O2 Sc Si3 -","- C108 H188 O8 Sc4 Si12 -","4","1","","Hitzbleck, Julia; Okuda, Jun","Ring-Opening of a Furyl Group Appended to the Cyclopentadienyl Ligand in Rare-Earth Metal Half-Sandwich Complexes","Organometallics","2007","26","13","3227","","10.1021/om0701726","","","0.71073","MoKα","","0.0775","0.0532","","","0.1412","0.1573","","","","","","1.036","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073203","10.7107","0.0011","15.9708","0.0016","20.006","0.002","90","","104.203","0.002","90","","3317.6","0.6","143","2","143","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Sc{C5Me4SiMe2(C4H2MeO-2)}(CH2SiMe3)2(THF)]","[Sc{C5Me4SiMe2(C4H2MeO-2)}(CH2SiMe3)2(THF)]","","- C28 H53 O2 Sc Si3 -","- C28 H53 O2 Sc Si3 -","- C112 H212 O8 Sc4 Si12 -","4","1","","Hitzbleck, Julia; Okuda, Jun","Ring-Opening of a Furyl Group Appended to the Cyclopentadienyl Ligand in Rare-Earth Metal Half-Sandwich Complexes","Organometallics","2007","26","13","3227","","10.1021/om0701726","","","0.71073","MoKα","","0.0358","0.0318","","","0.0875","0.0918","","","","","","1.045","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073204","16.875","0.004","10.176","0.002","17.594","0.004","90","","99.049","0.006","90","","2983.6","1.1","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Y{C5Me4SiMe2(C?CCH=CHO)}(CH2SiMe3)(THF)2]","[Y(C5Me4{SiMe2(C4H2O)})(CH2SiMe3)(THF)3]","","- C27 H45 O3 Si2 Y -","- C27 H45 O3 Si2 Y -","- C108 H180 O12 Si8 Y4 -","4","1","","Hitzbleck, Julia; Okuda, Jun","Ring-Opening of a Furyl Group Appended to the Cyclopentadienyl Ligand in Rare-Earth Metal Half-Sandwich Complexes","Organometallics","2007","26","13","3227","","10.1021/om0701726","","","0.71073","MoKα","","0.0686","0.0408","","","0.0934","0.106","","","","","","1.016","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073205","13.5735","0.0009","17.4864","0.0011","15.5798","0.001","90","","111.054","0.001","90","","3451","0.4","190","2","190","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 Br2 Cr N -","- C18 H18 Br2 Cr N -","- C144 H144 Br16 Cr8 N8 -","8","2","","Fernández, Pablo; Pritzkow, Hans; Carbó, Jorge J.; Hofmann, Peter; Enders, Markus","1H NMR Investigation of Paramagnetic Chromium(III) Olefin Polymerization Catalysts: Experimental Results, Shift Assignment and Prediction by Quantum Chemical Calculations†","Organometallics","2007","26","18","4402","","10.1021/om070173y","","","0.71073","MoKα","","0.0546","0.034","","","0.079","0.0883","","","","","","1.023","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073206","11.8","0.0005","8.9527","0.0004","14.6019","0.0006","90","","93.79","0.001","90","","1539.2","0.11","190","2","190","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 Cl2 Cr N -","- C17 H16 Cl2 Cr N -","- C68 H64 Cl8 Cr4 N4 -","4","1","","Fernández, Pablo; Pritzkow, Hans; Carbó, Jorge J.; Hofmann, Peter; Enders, Markus","1H NMR Investigation of Paramagnetic Chromium(III) Olefin Polymerization Catalysts: Experimental Results, Shift Assignment and Prediction by Quantum Chemical Calculations†","Organometallics","2007","26","18","4402","","10.1021/om070173y","","","0.71073","MoKα","","0.0393","0.0317","","","0.0842","0.0899","","","","","","1.066","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073207","8.6425","0.0005","10.0291","0.0006","13.5776","0.0009","97.051","0.001","100.808","0.001","114.19","0.001","1027.98","0.11","190","2","190","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H24 Cl2 Cr N Si -","- C20 H24 Cl2 Cr N Si -","- C40 H48 Cl4 Cr2 N2 Si2 -","2","1","","Fernández, Pablo; Pritzkow, Hans; Carbó, Jorge J.; Hofmann, Peter; Enders, Markus","1H NMR Investigation of Paramagnetic Chromium(III) Olefin Polymerization Catalysts: Experimental Results, Shift Assignment and Prediction by Quantum Chemical Calculations†","Organometallics","2007","26","18","4402","","10.1021/om070173y","","","0.71073","MoKα","","0.0728","0.0423","","","0.097","0.1167","","","","","","1.047","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073208","13.859","0.003","11.248","0.002","18.424","0.004","90","","105.97","0.004","90","","2761.2","1","106","2","106","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Cr F6 N O6 S2 Si -","- C22 H24 Cr F6 N O6 S2 Si -","- C88 H96 Cr4 F24 N4 O24 S8 Si4 -","4","1","","Fernández, Pablo; Pritzkow, Hans; Carbó, Jorge J.; Hofmann, Peter; Enders, Markus","1H NMR Investigation of Paramagnetic Chromium(III) Olefin Polymerization Catalysts: Experimental Results, Shift Assignment and Prediction by Quantum Chemical Calculations†","Organometallics","2007","26","18","4402","","10.1021/om070173y","","","0.71073","MoKα","","0.0446","0.0315","","","0.0773","0.0854","","","","","","1.038","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073209","14.0141","0.0012","13.8065","0.0012","17.5198","0.0015","90","","90","","90","","3389.8","0.5","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18.38 H19.13 Cl1.63 Cr N -","- C18.387 H19.161 Cl1.613 Cr N -","- C147.096 H153.288 Cl12.904 Cr8 N8 -","8","1","","Fernández, Pablo; Pritzkow, Hans; Carbó, Jorge J.; Hofmann, Peter; Enders, Markus","1H NMR Investigation of Paramagnetic Chromium(III) Olefin Polymerization Catalysts: Experimental Results, Shift Assignment and Prediction by Quantum Chemical Calculations†","Organometallics","2007","26","18","4402","","10.1021/om070173y","","","0.71073","MoKα","","0.0761","0.0494","","","0.1233","0.1395","","","","","","1.098","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4073210","8.1996","0.0007","12.4009","0.0011","16.4569","0.0015","90","","91.773","0.002","90","","1672.6","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H27 Cl2 Cr O3 -","- C13 H27 Cl2 Cr O3 -","- C52 H108 Cl8 Cr4 O12 -","4","1","","Fernández, Pablo; Pritzkow, Hans; Carbó, Jorge J.; Hofmann, Peter; Enders, Markus","1H NMR Investigation of Paramagnetic Chromium(III) Olefin Polymerization Catalysts: Experimental Results, Shift Assignment and Prediction by Quantum Chemical Calculations†","Organometallics","2007","26","18","4402","","10.1021/om070173y","","","0.71073","MoKα","","0.0775","0.0398","","","0.0908","0.112","","","","","","1.059","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073211","9.7874","0.0002","6.3569","0.0002","14.2795","0.0003","90","","105.868","0.0017","90","","854.58","0.04","150","1","150","1","","","","","","","","4","P 1 2/a 1","-P 2ya","13","","","","- C10 H10 F V -","- C10 H10 F V -","- C40 H40 F4 V4 -","4","1","","Harvey, Benjamin G.; Arif, Atta M.; Glöckner, Andreas; Ernst, Richard D.","SF6as a Selective and Reactive Fluorinating Agent for Low-Valent Transition Metal Complexes#","Organometallics","2007","26","11","2872","","10.1021/om070175i","","","0.71073","MoKα","","0.0334","0.0278","","","0.0707","0.0747","","","","","","1.056","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073212","7.4526","0.0002","8.5308","0.0004","14.9544","0.0008","79.848","0.003","82.488","0.003","65.649","0.003","850.82","0.07","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C17 H25 Cr F2 N2 -","- C17 H25 Cr F2 N2 -","- C34 H50 Cr2 F4 N4 -","2","1","","Harvey, Benjamin G.; Arif, Atta M.; Glöckner, Andreas; Ernst, Richard D.","SF6as a Selective and Reactive Fluorinating Agent for Low-Valent Transition Metal Complexes#","Organometallics","2007","26","11","2872","","10.1021/om070175i","","","0.71073","MoKα","","0.0763","0.0505","","","0.1008","0.1138","","","","","","1.098","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073213","11.7587","0.0007","14.4911","0.0012","14.8362","0.0013","97.213","0.004","111.974","0.005","102.408","0.005","2229.6","0.3","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C88 H122 Cr8 F18 -","- C88 H122 Cr8 F18 -","- C88 H122 Cr8 F18 -","1","0.5","","Harvey, Benjamin G.; Arif, Atta M.; Glöckner, Andreas; Ernst, Richard D.","SF6as a Selective and Reactive Fluorinating Agent for Low-Valent Transition Metal Complexes#","Organometallics","2007","26","11","2872","","10.1021/om070175i","","","0.71073","MoKα","","0.0931","0.0568","","","0.1308","0.1538","","","","","","1.06","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073214","10.6504","0.0002","14.6996","0.0003","15.6216","0.0003","63.313","0.0011","81.2757","0.0011","81.5338","0.001","2151.17","0.08","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C46 H73 F5 Fe2 -","- C46 H73 F5 Fe2 -","- C92 H146 F10 Fe4 -","2","1","","Harvey, Benjamin G.; Arif, Atta M.; Glöckner, Andreas; Ernst, Richard D.","SF6as a Selective and Reactive Fluorinating Agent for Low-Valent Transition Metal Complexes#","Organometallics","2007","26","11","2872","","10.1021/om070175i","","","0.71073","MoKα","","0.0834","0.0456","","","0.098","0.1136","","","","","","1.029","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073215","12.8139","0.0002","17.8524","0.0004","8.619","0.0002","90","","90","","90","","1971.67","0.07","150","1","150","1","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C40 H60 Cr3 F5 -","- C40 H60 Cr3 F5 -","- C80 H120 Cr6 F10 -","2","0.5","","Harvey, Benjamin G.; Arif, Atta M.; Glöckner, Andreas; Ernst, Richard D.","SF6as a Selective and Reactive Fluorinating Agent for Low-Valent Transition Metal Complexes#","Organometallics","2007","26","11","2872","","10.1021/om070175i","","","0.71073","MoKα","","0.0432","0.0361","","","0.085","0.0884","","","","","","1.111","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073216","16.4213","0.0013","12.2471","0.001","16.9408","0.0014","90","","90","","90","","3407","0.5","163","2","163","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C34 H56 N2 O Sm -","- C34 H56 N2 O Sm -","- C136 H224 N8 O4 Sm4 -","4","0.5","","Evans, William J.; Montalvo, Elizabeth; Foster, Samuel E.; Harada, Kimberly A.; Ziller, Joseph W.","Reactivity of (C5Me5)2Sm(THF)2with Nitriles: C−C Bond Cleavage To Form Cyanide Complexes","Organometallics","2007","26","11","2904","","10.1021/om070176a","","","0.71073","MoKα","","0.048","0.0262","","","0.0594","0.0732","","","","","","1.172","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073217","12.546","0.0012","13.3491","0.0012","16.9911","0.0016","90","","90","","90","","2845.6","0.5","163","2","163","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H48 N O Sm -","- C29 H48 N O Sm -","- C116 H192 N4 O4 Sm4 -","4","1","","Evans, William J.; Montalvo, Elizabeth; Foster, Samuel E.; Harada, Kimberly A.; Ziller, Joseph W.","Reactivity of (C5Me5)2Sm(THF)2with Nitriles: C−C Bond Cleavage To Form Cyanide Complexes","Organometallics","2007","26","11","2904","","10.1021/om070176a","","","0.71073","MoKα","","0.0387","0.0246","","","0.0543","0.0604","","","","","","1.07","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073218","20.3157","0.0008","20.3157","0.0008","14.2464","0.0009","90","","90","","120","","5092.1","0.4","163","2","163","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C99 H141 N6 Sm3 -","- C99 H138 N6 Sm3 -","- C198 H276 N12 Sm6 -","2","0.166667","","Evans, William J.; Montalvo, Elizabeth; Foster, Samuel E.; Harada, Kimberly A.; Ziller, Joseph W.","Reactivity of (C5Me5)2Sm(THF)2with Nitriles: C−C Bond Cleavage To Form Cyanide Complexes","Organometallics","2007","26","11","2904","","10.1021/om070176a","","","0.71073","MoKα","","0.0939","0.0651","","","0.1781","0.2046","","","","","","1.164","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073219","15.335","0.004","13.726","0.003","26.895","0.007","90","","102.477","0.004","90","","5527","2","163","2","163","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H84 N2 O Sm2 -","- C56 H84 N2 O Sm2 -","- C224 H336 N8 O4 Sm8 -","4","1","","Evans, William J.; Montalvo, Elizabeth; Foster, Samuel E.; Harada, Kimberly A.; Ziller, Joseph W.","Reactivity of (C5Me5)2Sm(THF)2with Nitriles: C−C Bond Cleavage To Form Cyanide Complexes","Organometallics","2007","26","11","2904","","10.1021/om070176a","","","0.71073","MoKα","","0.0456","0.0345","","","0.087","0.0942","","","","","","1.082","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073220","10.6146","0.001","17.1516","0.0016","10.2949","0.001","90","","96.932","0.002","90","","1860.6","0.3","163","2","163","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","[Cp*Ru(veratrole)]Cl Hydrate","","","- C18 H27 Cl O3 Ru -","- C18 H25 Cl O3 Ru -","- C72 H100 Cl4 O12 Ru4 -","4","0.5","","Fairchild, Robert M.; Holman, K. Travis","Facile, Near-Quantitative, Aqueous Routes to Nearly Any [Cp*Ru(η6-arene)]Cl Compound","Organometallics","2007","26","12","3049","","10.1021/om0701773","","","0.71073","MoKα","","0.0601","0.0334","","","0.0749","0.081","","","","","","1.093","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073221","7.4013","0.0004","17.2203","0.001","13.4802","0.0008","90","","95.861","0.001","90","","1709.11","0.17","163","2","163","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Cp*Ru(benzamide)]Cl hydrate","","","- C17 H24 Cl N O2 Ru -","- C17 H24 Cl N O2 Ru -","- C68 H96 Cl4 N4 O8 Ru4 -","4","1","","Fairchild, Robert M.; Holman, K. Travis","Facile, Near-Quantitative, Aqueous Routes to Nearly Any [Cp*Ru(η6-arene)]Cl Compound","Organometallics","2007","26","12","3049","","10.1021/om0701773","","","0.71073","MoKα","","0.0743","0.038","","","0.0861","0.0936","","","","","","0.98","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073222","11.0937","0.0008","13.5833","0.001","17.9283","0.0012","69.733","0.006","71.212","0.006","66.574","0.007","2271.5","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C47 H26 Co4 O15 -","- C47 H26 Co4 O15 -","- C94 H52 Co8 O30 -","2","1","","Melikyan, Gagik G.; Floruti, Arthur; Devletyan, Lucin; Toure, Pogban; Dean, Norman; Carlson, Louis","Cross-Coupling of Cobalt-Complexed Propargyl Radicals: Metal Core- and α- and γ-Aryl-Induced Chemo- and Diastereoselectivity†","Organometallics","2007","26","13","3173","","10.1021/om070180m","","","0.71073","MoKα","","0.0527","0.0495","","","0.1232","0.1255","","","","","","1.157","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073223","12.969","0.006","14.064","0.006","14.585","0.007","115.767","0.006","90.768","0.006","117.139","0.005","2056.2","1.6","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H28 N2 O4.5 -","- C21 H28 N2 O4.5 -","- C84 H112 N8 O18 -","4","2","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.1662","0.0948","","","0.2213","0.2561","","","","","","1.03","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073224","11.6131","0.0018","11.6131","0.0018","20.469","0.007","90","","90","","120","","2390.7","1","233","2","233","2","","","","","","","","4","P 65","P 65","170","","","","- C17 H21 Cl N2 -","- C17 H21 Cl N2 -","- C102 H126 Cl6 N12 -","6","1","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.1271","0.0604","","","0.1274","0.1503","","","","","","1.012","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073225","10.087","0.006","16.617","0.009","16.919","0.009","90","","101.374","0.01","90","","2780","3","207","2","207","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H33 Cl2 N2 O3 S -","- C27 H33 Cl2 N2 O3 S -","- C108 H132 Cl8 N8 O12 S4 -","4","1","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.0864","0.0584","","","0.1411","0.1552","","","","","","1.006","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073226","13.732","0.002","13.418","0.002","14.026","0.002","90","","91.796","0.003","90","","2583.1","0.7","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H29 Cl2 N2 O -","- C27 H27 Cl N2 O -","- C108 H108 Cl4 N8 O4 -","4","1","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.0582","0.0502","","","0.1282","0.1337","","","","","","1.053","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073227","14.069","0.003","13.564","0.002","18.238","0.003","90","","94.717","0.003","90","","3468.6","1.1","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H21 Br N2 -","- C21 H21 Br N2 -","- C168 H168 Br8 N16 -","8","2","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.0651","0.0563","","","0.1335","0.1385","","","","","","1.016","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073228","9.223","0.004","8.553","0.004","10.143","0.005","90","","117.04","0.04","90","","712.7","0.6","223","2","223","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C17 H20 N2 -","- C17 H20 N2 -","- C34 H40 N4 -","2","1","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.088","0.0759","","","0.2471","0.2596","","","","","","1.035","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073229","11.1938","0.0015","13.9491","0.0019","10.5219","0.0014","90","","90","","90","","1642.9","0.4","200","2","200","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C19 H24 N2 -","- C19 H24 N2 -","- C76 H96 N8 -","4","1","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.0562","0.0371","","","0.0828","0.0916","","","","","","1.04","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073230","12.4944","0.0018","11.4705","0.0016","15.323","0.002","90","","96.383","0.002","90","","2182.4","0.5","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C54 H48 N4 -","- C54 H48 N4 -","- C108 H96 N8 -","2","0.5","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.1088","0.0733","","","0.1849","0.2086","","","","","","1.066","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073231","11.985","0.002","8.6199","0.0016","17.383","0.003","90","","101.454","0.003","90","","1760.1","0.5","170","2","170","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 N2 -","- C22 H22 N2 -","- C88 H88 N8 -","4","1","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.0951","0.0642","","","0.1389","0.159","","","","","","1.069","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073232","10.964","0.003","11.591","0.004","17.429","0.005","91.921","0.006","97.232","0.006","113.765","0.006","2002.3","1.1","207","2","207","2","","","","","","","","3","P -1","-P 1","2","","","","- C52 H56 N4 -","- C52 H56 N4 -","- C104 H112 N8 -","2","1","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.1383","0.0721","","","0.1453","0.1703","","","","","","1.024","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073233","8.614","0.0013","13.555","0.002","17.067","0.003","93.69","0.003","97.561","0.003","97.573","0.003","1951.5","0.5","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","","","- C52 H56 N4 -","- C52 H56 N4 -","- C104 H112 N8 -","2","1","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.0841","0.0727","","","0.1822","0.1905","","","","","","1.059","","","","has coordinates","271475","2021-12-16","11:44:37",""
"4073234","10.3248","0.0016","14.149","0.002","16.339","0.003","112.486","0.002","93.646","0.002","94.078","0.002","2189.1","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C22.5 H24 Cl N2 O2 Rh -","- C22.5 H24 Cl N2 O2 Rh -","- C90 H96 Cl4 N8 O8 Rh4 -","4","2","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.042","0.0399","","","0.1107","0.1124","","","","","","1.084","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073235","10.241","0.002","16.129","0.003","14.067","0.003","90","","104.722","0.004","90","","2247.3","0.8","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H32 Cl N2 Rh -","- C25 H32 Cl N2 Rh -","- C100 H128 Cl4 N8 Rh4 -","4","1","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.0922","0.0724","","","0.1916","0.2037","","","","","","1.043","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073236","15.312","0.004","19.265","0.005","16.321","0.004","90","","102.566","0.004","90","","4699","2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28.5 H27.5 N2 S -","- C27 H24 N2 S -","- C216 H192 N16 S8 -","8","2","","Bazinet, Patrick; Ong, Tiow-Gan; O'Brien, Julie S.; Lavoie, Nathalie; Bell, Eleanor; Yap, Glenn P. A.; Korobkov, Ilia; Richeson, Darrin S.","Design of Sterically Demanding, Electron-Rich Carbene Ligands with the Perimidine Scaffold","Organometallics","2007","26","11","2885","","10.1021/om0701827","","","0.71073","MoKα","","0.1313","0.068","","","0.1193","0.1354","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073237","10.0782","0.0007","11.2516","0.0009","12.1662","0.0008","90.697","0.003","91.267","0.003","100.896","0.004","1354.21","0.17","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H33 Fe3 N O4 Si3 -","- C25 H33 Fe3 N O4 Si3 -","- C50 H66 Fe6 N2 O8 Si6 -","2","1","","Hirotsu, Masakazu; Nishida, Takuo; Sasaki, Hiromitsu; Muraoka, Takako; Yoshimura, Takashi; Ueno, Keiji","Photochemical Reaction of CpFe(CO)2SiMe3(Cp = η5-C5H5) with a Trihydrosilane Containing a Bulky Amino Substituent, Bis(trimethylsilyl)aminosilane","Organometallics","2007","26","10","2495","","10.1021/om070185j","","","0.7107","MoKα","","0.0501","0.0486","","","0.13","0.1315","","","","","","1.076","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073238","8.404","0.0005","17.3179","0.0008","15.7939","0.0011","90","","101.368","0.002","90","","2253.5","0.2","113","2","113","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H27 Fe2 N O3 Si3 -","- C19 H27 Fe2 N O3 Si3 -","- C76 H108 Fe8 N4 O12 Si12 -","4","1","","Hirotsu, Masakazu; Nishida, Takuo; Sasaki, Hiromitsu; Muraoka, Takako; Yoshimura, Takashi; Ueno, Keiji","Photochemical Reaction of CpFe(CO)2SiMe3(Cp = η5-C5H5) with a Trihydrosilane Containing a Bulky Amino Substituent, Bis(trimethylsilyl)aminosilane","Organometallics","2007","26","10","2495","","10.1021/om070185j","","","0.7107","MoKα","","0.053","0.0521","","","0.1331","0.1346","","","","","","1.066","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073239","12.313","0.0004","12.4321","0.0002","18.7094","0.0005","72.974","0.003","84.917","0.004","77.009","0.004","2667.56","0.13","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H80 Fe3 N3 O3 Si9 -","- C39 H73 Fe3 N3 O3 Si9 -","- C78 H146 Fe6 N6 O6 Si18 -","2","1","","Hirotsu, Masakazu; Nishida, Takuo; Sasaki, Hiromitsu; Muraoka, Takako; Yoshimura, Takashi; Ueno, Keiji","Photochemical Reaction of CpFe(CO)2SiMe3(Cp = η5-C5H5) with a Trihydrosilane Containing a Bulky Amino Substituent, Bis(trimethylsilyl)aminosilane","Organometallics","2007","26","10","2495","","10.1021/om070185j","","","0.71073","MoKα","","0.0491","0.0436","","","0.1254","0.1408","","","","","","1.061","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073240","10.596","0.002","11.496","0.002","14.619","0.003","95.065","0.003","92.839","0.003","100.834","0.003","1738.2","0.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H39 Br3 Cl3 N5 -","- C29 H39 Br3 Cl3 N5 -","- C58 H78 Br6 Cl6 N10 -","2","1","","Edworthy, Ian S.; Blake, Alexander J.; Wilson, Claire; Arnold, Polly L.","Synthesis and NHC Lability of d0Lithium, Yttrium, Titanium, and Zirconium Amido Bis(N-heterocyclic carbene) Complexes","Organometallics","2007","26","15","3684","","10.1021/om0701874","","","0.71073","MoKα","","0.0379","0.0316","","","0.0839","0.0866","","","","","","1.05","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073241","15.9217","0.0006","31.6519","0.0012","18.482","0.0007","90","","104.618","0.002","90","","9012.5","0.6","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34.25 H52.63 Cl N6 Si2 Y -","- C34 H52 Cl N6 Si2 Y -","- C272 H416 Cl8 N48 Si16 Y8 -","8","2","","Edworthy, Ian S.; Blake, Alexander J.; Wilson, Claire; Arnold, Polly L.","Synthesis and NHC Lability of d0Lithium, Yttrium, Titanium, and Zirconium Amido Bis(N-heterocyclic carbene) Complexes","Organometallics","2007","26","15","3684","","10.1021/om0701874","","","0.6712","synchrotron","","0.0578","0.0421","","","0.12","0.1259","","","","","","1.078","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073242","12.2517","0.0007","13.3636","0.0007","13.6072","0.0007","90","","103.625","0.001","90","","2165.2","0.2","273","2","273","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H25 Cl F6 Ir N2 P -","- C17 H24 Cl F6 Ir N2 P -","- C68 H96 Cl4 F24 Ir4 N8 P4 -","4","1","","Corberán, Rosa; Sanaú, Mercedes; Peris, Eduardo","“Cp*Ir(III)” Complexes with Hemicleaveable Ligands of the TypeN-Alkenyl Imidazolin-2-ylidene. Reactivity and Catalytic Properties","Organometallics","2007","26","14","3492","","10.1021/om070188w","","","0.71073","MoKα","","0.0727","0.055","","","0.142","0.1568","","","","","","1.043","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073243","12.7251","0.0007","14.1698","0.0008","14.1577","0.0008","90","","100.324","0.001","90","","2511.5","0.2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H29 Cl3 F6 Ir N2 P -","- C19 H29 Cl3 F6 Ir N2 P -","- C76 H116 Cl12 F24 Ir4 N8 P4 -","4","1","","Corberán, Rosa; Sanaú, Mercedes; Peris, Eduardo","“Cp*Ir(III)” Complexes with Hemicleaveable Ligands of the TypeN-Alkenyl Imidazolin-2-ylidene. Reactivity and Catalytic Properties","Organometallics","2007","26","14","3492","","10.1021/om070188w","","","0.71073","MoKα","","0.054","0.0394","","","0.106","0.1149","","","","","","1.065","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073244","12.2199","0.001","14.7477","0.0012","14.6193","0.0012","90","","104.305","0.002","90","","2552.9","0.4","273","2","273","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C19 H29 Cl F6 Ir N2 O P -","- C19 H29 Cl F6 Ir N2 O P -","- C76 H116 Cl4 F24 Ir4 N8 O4 P4 -","4","1","","Corberán, Rosa; Sanaú, Mercedes; Peris, Eduardo","“Cp*Ir(III)” Complexes with Hemicleaveable Ligands of the TypeN-Alkenyl Imidazolin-2-ylidene. Reactivity and Catalytic Properties","Organometallics","2007","26","14","3492","","10.1021/om070188w","","","0.71073","MoKα","","0.083","0.05","","","0.1216","0.133","","","","","","1.094","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073245","8.6793","0.0005","11.7118","0.0007","11.852","0.0007","84.111","0.001","79.798","0.001","84.993","0.001","1176.51","0.12","273","2","273","2","","","","","","","","8","P 1","P 1","1","","","","- C35 H50 Cl6 F12 Ir2 N4 O P2 -","- C35 H50 Cl6 F12 Ir2 N4 O P2 -","- C35 H50 Cl6 F12 Ir2 N4 O P2 -","1","1","","Corberán, Rosa; Sanaú, Mercedes; Peris, Eduardo","“Cp*Ir(III)” Complexes with Hemicleaveable Ligands of the TypeN-Alkenyl Imidazolin-2-ylidene. Reactivity and Catalytic Properties","Organometallics","2007","26","14","3492","","10.1021/om070188w","","","0.71073","MoKα","","0.0428","0.0363","","","0.1167","0.1207","","","","","","1.102","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073246","11.537","0.002","11.903","0.002","15.777","0.003","102.71","0.003","99.325","0.003","109.119","0.003","1931.4","0.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H48 Ag4 F24 N16 P4 -","- C42 H42 Ag4 F24 N14 P4 -","- C42 H42 Ag4 F24 N14 P4 -","1","0.5","","Liu, Bin; Chen, Wanzhi; Jin, Shouwen","Synthesis, Structural Characterization, and Luminescence of New Silver Aggregates Containing Short Ag−Ag Contacts Stabilized by Functionalized Bis(N-heterocyclic carbene) Ligands","Organometallics","2007","26","15","3660","","10.1021/om0701928","","","0.71073","MoKα","","0.0621","0.0375","","","0.089","0.0975","","","","","","0.925","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073247","11.61","0.02","12.02","0.03","15.74","0.03","102.25","0.03","99.82","0.03","108.88","0.03","1962","7","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H40 Ag4 F24 N12 O2 P4 -","- C38 H40 Ag4 F24 N12 O2 P4 -","- C38 H40 Ag4 F24 N12 O2 P4 -","1","0.5","","Liu, Bin; Chen, Wanzhi; Jin, Shouwen","Synthesis, Structural Characterization, and Luminescence of New Silver Aggregates Containing Short Ag−Ag Contacts Stabilized by Functionalized Bis(N-heterocyclic carbene) Ligands","Organometallics","2007","26","15","3660","","10.1021/om0701928","","","0.71073","MoKα","","0.3868","0.0928","","","0.1585","0.3014","","","","","","0.851","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073248","11.895","0.002","11.937","0.002","14.366","0.003","95.157","0.003","92.219","0.002","104.29","0.003","1964.8","0.6","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H54 Ag4 F24 N14 O2 P4 -","- C44 H48 Ag4 F24 N12 O2 P4 -","- C44 H48 Ag4 F24 N12 O2 P4 -","1","0.5","","Liu, Bin; Chen, Wanzhi; Jin, Shouwen","Synthesis, Structural Characterization, and Luminescence of New Silver Aggregates Containing Short Ag−Ag Contacts Stabilized by Functionalized Bis(N-heterocyclic carbene) Ligands","Organometallics","2007","26","15","3660","","10.1021/om0701928","","","0.71073","MoKα","","0.1338","0.0726","","","0.1766","0.1982","","","","","","0.873","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073249","8.288","0.002","24.503","0.003","20.007","0.002","90","","98.271","0.002","90","","4020.8","1.2","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C26 H32 Au2 F12 N8 O2 P2 -","- C22 H24 Au2 F12 N6 O P2 -","- C88 H96 Au8 F48 N24 O4 P8 -","4","1","","Liu, Bin; Chen, Wanzhi; Jin, Shouwen","Synthesis, Structural Characterization, and Luminescence of New Silver Aggregates Containing Short Ag−Ag Contacts Stabilized by Functionalized Bis(N-heterocyclic carbene) Ligands","Organometallics","2007","26","15","3660","","10.1021/om0701928","","","0.71073","MoKα","","0.1461","0.0945","","","0.2238","0.2426","","","","","","0.953","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073250","12.281","0.0018","21.32","0.003","15.26","0.003","90","","96.041","0.002","90","","3973.4","1.1","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H59 Ag4 F24 N15 O P4 -","- C56 H59 Ag4 F24 N15 O P4 -","- C112 H118 Ag8 F48 N30 O2 P8 -","2","0.5","","Liu, Bin; Chen, Wanzhi; Jin, Shouwen","Synthesis, Structural Characterization, and Luminescence of New Silver Aggregates Containing Short Ag−Ag Contacts Stabilized by Functionalized Bis(N-heterocyclic carbene) Ligands","Organometallics","2007","26","15","3660","","10.1021/om0701928","","","0.71073","MoKα","","0.1087","0.0584","","","0.1659","0.2417","","","","","","1.065","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073251","25.521","0.004","16.797","0.003","30.53","0.04","90","","113.76","0.003","90","","11978","16","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C88 H72 Ag6 F36 N32 P6 -","- C88 H72 Ag6 F36 N32 P6 -","- C352 H288 Ag24 F144 N128 P24 -","4","2","","Liu, Bin; Chen, Wanzhi; Jin, Shouwen","Synthesis, Structural Characterization, and Luminescence of New Silver Aggregates Containing Short Ag−Ag Contacts Stabilized by Functionalized Bis(N-heterocyclic carbene) Ligands","Organometallics","2007","26","15","3660","","10.1021/om0701928","","","0.71073","MoKα","","0.1243","0.0676","","","0.1727","0.2212","","","","","","1.053","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073252","17.58","0.002","24.385","0.003","18.446","0.003","90","","110.948","0.002","90","","7384.9","1.7","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C77.5 H71 Cl4 O3.5 P4 Ru -","- C77.5 H71 Cl4 O3.5 P4 Ru -","- C310 H284 Cl16 O14 P16 Ru4 -","4","1","","Zhang, Hong; Feng, Li; Gong, Lei; Wu, Liqiong; He, Guomei; Wen, Tingbin; Yang, Fangzu; Xia, Haiping","Synthesis and Characterization of Stable Ruthenabenzenes Starting from HC⋮CCH(OH)C⋮CH","Organometallics","2007","26","10","2705","","10.1021/om070195k","","","0.71073","MoKα","","0.097","0.0757","","","0.1916","0.2033","","","","","","1.085","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073253","11.776","0.003","20.801","0.006","20.544","0.006","90","","105.677","0.005","90","","4845","2","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C47 H57.5 Cl3 O3.25 P4 Ru -","- C47 H57.5 Cl3 O3.25 P4 Ru -","- C188 H230 Cl12 O13 P16 Ru4 -","4","1","","Zhang, Hong; Feng, Li; Gong, Lei; Wu, Liqiong; He, Guomei; Wen, Tingbin; Yang, Fangzu; Xia, Haiping","Synthesis and Characterization of Stable Ruthenabenzenes Starting from HC⋮CCH(OH)C⋮CH","Organometallics","2007","26","10","2705","","10.1021/om070195k","","","0.71073","MoKα","","0.0847","0.0735","","","0.1491","0.1546","","","","","","1.173","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073254","13.915","0.002","14.921","0.002","18.165","0.003","104.201","0.002","106.209","0.003","102.962","0.003","3332.8","0.9","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C70.5 H65 Cl6 N2 O3 P3 Ru -","- C70.5 H65 Cl6 N2 O3 P3 Ru -","- C141 H130 Cl12 N4 O6 P6 Ru2 -","2","1","","Zhang, Hong; Feng, Li; Gong, Lei; Wu, Liqiong; He, Guomei; Wen, Tingbin; Yang, Fangzu; Xia, Haiping","Synthesis and Characterization of Stable Ruthenabenzenes Starting from HC⋮CCH(OH)C⋮CH","Organometallics","2007","26","10","2705","","10.1021/om070195k","","","0.71073","MoKα","","0.0773","0.0699","","","0.1776","0.1822","","","","","","1.153","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073255","24.495","0.004","25.713","0.004","43.627","0.01","90","","90","","90","","27478","9","223","2","223","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C57 H59 Cl3 N2 P4 Ru -","- C57 H59 Cl3 N2 P4 Ru -","- C912 H944 Cl48 N32 P64 Ru16 -","16","0.5","","Zhang, Hong; Feng, Li; Gong, Lei; Wu, Liqiong; He, Guomei; Wen, Tingbin; Yang, Fangzu; Xia, Haiping","Synthesis and Characterization of Stable Ruthenabenzenes Starting from HC⋮CCH(OH)C⋮CH","Organometallics","2007","26","10","2705","","10.1021/om070195k","","","0.71073","MoKα","","0.0925","0.075","","","0.1867","0.197","","","","","","1.103","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073256","13.198","0.002","19.435","0.004","21.924","0.004","80.074","0.003","89.858","0.003","84.173","0.003","5510.1","1.7","223","2","223","2","","","","","","","","8","P -1","-P 1","2","","","","- C118 H96 B3 Cl3 F12 O0.5 P6 Ru2 -","- C118 H96 B3 Cl3 F12 O0.5 P6 Ru2 -","- C236 H192 B6 Cl6 F24 O P12 Ru4 -","2","1","","Zhang, Hong; Feng, Li; Gong, Lei; Wu, Liqiong; He, Guomei; Wen, Tingbin; Yang, Fangzu; Xia, Haiping","Synthesis and Characterization of Stable Ruthenabenzenes Starting from HC⋮CCH(OH)C⋮CH","Organometallics","2007","26","10","2705","","10.1021/om070195k","","","0.71073","MoKα","","0.1081","0.0869","","","0.2225","0.2343","","","","","","1.132","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073257","9.4106","0.0017","10.611","0.002","16.299","0.003","102.528","0.003","101.903","0.003","95.411","0.003","1538.1","0.5","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H33 Cl P2 -","- C41 H33 Cl P2 -","- C82 H66 Cl2 P4 -","2","1","","Zhang, Hong; Feng, Li; Gong, Lei; Wu, Liqiong; He, Guomei; Wen, Tingbin; Yang, Fangzu; Xia, Haiping","Synthesis and Characterization of Stable Ruthenabenzenes Starting from HC⋮CCH(OH)C⋮CH","Organometallics","2007","26","10","2705","","10.1021/om070195k","","","0.71073","MoKα","","0.0699","0.0612","","","0.1471","0.1522","","","","","","1.123","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073258","10.799","0.002","15.442","0.003","17.983","0.004","90.504","0.009","106.818","0.007","95.228","0.007","2856.7","1","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H27 Cr N O4 P2 -","- C31 H27 Cr N O4 P2 -","- C124 H108 Cr4 N4 O16 P8 -","4","2","","Rucklidge, Adam J.; McGuinness, David S.; Tooze, Robert P.; Slawin, Alexandra M. Z.; Pelletier, Jérémie D. A.; Hanton, Martin J.; Webb, Paul B.","Ethylene Tetramerization with Cationic Chromium(I) Complexes","Organometallics","2007","26","10","2782","","10.1021/om0701975","","","0.71073","MoKα","","0.1114","0.0665","","","0.1203","0.1406","","","","","","1.127","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073259","14.7195","0.0013","25.217","0.002","16.4329","0.0014","90","","103.915","0.003","90","","5920.6","0.9","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C47 H27 Al Cr F36 N O8 P2 -","- C47 H27 Al Cr F36 N O8 P2 -","- C188 H108 Al4 Cr4 F144 N4 O32 P8 -","4","1","","Rucklidge, Adam J.; McGuinness, David S.; Tooze, Robert P.; Slawin, Alexandra M. Z.; Pelletier, Jérémie D. A.; Hanton, Martin J.; Webb, Paul B.","Ethylene Tetramerization with Cationic Chromium(I) Complexes","Organometallics","2007","26","10","2782","","10.1021/om0701975","","","1.54178","CuKα","","0.2799","0.2615","","","0.6143","0.6397","","","","","","3.02","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073260","18.7419","0.0008","19.4591","0.0007","24.6209","0.001","90","","112.043","0.002","90","","8322.9","0.6","173","2","173","2","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","","","","- C45 H59 Ca N2 O P -","- C45 H59 Ca N2 O P -","- C360 H472 Ca8 N16 O8 P8 -","8","4","","Crimmin, Mark R.; Barrett, Anthony G. M.; Hill, Michael S.; Hitchcock, Peter B.; Procopiou, Panayiotis A.","Calcium-Catalyzed Intermolecular Hydrophosphination","Organometallics","2007","26","12","2953","","10.1021/om070200k","","x-ray","0.71073","MoKα","","0.1997","0.1079","","","0.2021","0.2461","","","","","","1.086","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073261","10.708","0.005","10.761","0.005","17.276","0.007","101.42","0.008","94.927","0.008","114.891","0.007","1737.7","1.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H6 N2 O19 Os7 -","- C25 H6 N2 O19 Os7 -","- C50 H12 N4 O38 Os14 -","2","1","","Cabeza, Javier A.; del Río, Ignacio; García-Álvarez, Pablo; Miguel, Daniel","High-Nuclearity Osmium Carbonyl Cluster Complexes Containing (6-Methylpyrid-2-yl)imido Ligands. Synthesis of Hepta-, Octa-, and Nonanuclear Derivatives","Organometallics","2007","26","13","3212","","10.1021/om070201c","","","0.71073","MoKα","","0.1006","0.0869","","","0.2222","0.2411","","","","","","1.017","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073262","16.9899","0.0001","11.8232","0.0008","18.983","0.0001","90","","103.28","0.001","90","","3711.2","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H8 N2 O20 Os8 -","- C26 H8 N2 O20 Os8 -","- C104 H32 N8 O80 Os32 -","4","1","","Cabeza, Javier A.; del Río, Ignacio; García-Álvarez, Pablo; Miguel, Daniel","High-Nuclearity Osmium Carbonyl Cluster Complexes Containing (6-Methylpyrid-2-yl)imido Ligands. Synthesis of Hepta-, Octa-, and Nonanuclear Derivatives","Organometallics","2007","26","13","3212","","10.1021/om070201c","","","1.5418","CuKα","","0.0352","0.0282","","","0.0728","0.0934","","","","","","1.101","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073263","10.383","0.004","11.184","0.005","20.07","0.008","97.207","0.008","93.225","0.008","91.379","0.008","2307.4","1.6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H14 Cl2 N4 O19 Os9 -","- C31 H14 Cl2 N4 O19 Os9 -","- C62 H28 Cl4 N8 O38 Os18 -","2","1","","Cabeza, Javier A.; del Río, Ignacio; García-Álvarez, Pablo; Miguel, Daniel","High-Nuclearity Osmium Carbonyl Cluster Complexes Containing (6-Methylpyrid-2-yl)imido Ligands. Synthesis of Hepta-, Octa-, and Nonanuclear Derivatives","Organometallics","2007","26","13","3212","","10.1021/om070201c","","","0.71073","MoKα","","0.0482","0.0386","","","0.1093","0.1175","","","","","","1.024","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073264","11.949","0.002","17.876","0.004","18.82","0.004","88.188","0.004","80.155","0.003","85.921","0.003","3950","1.4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C59.25 H37.5 Cl3.5 N4 O30 Ru14 -","- C59.25 H37.5 Cl3.5 N4 O30 Ru14 -","- C118.5 H75 Cl7 N8 O60 Ru28 -","2","1","","Cabeza, Javier A.; del Río, Ignacio; García-Álvarez, Pablo; Miguel, Daniel","Ruthenium Cluster Mediated Transformation of Linear Alkenes into Trienyl Ligands. Activation of Five C(sp3)−H Bonds of 1-Octene, 1-Nonene, and 1-Decene","Organometallics","2007","26","10","2482","","10.1021/om070205h","","","0.71073","MoKα","","0.0571","0.0458","","","0.1057","0.1194","","","","","","1.142","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073265","33.809","0.007","11.917","0.002","18.55","0.004","90","","93.714","0.004","90","","7458","3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H20 Cl N2 O15 Ru7 -","- C30 H20 Cl N2 O15 Ru7 -","- C240 H160 Cl8 N16 O120 Ru56 -","8","1","","Cabeza, Javier A.; del Río, Ignacio; García-Álvarez, Pablo; Miguel, Daniel","Ruthenium Cluster Mediated Transformation of Linear Alkenes into Trienyl Ligands. Activation of Five C(sp3)−H Bonds of 1-Octene, 1-Nonene, and 1-Decene","Organometallics","2007","26","10","2482","","10.1021/om070205h","","","0.71073","MoKα","","0.0867","0.0749","","","0.1878","0.1987","","","","","","1.046","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073266","10.094","0.003","10.685","0.003","19.963","0.006","96.418","0.006","102.817","0.006","109.754","0.005","1934.6","1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H22 Cl N2 O15 Ru7 -","- C31 H22 Cl N2 O15 Ru7 -","- C62 H44 Cl2 N4 O30 Ru14 -","2","1","","Cabeza, Javier A.; del Río, Ignacio; García-Álvarez, Pablo; Miguel, Daniel","Ruthenium Cluster Mediated Transformation of Linear Alkenes into Trienyl Ligands. Activation of Five C(sp3)−H Bonds of 1-Octene, 1-Nonene, and 1-Decene","Organometallics","2007","26","10","2482","","10.1021/om070205h","","","0.71073","MoKα","","0.0376","0.0347","","","0.0821","0.0845","","","","","","1.211","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073267","10.015","0.005","10.37","0.005","20.547","0.011","93.227","0.01","102.798","0.01","109.058","0.009","1947.6","1.7","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H22 Cl N2 O15 Ru7 -","- C31 H22 Cl N2 O15 Ru7 -","- C62 H44 Cl2 N4 O30 Ru14 -","2","1","","Cabeza, Javier A.; del Río, Ignacio; García-Álvarez, Pablo; Miguel, Daniel","Ruthenium Cluster Mediated Transformation of Linear Alkenes into Trienyl Ligands. Activation of Five C(sp3)−H Bonds of 1-Octene, 1-Nonene, and 1-Decene","Organometallics","2007","26","10","2482","","10.1021/om070205h","","","0.71073","MoKα","","0.0765","0.0649","","","0.2","0.2104","","","","","","1.121","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073268","10.678","0.012","29.84","0.03","14.767","0.016","90","","109.14","0.02","90","","4445","8","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H32 N2 O15 Ru7 -","- C35 H32 N2 O15 Ru7 -","- C140 H128 N8 O60 Ru28 -","4","1","","Cabeza, Javier A.; del Río, Ignacio; García-Álvarez, Pablo; Miguel, Daniel","Ruthenium Cluster Mediated Transformation of Linear Alkenes into Trienyl Ligands. Activation of Five C(sp3)−H Bonds of 1-Octene, 1-Nonene, and 1-Decene","Organometallics","2007","26","10","2482","","10.1021/om070205h","","","0.71073","MoKα","","0.0965","0.0745","","","0.1749","0.1885","","","","","","1.201","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073269","20.049","0.007","10.594","0.004","19.372","0.007","90","","103.02","0.006","90","","4009","3","293","2","293","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C35 H35 F6 N2 P Pd S6 -","- C34.9964 H35 F6 N2 P Pd S6 -","- C139.986 H140 F24 N8 P4 Pd4 S24 -","4","1","","Albano, Vincenzo G.; Bandini, Marco; Moorlag, Carolyn; Piccinelli, Fabio; Pietrangelo, Agostino; Tommasi, Simona; Umani-Ronchi, Achille; Wolf, Michael O.","Electropolymerized Pd-Containing Thiophene Polymer: A Reusable Supported Catalyst for Cross-Coupling Reactions","Organometallics","2007","26","18","4373","","10.1021/om070210l","","","0.71073","MoKα","","0.0786","0.0589","","","0.162","0.1783","","","","","","1.002","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073270","44.368","0.009","10.745","0.002","14.356","0.003","90","","103.65","0.03","90","","6651","2","100","2","100","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C62 H50 F12 Fe O10 P2 Ru4 -","- C62 H50 F12 Fe O10 P2 Ru4 -","- C248 H200 F48 Fe4 O40 P8 Ru16 -","4","1","","Moberg, Viktor; Haukka, Matti; Koshevoy, Igor O.; Ortiz, Roberto; Nordlander, Ebbe","Unprecedented Enantioselectivity in a Cluster-Based Catalytic System","Organometallics","2007","26","17","4090","","10.1021/om070211d","","","0.71073","MoKα","","0.0352","0.028","","","0.0634","0.0659","","","","","","1.015","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073271","10.836","0.002","14.243","0.003","32.129","0.006","90","","90","","90","","4958.7","1.7","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C52 H40 Fe O10 P2 Ru4 -","- C52 H40 Fe O10 P2 Ru4 -","- C208 H160 Fe4 O40 P8 Ru16 -","4","1","","Moberg, Viktor; Haukka, Matti; Koshevoy, Igor O.; Ortiz, Roberto; Nordlander, Ebbe","Unprecedented Enantioselectivity in a Cluster-Based Catalytic System","Organometallics","2007","26","17","4090","","10.1021/om070211d","","","0.71073","MoKα","","0.0852","0.0702","","","0.1768","0.183","","","","","","1.123","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073272","23.31","0.0003","12.3369","0.0002","20.406","0.0005","90","","105.45","0.0006","90","","5656.16","0.18","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C67 H80 O2 Zn2 -","- C67 H78.5 O2 Zn2 -","- C268 H314 O8 Zn8 -","4","1","","Bukhaltsev, Ella; Goldberg, Israel; Cohen, Revital; Vigalok, Arkadi","Tunable π-Interactions in Monomeric Organozinc Complexes: Solution and Solid-State Studies","Organometallics","2007","26","16","4015","","10.1021/om070213y","","","0.71073","MoKα","","0.0849","0.0552","","","0.1382","0.1557","","","","","","1.012","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073273","10.2094","0.0004","14.1816","0.0004","19.7097","0.0007","104.322","0.0012","98.4218","0.0017","96.127","0.003","2704.58","0.17","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H69 F3 O3 Zn2 -","- C64 H69 F3 O3 Zn2 -","- C128 H138 F6 O6 Zn4 -","2","1","","Bukhaltsev, Ella; Goldberg, Israel; Cohen, Revital; Vigalok, Arkadi","Tunable π-Interactions in Monomeric Organozinc Complexes: Solution and Solid-State Studies","Organometallics","2007","26","16","4015","","10.1021/om070213y","","","0.71073","MoKα","","0.0886","0.0624","","","0.162","0.1796","","","","","","1.044","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073274","8.3837","0.0004","8.8397","0.0004","12.2277","0.0004","103.423","0.0016","99.937","0.002","106.042","0.0011","819.5","0.06","173.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 Cl2 P4 Ru2 -","- C28 H54 Cl2 P4 Ru2 -","- C28 H54 Cl2 P4 Ru2 -","1","0.5","","Miyake, Yoshihiro; Nomaguchi, Yohei; Yuki, Masahiro; Nishibayashi, Yoshiaki","Synthesis and Reactivity of Diphosphine-Bridged Diruthenium Complexes","Organometallics","2007","26","14","3611","","10.1021/om070216a","","","0.71069","MoKα","","","0.038","","","","0.084","","","","","","1.02","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073275","11.0196","0.0007","11.309","0.0009","16.559","0.001","94.454","0.003","94.477","0.003","102.337","0.003","2000.3","0.2","173.1","","","","","","","","","","","8","P -1","-P 1","2","","","","- C31 H59 Cl F3 O3.5 P4 Ru2 S -","- C31.5 H54 Cl F3 O3 P4 Ru2 S -","- C63 H108 Cl2 F6 O6 P8 Ru4 S2 -","2","1","","Miyake, Yoshihiro; Nomaguchi, Yohei; Yuki, Masahiro; Nishibayashi, Yoshiaki","Synthesis and Reactivity of Diphosphine-Bridged Diruthenium Complexes","Organometallics","2007","26","14","3611","","10.1021/om070216a","","","0.7107","MoKα","","","0.044","","","","0.113","","","","","","1.071","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073276","11.9463","0.0002","13.3142","0.0001","17.366","0.0005","72.97","0.002","78.2095","0.0018","67.3295","0.0012","2423.86","0.09","173.1","","","","","","","","","","","8","P -1","-P 1","2","","","","- C32 H58 Cl6 F6 O6 P4 Ru2 S2 -","- C32 H58 Cl6 F6 O6 P4 Ru2 S2 -","- C64 H116 Cl12 F12 O12 P8 Ru4 S4 -","2","1","","Miyake, Yoshihiro; Nomaguchi, Yohei; Yuki, Masahiro; Nishibayashi, Yoshiaki","Synthesis and Reactivity of Diphosphine-Bridged Diruthenium Complexes","Organometallics","2007","26","14","3611","","10.1021/om070216a","","","0.71069","MoKα","","","0.0472","","","","0.1157","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073277","18.011","0.0014","18.011","0.0014","12.1888","0.001","90","","90","","120","","3424.3","0.5","173.1","","","","","","","","","","","5","P 32 2 1","P 32 2""","154","","","","- C44 H50 Cl2 P2 Ru2 -","- C44 H50 Cl2 P2 Ru2 -","- C132 H150 Cl6 P6 Ru6 -","3","0.5","","Miyake, Yoshihiro; Nomaguchi, Yohei; Yuki, Masahiro; Nishibayashi, Yoshiaki","Synthesis and Reactivity of Diphosphine-Bridged Diruthenium Complexes","Organometallics","2007","26","14","3611","","10.1021/om070216a","","","0.71069","MoKα","","","0.0311","","","","0.0953","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073278","16.56","0.02","20.274","0.005","16.741","0.012","90","","111.2","0.02","90","","5240","8","123.1","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C48 H55 Cl2 F6 O6.5 P2 Ru2 S2 -","- C48 H50 Cl2 F6 O6.5 P2 Ru2 S2 -","- C192 H200 Cl8 F24 O26 P8 Ru8 S8 -","4","1","","Miyake, Yoshihiro; Nomaguchi, Yohei; Yuki, Masahiro; Nishibayashi, Yoshiaki","Synthesis and Reactivity of Diphosphine-Bridged Diruthenium Complexes","Organometallics","2007","26","14","3611","","10.1021/om070216a","","","0.7107","MoKα","","","0.0724","","","","0.1973","","","","","","1.052","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073279","10.275","0.002","11.594","0.002","16.695","0.003","90","","95.21","0.03","90","","1980.6","0.6","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H32 O Zr -","- C24 H32 O Zr -","- C96 H128 O4 Zr4 -","4","1","","Beweries, Torsten; Jäger-Fiedler, Ulrike; Bach, Marc A.; Burlakov, Vladimir V.; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Ring-Opening Reactions of Tetrahydrofuran versus Alkyne Complexation by Group 4 Metallocene Complexes Leading to General Consequences for Synthesis and Reactions of Metallocene Complexes","Organometallics","2007","26","12","3000","","10.1021/om0702173","","","0.71073","MoKα","","0.0623","0.0473","","","0.1176","0.1242","","","","","","1.046","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073280","14.435","0.003","17.642","0.004","14.496","0.003","90","","103.01","0.03","90","","3596.8","1.4","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21.5 H27.5 Cl Ti -","- C21.5 H27.5 Cl Ti -","- C172 H220 Cl8 Ti8 -","8","2","","Beweries, Torsten; Jäger-Fiedler, Ulrike; Bach, Marc A.; Burlakov, Vladimir V.; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Ring-Opening Reactions of Tetrahydrofuran versus Alkyne Complexation by Group 4 Metallocene Complexes Leading to General Consequences for Synthesis and Reactions of Metallocene Complexes","Organometallics","2007","26","12","3000","","10.1021/om0702173","","","0.71073","MoKα","","0.0622","0.0328","","","0.0732","0.08","","","","","","0.886","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073281","5.9766","0.0002","17.987","0.0007","16.4842","0.0006","90","","95.393","0.001","90","","1764.23","0.11","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-{[(2,6-diisopropylphenyl)amino]methyl}-4-nitrophenol","","- C19 H24 N2 O3 -","- C19 H24 N2 O3 -","- C76 H96 N8 O12 -","4","1","","Occhipinti, Giovanni; Bjørsvik, Hans-René; Törnroos, Karl Wilhelm; Jensen, Vidar R.","Ruthenium Alkylidene Complexes of Chelating Amine Ligands","Organometallics","2007","26","24","5803","","10.1021/om070219n","","","0.71073","MoKα","","0.0546","0.044","","","0.1218","0.1314","","","","","","1.046","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073282","7.4854","0.0003","17.2911","0.0006","10.3006","0.0004","90","","101.464","0.001","90","","1306.62","0.09","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2-hydroxy-5-nitrobenzyl)piperidinium bromide","","- C12 H17 Br N2 O3 -","- C12 H17 Br N2 O3 -","- C48 H68 Br4 N8 O12 -","4","1","","Occhipinti, Giovanni; Bjørsvik, Hans-René; Törnroos, Karl Wilhelm; Jensen, Vidar R.","Ruthenium Alkylidene Complexes of Chelating Amine Ligands","Organometallics","2007","26","24","5803","","10.1021/om070219n","","","0.71073","MoKα","","0.0253","0.0195","","","0.0489","0.0513","","","","","","1.051","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073283","8.9396","0.0003","11.3515","0.0004","11.7548","0.0004","107.068","0.001","96.781","0.001","101.845","0.001","1095.58","0.07","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","2,2'-[(phenylimino)bis(methylene)]bis(4-nitrophenol)","","- C24 H25 N3 O7 -","- C24 H25 N3 O7 -","- C48 H50 N6 O14 -","2","1","","Occhipinti, Giovanni; Bjørsvik, Hans-René; Törnroos, Karl Wilhelm; Jensen, Vidar R.","Ruthenium Alkylidene Complexes of Chelating Amine Ligands","Organometallics","2007","26","24","5803","","10.1021/om070219n","","","0.71073","MoKα","","0.0429","0.0379","","","0.1037","0.1085","","","","","","1.035","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073284","27.083","0.003","25.022","0.003","20.657","0.003","90","","92.588","0.006","90","","13984","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H54 N3 O6 P Ru -","- C45 H54 N3 O6 P Ru -","- C540 H648 N36 O72 P12 Ru12 -","12","3","","Occhipinti, Giovanni; Bjørsvik, Hans-René; Törnroos, Karl Wilhelm; Jensen, Vidar R.","Ruthenium Alkylidene Complexes of Chelating Amine Ligands","Organometallics","2007","26","24","5803","","10.1021/om070219n","","","1.54178","CuKα","","0.1967","0.091","","","0.2151","0.2545","","","","","","0.907","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073285","19.724","0.003","9.398","0.0012","17.039","0.002","90","","115.347","0.002","90","","2854.4","0.7","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H33 Mn O7 P2 Sn -","- C23 H33 Mn O7 P2 Sn -","- C92 H132 Mn4 O28 P8 Sn4 -","4","1","","Albertin, Gabriele; Antoniutti, Stefano; Castro, Jesús; García-Fontán, Soledad; Zanardo, Gianluigi","Preparation and Reactivity of Stannyl Complexes of Manganese and Rhenium","Organometallics","2007","26","11","2918","","10.1021/om070220m","","","0.71073","MoKα","","0.102","0.0533","","","0.1157","0.1282","","","","","","0.925","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073286","17.267","0.003","11.6003","0.0018","18.095","0.003","90","","112.887","0.003","90","","3339.1","1","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H48 O11 P3 Re Sn -","- C20 H48 O11 P3 Re Sn -","- C80 H192 O44 P12 Re4 Sn4 -","4","1","","Albertin, Gabriele; Antoniutti, Stefano; Castro, Jesús; García-Fontán, Soledad; Zanardo, Gianluigi","Preparation and Reactivity of Stannyl Complexes of Manganese and Rhenium","Organometallics","2007","26","11","2918","","10.1021/om070220m","","","0.71073","MoKα","","0.0577","0.0336","","","0.0557","0.0597","","","","","","0.85","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073287","28.12","0.002","10.7089","0.0009","30.4873","0.0017","90","","122.795","0.005","90","","7717.5","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H54 O11 P3 Re Sn -","- C23 H54 O11 P3 Re Sn -","- C184 H432 O88 P24 Re8 Sn8 -","8","2","","Albertin, Gabriele; Antoniutti, Stefano; Castro, Jesús; García-Fontán, Soledad; Zanardo, Gianluigi","Preparation and Reactivity of Stannyl Complexes of Manganese and Rhenium","Organometallics","2007","26","11","2918","","10.1021/om070220m","","","0.71073","MoKα","","0.2602","0.056","","","0.0862","0.1198","","","","","","0.75","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073288","11.1114","0.0011","11.951","0.0013","16.5529","0.0017","109.711","0.002","92.817","0.002","114.348","0.002","1839.3","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H48 O16 P3 Re Sn -","- C22 H48 O16 P3 Re Sn -","- C44 H96 O32 P6 Re2 Sn2 -","2","1","","Albertin, Gabriele; Antoniutti, Stefano; Castro, Jesús; García-Fontán, Soledad; Zanardo, Gianluigi","Preparation and Reactivity of Stannyl Complexes of Manganese and Rhenium","Organometallics","2007","26","11","2918","","10.1021/om070220m","","","0.71073","MoKα","","0.0684","0.0459","","","0.09","0.0965","","","","","","0.897","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073289","15.5842","0.0019","14.072","0.003","20.847","0.003","90","","95.165","0.017","90","","4553.2","1.3","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C53 H46 F8 N4 O -","- C53 H46 F8 N4 O -","- C212 H184 F32 N16 O4 -","4","1","","Pilz, Maurice Frederic; Limberg, Christian; Lazarov, Boyan B.; Hultzsch, Kai C.; Ziemer, Burkhard","Dinuclear Zinc Complexes Based on Parallel β-Diiminato Binding Sites: Syntheses, Structures, and Properties as CO2/Epoxide Copolymerization Catalysts","Organometallics","2007","26","15","3668","","10.1021/om070221e","","","0.71073","MoKα","","0.2041","0.0591","","","0.0822","0.114","","","","","","0.67","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073290","16.073","0.005","16.716","0.005","18.411","0.007","90","","90","","90","","4947","3","100","2","100","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C54 H47 Cl3 F8 N4 O -","- C54 H47 Cl3 F8 N4 O -","- C216 H188 Cl12 F32 N16 O4 -","4","0.5","","Pilz, Maurice Frederic; Limberg, Christian; Lazarov, Boyan B.; Hultzsch, Kai C.; Ziemer, Burkhard","Dinuclear Zinc Complexes Based on Parallel β-Diiminato Binding Sites: Syntheses, Structures, and Properties as CO2/Epoxide Copolymerization Catalysts","Organometallics","2007","26","15","3668","","10.1021/om070221e","","","0.71073","MoKα","","0.1339","0.1134","","","0.2277","0.2388","","","","","","1.213","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073291","15.955","0.0018","18.698","0.003","22.696","0.002","90","","91.216","0.013","90","","6769.3","1.5","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C73 H86 F8 N4 O5 Zn2 -","- C73 H86 F8 N4 O5 Zn2 -","- C292 H344 F32 N16 O20 Zn8 -","4","1","","Pilz, Maurice Frederic; Limberg, Christian; Lazarov, Boyan B.; Hultzsch, Kai C.; Ziemer, Burkhard","Dinuclear Zinc Complexes Based on Parallel β-Diiminato Binding Sites: Syntheses, Structures, and Properties as CO2/Epoxide Copolymerization Catalysts","Organometallics","2007","26","15","3668","","10.1021/om070221e","","","0.71073","MoKα","","0.0681","0.0433","","","0.1039","0.1118","","","","","","0.923","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073292","16.806","0.003","17.11","0.003","20.756","0.003","102.129","0.019","93.16","0.02","99.35","0.02","5732.9","1.8","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C65 H78 N4 O Zn2 -","- C65 H78 N4 O Zn2 -","- C260 H312 N16 O4 Zn8 -","4","2","","Pilz, Maurice Frederic; Limberg, Christian; Lazarov, Boyan B.; Hultzsch, Kai C.; Ziemer, Burkhard","Dinuclear Zinc Complexes Based on Parallel β-Diiminato Binding Sites: Syntheses, Structures, and Properties as CO2/Epoxide Copolymerization Catalysts","Organometallics","2007","26","15","3668","","10.1021/om070221e","","","0.71073","MoKα","","0.072","0.039","","","0.0762","0.0835","","","","","","0.85","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073293","16.976","0.003","17.897","0.003","24.587","0.004","97.68","0.02","101.64","0.02","91.66","0.02","7239","2","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","(Me2C6H3Xanthdim)(Zn(SO2Et)2)2","","- C134 H164 N8 O11 S4 Zn4 -","- C134 H164 N8 O11 S4 Zn4 -","- C268 H328 N16 O22 S8 Zn8 -","2","1","","Pilz, Maurice Frederic; Limberg, Christian; Lazarov, Boyan B.; Hultzsch, Kai C.; Ziemer, Burkhard","Dinuclear Zinc Complexes Based on Parallel β-Diiminato Binding Sites: Syntheses, Structures, and Properties as CO2/Epoxide Copolymerization Catalysts","Organometallics","2007","26","15","3668","","10.1021/om070221e","","","0.71073","MoKα","","0.2691","0.0808","","","0.1921","0.261","","","","","","0.711","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073294","12.0519","0.0015","12.397","0.0016","12.8787","0.0016","68.495","0.002","74.493","0.002","77.091","0.002","1708.1","0.4","163","2","163","2","","","","","","","","4","P -1","-P 1","2","","","","- C71 H104 La2 O8 -","- C71 H103 La2 O8 -","- C71 H103 La2 O8 -","1","0.5","","Evans, William J.; Rego, Daniel B.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Facile Insertion of CO2into Tetra- and Pentamethylcyclopentadienyl Lanthanide Moieties To Form (C5Me4RCO2)-Carboxylate Ligands (R = H, Me)","Organometallics","2007","26","19","4737","","10.1021/om070223z","","","0.71073","MoKα","","0.02","0.0185","","","0.0459","0.0467","","","","","","1.064","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4073295","8.572","0.003","17.91","0.006","22.612","0.007","90","","95.777","0.005","90","","3454","2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","UCI-DBR-2","","","- C30 H50 Cl2 K La O6 -","- C30 H50 Cl2 K La O6 -","- C120 H200 Cl8 K4 La4 O24 -","4","1","","Evans, William J.; Rego, Daniel B.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Facile Insertion of CO2into Tetra- and Pentamethylcyclopentadienyl Lanthanide Moieties To Form (C5Me4RCO2)-Carboxylate Ligands (R = H, Me)","Organometallics","2007","26","19","4737","","10.1021/om070223z","","","0.71069","MoKα","","0.0303","0.0256","","","0.0594","0.0613","","","","","","1.07","","","","has coordinates,has disorder","204147","2020-10-21","18:00:00",""
"4073296","17.136","0.003","25.01","0.004","13.844","0.002","90","","100.998","0.003","90","","5824.2","1.6","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","DBR-La-CO2","","","- C56 H78 La2 O4 -","- C56 H76 La2 O4 -","- C224 H304 La8 O16 -","4","0.5","","Evans, William J.; Rego, Daniel B.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Facile Insertion of CO2into Tetra- and Pentamethylcyclopentadienyl Lanthanide Moieties To Form (C5Me4RCO2)-Carboxylate Ligands (R = H, Me)","Organometallics","2007","26","19","4737","","10.1021/om070223z","","","0.71073","MoKα","","0.0468","0.0401","","","0.1192","0.1229","","","","","","1.065","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4073297","12.3337","0.0001","12.3337","0.0001","12.3337","0.0001","112.92","0.02","112.92","0.02","112.92","0.02","1225.8","0.9","100","","100","","","","","","","","diethylether","6","R -3 :R","-P 3*","148","","trifluoromethanesulphonate-(η^3^-allyl)-palladium(ii)","","- C4 H5 F3 O3 Pd S -","- C4 H5 F3 O3 Pd S -","- C24 H30 F18 O18 Pd6 S6 -","6","1","","Chernyshova, Eleonora S.; Goddard, Richard; Pörschke, Klaus-Richard","Mononuclear NHC−Pd−π-Allyl Complexes Containing Weakly Coordinating Ligands","Organometallics","2007","26","13","3236","","10.1021/om0702274","","","0.71073","MoKα","","0.0203","0.0194","","","0.0449","0.0453","","","","","","1.136","","","","has coordinates","178621","2020-10-21","18:00:00",""
"4073298","10.2875","0.0002","12.6052","0.0003","16.3796","0.0003","90","","90","","90","","2124.04","0.08","100","","100","","","","","","","","tetrahydrofuran","7","P 21 21 21","P 2ac 2ab","19","","(η^3^-allyl)-(tetrahydrofuran-O)-(1,3-bis(tert-butyl)- imidazol-2-ylidine)-palladium(ii) tetrafluoroborate","","- C18 H33 B F4 N2 O Pd -","- C18 H32.629 B F4 N2 O Pd -","- C72 H130.516 B4 F16 N8 O4 Pd4 -","4","1","","Chernyshova, Eleonora S.; Goddard, Richard; Pörschke, Klaus-Richard","Mononuclear NHC−Pd−π-Allyl Complexes Containing Weakly Coordinating Ligands","Organometallics","2007","26","13","3236","","10.1021/om0702274","","","0.71073","MoKα","","0.0291","0.0268","","","0.0594","0.0604","","","","","","1.07","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073299","12.7245","0.0002","24.8421","0.0005","12.9234","0.0002","90","","93.908","0.001","90","","4075.63","0.12","100","","100","","","","","","","","dichloromethane/pentane","7","P 1 21/n 1","-P 2yn","14","","1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene- (dichloromethane-Cl)-(η^3^-allyl)palladium hexafluorophosphate di-dichloromethane solvate","","- C33 H47 Cl6 F6 N2 P Pd -","- C33 H46.72 Cl6 F6 N2 P Pd -","- C132 H186.88 Cl24 F24 N8 P4 Pd4 -","4","1","","Chernyshova, Eleonora S.; Goddard, Richard; Pörschke, Klaus-Richard","Mononuclear NHC−Pd−π-Allyl Complexes Containing Weakly Coordinating Ligands","Organometallics","2007","26","13","3236","","10.1021/om0702274","","","0.71073","MoKα","","0.0762","0.061","","","0.1223","0.1275","","","","","","1.189","","","","has coordinates,has disorder","178621","2020-10-21","18:00:00",""
"4073300","8.5926","0.0005","9.9062","0.0005","10.5937","0.0005","103.688","0.002","90.954","0.002","97.222","0.002","868.17","0.08","100","","100","","","","","","","","toluene","6","P -1","-P 1","2","","(η^3^-allyl)-(tetrafluoroborato-F)-(1,3-bis(tert-butyl)- imidazol-2-ylidine)-palladium(ii)","","- C14 H25 B F4 N2 Pd -","- C14 H24.5 B F4 N2 Pd -","- C28 H49 B2 F8 N4 Pd2 -","2","1","","Chernyshova, Eleonora S.; Goddard, Richard; Pörschke, Klaus-Richard","Mononuclear NHC−Pd−π-Allyl Complexes Containing Weakly Coordinating Ligands","Organometallics","2007","26","13","3236","","10.1021/om0702274","","","0.71073","MoKα","","0.0546","0.0427","","","0.0855","0.09","","","","","","1.114","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073301","10.681","0.003","12.141","0.004","17.176","0.004","75.483","0.014","80.656","0.015","66.124","0.013","1967","1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H54 B4 N4 Zn -","- C40 H54 B4 N4 Zn -","- C80 H108 B8 N8 Zn2 -","2","1","","Ly, Hanh V.; Forster, Taryn D.; Parvez, Masood; McDonald, Robert; Roesler, Roland","Zinc, Cadmium, and Mercury Metallocenes Incorporating 1,2-Diaza-3,5-diborolyl Ligands","Organometallics","2007","26","14","3516","","10.1021/om070230n","","","0.71073","MoKα","","0.0549","0.0417","","","0.1018","0.1094","","","","","","1.017","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073302","9.396","0.002","21.241","0.007","21.107","0.007","90","","96.85","0.02","90","","4182","2","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C16 H34 B2 Br0.5 Cd0.5 Li0.5 N2 O1.5 -","- C16 H34 B2 Br0.5 Cd0.5 Li0.5 N2 O1.5 -","- C128 H272 B16 Br4 Cd4 Li4 N16 O12 -","8","2","","Ly, Hanh V.; Forster, Taryn D.; Parvez, Masood; McDonald, Robert; Roesler, Roland","Zinc, Cadmium, and Mercury Metallocenes Incorporating 1,2-Diaza-3,5-diborolyl Ligands","Organometallics","2007","26","14","3516","","10.1021/om070230n","","","0.71073","MoKα","","0.0538","0.0383","","","0.0882","0.0974","","","","","","1.044","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073303","10.94","0.003","12.001","0.004","16.987","0.005","76.011","0.016","80.947","0.016","66.866","0.016","1985.2","1.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H54 B4 Cd N4 -","- C40 H54 B4 Cd N4 -","- C80 H108 B8 Cd2 N8 -","2","1","","Ly, Hanh V.; Forster, Taryn D.; Parvez, Masood; McDonald, Robert; Roesler, Roland","Zinc, Cadmium, and Mercury Metallocenes Incorporating 1,2-Diaza-3,5-diborolyl Ligands","Organometallics","2007","26","14","3516","","10.1021/om070230n","","","0.71073","MoKα","","0.0812","0.0605","","","0.1771","0.1894","","","","","","1.118","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073304","16.0954","0.0015","15.2954","0.0015","11.3501","0.0011","90","","101.249","0.0013","90","","2740.6","0.5","193","2","193","2","","","","","","","","5","I 1 2/m 1","-I 2y","12","","","","- C20 H46 B4 Hg N4 -","- C20 H46.5 B4 Hg N4 -","- C80 H186 B16 Hg4 N16 -","4","0.5","","Ly, Hanh V.; Forster, Taryn D.; Parvez, Masood; McDonald, Robert; Roesler, Roland","Zinc, Cadmium, and Mercury Metallocenes Incorporating 1,2-Diaza-3,5-diborolyl Ligands","Organometallics","2007","26","14","3516","","10.1021/om070230n","","","0.71073","MoKα","","0.0216","0.0196","","","0.0487","0.0499","","","","","","1.082","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073305","6.755","0.006","19.491","0.009","20.603","0.01","90","","93.47","0.04","90","","2708","3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21.25 H30 B2 Cl3 N2 Si -","- C21.25 H27 B2 Cl3 N2 Si -","- C85 H108 B8 Cl12 N8 Si4 -","4","1","","Ly, Hanh V.; Forster, Taryn D.; Parvez, Masood; McDonald, Robert; Roesler, Roland","Zinc, Cadmium, and Mercury Metallocenes Incorporating 1,2-Diaza-3,5-diborolyl Ligands","Organometallics","2007","26","14","3516","","10.1021/om070230n","","","0.71073","MoKα","","0.1196","0.0656","","","0.1552","0.1892","","","","","","1.107","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073306","12.519","0.003","17.679","0.004","15.887","0.003","90","","110.865","0.004","90","","3285.6","1.3","218","2","218","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H27 Cl5 Cr Tl -","- C36 H27 Cl5 Cr Tl -","- C144 H108 Cl20 Cr4 Tl4 -","4","1","","Davis, K. Brian; Harris, T. David; Castellani, Michael P.; Golen, James A.; Rheingold, Arnold L.","Synthesis and X-ray Crystal Structure of [(C5Ph5)CrCl(μ-Cl)2Tl]2: An Example of the Rare M−X−TlILinkage (X = Halide)","Organometallics","2007","26","19","4843","","10.1021/om070231f","","","0.71073","MoKα","","0.0496","0.0361","","","0.0831","0.0887","","","","","","1.022","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073307","16.225","0.003","11.999","0.003","32.866","0.006","90","","97.654","0.004","90","","6341","2","203","1","203","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H47 Lu N2 Si2 -","- C28 H32 Lu N2 Si2 -","- C224 H256 Lu8 N16 Si16 -","8","2","","Jantunen, Kimberly C.; Scott, Brian L.; Gordon, John C.; Kiplinger, Jaqueline L.","Reactivity of (C5Me5)Lu(CH2SiMe3)2(THF) with Pyridine Ring Systems: Synthesis and Structural Characterization of an η2-(N,C)-Pyridyl (Mono)pentamethylcyclopentadienyl Lutetium(III) Complex","Organometallics","2007","26","10","2777","","10.1021/om0702330","","","0.71073","MoKα","","0.1163","0.0688","","","0.1378","0.1498","","","","","","1.277","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073308","10.734","0.003","7.955","0.002","15.068","0.005","90","","102.85","0.004","90","","1254.4","0.6","203","2","203","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H35 Lu N2 Si -","- C24 H35 Lu N2 Si -","- C48 H70 Lu2 N4 Si2 -","2","1","","Jantunen, Kimberly C.; Scott, Brian L.; Gordon, John C.; Kiplinger, Jaqueline L.","Reactivity of (C5Me5)Lu(CH2SiMe3)2(THF) with Pyridine Ring Systems: Synthesis and Structural Characterization of an η2-(N,C)-Pyridyl (Mono)pentamethylcyclopentadienyl Lutetium(III) Complex","Organometallics","2007","26","10","2777","","10.1021/om0702330","","","0.71073","MoKα","","0.0523","0.0413","","","0.0957","0.1012","","","","","","1.033","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073309","10.548","0.006","21.289","0.011","23.14","0.012","90","","91.923","0.008","90","","5193","5","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H34 N Si2 Y -","- C26 H34 N Si2 Y -","- C208 H272 N8 Si16 Y8 -","8","2","","Zhou, Shuangliu; Wang, Shaowu; Yang, Gaosheng; Li, Qinghai; Zhang, Lijun; Yao, Zijian; Zhou, Zhangkai; Song, Hai-bin","Synthesis, Structure, and Diverse Catalytic Activities of [Ethylenebis(indenyl)]lanthanide(III) Amides on N−H and C−H Addition to Carbodiimides andɛ-Caprolactone Polymerization","Organometallics","2007","26","15","3755","","10.1021/om070234s","","","0.7107","MoKα","","0.1043","0.0655","","","0.1339","0.1533","","","","","","1.071","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073310","9.618","0.003","17.742","0.007","30.754","0.01","90","","91.96","0.03","90","","5245","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H34 N Si2 Sm -","- C26 H34 N Si2 Sm -","- C208 H272 N8 Si16 Sm8 -","8","2","","Zhou, Shuangliu; Wang, Shaowu; Yang, Gaosheng; Li, Qinghai; Zhang, Lijun; Yao, Zijian; Zhou, Zhangkai; Song, Hai-bin","Synthesis, Structure, and Diverse Catalytic Activities of [Ethylenebis(indenyl)]lanthanide(III) Amides on N−H and C−H Addition to Carbodiimides andɛ-Caprolactone Polymerization","Organometallics","2007","26","15","3755","","10.1021/om070234s","","","0.71073","MoKα","","0.1021","0.0597","","","0.1201","0.1373","","","","","","1.055","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073311","8.5537","0.0011","16.863","0.002","10.0178","0.0013","90","","90","","90","","1445","0.3","293","2","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C15 H20 N2 -","- C15 H20 N2 -","- C60 H80 N8 -","4","1","","Zhou, Shuangliu; Wang, Shaowu; Yang, Gaosheng; Li, Qinghai; Zhang, Lijun; Yao, Zijian; Zhou, Zhangkai; Song, Hai-bin","Synthesis, Structure, and Diverse Catalytic Activities of [Ethylenebis(indenyl)]lanthanide(III) Amides on N−H and C−H Addition to Carbodiimides andɛ-Caprolactone Polymerization","Organometallics","2007","26","15","3755","","10.1021/om070234s","","","0.71073","MoKα","","0.0738","0.0477","","","0.1273","0.1465","","","","","","1.005","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073312","8.851","0.0011","14.2184","0.0018","14.9359","0.0017","90","","95.772","0.005","90","","1870.1","0.4","113","2","113","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H33 N3 -","- C19 H33 N3 -","- C76 H132 N12 -","4","1","","Zhou, Shuangliu; Wang, Shaowu; Yang, Gaosheng; Li, Qinghai; Zhang, Lijun; Yao, Zijian; Zhou, Zhangkai; Song, Hai-bin","Synthesis, Structure, and Diverse Catalytic Activities of [Ethylenebis(indenyl)]lanthanide(III) Amides on N−H and C−H Addition to Carbodiimides andɛ-Caprolactone Polymerization","Organometallics","2007","26","15","3755","","10.1021/om070234s","","","0.7107","MoKα","","0.0735","0.0592","","","0.1316","0.1411","","","","","","1.122","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073313","8.035","0.002","10.948","0.003","22.256","0.003","90","","90","","90","","1957.8","0.8","103","2","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H34 O Zr -","- C21 H33.783 O Zr -","- C84 H135.132 O4 Zr4 -","4","1","","Gurubasavaraj, Prabhuodeyara M.; Roesky, Herbert W.; Sharma, Prabhuodeyara M. Veeresha; Oswald, Rainer B.; Dolle, Volker; Herbst-Irmer, Regine; Pal, Aritra","Oxygen Effect in Heterobimetallic Catalysis: The Zr−O−Ti System as an Excellent Example for Olefin Polymerization‡","Organometallics","2007","26","14","3346","","10.1021/om070235k","","","0.71073","MoKα","","0.0252","0.025","","","0.0621","0.0625","","","","","","1.193","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073314","8.601","0.002","15.399","0.002","23.084","0.003","90","","94.41","0.02","90","","3048.4","0.9","100","2","100","2","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C33 H54 O Ti Zr -","- C33 H54 O Ti Zr -","- C132 H216 O4 Ti4 Zr4 -","4","2","","Gurubasavaraj, Prabhuodeyara M.; Roesky, Herbert W.; Sharma, Prabhuodeyara M. Veeresha; Oswald, Rainer B.; Dolle, Volker; Herbst-Irmer, Regine; Pal, Aritra","Oxygen Effect in Heterobimetallic Catalysis: The Zr−O−Ti System as an Excellent Example for Olefin Polymerization‡","Organometallics","2007","26","14","3346","","10.1021/om070235k","","","1.54178","CuKα","","0.058","0.0496","","","0.1325","0.1377","","","","","","1.017","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073315","13.1319","0.0015","13.4079","0.0015","22.577","0.003","91.468","0.01","98.749","0.01","90.85","0.009","3926.9","0.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C83 H35 B F41 Si2 -","- C83 H35 B F41 Si2 -","- C166 H70 B2 F82 Si4 -","2","1","","Panisch, Robin; Bolte, Michael; Müller, Thomas","Structure and Bonding in Bissilylated Arenium Ions†","Organometallics","2007","26","14","3524","","10.1021/om0702375","","","0.71073","MoKα","","0.1793","0.0801","","","0.1602","0.2001","","","","","","0.965","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073316","8.847","0.0006","13.101","0.0009","16.44","0.0016","77.64","0.002","82.649","0.002","77.564","0.006","1810.9","0.3","173","1","173","1","","","","","","","","7","P -1","-P 1","2","","","","- C32 H17 Cl Cr2 N2 O11 Ru2 -","- C32 H17 Cl Cr2 N2 O11 Ru2 -","- C64 H34 Cl2 Cr4 N4 O22 Ru4 -","2","1","","Hijazi, Akram; Djukic, Jean-Pierre; Allouche, Lionel; de Cian, André; Pfeffer, Michel; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective Cyclometalation of Planar Pro-chiral (η6-Arene)tricarbonylchromium Complexes withOC-6-[Ru(CO)2Cl2]n","Organometallics","2007","26","17","4180","","10.1021/om070239p","","","0.71073","MoKα","","0.1081","0.0617","","","0.1455","0.1642","","","","","","1.013","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073317","16.297","0.001","28.842","0.001","13.838","0.001","90","","91.436","0.001","90","","6502.3","0.7","150","0.1","150","0.1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H23 Cl Cr N2 O9 Ru2 -","- C32 H23 Cl Cr N2 O9 Ru2 -","- C256 H184 Cl8 Cr8 N16 O72 Ru16 -","8","2","","Hijazi, Akram; Djukic, Jean-Pierre; Allouche, Lionel; de Cian, André; Pfeffer, Michel; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective Cyclometalation of Planar Pro-chiral (η6-Arene)tricarbonylchromium Complexes withOC-6-[Ru(CO)2Cl2]n","Organometallics","2007","26","17","4180","","10.1021/om070239p","","","0.71069","MoKα","","0.1063","0.0816","","","0.268","0.2905","","","","","","1.056","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073318","9.652","0.0002","15.492","0.0003","17.466","0.0003","68.621","0.001","84.502","0.0009","73.451","0.0008","2331.12","0.08","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C52 H38 Cl2 Cr N2 O5 P2 Ru -","- C52 H38 Cl2 Cr N2 O5 P2 Ru -","- C104 H76 Cl4 Cr2 N4 O10 P4 Ru2 -","2","1","","Hijazi, Akram; Djukic, Jean-Pierre; Allouche, Lionel; de Cian, André; Pfeffer, Michel; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective Cyclometalation of Planar Pro-chiral (η6-Arene)tricarbonylchromium Complexes withOC-6-[Ru(CO)2Cl2]n","Organometallics","2007","26","17","4180","","10.1021/om070239p","","","0.71073","MoKα","","0.0871","0.049","","","0.1025","0.1167","","","","","","1.047","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073319","8.533","0.001","17.422","0.001","14.069","0.001","90","","95.806","0.001","90","","2080.8","0.3","150","0.1","150","0.1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C21 H13 Cl Cr N2 O5 Ru -","- C21 H13 Cl Cr N2 O5 Ru -","- C84 H52 Cl4 Cr4 N8 O20 Ru4 -","4","1","","Hijazi, Akram; Djukic, Jean-Pierre; Allouche, Lionel; de Cian, André; Pfeffer, Michel; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective Cyclometalation of Planar Pro-chiral (η6-Arene)tricarbonylchromium Complexes withOC-6-[Ru(CO)2Cl2]n","Organometallics","2007","26","17","4180","","10.1021/om070239p","","","0.71069","MoKα","","0.05","0.0333","","","0.0806","0.088","","","","","","1.008","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073320","11.513","0.0008","13.35","0.0009","14.588","0.0012","116.896","0.005","101.656","0.004","96.7","0.005","1902","0.3","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H28 Cl6 Fe2 N2 O4 Ru2 -","- C36 H26 Cl6 Fe2 N2 O4 Ru2 -","- C72 H52 Cl12 Fe4 N4 O8 Ru4 -","2","1","","Hijazi, Akram; Djukic, Jean-Pierre; Allouche, Lionel; de Cian, André; Pfeffer, Michel; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective Cyclometalation of Planar Pro-chiral (η6-Arene)tricarbonylchromium Complexes withOC-6-[Ru(CO)2Cl2]n","Organometallics","2007","26","17","4180","","10.1021/om070239p","","","0.71073","MoKα","","0.1871","0.1099","","","0.1729","0.2031","","","","","","1.07","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073321","10.137","0.001","14.365","0.001","16.712","0.001","84.883","0.001","76.604","0.001","78.399","0.001","2316.7","0.3","150","0.1","150","0.1","","","","","","","","8","P -1","-P 1","2","","","","- C53 H42 Cl2 Fe N2 O2 P2 Ru -","- C53 H42 Cl2 Fe N2 O2 P2 Ru -","- C106 H84 Cl4 Fe2 N4 O4 P4 Ru2 -","2","1","","Hijazi, Akram; Djukic, Jean-Pierre; Allouche, Lionel; de Cian, André; Pfeffer, Michel; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective Cyclometalation of Planar Pro-chiral (η6-Arene)tricarbonylchromium Complexes withOC-6-[Ru(CO)2Cl2]n","Organometallics","2007","26","17","4180","","10.1021/om070239p","","","0.71069","MoKα","","0.0412","0.0315","","","0.0834","0.0875","","","","","","1.059","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073322","6.536","0.001","8.366","0.001","18.743","0.001","81.955","0.001","84.08","0.001","85.724","0.001","1007.5","0.2","150","0.1","150","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C21 H15 Cr N O7 Ru -","- C21 H15 Cr N O7 Ru -","- C42 H30 Cr2 N2 O14 Ru2 -","2","1","","Hijazi, Akram; Djukic, Jean-Pierre; Allouche, Lionel; de Cian, André; Pfeffer, Michel; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective Cyclometalation of Planar Pro-chiral (η6-Arene)tricarbonylchromium Complexes withOC-6-[Ru(CO)2Cl2]n","Organometallics","2007","26","17","4180","","10.1021/om070239p","","","0.71069","MoKα","","0.0568","0.046","","","0.1175","0.1246","","","","","","1.078","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073323","14.161","0.001","13.992","0.001","15.274","0.001","90","","105.695","0.001","90","","2913.6","0.3","150","0.1","150","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32.5 H21.5 Cr N3 O7.5 Ru -","- C31 H17 Cr N3 O7 Ru -","- C124 H68 Cr4 N12 O28 Ru4 -","4","1","","Hijazi, Akram; Djukic, Jean-Pierre; Allouche, Lionel; de Cian, André; Pfeffer, Michel; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective Cyclometalation of Planar Pro-chiral (η6-Arene)tricarbonylchromium Complexes withOC-6-[Ru(CO)2Cl2]n","Organometallics","2007","26","17","4180","","10.1021/om070239p","","","0.71069","MoKα","","0.0484","0.0407","","","0.1342","0.1396","","","","","","1.113","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073324","13.137","0.001","11.616","0.001","17.177","0.001","90","","92.078","0.001","90","","2619.5","0.3","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H21 Fe N3 O4 Ru -","- C32 H21 Fe N3 O4 Ru -","- C128 H84 Fe4 N12 O16 Ru4 -","4","1","","Hijazi, Akram; Djukic, Jean-Pierre; Allouche, Lionel; de Cian, André; Pfeffer, Michel; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective Cyclometalation of Planar Pro-chiral (η6-Arene)tricarbonylchromium Complexes withOC-6-[Ru(CO)2Cl2]n","Organometallics","2007","26","17","4180","","10.1021/om070239p","","","0.71069","MoKα","","0.0585","0.0357","","","0.0826","0.0901","","","","","","0.995","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073325","9.101","0.001","10.307","0.001","16.428","0.001","90","","95.1","0.001","90","","1534.9","0.2","150","0.1","150","0.1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C35 H25 Cr N3 O7 Ru -","- C35 H25 Cr N3 O7 Ru -","- C70 H50 Cr2 N6 O14 Ru2 -","2","1","","Hijazi, Akram; Djukic, Jean-Pierre; Allouche, Lionel; de Cian, André; Pfeffer, Michel; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective Cyclometalation of Planar Pro-chiral (η6-Arene)tricarbonylchromium Complexes withOC-6-[Ru(CO)2Cl2]n","Organometallics","2007","26","17","4180","","10.1021/om070239p","","","0.71073","MoKα","","0.0246","0.0238","","","0.0648","0.0657","","","","","","1.024","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073326","10.785","0.001","11.946","0.001","26.128","0.001","90","","90","","90","","3366.3","0.4","150","0.1","150","0.1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C36 H27 Cl2 Cr N3 O7 Ru -","- C36 H27 Cl2 Cr N3 O7 Ru -","- C144 H108 Cl8 Cr4 N12 O28 Ru4 -","4","1","","Hijazi, Akram; Djukic, Jean-Pierre; Allouche, Lionel; de Cian, André; Pfeffer, Michel; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective Cyclometalation of Planar Pro-chiral (η6-Arene)tricarbonylchromium Complexes withOC-6-[Ru(CO)2Cl2]n","Organometallics","2007","26","17","4180","","10.1021/om070239p","","","0.71069","MoKα","","0.0385","0.0351","","","0.0919","0.0938","","","","","","1.05","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073327","9.6","0.001","13.46","0.001","23.374","0.001","90","","90","","90","","3020.3","0.4","150","0.1","150","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H29 Fe N3 O4 Ru -","- C36 H29 Fe N3 O4 Ru -","- C144 H116 Fe4 N12 O16 Ru4 -","4","1","","Hijazi, Akram; Djukic, Jean-Pierre; Allouche, Lionel; de Cian, André; Pfeffer, Michel; Le Goff, Xavier-Frédéric; Ricard, Louis","Stereoselective Cyclometalation of Planar Pro-chiral (η6-Arene)tricarbonylchromium Complexes withOC-6-[Ru(CO)2Cl2]n","Organometallics","2007","26","17","4180","","10.1021/om070239p","","","0.71069","MoKα","","0.0262","0.0248","","","0.0656","0.0666","","","","","","1.032","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073328","17.021","0.002","16.803","0.002","7.9054","0.0011","90","","90","","90","","2261","0.5","100","2","100","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C21 H24 Cl3 Ga N2 -","- C21 H24 Cl3 Ga N2 -","- C84 H96 Cl12 Ga4 N8 -","4","1","","Marion, Nicolas; Escudero-Adán, Eduardo C.; Benet-Buchholz, Jordi; Stevens, Edwin D.; Fensterbank, Louis; Malacria, Max; Nolan, Steven P.","Synthesis, Characterization, and Structure of [GaCl3(NHC)] Complexes","Organometallics","2007","26","13","3256","","10.1021/om070241g","","","0.71073","MoKα","","0.0655","0.0473","","","0.1116","0.1193","","","","","","1.05","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073329","9.3044","0.0014","9.5428","0.0014","10.446","0.0016","100.038","0.003","94.926","0.003","117.304","0.002","796.8","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H20 Cl3 Ga N2 -","- C11 H20 Cl3 Ga N2 -","- C22 H40 Cl6 Ga2 N4 -","2","1","","Marion, Nicolas; Escudero-Adán, Eduardo C.; Benet-Buchholz, Jordi; Stevens, Edwin D.; Fensterbank, Louis; Malacria, Max; Nolan, Steven P.","Synthesis, Characterization, and Structure of [GaCl3(NHC)] Complexes","Organometallics","2007","26","13","3256","","10.1021/om070241g","","","0.71073","MoKα","","0.0486","0.0456","","","0.1221","0.1236","","","","","","1.134","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073330","18.3566","0.0008","16.1415","0.0007","20.1819","0.0008","90","","103.058","0.001","90","","5825.3","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H36 Cl3 Ga N2 -","- C27 H36 Cl3 Ga N2 -","- C216 H288 Cl24 Ga8 N16 -","8","2","","Marion, Nicolas; Escudero-Adán, Eduardo C.; Benet-Buchholz, Jordi; Stevens, Edwin D.; Fensterbank, Louis; Malacria, Max; Nolan, Steven P.","Synthesis, Characterization, and Structure of [GaCl3(NHC)] Complexes","Organometallics","2007","26","13","3256","","10.1021/om070241g","","","0.71073","MoKα","","0.0264","0.0236","","","0.0666","0.0687","","","","","","0.923","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073331","8.4275","0.0004","17.1273","0.0008","9.8083","0.0005","90","","100.015","0.004","90","","1394.16","0.12","180","2","180","","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 N2 Zr2 -","- C36 H34 N2 Zr2 -","- C72 H68 N4 Zr4 -","2","0.5","","Choukroun, Robert; Lorber, Christian; Vendier, Laure","CC and CN Coupling of Nitriles Mediated by B(C6F5)3and Cp2ZrPh2","Organometallics","2007","26","15","3784","","10.1021/om700261m","","","","MoKα","","0.0257","0.0221","","","0.0552","0.0564","","","","","","1.076","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073332","27.057","0.005","9.938","0.002","16.465","0.003","90","","103.1","0.03","90","","4312.1","1.5","180","","180","","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H36 F6 N2 Zr2 -","- C48 H36 F6 N2 Zr2 -","- C192 H144 F24 N8 Zr8 -","4","0.5","","Choukroun, Robert; Lorber, Christian; Vendier, Laure","CC and CN Coupling of Nitriles Mediated by B(C6F5)3and Cp2ZrPh2","Organometallics","2007","26","15","3784","","10.1021/om700261m","","","0.71073","MoKα","","0.0463","0.0384","","","0.1045","0.1084","","","","","","1.057","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073333","11.8872","0.0012","14.1704","0.0014","14.228","0.0016","89.479","0.013","74.665","0.013","75.927","0.012","2238","0.4","180","","180","","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C52.5 H29 B F18 N Zr -","- C52.5 H29 B F18 N Zr -","- C105 H58 B2 F36 N2 Zr2 -","2","1","","Choukroun, Robert; Lorber, Christian; Vendier, Laure","CC and CN Coupling of Nitriles Mediated by B(C6F5)3and Cp2ZrPh2","Organometallics","2007","26","15","3784","","10.1021/om700261m","","","0.71073","MoKα","","0.0511","0.0414","","","0.1081","0.113","","","","","","1.065","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073334","30.7452","0.0017","14.0485","0.0007","18.9224","0.0009","90","","102.14","0.004","90","","7990.3","0.7","180","2","180","","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H23 B F15 N3 Zr -","- C40 H23 B F15 N3 Zr -","- C320 H184 B8 F120 N24 Zr8 -","8","1","","Choukroun, Robert; Lorber, Christian; Vendier, Laure","CC and CN Coupling of Nitriles Mediated by B(C6F5)3and Cp2ZrPh2","Organometallics","2007","26","15","3784","","10.1021/om700261m","","","0.71073","MoKα","","0.0459","0.0326","","","0.0802","0.0856","","","","","","0.994","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073335","12.5777","0.0012","13.86","0.003","17.955","0.002","98.313","0.013","104.66","0.009","116.4","0.02","2590.2","0.9","180","","180","","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C50 H22 B F21 N2 Zr -","- C50 H22 B F21 N2 Zr -","- C100 H44 B2 F42 N4 Zr2 -","2","1","","Choukroun, Robert; Lorber, Christian; Vendier, Laure","CC and CN Coupling of Nitriles Mediated by B(C6F5)3and Cp2ZrPh2","Organometallics","2007","26","15","3784","","10.1021/om700261m","","","","MoKα","","0.0851","0.0635","","","0.1627","0.1772","","","","","","0.975","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073336","14.266","0.006","24.292","0.009","21.352","0.008","90","","92.193","0.003","90","","7394","5","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C83 H100 F3 Ir N2 O5 P2 S -","- C83 H100 F3 Ir N2 O5 P2 S -","- C332 H400 F12 Ir4 N8 O20 P8 S4 -","4","1","","Hayashi, Akito; Ishiyama, Takeshi; Okazaki, Masaaki; Ozawa, Fumiyuki","Cationic Iridium(III) Complexes Bearing Phosphaalkene and 2-Pyridylphenyl Ligands","Organometallics","2007","26","15","3708","","10.1021/om700275s","","","0.7107","MoKα","","0.0907","0.0604","","","0.1052","0.1164","","","","","","1.112","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073337","8.848","0.0006","8.9371","0.0007","13.1055","0.001","94.364","0.001","108.365","0.002","100.267","0.001","958.04","0.12","243","2","243","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H54 Mo O4 P2 -","- C40 H54 Mo O4 P2 -","- C40 H54 Mo O4 P2 -","1","0.5","","Buccella, Daniela; Tanski, Joseph M.; Parkin, Gerard","Factors Influencing Coordination versus Oxidative Addition of C−H Bonds to Molybdenum and Tungsten: Structural and Spectroscopic Evidence That the Calixarene Framework Promotes C−H Bond Activation","Organometallics","2007","26","14","3275","","10.1021/om700279c","","","0.71073","MoKα","","0.0463","0.0373","","","0.0933","0.0987","","","","","","1.017","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073338","8.7365","0.0001","11.2335","0.0002","15.7357","0.0002","80.529","0.001","76.557","0.001","80.475","0.001","1468.45","0.04","115","2","115","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H47 O2 P3 W -","- C26 H47 O2 P3 W -","- C52 H94 O4 P6 W2 -","2","1","","Buccella, Daniela; Tanski, Joseph M.; Parkin, Gerard","Factors Influencing Coordination versus Oxidative Addition of C−H Bonds to Molybdenum and Tungsten: Structural and Spectroscopic Evidence That the Calixarene Framework Promotes C−H Bond Activation","Organometallics","2007","26","14","3275","","10.1021/om700279c","","","0.71073","MoKα","","0.0144","0.0139","","","0.0358","0.036","","","","","","1.036","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073339","12.728","0.002","13.985","0.002","20.269","0.003","90","","104.827","0.003","90","","3487.8","0.9","243","2","243","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H56 O2 P4 W -","- C29 H56 O2 P4 W -","- C116 H224 O8 P16 W4 -","4","1","","Buccella, Daniela; Tanski, Joseph M.; Parkin, Gerard","Factors Influencing Coordination versus Oxidative Addition of C−H Bonds to Molybdenum and Tungsten: Structural and Spectroscopic Evidence That the Calixarene Framework Promotes C−H Bond Activation","Organometallics","2007","26","14","3275","","10.1021/om700279c","","","0.71073","MoKα","","0.0435","0.0298","","","0.0782","0.0838","","","","","","1.01","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073340","8.8431","0.001","11.2629","0.0013","15.8528","0.0018","80.757","0.002","76.411","0.002","80.895","0.002","1502.8","0.3","243","2","243","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H47 Mo O2 P3 -","- C26 H47 Mo O2 P3 -","- C52 H94 Mo2 O4 P6 -","2","1","","Buccella, Daniela; Tanski, Joseph M.; Parkin, Gerard","Factors Influencing Coordination versus Oxidative Addition of C−H Bonds to Molybdenum and Tungsten: Structural and Spectroscopic Evidence That the Calixarene Framework Promotes C−H Bond Activation","Organometallics","2007","26","14","3275","","10.1021/om700279c","","","0.71073","MoKα","","0.0341","0.029","","","0.0877","0.0905","","","","","","1.025","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073341","14.2713","0.0016","12.397","0.0015","25.911","0.003","90","","102.079","0.003","90","","4482.7","0.9","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H60 N3 Rh Si4 Sn -","- C39 H60 N3 Rh Si4 Sn -","- C156 H240 N12 Rh4 Si16 Sn4 -","4","1","","Kilian, Michaela; Wadepohl, Hubert; Gade, Lutz H.","Flexibly Coordinating Tris(arylamido)stannates as Ligands: A [Rh]+/[Sn]-Zwitterion as an Intermediate in the Formation of Rh−Sn Complexes","Organometallics","2007","26","13","3076","","10.1021/om700282e","","x-ray","0.71073","MoKα","","0.0849","0.0551","","","0.131","0.1471","","","","","","0.994","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073342","12.3271","0.001","12.8709","0.001","20.6506","0.0017","72.17","0.001","89.627","0.001","87.669","0.002","3116.4","0.4","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C57 H75 N3 O3 P Rh Si4 Sn -","- C57 H75 N3 O3 P Rh Si4 Sn -","- C114 H150 N6 O6 P2 Rh2 Si8 Sn2 -","2","1","","Kilian, Michaela; Wadepohl, Hubert; Gade, Lutz H.","Flexibly Coordinating Tris(arylamido)stannates as Ligands: A [Rh]+/[Sn]-Zwitterion as an Intermediate in the Formation of Rh−Sn Complexes","Organometallics","2007","26","13","3076","","10.1021/om700282e","","x-ray","0.71073","MoKα","","0.0742","0.042","","","0.0951","0.1064","","","","","","0.983","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073343","12.7606","0.0009","13.836","0.001","31.05","0.002","90","","91.829","0.001","90","","5479.3","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C53 H79 N4 Rh Si4 Sn -","- C53 H79 N4 Rh Si4 Sn -","- C212 H316 N16 Rh4 Si16 Sn4 -","4","1","","Kilian, Michaela; Wadepohl, Hubert; Gade, Lutz H.","Flexibly Coordinating Tris(arylamido)stannates as Ligands: A [Rh]+/[Sn]-Zwitterion as an Intermediate in the Formation of Rh−Sn Complexes","Organometallics","2007","26","13","3076","","10.1021/om700282e","","x-ray","0.71073","MoKα","","0.0729","0.0466","","","0.1089","0.1209","","","","","","1.105","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073344","15.0003","0.0003","15.1231","0.0003","16.56","0.0004","95.732","0.001","97.048","0.001","91.998","0.001","3705.4","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H53 Cl2 O3 Ta -","- C38 H53 Cl2 O3 Ta -","- C152 H212 Cl8 O12 Ta4 -","4","2","","Agapie, Theodor; Bercaw, John E.","Cyclometalated Tantalum Diphenolate Pincer Complexes: Intramolecular C−H/M−CH3σ-Bond Metathesis May Be Faster than O−H/M−CH3Protonolysis","Organometallics","2007","26","12","2957","","10.1021/om700284c","","","0.71073","MoKα","","0.0826","0.039","","","0.0748","0.0872","","","","","","1","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4073345","11.2683","0.0007","17.5151","0.0011","18.2677","0.0012","88.748","0.001","88.572","0.001","89.202","0.001","3603.1","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C76 H100 Cl4 O4 Ta2 -","- C76 H100 Cl4 O4 Ta2 -","- C152 H200 Cl8 O8 Ta4 -","2","1","","Agapie, Theodor; Bercaw, John E.","Cyclometalated Tantalum Diphenolate Pincer Complexes: Intramolecular C−H/M−CH3σ-Bond Metathesis May Be Faster than O−H/M−CH3Protonolysis","Organometallics","2007","26","12","2957","","10.1021/om700284c","","","0.71073","MoKα","","0.098","0.0605","","","0.1014","0.1066","","","","","","1.622","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4073346","15.21","0.002","20.703","0.002","19.144","0.002","90","","111.627","0.002","90","","5603.9","1.1","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C65 H60 Cl2 P4 Ru2 -","- C65 H60 Cl2 P4 Ru2 -","- C260 H240 Cl8 P16 Ru8 -","4","1","","Bruce, Michael I.; Costuas, Karine; Ellis, Ben G.; Halet, Jean-François; Low, Paul J.; Moubaraki, Boujemaa; Murray, Keith S.; Ouddaï, Nadia; Perkins, Gary J.; Skelton, Brian W.; White, Allan H.","Redox-Active Complexes Containing Group 8 Metal Centers Linked by C2Bridges","Organometallics","2007","26","15","3735","","10.1021/om7002859","","","0.71073","MoKα","","0.068","0.049","","0.076","","0.067","","","1.044","","","1.042","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073347","11.538","0.005","14.004","0.006","21.671","0.009","101.154","0.007","91.028","0.007","112.459","0.007","3159","2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C67 H64 F12 O P6 Ru2 -","- C67 H64 F12 O P6 Ru2 -","- C134 H128 F24 O2 P12 Ru4 -","2","1","","Bruce, Michael I.; Costuas, Karine; Ellis, Ben G.; Halet, Jean-François; Low, Paul J.; Moubaraki, Boujemaa; Murray, Keith S.; Ouddaï, Nadia; Perkins, Gary J.; Skelton, Brian W.; White, Allan H.","Redox-Active Complexes Containing Group 8 Metal Centers Linked by C2Bridges","Organometallics","2007","26","15","3735","","10.1021/om7002859","","","0.71073","MoKα","","0.1108","0.0714","","0.112","0.1822","0.2229","","","1.1","","","1.066","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073348","20.783","0.01","12.954","0.008","22.973","0.01","90","","95.48","0.01","90","","6157","6","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C64 H58 F6 P5 Ru2 -","- C64 H58 F6 P5 Ru2 -","- C256 H232 F24 P20 Ru8 -","4","1","","Bruce, Michael I.; Costuas, Karine; Ellis, Ben G.; Halet, Jean-François; Low, Paul J.; Moubaraki, Boujemaa; Murray, Keith S.; Ouddaï, Nadia; Perkins, Gary J.; Skelton, Brian W.; White, Allan H.","Redox-Active Complexes Containing Group 8 Metal Centers Linked by C2Bridges","Organometallics","2007","26","15","3735","","10.1021/om7002859","","","0.71073","MoKα","","0.321","0.125","","0.228","","0.149","","","0.894","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073349","11.639","0.002","15.134","0.003","19.865","0.004","69.693","0.003","84.767","0.003","69.351","0.003","3068.9","1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H60 F12 O P6 Ru2 -","- C64 H58 F12 O P6 Ru2 -","- C128 H116 F24 O2 P12 Ru4 -","2","1","","Bruce, Michael I.; Costuas, Karine; Ellis, Ben G.; Halet, Jean-François; Low, Paul J.; Moubaraki, Boujemaa; Murray, Keith S.; Ouddaï, Nadia; Perkins, Gary J.; Skelton, Brian W.; White, Allan H.","Redox-Active Complexes Containing Group 8 Metal Centers Linked by C2Bridges","Organometallics","2007","26","15","3735","","10.1021/om7002859","","","0.71073","MoKα","","0.1242","0.0695","","0.148","0.1506","0.1715","","","1.071","","","1.072","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073350","11.96","0.01","15.49","0.02","20.45","0.02","69.7","0.02","84.93","0.02","69.31","0.02","3322","6","150","","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H58 F12 P6 Ru2 -","- C64 H58 F12 P6 Ru2 -","- C128 H116 F24 P12 Ru4 -","2","1","","Bruce, Michael I.; Costuas, Karine; Ellis, Ben G.; Halet, Jean-François; Low, Paul J.; Moubaraki, Boujemaa; Murray, Keith S.; Ouddaï, Nadia; Perkins, Gary J.; Skelton, Brian W.; White, Allan H.","Redox-Active Complexes Containing Group 8 Metal Centers Linked by C2Bridges","Organometallics","2007","26","15","3735","","10.1021/om7002859","","","0.71073","MoKα","","0.392","0.159","","0.29","","0.209","","","0.955","","","1.222","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073351","16.4476","0.0011","9.9513","0.0006","17.7253","0.0012","90","","113.011","0.001","90","","2670.3","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H35 Cl3 N2 O3 Pd -","- C25 H35 Cl3 N2 O3 Pd -","- C100 H140 Cl12 N8 O12 Pd4 -","4","1","","Guo, Ruiyun; Portscheller, Janelle L.; Day, Victor W.; Malinakova, Helena C.","An Allylpalladium(IV) Intermediate in the Synthesis of Highly Substituted Benzoxepines and Benzopyrans via Reactions of Stable Pallada(II)cycles with Allyl Bromides","Organometallics","2007","26","15","3874","","10.1021/om7002865","","","0.71073","MoKα","","0.0292","0.0248","","","0.0624","0.0637","","","","","","1.014","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073352","7.9471","0.0007","19.6757","0.0017","11.1282","0.001","90","","99.475","0.002","90","","1716.3","0.3","100","2","100","2","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C20 H18 N2 O3 Pd -","- C20 H18 N2 O3 Pd -","- C80 H72 N8 O12 Pd4 -","4","2","","Guo, Ruiyun; Portscheller, Janelle L.; Day, Victor W.; Malinakova, Helena C.","An Allylpalladium(IV) Intermediate in the Synthesis of Highly Substituted Benzoxepines and Benzopyrans via Reactions of Stable Pallada(II)cycles with Allyl Bromides","Organometallics","2007","26","15","3874","","10.1021/om7002865","","","0.71073","MoKα","","0.0961","0.0762","","","0.1619","0.176","","","","","","1.076","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073353","7.3144","0.0013","10.319","0.0018","43.365","0.008","90","","90","","90","","3273.1","1","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H24 Br2 N2 Pd -","- C14 H24 Br2 N2 Pd -","- C112 H192 Br16 N16 Pd8 -","8","1","","Guo, Ruiyun; Portscheller, Janelle L.; Day, Victor W.; Malinakova, Helena C.","An Allylpalladium(IV) Intermediate in the Synthesis of Highly Substituted Benzoxepines and Benzopyrans via Reactions of Stable Pallada(II)cycles with Allyl Bromides","Organometallics","2007","26","15","3874","","10.1021/om7002865","","","0.71073","MoKα","","0.1164","0.0586","","","0.1021","0.1157","","","","","","0.949","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073354","5.0296","0.0005","5.9963","0.0006","12.2441","0.0011","85.413","0.002","80.885","0.002","86.155","0.002","362.88","0.06","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H14 Br2 O4 Pd2 -","- C10 H14 Br2 O4 Pd2 -","- C10 H14 Br2 O4 Pd2 -","1","0.5","","Guo, Ruiyun; Portscheller, Janelle L.; Day, Victor W.; Malinakova, Helena C.","An Allylpalladium(IV) Intermediate in the Synthesis of Highly Substituted Benzoxepines and Benzopyrans via Reactions of Stable Pallada(II)cycles with Allyl Bromides","Organometallics","2007","26","15","3874","","10.1021/om7002865","","","0.71073","MoKα","","0.0342","0.031","","","0.0767","0.0779","","","","","","1.01","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073355","8.2999","0.0008","10.7468","0.001","20.757","0.002","102.346","0.002","91.945","0.002","102.168","0.002","1762","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H49 Br N2 O7 Pd -","- C33 H49 Br N2 O7 Pd -","- C66 H98 Br2 N4 O14 Pd2 -","2","1","","Guo, Ruiyun; Portscheller, Janelle L.; Day, Victor W.; Malinakova, Helena C.","An Allylpalladium(IV) Intermediate in the Synthesis of Highly Substituted Benzoxepines and Benzopyrans via Reactions of Stable Pallada(II)cycles with Allyl Bromides","Organometallics","2007","26","15","3874","","10.1021/om7002865","","","0.71073","MoKα","","0.0461","0.0371","","","0.0922","0.0946","","","","","","1.028","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073356","8.2576","0.0009","12.5536","0.0014","13.0012","0.0014","112.321","0.003","93.136","0.003","101.218","0.003","1210.6","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H25 Br N2 O5 Pd -","- C25 H25 Br N2 O5 Pd -","- C50 H50 Br2 N4 O10 Pd2 -","2","1","","Guo, Ruiyun; Portscheller, Janelle L.; Day, Victor W.; Malinakova, Helena C.","An Allylpalladium(IV) Intermediate in the Synthesis of Highly Substituted Benzoxepines and Benzopyrans via Reactions of Stable Pallada(II)cycles with Allyl Bromides","Organometallics","2007","26","15","3874","","10.1021/om7002865","","","0.71073","MoKα","","0.0656","0.0507","","","0.1141","0.1191","","","","","","1.039","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073357","22.264","0.006","15.392","0.004","15.987","0.005","90","","100.678","0.007","90","","5384","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H29 Br N2 O6 Pd -","- C27 H29 Br N2 O6 Pd -","- C216 H232 Br8 N16 O48 Pd8 -","8","2","","Guo, Ruiyun; Portscheller, Janelle L.; Day, Victor W.; Malinakova, Helena C.","An Allylpalladium(IV) Intermediate in the Synthesis of Highly Substituted Benzoxepines and Benzopyrans via Reactions of Stable Pallada(II)cycles with Allyl Bromides","Organometallics","2007","26","15","3874","","10.1021/om7002865","","","0.71073","MoKα","","0.1692","0.0734","","","0.1298","0.1536","","","","","","0.903","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073358","16.951","0.005","12.186","0.004","14.239","0.004","90","","114.146","0.005","90","","2683.9","1.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H25 Br N2 O5 Pd -","- C28 H25 Br N2 O5 Pd -","- C112 H100 Br4 N8 O20 Pd4 -","4","1","","Guo, Ruiyun; Portscheller, Janelle L.; Day, Victor W.; Malinakova, Helena C.","An Allylpalladium(IV) Intermediate in the Synthesis of Highly Substituted Benzoxepines and Benzopyrans via Reactions of Stable Pallada(II)cycles with Allyl Bromides","Organometallics","2007","26","15","3874","","10.1021/om7002865","","","0.71073","MoKα","","0.1509","0.0699","","","0.163","0.1871","","","","","","0.895","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073359","9.5","0.0002","12.052","0.0003","13.007","0.0003","62.773","0.0012","76.968","0.0014","76.994","0.0014","1277.28","0.05","150","2","150","2","","","","","","","synthesized by the authors","5","P -1","-P 1","2","","","","- C34 H66 B22 O8 Sn2 -","- C34 H66 B22 O8 Sn2 -","- C34 H66 B22 O8 Sn2 -","1","0.5","","Kašná, Blanka; Dostál, Libor; Císařová, Ivana; Jambor, Roman","Dimeric Diorganotin Dications: Structure and Catalytic Activity in Alcohol Acetylation","Organometallics","2007","26","16","4080","","10.1021/om7002893","","","0.71073","MoKα","","0.0237","0.0211","","","0.0488","0.0499","","","","","","1.066","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073360","7.9694","0.0006","14.1687","0.0011","17.4841","0.0014","92.906","0.002","95.309","0.002","90.651","0.002","1963","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H38 Ni O P2 -","- C16 H38 Ni O P2 -","- C64 H152 Ni4 O4 P8 -","4","2","","Cámpora, Juan; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Graiff, Claudia; Tiripicchio, Antonio","Monomeric Alkoxo and Amido Methylnickel(II) Complexes. Synthesis and Heterocumulene Insertion Chemistry","Organometallics","2007","26","15","3840","","10.1021/om7002909","","","0.71073","MoKα","","0.0764","0.0499","","","0.1308","0.151","","","","","","1.041","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073361","8.9113","0.0006","14.9674","0.0008","10.0496","0.0006","90","","111.331","0.002","90","","1248.58","0.13","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H45 N Ni P2 -","- C23 H45 N Ni P2 -","- C46 H90 N2 Ni2 P4 -","2","1","","Cámpora, Juan; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Graiff, Claudia; Tiripicchio, Antonio","Monomeric Alkoxo and Amido Methylnickel(II) Complexes. Synthesis and Heterocumulene Insertion Chemistry","Organometallics","2007","26","15","3840","","10.1021/om7002909","","","0.71073","MoKα","","0.0592","0.0467","","","0.1087","0.1134","","","","","","0.998","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073362","9.7279","0.0007","14.9737","0.0009","15.2632","0.0011","80.308","0.002","77.419","0.002","79.294","0.002","2113.1","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H39 N Ni P2 -","- C18 H39 N Ni P2 -","- C72 H156 N4 Ni4 P8 -","4","2","","Cámpora, Juan; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Graiff, Claudia; Tiripicchio, Antonio","Monomeric Alkoxo and Amido Methylnickel(II) Complexes. Synthesis and Heterocumulene Insertion Chemistry","Organometallics","2007","26","15","3840","","10.1021/om7002909","","","0.71073","MoKα","","0.0544","0.0427","","","0.1242","0.1287","","","","","","1.117","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073363","10.3613","0.0016","10.3787","0.0016","14.333","0.002","100.194","0.002","93.297","0.002","99.191","0.002","1491.7","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H48 N2 Ni P2 S -","- C26 H48 N2 Ni P2 S -","- C52 H96 N4 Ni2 P4 S2 -","2","1","","Cámpora, Juan; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Graiff, Claudia; Tiripicchio, Antonio","Monomeric Alkoxo and Amido Methylnickel(II) Complexes. Synthesis and Heterocumulene Insertion Chemistry","Organometallics","2007","26","15","3840","","10.1021/om7002909","","","0.71073","MoKα","","0.0889","0.0585","","","0.1748","0.2087","","","","","","0.902","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073364","10.925","0.0006","11.9094","0.0006","14.906","0.0008","77.707","0.001","71.233","0.001","75.995","0.001","1762.37","0.16","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C33 H54 B Cl F4 O Os P2 -","- C33.019 H54 B Cl F4 O Os P2 -","- C66.038 H108 B2 Cl2 F8 O2 Os2 P4 -","2","1","","Esteruelas, Miguel A.; López, Ana M.; Oñate, Enrique","α-Substituted Alkenyl and α-Disubstituted Alkylidene Complexes with the OsCl(CO)(PiPr3)2Skeleton","Organometallics","2007","26","13","3260","","10.1021/om7002915","","","0.71073","MoKα","","0.0317","0.0269","","","0.0564","0.0569","","","","","","0.962","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073365","13.6218","0.0009","14.3945","0.0009","18.5983","0.0012","90","","99.348","0.001","90","","3598.3","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H55 Cl3 O Os P2 -","- C33 H55 Cl3 O Os P2 -","- C132 H220 Cl12 O4 Os4 P8 -","4","1","","Esteruelas, Miguel A.; López, Ana M.; Oñate, Enrique","α-Substituted Alkenyl and α-Disubstituted Alkylidene Complexes with the OsCl(CO)(PiPr3)2Skeleton","Organometallics","2007","26","13","3260","","10.1021/om7002915","","","0.71073","MoKα","","0.0355","0.0264","","","0.0517","0.0532","","","","","","0.942","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073366","9.7161","0.001","10.1762","0.0011","10.6933","0.001","114.273","0.011","107.889","0.011","90.735","0.013","905.3","0.2","160","","180","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C36 H69 Cl P2 Ru -","- C36 H69 Cl P2 Ru -","- C36 H69 Cl P2 Ru -","1","0.5","","Lachaize, Sébastien; Caballero, Ana; Vendier, Laure; Sabo-Etienne, Sylviane","Activation of Chlorosilanes at Ruthenium: A Route to Silyl σ-Dihydrogen Complexes","Organometallics","2007","26","15","3713","","10.1021/om700295g","","","0.71073","MoKα","","0.0531","0.0367","","","0.0741","0.0785","","","","","","0.953","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073367","14.8904","0.0006","12.2866","0.0005","22.655","0.001","90","","101.138","0.004","90","","4066.7","0.3","100","","100","","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H71 Cl3 P2 Ru Si -","- C37 H71 Cl3 P2 Ru Si -","- C148 H284 Cl12 P8 Ru4 Si4 -","4","1","","Lachaize, Sébastien; Caballero, Ana; Vendier, Laure; Sabo-Etienne, Sylviane","Activation of Chlorosilanes at Ruthenium: A Route to Silyl σ-Dihydrogen Complexes","Organometallics","2007","26","15","3713","","10.1021/om700295g","","","0.71073","MoKα","","0.0618","0.0329","","","0.0529","0.0574","","","","","","0.873","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073368","12.0427","0.0005","24.4381","0.0011","23.0694","0.001","90","","96.068","0.004","90","","6751.3","0.5","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C59.5 H69 Cl4 N5 O17.5 P4 Pd2 -","- C58 H65.5 Cl4 N4.5 O17 P4 Pd2 -","- C232 H262 Cl16 N18 O68 P16 Pd8 -","4","1","","Ghosh, Sushobhan; Mukherjee, Partha Sarathi","Self-Assembly of Metallamacrocycles via a Rigid Phosphorus Donor Linker#","Organometallics","2007","26","14","3362","","10.1021/om700296k","","","0.71073","MoKα","","0.1445","0.0687","","","0.1723","0.1893","","","","","","1.052","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073369","11.9286","0.0007","24.5101","0.0018","22.6167","0.0016","90","","92.483","0.007","90","","6606.3","0.8","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C58 H64 Cl0 N8 O12.5 P4 Pd2 -","- C58 H61 N8 O12.5 P4 Pd2 -","- C232 H244 N32 O50 P16 Pd8 -","4","1","","Ghosh, Sushobhan; Mukherjee, Partha Sarathi","Self-Assembly of Metallamacrocycles via a Rigid Phosphorus Donor Linker#","Organometallics","2007","26","14","3362","","10.1021/om700296k","","","0.71073","MoKα","","0.1909","0.1183","","","0.2409","0.265","","","","","","1.085","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073370","32.291","0.003","32.291","0.003","12.6462","0.0015","90","","90","","90","","13186","2","150","2","150","2","","","","","","","","6","P 42 b c","P 4c -2ab","106","","","","- C56 H60 N8 O12 P4 Pt2 -","- C74.6667 N11.3333 O16 P5.33333 Pt2.66667 -","- C448 N68 O96 P32 Pt16 -","6","0.75","","Ghosh, Sushobhan; Mukherjee, Partha Sarathi","Self-Assembly of Metallamacrocycles via a Rigid Phosphorus Donor Linker#","Organometallics","2007","26","14","3362","","10.1021/om700296k","","","0.71073","MoKα","","0.2244","0.1009","","","0.2011","0.2723","","","","","","1.244","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073371","10.8981","0.0008","13.8392","0.001","18.6187","0.0014","93.896","0.006","106.842","0.006","108.217","0.006","2513.8","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C52.5 H47 Cl5 O P4 Pt2 -","- C52.5 H45 Cl5 O P4 Pt2 -","- C105 H90 Cl10 O2 P8 Pt4 -","2","1","","Ghosh, Sushobhan; Mukherjee, Partha Sarathi","Self-Assembly of Metallamacrocycles via a Rigid Phosphorus Donor Linker#","Organometallics","2007","26","14","3362","","10.1021/om700296k","","","0.71073","MoKα","","0.0892","0.0564","","","0.1396","0.1564","","","","","","1.094","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073372","9.2752","0.0008","11.8534","0.001","17.0739","0.0017","78.961","0.008","84.692","0.007","79.053","0.007","1805.8","0.3","105","2","105","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H59 Ga N2 Ni -","- C41 H59 Ga N2 Ni -","- C82 H118 Ga2 N4 Ni2 -","2","1","","Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.","Nickel Olefin Complexes Supported by GaI(DDP)†","Organometallics","2007","26","17","4257","","10.1021/om700297t","","","0.71073","MoKα","","0.0947","0.0434","","","0.0788","0.0891","","","","","","0.811","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073373","9.2884","0.0016","20.037","0.003","19.677","0.003","90","","91.846","0.014","90","","3660.2","1","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C39 H55 Ga N2 Ni -","- C39 H55 Ga N2 Ni -","- C156 H220 Ga4 N8 Ni4 -","4","1","","Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.","Nickel Olefin Complexes Supported by GaI(DDP)†","Organometallics","2007","26","17","4257","","10.1021/om700297t","","","0.71073","MoKα","","0.0867","0.0442","","","0.0932","0.104","","","","","","0.904","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073374","9.917","0.007","19.531","0.013","21.161","0.012","80.32","0.05","83.78","0.05","88.8","0.05","4016","5","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H57 Ga N2 Ni -","- C45 H57 Ga N2 Ni -","- C180 H228 Ga4 N8 Ni4 -","4","2","","Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.","Nickel Olefin Complexes Supported by GaI(DDP)†","Organometallics","2007","26","17","4257","","10.1021/om700297t","","","0.71073","MoKα","","0.2866","0.0508","","","0.0645","0.1447","","","","","","0.644","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073375","11.658","0.003","17.539","0.002","20.306","0.004","97.219","0.014","105.796","0.019","91.338","0.014","3956.3","1.4","105","2","105","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H59 Ga N2 Ni O Si2 -","- C37 H59 Ga N2 Ni O Si2 -","- C148 H236 Ga4 N8 Ni4 O4 Si8 -","4","2","","Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.","Nickel Olefin Complexes Supported by GaI(DDP)†","Organometallics","2007","26","17","4257","","10.1021/om700297t","","","0.71073","MoKα","","0.2028","0.0598","","","0.0794","0.1048","","","","","","0.623","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073376","10.4969","0.0015","19.79","0.003","17.502","0.003","90","","104.556","0.014","90","","3519.1","1","113","2","113","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37 H56 Ga N2 Ni2 -","- C37 H56 Ga N2 Ni2 -","- C148 H224 Ga4 N8 Ni8 -","4","1","","Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.","Nickel Olefin Complexes Supported by GaI(DDP)†","Organometallics","2007","26","17","4257","","10.1021/om700297t","","","0.71073","MoKα","","0.2762","0.0558","","","0.078","0.0988","","","","","","0.551","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073377","11.107","0.004","11.538","0.004","13.631","0.005","87.64","0.03","80.73","0.03","76.94","0.03","1679.4","1.1","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H53 Ga N2 Ni2 -","- C35 H53 Ga N2 Ni2 -","- C70 H106 Ga2 N4 Ni4 -","2","1","","Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.","Nickel Olefin Complexes Supported by GaI(DDP)†","Organometallics","2007","26","17","4257","","10.1021/om700297t","","","0.71073","MoKα","","0.1311","0.0461","","","0.0521","0.066","","","","","","0.703","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073378","13.6444","0.0006","20.3701","0.001","21.6915","0.001","90","","90","","90","","6028.9","0.5","113","2","113","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C64 H90 Ga2 N4 Ni3 -","- C64 H90 Ga2 N4 Ni3 -","- C256 H360 Ga8 N16 Ni12 -","4","0.5","","Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.","Nickel Olefin Complexes Supported by GaI(DDP)†","Organometallics","2007","26","17","4257","","10.1021/om700297t","","","0.71073","MoKα","","0.0726","0.0327","","","0.0685","0.073","","","","","","0.811","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073379","12.5791","0.0005","19.3714","0.0012","22.6823","0.0013","90","","90","","90","","5527.1","0.5","113","2","113","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C65 H73 Ga N2 Ni2 -","- C65 H73 Ga N2 Ni2 -","- C260 H292 Ga4 N8 Ni8 -","4","1","","Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.","Nickel Olefin Complexes Supported by GaI(DDP)†","Organometallics","2007","26","17","4257","","10.1021/om700297t","","","0.71073","MoKα","","0.1871","0.0344","","","0.0378","0.0441","","","","","","0.495","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073380","9.946","0.006","9.941","0.006","18.143","0.01","71.33","0.02","74.88","0.03","76.26","0.03","1617.2","1.7","173.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C37 H44 O2 Ti -","- C37 H44 O2 Ti -","- C74 H88 O4 Ti2 -","2","1","","Zhang, Dao","Unexpected Binuclear Bis(phenolato) Titanium (IV) {[(L)Ti(Ph)]2(μ-OEt)2} Assisted by Carbon−Oxygen Bond Cleavage and Alkali-Metal-Containing Titanium(III) Complexes [Ti(L)2·M(solv)2] (M = Li, Na, K; solv = THF, DME)","Organometallics","2007","26","16","4072","","10.1021/om700298f","","","0.7107","MoKα","","","0.097","","","","0.201","","","","","","1.081","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073381","9.013","0.006","12.751","0.008","13.476","0.008","94.557","0.013","103.67","0.01","95.243","0.01","1490.4","1.6","173.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C35 H40 O2 Ti -","- C35 H40 O2 Ti -","- C70 H80 O4 Ti2 -","2","1","","Zhang, Dao","Unexpected Binuclear Bis(phenolato) Titanium (IV) {[(L)Ti(Ph)]2(μ-OEt)2} Assisted by Carbon−Oxygen Bond Cleavage and Alkali-Metal-Containing Titanium(III) Complexes [Ti(L)2·M(solv)2] (M = Li, Na, K; solv = THF, DME)","Organometallics","2007","26","16","4072","","10.1021/om700298f","","","0.7107","MoKα","","","0.06","","","","0.096","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073382","11.277","0.006","17.83","0.008","14.245","0.007","90","","94.076","0.009","90","","2857","2","173.1","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C25 H30 N3 O2 Ti -","- C31 H40 O3 Ti -","- C124 H160 O12 Ti4 -","4","1","","Zhang, Dao","Unexpected Binuclear Bis(phenolato) Titanium (IV) {[(L)Ti(Ph)]2(μ-OEt)2} Assisted by Carbon−Oxygen Bond Cleavage and Alkali-Metal-Containing Titanium(III) Complexes [Ti(L)2·M(solv)2] (M = Li, Na, K; solv = THF, DME)","Organometallics","2007","26","16","4072","","10.1021/om700298f","","","0.7107","MoKα","","","0.067","","","","0.11","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073383","11.058","0.005","11.058","0.005","23.401","0.011","93.137","0.008","92.929","0.009","100.721","0.011","2802","2","173.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C61 H90 Li O4 Ti -","- C59.5 H60 Li O6 Ti -","- C119 H120 Li2 O12 Ti2 -","2","1","","Zhang, Dao","Unexpected Binuclear Bis(phenolato) Titanium (IV) {[(L)Ti(Ph)]2(μ-OEt)2} Assisted by Carbon−Oxygen Bond Cleavage and Alkali-Metal-Containing Titanium(III) Complexes [Ti(L)2·M(solv)2] (M = Li, Na, K; solv = THF, DME)","Organometallics","2007","26","16","4072","","10.1021/om700298f","","","0.7107","MoKα","","","0.086","","","","0.268","","","","","","1.003","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073384","16.2073","0.0005","16.3911","0.0005","20.669","0.0007","90","","97.077","0.002","90","","5449","0.3","123","2","123","1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C54 H80 K O8 Ti -","- C54 H80 K O8 Ti -","- C216 H320 K4 O32 Ti4 -","4","1","","Zhang, Dao","Unexpected Binuclear Bis(phenolato) Titanium (IV) {[(L)Ti(Ph)]2(μ-OEt)2} Assisted by Carbon−Oxygen Bond Cleavage and Alkali-Metal-Containing Titanium(III) Complexes [Ti(L)2·M(solv)2] (M = Li, Na, K; solv = THF, DME)","Organometallics","2007","26","16","4072","","10.1021/om700298f","","","0.7107","MoKα","","0.1562","0.1468","","","0.3321","0.3377","","","","","","1.169","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073385","13.2269","0.0005","14.3139","0.0006","16.4955","0.0007","75.448","0.001","82.343","0.001","85.983","0.001","2993.7","0.2","200","2","200","2","","","","","","","","9","P -1","-P 1","2","","","","- C62 H49 Cl6 F3 N2 O5 P2 Pd S -","- C62 H49 Cl6 F3 N2 O5 P2 Pd S -","- C124 H98 Cl12 F6 N4 O10 P4 Pd2 S2 -","2","1","","Nama, Devendrababu; Butti, Pietro; Pregosin, Paul S.","Conformational Changes and Anion−Cation Interactions in Palladium-Cyclometalated BINAP and Chiraphos Cationic Complexes. A Structural Study via NMR and X-ray Methods","Organometallics","2007","26","20","4942","","10.1021/om700299b","","","0.71073","MoKα","","0.054","0.0465","","","0.1241","0.1306","","","","","","1.04","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073386","17.6911","0.001","11.519","0.0006","23.0571","0.0013","90","","90.832","0.001","90","","4698.2","0.4","200","2","200","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C55 H46 F3 N O3 P2 Pd S -","- C55 H46 F3 N O3 P2 Pd S -","- C220 H184 F12 N4 O12 P8 Pd4 S4 -","4","2","","Nama, Devendrababu; Butti, Pietro; Pregosin, Paul S.","Conformational Changes and Anion‒Cation Interactions in Palladium-Cyclometalated BINAP and Chiraphos Cationic Complexes. A Structural Study via NMR and X-ray Methods","Organometallics","2007","26","20","4942","4954","10.1021/om700299b","","","0.71073","MoKα","","0.0577","0.0505","","","0.1151","0.1199","","","","","","1.043","","","","has coordinates","209981","2020-10-21","18:00:00",""
"4073387","11.382","0.0011","15.5502","0.0014","17.191","0.0016","71.786","0.002","84.497","0.002","79.695","0.002","2841","0.5","200","2","200","2","","","","","","","","9","P -1","-P 1","2","","","","- C63 H50 Cl5 F3 N O3 P2 Pd S -","- C63 H50 Cl5 F3 N O3 P2 Pd S -","- C126 H100 Cl10 F6 N2 O6 P4 Pd2 S2 -","2","1","","Nama, Devendrababu; Butti, Pietro; Pregosin, Paul S.","Conformational Changes and Anion−Cation Interactions in Palladium-Cyclometalated BINAP and Chiraphos Cationic Complexes. A Structural Study via NMR and X-ray Methods","Organometallics","2007","26","20","4942","","10.1021/om700299b","","","0.71073","MoKα","","0.0639","0.0572","","","0.1462","0.1538","","","","","","1.034","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073388","11.8308","0.001","12.8673","0.001","36.642","0.003","90","","90","","90","","5578","0.8","200","2","200","2","","","","","","","","9","P 21 21 21","P 2ac 2ab","19","","","","- C57 H47 Cl6 F3 N O3 P2 Pd S -","- C57 H47 Cl6.016 F3 N O3 P2 Pd S -","- C228 H188 Cl24.064 F12 N4 O12 P8 Pd4 S4 -","4","1","","Nama, Devendrababu; Butti, Pietro; Pregosin, Paul S.","Conformational Changes and Anion−Cation Interactions in Palladium-Cyclometalated BINAP and Chiraphos Cationic Complexes. A Structural Study via NMR and X-ray Methods","Organometallics","2007","26","20","4942","","10.1021/om700299b","","","0.71073","MoKα","","0.0394","0.0371","","","0.0918","0.093","","","","","","1.078","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073389","13.7723","0.0006","16.9996","0.0007","18.7871","0.0008","83.322","0.003","69.348","0.003","78.093","0.003","4022.7","0.3","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C51.5 H48 Sn V4 -","- C49.75 H44 Sn V4 -","- C199 H176 Sn4 V16 -","4","2","","Elschenbroich, Christoph; Lu, Feng; Nowotny, Mathias; Burghaus, Olaf; Pietzonka, Clemens; Harms, Klaus","Tetrakis([5]trovacenyl)tin: Synthesis, Structure, and Intramolecular Communication†","Organometallics","2007","26","16","4025","","10.1021/om700300j","","","0.71073","MoKα","","0.0395","0.0268","","","0.0629","0.0657","","","","","","0.975","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073390","9.3888","0.0011","11.7664","0.0015","13.4341","0.0016","80.25","0.01","82.34","0.01","78.3","0.01","1424.7","0.3","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H32 Sn V2 -","- C36 H32 Sn V2 -","- C72 H64 Sn2 V4 -","2","1","","Elschenbroich, Christoph; Lu, Feng; Nowotny, Mathias; Burghaus, Olaf; Pietzonka, Clemens; Harms, Klaus","Tetrakis([5]trovacenyl)tin: Synthesis, Structure, and Intramolecular Communication†","Organometallics","2007","26","16","4025","","10.1021/om700300j","","","0.71073","MoKα","","0.026","0.0213","","","0.0517","0.0527","","","","","","0.972","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073391","10.1916","0.0001","23.3846","0.0003","11.7911","0.0001","90","","90.5754","0.0006","90","","2809.99","0.05","173","1","173","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H38 O5 Sn -","- C30 H38 O5 Sn -","- C120 H152 O20 Sn4 -","4","1","","Reeske, Gregor; Schürmann, Markus; Costisella, Burkhard; Jurkschat, Klaus","Ph(3-n)XnSnCH2-16-crown-5 (X = F, Cl, Br, I, SCN;n= 1, 2): Intramolecular O →Sn Coordination versus Ditopic Complexation of Sodium Thiocyanate†","Organometallics","2007","26","17","4170","","10.1021/om700304p","","","0.71073","MoKα","","0.0277","0.0206","","","0.0502","0.0516","","","","","","1.077","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073392","9.1694","0.0001","10.0578","0.0002","13.9514","0.0002","90","","95.1086","0.0008","90","","1281.54","0.03","173","1","173","1","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C24 H33 I O5 Sn -","- C24 H33 I O5 Sn -","- C48 H66 I2 O10 Sn2 -","2","1","","Reeske, Gregor; Schürmann, Markus; Costisella, Burkhard; Jurkschat, Klaus","Ph(3-n)XnSnCH2-16-crown-5 (X = F, Cl, Br, I, SCN;n= 1, 2): Intramolecular O →Sn Coordination versus Ditopic Complexation of Sodium Thiocyanate†","Organometallics","2007","26","17","4170","","10.1021/om700304p","","","0.71073","MoKα","","0.0199","0.0168","","","0.0314","0.0319","","","","","","0.991","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073393","9.3718","0.0008","12.6614","0.0007","12.744","0.001","114.571","0.005","99.533","0.004","96.655","0.005","1327.19","0.18","173","1","173","1","","","","","","","","6","P -1","-P 1","2","","","","- C24.5 H34 Br Cl O5 Sn -","- C24.5 H34 Br Cl O5 Sn -","- C49 H68 Br2 Cl2 O10 Sn2 -","2","1","","Reeske, Gregor; Schürmann, Markus; Costisella, Burkhard; Jurkschat, Klaus","Ph(3-n)XnSnCH2-16-crown-5 (X = F, Cl, Br, I, SCN;n= 1, 2): Intramolecular O →Sn Coordination versus Ditopic Complexation of Sodium Thiocyanate†","Organometallics","2007","26","17","4170","","10.1021/om700304p","","","0.71073","MoKα","","0.0456","0.0264","","","0.0432","0.0451","","","","","","0.813","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073394","9.316","0.0006","12.6372","0.0006","12.726","0.0008","114.544","0.003","99.695","0.002","96.533","0.004","1314.87","0.14","173","1","173","1","","","","","","","","5","P -1","-P 1","2","","","","- C24.5 H34 Cl2 O5 Sn -","- C24.5 H34 Cl2 O5 Sn -","- C49 H68 Cl4 O10 Sn2 -","2","1","","Reeske, Gregor; Schürmann, Markus; Costisella, Burkhard; Jurkschat, Klaus","Ph(3-n)XnSnCH2-16-crown-5 (X = F, Cl, Br, I, SCN;n= 1, 2): Intramolecular O →Sn Coordination versus Ditopic Complexation of Sodium Thiocyanate†","Organometallics","2007","26","17","4170","","10.1021/om700304p","","","0.71073","MoKα","","0.0394","0.0253","","","0.0412","0.0424","","","","","","0.819","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073395","9.339","0.001","10.7975","0.0009","12.386","0.002","97.413","0.007","103.057","0.005","93.902","0.006","1200.4","0.3","173","1","173","1","","","","","","","","5","P -1","-P 1","2","","","","- C24 H33 F O5 Sn -","- C24 H33 F O5 Sn -","- C48 H66 F2 O10 Sn2 -","2","1","","Reeske, Gregor; Schürmann, Markus; Costisella, Burkhard; Jurkschat, Klaus","Ph(3-n)XnSnCH2-16-crown-5 (X = F, Cl, Br, I, SCN;n= 1, 2): Intramolecular O →Sn Coordination versus Ditopic Complexation of Sodium Thiocyanate†","Organometallics","2007","26","17","4170","","10.1021/om700304p","","","0.71073","MoKα","","0.0363","0.0282","","","0.0521","0.0531","","","","","","0.956","","","","has coordinates,has disorder","178622","2020-10-21","18:00:00",""
"4073396","8.952","0.0001","12.8877","0.0002","18.7612","0.0003","90","","102.877","0.0006","90","","2110.06","0.05","173","1","173","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 Cl2 O5 Sn -","- C18 H28 Cl2 O5 Sn -","- C72 H112 Cl8 O20 Sn4 -","4","1","","Reeske, Gregor; Schürmann, Markus; Costisella, Burkhard; Jurkschat, Klaus","Ph(3-n)XnSnCH2-16-crown-5 (X = F, Cl, Br, I, SCN;n= 1, 2): Intramolecular O →Sn Coordination versus Ditopic Complexation of Sodium Thiocyanate†","Organometallics","2007","26","17","4170","","10.1021/om700304p","","","0.71073","MoKα","","0.0317","0.0194","","","0.0411","0.0433","","","","","","0.924","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073397","8.6467","0.0002","13.5974","0.0003","9.8469","0.0002","90","","98.525","0.001","90","","1144.93","0.04","173","1","173","1","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H28 I2 O5 Sn -","- C18 H28 I2 O5 Sn -","- C36 H56 I4 O10 Sn2 -","2","0.5","","Reeske, Gregor; Schürmann, Markus; Costisella, Burkhard; Jurkschat, Klaus","Ph(3-n)XnSnCH2-16-crown-5 (X = F, Cl, Br, I, SCN;n= 1, 2): Intramolecular O →Sn Coordination versus Ditopic Complexation of Sodium Thiocyanate†","Organometallics","2007","26","17","4170","","10.1021/om700304p","","","0.71073","MoKα","","0.0493","0.0282","","","0.0548","0.0581","","","","","","0.959","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073398","14.519","0.005","13.791","0.003","14.581","0.005","90","","94.09","0.05","90","","2912.1","1.6","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H40 B10 P2 Ru -","- C24 H40 B10 P2 Ru -","- C96 H160 B40 P8 Ru4 -","4","1","","Basato, Marino; Biffis, Andrea; Buscemi, Gabriella; Callegaro, Elena; Polo, Mauro; Tubaro, Cristina; Venzo, Alfonso; Vianini, Chiara; Graiff, Claudia; Tiripicchio, Antonio; Benetollo, Franco","Reaction of Cyclopentadienyl Ruthenium Complexes with a Carborane Anion: Effect of the Spectator Ligands on the Substitution Site","Organometallics","2007","26","17","4265","","10.1021/om700305e","","","1.5418","CuKα","","0.0277","0.0249","","","0.0644","0.0659","","","","","","1.006","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073399","17.09","0.003","16.233","0.003","9.215","0.001","90","","90","","90","","2556.4","0.7","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C25 H35 Cl P2 Ru -","- C25 H35 Cl P2 Ru -","- C100 H140 Cl4 P8 Ru4 -","4","1","","Basato, Marino; Biffis, Andrea; Buscemi, Gabriella; Callegaro, Elena; Polo, Mauro; Tubaro, Cristina; Venzo, Alfonso; Vianini, Chiara; Graiff, Claudia; Tiripicchio, Antonio; Benetollo, Franco","Reaction of Cyclopentadienyl Ruthenium Complexes with a Carborane Anion: Effect of the Spectator Ligands on the Substitution Site","Organometallics","2007","26","17","4265","","10.1021/om700305e","","","0.71073","MoKα","","0.0376","0.0362","","","0.0872","0.0887","","","","","","1.278","","","","has coordinates","178622","2020-10-21","18:00:00",""
"4073400","9.4569","0.0006","16.4263","0.001","21.202","0.0013","90","","92.331","0.001","90","","3290.8","0.4","187","2","187","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H51 Lu N2 O2 Si2 -","- C29 H51 Lu N2 O2 Si2 -","- C116 H204 Lu4 N8 O8 Si8 -","4","1","","Yang, Yi; Liu, Bo; Lv, Kui; Gao, Wei; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Pyrrolide-Supported Lanthanide Alkyl Complexes. Influence of Ligands on Molecular Structure and Catalytic Activity toward Isoprene Polymerization","Organometallics","2007","26","18","4575","","10.1021/om7003095","","","0.71073","MoKα","","0.0346","0.0252","","","0.0496","0.0515","","","","","","0.928","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073401","11.5805","0.0008","14.0152","0.001","17.7458","0.0013","90","","90.508","0.001","90","","2880.1","0.4","187","2","187","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H43 N2 O Sc Si2 -","- C25 H43 N2 O Sc Si2 -","- C100 H172 N8 O4 Sc4 Si8 -","4","1","","Yang, Yi; Liu, Bo; Lv, Kui; Gao, Wei; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Pyrrolide-Supported Lanthanide Alkyl Complexes. Influence of Ligands on Molecular Structure and Catalytic Activity toward Isoprene Polymerization","Organometallics","2007","26","18","4575","","10.1021/om7003095","","","0.71073","MoKα","","0.0563","0.0416","","","0.1032","0.1114","","","","","","1.021","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073402","10.3754","0.0006","19.2503","0.0011","20.9445","0.0012","88.342","0.001","89.659","0.001","88.049","0.001","4179","0.4","187","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H59 Lu N4 O Si -","- C42 H59 Lu N4 O Si -","- C168 H236 Lu4 N16 O4 Si4 -","4","2","","Yang, Yi; Liu, Bo; Lv, Kui; Gao, Wei; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Pyrrolide-Supported Lanthanide Alkyl Complexes. Influence of Ligands on Molecular Structure and Catalytic Activity toward Isoprene Polymerization","Organometallics","2007","26","18","4575","","10.1021/om7003095","","","0.71073","MoKα","","0.0659","0.0405","","","0.0791","0.086","","","","","","0.87","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073403","9.4442","0.0008","10.491","0.0009","11.4717","0.001","77.923","0.001","84.338","0.001","65.777","0.001","1013.49","0.15","187","2","187","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H66 N4 Si4 Y2 -","- C30 H66 N4 Si4 Y2 -","- C30 H66 N4 Si4 Y2 -","1","0.5","","Yang, Yi; Liu, Bo; Lv, Kui; Gao, Wei; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Pyrrolide-Supported Lanthanide Alkyl Complexes. Influence of Ligands on Molecular Structure and Catalytic Activity toward Isoprene Polymerization","Organometallics","2007","26","18","4575","","10.1021/om7003095","","","0.71073","MoKα","","0.0453","0.0389","","","0.0966","0.0987","","","","","","0.996","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073404","14.9571","0.0007","14.9571","0.0007","21.8098","0.0014","90","","90","","90","","4879.2","0.4","187","2","187","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C45 H66 Lu2 N8 Si2 -","- C45 H66 Lu2 N8 Si2 -","- C180 H264 Lu8 N32 Si8 -","4","0.5","","Yang, Yi; Liu, Bo; Lv, Kui; Gao, Wei; Cui, Dongmei; Chen, Xuesi; Jing, Xiabin","Pyrrolide-Supported Lanthanide Alkyl Complexes. Influence of Ligands on Molecular Structure and Catalytic Activity toward Isoprene Polymerization","Organometallics","2007","26","18","4575","","10.1021/om7003095","","","0.71073","MoKα","","0.0205","0.0184","","","0.0406","0.0411","","","","","","0.965","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073405","19.9387","0.0011","11.3926","0.0007","21.9592","0.0012","90","","100.816","0.001","90","","4899.5","0.5","100","2","100","2","","","","","","","Synthesized by the authors. See text","6","P 1 21 1","P 2yb","4","","","","- C46 H73 Cl2 N2 P Ru -","- C46 H73 Cl2 N2 P Ru -","- C184 H292 Cl8 N8 P4 Ru4 -","4","2","","Fournier, Pierre-André; Collins, Shawn K.","A Highly Active Chiral Ruthenium-Based Catalyst for Enantioselective Olefin Metathesis","Organometallics","2007","26","12","2945","","10.1021/om700312c","","","1.54178","CuKα","","0.0654","0.0543","","","0.1237","0.1287","","","","","","0.991","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073406","16.032","0.002","14.186","0.002","38.211","0.006","90","","96.765","0.003","90","","8630","2","163","2","163","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C47 H69 U2 -","- C47 H68 U2 -","- C376 H544 U16 -","8","2","","Evans, William J.; Miller, Kevin A.; Kozimor, Stosh A.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Actinide Hydride Complexes as Multielectron Reductants: Analogous Reduction Chemistry from [(C5Me5)2UH]2, [(C5Me5)2UH2]2, and [(C5Me5)2ThH2]2","Organometallics","2007","26","14","3568","","10.1021/om7003139","","","0.71073","MoKα","","0.0688","0.046","","","0.0966","0.1054","","","","","","1.082","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073407","18.897","0.001","12.877","0.0007","16.219","0.0009","90","","104.811","0.001","90","","3815.5","0.4","208","2","208","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","UCI-KAM-4","","","- C40 H64 U2 -","- C40 H62 U2 -","- C160 H248 U8 -","4","0.5","","Evans, William J.; Miller, Kevin A.; Kozimor, Stosh A.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Actinide Hydride Complexes as Multielectron Reductants: Analogous Reduction Chemistry from [(C5Me5)2UH]2, [(C5Me5)2UH2]2, and [(C5Me5)2ThH2]2","Organometallics","2007","26","14","3568","","10.1021/om7003139","","","0.71069","MoKα","","0.0525","0.0477","","","0.1194","0.1225","","","","","","1.103","","","","has coordinates,has disorder","204147","2020-10-21","18:00:00",""
"4073408","12.7763","0.0006","12.7763","0.0006","32.1519","0.0019","90","","90","","120","","4545.1","0.4","100","2","100","2","","","","","","","","4","P 61","P 61","169","UCI-KAM-1","","","- C32 H40 Se2 U -","- C32 H40 Se2 U -","- C192 H240 Se12 U6 -","6","1","","Evans, William J.; Miller, Kevin A.; Kozimor, Stosh A.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Actinide Hydride Complexes as Multielectron Reductants: Analogous Reduction Chemistry from [(C5Me5)2UH]2, [(C5Me5)2UH2]2, and [(C5Me5)2ThH2]2","Organometallics","2007","26","14","3568","","10.1021/om7003139","","","0.71073","MoKα","","0.028","0.0267","","","0.0464","0.0467","","","","","","1.025","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4073409","12.6647","0.0006","12.6647","0.0006","32.45","0.003","90","","90","","120","","4507.5","0.5","163","2","163","2","","","","","","","","4","P 65","P 65","170","","","","- C32 H40 S2 Th -","- C32 H40 S2 Th -","- C192 H240 S12 Th6 -","6","1","","Evans, William J.; Miller, Kevin A.; Kozimor, Stosh A.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Actinide Hydride Complexes as Multielectron Reductants: Analogous Reduction Chemistry from [(C5Me5)2UH]2, [(C5Me5)2UH2]2, and [(C5Me5)2ThH2]2","Organometallics","2007","26","14","3568","","10.1021/om7003139","","","0.71073","MoKα","","0.0279","0.0235","","","0.0454","0.0462","","","","","","1.102","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073410","15.372","0.007","9.907","0.004","13.781","0.006","90","","103.242","0.007","90","","2042.9","1.5","163","2","163","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C50 H60 Th2 -","- C50 H60 Th2 -","- C100 H120 Th4 -","2","0.5","","Evans, William J.; Miller, Kevin A.; Kozimor, Stosh A.; Ziller, Joseph W.; DiPasquale, Antonio G.; Rheingold, Arnold L.","Actinide Hydride Complexes as Multielectron Reductants: Analogous Reduction Chemistry from [(C5Me5)2UH]2, [(C5Me5)2UH2]2, and [(C5Me5)2ThH2]2","Organometallics","2007","26","14","3568","","10.1021/om7003139","","","0.71073","MoKα","","0.0308","0.0273","","","0.0695","0.0716","","","","","","1.034","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073411","11.348","0.001","22.12","0.001","16.841","0.001","90","","97.75","0.001","90","","4188.8","0.5","150","0.1","150","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H66 O Si6 Tm -","- C32 H66 O Si6 Tm -","- C128 H264 O4 Si24 Tm4 -","4","1","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Synthesis and Reactivity of Organometallic Complexes of Divalent Thulium with Cyclopentadienyl and Phospholyl Ligands","Organometallics","2007","26","14","3552","","10.1021/om700316a","","","0.71073","MoKα","","0.0628","0.0364","","","0.0708","0.0772","","","","","","0.998","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073412","40.915","0.002","18.358","0.001","32.965","0.002","90","","125.593","0.001","90","","20134.6","1.9","150","0.1","150","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H58 I Si6 Tm -","- C28 H58 I Si6 Tm -","- C560 H1160 I20 Si120 Tm20 -","20","2.5","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Synthesis and Reactivity of Organometallic Complexes of Divalent Thulium with Cyclopentadienyl and Phospholyl Ligands","Organometallics","2007","26","14","3552","","10.1021/om700316a","","","0.71069","MoKα","","0.0857","0.0433","","","0.098","0.1138","","","","","","1.015","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073413","10.45","0.001","16.293","0.001","20.077","0.001","90","","102.619","0.001","90","","3335.8","0.4","150","0.1","150","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H62 B Tm -","- C34 H62 B Tm -","- C136 H248 B4 Tm4 -","4","0.5","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Synthesis and Reactivity of Organometallic Complexes of Divalent Thulium with Cyclopentadienyl and Phospholyl Ligands","Organometallics","2007","26","14","3552","","10.1021/om700316a","","","0.71069","MoKα","","0.0397","0.0328","","","0.0825","0.087","","","","","","1.052","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073414","10.492","0.001","10.55","0.001","12.863","0.001","81.18","0.001","72.891","0.001","78.824","0.001","1327.9","0.2","150","0.1","150","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C52 H84 I2 Tm2 -","- C52 H84 I2 Tm2 -","- C52 H84 I2 Tm2 -","1","0.5","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Synthesis and Reactivity of Organometallic Complexes of Divalent Thulium with Cyclopentadienyl and Phospholyl Ligands","Organometallics","2007","26","14","3552","","10.1021/om700316a","","","0.71069","MoKα","","0.0416","0.039","","","0.106","0.108","","","","","","1.004","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073415","10.787","0.001","16.997","0.001","16.458","0.001","90","","91.982","0.001","90","","3015.7","0.4","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H48 I P2 Tm -","- C28 H48 I P2 Tm -","- C112 H192 I4 P8 Tm4 -","4","1","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Synthesis and Reactivity of Organometallic Complexes of Divalent Thulium with Cyclopentadienyl and Phospholyl Ligands","Organometallics","2007","26","14","3552","","10.1021/om700316a","","","0.71069","MoKα","","0.056","0.0374","","","0.0852","0.092","","","","","","0.994","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073416","27.944","0.001","13.034","0.001","20.208","0.001","90","","133.686","0.001","90","","5322.4","0.5","150","0.1","150","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H40 I P2 Tm -","- C24 H40 I P2 Tm -","- C192 H320 I8 P16 Tm8 -","8","1","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Synthesis and Reactivity of Organometallic Complexes of Divalent Thulium with Cyclopentadienyl and Phospholyl Ligands","Organometallics","2007","26","14","3552","","10.1021/om700316a","","","0.71069","MoKα","","0.0652","0.0354","","","0.081","0.0906","","","","","","1.019","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073417","10.73","0.001","11.957","0.001","20.32","0.001","88.78","0.001","79.279","0.001","74.166","0.001","2463.1","0.3","150","0.1","150","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C48 H80 P4 Tm2 -","- C48 H80 P4 Tm2 -","- C96 H160 P8 Tm4 -","2","1","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Synthesis and Reactivity of Organometallic Complexes of Divalent Thulium with Cyclopentadienyl and Phospholyl Ligands","Organometallics","2007","26","14","3552","","10.1021/om700316a","","","0.71069","MoKα","","0.0918","0.0528","","","0.1213","0.1333","","","","","","1.067","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073418","10.447","0.001","10.865","0.001","18.222","0.001","106.818","0.001","91.546","0.001","94.519","0.001","1971","0.3","150","0.1","150","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C78 H0 N2 Tm2 -","- C78 H126 N2 Tm2 -","- C78 H126 N2 Tm2 -","1","0.5","","Jaroschik, Florian; Nief, François; Le Goff, Xavier-Frédéric; Ricard, Louis","Synthesis and Reactivity of Organometallic Complexes of Divalent Thulium with Cyclopentadienyl and Phospholyl Ligands","Organometallics","2007","26","14","3552","","10.1021/om700316a","","","0.71069","MoKα","","0.0747","0.0537","","","0.1411","0.1513","","","","","","0.988","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073419","9.3093","0.0012","32.315","0.004","10.4798","0.0013","90","","106.958","0.006","90","","3015.6","0.7","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C58 H92 Cl4 Mg N2 O4 U2 -","- C58 H92 Cl4 Mg N2 O4 U2 -","- C116 H184 Cl8 Mg2 N4 O8 U4 -","2","0.5","","Maynadié, Jérôme; Berthet, Jean-Claude; Thuéry, Pierre; Ephritikhine, Michel","Bent and Linear Uranium(IV) Metallocenes with Terminal and Bridging Cyanide Ligands","Organometallics","2007","26","18","4585","4591","10.1021/om7003173","","","0.71073","MoKα","","0.0987","0.0637","","","0.1404","0.156","","","","","","1.112","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073420","33.605","0.002","41.64","0.003","13.5465","0.0006","90","","90","","90","","18956","2","100","2","100","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C45 H78 N4 O1.5 U -","- C45 H78 N4 O1.5 U -","- C720 H1248 N64 O24 U16 -","16","1","","Maynadié, Jérôme; Berthet, Jean-Claude; Thuéry, Pierre; Ephritikhine, Michel","Bent and Linear Uranium(IV) Metallocenes with Terminal and Bridging Cyanide Ligands","Organometallics","2007","26","18","4585","4591","10.1021/om7003173","","","0.71073","MoKα","","0.0456","0.034","","","0.0708","0.0735","","","","","","1.003","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073421","38.6077","0.0008","12.1228","0.0004","38.4765","0.0014","90","","118.949","0.002","90","","15758.2","0.9","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C51 H93 N9 U -","- C51 H93 N9 U -","- C612 H1116 N108 U12 -","12","3","","Maynadié, Jérôme; Berthet, Jean-Claude; Thuéry, Pierre; Ephritikhine, Michel","Bent and Linear Uranium(IV) Metallocenes with Terminal and Bridging Cyanide Ligands","Organometallics","2007","26","18","4585","4591","10.1021/om7003173","","","0.71073","MoKα","","0.0656","0.0466","","","0.1316","0.1406","","","","","","1.064","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073422","32.5453","0.0012","13.9298","0.0003","21.5528","0.0008","90","","105.331","0.002","90","","9423.2","0.5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C37 H65 Ag2 I2 N7 O5 U -","- C37 H65 Ag2 I2 N7 O5 U -","- C296 H520 Ag16 I16 N56 O40 U8 -","8","1","","Maynadié, Jérôme; Berthet, Jean-Claude; Thuéry, Pierre; Ephritikhine, Michel","Bent and Linear Uranium(IV) Metallocenes with Terminal and Bridging Cyanide Ligands","Organometallics","2007","26","18","4585","4591","10.1021/om7003173","","","0.71073","MoKα","","0.0514","0.0438","","","0.1101","0.1135","","","","","","1.029","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073423","14.146","0.0012","14.7776","0.0012","24.15","0.002","90","","102.094","0.001","90","","4936.4","0.7","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H69 I2 Li O2 Zn -","- C44 H69 I2 Li O2 Zn -","- C176 H276 I8 Li4 O8 Zn4 -","4","1","","Wang, Yuzhong; Quillian, Brandon; Wannere, Chaitanya S.; Wei, Pingrong; Schleyer, Paul v. R.; Robinson, Gregory H.","A Trimetallic Compound Containing Zn−Zr Bonds: Cp2Zr(ZnR)2(Cp = C5H5; R = C6H3-2,6-(2,4,6-i-Pr3C6H2)2)","Organometallics","2007","26","12","3054","","10.1021/om700319k","","","0.71073","MoKα","","0.0724","0.0385","","","0.0903","0.1121","","","","","","1.004","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073424","13.4042","0.0017","14.4142","0.0018","18.52","0.002","88.019","0.002","86.503","0.002","79.634","0.002","3512.3","0.7","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C72 H98 I2 Zn2 -","- C72 H98 I2 Zn2 -","- C144 H196 I4 Zn4 -","2","1","","Wang, Yuzhong; Quillian, Brandon; Wannere, Chaitanya S.; Wei, Pingrong; Schleyer, Paul v. R.; Robinson, Gregory H.","A Trimetallic Compound Containing Zn−Zr Bonds: Cp2Zr(ZnR)2(Cp = C5H5; R = C6H3-2,6-(2,4,6-i-Pr3C6H2)2)","Organometallics","2007","26","12","3054","","10.1021/om700319k","","","0.71073","MoKα","","0.1152","0.0463","","","0.1104","0.1433","","","","","","1.006","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073425","15.8883","0.0017","17.6831","0.0019","29.505","0.003","90","","90","","90","","8289.6","1.5","273","2","273","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C86 H118 O Zn2 Zr -","- C86 H118 O Zn2 Zr -","- C344 H472 O4 Zn8 Zr4 -","4","0.5","","Wang, Yuzhong; Quillian, Brandon; Wannere, Chaitanya S.; Wei, Pingrong; Schleyer, Paul v. R.; Robinson, Gregory H.","A Trimetallic Compound Containing Zn−Zr Bonds: Cp2Zr(ZnR)2(Cp = C5H5; R = C6H3-2,6-(2,4,6-i-Pr3C6H2)2)","Organometallics","2007","26","12","3054","","10.1021/om700319k","","","0.71073","MoKα","","0.1236","0.0654","","","0.1782","0.2304","","","","","","1.045","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073426","11.0969","0.0005","17.9753","0.0008","21.9851","0.0008","90","","92.29","0.001","90","","4381.9","0.3","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C42 H47 Cl4 F3 Mo N3 O3.5 S -","- C42 H47 Cl4 F3 Mo N3 O3.5 S -","- C168 H188 Cl16 F12 Mo4 N12 O14 S4 -","4","1","","Tonzetich, Zachary J.; Jiang, Annie J.; Schrock, Richard R.; Müller, Peter","Molybdenum Imido Alkylidene Complexes that Contain a β-Diketiminate Ligand","Organometallics","2007","26","15","3771","","10.1021/om7003207","","","0.71073","MoKα","","0.0452","0.0374","","","0.0908","0.0947","","","","","","1.086","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073427","10.755","0.0005","17.4054","0.0009","22.5561","0.0012","90","","92.02","0.002","90","","4219.8","0.4","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C44 H54 F3 Mo N3 O3 S -","- C44 H54 F3 Mo N3 O3 S -","- C176 H216 F12 Mo4 N12 O12 S4 -","4","2","","Tonzetich, Zachary J.; Jiang, Annie J.; Schrock, Richard R.; Müller, Peter","Molybdenum Imido Alkylidene Complexes that Contain a β-Diketiminate Ligand","Organometallics","2007","26","15","3771","","10.1021/om7003207","","","0.71073","MoKα","","0.045","0.0389","","","0.0765","0.0782","","","","","","1.009","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073428","11.429","0.0004","18.7038","0.0007","19.0217","0.0007","95.751","0.001","94.01","0.001","101.967","0.001","3940.6","0.2","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C80 H76 B Cl2 F24 Mo N3 O -","- C80 H76 B Cl2 F24 Mo N3 O -","- C160 H152 B2 Cl4 F48 Mo2 N6 O2 -","2","1","","Tonzetich, Zachary J.; Jiang, Annie J.; Schrock, Richard R.; Müller, Peter","Molybdenum Imido Alkylidene Complexes that Contain a β-Diketiminate Ligand","Organometallics","2007","26","15","3771","","10.1021/om7003207","","","0.71073","MoKα","","0.0471","0.0407","","","0.1056","0.1099","","","","","","1.025","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073429","15.0303","0.0003","13.7595","0.0003","19.5228","0.0004","90","","105.899","0.001","90","","3883.05","0.14","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H57 Cl O P2 Ru -","- C41 H57 Cl O P2 Ru -","- C164 H228 Cl4 O4 P8 Ru4 -","4","1","","Bornand, Marc; Torker, Sebastian; Chen, Peter","Mechanistically Designed Dual-Site Catalysts for the Alternating ROMP of Norbornene and Cyclooctene","Organometallics","2007","26","14","3585","","10.1021/om700321a","","","0.7107","MoKα","","0.0608","0.0497","","","0.1246","0.1347","","","","","","0.979","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073430","9.7302","0.0001","14.5588","0.0002","14.6718","0.0002","88.678","0.001","75.78","0.001","70.981","0.001","1901.06","0.04","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H61 Cl O P2 Ru -","- C39 H61 Cl O P2 Ru -","- C78 H122 Cl2 O2 P4 Ru2 -","2","1","","Bornand, Marc; Torker, Sebastian; Chen, Peter","Mechanistically Designed Dual-Site Catalysts for the Alternating ROMP of Norbornene and Cyclooctene","Organometallics","2007","26","14","3585","","10.1021/om700321a","","","0.7107","MoKα","","0.0376","0.0305","","","0.0775","0.0828","","","","","","0.896","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073431","16.7303","0.0004","11.6739","0.0003","17.8412","0.0004","90","","106.56","0.001","90","","3339.99","0.14","220","2","220","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H46 Cl O2 P Ru -","- C36 H46 Cl O2 P Ru -","- C144 H184 Cl4 O8 P4 Ru4 -","4","1","","Bornand, Marc; Torker, Sebastian; Chen, Peter","Mechanistically Designed Dual-Site Catalysts for the Alternating ROMP of Norbornene and Cyclooctene","Organometallics","2007","26","14","3585","","10.1021/om700321a","","","0.7107","MoKα","","0.0574","0.0426","","","0.1286","0.1419","","","","","","1.124","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073432","10.6258","0.0002","13.858","0.0002","27.9175","0.0004","90","","96.92","0.001","90","","4080.97","0.11","220","2","220","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39 H61 Cl4 O P Ru -","- C39 H61 Cl3.98 O P Ru -","- C156 H244 Cl15.92 O4 P4 Ru4 -","4","1","","Bornand, Marc; Torker, Sebastian; Chen, Peter","Mechanistically Designed Dual-Site Catalysts for the Alternating ROMP of Norbornene and Cyclooctene","Organometallics","2007","26","14","3585","","10.1021/om700321a","","","0.7107","MoKα","","0.073","0.0487","","","0.1014","0.1237","","","","","","1.178","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073433","15.816","0.003","10.573","0.002","10.12","0.002","90","","109.7","0.03","90","","1593.2","0.6","200","2","200","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C15 H28 N2 O -","- C15 H30 N2 O -","- C60 H120 N8 O4 -","4","0.5","","Bach, Marc A.; Beweries, Torsten; Burlakov, Vladimir V.; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Migratory Insertion of an Isocyanide into 1-Zirconacyclopent-3-ynes","Organometallics","2007","26","18","4592","","10.1021/om700324k","","","0.71073","MoKα","","0.0633","0.0509","","","0.1485","0.1532","","","","","","1.132","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073434","9.6079","0.0019","24.719","0.005","11.812","0.002","90","","92.09","0.03","90","","2803.5","0.9","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H43 N2 Si Zr -","- C29 H43 N2 Si Zr -","- C116 H172 N8 Si4 Zr4 -","4","1","","Bach, Marc A.; Beweries, Torsten; Burlakov, Vladimir V.; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Migratory Insertion of an Isocyanide into 1-Zirconacyclopent-3-ynes","Organometallics","2007","26","18","4592","","10.1021/om700324k","","","0.71073","MoKα","","0.0779","0.0449","","","0.0701","0.0745","","","","","","0.913","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073435","20.632","0.004","12.178","0.002","11.572","0.002","90","","90","","90","","2907.5","0.9","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H48 N2 Zr -","- C32 H48 N2 Zr -","- C128 H192 N8 Zr4 -","4","1","","Bach, Marc A.; Beweries, Torsten; Burlakov, Vladimir V.; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Migratory Insertion of an Isocyanide into 1-Zirconacyclopent-3-ynes","Organometallics","2007","26","18","4592","","10.1021/om700324k","","","0.71073","MoKα","","0.0516","0.0323","","","0.0524","0.0552","","","","","","0.871","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073436","12.166","0.002","12.236","0.002","20.316","0.004","90","","97.04","0.03","90","","3001.5","0.9","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H41 N Si3 Zr -","- C25 H41 N Si3 Zr -","- C100 H164 N4 Si12 Zr4 -","4","1","","Bach, Marc A.; Beweries, Torsten; Burlakov, Vladimir V.; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Migratory Insertion of an Isocyanide into 1-Zirconacyclopent-3-ynes","Organometallics","2007","26","18","4592","","10.1021/om700324k","","","0.71073","MoKα","","0.0485","0.0274","","","0.0479","0.0509","","","","","","0.832","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073437","11.387","0.005","10.935","0.005","5.093","0.003","97.13","0.05","78.64","0.05","90.73","0.05","616.9","0.5","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H14 Cu F3 O3 S -","- C9 H14 Cu F3 O3 S -","- C18 H28 Cu2 F6 O6 S2 -","2","1","","Pampaloni, Guido; Peloso, Riccardo; Belletti, Daniele; Graiff, Claudia; Tiripicchio, Antonio","Trifluoromethyl-Substituted Bis(pyrazolyl)methanes as Ligands for Copper and Silver: Synthesis and Spectroscopic and Structural Characterization","Organometallics","2007","26","17","4278","","10.1021/om700325t","","","1.54184","CuKα","","0.0654","0.0648","","","0.1756","0.1766","","","","","","1.004","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073438","14.748","0.005","13.785","0.005","8.82","0.003","90","","90","","90","","1793.1","1.1","203","2","203","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C11 H6 Cu F9 N4 O4 S -","- C11 H6 Cu F9 N4 O4 S -","- C44 H24 Cu4 F36 N16 O16 S4 -","4","0.5","","Pampaloni, Guido; Peloso, Riccardo; Belletti, Daniele; Graiff, Claudia; Tiripicchio, Antonio","Trifluoromethyl-Substituted Bis(pyrazolyl)methanes as Ligands for Copper and Silver: Synthesis and Spectroscopic and Structural Characterization","Organometallics","2007","26","17","4278","","10.1021/om700325t","","","1.54184","CuKα","","0.0473","0.0429","","","0.121","0.1247","","","","","","1.065","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073439","10.818","0.003","14.758","0.005","13.283","0.003","90","","95.407","0.005","90","","2111.2","1","203","2","203","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C13 H4 Cu F15 N4 O4 S -","- C13 H4 Cu F15 N4 O4 S -","- C52 H16 Cu4 F60 N16 O16 S4 -","4","1","","Pampaloni, Guido; Peloso, Riccardo; Belletti, Daniele; Graiff, Claudia; Tiripicchio, Antonio","Trifluoromethyl-Substituted Bis(pyrazolyl)methanes as Ligands for Copper and Silver: Synthesis and Spectroscopic and Structural Characterization","Organometallics","2007","26","17","4278","","10.1021/om700325t","","","1.54184","CuKα","","0.096","0.0488","","","0.1126","0.1446","","","","","","0.985","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073440","10.027","0.003","19.543","0.005","17.572","0.004","90","","92.71","0.05","90","","3439.5","1.6","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H8 Ag B F28 N8 -","- C22 H8 Ag B F28 N8 -","- C88 H32 Ag4 B4 F112 N32 -","4","1","","Pampaloni, Guido; Peloso, Riccardo; Belletti, Daniele; Graiff, Claudia; Tiripicchio, Antonio","Trifluoromethyl-Substituted Bis(pyrazolyl)methanes as Ligands for Copper and Silver: Synthesis and Spectroscopic and Structural Characterization","Organometallics","2007","26","17","4278","","10.1021/om700325t","","","1.54183","CuKα","","0.1357","0.0451","","","0.086","0.1196","","","","","","0.913","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073441","16.911","0.003","13.546","0.002","19.128","0.003","90","","93.319","0.003","90","","4374.4","1.2","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C40 H48 Cl3 F3 N4 O5 Os S -","- C40 H48 Cl3 F3 N4 O5 Os S -","- C160 H192 Cl12 F12 N16 O20 Os4 S4 -","4","1","","Castarlenas, Ricardo; Esteruelas, Miguel A.; Oñate, Enrique","Preparation of [C,N,O]-Pincer Osmium Complexes by Alkylidene Metathesis with a Methyl Group of 2,6-Diacetylpyridine","Organometallics","2007","26","13","3082","","10.1021/om700326f","","","0.71073","MoKα","","0.069","0.0409","","","0.0862","0.0928","","","","","","0.909","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073442","6.2478","0.0004","10.4688","0.0006","20.7139","0.0012","90","","90","","90","","1354.83","0.14","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","compound (R,S~p~)-8","(R,S~p~)-3-[1-(N,N-Dimethylamino)ethyl]-1-hydroxymethyl-ferrocene","","- C15 H21 Fe N O -","- C15 H21 Fe N O -","- C60 H84 Fe4 N4 O4 -","4","1","","Steurer, Marianne; Wang, Yaping; Mereiter, Kurt; Weissensteiner, Walter","Bromide-Mediatedortho-Deprotonation in the Synthesis of Chiral, Nonracemic Ferrocene Derivatives","Organometallics","2007","26","15","3850","","10.1021/om7003282","","","0.71073","MoKα","","0.0208","0.0202","","","0.053","0.0533","","","","","","1.04","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073443","9.0593","0.0018","11.785","0.002","12.541","0.003","96.29","0.03","95.75","0.03","96.76","0.03","1312.9","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H31 Fe2 N3 O4 -","- C29 H31 Fe2 N3 O4 -","- C58 H62 Fe4 N6 O8 -","2","1","","Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio","Reactions of Diazo Compounds at μ-Vinyliminium Ligands: Synthesis of Novel Dinuclear Azine−Bis(alkylidene) Complexes","Organometallics","2007","26","14","3577","","10.1021/om700334h","","","0.71073","MoKα","","0.0542","0.0421","","","0.1016","0.1075","","","","","","1.065","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073444","11.814","0.002","12.577","0.003","15.404","0.003","107.03","0.03","98.26","0.03","110.62","0.03","1968.8","1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C35 H42 Cl2 F3 Fe2 N3 O7 S -","- C35 H42 Cl2 F3 Fe2 N3 O7 S -","- C70 H84 Cl4 F6 Fe4 N6 O14 S2 -","2","1","","Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio","Reactions of Diazo Compounds at μ-Vinyliminium Ligands: Synthesis of Novel Dinuclear Azine−Bis(alkylidene) Complexes","Organometallics","2007","26","14","3577","","10.1021/om700334h","","","0.71073","MoKα","","0.0828","0.0607","","","0.1712","0.1901","","","","","","1.042","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073445","10.56","0.003","19.478","0.005","14.017","0.004","90","","112.13","","90","","2670.7","1.3","110","2","110","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H27 F6 Fe2 O6 P3 S2 -","- C15 H27 F6 Fe2 O6 P3 S2 -","- C60 H108 F24 Fe8 O24 P12 S8 -","4","1","","Thomas, Christine M.; Rüdiger, Olaf; Liu, Tianbiao; Carson, Cody E.; Hall, Michael B.; Darensbourg, Marcetta Y.","Synthesis of Carboxylic Acid-Modified [FeFe]-Hydrogenase Model Complexes Amenable to Surface Immobilization","Organometallics","2007","26","16","3976","","10.1021/om7003354","","","0.71073","MoKα","","0.0492","0.0368","","","0.0946","0.1","","","","","","1.02","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073446","9.701","0.009","26.87","0.02","9.429","0.008","90","","104.516","0.016","90","","2379","3","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H19 Fe2 N O8 S2 -","- C20 H19 Fe2 N O8 S2 -","- C80 H76 Fe8 N4 O32 S8 -","4","1","","Thomas, Christine M.; Rüdiger, Olaf; Liu, Tianbiao; Carson, Cody E.; Hall, Michael B.; Darensbourg, Marcetta Y.","Synthesis of Carboxylic Acid-Modified [FeFe]-Hydrogenase Model Complexes Amenable to Surface Immobilization","Organometallics","2007","26","16","3976","","10.1021/om7003354","","","0.71073","MoKα","","0.1301","0.092","","","0.1925","0.2106","","","","","","1.209","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073447","8.3065","0.0016","8.7654","0.0016","19.337","0.004","98.805","0.003","92.008","0.003","117.698","0.003","1222.8","0.4","163","2","163","2","","","","","","","","6","P -1","-P 1","2","diron hexacarbonyl","","","- C17 H23 Fe2 O12 P S2 -","- C17 H23 Fe2 O12 P S2 -","- C34 H46 Fe4 O24 P2 S4 -","2","1","","Thomas, Christine M.; Rüdiger, Olaf; Liu, Tianbiao; Carson, Cody E.; Hall, Michael B.; Darensbourg, Marcetta Y.","Synthesis of Carboxylic Acid-Modified [FeFe]-Hydrogenase Model Complexes Amenable to Surface Immobilization","Organometallics","2007","26","16","3976","","10.1021/om7003354","","","0.71073","MoKα","","0.0694","0.0508","","","0.1207","0.1354","","","","","","0.967","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073448","18.558","0.003","15.874","0.003","20.342","0.002","90","","112.648","0.012","90","","5530.4","1.6","296","","296","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","","","- C54 H51 Cl4 I Ir2 O2 P2 Si -","- C54 H51 Cl4 I Ir2 O2 P2 Si -","- C216 H204 Cl16 I4 Ir8 O8 P8 Si4 -","4","1","","Wu, He-Ping; Ess, Daniel H.; Lanza, Seren; Weakley, Timothy J. R.; Houk, K. N.; Baldridge, Kim K.; Haley, Michael M.","Rearrangement of Iridabenzvalenes to Iridabenzenes and/or η5-Cyclopentadienyliridium(I) Complexes: Experimental and Computational Analysis of the Influence of Silyl Ring Substituents and Phosphine Ligands§","Organometallics","2007","26","16","3957","","10.1021/om700336d","","","0.71073","MoKα","","0.083","0.046","","0.103","","0.05","","","1.81","","","1.92","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073449","11.958","0.003","13.111","0.0014","14.535","0.004","95.282","0.017","102.43","0.02","95.649","0.013","2199.5","0.9","296","","296","","","","","","","","","6","P -1","-P 1","2","","","","- C48 H51 Ir O P2 Si2 -","- C48 H51 Ir O P2 Si2 -","- C96 H102 Ir2 O2 P4 Si4 -","2","1","","Wu, He-Ping; Ess, Daniel H.; Lanza, Seren; Weakley, Timothy J. R.; Houk, K. N.; Baldridge, Kim K.; Haley, Michael M.","Rearrangement of Iridabenzvalenes to Iridabenzenes and/or η5-Cyclopentadienyliridium(I) Complexes: Experimental and Computational Analysis of the Influence of Silyl Ring Substituents and Phosphine Ligands§","Organometallics","2007","26","16","3957","","10.1021/om700336d","","","0.71073","MoKα","","0.058","0.033","","0.078","","0.038","","","1.58","","","1.59","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073450","10.176","0.0019","10.457","0.002","15.517","0.003","107.959","0.003","94.315","0.003","94.627","0.003","1556.9","0.5","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H14 Cl N O2 Ti -","- C18 H14 Cl N O2 Ti -","- C72 H56 Cl4 N4 O8 Ti4 -","4","2","","Zhang, Jun; Lin, Yue-Jian; Jin, Guo-Xin","Synthesis, Characterization, and Ethylene Polymerization of Group IV Metal Complexes with Mono-Cp and Tridentate Aryloxide or Arylsulfide Ligands","Organometallics","2007","26","16","4042","","10.1021/om700338y","","","0.71073","MoKα","","0.1832","0.0573","","","0.0906","0.1073","","","","","","0.673","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073451","12.36","0.003","12.831","0.003","13.71","0.004","90","","105.316","0.004","90","","2097.1","0.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 Cl N O2 Ti -","- C23 H24 Cl N O2 Ti -","- C92 H96 Cl4 N4 O8 Ti4 -","4","1","","Zhang, Jun; Lin, Yue-Jian; Jin, Guo-Xin","Synthesis, Characterization, and Ethylene Polymerization of Group IV Metal Complexes with Mono-Cp and Tridentate Aryloxide or Arylsulfide Ligands","Organometallics","2007","26","16","4042","","10.1021/om700338y","","","0.71073","MoKα","","0.0891","0.0482","","","0.102","0.1147","","","","","","0.913","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073452","21.043","0.004","21.043","0.004","7.488","0.002","90","","90","","90","","3315.7","1.3","293","2","293","2","","","","","","","","7","I -4","I -4","82","","","","- C18 H14 Cl N O S Ti -","- C18 H14 Cl N O S Ti -","- C144 H112 Cl8 N8 O8 S8 Ti8 -","8","1","","Zhang, Jun; Lin, Yue-Jian; Jin, Guo-Xin","Synthesis, Characterization, and Ethylene Polymerization of Group IV Metal Complexes with Mono-Cp and Tridentate Aryloxide or Arylsulfide Ligands","Organometallics","2007","26","16","4042","","10.1021/om700338y","","","0.71073","MoKα","","0.052","0.0419","","","0.0787","0.0816","","","","","","0.957","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073453","22.415","0.011","13.398","0.006","7.215","0.004","90","","90","","90","","2166.8","1.9","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C23 H24 Cl N O S Ti -","- C23 H24 Cl N O S Ti -","- C92 H96 Cl4 N4 O4 S4 Ti4 -","4","1","","Zhang, Jun; Lin, Yue-Jian; Jin, Guo-Xin","Synthesis, Characterization, and Ethylene Polymerization of Group IV Metal Complexes with Mono-Cp and Tridentate Aryloxide or Arylsulfide Ligands","Organometallics","2007","26","16","4042","","10.1021/om700338y","","","0.71073","MoKα","","0.1402","0.0539","","","0.0855","0.1002","","","","","","0.805","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073454","8.572","0.003","14.639","0.004","15.94","0.005","90","","93.075","0.005","90","","1997.4","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 Cl N O3 Zr -","- C22 H22 Cl N O3 Zr -","- C88 H88 Cl4 N4 O12 Zr4 -","4","1","","Zhang, Jun; Lin, Yue-Jian; Jin, Guo-Xin","Synthesis, Characterization, and Ethylene Polymerization of Group IV Metal Complexes with Mono-Cp and Tridentate Aryloxide or Arylsulfide Ligands","Organometallics","2007","26","16","4042","","10.1021/om700338y","","","0.71073","MoKα","","0.0772","0.0408","","","0.0834","0.09","","","","","","0.842","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073455","8.3343","0.0009","18.2838","0.0019","16.5594","0.0018","90","","97.411","0.002","90","","2502.3","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H36 Br2 P2 Pt -","- C22 H36 Br2 P2 Pt -","- C88 H144 Br8 P8 Pt4 -","4","1","","Chanda, Nripen; Sharp, Paul R.","Bromination of a Naphthalene Platinacycle","Organometallics","2007","26","14","3368","","10.1021/om7003404","","","0.71073","MoKα","","0.0655","0.0479","","","0.1188","0.1282","","","","","","1.066","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073456","14.251","0.003","10.554","0.002","13.122","0.003","90","","91.674","0.004","90","","1972.8","0.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H21 Br4 P Pt -","- C16 H21 Br4 P Pt -","- C64 H84 Br16 P4 Pt4 -","4","1","","Chanda, Nripen; Sharp, Paul R.","Bromination of a Naphthalene Platinacycle","Organometallics","2007","26","14","3368","","10.1021/om7003404","","","0.71073","MoKα","","0.0525","0.0342","","","0.0799","0.0878","","","","","","1.031","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073457","12.148","0.005","12.42","0.005","13.138","0.007","92.116","0.018","105.123","0.017","116.199","0.013","1690.3","1.4","93.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C41 H37 N O2 P2 Pd -","- C41 H37 N O2 P2 Pd -","- C82 H74 N2 O4 P4 Pd2 -","2","1","","Nishihara, Yasushi; Miyasaka, Mitsuru; Inoue, Yoshiaki; Yamaguchi, Tomoka; Kojima, Masaaki; Takagi, Kentaro","Preparation, Structures, and Thermal Reactivity of Alkoxycarbonyl(cyano)palladium(II) Complexestrans-Pd(COOR)(CN)(PPh3)2(R = Me, Et,nPr,iPr,nBu,tBu, and Bn) as Intermediates of the Palladium-Catalyzed Cyanoesterification of Norbornene Derivatives","Organometallics","2007","26","16","4054","","10.1021/om700343y","","","0.71075","MoKα","","","0.0617","","","","0.0918","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073458","11.288","0.003","12.435","0.004","15.926","0.006","68.424","0.014","89.252","0.015","68.756","0.012","1918.9","1.1","93.1","","","","","","","","","","","7","P -1","-P 1","2","","","","- C42 H39 Cl2 N O2 P2 Pd -","- C42 H39 Cl2 N O2 P2 Pd -","- C84 H78 Cl4 N2 O4 P4 Pd2 -","2","1","","Nishihara, Yasushi; Miyasaka, Mitsuru; Inoue, Yoshiaki; Yamaguchi, Tomoka; Kojima, Masaaki; Takagi, Kentaro","Preparation, Structures, and Thermal Reactivity of Alkoxycarbonyl(cyano)palladium(II) Complexestrans-Pd(COOR)(CN)(PPh3)2(R = Me, Et,nPr,iPr,nBu,tBu, and Bn) as Intermediates of the Palladium-Catalyzed Cyanoesterification of Norbornene Derivatives","Organometallics","2007","26","16","4054","","10.1021/om700343y","","","0.71075","MoKα","","","0.0443","","","","0.1363","","","","","","0.956","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073459","16.215","0.003","15.318","0.003","17.591","0.003","90","","115.382","0.006","90","","3947.5","1.3","93.1","","","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C85 H80 Cl2 N2 O4 P4 Pd2 -","- C85 H80 Cl2 N2 O4 P4 Pd2 -","- C170 H160 Cl4 N4 O8 P8 Pd4 -","2","1","","Nishihara, Yasushi; Miyasaka, Mitsuru; Inoue, Yoshiaki; Yamaguchi, Tomoka; Kojima, Masaaki; Takagi, Kentaro","Preparation, Structures, and Thermal Reactivity of Alkoxycarbonyl(cyano)palladium(II) Complexestrans-Pd(COOR)(CN)(PPh3)2(R = Me, Et,nPr,iPr,nBu,tBu, and Bn) as Intermediates of the Palladium-Catalyzed Cyanoesterification of Norbornene Derivatives","Organometallics","2007","26","16","4054","","10.1021/om700343y","","","0.71075","MoKα","","","0.0683","","","","0.2125","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073460","15.552","0.012","10.704","0.008","22.633","0.018","90","","90","","90","","3768","5","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C168 H184 O16 P8 S8 -","- C168 H184 O16 P8 S8 -","- C168 H184 O16 P8 S8 -","1","0.125","","Duan, Zheng; Clochard, Magali; Donnadieu, Bruno; Mathey, François; Tham, Fook S.","Synthesis and X-ray Crystal Structure of a P-Confused Carbaporphyrinoid","Organometallics","2007","26","15","3617","","10.1021/om700344q","","","0.71073","MoKα","","0.1295","0.0735","","","0.1507","0.1754","","","","","","1.098","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073461","11.521","0.002","20.938","0.004","23.518","0.005","90","","91.01","0.03","90","","5672.3","1.9","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C61 H86 Ga N4 Rh -","- C61 H86 Ga N4 Rh -","- C244 H344 Ga4 N16 Rh4 -","4","1","","Green, Shaun P.; Jones, Cameron; Mills, David P.; Stasch, Andreas","Group 9 and 11 Metal(I) Gallyl Complexes Stabilized by N-Heterocyclic Carbene Coordination: First Structural Characterization of Ga-M (M = Cu or Ag) Bonds","Organometallics","2007","26","14","3424","","10.1021/om700345m","","","0.71073","MoKα","","0.0497","0.0392","","","0.0933","0.0984","","","","","","1.022","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073462","12.472","0.003","22.889","0.005","20.442","0.004","90","","107.03","0.03","90","","5580","2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C61 H86 Ga Ir N4 -","- C61 H86 Ga Ir N4 -","- C244 H344 Ga4 Ir4 N16 -","4","1","","Green, Shaun P.; Jones, Cameron; Mills, David P.; Stasch, Andreas","Group 9 and 11 Metal(I) Gallyl Complexes Stabilized by N-Heterocyclic Carbene Coordination: First Structural Characterization of Ga-M (M = Cu or Ag) Bonds","Organometallics","2007","26","14","3424","","10.1021/om700345m","","","0.71073","MoKα","","0.0315","0.0258","","","0.0566","0.0587","","","","","","1.032","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073463","23.502","0.005","13.04","0.003","29.209","0.006","90","","90.26","0.03","90","","8951","3","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C47 H60 Cu Ga N4 -","- C47 H60 Cu Ga N4 -","- C376 H480 Cu8 Ga8 N32 -","8","1","","Green, Shaun P.; Jones, Cameron; Mills, David P.; Stasch, Andreas","Group 9 and 11 Metal(I) Gallyl Complexes Stabilized by N-Heterocyclic Carbene Coordination: First Structural Characterization of Ga-M (M = Cu or Ag) Bonds","Organometallics","2007","26","14","3424","","10.1021/om700345m","","","0.71073","MoKα","","0.0546","0.0426","","","0.0997","0.1053","","","","","","1.065","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073464","14.104","0.003","22.068","0.004","16.348","0.003","90","","108.55","0.03","90","","4823.9","1.8","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H67 Ag Ga N4 -","- C50 H67 Ag Ga N4 -","- C200 H268 Ag4 Ga4 N16 -","4","1","","Green, Shaun P.; Jones, Cameron; Mills, David P.; Stasch, Andreas","Group 9 and 11 Metal(I) Gallyl Complexes Stabilized by N-Heterocyclic Carbene Coordination: First Structural Characterization of Ga-M (M = Cu or Ag) Bonds","Organometallics","2007","26","14","3424","","10.1021/om700345m","","","0.71073","MoKα","","0.0432","0.0313","","","0.0674","0.072","","","","","","1.025","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073465","37.796","0.005","37.796","0.005","14.331","0.003","90","","90","","90","","20472","6","150","2","150","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48.5 H63.5 Au Ga N4 -","- C48.5 H63.5 Au Ga N4 -","- C776 H1016 Au16 Ga16 N64 -","16","1","","Green, Shaun P.; Jones, Cameron; Mills, David P.; Stasch, Andreas","Group 9 and 11 Metal(I) Gallyl Complexes Stabilized by N-Heterocyclic Carbene Coordination: First Structural Characterization of Ga-M (M = Cu or Ag) Bonds","Organometallics","2007","26","14","3424","","10.1021/om700345m","","","0.71073","MoKα","","0.0479","0.0382","","","0.094","0.0986","","","","","","1.067","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073466","12.249","0.002","19.506","0.004","23.836","0.005","90","","90","","90","","5695.1","1.9","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C57 H82 Cu Ga N4 O -","- C57 H82 Cu Ga N4 O -","- C228 H328 Cu4 Ga4 N16 O4 -","4","1","","Green, Shaun P.; Jones, Cameron; Mills, David P.; Stasch, Andreas","Group 9 and 11 Metal(I) Gallyl Complexes Stabilized by N-Heterocyclic Carbene Coordination: First Structural Characterization of Ga-M (M = Cu or Ag) Bonds","Organometallics","2007","26","14","3424","","10.1021/om700345m","","","0.71073","MoKα","","0.0434","0.0339","","","0.0748","0.0792","","","","","","1.029","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073467","20.768","0.004","11.945","0.002","21.231","0.004","90","","90","","90","","5266.9","1.7","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C53 H72 Ag Ga N4 -","- C53 H72 Ag Ga N4 -","- C212 H288 Ag4 Ga4 N16 -","4","1","","Green, Shaun P.; Jones, Cameron; Mills, David P.; Stasch, Andreas","Group 9 and 11 Metal(I) Gallyl Complexes Stabilized by N-Heterocyclic Carbene Coordination: First Structural Characterization of Ga-M (M = Cu or Ag) Bonds","Organometallics","2007","26","14","3424","","10.1021/om700345m","","","0.71073","MoKα","","0.0536","0.0469","","","0.1193","0.1244","","","","","","1.019","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073468","19.271","0.004","23.949","0.005","20.866","0.004","90","","92.51","0.03","90","","9621","3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C106 H144 Au Ga N8 -","- C106 H144 Au Ga N8 -","- C424 H576 Au4 Ga4 N32 -","4","1","","Green, Shaun P.; Jones, Cameron; Mills, David P.; Stasch, Andreas","Group 9 and 11 Metal(I) Gallyl Complexes Stabilized by N-Heterocyclic Carbene Coordination: First Structural Characterization of Ga-M (M = Cu or Ag) Bonds","Organometallics","2007","26","14","3424","","10.1021/om700345m","","","0.71073","MoKα","","0.0828","0.0495","","","0.0797","0.0885","","","","","","0.998","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073469","24.918","0.0015","24.918","0.0015","9.214","0.0011","90","","90","","90","","5721","0.8","100","2","100","2","","","","","","","","4","I -4","I -4","82","","","","- C34 H42 Au P -","- C34 H42 Au P -","- C272 H336 Au8 P8 -","8","1","","Partyka, David V.; Esswein, Arthur J.; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.","Gold(I) Pyrenyls: Excited-State Consequences of Carbon−Gold Bond Formation","Organometallics","2007","26","14","3279","","10.1021/om700346v","","","0.71073","MoKα","","0.05","0.0468","","","0.1204","0.124","","","","","","1.091","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073470","12.2122","0.0013","12.1108","0.0013","23.06","0.003","90","","90.024","0.002","90","","3410.6","0.7","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C43 H45 Au N2 -","- C43 H45 Au N2 -","- C172 H180 Au4 N8 -","4","1","","Partyka, David V.; Esswein, Arthur J.; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.","Gold(I) Pyrenyls: Excited-State Consequences of Carbon−Gold Bond Formation","Organometallics","2007","26","14","3279","","10.1021/om700346v","","","0.71073","MoKα","","0.0595","0.0522","","","0.1273","0.131","","","","","","1.14","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073471","45.186","0.005","9.3647","0.0006","43.241","0.004","90","","90.875","0.004","90","","18295","3","103","2","103","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","9-silaphenanthrene","","","- C40 H68 Si7 -","- C40 H68 Si7 -","- C640 H1088 Si112 -","16","2","","Tokitoh, Norihiro; Shinohara, Akihiro; Matsumoto, Takeshi; Sasamori, Takahiro; Takeda, Nobuhiro; Furukawa, Yukio","Synthesis and Properties of a Kinetically Stabilized 9-Silaphenanthrene","Organometallics","2007","26","16","4048","4053","10.1021/om700347z","","","0.71069","MoKα","","0.142","0.0607","","","0.1348","0.171","","","","","","0.998","","","","has coordinates","279035","2022-11-07","16:51:04",""
"4073472","8.5128","0.0007","30.503","0.002","7.8636","0.0006","90","","94.602","0.007","90","","2035.3","0.3","170","2","170","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H27 B Mo2 S2 -","- C20 H27 B Mo2 S2 -","- C80 H108 B4 Mo8 S8 -","4","1","","Le Goff, Alan; Le Roy, Christine; Pétillon, François Y.; Schollhammer, Philippe; Talarmin, Jean","Formation of New μ-Thioalkylidene and μ-Borohydride Dimolybdenum Complexes from the μ-Alkylidyne Precursor [Mo2Cp2(μ-SMe)3(μ-CCH2Ph)]","Organometallics","2007","26","14","3607","","10.1021/om7003496","","","0.71073","MoKα","","0.1158","0.0807","","","0.1192","0.129","","","","","","1.189","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073473","22.533","0.0007","11.2561","0.0004","20.6374","0.0006","90","","91.917","0.002","90","","5231.4","0.3","183","2","183","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C54 H73 Ca2 Cu O6 -","- C54 H73 Ca2 Cu O6 -","- C216 H292 Ca8 Cu4 O24 -","4","0.5","","Fischer, Reinald; Görls, Helmar; Westerhausen, Matthias","Syntheses and Structure of the Solvent-Separated Calcium Cuprate [(thf)3Ca(μ-Ph)3Ca(thf)3]+[Ph−Cu−Ph]-","Organometallics","2007","26","14","3269","","10.1021/om700353w","","","0.71073","MoKα","","0.09","0.0488","","","0.1136","0.1316","","","","","","1.01","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073474","19.501","0.0004","19.501","0.0004","22.1204","0.0005","90","","90","","120","","7285.1","0.3","183","2","183","2","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","","","- C42 H63 Br3 Ca3 Mg O7 -","- C42 H63 Br3 Ca3 Mg O7 -","- C252 H378 Br18 Ca18 Mg6 O42 -","6","0.333333","","Fischer, Reinald; Görls, Helmar; Westerhausen, Matthias","Syntheses and Structure of the Solvent-Separated Calcium Cuprate [(thf)3Ca(μ-Ph)3Ca(thf)3]+[Ph−Cu−Ph]-","Organometallics","2007","26","14","3269","","10.1021/om700353w","","","0.71073","MoKα","","0.0579","0.0433","","","0.1049","0.1128","","","","","","1.032","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073475","7.9","0.0004","24.4193","0.0012","8.9974","0.0004","90","","96.793","0.001","90","","1723.53","0.14","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C29 H54 Cl N4 O P2 Rh -","- C29 H54 Cl N4 O P2 Rh -","- C58 H108 Cl2 N8 O2 P4 Rh2 -","2","0.5","","Grotjahn, Douglas B.; Zeng, Xi; Cooksy, Andrew L.; Kassel, W. Scott; DiPasquale, Antonio G.; Zakharov, Lev. N.; Rheingold, Arnold L.","Experimental and Computational Study of the Transformation of Terminal Alkynes to Vinylidene Ligands ontrans-(Chloro)bis(phosphine)Rh Fragments and Effects of Phosphine Substituents","Organometallics","2007","26","14","3385","","10.1021/om700355r","","","0.71073","MoKα","","0.0388","0.0362","","","0.0872","0.0884","","","","","","1.137","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073476","8.541","0.0008","7.786","0.0007","19.808","0.0017","90","","96.3","0.002","90","","1309.3","0.2","208","2","208","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","DG1901","","","- C25 H38 Cl O P2 Rh -","- C25 H38 Cl O P2 Rh -","- C50 H76 Cl2 O2 P4 Rh2 -","2","0.5","","Grotjahn, Douglas B.; Zeng, Xi; Cooksy, Andrew L.; Kassel, W. Scott; DiPasquale, Antonio G.; Zakharov, Lev. N.; Rheingold, Arnold L.","Experimental and Computational Study of the Transformation of Terminal Alkynes to Vinylidene Ligands ontrans-(Chloro)bis(phosphine)Rh Fragments and Effects of Phosphine Substituents","Organometallics","2007","26","14","3385","","10.1021/om700355r","","","0.71073","MoKα","","0.0531","0.0496","","","0.1227","0.1246","","","","","","1.21","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4073477","10.232","0.011","15.409","0.017","9.569","0.01","90","","113.509","0.015","90","","1383","3","208","2","208","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H42 Cl O P2 Rh -","- C27 H42 Cl1.46 P2 Rh -","- C54 H84 Cl2.92 P4 Rh2 -","2","0.5","","Grotjahn, Douglas B.; Zeng, Xi; Cooksy, Andrew L.; Kassel, W. Scott; DiPasquale, Antonio G.; Zakharov, Lev. N.; Rheingold, Arnold L.","Experimental and Computational Study of the Transformation of Terminal Alkynes to Vinylidene Ligands ontrans-(Chloro)bis(phosphine)Rh Fragments and Effects of Phosphine Substituents","Organometallics","2007","26","14","3385","","10.1021/om700355r","","","0.71073","MoKα","","0.0498","0.0475","","","0.1119","0.1133","","","","","","1.089","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073478","9.6038","0.0006","10.514","0.0006","19.1961","0.0012","90","","103.768","0.001","90","","1882.6","0.2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C41 H46 Cl N4 O P2 Rh -","- C41 H46 Cl N4 O P2 Rh -","- C82 H92 Cl2 N8 O2 P4 Rh2 -","2","0.5","","Grotjahn, Douglas B.; Zeng, Xi; Cooksy, Andrew L.; Kassel, W. Scott; DiPasquale, Antonio G.; Zakharov, Lev. N.; Rheingold, Arnold L.","Experimental and Computational Study of the Transformation of Terminal Alkynes to Vinylidene Ligands ontrans-(Chloro)bis(phosphine)Rh Fragments and Effects of Phosphine Substituents","Organometallics","2007","26","14","3385","","10.1021/om700355r","","","0.71073","MoKα","","0.0371","0.031","","","0.0856","0.0895","","","","","","0.809","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073479","14.217","0.0011","14.3381","0.0011","16.6229","0.0013","112.352","0.001","95.69","0.001","111.594","0.001","2799","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C63 H69 Co N8 O6 -","- C63 H69 Co N8 O6 -","- C126 H138 Co2 N16 O12 -","2","1","","Bhuyan, Mouchumi; Laskar, Moitree; Mandal, Debaprasad; Gupta, B. D.","Co−C Bond Reactivity andCisInfluence Relationship in Benzylcobaloximes with Glyoxime and Dimesitylglyoxime","Organometallics","2007","26","14","3559","","10.1021/om7003578","","","0.71073","MoKα","","0.1041","0.0748","","","0.1987","0.2195","","","","","","1.043","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073480","8.6212","0.0006","26.734","0.002","13.5996","0.001","90","","102.995","0.001","90","","3054.2","0.4","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","2-naphthylCH2(O2)Co(dmestgH)2Py","","","- C58 H64 Cl4 Co N5 O6 -","- C58 H64 Cl4 Co N5 O6 -","- C116 H128 Cl8 Co2 N10 O12 -","2","1","","Bhuyan, Mouchumi; Laskar, Moitree; Mandal, Debaprasad; Gupta, B. D.","Co−C Bond Reactivity andCisInfluence Relationship in Benzylcobaloximes with Glyoxime and Dimesitylglyoxime","Organometallics","2007","26","14","3559","","10.1021/om7003578","","","0.71073","MoKα","","0.0851","0.0667","","","0.1441","0.1515","","","","","","0.928","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073481","10.177","0.004","10.854","0.004","19.864","0.007","90","","101.01","0.02","90","","2153.8","1.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","C6H5CH2Co(gH)2Py","","","- C20 H26 Co N5 O4 -","- C20 H26 Co N5 O4 -","- C80 H104 Co4 N20 O16 -","4","1","","Bhuyan, Mouchumi; Laskar, Moitree; Mandal, Debaprasad; Gupta, B. D.","Co−C Bond Reactivity andCisInfluence Relationship in Benzylcobaloximes with Glyoxime and Dimesitylglyoxime","Organometallics","2007","26","14","3559","","10.1021/om7003578","","","0.71073","MoKα","","0.1879","0.0801","","","0.143","0.1836","","","","","","1.005","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073482","10.213","0.002","11.269","0.003","12.049","0.003","89.426","0.004","78.679","0.004","74.408","0.004","1308.4","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(C4H3S-2)CCAg · 4AgCF3CO2","","","- C14 H3 Ag5 F12 O8 S -","- C14 H3 Ag5 F12 O8 S -","- C28 H6 Ag10 F24 O16 S2 -","2","1","","Zhao, Liang; Mak, Thomas C. W.","Silver(I)−Thiophene π Interaction in the Assembly of Coordination Networks with the Supramolecular Synthons R−C⋮C⊃Agn(R = 2- or 3-thienyl;n= 4)†","Organometallics","2007","26","18","4439","","10.1021/om700370p","","","0.71073","MoKα","","0.0398","0.0319","","","0.0841","0.0897","","","","","","1.016","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073483","11.3378","0.0012","12.2505","0.0013","20.313","0.002","77.61","0.002","73.911","0.002","88.355","0.002","2646.3","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","2[(C4H3S-2)CCAg] · 8AgCF3CO2 · CH3CN","","","- C30 H9 Ag10 F24 N O16 S2 -","- C30 H9 Ag10 F24 N O16 S2 -","- C60 H18 Ag20 F48 N2 O32 S4 -","2","1","","Zhao, Liang; Mak, Thomas C. W.","Silver(I)−Thiophene π Interaction in the Assembly of Coordination Networks with the Supramolecular Synthons R−C⋮C⊃Agn(R = 2- or 3-thienyl;n= 4)†","Organometallics","2007","26","18","4439","","10.1021/om700370p","","","0.71073","MoKα","","0.0466","0.0349","","","0.0899","0.0982","","","","","","1.045","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073484","11.2777","0.0019","13.87","0.003","22.812","0.004","73.065","0.004","79.733","0.004","80.77","0.004","3336.5","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","3[(C4H3S-2)CCAg] · 8AgCF3CO2 · Me3N+CH2CO2- · 4.5H2O","","","- C39 H20 Ag11 F24 N O22.5 S3 -","- C39 H20 Ag11 F24 N O22.5 S3 -","- C78 H40 Ag22 F48 N2 O45 S6 -","2","1","","Zhao, Liang; Mak, Thomas C. W.","Silver(I)−Thiophene π Interaction in the Assembly of Coordination Networks with the Supramolecular Synthons R−C⋮C⊃Agn(R = 2- or 3-thienyl;n= 4)†","Organometallics","2007","26","18","4439","","10.1021/om700370p","","","0.71073","MoKα","","0.1309","0.0866","","","0.2383","0.2918","","","","","","1.029","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073485","10.2834","0.0019","11.458","0.002","11.989","0.003","91.137","0.002","101.018","0.002","105.768","0.003","1330.6","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(C4H3S-3)CCAg · 4AgCF3CO2","","","- C14 H3 Ag5 F12 O8 S -","- C14 H3 Ag5 F12 O8 S -","- C28 H6 Ag10 F24 O16 S2 -","2","1","","Zhao, Liang; Mak, Thomas C. W.","Silver(I)−Thiophene π Interaction in the Assembly of Coordination Networks with the Supramolecular Synthons R−C⋮C⊃Agn(R = 2- or 3-thienyl;n= 4)†","Organometallics","2007","26","18","4439","","10.1021/om700370p","","","0.71073","MoKα","","0.053","0.0374","","","0.0981","0.1105","","","","","","1.025","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073486","14.1464","0.0018","20.208","0.002","29.49","0.004","90","","90","","90","","8430.3","1.8","293","2","293","2","","","","","","","","6","P b c m","-P 2c 2b","57","(C4H3S-3)CCAg · 5AgC2F5CO2 · 4H2O","","","- C21 H3 Ag6 F25 O14 S -","- C21 H3 Ag6 F25 O14 S -","- C168 H24 Ag48 F200 O112 S8 -","8","1","","Zhao, Liang; Mak, Thomas C. W.","Silver(I)−Thiophene π Interaction in the Assembly of Coordination Networks with the Supramolecular Synthons R−C⋮C⊃Agn(R = 2- or 3-thienyl;n= 4)†","Organometallics","2007","26","18","4439","","10.1021/om700370p","","","0.71073","MoKα","","0.0914","0.0541","","","0.1473","0.1847","","","","","","1.035","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073487","11.5327","0.0019","13.747","0.002","31.942","0.005","90","","90","","90","","5064.1","1.4","155","2","155","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C27 H38 S U -","- C27 H38 S U -","- C216 H304 S8 U8 -","8","2","","Evans, William J.; Miller, Kevin A.; Ziller, Joseph W.; DiPasquale, Antonio G.; Heroux, Katie J.; Rheingold, Arnold L.","Formation of (C5Me5)2U(EPh)Me, (C5Me5)2U(EPh)2, and (C5Me5)2U(η2-TeC6H4) from (C5Me5)2UMe2and PhEEPh (E = S, Se, Te)","Organometallics","2007","26","17","4287","","10.1021/om700382a","","","0.71073","MoKα","","0.0398","0.0277","","","0.0523","0.0559","","","","","","1.08","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073488","8.909","0.0015","17.166","0.003","16.484","0.003","90","","100.332","0.002","90","","2480.1","0.8","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","UCI-KAM-5","","","- C27 H38 Se U -","- C27 H38 Se U -","- C108 H152 Se4 U4 -","4","1","","Evans, William J.; Miller, Kevin A.; Ziller, Joseph W.; DiPasquale, Antonio G.; Heroux, Katie J.; Rheingold, Arnold L.","Formation of (C5Me5)2U(EPh)Me, (C5Me5)2U(EPh)2, and (C5Me5)2U(η2-TeC6H4) from (C5Me5)2UMe2and PhEEPh (E = S, Se, Te)","Organometallics","2007","26","17","4287","","10.1021/om700382a","","","0.71073","MoKα","","0.0423","0.0331","","","0.0757","0.0794","","","","","","1.049","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4073489","10.1421","0.0016","15.659","0.002","19.378","0.003","90","","90","","90","","3077.5","0.8","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H40 Te2 U -","- C32 H40 Te2 U -","- C128 H160 Te8 U4 -","4","1","","Evans, William J.; Miller, Kevin A.; Ziller, Joseph W.; DiPasquale, Antonio G.; Heroux, Katie J.; Rheingold, Arnold L.","Formation of (C5Me5)2U(EPh)Me, (C5Me5)2U(EPh)2, and (C5Me5)2U(η2-TeC6H4) from (C5Me5)2UMe2and PhEEPh (E = S, Se, Te)","Organometallics","2007","26","17","4287","","10.1021/om700382a","","","0.71073","MoKα","","0.0459","0.0385","","","0.0869","0.0899","","","","","","1.088","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073490","8.4434","0.0013","16.064","0.003","17.729","0.003","90","","93.046","0.002","90","","2401.3","0.7","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H34 Te U -","- C26 H34 Te U -","- C104 H136 Te4 U4 -","4","1","","Evans, William J.; Miller, Kevin A.; Ziller, Joseph W.; DiPasquale, Antonio G.; Heroux, Katie J.; Rheingold, Arnold L.","Formation of (C5Me5)2U(EPh)Me, (C5Me5)2U(EPh)2, and (C5Me5)2U(η2-TeC6H4) from (C5Me5)2UMe2and PhEEPh (E = S, Se, Te)","Organometallics","2007","26","17","4287","","10.1021/om700382a","","","0.71073","MoKα","","0.0279","0.0238","","","0.0608","0.0621","","","","","","1.04","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073491","13.2497","0.0003","4.7547","0.00001","25.7761","0.0005","90","","104.636","0.0001","90","","1571.16","0.05","100","","100","","","","","","","","diethylether","4","P 1 21/n 1","-P 2yn","14","","η^6^-1,4-di(diallylamino)-trans-but-2-ene nickel(0)","","- C16 H26 N2 Ni -","- C16 H26 N2 Ni -","- C64 H104 N8 Ni4 -","4","1","","Blum, Klaus; Chernyshova, Eleonora S.; Goddard, Richard; Jonas, Klaus; Pörschke, Klaus-Richard","4,9-Diazadodeca-1,trans-6,11-trienes as Ligands for Nickel(0), Palladium(0), and Platinum(0)","Organometallics","2007","26","21","5174","","10.1021/om700390k","","","0.71073","MoKα","","0.0388","0.029","","","0.0708","0.0755","","","","","","1.037","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073492","8.5111","0.0009","6.65","0.0007","10.6084","0.0011","90","","100.347","0.002","90","","590.66","0.11","115","2","115","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C13 H16 O4 -","- C13 H16 O4 -","- C26 H32 O8 -","2","1","","McGlacken, Gerard P.; O'Brien, Ciara T.; Whitwood, Adrian C.; Fairlamb, Ian J. S.","Chiral Mono- and Bis-annelated Cyclopentadienyl Ligands Derived from Tartaric Acid: Synthesis of [(η5-Cyclopentadienyl)RuCl(cod)] and [(η5-Cyclopentadienyl)(η6-benzene)Ru]PF6Derivatives","Organometallics","2007","26","15","3722","","10.1021/om700393b","","","0.71073","MoKα","","0.0489","0.0453","","","0.1158","0.119","","","","","","1.058","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073493","5.0093","0.0009","5.7478","0.001","13.953","0.003","97.094","0.004","98.241","0.004","93.637","0.004","393.2","0.13","115","2","115","2","","","","","","","","3","P 1","P 1","1","","","","- C9 H12 O2 -","- C9 H12 O2 -","- C18 H24 O4 -","2","2","","McGlacken, Gerard P.; O'Brien, Ciara T.; Whitwood, Adrian C.; Fairlamb, Ian J. S.","Chiral Mono- and Bis-annelated Cyclopentadienyl Ligands Derived from Tartaric Acid: Synthesis of [(η5-Cyclopentadienyl)RuCl(cod)] and [(η5-Cyclopentadienyl)(η6-benzene)Ru]PF6Derivatives","Organometallics","2007","26","15","3722","","10.1021/om700393b","","","0.71073","MoKα","","0.061","0.0462","","","0.116","0.1238","","","","","","1.06","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073494","19.5862","0.0019","6.9648","0.0007","8.4605","0.0008","90","","97.906","0.002","90","","1143.16","0.19","115","2","115","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C13 H18 O4 -","- C13 H18 O4 -","- C52 H72 O16 -","4","1","","McGlacken, Gerard P.; O'Brien, Ciara T.; Whitwood, Adrian C.; Fairlamb, Ian J. S.","Chiral Mono- and Bis-annelated Cyclopentadienyl Ligands Derived from Tartaric Acid: Synthesis of [(η5-Cyclopentadienyl)RuCl(cod)] and [(η5-Cyclopentadienyl)(η6-benzene)Ru]PF6Derivatives","Organometallics","2007","26","15","3722","","10.1021/om700393b","","","0.71073","MoKα","","0.0403","0.0385","","","0.098","0.0995","","","","","","1.054","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073495","23.2056","0.0011","8.1184","0.0004","23.2436","0.0011","90","","110.365","0.001","90","","4105.2","0.3","115","2","115","2","","","","","","","","7","P 1 2 1","P 2y","3","","","","- C37 H44 Cl2 F12 O4 P2 Ru2 -","- C37 H44 Cl2 F12 O4 P2 Ru2 -","- C148 H176 Cl8 F48 O16 P8 Ru8 -","4","2","","McGlacken, Gerard P.; O'Brien, Ciara T.; Whitwood, Adrian C.; Fairlamb, Ian J. S.","Chiral Mono- and Bis-annelated Cyclopentadienyl Ligands Derived from Tartaric Acid: Synthesis of [(η5-Cyclopentadienyl)RuCl(cod)] and [(η5-Cyclopentadienyl)(η6-benzene)Ru]PF6Derivatives","Organometallics","2007","26","15","3722","","10.1021/om700393b","","","0.71073","MoKα","","0.071","0.0493","","","0.1157","0.1264","","","","","","1.029","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073496","19.719","0.005","7.3842","0.0019","15.748","0.004","90","","113.273","0.005","90","","2106.5","0.9","100","2","100","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C12 H16 O2 -","- C12 H16 O2 -","- C96 H128 O16 -","8","2","","McGlacken, Gerard P.; O'Brien, Ciara T.; Whitwood, Adrian C.; Fairlamb, Ian J. S.","Chiral Mono- and Bis-annelated Cyclopentadienyl Ligands Derived from Tartaric Acid: Synthesis of [(η5-Cyclopentadienyl)RuCl(cod)] and [(η5-Cyclopentadienyl)(η6-benzene)Ru]PF6Derivatives","Organometallics","2007","26","15","3722","","10.1021/om700393b","","","0.71073","MoKα","","0.0983","0.076","","","0.2049","0.2161","","","","","","1.132","","","","has coordinates,has disorder","178623","2020-10-21","18:00:00",""
"4073497","12.094","0.002","12.297","0.002","14.618","0.003","88.707","0.003","73.95","0.003","79.967","0.003","2056.5","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H50 B10 Li O4 Rh S3 -","- C26 H46 B10 Li O4 Rh S3 -","- C52 H92 B20 Li2 O8 Rh2 S6 -","2","1","","Cai, Shuyi; Jin, Guo-Xin","Trinuclear Rh2M Complexes (M = Ni, Pd) Bridged by Butyl Selenolato and Carborane Diselenolato Ligands","Organometallics","2007","26","22","5442","","10.1021/om7004035","","","0.71073","MoKα","","0.1556","0.0683","","","0.197","0.2165","","","","","","0.818","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073498","11.488","0.003","21.292","0.005","23.703","0.006","90","","100.899","0.004","90","","5693","2","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C33 H70 B20 Cl2 Ni Rh2 Se6 -","- C33 H68 B20 Cl2 Ni Rh2 Se6 -","- C132 H272 B80 Cl8 Ni4 Rh8 Se24 -","4","0.5","","Cai, Shuyi; Jin, Guo-Xin","Trinuclear Rh2M Complexes (M = Ni, Pd) Bridged by Butyl Selenolato and Carborane Diselenolato Ligands","Organometallics","2007","26","22","5442","","10.1021/om7004035","","","0.71073","MoKα","","0.0967","0.0424","","","0.082","0.0923","","","","","","0.791","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073499","11.421","0.003","21.371","0.007","24.034","0.006","90","","101.274","0.004","90","","5753","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C33 H70 B20 Cl2 Pd Rh2 Se6 -","- C33 H68 B20 Cl2 Pd Rh2 Se6 -","- C132 H272 B80 Cl8 Pd4 Rh8 Se24 -","4","0.5","","Cai, Shuyi; Jin, Guo-Xin","Trinuclear Rh2M Complexes (M = Ni, Pd) Bridged by Butyl Selenolato and Carborane Diselenolato Ligands","Organometallics","2007","26","22","5442","","10.1021/om7004035","","","0.71073","MoKα","","0.1219","0.0384","","","0.0564","0.0665","","","","","","0.639","","","","has coordinates","178623","2020-10-21","18:00:00",""
"4073500","9.348","0.003","18.578","0.006","26.781","0.009","90","","90","","90","","4651","3","297","2","297","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","1191 - [PdCl2((R,Sp)-3)].2(C2H4Cl2)","((R,S~p~)-1-Diphenylphosphino-2-(1-bis-(3,5-dimethylphenyl)phosphino)ethyl- ferrocene)-dichloropalladium(II), solvate with 1,2-dichloroethane (1:2)","","- C44 H48 Cl6 Fe P2 Pd -","- C40 H40 Cl2 Fe P2 Pd -","- C160 H160 Cl8 Fe4 P8 Pd4 -","4","1","","Wang, Yaping; Weissensteiner, Walter; Spindler, Felix; Arion, Vladimir B.; Mereiter, Kurt","Synthesis and Use in Asymmetric Hydrogenations of Solely Planar Chiral 1,2-Disubstituted and 1,2,3-Trisubstituted Ferrocenyl Diphosphines: A Comparative Study","Organometallics","2007","26","14","3530","","10.1021/om700405a","","","0.71073","MoKα","","0.1628","0.0778","","","0.122","0.142","","","","","","0.689","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073501","11.5451","0.0005","17.7582","0.0008","18.3153","0.0008","90","","90","","90","","3755","0.3","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","1152 YW238-1 [PdCl2(9c)].(1/2CH2Cl2+1/2EtOH)","((R~p~)-1-Diphenylphosphino-2-bis-(3,5-dimethylphenyl)phosphinomethyl- ferrocene)-dichloropalladium(II), solvate with dichloromethane and ethanol","","- C40.5 H42 Cl3 Fe O0.5 P2 Pd -","- C40.46 H41.38 Cl3.08 Fe O0.46 P2 Pd -","- C161.84 H165.52 Cl12.32 Fe4 O1.84 P8 Pd4 -","4","1","","Wang, Yaping; Weissensteiner, Walter; Spindler, Felix; Arion, Vladimir B.; Mereiter, Kurt","Synthesis and Use in Asymmetric Hydrogenations of Solely Planar Chiral 1,2-Disubstituted and 1,2,3-Trisubstituted Ferrocenyl Diphosphines: A Comparative Study","Organometallics","2007","26","14","3530","","10.1021/om700405a","","","0.71073","MoKα","","0.0238","0.0234","","","0.0554","0.0556","","","","","","1.152","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4073502","9.7526","0.0005","19.0518","0.001","22.4483","0.0012","90","","90","","90","","4171","0.4","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","1153 YW234 [PdCl2(10c)].solv","((S~p~)-1-Diphenylphosphino-2-bis-(3,5-dimethylphenyl)phosphinomethyl- 3-methyl-ferrocene)-dichloropalladium(II), solvate with unknown solvent","","- C40 H40 Cl2 Fe P2 Pd -","- C40 H40 Cl2 Fe P2 Pd -","- C160 H160 Cl8 Fe4 P8 Pd4 -","4","1","","Wang, Yaping; Weissensteiner, Walter; Spindler, Felix; Arion, Vladimir B.; Mereiter, Kurt","Synthesis and Use in Asymmetric Hydrogenations of Solely Planar Chiral 1,2-Disubstituted and 1,2,3-Trisubstituted Ferrocenyl Diphosphines: A Comparative Study","Organometallics","2007","26","14","3530","","10.1021/om700405a","","","0.71073","MoKα","","0.0331","0.0312","","","0.0749","0.0756","","","","","","1.112","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073503","9.7252","0.0005","18.5716","0.001","23.1105","0.0014","90","","90","","90","","4174","0.4","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","VA YW244 [PdCl2(11c)].CH2Cl2","(S~p~)-1-Diphenylphosphino-2-bis-(3,5-dimethylphenyl)phosphinomethyl- 3-phenyl-ferrocene)-dichloropalladium(II) dichloromethane solvate","","- C46 H44 Cl4 Fe P2 Pd -","- C46 H44 Cl4 Fe P2 Pd -","- C184 H176 Cl16 Fe4 P8 Pd4 -","4","1","","Wang, Yaping; Weissensteiner, Walter; Spindler, Felix; Arion, Vladimir B.; Mereiter, Kurt","Synthesis and Use in Asymmetric Hydrogenations of Solely Planar Chiral 1,2-Disubstituted and 1,2,3-Trisubstituted Ferrocenyl Diphosphines: A Comparative Study","Organometallics","2007","26","14","3530","","10.1021/om700405a","","","0.71073","MoKα","","0.0738","0.0497","","","0.1085","0.1215","","","","","","1.042","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073504","12.825","0.003","12.607","0.003","13.035","0.004","90","","93.952","0.004","90","","2102.5","1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H38 P4 Ru -","- C14 H38 P4 Ru -","- C56 H152 P16 Ru4 -","4","1","","Field, Leslie D.; Magill, Alison M.; Shearer, Timothy K.; Dalgarno, Scott J.; Turner, Peter","Mono- and Bis-acetylidoruthenium(II) Complexes by Controlled Metathesis of Methylruthenium Complexes with Acetylenes","Organometallics","2007","26","19","4776","","10.1021/om7004063","","","0.71073","MoKα","","0.0492","0.0449","","","0.1203","0.1237","","","","","","1.225","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073505","9.0906","0.0018","8.8671","0.0018","31.194","0.006","90","","95.538","0.003","90","","2502.7","0.9","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H40 P4 Ru -","- C21 H40 P4 Ru -","- C84 H160 P16 Ru4 -","4","1","","Field, Leslie D.; Magill, Alison M.; Shearer, Timothy K.; Dalgarno, Scott J.; Turner, Peter","Mono- and Bis-acetylidoruthenium(II) Complexes by Controlled Metathesis of Methylruthenium Complexes with Acetylenes","Organometallics","2007","26","19","4776","","10.1021/om7004063","","","0.71073","MoKα","","0.0311","0.0248","","","0.0608","0.0626","","","","","","1.119","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073506","9.4092","0.0003","9.6418","0.0003","15.5081","0.0005","79.873","0.002","79.755","0.002","70.21","0.002","1292.53","0.07","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H44 P4 Ru -","- C19 H44 P4 Ru -","- C38 H88 P8 Ru2 -","2","1","","Field, Leslie D.; Magill, Alison M.; Shearer, Timothy K.; Dalgarno, Scott J.; Turner, Peter","Mono- and Bis-acetylidoruthenium(II) Complexes by Controlled Metathesis of Methylruthenium Complexes with Acetylenes","Organometallics","2007","26","19","4776","","10.1021/om7004063","","","0.71073","MoKα","","0.0286","0.022","","","0.0535","0.0552","","","","","","1.166","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073507","18.807","0.004","10.809","0.002","15.165","0.003","90","","102.438","0.004","90","","3010.5","1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H46 P4 Ru -","- C26.04 H46.12 P4 Ru -","- C104.16 H184.48 P16 Ru4 -","4","1","","Field, Leslie D.; Magill, Alison M.; Shearer, Timothy K.; Dalgarno, Scott J.; Turner, Peter","Mono- and Bis-acetylidoruthenium(II) Complexes by Controlled Metathesis of Methylruthenium Complexes with Acetylenes","Organometallics","2007","26","19","4776","","10.1021/om7004063","","","0.71073","MoKα","","0.0877","0.0471","","","0.1025","0.121","","","","","","1.035","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073508","39.173","0.012","10.478","0.003","15.255","0.005","90","","100.81","0.007","90","","6150","3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H46 P4 Ru Si -","- C25 H46 P4 Ru Si -","- C200 H368 P32 Ru8 Si8 -","8","1","","Field, Leslie D.; Magill, Alison M.; Shearer, Timothy K.; Dalgarno, Scott J.; Turner, Peter","Mono- and Bis-acetylidoruthenium(II) Complexes by Controlled Metathesis of Methylruthenium Complexes with Acetylenes","Organometallics","2007","26","19","4776","","10.1021/om7004063","","","0.71073","MoKα","","0.0999","0.0588","","","0.1249","0.14","","","","","","1.023","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073509","23.151","0.002","11.0862","0.0009","16.9491","0.0014","90","","90","","90","","4350.1","0.6","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","04224","","","- C30 H66 K2 O3 Si4 -","- C30 H66 K2 O3 Si4 -","- C120 H264 K8 O12 Si16 -","4","1","","Quisenberry, Keith T.; Gren, Cameron K.; White, Rosemary E.; Hanusa, Timothy P.; Brennessel, William W.","Trimethylsilylated Allyl Complexes of the Heavy Alkali Metals, M[1,3-(SiMe3)2C3H3](thf)n(M = K, Cs)","Organometallics","2007","26","17","4354","","10.1021/om700410a","","","0.71073","MoKα","","0.0559","0.0422","","","0.1054","0.1177","","","","","","1.019","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073510","6.4496","0.0008","10.1112","0.0013","30.041","0.004","90","","90.587","0.002","90","","1959","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","04168","","","- C13 H29 Cs O Si2 -","- C13 H29 Cs O Si2 -","- C52 H116 Cs4 O4 Si8 -","4","1","","Quisenberry, Keith T.; Gren, Cameron K.; White, Rosemary E.; Hanusa, Timothy P.; Brennessel, William W.","Trimethylsilylated Allyl Complexes of the Heavy Alkali Metals, M[1,3-(SiMe3)2C3H3](thf)n(M = K, Cs)","Organometallics","2007","26","17","4354","","10.1021/om700410a","","","0.71073","MoKα","","0.0672","0.0574","","","0.1161","0.1198","","","","","","1.043","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073511","10.0909","0.0002","11.1677","0.0002","22.256","0.0004","102.312","0.0013","90.6913","0.0008","104.418","0.001","2367.57","0.08","103","2","103","2","","","","","","","","6","P -1","-P 1","2","2b","","","- C39 H76 O P Rh Si6 -","- C39 H76 O P Rh Si6 -","- C78 H152 O2 P2 Rh2 Si12 -","2","1","","Sasamori, Takahiro; Matsumoto, Teruyuki; Takeda, Nobuhiro; Tokitoh, Norihiro","Synthesis and Properties of a Rhodium Complex Having a Novel β-Ketophosphenato Ligand, a Heavier Congener of a β-Ketoiminato Ligand#","Organometallics","2007","26","15","3621","","10.1021/om700412g","","","0.71069","MoKα","","0.0441","0.0396","","","0.0926","0.095","","","","","","1.107","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4073512","8.8811","0.0002","8.8115","0.0002","15.1061","0.0003","90.6294","0.0009","101.888","0.001","107.159","0.002","1102.04","0.04","103","2","103","2","","","","","","","","5","P -1","-P 1","2","4","","","- C25 H36 N O Rh -","- C25 H36 N O Rh -","- C50 H72 N2 O2 Rh2 -","2","1","","Sasamori, Takahiro; Matsumoto, Teruyuki; Takeda, Nobuhiro; Tokitoh, Norihiro","Synthesis and Properties of a Rhodium Complex Having a Novel β-Ketophosphenato Ligand, a Heavier Congener of a β-Ketoiminato Ligand#","Organometallics","2007","26","15","3621","","10.1021/om700412g","","","0.71069","MoKα","","0.0252","0.0237","","","0.06","0.0607","","","","","","1.167","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073513","25.462","0.0004","12.3405","0.0002","36.7695","0.0006","90","","107.142","0.0007","90","","11040.3","0.3","103","2","103","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C41 H89 Li O2 P Si7 -","- C41 H89 Li O2 P Si7 -","- C328 H712 Li8 O16 P8 Si56 -","8","2","","Sasamori, Takahiro; Matsumoto, Teruyuki; Takeda, Nobuhiro; Tokitoh, Norihiro","Synthesis and Properties of a Rhodium Complex Having a Novel β-Ketophosphenato Ligand, a Heavier Congener of a β-Ketoiminato Ligand#","Organometallics","2007","26","15","3621","","10.1021/om700412g","","","0.71069","MoKα","","0.0998","0.0667","","","0.1635","0.1896","","","","","","1.091","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073514","11.322","0.003","14.515","0.004","14.63","0.004","90","","94.668","0.005","90","","2396.3","1.1","120","","120","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H35 Cl N2 P2 Pd -","- C21 H34.9999 Cl N2 P2 Pd -","- C84 H140 Cl4 N8 P8 Pd4 -","4","1","","Weng, Wei; Chen, Chun-Hsing; Foxman, Bruce M.; Ozerov, Oleg V.","Palladium Complexes of a P2C Ligand Containing a Central Carbene Moiety","Organometallics","2007","26","14","3315","","10.1021/om700414t","","","0.71073","MoKα","","0.0425","0.0275","","0.0559","0.0528","0.0559","","","","","","0.8027","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073515","18.34","0.002","15.2377","0.0018","20.012","0.003","90","","90","","90","","5592.5","1.2","120","","120","","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C22 H35 F3 N2 O3 P2 Pd S -","- C22 H35 F3 N2 O3 P2 Pd S -","- C176 H280 F24 N16 O24 P16 Pd8 S8 -","8","1","","Weng, Wei; Chen, Chun-Hsing; Foxman, Bruce M.; Ozerov, Oleg V.","Palladium Complexes of a P2C Ligand Containing a Central Carbene Moiety","Organometallics","2007","26","14","3315","","10.1021/om700414t","","","0.71073","MoKα","","0.044","0.0255","","0.0635","0.0519","0.0635","","","","","","0.9213","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073516","12.9795","0.0011","9.5455","0.001","22.729","0.003","90","","104.171","0.006","90","","2730.3","0.5","120","","120","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C21 H34 Cl F6 N2 P3 Pd -","- C21 H34 Cl F6 N2 P3 Pd -","- C84 H136 Cl4 F24 N8 P12 Pd4 -","4","0.5","","Weng, Wei; Chen, Chun-Hsing; Foxman, Bruce M.; Ozerov, Oleg V.","Palladium Complexes of a P2C Ligand Containing a Central Carbene Moiety","Organometallics","2007","26","14","3315","","10.1021/om700414t","","","0.71073","MoKα","","0.0476","0.0348","","0.0828","0.0686","0.0828","","","","","","0.9081","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073517","10.0718","0.0006","14.1564","0.0009","16.4521","0.0009","90","","99.678","0.002","90","","2312.4","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tris(benzoxazolin-2-on-1-yl)phenylsilane","","- C27 H17 N3 O6 Si -","- C27 H17 N3 O6 Si -","- C108 H68 N12 O24 Si4 -","4","1","","Wagler, Jörg; Hill, Anthony F.","Templated Rearrangement of Silylated Benzoxazolin-2-ones: A Novel Tridentate (ONO)2-Chelating Ligand System","Organometallics","2007","26","15","3630","","10.1021/om700416b","","","0.71073","MoKα","","0.0688","0.0435","","","0.1006","0.1099","","","","","","1.04","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073518","10.1478","0.0003","13.9645","0.0004","16.675","0.0005","90","","106.381","0.001","90","","2267.08","0.12","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[N-(o-Oxyphenyl)-benzoxazolin-2-on-1-yl-carboxamido](benzoxazolin-2-on-1-yl) phenylsilicon","","- C27 H17 N3 O6 Si -","- C27 H17 N3 O6 Si -","- C108 H68 N12 O24 Si4 -","4","1","","Wagler, Jörg; Hill, Anthony F.","Templated Rearrangement of Silylated Benzoxazolin-2-ones: A Novel Tridentate (ONO)2-Chelating Ligand System","Organometallics","2007","26","15","3630","","10.1021/om700416b","","","0.71073","MoKα","","0.0585","0.0403","","","0.0972","0.104","","","","","","1.051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073519","6.8969","0.0002","34.1668","0.0011","10.0771","0.0003","90","","104.992","0.001","90","","2293.79","0.12","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[N-(o-Oxyphenyl)-benzoxazolin-2-on-1-yl-carboxamido](benzoxazolin-2-on-1-yl) phenylsilicon","","- C27 H17 N3 O6 Si -","- C27 H17 N3 O6 Si -","- C108 H68 N12 O24 Si4 -","4","1","","Wagler, Jörg; Hill, Anthony F.","Templated Rearrangement of Silylated Benzoxazolin-2-ones: A Novel Tridentate (ONO)2-Chelating Ligand System","Organometallics","2007","26","15","3630","","10.1021/om700416b","","","0.71073","MoKα","","0.0655","0.0419","","","0.0982","0.1055","","","","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073520","9.8488","0.0002","12.2068","0.0004","12.657","0.0003","65.848","0.001","80.353","0.002","74.744","0.001","1336.42","0.06","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","[N-(o-Oxyphenyl)-benzoxazolin-2-on-1-yl-carboxamido](benzoxazolin-2-on-1-yl) phenylsilicon N-methylimidazole complex","","- C31 H23 N5 O6 Si -","- C31 H23 N5 O6 Si -","- C62 H46 N10 O12 Si2 -","2","1","","Wagler, Jörg; Hill, Anthony F.","Templated Rearrangement of Silylated Benzoxazolin-2-ones: A Novel Tridentate (ONO)2-Chelating Ligand System","Organometallics","2007","26","15","3630","","10.1021/om700416b","","","0.71073","MoKα","","0.0555","0.0423","","","0.109","0.1146","","","","","","1.025","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073521","7.7327","0.0005","7.7327","0.0005","7.7327","0.0005","115.346","0.001","115.346","0.001","115.346","0.001","250.42","0.03","100","","100","","","","","","","","diethylether","3","R -3 m :R","-P 3* 2","166","","cis,cis,cis-1,5,9-Cyclododecatriene-nickel","","- C12 H18 Ni -","- C12 Ni -","- C12 Ni -","1","0.0833333","","Chernyshova, Eleonora S.; Goddard, Richard; Pörschke, Klaus-Richard","cis,cis,cis-1,5,9-Cyclododecatriene−Metal Complexes","Organometallics","2007","26","20","4872","","10.1021/om7004172","","","0.71073","MoKα","","0.0598","0.0565","","","0.1419","0.1436","","","","","","1.161","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073522","7.1207","0.0001","12.9571","0.0002","19.3026","0.0002","90","","100.2","0.001","90","","1752.78","0.04","100","","100","","","","","","","","methanol/water/dichloromethane","5","P 1 21/c 1","-P 2ybc","14","","catena[η^2^,η^2^,η^2^-cis-cis-cis-cyclododeca-1,5,9-triene- tris(nitrato-silver)]","","- C12 H18 Ag3 N3 O9 -","- C12 H18 Ag3 N3 O9 -","- C48 H72 Ag12 N12 O36 -","4","1","","Chernyshova, Eleonora S.; Goddard, Richard; Pörschke, Klaus-Richard","cis,cis,cis-1,5,9-Cyclododecatriene−Metal Complexes","Organometallics","2007","26","20","4872","","10.1021/om7004172","","","0.71073","MoKα","","0.0244","0.0233","","","0.0556","0.0562","","","","","","1.1","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073523","9.784","0.0005","10.9423","0.0006","13.7195","0.0007","90","","95.568","0.002","90","","1461.87","0.13","100","","100","","","","","","","","dichloromethane/diethylether/ethanol","6","C 1 c 1","C -2yc","9","","cis-cis-cis-cyclododeca-1,5,9-triene-methanol-copper(i) tetrafluoroborate","","- C13 H22 B Cu F4 O -","- C13 H22 B Cu F4 O -","- C52 H88 B4 Cu4 F16 O4 -","4","1","","Chernyshova, Eleonora S.; Goddard, Richard; Pörschke, Klaus-Richard","cis,cis,cis-1,5,9-Cyclododecatriene−Metal Complexes","Organometallics","2007","26","20","4872","","10.1021/om7004172","","","0.71073","MoKα","","0.0347","0.0272","","","0.0595","0.062","","","","","","1.059","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073524","13.6998","0.0005","14.6452","0.0005","19.7498","0.0007","90","","99.439","0.002","90","","3908.9","0.2","100","","100","","","","","","","","dichloromethane","6","P 1 21/c 1","-P 2ybc","14","","cis,cis,cis-cyclododeca-1,5,9-triene-copper(i) tetrakis(perfluoro-tert-butoxy)aluminate","","- C28 H18 Al Cu F36 O4 -","- C28 H18 Al Cu F35.94 O4 -","- C112 H72 Al4 Cu4 F143.76 O16 -","4","1","","Chernyshova, Eleonora S.; Goddard, Richard; Pörschke, Klaus-Richard","cis,cis,cis-1,5,9-Cyclododecatriene−Metal Complexes","Organometallics","2007","26","20","4872","","10.1021/om7004172","","","0.71073","MoKα","","0.1085","0.0588","","","0.1229","0.1453","","","","","","1.018","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073525","12.8797","0.0002","13.9842","0.0002","18.4902","0.0003","72.795","0.0008","75.438","0.0008","81.767","0.0008","3070.55","0.08","100","","100","","","","","","","","diethylether","4","P -1","-P 1","2","","(1,2-bis-(dimethylphosphino)ethane)(cis,cis,cis-1,5,9- cyclododecatriene)nickel","","- C30 H58 Ni P2 -","- C30 H58 Ni P2 -","- C120 H232 Ni4 P8 -","4","2","","Chernyshova, Eleonora S.; Goddard, Richard; Pörschke, Klaus-Richard","cis,cis,cis-1,5,9-Cyclododecatriene−Metal Complexes","Organometallics","2007","26","20","4872","","10.1021/om7004172","","","0.71073","MoKα","","0.0448","0.0358","","","0.0803","0.0842","","","","","","1.038","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073526","11.231","0.002","13.701","0.003","23.177","0.005","102.79","0.02","92.532","0.016","114.151","0.017","3136.9","1.3","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H104 N6 O4 P4 Si4 Y2 -","- C42 H104 N6 O4 P4 Si4 Y2 -","- C84 H208 N12 O8 P8 Si8 Y4 -","2","1","","Platel, Rachel H.; Hodgson, Linda M.; White, Andrew J. P.; Williams, Charlotte K.","Synthesis and Characterization of a Series of Bis(oxo/thiophosphinic)diamido Yttrium Complexes and Their Application as Initiators for Lactide Ring-Opening Polymerization","Organometallics","2007","26","20","4955","","10.1021/om7004194","","","1.54248","CuKα","","0.0984","0.0682","","","0.1966","0.2031","","","","","","1.076","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073527","15.913","0.005","16.52","0.005","19.837","0.005","90","0.005","95.946","0.005","90","0.005","5187","3","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","organotinphosphate","","","- C46 H60 O12 P2 Sn3 -","- C46 H59 O12 P2 Sn3 -","- C184 H236 O48 P8 Sn12 -","4","1","","Chandrasekhar, Vadapalli; Sasikumar, Palani; Thilagar, Pakkirisamy","Formation of a Double-Bicapped Hexatin Phosphate Cage by a De-arylation Reaction. Synthesis and Structure of [(PhSn)6(μ-OH)2(μ3-O)2(μ-OEt)4{(ArO)PO3}4] (Ar = 2,6-i-Pr2C6H3)","Organometallics","2007","26","18","4386","","10.1021/om700421b","","","0.71069","MoKα","","0.0705","0.0512","","","0.1264","0.1377","","","","","","1.033","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073528","15.543","0.001","23.253","0.002","9.9437","0.0007","90","","90","","90","","3593.9","0.5","100","2","100","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C18 H26 Fe N2 P2 -","- C18 H26 Fe N2 P2 -","- C144 H208 Fe8 N16 P16 -","8","0.5","","Balakrishna, Maravanji S.; Mague, Joel T.","Synthesis and Molecular Structure of 1,3-Di-tert-butyl-2,4-bis(cyclodipentadienyl)iron(II) 1,3,2,4-Diazadiphosphetidine, [Fe(η5-C5H4)2(PNtBu)2]","Organometallics","2007","26","18","4677","","10.1021/om700423h","","","0.71073","MoKα","","0.0209","0.0208","","","0.0531","0.0532","","","","","","1.089","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073529","9.0629","0.0006","12.8132","0.0009","13.605","0.0007","110.401","0.004","90.731","0.004","98.07","0.004","1462.87","0.17","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H45 Al N Ru Si3 -","- C24 H45 Al N Ru Si3 -","- C48 H90 Al2 N2 Ru2 Si6 -","2","1","","Schachner, Jörg A.; Tockner, Stefan; Lund, Clinton L.; Quail, J. Wilson; Rehahn, Matthias; Müller, Jens","[1]Metallocenophanes (M = Fe, Ru) of Heavier Group 13 Elements (E = Al, Ga): Synthesis, Characterization, and Ring-Opening Polymerization","Organometallics","2007","26","18","4658","","10.1021/om7004244","","","0.71073","MoKα","","0.092","0.0574","","","0.1219","0.1385","","","","","","1.028","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073530","9.0977","0.0003","9.1156","0.0003","19.1531","0.0007","79.084","0.002","84.375","0.002","62.2079","0.0017","1379.65","0.08","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H41 Ga N Ru Si3 -","- C24 H41 Ga N Ru Si3 -","- C48 H82 Ga2 N2 Ru2 Si6 -","2","1","","Schachner, Jörg A.; Tockner, Stefan; Lund, Clinton L.; Quail, J. Wilson; Rehahn, Matthias; Müller, Jens","[1]Metallocenophanes (M = Fe, Ru) of Heavier Group 13 Elements (E = Al, Ga): Synthesis, Characterization, and Ring-Opening Polymerization","Organometallics","2007","26","18","4658","","10.1021/om7004244","","","0.71073","MoKα","","0.0552","0.0386","","","0.0813","0.0894","","","","","","1.044","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073531","12.8506","0.0005","13.0843","0.0006","13.9351","0.0006","85.869","0.003","83.163","0.003","75.657","0.002","2251.68","0.17","200","","200","","","","","","","","local","8","P -1","-P 1","2","","","","- C47 H47 B N4 O0.5 P2 Rh S3 -","- C47 H47 B N4 O0.5 P2 Rh S3 -","- C94 H94 B2 N8 O P4 Rh2 S6 -","2","1","","Crossley, Ian R.; Hill, Anthony F.; Willis, Anthony C.","Metallaboratranes: The M→B Dative Bond as a Ligand Activating Function in the Phosphaboration of Carbon Monosulfide†","Organometallics","2007","26","16","3891","","10.1021/om700433q","","","0.71073","MoKα","","0.0535","0.0336","","0.0416","0.0344","0.0344","","","","","","1.1399","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073532","8.58","0.02","11.95","0.03","21.48","0.05","74.85","0.08","85.73","0.09","83.88","0.08","2111","9","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C48 H50 Cl2 O Sb2 -","- C48 H50 Cl2 O Sb2 -","- C96 H100 Cl4 O2 Sb4 -","2","1","","Beckmann, Jens; Heek, Timm; Takahashi, Masashi","The First Mixed-Valent Antimony(III/V) Oxo Clusters (2,6-Mes2C6H3Sb)2(ClSb)4O8and (2,6-Mes2C6H3Sb)4(ClSb)4(HOSb)2O14†","Organometallics","2007","26","15","3633","","10.1021/om700434m","","","0.71073","MoKα","","0.052","0.0343","","","0.0862","0.0937","","","","","","1.065","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073533","8.791","0.0007","21.8251","0.0012","14.2469","0.0011","90","","100.473","0.006","90","","2687.9","0.3","200","","200","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H50 Cl4 O8 Sb6 -","- C48 H50 Cl4 O8 Sb6 -","- C96 H100 Cl8 O16 Sb12 -","2","0.5","","Beckmann, Jens; Heek, Timm; Takahashi, Masashi","The First Mixed-Valent Antimony(III/V) Oxo Clusters (2,6-Mes2C6H3Sb)2(ClSb)4O8and (2,6-Mes2C6H3Sb)4(ClSb)4(HOSb)2O14†","Organometallics","2007","26","15","3633","","10.1021/om700434m","","","0.71073","MoKα","","0.0532","0.0365","","","0.0798","0.0852","","","","","","1.005","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073534","15.066","0.003","15.16","0.003","15.218","0.003","62.465","0.005","63.75","0.005","82.683","0.005","2751.2","1","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C104 H122 Cl4 O18 Sb10 -","- C104 H122 Cl4 O18 Sb10 -","- C104 H122 Cl4 O18 Sb10 -","1","0.5","","Beckmann, Jens; Heek, Timm; Takahashi, Masashi","The First Mixed-Valent Antimony(III/V) Oxo Clusters (2,6-Mes2C6H3Sb)2(ClSb)4O8and (2,6-Mes2C6H3Sb)4(ClSb)4(HOSb)2O14†","Organometallics","2007","26","15","3633","","10.1021/om700434m","","","0.71073","MoKα","","0.0646","0.0408","","","0.1057","0.121","","","","","","1.077","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073535","10.657","0.002","17.087","0.003","13.974","0.003","90","","93.371","0.005","90","","2540.2","0.9","173","","173","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C52 H60 Cl4 O Sb2 -","- C52 H60 Cl4 O Sb2 -","- C104 H120 Cl8 O2 Sb4 -","2","1","","Beckmann, Jens; Heek, Timm; Takahashi, Masashi","The First Mixed-Valent Antimony(III/V) Oxo Clusters (2,6-Mes2C6H3Sb)2(ClSb)4O8and (2,6-Mes2C6H3Sb)4(ClSb)4(HOSb)2O14†","Organometallics","2007","26","15","3633","","10.1021/om700434m","","","0.71073","MoKα","","0.0398","0.0329","","","0.0822","0.0882","","","","","","1.051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073536","38.306","0.006","8.7273","0.0014","24.836","0.004","90","","99.759","0.004","90","","8183","2","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H25 Cl5 Sb2 -","- C24 H25 Cl5 Sb2 -","- C288 H300 Cl60 Sb24 -","12","3","","Beckmann, Jens; Heek, Timm; Takahashi, Masashi","The First Mixed-Valent Antimony(III/V) Oxo Clusters (2,6-Mes2C6H3Sb)2(ClSb)4O8and (2,6-Mes2C6H3Sb)4(ClSb)4(HOSb)2O14†","Organometallics","2007","26","15","3633","","10.1021/om700434m","","","0.71073","MoKα","","0.1371","0.0787","","","0.1833","0.2142","","","","","","0.966","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073537","12.233","0.005","12.595","0.004","17.932","0.008","99.87","0.02","92.75","0.02","117.27","0.02","2394.1","1.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H60 B F10 N2 Sc -","- C49 H60 B F10 N2 Sc -","- C98 H120 B2 F20 N4 Sc2 -","2","1","","Conroy, Korey D.; Hayes, Paul G.; Piers, Warren E.; Parvez, Masood","Accelerated Ligand Metalation in a β-Diketiminato Scandium Dimethyl Complex Activated with Bis(pentafluorophenyl)borane","Organometallics","2007","26","18","4464","","10.1021/om700435v","","","0.71073","MoKα","","0.072","0.0427","","","0.0965","0.113","","","","","","1","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073538","13.4712","0.0001","18.581","0.0002","26.1801","0.0002","90","","90.899","0.001","90","","6552.29","0.1","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C65 H71 B2 F20 N2 Sc -","- C65 H71 B2 F20 N2 Sc -","- C260 H284 B8 F80 N8 Sc4 -","4","1","","Conroy, Korey D.; Hayes, Paul G.; Piers, Warren E.; Parvez, Masood","Accelerated Ligand Metalation in a β-Diketiminato Scandium Dimethyl Complex Activated with Bis(pentafluorophenyl)borane","Organometallics","2007","26","18","4464","","10.1021/om700435v","","","0.71069","MoKα","","0.0974","0.0567","","","0.1443","0.1645","","","","","","1.019","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073539","10.079","0.002","12.213","0.002","12.333","0.002","73.54","0.03","70.1","0.03","75.02","0.03","1346.7","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H34 As Fe N Si -","- C28 H34 As Fe N Si -","- C56 H68 As2 Fe2 N2 Si2 -","2","1","","Du, Hongguang; Park, Ki Chul; Wang, Feng; Wang, Shuming; Liu, Qun; Zhang, Shiwei; Huang, Yuli; Shi, Shujian","Synthesis and Characterization of Homoannularly Disubstituted and Heteroannularly Trisubstituted Ferrocene Derivatives by Arsenic and Silicon or by Arsenic and Tin","Organometallics","2007","26","25","6219","","10.1021/om7004468","","","0.71073","MoKα","","0.0959","0.0462","","0.1389","0.1143","","","","1.017","1.073","1.073","","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073540","9.9989","0.0004","15.5824","0.0006","23.2901","0.0009","90","","93.903","0.001","90","","3620.3","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H47 Cl4 N2 Pt -","- C34 H47 Cl4 N2 Pt -","- C136 H188 Cl16 N8 Pt4 -","4","1","","Fantasia, Serena; Jacobsen, Heiko; Cavallo, Luigi; Nolan, Steven P.","Insertion of a N-Heterocyclic Carbene (NHC) into a Platinum−Olefin Bond","Organometallics","2007","26","14","3286","","10.1021/om700447u","","","0.71073","MoKα","","0.0332","0.0259","","","0.0642","0.0672","","","","","","1.049","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073541","11.169","0.006","11.922","0.006","19.51","0.01","85.523","0.013","76.16","0.012","64.85","0.012","2283","2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H49 Cl11 N2 Pt -","- C36 H49 Cl11 N2 Pt -","- C72 H98 Cl22 N4 Pt2 -","2","1","","Fantasia, Serena; Jacobsen, Heiko; Cavallo, Luigi; Nolan, Steven P.","Insertion of a N-Heterocyclic Carbene (NHC) into a Platinum−Olefin Bond","Organometallics","2007","26","14","3286","","10.1021/om700447u","","","0.71073","MoKα","","0.0846","0.0676","","","0.1649","0.1744","","","","","","1.151","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073542","11.8474","0.0006","16.9853","0.0008","23.2002","0.001","90","","90","","90","","4668.6","0.4","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H31 Cl5 N2 Pt -","- C18 H31 Cl5 N2 Pt -","- C144 H248 Cl40 N16 Pt8 -","8","1","","Fantasia, Serena; Jacobsen, Heiko; Cavallo, Luigi; Nolan, Steven P.","Insertion of a N-Heterocyclic Carbene (NHC) into a Platinum−Olefin Bond","Organometallics","2007","26","14","3286","","10.1021/om700447u","","","0.71073","MoKα","","0.0493","0.0376","","","0.0853","0.09","","","","","","1.083","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073543","13.6364","0.0013","12.0796","0.0011","13.9393","0.0011","90","","90","","90","","2296.1","0.4","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C8 H4 B Br2 Mn O3 -","- C8 H4 B Br2 Mn O3 -","- C64 H32 B8 Br16 Mn8 O24 -","8","1","","Kunz, Kerstin; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mn(CO)2Complexes of Cyclopentadienyl/Scorpionate Hybrid Ligands","Organometallics","2007","26","18","4663","","10.1021/om700450j","","","0.71073","MoKα","","0.0979","0.0618","","","0.1048","0.1148","","","","","","1.084","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073544","11.8591","0.0011","8.2372","0.0005","23.1905","0.0019","90","","100.31","0.007","90","","2228.8","0.3","173","2","173","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C38 H42 B2 K2 Mn2 N8 O8 -","- C38 H42 B2 K2 Mn2 N8 O8 -","- C76 H84 B4 K4 Mn4 N16 O16 -","2","0.5","","Kunz, Kerstin; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mn(CO)2Complexes of Cyclopentadienyl/Scorpionate Hybrid Ligands","Organometallics","2007","26","18","4663","","10.1021/om700450j","","","0.71073","MoKα","","0.0491","0.0373","","","0.0951","0.0997","","","","","","1.024","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073545","9.7794","0.0011","11.5583","0.0014","12.218","0.0016","105.25","0.01","109.593","0.009","101.044","0.009","1194.3","0.3","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H21 B K Mn N6 O4 -","- C21 H21 B K Mn N6 O4 -","- C42 H42 B2 K2 Mn2 N12 O8 -","2","1","","Kunz, Kerstin; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mn(CO)2Complexes of Cyclopentadienyl/Scorpionate Hybrid Ligands","Organometallics","2007","26","18","4663","","10.1021/om700450j","","","0.71073","MoKα","","0.055","0.0493","","","0.133","0.137","","","","","","1.049","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073546","10.8194","0.0007","11.6661","0.0007","13.3634","0.0009","115.469","0.005","91.69","0.005","106.515","0.005","1437.38","0.18","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H37 B K Mn N2 O8 -","- C24 H37 B K Mn N2 O8 -","- C48 H74 B2 K2 Mn2 N4 O16 -","2","1","","Kunz, Kerstin; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mn(CO)2Complexes of Cyclopentadienyl/Scorpionate Hybrid Ligands","Organometallics","2007","26","18","4663","","10.1021/om700450j","","","0.71073","MoKα","","0.0296","0.0267","","","0.0674","0.0689","","","","","","1.038","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073547","10.3349","0.0007","10.4943","0.0007","18.034","0.0012","82.379","0.006","76.52","0.005","76.384","0.005","1842.3","0.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H45 B K Mn N4 O8 -","- C33 H45 B K Mn N4 O8 -","- C66 H90 B2 K2 Mn2 N8 O16 -","2","1","","Kunz, Kerstin; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mn(CO)2Complexes of Cyclopentadienyl/Scorpionate Hybrid Ligands","Organometallics","2007","26","18","4663","","10.1021/om700450j","","","0.71073","MoKα","","0.0608","0.047","","","0.1202","0.1274","","","","","","1.018","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073548","13.0269","0.0007","16.1183","0.0009","15.9486","0.001","90","","96.974","0.005","90","","3324","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H37 B K Mn N6 O8 -","- C28 H37 B K Mn N6 O8 -","- C112 H148 B4 K4 Mn4 N24 O32 -","4","1","","Kunz, Kerstin; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mn(CO)2Complexes of Cyclopentadienyl/Scorpionate Hybrid Ligands","Organometallics","2007","26","18","4663","","10.1021/om700450j","","","0.71073","MoKα","","0.062","0.0407","","","0.0956","0.1021","","","","","","1.014","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073549","10.8317","0.0013","13.0141","0.0016","13.2055","0.0015","109.377","0.009","114.001","0.009","96.173","0.008","1539.4","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H37 B Li Mn O4 -","- C34 H37 B Li Mn O4 -","- C68 H74 B2 Li2 Mn2 O8 -","2","1","","Kunz, Kerstin; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mn(CO)2Complexes of Cyclopentadienyl/Scorpionate Hybrid Ligands","Organometallics","2007","26","18","4663","","10.1021/om700450j","","","0.71073","MoKα","","0.1179","0.0662","","","0.1489","0.17","","","","","","0.955","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073550","7.8006","0.001","9.3963","0.0008","14.452","0.0018","90","","90.86","0.01","90","","1059.2","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H9 Mn N2 O2 -","- C10 H9 Mn N2 O2 -","- C40 H36 Mn4 N8 O8 -","4","1","","Kunz, Kerstin; Vitze, Hannes; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mn(CO)2Complexes of Cyclopentadienyl/Scorpionate Hybrid Ligands","Organometallics","2007","26","18","4663","","10.1021/om700450j","","","0.71073","MoKα","","0.0499","0.0425","","","0.0934","0.0964","","","","","","1.142","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073551","7.783","0.003","14.181","0.005","20.516","0.007","90","","90","","90","","2264.4","1.4","203","2","203","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H20 Cl3 Cr N2 S2 -","- C21 H20 Cl3 Cr N2 S2 -","- C84 H80 Cl12 Cr4 N8 S8 -","4","1","","Temple, Claire N.; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Robbert","New Insight into the Role of the Metal Oxidation State in Controlling the Selectivity of the Cr-(SNS) Ethylene Trimerization Catalyst","Organometallics","2007","26","18","4598","","10.1021/om700452u","","","0.71073","MoKα","","0.0565","0.0421","","","0.0995","0.1083","","","","","","1.034","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073552","22.081","0.007","9.809","0.003","22.623","0.007","90","","90.276","0.004","90","","4900","3","203","2","203","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C39 H59.5 Cl6 Cr2 N2.5 S4 -","- C39 H59.5 Cl6 Cr2 N2.5 S4 -","- C156 H238 Cl24 Cr8 N10 S16 -","4","1","","Temple, Claire N.; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Robbert","New Insight into the Role of the Metal Oxidation State in Controlling the Selectivity of the Cr-(SNS) Ethylene Trimerization Catalyst","Organometallics","2007","26","18","4598","","10.1021/om700452u","","","0.71073","MoKα","","0.1023","0.0764","","","0.1921","0.2172","","","","","","1.063","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073553","13.871","0.005","16.849","0.006","14.368","0.005","90","","95.566","0.005","90","","3342","2","203","2","203","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27 H40 Al Cl4 Cr N S2 -","- C27 H40 Al Cl4 Cr N S2 -","- C108 H160 Al4 Cl16 Cr4 N4 S8 -","4","1","","Temple, Claire N.; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Robbert","New Insight into the Role of the Metal Oxidation State in Controlling the Selectivity of the Cr-(SNS) Ethylene Trimerization Catalyst","Organometallics","2007","26","18","4598","","10.1021/om700452u","","","0.71073","MoKα","","0.1152","0.0643","","","0.141","0.1714","","","","","","1.007","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073554","10.91","0.02","11.81","0.02","14.52","0.03","86.87","0.03","74.34","0.03","75.86","0.03","1747","6","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H43 Al Cl3 Cr N S2 -","- C28 H43 Al Cl3 Cr N S2 -","- C56 H86 Al2 Cl6 Cr2 N2 S4 -","2","1","","Temple, Claire N.; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Robbert","New Insight into the Role of the Metal Oxidation State in Controlling the Selectivity of the Cr-(SNS) Ethylene Trimerization Catalyst","Organometallics","2007","26","18","4598","","10.1021/om700452u","","","0.71073","MoKα","","0.1101","0.0664","","","0.1517","0.1733","","","","","","1.053","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073555","20.613","0.0006","21.261","0.0006","27.921","0.001","90","","90","","90","","12236.5","0.7","230","0.1","230","0.1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C69 H68 N7 P3 Zr -","- C69 H60 N7 P3 Zr -","- C552 H480 N56 P24 Zr8 -","8","1","","Smolensky, Elena; Kapon, Moshe; Eisen, Moris S.","Intermolecular Hydroamination of Methylenecyclopropane Catalyzed by Group IV Metal Complexes","Organometallics","2007","26","18","4510","","10.1021/om700455e","","","0.71073","MoKα","","0.1475","0.0563","","","0.1136","0.1334","","","","","","0.881","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073556","4.8981","0.0002","9.6292","0.0003","12.5412","0.0004","74.138","0.002","89.849","0.0018","77.1268","0.0012","553.61","0.03","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C11 H12 F6 -","- C11 H12 F6 -","- C22 H24 F12 -","2","1","","Steffen, Andreas; Hagemeister, Timo; Braun, Thomas; Jutzi, Peter; Neumann, Beate; Stammler, Hans-Georg","Synthesis of 3,3,3-Trifluoropropyl Substituted Cyclopentadienes and Their Zirconocene Derivatives: Catalytic Applications in the Polymerization of Ethylene","Organometallics","2007","26","22","5289","","10.1021/om700457c","","","0.71073","MoKα","","0.0574","0.0421","","","0.1043","0.1128","","","","","","1.046","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073557","20.5177","0.0014","6.6645","0.0007","14.6427","0.0014","90","","114.193","0.006","90","","1826.4","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H16 Cl2 F6 Zr -","- C16 H16 Cl2 F6 Zr -","- C64 H64 Cl8 F24 Zr4 -","4","0.5","","Steffen, Andreas; Hagemeister, Timo; Braun, Thomas; Jutzi, Peter; Neumann, Beate; Stammler, Hans-Georg","Synthesis of 3,3,3-Trifluoropropyl Substituted Cyclopentadienes and Their Zirconocene Derivatives: Catalytic Applications in the Polymerization of Ethylene","Organometallics","2007","26","22","5289","","10.1021/om700457c","","","0.71073","MoKα","","0.0205","0.0177","","","0.0421","0.0433","","","","","","1.087","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073558","7.7452","0.0004","10.5132","0.0005","14.7256","0.0007","76.259","0.001","75.325","0.001","84.312","0.001","1125.78","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H30 Mo O5 S -","- C23 H30 Mo O5 S -","- C46 H60 Mo2 O10 S2 -","2","1","","Ahmed, Takiya J.; Zakharov, Lev N.; Tyler, David R.","Organometallic Catalysis in Aqueous Solution. The Hydrolytic Activity of a Water-Solubleansa-Molybdocene Catalyst","Organometallics","2007","26","21","5179","","10.1021/om7004657","","","0.71073","MoKα","","0.0211","0.0203","","","0.0524","0.0531","","","","","","1.012","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073559","17.207","0.002","7.7689","0.0011","17.786","0.003","90","","110.32","0.003","90","","2229.7","0.6","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H30 Mo O5 S -","- C23 H30 Mo O5 S -","- C92 H120 Mo4 O20 S4 -","4","1","","Ahmed, Takiya J.; Zakharov, Lev N.; Tyler, David R.","Organometallic Catalysis in Aqueous Solution. The Hydrolytic Activity of a Water-Solubleansa-Molybdocene Catalyst","Organometallics","2007","26","21","5179","","10.1021/om7004657","","","0.71073","MoKα","","0.0599","0.0499","","","0.1218","0.1282","","","","","","1.084","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073560","32.751","0.01","7.589","0.002","10.966","0.003","90","","106.612","0.005","90","","2611.8","1.3","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C16 H22 Mo -","- C16 H22 Mo -","- C128 H176 Mo8 -","8","1","","Ahmed, Takiya J.; Zakharov, Lev N.; Tyler, David R.","Organometallic Catalysis in Aqueous Solution. The Hydrolytic Activity of a Water-Solubleansa-Molybdocene Catalyst","Organometallics","2007","26","21","5179","","10.1021/om7004657","","","0.71073","MoKα","","0.0815","0.0639","","","0.1597","0.1779","","","","","","1.035","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073561","27.833","0.004","15.0277","0.0019","21.017","0.005","90","","124.407","0.001","90","","7253","2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C84 H80 F2 N2 O4 P2 Pd2 -","- C84 H80 F2 N2 O4 P2 Pd2 -","- C336 H320 F8 N8 O16 P8 Pd8 -","4","0.5","","Grushin, Vladimir V.; Marshall, William J.","Ar−F Reductive Elimination from Palladium(II) Revisited†","Organometallics","2007","26","20","4997","","10.1021/om700469k","","","0.71073","MoKα","","0.0758","0.0454","","","0.0938","0.109","","","","","","1.052","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073562","11.202","0.002","14.694","0.003","17.701","0.003","82.781","0.003","88.86","0.003","76.945","0.003","2815.7","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H52 Cl0 F2 P2 Pd2 -","- C54 H52 F2 P2 Pd2 -","- C108 H104 F4 P4 Pd4 -","2","1","","Grushin, Vladimir V.; Marshall, William J.","Ar−F Reductive Elimination from Palladium(II) Revisited†","Organometallics","2007","26","20","4997","","10.1021/om700469k","","","0.71073","MoKα","","0.0627","0.0431","","","0.1094","0.1171","","","","","","0.974","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073563","29.772","0.009","13.907","0.004","17.997","0.006","90","","124.594","0.005","90","","6134","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C58 H62 Cl4 F2 P2 Pd2 -","- C58 H62 Cl4 F2 P2 Pd2 -","- C232 H248 Cl16 F8 P8 Pd8 -","4","0.5","","Grushin, Vladimir V.; Marshall, William J.","Ar−F Reductive Elimination from Palladium(II) Revisited†","Organometallics","2007","26","20","4997","","10.1021/om700469k","","","0.71073","MoKα","","0.0807","0.0524","","","0.1436","0.1601","","","","","","1.052","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073564","15.578","0.003","16.113","0.003","16.354","0.003","94.252","0.003","113.506","0.003","115.104","0.003","3259.1","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C61 H66 Cl10 F2 O2 P2 Pd2 -","- C61 H66 Cl10 F2 O2 P2 Pd2 -","- C122 H132 Cl20 F4 O4 P4 Pd4 -","2","1","","Grushin, Vladimir V.; Marshall, William J.","Ar−F Reductive Elimination from Palladium(II) Revisited†","Organometallics","2007","26","20","4997","","10.1021/om700469k","","","0.71073","MoKα","","0.1149","0.0625","","","0.1546","0.1969","","","","","","1.032","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073565","14.4705","0.0004","10.5311","0.0003","28.5654","0.0009","90","","91.963","0.001","90","","4350.5","0.2","80","2","80","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H4 O11 Ru4 S -","- C17 H4 O11 Ru4 S -","- C136 H32 O88 Ru32 S8 -","8","1","","Hassan, Mohammad R.; Kabir, Shariff E.; Nicholson, Brian K.; Nordlander, Ebbe; Uddin, Md. Nazim","New Ruthenium Carbonyl Clusters Containing Unusual μ5-Sulfido-, μ4-Benzyne-, and Thianthrene-Derived Ligands: Insertion of Ruthenium into the Thianthrene Ring by C−S Activation","Organometallics","2007","26","18","4627","","10.1021/om7004707","","","0.71073","MoKα","","0.0406","0.0392","","","0.0942","0.0948","","","","","","1.225","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073566","11.456","0.001","15.88","0.001","19.179","0.001","90","","90.261","0.001","90","","3489","0.4","87","2","87","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H8 O17 Ru6 S2 -","- C29 H8 O17 Ru6 S2 -","- C116 H32 O68 Ru24 S8 -","4","1","","Hassan, Mohammad R.; Kabir, Shariff E.; Nicholson, Brian K.; Nordlander, Ebbe; Uddin, Md. Nazim","New Ruthenium Carbonyl Clusters Containing Unusual μ5-Sulfido-, μ4-Benzyne-, and Thianthrene-Derived Ligands: Insertion of Ruthenium into the Thianthrene Ring by C−S Activation","Organometallics","2007","26","18","4627","","10.1021/om7004707","","","0.71073","MoKα","","0.0248","0.0219","","","0.0497","0.0511","","","","","","1.058","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073567","9.4548","0.0001","10.5298","0.0001","19.1888","0.0002","90.504","0.001","101.411","0.001","115.811","0.001","1676.01","0.03","89","2","89","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H12 O13 Ru5 S2 -","- C31 H12 O13 Ru5 S2 -","- C62 H24 O26 Ru10 S4 -","2","1","","Hassan, Mohammad R.; Kabir, Shariff E.; Nicholson, Brian K.; Nordlander, Ebbe; Uddin, Md. Nazim","New Ruthenium Carbonyl Clusters Containing Unusual μ5-Sulfido-, μ4-Benzyne-, and Thianthrene-Derived Ligands: Insertion of Ruthenium into the Thianthrene Ring by C−S Activation","Organometallics","2007","26","18","4627","","10.1021/om7004707","","","0.71073","MoKα","","0.0251","0.0216","","","0.0535","0.0552","","","","","","1.054","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073568","18.2731","0.0002","11.7362","0.0002","17.7859","0.0003","90","","108.452","0.001","90","","3618.21","0.1","89","2","89","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32.5 H16 Cl N O12 Ru5 S2 -","- C32.5 H15 Cl N O12 Ru5 S2 -","- C130 H60 Cl4 N4 O48 Ru20 S8 -","4","1","","Hassan, Mohammad R.; Kabir, Shariff E.; Nicholson, Brian K.; Nordlander, Ebbe; Uddin, Md. Nazim","New Ruthenium Carbonyl Clusters Containing Unusual μ5-Sulfido-, μ4-Benzyne-, and Thianthrene-Derived Ligands: Insertion of Ruthenium into the Thianthrene Ring by C−S Activation","Organometallics","2007","26","18","4627","","10.1021/om7004707","","","0.71073","MoKα","","0.0425","0.0309","","","0.065","0.0694","","","","","","1.074","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073569","13.3729","0.0008","17.9756","0.001","20.4188","0.0012","83.627","0.001","80.736","0.001","83.703","0.001","4793.3","0.5","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C56 H68 Hf N2 -","- C56 H68 Hf N2 -","- C224 H272 Hf4 N8 -","4","2","","De Waele, Philip; Jazdzewski, Brian A.; Klosin, Jerzy; Murray, Rex E.; Theriault, Curt N.; Vosejpka, Paul C.; Petersen, Jeffrey L.","Synthesis of Hafnium and Zirconium Imino−Amido Complexes from Bis-imine Ligands. A New Family of Olefin Polymerization Catalysts","Organometallics","2007","26","16","3896","","10.1021/om7004723","","","0.71073","MoKα","","0.0595","0.0396","","","0.091","0.0988","","","","","","0.979","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073570","18.6846","0.0016","10.4569","0.0009","19.1504","0.0017","90","","102.568","0.002","90","","3652","0.6","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H54 Hf N2 -","- C42 H54 Hf N2 -","- C168 H216 Hf4 N8 -","4","1","","De Waele, Philip; Jazdzewski, Brian A.; Klosin, Jerzy; Murray, Rex E.; Theriault, Curt N.; Vosejpka, Paul C.; Petersen, Jeffrey L.","Synthesis of Hafnium and Zirconium Imino−Amido Complexes from Bis-imine Ligands. A New Family of Olefin Polymerization Catalysts","Organometallics","2007","26","16","3896","","10.1021/om7004723","","","0.71073","MoKα","","0.0522","0.0287","","","0.0689","0.0825","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073571","18.6901","0.0009","10.5637","0.0005","19.1698","0.0009","90","","102.335","0.001","90","","3697.4","0.3","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H54 N2 Zr -","- C42 H54 N2 Zr -","- C168 H216 N8 Zr4 -","4","1","","De Waele, Philip; Jazdzewski, Brian A.; Klosin, Jerzy; Murray, Rex E.; Theriault, Curt N.; Vosejpka, Paul C.; Petersen, Jeffrey L.","Synthesis of Hafnium and Zirconium Imino−Amido Complexes from Bis-imine Ligands. A New Family of Olefin Polymerization Catalysts","Organometallics","2007","26","16","3896","","10.1021/om7004723","","","0.71073","MoKα","","0.0433","0.0372","","","0.1004","0.1072","","","","","","1.051","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073572","13.5237","0.001","18.2574","0.0014","18.3733","0.0014","90","","91.016","0.002","90","","4535.8","0.6","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C54 H64 N2 Zr -","- C54 H64 N2 Zr -","- C216 H256 N8 Zr4 -","4","1","","De Waele, Philip; Jazdzewski, Brian A.; Klosin, Jerzy; Murray, Rex E.; Theriault, Curt N.; Vosejpka, Paul C.; Petersen, Jeffrey L.","Synthesis of Hafnium and Zirconium Imino−Amido Complexes from Bis-imine Ligands. A New Family of Olefin Polymerization Catalysts","Organometallics","2007","26","16","3896","","10.1021/om7004723","","","0.71073","MoKα","","0.0508","0.0409","","","0.1081","0.117","","","","","","1.038","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073573","13.1933","0.0005","11.7672","0.0005","21.042","0.0007","90","","105.379","0.002","90","","3149.8","0.2","100","2","100","2","","","","","","","synthesis","6","P 1 21/c 1","-P 2ybc","14","","","","- C66 H74 F12 O3 P4 Ru2 -","- C66 H74 F12 O3 P4 Ru2 -","- C132 H148 F24 O6 P8 Ru4 -","2","0.5","","Díez, J.; Gamasa, M. P.; Lastra, E.; Villar, A.; Pérez-Carreño, E.","Regioselective Synthesis of η4-Dienylphosphane Ruthenium Complexes by Oxidative Coupling Reactions","Organometallics","2007","26","22","5315","","10.1021/om700476f","","","1.54178","CuKα","","0.0782","0.0494","","","0.1103","0.1231","","","","","","1.012","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4073574","10.6948","0.0002","38.0333","0.0008","15.2449","0.0002","90","","110.003","0.001","90","","5826.92","0.18","100","2","100","2","","","","","","","synthesis","6","C 1 c 1","C -2yc","9","","","","- C31 H32 F6 O P2 Ru -","- C31 H32 F6 O P2 Ru -","- C248 H256 F48 O8 P16 Ru8 -","8","2","","Díez, J.; Gamasa, M. P.; Lastra, E.; Villar, A.; Pérez-Carreño, E.","Regioselective Synthesis of η4-Dienylphosphane Ruthenium Complexes by Oxidative Coupling Reactions","Organometallics","2007","26","22","5315","","10.1021/om700476f","","","1.54178","CuKα","","0.06","0.0504","","","0.115","0.1204","","","","","","1.021","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073575","16.1051","0.0002","11.723","0.0002","17.6605","0.0002","90","","106.563","0.001","90","","3195.95","0.08","100","2","100","2","","","","","","","synthesis","6","P 1 21/n 1","-P 2yn","14","","","","- C64 H70 F12 O3 P4 Ru2 -","- C64 H70 F12 O3 P4 Ru2 -","- C128 H140 F24 O6 P8 Ru4 -","2","0.5","","Díez, J.; Gamasa, M. P.; Lastra, E.; Villar, A.; Pérez-Carreño, E.","Regioselective Synthesis of η4-Dienylphosphane Ruthenium Complexes by Oxidative Coupling Reactions","Organometallics","2007","26","22","5315","","10.1021/om700476f","","","1.54178","CuKα","","0.059","0.0527","","","0.1461","0.1526","","","","","","1.035","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073576","9.4165","0.0001","18.136","0.0002","16.3007","0.0002","90","","106.866","0.001","90","","2664.05","0.05","150","2","150","2","","","","","","","synthesis","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H28 F6 P2 Ru -","- C29 H28 F6 P2 Ru -","- C116 H112 F24 P8 Ru4 -","4","1","","Díez, J.; Gamasa, M. P.; Lastra, E.; Villar, A.; Pérez-Carreño, E.","Regioselective Synthesis of η4-Dienylphosphane Ruthenium Complexes by Oxidative Coupling Reactions","Organometallics","2007","26","22","5315","","10.1021/om700476f","","","1.5418","CuKα","","0.0364","0.0356","","","0.0929","0.0935","","","","","","1.099","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073577","13.2196","0.0004","11.844","0.0004","9.7441","0.0003","90","","90","","90","","1525.66","0.08","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C16 H22 Cr Si2 -","- C16 H22 Cr Si2 -","- C64 H88 Cr4 Si8 -","4","0.5","","Braunschweig, Holger; Kupfer, Thomas","Transition-Metal-Catalyzed Bis-Silylation of Propyne by [2]Chromoarenophanes","Organometallics","2007","26","18","4634","","10.1021/om700479h","","","0.71073","MoKα","","0.0245","0.0237","","","0.0681","0.0688","","","","","","1.071","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073578","9.4352","0.0003","12.5514","0.0004","31.2216","0.001","90","","90","","90","","3697.4","0.2","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C19 H26 Cr Si2 -","- C19 H26 Cr Si2 -","- C152 H208 Cr8 Si16 -","8","1","","Braunschweig, Holger; Kupfer, Thomas","Transition-Metal-Catalyzed Bis-Silylation of Propyne by [2]Chromoarenophanes","Organometallics","2007","26","18","4634","","10.1021/om700479h","","","0.71073","MoKα","","0.0323","0.0308","","","0.0735","0.0743","","","","","","1.118","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073579","10.1815","0.0004","12.3894","0.0005","19.291","0.0007","93.776","0.002","90.841","0.002","93.436","0.002","2423.35","0.16","100","2","95","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H76 Cr2 Li4 O7 -","- C52 H76 Cr2 Li4 O7 -","- C104 H152 Cr4 Li8 O14 -","2","1","","Braunschweig, Holger; Kupfer, Thomas","Transition-Metal-Catalyzed Bis-Silylation of Propyne by [2]Chromoarenophanes","Organometallics","2007","26","18","4634","","10.1021/om700479h","","","0.71073","MoKα","","0.1134","0.0727","","","0.1796","0.2116","","","","","","1.027","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4073580","13.551","0.003","15.774","0.003","20.193","0.004","94.07","0.03","93.67","0.03","114.56","0.03","3895.1","1.7","253","2","253","2","","","","","","","","8","P -1","-P 1","2","","","","- C31 H32 F6 N4.5 O5.25 P Re S3 -","- C31 H27 F6 N4.5 O5.25 P Re S3 -","- C124 H108 F24 N18 O21 P4 Re4 S12 -","4","2","","Li, Mei-Jin; Ko, Chi-Chiu; Duan, Gong-Ping; Zhu, Nianyong; Yam, Vivian Wing-Wah","Functionalized Rhenium(I) Complexes with Crown Ether Pendants Derived from 1,10-Phenanthroline: Selective Sensing for Metal Ions","Organometallics","2007","26","25","6091","","10.1021/om700481f","","","0.71073","MoKα","","0.0857","0.0606","","","0.1595","0.1687","","","","","","0.963","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073581","11.512","0.002","9.568","0.0019","14.109","0.003","90","","97.74","0.03","90","","1539.9","0.5","173","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 B Cl N4 Zr -","- C14 H16 B Cl N4 Zr -","- C56 H64 B4 Cl4 N16 Zr4 -","4","1","","Hill, Anthony F.; Smith, Matthew K.","Cyclooctatetraene Poly(azolyl)borate Complexes of Zirconium: [Zr(κ2-L)Cl(η-C8H8)] (L = H2B(pz)2, HB(pzMe2)3, H2B(mt)2; pz = Pyrazolyl, mt = Methimazolyl)","Organometallics","2007","26","16","3900","","10.1021/om700484h","","","0.71073","MoKα","","0.0478","0.0322","","","0.0776","0.0852","","","","","","1.025","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073582","11.077","0.002","15.937","0.003","27.729","0.006","90","","99.38","0.03","90","","4829.7","1.7","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H30 B Cl N6 Zr -","- C23 H30 B Cl N6 Zr -","- C184 H240 B8 Cl8 N48 Zr8 -","8","2","","Hill, Anthony F.; Smith, Matthew K.","Cyclooctatetraene Poly(azolyl)borate Complexes of Zirconium: [Zr(κ2-L)Cl(η-C8H8)] (L = H2B(pz)2, HB(pzMe2)3, H2B(mt)2; pz = Pyrazolyl, mt = Methimazolyl)","Organometallics","2007","26","16","3900","","10.1021/om700484h","","","0.71073","MoKα","","0.0648","0.0421","","","0.0934","0.1042","","","","","","1.03","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073583","10.126","0.002","11.608","0.002","13.69","0.003","75.95","0.03","72.01","0.03","69.47","0.03","1416.9","0.6","200","2","200","2","","","","","","","","8","P -1","-P 1","2","","","","- C24 H36 B Cl N4 O2 S2 Zr -","- C24 H36 B Cl N4 O2 S2 Zr -","- C48 H72 B2 Cl2 N8 O4 S4 Zr2 -","2","1","","Hill, Anthony F.; Smith, Matthew K.","Cyclooctatetraene Poly(azolyl)borate Complexes of Zirconium: [Zr(κ2-L)Cl(η-C8H8)] (L = H2B(pz)2, HB(pzMe2)3, H2B(mt)2; pz = Pyrazolyl, mt = Methimazolyl)","Organometallics","2007","26","16","3900","","10.1021/om700484h","","","0.71073","MoKα","","0.0614","0.0497","","","0.1347","0.1509","","","","","","0.841","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073584","17.415","0.004","19.118","0.004","13.417","0.003","90","","90","","90","","4467.1","1.7","173","2","173","2","","","","","","","","5","C m c 21","C 2c -2","36","","","","- C18.5 H19 Cl3 O3 Zr2.5 -","- C18.5 H19 Cl3 O3 Zr2.5 -","- C148 H152 Cl24 O24 Zr20 -","8","1","","Hill, Anthony F.; Smith, Matthew K.","Cyclooctatetraene Poly(azolyl)borate Complexes of Zirconium: [Zr(κ2-L)Cl(η-C8H8)] (L = H2B(pz)2, HB(pzMe2)3, H2B(mt)2; pz = Pyrazolyl, mt = Methimazolyl)","Organometallics","2007","26","16","3900","","10.1021/om700484h","","","0.71073","MoKα","","0.0718","0.0575","","","0.1604","0.1702","","","","","","1.105","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073585","10.359","0.005","22.3","0.01","19.612","0.008","90","","102.577","0.011","90","","4422","3","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H76 P2 Ru -","- C46 H76 P2 Ru -","- C184 H304 P8 Ru4 -","4","1","","Menye-Biyogo, Richard; Delpech, Fabien; Castel, Annie; Pimienta, Véronique; Gornitzka, Heinz; Rivière, Pierre","Ruthenium-Stabilized Low-Coordinate Phosphorus Atoms.p-Cymene Ligand as Reactivity Switch","Organometallics","2007","26","20","5091","","10.1021/om7004854","","","0.71073","MoKα","","0.2257","0.0909","","","0.1628","0.2229","","","","","","0.913","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073586","10.385","0.013","15.164","0.018","15.641","0.019","61.91","0.02","73.53","0.02","78.16","0.02","2076","4","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H68 P2 Ru -","- C42 H68 P2 Ru -","- C84 H136 P4 Ru2 -","2","1","","Menye-Biyogo, Richard; Delpech, Fabien; Castel, Annie; Pimienta, Véronique; Gornitzka, Heinz; Rivière, Pierre","Ruthenium-Stabilized Low-Coordinate Phosphorus Atoms.p-Cymene Ligand as Reactivity Switch","Organometallics","2007","26","20","5091","","10.1021/om7004854","","","0.71073","MoKα","","0.236","0.1005","","","0.2011","0.2578","","","","","","0.884","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073587","10.669","0.011","13.778","0.013","18.348","0.018","90.854","0.016","95.22","0.019","99.5","0.02","2648","5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H81 B F4 P2 Ru -","- C53 H81 B F4 P2 Ru -","- C106 H162 B2 F8 P4 Ru2 -","2","1","","Menye-Biyogo, Richard; Delpech, Fabien; Castel, Annie; Pimienta, Véronique; Gornitzka, Heinz; Rivière, Pierre","Ruthenium-Stabilized Low-Coordinate Phosphorus Atoms.p-Cymene Ligand as Reactivity Switch","Organometallics","2007","26","20","5091","","10.1021/om7004854","","","0.71073","MoKα","","0.381","0.1102","","","0.1772","0.2964","","","","","","0.756","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073588","10.0467","0.0008","15.3629","0.0012","15.5878","0.0013","90","","101.615","0.002","90","","2356.7","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H44 Ir P3 Si -","- C16 H44 Ir P3 Si -","- C64 H176 Ir4 P12 Si4 -","4","1","","Bleeke, John R.; Thananatthanachon, Todsapon; Rath, Nigam P.","Synthesis, Structure, and Spectroscopy of Silaallyl− and Silapentadienyl−Iridium−Phosphine Complexes1","Organometallics","2007","26","16","3904","","10.1021/om700487n","","","0.71073","MoKα","","0.0575","0.0341","","","0.059","0.0654","","","","","","1.005","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073589","19.2398","0.0009","9.405","0.0004","14.0453","0.0006","90","","119.323","0.002","90","","2215.87","0.17","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C15 H40 Ir P3 Si -","- C15 H40 Ir P3 Si -","- C60 H160 Ir4 P12 Si4 -","4","1","","Bleeke, John R.; Thananatthanachon, Todsapon; Rath, Nigam P.","Synthesis, Structure, and Spectroscopy of Silaallyl− and Silapentadienyl−Iridium−Phosphine Complexes1","Organometallics","2007","26","16","3904","","10.1021/om700487n","","","0.71073","MoKα","","0.0163","0.0161","","","0.0386","0.0387","","","","","","1.061","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073590","24.867","0.002","13.4013","0.0007","13.4807","0.0007","90","","90","","90","","4492.4","0.5","100","2","100","2","","","","","","","","6","I b a m","-I 2 2c","72","","","","- C15 H39 Cl Ir P3 Si -","- C15 H39 Cl Ir P3 Si -","- C120 H312 Cl8 Ir8 P24 Si8 -","8","0.5","","Bleeke, John R.; Thananatthanachon, Todsapon; Rath, Nigam P.","Synthesis, Structure, and Spectroscopy of Silaallyl− and Silapentadienyl−Iridium−Phosphine Complexes1","Organometallics","2007","26","16","3904","","10.1021/om700487n","","","0.71073","MoKα","","0.0573","0.0383","","","0.0863","0.0924","","","","","","1.08","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073591","12.651","0.0006","13.0711","0.0006","13.2542","0.0006","90","","96.138","0.002","90","","2179.18","0.17","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C15 H38 Ir P3 Si -","- C15 H38 Ir P3 Si -","- C60 H152 Ir4 P12 Si4 -","4","1","","Bleeke, John R.; Thananatthanachon, Todsapon; Rath, Nigam P.","Synthesis, Structure, and Spectroscopy of Silaallyl− and Silapentadienyl−Iridium−Phosphine Complexes1","Organometallics","2007","26","16","3904","","10.1021/om700487n","","","0.71073","MoKα","","0.0184","0.0173","","","0.0325","0.0328","","","","","","1.028","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073592","16.98","0.001","33.843","0.002","18.534","0.001","90","","90","","90","","10650.6","1.1","296.2","","296","","","","","","","","","7","P b c a","-P 2ac 2ab","61","complex 1a","","","- C51 H83 Cl N O2 P2 Rh -","- C51 H83 Cl N O2 P2 Rh -","- C408 H664 Cl8 N8 O16 P16 Rh8 -","8","1","","Hayashi, Akito; Okazaki, Masaaki; Ozawa, Fumiyuki; Tanaka, Rika","Synthesis, Structures, and Catalytic Properties of Late-Transition-Metal 2,6-Bis(2-phosphaethenyl)pyridine Complexes","Organometallics","2007","26","21","5246","","10.1021/om700488y","","x-ray","0.7107","MoKα","","","0.063","","","","0.1831","","","","","","1.032","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073593","11.73","0.003","13.31","0.003","18.69","0.005","95.4","0.005","95.81","0.004","110.56","0.005","2691.6","1.2","223.2","","223","","","","","","","","","6","P -1","-P 1","2","complex 3","","","- C45 H66 Cu F6 N2 P3 -","- C45 H66 Cu F6 N2 P3 -","- C90 H132 Cu2 F12 N4 P6 -","2","1","","Hayashi, Akito; Okazaki, Masaaki; Ozawa, Fumiyuki; Tanaka, Rika","Synthesis, Structures, and Catalytic Properties of Late-Transition-Metal 2,6-Bis(2-phosphaethenyl)pyridine Complexes","Organometallics","2007","26","21","5246","","10.1021/om700488y","","x-ray","0.7107","MoKα","","","0.0866","","","","0.1865","","","","","","1.742","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073594","10.953","0.001","14.836","0.002","15.422","0.001","79.143","0.006","74.963","0.005","85.396","0.007","2375.6","0.4","223.2","","223","","","","","","","","","8","P -1","-P 1","2","complex 4","","","- C44 H65 Ag F3 N O4 P2 S -","- C44 H65 Ag F3 N O4 P2 S -","- C88 H130 Ag2 F6 N2 O8 P4 S2 -","2","1","","Hayashi, Akito; Okazaki, Masaaki; Ozawa, Fumiyuki; Tanaka, Rika","Synthesis, Structures, and Catalytic Properties of Late-Transition-Metal 2,6-Bis(2-phosphaethenyl)pyridine Complexes","Organometallics","2007","26","21","5246","","10.1021/om700488y","","x-ray","0.7107","MoKα","","","0.048","","","","0.1123","","","","","","1.048","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073595","10.8504","0.0003","9.7539","0.0004","18.4811","0.0005","90","","95.123","0.002","90","","1948.11","0.11","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H31 F6 N2 P -","- C17 H31 F6 N2 P -","- C68 H124 F24 N8 P4 -","4","1","","Iglesias, Manuel; Beetstra, Dirk J.; Stasch, Andreas; Horton, Peter N.; Hursthouse, Michael B.; Coles, Simon J.; Cavell, Kingsley J.; Dervisi, Athanasia; Fallis, Ian A.","First Examples of Diazepanylidene Carbenes and Their Late-Transition-Metal Complexes","Organometallics","2007","26","19","4800","","10.1021/om7004904","","","0.71073","MoKα","","0.064","0.0404","","","0.0908","0.1018","","","","","","1.026","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073596","10.2267","0.0004","14.7526","0.0007","15.942","0.0007","90","","91.736","0.002","90","","2404.07","0.18","120","2","120","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C20 H35 F6 N2 O2 P -","- C20 H35 F6 N2 O2 P -","- C80 H140 F24 N8 O8 P4 -","4","2","","Iglesias, Manuel; Beetstra, Dirk J.; Stasch, Andreas; Horton, Peter N.; Hursthouse, Michael B.; Coles, Simon J.; Cavell, Kingsley J.; Dervisi, Athanasia; Fallis, Ian A.","First Examples of Diazepanylidene Carbenes and Their Late-Transition-Metal Complexes","Organometallics","2007","26","19","4800","","10.1021/om7004904","","","0.71073","MoKα","","0.2011","0.0879","","","0.1949","0.2674","","","","","","1.087","","","","has coordinates,has disorder","178624","2020-10-21","18:00:00",""
"4073597","13.075","0.003","11.031","0.002","16.955","0.003","90","","102.86","0.03","90","","2384.1","0.9","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H42 Cl N2 Rh -","- C25 H42 Cl N2 Rh -","- C100 H168 Cl4 N8 Rh4 -","4","1","","Iglesias, Manuel; Beetstra, Dirk J.; Stasch, Andreas; Horton, Peter N.; Hursthouse, Michael B.; Coles, Simon J.; Cavell, Kingsley J.; Dervisi, Athanasia; Fallis, Ian A.","First Examples of Diazepanylidene Carbenes and Their Late-Transition-Metal Complexes","Organometallics","2007","26","19","4800","","10.1021/om7004904","","","0.71073","MoKα","","0.0404","0.0316","","","0.0689","0.0726","","","","","","1.038","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073598","13.0652","0.0002","11.0159","0.0002","16.9846","0.0003","90","","102.66","0.001","90","","2385.08","0.07","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H42 Cl Ir N2 -","- C25 H42 Cl Ir N2 -","- C100 H168 Cl4 Ir4 N8 -","4","1","","Iglesias, Manuel; Beetstra, Dirk J.; Stasch, Andreas; Horton, Peter N.; Hursthouse, Michael B.; Coles, Simon J.; Cavell, Kingsley J.; Dervisi, Athanasia; Fallis, Ian A.","First Examples of Diazepanylidene Carbenes and Their Late-Transition-Metal Complexes","Organometallics","2007","26","19","4800","","10.1021/om7004904","","","0.71073","MoKα","","0.0258","0.0216","","","0.05","0.0516","","","","","","1.068","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073599","9.274","0.005","16.763","0.005","13.187","0.005","90","0.005","91.532","0.005","90","0.005","2049.3","1.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H30 Cl Ir N2 O2 -","- C19 H30 Cl Ir N2 O2 -","- C76 H120 Cl4 Ir4 N8 O8 -","4","1","","Iglesias, Manuel; Beetstra, Dirk J.; Stasch, Andreas; Horton, Peter N.; Hursthouse, Michael B.; Coles, Simon J.; Cavell, Kingsley J.; Dervisi, Athanasia; Fallis, Ian A.","First Examples of Diazepanylidene Carbenes and Their Late-Transition-Metal Complexes","Organometallics","2007","26","19","4800","","10.1021/om7004904","","","0.71069","MoKα","","0.0242","0.0228","","","0.0564","0.0571","","","","","","1.09","","","","has coordinates","178624","2020-10-21","18:00:00",""
"4073600","20.584","0.004","12.814","0.003","27.659","0.006","90","","109.39","0.03","90","","6882","3","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C28.75 H47.75 Br Ir N2 O2 -","- C28 H46 Br Ir N2 O2 -","- C224 H368 Br8 Ir8 N16 O16 -","8","4","","Iglesias, Manuel; Beetstra, Dirk J.; Stasch, Andreas; Horton, Peter N.; Hursthouse, Michael B.; Coles, Simon J.; Cavell, Kingsley J.; Dervisi, Athanasia; Fallis, Ian A.","First Examples of Diazepanylidene Carbenes and Their Late-Transition-Metal Complexes","Organometallics","2007","26","19","4800","","10.1021/om7004904","","","0.71073","MoKα","","0.0705","0.0563","","","0.1389","0.1466","","","","","","1.061","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073601","11.7981","0.0003","11.0902","0.0002","21.1619","0.0005","90","","90","","90","","2768.89","0.11","120","2","120","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C31 H50 N2 Pt -","- C31 H50 N2 Pt -","- C124 H200 N8 Pt4 -","4","0.5","","Iglesias, Manuel; Beetstra, Dirk J.; Stasch, Andreas; Horton, Peter N.; Hursthouse, Michael B.; Coles, Simon J.; Cavell, Kingsley J.; Dervisi, Athanasia; Fallis, Ian A.","First Examples of Diazepanylidene Carbenes and Their Late-Transition-Metal Complexes","Organometallics","2007","26","19","4800","","10.1021/om7004904","","","0.71073","MoKα","","0.0326","0.0224","","","0.0451","0.049","","","","","","1.051","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073602","25.707","0.003","12.2251","0.0012","24.111","0.002","90","","103.182","0.001","90","","7377.7","1.3","138","","138","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H30 F6 N4 O10 Pd2 S2 -","- C34 H30 F6 N4 O10 Pd2 S2 -","- C272 H240 F48 N32 O80 Pd16 S16 -","8","1","","Conley, Nicholas R.; Labios, Liezel A.; Pearson, David M.; McCrory, Charles C. L.; Waymouth, Robert M.","Aerobic Alcohol Oxidation with Cationic Palladium Complexes: Insights into Catalyst Design and Decomposition","Organometallics","2007","26","23","5447","","10.1021/om700492n","","","0.71073","MoKα","","0.0422","0.0293","","","0.0677","0.0725","","","","","","1.026","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073603","18.364","0.014","8.892","0.007","22.191","0.016","90","","115.099","0.008","90","","3281","4","173","2","173","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","07041I","","","- C30 H26 F6 N4 O8 Pd2 S2 -","- C30 H26 F6 N4 O8 Pd2 S2 -","- C120 H104 F24 N16 O32 Pd8 S8 -","4","0.5","","Conley, Nicholas R.; Labios, Liezel A.; Pearson, David M.; McCrory, Charles C. L.; Waymouth, Robert M.","Aerobic Alcohol Oxidation with Cationic Palladium Complexes: Insights into Catalyst Design and Decomposition","Organometallics","2007","26","23","5447","","10.1021/om700492n","","","0.71073","MoKα","","0.059","0.056","","","0.1409","0.143","","","","","","1.005","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073604","11.157","0.0011","13.8378","0.0014","18.9319","0.0018","100.908","0.002","106.926","0.002","95.415","0.002","2710.8","0.5","123","2","123","2","","","","","","","","7","P -1","-P 1","2","07064","","","- C17 H12 F3 N3 O5 Pd S -","- C17 H12 F3 N3 O5 Pd S -","- C102 H72 F18 N18 O30 Pd6 S6 -","6","3","","Conley, Nicholas R.; Labios, Liezel A.; Pearson, David M.; McCrory, Charles C. L.; Waymouth, Robert M.","Aerobic Alcohol Oxidation with Cationic Palladium Complexes: Insights into Catalyst Design and Decomposition","Organometallics","2007","26","23","5447","","10.1021/om700492n","","","0.71073","MoKα","","0.0472","0.0344","","","0.089","0.0976","","","","","","1.014","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073605","10.8335","0.001","23.564","0.002","12.1408","0.0011","90","","113.284","0.001","90","","2846.9","0.4","140","2","140","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H32 Br N2 O Rh -","- C27 H32 Br N2 O Rh -","- C108 H128 Br4 N8 O4 Rh4 -","4","1","","Gómez, Fernando J.; Kamber, Nahrain E.; Deschamps, Nicole M.; Cole, Adam P.; Wender, Paul A.; Waymouth, Robert M.","N-Alkoxyimidazolylidene Transition-Metal Complexes: Application to [5+2] and [4+2] Cycloaddition Reactions","Organometallics","2007","26","18","4541","","10.1021/om700493y","","","0.71069","MoKα","","0.0732","0.0399","","","0.08","0.0858","","","","","","0.862","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073606","16.0366","0.0006","11.7983","0.0005","19.4395","0.0007","90","0.0004","99.529","0.001","90","0.001","3627.3","0.2","153","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H40 Br2 N4 O2 Pd -","- C38 H40 Br2 N4 O2 Pd -","- C152 H160 Br8 N16 O8 Pd4 -","4","0.5","","Gómez, Fernando J.; Kamber, Nahrain E.; Deschamps, Nicole M.; Cole, Adam P.; Wender, Paul A.; Waymouth, Robert M.","N-Alkoxyimidazolylidene Transition-Metal Complexes: Application to [5+2] and [4+2] Cycloaddition Reactions","Organometallics","2007","26","18","4541","","10.1021/om700493y","","","0.7107","MoKα","","","0.031","","","","0.079","","","","","","1.052","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073607","9.693","0.0006","36.906","0.0002","10.5513","0.0006","90","","109.456","0.001","90","","3559","0.3","115.2","","","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","","","- C38 H30 F3 Ir N2 O3 S Si2 -","- C38 H30 F3 Ir N2 O3 S Si2 -","- C152 H120 F12 Ir4 N8 O12 S4 Si8 -","4","1","","Sangtrirutnugul, Preeyanuch; Tilley, T. Don","Silyl Derivatives of [Bis(8-quinolyl)methylsilyl]iridium(III) Complexes: Catalytic Redistribution of Arylsilanes and Dehydrogenative Arene Silylation","Organometallics","2007","26","23","5557","","10.1021/om700494q","","","0.7107","MoKα","","0.0373","0.0373","","0.046","","0.046","","","","","","1.54","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073608","11.4977","0.0005","12.2351","0.0006","14.9903","0.0007","85.88","0.001","78.42","0.001","75.287","0.001","1997.62","0.16","159.2","","","","","","","","","","","8","P -1","-P 1","2","","","","- C42 H36 F3 Ir N4 O3 S Si2 -","- C42 H36 F3 Ir N4 O3 S Si2 -","- C84 H72 F6 Ir2 N8 O6 S2 Si4 -","2","1","","Sangtrirutnugul, Preeyanuch; Tilley, T. Don","Silyl Derivatives of [Bis(8-quinolyl)methylsilyl]iridium(III) Complexes: Catalytic Redistribution of Arylsilanes and Dehydrogenative Arene Silylation","Organometallics","2007","26","23","5557","","10.1021/om700494q","","","0.7107","MoKα","","0.0222","0.0222","","0.0292","","0.0292","","","","","","1.451","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073609","11.3836","0.0008","12.8864","0.0009","13.3337","0.001","87.398","0.001","76.661","0.001","66.764","0.001","1746.5","0.2","127.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C29 H44 Cl3 Ir N2 P3 Si -","- C29 H44 Cl3 Ir N2 P3 Si -","- C58 H88 Cl6 Ir2 N4 P6 Si2 -","2","1","","Sangtrirutnugul, Preeyanuch; Tilley, T. Don","Silyl Derivatives of [Bis(8-quinolyl)methylsilyl]iridium(III) Complexes: Catalytic Redistribution of Arylsilanes and Dehydrogenative Arene Silylation","Organometallics","2007","26","23","5557","","10.1021/om700494q","","","0.7107","MoKα","","0.0417","0.0417","","0.0619","","0.0619","","","","","","1.754","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073610","17.379","0.002","12.243","0.001","17.594","0.002","90","","113.064","0.001","90","","3444.3","0.6","155.2","","","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C31 H51 Ir N2 O0.5 P3 Si -","- C31 H51 Ir N2 O0.5 P3 Si -","- C124 H204 Ir4 N8 O2 P12 Si4 -","4","1","","Sangtrirutnugul, Preeyanuch; Tilley, T. Don","Silyl Derivatives of [Bis(8-quinolyl)methylsilyl]iridium(III) Complexes: Catalytic Redistribution of Arylsilanes and Dehydrogenative Arene Silylation","Organometallics","2007","26","23","5557","","10.1021/om700494q","","","0.7107","MoKα","","0.0372","0.0372","","0.0368","","0.0368","","","","","","1.266","","","","has coordinates","264242","2021-04-16","08:50:19",""
"4073611","6.3023","0.0007","9.9052","0.0011","10.3559","0.0011","90","","90.559","0.002","90","","646.44","0.12","178","2","178","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","06211","","","- C13 H17 Cr N O3 -","- C13 H17 Cr N O3 -","- C26 H34 Cr2 N2 O6 -","2","0.5","","Fischer, Paul J.; Herm, Zoey R.; Kucera, Benjamin E.","[(2-(Trimethylammonium)ethyl)cyclopentadienyl]tricarbonylmetalates: Group VI Metal Zwitterions","Organometallics","2007","26","18","4680","","10.1021/om700497z","","","0.71073","MoKα","","0.0538","0.0499","","","0.1294","0.1314","","","","","","1.021","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073612","6.3508","0.0013","9.796","0.002","10.603","0.002","90","","90.015","0.003","90","","659.6","0.2","173","2","173","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","06172","","","- C13 H17 Mo N O3 -","- C13 H17 Mo N O3 -","- C26 H34 Mo2 N2 O6 -","2","0.5","","Fischer, Paul J.; Herm, Zoey R.; Kucera, Benjamin E.","[(2-(Trimethylammonium)ethyl)cyclopentadienyl]tricarbonylmetalates: Group VI Metal Zwitterions","Organometallics","2007","26","18","4680","","10.1021/om700497z","","","0.71073","MoKα","","0.0371","0.0342","","","0.081","0.0829","","","","","","1.053","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073613","6.335","0.0007","9.7811","0.0011","10.5825","0.0011","90","","90.015","0.002","90","","655.73","0.12","173","2","173","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","06179","","","- C13 H17 N O3 W -","- C13 H17 N O3 W -","- C26 H34 N2 O6 W2 -","2","0.5","","Fischer, Paul J.; Herm, Zoey R.; Kucera, Benjamin E.","[(2-(Trimethylammonium)ethyl)cyclopentadienyl]tricarbonylmetalates: Group VI Metal Zwitterions","Organometallics","2007","26","18","4680","","10.1021/om700497z","","","0.71073","MoKα","","0.022","0.0218","","","0.0557","0.0559","","","","","","1.071","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073614","13.064","0.0009","9.927","0.0007","13.9859","0.001","90","","91.394","0.001","90","","1813.2","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","06189","","","- C13 H17 Cr I2 N O3 -","- C13 H17 Cr I2 N O3 -","- C52 H68 Cr4 I8 N4 O12 -","4","1","","Fischer, Paul J.; Herm, Zoey R.; Kucera, Benjamin E.","[(2-(Trimethylammonium)ethyl)cyclopentadienyl]tricarbonylmetalates: Group VI Metal Zwitterions","Organometallics","2007","26","18","4680","","10.1021/om700497z","","","0.71073","MoKα","","0.0395","0.0317","","","0.074","0.0772","","","","","","1.015","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073615","13.0506","0.0013","10.1154","0.001","13.9902","0.0013","90","","91.389","0.002","90","","1846.3","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","06168","","","- C13 H17 I2 Mo N O3 -","- C13 H17 I2 Mo N O3 -","- C52 H68 I8 Mo4 N4 O12 -","4","1","","Fischer, Paul J.; Herm, Zoey R.; Kucera, Benjamin E.","[(2-(Trimethylammonium)ethyl)cyclopentadienyl]tricarbonylmetalates: Group VI Metal Zwitterions","Organometallics","2007","26","18","4680","","10.1021/om700497z","","","0.71073","MoKα","","0.0229","0.0195","","","0.045","0.0461","","","","","","1.004","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073616","13.0362","0.001","10.128","0.0008","13.9445","0.0011","90","","91.189","0.001","90","","1840.7","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","06188","","","- C13 H17 I2 N O3 W -","- C13 H17 I2 N O3 W -","- C52 H68 I8 N4 O12 W4 -","4","1","","Fischer, Paul J.; Herm, Zoey R.; Kucera, Benjamin E.","[(2-(Trimethylammonium)ethyl)cyclopentadienyl]tricarbonylmetalates: Group VI Metal Zwitterions","Organometallics","2007","26","18","4680","","10.1021/om700497z","","","0.71073","MoKα","","0.0215","0.0194","","","0.0437","0.0446","","","","","","1.035","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073617","14.725","0.004","7.807","0.002","16.683","0.004","90","","115.575","0.004","90","","1729.9","0.8","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","05230","","","- C14 H20 I N O3 W -","- C14 H20 I N O3 W -","- C56 H80 I4 N4 O12 W4 -","4","1","","Fischer, Paul J.; Herm, Zoey R.; Kucera, Benjamin E.","[(2-(Trimethylammonium)ethyl)cyclopentadienyl]tricarbonylmetalates: Group VI Metal Zwitterions","Organometallics","2007","26","18","4680","","10.1021/om700497z","","","0.71073","MoKα","","0.0448","0.0276","","","0.0631","0.0716","","","","","","1.045","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073618","7.306","0.0002","8.2593","0.0003","16.8867","0.0005","91.379","0.001","102.107","0.001","102.64","0.001","969.56","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H27 Cl2 Ir N2 -","- C17 H27 Cl2 Ir N2 -","- C34 H54 Cl4 Ir2 N4 -","2","1","","Wang, Xinjiao; Chen, Hongyu; Li, Xingwei","Ir(III)-Induced C-Bound to N-Bound Tautomerization of a N-Heterocyclic Carbene","Organometallics","2007","26","18","4684","","10.1021/om700498w","","","0.71073","MoKα","","0.0196","0.0167","","","0.0383","0.0393","","","","","","1.053","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073619","14.044","0.0005","12.737","0.0004","30.7384","0.001","90","","100.953","0.002","90","","5398.3","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H30 Cl F6 Ir N3 P -","- C19 H30 Cl F6 Ir N3 P -","- C152 H240 Cl8 F48 Ir8 N24 P8 -","8","2","","Wang, Xinjiao; Chen, Hongyu; Li, Xingwei","Ir(III)-Induced C-Bound to N-Bound Tautomerization of a N-Heterocyclic Carbene","Organometallics","2007","26","18","4684","","10.1021/om700498w","","","0.71073","MoKα","","0.0965","0.0423","","","0.0791","0.0963","","","","","","1.011","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073620","20.0815","0.0012","9.2617","0.0005","20.7209","0.0013","90","","111.883","0.006","90","","3576.2","0.4","180","2","180","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C40 H32 Cl2 O3 P2 Ru -","- C40 H32 Cl2 O3 P2 Ru -","- C160 H128 Cl8 O12 P8 Ru4 -","4","1","","Benhamou, Laure; César, Vincent; Lugan, Noël; Lavigne, Guy","Snapshot of a Chelation-Assisted C−H/Alkyne Coupling: A Ruthenium Complex Caught in the Act of C−C Bond Formation","Organometallics","2007","26","18","4673","","10.1021/om7005003","","x-ray","0.71073","MoKα","","0.0493","0.029","","","0.0709","0.0752","","","","","","1.09","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073621","33.6265","0.0015","12.5816","0.0007","20.6793","0.001","90","","90.588","0.004","90","","8748.4","0.8","180","2","180","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C55 H43 O2 P2 Ru -","- C55 H43 O2 P2 Ru -","- C440 H344 O16 P16 Ru8 -","8","1","","Benhamou, Laure; César, Vincent; Lugan, Noël; Lavigne, Guy","Snapshot of a Chelation-Assisted C−H/Alkyne Coupling: A Ruthenium Complex Caught in the Act of C−C Bond Formation","Organometallics","2007","26","18","4673","","10.1021/om7005003","","x-ray","0.71073","MoKα","","0.1182","0.0525","","","0.098","0.1137","","","","","","0.919","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073622","13.5902","0.0013","14.3845","0.0013","18.5827","0.0017","90","","101.762","0.002","90","","3556.4","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[Zn3(TMG)4(Et)2] (1)","","","- C24 H58 N12 Zn3 -","- C24 H58 N12 Zn3 -","- C96 H232 N48 Zn12 -","4","1","","Bunge, Scott D.; Lance, Jacob M.; Bertke, Jeffrey A.","Synthesis, Structure, and Reactivity of Alkylzinc Complexes Stabilized with 1,1,3,3-Tetramethylguanidine","Organometallics","2007","26","25","6320","","10.1021/om700501g","","","0.71073","MoKα","","0.1384","0.0559","","","0.1216","0.1588","","","","","","0.999","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073623","10.083","0.002","11.379","0.002","13.732","0.003","92.734","0.004","99.931","0.004","99.86","0.004","1524.2","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","[Zn(TMG)(Et)]3 (2)","","","- C21 H51 N9 Zn3 -","- C21 H51 N9 Zn3 -","- C42 H102 N18 Zn6 -","2","1","","Bunge, Scott D.; Lance, Jacob M.; Bertke, Jeffrey A.","Synthesis, Structure, and Reactivity of Alkylzinc Complexes Stabilized with 1,1,3,3-Tetramethylguanidine","Organometallics","2007","26","25","6320","","10.1021/om700501g","","","0.71073","MoKα","","0.0589","0.0451","","","0.1188","0.1295","","","","","","0.917","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073624","9.5136","0.0017","9.9491","0.0018","10.1261","0.0018","117.446","0.003","98.305","0.003","94.292","0.003","830.7","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","[Zn(ONep)(Et)(H-TMG)]2 (3)","","","- C24 H58 N6 O2 Zn2 -","- C24 H58 N6 O2 Zn2 -","- C24 H58 N6 O2 Zn2 -","1","0.5","","Bunge, Scott D.; Lance, Jacob M.; Bertke, Jeffrey A.","Synthesis, Structure, and Reactivity of Alkylzinc Complexes Stabilized with 1,1,3,3-Tetramethylguanidine","Organometallics","2007","26","25","6320","","10.1021/om700501g","","","0.71073","MoKα","","0.0466","0.0323","","","0.0892","0.1026","","","","","","0.7","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073625","11.186","0.002","13.866","0.003","15.376","0.003","90","","99.819","0.004","90","","2350","0.8","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Zn(Et)(DBP)(H-TMG)] (4)","","","- C21 H39 N3 O Zn -","- C21 H39 N3 O Zn -","- C84 H156 N12 O4 Zn4 -","4","1","","Bunge, Scott D.; Lance, Jacob M.; Bertke, Jeffrey A.","Synthesis, Structure, and Reactivity of Alkylzinc Complexes Stabilized with 1,1,3,3-Tetramethylguanidine","Organometallics","2007","26","25","6320","","10.1021/om700501g","","","0.71073","MoKα","","0.1241","0.0567","","","0.1382","0.1881","","","","","","1.003","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073626","9.2716","0.0005","12.0066","0.0008","21.7463","0.0014","90","","94.985","0.001","90","","2411.6","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Zn(Et)(DBP-4Me)(H-TMG)] (5)","","","- C22 H41 N3 O Zn -","- C22 H41 N3 O Zn -","- C88 H164 N12 O4 Zn4 -","4","1","","Bunge, Scott D.; Lance, Jacob M.; Bertke, Jeffrey A.","Synthesis, Structure, and Reactivity of Alkylzinc Complexes Stabilized with 1,1,3,3-Tetramethylguanidine","Organometallics","2007","26","25","6320","","10.1021/om700501g","","","0.71073","MoKα","","0.0752","0.0497","","","0.0754","0.0788","","","","","","1.635","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073627","10.4473","0.0009","17.433","0.0014","14.5079","0.0012","90","","90.339","0.002","90","","2642.2","0.4","188","2","188","2","","","","","","","","5","P 1 21 1","P 2yb","4","[Zn2(TMG)(DBP)(Et)2] (6)","","","- C23 H43 N3 O Zn2 -","- C23 H43 N3 O Zn2 -","- C92 H172 N12 O4 Zn8 -","4","2","","Bunge, Scott D.; Lance, Jacob M.; Bertke, Jeffrey A.","Synthesis, Structure, and Reactivity of Alkylzinc Complexes Stabilized with 1,1,3,3-Tetramethylguanidine","Organometallics","2007","26","25","6320","","10.1021/om700501g","","","0.71073","MoKα","","0.071","0.0418","","","0.0796","0.0838","","","","","","0.816","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073628","9.2885","0.0013","9.6888","0.0013","16.675","0.002","84.828","0.002","80.272","0.002","66.688","0.002","1357.9","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","[Zn(OMe)(DBP)(H-TMG)]2*2THF (7)","","","- C50 H94 N6 O6 Zn2 -","- C50 H94 N6 O6 Zn2 -","- C50 H94 N6 O6 Zn2 -","1","0.5","","Bunge, Scott D.; Lance, Jacob M.; Bertke, Jeffrey A.","Synthesis, Structure, and Reactivity of Alkylzinc Complexes Stabilized with 1,1,3,3-Tetramethylguanidine","Organometallics","2007","26","25","6320","","10.1021/om700501g","","","0.71073","MoKα","","0.0542","0.0371","","","0.1035","0.1232","","","","","","0.851","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073629","10.2512","0.0017","16.578","0.003","14.609","0.003","90","","91.008","0.004","90","","2482.3","0.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Zn(OEt)(DBP-4Me)(H-TMG)]2 (8)","","","- C44 H82 N6 O4 Zn2 -","- C44 H82 N6 O4 Zn2 -","- C88 H164 N12 O8 Zn4 -","2","0.5","","Bunge, Scott D.; Lance, Jacob M.; Bertke, Jeffrey A.","Synthesis, Structure, and Reactivity of Alkylzinc Complexes Stabilized with 1,1,3,3-Tetramethylguanidine","Organometallics","2007","26","25","6320","","10.1021/om700501g","","","0.71073","MoKα","","0.0785","0.0415","","","0.109","0.1382","","","","","","0.833","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073630","9.5","0.0014","9.805","0.002","14.35","0.002","71.257","0.006","79.161","0.017","64.983","0.009","1144.9","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","[Zn(OEt)(DBP)(H-TMG)]2 (9)","","","- C42 H78 N6 O4 Zn2 -","- C42 H78 N6 O4 Zn2 -","- C42 H78 N6 O4 Zn2 -","1","0.5","","Bunge, Scott D.; Lance, Jacob M.; Bertke, Jeffrey A.","Synthesis, Structure, and Reactivity of Alkylzinc Complexes Stabilized with 1,1,3,3-Tetramethylguanidine","Organometallics","2007","26","25","6320","","10.1021/om700501g","","","0.71073","MoKα","","0.0643","0.0408","","","0.1047","0.1217","","","","","","0.763","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073631","7.2701","0.0007","18.9264","0.0018","19.1007","0.0018","60.573","0.002","85.034","0.002","88.127","0.002","2280.4","0.4","213","2","213","2","","","","","","","","7","P -1","-P 1","2","","","","- C15 H27 B10 Cl Fe N P -","- C15 H27 B10 Cl Fe N P -","- C60 H108 B40 Cl4 Fe4 N4 P4 -","4","2","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Stereoselective Synthesis ofortho-Carbaborane-ContainingP-Chiral Phosphanylferrocenes†","Organometallics","2007","26","19","4715","","10.1021/om700503t","","","0.71073","MoKα","","0.083","0.0559","","","0.1126","0.1223","","","","","","1.117","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073632","7.3494","0.0003","17.3675","0.0007","18.568","0.0008","90","","90","","90","","2370.03","0.17","213","2","213","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C16 H29 B10 Cl Fe N P -","- C16 H29 B10 Cl Fe N P -","- C64 H116 B40 Cl4 Fe4 N4 P4 -","4","1","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Stereoselective Synthesis ofortho-Carbaborane-ContainingP-Chiral Phosphanylferrocenes†","Organometallics","2007","26","19","4715","","10.1021/om700503t","","","0.71073","MoKα","","0.0425","0.0404","","","0.0895","0.0903","","","","","","1.25","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073633","10.2","0.0008","11.8589","0.0009","15.5906","0.0012","73.318","0.002","84.707","0.001","80.77","0.001","1781","0.2","213","2","213","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H42 B10 Cl2 Fe2 N2 P2 -","- C28 H42 B10 Cl2 Fe2 N2 P2 -","- C56 H84 B20 Cl4 Fe4 N4 P4 -","2","1","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Stereoselective Synthesis ofortho-Carbaborane-ContainingP-Chiral Phosphanylferrocenes†","Organometallics","2007","26","19","4715","","10.1021/om700503t","","","0.71073","MoKα","","0.0395","0.0295","","","0.0822","0.0852","","","","","","1.043","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073634","7.1778","0.0008","15.9142","0.0018","19.423","0.002","90","","90.792","0.002","90","","2218.5","0.4","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H28 B10 Fe N P -","- C15 H28 B10 Fe N P -","- C60 H112 B40 Fe4 N4 P4 -","4","1","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Stereoselective Synthesis ofortho-Carbaborane-ContainingP-Chiral Phosphanylferrocenes†","Organometallics","2007","26","19","4715","","10.1021/om700503t","","","0.71073","MoKα","","0.0819","0.0475","","","0.1015","0.1106","","","","","","0.973","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073635","10.0871","0.0017","8.615","0.002","26.168","0.003","90","","91.834","0.011","90","","2272.8","0.7","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H30 B10 Fe N O P -","- C16 H30 B10 Fe N O P -","- C64 H120 B40 Fe4 N4 O4 P4 -","4","1","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Stereoselective Synthesis ofortho-Carbaborane-ContainingP-Chiral Phosphanylferrocenes†","Organometallics","2007","26","19","4715","","10.1021/om700503t","","","0.71073","MoKα","","0.0505","0.032","","","0.072","0.079","","","","","","1.051","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073636","10.1289","0.0006","13.2285","0.0008","36.317","0.002","90","","91.085","0.005","90","","4865.2","0.5","180","2","180","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H32 B10 Fe N O P -","- C17 H32 B10 Fe N O P -","- C136 H256 B80 Fe8 N8 O8 P8 -","8","2","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Stereoselective Synthesis ofortho-Carbaborane-ContainingP-Chiral Phosphanylferrocenes†","Organometallics","2007","26","19","4715","","10.1021/om700503t","","","0.71073","MoKα","","0.0951","0.0693","","","0.1248","0.1335","","","","","","1.248","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073637","32.48","0.004","10.3106","0.0011","15.9441","0.0017","90","","104.883","0.003","90","","5160.4","1","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C18 H34 B10 Fe N O P -","- C18 H34 B10 Fe N O P -","- C144 H272 B80 Fe8 N8 O8 P8 -","8","1","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Stereoselective Synthesis ofortho-Carbaborane-ContainingP-Chiral Phosphanylferrocenes†","Organometallics","2007","26","19","4715","","10.1021/om700503t","","","0.71073","MoKα","","0.0566","0.0378","","","0.0758","0.0814","","","","","","1.048","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073638","11.202","0.002","20.432","0.004","22.582","0.005","90","","90","","90","","5168.6","1.8","193","2","193","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C47 H72 Lu N3 O3 Si3 -","- C47 H72 Lu N3 O3 Si3 -","- C188 H288 Lu4 N12 O12 Si12 -","4","1","","Lukešová, Lenka; Ward, Benjamin D.; Bellemin-Laponnaz, Stéphane; Wadepohl, Hubert; Gade, Lutz H.","C3-Symmetric Chiral Organolanthanide Complexes: Synthesis, Characterization, and Stereospecific Polymerization of α-Olefins‖","Organometallics","2007","26","18","4652","","10.1021/om700504f","","x-ray","0.71073","MoKα","","0.0456","0.0387","","","0.0604","0.0621","","","","","","1.058","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073639","10.2048","0.001","19.1148","0.0019","10.3849","0.001","90","","102.054","0.002","90","","1981","0.3","173","","173","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C32 H66 Lu N3 O3 Si3 -","- C32 H66 Lu N3 O3 Si3 -","- C64 H132 Lu2 N6 O6 Si6 -","2","1","","Lukešová, Lenka; Ward, Benjamin D.; Bellemin-Laponnaz, Stéphane; Wadepohl, Hubert; Gade, Lutz H.","C3-Symmetric Chiral Organolanthanide Complexes: Synthesis, Characterization, and Stereospecific Polymerization of α-Olefins‖","Organometallics","2007","26","18","4652","","10.1021/om700504f","","","0.71073","MoKα","","0.0341","0.03","","0.0352","0.0341","0.0341","","","","","","1.0563","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073640","10.2557","0.0006","19.0994","0.0011","10.3659","0.0006","90","","102.011","0.001","90","","1986","0.2","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C32 H66 Er N3 O3 Si3 -","- C32 H66 Er N3 O3 Si3 -","- C64 H132 Er2 N6 O6 Si6 -","2","1","","Lukešová, Lenka; Ward, Benjamin D.; Bellemin-Laponnaz, Stéphane; Wadepohl, Hubert; Gade, Lutz H.","C3-Symmetric Chiral Organolanthanide Complexes: Synthesis, Characterization, and Stereospecific Polymerization of α-Olefins‖","Organometallics","2007","26","18","4652","","10.1021/om700504f","","x-ray","0.71073","MoKα","","0.0408","0.0319","","","0.0651","0.0682","","","","","","1.066","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073641","10.2711","0.0002","19.1776","0.0003","10.4005","0.0002","90","","101.947","0.001","90","","2004.26","0.06","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C32 H66 Ho N3 O3 Si3 -","- C32 H66 Ho N3 O3 Si3 -","- C64 H132 Ho2 N6 O6 Si6 -","2","1","","Lukešová, Lenka; Ward, Benjamin D.; Bellemin-Laponnaz, Stéphane; Wadepohl, Hubert; Gade, Lutz H.","C3-Symmetric Chiral Organolanthanide Complexes: Synthesis, Characterization, and Stereospecific Polymerization of α-Olefins‖","Organometallics","2007","26","18","4652","","10.1021/om700504f","","x-ray","0.71073","MoKα","","0.0306","0.0257","","","0.0584","0.0604","","","","","","1.064","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073642","10.3013","0.0014","19.2","0.003","10.4282","0.0014","90","","102","0.003","90","","2017.5","0.5","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C32 H66 Dy N3 O3 Si3 -","- C32 H66 Dy N3 O3 Si3 -","- C64 H132 Dy2 N6 O6 Si6 -","2","1","","Lukešová, Lenka; Ward, Benjamin D.; Bellemin-Laponnaz, Stéphane; Wadepohl, Hubert; Gade, Lutz H.","C3-Symmetric Chiral Organolanthanide Complexes: Synthesis, Characterization, and Stereospecific Polymerization of α-Olefins‖","Organometallics","2007","26","18","4652","","10.1021/om700504f","","x-ray","0.71073","MoKα","","0.0618","0.0492","","","0.1068","0.1121","","","","","","0.993","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073643","9.8615","0.0009","10.8452","0.0008","25.9804","0.0019","89.473","0.006","87.86","0.007","78.52","0.007","2721.1","0.4","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H63 Cl2 Co N5 -","- C51 H63 Cl2 Co N5 -","- C102 H126 Cl4 Co2 N10 -","2","1","","Barbaro, Pierluigi; Bianchini, Claudio; Giambastiani, Giuliano; Rios, Itzel Guerrero; Meli, Andrea; Oberhauser, Werner; Segarra, Anna M.; Sorace, Lorenzo; Toti, Alessandro","Synthesis of New Polydentate Nitrogen Ligands and Their Use in Ethylene Polymerization in Conjunction with Iron(II) and Cobalt(II) Bis-halides and Methylaluminoxane","Organometallics","2007","26","18","4639","","10.1021/om7005062","","","0.71073","MoKα","","0.1703","0.0905","","","0.187","0.2253","","","","","","0.967","","","","has coordinates","288155","2023-12-07","17:20:21",""
"4073644","8.5871","0.0007","27.3894","0.0014","16.7052","0.0013","90","","101.091","0.006","90","","3855.6","0.5","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H45 Br2 Co N5 -","- C42 H45 Br2 Co N5 -","- C168 H180 Br8 Co4 N20 -","4","1","","Barbaro, Pierluigi; Bianchini, Claudio; Giambastiani, Giuliano; Rios, Itzel Guerrero; Meli, Andrea; Oberhauser, Werner; Segarra, Anna M.; Sorace, Lorenzo; Toti, Alessandro","Synthesis of New Polydentate Nitrogen Ligands and Their Use in Ethylene Polymerization in Conjunction with Iron(II) and Cobalt(II) Bis-halides and Methylaluminoxane","Organometallics","2007","26","18","4639","","10.1021/om7005062","","","0.71073","MoKα","","0.2222","0.0853","","","0.1075","0.1475","","","","","","1.031","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073645","34.147","0.003","9.3537","0.0007","33.687","0.003","90","","93.516","0.002","90","","10739.4","1.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C55.5 H88 N2 P2 -","- C55.5 H87 N2 P2 -","- C444 H696 N16 P16 -","8","1","","Ionkin, Alex S.; Marshall, William J.; Fish, Brian M.; Schiffhauer, Matthew F.; Davidson, Fredric; McEwen, Charles N.; Keys, Dalen E.","Aromatic 1H-[1,2]Diphosphole with a Planar Tricoordinated Phosphorus, Plus η2-Coordination Mode between Ruthenium(0) and a Phosphaalkene†","Organometallics","2007","26","20","5050","","10.1021/om7005084","","","0.71073","MoKα","","0.1334","0.0707","","","0.1846","0.2176","","","","","","0.884","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073646","14.087","0.005","6.235","0.002","22.974","0.008","90","","91.509","0.006","90","","2017.2","1.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H32 P2 -","- C21 H32 P2 -","- C84 H128 P8 -","4","1","","Ionkin, Alex S.; Marshall, William J.; Fish, Brian M.; Schiffhauer, Matthew F.; Davidson, Fredric; McEwen, Charles N.; Keys, Dalen E.","Aromatic 1H-[1,2]Diphosphole with a Planar Tricoordinated Phosphorus, Plus η2-Coordination Mode between Ruthenium(0) and a Phosphaalkene†","Organometallics","2007","26","20","5050","","10.1021/om7005084","","","0.71073","MoKα","","0.1082","0.0882","","","0.2555","0.2773","","","","","","1.06","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073647","10.124","0.003","20.119","0.005","24.693","0.007","90","","90","","90","","5030","2","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C47 H75 F3 N2 O3 P2 S -","- C47 H75 F3 N2 O3 P2 S -","- C188 H300 F12 N8 O12 P8 S4 -","4","1","","Ionkin, Alex S.; Marshall, William J.; Fish, Brian M.; Schiffhauer, Matthew F.; Davidson, Fredric; McEwen, Charles N.; Keys, Dalen E.","Aromatic 1H-[1,2]Diphosphole with a Planar Tricoordinated Phosphorus, Plus η2-Coordination Mode between Ruthenium(0) and a Phosphaalkene†","Organometallics","2007","26","20","5050","","10.1021/om7005084","","","0.71073","MoKα","","0.2069","0.0777","","","0.1552","0.2066","","","","","","0.994","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073648","9.8533","0.0017","14.226","0.002","17.618","0.003","79.224","0.002","77.112","0.002","71.911","0.002","2269.8","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H76 N2 O P2 -","- C46 H76 N2 O P2 -","- C92 H152 N4 O2 P4 -","2","1","","Ionkin, Alex S.; Marshall, William J.; Fish, Brian M.; Schiffhauer, Matthew F.; Davidson, Fredric; McEwen, Charles N.; Keys, Dalen E.","Aromatic 1H-[1,2]Diphosphole with a Planar Tricoordinated Phosphorus, Plus η2-Coordination Mode between Ruthenium(0) and a Phosphaalkene†","Organometallics","2007","26","20","5050","","10.1021/om7005084","","","0.71073","MoKα","","0.0748","0.0511","","","0.1271","0.1417","","","","","","1.078","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073649","20.683","0.0016","9.1194","0.0007","27.15","0.002","90","","104.055","0.001","90","","4967.6","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C47 H77 Br Cl2 N2 P2 -","- C47 H77 Br Cl2 N2 P2 -","- C188 H308 Br4 Cl8 N8 P8 -","4","1","","Ionkin, Alex S.; Marshall, William J.; Fish, Brian M.; Schiffhauer, Matthew F.; Davidson, Fredric; McEwen, Charles N.; Keys, Dalen E.","Aromatic 1H-[1,2]Diphosphole with a Planar Tricoordinated Phosphorus, Plus η2-Coordination Mode between Ruthenium(0) and a Phosphaalkene†","Organometallics","2007","26","20","5050","","10.1021/om7005084","","","0.71073","MoKα","","0.1106","0.0555","","","0.116","0.1317","","","","","","0.88","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073650","10.419","0.004","15.628","0.005","17.189","0.006","106.128","0.005","107.568","0.005","95.599","0.005","2512.5","1.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C51.5 H78 N2 O2 P2 Ru -","- C51.5 H74 N2 O2 P2 Ru -","- C103 H148 N4 O4 P4 Ru2 -","2","1","","Ionkin, Alex S.; Marshall, William J.; Fish, Brian M.; Schiffhauer, Matthew F.; Davidson, Fredric; McEwen, Charles N.; Keys, Dalen E.","Aromatic 1H-[1,2]Diphosphole with a Planar Tricoordinated Phosphorus, Plus η2-Coordination Mode between Ruthenium(0) and a Phosphaalkene†","Organometallics","2007","26","20","5050","","10.1021/om7005084","","","0.71073","MoKα","","0.0737","0.0466","","","0.0976","0.1099","","","","","","1.054","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073651","8.5609","0.0013","11.7715","0.0017","17.222","0.003","77.477","0.002","79.399","0.002","70.94","0.002","1589.3","0.4","100","2","373","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H54 B F4 N Os P2 -","- C28 H54 B F4 N Os P2 -","- C56 H108 B2 F8 N2 Os2 P4 -","2","1","","Baya, Miguel; Eguillor, Beatriz; Esteruelas, Miguel A.; Lledós, Agustí; Oliván, Montserrat; Oñate, Enrique","Coordination and Rupture of Methyl C(sp3)−H Bonds in Osmium−Polyhydride Complexes with δ Agostic Interaction","Organometallics","2007","26","21","5140","","10.1021/om700509d","","","0.71073","MoKα","","0.0366","0.0284","","","0.0562","0.0575","","","","","","0.949","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073652","12.0743","0.0017","15.241","0.002","16.79","0.002","90","","90","","90","","3089.8","0.7","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C25 H53 B F4 N2 Os P2 -","- C25 H53 B F4 N2 Os P2 -","- C100 H212 B4 F16 N8 Os4 P8 -","4","1","","Baya, Miguel; Eguillor, Beatriz; Esteruelas, Miguel A.; Lledós, Agustí; Oliván, Montserrat; Oñate, Enrique","Coordination and Rupture of Methyl C(sp3)−H Bonds in Osmium−Polyhydride Complexes with δ Agostic Interaction","Organometallics","2007","26","21","5140","","10.1021/om700509d","","","0.71073","MoKα","","0.0469","0.035","","","0.065","0.0669","","","","","","0.927","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073653","11.2561","0.0007","17.793","0.003","15.176","0.003","90","","91.275","0.009","90","","3038.7","0.8","140","2","140","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H34 F6 O2 P2 Ru -","- C31 H34 F6 O2 P2 Ru -","- C124 H136 F24 O8 P8 Ru4 -","4","1","","Chaplin, Adrian B.; Dyson, Paul J.","Catalytic Activity of Bis-phosphine Ruthenium(II)−Arene Compounds: Chemoselective Hydrogenation and Mechanistic Insights","Organometallics","2007","26","17","4357","","10.1021/om7005112","","","0.71073","MoKα","","0.0477","0.0341","","","0.0781","0.0857","","","","","","1.062","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073654","12.0477","0.0012","12.2926","0.001","18.0764","0.0018","85.438","0.007","80.435","0.007","71.09","0.007","2496.4","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H30 Cl P Ru -","- C28 H30 Cl P Ru -","- C112 H120 Cl4 P4 Ru4 -","4","2","","Chaplin, Adrian B.; Dyson, Paul J.","Catalytic Activity of Bis-phosphine Ruthenium(II)−Arene Compounds: Chemoselective Hydrogenation and Mechanistic Insights","Organometallics","2007","26","17","4357","","10.1021/om7005112","","","0.71073","MoKα","","0.0497","0.033","","","0.0602","0.0663","","","","","","1.146","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073655","14.7413","0.0002","11.0799","0.0001","18.076","0.0002","90","","110.357","0.001","90","","2768","0.06","200","","200","","","","","","","","?","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H25 As F6 P2 -","- C30 H25 As F6 P2 -","- C120 H100 As4 F24 P8 -","4","1","","Kilah, Nathan L.; Petrie, Simon; Stranger, Robert; Wielandt, J. Wolfram; Willis, Anthony C.; Wild, S. Bruce","Triphenylphosphine-Stabilized Diphenyl-Arsenium, -Stibenium, and -Bismuthenium Salts","Organometallics","2007","26","25","6106","","10.1021/om700512h","","","0.71073","MoKα","","","0.028","","","","0.0301","","","","","","1.0832","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073656","11.059","0.0002","18.6029","0.0004","15.0804","0.0003","90","","91.052","0.001","90","","3101.96","0.11","200","","200","","","","","","","","?","6","P 1 21/a 1","-P 2yab","14","","","","- C31 H27 Cl2 F6 P2 Sb -","- C31 H27 Cl2 F6 P2 Sb -","- C124 H108 Cl8 F24 P8 Sb4 -","4","1","","Kilah, Nathan L.; Petrie, Simon; Stranger, Robert; Wielandt, J. Wolfram; Willis, Anthony C.; Wild, S. Bruce","Triphenylphosphine-Stabilized Diphenyl-Arsenium, -Stibenium, and -Bismuthenium Salts","Organometallics","2007","26","25","6106","","10.1021/om700512h","","","0.71073","MoKα","","","0.0335","","","","0.0388","","","","","","1.0771","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073657","13.6686","0.0001","14.7131","0.0002","21.1858","0.0002","90","","93.7665","0.0005","90","","4251.42","0.08","200","","200","","","","","","","","?","5","C 1 c 1","C -2yc","9","","","","- C48 H40 F6 P3 Sb -","- C48 H40 F6 P3 Sb -","- C192 H160 F24 P12 Sb4 -","4","1","","Kilah, Nathan L.; Petrie, Simon; Stranger, Robert; Wielandt, J. Wolfram; Willis, Anthony C.; Wild, S. Bruce","Triphenylphosphine-Stabilized Diphenyl-Arsenium, -Stibenium, and -Bismuthenium Salts","Organometallics","2007","26","25","6106","","10.1021/om700512h","","","0.71073","MoKα","","0.0464","0.0256","","0.0457","0.0278","0.0278","","","","","","1.1229","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073658","13.6442","0.0003","14.6791","0.0004","21.3363","0.0004","90","","92.0761","0.0014","90","","4270.53","0.17","200","","200","","","","","","","","?","5","C 1 c 1","C -2yc","9","","","","- C48 H40 Bi F6 P3 -","- C48 H40 Bi F6 P3 -","- C192 H160 Bi4 F24 P12 -","4","1","","Kilah, Nathan L.; Petrie, Simon; Stranger, Robert; Wielandt, J. Wolfram; Willis, Anthony C.; Wild, S. Bruce","Triphenylphosphine-Stabilized Diphenyl-Arsenium, -Stibenium, and -Bismuthenium Salts","Organometallics","2007","26","25","6106","","10.1021/om700512h","","","0.71073","MoKα","","0.064","0.0447","","0.0849","0.0511","0.0511","","","","","","1.113","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073659","8.9733","0.0004","14.8189","0.0006","24.2085","0.0013","90","","92.3395","0.0015","90","","3216.4","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H39 N O2 Si W -","- C35 H39 N O2 Si W -","- C140 H156 N4 O8 Si4 W4 -","4","1","","Suzuki, Eiji; Komuro, Takashi; Okazaki, Masaaki; Tobita, Hiromi","Three- and Five-Membered W/C/N Metallacycles Formed by Incorporation of Acetonitrile Molecules into Silyltungsten Intermediates†","Organometallics","2007","26","18","4379","","10.1021/om700514d","","","0.71069","MoKα","","0.0892","0.0653","","","0.1403","0.1567","","","","","","1.329","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073660","12.272","0.0002","12.5646","0.0007","12.7437","0.0008","89.855","0.003","63.027","0.003","75.373","0.004","1680.12","0.16","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H42 N2 O2 Si W -","- C37 H42 N2 O2 Si W -","- C74 H84 N4 O4 Si2 W2 -","2","1","","Suzuki, Eiji; Komuro, Takashi; Okazaki, Masaaki; Tobita, Hiromi","Three- and Five-Membered W/C/N Metallacycles Formed by Incorporation of Acetonitrile Molecules into Silyltungsten Intermediates†","Organometallics","2007","26","18","4379","","10.1021/om700514d","","","0.71069","MoKα","","0.0496","0.0397","","","0.1042","0.118","","","","","","1.257","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073661","8.97","0.01","13.109","0.015","13.788","0.015","108.367","0.015","97.054","0.016","109.366","0.015","1404","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H26 Ir N6 O3 P S -","- C28 H26 Ir N6 O3 P S -","- C56 H52 Ir2 N12 O6 P2 S2 -","2","1","","Nagaraja, C. M.; Nethaji, Munirathinam; Jagirdar, Balaji R.","Tris(pyrazolyl)methane Sulfonate Complexes of Iridium: Catalytic Hydrogenation of 3,3-Dimethyl-1-butene","Organometallics","2007","26","25","6307","","10.1021/om700515n","","","0.71073","MoKα","","0.0422","0.0335","","","0.0819","0.0855","","","","","","1.081","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073662","12.9182","0.0018","17.933","0.002","20.0578","0.0017","90","","90","","90","","4646.6","0.9","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C52 H42 Cl4 P2 Ru S -","- C52 H42 Cl4 P2 Ru S -","- C208 H168 Cl16 P8 Ru4 S4 -","4","1","","Cowley, Andrew R.; Hector, Andrew L.; Hill, Anthony F.; White, Andrew J. P.; Williams, David J.; Wilton-Ely, James D. E. T.","Synthesis and Reactions of Five-Coordinate Mono- and Binuclear Thiocarbonyl−Alkenyl and Thioacyl Complexes of Ruthenium(II)","Organometallics","2007","26","25","6114","","10.1021/om700518m","","","0.71073","MoKα","","0.0621","0.0404","","","0.0818","0.0866","","","","","","0.891","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073663","12.1475","0.0002","12.2581","0.0002","18.0528","0.0003","75.0004","0.0007","78.8495","0.0007","63.7609","0.001","2319.31","0.07","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","6","P -1","-P 1","2","","","","- C54 H43 Cl3 P2 Ru S -","- C54 H43 Cl3 P2 Ru S -","- C108 H86 Cl6 P4 Ru2 S2 -","2","1","","Cowley, Andrew R.; Hector, Andrew L.; Hill, Anthony F.; White, Andrew J. P.; Williams, David J.; Wilton-Ely, James D. E. T.","Synthesis and Reactions of Five-Coordinate Mono- and Binuclear Thiocarbonyl−Alkenyl and Thioacyl Complexes of Ruthenium(II)","Organometallics","2007","26","25","6114","","10.1021/om700518m","","","","","","0.081","0.0444","","0.0845","0.0508","0.0508","","","","","","1.096","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073664","11.8799","0.0008","17.3422","0.0009","12.0943","0.0011","90","","102.544","0.007","90","","2432.2","0.3","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C56 H47 Cl O2 P2 Ru S -","- C55.998 H46.994 Cl O1.999 P2 Ru S -","- C111.996 H93.988 Cl2 O3.998 P4 Ru2 S2 -","2","1","","Cowley, Andrew R.; Hector, Andrew L.; Hill, Anthony F.; White, Andrew J. P.; Williams, David J.; Wilton-Ely, James D. E. T.","Synthesis and Reactions of Five-Coordinate Mono- and Binuclear Thiocarbonyl−Alkenyl and Thioacyl Complexes of Ruthenium(II)","Organometallics","2007","26","25","6114","","10.1021/om700518m","","","1.54178","CuKα","","0.0507","0.0468","","","0.1251","0.1285","","","","","","1.046","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073665","22.7759","0.0019","18.791","0.004","26.845","0.003","90","","90","","90","","11489","3","293","2","293","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C65 H51 Cl3 Fe O2 P2 Ru S -","- C65 H51 Cl3 Fe O2 P2 Ru S -","- C520 H408 Cl24 Fe8 O16 P16 Ru8 S8 -","8","1","","Cowley, Andrew R.; Hector, Andrew L.; Hill, Anthony F.; White, Andrew J. P.; Williams, David J.; Wilton-Ely, James D. E. T.","Synthesis and Reactions of Five-Coordinate Mono- and Binuclear Thiocarbonyl−Alkenyl and Thioacyl Complexes of Ruthenium(II)","Organometallics","2007","26","25","6114","","10.1021/om700518m","","","0.71073","MoKα","","0.1256","0.0608","","","0.1317","0.1503","","","","","","0.977","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073666","24.287","0.003","13.5739","0.0012","34.451","0.01","90","","95.559","0.01","90","","11304","4","293","2","293","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C126 H110 Fe O6 P4 Ru2 S2 -","- C118 H90 Fe O4 P4 Ru2 S2 -","- C472 H360 Fe4 O16 P16 Ru8 S8 -","4","0.5","","Cowley, Andrew R.; Hector, Andrew L.; Hill, Anthony F.; White, Andrew J. P.; Williams, David J.; Wilton-Ely, James D. E. T.","Synthesis and Reactions of Five-Coordinate Mono- and Binuclear Thiocarbonyl−Alkenyl and Thioacyl Complexes of Ruthenium(II)","Organometallics","2007","26","25","6114","","10.1021/om700518m","","","1.54178","CuKα","","0.1172","0.0746","","","0.1862","0.2096","","","","","","0.956","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073667","6.993","0.0014","28.041","0.006","13.723","0.003","90","","94.46","0.03","90","","2682.8","1","120","2","120","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C23 H38 Br N3 P2 Pt -","- C23 H38 Br N3 P2 Pt -","- C92 H152 Br4 N12 P8 Pt4 -","4","1","","Zenkina, Olena; Altman, Marc; Leitus, Gregory; Shimon, Linda J. W.; Cohen, Revital; van der Boom, Milko E.","From Azobenzene Coordination to Aryl−Halide Bond Activation by Platinum","Organometallics","2007","26","18","4528","","10.1021/om700519v","","","0.71073","MoKα","","0.0298","0.0269","","","0.064","0.0652","","","","","","1.049","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073668","18.851","0.004","7.919","0.0016","8.342","0.0017","90","","90","","90","","1245.3","0.4","120","2","120","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C23 H39 N3 P2 Pt -","- C23 H39 N3 P2 Pt -","- C46 H78 N6 P4 Pt2 -","2","0.5","","Zenkina, Olena; Altman, Marc; Leitus, Gregory; Shimon, Linda J. W.; Cohen, Revital; van der Boom, Milko E.","From Azobenzene Coordination to Aryl−Halide Bond Activation by Platinum","Organometallics","2007","26","18","4528","","10.1021/om700519v","","","0.71073","MoKα","","0.0343","0.03","","","0.073","0.0749","","","","","","1.031","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073669","37.662","0.005","9.4987","0.0011","16.76","0.002","90","","95.898","0.002","90","","5964","1.3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H17 B F10 N S2 -","- C35 H17 B F10 N S2 -","- C280 H136 B8 F80 N8 S16 -","8","1","","Sundararaman, Anand; Varughese, Resmi; Li, Haiyan; Zakharov, Lev N.; Rheingold, Arnold L.; Jäkle, Frieder","A Donor−Acceptor Dyad with a Highly Lewis Acidic Boryl Group","Organometallics","2007","26","25","6126","","10.1021/om700520n","","","0.71073","MoKα","","0.0675","0.0412","","","0.0982","0.1156","","","","","","1.048","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073670","20.364","0.003","12.918","0.001","16.369","0.002","90","","104.44","0.02","90","","4170","0.9","153","2","153","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C35 H33 Cl F18 Li2 N6 O Ru2 -","- C35 H33 Cl F18 Li2 N6 O Ru2 -","- C140 H132 Cl4 F72 Li8 N24 O4 Ru8 -","4","0.5","","Waheed, Abdul; Jones, Richard A.; Agapiou, Kyriacos; Yang, Xiaoping; Moore, Jennifer A.; Ekerdt, John G.","Synthesis and Structures of Dinuclear 3,5-Bis(trifluoromethyl)pyrazolate Complexes of Ruthenium","Organometallics","2007","26","27","6778","6783","10.1021/om700521y","","","0.71073","MoKα","","0.1251","0.0541","","","0.1059","0.1388","","","","","","0.981","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073671","13.463","0.003","11.055","0.002","19.13","0.004","90","","108.32","0.03","90","","2702.9","1.1","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C25 H31 Cl2 F6 N2 Ru2 -","- C25 H31 Cl2 F6 N2 Ru2 -","- C100 H124 Cl8 F24 N8 Ru8 -","4","0.5","","Waheed, Abdul; Jones, Richard A.; Agapiou, Kyriacos; Yang, Xiaoping; Moore, Jennifer A.; Ekerdt, John G.","Synthesis and Structures of Dinuclear 3,5-Bis(trifluoromethyl)pyrazolate Complexes of Ruthenium","Organometallics","2007","26","27","6778","6783","10.1021/om700521y","","","0.71073","MoKα","","0.0895","0.0718","","","0.1895","0.2128","","","","","","1.104","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073672","11.934","0.002","12.222","0.002","14.088","0.003","66.09","0.02","66.11","0.03","67.46","0.02","1657.5","0.7","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H30 Cl2 F12 N4 Ru2 -","- C30 H30 Cl2 F12 N4 Ru2 -","- C60 H60 Cl4 F24 N8 Ru4 -","2","1","","Waheed, Abdul; Jones, Richard A.; Agapiou, Kyriacos; Yang, Xiaoping; Moore, Jennifer A.; Ekerdt, John G.","Synthesis and Structures of Dinuclear 3,5-Bis(trifluoromethyl)pyrazolate Complexes of Ruthenium","Organometallics","2007","26","27","6778","6783","10.1021/om700521y","","","0.71073","MoKα","","0.0801","0.0568","","","0.1574","0.1777","","","","","","1.024","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073673","9.4914","0.0019","11.171","0.002","13.85","0.003","90.6","0.02","97.65","0.03","92.151","0.013","1454.2","0.5","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H67 F12 N4 O2.5 Ru4 -","- C52 H67 F12 N4 O2.5 Ru4 -","- C52 H67 F12 N4 O2.5 Ru4 -","1","0.5","","Waheed, Abdul; Jones, Richard A.; Agapiou, Kyriacos; Yang, Xiaoping; Moore, Jennifer A.; Ekerdt, John G.","Synthesis and Structures of Dinuclear 3,5-Bis(trifluoromethyl)pyrazolate Complexes of Ruthenium","Organometallics","2007","26","27","6778","6783","10.1021/om700521y","","","0.71073","MoKα","","0.0523","0.0366","","","0.1014","0.1156","","","","","","1.13","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073674","11.484","0.005","13.828","0.006","16.239","0.006","90","","97.515","0.008","90","","2556.6","1.8","103","2","103","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H26 N O5 P Pd S -","- C26 H26 N O5 P Pd S -","- C104 H104 N4 O20 P4 Pd4 S4 -","4","1","","Newsham, David K.; Borkar, Sachin; Sen, Ayusman; Conner, David M.; Goodall, Brian L.","Inhibitory Role of Carbon Monoxide in Palladium(II)-Catalyzed Nonalternating Ethene/Carbon Monoxide Copolymerizations and the Synthesis of Polyethene-block-poly(ethene-alt-carbon monoxide)","Organometallics","2007","26","15","3636","","10.1021/om700523m","","","0.71073","MoKα","","0.0821","0.0571","","","0.126","0.1342","","","","","","1.033","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073675","11.567","0.002","14.097","0.003","16.198","0.003","90","","96.68","0.03","90","","2623.3","0.9","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27 H26 N O6 P Pd S -","- C27 H26 N O6 P Pd S -","- C108 H104 N4 O24 P4 Pd4 S4 -","4","1","","Newsham, David K.; Borkar, Sachin; Sen, Ayusman; Conner, David M.; Goodall, Brian L.","Inhibitory Role of Carbon Monoxide in Palladium(II)-Catalyzed Nonalternating Ethene/Carbon Monoxide Copolymerizations and the Synthesis of Polyethene-block-poly(ethene-alt-carbon monoxide)","Organometallics","2007","26","15","3636","","10.1021/om700523m","","","0.71073","MoKα","","0.08","0.0529","","","0.1196","0.1289","","","","","","0.959","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073676","5.0886","0.0003","19.9527","0.001","25.9185","0.0013","90","","95.094","0.001","90","","2621.1","0.2","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H12 F12 Hg3 S3 -","- C24 H12 F12 Hg3 S3 -","- C96 H48 F48 Hg12 S12 -","4","1","","Tikhonova, Irina A.; Tugashov, Kirill I.; Dolgushin, Fedor M.; Petrovskii, Pavel V.; Shur, Vladimir B.","Complexation of [9]Thiacrown-3 and 1,3,5-Trithiane with Cyclic Trimeric Perfluoro-o-phenylenemercury. Synthesis and Structures of the First Complexes of Crown Compounds with an Anticrown","Organometallics","2007","26","21","5193","","10.1021/om700526w","","","0.71073","MoKα","","0.057","0.0359","","","0.0706","0.0759","","","","","","0.969","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073677","19.2128","0.0018","40.352","0.004","12.3272","0.0011","90","","107.742","0.001","90","","9102.4","1.5","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H12 F24 Hg6 S3 -","- C42 H12 F24 Hg6 S3 -","- C336 H96 F192 Hg48 S24 -","8","2","","Tikhonova, Irina A.; Tugashov, Kirill I.; Dolgushin, Fedor M.; Petrovskii, Pavel V.; Shur, Vladimir B.","Complexation of [9]Thiacrown-3 and 1,3,5-Trithiane with Cyclic Trimeric Perfluoro-o-phenylenemercury. Synthesis and Structures of the First Complexes of Crown Compounds with an Anticrown","Organometallics","2007","26","21","5193","","10.1021/om700526w","","","0.71073","MoKα","","0.0825","0.0596","","","0.1336","0.1419","","","","","","1.098","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073678","10.5723","0.001","21.781","0.002","21.997","0.002","98.782","0.002","103.749","0.002","90.145","0.002","4858.6","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H6 F12 Hg3 S3 -","- C21 H6 F12 Hg3 S3 -","- C168 H48 F96 Hg24 S24 -","8","4","","Tikhonova, Irina A.; Tugashov, Kirill I.; Dolgushin, Fedor M.; Petrovskii, Pavel V.; Shur, Vladimir B.","Complexation of [9]Thiacrown-3 and 1,3,5-Trithiane with Cyclic Trimeric Perfluoro-o-phenylenemercury. Synthesis and Structures of the First Complexes of Crown Compounds with an Anticrown","Organometallics","2007","26","21","5193","","10.1021/om700526w","","","0.71073","MoKα","","0.0953","0.0653","","","0.1496","0.1697","","","","","","1.013","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073679","11.4685","0.0006","12.6056","0.0006","18.3425","0.0009","81.983","0.001","77.081","0.001","65.461","0.001","2347.9","0.2","135","2","135","2","","","","","","","","6","P -1","-P 1","2","","","","- C47 H64.5 N2 O4.25 Si2 Zr -","- C47 H42 N2 O4.25 Si2 Zr -","- C94 H84 N4 O8.5 Si4 Zr2 -","2","1","","Baiz, Tamam I.; Schmidt, Joseph A. R.","A Discrete Ortho-Lithiated Acetophenone Imine Derivative: Isolation, Characterization, and Synthesis of Group IV Metal Complexes","Organometallics","2007","26","17","4094","","10.1021/om700530z","","","0.71073","MoKα","","0.1291","0.07","","","0.182","0.2098","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073680","8.872","0.003","9.166","0.003","10.099","0.003","78.427","0.005","82.422","0.005","81.789","0.005","791.8","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H9 Fe2 N O7 S2 -","- C10 H9 Fe2 N O7 S2 -","- C20 H18 Fe4 N2 O14 S4 -","2","1","","Song, Li-Cheng; Yin, Bang-Shao; Li, Yu-Long; Zhao, Li-Qun; Ge, Jian-Hua; Yang, Zhi-Yong; Hu, Qing-Mei","Synthesis, Structural Characterization, and Some Properties of New N-Functionally Substituted Diiron Azadithiolate Complexes as Biomimetic Models of Iron-Only Hydrogenases","Organometallics","2007","26","20","4921","","10.1021/om7005326","","","0.71073","MoKα","","0.0423","0.0307","","","0.0759","0.0824","","","","","","1.094","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073681","20.431","0.002","14.3819","0.0017","12.9839","0.0015","90","","99.376","0.002","90","","3764.2","0.7","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H11 Fe2 N O7 S3 -","- C12 H11 Fe2 N O7 S3 -","- C96 H88 Fe16 N8 O56 S24 -","8","1","","Song, Li-Cheng; Yin, Bang-Shao; Li, Yu-Long; Zhao, Li-Qun; Ge, Jian-Hua; Yang, Zhi-Yong; Hu, Qing-Mei","Synthesis, Structural Characterization, and Some Properties of New N-Functionally Substituted Diiron Azadithiolate Complexes as Biomimetic Models of Iron-Only Hydrogenases","Organometallics","2007","26","20","4921","","10.1021/om7005326","","","0.71073","MoKα","","0.0567","0.0309","","","0.0595","0.069","","","","","","1.021","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073682","36.383","0.009","8.623","0.002","14.27","0.003","90","","110.591","0.004","90","","4190.9","1.7","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C15 H11 Fe2 N O8 S3 -","- C15 H11 Fe2 N O8 S3 -","- C120 H88 Fe16 N8 O64 S24 -","8","1","","Song, Li-Cheng; Yin, Bang-Shao; Li, Yu-Long; Zhao, Li-Qun; Ge, Jian-Hua; Yang, Zhi-Yong; Hu, Qing-Mei","Synthesis, Structural Characterization, and Some Properties of New N-Functionally Substituted Diiron Azadithiolate Complexes as Biomimetic Models of Iron-Only Hydrogenases","Organometallics","2007","26","20","4921","","10.1021/om7005326","","","0.71073","MoKα","","0.0528","0.0363","","","0.0995","0.1134","","","","","","1.049","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073683","7.5467","0.0012","11.5639","0.0014","11.648","0.0013","116.801","0.008","90.823","0.007","102.403","0.008","878.9","0.2","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H11 Fe2 N O8 S2 -","- C12 H11 Fe2 N O8 S2 -","- C24 H22 Fe4 N2 O16 S4 -","2","1","","Song, Li-Cheng; Yin, Bang-Shao; Li, Yu-Long; Zhao, Li-Qun; Ge, Jian-Hua; Yang, Zhi-Yong; Hu, Qing-Mei","Synthesis, Structural Characterization, and Some Properties of New N-Functionally Substituted Diiron Azadithiolate Complexes as Biomimetic Models of Iron-Only Hydrogenases","Organometallics","2007","26","20","4921","","10.1021/om7005326","","","0.7107","MoKα","","0.0347","0.0267","","","0.0551","0.0574","","","","","","0.977","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073684","11.816","0.002","14.413","0.003","20.729","0.004","90","","90","","90","","3530.2","1.2","150","2","150","2","","","","","","","","4","P b c n","-P 2n 2ab","60","tetramesityldigemene","","","- C40 H52 Ge2 O -","- C40 H52 Ge2 O -","- C160 H208 Ge8 O4 -","4","0.5","","Hurni, Krysten L.; Rupar, Paul A.; Payne, Nicholas C.; Baines, Kim M.","On the Synthesis, Structure, and Reactivity of Tetramesityldigermene","Organometallics","2007","26","23","5569","","10.1021/om7005358","","x-ray","0.71073","MoKα","","0.0825","0.0565","","","0.1582","0.1778","","","","","","1.058","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073685","12.8332","0.0004","14.09","0.0003","20.2794","0.0006","90","","94.32","0.013","90","","3656.5","0.19","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C41 H54 Ge2 O2 -","- C41 H54 Ge2 O2 -","- C164 H216 Ge8 O8 -","4","1","","Hurni, Krysten L.; Rupar, Paul A.; Payne, Nicholas C.; Baines, Kim M.","On the Synthesis, Structure, and Reactivity of Tetramesityldigermene","Organometallics","2007","26","23","5569","","10.1021/om7005358","","x-ray","0.71073","MoKα","","0.0944","0.0522","","","0.1243","0.1414","","","","","","1.043","","","","has coordinates,has disorder","178625","2020-10-21","18:00:00",""
"4073686","22.918","0.002","16.0017","0.0008","17.421","0.002","90","","116.007","0.003","90","","5741.8","0.9","213","","213","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C53 H60 F18 O2 P2 Ru2 S2 -","- C53 H48 F18 O2 P2 Ru2 S2 -","- C212 H192 F72 O8 P8 Ru8 S8 -","4","0.5","","Uchida, Kazunori; Inagaki, Akiko; Akita, Munetaka","Preparation and Photochemical Behavior of Organoruthenium Derivatives of Photochromic Dithienylethene (DTE): DTE−(RRuLm)n(RRuLm= (η6-C6H5)Ru(η5-C5Me5), (η6-C6H5)RuCl2(PPh3), (η5-C5Me4)Ru(CO)2;n= 1, 2)†","Organometallics","2007","26","20","5030","","10.1021/om700537s","","","0.7107","MoKα","","","0.0444","","","","0.1309","","","","","","1.067","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073687","9.908","0.008","14.6","0.02","22.54","0.03","90","","89.52","0.06","90","","3260","7","213","","213","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C65 H52 Cl8 F6 P2 Ru2 S2 -","- C65 H48 Cl8 F6 P2 Ru2 S2 -","- C130 H96 Cl16 F12 P4 Ru4 S4 -","2","0.5","","Uchida, Kazunori; Inagaki, Akiko; Akita, Munetaka","Preparation and Photochemical Behavior of Organoruthenium Derivatives of Photochromic Dithienylethene (DTE): DTE−(RRuLm)n(RRuLm= (η6-C6H5)Ru(η5-C5Me5), (η6-C6H5)RuCl2(PPh3), (η5-C5Me4)Ru(CO)2;n= 1, 2)†","Organometallics","2007","26","20","5030","","10.1021/om700537s","","","0.7107","MoKα","","","0.0949","","","","0.2853","","","","","","0.782","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073688","26.694","0.005","13.4","0.002","13.509","0.003","90","","112.257","0.001","90","","4472.1","1.5","213","","213","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C37 H32 Cl2 F6 O4 Ru2 S2 -","- C37 H32 Cl2 F6 O4 Ru2 S2 -","- C148 H128 Cl8 F24 O16 Ru8 S8 -","4","0.5","","Uchida, Kazunori; Inagaki, Akiko; Akita, Munetaka","Preparation and Photochemical Behavior of Organoruthenium Derivatives of Photochromic Dithienylethene (DTE): DTE−(RRuLm)n(RRuLm= (η6-C6H5)Ru(η5-C5Me5), (η6-C6H5)RuCl2(PPh3), (η5-C5Me4)Ru(CO)2;n= 1, 2)†","Organometallics","2007","26","20","5030","","10.1021/om700537s","","","0.7107","MoKα","","","0.0626","","","","0.2237","","","","","","1.888","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073689","12.9774","0.0011","21.5134","0.0017","12.9372","0.0007","104.254","0.004","90.176","0.003","77.2712","0.0011","3409.7","0.4","298.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C67 H51 B F24 P2 Pd -","- C67 H51 B F24 P2 Pd -","- C134 H102 B2 F48 P4 Pd2 -","2","1","","Ogasawara, Masamichi; Okada, Atsushi; Watanabe, Susumu; Fan, Liyan; Uetake, Koichi; Nakajima, Kiyohiko; Takahashi, Tamotsu","Synthesis, Structure, and Reactivity of (1,2,3-η3-Butadien-3-yl)palladium Complexes","Organometallics","2007","26","20","5025","","10.1021/om700538p","","","0.71069","MoKα","","","0.0792","","","","0.2757","","","","","","1.012","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073690","11.8095","0.0011","36.34","0.003","19.1001","0.0016","90","","107.041","0.003","90","","7837.1","1.2","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C80 H68 Cl13 N8 O3 Ru2 -","- C80 H68 Cl13 N8 O3 Ru2 -","- C320 H272 Cl52 N32 O12 Ru8 -","4","1","","Chen, Wei-Zhong; Fanwick, Phillip E.; Ren, Tong","Peripheral Functionalization of Diruthenium Compounds via Heck Reactions","Organometallics","2007","26","17","4115","","10.1021/om7005408","","","0.71073","MO-Kα","","0.127","0.076","","","0.154","0.178","","","","","","1.055","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073691","11.5742","0.0007","13.7446","0.0008","22.3166","0.0011","86.287","0.002","82.449","0.003","86.862","0.004","3508.2","0.3","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C53 H42 Cl13 N8 Ru2 Si -","- C53 H42 Cl13 N8 Ru2 Si -","- C106 H84 Cl26 N16 Ru4 Si2 -","2","1","","Chen, Wei-Zhong; Fanwick, Phillip E.; Ren, Tong","Peripheral Functionalization of Diruthenium Compounds via Heck Reactions","Organometallics","2007","26","17","4115","","10.1021/om7005408","","","0.71073","MO-Kα","","0.104","0.079","","","0.215","0.229","","","","","","1.101","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073692","11.1108","0.0002","14.471","0.0003","21.901","0.0007","89.545","0.0017","84.059","0.003","72.877","0.003","3346.24","0.15","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C68 H46 Cl12 N8 O2 Ru2 -","- C68 H46 Cl12 N8 O2 Ru2 -","- C136 H92 Cl24 N16 O4 Ru4 -","2","1","","Chen, Wei-Zhong; Fanwick, Phillip E.; Ren, Tong","Peripheral Functionalization of Diruthenium Compounds via Heck Reactions","Organometallics","2007","26","17","4115","","10.1021/om7005408","","","0.71073","MO-Kα","","0.095","0.045","","","0.084","0.093","","","","","","1.051","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073693","9.8424","0.0001","10.6075","0.0001","23.6117","0.0004","90","","90","","90","","2465.14","0.05","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2-(diphenylphosphino)-1-(N-benzylcarbamoyl)ferrocene","","- C30 H26 Fe N O P -","- C30 H26 Fe N O P -","- C120 H104 Fe4 N4 O4 P4 -","4","1","","Lamač, Martin; Tauchman, Jiří; Císařová, Ivana; Štěpnička, Petr","Preparation of Chiral Phosphinoferrocene Carboxamide Ligands and Their Application to Palladium-Catalyzed Asymmetric Allylic Alkylation","Organometallics","2007","26","20","5042","","10.1021/om700542s","","","0.71073","MoKα","","0.0311","0.0268","","","0.0589","0.0611","","","","","","1.067","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073694","9.4409","0.0001","15.8585","0.0002","28.5158","0.0003","90","","90","","90","","4269.34","0.08","150","2","150","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C48 H45 Cl Fe N O6 P Pd -","- C48 H45 Cl Fe N O6 P Pd -","- C192 H180 Cl4 Fe4 N4 O24 P4 Pd4 -","4","1","","Lamač, Martin; Tauchman, Jiří; Císařová, Ivana; Štěpnička, Petr","Preparation of Chiral Phosphinoferrocene Carboxamide Ligands and Their Application to Palladium-Catalyzed Asymmetric Allylic Alkylation","Organometallics","2007","26","20","5042","","10.1021/om700542s","","","0.71073","MoKα","","0.039","0.033","","","0.0772","0.0809","","","","","","1.05","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073695","17.2381","0.0009","9.518","0.0005","17.8717","0.0009","90","","90","","90","","2932.2","0.3","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C26 H36 Br2 N4 Pt -","- C26 H36 Br2 N4 Pt -","- C104 H144 Br8 N16 Pt4 -","4","0.5","","Han, Yuan; Huynh, Han Vinh; Tan, Geok Kheng","Mono- vs Bis(carbene) Complexes: A Detailed Study on Platinum(II)−Benzimidazolin-2-ylidenes","Organometallics","2007","26","18","4612","","10.1021/om700543p","","","0.71073","MoKα","","0.0538","0.0269","","","0.061","0.0692","","","","","","0.992","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073696","9.547","0.003","10.589","0.003","14.693","0.004","90","","104.055","0.006","90","","1440.9","0.7","243","2","243","2","","","","","","","","8","P 1 21/m 1","-P 2yb","11","","","","- C17 H26 Br2 Cl6 N2 O Pt S -","- C17 H26 Br2 Cl6 N2 O Pt S -","- C34 H52 Br4 Cl12 N4 O2 Pt2 S2 -","2","0.5","","Han, Yuan; Huynh, Han Vinh; Tan, Geok Kheng","Mono- vs Bis(carbene) Complexes: A Detailed Study on Platinum(II)−Benzimidazolin-2-ylidenes","Organometallics","2007","26","18","4612","","10.1021/om700543p","","","0.71073","MoKα","","0.0405","0.0352","","","0.0926","0.0947","","","","","","1.089","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073697","10.5275","0.0005","17.5069","0.0008","16.5319","0.0007","90","","94.769","0.001","90","","3036.3","0.2","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H33 Br2 N2 P Pt -","- C31 H33 Br2 N2 P Pt -","- C124 H132 Br8 N8 P4 Pt4 -","4","1","","Han, Yuan; Huynh, Han Vinh; Tan, Geok Kheng","Mono- vs Bis(carbene) Complexes: A Detailed Study on Platinum(II)−Benzimidazolin-2-ylidenes","Organometallics","2007","26","18","4612","","10.1021/om700543p","","","0.71073","MoKα","","0.0412","0.0319","","","0.0753","0.0783","","","","","","1.053","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073698","17.1196","0.0007","9.7318","0.0004","29.7136","0.0011","90","","90","","90","","4950.4","0.3","223","2","223","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C22 H31 Br2 N3 O Pt -","- C22 H31 Br2 N3 O Pt -","- C176 H248 Br16 N24 O8 Pt8 -","8","1","","Han, Yuan; Huynh, Han Vinh; Tan, Geok Kheng","Mono- vs Bis(carbene) Complexes: A Detailed Study on Platinum(II)−Benzimidazolin-2-ylidenes","Organometallics","2007","26","18","4612","","10.1021/om700543p","","","0.71073","MoKα","","0.0444","0.0305","","","0.0636","0.0675","","","","","","1.022","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4073699","10.766","0.0005","16.4032","0.001","12.1182","0.0004","90","","102.878","0.003","90","","2086.21","0.18","150","1","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H39 Cl Ir N2 P -","- C16 H39 Cl Ir N2 P -","- C64 H156 Cl4 Ir4 N8 P4 -","4","1","","Choualeb, Aldjia; Lough, Alan J.; Gusev, Dmitry G.","Hemilabile Pincer-Type Hydride Complexes of Iridium","Organometallics","2007","26","21","5224","","10.1021/om700550x","","","0.71073","MoKα","","0.076","0.0438","","","0.0955","0.1087","","","","","","1.062","","","","has coordinates","178625","2020-10-21","18:00:00",""
"4073700","24.221","0.005","6.854","0.0014","24.793","0.005","90","","95.9","0.03","90","","4094.1","1.5","200","1","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H80 Ir2 N4 P2 -","- C32 H80 Ir2 N4 P2 -","- C128 H320 Ir8 N16 P8 -","4","0.5","","Choualeb, Aldjia; Lough, Alan J.; Gusev, Dmitry G.","Hemilabile Pincer-Type Hydride Complexes of Iridium","Organometallics","2007","26","21","5224","","10.1021/om700550x","","","0.71073","MoKα","","0.0562","0.0439","","","0.11","0.1183","","","","","","1.044","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073701","7.3569","0.0002","12.9056","0.0004","17.5057","0.0005","90","","100.907","0.002","90","","1632.06","0.08","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 Fe Si -","- C19 H18 Fe Si -","- C76 H72 Fe4 Si4 -","4","1","","Zamora, Magdalena; Alonso, Beatriz; Pastor, César; Cuadrado, Isabel","Multiredox Heterometallic Carbosilane Dendrimers","Organometallics","2007","26","21","5153","","10.1021/om700559t","","","1.54178","CuKα","","0.0298","0.029","","","0.0781","0.0787","","","","","","1.063","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073702","10.4463","0.0002","11.9294","0.0002","16.3013","0.0003","90","","97.001","0.001","90","","2016.29","0.06","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 Cr Fe O3 Si -","- C22 H20 Cr Fe O3 Si -","- C88 H80 Cr4 Fe4 O12 Si4 -","4","1","","Zamora, Magdalena; Alonso, Beatriz; Pastor, César; Cuadrado, Isabel","Multiredox Heterometallic Carbosilane Dendrimers","Organometallics","2007","26","21","5153","","10.1021/om700559t","","","1.54178","CuKα","","0.0577","0.0412","","","0.1027","0.111","","","","","","1.019","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073703","13.6205","0.0004","16.6389","0.0005","16.7659","0.0005","60.3685","0.0013","89.1379","0.0015","66.7793","0.0014","2957.24","0.17","120","","120","","","","","","","","","6","P -1","-P 1","2","","","","- C56 H90 N4 O P4 Rh2 -","- C56 H90 N4 O P4 Rh2 -","- C112 H180 N8 O2 P8 Rh4 -","2","1","","Gatard, Sylvain; Guo, Chengyun; Foxman, Bruce M.; Ozerov, Oleg V.","Thioether, Dinitrogen, and Olefin Complexes of (PNP)Rh: Kinetics and Thermodynamics of Exchange and Oxidative Addition Reactions","Organometallics","2007","26","25","6066","","10.1021/om700563k","","","0.71073","MoKα","","0.0319","0.0242","","0.0624","0.0578","0.0624","","","","","","0.9301","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073704","9.688","0.008","9.94","0.003","19.119","0.005","85.05","0.02","81.31","0.04","62.22","0.04","1610","1.6","294","","294","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H52 N P2 Rh -","- C32 H52 N P2 Rh -","- C64 H104 N2 P4 Rh2 -","2","1","","Gatard, Sylvain; Guo, Chengyun; Foxman, Bruce M.; Ozerov, Oleg V.","Thioether, Dinitrogen, and Olefin Complexes of (PNP)Rh: Kinetics and Thermodynamics of Exchange and Oxidative Addition Reactions","Organometallics","2007","26","25","6066","","10.1021/om700563k","","","0.71073","MoKα","","0.0783","0.0563","","0.0988","0.0661","0.0661","","","","","","1.0724","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073705","11.1675","0.0012","17.0037","0.0016","24.853","0.002","90","","98.47","0.006","90","","4667.8","0.8","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52.5 H57 B N4 P2 Rh -","- C52.5 H57 B N4 P2 Rh -","- C210 H228 B4 N16 P8 Rh4 -","4","1","","Fraser, Lauren R.; Bird, Jeffrey; Wu, Qiming; Cao, Changsheng; Patrick, Brian O.; Love, Jennifer A.","Synthesis, Structure, and Hydrothiolation Activity of Rhodium Pyrazolylborate Complexes","Organometallics","2007","26","23","5602","","10.1021/om700564t","","","0.71069","MoKα","","0.0606","0.0386","","","0.0869","0.0979","","","","","","1.015","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073706","17.4909","0.0009","18.524","0.001","18.517","0.001","90","","107.914","0.005","90","","5708.7","0.5","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C68 H64 B N6 P2 Rh -","- C68 H64 B N6 P2 Rh -","- C272 H256 B4 N24 P8 Rh4 -","4","1","","Fraser, Lauren R.; Bird, Jeffrey; Wu, Qiming; Cao, Changsheng; Patrick, Brian O.; Love, Jennifer A.","Synthesis, Structure, and Hydrothiolation Activity of Rhodium Pyrazolylborate Complexes","Organometallics","2007","26","23","5602","","10.1021/om700564t","","","0.71069","MoKα","","0.0533","0.0366","","","0.0853","0.0931","","","","","","1.017","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073707","14.9","0.0005","14.8303","0.0005","29.46","0.001","90","","92.26","0.002","90","","6504.8","0.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C72 H72 B N6 P2 Rh -","- C66 H58 B N6 P2 Rh -","- C264 H232 B4 N24 P8 Rh4 -","4","1","","Fraser, Lauren R.; Bird, Jeffrey; Wu, Qiming; Cao, Changsheng; Patrick, Brian O.; Love, Jennifer A.","Synthesis, Structure, and Hydrothiolation Activity of Rhodium Pyrazolylborate Complexes","Organometallics","2007","26","23","5602","","10.1021/om700564t","","","0.71069","MoKα","","0.0581","0.0368","","","0.0841","0.0898","","","","","","0.987","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073708","20.0374","0.0014","12.3041","0.0016","32.45","0.002","90","","93.294","0.006","90","","7987.1","1.3","200","2","200","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C40 H60 Eu Ga2 -","- C40 H60 Eu Ga2 -","- C320 H480 Eu8 Ga16 -","8","1","","Wiecko, Michal; Roesky, Peter W.","Gallium(I)−Lanthanide(II) Donor−Acceptor Bonds","Organometallics","2007","26","19","4846","","10.1021/om7005672","","","0.71073","MoKα","","0.044","0.0385","","","0.0985","0.1014","","","","","","1.034","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073709","15.9742","0.0007","22.7462","0.0011","18.2842","0.0013","90","","90","","90","","6643.6","0.6","200","2","200","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C34 H53 Ga O Yb -","- C34 H53 Ga O Yb -","- C272 H424 Ga8 O8 Yb8 -","8","1","","Wiecko, Michal; Roesky, Peter W.","Gallium(I)−Lanthanide(II) Donor−Acceptor Bonds","Organometallics","2007","26","19","4846","","10.1021/om7005672","","","0.71073","MoKα","","0.0425","0.0259","","","0.0469","0.0496","","","","","","1.004","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073710","15.5982","0.0019","13.21","0.0015","11.1157","0.0012","90","","108.847","0.012","90","","2167.6","0.5","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H33 B O2 Si2 -","- C19 H33 B O2 Si2 -","- C76 H132 B4 O8 Si8 -","4","1","","Büttner, Matthias W.; Nätscher, Jennifer B.; Burschka, Christian; Tacke, Reinhold","Development of a New Building Block for the Synthesis of Silicon-Based Drugs and Odorants: Alternative Synthesis of the Retinoid Agonist Disila-bexarotene","Organometallics","2007","26","19","4835","","10.1021/om700570f","","","0.71073","MoKα","","0.0601","0.0498","","","0.1012","0.1072","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073711","9.2211","0.0018","10.489","0.002","16.445","0.003","92.22","0.03","102.27","0.03","100.55","0.03","1523","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H22 O Si2 -","- C13 H22 O Si2 -","- C52 H88 O4 Si8 -","4","2","","Büttner, Matthias W.; Nätscher, Jennifer B.; Burschka, Christian; Tacke, Reinhold","Development of a New Building Block for the Synthesis of Silicon-Based Drugs and Odorants: Alternative Synthesis of the Retinoid Agonist Disila-bexarotene","Organometallics","2007","26","19","4835","","10.1021/om700570f","","","0.71073","MoKα","","0.0654","0.0413","","","0.1022","0.1132","","","","","","1.027","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073712","19.945","0.0001","9.597","0.0002","31.168","0.0003","90","","90","","90","","5965.93","0.14","150","2","150","2","","","","","","","synthesized by the authors","4","P b c a","-P 2ac 2ab","61","","","","- C34 H40 O2 Sn -","- C34 H40 O2 Sn -","- C272 H320 O16 Sn8 -","8","1","","Dostál, Libor; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Holeček, Jaroslav; Biesemans, Monique; Willem, Rudolph; De Proft, Frank; Geerlings, Paul","Organotin(IV) Derivatives of Some O,C,O-Chelating Ligands. Part 2⊥","Organometallics","2007","26","25","6312","","10.1021/om700576n","","","0.71073","MoKα","","0.0618","0.0337","","","0.0748","0.0847","","","","","","1.034","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073713","13.489","0.0003","8.604","0.0002","17.746","0.0003","90","","97.852","0.0013","90","","2040.28","0.07","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H26 Cl2 O2 Sn -","- C20 H26 Cl2 O2 Sn -","- C80 H104 Cl8 O8 Sn4 -","4","1","","Dostál, Libor; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Holeček, Jaroslav; Biesemans, Monique; Willem, Rudolph; De Proft, Frank; Geerlings, Paul","Organotin(IV) Derivatives of Some O,C,O-Chelating Ligands. Part 2⊥","Organometallics","2007","26","25","6312","","10.1021/om700576n","","","0.7107","MoKα","","0.0332","0.026","","","0.059","0.0617","","","","","","1.046","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4073714","13.909","0.0002","12.327","0.0001","14.626","0.0002","90","","106.567","0.0007","90","","2403.61","0.05","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H28 O2 Sn -","- C28 H28 O2 Sn -","- C112 H112 O8 Sn4 -","4","1","","Dostál, Libor; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Holeček, Jaroslav; Biesemans, Monique; Willem, Rudolph; De Proft, Frank; Geerlings, Paul","Organotin(IV) Derivatives of Some O,C,O-Chelating Ligands. Part 2⊥","Organometallics","2007","26","25","6312","","10.1021/om700576n","","","0.7107","MoKα","","0.0256","0.0221","","","0.0537","0.0557","","","","","","1.052","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4073715","24.961","0.0001","25.659","0.0002","12.819","0.0002","90","","90","","90","","8210.24","0.15","150","2","150","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C22 H23 Cl O2 Sn -","- C22 H23 Cl O2 Sn -","- C352 H368 Cl16 O32 Sn16 -","16","2","","Dostál, Libor; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Holeček, Jaroslav; Biesemans, Monique; Willem, Rudolph; De Proft, Frank; Geerlings, Paul","Organotin(IV) Derivatives of Some O,C,O-Chelating Ligands. Part 2⊥","Organometallics","2007","26","25","6312","","10.1021/om700576n","","","0.7107","MoKα","","0.0412","0.0294","","","0.0701","0.0755","","","","","","1.055","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4073716","12.524","0.0002","12.524","0.0002","9.29","0.0002","90","","90","","120","","1261.92","0.04","150","2","150","2","","","","","","","","5","P 32","P 32","145","","","","- C16 H18 Cl2 O2 Sn -","- C16 H18 Cl2 O2 Sn -","- C48 H54 Cl6 O6 Sn3 -","3","1","","Dostál, Libor; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Holeček, Jaroslav; Biesemans, Monique; Willem, Rudolph; De Proft, Frank; Geerlings, Paul","Organotin(IV) Derivatives of Some O,C,O-Chelating Ligands. Part 2⊥","Organometallics","2007","26","25","6312","","10.1021/om700576n","","","0.7107","MoKα","","0.0153","0.015","","","0.034","0.0341","","","","","","1.112","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4073717","9.551","0.0003","12.179","0.0003","12.647","0.0004","106.914","0.0018","99.294","0.0016","94.071","0.0019","1378.12","0.07","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H13 Cl3 O2 Sn -","- C10 H13 Cl3 O2 Sn -","- C40 H52 Cl12 O8 Sn4 -","4","2","","Dostál, Libor; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Holeček, Jaroslav; Biesemans, Monique; Willem, Rudolph; De Proft, Frank; Geerlings, Paul","Organotin(IV) Derivatives of Some O,C,O-Chelating Ligands. Part 2⊥","Organometallics","2007","26","25","6312","","10.1021/om700576n","","","0.7107","MoKα","","0.0282","0.0262","","","0.0673","0.0684","","","","","","1.093","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073718","17.87","0.0002","13.418","0.0002","11.379","0.0002","90","","90","","90","","2728.45","0.07","150","2","150","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C23 H31 Cl5 O2 Sn -","- C23 H31 Cl5 O2 Sn -","- C92 H124 Cl20 O8 Sn4 -","4","1","","Dostál, Libor; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Holeček, Jaroslav; Biesemans, Monique; Willem, Rudolph; De Proft, Frank; Geerlings, Paul","Organotin(IV) Derivatives of Some O,C,O-Chelating Ligands. Part 2⊥","Organometallics","2007","26","25","6312","","10.1021/om700576n","","","0.7107","MoKα","","0.0319","0.0278","","","0.0693","0.0714","","","","","","1.049","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073719","8.261","0.0002","9.057","0.0002","30.379","0.0009","90","","96.76","0.001","90","","2257.15","0.1","150","2","150","2","","","","","","","synthesized by the authors","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H27 Cl O2 Sn -","- C24 H27 Cl O2 Sn -","- C96 H108 Cl4 O8 Sn4 -","4","1","","Dostál, Libor; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Holeček, Jaroslav; Biesemans, Monique; Willem, Rudolph; De Proft, Frank; Geerlings, Paul","Organotin(IV) Derivatives of Some O,C,O-Chelating Ligands. Part 2⊥","Organometallics","2007","26","25","6312","","10.1021/om700576n","","","0.71073","MoKα","","0.0312","0.0225","","","0.0458","0.0489","","","","","","1.03","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4073720","18.062","0.0002","11.654","0.0003","18.445","0.0003","90","","90","","90","","3882.57","0.13","150","2","150","2","","","","","","","synthesized by the authors","5","P b c a","-P 2ac 2ab","61","","","","- C18 H22 Cl2 O2 Sn -","- C18 H22 Cl2 O2 Sn -","- C144 H176 Cl16 O16 Sn8 -","8","1","","Dostál, Libor; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Holeček, Jaroslav; Biesemans, Monique; Willem, Rudolph; De Proft, Frank; Geerlings, Paul","Organotin(IV) Derivatives of Some O,C,O-Chelating Ligands. Part 2⊥","Organometallics","2007","26","25","6312","","10.1021/om700576n","","","0.7107","MoKα","","0.0274","0.023","","","0.0615","0.0637","","","","","","1.03","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073721","15.711","0.002","7.7716","0.0008","17.039","0.002","90","","109.499","0.006","90","","1961.1","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","cis-Cp*W(NO)[eta2-(CH2NMe)P(NMe2)2](H)","","","- C16 H33 N4 O P W -","- C16 H33 N4 O P W -","- C64 H132 N16 O4 P4 W4 -","4","1","","Blackmore, Ian J.; Semiao, Christopher J.; Buschhaus, Miriam S. A.; Patrick, Brian O.; Legzdins, Peter","Investigations Directed at Catalytic Carbon−Carbon and Carbon−Oxygen Bond Formation via C−H Bond Activation","Organometallics","2007","26","20","4881","","10.1021/om700583q","","","0.71073","MoKα","","0.0378","0.0295","","","0.073","0.0791","","","","","","1.068","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073722","8.2752","0.0002","18.3553","0.0004","15.2157","0.0004","90","","102.132","0.001","90","","2259.55","0.09","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Cp*W(NO)(OCHiPr2)(Ph)","","","- C23 H35 N O2 W -","- C23 H35 N O2 W -","- C92 H140 N4 O8 W4 -","4","1","","Blackmore, Ian J.; Semiao, Christopher J.; Buschhaus, Miriam S. A.; Patrick, Brian O.; Legzdins, Peter","Investigations Directed at Catalytic Carbon−Carbon and Carbon−Oxygen Bond Formation via C−H Bond Activation","Organometallics","2007","26","20","4881","","10.1021/om700583q","","","0.71073","MoKα","","0.0414","0.0243","","","0.0403","0.0474","","","","","","1.097","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073723","11.323","0.002","12.829","0.002","13.41","0.002","89.345","0.005","76.52","0.004","74.479","0.004","1822.5","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Cp*W(NO)(eta2-OCiPr2)(PPh3).THF","","","- C39 H50 N O3 P W -","- C39 H50 N O3 P W -","- C78 H100 N2 O6 P2 W2 -","2","1","","Blackmore, Ian J.; Semiao, Christopher J.; Buschhaus, Miriam S. A.; Patrick, Brian O.; Legzdins, Peter","Investigations Directed at Catalytic Carbon−Carbon and Carbon−Oxygen Bond Formation via C−H Bond Activation","Organometallics","2007","26","20","4881","","10.1021/om700583q","","","0.71073","MoKα","","0.0377","0.0337","","","0.0844","0.0863","","","","","","1.071","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073724","22.541","0.005","10.63","0.004","26.256","0.01","90","","111.75","0.02","90","","5843","3","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C35 H28 Cr O7 -","- C35 H28 Cr O7 -","- C280 H224 Cr8 O56 -","8","1","","Germaneau, Romain; Chavignon, René; Tranchier, Jean-Philippe; Rose-Munch, Françoise; Rose, Eric; Collot, Mayeul; Duhayon, Carine","(η6-Arene)tricarbonylchromium and Ferrocene Complexes Linked to Binaphthyl Derivatives","Organometallics","2007","26","25","6139","","10.1021/om700586z","","","0.71073","MoKα","","0.191","0.0744","","0.2208","0.0822","0.0822","","","","","","1.1442","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073725","10.61","0.0016","24.26","0.007","14.354","0.004","90","","107.978","0.017","90","","3514.3","1.5","120","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C44 H26 Cr2 O8 -","- C44 H26 Cr2 O8 -","- C176 H104 Cr8 O32 -","4","1","","Germaneau, Romain; Chavignon, René; Tranchier, Jean-Philippe; Rose-Munch, Françoise; Rose, Eric; Collot, Mayeul; Duhayon, Carine","(η6-Arene)tricarbonylchromium and Ferrocene Complexes Linked to Binaphthyl Derivatives","Organometallics","2007","26","25","6139","","10.1021/om700586z","","","0.71073","MoKα","","0.1592","0.0842","","0.1775","0.0875","0.0875","","","","","","1.0468","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073726","11.55","0.0002","16.0631","0.0003","15.943","0.0003","90","","92.407","0.001","90","","2955.28","0.09","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C18 H46 Al Cl Li N3 O Si3 -","- C18 H46 Al Cl Li N3 O Si3 -","- C72 H184 Al4 Cl4 Li4 N12 O4 Si12 -","4","1","","Zhu, Hongping; Chen, Eugene Y.-X.","Group 13 and Lanthanide Complexes Supported by Tridentate Tripodal Triamine Ligands: Structural Diversity and Polymerization Catalysis","Organometallics","2007","26","22","5395","","10.1021/om700587w","","","0.71073","MoKα","","0.0765","0.0446","","","0.1052","0.1209","","","","","","0.994","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073727","9.8773","0.0003","11.8618","0.0004","13.7028","0.0005","105.722","0.002","93.966","0.002","96.701","0.002","1526.28","0.09","100","","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H44 Al N3 Si3 -","- C29 H44 Al N3 Si3 -","- C58 H88 Al2 N6 Si6 -","2","1","","Zhu, Hongping; Chen, Eugene Y.-X.","Group 13 and Lanthanide Complexes Supported by Tridentate Tripodal Triamine Ligands: Structural Diversity and Polymerization Catalysis","Organometallics","2007","26","22","5395","","10.1021/om700587w","","","0.71073","MoKα","","0.0607","0.0394","","","0.0893","0.099","","","","","","1.015","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073728","39.9056","0.0013","9.3888","0.0003","19.4839","0.0006","90","","90","","90","","7299.9","0.4","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C32 H53 Al2 N3 Si3 -","- C32 H53 Al2 N3 Si3 -","- C256 H424 Al16 N24 Si24 -","8","2","","Zhu, Hongping; Chen, Eugene Y.-X.","Group 13 and Lanthanide Complexes Supported by Tridentate Tripodal Triamine Ligands: Structural Diversity and Polymerization Catalysis","Organometallics","2007","26","22","5395","","10.1021/om700587w","","","0.71073","MoKα","","0.0837","0.0508","","","0.0984","0.1113","","","","","","0.997","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073729","36.562","0.003","9.5547","0.0009","19.4147","0.0016","90","","100.698","0.006","90","","6664.4","1","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H45 Al2 N3 Si4 -","- C28 H45 Al2 N3 Si4 -","- C224 H360 Al16 N24 Si32 -","8","1","","Zhu, Hongping; Chen, Eugene Y.-X.","Group 13 and Lanthanide Complexes Supported by Tridentate Tripodal Triamine Ligands: Structural Diversity and Polymerization Catalysis","Organometallics","2007","26","22","5395","","10.1021/om700587w","","","0.71073","MoKα","","0.2428","0.1117","","","0.2386","0.2942","","","","","","1.052","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073730","13.9744","0.0006","14.4707","0.0006","18.2232","0.0008","84.707","0.003","80.305","0.003","63.979","0.002","3263.5","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H84 N6 Si8 Sm2 -","- C58 H84 N6 Si8 Sm2 -","- C116 H168 N12 Si16 Sm4 -","2","1","","Zhu, Hongping; Chen, Eugene Y.-X.","Group 13 and Lanthanide Complexes Supported by Tridentate Tripodal Triamine Ligands: Structural Diversity and Polymerization Catalysis","Organometallics","2007","26","22","5395","","10.1021/om700587w","","","0.71073","MoKα","","0.1572","0.1167","","","0.2874","0.3049","","","","","","1.086","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073731","43.751","0.0012","12.7618","0.0004","26.9246","0.0007","90","","127.374","0.002","90","","11946.7","0.7","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C57.2 H78.8 B N3 Si3 Zr -","- C57.2 H78.8 B N3 Si3 Zr -","- C457.6 H630.4 B8 N24 Si24 Zr8 -","8","1","","Zhu, Hongping; Chen, Eugene Y.-X.","Group 13 and Lanthanide Complexes Supported by Tridentate Tripodal Triamine Ligands: Structural Diversity and Polymerization Catalysis","Organometallics","2007","26","22","5395","","10.1021/om700587w","","","0.71073","MoKα","","0.1212","0.0699","","","0.1794","0.2172","","","","","","1.022","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073732","14.4807","0.001","15.9232","0.0011","20.1442","0.0013","90","","110.252","0.001","90","","4357.7","0.5","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H48 N6 O7 Ru -","- C48 H48 N6 O7 Ru -","- C192 H192 N24 O28 Ru4 -","4","1","","Occhipinti, Giovanni; Bjørsvik, Hans-René; Törnroos, Karl Wilhelm; Fürstner, Alois; Jensen, Vidar R.","The First Imidazolium-Substituted Metal Alkylidene","Organometallics","2007","26","18","4383","","10.1021/om700590v","","","0.71073","MoKα","","0.1326","0.0819","","","0.1535","0.1689","","","","","","1.099","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073733","10.9968","0.0005","15.9651","0.0008","26.2519","0.0012","90","","90","","90","","4608.9","0.4","123","2","123","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Chloro{3-[2-(hydroxy-k<i>O</i>)-5-nitrobenzyl]-1-(2,4,6- trimethylphenyl)-\1<i>H</i>-imidazol-3-ium-2-yl-k<i>C</i>^2^} {[2-(1-methylethoxy)phenyl][3-(5-νitro-2-oxidobenzyl)-1-(2,4,6- trimethylphenyl)-1<i>H</i>-imidazol-3-ium-2-ψl]methylidene} ruthenium(IV) dichloromethane solvate","","- C49 H49 Cl3 N6 O7 Ru -","- C49 H49 Cl3 N6 O7 Ru -","- C196 H196 Cl12 N24 O28 Ru4 -","4","1","","Occhipinti, Giovanni; Bjørsvik, Hans-René; Törnroos, Karl Wilhelm; Fürstner, Alois; Jensen, Vidar R.","The First Imidazolium-Substituted Metal Alkylidene","Organometallics","2007","26","18","4383","","10.1021/om700590v","","","0.71073","MoKα","","0.0558","0.0415","","","0.0953","0.1036","","","","","","1.082","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073734","17.435","0.002","8.688","0.001","18.59","0.003","90","","96.765","0.002","90","","2796.3","0.6","163","2","163","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H40 I2 O2 P Sm -","- C22 H40 I2 O2 P Sm -","- C88 H160 I8 O8 P4 Sm4 -","4","1","","Jaroschik, Florian; Shima, Takanori; Li, Xiaofang; Mori, Kyouichi; Ricard, Louis; Le Goff, Xavier-Frédéric; Nief, François; Hou, Zhaomin","Synthesis, Characterization, and Reactivity of Mono(phospholyl)lanthanoid(III) Bis(dimethylaminobenzyl) Complexes","Organometallics","2007","26","23","5654","","10.1021/om7005936","","","0.71073","MoKα","","0.0601","0.0409","","","0.0859","0.0928","","","","","","1.009","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073735","21.86","0.001","11.952","0.001","23.239","0.001","90","","96.43","0.001","90","","6033.5","0.6","150","0.1","150","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H48 N2 P Sc -","- C32 H48 N2 P Sc -","- C256 H384 N16 P8 Sc8 -","8","2","","Jaroschik, Florian; Shima, Takanori; Li, Xiaofang; Mori, Kyouichi; Ricard, Louis; Le Goff, Xavier-Frédéric; Nief, François; Hou, Zhaomin","Synthesis, Characterization, and Reactivity of Mono(phospholyl)lanthanoid(III) Bis(dimethylaminobenzyl) Complexes","Organometallics","2007","26","23","5654","","10.1021/om7005936","","","0.71069","MoKα","","0.1011","0.047","","","0.1047","0.1239","","","","","","0.945","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073736","15.253","0.001","12.08","0.001","16.77","0.001","90","","92.676","0.001","90","","3086.6","0.4","163","0.1","163","0.1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C32 H48 N2 P Y -","- C32 H48 N2 P Y -","- C128 H192 N8 P4 Y4 -","4","2","","Jaroschik, Florian; Shima, Takanori; Li, Xiaofang; Mori, Kyouichi; Ricard, Louis; Le Goff, Xavier-Frédéric; Nief, François; Hou, Zhaomin","Synthesis, Characterization, and Reactivity of Mono(phospholyl)lanthanoid(III) Bis(dimethylaminobenzyl) Complexes","Organometallics","2007","26","23","5654","","10.1021/om7005936","","","0.71073","MoKα","","0.0834","0.0415","","","0.0486","0.0545","","","","","","0.74","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073737","15.379","0.001","12.077","0.001","16.759","0.001","90","","92.095","0.001","90","","3110.6","0.4","163","0.1","163","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C32 H48 N2 P Sm -","- C32 H48 N2 P Sm -","- C128 H192 N8 P4 Sm4 -","4","2","","Jaroschik, Florian; Shima, Takanori; Li, Xiaofang; Mori, Kyouichi; Ricard, Louis; Le Goff, Xavier-Frédéric; Nief, François; Hou, Zhaomin","Synthesis, Characterization, and Reactivity of Mono(phospholyl)lanthanoid(III) Bis(dimethylaminobenzyl) Complexes","Organometallics","2007","26","23","5654","","10.1021/om7005936","","","0.71073","MoKα","","0.0285","0.0259","","","0.0526","0.0534","","","","","","0.984","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073738","10.698","0.001","26.473","0.001","21.439","0.001","90","","91.163","0.001","90","","6070.4","0.7","150","0.1","150","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H96 Cl4 O6 P2 Sc2 -","- C52 H96 Cl4 O6 P2 Sc2 -","- C208 H384 Cl16 O24 P8 Sc8 -","4","1","","Jaroschik, Florian; Shima, Takanori; Li, Xiaofang; Mori, Kyouichi; Ricard, Louis; Le Goff, Xavier-Frédéric; Nief, François; Hou, Zhaomin","Synthesis, Characterization, and Reactivity of Mono(phospholyl)lanthanoid(III) Bis(dimethylaminobenzyl) Complexes","Organometallics","2007","26","23","5654","","10.1021/om7005936","","","0.71069","MoKα","","0.0615","0.0418","","","0.1158","0.1255","","","","","","1.065","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073739","13.808","0.001","15.315","0.001","11.507","0.001","90","","107.981","0.001","90","","2314.5","0.3","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H66 Cl4 N2 P2 Sc2 -","- C38 H58 Cl4 N2 P2 Sc2 -","- C76 H116 Cl8 N4 P4 Sc4 -","2","0.5","","Jaroschik, Florian; Shima, Takanori; Li, Xiaofang; Mori, Kyouichi; Ricard, Louis; Le Goff, Xavier-Frédéric; Nief, François; Hou, Zhaomin","Synthesis, Characterization, and Reactivity of Mono(phospholyl)lanthanoid(III) Bis(dimethylaminobenzyl) Complexes","Organometallics","2007","26","23","5654","","10.1021/om7005936","","","0.71069","MoKα","","0.0466","0.0385","","","0.1236","0.1273","","","","","","1.104","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073740","8.291","0.001","25.129","0.001","15.434","0.001","90","","92.97","0.01","90","","3211.3","0.5","198","2","198","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C41 H33 P Zr -","- C41 H33 P Zr -","- C164 H132 P4 Zr4 -","4","1","","Spies, Patrick; Kehr, Gerald; Kehr, Seda; Fröhlich, Roland; Erker, Gerhard","Formation and Structural and Dynamic Features of Atropisomeric η2-Iminoacyl Zirconium Complexes","Organometallics","2007","26","23","5612","","10.1021/om7005968","","","0.71073","MoKα","","0.0475","0.0358","","","0.0861","0.0921","","","","","","1.057","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073741","8.412","0.001","11.119","0.001","22.698","0.001","81.52","0.01","79.7","0.01","71.34","0.01","1969.7","0.3","198","2","198","2","","","","","","","","6","P -1","-P 1","2","","","","- C46.5 H43 Cl N P Zr -","- C46.5 H43 Cl N P Zr -","- C93 H86 Cl2 N2 P2 Zr2 -","2","1","","Spies, Patrick; Kehr, Gerald; Kehr, Seda; Fröhlich, Roland; Erker, Gerhard","Formation and Structural and Dynamic Features of Atropisomeric η2-Iminoacyl Zirconium Complexes","Organometallics","2007","26","23","5612","","10.1021/om7005968","","","0.71073","MoKα","","0.0447","0.0378","","","0.0978","0.1028","","","","","","1.014","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073742","21.386","0.001","10.982","0.001","30.684","0.001","90","","95.67","0.01","90","","7171.2","0.8","198","2","198","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C40 H24 Cl F10 O0.5 P Zr -","- C40 H24 Cl F10 O0.5 P Zr -","- C320 H192 Cl8 F80 O4 P8 Zr8 -","8","1","","Spies, Patrick; Kehr, Gerald; Kehr, Seda; Fröhlich, Roland; Erker, Gerhard","Formation and Structural and Dynamic Features of Atropisomeric η2-Iminoacyl Zirconium Complexes","Organometallics","2007","26","23","5612","","10.1021/om7005968","","","0.71073","MoKα","","0.0869","0.0492","","","0.0894","0.1015","","","","","","1.026","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073743","12.5348","0.0002","17.3494","0.0003","18.25","0.0003","90","","103.452","0.001","90","","3859.97","0.11","198","2","198","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C43 H29 Cl F10 N P Zr -","- C43 H29 Cl F10 N P Zr -","- C172 H116 Cl4 F40 N4 P4 Zr4 -","4","1","","Spies, Patrick; Kehr, Gerald; Kehr, Seda; Fröhlich, Roland; Erker, Gerhard","Formation and Structural and Dynamic Features of Atropisomeric η2-Iminoacyl Zirconium Complexes","Organometallics","2007","26","23","5612","","10.1021/om7005968","","","0.71073","MoKα","","0.1849","0.0663","","","0.1054","0.1351","","","","","","1.039","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073744","20.091","0.003","19.288","0.002","29.998","0.004","90","","90","","90","","11625","3","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C64 H82 Li6 N4 -","- C64 H82 Li6 N4 -","- C512 H656 Li48 N32 -","8","1","","Koller, Jürgen; Sarkar, Soumya; Abboud, Khalil A.; Veige, Adam S.","Synthesis and Characterization of (2,6-iPrNCN)HfCl2-and (3,5-MeNCN)2Hf2-(where NCN = 2,6-bis[phenylazanidyl]methylphenyl): New Trianionic Pincer Ligands","Organometallics","2007","26","22","5438","","10.1021/om700597u","","","0.71073","MoKα","","0.1887","0.0589","","","0.0916","0.1242","","","","","","0.874","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073745","14.2626","0.0011","12.6991","0.001","27.443","0.002","90","","98.627","0.002","90","","4914.3","0.6","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H71 Cl2 Hf Li N2 O6 -","- C44 H71 Cl2 Hf Li N2 O6 -","- C176 H284 Cl8 Hf4 Li4 N8 O24 -","4","1","","Koller, Jürgen; Sarkar, Soumya; Abboud, Khalil A.; Veige, Adam S.","Synthesis and Characterization of (2,6-iPrNCN)HfCl2-and (3,5-MeNCN)2Hf2-(where NCN = 2,6-bis[phenylazanidyl]methylphenyl): New Trianionic Pincer Ligands","Organometallics","2007","26","22","5438","","10.1021/om700597u","","","0.71073","MoKα","","0.1439","0.0704","","","0.1418","0.1669","","","","","","1.024","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073746","15.3065","0.0005","15.3065","0.0005","16.118","0.001","90","","90","","90","","3776.3","0.3","173","2","173","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C72 H110 Li6 N4 O12 -","- C72 H110 Li6 N4 O12 -","- C144 H220 Li12 N8 O24 -","2","0.25","","Koller, Jürgen; Sarkar, Soumya; Abboud, Khalil A.; Veige, Adam S.","Synthesis and Characterization of (2,6-iPrNCN)HfCl2-and (3,5-MeNCN)2Hf2-(where NCN = 2,6-bis[phenylazanidyl]methylphenyl): New Trianionic Pincer Ligands","Organometallics","2007","26","22","5438","","10.1021/om700597u","","","0.71073","MoKα","","0.086","0.0493","","","0.1221","0.1384","","","","","","0.943","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073747","39.443","0.004","16.5027","0.0017","16.2419","0.0017","90","","98.916","0.002","90","","10444.4","1.9","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H70 Hf Li2 N4 O4 -","- C56 H70 Hf Li2 N4 O4 -","- C448 H560 Hf8 Li16 N32 O32 -","8","2","","Koller, Jürgen; Sarkar, Soumya; Abboud, Khalil A.; Veige, Adam S.","Synthesis and Characterization of (2,6-iPrNCN)HfCl2-and (3,5-MeNCN)2Hf2-(where NCN = 2,6-bis[phenylazanidyl]methylphenyl): New Trianionic Pincer Ligands","Organometallics","2007","26","22","5438","","10.1021/om700597u","","","0.71073","MoKα","","0.0933","0.0422","","","0.066","0.0736","","","","","","0.868","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073748","17.62","0.001","19.713","0.001","20.132","0.001","90","","90","","90","","6992.7","0.6","150","0.1","150","0.1","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C29 H36 Au F6 N3 O4 S2 -","- C29 H36 Au F6 N3 O4 S2 -","- C232 H288 Au8 F48 N24 O32 S16 -","8","1","","Ricard, Louis; Gagosz, Fabien","Synthesis and Reactivity of Air-Stable N-Heterocyclic Carbene Gold(I) Bis(trifluoromethanesulfonyl)imidate Complexes","Organometallics","2007","26","19","4704","","10.1021/om7006002","","","0.71069","MoKα","","0.044","0.0272","","","0.0713","0.0781","","","","","","1.031","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073749","11.823","0.001","15.867","0.001","15.496","0.001","90","","108.201","0.001","90","","2761.5","0.3","396","2","396","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 Au F6 N3 O4 S2 -","- C23 H24 Au F6 N3 O4 S2 -","- C92 H96 Au4 F24 N12 O16 S8 -","4","1","","Ricard, Louis; Gagosz, Fabien","Synthesis and Reactivity of Air-Stable N-Heterocyclic Carbene Gold(I) Bis(trifluoromethanesulfonyl)imidate Complexes","Organometallics","2007","26","19","4704","","10.1021/om7006002","","","0.71069","MoKα","","0.0556","0.0378","","","0.0865","0.0932","","","","","","0.988","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073750","6.767","0.001","9.402","0.001","22.272","0.001","93.184","0.001","94.124","0.001","93.031","0.001","1408.9","0.3","150","0.1","150","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C25 H32 Au F6 N3 O4 S2 -","- C25 H32 Au F6 N3 O4 S2 -","- C50 H64 Au2 F12 N6 O8 S4 -","2","1","","Ricard, Louis; Gagosz, Fabien","Synthesis and Reactivity of Air-Stable N-Heterocyclic Carbene Gold(I) Bis(trifluoromethanesulfonyl)imidate Complexes","Organometallics","2007","26","19","4704","","10.1021/om7006002","","","0.71069","MoKα","","0.0285","0.0258","","","0.0675","0.069","","","","","","1.037","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073751","12.724","0.005","15.191","0.006","18.227","0.007","80.888","0.007","74.034","0.007","81.154","0.007","3322","2","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C66 H66 B F24 N2 O2 Pd -","- C66 H66 B F24 N2 O2 Pd -","- C132 H132 B2 F48 N4 O4 Pd2 -","2","1","","Borkar, Sachin; Yennawar, Hemant; Sen, Ayusman","Methacrylate Insertion into Cationic Diimine Palladium(II)−Alkyl Complexes and the Synthesis of Poly(alkene-block-alkene/carbon monoxide) Copolymers","Organometallics","2007","26","19","4711","","10.1021/om7006024","","","0.71073","MoKα","","0.1408","0.0898","","","0.1817","0.2066","","","","","","1.044","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073752","15.436","0.0006","6.7896","0.0002","21.5079","0.0008","90","","94.606","0.001","90","","2246.84","0.14","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H33 Cl N2 O5 -","- C21 H33 Cl N2 O5 -","- C84 H132 Cl4 N8 O20 -","4","1","","Stylianides, Neoklis; Danopoulos, Andreas A.; Pugh, David; Hancock, Fred; Zanotti-Gerosa, Antonio","Cyclometalated and Alkoxyphenyl-Substituted Palladium Imidazolin-2-ylidene Complexes. Synthetic, Structural, and Catalytic Studies","Organometallics","2007","26","23","5627","","10.1021/om700603d","","","0.71073","MoKα","","0.0715","0.046","","","0.0932","0.1025","","","","","","1.032","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073753","17.4391","0.0012","7.6873","0.0007","16.8172","0.0013","90","","102.049","0.005","90","","2204.8","0.3","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H27 B F4 N2 O6 -","- C21 H27 B F4 N2 O6 -","- C84 H108 B4 F16 N8 O24 -","4","1","","Stylianides, Neoklis; Danopoulos, Andreas A.; Pugh, David; Hancock, Fred; Zanotti-Gerosa, Antonio","Cyclometalated and Alkoxyphenyl-Substituted Palladium Imidazolin-2-ylidene Complexes. Synthetic, Structural, and Catalytic Studies","Organometallics","2007","26","23","5627","","10.1021/om700603d","","","0.71073","MoKα","","0.1152","0.0799","","","0.2006","0.2263","","","","","","1.038","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073754","16.7336","0.0018","11.2402","0.0012","22.3834","0.0016","90","","100.888","0.007","90","","4134.3","0.7","120","2","120","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C97 H104 N8 O8 Pd4 -","- C97 H104 N8 O8 Pd4 -","- C194 H208 N16 O16 Pd8 -","2","0.5","","Stylianides, Neoklis; Danopoulos, Andreas A.; Pugh, David; Hancock, Fred; Zanotti-Gerosa, Antonio","Cyclometalated and Alkoxyphenyl-Substituted Palladium Imidazolin-2-ylidene Complexes. Synthetic, Structural, and Catalytic Studies","Organometallics","2007","26","23","5627","","10.1021/om700603d","","","0.71073","MoKα","","0.164","0.0617","","","0.0975","0.1224","","","","","","1.006","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073755","12.309","0.002","12.969","0.002","13.57","0.002","115.906","0.004","97.093","0.004","95.803","0.005","1904.3","0.5","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H51 Cl N4 Pd -","- C42 H51 Cl N4 Pd -","- C84 H102 Cl2 N8 Pd2 -","2","1","","Stylianides, Neoklis; Danopoulos, Andreas A.; Pugh, David; Hancock, Fred; Zanotti-Gerosa, Antonio","Cyclometalated and Alkoxyphenyl-Substituted Palladium Imidazolin-2-ylidene Complexes. Synthetic, Structural, and Catalytic Studies","Organometallics","2007","26","23","5627","","10.1021/om700603d","","","0.71073","MoKα","","0.0926","0.0777","","","0.1996","0.2129","","","","","","1.103","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073756","22.4014","0.0007","8.0114","0.0003","24.4471","0.0008","90","","114.925","0.002","90","","3978.8","0.2","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C44 H58 N4 Pd -","- C44 H58 N4 Pd -","- C176 H232 N16 Pd4 -","4","1","","Stylianides, Neoklis; Danopoulos, Andreas A.; Pugh, David; Hancock, Fred; Zanotti-Gerosa, Antonio","Cyclometalated and Alkoxyphenyl-Substituted Palladium Imidazolin-2-ylidene Complexes. Synthetic, Structural, and Catalytic Studies","Organometallics","2007","26","23","5627","","10.1021/om700603d","","","0.71073","MoKα","","0.0713","0.0421","","","0.0833","0.0927","","","","","","1.024","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073757","23.344","0.002","8.0765","0.0004","19.6151","0.0018","90","","100.456","0.003","90","","3636.8","0.5","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C42 H52 N4 Pd -","- C42 H52 N4 Pd -","- C168 H208 N16 Pd4 -","4","0.5","","Stylianides, Neoklis; Danopoulos, Andreas A.; Pugh, David; Hancock, Fred; Zanotti-Gerosa, Antonio","Cyclometalated and Alkoxyphenyl-Substituted Palladium Imidazolin-2-ylidene Complexes. Synthetic, Structural, and Catalytic Studies","Organometallics","2007","26","23","5627","","10.1021/om700603d","","","0.71073","MoKα","","0.0727","0.056","","","0.115","0.1212","","","","","","1.164","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073758","10.063","0.002","12.528","0.002","14.84","0.003","71.63","0.03","86.25","0.03","89.04","0.03","1771.7","0.7","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H50 N4 Pd -","- C42 H50 N4 Pd -","- C84 H100 N8 Pd2 -","2","1","","Stylianides, Neoklis; Danopoulos, Andreas A.; Pugh, David; Hancock, Fred; Zanotti-Gerosa, Antonio","Cyclometalated and Alkoxyphenyl-Substituted Palladium Imidazolin-2-ylidene Complexes. Synthetic, Structural, and Catalytic Studies","Organometallics","2007","26","23","5627","","10.1021/om700603d","","","0.71073","MoKα","","0.0614","0.0392","","","0.0781","0.0858","","","","","","1.096","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073759","10.4722","0.0005","16.085","0.0009","18.4923","0.0009","90","","92.636","0.002","90","","3111.6","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H38 N4 O4 Pd -","- C35 H38 N4 O4 Pd -","- C140 H152 N16 O16 Pd4 -","4","1","","Stylianides, Neoklis; Danopoulos, Andreas A.; Pugh, David; Hancock, Fred; Zanotti-Gerosa, Antonio","Cyclometalated and Alkoxyphenyl-Substituted Palladium Imidazolin-2-ylidene Complexes. Synthetic, Structural, and Catalytic Studies","Organometallics","2007","26","23","5627","","10.1021/om700603d","","","0.71073","MoKα","","0.066","0.0393","","","0.0708","0.078","","","","","","1.028","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4073760","11.514","0.0002","17.8268","0.0004","18.584","0.0005","87.615","0.001","86.81","0.001","85.369","0.001","3793.52","0.15","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H46 N4 O8 Pd -","- C39 H46 N4 O8 Pd -","- C156 H184 N16 O32 Pd4 -","4","2","","Stylianides, Neoklis; Danopoulos, Andreas A.; Pugh, David; Hancock, Fred; Zanotti-Gerosa, Antonio","Cyclometalated and Alkoxyphenyl-Substituted Palladium Imidazolin-2-ylidene Complexes. Synthetic, Structural, and Catalytic Studies","Organometallics","2007","26","23","5627","","10.1021/om700603d","","","0.71073","MoKα","","0.0864","0.0485","","","0.0834","0.0926","","","","","","1.052","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073761","9.0941","0.0012","17.826","0.002","19.7889","0.0019","90","","94.333","0.004","90","","3198.8","0.6","233","2","233","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C35 H46 Os Ru -","- C35 H46 Os Ru -","- C140 H184 Os4 Ru4 -","4","1","","Shima, Takanori; Ichikawa, Toshiaki; Suzuki, Hiroharu","Reaction of a Heterobimetallic Polyhydrido Cluster, [Cp*Ru(μ-H)4OsCp*] (Cp* = η5-C5Me5), with Diphenylacetylene. Regioselective C−H Bond Activation at the Osmium Center","Organometallics","2007","26","25","6329","","10.1021/om700606q","","","0.71069","MoKα","","0.0994","0.0789","","","0.1876","0.1953","","","","","","1.142","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073762","11.391","0.004","17.621","0.005","11.303","0.0016","98.789","0.009","112.548","0.016","76.785","0.019","2034.5","1","253","2","253","2","","","","","","","","4","P -1","-P 1","2","","","","- C49 H56 Os Ru -","- C49 H56 Os Ru -","- C98 H112 Os2 Ru2 -","2","1","","Shima, Takanori; Ichikawa, Toshiaki; Suzuki, Hiroharu","Reaction of a Heterobimetallic Polyhydrido Cluster, [Cp*Ru(μ-H)4OsCp*] (Cp* = η5-C5Me5), with Diphenylacetylene. Regioselective C−H Bond Activation at the Osmium Center","Organometallics","2007","26","25","6329","","10.1021/om700606q","","","0.71069","MoKα","","0.0789","0.0647","","","0.1331","0.1404","","","","","","1.068","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073763","11.604","0.002","16.869","0.003","15.809","0.003","90","","104.89","0.03","90","","2990.7","1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H42 Os Ru -","- C34 H42 Os Ru -","- C136 H168 Os4 Ru4 -","4","0.5","","Shima, Takanori; Ichikawa, Toshiaki; Suzuki, Hiroharu","Reaction of a Heterobimetallic Polyhydrido Cluster, [Cp*Ru(μ-H)4OsCp*] (Cp* = η5-C5Me5), with Diphenylacetylene. Regioselective C−H Bond Activation at the Osmium Center","Organometallics","2007","26","25","6329","","10.1021/om700606q","","","0.71069","MoKα","","0.0367","0.0324","","","0.0757","0.0772","","","","","","1.133","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073764","14.3301","0.0006","11.061","0.0003","19.2268","0.0005","90.338","0.001","97.714","0.002","95.387","0.001","3006.1","0.17","233","2","233","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H44 Os Ru -","- C35 H44 Os Ru -","- C140 H176 Os4 Ru4 -","4","2","","Shima, Takanori; Ichikawa, Toshiaki; Suzuki, Hiroharu","Reaction of a Heterobimetallic Polyhydrido Cluster, [Cp*Ru(μ-H)4OsCp*] (Cp* = η5-C5Me5), with Diphenylacetylene. Regioselective C−H Bond Activation at the Osmium Center","Organometallics","2007","26","25","6329","","10.1021/om700606q","","","0.71069","MoKα","","0.0519","0.0381","","","0.08","0.0839","","","","","","1.075","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073765","10.9901","0.0004","14.2683","0.0009","19.1063","0.0013","98.777","0.002","90.598","0.001","95.414","0.004","2946.8","0.3","253","2","253","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H42 Os2 -","- C34 H41 Os2 -","- C136 H164 Os8 -","4","2","","Shima, Takanori; Ichikawa, Toshiaki; Suzuki, Hiroharu","Reaction of a Heterobimetallic Polyhydrido Cluster, [Cp*Ru(μ-H)4OsCp*] (Cp* = η5-C5Me5), with Diphenylacetylene. Regioselective C−H Bond Activation at the Osmium Center","Organometallics","2007","26","25","6329","","10.1021/om700606q","","","0.71069","MoKα","","0.063","0.0453","","","0.1003","0.1042","","","","","","1.172","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073766","16.2756","0.0018","18.041","0.002","23.284","0.003","90","","90","","90","","6836.8","1.4","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C38 H38 N6 Ni O3 S -","- C38 H38 N6 Ni O3 S -","- C304 H304 N48 Ni8 O24 S8 -","8","1","","Liao, Chuang-Yi; Chan, Kai-Ting; Chang, Yu-Chuan; Chen, Chih-Yuan; Tu, Cheng-Yi; Hu, Ching-Han; Lee, Hon Man","Unexpected Solvent-Induced Cis/Trans Isomerization and Catalytic Application of a Bis-bidentate Nickel(II) Complex with N-Heterocyclic Carbene and Amido Functionalities","Organometallics","2007","26","24","5826","","10.1021/om700607m","","x-ray","0.71073","MoKα","","0.1138","0.0488","","","0.0998","0.1216","","","","","","1.008","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073767","9.904","0.006","23.413","0.013","9.309","0.006","90","","116.437","0.009","90","","1933","2","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H34 Cl6 N6 Ni O2 -","- C38 H34 Cl6 N6 Ni O2 -","- C76 H68 Cl12 N12 Ni2 O4 -","2","0.5","","Liao, Chuang-Yi; Chan, Kai-Ting; Chang, Yu-Chuan; Chen, Chih-Yuan; Tu, Cheng-Yi; Hu, Ching-Han; Lee, Hon Man","Unexpected Solvent-Induced Cis/Trans Isomerization and Catalytic Application of a Bis-bidentate Nickel(II) Complex with N-Heterocyclic Carbene and Amido Functionalities","Organometallics","2007","26","24","5826","","10.1021/om700607m","","x-ray","0.71073","MoKα","","0.1559","0.0625","","","0.1428","0.1691","","","","","","0.926","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073768","15.809","0.003","15.718","0.002","13.543","0.002","90","","101.777","0.003","90","","3294.4","0.9","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H34 F2 N6 Ni O4 -","- C36 H34 F2 N6 Ni O4 -","- C144 H136 F8 N24 Ni4 O16 -","4","0.5","","Liao, Chuang-Yi; Chan, Kai-Ting; Chang, Yu-Chuan; Chen, Chih-Yuan; Tu, Cheng-Yi; Hu, Ching-Han; Lee, Hon Man","Unexpected Solvent-Induced Cis/Trans Isomerization and Catalytic Application of a Bis-bidentate Nickel(II) Complex with N-Heterocyclic Carbene and Amido Functionalities","Organometallics","2007","26","24","5826","","10.1021/om700607m","","x-ray","0.71073","MoKα","","0.082","0.0545","","","0.1159","0.1285","","","","","","1.043","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073769","10.981","0.0005","11.8396","0.0006","12.7934","0.0006","85.275","0.003","86.123","0.003","89.313","0.003","1653.8","0.14","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H36 N6 Ni O4 -","- C38 H36 N6 Ni O4 -","- C76 H72 N12 Ni2 O8 -","2","1","","Liao, Chuang-Yi; Chan, Kai-Ting; Chang, Yu-Chuan; Chen, Chih-Yuan; Tu, Cheng-Yi; Hu, Ching-Han; Lee, Hon Man","Unexpected Solvent-Induced Cis/Trans Isomerization and Catalytic Application of a Bis-bidentate Nickel(II) Complex with N-Heterocyclic Carbene and Amido Functionalities","Organometallics","2007","26","24","5826","","10.1021/om700607m","","x-ray","0.71073","MoKα","","0.133","0.0552","","","0.1156","0.139","","","","","","0.946","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073770","17.657","0.004","14.385","0.003","17.884","0.004","90","","112.732","0.007","90","","4189.6","1.6","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H48 N10 Ni O6 -","- C44 H48 N10 Ni O6 -","- C176 H192 N40 Ni4 O24 -","4","1","","Liao, Chuang-Yi; Chan, Kai-Ting; Chang, Yu-Chuan; Chen, Chih-Yuan; Tu, Cheng-Yi; Hu, Ching-Han; Lee, Hon Man","Unexpected Solvent-Induced Cis/Trans Isomerization and Catalytic Application of a Bis-bidentate Nickel(II) Complex with N-Heterocyclic Carbene and Amido Functionalities","Organometallics","2007","26","24","5826","","10.1021/om700607m","","x-ray","0.71073","MoKα","","0.2427","0.0718","","","0.126","0.1658","","","","","","0.84","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073771","15.5098","0.0009","17.722","0.002","22.2233","0.0009","90","","99.838","0.004","90","","6018.6","0.8","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H45.5 Al2 N2.5 O -","- C28 H45.5 Al2 N2.5 O -","- C224 H364 Al16 N20 O8 -","8","2","","Gibson, Vernon C.; Redshaw, Carl; Solan, Gregory A.; White, Andrew J. P.; Williams, David J.","Aluminum Alkyl-Mediated Route to NovelN,N,O-Chelates for Five-Coordinate Iron(II) Chloride Complexes: Synthesis, Structures, and Ethylene Polymerization Studies","Organometallics","2007","26","20","5119","","10.1021/om700611q","","","1.54178","CuKα","","0.1296","0.0652","","0.1637","0.132","","","","1.035","1.133","1.133","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073772","12.481","0.002","12.229","0.002","18.486","0.003","90","","109.22","0.02","90","","2664.3","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H33 Cl2 Fe N3 O -","- C24 H33 Cl2 Fe N3 O -","- C96 H132 Cl8 Fe4 N12 O4 -","4","1","","Gibson, Vernon C.; Redshaw, Carl; Solan, Gregory A.; White, Andrew J. P.; Williams, David J.","Aluminum Alkyl-Mediated Route to NovelN,N,O-Chelates for Five-Coordinate Iron(II) Chloride Complexes: Synthesis, Structures, and Ethylene Polymerization Studies","Organometallics","2007","26","20","5119","","10.1021/om700611q","","","0.71073","MoKα","","0.1506","0.0698","","0.169","0.1278","","","","0.99","1.122","1.122","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073773","9.49","0.0019","17.456","0.004","23.418","0.005","90","","90.02","0.03","90","","3879.4","1.4","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H32 B Cl7.5 N6 S3 Ta -","- C29 H32 B Cl7.5 N6 S3 Ta -","- C116 H128 B4 Cl30 N24 S12 Ta4 -","4","1","","Hill, Anthony F.; Smith, Matthew K.","Organometallic Tantalum Tris(methimazolyl)borato Complexes: [Ta(η2-RC⋮CR)Cl2{HB(mt)3}] (R = Ph, Et; mt = methimazolyl)","Organometallics","2007","26","18","4688","","10.1021/om700615w","","","0.71073","MoKα","","0.0771","0.0547","","","0.1298","0.141","","","","","","1.105","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073774","9.909","0.002","17.594","0.004","18.391","0.004","90","","98.08","0.03","90","","3174.4","1.2","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H30 B Cl6 N6 S3 Ta -","- C20 H30 B Cl6 N6 S3 Ta -","- C80 H120 B4 Cl24 N24 S12 Ta4 -","4","1","","Hill, Anthony F.; Smith, Matthew K.","Organometallic Tantalum Tris(methimazolyl)borato Complexes: [Ta(η2-RC⋮CR)Cl2{HB(mt)3}] (R = Ph, Et; mt = methimazolyl)","Organometallics","2007","26","18","4688","","10.1021/om700615w","","","0.71073","MoKα","","0.0622","0.0363","","","0.0812","0.0926","","","","","","0.984","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073775","8.8091","0.0009","13.7282","0.0017","14.061","0.002","63.736","0.005","80.017","0.007","81.165","0.008","1496.1","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C32.5 H46 Ge N2 -","- C32.5 H46 Ge N2 -","- C65 H92 Ge2 N4 -","2","1","","Rupar, Paul A.; Jennings, Michael C.; Ragogna, Paul J.; Baines, Kim M.","Stabilization of a Transient Diorganogermylene by an N-Heterocyclic Carbene","Organometallics","2007","26","17","4109","","10.1021/om7006198","","x-ray","0.71073","MoKα","","0.0678","0.0509","","","0.1246","0.1347","","","","","","1.022","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073776","22.0634","0.0005","8.6076","0.0002","16.2745","0.0005","90","","93.096","0.001","90","","3086.23","0.14","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H48 B Ge N2 -","- C32 H48 B Ge N2 -","- C128 H192 B4 Ge4 N8 -","4","1","","Rupar, Paul A.; Jennings, Michael C.; Ragogna, Paul J.; Baines, Kim M.","Stabilization of a Transient Diorganogermylene by an N-Heterocyclic Carbene","Organometallics","2007","26","17","4109","","10.1021/om7006198","","x-ray","0.71073","MoKα","","0.0524","0.0365","","","0.087","0.0924","","","","","","1.078","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073777","11.2443","0.0008","11.9747","0.0009","13.7764","0.001","106.461","0.001","102.615","0.001","102.157","0.001","1660.8","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H49 N2 Rh -","- C38 H49 N2 Rh -","- C76 H98 N4 Rh2 -","2","1","","Sau, Yiu-Keung; Chan, Ka-Wang; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Alkyl and Aryl Compounds of Rhodium(III) and Iridium(III) Supported by 4,4‘-Di-tert-butyl-2,2‘-bipyridyl","Organometallics","2007","26","25","6338","","10.1021/om7006216","","","0.71073","MoKα","","0.0663","0.0452","","","0.0813","0.0865","","","","","","1.005","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073778","11.9859","0.0009","13.7168","0.001","13.8715","0.001","115.9","0.001","106.191","0.001","91.323","0.001","1942.2","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C45.5 H55 N2 Rh -","- C45.5 H35 N2 Rh -","- C91 H70 N4 Rh2 -","2","1","","Sau, Yiu-Keung; Chan, Ka-Wang; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Alkyl and Aryl Compounds of Rhodium(III) and Iridium(III) Supported by 4,4‘-Di-tert-butyl-2,2‘-bipyridyl","Organometallics","2007","26","25","6338","","10.1021/om7006216","","","0.71073","MoKα","","0.0495","0.041","","","0.0942","0.0975","","","","","","1.033","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073779","11.9687","0.0009","13.7906","0.001","13.8682","0.001","115.726","0.001","106.275","0.001","91.496","0.001","1950.4","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H54 Ir N2 -","- C45 H45 Ir N2 -","- C90 H90 Ir2 N4 -","2","1","","Sau, Yiu-Keung; Chan, Ka-Wang; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Alkyl and Aryl Compounds of Rhodium(III) and Iridium(III) Supported by 4,4‘-Di-tert-butyl-2,2‘-bipyridyl","Organometallics","2007","26","25","6338","","10.1021/om7006216","","","0.71073","MoKα","","0.0422","0.0359","","","0.0903","0.0927","","","","","","1.092","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073780","12.8551","0.0007","17.4188","0.001","22.928","0.0013","90","","103.181","0.001","90","","4998.8","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C58 H75 Ir N3 O -","- C58 H42 Ir N3 O -","- C232 H168 Ir4 N12 O4 -","4","1","","Sau, Yiu-Keung; Chan, Ka-Wang; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Alkyl and Aryl Compounds of Rhodium(III) and Iridium(III) Supported by 4,4‘-Di-tert-butyl-2,2‘-bipyridyl","Organometallics","2007","26","25","6338","","10.1021/om7006216","","","0.71073","MoKα","","0.067","0.0413","","","0.093","0.1008","","","","","","1.009","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073781","38.93","0.012","13.75","0.004","22.523","0.007","90","","92.302","0.007","90","","12047","6","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C53 H67 Ag3 F9 Ir N2 O11 S3 -","- C53 H59 Ag3 F9 Ir N2 O11 S3 -","- C424 H472 Ag24 F72 Ir8 N16 O88 S24 -","8","1","","Sau, Yiu-Keung; Chan, Ka-Wang; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Alkyl and Aryl Compounds of Rhodium(III) and Iridium(III) Supported by 4,4‘-Di-tert-butyl-2,2‘-bipyridyl","Organometallics","2007","26","25","6338","","10.1021/om7006216","","","0.71073","MoKα","","0.0902","0.0682","","","0.1132","0.1341","","","","","","0.942","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073782","9.7671","0.0008","11.6876","0.001","16.2933","0.0014","72.435","0.001","79.732","0.002","86.475","0.002","1744.8","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H36 Br0.6 Cl1.4 F6 Ir N3 -","- C35 H36 Br0.6 Cl1.4 F6 Ir N3 -","- C70 H72 Br1.2 Cl2.8 F12 Ir2 N6 -","2","1","","Sau, Yiu-Keung; Chan, Ka-Wang; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Alkyl and Aryl Compounds of Rhodium(III) and Iridium(III) Supported by 4,4‘-Di-tert-butyl-2,2‘-bipyridyl","Organometallics","2007","26","25","6338","","10.1021/om7006216","","","0.71073","MoKα","","0.0449","0.0323","","","0.0649","0.0675","","","","","","0.994","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073783","25.5","0.005","9.7417","0.0019","19.954","0.004","90","","115.42","0.03","90","","4476.9","1.9","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C178 H226 Fe8 O32 Sn8 -","- C178 H226 Fe8 O32 Sn8 -","- C178 H226 Fe8 O32 Sn8 -","1","0.125","","Chandrasekhar, Vadapalli; Thirumoorthi, Ramalingam","1,1‘-Ferrocenedicarboxylate-Bridged Redox-Active Organotin and -tellurium-Containing 16-Membered Macrocycles: Synthesis, Structure, and Electrochemistry","Organometallics","2007","26","22","5415","","10.1021/om700622r","","","0.71073","MoKα","","0.0773","0.0515","","","0.1171","0.129","","","","","","0.972","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073784","13.5963","0.0016","10.3361","0.0012","19.075","0.002","90","","105.662","0.002","90","","2581.1","0.5","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H48 Cl4 Fe2 O8 Sn2 -","- C54 H48 Cl4 Fe2 O8 Sn2 -","- C108 H96 Cl8 Fe4 O16 Sn4 -","2","0.5","","Chandrasekhar, Vadapalli; Thirumoorthi, Ramalingam","1,1‘-Ferrocenedicarboxylate-Bridged Redox-Active Organotin and -tellurium-Containing 16-Membered Macrocycles: Synthesis, Structure, and Electrochemistry","Organometallics","2007","26","22","5415","","10.1021/om700622r","","","0.71073","MoKα","","0.1016","0.0528","","","0.0941","0.1173","","","","","","1.008","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073785","15.241","0.0007","21.6111","0.0011","15.7105","0.0008","90","","103.56","0.001","90","","5030.4","0.4","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C53 H46 Cl2 Fe2 O12 Te2 -","- C53 H44 Cl2 Fe2 O12 Te2 -","- C212 H176 Cl8 Fe8 O48 Te8 -","4","1","","Chandrasekhar, Vadapalli; Thirumoorthi, Ramalingam","1,1‘-Ferrocenedicarboxylate-Bridged Redox-Active Organotin and -tellurium-Containing 16-Membered Macrocycles: Synthesis, Structure, and Electrochemistry","Organometallics","2007","26","22","5415","","10.1021/om700622r","","","0.71073","MoKα","","0.0452","0.0357","","","0.0772","0.0811","","","","","","1.034","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073786","14.079","0.003","12.862","0.003","23.706","0.005","90","","93.05","0.03","90","","4286.7","1.6","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C43 H30 Cl4 F6 Ir N6 O0 P -","- C43 H28 Cl4 F6 Ir N6 P -","- C172 H112 Cl16 F24 Ir4 N24 P4 -","4","1","","Zhao, Qiang; Liu, Shujuan; Shi, Mei; Li, Fuyou; Jing, Hao; Yi, Tao; Huang, Chunhui","Tuning Photophysical and Electrochemical Properties of Cationic Iridium(III) Complex Salts with Imidazolyl Substituents by Proton and Anions","Organometallics","2007","26","24","5922","","10.1021/om700623j","","","0.71073","MoKα","","0.0779","0.0396","","","0.0783","0.0901","","","","","","0.964","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073787","11.782","0.005","9.46","0.005","12.125","0.005","90","0.005","105.38","0.005","90","0.005","1303","1","293","2","293","2","","","","","","","synthesis as described","6","P 1 n 1","P -2yac","7","","","","- C26 H24 F6 Fe O2 P2 -","- C26 H24 F6 Fe O2 P2 -","- C52 H48 F12 Fe2 O4 P4 -","2","1","","Chaudhury, Subhabrata; Li, Shukun; Bennett, Dennis W.; Siddiquee, Tasneem; Haworth, Daniel T.; Donaldson, William A.","Preparation, Characterization, and Reactivity of (3-Methylpentadienyl)iron(1+) Cations","Organometallics","2007","26","22","5295","","10.1021/om7006248","","x-ray","0.71069","MoKα","","0.0792","0.0726","","","0.1844","0.1926","","","","","","1.05","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073788","10.279","0.005","12.861","0.005","21.041","0.005","90","0.005","90","0.005","90","0.005","2781.6","1.9","293","2","293","2","","","","","","","synthesis as described","6","P 21 21 21","P 2ac 2ab","19","","","","- C27 H24 F6 Fe O3 P2 -","- C27 H24 F6 Fe O3 P2 -","- C108 H96 F24 Fe4 O12 P8 -","4","1","","Chaudhury, Subhabrata; Li, Shukun; Bennett, Dennis W.; Siddiquee, Tasneem; Haworth, Daniel T.; Donaldson, William A.","Preparation, Characterization, and Reactivity of (3-Methylpentadienyl)iron(1+) Cations","Organometallics","2007","26","22","5295","","10.1021/om7006248","","x-ray","0.71069","MoKα","","0.0753","0.0563","","","0.1307","0.1424","","","","","","1.058","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073789","11.5977","0.0004","20.7073","0.0008","20.6254","0.0007","90","","101.527","0.002","90","","4853.4","0.3","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[(Ph2C-NPh)2-]Yb(2+)(HMPA)3","","","- C37 H69 Ca N10 O3 P3 -","- C37 H69 Ca N10 O3 P3 -","- C148 H276 Ca4 N40 O12 P12 -","4","1","","Buch, Frank; Harder, Sjoerd","The Azametallacyclopropane Ca(η2-Ph2CNPh)(hmpa)3: A Calcium Alternative to a Versatile Ytterbium(II) Catalyst","Organometallics","2007","26","21","5132","","10.1021/om700626s","","","0.71073","MoKα","","0.0414","0.0354","","","0.098","0.1021","","","","","","1.05","","","","has coordinates,has disorder","178626","2020-10-21","18:00:00",""
"4073790","18.0573","0.0014","10.1691","0.0008","19.585","0.0015","90","","98.765","0.002","90","","3554.3","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H37 Cl O3 P2 Ru -","- C42 H37 Cl O3 P2 Ru -","- C168 H148 Cl4 O12 P8 Ru4 -","4","1","","Bai, Tao; Zhu, Jun; Xue, Peng; Sung, Herman Ho-Yung; Williams, Ian Duncan; Ma, Shengming; Lin, Zhenyang; Jia, Guochen","Ligand Effect on the Insertion Reactions of Allenes with MHCl(CO)(PPh3)3and MHCl(PPh3)3(M = Ru, Os)","Organometallics","2007","26","23","5581","","10.1021/om700629x","","","0.71073","MoKα","","0.0853","0.0448","","","0.0777","0.0939","","","","","","1.009","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073791","15.3034","0.0009","10.0384","0.0006","24.8593","0.0014","90","","106.271","0.001","90","","3666","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H39 Cl O Os P2 -","- C46 H39 Cl O Os P2 -","- C184 H156 Cl4 O4 Os4 P8 -","4","1","","Bai, Tao; Zhu, Jun; Xue, Peng; Sung, Herman Ho-Yung; Williams, Ian Duncan; Ma, Shengming; Lin, Zhenyang; Jia, Guochen","Ligand Effect on the Insertion Reactions of Allenes with MHCl(CO)(PPh3)3and MHCl(PPh3)3(M = Ru, Os)","Organometallics","2007","26","23","5581","","10.1021/om700629x","","","0.71073","MoKα","","0.0261","0.0194","","","0.0409","0.0423","","","","","","0.987","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073792","8.9058","0.0006","15.2241","0.0011","17.3077","0.0012","79.338","0.001","88.105","0.001","89.178","0.001","2304.8","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H48 F6 N4 O8 S3 -","- C36 H32 F6 N4 O6 S2 -","- C72 H64 F12 N8 O12 S4 -","2","1","","Jeletic, Matthew S.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.","Mono- and Bimetallic Rhodium(I) Complexes Supported by NewC2-Symmetric Bis-N-heterocyclic Carbene Ligands: Metalation via CC Bond Cleavage under Mild Conditions","Organometallics","2007","26","22","5267","","10.1021/om700630u","","","0.71073","MoKα","","0.0772","0.0525","","","0.1326","0.1406","","","","","","0.893","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073793","8.5559","0.0005","37.035","0.002","8.0501","0.0005","90","","90","","90","","2550.8","0.3","173","2","173","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C34 H30 N4 -","- C34 H30 N4 -","- C136 H120 N16 -","4","1","","Jeletic, Matthew S.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.","Mono- and Bimetallic Rhodium(I) Complexes Supported by NewC2-Symmetric Bis-N-heterocyclic Carbene Ligands: Metalation via CC Bond Cleavage under Mild Conditions","Organometallics","2007","26","22","5267","","10.1021/om700630u","","","0.71073","MoKα","","0.0599","0.0417","","","0.0877","0.0984","","","","","","0.994","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073794","8.3292","0.0006","35.314","0.003","8.6567","0.0006","90","","93.567","0.002","90","","2541.3","0.3","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C34 H30 N4 -","- C34 H30 N4 -","- C136 H120 N16 -","4","1","","Jeletic, Matthew S.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.","Mono- and Bimetallic Rhodium(I) Complexes Supported by NewC2-Symmetric Bis-N-heterocyclic Carbene Ligands: Metalation via CC Bond Cleavage under Mild Conditions","Organometallics","2007","26","22","5267","","10.1021/om700630u","","","0.71073","MoKα","","0.0844","0.0541","","","0.1224","0.1381","","","","","","1.038","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073795","19.3658","0.0011","15.2156","0.0009","11.4987","0.0006","90","","100.263","0.001","90","","3334","0.3","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C42 H46 N4 O -","- C42 H46 N4 O -","- C168 H184 N16 O4 -","4","0.5","","Jeletic, Matthew S.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.","Mono- and Bimetallic Rhodium(I) Complexes Supported by NewC2-Symmetric Bis-N-heterocyclic Carbene Ligands: Metalation via CC Bond Cleavage under Mild Conditions","Organometallics","2007","26","22","5267","","10.1021/om700630u","","","0.71073","MoKα","","0.0663","0.05","","","0.1286","0.1393","","","","","","1.048","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073796","11.5228","0.0002","18.4367","0.0016","17.3807","0.0015","90","","101.95","0.02","90","","3612.4","0.5","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C42 H38 F3 N4 O3 Rh S -","- C42 H38 F3 N4 O3 Rh S -","- C168 H152 F12 N16 O12 Rh4 S4 -","4","1","","Jeletic, Matthew S.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.","Mono- and Bimetallic Rhodium(I) Complexes Supported by NewC2-Symmetric Bis-N-heterocyclic Carbene Ligands: Metalation via CC Bond Cleavage under Mild Conditions","Organometallics","2007","26","22","5267","","10.1021/om700630u","","","0.71073","MoKα","","0.0984","0.0513","","","0.1111","0.1338","","","","","","1.017","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073797","11.9962","0.0003","11.9962","0.0003","28.3024","0.0016","90","","90","","120","","3527.3","0.2","173","2","173","2","","","","","","","","6","P 32 2 1","P 32 2""","154","","","","- C54 H64 Cl2 N4 O Rh2 -","- C50 H54 Cl2 N4 Rh2 -","- C150 H162 Cl6 N12 Rh6 -","3","0.5","","Jeletic, Matthew S.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.","Mono- and Bimetallic Rhodium(I) Complexes Supported by NewC2-Symmetric Bis-N-heterocyclic Carbene Ligands: Metalation via CC Bond Cleavage under Mild Conditions","Organometallics","2007","26","22","5267","","10.1021/om700630u","","","0.71073","MoKα","","0.0985","0.053","","","0.1014","0.1127","","","","","","1.007","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073798","13.5851","0.0016","16.976","0.002","22.353","0.003","90","","90","","90","","5155.1","1.1","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C60 H68 Cl2 N4 Rh2 -","- C60 H68 Cl2 N4 Rh2 -","- C240 H272 Cl8 N16 Rh8 -","4","1","","Jeletic, Matthew S.; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S.","Mono- and Bimetallic Rhodium(I) Complexes Supported by NewC2-Symmetric Bis-N-heterocyclic Carbene Ligands: Metalation via CC Bond Cleavage under Mild Conditions","Organometallics","2007","26","22","5267","","10.1021/om700630u","","","0.71073","MoKα","","0.0573","0.0454","","","0.0744","0.0776","","","","","","1.032","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073799","10.128","0.005","10.219","0.005","14.175","0.008","84.4","0.02","72.77","0.02","77.58","0.02","1367.6","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H37 Mo2 O4 P -","- C28 H37 Mo2 O4 P -","- C56 H74 Mo4 O8 P2 -","2","1","","Alvarez, M. Angeles; García, M. Esther; Ramos, Alberto; Ruiz, Miguel A.; Lanfranchi, Maurizio; Tiripicchio, Antonio","Alkenyl Derivatives of the Unsaturated Dimolybdenum Hydride Complex [Mo2(η5-C5H5)2(μ-H)(μ-PCy2)(CO)2]","Organometallics","2007","26","23","5454","","10.1021/om700634x","","","0.71073","MoKα","","0.1118","0.0651","","","0.1647","0.1875","","","","","","0.958","","","","has coordinates","178626","2020-10-21","18:00:00",""
"4073800","10.021","0.002","14.848","0.003","19.166","0.004","90","","94.815","0.004","90","","2841.7","1","100","0.1","100","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H39 Mo2 O6 P -","- C30 H39 Mo2 O6 P -","- C120 H156 Mo8 O24 P4 -","4","1","","Alvarez, M. Angeles; García, M. Esther; Ramos, Alberto; Ruiz, Miguel A.; Lanfranchi, Maurizio; Tiripicchio, Antonio","Alkenyl Derivatives of the Unsaturated Dimolybdenum Hydride Complex [Mo2(η5-C5H5)2(μ-H)(μ-PCy2)(CO)2]","Organometallics","2007","26","23","5454","","10.1021/om700634x","","x-ray","0.71073","MoKα","","0.1181","0.0729","","","0.1773","0.2008","","","","","","0.939","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073801","11.1386","0.0002","14.9749","0.0003","19.9107","0.0005","90","","117.795","0.001","90","","2937.91","0.11","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H39 Mo2 O6 P -","- C30 H39 Mo2 O6 P -","- C120 H156 Mo8 O24 P4 -","4","1","","Alvarez, M. Angeles; García, M. Esther; Ramos, Alberto; Ruiz, Miguel A.; Lanfranchi, Maurizio; Tiripicchio, Antonio","Alkenyl Derivatives of the Unsaturated Dimolybdenum Hydride Complex [Mo2(η5-C5H5)2(μ-H)(μ-PCy2)(CO)2]","Organometallics","2007","26","23","5454","","10.1021/om700634x","","x-ray","0.71073","MoKα","","0.0795","0.0527","","","0.1451","0.1843","","","","","","1.164","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073802","9.7517","0.0004","16.2182","0.0006","18.3839","0.0006","90","","91.547","0.002","90","","2906.45","0.19","100","0.1","100","0.1","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H39 Mo2 O6 P -","- C30 H39 Mo2 O6 P -","- C120 H156 Mo8 O24 P4 -","4","1","","Alvarez, M. Angeles; García, M. Esther; Ramos, Alberto; Ruiz, Miguel A.; Lanfranchi, Maurizio; Tiripicchio, Antonio","Alkenyl Derivatives of the Unsaturated Dimolybdenum Hydride Complex [Mo2(η5-C5H5)2(μ-H)(μ-PCy2)(CO)2]","Organometallics","2007","26","23","5454","","10.1021/om700634x","","x-ray","0.71073","MoKα","","0.0598","0.036","","","0.0678","0.0728","","","","","","1.042","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073803","8.827","0.0016","31.354","0.006","23.659","0.004","90","","95.603","0.004","90","","6517","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H53 Cl2 N Os P2 -","- C31 H53 Cl2 N Os P2 -","- C248 H424 Cl16 N8 Os8 P16 -","8","2","","Esteruelas, Miguel A.; Fernández-Alvarez, Francisco J.; Oñate, Enrique","Osmium and Ruthenium Complexes Containing an N-Heterocyclic Carbene Ligand Derived from Benzo[h]quinoline","Organometallics","2007","26","21","5239","","10.1021/om700639a","","","0.71073","MoKα","","0.1085","0.0736","","","0.1243","0.1355","","","","","","1.119","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073804","10.2474","0.0007","10.5561","0.0007","15.5706","0.0011","93.026","0.001","101.436","0.001","107.925","0.001","1559","0.19","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H52 Cl N Os P2 -","- C31 H52 Cl N Os P2 -","- C62 H104 Cl2 N2 Os2 P4 -","2","1","","Esteruelas, Miguel A.; Fernández-Alvarez, Francisco J.; Oñate, Enrique","Osmium and Ruthenium Complexes Containing an N-Heterocyclic Carbene Ligand Derived from Benzo[h]quinoline","Organometallics","2007","26","21","5239","","10.1021/om700639a","","","0.71073","MoKα","","0.0577","0.0456","","","0.085","0.0888","","","","","","1.053","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073805","10.288","0.003","10.544","0.003","15.572","0.004","93.132","0.005","100.966","0.005","107.901","0.005","1566.5","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H52 Cl N P2 Ru -","- C31 H52 Cl N P2 Ru -","- C62 H104 Cl2 N2 P4 Ru2 -","2","1","","Esteruelas, Miguel A.; Fernández-Alvarez, Francisco J.; Oñate, Enrique","Osmium and Ruthenium Complexes Containing an N-Heterocyclic Carbene Ligand Derived from Benzo[h]quinoline","Organometallics","2007","26","21","5239","","10.1021/om700639a","","","0.71073","MoKα","","0.0561","0.0422","","","0.0912","0.1027","","","","","","1.019","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073806","13.2021","0.0003","20.3922","0.0005","28.6081","0.0007","90","","104.565","0.001","90","","7454.4","0.3","203","2","203","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[(TMS-N=P(Ph)2)CH]2Ba","","","- C62 H78 Ba N4 P4 Si4 -","- C62 H78 Ba N4 P4 Si4 -","- C248 H312 Ba4 N16 P16 Si16 -","4","0.5","","Orzechowski, Lars; Harder, Sjoerd","Syntheses, Structures, and Reactivity of Barium Carbene Complexes with Chelating Bis-iminophosphorano Arms","Organometallics","2007","26","23","5501","","10.1021/om700640c","","","0.71073","MoKα","","0.0635","0.044","","","0.107","0.1134","","","","","","1.068","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073807","12.2767","0.0003","13.7861","0.0003","13.844","0.0003","79.957","0.001","64.154","0.001","78.575","0.001","2056.59","0.08","203","2","203","2","","","","","","","","7","P -1","-P 1","2","[C(Ph2P=NTMS)2Ba.THF]2","","","- C35 H46 Ba N2 O P2 Si2 -","- C35 H46 Ba N2 O P2 Si2 -","- C70 H92 Ba2 N4 O2 P4 Si4 -","2","1","","Orzechowski, Lars; Harder, Sjoerd","Syntheses, Structures, and Reactivity of Barium Carbene Complexes with Chelating Bis-iminophosphorano Arms","Organometallics","2007","26","23","5501","","10.1021/om700640c","","","0.71073","MoKα","","0.0336","0.029","","","0.089","0.0918","","","","","","1.095","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073808","15.2106","0.0008","17.7038","0.0009","24.3033","0.0012","89.555","0.003","79.116","0.003","64.692","0.003","5790.3","0.5","203","2","203","2","","","","","","","","6","P -1","-P 1","2","{Ba[CyNC(O)C(Ph2P=N-DIPP)2]}2.THF","","","- C134 H156 Ba2 N6 O3 P4 -","- C134 H156 Ba2 N6 O3 P4 -","- C268 H312 Ba4 N12 O6 P8 -","2","1","","Orzechowski, Lars; Harder, Sjoerd","Syntheses, Structures, and Reactivity of Barium Carbene Complexes with Chelating Bis-iminophosphorano Arms","Organometallics","2007","26","23","5501","","10.1021/om700640c","","","0.71073","MoKα","","0.0553","0.0365","","","0.0913","0.1054","","","","","","1.055","","","","has coordinates","176810","2020-10-21","18:00:00",""
"4073809","5.8276","0.0006","7.3421","0.0008","14.8654","0.0015","95.448","0.002","94.829","0.002","92.512","0.002","630.06","0.11","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H11 F3 O -","- C16 H11 F3 O -","- C32 H22 F6 O2 -","2","1","","Moulton, Benjamin E.; Duhme-Klair, Anne K.; Fairlamb, Ian J. S.; Lynam, Jason M.; Whitwood, Adrian C.","A Rationale for the Linear Correlation of Aryl Substituent Effects in Iron(0) Tricarbonyl Complexes Containing α,β-Unsaturated Enone (Chalcone) Ligands","Organometallics","2007","26","25","6354","","10.1021/om7006425","","","0.71073","MoKα","","0.0495","0.0451","","","0.1225","0.1262","","","","","","1.019","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073810","13.5188","0.0008","7.8075","0.0005","14.9709","0.0009","90","","109.797","0.001","90","","1486.76","0.16","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 O4 -","- C18 H18 O4 -","- C72 H72 O16 -","4","1","","Moulton, Benjamin E.; Duhme-Klair, Anne K.; Fairlamb, Ian J. S.; Lynam, Jason M.; Whitwood, Adrian C.","A Rationale for the Linear Correlation of Aryl Substituent Effects in Iron(0) Tricarbonyl Complexes Containing α,β-Unsaturated Enone (Chalcone) Ligands","Organometallics","2007","26","25","6354","","10.1021/om7006425","","","0.71073","MoKα","","0.0508","0.0439","","","0.1145","0.1195","","","","","","1.026","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073811","26.628","0.004","11.321","0.0016","20.637","0.003","90","","90","","90","","6221.1","1.6","100","2","100","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C18 H12 Fe O4 -","- C18 H12 Fe O4 -","- C288 H192 Fe16 O64 -","16","4","","Moulton, Benjamin E.; Duhme-Klair, Anne K.; Fairlamb, Ian J. S.; Lynam, Jason M.; Whitwood, Adrian C.","A Rationale for the Linear Correlation of Aryl Substituent Effects in Iron(0) Tricarbonyl Complexes Containing α,β-Unsaturated Enone (Chalcone) Ligands","Organometallics","2007","26","25","6354","","10.1021/om7006425","","","0.71073","MoKα","","0.0351","0.0307","","","0.072","0.0741","","","","","","1.036","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073812","10.8542","0.0018","16.111","0.003","10.4171","0.0017","90","","111.817","0.003","90","","1691.2","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H11 F3 Fe O4 -","- C19 H11 F3 Fe O4 -","- C76 H44 F12 Fe4 O16 -","4","1","","Moulton, Benjamin E.; Duhme-Klair, Anne K.; Fairlamb, Ian J. S.; Lynam, Jason M.; Whitwood, Adrian C.","A Rationale for the Linear Correlation of Aryl Substituent Effects in Iron(0) Tricarbonyl Complexes Containing α,β-Unsaturated Enone (Chalcone) Ligands","Organometallics","2007","26","25","6354","","10.1021/om7006425","","","0.71073","MoKα","","0.0695","0.0473","","","0.1179","0.1296","","","","","","1.048","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073813","8.0365","0.0009","9.4564","0.0011","12.237","0.0014","110.728","0.002","92.247","0.002","100.016","0.002","851.37","0.17","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H11 F3 Fe O4 -","- C19 H11 F3 Fe O4 -","- C38 H22 F6 Fe2 O8 -","2","1","","Moulton, Benjamin E.; Duhme-Klair, Anne K.; Fairlamb, Ian J. S.; Lynam, Jason M.; Whitwood, Adrian C.","A Rationale for the Linear Correlation of Aryl Substituent Effects in Iron(0) Tricarbonyl Complexes Containing α,β-Unsaturated Enone (Chalcone) Ligands","Organometallics","2007","26","25","6354","","10.1021/om7006425","","","0.71073","MoKα","","0.0476","0.0336","","","0.0775","0.0833","","","","","","1.028","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073814","11.428","0.002","16.292","0.003","9.2583","0.0017","90","","103.249","0.004","90","","1677.9","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H11 F3 Fe O4 -","- C19 H11 F3 Fe O4 -","- C76 H44 F12 Fe4 O16 -","4","1","","Moulton, Benjamin E.; Duhme-Klair, Anne K.; Fairlamb, Ian J. S.; Lynam, Jason M.; Whitwood, Adrian C.","A Rationale for the Linear Correlation of Aryl Substituent Effects in Iron(0) Tricarbonyl Complexes Containing α,β-Unsaturated Enone (Chalcone) Ligands","Organometallics","2007","26","25","6354","","10.1021/om7006425","","","0.71073","MoKα","","0.0346","0.0296","","","0.0746","0.0773","","","","","","1.02","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073815","12.0533","0.0013","22.984","0.003","11.395","0.0012","90","","90","","90","","3156.8","0.6","100","2","100","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C18 H11 F Fe O4 -","- C18 H11 F Fe O4 -","- C144 H88 F8 Fe8 O32 -","8","1","","Moulton, Benjamin E.; Duhme-Klair, Anne K.; Fairlamb, Ian J. S.; Lynam, Jason M.; Whitwood, Adrian C.","A Rationale for the Linear Correlation of Aryl Substituent Effects in Iron(0) Tricarbonyl Complexes Containing α,β-Unsaturated Enone (Chalcone) Ligands","Organometallics","2007","26","25","6354","","10.1021/om7006425","","","0.71073","MoKα","","0.0638","0.0417","","","0.0963","0.1063","","","","","","1.029","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073816","11.2496","0.0011","15.2045","0.0016","9.4967","0.001","90","","102.491","0.002","90","","1585.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H11 Cl Fe O4 -","- C18 H11 Cl Fe O4 -","- C72 H44 Cl4 Fe4 O16 -","4","1","","Moulton, Benjamin E.; Duhme-Klair, Anne K.; Fairlamb, Ian J. S.; Lynam, Jason M.; Whitwood, Adrian C.","A Rationale for the Linear Correlation of Aryl Substituent Effects in Iron(0) Tricarbonyl Complexes Containing α,β-Unsaturated Enone (Chalcone) Ligands","Organometallics","2007","26","25","6354","","10.1021/om7006425","","","0.71073","MoKα","","0.056","0.0407","","","0.0832","0.0882","","","","","","1.04","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073817","23.18","0.002","7.4095","0.0008","26.823","0.003","90","","113.899","0.0016","90","","4211.9","0.8","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H32 Ir O P -","- C23 H32 Ir O P -","- C184 H256 Ir8 O8 P8 -","8","2","","Hesp, Kevin D.; Wechsler, Dominik; Cipot, Judy; Myers, Anne; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","Exploring the Utility of Neutral Rhodium and Iridium κ2-P,Oand κ2-P(S),OComplexes as Catalysts for Alkene Hydrogenation and Hydrosilylation","Organometallics","2007","26","22","5430","","10.1021/om7006437","","","0.71073","MoKα","","0.0437","0.0345","","","0.0705","0.0744","","","","","","1.06","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073818","11.5449","0.0008","16.3575","0.0012","12.4929","0.0009","90","","111.797","0.001","90","","2190.6","0.3","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H32 O P Rh S -","- C23 H32 O P Rh S -","- C92 H128 O4 P4 Rh4 S4 -","4","1","","Hesp, Kevin D.; Wechsler, Dominik; Cipot, Judy; Myers, Anne; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","Exploring the Utility of Neutral Rhodium and Iridium κ2-P,Oand κ2-P(S),OComplexes as Catalysts for Alkene Hydrogenation and Hydrosilylation","Organometallics","2007","26","22","5430","","10.1021/om7006437","","","0.71073","MoKα","","0.0648","0.0375","","","0.0716","0.0796","","","","","","0.992","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073819","9.594","0.0002","13.766","0.0003","15.038","0.0003","90","","103.803","0.0013","90","","1928.73","0.07","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H30 Ir O P -","- C20 H30 Ir O P -","- C80 H120 Ir4 O4 P4 -","4","1","","Hesp, Kevin D.; Wechsler, Dominik; Cipot, Judy; Myers, Anne; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","Exploring the Utility of Neutral Rhodium and Iridium κ2-P,Oand κ2-P(S),OComplexes as Catalysts for Alkene Hydrogenation and Hydrosilylation","Organometallics","2007","26","22","5430","","10.1021/om7006437","","","0.71073","MoKα","","0.0448","0.0339","","","0.0805","0.0871","","","","","","1.052","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073820","11.2382","0.001","16.8261","0.0015","12.6211","0.0011","90","","112.26","0.0013","90","","2208.7","0.3","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H32 Ir O P S -","- C23 H32 Ir O P S -","- C92 H128 Ir4 O4 P4 S4 -","4","1","","Hesp, Kevin D.; Wechsler, Dominik; Cipot, Judy; Myers, Anne; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","Exploring the Utility of Neutral Rhodium and Iridium κ2-P,Oand κ2-P(S),OComplexes as Catalysts for Alkene Hydrogenation and Hydrosilylation","Organometallics","2007","26","22","5430","","10.1021/om7006437","","","0.71073","MoKα","","0.0331","0.0243","","","0.0531","0.0564","","","","","","1.038","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073821","37.2956","0.001","9.9079","0.0003","24.8352","0.0005","90","","90.938","0.002","90","","9175.9","0.4","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H44 Cl8 N2 P2 Ru -","- C45.589 H43.178 Cl7.178 N2 P2 Ru -","- C364.712 H345.424 Cl57.424 N16 P16 Ru8 -","8","1","","Del Zotto, Alessandro; Baratta, Walter; Ballico, Maurizio; Herdtweck, Eberhardt; Rigo, Pierluigi","[RuCl2(PPh3)(PNN‘)] Complexes as Efficient Catalysts in Transfer Hydrogenation of Ketones","Organometallics","2007","26","23","5636","","10.1021/om700647k","","","0.71073","MoKα","","0.081","0.0686","","","0.1654","0.1693","","","","","","1.192","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073822","14.7843","0.0003","12.3934","0.0003","14.952","0.0003","90","","98.7963","0.0013","90","","2707.4","0.1","150","1","150","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C23 H48 Cl N Os P2 -","- C23 H48 Cl N Os P2 -","- C92 H192 Cl4 N4 Os4 P8 -","4","2","","Kuznetsov, Vladimir F.; Gusev, Dmitry G.","Chiral Hydride and Dihydrogen Pincer-Type Complexes of Osmium","Organometallics","2007","26","23","5661","","10.1021/om700651g","","","0.71073","MoKα","","0.0554","0.0406","","","0.0835","0.0909","","","","","","1.03","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073823","13.0287","0.0011","22.895","0.002","9.3671","0.0008","90","","90","","90","","2794.1","0.4","223","2","223","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C23 H48 Cl N Os P2 -","- C23 H48 Cl N Os P2 -","- C92 H192 Cl4 N4 Os4 P8 -","4","1","","Kuznetsov, Vladimir F.; Gusev, Dmitry G.","Chiral Hydride and Dihydrogen Pincer-Type Complexes of Osmium","Organometallics","2007","26","23","5661","","10.1021/om700651g","","","0.71073","MoKα","","0.0335","0.0264","","","0.0481","0.0504","","","","","","1.126","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073824","23.967","0.01","8.126","0.004","15.972","0.006","90","","107.487","0.018","90","","2967","2","243.1","","","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C30 H39 Cl2 N O Ti -","- C30 H39 Cl2 N O Ti -","- C120 H156 Cl8 N4 O4 Ti4 -","4","1","","Zhang, Hao; Katao, Shohei; Nomura, Kotohiro; Huang, Jiling","Synthesis of Half-Titanocenes Containing Phenoxy-imine Ligands and Their Use as Catalysts for Olefin Polymerization","Organometallics","2007","26","24","5967","","10.1021/om700660b","","","0.71075","MoKα","","","0.0335","","","","0.0873","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073825","18.083","0.003","15.268","0.003","23.643","0.005","90","","90","","90","","6528","2","243.1","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C33 H45 Cl2 N O Ti -","- C33 H45 Cl2 N O Ti -","- C264 H360 Cl16 N8 O8 Ti8 -","8","1","","Zhang, Hao; Katao, Shohei; Nomura, Kotohiro; Huang, Jiling","Synthesis of Half-Titanocenes Containing Phenoxy-imine Ligands and Their Use as Catalysts for Olefin Polymerization","Organometallics","2007","26","24","5967","","10.1021/om700660b","","","0.71075","MoKα","","","0.037","","","","0.0976","","","","","","1.007","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073826","7.405","0.003","9.169","0.005","17.929","0.01","80.16","0.02","82.88","0.02","72.895","0.019","1142.8","1","243.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H31 Cl2 N O Ti -","- C22 H31 Cl2 N O Ti -","- C44 H62 Cl4 N2 O2 Ti2 -","2","1","","Zhang, Hao; Katao, Shohei; Nomura, Kotohiro; Huang, Jiling","Synthesis of Half-Titanocenes Containing Phenoxy-imine Ligands and Their Use as Catalysts for Olefin Polymerization","Organometallics","2007","26","24","5967","","10.1021/om700660b","","","0.71075","MoKα","","","0.0541","","","","0.1142","","","","","","1.003","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073827","14.914","0.005","15.886","0.005","24.206","0.01","90","","104.932","0.012","90","","5541","3","243.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H35 Cl2 N O Ti -","- C28 H35 Cl2 N O Ti -","- C224 H280 Cl16 N8 O8 Ti8 -","8","2","","Zhang, Hao; Katao, Shohei; Nomura, Kotohiro; Huang, Jiling","Synthesis of Half-Titanocenes Containing Phenoxy-imine Ligands and Their Use as Catalysts for Olefin Polymerization","Organometallics","2007","26","24","5967","","10.1021/om700660b","","","0.71075","MoKα","","","0.0669","","","","0.131","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073828","13.129","0.004","14.93","0.003","24.791","0.006","90","","90","","90","","4859","2","243.1","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C25 H29 Cl2 N O Ti -","- C25 H29 Cl2 N O Ti -","- C200 H232 Cl16 N8 O8 Ti8 -","8","1","","Zhang, Hao; Katao, Shohei; Nomura, Kotohiro; Huang, Jiling","Synthesis of Half-Titanocenes Containing Phenoxy-imine Ligands and Their Use as Catalysts for Olefin Polymerization","Organometallics","2007","26","24","5967","","10.1021/om700660b","","","0.71075","MoKα","","","0.0443","","","","0.0973","","","","","","1.013","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073829","13.556","0.006","7.224","0.003","18.814","0.007","90","","102.982","0.018","90","","1795.3","1.3","243.1","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C17 H21 Cl2 N O Ti -","- C17 H21 Cl2 N O Ti -","- C68 H84 Cl8 N4 O4 Ti4 -","4","1","","Zhang, Hao; Katao, Shohei; Nomura, Kotohiro; Huang, Jiling","Synthesis of Half-Titanocenes Containing Phenoxy-imine Ligands and Their Use as Catalysts for Olefin Polymerization","Organometallics","2007","26","24","5967","","10.1021/om700660b","","","0.71075","MoKα","","","0.0259","","","","0.0798","","","","","","0.999","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073830","24.043","0.003","8.1281","0.0008","16.5418","0.0017","90","","108.631","0.003","90","","3063.3","0.6","243.1","","","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C32 H45 N O Ti -","- C32 H45 N O Ti -","- C128 H180 N4 O4 Ti4 -","4","1","","Zhang, Hao; Katao, Shohei; Nomura, Kotohiro; Huang, Jiling","Synthesis of Half-Titanocenes Containing Phenoxy-imine Ligands and Their Use as Catalysts for Olefin Polymerization","Organometallics","2007","26","24","5967","","10.1021/om700660b","","","0.71075","MoKα","","","0.0364","","","","0.0828","","","","","","0.999","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073831","9.6109","0.0012","11.0995","0.0014","11.2859","0.0014","99.188","0.002","113.528","0.002","105.054","0.002","1017.7","0.2","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H20 F6 O6 -","- C19 H20 F6 O6 -","- C38 H40 F12 O12 -","2","1","","Doherty, Simon; Knight, Julian G.; Smyth, Catherine H.; Harrington, Ross W.; Clegg, William","Metal-Dependent Reactivity of Electrophilic Platinum Group Metal Lewis Acid Catalysts: Competitive Alkene Dimerization, Intramolecular Friedel−Crafts Alkylation, and Carbonyl-Ene Reactivity","Organometallics","2007","26","24","5961","","10.1021/om7006612","","","0.71073","MoKα","","0.0652","0.048","","","0.1259","0.1571","","","","","","1.138","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073832","11.715","0.003","11.8054","0.0015","16.619","0.004","90","","108.851","0.018","90","","2175.1","0.8","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 Cl F6 O6 -","- C19 H19 Cl F6 O6 -","- C76 H76 Cl4 F24 O24 -","4","1","","Doherty, Simon; Knight, Julian G.; Smyth, Catherine H.; Harrington, Ross W.; Clegg, William","Metal-Dependent Reactivity of Electrophilic Platinum Group Metal Lewis Acid Catalysts: Competitive Alkene Dimerization, Intramolecular Friedel−Crafts Alkylation, and Carbonyl-Ene Reactivity","Organometallics","2007","26","24","5961","","10.1021/om7006612","","","0.71073","MoKα","","0.0682","0.0498","","","0.1255","0.1462","","","","","","1.125","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073833","13.728","0.003","7.05","0.002","13.559","0.003","90","","90","","90","","1312.3","0.6","298","2","298","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C13 H8 Cu2 N2 O5 -","- C13 H8 Cu2 N2 O5 -","- C52 H32 Cu8 N8 O20 -","4","0.5","","Liang, Fu-Pei; Qin, Su-Ni; Jiang, Chun-Fang; Zhang, Zhong; Chen, Zi-Lu","Organic-Ligand-Supported Two-Dimensional Carbonyl-Bridged Copper(I) Polymers","Organometallics","2007","26","19","4839","","10.1021/om700662h","","","0.71073","MoKα","","0.061","0.0328","","","0.0746","0.09","","","","","","0.999","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073834","13.668","0.014","8.401","0.009","12.406","0.013","90","","96.961","0.013","90","","1414","3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H8 Cu2 N2 O5 -","- C13 H8 Cu2 N2 O5 -","- C52 H32 Cu8 N8 O20 -","4","0.5","","Liang, Fu-Pei; Qin, Su-Ni; Jiang, Chun-Fang; Zhang, Zhong; Chen, Zi-Lu","Organic-Ligand-Supported Two-Dimensional Carbonyl-Bridged Copper(I) Polymers","Organometallics","2007","26","19","4839","","10.1021/om700662h","","","0.71073","MoKα","","0.0665","0.0381","","","0.0859","0.1011","","","","","","1.04","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073835","12.428","0.001","17.843","0.001","24.445","0.001","77.01","0.001","87.64","0.001","89.45","0.001","5277.5","0.6","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C58 H66 Li O4 P3 S2 -","- C58 H66 Li O4 P3 S2 -","- C232 H264 Li4 O16 P12 S8 -","4","2","","Doux, Marjolaine; Thuéry, Pierre; Blug, Matthias; Ricard, Louis; Le Floch, Pascal; Arliguie, Thérèse; Mézailles, Nicolas","Anions of Tridentate SPS Ligands: Syntheses, X-ray Structures and DFT Calculations","Organometallics","2007","26","23","5643","","10.1021/om7006634","","","0.71069","MoKα","","0.0912","0.0611","","","0.1609","0.1783","","","","","","1.025","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073836","10.565","0.001","13.316","0.001","17.546","0.001","73.077","0.001","74.38","0.001","75.77","0.001","2236.5","0.3","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C50 H50 Li O2 P3 S2 -","- C50 H50 Li O2 P3 S2 -","- C100 H100 Li2 O4 P6 S4 -","2","1","","Doux, Marjolaine; Thuéry, Pierre; Blug, Matthias; Ricard, Louis; Le Floch, Pascal; Arliguie, Thérèse; Mézailles, Nicolas","Anions of Tridentate SPS Ligands: Syntheses, X-ray Structures and DFT Calculations","Organometallics","2007","26","23","5643","","10.1021/om7006634","","","0.71069","MoKα","","0.0497","0.0383","","","0.0991","0.1053","","","","","","1.069","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073837","12.324","0.001","13.105","0.001","15.844","0.001","74.112","0.001","68.143","0.001","86.087","0.001","2282.6","0.3","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C50 H50 K O2 P3 S2 -","- C50 H50 K O2 P3 S2 -","- C100 H100 K2 O4 P6 S4 -","2","1","","Doux, Marjolaine; Thuéry, Pierre; Blug, Matthias; Ricard, Louis; Le Floch, Pascal; Arliguie, Thérèse; Mézailles, Nicolas","Anions of Tridentate SPS Ligands: Syntheses, X-ray Structures and DFT Calculations","Organometallics","2007","26","23","5643","","10.1021/om7006634","","","0.71069","MoKα","","0.0727","0.0486","","","0.1341","0.1471","","","","","","1.092","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073838","9.3537","0.0002","20.6676","0.0006","15.8981","0.0007","90","","93.302","0.001","90","","3068.29","0.17","100","2","100","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C62 H77 B K O8 P3 S2 -","- C62 H69 B K O8 P3 S2 -","- C124 H138 B2 K2 O16 P6 S4 -","2","0.5","","Doux, Marjolaine; Thuéry, Pierre; Blug, Matthias; Ricard, Louis; Le Floch, Pascal; Arliguie, Thérèse; Mézailles, Nicolas","Anions of Tridentate SPS Ligands: Syntheses, X-ray Structures and DFT Calculations","Organometallics","2007","26","23","5643","","10.1021/om7006634","","","0.71073","MoKα","","0.0669","0.0558","","","0.1543","0.1619","","","","","","1.057","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073839","13.737","0.001","12.366","0.001","26.453","0.001","90","","104.747","0.001","90","","4345.6","0.5","150","1","150","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C51 H45 Li N O P3 S2 -","- C51 H45 Li N O P3 S2 -","- C204 H180 Li4 N4 O4 P12 S8 -","4","1","","Doux, Marjolaine; Thuéry, Pierre; Blug, Matthias; Ricard, Louis; Le Floch, Pascal; Arliguie, Thérèse; Mézailles, Nicolas","Anions of Tridentate SPS Ligands: Syntheses, X-ray Structures and DFT Calculations","Organometallics","2007","26","23","5643","","10.1021/om7006634","","","0.71073","MoKα","","0.065","0.0392","","","0.0933","0.1058","","","","","","1.002","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073840","12.4295","0.0006","7.6154","0.0004","15.0557","0.0008","90","","105.857","0.002","90","","1370.88","0.12","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H21 Cl2 N O Pt -","- C9 H21 Cl2 N O Pt -","- C36 H84 Cl8 N4 O4 Pt4 -","4","1","","Vicente, José; Arcas, Aurelia; Fernández-Hernández, Jesús M.; Aullón, Gabriel; Bautista, Delia","Acetonyl Platinum(II) Complexes†","Organometallics","2007","26","25","6155","","10.1021/om700665n","","","0.71073","MoKα","","0.0219","0.0212","","","0.0454","0.0457","","","","","","1.185","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073841","15.6536","0.0009","6.8386","0.0004","16.509","0.0009","90","","102.075","0.002","90","","1728.17","0.17","447","2","447","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H25 Cl2 N O Pt -","- C15 H25 Cl2 N O Pt -","- C60 H100 Cl8 N4 O4 Pt4 -","4","1","","Vicente, José; Arcas, Aurelia; Fernández-Hernández, Jesús M.; Aullón, Gabriel; Bautista, Delia","Acetonyl Platinum(II) Complexes†","Organometallics","2007","26","25","6155","","10.1021/om700665n","","","0.71073","MoKα","","0.0262","0.0256","","","0.0559","0.0562","","","","","","1.252","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073842","12.2711","0.0005","11.3098","0.0004","27.4801","0.0011","90","","99.633","0.001","90","","3760","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H36 Cl4 O P2 Pt -","- C40 H36 Cl4 O P2 Pt -","- C160 H144 Cl16 O4 P8 Pt4 -","4","1","","Vicente, José; Arcas, Aurelia; Fernández-Hernández, Jesús M.; Aullón, Gabriel; Bautista, Delia","Acetonyl Platinum(II) Complexes†","Organometallics","2007","26","25","6155","","10.1021/om700665n","","","0.71073","MoKα","","0.0195","0.0179","","","0.0427","0.0433","","","","","","1.059","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073843","33.0213","0.0019","15.9116","0.0009","11.9507","0.0007","90","","92.638","0.002","90","","6272.5","0.6","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28.5 H29.5 Cl5.5 N3 O Pt -","- C28.5 H29.5 Cl5.5 N3 O Pt -","- C228 H236 Cl44 N24 O8 Pt8 -","8","1","","Vicente, José; Arcas, Aurelia; Fernández-Hernández, Jesús M.; Aullón, Gabriel; Bautista, Delia","Acetonyl Platinum(II) Complexes†","Organometallics","2007","26","25","6155","","10.1021/om700665n","","","0.71073","MoKα","","0.0271","0.0235","","","0.0595","0.0613","","","","","","1.058","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073844","10.0835","0.0006","12.903","0.0008","13.2332","0.0008","100.728","0.002","99.835","0.002","100.983","0.002","1622.24","0.17","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H38 Cl2 N4 Pt -","- C35 H38 Cl2 N4 Pt -","- C70 H76 Cl4 N8 Pt2 -","2","1","","Vicente, José; Arcas, Aurelia; Fernández-Hernández, Jesús M.; Aullón, Gabriel; Bautista, Delia","Acetonyl Platinum(II) Complexes†","Organometallics","2007","26","25","6155","","10.1021/om700665n","","","0.71073","MoKα","","0.0284","0.0259","","","0.0557","0.0566","","","","","","1.08","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073845","8.0409","0.0004","10.4023","0.0005","10.8166","0.0005","85.016","0.002","80.162","0.002","87.287","0.002","887.58","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H18 Cl2 N2 Pt -","- C18 H18 Cl2 N2 Pt -","- C36 H36 Cl4 N4 Pt2 -","2","1","","Vicente, José; Arcas, Aurelia; Fernández-Hernández, Jesús M.; Aullón, Gabriel; Bautista, Delia","Acetonyl Platinum(II) Complexes†","Organometallics","2007","26","25","6155","","10.1021/om700665n","","","0.71073","MoKα","","0.02","0.0189","","","0.047","0.0475","","","","","","1.084","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073846","9.5052","0.0008","24.039","0.002","20.8556","0.0017","90","","99.004","0.002","90","","4706.7","0.7","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H17 B2 Cl2 F24 N3 -","- C50 H16.9998 B2 Cl1.9999 F24 N3 -","- C200 H67.9992 B8 Cl7.9996 F96 N12 -","4","1","","Chai, Jianfang; Lewis, Stewart P.; Collins, Scott; Sciarone, Timo J. J.; Henderson, Lee D.; Chase, Preston A.; Irvine, Geoffrey J.; Piers, Warren E.; Elsegood, Mark R. J.; Clegg, William","Formation of Chelated Counteranions Using Lewis Acidic Diboranes: Relevance to Isobutene Polymerization","Organometallics","2007","26","23","5667","","10.1021/om700672q","","","0.71073","MoKα","","0.0626","0.0401","","","0.1049","0.1126","","","","","","1.03","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073847","37.975","0.004","10.9235","0.0011","21.671","0.002","90","","91.987","0.002","90","","8984.2","1.5","160","2","160","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C50 H17 B2 Cl2 F20 N3 -","- C50 H17 B2 Cl2 F20 N3 -","- C400 H136 B16 Cl16 F160 N24 -","8","1","","Chai, Jianfang; Lewis, Stewart P.; Collins, Scott; Sciarone, Timo J. J.; Henderson, Lee D.; Chase, Preston A.; Irvine, Geoffrey J.; Piers, Warren E.; Elsegood, Mark R. J.; Clegg, William","Formation of Chelated Counteranions Using Lewis Acidic Diboranes: Relevance to Isobutene Polymerization","Organometallics","2007","26","23","5667","","10.1021/om700672q","","","0.71073","MoKα","","0.0719","0.0417","","","0.0956","0.1097","","","","","","1.006","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073848","9.753","0.005","18.161","0.009","12.285","0.006","90","","110.016","0.017","90","","2044.5","1.8","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H39 B N2 O -","- C18 H39 B N2 O -","- C72 H156 B4 N8 O4 -","4","1","","Ma, Lili; Hopson, Russell; Li, Deyu; Zhang, Yong; Williard, Paul G.","Synthesis and Structural Characterization of the Bis(diisopropylamino)boron Enolate oftert-Butyl Methyl Ketone","Organometallics","2007","26","24","5834","","10.1021/om700676w","","","0.71073","MoKα","","0.0656","0.0562","","","0.1566","0.1669","","","","","","1.049","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073849","11.851","0.002","16.094","0.003","20.411","0.004","90","","97.04","0.03","90","","3863.6","1.3","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H58 Li O2 Si4 Tb -","- C32 H58 Li O2 Si4 Tb -","- C128 H232 Li4 O8 Si16 Tb4 -","4","1","","Lorenz, Volker; Edelmann, Anja; Blaurock, Steffen; Freise, Fritjof; Edelmann, Frank T.","A Surprising Solvent Effect on the Crystal Structure of an Anionic Lanthanide Sandwich Complex†","Organometallics","2007","26","26","6681","","10.1021/om7006776","","","0.71073","MoKα","","0.0798","0.0429","","","0.0903","0.0977","","","","","","0.844","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073850","14.059","0.003","14.773","0.003","22.533","0.005","90","","104.31","0.03","90","","4534.8","1.8","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H70 Li O2 Si4 Tb -","- C37 H70 Li O2 Si4 Tb -","- C148 H280 Li4 O8 Si16 Tb4 -","4","1","","Lorenz, Volker; Edelmann, Anja; Blaurock, Steffen; Freise, Fritjof; Edelmann, Frank T.","A Surprising Solvent Effect on the Crystal Structure of an Anionic Lanthanide Sandwich Complex†","Organometallics","2007","26","26","6681","","10.1021/om7006776","","","0.71073","MoKα","","0.0479","0.0299","","","0.0749","0.0781","","","","","","0.871","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073851","11.575","0.002","13.026","0.002","17.558","0.002","78","0.01","82.34","0.01","64.95","0.01","2342.8","0.6","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C53 H50 O5 Sb2 W -","- C53 H50 O5 Sb2 W -","- C106 H100 O10 Sb4 W2 -","2","1","","Breunig, Hans J.; Borrmann, Tobias; Lork, Enno; Raţ, Ciprian I.; Rosenthal, Uwe","Syntheses and Structures of Distibene Complexes of Tungsten and Titanium: [W(CO)5{(2,6-Mes2C6H3)2Sb2}] (Mes = 2,4,6-Me3C6H2) and [Cp2Ti{(2,6-Mes2C6H3)2Sb2)}]","Organometallics","2007","26","22","5364","","10.1021/om700681w","","x-ray","0.71073","MoKα","","0.0451","0.0341","","","0.074","0.078","","","","","","1.051","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073852","11.272","0.001","12.836","0.002","20.263","0.002","97.06","0.01","93.69","0.01","109.12","0.01","2731.9","0.6","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C67 H60 D9 Sb2 Ti -","- C67 H60 D9 Sb2 Ti -","- C134 H120 D18 Sb4 Ti2 -","2","1","","Breunig, Hans J.; Borrmann, Tobias; Lork, Enno; Raţ, Ciprian I.; Rosenthal, Uwe","Syntheses and Structures of Distibene Complexes of Tungsten and Titanium: [W(CO)5{(2,6-Mes2C6H3)2Sb2}] (Mes = 2,4,6-Me3C6H2) and [Cp2Ti{(2,6-Mes2C6H3)2Sb2)}]","Organometallics","2007","26","22","5364","","10.1021/om700681w","","x-ray","0.71073","MoKα","","0.0735","0.0431","","","0.088","0.0983","","","","","","0.976","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073853","14.688","0.0011","23.835","0.002","21.211","0.002","90","","102.572","0.005","90","","7247.7","1.1","113","2","113","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C34 H30 Cl N4 O2 Y -","- C34 H30 Cl N4 O2 Y -","- C272 H240 Cl8 N32 O16 Y8 -","8","4","","Xiang, Li; Wang, Qiuwen; Song, Haibin; Zi, Guofu","Synthesis, Structural Characterization, and Reactivity of Organolanthanides Derived from a New Chiral Ligand, (R)-Bis(pyrrol-2-ylmethyleneamino)-1,1‘-binaphthyl","Organometallics","2007","26","22","5323","","10.1021/om7006826","","","0.7107","MoKα","","0.1112","0.0768","","","0.178","0.2024","","","","","","0.98","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073854","11.236","0.002","17.36","0.004","68.727","0.014","90","","90","","90","","13406","5","113","2","113","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C47 H54 N5 O Si2 Sm -","- C47 H54 N5 O Si2 Sm -","- C564 H648 N60 O12 Si24 Sm12 -","12","3","","Xiang, Li; Wang, Qiuwen; Song, Haibin; Zi, Guofu","Synthesis, Structural Characterization, and Reactivity of Organolanthanides Derived from a New Chiral Ligand, (R)-Bis(pyrrol-2-ylmethyleneamino)-1,1‘-binaphthyl","Organometallics","2007","26","22","5323","","10.1021/om7006826","","","0.71073","MoKα","","0.0622","0.0483","","","0.0728","0.0763","","","","","","1.005","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073855","11.179","0.003","17.442","0.005","68.466","0.019","90","","90","","90","","13350","6","113","2","113","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C47 H54 N5 O Si2 Y -","- C47 H54 N5 O Si2 Y -","- C564 H648 N60 O12 Si24 Y12 -","12","3","","Xiang, Li; Wang, Qiuwen; Song, Haibin; Zi, Guofu","Synthesis, Structural Characterization, and Reactivity of Organolanthanides Derived from a New Chiral Ligand, (R)-Bis(pyrrol-2-ylmethyleneamino)-1,1‘-binaphthyl","Organometallics","2007","26","22","5323","","10.1021/om7006826","","","0.7107","MoKα","","0.1019","0.0526","","","0.0572","0.0669","","","","","","0.822","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073856","25.536","0.003","22.103","0.002","25.583","0.003","90","","111.308","0.003","90","","13453","3","113","2","113","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C98.67 H69.33 N12 Yb2 -","- C98.6667 H69.3333 N12 Yb2 -","- C592 H416 N72 Yb12 -","6","1.5","","Xiang, Li; Wang, Qiuwen; Song, Haibin; Zi, Guofu","Synthesis, Structural Characterization, and Reactivity of Organolanthanides Derived from a New Chiral Ligand, (R)-Bis(pyrrol-2-ylmethyleneamino)-1,1‘-binaphthyl","Organometallics","2007","26","22","5323","","10.1021/om7006826","","","0.7107","MoKα","","0.0696","0.0599","","","0.1203","0.1275","","","","","","1.051","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073857","10.173","0.0012","11.5674","0.0007","31.877","0.003","90","","95.862","0.009","90","","3731.5","0.6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H67 B10 Cl N2 Sn -","- C25 H67 B10 Cl N2 Sn -","- C100 H268 B40 Cl4 N8 Sn4 -","4","1","","Joosten, Dominik; Weissinger, Ines; Kirchmann, Marius; Maichle-Mössmer, Cäcilia; Schappacher, Falko M.; Pöttgen, Rainer; Wesemann, Lars","1,2-Carbastanna-closo-dodecaborate, a New Tin Ligand in Coordination Chemistry: Synthesis, Structure, and Reactivity","Organometallics","2007","26","23","5696","","10.1021/om7006858","","","0.71073","MoKα","","0.0894","0.0607","","","0.1293","0.1418","","","","","","1.074","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073858","25.1882","0.0017","20.2044","0.0009","35.831","0.002","90","","101.118","0.005","90","","17892.6","1.8","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C76 H87 Au4 B20 Cl4 P4 Sn2 -","- C76 H87 Au4 B20 Cl4 P4 Sn2 -","- C608 H696 Au32 B160 Cl32 P32 Sn16 -","8","2","","Joosten, Dominik; Weissinger, Ines; Kirchmann, Marius; Maichle-Mössmer, Cäcilia; Schappacher, Falko M.; Pöttgen, Rainer; Wesemann, Lars","1,2-Carbastanna-closo-dodecaborate, a New Tin Ligand in Coordination Chemistry: Synthesis, Structure, and Reactivity","Organometallics","2007","26","23","5696","","10.1021/om7006858","","","0.71073","MoKα","","0.1663","0.0788","","","0.1068","0.1256","","","","","","1.017","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073859","17.6722","0.0008","22.529","0.0007","24.2283","0.001","90","","99.158","0.003","90","","9523.2","0.7","193","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C72 H137 B30 Cl2 N2 P2 Rh Sn3 -","- C72 H137 B30 Cl2 N2 P2 Rh Sn3 -","- C288 H548 B120 Cl8 N8 P8 Rh4 Sn12 -","4","1","","Joosten, Dominik; Weissinger, Ines; Kirchmann, Marius; Maichle-Mössmer, Cäcilia; Schappacher, Falko M.; Pöttgen, Rainer; Wesemann, Lars","1,2-Carbastanna-closo-dodecaborate, a New Tin Ligand in Coordination Chemistry: Synthesis, Structure, and Reactivity","Organometallics","2007","26","23","5696","","10.1021/om7006858","","","0.71073","MoKα","","0.0895","0.0572","","","0.0971","0.1075","","","","","","1.079","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073860","9.8319","0.0004","12.8275","0.0006","19.633","0.0009","70.935","0.001","83.12","0.001","88.67","0.001","2323.09","0.18","180","2","180","2","","","","","","","","8","P -1","-P 1","2","","","","- C93 H40 B2 Cl6 Cr2 F40 O6 P2 -","- C93 H40 B2 Cl6 Cr2 F40 O6 P2 -","- C93 H40 B2 Cl6 Cr2 F40 O6 P2 -","1","0.5","","Brownie, John H.; Baird, Michael C.; Laws, Derek R.; Geiger, William E.","One-Electron Oxidations of the Methyldiphenylphosphonium Cyclopentadienylide Complexes M(η5-C5H4PMePh2)(CO)3(M = Cr, Mo, W): Formation and Dimerization of the 17-Electron, Metal-Centered Radicals [M(η5-C5H4PMePh2)(CO)3]+","Organometallics","2007","26","24","5890","","10.1021/om700688p","","","0.71073","MoKα","","0.0467","0.0351","","","0.094","0.1023","","","","","","1","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073861","13.0003","0.0018","10.0517","0.0014","38.132","0.005","90","","92.466","0.002","90","","4978.3","1.2","298","2","298","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C102 H58 B2 F40 Mo2 O9 P2 -","- C90 H34 B2 F40 Mo2 O6 P2 -","- C180 H68 B4 F80 Mo4 O12 P4 -","2","0.5","","Brownie, John H.; Baird, Michael C.; Laws, Derek R.; Geiger, William E.","One-Electron Oxidations of the Methyldiphenylphosphonium Cyclopentadienylide Complexes M(η5-C5H4PMePh2)(CO)3(M = Cr, Mo, W): Formation and Dimerization of the 17-Electron, Metal-Centered Radicals [M(η5-C5H4PMePh2)(CO)3]+","Organometallics","2007","26","24","5890","","10.1021/om700688p","","","0.71073","MoKα","","0.1209","0.0881","","","0.211","0.2248","","","","","","1.054","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073862","12.9575","0.0007","9.9157","0.0006","37.847","0.002","90","","91.96","0.001","90","","4859.8","0.5","180","2","180","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C102 H58 B2 F40 O9 P2 W2 -","- C102 H50 B2 F40 O9 P2 W2 -","- C204 H100 B4 F80 O18 P4 W4 -","2","0.5","","Brownie, John H.; Baird, Michael C.; Laws, Derek R.; Geiger, William E.","One-Electron Oxidations of the Methyldiphenylphosphonium Cyclopentadienylide Complexes M(η5-C5H4PMePh2)(CO)3(M = Cr, Mo, W): Formation and Dimerization of the 17-Electron, Metal-Centered Radicals [M(η5-C5H4PMePh2)(CO)3]+","Organometallics","2007","26","24","5890","","10.1021/om700688p","","","0.71073","MoKα","","0.0453","0.0376","","","0.1283","0.1369","","","","","","1","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073863","8.387","0.003","8.827","0.003","16.629","0.006","90","","93.999","0.005","90","","1228.1","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 Cl2 O4 Rh2 -","- C22 H30 Cl2 O4 Rh2 -","- C44 H60 Cl4 O8 Rh4 -","2","0.5","","Han, Ying-Feng; Lin, Yue-Jian; Jia, Wei-Guo; Weng, Lin-Hong; Jin, Guo-Xin","Stepwise Formation of Tetra- and Hexanuclear Iridium and Rhodium Complexes Containing Oxalato Ligands","Organometallics","2007","26","24","5848","","10.1021/om700691u","","","0.71073","MoKα","","0.0558","0.0422","","","0.0963","0.1016","","","","","","1.044","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073864","12.685","0.01","14.25","0.011","15.672","0.012","95.394","0.012","111.274","0.01","116.316","0.009","2253","3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C70 H84 Cl4 F12 Ir4 N4 O22 S4 -","- C68 H80 Cl4 F6 Ir4 N4 O16 S2 -","- C68 H80 Cl4 F6 Ir4 N4 O16 S2 -","1","0.5","","Han, Ying-Feng; Lin, Yue-Jian; Jia, Wei-Guo; Weng, Lin-Hong; Jin, Guo-Xin","Stepwise Formation of Tetra- and Hexanuclear Iridium and Rhodium Complexes Containing Oxalato Ligands","Organometallics","2007","26","24","5848","","10.1021/om700691u","","","0.71073","MoKα","","0.0794","0.0452","","","0.1042","0.11","","","","","","0.826","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073865","16.654","0.005","30.945","0.01","18.917","0.006","90","","91.905","0.006","90","","9744","5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C72 H76 F12 Ir4 N8 O22 S4 -","- C71 H76 F9 Ir4 N8 O19 S3 -","- C284 H304 F36 Ir16 N32 O76 S12 -","4","1","","Han, Ying-Feng; Lin, Yue-Jian; Jia, Wei-Guo; Weng, Lin-Hong; Jin, Guo-Xin","Stepwise Formation of Tetra- and Hexanuclear Iridium and Rhodium Complexes Containing Oxalato Ligands","Organometallics","2007","26","24","5848","","10.1021/om700691u","","","0.71073","MoKα","","0.1299","0.071","","","0.1666","0.1864","","","","","","0.871","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073866","50.627","0.01","50.627","0.01","50.627","0.01","90","","90","","90","","129762","4","293","2","293","2","","","","","","","","7","F d -3 c :2","-F 4ud 2vw 3","228","","","","- C108 H114 F18 Ir6 N12 O30 S6 -","- C103 H114 F3 Ir6 N12 O15 S -","- C3296 H3648 F96 Ir192 N384 O480 S32 -","32","0.166667","","Han, Ying-Feng; Lin, Yue-Jian; Jia, Wei-Guo; Weng, Lin-Hong; Jin, Guo-Xin","Stepwise Formation of Tetra- and Hexanuclear Iridium and Rhodium Complexes Containing Oxalato Ligands","Organometallics","2007","26","24","5848","","10.1021/om700691u","","","0.71073","MoKα","","0.101","0.0604","","","0.1376","0.1516","","","","","","1.01","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073867","18.286","0.003","11.617","0.003","20.683","0.004","90","","114.68","0.01","90","","3992.3","1.5","297","2","296","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C42 H42 B F4 N O3 P2 Pt -","- C42 H42 B F4 N O3 P2 Pt -","- C168 H168 B4 F16 N4 O12 P8 Pt4 -","4","1","","Cucciolito, Maria Elena; D'Amora, Angela; Tuzi, Angela; Vitagliano, Aldo","Catalytic Hydroarylation of Olefins Promoted by Dicationic Platinum(II) and Palladium(II) Complexes. The Interplay of C−C Bond Formation and M−C Bond Cleavage","Organometallics","2007","26","21","5216","","10.1021/om700692s","","","0.71073","MoKα","","0.1886","0.0561","","","0.1166","0.1743","","","","","","0.939","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073868","8.934","0.0018","11.258","0.002","13.631","0.003","80.97","0.03","72.96","0.03","70.79","0.03","1235","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H30 N2 O2 W -","- C28 H30 N2 O2 W -","- C56 H60 N4 O4 W2 -","2","1","","Wu, Fan; Dioumaev, Vladimir K.; Szalda, David J.; Hanson, Jonathan; Bullock, R. Morris","A Tungsten Complex with a Bidentate, Hemilabile N-Heterocyclic Carbene Ligand, Facile Displacement of the Weakly Bound W−(CC) Bond, and the Vulnerability of the NHC Ligand toward Catalyst Deactivation during Ketone Hydrogenation","Organometallics","2007","26","20","5079","","10.1021/om700694e","","","0.71073","MoKα","","0.0681","0.0284","","","0.0656","0.0724","","","","","","1.056","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073869","8.508","0.0017","16.515","0.003","21.351","0.004","106.97","0.03","95.45","0.03","92.94","0.03","2846.6","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C31.5 H34 Mo N2 O2 -","- C31.5 H30 Mo N2 O2 -","- C126 H120 Mo4 N8 O8 -","4","2","","Wu, Fan; Dioumaev, Vladimir K.; Szalda, David J.; Hanson, Jonathan; Bullock, R. Morris","A Tungsten Complex with a Bidentate, Hemilabile N-Heterocyclic Carbene Ligand, Facile Displacement of the Weakly Bound W−(CC) Bond, and the Vulnerability of the NHC Ligand toward Catalyst Deactivation during Ketone Hydrogenation","Organometallics","2007","26","20","5079","","10.1021/om700694e","","","0.71073","MoKα","","0.2577","0.0559","","","0.1206","0.1596","","","","","","0.979","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073870","18.262","0.004","17.725","0.004","17.657","0.004","90","","113.87","0.03","90","","5227","2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C55.5 H33 B F20 N2 O2 W -","- C55.5 H29 B F20 N2 O2 W -","- C222 H116 B4 F80 N8 O8 W4 -","4","1","","Wu, Fan; Dioumaev, Vladimir K.; Szalda, David J.; Hanson, Jonathan; Bullock, R. Morris","A Tungsten Complex with a Bidentate, Hemilabile N-Heterocyclic Carbene Ligand, Facile Displacement of the Weakly Bound W−(CC) Bond, and the Vulnerability of the NHC Ligand toward Catalyst Deactivation during Ketone Hydrogenation","Organometallics","2007","26","20","5079","","10.1021/om700694e","","","0.9035","","","0.0585","0.0573","","","0.1528","0.154","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073871","17.636","0.004","17.126","0.003","35.532","0.007","90","","90","","90","","10732","4","150","2","150","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C57 H41 B F20 N2 O3 W -","- C57 H41 B F20 N2 O3 W -","- C456 H328 B8 F160 N16 O24 W8 -","8","1","","Wu, Fan; Dioumaev, Vladimir K.; Szalda, David J.; Hanson, Jonathan; Bullock, R. Morris","A Tungsten Complex with a Bidentate, Hemilabile N-Heterocyclic Carbene Ligand, Facile Displacement of the Weakly Bound W−(CC) Bond, and the Vulnerability of the NHC Ligand toward Catalyst Deactivation during Ketone Hydrogenation","Organometallics","2007","26","20","5079","","10.1021/om700694e","","","0.922","synchrotron","","0.0952","0.0607","","","0.1539","0.1733","","","","","","1.047","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073872","11.2711","0.0009","9.1727","0.0008","14.3367","0.0011","90","","90.512","0.002","90","","1482.2","0.2","293","2","293","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C22 H32 Br Cl3 F6 Ir N4 P -","- C22 H32 Br Cl3 F6 Ir N4 P -","- C44 H64 Br2 Cl6 F12 Ir2 N8 P2 -","2","1","","Viciano, Mónica; Feliz, Marta; Corberán, Rosa; Mata, Jose A.; Clot, Eric; Peris, Eduardo","Aliphatic versus Aromatic C−H Activation in the Formation of Abnormal Carbenes with Iridium: A Combined Experimental and Theoretical Study","Organometallics","2007","26","22","5304","","10.1021/om7006979","","","0.71073","MoKα","","0.0826","0.0506","","","0.0834","0.0926","","","","","","1.014","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073873","12.3869","0.0006","15.5378","0.0007","15.7627","0.0007","90","","102.102","0.001","90","","2966.3","0.2","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C22 H33 Cl2 F6 I Ir N4 P -","- C22 H33 Cl2 F6 I Ir N4 P -","- C88 H132 Cl8 F24 I4 Ir4 N16 P4 -","4","1","","Viciano, Mónica; Feliz, Marta; Corberán, Rosa; Mata, Jose A.; Clot, Eric; Peris, Eduardo","Aliphatic versus Aromatic C−H Activation in the Formation of Abnormal Carbenes with Iridium: A Combined Experimental and Theoretical Study","Organometallics","2007","26","22","5304","","10.1021/om7006979","","","0.71073","MoKα","","0.0322","0.0243","","","0.0584","0.0623","","","","","","1.013","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073874","38.213","0.002","8.3789","0.0005","23.3134","0.0015","90","","102.608","0.001","90","","7284.6","0.7","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H35 Cl7 F6 Ir N4 P -","- C24 H35 Cl7 F6 Ir N4 P -","- C192 H280 Cl56 F48 Ir8 N32 P8 -","8","1","","Viciano, Mónica; Feliz, Marta; Corberán, Rosa; Mata, Jose A.; Clot, Eric; Peris, Eduardo","Aliphatic versus Aromatic C−H Activation in the Formation of Abnormal Carbenes with Iridium: A Combined Experimental and Theoretical Study","Organometallics","2007","26","22","5304","","10.1021/om7006979","","x-ray","0.71073","MoKα","","0.0507","0.0414","","","0.1099","0.1167","","","","","","1.033","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073875","7.4921","0.0004","16.5039","0.0009","13.9741","0.0008","90","","101.704","0.001","90","","1691.96","0.16","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H23 Cl2 Ir N2 -","- C15 H23 Cl2 Ir N2 -","- C60 H92 Cl8 Ir4 N8 -","4","1","","Viciano, Mónica; Feliz, Marta; Corberán, Rosa; Mata, Jose A.; Clot, Eric; Peris, Eduardo","Aliphatic versus Aromatic C−H Activation in the Formation of Abnormal Carbenes with Iridium: A Combined Experimental and Theoretical Study","Organometallics","2007","26","22","5304","","10.1021/om7006979","","x-ray","0.71073","MoKα","","0.0683","0.0369","","","0.0691","0.0777","","","","","","1.03","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073876","3.9855","0.0006","24.1","0.003","12.6805","0.0017","90","","92.369","0.002","90","","1216.9","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H9 P S2 -","- C15 H9 P S2 -","- C60 H36 P4 S8 -","4","1","","Huy, Ngoc Hoa Tran; Donnadieu, Bruno; Mathey, François","Dithienophosphinine","Organometallics","2007","26","25","6497","","10.1021/om7006997","","","0.71073","MoKα","","0.0412","0.0322","","","0.0772","0.0816","","","","","","1.043","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4073877","13.2079","0.0008","10.93","0.0006","12.503","0.0007","90","","94.503","0.003","90","","1799.39","0.18","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 O2 P S2 -","- C21 H15 O2 P S2 -","- C84 H60 O8 P4 S8 -","4","1","","Huy, Ngoc Hoa Tran; Donnadieu, Bruno; Mathey, François","Dithienophosphinine","Organometallics","2007","26","25","6497","","10.1021/om7006997","","","0.71073","MoKα","","0.0579","0.0404","","","0.1062","0.1162","","","","","","1.048","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073878","11.5695","0.0018","9.8629","0.0015","15.957","0.003","90","","99.685","0.002","90","","1794.9","0.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H15 P S3 -","- C21 H15 P S3 -","- C84 H60 P4 S12 -","4","1","","Huy, Ngoc Hoa Tran; Donnadieu, Bruno; Mathey, François","Dithienophosphinine","Organometallics","2007","26","25","6497","","10.1021/om7006997","","","0.71073","MoKα","","0.0285","0.0275","","","0.0736","0.0743","","","","","","1.05","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073879","29.212","0.002","28.996","0.003","12.2327","0.001","90","","90","","90","","10361.5","1.5","223","2","223","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C94.5 H81 F6 O7 P6 Pt2 S2 -","- C94.5 H82 F6 O7 P6 Pt2 S2 -","- C378 H328 F24 O28 P24 Pt8 S8 -","4","0.5","","Hu, Jian; Lin, Ronger; Yip, John H. K.; Wong, Kwok-Yin; Ma, Dik-Lung; Vittal, Jagadese J.","Synthesis and Electronic Spectroscopy of Luminescent Cyclometalated Platinum−Anthracenyl Complexes","Organometallics","2007","26","26","6533","","10.1021/om700706r","","","0.71073","MoKα","","0.0936","0.0562","","","0.1397","0.1542","","","","","","1.052","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073880","15.4379","0.0013","19.4669","0.0015","33.992","0.003","90","","90.347","0.002","90","","10215.4","1.5","223","2","223","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C95.25 H81.5 Cl2.5 F6 O6.5 P6 Pt2 S2 -","- C95.25 H81.5 Cl2.5 F6 O6.5 P6 Pt2 S2 -","- C381 H326 Cl10 F24 O26 P24 Pt8 S8 -","4","1","","Hu, Jian; Lin, Ronger; Yip, John H. K.; Wong, Kwok-Yin; Ma, Dik-Lung; Vittal, Jagadese J.","Synthesis and Electronic Spectroscopy of Luminescent Cyclometalated Platinum−Anthracenyl Complexes","Organometallics","2007","26","26","6533","","10.1021/om700706r","","","0.71073","MoKα","","0.1399","0.0711","","","0.2016","0.2356","","","","","","0.996","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073881","18.8456","0.0008","15.193","0.0006","31.3809","0.0012","90","","94.382","0.001","90","","8958.8","0.6","223","2","223","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C94 H78 Cl4 F6 O6 P6 Pt2 S2 -","- C94 H78 Cl4 F6 O6 P6 Pt2 S2 -","- C376 H312 Cl16 F24 O24 P24 Pt8 S8 -","4","0.5","","Hu, Jian; Lin, Ronger; Yip, John H. K.; Wong, Kwok-Yin; Ma, Dik-Lung; Vittal, Jagadese J.","Synthesis and Electronic Spectroscopy of Luminescent Cyclometalated Platinum−Anthracenyl Complexes","Organometallics","2007","26","26","6533","","10.1021/om700706r","","","0.71073","MoKα","","0.0685","0.0508","","","0.1221","0.1304","","","","","","1.034","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073882","31.534","0.004","19.08","0.002","17.17","0.002","90","","92.981","0.002","90","","10317","2","295","2","295","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C98.5 H87 Cl9 F6 O6 P6 Pt2 S2 -","- C98.5 H87 Cl9 F6 O6 P6 Pt2 S2 -","- C394 H348 Cl36 F24 O24 P24 Pt8 S8 -","4","0.5","","Hu, Jian; Lin, Ronger; Yip, John H. K.; Wong, Kwok-Yin; Ma, Dik-Lung; Vittal, Jagadese J.","Synthesis and Electronic Spectroscopy of Luminescent Cyclometalated Platinum−Anthracenyl Complexes","Organometallics","2007","26","26","6533","","10.1021/om700706r","","","0.71073","MoKα","","0.0885","0.0502","","","0.1344","0.1523","","","","","","1.009","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073883","11.4542","0.0006","14.2431","0.0007","16.5993","0.0008","69.655","0.001","77.781","0.001","87.317","0.001","2480.5","0.2","223","2","223","2","","","","","","","","8","P -1","-P 1","2","","","","- C98 H86 Cl8 F6 O6 P6 Pt2 S2 -","- C98 H86 Cl8 F6 O6 P6 Pt2 S2 -","- C98 H86 Cl8 F6 O6 P6 Pt2 S2 -","1","0.5","","Hu, Jian; Lin, Ronger; Yip, John H. K.; Wong, Kwok-Yin; Ma, Dik-Lung; Vittal, Jagadese J.","Synthesis and Electronic Spectroscopy of Luminescent Cyclometalated Platinum−Anthracenyl Complexes","Organometallics","2007","26","26","6533","","10.1021/om700706r","","","0.71073","MoKα","","0.0546","0.0455","","","0.1141","0.1184","","","","","","1.083","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073884","11.6283","0.0005","27.324","0.0012","14.7234","0.0006","90","","91.099","0.001","90","","4677.2","0.3","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C53 H44 Cl3 O4 P3 Pt -","- C53 H44 Cl3 O4 P3 Pt -","- C212 H176 Cl12 O16 P12 Pt4 -","4","1","","Hu, Jian; Lin, Ronger; Yip, John H. K.; Wong, Kwok-Yin; Ma, Dik-Lung; Vittal, Jagadese J.","Synthesis and Electronic Spectroscopy of Luminescent Cyclometalated Platinum−Anthracenyl Complexes","Organometallics","2007","26","26","6533","","10.1021/om700706r","","","0.71073","MoKα","","0.0544","0.0416","","","0.0868","0.0913","","","","","","1.067","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073885","19.369","0.004","12.15","0.002","27.89","0.006","90","","103.74","0.03","90","","6376","2","150","1","150","1","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C33 H34 Cl4 N P Pd -","- C33 H34 Cl4 N P Pd -","- C264 H272 Cl32 N8 P8 Pd8 -","8","1","","Aguilar, David; Aznárez, Francisco; Bielsa, Raquel; Falvello, Larry R.; Navarro, Rafael; Urriolabeitia, Esteban P.","Versatility of Iminophosphoranes and Noninnocent Behavior of the 1,5-Cyclooctadiene Ligand in Palladium(II) Complexes. Synthesis of σ-Allyl Derivatives","Organometallics","2007","26","25","6397","","10.1021/om700707j","","","0.71073","MoKα","","0.0609","0.0403","","","0.1088","0.1149","","","","","","1.064","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073886","11.49","0.001","17.566","0.001","19.304","0.001","90","","90","","90","","3896.2","0.5","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C40 H56 N2 O4 Pt -","- C40 H56 N2 O4 Pt -","- C160 H224 N8 O16 Pt4 -","4","1","","Berthon-Gelloz, Guillaume; Schumers, Jean-Marc; Lucaccioni, Fabio; Tinant, Bernard; Wouters, Johan; Markó, István E.","Expedient, Direct Synthesis of (L)Pt(0)(1,6-diene) Complexes from H2PtCl6","Organometallics","2007","26","23","5731","","10.1021/om7007088","","","0.71069","MoKα","","0.0278","0.0273","","","0.0789","0.0793","","","","","","1.217","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073887","17.459","0.002","10.3452","0.0011","18.305","0.002","90","","105.467","0.0019","90","","3186.5","0.6","123.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H42 Br2 Co N2 Si3 -","- C26 H42 Br2 Co N2 Si3 -","- C104 H168 Br8 Co4 N8 Si12 -","4","1","","Tanabiki, Masao; Sunada, Yusuke; Nagashima, Hideo","A Bis-[C(trimethylsilyl)-N-arylimino]dimethylsilane, Me3Si(CNAr)SiMe2(CNAr)SiMe3(Ar = 2,6-xylyl), as a New β-Diimine Ligand‖","Organometallics","2007","26","24","6055","","10.1021/om700711r","","","0.7107","MoKα","","","0.0298","","","","0.074","","","","","","1.016","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073888","7.635","0.003","14.65","0.006","11.743","0.005","90","","92.222","0.005","90","","1312.5","0.9","123.1","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C25 H34 Br2 Co N2 O -","- C25 H24 Br2 Co N2 O -","- C50 H48 Br4 Co2 N4 O2 -","2","0.5","","Tanabiki, Masao; Sunada, Yusuke; Nagashima, Hideo","A Bis-[C(trimethylsilyl)-N-arylimino]dimethylsilane, Me3Si(CNAr)SiMe2(CNAr)SiMe3(Ar = 2,6-xylyl), as a New β-Diimine Ligand‖","Organometallics","2007","26","24","6055","","10.1021/om700711r","","","0.7107","MoKα","","","0.0726","","","","0.2381","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073889","10.929","0.003","14.795","0.003","14.31","0.003","90","","94.069","0.003","90","","2308","0.9","123.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 Br2 Co N2 O -","- C21.5 H24 Br2 Co N2 O0.5 -","- C86 H96 Br8 Co4 N8 O2 -","4","1","","Tanabiki, Masao; Sunada, Yusuke; Nagashima, Hideo","A Bis-[C(trimethylsilyl)-N-arylimino]dimethylsilane, Me3Si(CNAr)SiMe2(CNAr)SiMe3(Ar = 2,6-xylyl), as a New β-Diimine Ligand‖","Organometallics","2007","26","24","6055","","10.1021/om700711r","","","0.7107","MoKα","","","0.0428","","","","0.1373","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073890","8.57","0.002","14.353","0.003","12.1","0.003","90","","105.23","0.03","90","","1436.1","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H38 Cl2 N2 O2 Pt2 -","- C24 H38 Cl2 N2 O2 Pt2 -","- C48 H76 Cl4 N4 O4 Pt4 -","2","0.5","","Albrecht, Christian; Schwieger, Sebastian; Rüffer, Tobias; Bruhn, Clemens; Lis, Tadeusz; Steinborn, Dirk","Polymeric Alkylidene-Bridged Platinum Complex [{Pt2(μ-Cl)2{μ-C(OBu)Me}2}n]: Synthesis, Reactivity, and Quantum Chemical Calculations","Organometallics","2007","26","24","6000","","10.1021/om7007138","","","0.71073","MoKα","","0.0626","0.039","","","0.0881","0.0927","","","","","","1.073","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073891","8.388","0.003","19.26","0.004","9.073","0.003","90","","112.84","0.03","90","","1350.8","0.8","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H38 Cl2 N2 O2 Pt2 -","- C24 H38 Cl2 N2 O2 Pt2 -","- C48 H76 Cl4 N4 O4 Pt4 -","2","0.5","","Albrecht, Christian; Schwieger, Sebastian; Rüffer, Tobias; Bruhn, Clemens; Lis, Tadeusz; Steinborn, Dirk","Polymeric Alkylidene-Bridged Platinum Complex [{Pt2(μ-Cl)2{μ-C(OBu)Me}2}n]: Synthesis, Reactivity, and Quantum Chemical Calculations","Organometallics","2007","26","24","6000","","10.1021/om7007138","","","0.71073","MoKα","","0.028","0.0246","","","0.0562","0.0574","","","","","","1.078","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073892","8.368","0.003","8.452","0.003","10.835","0.003","103.28","0.03","92.23","0.03","113.92","0.03","674.2","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H32 Br2 Cl2 N2 O2 Pt2 -","- C22 H32 Br2 Cl2 N2 O2 Pt2 -","- C22 H32 Br2 Cl2 N2 O2 Pt2 -","1","0.5","","Albrecht, Christian; Schwieger, Sebastian; Rüffer, Tobias; Bruhn, Clemens; Lis, Tadeusz; Steinborn, Dirk","Polymeric Alkylidene-Bridged Platinum Complex [{Pt2(μ-Cl)2{μ-C(OBu)Me}2}n]: Synthesis, Reactivity, and Quantum Chemical Calculations","Organometallics","2007","26","24","6000","","10.1021/om7007138","","","0.71073","MoKα","","0.027","0.0249","","","0.0625","0.0632","","","","","","1.028","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073893","9.986","0.003","12.136","0.002","13.073","0.002","62.409","0.015","73.73","0.02","67.477","0.019","1286.8","0.5","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H56 Cl8 O2 P2 Pt2 -","- C50 H56 Cl8 O2 P2 Pt2 -","- C50 H56 Cl8 O2 P2 Pt2 -","1","0.5","","Albrecht, Christian; Schwieger, Sebastian; Rüffer, Tobias; Bruhn, Clemens; Lis, Tadeusz; Steinborn, Dirk","Polymeric Alkylidene-Bridged Platinum Complex [{Pt2(μ-Cl)2{μ-C(OBu)Me}2}n]: Synthesis, Reactivity, and Quantum Chemical Calculations","Organometallics","2007","26","24","6000","","10.1021/om7007138","","","0.71073","MoKα","","0.0511","0.042","","","0.1187","0.1327","","","","","","1.038","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073894","9.9049","0.0014","10.767","0.003","13.881","0.004","87.27","0.02","82.492","0.016","66.795","0.018","1348.9","0.6","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H27 Cl4 N O P Pt -","- C24 H27 Cl4 N O P Pt -","- C48 H54 Cl8 N2 O2 P2 Pt2 -","2","1","","Albrecht, Christian; Schwieger, Sebastian; Rüffer, Tobias; Bruhn, Clemens; Lis, Tadeusz; Steinborn, Dirk","Polymeric Alkylidene-Bridged Platinum Complex [{Pt2(μ-Cl)2{μ-C(OBu)Me}2}n]: Synthesis, Reactivity, and Quantum Chemical Calculations","Organometallics","2007","26","24","6000","","10.1021/om7007138","","","0.71073","MoKα","","0.0549","0.0416","","","0.1041","0.1085","","","","","","1.051","","","","has coordinates,has disorder","178627","2020-10-21","18:00:00",""
"4073895","6.4686","0.0011","13.64","0.002","23.973","0.004","90","","90","","90","","2115.2","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","fluoroester","","","- C20 H29 F O6 -","- C20 H29 F O6 -","- C80 H116 F4 O24 -","4","1","","Althaus, Martin; Becker, Claus; Togni, Antonio; Mezzetti, Antonio","Ruthenium-Catalyzed Asymmetric Electrophilic Fluorination of 1,3-Dicarbonyl Compounds","Organometallics","2007","26","24","5902","","10.1021/om700714u","","x-ray","0.71073","MoKα","","0.0459","0.0394","","","0.1047","0.1101","","","","","","1.036","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073896","13.0229","0.0007","17.3001","0.0008","16.3817","0.0009","90","","109.13","0.0011","90","","3486.9","0.3","120","","120","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H47 F5.5 N P2 Ta -","- C35 H47 F5.5 N P2 Ta -","- C140 H188 F22 N4 P8 Ta4 -","4","1","","Gerber, Laura C. H.; Watson, Lori A.; Parkin, Sean; Weng, Wei; Foxman, Bruce M.; Ozerov, Oleg V.","Bis(methylidene) Complex of Tantalum Supported by a PNP Ligand","Organometallics","2007","26","20","4866","","10.1021/om700715s","","","0.71073","MoKα","","0.0558","0.0326","","0.0662","0.0606","0.0662","","","","","","0.8312","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073897","11.5592","0.0002","9.3509","0.0002","12.8516","0.0002","90","","95.836","0.001","90","","1381.92","0.04","90","0.2","90","0.2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C28 H44 N P2 Ta -","- C28 H44 N P2 Ta -","- C56 H88 N2 P4 Ta2 -","2","0.5","","Gerber, Laura C. H.; Watson, Lori A.; Parkin, Sean; Weng, Wei; Foxman, Bruce M.; Ozerov, Oleg V.","Bis(methylidene) Complex of Tantalum Supported by a PNP Ligand","Organometallics","2007","26","20","4866","","10.1021/om700715s","","","0.71073","MoKα","","0.018","0.0153","","","0.0362","0.0367","","","","","","0.995","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073898","12.03","0.002","15.178","0.003","15.529","0.003","90","","103.977","0.004","90","","2751.5","0.9","243","2","243","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34.5 H25 Au Cl P -","- C34.5 H25 Au Cl P -","- C138 H100 Au4 Cl4 P4 -","4","1","","Heng, Wendy Yuqing; Hu, Jian; Yip, John H. K.","Attaching Gold and Platinum to the Rim of Pyrene: A Synthetic and Spectroscopic Study","Organometallics","2007","26","27","6760","","10.1021/om700716p","","","0.71073","MoKα","","0.0584","0.044","","","0.1186","0.1254","","","","","","1.081","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073899","10.7417","0.0006","14.4354","0.0007","15.7306","0.0008","92.617","0.001","103.025","0.001","111.339","0.001","2191.5","0.2","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C53 H40 Au2 Cl2 P2 -","- C53 H40 Au2 Cl2 P2 -","- C106 H80 Au4 Cl4 P4 -","2","1","","Heng, Wendy Yuqing; Hu, Jian; Yip, John H. K.","Attaching Gold and Platinum to the Rim of Pyrene: A Synthetic and Spectroscopic Study","Organometallics","2007","26","27","6760","","10.1021/om700716p","","","0.71073","MoKα","","0.0343","0.0286","","","0.0686","0.071","","","","","","1.03","","","","has coordinates","178627","2020-10-21","18:00:00",""
"4073900","7.0423","0.0006","11.6307","0.001","55.107","0.005","90","","90.598","0.002","90","","4513.4","0.7","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C53 H40 Au2 Cl2 P2 -","- C53 H40 Au2 Cl2 P2 -","- C212 H160 Au8 Cl8 P8 -","4","1","","Heng, Wendy Yuqing; Hu, Jian; Yip, John H. K.","Attaching Gold and Platinum to the Rim of Pyrene: A Synthetic and Spectroscopic Study","Organometallics","2007","26","27","6760","","10.1021/om700716p","","","0.71073","MoKα","","0.0828","0.0631","","","0.1478","0.1596","","","","","","1.15","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073901","9.6714","0.0005","11.3463","0.0006","13.057","0.0007","114.603","0.001","98.3","0.001","97.532","0.001","1259.64","0.12","243","2","243","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H47 Au2 Br O P2 -","- C56 H47 Au2 Br O P2 -","- C56 H47 Au2 Br O P2 -","1","0.5","","Heng, Wendy Yuqing; Hu, Jian; Yip, John H. K.","Attaching Gold and Platinum to the Rim of Pyrene: A Synthetic and Spectroscopic Study","Organometallics","2007","26","27","6760","","10.1021/om700716p","","","0.71073","MoKα","","0.0462","0.0379","","","0.1012","0.1054","","","","","","1.042","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073902","13.4514","0.0006","14.2834","0.0006","14.9128","0.0007","90","","100.568","0.001","90","","2816.6","0.2","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H39 Br P2 Pt -","- C28 H39 Br P2 Pt -","- C112 H156 Br4 P8 Pt4 -","4","1","","Heng, Wendy Yuqing; Hu, Jian; Yip, John H. K.","Attaching Gold and Platinum to the Rim of Pyrene: A Synthetic and Spectroscopic Study","Organometallics","2007","26","27","6760","","10.1021/om700716p","","","0.71073","MoKα","","0.0427","0.0343","","","0.091","0.0951","","","","","","1.051","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073903","8.8737","0.0005","15.8737","0.0009","16.0938","0.0009","90","","105.402","0.001","90","","2185.5","0.2","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H68 Br2 P4 Pt2 -","- C40 H68 Br2 P4 Pt2 -","- C80 H136 Br4 P8 Pt4 -","2","0.5","","Heng, Wendy Yuqing; Hu, Jian; Yip, John H. K.","Attaching Gold and Platinum to the Rim of Pyrene: A Synthetic and Spectroscopic Study","Organometallics","2007","26","27","6760","","10.1021/om700716p","","","0.71073","MoKα","","0.0614","0.0452","","","0.1089","0.1156","","","","","","1.035","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073904","37.508","0.002","9.1892","0.0006","13.7163","0.0009","90","","90","","90","","4727.6","0.5","223","2","223","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C40 H68 Br2 P4 Pt2 -","- C40 H68 Br2 P4 Pt2 -","- C160 H272 Br8 P16 Pt8 -","4","1","","Heng, Wendy Yuqing; Hu, Jian; Yip, John H. K.","Attaching Gold and Platinum to the Rim of Pyrene: A Synthetic and Spectroscopic Study","Organometallics","2007","26","27","6760","","10.1021/om700716p","","","0.71073","MoKα","","0.1017","0.0571","","","0.112","0.1254","","","","","","1.016","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073905","9.0276","0.0005","14.8358","0.0008","17.3662","0.0009","90","","102.362","0.001","90","","2272","0.2","243","2","243","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H68 Br3 P4 Pt2 -","- C40 H68 Br3 P4 Pt2 -","- C80 H136 Br6 P8 Pt4 -","2","0.5","","Heng, Wendy Yuqing; Hu, Jian; Yip, John H. K.","Attaching Gold and Platinum to the Rim of Pyrene: A Synthetic and Spectroscopic Study","Organometallics","2007","26","27","6760","","10.1021/om700716p","","","0.71073","MoKα","","0.0412","0.0325","","","0.0727","0.0755","","","","","","1.085","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073906","38.218","0.003","9.4235","0.0007","13.5115","0.001","90","","90","","90","","4866.1","0.6","223","2","223","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C40 H67 Br3 P4 Pt2 -","- C40 H67 Br3 P4 Pt2 -","- C160 H268 Br12 P16 Pt8 -","4","1","","Heng, Wendy Yuqing; Hu, Jian; Yip, John H. K.","Attaching Gold and Platinum to the Rim of Pyrene: A Synthetic and Spectroscopic Study","Organometallics","2007","26","27","6760","","10.1021/om700716p","","","0.71073","MoKα","","0.089","0.0776","","","0.1688","0.1734","","","","","","1.184","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073907","9.5104","0.0009","19.863","0.004","13.515","0.003","90","","107.984","0.009","90","","2428.3","0.8","200","","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H16 Cl F2 Mn N4 O7 -","- C23 H16 Cl F2 Mn N4 O7 -","- C92 H64 Cl4 F8 Mn4 N16 O28 -","4","1","","Ruiz, Javier; Perandones, Bernabé F.; García, Gabriel; Mosquera, Marta E. G.","Synthesis of N-Heterocyclic Carbene Complexes of Manganese(I) by Coupling Isocyanide Ligands with Propargylamines and Propargylic Alcohols§","Organometallics","2007","26","23","5687","","10.1021/om700718x","","","0.71073","MoKα","","0.0804","0.0447","","","0.0893","0.1011","","","","","","1.023","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073908","10.9964","0.0013","17.422","0.003","13.675","0.0015","90","","104.356","0.011","90","","2538","0.6","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H16 Cl F2 Mn N4 O7 -","- C23 H16 Cl F2 Mn N4 O7 -","- C92 H64 Cl4 F8 Mn4 N16 O28 -","4","1","","Ruiz, Javier; Perandones, Bernabé F.; García, Gabriel; Mosquera, Marta E. G.","Synthesis of N-Heterocyclic Carbene Complexes of Manganese(I) by Coupling Isocyanide Ligands with Propargylamines and Propargylic Alcohols§","Organometallics","2007","26","23","5687","","10.1021/om700718x","","x-ray","0.71073","MoKα","","0.0635","0.0384","","","0.0893","0.0977","","","","","","1.037","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073909","13.223","0.004","14.573","0.003","24.6375","0.0016","90","","90","","90","","4747.6","1.8","293","2","293","2","","","","","","","","6","P c a b","-P 2bc 2ac","61","","","","- C23 H17 Cl Mn N3 O8 -","- C23 H17 Cl Mn N3 O8 -","- C184 H136 Cl8 Mn8 N24 O64 -","8","1","","Ruiz, Javier; Perandones, Bernabé F.; García, Gabriel; Mosquera, Marta E. G.","Synthesis of N-Heterocyclic Carbene Complexes of Manganese(I) by Coupling Isocyanide Ligands with Propargylamines and Propargylic Alcohols§","Organometallics","2007","26","23","5687","","10.1021/om700718x","","","0.71073","MoKα","","0.1021","0.0462","","","0.0936","0.1181","","","","","","1.046","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073910","10.319","0.004","10.579","0.003","13.042","0.003","90","","97.83","0.02","90","","1410.5","0.8","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","1b","1b","","- C27 H42 O Si2 -","- C27 H42 O Si2 -","- C54 H84 O2 Si4 -","2","1","","Minglana, Jim Josephus G.; Okazaki, Masaaki; Hasegawa, Kenji; Luh, Lung-Shiang; Yamahira, Nobukazu; Komuro, Takashi; Ogino, Hiroshi; Tobita, Hiromi","Iron, Ruthenium, and Osmium Complexes Supported by the Bis(silyl) Chelate Ligand (9,9-Dimethylxanthene-4,5-diyl)bis(dimethylsilyl): Synthesis, Characterization, and Reactivity","Organometallics","2007","26","24","5859","","10.1021/om700720s","","x-ray","0.71069","MoKα","","0.1032","0.0542","","","0.1355","0.1597","","","","","","1.013","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073911","12.214","0.005","10.05","0.01","19.45","0.005","90","","92.87","0.03","90","","2385","3","293.2","","293.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","2","2","","- C23 H24 Fe O5 Si2 -","- C23 H24 Fe O5 Si2 -","- C92 H96 Fe4 O20 Si8 -","4","1","","Minglana, Jim Josephus G.; Okazaki, Masaaki; Hasegawa, Kenji; Luh, Lung-Shiang; Yamahira, Nobukazu; Komuro, Takashi; Ogino, Hiroshi; Tobita, Hiromi","Iron, Ruthenium, and Osmium Complexes Supported by the Bis(silyl) Chelate Ligand (9,9-Dimethylxanthene-4,5-diyl)bis(dimethylsilyl): Synthesis, Characterization, and Reactivity","Organometallics","2007","26","24","5859","","10.1021/om700720s","","x-ray","0.7107","MoKα","","","0.0494","","","0.0786","","","","","0.739","0.739","","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073912","12.372","0.005","10.1","0.01","19.524","0.005","90","","93.2","0.03","90","","2436","3","293.2","","293.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 O5 Ru Si2 -","- C23 H24 O5 Ru Si2 -","- C92 H96 O20 Ru4 Si8 -","4","1","","Minglana, Jim Josephus G.; Okazaki, Masaaki; Hasegawa, Kenji; Luh, Lung-Shiang; Yamahira, Nobukazu; Komuro, Takashi; Ogino, Hiroshi; Tobita, Hiromi","Iron, Ruthenium, and Osmium Complexes Supported by the Bis(silyl) Chelate Ligand (9,9-Dimethylxanthene-4,5-diyl)bis(dimethylsilyl): Synthesis, Characterization, and Reactivity","Organometallics","2007","26","24","5859","","10.1021/om700720s","","","0.7107","MoKα","","","0.0409","","","0.0558","","","","","0.925","0.925","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073913","12.311","0.0007","10.0336","0.0006","19.1542","0.0019","90","","93.018","0.004","90","","2362.7","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 O5 Os Si2 -","- C23 H24 O5 Os Si2 -","- C92 H96 O20 Os4 Si8 -","4","1","","Minglana, Jim Josephus G.; Okazaki, Masaaki; Hasegawa, Kenji; Luh, Lung-Shiang; Yamahira, Nobukazu; Komuro, Takashi; Ogino, Hiroshi; Tobita, Hiromi","Iron, Ruthenium, and Osmium Complexes Supported by the Bis(silyl) Chelate Ligand (9,9-Dimethylxanthene-4,5-diyl)bis(dimethylsilyl): Synthesis, Characterization, and Reactivity","Organometallics","2007","26","24","5859","","10.1021/om700720s","","x-ray","0.71069","MoKα","","0.0356","0.029","","","0.083","0.1056","","","","","","1.182","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073914","15.2588","0.0009","17.1038","0.0011","12.2358","0.0006","90.3239","0.0019","111.541","0.002","103.163","0.003","2878.2","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H48 O16 Ru4 Si4 -","- C52 H48 O16 Ru4 Si4 -","- C104 H96 O32 Ru8 Si8 -","2","1","","Minglana, Jim Josephus G.; Okazaki, Masaaki; Hasegawa, Kenji; Luh, Lung-Shiang; Yamahira, Nobukazu; Komuro, Takashi; Ogino, Hiroshi; Tobita, Hiromi","Iron, Ruthenium, and Osmium Complexes Supported by the Bis(silyl) Chelate Ligand (9,9-Dimethylxanthene-4,5-diyl)bis(dimethylsilyl): Synthesis, Characterization, and Reactivity","Organometallics","2007","26","24","5859","","10.1021/om700720s","","","0.71069","MoKα","","0.0389","0.0314","","","0.0898","0.0947","","","","","","1.041","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073915","9.565","0.008","14.535","0.009","18.479","0.006","90","","92.26","0.04","90","","2567","3","293.2","","293.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","complex 6","","","- C27 H32 O2 Ru Si2 -","- C27 H32 O2 Ru Si2 -","- C108 H128 O8 Ru4 Si8 -","4","1","","Minglana, Jim Josephus G.; Okazaki, Masaaki; Hasegawa, Kenji; Luh, Lung-Shiang; Yamahira, Nobukazu; Komuro, Takashi; Ogino, Hiroshi; Tobita, Hiromi","Iron, Ruthenium, and Osmium Complexes Supported by the Bis(silyl) Chelate Ligand (9,9-Dimethylxanthene-4,5-diyl)bis(dimethylsilyl): Synthesis, Characterization, and Reactivity","Organometallics","2007","26","24","5859","","10.1021/om700720s","","x-ray","0.7107","MoKα","","","0.038","","","0.0651","","","","","0.696","0.696","","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073916","10.2901","0.0015","17.239","0.003","15.961","0.002","90","","98.652","0.003","90","","2799.1","0.7","100","0.2","100","0.2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H38 B F4 Os P -","- C30 H38 B F4 Os P -","- C120 H152 B4 F16 Os4 P4 -","4","1","","Esteruelas, Miguel A.; Hernández, Yohar A.; López, Ana M.; Oñate, Enrique","Preparation and Characterization of a Monocyclopentadienyl Osmium−Allenylcarbene Complex","Organometallics","2007","26","24","6009","","10.1021/om700722e","","","0.71069","MoKα","","0.091","0.067","","","0.161","0.171","","","","","","1.17","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073917","14.7332","0.0004","10.3695","0.0007","23.1394","0.0014","90","","96.308","0.004","90","","3513.7","0.3","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H47 F3 O4 P2 Pd -","- C28 H47 F3 O4 P2 Pd -","- C112 H188 F12 O16 P8 Pd4 -","4","1","","Bedford, Robin B.; Betham, Michael; Charmant, Jonathan P. H.; Haddow, Mairi F.; Orpen, A. Guy; Pilarski, Lukasz T.; Coles, Simon J.; Hursthouse, Michael B.","Simple Palladacyclic and Platinacyclic Catalysts for the 1,4-Conjugate Addition of Arylboronic Acids and Arylsiloxanes to Enones","Organometallics","2007","26","25","6346","","10.1021/om700724c","","","0.71073","MoKα","","0.0423","0.0326","","","0.0991","0.1047","","","","","","0.997","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073918","10.454","0.0013","13.929","0.003","20.714","0.006","90","","100.759","0.019","90","","2963.2","1.1","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H47 Cl O2 P2 Pd -","- C26 H47 Cl O2 P2 Pd -","- C104 H188 Cl4 O8 P8 Pd4 -","4","1","","Bedford, Robin B.; Betham, Michael; Charmant, Jonathan P. H.; Haddow, Mairi F.; Orpen, A. Guy; Pilarski, Lukasz T.; Coles, Simon J.; Hursthouse, Michael B.","Simple Palladacyclic and Platinacyclic Catalysts for the 1,4-Conjugate Addition of Arylboronic Acids and Arylsiloxanes to Enones","Organometallics","2007","26","25","6346","","10.1021/om700724c","","","0.71073","MoKα","","0.0329","0.0245","","","0.0618","0.0661","","","","","","1.009","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073919","13.335","0.003","15.403","0.003","18.835","0.004","85.42","0.03","89.33","0.03","65.45","0.03","3506.7","1.5","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H55 Cl N4 O2 P2 Pd -","- C30 H55 Cl N4 O2 P2 Pd -","- C120 H220 Cl4 N16 O8 P8 Pd4 -","4","2","","Bedford, Robin B.; Betham, Michael; Charmant, Jonathan P. H.; Haddow, Mairi F.; Orpen, A. Guy; Pilarski, Lukasz T.; Coles, Simon J.; Hursthouse, Michael B.","Simple Palladacyclic and Platinacyclic Catalysts for the 1,4-Conjugate Addition of Arylboronic Acids and Arylsiloxanes to Enones","Organometallics","2007","26","25","6346","","10.1021/om700724c","","","0.71073","MoKα","","0.0605","0.0433","","","0.1","0.1116","","","","","","1.093","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073920","14.496","0.005","10.941","0.003","16.481","0.005","90","","105.09","0.03","90","","2523.8","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H42 Ni O P2 -","- C23 H42 Ni O P2 -","- C92 H168 Ni4 O4 P8 -","4","1","","Cámpora, Juan; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Graiff, Claudia; Tiripicchio, Antonio","Acid−Base Reactions of Methylnickel Hydroxo, Alkoxo, and Amide Complexes with Carbon Acids. Studies on the Reactivity of Noncyclic Nickel Enolates","Organometallics","2007","26","23","5712","","10.1021/om7007259","","","0.71073","MoKα","","0.0632","0.0371","","","0.0928","0.1026","","","","","","0.943","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073921","10.1804","0.0007","16.4024","0.0011","13.0782","0.0009","90","","98.633","0.001","90","","2159.1","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H40 Ni O2 P2 -","- C18 H40 Ni O2 P2 -","- C72 H160 Ni4 O8 P8 -","4","1","","Cámpora, Juan; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Graiff, Claudia; Tiripicchio, Antonio","Acid−Base Reactions of Methylnickel Hydroxo, Alkoxo, and Amide Complexes with Carbon Acids. Studies on the Reactivity of Noncyclic Nickel Enolates","Organometallics","2007","26","23","5712","","10.1021/om7007259","","","0.71073","MoKα","","0.0401","0.0276","","","0.0659","0.0702","","","","","","1.026","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073922","14.2577","0.0011","15.5013","0.0012","18.316","0.0015","90","","96.412","0.001","90","","4022.7","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C72 H136 Ni4 O8 P6 -","- C72 H136 Ni4 O8 P6 -","- C144 H272 Ni8 O16 P12 -","2","0.5","","Cámpora, Juan; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Graiff, Claudia; Tiripicchio, Antonio","Acid−Base Reactions of Methylnickel Hydroxo, Alkoxo, and Amide Complexes with Carbon Acids. Studies on the Reactivity of Noncyclic Nickel Enolates","Organometallics","2007","26","23","5712","","10.1021/om7007259","","","0.71073","MoKα","","0.047","0.0406","","","0.1117","0.1165","","","","","","1.032","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073923","35.85","0.03","8.899","0.007","15.788","0.015","90","","102.58","0.02","90","","4916","7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H35 Mo2 O2 P -","- C25 H35 Mo2 O2 P -","- C200 H280 Mo16 O16 P8 -","8","1","","García, M. Esther; Ramos, Alberto; Ruiz, Miguel A.; Lanfranchi, Maurizio; Marchio, Luciano","Structure and Bonding in the Unsaturated Hydride- and Hydrocarbyl-Bridged Complexes [Mo2(η5-C5H5)2(μ-X)(μ-PCy2)(CO)2] (X = H, CH3, CH2Ph, Ph). Evidence for the Presence of α-Agostic and π-Bonding Interactions†","Organometallics","2007","26","25","6197","","10.1021/om7007265","","","0.71073","MoKα","","0.0585","0.033","","","0.077","0.0852","","","","","","1.004","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073924","10.308","0.005","29.438","0.01","9.913","0.004","90","","108.74","0.02","90","","2849","2","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C31 H39 Mo2 O2 P -","- C31 H39 Mo2 O2 P -","- C124 H156 Mo8 O8 P4 -","4","1","","García, M. Esther; Ramos, Alberto; Ruiz, Miguel A.; Lanfranchi, Maurizio; Marchio, Luciano","Structure and Bonding in the Unsaturated Hydride- and Hydrocarbyl-Bridged Complexes [Mo2(η5-C5H5)2(μ-X)(μ-PCy2)(CO)2] (X = H, CH3, CH2Ph, Ph). Evidence for the Presence of α-Agostic and π-Bonding Interactions†","Organometallics","2007","26","25","6197","","10.1021/om7007265","","","0.71073","MoKα","","0.1493","0.0508","","","0.058","0.0713","","","","","","0.816","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073925","17.751","0.004","10.243","0.003","29.979","0.008","90","","93.388","0.015","90","","5441","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28.5 H35.75 Cl0.25 Mo2 O2 P -","- C28.5 H35.75 Cl0.25 Mo2 O2 P -","- C228 H286 Cl2 Mo16 O16 P8 -","8","1","","García, M. Esther; Ramos, Alberto; Ruiz, Miguel A.; Lanfranchi, Maurizio; Marchio, Luciano","Structure and Bonding in the Unsaturated Hydride- and Hydrocarbyl-Bridged Complexes [Mo2(η5-C5H5)2(μ-X)(μ-PCy2)(CO)2] (X = H, CH3, CH2Ph, Ph). Evidence for the Presence of α-Agostic and π-Bonding Interactions†","Organometallics","2007","26","25","6197","","10.1021/om7007265","","","0.71073","MoKα","","0.1433","0.106","","","0.2385","0.2641","","","","","","1.055","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073926","14.0262","0.0005","15.9043","0.0006","16.2287","0.0006","96.672","0.002","96.046","0.002","90.049","0.002","3575.4","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H28 N2 O11 Os4 -","- C32 H28 N2 O11 Os4 -","- C128 H112 N8 O44 Os16 -","4","2","","Cooke, Craig E.; Jennings, Michael C.; Pomeroy, Roland K.; Clyburne, Jason A. C.","Normal and Abnormal NHC Coordination in [Os4(μ-H)4(CO)11(IMes)] and Exhaustive Dehydrogenation of an IMes Methyl Group","Organometallics","2007","26","25","6059","","10.1021/om7007293","","","0.71073","MoKα","","0.075","0.0672","","","0.1781","0.1878","","","","","","1.02","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073927","27.9147","0.0005","16.5133","0.0003","15.2219","0.0002","90","","90","","90","","7016.7","0.2","150","2","150","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C32 H28 N2 O11 Os4 -","- C32 H28 N2 O11 Os4 -","- C256 H224 N16 O88 Os32 -","8","2","","Cooke, Craig E.; Jennings, Michael C.; Pomeroy, Roland K.; Clyburne, Jason A. C.","Normal and Abnormal NHC Coordination in [Os4(μ-H)4(CO)11(IMes)] and Exhaustive Dehydrogenation of an IMes Methyl Group","Organometallics","2007","26","25","6059","","10.1021/om7007293","","","0.71073","MoKα","","0.0839","0.0478","","","0.0902","0.1011","","","","","","0.969","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073928","12.3074","0.0004","12.6819","0.0004","14.7598","0.0005","74.792","0.002","87.235","0.002","62.317","0.002","1961.26","0.12","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H33 N2 O10 Os4 -","- C40 H33 N2 O10 Os4 -","- C80 H66 N4 O20 Os8 -","2","1","","Cooke, Craig E.; Jennings, Michael C.; Pomeroy, Roland K.; Clyburne, Jason A. C.","Normal and Abnormal NHC Coordination in [Os4(μ-H)4(CO)11(IMes)] and Exhaustive Dehydrogenation of an IMes Methyl Group","Organometallics","2007","26","25","6059","","10.1021/om7007293","","","0.71073","MoKα","","0.0552","0.0513","","","0.1408","0.1448","","","","","","1.04","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073929","11.453","0.003","14.319","0.003","17.84","0.004","90","","95.953","0.004","90","","2909.9","1.2","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H60 Cl14 D4 Mg N12 -","- C40 H60 Cl14 D4 Mg N12 -","- C80 H120 Cl28 D8 Mg2 N24 -","2","0.5","","Sánchez-Barba, Luis F.; Garcés, Andrés; Fajardo, Mariano; Alonso-Moreno, Carlos; Fernández-Baeza, Juan; Otero, Antonio; Antiñolo, Antonio; Tejeda, Juan; Lara-Sánchez, Agustín; López-Solera, María I.","Well-Defined Alkyl Heteroscorpionate Magnesium Complexes as Excellent Initiators for the ROP of Cyclic Esters","Organometallics","2007","26","25","6403","","10.1021/om7007327","","","0.71073","MoKα","","0.0676","0.0506","","","0.1533","0.1795","","","","","","0.741","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073930","12.001","0.004","13.847","0.005","14.45","0.005","90","","113.049","0.005","90","","2209.6","1.3","130","2","130","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H33 Mg N6 -","- C21 H33 Mg N6 -","- C84 H132 Mg4 N24 -","4","1","","Sánchez-Barba, Luis F.; Garcés, Andrés; Fajardo, Mariano; Alonso-Moreno, Carlos; Fernández-Baeza, Juan; Otero, Antonio; Antiñolo, Antonio; Tejeda, Juan; Lara-Sánchez, Agustín; López-Solera, María I.","Well-Defined Alkyl Heteroscorpionate Magnesium Complexes as Excellent Initiators for the ROP of Cyclic Esters","Organometallics","2007","26","25","6403","","10.1021/om7007327","","","0.71073","MoKα","","0.0527","0.0423","","","0.1212","0.1401","","","","","","0.532","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073931","17.272","0.011","9.691","0.006","20.14","0.012","90","","94.441","0.013","90","","3361","4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32.5 H45.25 Cl3 N2 O4.5 Rh -","- C31 H32 Cl3 N2 O4.5 Rh -","- C124 H128 Cl12 N8 O18 Rh4 -","4","1","","Ito, Jun-ichi; Kitase, Megumi; Nishiyama, Hisao","Cross-Coupling of Alkynes Catalyzed by Phebox−Rhodium Acetate Complexes","Organometallics","2007","26","25","6412","","10.1021/om700742t","","","0.71073","MoKα","","0.0789","0.0543","","","0.1197","0.1295","","","","","","1.061","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073932","9.437","0.01","9.469","0.011","19.68","0.02","89.08","0.02","84.11","0.03","86.76","0.02","1746","3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H44 N2 O8 Rh -","- C37 H44 N2 O8 Rh -","- C74 H88 N4 O16 Rh2 -","2","1","","Ito, Jun-ichi; Kitase, Megumi; Nishiyama, Hisao","Cross-Coupling of Alkynes Catalyzed by Phebox−Rhodium Acetate Complexes","Organometallics","2007","26","25","6412","","10.1021/om700742t","","","0.71073","MoKα","","0.1103","0.085","","","0.1923","0.2045","","","","","","1.11","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073933","21.3901","0.0011","10.2591","0.0004","23.6159","0.0012","90","","111.582","0.001","90","","4819","0.4","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C203 H224 Cl8 O12 P8 Pd4 -","- C203 H224 Cl8 O12 P8 Pd4 -","- C203 H224 Cl8 O12 P8 Pd4 -","1","0.5","","Rubio, Miguel; Suárez, Andrés; Álvarez, Eleuterio; Bianchini, Claudio; Oberhauser, Werner; Peruzzini, Maurizio; Pizzano, Antonio","Asymmetric Hydroformylation of Olefins with Rh Catalysts Modified with Chiral Phosphine−Phosphite Ligands","Organometallics","2007","26","25","6428","","10.1021/om700744b","","","0.71073","MoKα","","0.1042","0.0646","","","0.1575","0.1823","","","","","","1.037","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073934","10.4905","0.0006","14.6466","0.0009","18.4648","0.0011","101.028","0.002","96.166","0.002","92.38","0.002","2763","0.3","100","2","100","2","","","","","","","","6","P 1","P 1","1","","","","- C123 H140 Cl4 O6 P4 Pd2 -","- C123 H140 Cl4 O6 P4 Pd2 -","- C123 H140 Cl4 O6 P4 Pd2 -","1","1","","Rubio, Miguel; Suárez, Andrés; Álvarez, Eleuterio; Bianchini, Claudio; Oberhauser, Werner; Peruzzini, Maurizio; Pizzano, Antonio","Asymmetric Hydroformylation of Olefins with Rh Catalysts Modified with Chiral Phosphine−Phosphite Ligands","Organometallics","2007","26","25","6428","","10.1021/om700744b","","","0.71073","MoKα","","0.0586","0.0447","","","0.1056","0.1115","","","","","","0.99","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073935","11.4772","0.0018","13.186","0.002","16.507","0.003","84.376","0.003","82.862","0.003","88.43","0.003","2466.6","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H76 B N3 Os P2 -","- C52 H76 B N3 Os P2 -","- C104 H152 B2 N6 Os2 P4 -","2","1","","Baya, Miguel; Eguillor, Beatriz; Esteruelas, Miguel A.; Oliván, Montserrat; Oñate, Enrique","Influence of the Anion of the Salt Used on the Coordination Mode of an N-Heterocyclic Carbene Ligand to Osmium","Organometallics","2007","26","26","6556","","10.1021/om700746h","","","0.71073","MoKα","","0.0837","0.0481","","","0.0732","0.0806","","","","","","0.752","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073936","8.664","0.003","11.597","0.004","16.999","0.005","89.303","0.005","86.032","0.006","86.22","0.006","1700.1","1","105","2","105","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H46 Br Cl2 N6 Os P -","- C30 H46 Br Cl2 N6 Os P -","- C60 H92 Br2 Cl4 N12 Os2 P2 -","2","1","","Baya, Miguel; Eguillor, Beatriz; Esteruelas, Miguel A.; Oliván, Montserrat; Oñate, Enrique","Influence of the Anion of the Salt Used on the Coordination Mode of an N-Heterocyclic Carbene Ligand to Osmium","Organometallics","2007","26","26","6556","","10.1021/om700746h","","","0.71073","MoKα","","0.0967","0.062","","","0.1236","0.1369","","","","","","0.995","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073937","14.805","0.002","17.604","0.002","18.045","0.003","90","","90","","90","","4703","1.1","200","2","200","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C46 H57 Au Ir O2 P S2 Zr -","- C46 H48 Au Ir O2 P S2 Zr -","- C184 H192 Au4 Ir4 O8 P4 S8 Zr4 -","4","1","","Hernandez-Gruel, Marc A. F.; Dobrinovitch, Isabel T.; Lahoz, Fernando J.; Oro, Luis A.; Pérez-Torrente, Jesús J.","The Anions [Cptt2Zr(μ-S)2M(CO)2]-(M = Rh, Ir) as Versatile Precursors for the Synthesis of Sulfido-Bridged Early−Late Heterotrimetallic (ELHT) Compounds†","Organometallics","2007","26","25","6437","","10.1021/om700749n","","","0.71073","MoKα","","0.0658","0.0439","","","0.0748","0.0808","","","","","","1.012","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073938","10.344","0.0007","38.998","0.003","13.9883","0.0009","90","","96.252","0.001","90","","5609.3","0.7","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H72 Au2 P2 S2 Zr -","- C62 H72 Au2 P2 S2 Zr -","- C248 H288 Au8 P8 S8 Zr4 -","4","1","","Hernandez-Gruel, Marc A. F.; Dobrinovitch, Isabel T.; Lahoz, Fernando J.; Oro, Luis A.; Pérez-Torrente, Jesús J.","The Anions [Cptt2Zr(μ-S)2M(CO)2]-(M = Rh, Ir) as Versatile Precursors for the Synthesis of Sulfido-Bridged Early−Late Heterotrimetallic (ELHT) Compounds†","Organometallics","2007","26","25","6437","","10.1021/om700749n","","","0.71073","MoKα","","0.0643","0.0439","","","0.0561","0.0594","","","","","","0.917","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073939","10.417","0.002","10.43","0.002","14.391","0.003","76.58","0.03","88.85","0.03","88.39","0.03","1520.1","0.6","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H48 Si8 -","- C16 H48 Si8 -","- C32 H96 Si16 -","2","1","","Wagner, Harald; Wallner, Andreas; Fischer, Jelena; Flock, Michaela; Baumgartner, Judith; Marschner, Christoph","Rearrangement of Cyclic Silanes with Aluminum Trichloride","Organometallics","2007","26","27","6704","","10.1021/om7007524","","","0.71073","MoKα","","0.0425","0.0378","","","0.1004","0.1048","","","","","","0.993","","","","has coordinates","273129","2022-02-23","10:11:33",""
"4073940","10.106","0.002","22.497","0.005","30.43","0.006","90","","90","","90","","6918","2","200","2","200","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C18 H54 Si9 -","- C18 H54 Si9 -","- C144 H432 Si72 -","8","1","","Wagner, Harald; Wallner, Andreas; Fischer, Jelena; Flock, Michaela; Baumgartner, Judith; Marschner, Christoph","Rearrangement of Cyclic Silanes with Aluminum Trichloride","Organometallics","2007","26","27","6704","","10.1021/om7007524","","","0.71073","MoKα","","0.0906","0.0763","","","0.1595","0.1656","","","","","","1.295","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073941","19.235","0.004","12.713","0.003","10.285","0.002","90","","118.53","0.03","90","","2209.6","1","100","2","100","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- C24 H72 Si12 -","- C24 H72 Si12 -","- C48 H144 Si24 -","2","0.25","","Wagner, Harald; Wallner, Andreas; Fischer, Jelena; Flock, Michaela; Baumgartner, Judith; Marschner, Christoph","Rearrangement of Cyclic Silanes with Aluminum Trichloride","Organometallics","2007","26","27","6704","","10.1021/om7007524","","","0.71073","MoKα","","0.0638","0.0573","","","0.1552","0.1592","","","","","","1.115","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073942","16.458","0.003","10.881","0.002","16.485","0.003","90","","117.18","0.03","90","","2626.1","1.1","100","2","100","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C14 H42 Si7 -","- C14 H42 Si7 -","- C56 H168 Si28 -","4","1","","Wagner, Harald; Wallner, Andreas; Fischer, Jelena; Flock, Michaela; Baumgartner, Judith; Marschner, Christoph","Rearrangement of Cyclic Silanes with Aluminum Trichloride","Organometallics","2007","26","27","6704","","10.1021/om7007524","","","0.71073","MoKα","","0.0701","0.0561","","","0.1113","0.1181","","","","","","1.037","","","","has coordinates","273129","2022-02-23","10:11:33",""
"4073943","9.4757","0.0019","12.848","0.003","16.166","0.003","85.29","0.03","88.57","0.03","74.54","0.03","1890.5","0.7","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H60 Si10 -","- C20 H60 Si10 -","- C40 H120 Si20 -","2","1","","Wagner, Harald; Wallner, Andreas; Fischer, Jelena; Flock, Michaela; Baumgartner, Judith; Marschner, Christoph","Rearrangement of Cyclic Silanes with Aluminum Trichloride","Organometallics","2007","26","27","6704","","10.1021/om7007524","","","0.71073","MoKα","","0.1336","0.1084","","","0.2404","0.2557","","","","","","1.217","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073944","9.426","0.0019","17.381","0.006","25.2","0.005","90","","92.44","0.03","90","","4124.9","1.8","100","2","100","2","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C22 H66 Si11 -","- C22 H66 Si11 -","- C88 H264 Si44 -","4","1","","Wagner, Harald; Wallner, Andreas; Fischer, Jelena; Flock, Michaela; Baumgartner, Judith; Marschner, Christoph","Rearrangement of Cyclic Silanes with Aluminum Trichloride","Organometallics","2007","26","27","6704","","10.1021/om7007524","","","0.71073","MoKα","","0.1812","0.1543","","","0.3345","0.3548","","","","","","1.135","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073945","9.214","0.0018","14.738","0.003","16.797","0.003","88.72","0.03","84.71","0.03","76.88","0.03","2212","0.8","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H72 Si12 -","- C24 H72 Si12 -","- C48 H144 Si24 -","2","1","","Wagner, Harald; Wallner, Andreas; Fischer, Jelena; Flock, Michaela; Baumgartner, Judith; Marschner, Christoph","Rearrangement of Cyclic Silanes with Aluminum Trichloride","Organometallics","2007","26","27","6704","","10.1021/om7007524","","","0.71073","MoKα","","0.1282","0.1174","","","0.2436","0.249","","","","","","1.309","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073946","9.6203","0.0019","31.999","0.006","14.645","0.003","90","","98.75","0.03","90","","4455.8","1.6","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H72 Si12 -","- C24 H72 Si12 -","- C96 H288 Si48 -","4","1","","Wagner, Harald; Wallner, Andreas; Fischer, Jelena; Flock, Michaela; Baumgartner, Judith; Marschner, Christoph","Rearrangement of Cyclic Silanes with Aluminum Trichloride","Organometallics","2007","26","27","6704","","10.1021/om7007524","","","0.71073","MoKα","","0.2063","0.1954","","","0.4092","0.4155","","","","","","1.28","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073947","9.91","0.002","15.866","0.003","17.13","0.003","76.2","0.03","78.64","0.03","72.26","0.03","2468.7","0.9","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C26 H78 Si13 -","- C26 H78 Si13 -","- C52 H156 Si26 -","2","1","","Wagner, Harald; Wallner, Andreas; Fischer, Jelena; Flock, Michaela; Baumgartner, Judith; Marschner, Christoph","Rearrangement of Cyclic Silanes with Aluminum Trichloride","Organometallics","2007","26","27","6704","","10.1021/om7007524","","","0.71073","MoKα","","0.1845","0.0875","","","0.1649","0.2028","","","","","","0.967","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073948","38.585","0.008","9.6279","0.0019","29.84","0.006","90","","107.39","0.03","90","","10579","4","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C28 H84 Si14 -","- C28 H84 Si14 -","- C224 H672 Si112 -","8","1","","Wagner, Harald; Wallner, Andreas; Fischer, Jelena; Flock, Michaela; Baumgartner, Judith; Marschner, Christoph","Rearrangement of Cyclic Silanes with Aluminum Trichloride","Organometallics","2007","26","27","6704","","10.1021/om7007524","","","0.71073","MoKα","","0.1397","0.1055","","","0.1851","0.1978","","","","","","1.27","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073949","14.9471","0.0007","10.1197","0.0004","64.853","0.003","90","","90.138","0.001","90","","9809.6","0.8","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C44 H60 Br4 N6 O2 Pd2 -","- C44 H60 Br4 N6 O2 Pd2 -","- C352 H480 Br32 N48 O16 Pd16 -","8","1","","Han, Yuan; Huynh, Han Vinh; Tan, Geok Kheng","Syntheses and Characterizations of Pd(II) Complexes Incorporating aN-Heterocyclic Carbene and AromaticN-Heterocycles","Organometallics","2007","26","25","6447","","10.1021/om700753d","","","0.71073","MoKα","","0.096","0.0788","","","0.1699","0.1762","","","","","","1.184","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073950","14.9211","0.0008","9.9826","0.0006","16.1261","0.0009","90","","116.725","0.001","90","","2145.4","0.2","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H48 Br4 N6 Pd2 -","- C38 H48 Br4 N6 Pd2 -","- C76 H96 Br8 N12 Pd4 -","2","0.5","","Han, Yuan; Huynh, Han Vinh; Tan, Geok Kheng","Syntheses and Characterizations of Pd(II) Complexes Incorporating aN-Heterocyclic Carbene and AromaticN-Heterocycles","Organometallics","2007","26","25","6447","","10.1021/om700753d","","","0.71073","MoKα","","0.0432","0.0312","","","0.0688","0.0731","","","","","","1.018","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073951","16.99","0.004","24.792","0.006","9.693","0.002","90","","90","","90","","4082.8","1.6","223","2","223","2","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C18 H23 Br2 N3 Pd -","- C18 H23 Br2 N3 Pd -","- C144 H184 Br16 N24 Pd8 -","8","1","","Han, Yuan; Huynh, Han Vinh; Tan, Geok Kheng","Syntheses and Characterizations of Pd(II) Complexes Incorporating aN-Heterocyclic Carbene and AromaticN-Heterocycles","Organometallics","2007","26","25","6447","","10.1021/om700753d","","","0.71073","MoKα","","0.0346","0.0298","","","0.073","0.0756","","","","","","1.033","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073952","10.7877","0.0002","11.6261","0.0003","25.8717","0.0007","90","","98.831","0.005","90","","3206.33","0.14","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H45 N5 Ti -","- C34 H45 N5 Ti -","- C136 H180 N20 Ti4 -","4","1","","Vujkovic, Nadia; Ward, Benjamin D.; Maisse-François, Aline; Wadepohl, Hubert; Mountford, Philip; Gade, Lutz H.","Imido-Alkyne Coupling in Titanium Complexes: New Insights into the Alkyne Hydroamination Reaction","Organometallics","2007","26","23","5522","","10.1021/om700758v","","","0.71073","Mo-Kα","","0.11","0.087","","0.209","","0.101","","","1.238","","","1.009","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073953","10.637","0.002","22.176","0.004","11.572","0.002","90","","91.32","0.03","90","","2728.9","0.9","100","2","100","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H41 N5 Ti -","- C29 H41 N5 Ti -","- C116 H164 N20 Ti4 -","4","1","","Vujkovic, Nadia; Ward, Benjamin D.; Maisse-François, Aline; Wadepohl, Hubert; Mountford, Philip; Gade, Lutz H.","Imido-Alkyne Coupling in Titanium Complexes: New Insights into the Alkyne Hydroamination Reaction","Organometallics","2007","26","23","5522","","10.1021/om700758v","","","0.71073","MoKα","","0.0823","0.0561","","0.1605","0.1411","0.1605","","","","","","0.9674","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073954","8.65","0.006","20.362","0.013","17.777","0.011","90","","93.924","0.014","90","","3124","4","100","2","100","2","","","","","","","Synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H43 N5 Ti -","- C34 H43 N5 Ti -","- C136 H172 N20 Ti4 -","4","1","","Vujkovic, Nadia; Ward, Benjamin D.; Maisse-François, Aline; Wadepohl, Hubert; Mountford, Philip; Gade, Lutz H.","Imido-Alkyne Coupling in Titanium Complexes: New Insights into the Alkyne Hydroamination Reaction","Organometallics","2007","26","23","5522","","10.1021/om700758v","","","0.71073","MoKα","","0.0825","0.0564","","0.1553","0.1268","0.1553","","","","","","0.8625","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073955","30.081","0.006","13.029","0.003","21.53","0.004","90","","102.73","0.03","90","","8231","3","100","2","100","2","","","","","","","synthesis as described","4","C 1 2/c 1","-C 2yc","15","","","","- C45 H50 N4 Ti -","- C45 H50 N4 Ti -","- C360 H400 N32 Ti8 -","8","1","","Vujkovic, Nadia; Ward, Benjamin D.; Maisse-François, Aline; Wadepohl, Hubert; Mountford, Philip; Gade, Lutz H.","Imido-Alkyne Coupling in Titanium Complexes: New Insights into the Alkyne Hydroamination Reaction","Organometallics","2007","26","23","5522","","10.1021/om700758v","","","0.71073","MoKα","","0.1227","0.0995","","0.2367","0.2296","0.2367","","","","","","1.0351","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073956","31.3967","0.0018","12.6357","0.0008","22.2022","0.0013","90","","114.867","0.001","90","","7991.4","0.8","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C47 H54 N4 Ti -","- C47 H54 N4 Ti -","- C376 H432 N32 Ti8 -","8","1","","Vujkovic, Nadia; Ward, Benjamin D.; Maisse-François, Aline; Wadepohl, Hubert; Mountford, Philip; Gade, Lutz H.","Imido-Alkyne Coupling in Titanium Complexes: New Insights into the Alkyne Hydroamination Reaction","Organometallics","2007","26","23","5522","","10.1021/om700758v","","x-ray","0.71073","MoKα","","0.0791","0.0499","","","0.133","0.1477","","","","","","1.087","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073957","12.9196","0.0007","15.5471","0.0009","19.9986","0.0011","90","","90","","90","","4017","0.4","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C44 H28 Fe O10 Os3 P2 -","- C44 H28 Fe O10 Os3 P2 -","- C176 H112 Fe4 O40 Os12 P8 -","4","1","","Begum, Noorjahan; Das, Uttam K.; Hassan, Manzur; Hogarth, Graeme; Kabir, Shariff E.; Nordlander, Ebbe; Rahman, Mohammad A.; Tocher, Derek A.","Chelate and Bridge Diphosphine Isomerization: Triosmium and Triruthenium Clusters Containing 1,1‘-Bis(diphenylphosphino)ferrocene (dppf)","Organometallics","2007","26","25","6462","","10.1021/om700759z","","","0.71073","MoKα","","0.0199","0.0194","","","0.0424","0.0426","","","","","","1.082","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073958","16.3658","0.0009","16.2298","0.0009","18.0422","0.001","90","","90","","90","","4792.3","0.5","150","2","150","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C46 H32 Cl4 Fe O10 Os3 P2 -","- C46 H32 Cl4 Fe O10 Os3 P2 -","- C184 H128 Cl16 Fe4 O40 Os12 P8 -","4","0.5","","Begum, Noorjahan; Das, Uttam K.; Hassan, Manzur; Hogarth, Graeme; Kabir, Shariff E.; Nordlander, Ebbe; Rahman, Mohammad A.; Tocher, Derek A.","Chelate and Bridge Diphosphine Isomerization: Triosmium and Triruthenium Clusters Containing 1,1‘-Bis(diphenylphosphino)ferrocene (dppf)","Organometallics","2007","26","25","6462","","10.1021/om700759z","","","0.71073","MoKα","","0.0327","0.0296","","","0.0666","0.0683","","","","","","1.013","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073959","19.9197","0.0015","11.6063","0.0008","21.4376","0.0016","90","","108.091","0.001","90","","4711.2","0.6","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H30 Fe O10 P2 Ru3 -","- C42 H28 Fe O10 P2 Ru3 -","- C168 H112 Fe4 O40 P8 Ru12 -","4","1","","Begum, Noorjahan; Das, Uttam K.; Hassan, Manzur; Hogarth, Graeme; Kabir, Shariff E.; Nordlander, Ebbe; Rahman, Mohammad A.; Tocher, Derek A.","Chelate and Bridge Diphosphine Isomerization: Triosmium and Triruthenium Clusters Containing 1,1‘-Bis(diphenylphosphino)ferrocene (dppf)","Organometallics","2007","26","25","6462","","10.1021/om700759z","","","0.71073","MoKα","","0.0632","0.0546","","","0.1503","0.1558","","","","","","1.113","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073960","19.6709","0.0012","11.8123","0.0007","21.0066","0.0013","90","","105.971","0.001","90","","4692.7","0.5","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H37 Fe O8 Os3 P2 -","- C45 H37 Fe O8 Os3 P2 -","- C180 H148 Fe4 O32 Os12 P8 -","4","1","","Begum, Noorjahan; Das, Uttam K.; Hassan, Manzur; Hogarth, Graeme; Kabir, Shariff E.; Nordlander, Ebbe; Rahman, Mohammad A.; Tocher, Derek A.","Chelate and Bridge Diphosphine Isomerization: Triosmium and Triruthenium Clusters Containing 1,1‘-Bis(diphenylphosphino)ferrocene (dppf)","Organometallics","2007","26","25","6462","","10.1021/om700759z","","","0.71073","MoKα","","0.0323","0.0278","","","0.0704","0.0725","","","","","","1.013","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073961","13.017","0.004","19.538","0.006","16.406","0.005","90","","99.544","0.005","90","","4115","2","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H22 Mo O10 P2 -","- C16 H22 Mo O10 P2 -","- C128 H176 Mo8 O80 P16 -","8","2","","Darensbourg, Donald J.; Andreatta, Jeremy R.; Stranahan, Sarah M.; Reibenspies, Joseph H.","What is the Real Steric Impact of Triphenylphosphite? Solid-State and Solution Structural Studies ofcis- andtrans-Isomers of M(CO)4[P(OPh)3]2(M = Mo and W)","Organometallics","2007","26","27","6832","","10.1021/om700761q","","","0.71073","MoKα","","0.0986","0.0772","","","0.1656","0.1896","","","","","","1.039","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073962","11.198","","16.033","","11.737","","90","","118.04","","90","","1859.88","","110","2","110","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C40 H30 Mo O10 P2 -","- C40 H30 Mo O10 P2 -","- C80 H60 Mo2 O20 P4 -","2","1","","Darensbourg, Donald J.; Andreatta, Jeremy R.; Stranahan, Sarah M.; Reibenspies, Joseph H.","What is the Real Steric Impact of Triphenylphosphite? Solid-State and Solution Structural Studies ofcis- andtrans-Isomers of M(CO)4[P(OPh)3]2(M = Mo and W)","Organometallics","2007","26","27","6832","","10.1021/om700761q","","","0.71073","MoKα","","0.049","0.0457","","","0.112","0.118","","","","","","1.137","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073963","9.505","0.004","11.103","0.004","11.161","0.004","105.927","0.006","94.806","0.006","98.846","0.006","1109.3","0.7","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H15 Mo O8 P -","- C23 H15 Mo O8 P -","- C46 H30 Mo2 O16 P2 -","2","1","","Darensbourg, Donald J.; Andreatta, Jeremy R.; Stranahan, Sarah M.; Reibenspies, Joseph H.","What is the Real Steric Impact of Triphenylphosphite? Solid-State and Solution Structural Studies ofcis- andtrans-Isomers of M(CO)4[P(OPh)3]2(M = Mo and W)","Organometallics","2007","26","27","6832","","10.1021/om700761q","","","0.71073","MoKα","","0.0503","0.0488","","","0.123","0.125","","","","","","1.069","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073964","8.484","","9.623","","12.11","","74.83","","75","","76.93","","908.309","","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H15 Mo0.5 O5 P -","- C20 H15 Mo0.5 O5 P -","- C40 H30 Mo O10 P2 -","2","1","","Darensbourg, Donald J.; Andreatta, Jeremy R.; Stranahan, Sarah M.; Reibenspies, Joseph H.","What is the Real Steric Impact of Triphenylphosphite? Solid-State and Solution Structural Studies ofcis- andtrans-Isomers of M(CO)4[P(OPh)3]2(M = Mo and W)","Organometallics","2007","26","27","6832","","10.1021/om700761q","","","0.71073","MoKα","","0.0554","0.0475","","","0.116","0.1199","","","","","","1.131","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073965","9.17","","11.151","","11.375","","69.75","","89.76","","68.3","","1003.65","","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C20.5 H15.5 Cl1.5 O5 P W0.5 -","- C20.5 H15.5 Cl1.5 O5 P W0.5 -","- C41 H31 Cl3 O10 P2 W -","2","1","","Darensbourg, Donald J.; Andreatta, Jeremy R.; Stranahan, Sarah M.; Reibenspies, Joseph H.","What is the Real Steric Impact of Triphenylphosphite? Solid-State and Solution Structural Studies ofcis- andtrans-Isomers of M(CO)4[P(OPh)3]2(M = Mo and W)","Organometallics","2007","26","27","6832","","10.1021/om700761q","","","0.71073","MoKα","","0.02","0.02","","","0.049","0.049","","","","","","1.069","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4073966","18.366","0.0018","14.5829","0.0015","19.565","0.002","90","","90","","90","","5240.1","0.9","110","2","110","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C54 H48 N2 O14 P2 W2 -","- C54 H52 N2 O14 P2 W2 -","- C216 H208 N8 O56 P8 W8 -","4","0.5","","Darensbourg, Donald J.; Andreatta, Jeremy R.; Stranahan, Sarah M.; Reibenspies, Joseph H.","What is the Real Steric Impact of Triphenylphosphite? Solid-State and Solution Structural Studies ofcis- andtrans-Isomers of M(CO)4[P(OPh)3]2(M = Mo and W)","Organometallics","2007","26","27","6832","","10.1021/om700761q","","","0.71073","MoKα","","0.0569","0.0504","","","0.1237","0.1345","","","","","","1.084","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073967","9.86","0.004","14.171","0.005","18.738","0.007","98.619","0.006","102.019","0.006","93.095","0.006","2522","1.7","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H38 N4 W -","- C24 H38 N4 W -","- C96 H152 N16 W4 -","4","2","","Lavoie, Nathalie; Ong, Tiow-Gan; Gorelsky, Serge I.; Korobkov, Ilia; Yap, Glenn P. A.; Richeson, Darrin S.","Bis(imido) W(VI) Complexes Chelated by N,N′-Disubstituted 1,8-Diamidonaphthalene: An Analysis of Bonding, Isocyanate Insertion, and Al-Me Transfer","Organometallics","2007","26","26","6586","","10.1021/om700763v","","","0.71073","MoKα","","0.0436","0.0363","","","0.0893","0.0949","","","","","","1.009","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073968","10.7269","0.0014","17.284","0.003","18.857","0.003","67.839","0.008","74.348","0.009","76.871","0.015","3086.9","0.9","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H45 N5 O W -","- C32 H45 N5 O W -","- C128 H180 N20 O4 W4 -","4","2","","Lavoie, Nathalie; Ong, Tiow-Gan; Gorelsky, Serge I.; Korobkov, Ilia; Yap, Glenn P. A.; Richeson, Darrin S.","Bis(imido) W(VI) Complexes Chelated by N,N′-Disubstituted 1,8-Diamidonaphthalene: An Analysis of Bonding, Isocyanate Insertion, and Al-Me Transfer","Organometallics","2007","26","26","6586","","10.1021/om700763v","","","0.71073","MoKα","","0.0682","0.0456","","","0.0857","0.094","","","","","","1","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073969","18.09","0.003","10.2206","0.0014","22.508","0.003","90","","110.758","0.002","90","","3891.4","1","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H49 N5 O W -","- C42 H49 N5 O W -","- C168 H196 N20 O4 W4 -","4","1","","Lavoie, Nathalie; Ong, Tiow-Gan; Gorelsky, Serge I.; Korobkov, Ilia; Yap, Glenn P. A.; Richeson, Darrin S.","Bis(imido) W(VI) Complexes Chelated by N,N′-Disubstituted 1,8-Diamidonaphthalene: An Analysis of Bonding, Isocyanate Insertion, and Al-Me Transfer","Organometallics","2007","26","26","6586","","10.1021/om700763v","","","0.71073","MoKα","","0.0725","0.0428","","","0.0885","0.0987","","","","","","1.07","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073970","9.248","0.004","21.027","0.009","15.445","0.007","90","","101.544","0.007","90","","2943","2","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H47 Al N4 W -","- C27 H47 Al N4 W -","- C108 H188 Al4 N16 W4 -","4","1","","Lavoie, Nathalie; Ong, Tiow-Gan; Gorelsky, Serge I.; Korobkov, Ilia; Yap, Glenn P. A.; Richeson, Darrin S.","Bis(imido) W(VI) Complexes Chelated by N,N′-Disubstituted 1,8-Diamidonaphthalene: An Analysis of Bonding, Isocyanate Insertion, and Al-Me Transfer","Organometallics","2007","26","26","6586","","10.1021/om700763v","","","0.71073","MoKα","","0.0433","0.0339","","","0.1043","0.1127","","","","","","1.015","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073971","10.6792","0.0018","11.713","0.002","15.218","0.003","84.744","0.003","78.196","0.003","75.125","0.003","1799.3","0.6","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H51 Al N4 W -","- C37 H51 Al N4 W -","- C74 H102 Al2 N8 W2 -","2","1","","Lavoie, Nathalie; Ong, Tiow-Gan; Gorelsky, Serge I.; Korobkov, Ilia; Yap, Glenn P. A.; Richeson, Darrin S.","Bis(imido) W(VI) Complexes Chelated by N,N′-Disubstituted 1,8-Diamidonaphthalene: An Analysis of Bonding, Isocyanate Insertion, and Al-Me Transfer","Organometallics","2007","26","26","6586","","10.1021/om700763v","","","0.71073","MoKα","","0.0312","0.027","","","0.0736","0.0758","","","","","","1.013","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073972","14.873","0.008","11.336","0.005","17.234","0.008","90","","93.618","0.019","90","","2900","2","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C26 H28 Cl6 N4 Pd -","- C26 H28 Cl6 N4 Pd -","- C104 H112 Cl24 N16 Pd4 -","4","1","","Burns, Christopher T.; Jordan, Richard F.","Ethylene Polymerization by Sterically Crowded Palladium(II) Complexes that Contain Bis(heterocycle)methane Ligands","Organometallics","2007","26","27","6737","","10.1021/om700768j","","","0.71073","MoKα","","0.0291","0.0286","","","0.0709","0.0713","","","","","","1.035","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073973","9.397","0.002","9.948","0.002","19.007","0.004","85.413","0.004","86.325","0.004","85.283","0.004","1762.1","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H34 Cl8 N2 Pd -","- C32.178 H34.02 Cl7.95 N2 Pd -","- C64.356 H68.04 Cl15.9 N4 Pd2 -","2","1","","Burns, Christopher T.; Jordan, Richard F.","Ethylene Polymerization by Sterically Crowded Palladium(II) Complexes that Contain Bis(heterocycle)methane Ligands","Organometallics","2007","26","27","6737","","10.1021/om700768j","","","0.71073","MoKα","","0.0339","0.0284","","","0.0644","0.0659","","","","","","0.994","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073974","19.916","0.005","8.403","0.002","19.238","0.005","90","","98.87","0.004","90","","3181.1","1.4","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C31 H33 Cl5 N2 Pd -","- C31 H33 Cl5 N2 Pd -","- C124 H132 Cl20 N8 Pd4 -","4","1","","Burns, Christopher T.; Jordan, Richard F.","Ethylene Polymerization by Sterically Crowded Palladium(II) Complexes that Contain Bis(heterocycle)methane Ligands","Organometallics","2007","26","27","6737","","10.1021/om700768j","","","0.71073","MoKα","","0.0236","0.0233","","","0.0527","0.0528","","","","","","1.027","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073975","15.494","0.003","13.882","0.003","21.23","0.003","90","","113.31","0.011","90","","4193.6","1.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40.5 H38 Cl9.5 N2 Pd -","- C40.5 H38 Cl9.5 N2 Pd -","- C162 H152 Cl38 N8 Pd4 -","4","1","","Burns, Christopher T.; Jordan, Richard F.","Ethylene Polymerization by Sterically Crowded Palladium(II) Complexes that Contain Bis(heterocycle)methane Ligands","Organometallics","2007","26","27","6737","","10.1021/om700768j","","","0.71073","MoKα","","0.0631","0.0596","","","0.1524","0.1548","","","","","","1.156","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073976","13.379","0.002","18.531","0.003","20.735","0.004","114.939","0.003","103.056","0.003","92.893","0.003","4478.7","1.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H39 Cl11 N4 Pd Si -","- C35 H39 Cl11 N4 Pd Si -","- C140 H156 Cl44 N16 Pd4 Si4 -","4","2","","Conley, Matthew P.; Burns, Christopher T.; Jordan, Richard F.","Mechanism of Ethylene Oligomerization by a Cationic Palladium(II) Alkyl Complex that Contains a (3,5-Me2-pyrazolyl)2CHSi(p-tolyl)3) Ligand","Organometallics","2007","26","27","6750","6759","10.1021/om7007698","","","0.71073","MoKα","","0.0538","0.0479","","","0.1135","0.1171","","","","","","1.084","","","","has coordinates","209823","2020-10-21","18:00:00",""
"4073977","15.782","","18.16","","9.047","","90","","103.98","","90","","2516.08","","293","2","293","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C22 H25 B Cl2 F4 N2 O2 Ru -","- C22 H25 B Cl2 F4 N2 O2 Ru -","- C88 H100 B4 Cl8 F16 N8 O8 Ru4 -","4","2","","Zuccaccia, Daniele; Foresti, Elisabetta; Pettirossi, Stefania; Sabatino, Piera; Zuccaccia, Cristiano; Macchioni, Alceo","From Ion Pairs to Ion Triples through a Hydrogen Bonding-Driven Aggregative Process","Organometallics","2007","26","25","6099","","10.1021/om700775u","","","0.71073","MoKα","","0.0667","0.0488","","","0.1303","0.1394","","","","","","1.214","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073978","10.24","0.005","18.724","0.005","22.536","0.005","75.787","0.005","77.618","0.005","80.571","0.005","4063","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C94.5 H95 B2 Cl N4 O6 Ru2 -","- C94.5 H95 B2 Cl N4 O6 Ru2 -","- C189 H190 B4 Cl2 N8 O12 Ru4 -","2","1","","Zuccaccia, Daniele; Foresti, Elisabetta; Pettirossi, Stefania; Sabatino, Piera; Zuccaccia, Cristiano; Macchioni, Alceo","From Ion Pairs to Ion Triples through a Hydrogen Bonding-Driven Aggregative Process","Organometallics","2007","26","25","6099","","10.1021/om700775u","","","0.71069","MoKα","","0.058","0.0463","","","0.1632","0.1488","","","","","","1.149","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073979","13.9899","0.0014","10.9587","0.0011","16.061","0.0016","90","","115.815","0.001","90","","2216.6","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H33 I O P2 Pt -","- C17 H33 I O P2 Pt -","- C68 H132 I4 O4 P8 Pt4 -","4","1","","Leontyeva, Lyudmila; Hughes, Russell P.; Rheingold, Arnold L.","An Unusual Migratory Insertion of CO into a Pentamethylcyclopentadienyl−Platinum Bond","Organometallics","2007","26","23","5735","","10.1021/om700777p","","","0.71073","MoKα","","0.0197","0.0182","","","0.0426","0.0431","","","","","","1.044","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073980","17.693","0.004","12.837","0.003","20.962","0.004","90","","112.64","0.03","90","","4394.1","1.9","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C51 H55 N3 O2 P2 Ru -","- C51 H53 N3 O2 P2 Ru -","- C204 H212 N12 O8 P8 Ru4 -","4","1","","Li, Tianshu; Bergner, Ines; Haque, F. Nipa; Zimmer-De Iuliis, Marco; Song, Datong; Morris, Robert H.","Hydrogenation of Benzonitrile to Benzylamine Catalyzed by Ruthenium Hydride Complexes with P−NH−NH−P Tetradentate Ligands: Evidence for a Hydridic−Protonic Outer Sphere Mechanism","Organometallics","2007","26","24","5940","","10.1021/om700783e","","","0.71073","MoKα","","0.1087","0.0557","","","0.124","0.1469","","","","","","1.03","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073981","10.163","0.002","15.129","0.003","24.273","0.005","99.54","0.03","98.42","0.03","104.56","0.03","3492.5","1.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H43 B N2 P2 Ru -","- C40 H43 B N2 P2 Ru -","- C160 H172 B4 N8 P8 Ru4 -","4","2","","Li, Tianshu; Bergner, Ines; Haque, F. Nipa; Zimmer-De Iuliis, Marco; Song, Datong; Morris, Robert H.","Hydrogenation of Benzonitrile to Benzylamine Catalyzed by Ruthenium Hydride Complexes with P−NH−NH−P Tetradentate Ligands: Evidence for a Hydridic−Protonic Outer Sphere Mechanism","Organometallics","2007","26","24","5940","","10.1021/om700783e","","","0.71073","MoKα","","0.1808","0.0733","","","0.1051","0.1328","","","","","","1.014","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073982","9.8721","0.0007","10.2072","0.0007","12.0467","0.0008","105.168","0.006","108.919","0.005","95.834","0.006","1084.96","0.14","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C21.5 H21 Cl3 N P Pt -","- C21.5 H21 Cl3 N P Pt -","- C43 H42 Cl6 N2 P2 Pt2 -","2","1","","Dugal-Tessier, Julien; Dake, Gregory R.; Gates, Derek P.","P,N-Chelate Complexes of Pd(II) and Pt(II) Based on a Phosphaalkene Motif: A Catalyst for the Overman−Claisen Rearrangement","Organometallics","2007","26","25","6481","","10.1021/om700784x","","","0.71073","MoKα","","0.0285","0.0259","","","0.0653","0.0662","","","","","","1.09","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4073983","9.865","0.0003","11.7091","0.0004","12.5723","0.0005","86.292","0.001","88.685","0.001","69.904","0.001","1360.96","0.08","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H24 Cl6 N P Pd -","- C23 H24 Cl6 N P Pd -","- C46 H48 Cl12 N2 P2 Pd2 -","2","1","","Dugal-Tessier, Julien; Dake, Gregory R.; Gates, Derek P.","P,N-Chelate Complexes of Pd(II) and Pt(II) Based on a Phosphaalkene Motif: A Catalyst for the Overman−Claisen Rearrangement","Organometallics","2007","26","25","6481","","10.1021/om700784x","","","0.71073","MoKα","","0.0519","0.0373","","","0.0993","0.1062","","","","","","1.067","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073984","15.968","0.003","12.0901","0.0019","17.509","0.003","90","","104.801","0.004","90","","3268","1","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H47 Cl O2 S2 Ti -","- C31 H47 Cl O2 S2 Ti -","- C124 H188 Cl4 O8 S8 Ti4 -","4","1","","Lian, Bing; Spaniol, Thomas P.; Okuda, Jun","Titanium Ester Enolate Complex Supported by a Tetradentate Bis(phenolato) Ligand: Synthesis, Structure, and Activity in Methacrylate Polymerization","Organometallics","2007","26","26","6653","","10.1021/om700785c","","","0.71073","MoKα","","0.0792","0.0534","","","0.131","0.1473","","","","","","1.083","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073985","10.093","0.0011","15.7694","0.0016","25.037","0.002","90","","100.761","0.003","90","","3914.8","0.7","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H60 O4 S2 Ti -","- C38 H60 O4 S2 Ti -","- C152 H240 O16 S8 Ti4 -","4","1","","Lian, Bing; Spaniol, Thomas P.; Okuda, Jun","Titanium Ester Enolate Complex Supported by a Tetradentate Bis(phenolato) Ligand: Synthesis, Structure, and Activity in Methacrylate Polymerization","Organometallics","2007","26","26","6653","","10.1021/om700785c","","","0.71073","MoKα","","0.1227","0.0651","","","0.1335","0.1689","","","","","","0.958","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073986","10.8126","0.001","13.3683","0.0012","16.3273","0.0015","105.48","0.0015","94.0812","0.0016","94.0877","0.0016","2258.6","0.4","243","2","243","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H66 O5 S2 Ti -","- C41 H66 O5 S2 Ti -","- C82 H132 O10 S4 Ti2 -","2","1","","Lian, Bing; Spaniol, Thomas P.; Okuda, Jun","Titanium Ester Enolate Complex Supported by a Tetradentate Bis(phenolato) Ligand: Synthesis, Structure, and Activity in Methacrylate Polymerization","Organometallics","2007","26","26","6653","","10.1021/om700785c","","","0.71073","MoKα","","0.1117","0.0521","","","0.1091","0.1229","","","","","","0.8","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073987","8.9014","0.0002","16.2671","0.0003","14.7419","0.0003","90","","94.751","0.001","90","","2127.29","0.08","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H19 O8 P Re2 -","- C16 H19 O8 P Re2 -","- C64 H76 O32 P4 Re8 -","4","1","","Adams, Richard D.; Captain, Burjor; Pellechia, Perry J.","Studies of Ligand Additions to Coordinatively Unsaturated Dirhenium Complexes Containing the Bulky PBut3Ligand","Organometallics","2007","26","26","6564","","10.1021/om700790c","","","0.71073","MoKα","","0.0273","0.0208","","","0.0457","0.0484","","","","","","1.034","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073988","9.1219","0.0002","12.8748","0.0003","12.9356","0.0003","91.103","0.001","99.36","0.001","95.35","0.001","1491.52","0.06","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H38 O7 P2 Re2 -","- C23 H38 O7 P2 Re2 -","- C46 H76 O14 P4 Re4 -","2","1","","Adams, Richard D.; Captain, Burjor; Pellechia, Perry J.","Studies of Ligand Additions to Coordinatively Unsaturated Dirhenium Complexes Containing the Bulky PBut3Ligand","Organometallics","2007","26","26","6564","","10.1021/om700790c","","","0.71073","MoKα","","0.0317","0.024","","","0.0569","0.0705","","","","","","1.085","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073989","8.0633","0.0005","29.2329","0.0017","8.4785","0.0005","90","","106.308","0.001","90","","1918.1","0.2","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H28 O4 P Re -","- C16 H28 O4 P Re -","- C64 H112 O16 P4 Re4 -","4","1","","Adams, Richard D.; Captain, Burjor; Pellechia, Perry J.","Studies of Ligand Additions to Coordinatively Unsaturated Dirhenium Complexes Containing the Bulky PBut3Ligand","Organometallics","2007","26","26","6564","","10.1021/om700790c","","","0.71073","MoKα","","0.0478","0.0332","","","0.0805","0.0953","","","","","","1.091","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073990","21.1976","0.001","17.2257","0.0008","8.8901","0.0004","90","","90","","90","","3246.2","0.3","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C26 H46 O6 P2 Re2 -","- C26 H46 O6 P2 Re2 -","- C104 H184 O24 P8 Re8 -","4","1","","Adams, Richard D.; Captain, Burjor; Pellechia, Perry J.","Studies of Ligand Additions to Coordinatively Unsaturated Dirhenium Complexes Containing the Bulky PBut3Ligand","Organometallics","2007","26","26","6564","","10.1021/om700790c","","","0.71073","MoKα","","0.0334","0.0279","","","0.0626","0.0722","","","","","","1.078","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073991","51.0915","0.0017","8.7205","0.0003","19.8896","0.0007","90","","97.067","0.001","90","","8794.4","0.5","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H65 O6 P3 Re2 -","- C33 H65 O6 P3 Re2 -","- C264 H520 O48 P24 Re16 -","8","1","","Adams, Richard D.; Captain, Burjor; Pellechia, Perry J.","Studies of Ligand Additions to Coordinatively Unsaturated Dirhenium Complexes Containing the Bulky PBut3Ligand","Organometallics","2007","26","26","6564","","10.1021/om700790c","","","0.71073","MoKα","","0.0718","0.0458","","","0.1274","0.1459","","","","","","1.034","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073992","16.4619","0.0004","11.8441","0.0003","16.9897","0.0004","90","","93.057","0.001","90","","3307.88","0.14","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H46 O7 P2 Re2 -","- C27 H46 O7 P2 Re2 -","- C108 H184 O28 P8 Re8 -","4","1","","Adams, Richard D.; Captain, Burjor; Pellechia, Perry J.","Studies of Ligand Additions to Coordinatively Unsaturated Dirhenium Complexes Containing the Bulky PBut3Ligand","Organometallics","2007","26","26","6564","","10.1021/om700790c","","","0.71073","MoKα","","0.0254","0.0217","","","0.0539","0.0596","","","","","","1.061","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073993","11.0279","0.0004","29.6026","0.001","10.7886","0.0003","90","","105.577","0.001","90","","3392.63","0.19","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H49 N O6 P2 Re2 -","- C28 H49 N O6 P2 Re2 -","- C112 H196 N4 O24 P8 Re8 -","4","1","","Adams, Richard D.; Captain, Burjor; Pellechia, Perry J.","Studies of Ligand Additions to Coordinatively Unsaturated Dirhenium Complexes Containing the Bulky PBut3Ligand","Organometallics","2007","26","26","6564","","10.1021/om700790c","","","0.71073","MoKα","","0.0288","0.0227","","","0.0532","0.0618","","","","","","1.101","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073994","11.8592","0.0003","11.2504","0.0003","14.1065","0.0004","90","","94.708","0.001","90","","1875.75","0.09","294","2","294","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C33 H51 N O6 P2 Re2 -","- C33 H51 N O6 P2 Re2 -","- C66 H102 N2 O12 P4 Re4 -","2","1","","Adams, Richard D.; Captain, Burjor; Pellechia, Perry J.","Studies of Ligand Additions to Coordinatively Unsaturated Dirhenium Complexes Containing the Bulky PBut3Ligand","Organometallics","2007","26","26","6564","","10.1021/om700790c","","","0.71073","MoKα","","0.0184","0.0174","","","0.0387","0.0487","","","","","","1.055","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073995","19.3906","0.0007","12.4072","0.0005","17.2721","0.0008","90","","91.314","0.001","90","","4154.3","0.3","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H65 O7 P3 Re2 -","- C34 H65 O7 P3 Re2 -","- C136 H260 O28 P12 Re8 -","4","1","","Adams, Richard D.; Captain, Burjor; Pellechia, Perry J.","Studies of Ligand Additions to Coordinatively Unsaturated Dirhenium Complexes Containing the Bulky PBut3Ligand","Organometallics","2007","26","26","6564","","10.1021/om700790c","","","0.71073","MoKα","","0.0571","0.049","","","0.1141","0.1185","","","","","","1.298","","","","has coordinates,has disorder","178628","2020-10-21","18:00:00",""
"4073996","20.6064","0.0011","15.2933","0.0008","11.5848","0.0006","90","","111.056","0.001","90","","3407.1","0.3","563","2","563","2","","","","","","","","7","C 1 m 1","C -2y","8","","","","- C50 H74 B3 Cl5 F12 N6 Ru4 -","- C50 H74 B3 Cl5 F12 N6 Ru4 -","- C100 H148 B6 Cl10 F24 N12 Ru8 -","2","0.5","","Viciano, Mónica; Sanaú, Mercedes; Peris, Eduardo","Ruthenium Janus-Head Complexes with a Triazolediylidene Ligand. Structural Features and Catalytic Applications","Organometallics","2007","26","24","6050","","10.1021/om7007919","","","0.71073","MoKα","","0.072","0.0501","","","0.1397","0.1535","","","","","","1.048","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073997","10.11","0.002","26.266","0.005","16.681","0.003","90","","94.084","0.004","90","","4418.4","1.5","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H62 B O4 Sc -","- C52 H62 B O4 Sc -","- C208 H248 B4 O16 Sc4 -","4","1","","Zeimentz, Peter M.; Okuda, Jun","Cationic Aryl Complexes of the Rare-Earth Metals","Organometallics","2007","26","25","6388","","10.1021/om7007953","","","0.71073","MoKα","","0.0827","0.0744","","","0.1793","0.1847","","","","","","1.221","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073998","12.3689","0.0015","13.8132","0.0016","41.361","0.005","90","","90","","90","","7066.7","1.5","130","","130","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C82 H101 B2 Lu O7 -","- C82 H101 B2 Lu O7 -","- C328 H404 B8 Lu4 O28 -","4","1","","Zeimentz, Peter M.; Okuda, Jun","Cationic Aryl Complexes of the Rare-Earth Metals","Organometallics","2007","26","25","6388","","10.1021/om7007953","","","0.71073","MoKα","","0.1024","0.0692","","","0.145","0.1555","","","","","","1.019","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4073999","8.5471","0.001","9.8544","0.0011","11.1205","0.0012","77.363","0.012","72.171","0.012","80.161","0.013","864.6","0.18","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 O3 Si -","- C18 H22 O3 Si -","- C36 H44 O6 Si2 -","2","1","","Popp, Friedrich; Nätscher, Jennifer B.; Daiss, Jürgen O.; Burschka, Christian; Tacke, Reinhold","The 2,4,6-Trimethoxyphenyl Unit as a Unique Protecting Group for Silicon in Synthesis and the Silylation Potential of (2,4,6-Trimethoxyphenyl)silanes","Organometallics","2007","26","24","6014","","10.1021/om700805p","","","0.71073","MoKα","","0.0428","0.0357","","","0.096","0.0994","","","","","","1.068","","","","has coordinates","178628","2020-10-21","18:00:00",""
"4074000","8.299","0.0017","14.67","0.003","15.057","0.003","86.34","0.03","85.94","0.03","81.1","0.03","1803.9","0.7","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H24 O3 Si -","- C19 H24 O3 Si -","- C76 H96 O12 Si4 -","4","2","","Popp, Friedrich; Nätscher, Jennifer B.; Daiss, Jürgen O.; Burschka, Christian; Tacke, Reinhold","The 2,4,6-Trimethoxyphenyl Unit as a Unique Protecting Group for Silicon in Synthesis and the Silylation Potential of (2,4,6-Trimethoxyphenyl)silanes","Organometallics","2007","26","24","6014","","10.1021/om700805p","","","0.71073","MoKα","","0.0731","0.0448","","","0.113","0.1238","","","","","","1.006","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074001","7.6734","0.0015","32.416","0.007","8.3543","0.0017","90","","94.62","0.03","90","","2071.3","0.7","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 O3 Si -","- C22 H30 O3 Si -","- C88 H120 O12 Si4 -","4","1","","Popp, Friedrich; Nätscher, Jennifer B.; Daiss, Jürgen O.; Burschka, Christian; Tacke, Reinhold","The 2,4,6-Trimethoxyphenyl Unit as a Unique Protecting Group for Silicon in Synthesis and the Silylation Potential of (2,4,6-Trimethoxyphenyl)silanes","Organometallics","2007","26","24","6014","","10.1021/om700805p","","","0.71073","MoKα","","0.0544","0.0436","","","0.1166","0.1243","","","","","","1.057","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074002","7.0858","0.0014","9.863","0.002","16.141","0.003","82.83","0.03","78.3","0.03","89.25","0.03","1095.9","0.4","183","2","183","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H28 Si -","- C28 H28 Si -","- C56 H56 Si2 -","2","1","","Popp, Friedrich; Nätscher, Jennifer B.; Daiss, Jürgen O.; Burschka, Christian; Tacke, Reinhold","The 2,4,6-Trimethoxyphenyl Unit as a Unique Protecting Group for Silicon in Synthesis and the Silylation Potential of (2,4,6-Trimethoxyphenyl)silanes","Organometallics","2007","26","24","6014","","10.1021/om700805p","","","0.71073","MoKα","","0.0504","0.0399","","","0.104","0.1102","","","","","","1.024","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074003","8.5002","0.0017","11.474","0.002","11.703","0.002","83.47","0.03","85.03","0.03","74.21","0.03","1089.4","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H25 Cl O5 Si -","- C23 H25 Cl O5 Si -","- C46 H50 Cl2 O10 Si2 -","2","1","","Popp, Friedrich; Nätscher, Jennifer B.; Daiss, Jürgen O.; Burschka, Christian; Tacke, Reinhold","The 2,4,6-Trimethoxyphenyl Unit as a Unique Protecting Group for Silicon in Synthesis and the Silylation Potential of (2,4,6-Trimethoxyphenyl)silanes","Organometallics","2007","26","24","6014","","10.1021/om700805p","","","0.71073","MoKα","","0.0527","0.0406","","","0.1","0.1048","","","","","","1.043","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074004","9.231","0.0003","9.7276","0.0003","11.8768","0.0004","105.505","0.002","99.266","0.001","104.773","0.001","963.17","0.06","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H21 Cl O3 Si -","- C21 H21 Cl O3 Si -","- C42 H42 Cl2 O6 Si2 -","2","1","","Popp, Friedrich; Nätscher, Jennifer B.; Daiss, Jürgen O.; Burschka, Christian; Tacke, Reinhold","The 2,4,6-Trimethoxyphenyl Unit as a Unique Protecting Group for Silicon in Synthesis and the Silylation Potential of (2,4,6-Trimethoxyphenyl)silanes","Organometallics","2007","26","24","6014","","10.1021/om700805p","","","0.71073","MoKα","","0.0422","0.0386","","","0.1023","0.1049","","","","","","1.041","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074005","9.4546","0.0008","7.1925","0.0004","19.9374","0.0016","90","","91.829","0.01","90","","1355.1","0.18","173","2","173","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C12 H20 O3 Si -","- C12 H20 O3 Si -","- C48 H80 O12 Si4 -","4","1","","Popp, Friedrich; Nätscher, Jennifer B.; Daiss, Jürgen O.; Burschka, Christian; Tacke, Reinhold","The 2,4,6-Trimethoxyphenyl Unit as a Unique Protecting Group for Silicon in Synthesis and the Silylation Potential of (2,4,6-Trimethoxyphenyl)silanes","Organometallics","2007","26","24","6014","","10.1021/om700805p","","","0.71073","MoKα","","0.0626","0.0425","","","0.1046","0.1162","","","","","","1.047","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074006","14.9422","0.0015","26.233","0.0016","40.473","0.003","90","","90","","90","","15865","2","173","2","173","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C22 H24 O3 Si -","- C22 H24 O3 Si -","- C704 H768 O96 Si32 -","32","1","","Popp, Friedrich; Nätscher, Jennifer B.; Daiss, Jürgen O.; Burschka, Christian; Tacke, Reinhold","The 2,4,6-Trimethoxyphenyl Unit as a Unique Protecting Group for Silicon in Synthesis and the Silylation Potential of (2,4,6-Trimethoxyphenyl)silanes","Organometallics","2007","26","24","6014","","10.1021/om700805p","","","0.71073","MoKα","","0.0464","0.0375","","","0.1023","0.1074","","","","","","1.031","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074007","7.6076","0.0015","8.4671","0.0017","14.298","0.003","101.62","0.03","97.54","0.03","112.84","0.03","808.7","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H26 O3 Si -","- C15 H26 O3 Si -","- C30 H52 O6 Si2 -","2","1","","Popp, Friedrich; Nätscher, Jennifer B.; Daiss, Jürgen O.; Burschka, Christian; Tacke, Reinhold","The 2,4,6-Trimethoxyphenyl Unit as a Unique Protecting Group for Silicon in Synthesis and the Silylation Potential of (2,4,6-Trimethoxyphenyl)silanes","Organometallics","2007","26","24","6014","","10.1021/om700805p","","","0.71073","MoKα","","0.048","0.0409","","","0.0986","0.103","","","","","","1.049","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074008","18.0227","0.001","18.0227","0.001","11.2255","0.0008","90","","90","","90","","3646.2","0.4","293","2","293","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C36 H42 Fe2 N2 O6 Pd2 -","- C36 H42 Fe2 N2 O6 Pd2 -","- C144 H168 Fe8 N8 O24 Pd8 -","4","0.5","","Xia, Ji-Bao; You, Shu-Li","Carbon−Carbon Bond Formation through Double sp2C−H Activations: Synthesis of Ferrocenyl Oxazoline Derivatives","Organometallics","2007","26","20","4869","","10.1021/om700806e","","","0.71073","MoKα","","0.0413","0.0335","","","0.0571","0.0591","","","","","","0.89","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074009","9.0821","0.0008","10.9265","0.0009","12.4005","0.0012","71.806","0.006","76.42","0.006","88.703","0.006","1134.65","0.18","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","N-(9-bromo-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-yliden-N'- 2-hydroxybenzylidene)azinium nitrate methanol solvate","","- C24 H22 Br N5 O5 -","- C24 H22 Br N5 O5 -","- C48 H44 Br2 N10 O10 -","2","1","","Schmid, Wolfgang F.; John, Roland O.; Arion, Vladimir B.; Jakupec, Michael A.; Keppler, Bernhard K.","Highly Antiproliferative Ruthenium(II) and Osmium(II) Arene Complexes with Paullone-Derived Ligands","Organometallics","2007","26","26","6643","","10.1021/om700813c","","","0.71073","MoKα","","0.0448","0.032","","","0.0757","0.0803","","","","","","1.015","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074010","11.0237","0.0009","11.0373","0.0007","13.7107","0.0011","90","","90.076","0.006","90","","1668.2","0.2","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","(hapto^6^-p-Cymene)[N-(9-bromo-7,12-dihydroindolo[3,2-d][1]benzazepin- kappaN-6-yl)-N'-kappaN-(2-hydroxybenzylidene)azine]chlororuthenium(II) chloride ethanol solvate","","- C35 H37 Br Cl2 N4 O2 Ru -","- C35 H37 Br Cl2 N4 O2 Ru -","- C70 H74 Br2 Cl4 N8 O4 Ru2 -","2","1","","Schmid, Wolfgang F.; John, Roland O.; Arion, Vladimir B.; Jakupec, Michael A.; Keppler, Bernhard K.","Highly Antiproliferative Ruthenium(II) and Osmium(II) Arene Complexes with Paullone-Derived Ligands","Organometallics","2007","26","26","6643","","10.1021/om700813c","","","0.71073","MoKα","","0.0493","0.0355","","","0.0629","0.0672","","","","","","1.019","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074011","11.092","0.001","11.1604","0.0008","13.9373","0.0011","90","","90.296","0.006","90","","1725.3","0.2","296","2","296","2","","","","","","","","7","P 1 21 1","P 2yb","4","","(hapto^6^-p-Cymene)[N-(9-bromo-7,12-dihydroindolo[3,2-d][1]benzazepin- kappaN-6-yl)-N'-kappaN-(2-hydroxybenzylidene)azine]chloroosmium(II) chloride ethanol solvate","","- C35 H37 Br Cl2 N4 O2 Os -","- C35 H37 Br Cl2 N4 O2 Os -","- C70 H74 Br2 Cl4 N8 O4 Os2 -","2","1","","Schmid, Wolfgang F.; John, Roland O.; Arion, Vladimir B.; Jakupec, Michael A.; Keppler, Bernhard K.","Highly Antiproliferative Ruthenium(II) and Osmium(II) Arene Complexes with Paullone-Derived Ligands","Organometallics","2007","26","26","6643","","10.1021/om700813c","","","0.71073","MoKα","","0.095","0.0508","","","0.0787","0.0923","","","","","","0.959","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074012","13.1551","0.0007","16.7459","0.0009","19.1476","0.0009","81.092","0.003","83.527","0.003","72.158","0.004","3957.2","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","(hapto^6^-p-Cymene)[N-(9-bromo-7,12-dihydroindolo[3,2-d][1]benzazepin- kappaN-6-yl)-N'-kappaN-(3-hydroxy-5-(hydroxymethyl)-2-methyl-pyridin- 4-yl-methylene)azine]chloroosmium(II) acetone water solvate","","- C77 H88.2 Br2 Cl4 N10 O8.1 Os2 -","- C77 H86 Br2 Cl4 N10 O8.1 Os2 -","- C154 H172 Br4 Cl8 N20 O16.2 Os4 -","2","1","","Schmid, Wolfgang F.; John, Roland O.; Arion, Vladimir B.; Jakupec, Michael A.; Keppler, Bernhard K.","Highly Antiproliferative Ruthenium(II) and Osmium(II) Arene Complexes with Paullone-Derived Ligands","Organometallics","2007","26","26","6643","","10.1021/om700813c","","","0.71073","MoKα","","0.0584","0.0375","","","0.0872","0.0928","","","","","","1.071","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4074013","14.729","0.004","20.074","0.005","6.2507","0.0016","90","","90","","90","","1848.1","0.8","173","2","173","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C20 H18 N4 Pt -","- C20 H18 N4 Pt -","- C80 H72 N16 Pt4 -","4","0.5","","Dylla, Anthony G.; Janzen, Daron E.; Pomije, Marie K.; Mann, Kent R.","A Comparison of Isomers: trans- andcis-Dicyanobis(para-ethylisocyanobenzene)Platinum","Organometallics","2007","26","25","6243","","10.1021/om7008167","","","0.71073","MoKα","","0.0616","0.0407","","","0.0944","0.1007","","","","","","1.056","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074014","17.6524","0.0008","19.7974","0.0007","14.4264","0.0006","90","","112.199","0.001","90","","4667.9","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H52 Cu F6 N10 P -","- C45 H52 Cu F6 N10 P -","- C180 H208 Cu4 F24 N40 P4 -","4","1","","Rodríguez, Pilar; Álvarez, Eleuterio; Nicasio, M. Carmen; Pérez, Pedro J.","Catalytic Carbon−Hydrogen Bond Functionalization in an Ionic Liquid Medium","Organometallics","2007","26","26","6661","","10.1021/om700822a","","","0.71073","MoKα","","0.0872","0.0532","","","0.1292","0.1481","","","","","","1.023","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074015","17.598","0.0009","17.1666","0.0008","10.4896","0.0005","90","","90","","90","","3168.9","0.3","100","2","100","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C37 H40 N6 -","- C37 H40 N6 -","- C148 H160 N24 -","4","1","","Rodríguez, Pilar; Álvarez, Eleuterio; Nicasio, M. Carmen; Pérez, Pedro J.","Catalytic Carbon−Hydrogen Bond Functionalization in an Ionic Liquid Medium","Organometallics","2007","26","26","6661","","10.1021/om700822a","","","0.71073","MoKα","","0.0606","0.0369","","","0.0771","0.0881","","","","","","1.067","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4074016","8.2398","0.0009","11.7664","0.0014","17.0887","0.0018","75.768","0.003","79.294","0.003","85.418","0.003","1577","0.3","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C37 H40 N6 -","- C37 H40 N6 -","- C74 H80 N12 -","2","1","","Rodríguez, Pilar; Álvarez, Eleuterio; Nicasio, M. Carmen; Pérez, Pedro J.","Catalytic Carbon−Hydrogen Bond Functionalization in an Ionic Liquid Medium","Organometallics","2007","26","26","6661","","10.1021/om700822a","","","0.71073","MoKα","","0.0724","0.0525","","","0.1379","0.1574","","","","","","1.022","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4074017","11.302","0.0013","11.7003","0.0013","31.275","0.004","82.957","0.003","81.382","0.003","77.863","0.003","3979.8","0.8","133","2","133","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H62.5 N Nb O0.25 P2 Si2 -","- C35 H62.5 N Nb O0.25 P2 Si2 -","- C140 H250 N4 Nb4 O P8 Si8 -","4","2","","Kilgore, Uriah J.; Tomaszewski, John; Fan, Hongjun; Huffman, John C.; Mindiola, Daniel J.","Niobium Bis-alkylidene Complexes Prepared by a Multi-Electron Redox Process","Organometallics","2007","26","25","6132","","10.1021/om7008233","","","0.71073","MoKα","","0.0582","0.0365","","","0.0921","0.1008","","","","","","0.983","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4074018","10.73","0.004","11.655","0.004","16.206","0.006","102.553","0.009","104.791","0.009","103.862","0.008","1816.8","1.2","138","2","138","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H60 N Nb P2 -","- C36 H60 N Nb P2 -","- C72 H120 N2 Nb2 P4 -","2","1","","Kilgore, Uriah J.; Tomaszewski, John; Fan, Hongjun; Huffman, John C.; Mindiola, Daniel J.","Niobium Bis-alkylidene Complexes Prepared by a Multi-Electron Redox Process","Organometallics","2007","26","25","6132","","10.1021/om7008233","","","0.71073","MoKα","","0.0854","0.0502","","","0.104","0.1137","","","","","","0.905","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074019","9.797","0.002","16.224","0.003","21.789","0.004","90","","101.02","0.03","90","","3399.4","1.2","128","2","128","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H50 Cl N Nb P2 Si -","- C30 H50 Cl N Nb P2 Si -","- C120 H200 Cl4 N4 Nb4 P8 Si4 -","4","1","","Kilgore, Uriah J.; Tomaszewski, John; Fan, Hongjun; Huffman, John C.; Mindiola, Daniel J.","Niobium Bis-alkylidene Complexes Prepared by a Multi-Electron Redox Process","Organometallics","2007","26","25","6132","","10.1021/om7008233","","","0.71073","MoKα","","0.0458","0.0374","","","0.1028","0.1078","","","","","","1.04","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074020","18.198","0.0007","11.9925","0.0005","20.5405","0.0008","90","","112.547","0.001","90","","4140.1","0.3","295","2","295","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C50 H42 Cl N2 O P2 Rh -","- C50 H42 Cl N2 O P2 Rh -","- C200 H168 Cl4 N8 O4 P8 Rh4 -","4","1","","Baksi, Suparna; Acharyya, Rama; Basuli, Falguni; Peng, Shie-Ming; Lee, Gene-Hsiang; Nethaji, Munirathinam; Bhattacharya, Samaresh","Rhodium-Mediated C‒C Bond Activation of 2-(2′,6′-Dialkylarylazo)-4-methylphenols. Elimination and Migration of Alkyl Groups","Organometallics","2007","26","26","6596","","10.1021/om700826t","","","0.71073","MoKα","","0.0705","0.0565","","","0.1192","0.1282","","","","","","1.182","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074021","15.887","0.005","12.016","0.004","25.41","0.009","90","","100.139","0.007","90","","4775","3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C55 H52 Cl N2 O P2 Rh -","- C55 H52 Cl N2 O P2 Rh -","- C220 H208 Cl4 N8 O4 P8 Rh4 -","4","1","","Baksi, Suparna; Acharyya, Rama; Basuli, Falguni; Peng, Shie-Ming; Lee, Gene-Hsiang; Nethaji, Munirathinam; Bhattacharya, Samaresh","Rhodium-Mediated C‒C Bond Activation of 2-(2′,6′-Dialkylarylazo)-4-methylphenols. Elimination and Migration of Alkyl Groups","Organometallics","2007","26","26","6596","","10.1021/om700826t","","","0.71073","MoKα","","0.2075","0.075","","","0.1541","0.2113","","","","","","0.885","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074022","18.463","0.01","12.007","0.007","20.898","0.012","90","","92.519","0.01","90","","4628","5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C51 H44 Cl N O P2 Rh -","- C51 H44 Cl N2 O P2 Rh -","- C204 H176 Cl4 N8 O4 P8 Rh4 -","4","1","","Baksi, Suparna; Acharyya, Rama; Basuli, Falguni; Peng, Shie-Ming; Lee, Gene-Hsiang; Nethaji, Munirathinam; Bhattacharya, Samaresh","Rhodium-Mediated C‒C Bond Activation of 2-(2′,6′-Dialkylarylazo)-4-methylphenols. Elimination and Migration of Alkyl Groups","Organometallics","2007","26","26","6596","","10.1021/om700826t","","","0.71073","MoKα","","0.2604","0.1199","","","0.2956","0.3744","","","","","","0.98","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4074023","19.751","0.003","10.5371","0.0016","29.873","0.006","90","","104.926","0.003","90","","6007.3","1.8","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Compound 1","","","- C50 H100 Al3 N6 Na3 O2 -","- C50 H100 Al3 N6 Na3 O2 -","- C200 H400 Al12 N24 Na12 O8 -","4","1","","Cortes-Llamas, Sara A.; Muñoz-Hernández, Miguel-Ángel","Sodium Polypyrazolylaluminates: Synthesis, Characterization, and Isolation of a Reaction Intermediate of a Trispyrazolylaluminate","Organometallics","2007","26","27","6844","","10.1021/om700828b","","","0.71073","MoKα","","0.1032","0.0671","","","0.1663","0.1878","","","","","","0.99","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074024","10.2984","0.001","13.0764","0.0013","15.4157","0.0016","102.456","0.002","107.236","0.002","109.556","0.002","1750.3","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","Compound 2","","","- C32 H57 Al N4 Na O -","- C32 H57 Al N4 Na O -","- C64 H114 Al2 N8 Na2 O2 -","2","1","","Cortes-Llamas, Sara A.; Muñoz-Hernández, Miguel-Ángel","Sodium Polypyrazolylaluminates: Synthesis, Characterization, and Isolation of a Reaction Intermediate of a Trispyrazolylaluminate","Organometallics","2007","26","27","6844","","10.1021/om700828b","","","0.71073","MoKα","","0.0858","0.0776","","","0.175","0.1794","","","","","","1.139","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074025","11.3646","0.001","20.8314","0.0018","34.466","0.003","90","","90","","90","","8159.5","1.2","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Compound 3","","","- C38 H68 Al N6 Na O -","- C38 H68 Al N6 Na O -","- C304 H544 Al8 N48 Na8 O8 -","8","1","","Cortes-Llamas, Sara A.; Muñoz-Hernández, Miguel-Ángel","Sodium Polypyrazolylaluminates: Synthesis, Characterization, and Isolation of a Reaction Intermediate of a Trispyrazolylaluminate","Organometallics","2007","26","27","6844","","10.1021/om700828b","","","0.71073","MoKα","","0.0607","0.0463","","","0.1148","0.1249","","","","","","0.946","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074026","9.8013","0.0013","10.5746","0.0014","21.951","0.003","95.412","0.002","99.459","0.002","110.421","0.002","2074.6","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","Compound 4","","","- C77 H136 Al2 N12 Na2 -","- C38.44 H81 Al N6 Na -","- C76.88 H162 Al2 N12 Na2 -","2","1","","Cortes-Llamas, Sara A.; Muñoz-Hernández, Miguel-Ángel","Sodium Polypyrazolylaluminates: Synthesis, Characterization, and Isolation of a Reaction Intermediate of a Trispyrazolylaluminate","Organometallics","2007","26","27","6844","","10.1021/om700828b","","","0.71073","MoKα","","0.0534","0.0481","","","0.1274","0.1313","","","","","","1.075","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4074027","13.5889","0.0004","16.4035","0.0005","18.5564","0.0006","90","","90","","90","","4136.3","0.2","123","2","123","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C41 H67 Al Lu N3 -","- C41 H67 Al Lu N3 -","- C164 H268 Al4 Lu4 N12 -","4","0.5","","Zimmermann, Melanie; Estler, Frank; Herdtweck, Eberhardt; Törnroos, Karl W.; Anwander, Reiner","Distinct C−H Bond Activation Pathways in Diamido-Pyridine-Supported Rare-Earth Metal Hydrocarbyl Complexes","Organometallics","2007","26","24","6029","","10.1021/om700830k","","","0.71073","MoKα","","0.0303","0.0218","","","0.0516","0.0561","","","","","","1.07","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074028","21.1535","0.0013","9.1668","0.0006","18.287","0.0011","90","","101.919","0.001","90","","3469.6","0.4","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C35 H53 Al2 N3 -","- C35 H53 Al2 N3 -","- C140 H212 Al8 N12 -","4","1","","Zimmermann, Melanie; Estler, Frank; Herdtweck, Eberhardt; Törnroos, Karl W.; Anwander, Reiner","Distinct C−H Bond Activation Pathways in Diamido-Pyridine-Supported Rare-Earth Metal Hydrocarbyl Complexes","Organometallics","2007","26","24","6029","","10.1021/om700830k","","","0.71073","MoKα","","0.156","0.0544","","","0.0977","0.1332","","","","","","0.987","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074029","11.2525","0.0005","23.1905","0.0009","15.2776","0.0006","90","","105.627","0.001","90","","3839.3","0.3","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37 H58 Al2 N3 Y -","- C37 H58 Al2 N3 Y -","- C148 H232 Al8 N12 Y4 -","4","1","","Zimmermann, Melanie; Estler, Frank; Herdtweck, Eberhardt; Törnroos, Karl W.; Anwander, Reiner","Distinct C−H Bond Activation Pathways in Diamido-Pyridine-Supported Rare-Earth Metal Hydrocarbyl Complexes","Organometallics","2007","26","24","6029","","10.1021/om700830k","","","0.71073","MoKα","","0.041","0.0272","","","0.0651","0.0708","","","","","","1.028","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074030","10.0267","0.0004","12.5492","0.0004","28.8528","0.001","90","","94.243","0.001","90","","3620.5","0.2","103","2","103","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H57 Al Lu N3 O -","- C38 H57 Al Lu N3 O -","- C152 H228 Al4 Lu4 N12 O4 -","4","1","","Zimmermann, Melanie; Estler, Frank; Herdtweck, Eberhardt; Törnroos, Karl W.; Anwander, Reiner","Distinct C−H Bond Activation Pathways in Diamido-Pyridine-Supported Rare-Earth Metal Hydrocarbyl Complexes","Organometallics","2007","26","24","6029","","10.1021/om700830k","","","0.71073","MoKα","","0.0522","0.0399","","","0.095","0.1018","","","","","","1.042","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074031","19.098","0.0008","17.7147","0.0007","17.284","0.0007","90","","112.208","0.001","90","","5413.7","0.4","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C62 H80 Lu2 N6 -","- C62 H80 Lu2 N6 -","- C248 H320 Lu8 N24 -","4","0.5","","Zimmermann, Melanie; Estler, Frank; Herdtweck, Eberhardt; Törnroos, Karl W.; Anwander, Reiner","Distinct C−H Bond Activation Pathways in Diamido-Pyridine-Supported Rare-Earth Metal Hydrocarbyl Complexes","Organometallics","2007","26","24","6029","","10.1021/om700830k","","","0.71073","MoKα","","0.0283","0.019","","","0.0419","0.0453","","","","","","1.023","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074032","15.0636","0.0007","10.1395","0.0005","17.195","0.0008","90","","96.1692","0.0008","90","","2611.1","0.2","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H40 N P Ru S -","- C27 H40 N P Ru S -","- C108 H160 N4 P4 Ru4 S4 -","4","1","","Wechsler, Dominik; Rankin, Matthew A.; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","New Racemic Planar-Chiral Metalloligands Derived from Donor-Substituted Indenes: A Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","25","6418","","10.1021/om700832f","","","0.71073","MoKα","","0.03","0.0244","","","0.0607","0.0657","","","","","","1.071","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074033","11.5111","0.0008","9.8759","0.0007","22.9793","0.0017","90","","103.242","0.001","90","","2542.9","0.3","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H40 N P Ru -","- C27 H40 N P Ru -","- C108 H160 N4 P4 Ru4 -","4","1","","Wechsler, Dominik; Rankin, Matthew A.; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","New Racemic Planar-Chiral Metalloligands Derived from Donor-Substituted Indenes: A Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","25","6418","","10.1021/om700832f","","","0.71073","MoKα","","0.0252","0.0223","","","0.0588","0.061","","","","","","1.043","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074034","9.688","0.002","15.57","0.004","13.898","0.003","90","","91.494","0.004","90","","2095.7","0.8","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H25 Mn N O3 P S -","- C20 H25 Mn N O3 P S -","- C80 H100 Mn4 N4 O12 P4 S4 -","4","1","","Wechsler, Dominik; Rankin, Matthew A.; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","New Racemic Planar-Chiral Metalloligands Derived from Donor-Substituted Indenes: A Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","25","6418","","10.1021/om700832f","","","0.71073","MoKα","","0.0295","0.0273","","","0.0745","0.0764","","","","","","1.043","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074035","8.228","0.0007","18.737","0.002","20.574","0.0016","79.373","0.005","88.354","0.004","79.595","0.005","3066.2","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H47 Cl P Rh Ru -","- C33.008 H47 Cl P Rh Ru -","- C132.032 H188 Cl4 P4 Rh4 Ru4 -","4","2","","Wechsler, Dominik; Rankin, Matthew A.; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","New Racemic Planar-Chiral Metalloligands Derived from Donor-Substituted Indenes: A Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","25","6418","","10.1021/om700832f","","","0.71073","MoKα","","0.0843","0.0603","","","0.1238","0.1344","","","","","","1.035","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074036","11.452","0.0003","14.895","0.0004","19.789","0.0005","90","","90","","90","","3375.56","0.15","173","2","173","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C35 H52 B F4 Fe N P Rh -","- C35 H52 B F4 Fe N P Rh -","- C140 H208 B4 F16 Fe4 N4 P4 Rh4 -","4","1","","Wechsler, Dominik; Rankin, Matthew A.; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","New Racemic Planar-Chiral Metalloligands Derived from Donor-Substituted Indenes: A Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","25","6418","","10.1021/om700832f","","","0.71073","MoKα","","0.0589","0.0441","","","0.0884","0.0979","","","","","","1.066","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074037","11.5994","0.0012","9.8244","0.001","22.447","0.002","90","","102.364","0.0015","90","","2498.7","0.4","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H40 Fe N P S -","- C27 H40 Fe N P S -","- C108 H160 Fe4 N4 P4 S4 -","4","1","","Wechsler, Dominik; Rankin, Matthew A.; McDonald, Robert; Ferguson, Michael J.; Schatte, Gabriele; Stradiotto, Mark","New Racemic Planar-Chiral Metalloligands Derived from Donor-Substituted Indenes: A Synthetic, Structural, and Catalytic Investigation","Organometallics","2007","26","25","6418","","10.1021/om700832f","","","0.71073","MoKα","","0.0366","0.0314","","","0.0826","0.0865","","","","","","1.032","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074038","9.9222","0.0003","10.008","0.0004","18.5846","0.0008","98.864","0.002","95.544","0.001","118.624","0.0009","1569.38","0.11","100.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H46 O2 Si4 -","- C28 H46 O2 Si4 -","- C56 H92 O4 Si8 -","2","1","","Naka, Akinobu; Fujioka, Nana; Ohshita, Joji; Ikadai, Junnai; Kunai, Atsutaka; Kobayashi, Hisayoshi; Miura, Toshiko; Ishikawa, Mitsuo","Silicon−Carbon Unsaturated Compounds. 72. Thermolysis of Acylpolysilanes with Diphenylketene","Organometallics","2007","26","23","5535","","10.1021/om700838n","","","0.7107","MoKα","","","0.034","","","","0.043","","","","","","0.279","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4074039","10.157","0.003","22.071","0.005","11.089","0.003","90","","102.398","0.005","90","","2427.9","1.1","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C45.25 H43.5 Cl2.5 I2 N3 P2 Pt -","- C45.25 H43.5 Cl2.5 I2 N3 P2 Pt -","- C90.5 H87 Cl5 I4 N6 P4 Pt2 -","2","1","","Brissy, Delphine; Skander, Myriem; Retailleau, Pascal; Marinetti, Angela","N-Heterocyclic Carbenes in the Synthesis of Axially Chiral Square-Planar Platinum Complexes","Organometallics","2007","26","24","5782","","10.1021/om700839y","","","0.71069","MoKα","","0.0888","0.0731","","","0.1929","0.2066","","","","","","1.081","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4074040","10.641","0.001","12.912","0.002","12.076","0.002","90","","92.034","0.003","90","","1658.2","0.4","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C25 H40 Cl2 I2 N2 P2 Pt -","- C25 H40 Cl2 I2 N2 P2 Pt -","- C50 H80 Cl4 I4 N4 P4 Pt2 -","2","1","","Brissy, Delphine; Skander, Myriem; Retailleau, Pascal; Marinetti, Angela","N-Heterocyclic Carbenes in the Synthesis of Axially Chiral Square-Planar Platinum Complexes","Organometallics","2007","26","24","5782","","10.1021/om700839y","","","0.71069","MoKα","","0.0524","0.0383","","","0.075","0.081","","","","","","1.047","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074041","20.337","0.002","29.842","0.003","11.485","0.001","90","","90","","90","","6970.2","1.2","293","2","293","2","","","","","","","","7","C 2 2 21","C 2c 2","20","","","","- C28.48 H39.19 I2 N2 O0.12 P2 Pt -","- C28 H38 I2 N2 P2 Pt -","- C224 H304 I16 N16 P16 Pt8 -","8","1","","Brissy, Delphine; Skander, Myriem; Retailleau, Pascal; Marinetti, Angela","N-Heterocyclic Carbenes in the Synthesis of Axially Chiral Square-Planar Platinum Complexes","Organometallics","2007","26","24","5782","","10.1021/om700839y","","","0.71069","MoKα","","0.041","0.031","","","0.0675","0.0708","","","","","","1.049","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074042","10.2363","0.0012","11.7846","0.0014","12.601","0.0014","86.3078","0.0014","83.192","0.0014","72.7088","0.0013","1440.5","0.3","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H42 N2 O P2 Zr -","- C27 H42 N2 O P2 Zr -","- C54 H84 N4 O2 P4 Zr2 -","2","1","","Turculet, Laura; McDonald, Robert","Mono-, Di-, and Trinuclear Complexes Featuring the New Bis(phosphido) Ligand 4,5-Bis(tert-butylphosphido)-9,9-dimethylxanthene ([POP]2−)","Organometallics","2007","26","27","6821","","10.1021/om700843n","","","0.71073","MoKα","","0.0285","0.025","","","0.069","0.0728","","","","","","1.058","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074043","12.5425","0.0013","22.708","0.002","11.3647","0.0012","90","","113.609","0.0015","90","","2965.9","0.5","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H40 K2 O2 P2 -","- C27 H40 K2 O2 P2 -","- C108 H160 K8 O8 P8 -","4","1","","Turculet, Laura; McDonald, Robert","Mono-, Di-, and Trinuclear Complexes Featuring the New Bis(phosphido) Ligand 4,5-Bis(tert-butylphosphido)-9,9-dimethylxanthene ([POP]2−)","Organometallics","2007","26","27","6821","","10.1021/om700843n","","","0.71073","MoKα","","0.1076","0.0557","","","0.1285","0.1511","","","","","","1.022","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074044","20.062","0.003","12.504","0.002","21.195","0.004","90","","110.51","0.002","90","","4979.8","1.4","193","2","193","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C47 H76 Cl2 N2 O2 P2 Rh2 Zr -","- C47 H76 Cl2 N2 O2 P2 Rh2 Zr -","- C188 H304 Cl8 N8 O8 P8 Rh8 Zr4 -","4","1","","Turculet, Laura; McDonald, Robert","Mono-, Di-, and Trinuclear Complexes Featuring the New Bis(phosphido) Ligand 4,5-Bis(tert-butylphosphido)-9,9-dimethylxanthene ([POP]2−)","Organometallics","2007","26","27","6821","","10.1021/om700843n","","","0.71073","MoKα","","0.0652","0.0401","","","0.0888","0.1018","","","","","","1.034","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074045","8.7303","0.0016","10.811","0.002","12.557","0.002","72.825","0.004","84.065","0.004","81.242","0.004","1117","0.3","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H23 F6 N2 P Te -","- C23 H23 F6 N2 P Te -","- C46 H46 F12 N4 P2 Te2 -","2","1","","Calitree, Brandon; Donnelly, David J.; Holt, Jason J.; Gannon, Michael K.; Nygren, Cara L.; Sukumaran, Dinesh K.; Autschbach, Jochen; Detty, Michael R.","Tellurium Analogues of Rosamine and Rhodamine Dyes: Synthesis, Structure,125Te NMR, and Heteroatom Contributions to Excitation Energies","Organometallics","2007","26","25","6248","","10.1021/om700846m","","","0.71073","MoKα","","0.0593","0.036","","","0.0787","0.0918","","","","","","1.042","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4074046","11.139","0.002","12.076","0.002","16.788","0.003","90","","95.22","0.03","90","","2248.9","0.7","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C55 H51 N2 P2 Ru -","- C55 H44 N2 P2 Ru -","- C110 H88 N4 P4 Ru2 -","2","1","","Hadzovic, Alen; Song, Datong; MacLaughlin, Christina M.; Morris, Robert H.","A Mechanism Displaying Autocatalysis: The Hydrogenation of Acetophenone Catalyzed by RuH(S-binap)(app) Where app Is the Amido Ligand Derived from 2-Amino-2-(2-pyridyl)propane","Organometallics","2007","26","24","5987","","10.1021/om700849w","","","0.71073","MoKα","","0.0482","0.0431","","","0.1114","0.1156","","","","","","1.07","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074047","13.053","0.003","10.024","0.002","25.586","0.005","90","","98.12","0.003","90","","3314.2","1.2","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H34 B20 Ru2 S6 -","- C14 H34 B20 Ru2 S6 -","- C56 H136 B80 Ru8 S24 -","4","1","","Wu, De-Hong; Xu, Bao-Hua; Li, Yi-Zhi; Yan, Hong","Diruthenium Half-Sandwich Complexes Containing One μ-E2(E = S, Se) Unit and Two Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dithiolate Ligands: Reactivity Studies with Methyl Acetylene Carboxylates","Organometallics","2007","26","25","6300","","10.1021/om7008556","","","0.71073","MoKαdiffrn_radiation_sourcesealedtube","","0.0686","0.0477","","","0.0924","0.0955","","","","","","1.042","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074048","12.078","0.0016","13.0508","0.0018","13.4696","0.0019","106.665","0.002","97.858","0.002","108.704","0.002","1864.4","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H38 B20 O2 Ru2 S6 -","- C18 H38 B20 O2 Ru2 S6 -","- C36 H76 B40 O4 Ru4 S12 -","2","1","","Wu, De-Hong; Xu, Bao-Hua; Li, Yi-Zhi; Yan, Hong","Diruthenium Half-Sandwich Complexes Containing One μ-E2(E = S, Se) Unit and Two Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dithiolate Ligands: Reactivity Studies with Methyl Acetylene Carboxylates","Organometallics","2007","26","25","6300","","10.1021/om7008556","","","0.71073","MoKα","","0.0932","0.0634","","","0.1409","0.147","","","","","","1.039","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074049","13.434","0.003","14.267","0.003","23.072","0.005","90.101","0.004","97.344","0.003","116.697","0.003","3909.5","1.5","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H162 B80 O13 Ru8 S24 -","- C72 H162 B80 O13 Ru8 S24 -","- C72 H162 B80 O13 Ru8 S24 -","1","0.5","","Wu, De-Hong; Xu, Bao-Hua; Li, Yi-Zhi; Yan, Hong","Diruthenium Half-Sandwich Complexes Containing One μ-E2(E = S, Se) Unit and Two Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dithiolate Ligands: Reactivity Studies with Methyl Acetylene Carboxylates","Organometallics","2007","26","25","6300","","10.1021/om7008556","","","0.71073","MoKα","","0.0971","0.0683","","","0.143","0.1491","","","","","","1.074","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074050","10.5166","0.0016","20.192","0.003","19.339","0.003","90","","98.882","0.003","90","","4057.4","1.1","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H82 B40 O9 Ru4 S12 -","- C40 H82 B40 O9 Ru4 S12 -","- C80 H164 B80 O18 Ru8 S24 -","2","0.5","","Wu, De-Hong; Xu, Bao-Hua; Li, Yi-Zhi; Yan, Hong","Diruthenium Half-Sandwich Complexes Containing One μ-E2(E = S, Se) Unit and Two Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dithiolate Ligands: Reactivity Studies with Methyl Acetylene Carboxylates","Organometallics","2007","26","25","6300","","10.1021/om7008556","","","0.71073","MoKα","","0.0698","0.0477","","","0.0972","0.1016","","","","","","1.011","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074051","11.8523","0.0016","12.0728","0.0016","13.9244","0.0019","86.559","0.002","85.718","0.002","68.181","0.002","1843.4","0.4","291","2","291","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H38 B20 O2 Ru2 S4 Se2 -","- C18 H38 B20 O2 Ru2 S4 Se2 -","- C36 H76 B40 O4 Ru4 S8 Se4 -","2","1","","Wu, De-Hong; Xu, Bao-Hua; Li, Yi-Zhi; Yan, Hong","Diruthenium Half-Sandwich Complexes Containing One μ-E2(E = S, Se) Unit and Two Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dithiolate Ligands: Reactivity Studies with Methyl Acetylene Carboxylates","Organometallics","2007","26","25","6300","","10.1021/om7008556","","","0.71073","MoKα","","0.0887","0.0604","","","0.1283","0.1344","","","","","","1.071","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4074052","11.274","0.002","22.082","0.005","20.768","0.005","90","","103.722","0.003","90","","5022.7","1.9","291","2","291","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H44 B20 O5 Ru2 S4 Se2 -","- C18 H44 B20 O5 Ru2 S4 Se2 -","- C72 H176 B80 O20 Ru8 S16 Se8 -","4","1","","Wu, De-Hong; Xu, Bao-Hua; Li, Yi-Zhi; Yan, Hong","Diruthenium Half-Sandwich Complexes Containing One μ-E2(E = S, Se) Unit and Two Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dithiolate Ligands: Reactivity Studies with Methyl Acetylene Carboxylates","Organometallics","2007","26","25","6300","","10.1021/om7008556","","","0.71073","MoKα","","0.0653","0.0482","","","0.1142","0.1199","","","","","","1.059","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4074053","12.8264","0.0017","13.6352","0.0017","13.7639","0.0017","92.99","0.002","103.591","0.002","108.031","0.002","2204.5","0.5","291","2","291","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H42 B20 O5 Ru2 S4 Se2 -","- C20 H42 B20 O5 Ru2 S4 Se2 -","- C40 H84 B40 O10 Ru4 S8 Se4 -","2","1","","Wu, De-Hong; Xu, Bao-Hua; Li, Yi-Zhi; Yan, Hong","Diruthenium Half-Sandwich Complexes Containing One μ-E2(E = S, Se) Unit and Two Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dithiolate Ligands: Reactivity Studies with Methyl Acetylene Carboxylates","Organometallics","2007","26","25","6300","","10.1021/om7008556","","","0.71073","MoKα","","0.0769","0.0595","","","0.1286","0.1324","","","","","","1.05","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4074054","10.4897","0.0012","13.5796","0.0017","18.082","0.002","90","","104.939","0.002","90","","2488.7","0.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H30 Cl2 N2 O Pt S -","- C23 H30 Cl2 N2 O Pt S -","- C92 H120 Cl8 N8 O4 Pt4 S4 -","4","1","","Fantasia, Serena; Petersen, Jeffrey L.; Jacobsen, Heiko; Cavallo, Luigi; Nolan, Steven P.","Electronic Properties of N-Heterocyclic Carbene (NHC) Ligands: Synthetic, Structural, and Spectroscopic Studies of (NHC)Platinum(II) Complexes","Organometallics","2007","26","24","5880","","10.1021/om700857j","","","0.71073","MoKα","","0.0678","0.0564","","","0.1496","0.1596","","","","","","1.046","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074055","10.8158","0.001","14.0465","0.0012","17.2816","0.0015","90","","107.298","0.002","90","","2506.7","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H32 Cl2 N2 O Pt S -","- C23 H32 Cl2 N2 O Pt S -","- C92 H128 Cl8 N8 O4 Pt4 S4 -","4","1","","Fantasia, Serena; Petersen, Jeffrey L.; Jacobsen, Heiko; Cavallo, Luigi; Nolan, Steven P.","Electronic Properties of N-Heterocyclic Carbene (NHC) Ligands: Synthetic, Structural, and Spectroscopic Studies of (NHC)Platinum(II) Complexes","Organometallics","2007","26","24","5880","","10.1021/om700857j","","","0.71073","MoKα","","0.0462","0.0407","","","0.1034","0.1084","","","","","","1.046","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074056","29.6172","0.0015","9.6056","0.0005","16.3161","0.0008","90","","90","","90","","4641.8","0.4","100","2","100","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C22 H20 Cl2 N3 O Pt S -","- C22 H20 Cl2 N3 O Pt S -","- C176 H160 Cl16 N24 O8 Pt8 S8 -","8","1","","Fantasia, Serena; Petersen, Jeffrey L.; Jacobsen, Heiko; Cavallo, Luigi; Nolan, Steven P.","Electronic Properties of N-Heterocyclic Carbene (NHC) Ligands: Synthetic, Structural, and Spectroscopic Studies of (NHC)Platinum(II) Complexes","Organometallics","2007","26","24","5880","","10.1021/om700857j","","","0.71073","MoKα","","0.0544","0.0406","","","0.0906","0.0977","","","","","","1.131","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074057","30.5622","0.0009","18.2552","0.0006","22.2579","0.0007","90","","132.751","0.001","90","","9118.7","0.5","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C44 H81 Mo N O2 Si2 -","- C44 H81 Mo N O2 Si2 -","- C352 H648 Mo8 N8 O16 Si16 -","8","1","","Wampler, Keith M.; Schrock, Richard R.; Hock, Adam S.","Synthesis of Molybdenum Imido Alkylidene Complexes That Contain Siloxides","Organometallics","2007","26","26","6674","","10.1021/om700864u","","","0.71073","MoKα","","0.069","0.0425","","","0.0917","0.1044","","","","","","1.016","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074058","12.038","0.002","12.567","0.003","12.897","0.003","81.45","0.03","86.62","0.03","87.79","0.03","1925.2","0.7","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H60 Mo N2 O Si -","- C38 H60 Mo N2 O Si -","- C76 H120 Mo2 N4 O2 Si2 -","2","1","","Wampler, Keith M.; Schrock, Richard R.; Hock, Adam S.","Synthesis of Molybdenum Imido Alkylidene Complexes That Contain Siloxides","Organometallics","2007","26","26","6674","","10.1021/om700864u","","","0.71073","MoKα","","0.0418","0.0352","","","0.0955","0.1021","","","","","","1.055","","","","has coordinates,has disorder","201982","2020-10-21","18:00:00",""
"4074059","10.8524","0.0008","15.9998","0.0011","16.1965","0.0012","90","","97.488","0.002","90","","2788.3","0.3","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H33 I2 N4 O0.5 Pd -","- C24 H33 I2 N4 O0.5 Pd -","- C96 H132 I8 N16 O2 Pd4 -","4","1","","Huynh, Han Vinh; Jothibasu, Ramasamy; Koh, Lip Lin","Dipalladium Bis(μ-isopropylthiolato) Complexes with a [Pd2S2] Core Supported by N-Heterocyclic Carbenes","Organometallics","2007","26","27","6852","","10.1021/om700867e","","","0.71073","MoKα","","0.075","0.0525","","","0.1211","0.1311","","","","","","1.046","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4074060","20.0286","0.0008","10.1606","0.0004","18.8389","0.0008","90","","90","","90","","3833.8","0.3","223","2","223","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C46 H42 N4 O4 Pd -","- C46 H42 N4 O4 Pd -","- C184 H168 N16 O16 Pd4 -","4","0.5","","Huynh, Han Vinh; Jothibasu, Ramasamy; Koh, Lip Lin","Dipalladium Bis(μ-isopropylthiolato) Complexes with a [Pd2S2] Core Supported by N-Heterocyclic Carbenes","Organometallics","2007","26","27","6852","","10.1021/om700867e","","","0.71073","MoKα","","0.0914","0.0855","","","0.158","0.1605","","","","","","1.332","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074061","16.6078","0.0006","15.3151","0.0006","18.868","0.0007","90","","104.095","0.001","90","","4654.6","0.3","223","2","223","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C94 H92 B2 F8 N10 Pd2 S2 -","- C94 H92 B2 F8 N10 Pd2 S2 -","- C188 H184 B4 F16 N20 Pd4 S4 -","2","0.5","","Huynh, Han Vinh; Jothibasu, Ramasamy; Koh, Lip Lin","Dipalladium Bis(μ-isopropylthiolato) Complexes with a [Pd2S2] Core Supported by N-Heterocyclic Carbenes","Organometallics","2007","26","27","6852","","10.1021/om700867e","","","0.71073","MoKα","","0.1178","0.1077","","","0.2501","0.2551","","","","","","1.28","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074062","27.346","0.0011","12.2423","0.0005","18.151","0.0007","90","","97.007","0.001","90","","6031.2","0.4","223","2","223","2","","","","","","","","8","C 1 c 1","C -2yc","9","","","","- C52 H75 B2 F8 N9 O Pd2 S2 -","- C52 H75 B2 F8 N9 O Pd2 S2 -","- C208 H300 B8 F32 N36 O4 Pd8 S8 -","4","1","","Huynh, Han Vinh; Jothibasu, Ramasamy; Koh, Lip Lin","Dipalladium Bis(μ-isopropylthiolato) Complexes with a [Pd2S2] Core Supported by N-Heterocyclic Carbenes","Organometallics","2007","26","27","6852","","10.1021/om700867e","","","0.71073","MoKα","","0.0452","0.0421","","","0.1022","0.1046","","","","","","1.043","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074063","12.269","0.002","18.043","0.003","16.306","0.003","90","","104.454","0.003","90","","3495.4","1","80","2","80","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","1a","","","- C31.5 H39 Cl3 N O5 P Pd S Si -","- C31.5 H39 Cl3 N O5 P Pd S Si -","- C126 H156 Cl12 N4 O20 P4 Pd4 S4 Si4 -","4","1","","Vela, Javier; Lief, Graham R.; Shen, Zhongliang; Jordan, Richard F.","Ethylene Polymerization by Palladium Alkyl Complexes Containing Bis(aryl)phosphino-toluenesulfonate Ligands","Organometallics","2007","26","26","6624","","10.1021/om700869c","","","0.71073","MoKα","","0.0366","0.0325","","","0.0918","0.0936","","","","","","1.023","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074064","10.249","0.002","22.544","0.004","14.59","0.005","90","","127.194","0.019","90","","2685.4","1.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H32 N O3 P Pd S -","- C29 H32 N O3 P Pd S -","- C116 H128 N4 O12 P4 Pd4 S4 -","4","1","","Vela, Javier; Lief, Graham R.; Shen, Zhongliang; Jordan, Richard F.","Ethylene Polymerization by Palladium Alkyl Complexes Containing Bis(aryl)phosphino-toluenesulfonate Ligands","Organometallics","2007","26","26","6624","","10.1021/om700869c","","","0.71073","MoKα","","0.0418","0.0367","","","0.0791","0.0815","","","","","","1.155","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074065","21.021","0.004","23.794","0.005","12.759","0.003","90","","100.44","0.03","90","","6276","2","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","DOMPTS[PdCH2SiMe3]","","","- C26 H32 Cl2 O5 P Pd S Si -","- C26 H32 Cl2.001 O5 P Pd S Si -","- C208 H256 Cl16.008 O40 P8 Pd8 S8 Si8 -","8","1","","Vela, Javier; Lief, Graham R.; Shen, Zhongliang; Jordan, Richard F.","Ethylene Polymerization by Palladium Alkyl Complexes Containing Bis(aryl)phosphino-toluenesulfonate Ligands","Organometallics","2007","26","26","6624","","10.1021/om700869c","","","0.71073","MoKα","","0.0374","0.0361","","","0.0871","0.0881","","","","","","1.082","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074066","12.2105","0.0011","13.822","0.0013","23.156","0.002","90","","104.794","0.002","90","","3778.6","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H46 B2 N2 O2 Sm -","- C42 H46 B2 N2 O2 Sm -","- C168 H184 B8 N8 O8 Sm4 -","4","0.5","","Cui, Peng; Chen, Yaofeng; Zeng, Xiaohua; Sun, Jie; Li, Guangyu; Xia, Wei","Boratabenzene Derivatives of Divalent Samarium: Syntheses, Structures and Catalytic Reactivities of (C5H5BXPh2)2Sm(THF)2(X = N, P)","Organometallics","2007","26","26","6519","","10.1021/om700878a","","","0.71073","MoKα","","0.0528","0.0461","","","0.1173","0.1204","","","","","","1.05","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074067","8.4309","0.0008","16.1377","0.0014","30.901","0.003","90","","94.062","0.002","90","","4193.7","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H50 B2 O2.5 P2 Sm -","- C44 H46 B2 O2.5 P2 Sm -","- C176 H184 B8 O10 P8 Sm4 -","4","1","","Cui, Peng; Chen, Yaofeng; Zeng, Xiaohua; Sun, Jie; Li, Guangyu; Xia, Wei","Boratabenzene Derivatives of Divalent Samarium: Syntheses, Structures and Catalytic Reactivities of (C5H5BXPh2)2Sm(THF)2(X = N, P)","Organometallics","2007","26","26","6519","","10.1021/om700878a","","","0.71073","MoKα","","0.0778","0.0451","","","0.0929","0.1006","","","","","","0.852","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4074068","24.27","0.001","9.386","0.001","16.451","0.001","90","","113.87","0.01","90","","3427","0.5","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H23 Li2 N O2 -","- C18 H23 Li2 N O2 -","- C144 H184 Li16 N8 O16 -","8","1","","Kotov, Vasily V.; Wang, Cun; Kehr, Gerald; Fröhlich, Roland; Erker, Gerhard","Remarkable Dichotomy of Oligomeric Chain Structures of Dilithium(amidoalkyl-cyclopentadienide) Systems Li2[C5H4-CHR-NAr]","Organometallics","2007","26","25","6258","","10.1021/om700885g","","","1.54178","CuKα","","0.0552","0.0492","","","0.1277","0.1334","","","","","","1.005","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074069","12.293","0.001","19.924","0.001","10.208","0.001","90","","107.19","0.01","90","","2388.5","0.4","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H37 Li2 N O3 -","- C25 H37 Li2 N O3 -","- C100 H148 Li8 N4 O12 -","4","1","","Kotov, Vasily V.; Wang, Cun; Kehr, Gerald; Fröhlich, Roland; Erker, Gerhard","Remarkable Dichotomy of Oligomeric Chain Structures of Dilithium(amidoalkyl-cyclopentadienide) Systems Li2[C5H4-CHR-NAr]","Organometallics","2007","26","25","6258","","10.1021/om700885g","","","1.54178","CuKα","","0.0687","0.0602","","","0.1502","0.1581","","","","","","1.052","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074070","12.898","0.003","17.481","0.004","8.2913","0.0017","90","","103.99","0.03","90","","1814","0.7","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H29 Co Si -","- C19 H29 Co Si -","- C76 H116 Co4 Si4 -","4","1","","Chadha, Preeti; Dutton, Jason L.; Sgro, Michael J.; Ragogna, Paul J.","Synthesis of Neutral Mixed Sandwich CH2-SiR2Bridged [2]Cobaltoarenophanes from the Dilithiation of Cb*CoCp [Co(η4-C4Me4)(η5-C5H5)]","Organometallics","2007","26","25","6063","","10.1021/om700900e","","","0.71073","MoKα","","0.0403","0.035","","","0.0955","0.0986","","","","","","1.064","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074071","8.0983","0.0011","8.9558","0.0012","20.885","0.003","87.9573","0.0019","86.5522","0.0018","77.6112","0.0017","1476.4","0.4","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H21 Co Si -","- C15 H21 Co Si -","- C60 H84 Co4 Si4 -","4","2","","Chadha, Preeti; Dutton, Jason L.; Sgro, Michael J.; Ragogna, Paul J.","Synthesis of Neutral Mixed Sandwich CH2-SiR2Bridged [2]Cobaltoarenophanes from the Dilithiation of Cb*CoCp [Co(η4-C4Me4)(η5-C5H5)]","Organometallics","2007","26","25","6063","","10.1021/om700900e","","","0.71073","MoKα","","0.0396","0.036","","","0.1167","0.119","","","","","","1.164","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074072","40.204","0.003","8.5482","0.0006","15.83","0.001","90","","103.744","0.001","90","","5284.6","0.6","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22 H30 B N8 O2 P Ru -","- C22 H30 B N8 O2 P Ru -","- C176 H240 B8 N64 O16 P8 Ru8 -","8","1","","DeYonker, Nathan J.; Foley, Nicholas A.; Cundari, Thomas R.; Gunnoe, T. Brent; Petersen, Jeffrey L.","Combined Experimental and Computational Studies on the Nature of Aromatic C−H Activation by Octahedral Ruthenium(II) Complexes: Evidence for σ-Bond Metathesis from Hammett Studies","Organometallics","2007","26","26","6604","","10.1021/om7009057","","","0.71073","MoKα","","0.0812","0.0528","","","0.1326","0.1489","","","","","","1.02","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074073","12.0615","0.0005","39.2897","0.0018","11.1728","0.0005","90","","100.801","0.001","90","","5200.9","0.4","293","2","293","2","","","","","","","","10","P 1 21/c 1","-P 2ybc","14","","","","- C51 H50 Cl2 F3 I N2 O4 P2 Pd S -","- C51 H50 Cl2 F3 I N2 O4 P2 Pd S -","- C204 H200 Cl8 F12 I4 N8 O16 P8 Pd4 S4 -","4","1","","Han, Yuan; Huynh, Han Vinh; Tan, Geok Kheng","Palladium(II) Pyrazolin-4-ylidenes: Remote N-Heterocyclic Carbene Complexes and Their Catalytic Application in Aqueous Suzuki−Miyaura Coupling","Organometallics","2007","26","26","6581","","10.1021/om7009107","","","0.71073","MoKα","","0.0962","0.0607","","","0.1231","0.1356","","","","","","1.038","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074074","10.0914","0.0005","22.4737","0.0011","20.9892","0.0011","90","","90","","90","","4760.2","0.4","223","2","223","2","","","","","","","","10","P n m a","-P 2ac 2n","62","","","","- C46 H46 Cl2 F3 I N2 O3 P2 Pd S -","- C46 H46 Cl2 F3 I N2 O3 P2 Pd S -","- C184 H184 Cl8 F12 I4 N8 O12 P8 Pd4 S4 -","4","0.5","","Han, Yuan; Huynh, Han Vinh; Tan, Geok Kheng","Palladium(II) Pyrazolin-4-ylidenes: Remote N-Heterocyclic Carbene Complexes and Their Catalytic Application in Aqueous Suzuki−Miyaura Coupling","Organometallics","2007","26","26","6581","","10.1021/om7009107","","","0.71073","MoKα","","0.1","0.0705","","","0.1551","0.1674","","","","","","1.079","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074075","10.1553","0.0003","10.5481","0.0003","14.5085","0.0004","99.349","0.002","90.46","0.003","110.431","0.002","1433.5","0.07","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H48 Hf -","- C32 H48 Hf -","- C64 H96 Hf2 -","2","1","","Beweries, Torsten; Burlakov, Vladimir V.; Peitz, Stephan; Bach, Marc A.; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Reactions of Decamethylhafnocene with 1,3-Butadiynes: Formation of Hafnacyclocumulenes and C−H Activation at Pentamethylcyclopentadienyl Ligands","Organometallics","2007","26","27","6827","","10.1021/om700911a","","","0.71073","MoKα","","0.0227","0.0184","","","0.0408","0.0415","","","","","","0.986","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074076","11.4937","0.0006","13.1411","0.0006","15.2373","0.0008","64.457","0.004","80.109","0.004","66.716","0.004","1907.38","0.19","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H66 Hf N2 -","- C42 H66 Hf N2 -","- C84 H132 Hf2 N4 -","2","1","","Beweries, Torsten; Burlakov, Vladimir V.; Peitz, Stephan; Bach, Marc A.; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe","Reactions of Decamethylhafnocene with 1,3-Butadiynes: Formation of Hafnacyclocumulenes and C−H Activation at Pentamethylcyclopentadienyl Ligands","Organometallics","2007","26","27","6827","","10.1021/om700911a","","","0.71073","MoKα","","0.0206","0.017","","","0.0403","0.0409","","","","","","0.979","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074077","19.301","0.003","9.7826","0.0018","20.697","0.004","90","","103.064","0.004","90","","3806.7","1.2","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","complex 3","","","- C38.5 H47 Cl2 Fe N Ni P2 Zn -","- C38.5 H47 Cl2 Fe N Ni P2 Zn -","- C154 H188 Cl8 Fe4 N4 Ni4 P8 Zn4 -","4","1","","Acosta-Ramírez, Alberto; Muñoz-Hernández, Miguel; Jones, William D.; García, Juventino J.","Catalytic Isomerization of 2-Methyl-3-butenenitrile by Nickel Systems Using Bis-diphosphinoferrocene Ligands: Evidence for Hemilability","Organometallics","2007","26","24","5766","","10.1021/om700928y","","","0.71073","MoKα","","0.1016","0.074","","","0.1501","0.1627","","","","","","1.107","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4074078","11.2541","0.0009","13.4722","0.0011","17.6235","0.0014","85.01","0.0011","85.5172","0.0011","85.887","0.0011","2648.1","0.4","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C61 H61 Cl O1.5 P3 Ru Si -","- C61 H61 Cl O1.5 P3 Ru Si -","- C122 H122 Cl2 O3 P6 Ru2 Si2 -","2","1","","MacInnis, Morgan C.; MacLean, Darren F.; Lundgren, Rylan J.; McDonald, Robert; Turculet, Laura","Synthesis and Reactivity of Platinum Group Metal Complexes Featuring the New Pincer-like Bis(phosphino)silyl Ligand [κ3-(2-Ph2PC6H4)2SiMe]−([PSiP]): Application in the Ruthenium-Mediated Transfer Hydrogenation of Ketones","Organometallics","2007","26","26","6522","","10.1021/om7009528","","","0.71073","MoKα","","0.0475","0.0369","","","0.0912","0.0975","","","","","","1.05","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074079","6.862","0.01","12.46","0.02","24.04","0.04","90","","90","","90","","2055","6","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H26 F3 N O3 -","- C22 H26 F3 N O3 -","- C88 H104 F12 N4 O12 -","4","1","","Doherty, Simon; Knight, Julian G.; Smyth, Catherine H.; Harrington, Ross W.; Clegg, William","Efficient Asymmetric Carbonyl-Ene Reactions Catalyzed by Platinum Metal Lewis Acid Complexes of Conformationally Flexible NUPHOS Diphosphines: A Comparison with BINAP","Organometallics","2007","26","25","6453","","10.1021/om700954s","","","0.71073","MoKα","","0.0973","0.0661","","","0.136","0.1501","","","","","","1.115","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074080","11.2711","0.0019","6.6473","0.0011","13.145","0.002","90","","114.252","0.002","90","","897.9","0.3","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H24 F3 N O3 -","- C18 H24 F3 N O3 -","- C36 H48 F6 N2 O6 -","2","1","","Doherty, Simon; Knight, Julian G.; Smyth, Catherine H.; Harrington, Ross W.; Clegg, William","Efficient Asymmetric Carbonyl-Ene Reactions Catalyzed by Platinum Metal Lewis Acid Complexes of Conformationally Flexible NUPHOS Diphosphines: A Comparison with BINAP","Organometallics","2007","26","25","6453","","10.1021/om700954s","","","0.6911","synchrotron","","0.0738","0.0666","","","0.1894","0.1983","","","","","","1.128","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074081","8.6828","0.0018","11.9631","0.0008","19.144","0.003","90","","90","","90","","1988.5","0.5","160","2","160","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H22 F6 O6 -","- C17 H22 F6 O6 -","- C68 H88 F24 O24 -","4","1","","Doherty, Simon; Knight, Julian G.; Smyth, Catherine H.; Harrington, Ross W.; Clegg, William","Efficient Asymmetric Carbonyl-Ene Reactions Catalyzed by Platinum Metal Lewis Acid Complexes of Conformationally Flexible NUPHOS Diphosphines: A Comparison with BINAP","Organometallics","2007","26","25","6453","","10.1021/om700954s","","","0.71073","MoKα","","0.0596","0.0527","","","0.1416","0.149","","","","","","1.162","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074082","19.157","0.0004","12.2804","0.0003","9.0897","0.0002","90","","90","","90","","2138.4","0.08","173","2","173","2","","","","","","","synthesis as described","4","P n a 21","P 2c -2n","33","","","","- C16 H37 N3 Si3 -","- C16 H37 N3 Si3 -","- C64 H148 N12 Si12 -","4","1","","Coles, Martyn P.; Sözerli, Sebnem E.; Smith, J. David; Hitchcock, Peter B.","Metal Complexes of Guanidine-Substituted Alkyl Ligands: An Unsolvated Monomeric Two-Coordinate Organolithium","Organometallics","2007","26","27","6691","","10.1021/om700963c","","x-ray","0.71073","MoKα","","0.0445","0.0375","","","0.0922","0.0968","","","","","","1.028","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074083","8.9987","0.0001","12.015","0.0002","20.4041","0.0003","90","","90","","90","","2206.08","0.05","173","2","173","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H36 Li N3 Si3 -","- C16 H36 Li N3 Si3 -","- C64 H144 Li4 N12 Si12 -","4","1","","Coles, Martyn P.; Sözerli, Sebnem E.; Smith, J. David; Hitchcock, Peter B.","Metal Complexes of Guanidine-Substituted Alkyl Ligands: An Unsolvated Monomeric Two-Coordinate Organolithium","Organometallics","2007","26","27","6691","","10.1021/om700963c","","x-ray","0.71073","MoKα","","0.0287","0.0266","","","0.0701","0.0715","","","","","","1.056","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074084","12.8652","0.0004","17.5997","0.0004","19.9029","0.0007","90","","90","","90","","4506.5","0.2","173","2","173","2","","","","","","","synthesis as described","5","P b c a","-P 2ac 2ab","61","","","","- C16 H36 K N3 Si3 -","- C16 H36 K N3 Si3 -","- C128 H288 K8 N24 Si24 -","8","1","","Coles, Martyn P.; Sözerli, Sebnem E.; Smith, J. David; Hitchcock, Peter B.","Metal Complexes of Guanidine-Substituted Alkyl Ligands: An Unsolvated Monomeric Two-Coordinate Organolithium","Organometallics","2007","26","27","6691","","10.1021/om700963c","","x-ray","0.71073","MoKα","","0.0525","0.0367","","","0.0844","0.0915","","","","","","1.033","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074085","6.4272","0.0013","10.63","0.002","14.087","0.003","87.57","0.03","89.38","0.03","73.17","0.03","920.4","0.4","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","","","- C21 H21 Bi -","- C21 H21 Bi -","- C42 H42 Bi2 -","2","1","","Stavila, Vitalie; Thurston, John H.; Prieto-Centurión, Darío; Whitmire, Kenton H.","A New Methodology for Synthesis of Aryl Bismuth Compounds: Arylation of Bismuth(III) Carboxylates by Sodium Tetraarylborate Salts","Organometallics","2007","26","27","6864","","10.1021/om7009667","","","0.71073","MoKα","","0.101","0.0272","","","0.0494","0.0582","","","","","","0.428","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074086","11.8094","0.0014","14.5658","0.0018","15.5167","0.0019","88.765","0.002","87.888","0.002","79.861","0.002","2625.3","0.6","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H30 N P -","- C34 H30 N P -","- C136 H120 N4 P4 -","4","2","","Oulié, Pascal; Freund, Christelle; Saffon, Nathalie; Martin-Vaca, Blanca; Maron, Laurent; Bourissou, Didier","Enforced η1-Fluorenyl and Indenyl Coordination to Zirconium: Geometrically Constrained and Sterically Expanded Complexes Derived from the Bifunctional (FluPPh2NAr)−and (IndPPh2NAr)−Ligands","Organometallics","2007","26","27","6793","","10.1021/om700974g","","","0.71073","MoKα","","0.0805","0.0718","","","0.167","0.1713","","","","","","1.148","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074087","9.0146","0.0011","17.367","0.002","18.711","0.002","68.706","0.003","82.801","0.003","81.75","0.002","2692.6","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C33 H34 N P -","- C33 H34 N P -","- C132 H136 N4 P4 -","4","2","","Oulié, Pascal; Freund, Christelle; Saffon, Nathalie; Martin-Vaca, Blanca; Maron, Laurent; Bourissou, Didier","Enforced η1-Fluorenyl and Indenyl Coordination to Zirconium: Geometrically Constrained and Sterically Expanded Complexes Derived from the Bifunctional (FluPPh2NAr)−and (IndPPh2NAr)−Ligands","Organometallics","2007","26","27","6793","","10.1021/om700974g","","","0.71073","MoKα","","0.1491","0.0546","","","0.0753","0.0951","","","","","","0.865","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074088","9.9869","0.0014","18.293","0.003","22.616","0.003","90","","101.602","0.003","90","","4047.3","1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H44 N P Zr -","- C52 H44 N P Zr -","- C208 H176 N4 P4 Zr4 -","4","1","","Oulié, Pascal; Freund, Christelle; Saffon, Nathalie; Martin-Vaca, Blanca; Maron, Laurent; Bourissou, Didier","Enforced η1-Fluorenyl and Indenyl Coordination to Zirconium: Geometrically Constrained and Sterically Expanded Complexes Derived from the Bifunctional (FluPPh2NAr)−and (IndPPh2NAr)−Ligands","Organometallics","2007","26","27","6793","","10.1021/om700974g","","","0.71073","MoKα","","0.1871","0.0687","","","0.0737","0.097","","","","","","0.938","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074089","12.8962","0.0012","12.9966","0.001","15.1856","0.0012","82.994","0.005","78.34","0.005","68.739","0.005","2319.7","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C58.5 H54 N P Zr -","- C58.5 H54 N P Zr -","- C117 H108 N2 P2 Zr2 -","2","1","","Oulié, Pascal; Freund, Christelle; Saffon, Nathalie; Martin-Vaca, Blanca; Maron, Laurent; Bourissou, Didier","Enforced η1-Fluorenyl and Indenyl Coordination to Zirconium: Geometrically Constrained and Sterically Expanded Complexes Derived from the Bifunctional (FluPPh2NAr)−and (IndPPh2NAr)−Ligands","Organometallics","2007","26","27","6793","","10.1021/om700974g","","","0.71073","MoKα","","0.2215","0.0532","","","0.0732","0.117","","","","","","0.628","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4074090","12.8193","0.0007","19.4797","0.0011","21.7493","0.0012","90","","106.413","0.001","90","","5209.8","0.5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C62 H70 N O2 P Zr -","- C62 H70 N O2 P Zr -","- C248 H280 N4 O8 P4 Zr4 -","4","1","","Oulié, Pascal; Freund, Christelle; Saffon, Nathalie; Martin-Vaca, Blanca; Maron, Laurent; Bourissou, Didier","Enforced η1-Fluorenyl and Indenyl Coordination to Zirconium: Geometrically Constrained and Sterically Expanded Complexes Derived from the Bifunctional (FluPPh2NAr)−and (IndPPh2NAr)−Ligands","Organometallics","2007","26","27","6793","","10.1021/om700974g","","","0.71073","MoKα","","0.0807","0.0429","","","0.0853","0.0965","","","","","","0.997","","","","has coordinates,has disorder","178629","2020-10-21","18:00:00",""
"4074091","10.7685","0.0004","16.9735","0.0007","22.2085","0.0009","90","","90","","90","","4059.3","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C51 H48 N P Zr -","- C51 H48 N P Zr -","- C204 H192 N4 P4 Zr4 -","4","1","","Oulié, Pascal; Freund, Christelle; Saffon, Nathalie; Martin-Vaca, Blanca; Maron, Laurent; Bourissou, Didier","Enforced η1-Fluorenyl and Indenyl Coordination to Zirconium: Geometrically Constrained and Sterically Expanded Complexes Derived from the Bifunctional (FluPPh2NAr)−and (IndPPh2NAr)−Ligands","Organometallics","2007","26","27","6793","","10.1021/om700974g","","","0.71073","MoKα","","0.1093","0.0454","","","0.0622","0.0758","","","","","","0.743","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074092","28.421","0.002","11.0913","0.001","13.323","0.0011","90","","115.21","0.001","90","","3799.7","0.5","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C46 H42 Si2 Zr -","- C46 H42 Si2 Zr -","- C184 H168 Si8 Zr4 -","4","0.5","","Liu, Junhui; Zhang, Wen-Xiong; Guo, Xiangyu; Hou, Zhaomin; Xi, Zhenfeng","Isolation and Synthetic Applications of 2,5-Bis(alkynylsilyl) Zirconacyclopentadienes","Organometallics","2007","26","27","6812","","10.1021/om701002k","","","0.71073","MoKα","","0.0341","0.0274","","","0.0688","0.0704","","","","","","1.042","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074093","14.465","0.005","8.585","0.002","16.138","0.004","90","","116.824","0.011","90","","1788.4","0.9","150","1","150","1","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C20 H27 N Ti -","- C20 H27 N Ti -","- C80 H108 N4 Ti4 -","4","1","","Wu, Chun Ji; Lee, Sang Hoon; Yun, Hoseop; Lee, Bun Yeoul","Ortho Lithiation of Tetrahydroquinoline Derivatives and Its Use for the Facile Construction of Polymerization Catalysts","Organometallics","2007","26","27","6685","","10.1021/om7010084","","","0.71073","MoKα","","0.0614","0.0407","","","0.0891","0.0973","","","","","","1.03","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074094","15.4701","0.0017","14.6775","0.0014","15.8899","0.0014","90","","103.832","0.003","90","","3503.4","0.6","150","1","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H23 N Ti -","- C21 H23 N Ti -","- C168 H184 N8 Ti8 -","8","1","","Wu, Chun Ji; Lee, Sang Hoon; Yun, Hoseop; Lee, Bun Yeoul","Ortho Lithiation of Tetrahydroquinoline Derivatives and Its Use for the Facile Construction of Polymerization Catalysts","Organometallics","2007","26","27","6685","","10.1021/om7010084","","","0.71073","MoKα","","0.0952","0.0679","","","0.1692","0.1886","","","","","","1.053","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074095","12.4129","0.0003","12.45","0.0003","14.4623","0.0004","68.4935","0.0007","68.3872","0.0007","73.8696","0.0007","1906.68","0.08","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C24 H23 N Ti -","- C24 H23 N Ti -","- C96 H92 N4 Ti4 -","4","2","","Wu, Chun Ji; Lee, Sang Hoon; Yun, Hoseop; Lee, Bun Yeoul","Ortho Lithiation of Tetrahydroquinoline Derivatives and Its Use for the Facile Construction of Polymerization Catalysts","Organometallics","2007","26","27","6685","","10.1021/om7010084","","","0.71073","MoKα","","0.0519","0.038","","","0.1066","0.1188","","","","","","1.109","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074096","11.189","0.003","25.149","0.006","28.964","0.007","90","","90","","90","","8150","4","100","","100","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","CpFeCl(CO)2TRIMEB","","","- C70 H117 Cl Fe O37 -","- C70 H117 Cl Fe O37 -","- C280 H468 Cl4 Fe4 O148 -","4","1","","Balula, Salete S.; Coelho, Ana C.; Braga, Susana S.; Hazell, Alan; Valente, Anabela A.; Pillinger, Martyn; Seixas, João D.; Romão, Carlos C.; Gonçalves, Isabel S.","Influence of Cyclodextrins on Catalytic Olefin Epoxidation with Metal‒Carbonyl Compounds. Crystal Structure of the TRIMEB Complex with CpFe(CO)2Cl","Organometallics","2007","26","27","6857","","10.1021/om701025z","","","0.71073","MoKα","","","0.08","","","","0.09","","","","","","1.404","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4074097","8.1406","0.0002","16.775","0.0004","21.4929","0.0005","90","","90.5","0.001","90","","2934.93","0.12","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[2]ansasilanicklocenen","[2]ansatetramethylsilanicklocenen","","- C14 H20 Ni Si2 -","- C14 H20 Ni Si2 -","- C112 H160 Ni8 Si16 -","8","2","","Braunschweig, Holger; Gross, Manuela; Radacki, Krzysztof","Synthesis, Molecular Structure, and Reactivity of the First Strained [2]Silanickelocenophane","Organometallics","2007","26","27","6688","","10.1021/om701037s","","","0.71073","MoKα","","0.0412","0.03","","","0.0712","0.0755","","","","","","1.04","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074098","6.5827","0.0002","8.745","0.0003","11.4819","0.0003","100.362","0.001","90.349","0.001","93.194","0.001","649.09","0.03","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H38 N2 Ni2 Si2 -","- C24 H38 N2 Ni2 Si2 -","- C24 H38 N2 Ni2 Si2 -","1","0.5","","Braunschweig, Holger; Gross, Manuela; Radacki, Krzysztof","Synthesis, Molecular Structure, and Reactivity of the First Strained [2]Silanickelocenophane","Organometallics","2007","26","27","6688","","10.1021/om701037s","","","0.71073","MoKα","","0.0249","0.0232","","","0.0616","0.0624","","","","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4074099","12.4424","0.0004","14.1444","0.0006","10.6957","0.0004","90","","97.142","0.002","90","","1867.73","0.12","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H22 Fe O6 -","- C19 H22 Fe O6 -","- C76 H88 Fe4 O24 -","4","1","","Stoll, Armin H.; Mayer, P.; Knochel, Paul","Preparation of Di-, Tri-, and Tetra-Substituted Functionalized Ferrocenes via Magnesium Organometallics","Organometallics","2007","26","27","6694","","10.1021/om701046c","","","0.71073","MoKα","","0.0662","0.0377","","","0.0842","0.0957","","","","","","1.045","","","","has coordinates","178629","2020-10-21","18:00:00",""
"4074100","7.1414","0.0002","10.5225","0.0003","15.7618","0.0004","83.2794","0.0016","85.3185","0.0018","71.1689","0.0014","1112.11","0.05","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H26 Fe O8 -","- C22 H26 Fe O8 -","- C44 H52 Fe2 O16 -","2","1","","Stoll, Armin H.; Mayer, P.; Knochel, Paul","Preparation of Di-, Tri-, and Tetra-Substituted Functionalized Ferrocenes via Magnesium Organometallics","Organometallics","2007","26","27","6694","","10.1021/om701046c","","","0.71073","MoKα","","0.0529","0.0364","","","0.0836","0.0912","","","","","","1.058","","","","has coordinates","178630","2020-10-21","18:00:00",""
"4074101","12.178","0.003","20.115","0.005","13.9","0.005","90","","109.769","0.011","90","","3204.3","1.6","298.1","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C34 H50 O P2 Ru -","- C34 H50 O P2 Ru -","- C136 H200 O4 P8 Ru4 -","4","1","","Ogasawara, Masamichi; Sakamoto, Takeshi; Ito, Azumi; Ge, Yonghui; Nakajima, Kiyohiko; Takahashi, Tamotsu; Hayashi, Tamio","Unprecedented Formation of μ-Vinylidene Complexes from Phospharuthenocene and Acyl Chloride via Activation of the CO Double Bond","Organometallics","2007","26","27","6698","","10.1021/om701063k","","","0.71075","MoKα","","","0.0425","","","","0.1548","","","","","","1.006","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4074102","13.829","0.004","13.881","0.003","18.137","0.007","69.891","0.012","81.569","0.013","62.002","0.011","2886.3","1.6","298.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H45 O2 P Ru -","- C29.995 H41 O2 P Ru -","- C119.98 H164 O8 P4 Ru4 -","4","2","","Ogasawara, Masamichi; Sakamoto, Takeshi; Ito, Azumi; Ge, Yonghui; Nakajima, Kiyohiko; Takahashi, Tamotsu; Hayashi, Tamio","Unprecedented Formation of μ-Vinylidene Complexes from Phospharuthenocene and Acyl Chloride via Activation of the CO Double Bond","Organometallics","2007","26","27","6698","","10.1021/om701063k","","","0.71075","MoKα","","","0.0537","","","","0.1218","","","","","","1.46","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4074103","11.897","0.003","16.879","0.004","17.761","0.006","90","","90.759","0.013","90","","3566.3","1.7","298.1","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C34 H53 O1.5 P2 Ru -","- C34 H41 O1.52 P2 Ru -","- C136 H164 O6.08 P8 Ru4 -","4","1","","Ogasawara, Masamichi; Sakamoto, Takeshi; Ito, Azumi; Ge, Yonghui; Nakajima, Kiyohiko; Takahashi, Tamotsu; Hayashi, Tamio","Unprecedented Formation of μ-Vinylidene Complexes from Phospharuthenocene and Acyl Chloride via Activation of the CO Double Bond","Organometallics","2007","26","27","6698","","10.1021/om701063k","","","0.71075","MoKα","","","0.0615","","","","0.2074","","","","","","0.994","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4074104","16.1963","0.0002","18.3611","0.0003","27.7087","0.0004","88.5192","0.0006","75.1286","0.0005","77.435","0.0008","7769.4","0.2","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C73 H61 Cl13 N8 O5 Ru2 -","- C72.532 H60.064 Cl13 N8 O5.258 Ru2 -","- C290.128 H240.256 Cl52 N32 O21.032 Ru8 -","4","2","","Zhang, Lei; Huang, Zhihong; Chen, Wei-Zhong; Negishi, Ei-ichi; Fanwick, Phillip E.; Updegraff, James B.; Protasiewicz, John D.; Ren, Tong","Negishi CouplingExpedient Formation of Biphenyls on the Periphery of Inorganic/Organometallic Diruthenium Species","Organometallics","2007","26","26","6526","","10.1021/om701083q","","","0.71073","MO-Kα","","0.084","0.058","","","0.141","0.155","","","","","","1.023","","","","has coordinates","178630","2020-10-21","18:00:00",""
"4074105","14.408","0.006","24.52","0.009","24.802","0.01","90","","98.012","0.005","90","","8677","6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C72 H43 Cl12 F3 N8 Ru2 -","- C72 H43 Cl12.03 F3 N8 Ru2 -","- C288 H172 Cl48.12 F12 N32 Ru8 -","4","1","","Zhang, Lei; Huang, Zhihong; Chen, Wei-Zhong; Negishi, Ei-ichi; Fanwick, Phillip E.; Updegraff, James B.; Protasiewicz, John D.; Ren, Tong","Negishi CouplingExpedient Formation of Biphenyls on the Periphery of Inorganic/Organometallic Diruthenium Species","Organometallics","2007","26","26","6526","","10.1021/om701083q","","","0.71073","MoKα","","0.1105","0.0657","","","0.1639","0.1806","","","","","","1.102","","","","has coordinates","178630","2020-10-21","18:00:00",""
"4074106","11.7373","0.0009","17.2111","0.0013","18.3398","0.0013","90","","94.126","0.004","90","","3695.3","0.5","120","","120","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H55 Ir N2 P2 S -","- C38 H55 Ir N2 P2 S -","- C152 H220 Ir4 N8 P8 S4 -","4","1","","Zhu, Yanjun; Fan, Lei; Chen, Chun-Hsing; Finnell, Shannon R.; Foxman, Bruce M.; Ozerov, Oleg V.","C−H Oxidative Addition to a (PNP)Ir Center and Ligand-Induced Reversal of Benzyl/Aryl Selectivity","Organometallics","2007","26","27","6701","","10.1021/om701110y","","","0.71073","MoKα","","0.0305","0.0223","","0.0591","0.0494","0.0591","","","","","","0.9444","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4074107","14.3364","0.0009","8.0561","0.0005","14.0038","0.001","90","","109.016","0.002","90","","1529.11","0.17","233","2","233","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H19 Cl N3 O2 Rh -","- C13 H19 Cl N3 O2 Rh -","- C52 H76 Cl4 N12 O8 Rh4 -","4","1","","Khramov, Dimitri M.; Lynch, Vincent M.; Bielawski, Christopher W.","N-Heterocyclic Carbene−Transition Metal Complexes: Spectroscopic and Crystallographic Analyses of π-Back-bonding Interactions","Organometallics","2007","26","24","6042","","10.1021/om700591z","","","0.71073","MoKα","","0.0458","0.034","","","0.0773","0.083","","","","","","1.014","","","","has coordinates","178630","2020-10-21","18:00:00",""
"4074108","18.643","0.0003","12.005","0.0002","14.91","0.0002","90","","113.841","0.0009","90","","3052.25","0.08","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H18 Cl3 N2 Rh -","- C13 H18 Cl3 N2 Rh -","- C104 H144 Cl24 N16 Rh8 -","8","1","","Khramov, Dimitri M.; Lynch, Vincent M.; Bielawski, Christopher W.","N-Heterocyclic Carbene−Transition Metal Complexes: Spectroscopic and Crystallographic Analyses of π-Back-bonding Interactions","Organometallics","2007","26","24","6042","","10.1021/om700591z","","","0.71073","MoKα","","0.0327","0.0249","","","0.0552","0.0582","","","","","","1.09","","","","has coordinates","178630","2020-10-21","18:00:00",""
"4074109","14.491","0.0008","11.043","0.0005","20.088","0.001","90","","96.598","0.003","90","","3193.3","0.3","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 Cl N4 Rh -","- C15 H18 Cl N4 Rh -","- C120 H144 Cl8 N32 Rh8 -","8","2","","Khramov, Dimitri M.; Lynch, Vincent M.; Bielawski, Christopher W.","N-Heterocyclic Carbene−Transition Metal Complexes: Spectroscopic and Crystallographic Analyses of π-Back-bonding Interactions","Organometallics","2007","26","24","6042","","10.1021/om700591z","","","0.71073","MoKα","","0.1012","0.0536","","","0.1157","0.1361","","","","","","1.028","","","","has coordinates,has disorder","178630","2020-10-21","18:00:00",""
"4082256","8.7295","0.0001","13.9371","0.0002","17.032","0.0002","90","","90","","90","","2072.18","0.05","150","2","150","2","","","","","","","Synthesized by the authors. See text","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H33 Cl Ni O2 P2 -","- C15 H33 Cl Ni O2 P2 -","- C60 H132 Cl4 Ni4 O8 P8 -","4","1","","Pandarus, Valerica; Zargarian, Davit","New Pincer-Type Diphosphinito (POCOP) Complexes of Nickel","Organometallics","2007","26","17","4321","","10.1021/om700400x","","","1.54178","CuKα","","0.0447","0.0417","","","0.09","0.0915","","","","","","1.013","","","","has coordinates","178711","2020-10-21","18:00:00",""
"4082257","20.0267","0.0004","12.6735","0.0002","33.2826","0.0006","90","","102.516","0.001","90","","8246.7","0.3","150","2","150","2","","","","","","","Synthesized by the authors. See text","8","P 1 21/c 1","-P 2ybc","14","","","","- C21 H34 F3 N Ni O5 P2 S -","- C21 H34 F3 N Ni O5 P2 S -","- C252 H408 F36 N12 Ni12 O60 P24 S12 -","12","3","","Pandarus, Valerica; Zargarian, Davit","New Pincer-Type Diphosphinito (POCOP) Complexes of Nickel","Organometallics","2007","26","17","4321","","10.1021/om700400x","","","1.54178","CuKα","","0.0521","0.0364","","","0.0974","0.1056","","","","","","1.041","","","","has coordinates","178711","2020-10-21","18:00:00",""
"4082258","8.395","0.0004","10.4148","0.0005","13.1212","0.0007","81.803","0.003","80.886","0.003","88.316","0.003","1121.13","0.1","150","2","150","2","","","","","","","Synthesized by the authors. See text","6","P -1","-P 1","2","","","","- C18 H31 I Ni O2 P2 -","- C18 H31 I Ni O2 P2 -","- C36 H62 I2 Ni2 O4 P4 -","2","1","","Pandarus, Valerica; Zargarian, Davit","New Pincer-Type Diphosphinito (POCOP) Complexes of Nickel","Organometallics","2007","26","17","4321","","10.1021/om700400x","","","1.54178","CuKα","","0.0908","0.0568","","","0.1303","0.1452","","","","","","0.899","","","","has coordinates,has disorder","178711","2020-10-21","18:00:00",""
"4082259","13.5766","0.0003","6.9842","0.0002","22.2642","0.0005","90","","104.721","0.001","90","","2041.83","0.09","150","2","150","2","","","","","","","Synthesized by the authors. See text","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H33 Cl2 Ni O2 P2 -","- C15 H33 Cl2 Ni O2 P2 -","- C60 H132 Cl8 Ni4 O8 P8 -","4","1","","Pandarus, Valerica; Zargarian, Davit","New Pincer-Type Diphosphinito (POCOP) Complexes of Nickel","Organometallics","2007","26","17","4321","","10.1021/om700400x","","","1.54178","CuKα","","0.0319","0.0305","","","0.0879","0.0891","","","","","","1.079","","","","has coordinates","178711","2020-10-21","18:00:00",""
"4082260","9.6621","0.0003","9.9213","0.0002","28.2123","0.0007","80.107","0.001","83.663","0.001","60.95","0.001","2327.92","0.11","150","2","150","2","","","","","","","Synthesized by the authors. See text","7","P -1","-P 1","2","","","","- C16 H33 F3 Ni O5 P2 S -","- C16 H33 F3 Ni O5 P2 S -","- C64 H132 F12 Ni4 O20 P8 S4 -","4","2","","Pandarus, Valerica; Zargarian, Davit","New Pincer-Type Diphosphinito (POCOP) Complexes of Nickel","Organometallics","2007","26","17","4321","","10.1021/om700400x","","","1.54178","CuKα","","0.0756","0.055","","","0.1402","0.1527","","","","","","0.976","","","","has coordinates,has disorder","178711","2020-10-21","18:00:00",""
"4082261","13.0447","0.0003","13.0888","0.0004","13.3978","0.0004","78.418","0.001","76.138","0.001","87.343","0.001","2175.69","0.11","150","2","150","2","","","","","","","Synthesized by the authors. See text","5","P -1","-P 1","2","","","","- C19 H34 Ni O2 P2 -","- C19 H34 Ni O2 P2 -","- C76 H136 Ni4 O8 P8 -","4","2","","Pandarus, Valerica; Zargarian, Davit","New Pincer-Type Diphosphinito (POCOP) Complexes of Nickel","Organometallics","2007","26","17","4321","","10.1021/om700400x","","","1.54178","CuKα","","0.0356","0.0331","","","0.0951","0.0978","","","","","","1.061","","","","has coordinates","178711","2020-10-21","18:00:00",""
"4082262","9.7318","0.0002","16.9949","0.0004","14.0405","0.0003","90","","103.733","0.001","90","","2255.79","0.09","150","2","150","2","","","","","","","Synthesized by the authors. See text","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H36 Ni O2 P2 -","- C20 H36 Ni O2 P2 -","- C80 H144 Ni4 O8 P8 -","4","1","","Pandarus, Valerica; Zargarian, Davit","New Pincer-Type Diphosphinito (POCOP) Complexes of Nickel","Organometallics","2007","26","17","4321","","10.1021/om700400x","","","1.54178","CuKα","","0.0347","0.0281","","","0.0752","0.0788","","","","","","1.021","","","","has coordinates","178711","2020-10-21","18:00:00",""
"4082263","12.9455","0.0002","12.9983","0.0002","13.4011","0.0002","78.455","0.001","76.121","0.001","87.062","0.001","2144.86","0.06","100","2","100","2","","","","","","","Synthesized by the authors. See text","6","P -1","-P 1","2","","","","- C18 H31 Cl Ni O2 P2 -","- C18 H31 Cl Ni O2 P2 -","- C72 H124 Cl4 Ni4 O8 P8 -","4","2","","Pandarus, Valerica; Zargarian, Davit","New Pincer-Type Diphosphinito (POCOP) Complexes of Nickel","Organometallics","2007","26","17","4321","","10.1021/om700400x","","","1.54178","CuKα","","0.043","0.0352","","","0.0906","0.0935","","","","","","1.021","","","","has coordinates","178711","2020-10-21","18:00:00",""
"4082264","8.8178","0.0001","12.8678","0.0002","18.3162","0.0002","90","","93.163","0.001","90","","2075.09","0.05","150","2","150","2","","","","","","","Synthesized by the authors. See text","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H33 I Ni O2 P2 -","- C15 H33 I Ni O2 P2 -","- C60 H132 I4 Ni4 O8 P8 -","4","1","","Pandarus, Valerica; Zargarian, Davit","New Pincer-Type Diphosphinito (POCOP) Complexes of Nickel","Organometallics","2007","26","17","4321","","10.1021/om700400x","","","1.54178","CuKα","","0.0539","0.041","","","0.0913","0.0957","","","","","","0.976","","","","has coordinates,has disorder","178711","2020-10-21","18:00:00",""
"4082265","10.68","0.002","10.981","0.002","17.341","0.004","93.24","0.03","92.81","0.03","105.96","0.03","1947.8","0.7","100","2","100","2","","","","","","","","7","P -1","-P 1","2","[(η^5^-C~5~Me~5~)Ru{=C(-OC~6~H~3~OH-CH(C~6~H~4~F)CH~2~-)}(dippe)][BF~4~]","1,2-bis(diisopropylphosphine)ethane-7-hydroxy-4-p-fluorphenyl-chroman-2- ylidene-η^5^-pentamethylcyclopentadienyl-ruthenium (II) tetrafluorborate","","- C39 H57 B F5 O2 P2 Ru -","- C39 H58 B F5 O2 P2 Ru -","- C78 H116 B2 F10 O4 P4 Ru2 -","2","1","","Bustelo, Emilio; Jiménez-Tenorio, Manuel; Puerta, M. Carmen; Valerga, Pedro","γ-Substituted Vinylidene, Chroman-2-ylidene, and Hexahydrochromen-2-ylidene from Ruthenium Allenylidene/Alkenylcarbyne Complexes","Organometallics","2007","26","17","4300","","10.1021/om700431n","","x-ray","0.71073","MoKα","","0.0782","0.0737","","","0.1483","0.151","","","","","","1.064","","","","has coordinates,has disorder","178711","2020-10-21","18:00:00",""
"4082266","12.25","0.003","9.259","0.003","17.685","0.005","90","","99.682","0.004","90","","1977.3","1","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 B10 Co2 Se2 -","- C12 H20 B10 Co2 Se2 -","- C48 H80 B40 Co8 Se8 -","4","1","","Xu, Bao-Hua; Wu, De-Hong; Li, Yi-Zhi; Yan, Hong","Reactivity of CpCo 16eHalf-Sandwich Complexes Containing a Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dichalcogenolate Ligand toward Phenylacetylene","Organometallics","2007","26","17","4344","","10.1021/om700454p","","","0.71073","MoKα","","0.0624","0.051","","","0.1257","0.1293","","","","","","1.096","","","","has coordinates","178711","2020-10-21","18:00:00",""
"4082267","11.152","0.01","12.074","0.01","20.855","0.016","90","","105.51","0.04","90","","2706","4","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H56 B20 Co2 O S4 -","- C46 H56 B20 Co2 O S4 -","- C92 H112 B40 Co4 O2 S8 -","2","0.5","","Xu, Bao-Hua; Wu, De-Hong; Li, Yi-Zhi; Yan, Hong","Reactivity of CpCo 16eHalf-Sandwich Complexes Containing a Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dichalcogenolate Ligand toward Phenylacetylene","Organometallics","2007","26","17","4344","","10.1021/om700454p","","","0.71073","MoKα","","0.0712","0.0546","","","0.1272","0.132","","","","","","1.033","","","","has coordinates","178711","2020-10-21","18:00:00",""
"4082268","11.962","0.003","13.029","0.003","15.174","0.004","115.007","0.003","103.298","0.005","98.994","0.004","1997.7","0.9","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H21 B10 Co S2 -","- C15 H21 B10 Co S2 -","- C60 H84 B40 Co4 S8 -","4","2","","Xu, Bao-Hua; Wu, De-Hong; Li, Yi-Zhi; Yan, Hong","Reactivity of CpCo 16eHalf-Sandwich Complexes Containing a Chelating 1,2-Dicarba-closo-dodecaborane-1,2-dichalcogenolate Ligand toward Phenylacetylene","Organometallics","2007","26","17","4344","","10.1021/om700454p","","","0.71073","MoKα","","0.0902","0.0676","","","0.1529","0.1589","","","","","","1.011","","","","has coordinates","178711","2020-10-21","18:00:00",""
"4082269","8.5458","0.0006","15.2243","0.001","23.9895","0.0015","90","","90.042","0.002","90","","3121.1","0.4","273","2","273","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C33 H42 Cl Ir N2 O -","- C33 H42 Cl Ir N2 O -","- C132 H168 Cl4 Ir4 N8 O4 -","4","2","","Corberán, Rosa; Lillo, Vanessa; Mata, José A.; Fernandez, Elena; Peris, Eduardo","Enantioselective Preparation of a Chiral-at-Metal Cp*Ir(NHC) Complex and Its Application in the Catalytic Diboration of Olefins","Organometallics","2007","26","17","4350","","10.1021/om7004639","","x-ray","0.71073","MoKα","","0.0863","0.0515","","","0.1014","0.1124","","","","","","1.024","","","","has coordinates","178711","2020-10-21","18:00:00",""
"4083623","8.1984","0.0011","12.0862","0.0017","12.4671","0.0017","69.703","0.003","82.395","0.002","80.066","0.003","1137.7","0.3","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H26 N4 O7 Si2 -","- C18 H26 N4 O7 Si2 -","- C36 H52 N8 O14 Si4 -","2","1","","Hassall, Kathyrn; Schiesser, Carl H.; White, Jonathan M.","Solution and Solid-State Structure of 2- and 4-Bis(trimethylsilyl)methylpyridinium Cations","Organometallics","2007","26","13","3094","","10.1021/om070045+","","","0.71073","MoKα","","0.0589","0.0423","","","0.0805","0.0848","","","","","","0.898","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083624","14.516","0.002","27.166","0.004","10.0497","0.0013","90","","102.405","0.005","90","","3870.5","0.9","95","2","95","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","FM06","","","- C49 H42 N3 P S -","- C49 H42 N3 P S -","- C196 H168 N12 P4 S4 -","4","1","","Duan, Zheng; Clochard, Magali; Donnadieu, Bruno; Mathey, François; Tham, Fook S.","Synthesis and X-ray Crystal Structure of a P-Confused Carbaporphyrinoid","Organometallics","2007","26","15","3617","","10.1021/om700344q","","","0.49594","","","0.0756","0.0497","","","0.0946","0.1036","","","","","","1.077","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083625","11.4151","0.0012","17.8705","0.0018","24.26","0.002","90","","98.424","0.002","90","","4895.5","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C62 H49 Ir N4 O -","- C62 H49 Ir N4 O -","- C248 H196 Ir4 N16 O4 -","4","1","","Song, Xu; Chan, Kin Shing","Syntheses of Acyliridium Porphyrins by Aldehydic Carbon−Hydrogen Bond Activation with Iridium(III) Porphyrin Chloride and Methyl","Organometallics","2007","26","4","965","","10.1021/om060849+","","","0.71073","MoKα","","0.0835","0.0524","","","0.1052","0.1211","","","","","","1.079","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083626","8.839","0.0014","28.222","0.004","22.931","0.004","90","","98.215","0.003","90","","5661.5","1.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H43 Ir N4 O2 -","- C56 H40 Ir N4 O2 -","- C224 H160 Ir4 N16 O8 -","4","0.5","","Song, Xu; Chan, Kin Shing","Syntheses of Acyliridium Porphyrins by Aldehydic Carbon−Hydrogen Bond Activation with Iridium(III) Porphyrin Chloride and Methyl","Organometallics","2007","26","4","965","","10.1021/om060849+","","","0.71073","MoKα","","0.0911","0.065","","","0.1837","0.2055","","","","","","1.136","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083627","13.8753","0.0015","22.28","0.002","15.5951","0.0016","90","","96.397","0.002","90","","4791.1","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H47 Ir N4 O3 -","- C56 H43 Ir N4 O3 -","- C224 H172 Ir4 N16 O12 -","4","1","","Song, Xu; Chan, Kin Shing","Syntheses of Acyliridium Porphyrins by Aldehydic Carbon−Hydrogen Bond Activation with Iridium(III) Porphyrin Chloride and Methyl","Organometallics","2007","26","4","965","","10.1021/om060849+","","","0.71073","MoKα","","0.1228","0.0593","","","0.1369","0.1782","","","","","","1.044","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083628","20.648","0.003","13.5262","0.0018","20.692","0.003","90","","99.762","0.003","90","","5695.4","1.4","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C63 H57 Ir N4 O2 -","- C63 H57 Ir N4 O2 -","- C252 H228 Ir4 N16 O8 -","4","1","","Song, Xu; Chan, Kin Shing","Syntheses of Acyliridium Porphyrins by Aldehydic Carbon−Hydrogen Bond Activation with Iridium(III) Porphyrin Chloride and Methyl","Organometallics","2007","26","4","965","","10.1021/om060849+","","","0.71073","MoKα","","0.1345","0.0797","","","0.2214","0.2716","","","","","","1.057","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083629","11.338","0.002","18.307","0.004","23.902","0.005","90","","99.05","0.03","90","","4899.5","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C62 H48 F Ir N4 O -","- C62 H48 F Ir N4 O -","- C248 H192 F4 Ir4 N16 O4 -","4","1","","Song, Xu; Chan, Kin Shing","Syntheses of Acyliridium Porphyrins by Aldehydic Carbon−Hydrogen Bond Activation with Iridium(III) Porphyrin Chloride and Methyl","Organometallics","2007","26","4","965","","10.1021/om060849+","","","0.71073","MoKα","","0.1191","0.0512","","","0.1206","0.1425","","","","","","0.984","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083630","11.239","0.002","18.548","0.003","24.007","0.005","90","","98.714","0.004","90","","4946.8","1.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C62 H48 Cl Ir N4 O -","- C62 H48 Cl Ir N4 O -","- C248 H192 Cl4 Ir4 N16 O4 -","4","1","","Song, Xu; Chan, Kin Shing","Syntheses of Acyliridium Porphyrins by Aldehydic Carbon−Hydrogen Bond Activation with Iridium(III) Porphyrin Chloride and Methyl","Organometallics","2007","26","4","965","","10.1021/om060849+","","","0.71073","MoKα","","0.0735","0.0404","","","0.0843","0.0983","","","","","","1.05","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083631","11.334","0.007","11.146","0.007","15.082","0.009","90","0.011","109.201","0.01","90","0.01","1799.3","1.9","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C40 H55 Cl Ir N5 -","- C40 H55 Cl Ir N5 -","- C80 H110 Cl2 Ir2 N10 -","2","1","","Chen, Dianjun; Banphavichit, Vorawit; Reibenspies, Joe; Burgess, Kevin","New Optically ActiveN-Heterocyclic Carbene Complexes for Hydrogenation: A Tale with an Atropisomeric Twist","Organometallics","2007","26","4","855","","10.1021/om061013+","","","0.71073","MoKα","","0.0582","0.045","","","0.082","0.0865","","","","","","1.064","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083632","13.942","0.009","14.236","0.009","18.453","0.012","90","","90","","90","","3663","4","110","2","110","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C40 H55 Cl Ir N5 -","- C40 H55 Cl Ir N5 -","- C160 H220 Cl4 Ir4 N20 -","4","1","","Chen, Dianjun; Banphavichit, Vorawit; Reibenspies, Joe; Burgess, Kevin","New Optically ActiveN-Heterocyclic Carbene Complexes for Hydrogenation: A Tale with an Atropisomeric Twist","Organometallics","2007","26","4","855","","10.1021/om061013+","","","0.71073","MoKα","","0.0842","0.0629","","","0.1141","0.1202","","","","","","1.015","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083634","7.2505","0.0001","15.304","0.0003","12.4512","0.0002","90","","91.286","0.001","90","","1381.26","0.04","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[2-(2-benzoimidazole)-6-methylpyridine]dichlorocobalt","","- C13 H11 Cl2 Co N3 O0 -","- C13 H11 Cl2 Co N3 -","- C52 H44 Cl8 Co4 N12 -","4","1","","Sun, Wen-Hua; Hao, Peng; Zhang, Shu; Shi, Qisong; Zuo, Weiwei; Tang, Xiubo; Lu, Xiaoming","Iron(II) and Cobalt(II) 2-(Benzimidazolyl)-6-(1-(arylimino)ethyl)pyridyl Complexes as Catalysts for Ethylene Oligomerization and Polymerization","Organometallics","2007","26","10","2720","","10.1021/om0700819","","","0.71073","MoKα","","","0.0278","","","0.0766","0.0813","","","","","","1.056","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083635","7.8858","0.0002","16.8075","0.0004","14.1633","0.0004","90","","94.291","0.001","90","","1871.95","0.08","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[2-(1-methyl-2-benzoimidazole)-6-methylpyridine]dichloroiron","","- C17 H20 Cl2 Fe N4 O -","- C17 H20 Cl2 Fe N4 O -","- C68 H80 Cl8 Fe4 N16 O4 -","4","1","","Sun, Wen-Hua; Hao, Peng; Zhang, Shu; Shi, Qisong; Zuo, Weiwei; Tang, Xiubo; Lu, Xiaoming","Iron(II) and Cobalt(II) 2-(Benzimidazolyl)-6-(1-(arylimino)ethyl)pyridyl Complexes as Catalysts for Ethylene Oligomerization and Polymerization","Organometallics","2007","26","10","2720","","10.1021/om0700819","","","0.71073","MoKα","","","0.0391","","","0.104","0.1124","","","","","","1.063","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083636","8.6204","0.0002","7.4012","0.0002","12.1953","0.0003","90","","107.84","0.001","90","","740.66","0.03","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","[2-(1-methyl-2-benzoimidazole)-6-methylpyridine]dichlorocobalt","","- C14 H13 Cl2 Co N3 O0 -","- C14 H13 Cl2 Co N3 -","- C28 H26 Cl4 Co2 N6 -","2","0.5","","Sun, Wen-Hua; Hao, Peng; Zhang, Shu; Shi, Qisong; Zuo, Weiwei; Tang, Xiubo; Lu, Xiaoming","Iron(II) and Cobalt(II) 2-(Benzimidazolyl)-6-(1-(arylimino)ethyl)pyridyl Complexes as Catalysts for Ethylene Oligomerization and Polymerization","Organometallics","2007","26","10","2720","","10.1021/om0700819","","","0.71073","MoKα","","","0.0269","","","0.0791","0.0825","","","","","","0.982","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083637","7.7749","0.0003","8.3615","0.0002","13.3453","0.0004","92.052","0.002","93.674","0.002","99.584","0.002","852.76","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[2-carboethoxy-6-(1-methyl-2-benzoimidazolyl)pyridine]dichlorocobalt","","- C16 H15 Cl2 Co N3 O2 -","- C16 H15 Cl2 Co N3 O2 -","- C32 H30 Cl4 Co2 N6 O4 -","2","1","","Sun, Wen-Hua; Hao, Peng; Zhang, Shu; Shi, Qisong; Zuo, Weiwei; Tang, Xiubo; Lu, Xiaoming","Iron(II) and Cobalt(II) 2-(Benzimidazolyl)-6-(1-(arylimino)ethyl)pyridyl Complexes as Catalysts for Ethylene Oligomerization and Polymerization","Organometallics","2007","26","10","2720","","10.1021/om0700819","","","0.71073","MoKα","","","0.0367","","","0.0927","0.1008","","","","","","1.029","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083638","17.8207","0.0003","8.3406","0.0001","13.2319","0.0002","90","","100.749","0.001","90","","1932.22","0.05","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(E)-2,6-dimethyl-N-(1-(6-(1-methyl-1H-benzo[d]imidazol-2-yl) pyridin-2-yl)ethylidene)benzenamine","","- C23 H22 N4 -","- C23 H22 N4 -","- C92 H88 N16 -","4","1","","Sun, Wen-Hua; Hao, Peng; Zhang, Shu; Shi, Qisong; Zuo, Weiwei; Tang, Xiubo; Lu, Xiaoming","Iron(II) and Cobalt(II) 2-(Benzimidazolyl)-6-(1-(arylimino)ethyl)pyridyl Complexes as Catalysts for Ethylene Oligomerization and Polymerization","Organometallics","2007","26","10","2720","","10.1021/om0700819","","","0.71073","MoKα","","","0.0468","","","0.1499","0.1705","","","","","","1.042","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083639","17.9085","0.0005","8.3223","0.0002","25.3872","0.0007","90","","90","","90","","3783.71","0.17","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","(E)-2,6-dichloro-N-(1-(6-(1-methyl-1H-benzo[d]imidazol-2-yl) pyridin-2-yl)ethylidene)benzenamine","","- C21 H16 Cl2 N4 O0 -","- C21 H16 Cl2 N4 -","- C168 H128 Cl16 N32 -","8","1","","Sun, Wen-Hua; Hao, Peng; Zhang, Shu; Shi, Qisong; Zuo, Weiwei; Tang, Xiubo; Lu, Xiaoming","Iron(II) and Cobalt(II) 2-(Benzimidazolyl)-6-(1-(arylimino)ethyl)pyridyl Complexes as Catalysts for Ethylene Oligomerization and Polymerization","Organometallics","2007","26","10","2720","","10.1021/om0700819","","","0.71073","MoKα","","","0.0447","","","0.1215","0.137","","","","","","0.994","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083640","12.8592","0.0009","8.8271","0.0006","23.0969","0.0016","90","","101.934","0.004","90","","2565.1","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","{(E)-2,6-dimethyl-N-(1-(6-(1-methyl-1H-benzo[d]imidazol-2-yl) pyridin-2-yl)ethylidene)benzenamine}dichloroiron","","- C23 H22 Cl2 Fe N4 O -","- C23 H22 Cl2 Fe N4 O -","- C92 H88 Cl8 Fe4 N16 O4 -","4","1","","Sun, Wen-Hua; Hao, Peng; Zhang, Shu; Shi, Qisong; Zuo, Weiwei; Tang, Xiubo; Lu, Xiaoming","Iron(II) and Cobalt(II) 2-(Benzimidazolyl)-6-(1-(arylimino)ethyl)pyridyl Complexes as Catalysts for Ethylene Oligomerization and Polymerization","Organometallics","2007","26","10","2720","","10.1021/om0700819","","","0.71073","MoKα","","","0.0592","","","0.1823","0.2183","","","","","","0.822","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083641","10.221","0.0003","15.1437","0.0004","14.1708","0.0004","90","","97.857","0.002","90","","2172.82","0.11","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{(E)-2,6-dichloro-N-(1-(6-(1-methyl-1H-benzo[d]imidazol-2-yl) pyridin-2-yl)ethylidene)benzenamine}chloroiron","","- C21 H16 Cl4 Fe N4 O0 -","- C21 H16 Cl4 Fe N4 -","- C84 H64 Cl16 Fe4 N16 -","4","1","","Sun, Wen-Hua; Hao, Peng; Zhang, Shu; Shi, Qisong; Zuo, Weiwei; Tang, Xiubo; Lu, Xiaoming","Iron(II) and Cobalt(II) 2-(Benzimidazolyl)-6-(1-(arylimino)ethyl)pyridyl Complexes as Catalysts for Ethylene Oligomerization and Polymerization","Organometallics","2007","26","10","2720","","10.1021/om0700819","","","0.71073","MoKα","","","0.0434","","","0.1094","0.1234","","","","","","1.058","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083642","8.1428","0.0001","15.0548","0.0002","18.0755","0.0003","90","","96.146","0.001","90","","2203.11","0.05","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","{(E)-2,6-dimethyl-N-(1-(6-(1-methyl-1H-benzo[d]imidazol-2-yl) pyridin-2-yl)ethylidene)benzenamine}dichlorocobalt","","- C23 H22 Cl2 Co N4 O0 -","- C23 H22 Cl2 Co N4 -","- C92 H88 Cl8 Co4 N16 -","4","1","","Sun, Wen-Hua; Hao, Peng; Zhang, Shu; Shi, Qisong; Zuo, Weiwei; Tang, Xiubo; Lu, Xiaoming","Iron(II) and Cobalt(II) 2-(Benzimidazolyl)-6-(1-(arylimino)ethyl)pyridyl Complexes as Catalysts for Ethylene Oligomerization and Polymerization","Organometallics","2007","26","10","2720","","10.1021/om0700819","","","0.71073","MoKα","","","0.0317","","","0.0897","0.0934","","","","","","1.048","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083643","9.5729","0.0001","14.1768","0.0002","18.5031","0.0003","90","","95.501","0.001","90","","2499.55","0.06","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","{(E)-2,6-diethyl-N-(1-(6-(1-methyl-1H-benzo[d]imidazol-2-yl) pyridin-2-yl)ethylidene)benzenamine}dichlorocobalt","","- C25 H26 Cl2 Co N4 -","- C25 H26 Cl2 Co N4 -","- C100 H104 Cl8 Co4 N16 -","4","1","","Sun, Wen-Hua; Hao, Peng; Zhang, Shu; Shi, Qisong; Zuo, Weiwei; Tang, Xiubo; Lu, Xiaoming","Iron(II) and Cobalt(II) 2-(Benzimidazolyl)-6-(1-(arylimino)ethyl)pyridyl Complexes as Catalysts for Ethylene Oligomerization and Polymerization","Organometallics","2007","26","10","2720","","10.1021/om0700819","","","0.71073","MoKα","","","0.0577","","","0.1801","0.1963","","","","","","1.087","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083644","10.1894","0.0003","15.1037","0.0005","14.1505","0.0004","90","","98.085","0.002","90","","2156.08","0.11","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","{(E)-2,6-dichloro-N-(1-(6-(1-methyl-1H-benzo[d]imidazol-2-yl) pyridin-2-yl)ethylidene)benzenamine}dichlorocobalt","","- C21 H16 Cl4 Co N4 -","- C21 H16 Cl4 Co N4 -","- C84 H64 Cl16 Co4 N16 -","4","1","","Sun, Wen-Hua; Hao, Peng; Zhang, Shu; Shi, Qisong; Zuo, Weiwei; Tang, Xiubo; Lu, Xiaoming","Iron(II) and Cobalt(II) 2-(Benzimidazolyl)-6-(1-(arylimino)ethyl)pyridyl Complexes as Catalysts for Ethylene Oligomerization and Polymerization","Organometallics","2007","26","10","2720","","10.1021/om0700819","","","0.71073","MoKα","","","0.0309","","","0.086","0.091","","","","","","1.084","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083645","12.245","0.003","15.001","0.004","19.71","0.005","90","","93.793","0.004","90","","3612.5","1.6","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C88.6 H94.18 Mo N O6.65 -","- C88.592 H94.184 Mo N O6.648 -","- C177.184 H188.368 Mo2 N2 O13.296 -","2","1","","Singh, Rojendra; Czekelius, Constantin; Schrock, Richard R.; Müller, Peter; Hoveyda, Amir H.","Molybdenum Imido Alkylidene Metathesis Catalysts that Contain Electron Withdrawing Biphenolates or Binaphtholates.","Organometallics","2007","26","10","2528","2539","10.1021/om061134+","","","0.71073","MoKα","","0.0551","0.0461","","","0.1203","0.1263","","","","","","1.036","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4083646","12.7386","0.0014","12.9783","0.0016","15.7794","0.0019","76.012","0.004","80.948","0.003","61.683","0.003","2225.7","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H61 F6 Mo N O3 -","- C48 H61 F6 Mo N O3 -","- C96 H122 F12 Mo2 N2 O6 -","2","1","","Singh, Rojendra; Czekelius, Constantin; Schrock, Richard R.; Müller, Peter; Hoveyda, Amir H.","Molybdenum Imido Alkylidene Metathesis Catalysts that Contain Electron Withdrawing Biphenolates or Binaphtholates.","Organometallics","2007","26","10","2528","2539","10.1021/om061134+","","","0.71073","MoKα","","0.0505","0.0403","","","0.0906","0.0942","","","","","","1.026","","","","has coordinates,has disorder","178725","2020-10-21","18:00:00",""
"4083647","12.5485","0.0003","25.4035","0.0004","13.0279","0.0003","90","","92.071","0.001","90","","4150.27","0.15","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C48 H54 N4 P2 -","- C48 H54 N4 P2 -","- C192 H216 N16 P8 -","4","1","","Ahmed, Shabana A.; Hill, Michael S.; Hitchcock, Peter B.; Mansell, Stephen M.; St John, Oliver","DACH-Bridged (DACH =trans-1,2-Diaminocyclohexane) Bis(iminophosphonamide) Derivatives of Groups 3 and 13 and Their Use in the Enantiomorphic Polymerization of Methyl Methacrylate","Organometallics","2007","26","3","538","","10.1021/om060860+","","x-ray","0.71073","MoKα","","0.0668","0.051","","","0.1212","0.129","","","","","","1.106","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083648","11.745","0.0003","19.6556","0.0006","17.8171","0.0006","90","","106.376","0.002","90","","3946.3","0.2","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H50 N4 P2 -","- C46 H50 N4 P2 -","- C184 H200 N16 P8 -","4","1","","Ahmed, Shabana A.; Hill, Michael S.; Hitchcock, Peter B.; Mansell, Stephen M.; St John, Oliver","DACH-Bridged (DACH =trans-1,2-Diaminocyclohexane) Bis(iminophosphonamide) Derivatives of Groups 3 and 13 and Their Use in the Enantiomorphic Polymerization of Methyl Methacrylate","Organometallics","2007","26","3","538","","10.1021/om060860+","","x-ray","0.71073","MoKα","","0.1001","0.0527","","","0.0994","0.116","","","","","","1.016","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083649","21.2255","0.0008","11.0889","0.0003","22.1562","0.0009","90","","94.607","0.002","90","","5198","0.3","173","2","173","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C56 H68 Li2 N4 O2 P2 -","- C56 H68 Li2 N4 O2 P2 -","- C224 H272 Li8 N16 O8 P8 -","4","0.5","","Ahmed, Shabana A.; Hill, Michael S.; Hitchcock, Peter B.; Mansell, Stephen M.; St John, Oliver","DACH-Bridged (DACH =trans-1,2-Diaminocyclohexane) Bis(iminophosphonamide) Derivatives of Groups 3 and 13 and Their Use in the Enantiomorphic Polymerization of Methyl Methacrylate","Organometallics","2007","26","3","538","","10.1021/om060860+","","x-ray","0.71073","MoKα","","0.1058","0.0602","","","0.1371","0.1611","","","","","","1.002","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083650","16.9962","0.0003","15.3015","0.0003","17.2349","0.0003","90","","94.439","0.001","90","","4468.79","0.14","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H57 Al N4 P2 -","- C50 H57 Al N4 P2 -","- C200 H228 Al4 N16 P8 -","4","1","","Ahmed, Shabana A.; Hill, Michael S.; Hitchcock, Peter B.; Mansell, Stephen M.; St John, Oliver","DACH-Bridged (DACH =trans-1,2-Diaminocyclohexane) Bis(iminophosphonamide) Derivatives of Groups 3 and 13 and Their Use in the Enantiomorphic Polymerization of Methyl Methacrylate","Organometallics","2007","26","3","538","","10.1021/om060860+","","x-ray","0.71073","MoKα","","0.0499","0.0398","","","0.0997","0.1068","","","","","","1.053","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4083651","11.1385","0.0006","22.2343","0.0011","17.2163","0.0008","90","","93.876","0.003","90","","4254","0.4","173","2","173","2","","","","","","","synthesis as described","5","C 1 c 1","C -2yc","9","","","","- C48 H53 Al N4 P2 -","- C48 H53 Al N4 P2 -","- C192 H212 Al4 N16 P8 -","4","1","","Ahmed, Shabana A.; Hill, Michael S.; Hitchcock, Peter B.; Mansell, Stephen M.; St John, Oliver","DACH-Bridged (DACH =trans-1,2-Diaminocyclohexane) Bis(iminophosphonamide) Derivatives of Groups 3 and 13 and Their Use in the Enantiomorphic Polymerization of Methyl Methacrylate","Organometallics","2007","26","3","538","","10.1021/om060860+","","x-ray","0.71073","MoKα","","0.0893","0.0558","","","0.1038","0.1182","","","","","","1.01","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083652","10.7589","0.0003","20.0262","0.0005","24.1643","0.0008","90","","91.247","0.001","90","","5205.2","0.3","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H72 Al2 N4 P2 -","- C56 H72 Al2 N4 P2 -","- C224 H288 Al8 N16 P8 -","4","1","","Ahmed, Shabana A.; Hill, Michael S.; Hitchcock, Peter B.; Mansell, Stephen M.; St John, Oliver","DACH-Bridged (DACH =trans-1,2-Diaminocyclohexane) Bis(iminophosphonamide) Derivatives of Groups 3 and 13 and Their Use in the Enantiomorphic Polymerization of Methyl Methacrylate","Organometallics","2007","26","3","538","","10.1021/om060860+","","x-ray","0.71073","MoKα","","0.1227","0.0698","","","0.1547","0.1795","","","","","","1.018","","","","has coordinates,has disorder","178725","2020-10-21","18:00:00",""
"4083653","19.9804","0.0006","17.5058","0.0006","17.2688","0.0004","90","","109.735","0.002","90","","5685.4","0.3","173","2","173","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C61 H76 Al2 N4 P2 -","- C61 H68 Al2 N4 P2 -","- C244 H272 Al8 N16 P8 -","4","0.5","","Ahmed, Shabana A.; Hill, Michael S.; Hitchcock, Peter B.; Mansell, Stephen M.; St John, Oliver","DACH-Bridged (DACH =trans-1,2-Diaminocyclohexane) Bis(iminophosphonamide) Derivatives of Groups 3 and 13 and Their Use in the Enantiomorphic Polymerization of Methyl Methacrylate","Organometallics","2007","26","3","538","","10.1021/om060860+","","x-ray","0.71073","MoKα","","0.1149","0.0846","","","0.2375","0.2643","","","","","","1.027","","","","has coordinates,has disorder","178725","2020-10-21","18:00:00",""
"4083654","9.6071","0.0006","14.9814","0.001","19.1994","0.0013","90","","90","","90","","2763.3","0.3","273","2","273","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C24 H29 B F10 N P Si -","- C24 H29 B F10 N P Si -","- C96 H116 B4 F40 N4 P4 Si4 -","4","1","","Alhomaidan, Osamah; Hollink, Emily; Stephan, Douglas W.","Main Group Heterocycles from Lithiated Phosphinimines","Organometallics","2007","26","12","3041","","10.1021/om070154o","","","0.71073","MoKα","","0.0354","0.0321","","","0.0809","0.0838","","","","","","1.039","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083655","12.3506","0.0019","23.052","0.004","12.2362","0.0019","90","","94.344","0.002","90","","3473.7","1","296","2","296","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C36 H37 B F10 N P -","- C36 H37 B F10 N P -","- C144 H148 B4 F40 N4 P4 -","4","1","","Alhomaidan, Osamah; Hollink, Emily; Stephan, Douglas W.","Main Group Heterocycles from Lithiated Phosphinimines","Organometallics","2007","26","12","3041","","10.1021/om070154o","","","0.71073","MoKα","","0.0679","0.0512","","","0.1344","0.149","","","","","","1.018","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083656","9.7085","0.0011","17.605","0.002","10.1862","0.0012","90","","113.078","0.001","90","","1601.7","0.3","298","2","298","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C30 H33 B F10 N P Si -","- C30 H33 B F10 N P Si -","- C60 H66 B2 F20 N2 P2 Si2 -","2","1","","Alhomaidan, Osamah; Hollink, Emily; Stephan, Douglas W.","Main Group Heterocycles from Lithiated Phosphinimines","Organometallics","2007","26","12","3041","","10.1021/om070154o","","","0.71073","MoKα","","0.0586","0.0445","","","0.1131","0.1229","","","","","","1.011","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083657","15.672","0.002","13.783","0.002","18.216","0.003","90","","111.9","0.002","90","","3650.8","0.9","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H62 Li2 N2 P2 Si2 -","- C28 H62 Li2 N2 P2 Si2 -","- C112 H248 Li8 N8 P8 Si8 -","4","1","","Alhomaidan, Osamah; Hollink, Emily; Stephan, Douglas W.","Main Group Heterocycles from Lithiated Phosphinimines","Organometallics","2007","26","12","3041","","10.1021/om070154o","","","0.71073","MoKα","","0.1019","0.0596","","","0.1555","0.1911","","","","","","1.021","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083658","17.277","0.004","8.5002","0.0019","19.357","0.004","90","","95.428","0.003","90","","2830","1.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H33 B F10 N P Si -","- C26 H33 B F10 N P Si -","- C104 H132 B4 F40 N4 P4 Si4 -","4","1","","Alhomaidan, Osamah; Hollink, Emily; Stephan, Douglas W.","Main Group Heterocycles from Lithiated Phosphinimines","Organometallics","2007","26","12","3041","","10.1021/om070154o","","","0.71073","MoKα","","0.0831","0.0484","","","0.1195","0.1375","","","","","","1.017","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083659","11.825","0.007","15.73","0.009","16.846","0.01","90","","110.55","0.01","90","","2934","3","273","2","273","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C24 H30 B Cl F10 N P Si -","- C24 H30 B Cl F10 N P Si -","- C96 H120 B4 Cl4 F40 N4 P4 Si4 -","4","1","","Alhomaidan, Osamah; Hollink, Emily; Stephan, Douglas W.","Main Group Heterocycles from Lithiated Phosphinimines","Organometallics","2007","26","12","3041","","10.1021/om070154o","","","0.71073","MoKα","","0.1354","0.0527","","","0.1147","0.1502","","","","","","0.733","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083660","9.4554","0.0018","24.569","0.005","20.408","0.004","90","","99.463","0.002","90","","4676.5","1.6","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H21 B F10 N P -","- C21 H21 B F10 N P -","- C168 H168 B8 F80 N8 P8 -","8","2","","Alhomaidan, Osamah; Hollink, Emily; Stephan, Douglas W.","Main Group Heterocycles from Lithiated Phosphinimines","Organometallics","2007","26","12","3041","","10.1021/om070154o","","","0.71073","MoKα","","0.1851","0.0794","","","0.1857","0.2709","","","","","","1.062","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083661","6.707","0.006","31.633","0.007","9.144","0.003","90","","101.34","0.04","90","","1902.1","1.9","298.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H15 Br2 O P -","- C22 H15 Br2 O P -","- C88 H60 Br8 O4 P4 -","4","1","","Mustafizur Rahman, A. F. M.; Murafuji, Toshihiro; Shibasaki, Toshihisa; Suetake, Kouichi; Kurotobi, Kei; Sugihara, Yoshikazu; Azuma, Nagao; Mikata, Yuji","Characterization of Azulenylphosphine Derivatives. Unexpected Debromination and Its Synthetic Utility in the Preparation of 2-Substituted Azulene","Organometallics","2007","26","12","2971","","10.1021/om0607090","","","0.7107","MoKα","","","0.0598","","","","0.1964","","","","","","0.951","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4083662","9.984","0.005","9.519","0.005","18.881","0.01","90","","95.74","0.002","90","","1785.4","1.6","173.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 Br O P -","- C22 H16 Br O P -","- C88 H64 Br4 O4 P4 -","4","1","","Mustafizur Rahman, A. F. M.; Murafuji, Toshihiro; Shibasaki, Toshihisa; Suetake, Kouichi; Kurotobi, Kei; Sugihara, Yoshikazu; Azuma, Nagao; Mikata, Yuji","Characterization of Azulenylphosphine Derivatives. Unexpected Debromination and Its Synthetic Utility in the Preparation of 2-Substituted Azulene","Organometallics","2007","26","12","2971","","10.1021/om0607090","","","0.7107","MoKalpha","","","0.046","","","","0.11","","","","","","0.955","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4083663","11.766","0.0008","7.981","0.0006","17.774","0.0009","90","0.006","90.837","0.005","90","0.006","1668.88","0.19","292","2","292","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C11 H13 Cl F3 O5 S Sb -","- C11 H13 Cl F3 O5 S Sb -","- C44 H52 Cl4 F12 O20 S4 Sb4 -","4","1","","Dostál, Libor; Novák, Petr; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Jirásko, Robert; Holeček, Jaroslav","Synthesis and Structural Study of Organoantimony(III) and Organobismuth(III) Triflates and Cations Containing O,C,O-Pincer Type Ligands†","Organometallics","2007","26","11","2911","","10.1021/om070186b","","","0.71073","MoKα","","0.0956","0.0682","","","0.1779","0.2091","","","","","","1.099","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083664","12.786","0.0012","15.094","0.0014","11.514","0.0011","90","0.007","101.349","0.006","90","0.007","2178.7","0.4","150","1","150","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H25 Bi Cl F3 O5 S -","- C17 H25 Bi Cl F3 O5 S -","- C68 H100 Bi4 Cl4 F12 O20 S4 -","4","1","","Dostál, Libor; Novák, Petr; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Jirásko, Robert; Holeček, Jaroslav","Synthesis and Structural Study of Organoantimony(III) and Organobismuth(III) Triflates and Cations Containing O,C,O-Pincer Type Ligands†","Organometallics","2007","26","11","2911","","10.1021/om070186b","","","0.71073","MoKα","","0.0873","0.0536","","","0.0988","0.1151","","","","","","1.135","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083665","12.233","0.0006","12.292","0.0006","13.981","0.0005","68.775","0.003","81.296","0.003","87.817","0.002","1936.8","0.16","150","2","150","2","","","","","","","synthesized by the authors","6","P -1","-P 1","2","","","","- C12 H13 F6 O8 S2 Sb -","- C12 H13 F6 O8 S2 Sb -","- C48 H52 F24 O32 S8 Sb4 -","4","2","","Dostál, Libor; Novák, Petr; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Jirásko, Robert; Holeček, Jaroslav","Synthesis and Structural Study of Organoantimony(III) and Organobismuth(III) Triflates and Cations Containing O,C,O-Pincer Type Ligands†","Organometallics","2007","26","11","2911","","10.1021/om070186b","","","0.71073","MoKα","","0.0656","0.0423","","","0.0956","0.1046","","","","","","1.051","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083666","10.309","0.0004","12.556","0.0009","13.514","0.0008","97.763","0.005","111.887","0.004","114.022","0.005","1395.1","0.18","150","1","150","1","","","","","","","","7","P -1","-P 1","2","","","","- C19 H27 Bi Cl2 F6 O8 S2 -","- C19 H27 Bi Cl2 F6 O8 S2 -","- C38 H54 Bi2 Cl4 F12 O16 S4 -","2","1","","Dostál, Libor; Novák, Petr; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Jirásko, Robert; Holeček, Jaroslav","Synthesis and Structural Study of Organoantimony(III) and Organobismuth(III) Triflates and Cations Containing O,C,O-Pincer Type Ligands†","Organometallics","2007","26","11","2911","","10.1021/om070186b","","","0.71073","MoKα","","0.0712","0.0514","","","0.1265","0.1413","","","","","","1.094","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4083667","15.29","0.0013","11.373","0.0008","16.153","0.0009","90","0.006","117.88","0.006","90","0.007","2482.9","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H33 B11 Cl O3 Sb -","- C15 H33 B11 Cl O3 Sb -","- C60 H132 B44 Cl4 O12 Sb4 -","4","1","","Dostál, Libor; Novák, Petr; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Jirásko, Robert; Holeček, Jaroslav","Synthesis and Structural Study of Organoantimony(III) and Organobismuth(III) Triflates and Cations Containing O,C,O-Pincer Type Ligands†","Organometallics","2007","26","11","2911","","10.1021/om070186b","","","0.71073","MoKα","","0.1222","0.054","","","0.0859","0.1029","","","","","","1.047","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083668","19.906","","12.971","","22.153","","90","","100.13","","90","","5630.75","","150","1","150","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C17.5 H38 B11 Bi Cl2 O2 -","- C17.5 H38 B11 Bi Cl2 O2 -","- C140 H304 B88 Bi8 Cl16 O16 -","8","1","","Dostál, Libor; Novák, Petr; Jambor, Roman; Růžička, Aleš; Císařová, Ivana; Jirásko, Robert; Holeček, Jaroslav","Synthesis and Structural Study of Organoantimony(III) and Organobismuth(III) Triflates and Cations Containing O,C,O-Pincer Type Ligands†","Organometallics","2007","26","11","2911","","10.1021/om070186b","","","0.71073","MoKα","","0.0633","0.0485","","","0.1222","0.1441","","","","","","1.125","","","","has coordinates","264242","2021-04-16","08:51:14",""
"4083669","13.2574","0.0003","18.3797","0.0003","18.472","0.0003","88.757","0.001","82.782","0.001","86.7","0.001","4457.47","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C110 H92 Ge2 P4 Pt2 -","- C110 H92 Ge2 P4 Pt2 -","- C220 H184 Ge4 P8 Pt4 -","2","1","","White, Colin P.; Braddock-Wilking, Janet; Corey, Joyce Y.; Xu, Huan; Redekop, Evgeniy; Sedinkin, Sergey; Rath, Nigam P.","Activation of Group 14 El−H Bonds at Platinum(0)","Organometallics","2007","26","8","1996","","10.1021/om061180+","","","0.71073","MoKα","","0.1017","0.0469","","","0.07","0.0832","","","","","","0.994","","","","has coordinates,has disorder","178725","2020-10-21","18:00:00",""
"4083670","20.0078","0.0006","14.6737","0.0004","15.2414","0.0005","90","","90","","90","","4474.7","0.2","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C54 H54 Ge P2 Pt -","- C54 H54 Ge P2 Pt -","- C216 H216 Ge4 P8 Pt4 -","4","1","","White, Colin P.; Braddock-Wilking, Janet; Corey, Joyce Y.; Xu, Huan; Redekop, Evgeniy; Sedinkin, Sergey; Rath, Nigam P.","Activation of Group 14 El−H Bonds at Platinum(0)","Organometallics","2007","26","8","1996","","10.1021/om061180+","","","0.71073","MoKα","","0.0591","0.0348","","","0.0533","0.0603","","","","","","0.941","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083671","9.9959","0.0002","12.539","0.0002","12.8678","0.0002","112.428","0.001","98.04","0.001","102.736","0.001","1408.57","0.05","170","2","170","2","","","","","","","","5","P -1","-P 1","2","","","","- C67 H60 P2 Pt2 Si2 -","- C67 H57 P2 Pt2 Si2 -","- C67 H57 P2 Pt2 Si2 -","1","0.5","","White, Colin P.; Braddock-Wilking, Janet; Corey, Joyce Y.; Xu, Huan; Redekop, Evgeniy; Sedinkin, Sergey; Rath, Nigam P.","Activation of Group 14 El−H Bonds at Platinum(0)","Organometallics","2007","26","8","1996","","10.1021/om061180+","","","0.71073","MoKα","","0.0345","0.0286","","","0.0685","0.0716","","","","","","1.027","","","","has coordinates,has disorder","178725","2020-10-21","18:00:00",""
"4083672","13.409","0.004","10.221","0.003","21.136","0.007","90","","97.111","0.005","90","","2874.5","1.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H34 N4 Yb2 -","- C32 H34 N4 Yb2 -","- C128 H136 N16 Yb8 -","4","1","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0435","0.0325","","","0.0617","0.0645","","","","","","0.937","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083673","12.774","0.004","13.259","0.004","17.183","0.006","87.481","0.004","72.551","0.004","76.386","0.004","2697.3","1.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C57 H81 N7 O1.5 Yb2 -","- C57 H77 N7 O1.5 Yb2 -","- C114 H154 N14 O3 Yb4 -","2","1","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0628","0.041","","","0.1115","0.1245","","","","","","1.013","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4083674","15.177","0.011","10.778","0.008","26.82","0.02","90","","90.859","0.01","90","","4387","6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H68 N7 O Yb -","- C45 H68 N7 O Yb -","- C180 H272 N28 O4 Yb4 -","4","1","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0881","0.0742","","","0.1809","0.1865","","","","","","1.174","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083675","11.888","0.002","12.474","0.003","18.948","0.003","89.943","0.002","107.317","0.002","114.887","0.003","2408.2","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H77 N6 O2 Yb -","- C50 H77 N6 O2 Yb -","- C100 H154 N12 O4 Yb2 -","2","1","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0435","0.0332","","","0.0695","0.072","","","","","","0.949","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083676","20.31","0.006","42.705","0.012","9.543","0.003","90","","90","","90","","8277","4","293","2","293","2","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C42 H54 N4 O Yb2 -","- C42 H54 N4 O Yb2 -","- C336 H432 N32 O8 Yb16 -","8","1","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0688","0.0392","","","0.1043","0.1243","","","","","","0.982","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083677","8.743","0.003","11.184","0.003","15.741","0.005","90","","90","","90","","1539.2","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H19 N2 Yb -","- C17 H19 N2 Yb -","- C68 H76 N8 Yb4 -","4","1","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0274","0.0264","","","0.0636","0.064","","","","","","1.041","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083678","40.03","0.02","10.439","0.006","13.111","0.008","90","","90","","90","","5479","5","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C30 H30 N4 Yb2 -","- C30 H30 N4 Yb2 -","- C240 H240 N32 Yb16 -","8","0.5","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0598","0.0551","","","0.1343","0.1364","","","","","","1.027","","","","has coordinates,has disorder","178725","2020-10-21","18:00:00",""
"4083679","16.007","0.005","32.816","0.009","10.753","0.003","90","","90","","90","","5648","3","293","2","293","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C30 H41 N4 Yb -","- C30 H41 N4 Yb -","- C240 H328 N32 Yb8 -","8","1","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0495","0.0311","","","0.071","0.0768","","","","","","1.098","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083680","19.693","0.007","18.826","0.006","16.666","0.006","90","","113.394","0.004","90","","5671","3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H32 N6 Yb2 -","- C30 H32 N6 Yb2 -","- C240 H256 N48 Yb16 -","8","2","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0732","0.0431","","","0.0839","0.0934","","","","","","0.875","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083681","11.191","0.004","15.599","0.005","36.782","0.011","90","","94.926","0.005","90","","6397","4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H34 N4 Yb2 -","- C38 H34 N4 Yb2 -","- C304 H272 N32 Yb16 -","8","2","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0714","0.0422","","","0.0678","0.0743","","","","","","0.949","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083682","23.396","0.005","23.396","0.005","10.755","0.004","90","","90","","90","","5887","3","293","2","293","2","","","","","","","","4","I -4","I -4","82","","","","- C32 H39 N4 Yb -","- C32 H39 N4 Yb -","- C256 H312 N32 Yb8 -","8","1","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0331","0.0275","","","0.0449","0.0459","","","","","","0.912","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083683","7.979","0.003","9.383","0.004","29.536","0.012","90","","90","","90","","2211.3","1.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H31 N4 Yb -","- C23 H31 N4 Yb -","- C92 H124 N16 Yb4 -","4","1","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0336","0.0316","","","0.0706","0.0712","","","","","","1.093","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083684","8.357","0.002","9.922","0.003","28.681","0.008","90","","90","","90","","2378.2","1.1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H32 N4 Yb -","- C24 H32 N4 Yb -","- C96 H128 N16 Yb4 -","4","1","","Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng","Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes","Organometallics","2007","26","8","1934","","10.1021/om061094+","","","0.71073","MoKα","","0.0289","0.0252","","","0.0424","0.0431","","","","","","0.96","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4083685","16.5266","0.0016","15.5034","0.0015","21.809","0.002","90","","106.703","0.001","90","","5352.1","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C66 H70 Cl0 O4 Sm2 -","- C58 H58 O4 Sm2 -","- C232 H232 O16 Sm8 -","4","1","","Rabe, Gerd W.; Riederer, Florian A.; Zhang-Presse, Mei; Rheingold, Arnold L.","A Partially Demethylated Donor-Functionalized Terphenyl Lanthanide Compound","Organometallics","2007","26","23","5724","","10.1021/om070010+","","","0.71073","MoKα","","0.0268","0.0226","","","0.0722","0.0743","","","","","","1.02","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083686","10.477","0.003","31.172","0.009","8.232","0.003","90","","107.43","0.006","90","","2565","1.4","198","2","198","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H33 Cl O2 Yb -","- C30 H33 Cl O2 Yb -","- C120 H132 Cl4 O8 Yb4 -","4","1","","Rabe, Gerd W.; Riederer, Florian A.; Zhang-Presse, Mei; Rheingold, Arnold L.","A Partially Demethylated Donor-Functionalized Terphenyl Lanthanide Compound","Organometallics","2007","26","23","5724","","10.1021/om070010+","","","0.71073","MoKα","","0.0661","0.0554","","","0.1379","0.1444","","","","","","1.125","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083687","12.3271","0.0004","13.8358","0.0004","15.1325","0.0005","90","","90","","90","","2580.93","0.14","150","1","150","1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C20 H46 Br N2 O P2 Re -","- C20 H46 Br N2 O P2 Re -","- C80 H184 Br4 N8 O4 P8 Re4 -","4","1","","Choualeb, Aldjia; Lough, Alan J.; Gusev, Dmitry G.","Hydridic Rhenium Nitrosyl Complexes with Pincer-Type PNP Ligands","Organometallics","2007","26","14","3509","","10.1021/om070206+","","","0.71073","MoKα","","0.0462","0.0347","","","0.0666","0.0702","","","","","","1.067","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083688","14.3447","0.0002","13.4055","0.0002","21.8565","0.0004","90","","90","","90","","4202.96","0.12","150","1","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C16 H39 N2 O P2 Re -","- C16 H39 N2 O P2 Re -","- C128 H312 N16 O8 P16 Re8 -","8","1","","Choualeb, Aldjia; Lough, Alan J.; Gusev, Dmitry G.","Hydridic Rhenium Nitrosyl Complexes with Pincer-Type PNP Ligands","Organometallics","2007","26","14","3509","","10.1021/om070206+","","","0.71073","MoKα","","0.0556","0.037","","","0.0826","0.0911","","","","","","1.121","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083689","16.576","0.003","11.509","0.004","17.059","0.002","90","","115.36","0.02","90","","2940.8","1.3","293","2","250","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C33 H37 Li N4 O -","- C33 H37 Li N4 O -","- C132 H148 Li4 N16 O4 -","4","1","","Otero, Antonio; Fernández-Baeza, Juan; Antiñolo, Antonio; Tejeda, Juan; Lara-Sánchez, Agustín; Sánchez-Barba, Luis F.; Sánchez-Molina, Margarita; Rodríguez, Ana M.; Bo, Carles; Urbano-Cuadrado, Manuel","Expanding Heteroscorpionates. Facile Synthesis of New Hybrid Scorpionate/Cyclopentadienyl Ligands and Their Lithium and Group 4 Metal Compounds: A Combined Experimental and Density Functional Theory Study","Organometallics","2007","26","17","4310","","10.1021/om7003942","","","0.71073","MoKα","","0.3313","0.0745","","","0.1333","0.1996","","","","","","0.902","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083690","8.98","0.0012","15.405","0.002","17.817","0.003","90","","98.094","0.003","90","","2440.2","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H37 Li N4 O -","- C25 H37 Li N4 O -","- C100 H148 Li4 N16 O4 -","4","1","","Otero, Antonio; Fernández-Baeza, Juan; Antiñolo, Antonio; Tejeda, Juan; Lara-Sánchez, Agustín; Sánchez-Barba, Luis F.; Sánchez-Molina, Margarita; Rodríguez, Ana M.; Bo, Carles; Urbano-Cuadrado, Manuel","Expanding Heteroscorpionates. Facile Synthesis of New Hybrid Scorpionate/Cyclopentadienyl Ligands and Their Lithium and Group 4 Metal Compounds: A Combined Experimental and Density Functional Theory Study","Organometallics","2007","26","17","4310","","10.1021/om7003942","","","0.71073","MoKα","","0.1421","0.0647","","","0.1574","0.1894","","","","","","1.025","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083691","8.9328","0.0012","9.6301","0.0013","12.1514","0.0016","106.294","0.003","96.654","0.003","94.664","0.003","989.4","0.2","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C23 H26 N4 -","- C23 H26 N4 -","- C46 H52 N8 -","2","1","","Otero, Antonio; Fernández-Baeza, Juan; Antiñolo, Antonio; Tejeda, Juan; Lara-Sánchez, Agustín; Sánchez-Barba, Luis F.; Sánchez-Molina, Margarita; Rodríguez, Ana M.; Bo, Carles; Urbano-Cuadrado, Manuel","Expanding Heteroscorpionates. Facile Synthesis of New Hybrid Scorpionate/Cyclopentadienyl Ligands and Their Lithium and Group 4 Metal Compounds: A Combined Experimental and Density Functional Theory Study","Organometallics","2007","26","17","4310","","10.1021/om7003942","","","0.71073","MoKα","","0.1344","0.0754","","","0.1918","0.2199","","","","","","1.058","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083692","12.222","0.0011","23.628","0.002","12.8891","0.0012","90","","100.935","0.002","90","","3654.5","0.6","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H45 Cl3 N4 O2 Zr -","- C37 H37 Cl3 N4 O2 Zr -","- C148 H148 Cl12 N16 O8 Zr4 -","4","1","","Otero, Antonio; Fernández-Baeza, Juan; Antiñolo, Antonio; Tejeda, Juan; Lara-Sánchez, Agustín; Sánchez-Barba, Luis F.; Sánchez-Molina, Margarita; Rodríguez, Ana M.; Bo, Carles; Urbano-Cuadrado, Manuel","Expanding Heteroscorpionates. Facile Synthesis of New Hybrid Scorpionate/Cyclopentadienyl Ligands and Their Lithium and Group 4 Metal Compounds: A Combined Experimental and Density Functional Theory Study","Organometallics","2007","26","17","4310","","10.1021/om7003942","","","0.71073","MoKα","","0.0837","0.0538","","","0.153","0.1716","","","","","","1.038","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083693","9.901","0.0002","10.8544","0.0002","11.0362","0.0002","62.365","0.001","69.458","0.001","63.26","0.001","923.1","0.03","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[2-(1-methyl-2-benzoimidazole)-6-methylpyridine]dichloronickel","","- C16 H21 Cl2 N3 Ni O2 -","- C16 H21 Cl2 N3 Ni O2 -","- C32 H42 Cl4 N6 Ni2 O4 -","2","1","","Hao, Peng; Zhang, Shu; Sun, Wen-Hua; Shi, Qisong; Adewuyi, Sherrif; Lu, Xiaoming; Li, Peizhou","Synthesis, Characterization and Ethylene Oligomerization Studies of Nickel Complexes Bearing 2-Benzimidazolylpyridine Derivatives","Organometallics","2007","26","9","2439","","10.1021/om070049e","","","0.71073","MoKα","","","0.0333","","","0.099","0.1028","","","","","","1.123","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083694","8.0306","0.0002","12.5947","0.0003","13.34","0.0003","71.778","0.002","86.487","0.001","86.665","0.001","1278.09","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[2-carboethoxy-6-(1-methyl-2-benzoimidazolyl)pyridine]dichloronickel","","- C21 H28 Cl2 N4 Ni O4 -","- C21 H28 Cl2 N4 Ni O4 -","- C42 H56 Cl4 N8 Ni2 O8 -","2","1","","Hao, Peng; Zhang, Shu; Sun, Wen-Hua; Shi, Qisong; Adewuyi, Sherrif; Lu, Xiaoming; Li, Peizhou","Synthesis, Characterization and Ethylene Oligomerization Studies of Nickel Complexes Bearing 2-Benzimidazolylpyridine Derivatives","Organometallics","2007","26","9","2439","","10.1021/om070049e","","","0.71073","MoKα","","","0.0435","","","0.1232","0.1406","","","","","","0.961","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083695","7.8096","0.0004","12.9994","0.0008","19.3219","0.0011","90","","93.425","0.003","90","","1958.06","0.19","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[2-acetyl-6-(1-methyl-2-benzoimidazolyl)pyridine]dichloronickel","","- C17 H21 Cl2 N3 Ni O3 -","- C17 H21 Cl2 N3 Ni O3 -","- C68 H84 Cl8 N12 Ni4 O12 -","4","1","","Hao, Peng; Zhang, Shu; Sun, Wen-Hua; Shi, Qisong; Adewuyi, Sherrif; Lu, Xiaoming; Li, Peizhou","Synthesis, Characterization and Ethylene Oligomerization Studies of Nickel Complexes Bearing 2-Benzimidazolylpyridine Derivatives","Organometallics","2007","26","9","2439","","10.1021/om070049e","","","0.71073","MoKα","","","0.0415","","","0.0881","0.1084","","","","","","0.818","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083696","8.6398","0.0003","12.7231","0.0004","12.8188","0.0004","70.687","0.001","80.101","0.001","86.354","0.001","1309.98","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","{(E)-2,6-dimethyl-N-(1-(6-(1-methyl-1H-benzo[d]imidazol-2-yl) pyridin-2-yl)ethylidene)benzenamine}dichloronickel","","- C26 H29 Cl2 N5 Ni O -","- C26 H29 Cl2 N5 Ni O -","- C52 H58 Cl4 N10 Ni2 O2 -","2","1","","Hao, Peng; Zhang, Shu; Sun, Wen-Hua; Shi, Qisong; Adewuyi, Sherrif; Lu, Xiaoming; Li, Peizhou","Synthesis, Characterization and Ethylene Oligomerization Studies of Nickel Complexes Bearing 2-Benzimidazolylpyridine Derivatives","Organometallics","2007","26","9","2439","","10.1021/om070049e","","","0.71073","MoKα","","","0.0344","","","0.1004","0.1046","","","","","","1.108","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083697","9.5439","0.0003","13.9544","0.0004","18.5858","0.0006","90","","94.433","0.002","90","","2467.84","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","{(E)-2,6-diethyl-N-(1-(6-(1-methyl-1H-benzo[d]imidazol-2-yl) pyridin-2-yl)ethylidene)benzenamine}dichloronickel","","- C25 H26 Cl2 N4 Ni -","- C25 H26 Cl2 N4 Ni -","- C100 H104 Cl8 N16 Ni4 -","4","1","","Hao, Peng; Zhang, Shu; Sun, Wen-Hua; Shi, Qisong; Adewuyi, Sherrif; Lu, Xiaoming; Li, Peizhou","Synthesis, Characterization and Ethylene Oligomerization Studies of Nickel Complexes Bearing 2-Benzimidazolylpyridine Derivatives","Organometallics","2007","26","9","2439","","10.1021/om070049e","","","0.71073","MoKα","","","0.0522","","","0.1594","0.1713","","","","","","1.088","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4083698","9.6969","0.0002","14.9381","0.0003","18.2266","0.0004","90","","91.94","0.001","90","","2638.67","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","{(E)-2,6-diisopropyl-N-(1-(6-(1-methyl-1H-benzo[d]imidazol-2-yl) pyridin-2-yl)ethylidene)benzenamine}dichloronickel","","- C27 H30 Cl2 N4 Ni -","- C27 H30 Cl2 N4 Ni -","- C108 H120 Cl8 N16 Ni4 -","4","1","","Hao, Peng; Zhang, Shu; Sun, Wen-Hua; Shi, Qisong; Adewuyi, Sherrif; Lu, Xiaoming; Li, Peizhou","Synthesis, Characterization and Ethylene Oligomerization Studies of Nickel Complexes Bearing 2-Benzimidazolylpyridine Derivatives","Organometallics","2007","26","9","2439","","10.1021/om070049e","","","0.71073","MoKα","","","0.0305","","","0.0875","0.093","","","","","","1.034","","","","has coordinates","178725","2020-10-21","18:00:00",""
"4086071","16.519","","11.058","","16.794","","90","","104.33","","90","","2972.26","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Li O C (C F3)3","","- C4 F9 Li O -","- C4 F9 Li O -","- C64 F144 Li16 O16 -","16","4","","Reisinger, A.; Trapp, N.; Krossing, I.","Ag O C (C F3)3: Synthesis and applications of the first donor-free silver(I) alkoxide","Organometallics","2007","26","","2096","2105","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4086072","6.8108","","10.122","","10.92","","85.76","","89.62","","88.93","","750.611","","","","","","","","","","","","","4","P -1","-P 1","2","","Ag O C (C F3)3","","- C4 Ag F9 O -","- C4 Ag F9 O -","- C16 Ag4 F36 O4 -","4","2","","Reisinger, A.; Trapp, N.; Krossing, I.","Ag O C (C F3)3: Synthesis and applications of the first donor-free silver(I) alkoxide","Organometallics","2007","26","","2096","2105","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4089348","11.3748","0.0011","7.4448","0.0007","25.444","0.003","90","","102.877","0.002","90","","2100.5","0.4","100","0.1","100","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","holjv69","","","- C26 H32 N4 -","- C26 H32 N4 -","- C104 H128 N16 -","4","1","","Vela, Javier; Zhu, Liwei; Flaschenriem, Christine J.; Brennessel, William W.; Lachicotte, Rene J.; Holland, Patrick L.","Macrocyclic Binucleating β-Diketiminate Ligands and their Lithium, Aluminum, and Zinc Complexes.","Organometallics","2007","26","14","3416","3423","10.1021/om0700258","","","0.71073","MoKα","","0.1367","0.0582","","","0.0858","0.1018","","","","","","0.97","","","","has coordinates,has disorder","243616","2020-10-21","18:00:00",""
"4089349","9.0355","0.0007","15.7467","0.0012","25.57","0.002","90","","90","","90","","3638.1","0.5","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","holjv11","","","- C38 H54 Li2 N4 O3 -","- C38 H54 Li2 N4 O3 -","- C152 H216 Li8 N16 O12 -","4","1","","Vela, Javier; Zhu, Liwei; Flaschenriem, Christine J.; Brennessel, William W.; Lachicotte, Rene J.; Holland, Patrick L.","Macrocyclic Binucleating β-Diketiminate Ligands and their Lithium, Aluminum, and Zinc Complexes.","Organometallics","2007","26","14","3416","3423","10.1021/om0700258","","","0.71073","MoKα","","0.0949","0.058","","","0.1285","0.1421","","","","","","1.018","","","","has coordinates","243616","2020-10-21","18:00:00",""
"4089350","17.9985","0.0016","20.5761","0.0018","22.744","0.002","90","","90","","90","","8423","1.3","100","0.1","100","0.1","","","","","","","","5","P b c a","-P 2ac 2ab","61","holjv64","","","- C42 H62 Li2 N4 O4 -","- C42 H62 Li2 N4 O4 -","- C336 H496 Li16 N32 O32 -","8","1","","Vela, Javier; Zhu, Liwei; Flaschenriem, Christine J.; Brennessel, William W.; Lachicotte, Rene J.; Holland, Patrick L.","Macrocyclic Binucleating β-Diketiminate Ligands and their Lithium, Aluminum, and Zinc Complexes.","Organometallics","2007","26","14","3416","3423","10.1021/om0700258","","","0.71073","MoKα","","0.1971","0.1459","","","0.4443","0.4922","","","","","","1.794","","","","has coordinates,has disorder","243616","2020-10-21","18:00:00",""
"4089351","9.0065","0.0004","15.1913","0.0007","10.9765","0.0005","90","","107.887","0.001","90","","1429.22","0.11","100","0.1","100","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","holjv62","","","- C30 H42 Al2 N4 -","- C30 H42 Al2 N4 -","- C60 H84 Al4 N8 -","2","0.5","","Vela, Javier; Zhu, Liwei; Flaschenriem, Christine J.; Brennessel, William W.; Lachicotte, Rene J.; Holland, Patrick L.","Macrocyclic Binucleating β-Diketiminate Ligands and their Lithium, Aluminum, and Zinc Complexes.","Organometallics","2007","26","14","3416","3423","10.1021/om0700258","","","0.71073","MoKα","","0.0542","0.0378","","","0.0976","0.1047","","","","","","1.039","","","","has coordinates","243616","2020-10-21","18:00:00",""
"4089352","32.194","0.002","32.194","0.002","8.6456","0.0012","90","","90","","120","","7760.2","1.3","100","0.1","100","0.1","","","","","","","","4","R -3 :H","-R 3","148","holjv68","","","- C30 H42 Al2 N4 -","- C30 H42 Al2 N4 -","- C270 H378 Al18 N36 -","9","0.5","","Vela, Javier; Zhu, Liwei; Flaschenriem, Christine J.; Brennessel, William W.; Lachicotte, Rene J.; Holland, Patrick L.","Macrocyclic Binucleating β-Diketiminate Ligands and their Lithium, Aluminum, and Zinc Complexes.","Organometallics","2007","26","14","3416","3423","10.1021/om0700258","","","0.71073","MoKα","","0.0622","0.0487","","","0.1503","0.1543","","","","","","1.091","","","","has coordinates","243616","2020-10-21","18:00:00",""
"4089353","14.1581","0.0017","11.7048","0.0014","20.864","0.003","90","","90","","90","","3457.5","0.8","173","0.1","173","0.1","","","","","","","","5","P n m a","-P 2ac 2n","62","hollz01","","","- C34 H50 Al2 N4 O -","- C30 H42 Al2 N4 -","- C120 H168 Al8 N16 -","4","0.5","","Vela, Javier; Zhu, Liwei; Flaschenriem, Christine J.; Brennessel, William W.; Lachicotte, Rene J.; Holland, Patrick L.","Macrocyclic Binucleating β-Diketiminate Ligands and their Lithium, Aluminum, and Zinc Complexes.","Organometallics","2007","26","14","3416","3423","10.1021/om0700258","","","0.71073","MoKα","","0.0585","0.0444","","","0.129","0.1354","","","","","","1.081","","","","has coordinates,has disorder","243616","2020-10-21","18:00:00",""
"4089354","9.6439","0.0015","17.498","0.003","11.9596","0.0019","90","","113.408","0.008","90","","1852.1","0.5","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","holjv63","","","- C40 H48 N6 Zn2 -","- C40 H48 N6 Zn2 -","- C80 H96 N12 Zn4 -","2","0.5","","Vela, Javier; Zhu, Liwei; Flaschenriem, Christine J.; Brennessel, William W.; Lachicotte, Rene J.; Holland, Patrick L.","Macrocyclic Binucleating β-Diketiminate Ligands and their Lithium, Aluminum, and Zinc Complexes.","Organometallics","2007","26","14","3416","3423","10.1021/om0700258","","","0.71073","MoKα","","0.0455","0.037","","","0.1026","0.1111","","","","","","1.077","","","","has coordinates","243616","2020-10-21","18:00:00",""
"4089355","18.1741","0.0005","27.3477","0.0008","21.2134","0.0005","90","","90","","90","","10543.5","0.5","293.1","","","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C23 H30 Ir2 Mo O3 S2 -","- C23 H30 Ir2 Mo O3 S2 -","- C368 H480 Ir32 Mo16 O48 S32 -","16","2","","Kajitani, Hidenobu; Seino, Hidetake; Mizobe, Yasushi","Synthesis of a Sulfido-Capped Trinuclear Cluster [{(η5-C5Me5)Ir}2{Mo(CO)3}(μ3-S)2] and Its Reactions at the Molybdenum Site Forming a Series of Ir2MoS2Clusters","Organometallics","2007","26","14","3499","","10.1021/om070190n","","","0.7107","MoKα","","","0.03","","","","0.086","","","","","","1.026","","","","has coordinates","243617","2020-10-21","18:00:00",""
"4089356","19.5871","0.0009","10.8158","0.0005","21.2531","0.0009","90","","93.573","0.001","90","","4493.7","0.3","293","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C47 H54 Ir2 Mo O P2 S2 -","- C47 H54 Ir2 Mo O P2 S2 -","- C188 H216 Ir8 Mo4 O4 P8 S8 -","4","1","","Kajitani, Hidenobu; Seino, Hidetake; Mizobe, Yasushi","Synthesis of a Sulfido-Capped Trinuclear Cluster [{(η5-C5Me5)Ir}2{Mo(CO)3}(μ3-S)2] and Its Reactions at the Molybdenum Site Forming a Series of Ir2MoS2Clusters","Organometallics","2007","26","14","3499","","10.1021/om070190n","","","0.7107","MoKα","","","0.0259","","","","0.0625","","","","","","1.013","","","","has coordinates","243617","2020-10-21","18:00:00",""
"4089357","10.6356","0.0019","11.495","0.002","12.1608","0.0019","64.897","0.006","75.099","0.007","84.534","0.007","1300.9","0.4","293.1","","","","","","","","","","","9","P 1","P 1","1","","","","- C48 H56 Cl2 I2 Ir2 Mo O P2 S2 -","- C48 H54 Cl2 I2 Ir2 Mo O P2 S2 -","- C48 H54 Cl2 I2 Ir2 Mo O P2 S2 -","1","1","","Kajitani, Hidenobu; Seino, Hidetake; Mizobe, Yasushi","Synthesis of a Sulfido-Capped Trinuclear Cluster [{(η5-C5Me5)Ir}2{Mo(CO)3}(μ3-S)2] and Its Reactions at the Molybdenum Site Forming a Series of Ir2MoS2Clusters","Organometallics","2007","26","14","3499","","10.1021/om070190n","","","0.7107","MoKα","","","0.0334","","","","0.0954","","","","","","1.071","","","","has coordinates","243617","2020-10-21","18:00:00",""
"4089358","10.468","0.003","12.988","0.003","16.24","0.004","70.917","0.009","77.631","0.01","72.611","0.01","1974.6","0.9","293.1","","","","","","","","","","","9","P -1","-P 1","2","","","","- C27 H37.5 F12 Ir2 Mo N2.5 O2 P2 S2 -","- C26.5 H36 F12 Ir2 Mo N3 O2 P2 S2 -","- C53 H72 F24 Ir4 Mo2 N6 O4 P4 S4 -","2","1","","Kajitani, Hidenobu; Seino, Hidetake; Mizobe, Yasushi","Synthesis of a Sulfido-Capped Trinuclear Cluster [{(η5-C5Me5)Ir}2{Mo(CO)3}(μ3-S)2] and Its Reactions at the Molybdenum Site Forming a Series of Ir2MoS2Clusters","Organometallics","2007","26","14","3499","","10.1021/om070190n","","","0.7107","MoKα","","","0.036","","","","0.084","","","","","","1.01","","","","has coordinates","243617","2020-10-21","18:00:00",""
"4089359","14.356","0.002","10.1922","0.001","18.0798","0.0018","90","","107.881","0.0015","90","","2517.6","0.5","293.1","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H30 Cl2 Ir2 Mo O S2 -","- C20 H30 Cl2 Ir2 Mo O S2 -","- C80 H120 Cl8 Ir8 Mo4 O4 S8 -","4","1","","Kajitani, Hidenobu; Seino, Hidetake; Mizobe, Yasushi","Synthesis of a Sulfido-Capped Trinuclear Cluster [{(η5-C5Me5)Ir}2{Mo(CO)3}(μ3-S)2] and Its Reactions at the Molybdenum Site Forming a Series of Ir2MoS2Clusters","Organometallics","2007","26","14","3499","","10.1021/om070190n","","","0.7107","MoKα","","","0.027","","","","0.07","","","","","","1.007","","","","has coordinates","243617","2020-10-21","18:00:00",""
"4089360","11.036","0.003","26.998","0.007","15.173","0.004","90","","96.3723","0.0011","90","","4493","2","293.1","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C32 H58 Cl6 Ir2 Mo O P2 S2 -","- C32 H58 Cl6 Ir2 Mo O P2 S2 -","- C128 H232 Cl24 Ir8 Mo4 O4 P8 S8 -","4","1","","Kajitani, Hidenobu; Seino, Hidetake; Mizobe, Yasushi","Synthesis of a Sulfido-Capped Trinuclear Cluster [{(η5-C5Me5)Ir}2{Mo(CO)3}(μ3-S)2] and Its Reactions at the Molybdenum Site Forming a Series of Ir2MoS2Clusters","Organometallics","2007","26","14","3499","","10.1021/om070190n","","","0.7107","MoKα","","","0.043","","","","0.16","","","","","","1.009","","","","has coordinates","243617","2020-10-21","18:00:00",""
"4089361","8.7534","0.0013","14.1283","0.0015","16.1347","0.0014","91.099","0.006","96.24","0.006","99.605","0.006","1954.3","0.4","293.1","","","","","","","","","","","8","P -1","-P 1","2","","","","- C26 H46 B Cl7 Ir2 Mo P2 S2 -","- C26 H46 B Cl7 Ir2 Mo P2 S2 -","- C52 H92 B2 Cl14 Ir4 Mo2 P4 S4 -","2","1","","Kajitani, Hidenobu; Seino, Hidetake; Mizobe, Yasushi","Synthesis of a Sulfido-Capped Trinuclear Cluster [{(η5-C5Me5)Ir}2{Mo(CO)3}(μ3-S)2] and Its Reactions at the Molybdenum Site Forming a Series of Ir2MoS2Clusters","Organometallics","2007","26","14","3499","","10.1021/om070190n","","","0.7107","MoKα","","","0.037","","","","0.124","","","","","","1.005","","","","has coordinates","243617","2020-10-21","18:00:00",""
"4089362","24.372","0.003","22.53","0.003","17.977","0.002","90","","90","","90","","9871","2","293.1","","","","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C50 H64 Ir2 Mo O P2 S2 -","- C51 H51 Ir2 Mo P2 S2 -","- C408 H408 Ir16 Mo8 P16 S16 -","8","1","","Kajitani, Hidenobu; Seino, Hidetake; Mizobe, Yasushi","Synthesis of a Sulfido-Capped Trinuclear Cluster [{(η5-C5Me5)Ir}2{Mo(CO)3}(μ3-S)2] and Its Reactions at the Molybdenum Site Forming a Series of Ir2MoS2Clusters","Organometallics","2007","26","14","3499","","10.1021/om070190n","","","0.7107","MoKα","","","0.0431","","","","0.0877","","","","","","1.03","","","","has coordinates","243617","2020-10-21","18:00:00",""
"4101747","11.577","0.001","12.875","0.001","23.402","0.002","94.855","0.001","95.482","0.002","115.991","0.002","3089.7","0.4","123.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C67 H64 B2 F8 Fe2 N10 O3 -","- C67 H64 B2 F8 Fe2 N10 O3 -","- C134 H128 B4 F16 Fe4 N20 O6 -","2","1","","Yamashita, Mai; Furutachi, Hideki; Tosha, Takehiko; Fujinami, Shuhei; Saito, Wataru; Maeda, Yonezo; Takahashi, Kenji; Tanaka, Koji; Kitagawa, Teizo; Suzuki, Masatatsu","Regioselective arene hydroxylation mediated by a (mu-peroxo)diiron(III) complex: a functional model for toluene monooxygenase.","Journal of the American Chemical Society","2007","129","1","2","3","10.1021/ja063987z","","","0.7107","MoKα","","","0.0519","","","","0.0793","","","","","","1.381","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101748","11.75","0.0009","14.469","0.001","17.551","0.001","79.861","0.008","67.12","0.006","82.632","0.009","2700.3","0.3","123.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C54 H54 Cl2 Fe2 N10 O11 -","- C54 H54 Cl2 Fe2 N10 O11 -","- C108 H108 Cl4 Fe4 N20 O22 -","2","1","","Yamashita, Mai; Furutachi, Hideki; Tosha, Takehiko; Fujinami, Shuhei; Saito, Wataru; Maeda, Yonezo; Takahashi, Kenji; Tanaka, Koji; Kitagawa, Teizo; Suzuki, Masatatsu","Regioselective arene hydroxylation mediated by a (mu-peroxo)diiron(III) complex: a functional model for toluene monooxygenase.","Journal of the American Chemical Society","2007","129","1","2","3","10.1021/ja063987z","","","0.7107","MoKα","","","0.0437","","","","0.0565","","","","","","1.436","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101749","12.497","0.002","22.823","0.003","13.582","0.002","90","","108.548","0.001","90","","3672.6","0.9","123.2","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C70 H74 Cl8 Fe2 N10 O15 -","- C70 H63 Cl8 Fe2 N10 O15 -","- C140 H126 Cl16 Fe4 N20 O30 -","2","1","","Yamashita, Mai; Furutachi, Hideki; Tosha, Takehiko; Fujinami, Shuhei; Saito, Wataru; Maeda, Yonezo; Takahashi, Kenji; Tanaka, Koji; Kitagawa, Teizo; Suzuki, Masatatsu","Regioselective arene hydroxylation mediated by a (mu-peroxo)diiron(III) complex: a functional model for toluene monooxygenase.","Journal of the American Chemical Society","2007","129","1","2","3","10.1021/ja063987z","","","0.7107","MoKα","","","0.067","","","","0.0894","","","","","","1.416","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101750","14.539","0.005","15.527","0.006","16.016","0.006","96.173","0.003","111.734","0.006","116.84","0.004","2827.3","1.8","123.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C102 H112 Cl4 Fe4 N24 O24 -","- C102 H96 Cl4 Fe4 N24 O24 -","- C102 H96 Cl4 Fe4 N24 O24 -","1","0.5","","Yamashita, Mai; Furutachi, Hideki; Tosha, Takehiko; Fujinami, Shuhei; Saito, Wataru; Maeda, Yonezo; Takahashi, Kenji; Tanaka, Koji; Kitagawa, Teizo; Suzuki, Masatatsu","Regioselective arene hydroxylation mediated by a (mu-peroxo)diiron(III) complex: a functional model for toluene monooxygenase.","Journal of the American Chemical Society","2007","129","1","2","3","10.1021/ja063987z","","","0.7107","MoKα","","","0.0597","","","","0.0911","","","","","","1.456","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101751","11.2119","0.0004","37.5185","0.0013","13.2026","0.0005","90","","112.318","0.001","90","","5137.7","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C51 H87 B Cl Fe P3 -","- C51 H87 B Cl Fe P3 -","- C204 H348 B4 Cl4 Fe4 P12 -","4","1","","Lu, Connie C.; Saouma, Caroline T.; Day, Michael W.; Peters, Jonas C.","Fe(I)-mediated reductive cleavage and coupling of CO(2): an Fe(II)(mu-O, mu-CO)Fe(II) core.","Journal of the American Chemical Society","2007","129","1","4","5","10.1021/ja065524z","","","0.71073","MoKα","","0.1442","0.0694","","","0.1094","0.1187","","","","","","1.387","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4101752","11.2942","0.0006","14.092","0.0008","17.6538","0.0009","89.927","0.001","87.422","0.001","80.938","0.001","2771.8","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H98 B Fe P4 -","- C54 H98 B Fe P4 -","- C108 H196 B2 Fe2 P8 -","2","1","","Lu, Connie C.; Saouma, Caroline T.; Day, Michael W.; Peters, Jonas C.","Fe(I)-mediated reductive cleavage and coupling of CO(2): an Fe(II)(mu-O, mu-CO)Fe(II) core.","Journal of the American Chemical Society","2007","129","1","4","5","10.1021/ja065524z","","","0.71073","MoKα","","0.0787","0.0465","","","0.0804","0.0846","","","","","","1.443","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4101753","11.271","0.0007","23.084","0.0015","22.3839","0.0014","90","","91.328","0.001","90","","5822.3","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C61 H104 B Fe N P3 -","- C61 H104 B Fe N P3 -","- C244 H416 B4 Fe4 N4 P12 -","4","1","","Lu, Connie C.; Saouma, Caroline T.; Day, Michael W.; Peters, Jonas C.","Fe(I)-mediated reductive cleavage and coupling of CO(2): an Fe(II)(mu-O, mu-CO)Fe(II) core.","Journal of the American Chemical Society","2007","129","1","4","5","10.1021/ja065524z","","","0.71073","MoKα","","0.1848","0.1185","","","0.1912","0.1947","","","","","","3.506","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4101754","16.7997","0.0017","19.67","0.002","18.2319","0.0019","90","","105.532","0.002","90","","5804.7","1","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C129 H208 B2 Fe2 P6 -","- C129 H208 B2 Fe2 P6 -","- C258 H416 B4 Fe4 P12 -","2","0.5","","Lu, Connie C.; Saouma, Caroline T.; Day, Michael W.; Peters, Jonas C.","Fe(I)-mediated reductive cleavage and coupling of CO(2): an Fe(II)(mu-O, mu-CO)Fe(II) core.","Journal of the American Chemical Society","2007","129","1","4","5","10.1021/ja065524z","","","0.71073","MoKα","","0.1583","0.0774","","","0.141","0.1502","","","","","","2.077","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4101755","16.834","0.008","25.105","0.011","28.444","0.013","73.111","0.011","78.703","0.015","84.399","0.012","11269","9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C103 H178 B2 Fe2 O2 P6 -","- C103 H178 B2 Fe2 O2 P6 -","- C412 H712 B8 Fe8 O8 P24 -","4","2","","Lu, Connie C.; Saouma, Caroline T.; Day, Michael W.; Peters, Jonas C.","Fe(I)-mediated reductive cleavage and coupling of CO(2): an Fe(II)(mu-O, mu-CO)Fe(II) core.","Journal of the American Chemical Society","2007","129","1","4","5","10.1021/ja065524z","","","0.71073","MoKα","","0.3696","0.1564","","","0.1961","0.209","","","","","","1.481","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4101756","15.138","0.0018","20.125","0.002","19.819","0.002","90","","110.896","0.002","90","","5640.8","1","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C123 H198 B2 Fe2 O4 P6 -","- C123 H198 B2 Fe2 O4 P6 -","- C246 H396 B4 Fe4 O8 P12 -","2","0.5","","Lu, Connie C.; Saouma, Caroline T.; Day, Michael W.; Peters, Jonas C.","Fe(I)-mediated reductive cleavage and coupling of CO(2): an Fe(II)(mu-O, mu-CO)Fe(II) core.","Journal of the American Chemical Society","2007","129","1","4","5","10.1021/ja065524z","","","0.71073","MoKα","","0.1306","0.0616","","","0.0938","0.1051","","","","","","1.312","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4101757","13.6402","0.0008","14.6845","0.0009","16.7752","0.001","71.35","0.003","89.149","0.003","62.553","0.003","2789.9","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C116 H202 B2 Fe2 O6 P6 -","- C116 H202 B2 Fe2 O6 P6 -","- C116 H202 B2 Fe2 O6 P6 -","1","0.5","","Lu, Connie C.; Saouma, Caroline T.; Day, Michael W.; Peters, Jonas C.","Fe(I)-mediated reductive cleavage and coupling of CO(2): an Fe(II)(mu-O, mu-CO)Fe(II) core.","Journal of the American Chemical Society","2007","129","1","4","5","10.1021/ja065524z","","","0.71073","MoKα","","0.1128","0.0546","","","0.0886","0.097","","","","","","1.244","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4101758","12.4947","0.0009","13.2846","0.0009","14.5047","0.0011","71.488","0.004","82.305","0.004","68.687","0.004","2126.4","0.3","150","","150","","","","","","","","C. Milios","5","P -1","-P 1","2","","","","- C40 H52 Mn3 N3 O13 -","- C40 H52 Mn3 N3 O13 -","- C80 H104 Mn6 N6 O26 -","2","1","","Milios, Constantinos J.; Vinslava, Alina; Wood, Peter A.; Parsons, Simon; Wernsdorfer, Wolfgang; Christou, George; Perlepes, Spyros P.; Brechin, Euan K.","A single-molecule magnet with a ""twist"".","Journal of the American Chemical Society","2007","129","1","8","9","10.1021/ja0666755","","","0.71073","MoKα","","0.0589","0.0339","","0.1033","0.0796","0.1033","","","","","","0.969","","","","has coordinates","264242","2021-04-16","08:51:38",""
"4101759","10.33","0.007","10.249","0.007","14.12","0.008","90","","95.595","0.014","90","","1487.8","1.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H21 B11 Si -","- C6 H21 B11 Si -","- C24 H84 B44 Si4 -","4","1","","Zhang, Jian; Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei","Role of c,c'-linkage in the formation and stabilization of supercarboranes. Synthesis and structure of carbon-atoms-apart 13-vertex carborane and 14-vertex metallacarborane.","Journal of the American Chemical Society","2007","129","1","18","19","10.1021/ja067129e","","","0.71073","MoKα","","0.0893","0.051","","","0.1333","0.1654","","","","","","1.029","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101760","7.0551","0.0009","11.6875","0.0014","8.0262","0.001","90","","115.576","0.002","90","","596.96","0.13","293","2","293","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C4 H17 B11 -","- C4 H17 B11 -","- C8 H34 B22 -","2","0.5","","Zhang, Jian; Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei","Role of c,c'-linkage in the formation and stabilization of supercarboranes. Synthesis and structure of carbon-atoms-apart 13-vertex carborane and 14-vertex metallacarborane.","Journal of the American Chemical Society","2007","129","1","18","19","10.1021/ja067129e","","","0.71073","MoKα","","0.0904","0.0724","","","0.2121","0.2415","","","","","","1.071","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101761","9.9962","0.0013","12.7008","0.0016","16.033","0.002","90","","90","","90","","2035.5","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H31 B11 Ru -","- C14 H31 B11 Ru -","- C56 H124 B44 Ru4 -","4","1","","Zhang, Jian; Deng, Liang; Chan, Hoi-Shan; Xie, Zuowei","Role of c,c'-linkage in the formation and stabilization of supercarboranes. Synthesis and structure of carbon-atoms-apart 13-vertex carborane and 14-vertex metallacarborane.","Journal of the American Chemical Society","2007","129","1","18","19","10.1021/ja067129e","","","0.71073","MoKα","","0.0306","0.0259","","","0.0605","0.0632","","","","","","1.088","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101762","25.348","0.0006","13.879","0.0004","23.199","0.0007","90","","114.679","0.001","90","","7416.1","0.4","120","0.1","120","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tris(1,2-dimethoxyethane)lithium(I) trans-1,1,4,4-tetrakis- [bis(trimethylsilyl)methyl]-1,4-diisopropyl-2-tetrasilene-2-yl-2-ide","","- C52 H127 Li O6 Si12 -","- C52 H127 Li O6 Si12 -","- C208 H508 Li4 O24 Si48 -","4","1","","Kinjo, Rei; Ichinohe, Masaaki; Sekiguchi, Akira","An isolable disilyne anion radical and a new route to the disilenide ion upon reduction of a disilyne.","Journal of the American Chemical Society","2007","129","1","26","27","10.1021/ja066762x","","","0.7107","MoKα","","0.0648","0.0494","","","0.1349","0.1456","","","","","","1.049","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101763","11.171","0.0008","22.179","0.0012","31.458","0.0019","90","","93.542","0.004","90","","7779.2","0.8","120","0.1","120","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,1,4,4-tetrakis[bis(trimethylsilyl)methyl]-1,4-diisopropyl- 2-tetrasilyne anion radical","","- C50 H130 K O8 Si12 -","- C50 H130 K O8 Si12 -","- C200 H520 K4 O32 Si48 -","4","1","","Kinjo, Rei; Ichinohe, Masaaki; Sekiguchi, Akira","An isolable disilyne anion radical and a new route to the disilenide ion upon reduction of a disilyne.","Journal of the American Chemical Society","2007","129","1","26","27","10.1021/ja066762x","","","0.7107","MoKα","","0.1229","0.0712","","","0.1798","0.2145","","","","","","0.984","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101764","63.105","0.009","15.236","0.003","21.642","0.003","90","","91.699","0.005","90","","20799","6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C123.5 H100.5 N8.5 P6 Pd1.5 -","- C123.5 H97.5 N8.5 P6 Pd1.5 -","- C988 H780 N68 P48 Pd12 -","8","1","","Dobbs, Kerwin D; Marshall, William J; Grushin, Vladimir V","Why excess cyanide can be detrimental to Pd-catalyzed cyanation of haloarenes. Facile formation and characterization of [Pd(CN)(3)(H)](2-) and [Pd(CN)(3)(Ph)](2-).","Journal of the American Chemical Society","2007","129","1","30","31","10.1021/ja066931d","","","0.71073","MoKα","","0.1843","0.1043","","","0.2563","0.3089","","","","","","1.365","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4101765","7.6669","0.0012","14.484","0.002","17.268","0.003","66.9","0.002","87.29","0.002","87.172","0.003","1760.9","0.5","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H28 I K N8 O6 -","- C32 H28 I K N8 O6 -","- C64 H56 I2 K2 N16 O12 -","2","1","","Berryman, Orion B.; Bryantsev, Vyacheslav S.; Stay, David P.; Johnson, Darren W.; Hay, Benjamin P.","Structural criteria for the design of anion receptors: the interaction of halides with electron-deficient arenes.","Journal of the American Chemical Society","2007","129","1","48","58","10.1021/ja063460m","","","0.71073","MoKα","","0.0617","0.0457","","","0.0878","0.0986","","","","","","1.095","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101766","16.976","0.004","7.5295","0.0019","27.347","0.007","90","","102.415","0.005","90","","3413.8","1.5","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H28 Br K N8 O6 -","- C32 H28 Br K N8 O6 -","- C128 H112 Br4 K4 N32 O24 -","4","1","","Berryman, Orion B; Bryantsev, Vyacheslav S; Stay, David P; Johnson, Darren W; Hay, Benjamin P","Structural criteria for the design of anion receptors: the interaction of halides with electron-deficient arenes.","Journal of the American Chemical Society","2007","129","1","48","58","10.1021/ja063460m","","","0.71073","MoKα","","0.1294","0.062","","","0.1039","0.1323","","","","","","0.996","","","","has coordinates","178763","2020-10-21","18:00:00",""
"4101767","7.5556","0.0009","14.2604","0.0017","17.523","0.003","66.019","0.002","89.215","0.003","86.695","0.002","1722.1","0.4","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H28 I N8 Na O6 -","- C32 H28 I N8 Na O6 -","- C64 H56 I2 N16 Na2 O12 -","2","1","","Berryman, Orion B; Bryantsev, Vyacheslav S; Stay, David P; Johnson, Darren W; Hay, Benjamin P","Structural criteria for the design of anion receptors: the interaction of halides with electron-deficient arenes.","Journal of the American Chemical Society","2007","129","1","48","58","10.1021/ja063460m","","","0.71073","MoKα","","0.0557","0.0403","","","0.0745","0.0846","","","","","","1.06","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4103730","20.4638","0.0008","21.4603","0.0008","14.8607","0.0006","90","","104.885","0.002","90","","6307.2","0.4","150","2","150","2","","","","","","","Synthesized by the authors. See text","5","C 1 2/m 1","-C 2y","12","","","","- C68 H110 N20 O12 S12 -","- C70 H110 N20 O12 S12 -","- C140 H220 N40 O24 S24 -","2","0.25","","Kenneth E. Maly; Thierry Maris; James D. Wuest","Engineering Hydrogen-Bonded Molecular Crystals Built from Derivatives of Hexaphenylbenzene and Related Compounds","J. Am. Chem. Soc.","2007","129","","4306","4322","10.1021/ja067571x","","","1.54178","CuKα","","0.0845","0.073","","","0.1611","0.1627","","","","","","1.181","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00",""
"4103731","38.674","0.0009","38.674","0.0009","10.01","0.003","90","","90","","120","","12966","4","100","2","100","2","","","","","","","Synthesized by the authors. See text","5","R -3 :H","-R 3","148","","","","- C156 H192 N30 O12 S12 -","- C108 H120 N30 O6 S6 -","- C324 H360 N90 O18 S18 -","3","0.166667","","Kenneth E. Maly; Thierry Maris; James D. Wuest","Engineering Hydrogen-Bonded Molecular Crystals Built from Derivatives of Hexaphenylbenzene and Related Compounds","J. Am. Chem. Soc.","2007","129","","4306","4322","10.1021/ja067571x","","","1.54178","CuKα","","0.0631","0.0587","","","0.1369","0.1374","","","","","","1.028","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00",""
"4103732","40.396","0.0013","20.6327","0.0007","12.0265","0.0004","90","","99.926","0.002","90","","9873.8","0.6","100","2","100","2","","","","","","","Synthesized by the authors. See text","5","C 1 2/c 1","-C 2yc","15","","","","- C82 H108 N26 O8 S8 -","- C82 H108 N26 O8 S8 -","- C328 H432 N104 O32 S32 -","4","0.5","","Kenneth E. Maly; Thierry Maris; James D. Wuest","Engineering Hydrogen-Bonded Molecular Crystals Built from Derivatives of Hexaphenylbenzene and Related Compounds","J. Am. Chem. Soc.","2007","129","","4306","4322","10.1021/ja067571x","","","1.54178","CuKα","","0.0643","0.0622","","","0.1476","0.1482","","","","","","1.003","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00",""
"4103733","22.807","0.0009","22.807","0.0009","17.2915","0.0016","90","","90","","120","","7789.3","0.8","200","2","200","2","","","","","","","Synthesized by the authors. See text","3","R -3 :H","-R 3","148","","","","- C60 H48 N30 -","- C60 H48 N30 -","- C180 H144 N90 -","3","0.166667","","Kenneth E. Maly; Thierry Maris; James D. Wuest","Engineering Hydrogen-Bonded Molecular Crystals Built from Derivatives of Hexaphenylbenzene and Related Compounds","J. Am. Chem. Soc.","2007","129","","4306","4322","10.1021/ja067571x","","","1.54178","CuKα","","0.0645","0.0614","","","0.1513","0.152","","","","","","1.048","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103734","8.975","0.0003","22.7525","0.0006","21.9316","0.0008","90","","101.498","0.001","90","","4388.6","0.2","150","2","150","2","","","","","","","Synthesized by the authors. See text","5","P 1 21/c 1","-P 2ybc","14","","","","- C66 H106 N20 O12 S12 -","- C66 H106 N20 O12 S12 -","- C132 H212 N40 O24 S24 -","2","0.5","","Kenneth E. Maly; Thierry Maris; James D. Wuest","Engineering Hydrogen-Bonded Molecular Crystals Built from Derivatives of Hexaphenylbenzene and Related Compounds","J. Am. Chem. Soc.","2007","129","","4306","4322","10.1021/ja067571x","","","1.54178","CuKα","","0.0721","0.0651","","","0.1491","0.1503","","","","","","1.085","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00",""
"4103735","31.282","0.015","24.617","0.003","11.704","0.009","90","","108.302","0.004","90","","8557","8","100","2","100","2","","","","","","","Synthesized by the authors. See text","5","C 1 2/c 1","-C 2yc","15","","","","- C67 H89 N25 O8 S8 -","- C67 H89 N25 O8 S8 -","- C268 H356 N100 O32 S32 -","4","0.5","","Kenneth E. Maly; Thierry Maris; James D. Wuest","Engineering Hydrogen-Bonded Molecular Crystals Built from Derivatives of Hexaphenylbenzene and Related Compounds","J. Am. Chem. Soc.","2007","129","","4306","4322","10.1021/ja067571x","","","1.54178","CuKα","","0.1237","0.089","","","0.1426","0.1474","","","","","","1","","","","has coordinates","178783","2020-10-21","18:00:00",""
"4103736","34.706","0.002","14.9704","0.0009","12.0264","0.0007","90","","91.318","0.002","90","","6246.8","0.6","150","2","150","2","","","","","","","Synthesized by the authors. See text","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H66 N20 O6 S4 -","- C52 H66 N20 O6 S4 -","- C208 H264 N80 O24 S16 -","4","1","","Kenneth E. Maly; Thierry Maris; James D. Wuest","Engineering Hydrogen-Bonded Molecular Crystals Built from Derivatives of Hexaphenylbenzene and Related Compounds","J. Am. Chem. Soc.","2007","129","","4306","4322","10.1021/ja067571x","","","1.54178","CuKα","","0.1143","0.0794","","","0.1704","0.1913","","","","","","1.115","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00",""
"4103737","17.77","0.002","21.235","0.003","21.691","0.002","98.4","0.006","110.518","0.005","103.475","0.006","7217.9","1.5","100","2","100","2","","","","","","","Synthesized by the authors. See text","5","P -1","-P 1","2","","","","- C106 H164 N30 O19 S9 -","- C106 H158 N30 O19 S9 -","- C212 H316 N60 O38 S18 -","2","1","","Kenneth E. Maly; Thierry Maris; James D. Wuest","Engineering Hydrogen-Bonded Molecular Crystals Built from Derivatives of Hexaphenylbenzene and Related Compounds","J. Am. Chem. Soc.","2007","129","","4306","4322","10.1021/ja067571x","","","1.54178","CuKα","","0.1377","0.116","","","0.2902","0.2974","","","","","","1.096","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00",""
"4103738","8.4178","0.0011","16.424","0.002","20.251","0.003","105.291","0.005","97.289","0.006","93.544","0.006","2665.5","0.6","100","2","100","2","","","","","","","Synthesized by the authors. See text","5","P -1","-P 1","2","","","","- C42 H62 N15 O7 S6 -","- C42 H60 N15 O7 S6 -","- C84 H120 N30 O14 S12 -","2","1","","Kenneth E. Maly; Thierry Maris; James D. Wuest","Engineering Hydrogen-Bonded Molecular Crystals Built from Derivatives of Hexaphenylbenzene and Related Compounds","J. Am. Chem. Soc.","2007","129","","4306","4322","10.1021/ja067571x","","","1.54178","CuKα","","0.0973","0.0792","","","0.1865","0.1897","","","","","","1.045","","","","has coordinates,has disorder","178783","2020-10-21","18:00:00",""
"4108966","16.3466","0.0018","16.3466","0.0018","42.227","0.009","90","","90","","120","","9772","3","193","2","193","2","","","","","","","","8","R -3 :H","-R 3","148","","","","- C108 H95 Cl12 Fe Mn6 N24 Nb6 O17 -","- C108 H84 Cl12 Fe Mn6 N24 Nb6 O17.04 -","- C324 H252 Cl36 Fe3 Mn18 N72 Nb18 O51.12 -","3","0.166667","","Jianjun Zhang; Abdessadek Lachgar","Superexpanded Prussian-Blue Analogue with [Fe(CN)6]4-, [Nb6Cl12(CN)6]4-, and [Mn(salen)]+ as Building Units","Journal of the American Chemical Society","2007","129","","250","251","10.1021/ja066104c","","","0.71073","MoKα","","0.0672","0.0528","","","0.1225","0.1282","","","","","","1.102","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108967","7.531","0.001","14.291","0.002","14.92","0.003","90","","90","","90","","1605.8","0.4","243.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H17 Mn2 N8 O3 -","- C9 H15 Mn2 N8 O2 -","- C36 H60 Mn8 N32 O8 -","4","1","","Wakako Kaneko; Susumu Kitagawa; Masaaki Ohba","Chiral Cyanide-Bridged MnIIMnIII Ferrimagnets, [MnII(HL)(H2O)][MnIII(CN)6].2H2O (L = S- or R-1,2-diaminopropane): Syntheses, Structures, and Magnetic Behaviors","Journal of the American Chemical Society","2007","129","","248","249","10.1021/ja066140b","","","0.7107","MoKα","","","0.032","","","","0.0838","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108968","7.5145","0.0005","14.261","0.001","14.844","0.001","90","","90","","90","","1590.75","0.19","243.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H17 Mn2 N8 O3 -","- C9 H15 Mn2 N8 O2 -","- C36 H60 Mn8 N32 O8 -","4","1","","Wakako Kaneko; Susumu Kitagawa; Masaaki Ohba","Chiral Cyanide-Bridged MnIIMnIII Ferrimagnets, [MnII(HL)(H2O)][MnIII(CN)6].2H2O (L = S- or R-1,2-diaminopropane): Syntheses, Structures, and Magnetic Behaviors","Journal of the American Chemical Society","2007","129","","248","249","10.1021/ja066140b","","","0.7107","MoKα","","","0.0422","","","","0.116","","","","","","1.003","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108969","7.541","0.001","14.318","0.002","14.94","0.003","90","","89.992","0.002","90","","1613.1","0.4","243.1","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C9 H17 Mn2 N8 O3 -","- C9 H13 Mn2 N8 O2 -","- C36 H52 Mn8 N32 O8 -","4","1","","Wakako Kaneko; Susumu Kitagawa; Masaaki Ohba","Chiral Cyanide-Bridged MnIIMnIII Ferrimagnets, [MnII(HL)(H2O)][MnIII(CN)6].2H2O (L = S- or R-1,2-diaminopropane): Syntheses, Structures, and Magnetic Behaviors","Journal of the American Chemical Society","2007","129","","248","249","10.1021/ja066140b","","","0.7107","MoKα","","","0.079","","","","0.2168","","","","","","1.925","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108970","10.653","0.002","14.545","0.003","21.789","0.004","90","","90","","90","","3376.2","1.1","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C17 H22 N2 O2 -","- C17 H22 N2 O2 -","- C136 H176 N16 O16 -","8","1","","Mukund P. Sibi; Levi M. Stanley; Xiaoping Nie; Lakshmanan Venkatraman; Mei Liu; Craig P. Jasperse","The Role of Achiral Pyrazolidinone Templates in Enantioselective Diels-Alder Reactions: Scope, Limitations, and Conformational Insights","Journal of the American Chemical Society","2007","129","","395","405","10.1021/ja066425o","","","0.71073","MoKα","","0.174","0.0475","","","0.0917","0.1327","","","","","","0.941","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108971","10.418","0.002","22.807","0.005","7.876","0.0016","90","","112.21","0.03","90","","1732.5","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 N2 O2 -","- C20 H22 N2 O2 -","- C80 H88 N8 O8 -","4","1","","Mukund P. Sibi; Levi M. Stanley; Xiaoping Nie; Lakshmanan Venkatraman; Mei Liu; Craig P. Jasperse","The Role of Achiral Pyrazolidinone Templates in Enantioselective Diels-Alder Reactions: Scope, Limitations, and Conformational Insights","Journal of the American Chemical Society","2007","129","","395","405","10.1021/ja066425o","","","0.71073","MoKα","","0.1877","0.0492","","","0.0872","0.1226","","","","","","0.916","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108972","14.6499","0.0003","14.5155","0.0003","19.163","0.0004","90","","90.96","0.001","90","","4074.45","0.15","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C96 H80 Cu2 I2 P4 -","- C96 H80 Cu2 I2 P4 -","- C192 H160 Cu4 I4 P8 -","2","1","","Shun-Yi Wang; Shun-Jun Ji; Teck-Peng Loh","Cu(I) Tol-BINAP-Catalyzed Enantioselective Michael Reactions of Grignard Reagents and Unsaturated Esters","Journal of the American Chemical Society","2007","129","","276","277","10.1021/ja0666046","","","0.71073","MoKα","","0.0844","0.0365","","","0.0674","0.0925","","","","","","1.022","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108973","12.0843","0.0007","14.9833","0.0008","16.5629","0.0009","90","","100.734","0.001","90","","2946.4","0.3","153","2","153","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C22 H31 B F3 N8 O6 P S W -","- C22 H31 B F3 N8 O6 P S W -","- C88 H124 B4 F12 N32 O24 P4 S4 W4 -","4","1","","David A. Delafuente; George W. Kosturko; Peter M. Graham; W. Hill Harman; William H. Myers; Yogesh Surendranath; Rachel C. Klet; Kevin D. Welch; Carl O. Trindle; Michal Sabat; W. Dean Harman","Isomerization Dynamics and Control of the η2/N Equilibrium for Pyridine Complexes","Journal of the American Chemical Society","2007","129","","406","416","10.1021/ja066623f","","","0.71073","MoKα","","0.0429","0.0307","","","0.0609","0.0638","","","","","","0.937","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108974","20.934","0.004","6.895","0.0014","12.745","0.003","90","","93.88","0.03","90","","1835.4","0.7","296","2","296","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C19 H22 O6 -","- C19 H22 O6 -","- C76 H88 O24 -","4","1","","K. C. Nicolaou; Scott T. Harrison","Total Synthesis of Abyssomicin C, Atrop-abyssomicin C, and Abyssomicin D: Implications for Natural Origins of Atrop-abyssomicin C","Journal of the American Chemical Society","2007","129","","429","440","10.1021/ja067083p","","","0.71073","MoKα","","0.0588","0.0462","","","0.1096","0.1169","","","","","","1.069","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108975","19.187","0.004","9.2491","0.0018","12.923","0.003","90","","101.35","0.03","90","","2248.5","0.9","296","2","296","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C43 H53 Cl2 O10 S4 -","- C43 H53 Cl2 O10 S4 -","- C86 H106 Cl4 O20 S8 -","2","0.5","","K. C. Nicolaou; Scott T. Harrison","Total Synthesis of Abyssomicin C, Atrop-abyssomicin C, and Abyssomicin D: Implications for Natural Origins of Atrop-abyssomicin C","Journal of the American Chemical Society","2007","129","","429","440","10.1021/ja067083p","","","0.71073","MoKα","","0.0557","0.0532","","","0.1481","0.1511","","","","","","1.119","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108976","7.3503","0.0015","11.878","0.002","33.132","0.007","90","","90","","90","","2892.7","1","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H22 Br2 N4 O5 -","- C27 H22 Br2 N4 O5 -","- C108 H88 Br8 N16 O20 -","4","1","","Carrie E. Aroyan; Scott J. Miller","Enantioselective Rauhut-Currier Reactions Promoted by Protected Cysteine","Journal of the American Chemical Society","2007","129","","256","257","10.1021/ja067139f","","","0.71073","MoKα","","0.0891","0.0521","","","0.1252","0.1417","","","","","","1.008","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108977","10.636","0.005","28.815","0.005","31.319","0.005","90","0.005","90","0.005","90","0.005","9599","5","100","2","100","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C108 H115 N9 O18 -","- C108 H115 N9 O18 -","- C432 H460 N36 O72 -","4","1","","Thomas B. Poulsen; Luca Bernardi; José Alemán; Jacob Overgaard; Karl Anker Jørgensen","Organocatalytic Asymmetric Direct α-Alkynylation of Cyclic β-Ketoesters","Journal of the American Chemical Society","2007","129","","441","449","10.1021/ja067289q","","x-ray","0.71069","MoKα","","0.1586","0.1225","","","0.3066","0.3288","","","","","","1.029","","","","has coordinates,has disorder","178835","2020-10-21","18:00:00",""
"4108978","4.7314","0.0009","9.4083","0.0019","23.648","0.005","90","","90","","90","","1052.7","0.4","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H11 N O5 -","- C10 H11 N O5 -","- C40 H44 N4 O20 -","4","1","","S. S. V. Ramasastry; Haile Zhang; Fujie Tanaka; Carlos F. Barbas","Direct Catalytic Asymmetric Synthesis of anti-1,2-Amino Alcohols and syn-1,2-Diols through Organocatalytic anti-Mannich and syn-Aldol Reactions","Journal of the American Chemical Society","2007","129","","288","289","10.1021/ja0677012","","","0.71073","MoKα","","0.0417","0.0377","","","0.0943","0.0973","","","","","","1.059","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108979","7.88","0.02","7.034","0.012","13.89","0.03","90","","97.6","0.03","90","","763","3","193.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H14 F N O4 -","- C18 H14 F N O4 -","- C36 H28 F2 N2 O8 -","2","1","","Masato Ito; Ayaka Sakaguchi; Chika Kobayashi; Takao Ikariya","Chemoselective Hydrogenation of Imides Catalyzed by Cp*Ru(PN) Complexes and Its Application to the Asymmetric Synthesis of Paroxetine","Journal of the American Chemical Society","2007","129","","290","291","10.1021/ja067777y","","","0.7107","MoKα","","","0.051","","","","0.154","","","","","","1.004","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108980","6.769","0.005","8.058","0.006","28.09","0.02","90","","90","","90","","1532.2","1.9","193.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H16 F N O3 -","- C18 H16 F N O3 -","- C72 H64 F4 N4 O12 -","4","1","","Masato Ito; Ayaka Sakaguchi; Chika Kobayashi; Takao Ikariya","Chemoselective Hydrogenation of Imides Catalyzed by Cp*Ru(PN) Complexes and Its Application to the Asymmetric Synthesis of Paroxetine","Journal of the American Chemical Society","2007","129","","290","291","10.1021/ja067777y","","","0.7107","MoKα","","","0.043","","","","0.123","","","","","","1.012","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108981","7.4534","0.0012","7.9041","0.0013","7.9896","0.0013","106.47","0.002","93.962","0.003","113.016","0.003","406.72","0.12","173","2","173","2","","","","","","","","5","P -1","-P 1","2","UO2(Ac)2(Meimid)2 (Ac = CH3COO, Meimid = 1-methyl-imidazole)","","","- C12 H18 N4 O6 U -","- C12 H18 N4 O6 U -","- C12 H18 N4 O6 U -","1","0.5","","Keith E. Gutowski; Violina A. Cocalia; Scott T. Griffin; Nicholas J. Bridges; David A. Dixon; Robin D. Rogers","Interactions of 1-Methylimidazole with UO2(CH3CO2)2 and UO2(NO3)2: Structural, Spectroscopic, and Theoretical Evidence for Imidazole Binding to the Uranyl Ion","Journal of the American Chemical Society","2007","129","","526","536","10.1021/ja064592i","","","0.71073","MoKα","","0.0182","0.0182","","","0.0464","0.0464","","","","","","1.078","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4108982","16.2538","0.0003","16.2538","0.0003","16.2538","0.0003","90","","90","","90","","4294.03","0.14","100","2","100","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","O[Ir[(C6H3Me2)]3]2","Oxobis(tris(dimethylphenyl)iridium(IV)) deuterodichloromethane solvate","","- C49 H54 Cl2 D2 Ir2 O -","- C49.0002 H56.0004 Cl2 Ir2 O -","- C196.001 H224.002 Cl8 Ir8 O4 -","4","0.166667","","Kevin C. Fortner; David S. Laitar; John Muldoon; Lihung Pu; Sonja B. Braun-Sand; Olaf Wiest; Seth N. Brown","Ultrafast and Ultraslow Oxygen Atom Transfer Reactions between Late Metal Centers","Journal of the American Chemical Society","2007","129","","588","600","10.1021/ja065713h","","","0.71073","MoKα","","0.0177","0.0156","","0.0396","","0.0385","","","1.082","","","1.094","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108983","7.5383","0.0006","18.2795","0.0013","19.8407","0.0013","88.622","0.001","87.493","0.002","89.223","0.001","2730.4","0.3","243","2","243","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H16 O6 -","- C14 H16 O6 -","- C112 H128 O48 -","8","4","","Mingji Dai; David Sarlah; Maolin Yu; Samuel J. Danishefsky; Gavin O. Jones; K. N. Houk","Highly Selective Diels-Alder Reactions of Directly Connected Enyne Dienophiles","Journal of the American Chemical Society","2007","129","","645","657","10.1021/ja065762u","","","0.71073","MoKα","","0.1155","0.0528","","","0.1343","0.1578","","","","","","1.048","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108984","13.4646","0.0002","13.4646","0.0002","59.9213","0.001","90","","90","","120","","9408","0.3","150","1","150","1","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","","","- C45 H75 Cl2 Mn5 N24 O7 -","- C45 H75 Cl2 Mn5 N24 O7 -","- C270 H450 Cl12 Mn30 N144 O42 -","6","0.333333","","Chen-I Yang; Wolfgang Wernsdorfer; Gene-Hsiang Lee; Hui-Lien Tsai","A Pentanuclear Manganese Single-Molecule Magnet with a Large Anisotropy","Journal of the American Chemical Society","2007","129","","456","457","10.1021/ja066533a","","","0.71073","MoKα","","0.0475","0.0374","","","0.0817","0.0855","","","","","","1.11","","","","has coordinates,has disorder","178835","2020-10-21","18:00:00",""
"4108985","6.9329","0.0003","10.8831","0.0005","13.8384","0.0007","109.777","0.001","101.603","0.001","94.201","0.001","951.09","0.08","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H30 Zn2 -","- C20 H30 Zn2 -","- C40 H60 Zn4 -","2","1","","Abdessamad Grirrane; Irene Resa; Amor Rodriguez; Ernesto Carmona; Eleuterio Alvarez; Enrique Gutierrez-Puebla; Angeles Monge; Agustín Galindo; Diego del Río; Richard A. Andersen","Zinc-Zinc Bonded Zincocene Structures. Synthesis and Characterization of Zn2(η5-C5Me5)2 and Zn2(η5-C5Me4Et)2","Journal of the American Chemical Society","2007","129","","693","703","10.1021/ja0668217","","","0.71073","MoKα","","0.0485","0.031","","","0.0726","0.0759","","","","","","0.988","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108986","7.0428","0.0004","10.3194","0.0006","14.8036","0.0009","86.446","0.002","89.191","0.002","76.599","0.002","1044.58","0.11","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H34 Zn2 -","- C22 H34 Zn2 -","- C44 H68 Zn4 -","2","1","","Abdessamad Grirrane; Irene Resa; Amor Rodriguez; Ernesto Carmona; Eleuterio Alvarez; Enrique Gutierrez-Puebla; Angeles Monge; Agustín Galindo; Diego del Río; Richard A. Andersen","Zinc-Zinc Bonded Zincocene Structures. Synthesis and Characterization of Zn2(η5-C5Me5)2 and Zn2(η5-C5Me4Et)2","Journal of the American Chemical Society","2007","129","","693","703","10.1021/ja0668217","","","0.71073","MoKα","","0.0489","0.0326","","","0.0768","0.0833","","","","","","1.037","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108987","8.1668","0.0006","8.1758","0.0006","10.7877","0.001","67.755","0.002","77.755","0.003","75.47","0.002","639.83","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H46 N2 O2 Zn2 -","- C22 H46 N2 O2 Zn2 -","- C22 H46 N2 O2 Zn2 -","1","0.5","","Abdessamad Grirrane; Irene Resa; Amor Rodriguez; Ernesto Carmona; Eleuterio Alvarez; Enrique Gutierrez-Puebla; Angeles Monge; Agustín Galindo; Diego del Río; Richard A. Andersen","Zinc-Zinc Bonded Zincocene Structures. Synthesis and Characterization of Zn2(η5-C5Me5)2 and Zn2(η5-C5Me4Et)2","Journal of the American Chemical Society","2007","129","","693","703","10.1021/ja0668217","","","0.71073","MoKα","","0.0456","0.0383","","","0.0998","0.1035","","","","","","1.079","","","","has coordinates,has disorder","178835","2020-10-21","18:00:00",""
"4108988","12.432","0.004","17.46","0.005","31.649","0.009","90","","101.751","0.012","90","","6726","3","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C76 H58 F20 N6 Si2 -","- C76 H58 F20 N6 Si2 -","- C304 H232 F80 N24 Si8 -","4","1","","Masaaki Suzuki; Atsuhiro Osuka","Cross-Bridging Reaction of 5,20-Diethynyl Substituted Hexaphyrins to Vinylene-Bridged Hexaphyrins","Journal of the American Chemical Society","2007","129","","464","465","10.1021/ja067102v","","","0.71075","MoKα","","0.223","0.0758","","","0.1636","0.2246","","","","","","0.862","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108989","17.0582","0.0018","15.5874","0.0017","14.5782","0.0016","90","","98.29","0.002","90","","3835.7","0.7","90","2","90","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C78 H30 Cl2 F20 N6 O6 Zn2 -","- C78 H30 Cl2 F20 N6 O6 Zn2 -","- C156 H60 Cl4 F40 N12 O12 Zn4 -","2","1","","Masaaki Suzuki; Atsuhiro Osuka","Cross-Bridging Reaction of 5,20-Diethynyl Substituted Hexaphyrins to Vinylene-Bridged Hexaphyrins","Journal of the American Chemical Society","2007","129","","464","465","10.1021/ja067102v","","","0.71073","MoKα","","0.126","0.0912","","","0.2555","0.292","","","","","","1.06","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108990","8.39","0.005","13.865","0.009","15.169","0.007","95.39","0.02","103.75","0.02","96.1","0.02","1691.3","1.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C76 H56 F20 N6 Si2 -","- C76 H56 F20 N6 Si2 -","- C76 H56 F20 N6 Si2 -","1","0.5","","Masaaki Suzuki; Atsuhiro Osuka","Cross-Bridging Reaction of 5,20-Diethynyl Substituted Hexaphyrins to Vinylene-Bridged Hexaphyrins","Journal of the American Chemical Society","2007","129","","464","465","10.1021/ja067102v","","","0.71075","MoKα","","0.1085","0.0733","","","0.1976","0.222","","","","","","1.072","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108991","13.7096","0.0009","7.1732","0.0005","14.135","0.0009","90","","110.494","0.004","90","","1302.08","0.15","150","2","150","2","","","","","","","S. Djurdjevic, SDCDM/Ex1","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H11 N3 -","- C19 H11 N3 -","- C76 H44 N12 -","4","1","","Smilja Djurdjevic; David A. Leigh; Hamish McNab; Simon Parsons; Gilberto Teobaldi; Francesco Zerbetto","Extremely Strong and Readily Accessible AAA-DDD Triple Hydrogen Bond Complexes","Journal of the American Chemical Society","2007","129","","476","477","10.1021/ja067410t","","","0.71073","MoKα","","0.069","0.0431","","","0.1002","0.1087","","","","","","1.045","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108992","13.3373","0.0009","7.1636","0.0005","26.4564","0.0018","90","","90","","90","","2527.7","0.3","150","2","150","2","","","","","","","S. Djurdjevic SD2H/DDD","4","P b c a","-P 2ac 2ab","61","","","","- C16 H14 N2 O2 -","- C16 H14 N2 O2 -","- C128 H112 N16 O16 -","8","1","","Smilja Djurdjevic; David A. Leigh; Hamish McNab; Simon Parsons; Gilberto Teobaldi; Francesco Zerbetto","Extremely Strong and Readily Accessible AAA-DDD Triple Hydrogen Bond Complexes","Journal of the American Chemical Society","2007","129","","476","477","10.1021/ja067410t","","","0.71073","MoKα","","0.0621","0.0437","","","0.0964","0.1041","","","","","","1.053","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4108993","17.124","0.003","6.0143","0.0009","12.8665","0.0019","90","","90","","90","","1325.1","0.4","273","2","273","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C15.5 H25.5 O3 -","- C14 H25 O3.5 -","- C56 H100 O14 -","4","1","","Michael J. Williams; Holly L. Deak; Marc L. Snapper","Intramolecular Cyclobutadiene Cycloaddition/Cyclopropanation/Thermal Rearrangement: An Effective Strategy for the Asymmetric Syntheses of Pleocarpenene and Pleocarpenone","Journal of the American Chemical Society","2007","129","","486","487","10.1021/ja0674340","","","0.71073","MoKα","","0.0408","0.0402","","","0.106","0.1069","","","","","","1.079","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108994","16.19","0.005","27.376","0.008","14.093","0.004","90","","90","","90","","6246","3","90","2","90","2","","","","","","","","2","C m c 21","C 2c -2","36","pentaindenocorannulene","pentaindeno[1,2,3-bc; 1',2',3'-ef; 1'',2'',3''-hi; 1'''',2'''',3''''-no]corannulene","","- C53.5 H24 -","- C53.5 H24 -","- C428 H192 -","8","1","","Edward A. Jackson; Brian D. Steinberg; Mihail Bancu; Atsushi Wakamiya; Lawrence T. Scott","Pentaindenocorannulene and Tetraindenocorannulene: New Aromatic Hydrocarbon π Systems with Curvatures Surpassing That of C60","Journal of the American Chemical Society","2007","129","","484","485","10.1021/ja067487h","","","0.7107","MoKα","","0.1133","0.0944","","","0.2344","0.2542","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4108995","8.555","0.003","26.233","0.008","11.072","0.003","90","","90","","90","","2484.8","1.3","123","2","123","2","","","","","","","","2","P n m a","-P 2ac 2n","62","tetraindenocorannulene","tetraindeno[1,2,3-bc; 1',2',3'-ef; 1'',2'',3''-hi; 1''',2''',3'''-kl]corannulene","","- C44 H18 -","- C44 H18 -","- C176 H72 -","4","0.5","","Edward A. Jackson; Brian D. Steinberg; Mihail Bancu; Atsushi Wakamiya; Lawrence T. Scott","Pentaindenocorannulene and Tetraindenocorannulene: New Aromatic Hydrocarbon π Systems with Curvatures Surpassing That of C60","Journal of the American Chemical Society","2007","129","","484","485","10.1021/ja067487h","","","0.7107","MoKα","","0.0651","0.0582","","","0.1195","0.1235","","","","","","1.193","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108996","8.44","0.0015","7.1595","0.0013","10.6031","0.0018","90","","100.891","0.003","90","","629.16","0.19","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H14 Br N O -","- C13 H14 Br N O -","- C26 H28 Br2 N2 O2 -","2","1","","Andre J. B. Lapierre; Steven J. Geib; Dennis P. Curran","Low-Temperature Heck Reactions of Axially Chiral o-Iodoacrylanilides Occur with Chirality Transfer: Implications for Catalytic Asymmetric Heck Reactions","Journal of the American Chemical Society","2007","129","","494","495","10.1021/ja067790i","","","0.71073","MoKα","","0.077","0.0528","","","0.1269","0.1398","","","","","","0.967","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108997","6.5577","0.0007","13.4492","0.0013","16.1147","0.0016","90","","90","","90","","1421.2","0.2","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C13 H15 Br I N O -","- C13 H15 Br I N O -","- C52 H60 Br4 I4 N4 O4 -","4","1","","Andre J. B. Lapierre; Steven J. Geib; Dennis P. Curran","Low-Temperature Heck Reactions of Axially Chiral o-Iodoacrylanilides Occur with Chirality Transfer: Implications for Catalytic Asymmetric Heck Reactions","Journal of the American Chemical Society","2007","129","","494","495","10.1021/ja067790i","","","0.71073","MoKα","","0.0156","0.0148","","","0.0372","0.0375","","","","","","0.858","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4108998","6.7838","0.0003","5.0683","0.0002","20.4498","0.0009","90","","94.454","0.002","90","","700.99","0.05","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H19 N O4 -","- C15 H19 N O4 -","- C30 H38 N2 O8 -","2","1","","Jennifer E. Davoren; Stephen F. Martin","Enantioselective Synthesis and Structure Revision of Solandelactone E","Journal of the American Chemical Society","2007","129","","510","511","10.1021/ja068270q","","","0.71073","MoKα","","0.1403","0.0573","","","0.1073","0.1301","","","","","","1.012","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4108999","9.1393","0.0008","13.3909","0.0013","12.5744","0.001","90","","109.609","0.005","90","","1449.6","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","TTf+ Car-","Tetrathiafulvalenium Dodecamethylcarba-closo-dodecaboranate","","- C19 H40 B11 S4 -","- C19 H40 B11 S4 -","- C38 H80 B22 S8 -","2","0.5","","Sergiy V. Rosokha; Jay K. Kochi","Molecular and Electronic Structures of the Long-Bonded π-Dimers of Tetrathiafulvalene Cation-Radical in Intermolecular Electron Transfer and in (Solid-State) Conductivity","Journal of the American Chemical Society","2007","129","","828","838","10.1021/ja064166x","","","0.71073","MoKα","","0.0514","0.0454","","","0.1292","0.1319","","","","","","1.109","","","","has coordinates","178835","2020-10-21","18:00:00",""
"4109000","6.9849","0.001","10.1656","0.0015","17.697","0.003","77.32","0.002","82.054","0.002","73.833","0.002","1173.5","0.3","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C60 H52 O6 -","- C60 H52 O6 -","- C60 H52 O6 -","1","0.5","","Tinh-Alfredo V. Khuong; Hung Dang; Peter D. Jarowski; Emily F. Maverick; Miguel A. Garcia-Garibay","Rotational Dynamics in a Crystalline Molecular Gyroscope by Variable-Temperature 13C NMR,2H NMR, X-Ray Diffraction, and Force Field Calculations","Journal of the American Chemical Society","2007","129","","839","845","10.1021/ja064325c","","","0.71073","MoKα","","0.1348","0.0611","","","0.1437","0.1753","","","","","","0.962","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109001","7.059","0.0012","10.1724","0.0017","17.82","0.003","77.152","0.003","81.507","0.003","73.412","0.003","1190.8","0.3","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","","","- C60 H52 O6 -","- C60 H52 O6 -","- C60 H52 O6 -","1","0.5","","Tinh-Alfredo V. Khuong; Hung Dang; Peter D. Jarowski; Emily F. Maverick; Miguel A. Garcia-Garibay","Rotational Dynamics in a Crystalline Molecular Gyroscope by Variable-Temperature 13C NMR,2H NMR, X-Ray Diffraction, and Force Field Calculations","Journal of the American Chemical Society","2007","129","","839","845","10.1021/ja064325c","","","0.71073","MoKα","","0.1731","0.0657","","","0.1453","0.1871","","","","","","0.939","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109002","7.116","0.004","10.145","0.005","17.823","0.009","77.253","0.009","80.996","0.008","73.084","0.008","1194.8","1.1","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","","","- C60 H52 O6 -","- C60 H52 O6 -","- C60 H52 O6 -","1","0.5","","Tinh-Alfredo V. Khuong; Hung Dang; Peter D. Jarowski; Emily F. Maverick; Miguel A. Garcia-Garibay","Rotational Dynamics in a Crystalline Molecular Gyroscope by Variable-Temperature 13C NMR,2H NMR, X-Ray Diffraction, and Force Field Calculations","Journal of the American Chemical Society","2007","129","","839","845","10.1021/ja064325c","","","0.71073","MoKα","","0.264","0.0656","","","0.1277","0.1772","","","","","","0.772","","","","has coordinates","212012","2020-10-21","18:00:00",""
"4109003","15.6669","0.0012","28.019","0.003","21.1975","0.0016","90","","96.944","0.001","90","","9236.8","1.4","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H48.67 Ir P2 -","- C32 H48.6667 Ir P2 -","- C384 H584 Ir12 P24 -","12","1.5","","Rajshekhar Ghosh; Xiawei Zhang; Patrick Achord; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Dimerization of Alkynes Promoted by a Pincer-Ligated Iridium Complex. C-C Reductive Elimination Inhibited by Steric Crowding","Journal of the American Chemical Society","2007","129","","853","866","10.1021/ja0647194","","","0.71073","MoKα","","0.0742","0.0434","","","0.0889","0.0987","","","","","","1.037","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109004","9.0296","0.0011","10.7199","0.0013","20.151","0.002","103.081","0.002","99.055","0.002","100.91","0.002","1824.3","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H57 Ir P2 -","- C41 H57 Ir P2 -","- C82 H114 Ir2 P4 -","2","1","","Rajshekhar Ghosh; Xiawei Zhang; Patrick Achord; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Dimerization of Alkynes Promoted by a Pincer-Ligated Iridium Complex. C-C Reductive Elimination Inhibited by Steric Crowding","Journal of the American Chemical Society","2007","129","","853","866","10.1021/ja0647194","","","0.71073","MoKα","","0.0951","0.0677","","","0.1473","0.1568","","","","","","1.03","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109005","21.231","0.0015","7.9699","0.0006","41.317","0.003","90","","94.434","0.001","90","","6970.3","0.9","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C37 H52 Ir O P2 -","- C37 H52 Ir O P2 -","- C296 H416 Ir8 O8 P16 -","8","1","","Rajshekhar Ghosh; Xiawei Zhang; Patrick Achord; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Dimerization of Alkynes Promoted by a Pincer-Ligated Iridium Complex. C-C Reductive Elimination Inhibited by Steric Crowding","Journal of the American Chemical Society","2007","129","","853","866","10.1021/ja0647194","","","0.71073","MoKα","","0.0513","0.0409","","","0.0847","0.0884","","","","","","1.009","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109006","13.6792","0.0007","15.4032","0.0008","15.8231","0.0009","90","","111.056","0.001","90","","3111.4","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H50 Cl Ir P2 -","- C32 H50 Cl Ir P2 -","- C128 H200 Cl4 Ir4 P8 -","4","1","","Rajshekhar Ghosh; Xiawei Zhang; Patrick Achord; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Dimerization of Alkynes Promoted by a Pincer-Ligated Iridium Complex. C-C Reductive Elimination Inhibited by Steric Crowding","Journal of the American Chemical Society","2007","129","","853","866","10.1021/ja0647194","","","0.71073","MoKα","","0.024","0.0198","","","0.0489","0.0504","","","","","","1.004","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109007","11.6801","0.0011","10.7345","0.001","29.517","0.003","90","","97.617","0.001","90","","3668.2","0.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H55 Ir O P2 -","- C41 H55 Ir O P2 -","- C164 H220 Ir4 O4 P8 -","4","1","","Rajshekhar Ghosh; Xiawei Zhang; Patrick Achord; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Dimerization of Alkynes Promoted by a Pincer-Ligated Iridium Complex. C-C Reductive Elimination Inhibited by Steric Crowding","Journal of the American Chemical Society","2007","129","","853","866","10.1021/ja0647194","","","0.71073","MoKα","","0.0243","0.0202","","","0.0432","0.0446","","","","","","1.008","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109008","11.313","0.0008","39.671","0.003","9.3604","0.0007","90","","114.286","0.001","90","","3829.2","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H57 Ir O P2 -","- C42 H57 Ir O P2 -","- C168 H228 Ir4 O4 P8 -","4","1","","Rajshekhar Ghosh; Xiawei Zhang; Patrick Achord; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Dimerization of Alkynes Promoted by a Pincer-Ligated Iridium Complex. C-C Reductive Elimination Inhibited by Steric Crowding","Journal of the American Chemical Society","2007","129","","853","866","10.1021/ja0647194","","","0.71073","MoKα","","0.0792","0.0495","","","0.0853","0.0936","","","","","","1.01","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109009","13.7974","0.0006","15.2017","0.0007","20.0847","0.0009","90","","95.194","0.001","90","","4195.3","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H63 Ir O P2 -","- C50 H63 Ir O P2 -","- C200 H252 Ir4 O4 P8 -","4","1","","Rajshekhar Ghosh; Xiawei Zhang; Patrick Achord; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Dimerization of Alkynes Promoted by a Pincer-Ligated Iridium Complex. C-C Reductive Elimination Inhibited by Steric Crowding","Journal of the American Chemical Society","2007","129","","853","866","10.1021/ja0647194","","","0.71073","MoKα","","0.0507","0.0291","","","0.0606","0.0677","","","","","","1","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109010","33.617","0.002","10.3664","0.0006","20.5194","0.0012","90","","91.769","0.001","90","","7147.3","0.7","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C40 H55 Ir P2 -","- C40 H55 Ir P2 -","- C320 H440 Ir8 P16 -","8","1","","Rajshekhar Ghosh; Xiawei Zhang; Patrick Achord; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Dimerization of Alkynes Promoted by a Pincer-Ligated Iridium Complex. C-C Reductive Elimination Inhibited by Steric Crowding","Journal of the American Chemical Society","2007","129","","853","866","10.1021/ja0647194","","","0.71073","MoKα","","0.0358","0.0288","","","0.0614","0.0633","","","","","","1.01","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109011","11.1749","0.0009","16.5519","0.0013","17.6922","0.0014","90","","97.355","0.001","90","","3245.5","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H50 Cl Ir O P2 -","- C33 H50 Cl Ir O P2 -","- C132 H200 Cl4 Ir4 O4 P8 -","4","1","","Rajshekhar Ghosh; Xiawei Zhang; Patrick Achord; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman","Dimerization of Alkynes Promoted by a Pincer-Ligated Iridium Complex. C-C Reductive Elimination Inhibited by Steric Crowding","Journal of the American Chemical Society","2007","129","","853","866","10.1021/ja0647194","","","0.71073","MoKα","","0.0195","0.0168","","","0.0398","0.0409","","","","","","1.009","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109012","11.4827","0.0011","14.1996","0.0012","14.2725","0.0008","105.075","0.005","92.968","0.006","101.382","0.007","2189.7","0.3","120","2","120","2","","","","","","","","8","P -1","-P 1","2","Compound 3","","","- C76 H14 B4 Cl8 F60 N2 O2 Tl4 -","- C76 H12 B4 Cl8 F60 N2 O2 Tl4 -","- C76 H12 B4 Cl8 F60 N2 O2 Tl4 -","1","0.5","","Yann Sarazin; David L. Hughes; Nikolas Kaltsoyannis; Joseph A. Wright; Manfred Bochmann","Thallium(I) Sandwich, Multidecker, and Ether Complexes Stabilized by Weakly-Coordinating Anions: A Spectroscopic, Structural, and Theoretical Investigation","Journal of the American Chemical Society","2007","129","","881","894","10.1021/ja0657105","","","0.71073","MoKα","","0.0386","0.0336","","","0.0816","0.0844","","","","","","1.092","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109013","12.2427","0.0005","13.9012","0.0004","19.1784","0.0006","84.244","0.002","86.754","0.003","87.66","0.003","3240.24","0.19","140","1","140","1","","","","","","","","7","P -1","-P 1","2","Compound 5b","","","- C62.5 H43 B2 Cl5 F30 N Tl -","- C62.5 H42 B2 Cl5 F30 N Tl -","- C125 H84 B4 Cl10 F60 N2 Tl2 -","2","1","","Yann Sarazin; David L. Hughes; Nikolas Kaltsoyannis; Joseph A. Wright; Manfred Bochmann","Thallium(I) Sandwich, Multidecker, and Ether Complexes Stabilized by Weakly-Coordinating Anions: A Spectroscopic, Structural, and Theoretical Investigation","Journal of the American Chemical Society","2007","129","","881","894","10.1021/ja0657105","","","0.71073","Mo-Kα","","0.0434","0.0319","","","0.0729","0.0753","","","","","","1.011","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109014","10.0625","0.0009","11.6162","0.001","24.6374","0.0019","82.719","0.007","81.749","0.007","84.366","0.007","2817.6","0.4","180","2","140","1","","","","","","","","8","P -1","-P 1","2","Compound 6","","","- C107 H44 B4 Cl10 F60 Fe3 N2 Tl2 -","- C107 H44 B4 Cl10 F60 Fe3 N2 Tl2 -","- C107 H44 B4 Cl10 F60 Fe3 N2 Tl2 -","1","0.5","","Yann Sarazin; David L. Hughes; Nikolas Kaltsoyannis; Joseph A. Wright; Manfred Bochmann","Thallium(I) Sandwich, Multidecker, and Ether Complexes Stabilized by Weakly-Coordinating Anions: A Spectroscopic, Structural, and Theoretical Investigation","Journal of the American Chemical Society","2007","129","","881","894","10.1021/ja0657105","","","0.71073","MoKα","","0.1511","0.0669","","","0.159","0.177","","","","","","0.946","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109015","12.4566","0.0003","15.7031","0.0006","16.4745","0.001","73.71","0.004","87.071","0.004","72.249","0.003","2943.8","0.2","140","1","140","1","","","","","","","","8","P -1","-P 1","2","Compound 11b","","","- C50 H30 B2 Cl4 F30 N O6 Tl -","- C50 H30 B2 Cl4 F30 N O6 Tl -","- C100 H60 B4 Cl8 F60 N2 O12 Tl2 -","2","1","","Yann Sarazin; David L. Hughes; Nikolas Kaltsoyannis; Joseph A. Wright; Manfred Bochmann","Thallium(I) Sandwich, Multidecker, and Ether Complexes Stabilized by Weakly-Coordinating Anions: A Spectroscopic, Structural, and Theoretical Investigation","Journal of the American Chemical Society","2007","129","","881","894","10.1021/ja0657105","","","0.71073","Mo-Kα","","0.039","0.0302","","","0.0805","0.0832","","","","","","1.052","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109016","28.3882","0.0013","14.5749","0.0005","24.8491","0.0014","90","","105.688","0.004","90","","9898.4","0.8","140","2","140","1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C47.5 H20 B2 Cl3 F30 N Sn -","- C47.5 H20 B2 Cl3 F30 N Sn -","- C380 H160 B16 Cl24 F240 N8 Sn8 -","8","1","","Yann Sarazin; David L. Hughes; Nikolas Kaltsoyannis; Joseph A. Wright; Manfred Bochmann","Thallium(I) Sandwich, Multidecker, and Ether Complexes Stabilized by Weakly-Coordinating Anions: A Spectroscopic, Structural, and Theoretical Investigation","Journal of the American Chemical Society","2007","129","","881","894","10.1021/ja0657105","","","0.71073","Mo-Kα","","0.0848","0.0521","","","0.1269","0.1375","","","","","","1.073","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109017","12.2481","0.0004","13.7603","0.0005","17.304","0.0006","86.556","0.002","76.904","0.002","87.12","0.002","2833.38","0.17","120","2","120","2","","","","","","","","7","P -1","-P 1","2","Compound 2b","","","- C52 H42 B2 F30 N O4 Tl -","- C52 H42 B2 F30 N O4 Tl -","- C104 H84 B4 F60 N2 O8 Tl2 -","2","1","","Yann Sarazin; David L. Hughes; Nikolas Kaltsoyannis; Joseph A. Wright; Manfred Bochmann","Thallium(I) Sandwich, Multidecker, and Ether Complexes Stabilized by Weakly-Coordinating Anions: A Spectroscopic, Structural, and Theoretical Investigation","Journal of the American Chemical Society","2007","129","","881","894","10.1021/ja0657105","","","0.71073","MoKα","","0.0799","0.0479","","","0.1058","0.113","","","","","","1.064","","","","has coordinates,has disorder","212012","2020-10-21","18:00:00",""
"4109018","13.781","0.005","18.151","0.008","21.698","0.014","90","","91.68","0.05","90","","5425","5","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Compound 4b","","","- C57 H26 B2 F30 N Tl -","- C57 H26 B2 F30 N Tl -","- C228 H104 B8 F120 N4 Tl4 -","4","1","","Yann Sarazin; David L. Hughes; Nikolas Kaltsoyannis; Joseph A. Wright; Manfred Bochmann","Thallium(I) Sandwich, Multidecker, and Ether Complexes Stabilized by Weakly-Coordinating Anions: A Spectroscopic, Structural, and Theoretical Investigation","Journal of the American Chemical Society","2007","129","","881","894","10.1021/ja0657105","","","0.71073","MoKα","","0.071","0.0481","","","0.0752","0.081","","","","","","1.082","","","","has coordinates","212012","2020-10-21","18:00:00",""
"4109019","12.6228","0.0005","15.3039","0.0006","20.0687","0.0008","90","","90","","90","","3876.8","0.3","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","1002FH ZH-760 C37H67BNO4Sn chiral xx1","","","- C37 H68 B N O4 Sn -","- C37 H68 B N O4 Sn -","- C148 H272 B4 N4 O16 Sn4 -","4","1","","Dagmar Kapeller; Roland Barth; Kurt Mereiter; Friedrich Hammerschmidt","Preparation of Chiral α-Oxy-[2H1]methyllithiums of 99% ee and Determination of Their Configurational Stability","Journal of the American Chemical Society","2007","129","","914","923","10.1021/ja066183s","","","0.71073","MoKα","","0.0172","0.0165","","","0.042","0.0424","","","","","","1.04","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109020","7.5037","0.0006","31.613","0.003","8.2016","0.0007","90","","98.972","0.002","90","","1921.7","0.3","88","2","88","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(2,3-dimethylpyridinium) tetrabromocuprate","","- C14 H20 Br4 Cu N2 -","- C14 H20 Br4 Cu N2 -","- C56 H80 Br16 Cu4 N8 -","4","1","","Alexander Shapiro; Christopher P. Landee; Mark M. Turnbull; Joaquim Jornet; Mercè Deumal; Juan J. Novoa; Michael A. Robb; William Lewis","Synthesis, Structure, and Magnetic Properties of an Antiferromagnetic Spin-Ladder Complex: Bis(2,3-dimethylpyridinium) Tetrabromocuprate","Journal of the American Chemical Society","2007","129","","952","959","10.1021/ja066330m","","","0.71073","MoKα","","0.0573","0.0359","","","0.0672","0.0724","","","","","","1.039","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109021","10.3644","0.0012","12.56","0.0015","14.1755","0.0017","91.41","0.002","99.142","0.002","101.852","0.002","1779.9","0.4","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H63 Cl N2 P2 Pd -","- C34 H63 Cl N2 P2 Pd -","- C68 H126 Cl2 N4 P4 Pd2 -","2","1","","Joan Vignolle; Heinz Gornitzka; Laurent Maron; Wolfgang W. Schoeller; Didier Bourissou; Guy Bertrand","Transient Palladadiphosphanylcarbenes: Singlet Carbenes with an ""Inverse"" Electronic Configuration (pπ2 instead of σ2) and Unusual Transannular Metal-Carbene Interactions (πC\ρightarrowPd Donation and σPd\ρightarrowC Back-donation)","Journal of the American Chemical Society","2007","129","","978","985","10.1021/ja066738j","","","0.71073","MoKα","","0.049","0.0333","","","0.0815","0.0891","","","","","","1.033","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109022","36.164","0.004","12.5747","0.0014","13.9696","0.0015","90","","90","","90","","6352.7","1.2","193","2","193","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C65 H92 B Cl4 N3 P2 Pd -","- C65 H92 B Cl4 N3 P2 Pd -","- C260 H368 B4 Cl16 N12 P8 Pd4 -","4","1","","Joan Vignolle; Heinz Gornitzka; Laurent Maron; Wolfgang W. Schoeller; Didier Bourissou; Guy Bertrand","Transient Palladadiphosphanylcarbenes: Singlet Carbenes with an ""Inverse"" Electronic Configuration (pπ2 instead of σ2) and Unusual Transannular Metal-Carbene Interactions (πC\ρightarrowPd Donation and σPd\ρightarrowC Back-donation)","Journal of the American Chemical Society","2007","129","","978","985","10.1021/ja066738j","","","0.71073","MoKα","","0.0622","0.0516","","","0.1024","0.1062","","","","","","1.073","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109023","17.119","0.004","16.313","0.004","21.541","0.005","90","","110.272","0.004","90","","5643","2","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C61 H92 B N2 P3 Pd -","- C61 H92 B N2 P3 Pd -","- C244 H368 B4 N8 P12 Pd4 -","4","1","","Joan Vignolle; Heinz Gornitzka; Laurent Maron; Wolfgang W. Schoeller; Didier Bourissou; Guy Bertrand","Transient Palladadiphosphanylcarbenes: Singlet Carbenes with an ""Inverse"" Electronic Configuration (pπ2 instead of σ2) and Unusual Transannular Metal-Carbene Interactions (πC\ρightarrowPd Donation and σPd\ρightarrowC Back-donation)","Journal of the American Chemical Society","2007","129","","978","985","10.1021/ja066738j","","","0.71073","MoKα","","0.0822","0.0427","","","0.0912","0.1075","","","","","","0.997","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109024","20.26","0.02","17.919","0.019","26.31","0.03","90","","96.99","0.02","90","","9481","17","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H43.5 Al Cl6.88 N2 O2 -","- C49 H43.5 Al Cl6.9015 N2 O2 -","- C392 H348 Al8 Cl55.212 N16 O16 -","8","2","","Norito Takenaka; Joshua P. Abell; Hisashi Yamamoto","Asymmetric Conjugate Addition of Silyl Enol Ethers Catalyzed by Tethered Bis(8-quinolinolato) Aluminum Complexes","Journal of the American Chemical Society","2007","129","","742","743","10.1021/ja0668320","","","0.71073","MoKα","","0.1824","0.1504","","","0.266","0.282","","","","","","1.349","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109025","7.273","0.015","10.13","0.02","11.76","0.02","82.93","0.04","82.72","0.04","71.26","0.03","811","3","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H22 O3 -","- C20 H22 O3 -","- C40 H44 O6 -","2","1","","Norito Takenaka; Joshua P. Abell; Hisashi Yamamoto","Asymmetric Conjugate Addition of Silyl Enol Ethers Catalyzed by Tethered Bis(8-quinolinolato) Aluminum Complexes","Journal of the American Chemical Society","2007","129","","742","743","10.1021/ja0668320","","","0.71073","MoKα","","0.0738","0.0598","","","0.1447","0.1542","","","","","","0.997","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109026","13.9117","0.0013","24.058","0.002","18.0919","0.0017","90","","92.21","0.002","90","","6050.6","0.9","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H95 O6 P3 Pt3 Re2 -","- C48 H95 O6 P3 Pt3 Re2 -","- C192 H380 O24 P12 Pt12 Re8 -","4","1","","Richard D. Adams; Burjor Captain; Chad Beddie; Michael B. Hall","Photoreversible Multiple Additions of Hydrogen to a Highly Unsaturated Platinum-Rhenium Cluster Complex","Journal of the American Chemical Society","2007","129","","986","1000","10.1021/ja067028g","","","0.71073","MoKα","","0.0865","0.0501","","","0.101","0.1143","","","","","","1.004","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109027","13.9272","0.0013","23.991","0.002","18.0905","0.0016","90","","91.807","0.002","90","","6041.5","0.9","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H95 O6 P3 Pt3 Re2 -","- C48 H95 O6 P3 Pt3 Re2 -","- C192 H380 O24 P12 Pt12 Re8 -","4","1","","Richard D. Adams; Burjor Captain; Chad Beddie; Michael B. Hall","Photoreversible Multiple Additions of Hydrogen to a Highly Unsaturated Platinum-Rhenium Cluster Complex","Journal of the American Chemical Society","2007","129","","986","1000","10.1021/ja067028g","","","0.71073","MoKα","","0.1169","0.0515","","","0.1068","0.1303","","","","","","1.004","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109028","24.044","0.002","18.2218","0.0016","13.8953","0.0012","90","","90","","90","","6087.9","0.9","296","2","296","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C48 H95 O6 P3 Pt3 Re2 -","- C48 H95 O6 P3 Pt3 Re2 -","- C192 H380 O24 P12 Pt12 Re8 -","4","0.5","","Richard D. Adams; Burjor Captain; Chad Beddie; Michael B. Hall","Photoreversible Multiple Additions of Hydrogen to a Highly Unsaturated Platinum-Rhenium Cluster Complex","Journal of the American Chemical Society","2007","129","","986","1000","10.1021/ja067028g","","","0.71073","MoKα","","0.0639","0.0392","","","0.0856","0.0955","","","","","","1.044","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109029","14.7099","0.0006","23.4704","0.0009","17.7176","0.0007","90","","91.031","0.001","90","","6116","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H102 O6 P3 Pt3 Re2 -","- C52 H102 O6 P3 Pt3 Re2 -","- C208 H408 O24 P12 Pt12 Re8 -","4","1","","Richard D. Adams; Burjor Captain; Chad Beddie; Michael B. Hall","Photoreversible Multiple Additions of Hydrogen to a Highly Unsaturated Platinum-Rhenium Cluster Complex","Journal of the American Chemical Society","2007","129","","986","1000","10.1021/ja067028g","","","0.71073","MoKα","","0.0431","0.0342","","","0.0757","0.079","","","","","","1.06","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109030","11.777","0.0011","14.9566","0.0015","45.768","0.005","90","","92.098","0.002","90","","8056.3","1.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H27 O9 P Re2 -","- C21 H27 O9 P Re2 -","- C252 H324 O108 P12 Re24 -","12","3","","Richard D. Adams; Burjor Captain; Chad Beddie; Michael B. Hall","Photoreversible Multiple Additions of Hydrogen to a Highly Unsaturated Platinum-Rhenium Cluster Complex","Journal of the American Chemical Society","2007","129","","986","1000","10.1021/ja067028g","","","0.71073","MoKα","","0.0515","0.0331","","","0.0745","0.0856","","","","","","1.064","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109031","8.9858","0.0015","12.415","0.002","10.8491","0.0018","90","","95.168","0.002","90","","1205.4","0.3","173","2","173","2","","","","","","","synthesis as described","6","P 1 n 1","P -2yac","7","","","","- C18 H33 F I2 Ni P2 -","- C18 H33 F I2 Ni P2 -","- C36 H66 F2 I4 Ni2 P4 -","2","1","","Alana L. Keen; Meghan Doster; Samuel A. Johnson","1,4-Shifts in a Dinuclear Ni(I) Biarylyl Complex: A Mechanistic Study of C-H Bond Activation by Monovalent Nickel","Journal of the American Chemical Society","2007","129","","810","819","10.1021/ja067112w","","x-ray","0.71073","MoKα","","0.0447","0.0361","","","0.0877","0.0979","","","","","","1.099","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109032","19.576","0.002","28.862","0.003","13.9109","0.0015","90","","117.108","0.001","90","","6996.3","1.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H52 F4 Ni2 P4 -","- C30 H52 F4 Ni2 P4 -","- C240 H416 F32 Ni16 P32 -","8","1","","Alana L. Keen; Meghan Doster; Samuel A. Johnson","1,4-Shifts in a Dinuclear Ni(I) Biarylyl Complex: A Mechanistic Study of C-H Bond Activation by Monovalent Nickel","Journal of the American Chemical Society","2007","129","","810","819","10.1021/ja067112w","","","0.71073","MoKα","","0.0735","0.0608","","","0.119","0.124","","","","","","1.234","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109033","11.0586","0.0019","11.0586","0.0019","38.711","0.013","90","","90","","90","","4734","2","173","2","173","2","","","","","","","synthesis as described","4","I 41/a :2","-I 4ad","88","","","","- C24 H38 Ni P2 -","- C24 H38 Ni P2 -","- C192 H304 Ni8 P16 -","8","0.5","","Alana L. Keen; Meghan Doster; Samuel A. Johnson","1,4-Shifts in a Dinuclear Ni(I) Biarylyl Complex: A Mechanistic Study of C-H Bond Activation by Monovalent Nickel","Journal of the American Chemical Society","2007","129","","810","819","10.1021/ja067112w","","x-ray","0.71073","MoKα","","0.0458","0.0385","","","0.0878","0.0918","","","","","","1.152","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109034","12.42","0.003","14.719","0.003","21.426","0.005","90","","95.076","0.004","90","","3901.5","1.5","223","2","223","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H51 F6 Ni3 P3 -","- C36 H31 F6 Ni3 P3 -","- C144 H124 F24 Ni12 P12 -","4","1","","Alana L. Keen; Meghan Doster; Samuel A. Johnson","1,4-Shifts in a Dinuclear Ni(I) Biarylyl Complex: A Mechanistic Study of C-H Bond Activation by Monovalent Nickel","Journal of the American Chemical Society","2007","129","","810","819","10.1021/ja067112w","","x-ray","0.71073","MoKα","","0.0537","0.0442","","","0.1275","0.1364","","","","","","1.049","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109035","15.512","0.002","10.083","0.001","16.336","0.002","90","","111.022","0.002","90","","2385","0.5","173.2","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C21 H41 Cl Ir O P -","- C21 H41 Cl Ir O P -","- C84 H164 Cl4 Ir4 O4 P4 -","4","1","","Mitchell R. Anstey; Cathleen M. Yung; Juana Du; Robert G. Bergman","Unexpected C-C Bond Cleavage and C-C Bond Formation Observed in the Reaction of a Cationic Iridium Complex with Heteroatom-Substituted Cyclopropanes","Journal of the American Chemical Society","2007","129","","776","777","10.1021/ja068312a","","","0.7107","MoKα","","0.0671","0.0368","","0.0466","","0.041","","","","","","1.291","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109036","6.325","0.005","6.363","0.005","11.963","0.009","99.621","0.018","97.89","0.019","93.099","0.017","468.7","0.6","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C20 H25 N O4 -","- C20 H25 N O4 -","- C20 H25 N O4 -","1","1","","Javier Adrio; Juan C. Carretero","Butenolide Synthesis by Molybdenum-Mediated Hetero-Pauson-Khand Reaction of Alkynyl Aldehydes","Journal of the American Chemical Society","2007","129","","778","779","10.1021/ja0684186","","","0.71073","MoKα","","0.1104","0.0992","","","0.2531","0.2676","","","","","","1.223","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109037","5.876","0.004","20.129","0.015","14.512","0.013","90","","100.05","0.03","90","","1690","2","115","","115","","","","","","","","local laboratory","3","P 1 21/c 1","-P 2ybc","14","","","","- C23.5 H16 O3.5 -","- C23.5 H14 O3.5 -","- C94 H56 O14 -","4","1","","Youjun Yang; Mark Lowry; Corin M. Schowalter; Sayo O. Fakayode; Jorge O. Escobedo; Xiangyang Xu; Huating Zhang; Timothy J. Jensen; Frank R. Fronczek; Isiah M. Warner; Robert M. Strongin","An Organic White Light-Emitting Fluorophore","Journal of the American Chemical Society","2007","129","","1008","1008","10.1021/ja068506q","","","0.71073","MoKα","","0.198","0.082","","","0.146","0.186","","","","","","1.062","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109038","7.116","0.004","10.145","0.005","17.823","0.009","77.253","0.009","80.996","0.008","73.084","0.008","1194.8","1.1","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","","","- C60 H52 O6 -","- C60 H52 O6 -","- C60 H52 O6 -","1","0.5","","Tinh-Alfredo V. Khuong; Hung Dang; Peter D. Jarowski; Emily F. Maverick; Miguel A. Garcia-Garibay","Rotational Dynamics in a Crystalline Molecular Gyroscope by Variable-Temperature 13C NMR,2H NMR, X-Ray Diffraction, and Force Field Calculations","Journal of the American Chemical Society","2007","129","","839","845","10.1021/ja064325c","","","0.71073","MoKα","","0.1684","0.0649","","","0.1335","0.1668","","","","","","0.865","","4109002","","has coordinates,has disorder","215354","2020-10-21","18:00:00",""
"4109039","12.2481","0.0004","13.7603","0.0005","17.304","0.0006","86.556","0.002","76.904","0.002","87.12","0.002","2833.38","0.17","120","2","120","2","","","","","","","","7","P -1","-P 1","2","Compound 2b","","","- C52 H42 B2 F30 N O4 Tl -","- C52 H29 B2 F30 N O4 Tl0.99 -","- C104 H58 B4 F60 N2 O8 Tl1.98 -","2","1","","Yann Sarazin; David L. Hughes; Nikolas Kaltsoyannis; Joseph A. Wright; Manfred Bochmann","Thallium(I) Sandwich, Multidecker, and Ether Complexes Stabilized by Weakly-Coordinating Anions: A Spectroscopic, Structural, and Theoretical Investigation","Journal of the American Chemical Society","2007","129","","881","894","10.1021/ja0657105","","","0.71073","MoKα","","0.0906","0.0557","","","0.132","0.145","","","","","","1.061","","4109017","","has coordinates,has disorder","215354","2020-10-21","18:00:00",""
"4109040","13.781","","18.151","","21.698","","90","","91.68","","90","","5425.18","","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Compound 4b","","","- C57 H26 B2 F30 N Tl -","- C57 H26 B2 F30 N Tl -","- C228 H104 B8 F120 N4 Tl4 -","4","1","","Yann Sarazin; David L. Hughes; Nikolas Kaltsoyannis; Joseph A. Wright; Manfred Bochmann","Thallium(I) Sandwich, Multidecker, and Ether Complexes Stabilized by Weakly-Coordinating Anions: A Spectroscopic, Structural, and Theoretical Investigation","Journal of the American Chemical Society","2007","129","","881","894","10.1021/ja0657105","","","0.71073","MoKα","","0.071","0.0482","","","0.1003","0.1082","","","","","","1.081","","4109018","","has coordinates","215354","2020-10-21","18:00:00",""
"4109041","9.144","0.0003","17.419","0.0005","14.4173","0.0004","90","","94.435","0.002","90","","2289.5","0.12","120","1","120","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H12 Fe3 N3 O3 S6 -","- C18 H12 Fe3 N3 O3 S6 -","- C72 H48 Fe12 N12 O12 S24 -","4","1","","I-Jui Hsu; Chung-Hung Hsieh; Shyue-Chu Ke; Kuo-An Chiang; Jenn-Min Lee; Jin-Ming Chen; Ling-Yun Jang; Gene-Hsiang Lee; Yu Wang; Wen-Feng Liaw","New Members of a Class of Iron-Thiolate-Nitrosyl Compounds: Trinuclear Iron-Thiolate-Nitrosyl Complexes Containing Fe3S6 Core","Journal of the American Chemical Society","2007","129","","1151","1159","10.1021/ja065401e","","","0.71073","MoKα","","0.047","0.0346","","","0.0963","0.1215","","","","","","1.167","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109042","25.5399","0.0006","10.2124","0.0002","11.2987","0.0003","90","","90","","90","","2946.97","0.12","150","1","150","1","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C20 H20 F6 Fe3 N3 O5 P S6 -","- C20 H20 F6 Fe3 N3 O5 P S6 -","- C80 H80 F24 Fe12 N12 O20 P4 S24 -","4","0.5","","I-Jui Hsu; Chung-Hung Hsieh; Shyue-Chu Ke; Kuo-An Chiang; Jenn-Min Lee; Jin-Ming Chen; Ling-Yun Jang; Gene-Hsiang Lee; Yu Wang; Wen-Feng Liaw","New Members of a Class of Iron-Thiolate-Nitrosyl Compounds: Trinuclear Iron-Thiolate-Nitrosyl Complexes Containing Fe3S6 Core","Journal of the American Chemical Society","2007","129","","1151","1159","10.1021/ja065401e","","","0.71073","MoKα","","0.1179","0.0672","","","0.178","0.2186","","","","","","1.117","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109043","12.3585","0.0008","13.2595","0.0005","16.1042","0.0011","106.938","0.003","103.032","0.003","90.219","0.003","2452.6","0.3","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C53 H31 B F20 N3 O3 Re -","- C53 H31 B F20 N3 O3 Re -","- C106 H62 B2 F40 N6 O6 Re2 -","2","1","","Elon A. Ison; Jeanette E. Cessarich; Nicholas E. Travia; Phillip E. Fanwick; Mahdi M. Abu-Omar","Synthesis of Cationic Rhenium(VII) Oxo Imido Complexes and Their Tunability Towards Oxygen Atom Transfer","Journal of the American Chemical Society","2007","129","","1167","1178","10.1021/ja065551p","","","0.71073","MO-Kα","","0.077","0.045","","","0.091","0.105","","","","","","1.014","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109044","18.1716","0.0003","19.4058","0.0003","22.118","0.0003","72.3473","0.0011","76.3375","0.0008","65.7914","0.0007","6722.32","0.18","150","","150","","","","","","","","","9","P -1","-P 1","2","","","","- C69.43 H44.87 B Cl2.87 F20 N3 O2 P Re -","- C69.434 H44.868 B Cl2.868 F20 N3 O2 P Re -","- C277.736 H179.472 B4 Cl11.472 F80 N12 O8 P4 Re4 -","4","2","","Elon A. Ison; Jeanette E. Cessarich; Nicholas E. Travia; Phillip E. Fanwick; Mahdi M. Abu-Omar","Synthesis of Cationic Rhenium(VII) Oxo Imido Complexes and Their Tunability Towards Oxygen Atom Transfer","Journal of the American Chemical Society","2007","129","","1167","1178","10.1021/ja065551p","","","0.71073","MO-Kα","","0.107","0.053","","","0.124","0.143","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109045","20.3441","0.0009","20.3441","0.0009","20.3441","0.0009","90","","90","","90","","8420.1","0.6","123","2","123","2","","","","","","","","6","I -4 3 m","I -4 2 3","217","","","","- C78 H230 Cu17 Mn28 N12 O128 -","- C78 H229.92 Cu17 Mn28 N12 O128 -","- C156 H459.84 Cu34 Mn56 N24 O256 -","2","0.0416667","","Wen-Guo Wang; Ai-Ju Zhou; Wei-Xiong Zhang; Ming-Liang Tong; Xiao-Ming Chen; Motohiro Nakano; Christopher C. Beedle; David N. Hendrickson","Giant Heterometallic Cu17Mn28 Cluster with Td Symmetry and High-Spin Ground State","Journal of the American Chemical Society","2007","129","","1014","1015","10.1021/ja065707l","","","0.71073","MoKα","","0.0481","0.0456","","","0.1178","0.1195","","","","","","1.087","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109046","23.504","0.003","23.504","0.003","7.7038","0.0014","90","","90","","120","","3685.7","0.9","173","2","173","2","","","","","","","","5","R -3 :H","-R 3","148","Cesium hexakis(2,6-dimethylphenylisocyanido)-niobium","","","- C54 H54 Cs N6 Nb -","- C54 H54 Cs N6 Nb -","- C162 H162 Cs3 N18 Nb3 -","3","0.166667","","Mikhail V. Barybin; William W. Brennessel; Benjamin E. Kucera; Mikhail E. Minyaev; Victor J. Sussman; Victor G. Young; John E. Ellis","Homoleptic Isocyanidemetalates of 4d- and 5d-Transition Metals: [Nb(CNXyl)6]-, [Ta(CNXyl)6]-, and Derivatives Thereof1","Journal of the American Chemical Society","2007","129","","1141","1150","10.1021/ja065964q","","","0.71073","MoKα","","0.0524","0.0314","","","0.0776","0.0847","","","","","","1.004","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109047","11.4367","0.0003","22.3813","0.0005","22.7631","0.0006","90","","91.538","0.001","90","","5824.5","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Heptakis(2,6-dimethylphenylisocyanido)-tantalum tetrafluoroborate","","","- C63 H63 B F4 N7 Ta -","- C63 H63 B F4 N7 Ta -","- C252 H252 B4 F16 N28 Ta4 -","4","1","","Mikhail V. Barybin; William W. Brennessel; Benjamin E. Kucera; Mikhail E. Minyaev; Victor J. Sussman; Victor G. Young; John E. Ellis","Homoleptic Isocyanidemetalates of 4d- and 5d-Transition Metals: [Nb(CNXyl)6]-, [Ta(CNXyl)6]-, and Derivatives Thereof1","Journal of the American Chemical Society","2007","129","","1141","1150","10.1021/ja065964q","","","0.71073","MoKα","","0.0792","0.0461","","","0.0702","0.0793","","","","","","1.01","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109048","23.49","0.016","23.49","0.016","7.772","0.005","90","0.012","90","0.012","120","0.01","3714","4","173","2","173","2","","","","","","","","5","R -3 :H","-R 3","148","Cesium hexakis(2,6-dimethylphenylisocyanido)-tantalum","","","- C54 H54 Cs N6 Ta -","- C54 H54 Cs N6 Ta -","- C162 H162 Cs3 N18 Ta3 -","3","0.166667","","Mikhail V. Barybin; William W. Brennessel; Benjamin E. Kucera; Mikhail E. Minyaev; Victor J. Sussman; Victor G. Young; John E. Ellis","Homoleptic Isocyanidemetalates of 4d- and 5d-Transition Metals: [Nb(CNXyl)6]-, [Ta(CNXyl)6]-, and Derivatives Thereof1","Journal of the American Chemical Society","2007","129","","1141","1150","10.1021/ja065964q","","","0.71073","MoKα","","0.0355","0.0282","","","0.0606","0.0631","","","","","","1.077","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109049","11.5129","0.0006","40.725","0.002","11.7507","0.0006","90","","118.769","0.001","90","","4829.4","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Iodo-hexakis(2.6-dimethylphenylisocyanido)-tantalum","","","- C54 H54 I N6 Ta -","- C54 H54 I N6 Ta -","- C216 H216 I4 N24 Ta4 -","4","1","","Mikhail V. Barybin; William W. Brennessel; Benjamin E. Kucera; Mikhail E. Minyaev; Victor J. Sussman; Victor G. Young; John E. Ellis","Homoleptic Isocyanidemetalates of 4d- and 5d-Transition Metals: [Nb(CNXyl)6]-, [Ta(CNXyl)6]-, and Derivatives Thereof1","Journal of the American Chemical Society","2007","129","","1141","1150","10.1021/ja065964q","","","0.71073","MoKα","","0.0378","0.033","","","0.069","0.0707","","","","","","1.017","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109050","9.593","0.0012","13.911","0.0017","20.342","0.002","102.126","0.002","90.323","0.002","105.605","0.002","2550.6","0.5","93","2","93","2","","","","","","","","6","P -1","-P 1","2","(BBV)3(HPTS)2.2CH3OH.2H2O","","","- C108 H102 B6 N6 O36 S6 -","- C108 H102 B6 N6 O36 S6 -","- C108 H102 B6 N6 O36 S6 -","1","0.5","","Soya Gamsey; Aaron Miller; Marilyn M. Olmstead; Christine M. Beavers; Lacie C. Hirayama; Sulolit Pradhan; Ritchie A. Wessling; Bakthan Singaram","Boronic Acid-Based Bipyridinium Salts as Tunable Receptors for Monosaccharides and α-Hydroxycarboxylates","Journal of the American Chemical Society","2007","129","","1278","1286","10.1021/ja066567i","","","0.71073","MoKα","","0.1565","0.0629","","","0.1394","0.181","","","","","","0.981","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109051","12.4366","0.0017","25.409","0.003","12.862","0.003","90","","113.313","0.012","90","","3732.6","1.2","180","","180","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C64 H70 Cl4 N12 O19 Pd2 Ru2 -","- C64 H48 Cl4 N12 O19 Pd2 Ru2 -","- C128 H96 Cl8 N24 O38 Pd4 Ru4 -","2","1","","Fabrice Pointillart; Cyrille Train; Françoise Villain; Patrick Gredin; Lise-Marie Chamoreau; Michel Gruselle; Gabriel Aullon; Santiago Alvarez; Michel Verdaguer","Six-fold Oxygen-Coordinated Triplet (S= 1) Palladium(II) Moieties Templated by Tris(bipyridine)ruthenium(II) Ions","Journal of the American Chemical Society","2007","129","","1327","1334","10.1021/ja066817v","","","0.71073","MoKα","","0.0781","0.0578","","0.0801","0.0645","0.0645","","","","","","1.077","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109052","16.302","0.003","16.465","0.003","16.551","0.002","101.751","0.011","111.493","0.009","113.567","0.011","3454.8","1.2","250","2","250","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H25 Cl6 N6 O0.5 Pd2 Ru -","- C30 H25 Cl6 N6 O0.5 Pd2 Ru -","- C120 H100 Cl24 N24 O2 Pd8 Ru4 -","4","2","","Fabrice Pointillart; Cyrille Train; Françoise Villain; Patrick Gredin; Lise-Marie Chamoreau; Michel Gruselle; Gabriel Aullon; Santiago Alvarez; Michel Verdaguer","Six-fold Oxygen-Coordinated Triplet (S= 1) Palladium(II) Moieties Templated by Tris(bipyridine)ruthenium(II) Ions","Journal of the American Chemical Society","2007","129","","1327","1334","10.1021/ja066817v","","","0.71073","MoKα","","0.1326","0.0432","","","0.0712","0.0895","","","","","","0.949","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109053","15.473","0.004","12.45","0.003","26.373","0.007","90","","100.704","0.004","90","","4992","2","174","2","174","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H72 F4 N2 O4 P2 Pd2 -","- C48 H72 F4 N2 O4 P2 Pd2 -","- C192 H288 F16 N8 O16 P8 Pd8 -","4","1","","Dmitry V. Yandulov; Ngon T. Tran","Aryl-Fluoride Reductive Elimination from Pd(II): Feasibility Assessment from Theory and Experiment","Journal of the American Chemical Society","2007","129","","1342","1358","10.1021/ja066930l","","","0.71073","MoKα","","0.0857","0.045","","","0.0901","0.1028","","","","","","1.018","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109054","10.035","0.0002","6.3816","0.0001","13.8107","0.0003","90","","108.672","0.001","90","","837.88","0.03","200","2","200","2","","","","","","","chemical synthesis","3","P 1 21 1","P 2yb","4","","(E)-5-Benzoyloxymethylenecyclohex-3-ene-1,1-dicarboxylic Acid Dimethyl Ester","","- C18 H18 O6 -","- C18 H18 O6 -","- C36 H36 O12 -","2","1","","Hahn Kim; Stephen D. Goble; Chulbom Lee","Ruthenium-Catalyzed Carboxylative Cyclization of 1,6-Diynes","Journal of the American Chemical Society","2007","129","","1030","1031","10.1021/ja067336e","","","0.71073","MoKα","","0.0546","0.0439","","0.1092","","0.0983","","","1.09","","","1.064","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109055","18.309","0.004","10.249","0.002","28.639","0.005","90","","90","","90","","5374.1","1.8","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C32 H42 O3 -","- C32 H42 O3 -","- C256 H336 O24 -","8","1","","Aaron B. Beeler; Shun Su; Chris A. Singleton; John A. Porco","Discovery of Chemical Reactions through Multidimensional Screening","Journal of the American Chemical Society","2007","129","","1413","1419","10.1021/ja0674744","","","0.71073","MoKα","","0.0811","0.0466","","","0.1079","0.1317","","","","","","1.059","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109056","7.1639","0.0014","11.318","0.002","14.06","0.003","106.268","0.01","90.217","0.011","104.607","0.011","1055.6","0.4","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C23 H28 O6 -","- C23 H28 O6 -","- C46 H56 O12 -","2","1","","Aaron B. Beeler; Shun Su; Chris A. Singleton; John A. Porco","Discovery of Chemical Reactions through Multidimensional Screening","Journal of the American Chemical Society","2007","129","","1413","1419","10.1021/ja0674744","","","0.71073","MoKα","","0.0575","0.0469","","","0.139","0.1485","","","","","","1.033","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109057","11.094","0.006","11.378","0.006","25.409","0.013","81.701","0.008","79.045","0.008","82.545","0.008","3099","3","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H33 Br I N O5 Si -","- C31 H33 Br I N O5 Si -","- C124 H132 Br4 I4 N4 O20 Si4 -","4","2","","Annaliese K. Franz; Philip D. Dreyfuss; Stuart L. Schreiber","Synthesis and Cellular Profiling of Diverse Organosilicon Small Molecules","Journal of the American Chemical Society","2007","129","","1020","1021","10.1021/ja067552n","","","0.71073","MoKα","","0.141","0.0736","","","0.1439","0.1655","","","","","","0.955","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109058","11.9583","0.0003","18.065","0.0003","21.9228","0.0005","90","","90","","90","","4735.91","0.18","143.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H28 Br N O4 -","- C22 H28 Br N O4 -","- C176 H224 Br8 N8 O32 -","8","2","","Xisheng Wang; Masanori Kitamura; Keiji Maruoka","New, Chiral Phase Transfer Catalysts for Effecting Asymmetric Conjugate Additions of α-Alkyl-α-cyanoacetates to Acetylenic Esters","Journal of the American Chemical Society","2007","129","","1038","1039","10.1021/ja068119g","","","1.54187","CuKα","","","0.0669","","","","0.1804","","","","","","1.039","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109059","5.8517","0.0003","18.9534","0.0006","20.9196","0.0006","90","","90","","90","","2320.18","0.15","143.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H28 Br N O4 -","- C22 H28 Br N O4 -","- C88 H112 Br4 N4 O16 -","4","1","","Xisheng Wang; Masanori Kitamura; Keiji Maruoka","New, Chiral Phase Transfer Catalysts for Effecting Asymmetric Conjugate Additions of α-Alkyl-α-cyanoacetates to Acetylenic Esters","Journal of the American Chemical Society","2007","129","","1038","1039","10.1021/ja068119g","","","1.54187","CuKα","","","0.061","","","","0.1652","","","","","","1.072","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109060","6.32501","0.00011","15.6014","0.0003","22.1928","0.0004","90","","90","","90","","2189.96","0.07","133.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H33 N O4 Si -","- C19 H33 N O4 Si -","- C76 H132 N4 O16 Si4 -","4","1","","Xisheng Wang; Masanori Kitamura; Keiji Maruoka","New, Chiral Phase Transfer Catalysts for Effecting Asymmetric Conjugate Additions of α-Alkyl-α-cyanoacetates to Acetylenic Esters","Journal of the American Chemical Society","2007","129","","1038","1039","10.1021/ja068119g","","","1.54187","CuKα","","","0.0494","","","","0.1438","","","","","","1.089","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109061","13.1047","0.0005","13.3397","0.0005","26.0901","0.0009","90","","90.013","0.001","90","","4560.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H73 N6 O12 Tb -","- C38 H73 N6 O12 Tb -","- C152 H292 N24 O48 Tb4 -","4","1","","Morgan L. Cable; James P. Kirby; Karn Sorasaenee; Harry B. Gray; Adrian Ponce","Bacterial Spore Detection by [Tb3+(macrocycle)(dipicolinate)] Luminescence","Journal of the American Chemical Society","2007","129","","1474","1475","10.1021/ja061831t","","","0.71073","MoKα","","0.09","0.0384","","","0.0639","0.0717","","","","","","1.077","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4109062","9.7866","0.0012","9.9982","0.0012","15.081","0.0018","78.616","0.002","79.77","0.002","71.566","0.002","1361.8","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H39 N3 O2 Ti -","- C29 H39 N3 O2 Ti -","- C58 H78 N6 O4 Ti2 -","2","1","","Denis A. Kissounko; Justin M. Hoerter; Ilia A. Guzei; Qiang Cui; Samuel H. Gellman; Shannon S. Stahl","TiIV-Mediated Reactions between Primary Amines and Secondary Carboxamides: Amidine Formation Versus Transamidation","Journal of the American Chemical Society","2007","129","","1776","1783","10.1021/ja0650293","","","0.71073","MoKα","","0.046","0.0413","","","0.113","0.1187","","","","","","1.058","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109063","10.0119","0.0013","10.7531","0.0014","19.057","0.002","78.537","0.002","84.422","0.002","74.298","0.002","1933.6","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H50 Cl4 N2 O4 Ti2 -","- C38 H50 Cl4 N2 O4 Ti2.051 -","- C76 H100 Cl8 N4 O8 Ti4.102 -","2","1","","Denis A. Kissounko; Justin M. Hoerter; Ilia A. Guzei; Qiang Cui; Samuel H. Gellman; Shannon S. Stahl","TiIV-Mediated Reactions between Primary Amines and Secondary Carboxamides: Amidine Formation Versus Transamidation","Journal of the American Chemical Society","2007","129","","1776","1783","10.1021/ja0650293","","","0.71073","MoKα","","0.121","0.1078","","","0.3241","0.3603","","","","","","1.017","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109064","16.214","0.005","8.651","0.003","21.519","0.007","90","","107.234","0.005","90","","2882.9","1.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H39 N3 O3 Ti -","- C34 H39 N3 O3 Ti -","- C136 H156 N12 O12 Ti4 -","4","1","","Denis A. Kissounko; Justin M. Hoerter; Ilia A. Guzei; Qiang Cui; Samuel H. Gellman; Shannon S. Stahl","TiIV-Mediated Reactions between Primary Amines and Secondary Carboxamides: Amidine Formation Versus Transamidation","Journal of the American Chemical Society","2007","129","","1776","1783","10.1021/ja0650293","","","0.71073","MoKα","","0.1311","0.0772","","","0.173","0.1854","","","","","","1.001","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109065","11.123","0.005","12.226","0.005","16.556","0.009","90","","90","","90","","2251.4","1.8","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H24 N2 O2 S -","- C27 H24 N2 O2 S -","- C108 H96 N8 O8 S4 -","4","1","","Jorge Esquivias; Ramón Gómez Arrayás; Juan C. Carretero","Catalytic Asymmetric Inverse-Electron-Demand Diels-Alder Reaction of N-Sulfonyl-1-Aza-1,3-Dienes","Journal of the American Chemical Society","2007","129","","1480","1481","10.1021/ja0658766","","","0.71073","MoKα","","0.1311","0.0762","","","0.1738","0.2115","","","","","","1.022","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109066","9.4345","0.0002","11.1796","0.0003","21.8461","0.0006","90","","90","","90","","2304.19","0.1","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H23 F3 N2 O3 S -","- C25 H23 F3 N2 O3 S -","- C100 H92 F12 N8 O12 S4 -","4","1","","Jorge Esquivias; Ramón Gómez Arrayás; Juan C. Carretero","Catalytic Asymmetric Inverse-Electron-Demand Diels-Alder Reaction of N-Sulfonyl-1-Aza-1,3-Dienes","Journal of the American Chemical Society","2007","129","","1480","1481","10.1021/ja0658766","","","1.54178","CuKα","","0.0305","0.0296","","","0.0763","0.0771","","","","","","1.037","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109067","20.342","0.0001","24.448","0.0002","35.36","0.0003","90","","90.13","","90","","17585.2","0.2","150","2","150","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","Cy-[H12]+","","","- C178.5 H265.5 B F24 P6 Rh6 -","- C178.5 H265.5 B F24 P6 Rh6 -","- C714 H1062 B4 F96 P24 Rh24 -","4","1","","Simon K. Brayshaw; Andrew Harrison; J. Scott McIndoe; Frank Marken; Paul R. Raithby; John E. Warren; Andrew S. Weller","Sequential Reduction of High Hydride Count Octahedral Rhodium Clusters [Rh6(PR3)6H12][BArF4]2: Redox-Switchable Hydrogen Storage","Journal of the American Chemical Society","2007","129","","1793","1804","10.1021/ja066940m","","","0.71073","MoKα","","0.1","0.0408","","","0.0874","0.1065","","","","","","1.019","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109068","13.4673","0.0005","13.4673","0.0005","33.922","0.002","90","","90","","120","","5328.1","0.4","150","2","150","2","","","","","","","","4","R -3 :H","-R 3","148","iPr-[H12]","","","- C54 H138 P6 Rh6 -","- C54 H138 P6 Rh6 -","- C162 H414 P18 Rh18 -","3","0.166667","","Simon K. Brayshaw; Andrew Harrison; J. Scott McIndoe; Frank Marken; Paul R. Raithby; John E. Warren; Andrew S. Weller","Sequential Reduction of High Hydride Count Octahedral Rhodium Clusters [Rh6(PR3)6H12][BArF4]2: Redox-Switchable Hydrogen Storage","Journal of the American Chemical Society","2007","129","","1793","1804","10.1021/ja066940m","","","0.846","Synchrotron","","0.0185","0.0179","","","0.0454","0.0459","","","","","","1.052","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109069","12.7316","0.0014","14.217","0.0016","14.8102","0.0016","90","","111.394","0.002","90","","2496","0.5","143","2","143","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H48 Cl4 Cu2 N8 O6 -","- C50 H48 Cl4 Cu2 N8 O6 -","- C100 H96 Cl8 Cu4 N16 O12 -","2","0.5","","Yu-Bin Dong; Qiang Zhang; Li-Li Liu; Jian-Ping Ma; Bo Tang; Ru-Qi Huang","[Cu(C24H22N4O3)].CH2Cl2: A Discrete Breathing Metallamacrocycle Showing Selective and Reversible Guest Adsorption with Retention of Single Crystallinity","Journal of the American Chemical Society","2007","129","","1514","1515","10.1021/ja067384z","","","0.71073","MoKα","","0.0738","0.0676","","","0.1969","0.2025","","","","","","1.086","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109070","12.7084","0.0014","14.2054","0.0015","14.8522","0.0016","90","","111.427","0.001","90","","2495.9","0.5","143","2","143","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H48 Cl4 Cu2 N8 O6 -","- C50 H48 Cl4 Cu2 N8 O6 -","- C100 H96 Cl8 Cu4 N16 O12 -","2","0.5","","Yu-Bin Dong; Qiang Zhang; Li-Li Liu; Jian-Ping Ma; Bo Tang; Ru-Qi Huang","[Cu(C24H22N4O3)].CH2Cl2: A Discrete Breathing Metallamacrocycle Showing Selective and Reversible Guest Adsorption with Retention of Single Crystallinity","Journal of the American Chemical Society","2007","129","","1514","1515","10.1021/ja067384z","","","0.71073","MoKα","","0.0621","0.0551","","","0.1553","0.1611","","","","","","1.061","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109071","12.884","0.004","14.424","0.004","14.906","0.004","90","","112.325","0.004","90","","2562.5","1.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H48 Cl4 Cu2 N8 O6 -","- C50 H48 Cl4 Cu2 N8 O6 -","- C100 H96 Cl8 Cu4 N16 O12 -","2","0.5","","Yu-Bin Dong; Qiang Zhang; Li-Li Liu; Jian-Ping Ma; Bo Tang; Ru-Qi Huang","[Cu(C24H22N4O3)].CH2Cl2: A Discrete Breathing Metallamacrocycle Showing Selective and Reversible Guest Adsorption with Retention of Single Crystallinity","Journal of the American Chemical Society","2007","129","","1514","1515","10.1021/ja067384z","","","0.71073","MoKα","","0.1272","0.0946","","","0.2216","0.2347","","","","","","1.13","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109072","12.8528","0.0015","14.0181","0.0016","14.4074","0.0017","90","","110.802","0.002","90","","2426.6","0.5","143","2","143","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H44 Cl2 Cu2 N8 O6 -","- C49 H44 Cl2 Cu2 N8 O6 -","- C98 H88 Cl4 Cu4 N16 O12 -","2","0.5","","Yu-Bin Dong; Qiang Zhang; Li-Li Liu; Jian-Ping Ma; Bo Tang; Ru-Qi Huang","[Cu(C24H22N4O3)].CH2Cl2: A Discrete Breathing Metallamacrocycle Showing Selective and Reversible Guest Adsorption with Retention of Single Crystallinity","Journal of the American Chemical Society","2007","129","","1514","1515","10.1021/ja067384z","","","0.71073","MoKα","","0.0554","0.0464","","","0.1181","0.1247","","","","","","1.034","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109073","12.8545","0.0018","14.052","0.002","14.44","0.002","90","","110.881","0.002","90","","2437","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H44 Cl2 Cu2 N8 O6 -","- C49 H44 Cl2 Cu2 N8 O6 -","- C98 H88 Cl4 Cu4 N16 O12 -","2","0.5","","Yu-Bin Dong; Qiang Zhang; Li-Li Liu; Jian-Ping Ma; Bo Tang; Ru-Qi Huang","[Cu(C24H22N4O3)].CH2Cl2: A Discrete Breathing Metallamacrocycle Showing Selective and Reversible Guest Adsorption with Retention of Single Crystallinity","Journal of the American Chemical Society","2007","129","","1514","1515","10.1021/ja067384z","","","0.71073","MoKα","","0.0694","0.0545","","","0.1474","0.1594","","","","","","1.032","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109074","12.89","0.002","14.216","0.003","14.559","0.003","90","","111.24","0.002","90","","2486.6","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H44 Cl2 Cu2 N8 O6 -","- C49 H44 Cl2 Cu2 N8 O6 -","- C98 H88 Cl4 Cu4 N16 O12 -","2","0.5","","Yu-Bin Dong; Qiang Zhang; Li-Li Liu; Jian-Ping Ma; Bo Tang; Ru-Qi Huang","[Cu(C24H22N4O3)].CH2Cl2: A Discrete Breathing Metallamacrocycle Showing Selective and Reversible Guest Adsorption with Retention of Single Crystallinity","Journal of the American Chemical Society","2007","129","","1514","1515","10.1021/ja067384z","","","0.71073","MoKα","","0.0879","0.0658","","","0.1881","0.2","","","","","","1.049","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109075","12.932","0.01","14.202","0.011","14.499","0.011","90","","111.348","0.011","90","","2480","3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H44 Cl2 Cu2 N8 O6 -","- C49 H44 Cl2 Cu2 N8 O6 -","- C98 H88 Cl4 Cu4 N16 O12 -","2","0.5","","Yu-Bin Dong; Qiang Zhang; Li-Li Liu; Jian-Ping Ma; Bo Tang; Ru-Qi Huang","[Cu(C24H22N4O3)].CH2Cl2: A Discrete Breathing Metallamacrocycle Showing Selective and Reversible Guest Adsorption with Retention of Single Crystallinity","Journal of the American Chemical Society","2007","129","","1514","1515","10.1021/ja067384z","","","0.71073","MoKα","","0.0915","0.064","","","0.1651","0.184","","","","","","1.03","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109076","13.045","0.002","14.52","0.002","14.917","0.002","90","","112.884","0.002","90","","2603.1","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H46 Cl6 Cu2 N8 O6 -","- C50 H46 Cl6 Cu2 N8 O6 -","- C100 H92 Cl12 Cu4 N16 O12 -","2","0.5","","Yu-Bin Dong; Qiang Zhang; Li-Li Liu; Jian-Ping Ma; Bo Tang; Ru-Qi Huang","[Cu(C24H22N4O3)].CH2Cl2: A Discrete Breathing Metallamacrocycle Showing Selective and Reversible Guest Adsorption with Retention of Single Crystallinity","Journal of the American Chemical Society","2007","129","","1514","1515","10.1021/ja067384z","","","0.71073","MoKα","","0.1076","0.0704","","","0.1911","0.2126","","","","","","0.977","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109077","13.002","0.005","14.452","0.005","14.878","0.006","90","","112.47","0.005","90","","2583.4","1.7","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H46 Cl6 Cu2 N8 O6 -","- C50 H46 Cl6 Cu2 N8 O6 -","- C100 H92 Cl12 Cu4 N16 O12 -","2","0.5","","Yu-Bin Dong; Qiang Zhang; Li-Li Liu; Jian-Ping Ma; Bo Tang; Ru-Qi Huang","[Cu(C24H22N4O3)].CH2Cl2: A Discrete Breathing Metallamacrocycle Showing Selective and Reversible Guest Adsorption with Retention of Single Crystallinity","Journal of the American Chemical Society","2007","129","","1514","1515","10.1021/ja067384z","","","0.71073","MoKα","","0.1587","0.1317","","","0.344","0.3547","","","","","","1.151","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109078","13.0155","0.0018","14.487","0.002","14.856","0.002","90","","112.644","0.002","90","","2585.3","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H46 Cl6 Cu2 N8 O6 -","- C50 H46 Cl6 Cu2 N8 O6 -","- C100 H92 Cl12 Cu4 N16 O12 -","2","0.5","","Yu-Bin Dong; Qiang Zhang; Li-Li Liu; Jian-Ping Ma; Bo Tang; Ru-Qi Huang","[Cu(C24H22N4O3)].CH2Cl2: A Discrete Breathing Metallamacrocycle Showing Selective and Reversible Guest Adsorption with Retention of Single Crystallinity","Journal of the American Chemical Society","2007","129","","1514","1515","10.1021/ja067384z","","","0.71073","MoKα","","0.1084","0.091","","","0.2859","0.3182","","","","","","1.079","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109079","12.955","0.005","14.405","0.005","14.804","0.006","90","","112.447","0.005","90","","2553.4","1.7","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H46 Cl6 Cu2 N8 O6 -","- C50 H46 Cl6 Cu2 N8 O6 -","- C100 H92 Cl12 Cu4 N16 O12 -","2","0.5","","Yu-Bin Dong; Qiang Zhang; Li-Li Liu; Jian-Ping Ma; Bo Tang; Ru-Qi Huang","[Cu(C24H22N4O3)].CH2Cl2: A Discrete Breathing Metallamacrocycle Showing Selective and Reversible Guest Adsorption with Retention of Single Crystallinity","Journal of the American Chemical Society","2007","129","","1514","1515","10.1021/ja067384z","","","0.71073","MoKα","","0.1681","0.1334","","","0.3518","0.3645","","","","","","1.132","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109080","8.7737","0.0005","8.8872","0.0005","20.9878","0.0011","90","","90","","90","","1636.49","0.16","193","","193","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","[9]metacyclophane","","- C18 H24 O5 -","- C18 H24 O5 -","- C72 H96 O20 -","4","1","","Ken Tanaka; Hiromi Sagae; Kazuki Toyoda; Keiichi Noguchi; Masao Hirano","Enantioselective Synthesis of Planar-Chiral Metacyclophanes through Rhodium-Catalyzed Alkyne Cyclotrimerization","Journal of the American Chemical Society","2007","129","","1522","1523","10.1021/ja0679127","","","1.54187","CuKα","","0.0358","0.0322","","","0.0806","0.0839","","","","","","1.105","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109081","36.257","0.007","8.2518","0.0017","21.011","0.004","90","","117.31","0.03","90","","5586","2","158","2","158","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C30 H38 O7 -","- C29 H38 O7 -","- C232 H304 O56 -","8","2","","K. C. Nicolaou; Andrea L. Nold; Robert R. Milburn; Corinna S. Schindler; Kevin P. Cole; Junichiro Yamaguchi","Total Synthesis of Marinomycins A-C and of Their Monomeric Counterparts Monomarinomycin A and iso-Monomarinomycin A","Journal of the American Chemical Society","2007","129","","1760","1768","10.1021/ja068053p","","","0.71073","MoKα","","0.1132","0.0669","","","0.1263","0.1584","","","","","","1.039","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109082","10.419","0.005","7.186","0.003","12.309","0.006","90","","91.26","0.02","90","","921.4","0.7","123.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H12 Br4 O2 -","- C20 H12 Br4 O2 -","- C40 H24 Br8 O4 -","2","1","","Takahiro Nishimura; Takahiro Kawamoto; Keigo Sasaki; Eiji Tsurumaki; Tamio Hayashi","Rhodium-Catalyzed Asymmetric Cyclodimerization of Oxa- and Azabicyclic Alkenes","Journal of the American Chemical Society","2007","129","","1492","1493","10.1021/ja068488c","","","0.71075","MoKα","","","0.0471","","","","0.0611","","","","","","1.341","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109083","12.21","0.01","4.332","0.003","16.228","0.012","90","","100.52","0.03","90","","843.9","1.1","123.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H16 Br2 O5 -","- C18 H16 Br2 O5 -","- C36 H32 Br4 O10 -","2","1","","Takahiro Nishimura; Takahiro Kawamoto; Keigo Sasaki; Eiji Tsurumaki; Tamio Hayashi","Rhodium-Catalyzed Asymmetric Cyclodimerization of Oxa- and Azabicyclic Alkenes","Journal of the American Chemical Society","2007","129","","1492","1493","10.1021/ja068488c","","","0.71075","MoKα","","","0.0664","","","","0.0877","","","","","","1.06","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109084","11.572","0.002","12.151","0.002","19.709","0.004","90","","90","","90","","2771.3","0.9","180","2","180","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H53 Al Li N O -","- C25 H53 Al Li N O -","- C100 H212 Al4 Li4 N4 O4 -","4","1","","Hiroshi Naka; Masanobu Uchiyama; Yotaro Matsumoto; Andrew E. H. Wheatley; Mary McPartlin; James V. Morey; Yoshinori Kondo","An Aluminum Ate Base: Its Design, Structure, Function, and Reaction Mechanism","Journal of the American Chemical Society","2007","129","","1921","1930","10.1021/ja064601n","","","0.71073","MoKα","","0.0731","0.0494","","","0.1092","0.1208","","","","","","1.032","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109085","38.469","0.008","9.4325","0.0019","16.561","0.003","90","","114.18","0.03","90","","5482","2","180","2","180","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C25 H46 Al Li N2 O -","- C25 H46 Al Li N2 O -","- C200 H368 Al8 Li8 N16 O8 -","8","2","","Hiroshi Naka; Masanobu Uchiyama; Yotaro Matsumoto; Andrew E. H. Wheatley; Mary McPartlin; James V. Morey; Yoshinori Kondo","An Aluminum Ate Base: Its Design, Structure, Function, and Reaction Mechanism","Journal of the American Chemical Society","2007","129","","1921","1930","10.1021/ja064601n","","","0.71073","MoKα","","0.0639","0.0467","","","0.095","0.1038","","","","","","1.08","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109086","7.912","0.004","15.001","0.008","36.97","0.02","90","","90","","90","","4388","4","180","2","180","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H27 Al Li N -","- C12 H27 Al Li N -","- C144 H324 Al12 Li12 N12 -","12","3","","Hiroshi Naka; Masanobu Uchiyama; Yotaro Matsumoto; Andrew E. H. Wheatley; Mary McPartlin; James V. Morey; Yoshinori Kondo","An Aluminum Ate Base: Its Design, Structure, Function, and Reaction Mechanism","Journal of the American Chemical Society","2007","129","","1921","1930","10.1021/ja064601n","","","0.71073","MoKα","","0.0806","0.0765","","","0.1985","0.2052","","","","","","1.038","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109087","8.9858","0.0018","22.608","0.005","9.4897","0.0019","90","","102.64","0.03","90","","1881.1","0.7","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H35 Al Li N O -","- C16 H35 Al Li N O -","- C64 H140 Al4 Li4 N4 O4 -","4","1","","Hiroshi Naka; Masanobu Uchiyama; Yotaro Matsumoto; Andrew E. H. Wheatley; Mary McPartlin; James V. Morey; Yoshinori Kondo","An Aluminum Ate Base: Its Design, Structure, Function, and Reaction Mechanism","Journal of the American Chemical Society","2007","129","","1921","1930","10.1021/ja064601n","","","0.71073","MoKα","","0.0998","0.0603","","","0.2042","0.247","","","","","","0.906","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109088","12.853","0.004","12.853","0.004","23.193","0.014","90","","90","","90","","3831","3","193","2","193","2","","","","","","","","8","P -4 21 c","P -4 2n","114","","","","- C72 H84 Co8 F6 K N12 O2 P -","- C72 H84 Co8 F6 K N12 O2 P -","- C144 H168 Co16 F12 K2 N24 O4 P2 -","2","0.25","","Julie L. Boyer; Maya Ramesh; Haijun Yao; Thomas B. Rauchfuss; Scott R. Wilson","Redox-Switched Complexation/Decomplexation of K+ and Cs+ by Molecular Cyanometalate Boxes","Journal of the American Chemical Society","2007","129","","1931","1936","10.1021/ja0646545","","","0.71073","MoKα","","0.0469","0.0332","","","0.0618","0.0656","","","","","","1.013","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109089","10.7603","0.0003","16.7937","0.0004","20.2847","0.0005","90","","90","","90","","3665.55","0.16","183.1","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C37 H56 Al Cl N2 O2 -","- C37 H47 Al Cl N2 O2 -","- C148 H188 Al4 Cl4 N8 O8 -","4","1","","Bunnai Saito; Hiromichi Egami; Tsutomu Katsuki","Synthesis of an Optically Active Al(salalen) Complex and Its Application to Catalytic Hydrophosphonylation of Aldehydes and Aldimines","Journal of the American Chemical Society","2007","129","","1978","1986","10.1021/ja0651005","","","0.71069","MoKα","","","0.0672","","","","0.1756","","","","","","0.997","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109090","9.7268","0.0017","16.328","0.003","24.538","0.005","90","","101.171","0.003","90","","3823.3","1.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H46 N2 O P2 Ru -","- C46 H46 N2 O P2 Ru -","- C184 H184 N8 O4 P8 Ru4 -","4","1","","Suzanne Burling; Belinda M. Paine; Devendrababu Nama; Victoria S. Brown; Mary F. Mahon; Timothy J. Prior; Paul S. Pregosin; Michael K. Whittlesey; Jonathan M. J. Williams","CH Activation Reactions of Ruthenium N-Heterocyclic Carbene Complexes: Application in a Catalytic Tandem Reaction Involving CC Bond Formation from Alcohols","Journal of the American Chemical Society","2007","129","","1987","1995","10.1021/ja065790c","","","0.846","Synchrotron","","0.093","0.0684","","","0.1638","0.1826","","","","","","1.068","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109091","9.516","0.0001","33.344","0.0003","13.457","0.0001","90","","110.251","0.001","90","","4005.98","0.07","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H48 N2 O P2 Ru -","- C46 H48 N2 O P2 Ru -","- C184 H192 N8 O4 P8 Ru4 -","4","1","","Suzanne Burling; Belinda M. Paine; Devendrababu Nama; Victoria S. Brown; Mary F. Mahon; Timothy J. Prior; Paul S. Pregosin; Michael K. Whittlesey; Jonathan M. J. Williams","CH Activation Reactions of Ruthenium N-Heterocyclic Carbene Complexes: Application in a Catalytic Tandem Reaction Involving CC Bond Formation from Alcohols","Journal of the American Chemical Society","2007","129","","1987","1995","10.1021/ja065790c","","","0.71073","MoKα","","0.0398","0.0316","","","0.0683","0.0709","","","","","","1.072","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109092","24.208","0.0003","9.081","0.0001","19.636","0.0003","90","","114.159","0.001","90","","3938.56","0.09","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C46 H46 N2 O P2 Ru -","- C46 H47 N2 O P2 Ru -","- C184 H188 N8 O4 P8 Ru4 -","4","1","","Suzanne Burling; Belinda M. Paine; Devendrababu Nama; Victoria S. Brown; Mary F. Mahon; Timothy J. Prior; Paul S. Pregosin; Michael K. Whittlesey; Jonathan M. J. Williams","CH Activation Reactions of Ruthenium N-Heterocyclic Carbene Complexes: Application in a Catalytic Tandem Reaction Involving CC Bond Formation from Alcohols","Journal of the American Chemical Society","2007","129","","1987","1995","10.1021/ja065790c","","","0.71073","MoKα","","0.0455","0.0368","","","0.0851","0.0898","","","","","","1.051","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109093","10.486","0.0001","22.622","0.0003","19.816","0.0003","90","","92.417","0.001","90","","4696.46","0.1","396","2","396","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C56 H52 N2 O P2 Ru -","- C56 H52 N2 O P2 Ru -","- C224 H208 N8 O4 P8 Ru4 -","4","2","","Suzanne Burling; Belinda M. Paine; Devendrababu Nama; Victoria S. Brown; Mary F. Mahon; Timothy J. Prior; Paul S. Pregosin; Michael K. Whittlesey; Jonathan M. J. Williams","CH Activation Reactions of Ruthenium N-Heterocyclic Carbene Complexes: Application in a Catalytic Tandem Reaction Involving CC Bond Formation from Alcohols","Journal of the American Chemical Society","2007","129","","1987","1995","10.1021/ja065790c","","","0.71073","MoKα","","0.075","0.0421","","","0.0742","0.082","","","","","","1.014","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109094","17.5945","0.0008","8.6401","0.0004","17.4677","0.0008","90","","94.092","0.001","90","","2648.6","0.2","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H42 O P Rh Si -","- C25 H42 O P Rh Si -","- C100 H168 O4 P4 Rh4 Si4 -","4","1","","Amy H. Roy; Christian P. Lenges; Maurice Brookhart","Scope and Mechanism of the Intermolecular Addition of Aromatic Aldehydes to Olefins Catalyzed by Rh(I) Olefin Complexes","Journal of the American Chemical Society","2007","129","","2082","2093","10.1021/ja066509x","","","0.71073","MolybdenumKα","","0.021","0.017","","0.022","0.022","","","","","","","1.33","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109095","10.05","0.002","18.319","0.004","21.396","0.005","76.932","0.004","80.904","0.004","78.553","0.004","3734.3","1.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C130 H172 N8 O6 P8 Pt4 -","- C130 H170 N8 O14 P8 Pt4 -","- C130 H170 N8 O14 P8 Pt4 -","1","0.5","","Hai-Bo Yang; Adam M. Hawkridge; Songping D. Huang; Neeladri Das; Scott D. Bunge; David C. Muddiman; Peter J. Stang","Coordination-Driven Self-Assembly of Metallodendrimers Possessing Well-Defined and Controllable Cavities as Cores","Journal of the American Chemical Society","2007","129","","2120","2129","10.1021/ja066804h","","","0.71073","MoKα","","0.1065","0.0722","","","0.2095","0.243","","","","","","1.058","","","","has coordinates,has disorder","178836","2020-10-21","18:00:00",""
"4109096","14.111","0.003","14.348","0.003","26.476","0.005","79.705","0.003","78.901","0.003","76.468","0.003","5063.7","1.8","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C158 H196 Cl2 N8 O10 P8 Pt4 -","- C164 H174 Cl8 N4 O20 P8 Pt4 -","- C164 H174 Cl8 N4 O20 P8 Pt4 -","1","0.5","","Hai-Bo Yang; Adam M. Hawkridge; Songping D. Huang; Neeladri Das; Scott D. Bunge; David C. Muddiman; Peter J. Stang","Coordination-Driven Self-Assembly of Metallodendrimers Possessing Well-Defined and Controllable Cavities as Cores","Journal of the American Chemical Society","2007","129","","2120","2129","10.1021/ja066804h","","","0.71073","MoKα","","0.1652","0.0805","","","0.2211","0.2695","","","","","","1.034","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109097","15.182","0.001","19.779","0.002","23.308","0.002","90","","90","","90","","6999","1","296.1","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C78 H76 Cl6 O2 P3 Rh3 -","- C78 H76 Cl6 O2 P3 Rh3 -","- C312 H304 Cl24 O8 P12 Rh12 -","4","1","","Wei-Liang Duan; Hiroshi Iwamura; Ryo Shintani; Tamio Hayashi","Chiral Phosphine-Olefin Ligands in the Rhodium-Catalyzed Asymmetric 1,4-Addition Reactions","Journal of the American Chemical Society","2007","129","","2130","2138","10.1021/ja0671013","","","0.7107","MoKα","","","0.029","","","","0.036","","","","","","1.01","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109098","46.636","0.005","46.636","0.005","46.636","0.005","90","","90","","90","","101429","19","250","2","250","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","PCN-6'","","","- C32 H16 Cu2 N4 O10 -","- C32 H16 Cu2 N4 O10 -","- C768 H384 Cu48 N96 O240 -","24","0.125","","Shengqian Ma; Daofeng Sun; Michael Ambrogio; Jacqueline A. Fillinger; Sean Parkin; Hong-Cai Zhou","Framework-Catenation Isomerism in Metal-Organic Frameworks and Its Impact on Hydrogen Uptake","Journal of the American Chemical Society","2007","129","","1858","1859","10.1021/ja067435s","","","1.54178","CuKα","","0.0886","0.065","","","0.1605","0.1721","","","","","","1.153","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109099","37.291","0.002","37.291","0.002","92.159","0.003","90","","90","","120","","110988","9","258","2","258","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","MOF-HTB","","","- C108 H48 Cu6 N28 O30 -","- C109.5 H48 Cu6 N28 O30 -","- C1314 H576 Cu72 N336 O360 -","12","0.333333","","Shengqian Ma; Daofeng Sun; Michael Ambrogio; Jacqueline A. Fillinger; Sean Parkin; Hong-Cai Zhou","Framework-Catenation Isomerism in Metal-Organic Frameworks and Its Impact on Hydrogen Uptake","Journal of the American Chemical Society","2007","129","","1858","1859","10.1021/ja067435s","","","1.54178","CuKα","","0.1238","0.108","","","0.3272","0.3451","","","","","","1.637","","","","has coordinates","178836","2020-10-21","18:00:00",""
"4109100","52.993","0.006","52.993","0.006","52.993","0.006","90","","90","","90","","148818","3","295","2","295","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","MOF-HTB'","","","- C9 H4 Cu0.5 N2.33 O2.5 -","- C9 H4 Cu0.5 N2.33333 O2.5 -","- C864 H384 Cu48 N224 O240 -","96","0.5","","Shengqian Ma; Daofeng Sun; Michael Ambrogio; Jacqueline A. Fillinger; Sean Parkin; Hong-Cai Zhou","Framework-Catenation Isomerism in Metal-Organic Frameworks and Its Impact on Hydrogen Uptake","Journal of the American Chemical Society","2007","129","","1858","1859","10.1021/ja067435s","","","1.54178","CuKα","","0.0659","0.0417","","","0.0971","0.1042","","","","","","0.951","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109101","11.8357","0.0003","18.8226","0.0005","18.9559","0.0006","90","","95.102","0.001","90","","4206.2","0.2","198","2","198","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H58 P4 Si4 Ti -","- C36 H58 P4 Si4 Ti -","- C144 H232 P16 Si16 Ti4 -","4","1","","Michael D. Spencer; Quinetta D. Shelby; Gregory S. Girolami","Titanium-Catalyzed Dehydrocoupling of Silanes: Direct Conversion of Primary Monosilanes to Titanium(0) Oligosilane Complexes with Agostic α-Si-H...Ti Interactions","Journal of the American Chemical Society","2007","129","","1860","1861","10.1021/ja067503a","","","0.71073","MoKα","","0.1291","0.0463","","0.0779","","0.067","","","0.755","","","1.002","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109102","12.1252","0.0018","18.51","0.003","14.973","0.002","90","","107.956","0.003","90","","3196.8","0.8","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H29 B F15 P -","- C30 H29 B F15 P -","- C120 H116 B4 F60 P4 -","4","1","","Gregory C. Welch; Douglas W. Stephan","Facile Heterolytic Cleavage of Dihydrogen by Phosphines and Boranes","Journal of the American Chemical Society","2007","129","","1880","1881","10.1021/ja067961j","","","0.71073","MoKα","","0.2408","0.1254","","","0.3352","0.4022","","","","","","1.069","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109103","13.611","0.0011","8.4257","0.0004","15.6598","0.0012","90","","98.437","0.003","90","","1776.5","0.2","120","2","120","2","","","","","","","Roberto Quesada","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 N2 O4 -","- C18 H28 N2 O4 -","- C72 H112 N8 O16 -","4","1","","Paul V. Santacroce; Jeffery T. Davis; Mark E. Light; Philip A. Gale; José Carlos Iglesias-Sánchez; Pilar Prados; Roberto Quesada","Conformational Control of Transmembrane Cl-Transport","Journal of the American Chemical Society","2007","129","","1886","1887","10.1021/ja068067v","","","0.71073","MoKα","","0.1433","0.0662","","","0.1399","0.1674","","","","","","1.028","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109104","14.7447","0.0006","21.143","0.0009","15.954","0.0007","90","","101.983","0.002","90","","4865.2","0.4","120","2","120","2","","","","","","","Roberto Quesada","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H24 N2 O4 -","- C16 H24 N2 O4 -","- C192 H288 N24 O48 -","12","3","","Paul V. Santacroce; Jeffery T. Davis; Mark E. Light; Philip A. Gale; José Carlos Iglesias-Sánchez; Pilar Prados; Roberto Quesada","Conformational Control of Transmembrane Cl-Transport","Journal of the American Chemical Society","2007","129","","1886","1887","10.1021/ja068067v","","","0.71073","MoKα","","0.259","0.0793","","","0.1765","0.2418","","","","","","0.926","","","","has coordinates,has disorder","178837","2020-10-21","18:00:00",""
"4109105","37.074","0.002","9.0221","0.0005","9.3593","0.0005","90","","90","","90","","3130.5","0.3","120","","120","","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C33 H29 N9 O4 -","- C33 H29 N9 O4 -","- C132 H116 N36 O16 -","4","0.5","","Iwao Okamoto; Mayumi Nabeta; Yasuko Hayakawa; Nobuyoshi Morita; Tetsuya Takeya; Hyuma Masu; Isao Azumaya; Osamu Tamura","Acid-Induced Molecular Folding and Unfolding of N-Methyl Aromatic Amide Bearing 2,6-Disubstituted Pyridines","Journal of the American Chemical Society","2007","129","","1892","1893","10.1021/ja0682879","","","0.71073","MoKα","","0.095","0.0531","","","0.099","0.1133","","","","","","0.937","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109106","26.4","0.02","9.105","0.008","16.398","0.015","90","","115.715","0.01","90","","3551","5","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H31 Cl2 N9 O12 -","- C33 H31 Cl2 N9 O12 -","- C132 H124 Cl8 N36 O48 -","4","0.5","","Iwao Okamoto; Mayumi Nabeta; Yasuko Hayakawa; Nobuyoshi Morita; Tetsuya Takeya; Hyuma Masu; Isao Azumaya; Osamu Tamura","Acid-Induced Molecular Folding and Unfolding of N-Methyl Aromatic Amide Bearing 2,6-Disubstituted Pyridines","Journal of the American Chemical Society","2007","129","","1892","1893","10.1021/ja0682879","","","0.71073","MoKα","","0.1766","0.1345","","","0.347","0.3668","","","","","","1.093","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109107","11.9275","0.0003","6.0749","0.0002","34.473","0.0008","90","","93.038","0.002","90","","2494.35","0.12","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H33 B O8 -","- C25 H33 B O8 -","- C100 H132 B4 O32 -","4","1","","Juan Marco-Martínez; Verónica López-Carrillo; Elena Buñuel; Raquel Simancas; Diego J. Cárdenas","Pd-Catalyzed Borylative Cyclization of 1,6-Enynes","Journal of the American Chemical Society","2007","129","","1874","1875","10.1021/ja0685598","","","1.54178","CuKα","","0.0748","0.0444","","","0.0997","0.1146","","","","","","0.983","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109108","10.693","0.002","17.341","0.004","18.915","0.004","90","","106.35","0.03","90","","3365.5","1.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27.5 H59 B O2 P3 Rh -","- C27.5 H59 B O2 P3 Rh -","- C110 H236 B4 O8 P12 Rh4 -","4","1","","Pinjing Zhao; Christopher D. Incarvito; John F. Hartwig","Directly Observed Transmetalation from Boron to Rhodium. β-Aryl Elimination from Rh(I) Arylboronates and Diarylborinates","Journal of the American Chemical Society","2007","129","","1876","1877","10.1021/ja068587q","","","0.71073","MoKα","","0.0693","0.0388","","","0.0868","0.096","","","","","","1.046","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109109","13.5894","0.0003","12.7606","0.0004","18.803","0.0005","90","","117.84","0.0017","90","","2883.21","0.14","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H31 Cl4 Fe N4 O5 -","- C25 H31 Cl4 Fe N4 O5 -","- C100 H124 Cl16 Fe4 N16 O20 -","4","1","","Pieter C. A. Bruijnincx; Martin Lutz; Anthony L. Spek; Wilfred R. Hagen; Bert M. Weckhuysen; Gerard van Koten; Robertus J. M. Klein Gebbink","Modeling the 2-His-1-Carboxylate Facial Triad: Iron-Catecholato Complexes as Structural and Functional Models of the Extradiol Cleaving Dioxygenases","Journal of the American Chemical Society","2007","129","","2275","2286","10.1021/ja064816x","","","0.71073","MoKα","","0.0637","0.0375","","","0.0832","0.0947","","","","","","1.088","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109110","14.1135","0.0004","18.7149","0.0006","14.8501","0.0004","90","","97.8247","0.001","90","","3885.9","0.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Fe(TPFP)(NO)(1-MeIm)]","","","- C48 H30 F4 Fe N7 O -","- C48 H30 F4 Fe N7 O -","- C192 H120 F16 Fe4 N28 O4 -","4","1","","Nathan J. Silvernail; Alexander Barabanschikov; Jeffrey W. Pavlik; Bruce C. Noll; Jiyong Zhao; E. Ercan Alp; Wolfgang Sturhahn; J. Timothy Sage; W. Robert Scheidt","Interplay of Structure and Vibrational Dynamics in Six-Coordinate Heme Nitrosyls","Journal of the American Chemical Society","2007","129","","2200","2201","10.1021/ja066869k","","","0.71073","MoKα","","0.052","0.0383","","","0.0983","0.1077","","","","","","1.04","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109111","11.4205","0.0002","12.1603","0.0002","14.3296","0.0002","92.789","0.001","102.651","0.001","99.585","0.001","1907.12","0.05","100","2","100","2","","","","","","","","6","P -1","-P 1","2","[Fe(TPFP)(NO)(1-MeIm)]","","","- C48 H30 F4 Fe N7 O -","- C48 H30 F4 Fe N7 O -","- C96 H60 F8 Fe2 N14 O2 -","2","1","","Nathan J. Silvernail; Alexander Barabanschikov; Jeffrey W. Pavlik; Bruce C. Noll; Jiyong Zhao; E. Ercan Alp; Wolfgang Sturhahn; J. Timothy Sage; W. Robert Scheidt","Interplay of Structure and Vibrational Dynamics in Six-Coordinate Heme Nitrosyls","Journal of the American Chemical Society","2007","129","","2200","2201","10.1021/ja066869k","","","0.71073","MoKα","","0.0432","0.0346","","","0.0936","0.0995","","","","","","1.044","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109112","27.687","0.013","15.086","0.005","18.057","0.007","90","","118.63","0.014","90","","6620","5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C29 H45 Cl Cr N O -","- C29 H45 Cl Cr N O -","- C232 H360 Cl8 Cr8 N8 O8 -","8","1","","Tieqi Xu; Ying Mu; Wei Gao; Jianguo Ni; Ling Ye; Yanchun Tao","Highly Active Half-Metallocene Chromium(III) Catalysts for Ethylene Polymerization Activated by Trialkylaluminum","Journal of the American Chemical Society","2007","129","","2236","2237","10.1021/ja0671363","","","0.71073","MoKα","","0.1391","0.0705","","","0.1648","0.1968","","","","","","1.025","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109113","13.117","0.004","11.47","0.004","20.571","0.008","90","","106.435","0.011","90","","2968.5","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H41 Cl Cr N O -","- C31 H41 Cl Cr N O -","- C124 H164 Cl4 Cr4 N4 O4 -","4","1","","Tieqi Xu; Ying Mu; Wei Gao; Jianguo Ni; Ling Ye; Yanchun Tao","Highly Active Half-Metallocene Chromium(III) Catalysts for Ethylene Polymerization Activated by Trialkylaluminum","Journal of the American Chemical Society","2007","129","","2236","2237","10.1021/ja0671363","","","0.71073","MoKα","","0.1466","0.0668","","","0.1191","0.148","","","","","","1.022","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109114","11.988","0.004","23.774","0.008","12.62","0.003","90","","104.731","0.012","90","","3478.5","1.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H53 Cl Cr N O -","- C37 H53 Cl Cr N O -","- C148 H212 Cl4 Cr4 N4 O4 -","4","1","","Tieqi Xu; Ying Mu; Wei Gao; Jianguo Ni; Ling Ye; Yanchun Tao","Highly Active Half-Metallocene Chromium(III) Catalysts for Ethylene Polymerization Activated by Trialkylaluminum","Journal of the American Chemical Society","2007","129","","2236","2237","10.1021/ja0671363","","","0.71073","MoKα","","0.0831","0.0496","","","0.1115","0.1297","","","","","","1.032","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109115","24.3216","0.0006","15.5835","0.0004","16.6696","0.0003","90","","116.988","0.0012","90","","5630","0.2","150","1","150","1","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C50 H48 B3 Cl2 Co2 F12 N12 O4 -","- C50 H48 B3 Cl2 Co2 F12 N12 O4 -","- C200 H192 B12 Cl8 Co8 F48 N48 O16 -","4","0.5","","Kil Sik Min; Antonio G. DiPasquale; James A. Golen; Arnold L. Rheingold; Joel S. Miller","Synthesis, Structure, and Magnetic Properties of Valence Ambiguous Dinuclear Antiferromagnetically Coupled Cobalt and Ferromagnetically Coupled Iron Complexes Containing the Chloranilate(2-) and the Significantly Stronger Coupling Chloranilate(.3-) Radical Trianion","Journal of the American Chemical Society","2007","129","","2360","2368","10.1021/ja067208q","","","0.71073","MoKα","","0.0693","0.0436","","","0.0946","0.106","","","","","","1.05","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109116","9.005","0.002","10.239","0.002","14.93","0.004","88.531","0.004","79.184","0.004","77.1","0.004","1317.8","0.5","208","2","208","2","","","","","","","","8","P -1","-P 1","2","KS-108-03","","","- C44 H39 B4 Cl2 Co2 F16 N9 O4 -","- C42 H36 Cl2 Co2 N8 O4 -","- C42 H36 Cl2 Co2 N8 O4 -","1","0.5","","Kil Sik Min; Antonio G. DiPasquale; James A. Golen; Arnold L. Rheingold; Joel S. Miller","Synthesis, Structure, and Magnetic Properties of Valence Ambiguous Dinuclear Antiferromagnetically Coupled Cobalt and Ferromagnetically Coupled Iron Complexes Containing the Chloranilate(2-) and the Significantly Stronger Coupling Chloranilate(.3-) Radical Trianion","Journal of the American Chemical Society","2007","129","","2360","2368","10.1021/ja067208q","","","0.71073","MoKα","","0.0805","0.0641","","","0.1465","0.1534","","","","","","1.092","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4109117","26.758","0.004","10.976","0.0017","16.503","0.003","90","","93.324","0.002","90","","4838.7","1.4","218","2","218","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 B Cl F4 Fe N4 O3 -","- C21 H18 B Cl F4 Fe N4 O2 -","- C168 H144 B8 Cl8 F32 Fe8 N32 O16 -","8","1","","Kil Sik Min; Antonio G. DiPasquale; James A. Golen; Arnold L. Rheingold; Joel S. Miller","Synthesis, Structure, and Magnetic Properties of Valence Ambiguous Dinuclear Antiferromagnetically Coupled Cobalt and Ferromagnetically Coupled Iron Complexes Containing the Chloranilate(2-) and the Significantly Stronger Coupling Chloranilate(.3-) Radical Trianion","Journal of the American Chemical Society","2007","129","","2360","2368","10.1021/ja067208q","","","0.71073","MoKα","","0.0518","0.0464","","","0.1161","0.1186","","","","","","1.096","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109118","9.913","0.0002","13.1154","0.0003","12.6473","0.0002","90","","91.96","0.001","90","","1643.35","0.06","80","2","80","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H4 Br6 N2 -","- C13 H4 Br6 N2 -","- C52 H16 Br24 N8 -","4","1","","Masaki Kawano; Katsuyuki Hirai; Hideo Tomioka; Yuji Ohashi","Structure Determination of Triplet Diphenylcarbenes by in Situ X-ray Crystallographic Analysis","Journal of the American Chemical Society","2007","129","","2383","2391","10.1021/ja067306b","","","0.71073","MoKα","","0.0483","0.0305","","","0.0618","0.0656","","","","","","1.039","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109119","9.9776","0.0003","13.096","0.0004","12.6356","0.0004","90","","91.409","0.001","90","","1650.55","0.09","80","2","80","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H4 Br6 N2 -","- C13 H4 Br6 N2 -","- C52 H16 Br24 N8 -","4","1","","Masaki Kawano; Katsuyuki Hirai; Hideo Tomioka; Yuji Ohashi","Structure Determination of Triplet Diphenylcarbenes by in Situ X-ray Crystallographic Analysis","Journal of the American Chemical Society","2007","129","","2383","2391","10.1021/ja067306b","","","0.71073","MoKα","","0.0787","0.0408","","","0.0768","0.0848","","","","","","1.054","","","","has coordinates,has disorder","178837","2020-10-21","18:00:00",""
"4109120","8.3253","0.0003","8.5901","0.0003","12.3494","0.0004","78.629","0.001","82.928","0.001","71.105","0.001","817.5","0.05","80","2","80","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H10 Br4 N2 -","- C15 H10 Br4 N2 -","- C30 H20 Br8 N4 -","2","1","","Masaki Kawano; Katsuyuki Hirai; Hideo Tomioka; Yuji Ohashi","Structure Determination of Triplet Diphenylcarbenes by in Situ X-ray Crystallographic Analysis","Journal of the American Chemical Society","2007","129","","2383","2391","10.1021/ja067306b","","","0.71073","MoKα","","0.0542","0.0329","","","0.0743","0.0783","","","","","","0.973","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109121","13.9646","0.0002","10.1344","0.0001","17.5916","0.0003","90","","112.585","0.001","90","","2298.69","0.06","80","2","80","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 Br4 N2 -","- C21 H22 Br4 N2 -","- C84 H88 Br16 N8 -","4","1","","Masaki Kawano; Katsuyuki Hirai; Hideo Tomioka; Yuji Ohashi","Structure Determination of Triplet Diphenylcarbenes by in Situ X-ray Crystallographic Analysis","Journal of the American Chemical Society","2007","129","","2383","2391","10.1021/ja067306b","","","0.71073","MoKα","","0.1078","0.0429","","","0.073","0.0877","","","","","","0.976","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109122","13.9645","0.0003","10.1039","0.0003","17.5479","0.0004","90","","112.625","0.001","90","","2285.39","0.1","80","2","80","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 Br4 N2 -","- C21 H22 Br4 N2 -","- C84 H88 Br16 N8 -","4","1","","Masaki Kawano; Katsuyuki Hirai; Hideo Tomioka; Yuji Ohashi","Structure Determination of Triplet Diphenylcarbenes by in Situ X-ray Crystallographic Analysis","Journal of the American Chemical Society","2007","129","","2383","2391","10.1021/ja067306b","","","0.71073","MoKα","","0.12","0.0473","","","0.0893","0.1082","","","","","","0.99","","","","has coordinates,has disorder","178837","2020-10-21","18:00:00",""
"4109123","10.869","0.002","11.121","0.001","15.731","0.002","93.64","0.01","90.928","0.009","94.05","0.01","1892.5","0.5","80","2","80","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H19 Br3 N2 -","- C19 H19 Br3 N2 -","- C76 H76 Br12 N8 -","4","2","","Masaki Kawano; Katsuyuki Hirai; Hideo Tomioka; Yuji Ohashi","Structure Determination of Triplet Diphenylcarbenes by in Situ X-ray Crystallographic Analysis","Journal of the American Chemical Society","2007","129","","2383","2391","10.1021/ja067306b","","","0.71073","MoKα","","0.0946","0.0388","","","0.0698","0.0814","","","","","","0.923","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109124","16.7682","0.0005","3.9553","0.0001","19.7247","0.0006","90","","113.701","0.001","90","","1197.87","0.06","80","2","80","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H8 Br2 N2 -","- C13 H8 Br2 N2 -","- C52 H32 Br8 N8 -","4","1","","Masaki Kawano; Katsuyuki Hirai; Hideo Tomioka; Yuji Ohashi","Structure Determination of Triplet Diphenylcarbenes by in Situ X-ray Crystallographic Analysis","Journal of the American Chemical Society","2007","129","","2383","2391","10.1021/ja067306b","","","0.71073","MoKα","","0.0418","0.0264","","","0.0584","0.0619","","","","","","1.016","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109125","10.9895","0.0002","5.4546","0.0001","16.1924","0.0001","90","","93.642","0.001","90","","968.67","0.03","80","2","80","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C13 H8 N2 -","- C13 H8 N2 -","- C52 H32 N8 -","4","2","","Masaki Kawano; Katsuyuki Hirai; Hideo Tomioka; Yuji Ohashi","Structure Determination of Triplet Diphenylcarbenes by in Situ X-ray Crystallographic Analysis","Journal of the American Chemical Society","2007","129","","2383","2391","10.1021/ja067306b","","","0.71073","MoKα","","0.079","0.0587","","","0.1447","0.1554","","","","","","1.032","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109126","6.187","0.004","7.662","0.006","16.21","0.01","90","","92.49","0.02","90","","767.7","0.9","293.1","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H12 S2 -","- C22 H12 S2 -","- C44 H24 S4 -","2","1","","Tatsuya Yamamoto; Kazuo Takimiya","Facile Synthesis of Highly π-Extended Heteroarenes, Dinaphtho[2,3-b:2',3'-f]chalcogenopheno[3,2-b]chalcogenophenes, and Their Application to Field-Effect Transistors","Journal of the American Chemical Society","2007","129","","2224","2225","10.1021/ja068429z","","","0.7107","MoKα","","","0.044","","","","0.068","","","","","","0.984","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109127","10.845","0.004","11.766","0.005","34.172","0.013","84.827","0.01","86.286","0.011","75.697","0.011","4204","3","126","2","126","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H66 N2 P2 Ti -","- C43 H66 N2 P2 Ti -","- C172 H264 N8 P8 Ti4 -","4","2","","Brad C. Bailey; Alison R. Fout; Hongjun Fan; John Tomaszewski; John C. Huffman; J. Brannon Gary; Marc J. A. Johnson; Daniel J. Mindiola","Snapshots of an Alkylidyne for Nitride Triple-Bond Metathesis","Journal of the American Chemical Society","2007","129","","2234","2235","10.1021/ja0689684","","","0.71073","MoKα","","0.1735","0.073","","","0.1156","0.1442","","","","","","0.791","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109128","11.655","0.002","41.822","0.008","14.864","0.003","90","","94.14","0.03","90","","7226","2","126","2","126","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31.5 H55 Cl N2 P2 Si Ti -","- C31.5 H55 Cl N2 P2 Si Ti -","- C252 H440 Cl8 N16 P16 Si8 Ti8 -","8","2","","Brad C. Bailey; Alison R. Fout; Hongjun Fan; John Tomaszewski; John C. Huffman; J. Brannon Gary; Marc J. A. Johnson; Daniel J. Mindiola","Snapshots of an Alkylidyne for Nitride Triple-Bond Metathesis","Journal of the American Chemical Society","2007","129","","2234","2235","10.1021/ja0689684","","","0.71073","MoKα","","0.0672","0.0375","","","0.085","0.0939","","","","","","0.889","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109129","11.0567","0.0008","18.3297","0.0013","18.4304","0.0014","81.664","0.002","87.757","0.002","89.504","0.002","3692.9","0.5","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H58 Al2 N2 P2 Ti -","- C32 H58 Al2 N2 P2 Ti -","- C128 H232 Al8 N8 P8 Ti4 -","4","2","","Brad C. Bailey; Alison R. Fout; Hongjun Fan; John Tomaszewski; John C. Huffman; J. Brannon Gary; Marc J. A. Johnson; Daniel J. Mindiola","Snapshots of an Alkylidyne for Nitride Triple-Bond Metathesis","Journal of the American Chemical Society","2007","129","","2234","2235","10.1021/ja0689684","","","0.71073","MoKα","","0.0697","0.041","","","0.0891","0.0965","","","","","","0.92","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109130","16.029","0.004","13.029","0.003","17.866","0.006","90","","103.364","0.011","90","","3630.1","1.7","123.1","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C42 H23 F12 N O3 S -","- C42 H23 F12 N O3 S -","- C168 H92 F48 N4 O12 S4 -","4","2","","Takashi Ooi; Kohsuke Ohmatsu; Keiji Maruoka","Catalytic Asymmetric Rearrangement of α,α-Disubstituted α-Siloxy Aldehydes to Optically Active Acyloins Using Axially Chiral Organoaluminum Lewis Acids","Journal of the American Chemical Society","2007","129","","2410","2411","10.1021/ja063051q","","","0.71075","MoKα","","","0.0506","","","","0.1341","","","","","","1.326","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109131","18.566","0.003","10.4527","0.0015","19.192","0.003","90","","108.009","0.002","90","","3542","0.9","173","2","173","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C38 H63 Ce O0.5 -","- C38 H63 Ce O0.5 -","- C152 H252 Ce4 O2 -","4","1","","Evan L. Werkema; Laurent Maron; Odile Eisenstein; Richard A. Andersen","Reactions of Monomeric [1,2,4-(Me3C)3C5H2]2CeH and CO with or without H2: An Experimental and Computational Study","Journal of the American Chemical Society","2007","129","","2529","2541","10.1021/ja066482h","","","0.71073","MoKα","","0.1207","0.0716","","","0.1424","0.1597","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109132","10.5543","0.0006","10.658","0.0006","15.7061","0.0009","73.949","0.001","81.19","0.001","83.217","0.001","1672.49","0.16","166.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C70 H118 Ce2 O2 -","- C70 H118 Ce2 O2 -","- C70 H118 Ce2 O2 -","1","0.5","","Evan L. Werkema; Laurent Maron; Odile Eisenstein; Richard A. Andersen","Reactions of Monomeric [1,2,4-(Me3C)3C5H2]2CeH and CO with or without H2: An Experimental and Computational Study","Journal of the American Chemical Society","2007","129","","2529","2541","10.1021/ja066482h","","","0.7107","MoKα","","0.0447","0.0384","","0.0499","","0.0481","","","","","","1.584","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109133","12.1738","0.0013","15.991","0.002","19.349","0.003","84.22","0.003","79.055","0.003","68.46","0.02","3437.9","0.9","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C70 H118 Ce2 O2 -","- C70 H118 Ce2 O2 -","- C140 H236 Ce4 O4 -","2","1","","Evan L. Werkema; Laurent Maron; Odile Eisenstein; Richard A. Andersen","Reactions of Monomeric [1,2,4-(Me3C)3C5H2]2CeH and CO with or without H2: An Experimental and Computational Study","Journal of the American Chemical Society","2007","129","","2529","2541","10.1021/ja066482h","","","0.775","synchrotron","","0.0964","0.0583","","","0.1483","0.1606","","","","","","0.976","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109134","15.777","0.003","11.349","0.002","30.139","0.006","90","","105.16","0.01","90","","5208.7","1.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","tert-Butylamidophenyltris-(1-tert-butyl-imidazol-2-ylidene)boratocobalt(II)","","- C31 H47 B Co N7 -","- C10.9412 H16.8824 B0.352941 Co0.352941 N2.47059 -","- C186 H287 B6 Co6 N42 -","17","8.5","","Ryan E. Cowley; Ranko P. Bontchev; John Sorrell; Orcino Sarracino; Yanhua Feng; Haobin Wang; Jeremy M. Smith","Formation of a Cobalt(III) Imido from a Cobalt(II) Amido Complex. Evidence for Proton-Coupled Electron Transfer","Journal of the American Chemical Society","2007","129","","2424","2425","10.1021/ja066899n","","","0.71073","MoKα","","0.0657","0.0537","","","0.1563","0.1664","","","","","","1.089","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109135","9.6389","0.0003","20.8449","0.0007","17.178","0.0006","90","","100.028","0.002","90","","3398.7","0.2","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tert-Butylimidophenyltris-(1-tert-butyl-imidazol-2-ylidene)boratocobalt(iii)","","- C21.67 H32 B0.67 Co0.67 N4.67 O0.33 -","- C21.6667 H32 B0.666667 Co0.666667 N4.66667 O0.333333 -","- C130 H192 B4 Co4 N28 O2 -","6","1.5","","Ryan E. Cowley; Ranko P. Bontchev; John Sorrell; Orcino Sarracino; Yanhua Feng; Haobin Wang; Jeremy M. Smith","Formation of a Cobalt(III) Imido from a Cobalt(II) Amido Complex. Evidence for Proton-Coupled Electron Transfer","Journal of the American Chemical Society","2007","129","","2424","2425","10.1021/ja066899n","","","0.71073","MoKα","","0.0593","0.0519","","","0.1651","0.1783","","","","","","1.15","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109136","26.287","0.006","10.919","0.003","10.265","0.003","90","","90","","90","","2946.3","1.4","133.2","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C32 H46 N2 Ni O2 -","- C32 H46 N2 Ni O2 -","- C128 H184 N8 Ni4 O8 -","4","0.5","","Yuichi Shimazaki; Tatsuo Yajima; Fumito Tani; Satoru Karasawa; Koichi Fukui; Yoshinori Naruta; Osamu Yamauchi","Syntheses and Electronic Structures of One-Electron-Oxidized Group 10 Metal(II)-(Disalicylidene)diamine Complexes (Metal = Ni, Pd, Pt)","Journal of the American Chemical Society","2007","129","","2559","2568","10.1021/ja067022r","","","0.7107","MoKα","","","0.0427","","","","0.0919","","","","","","0.816","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109137","26.674","0.008","10.956","0.004","10.273","0.004","90","","90","","90","","3002.2","1.8","133.2","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C32 H46 N2 O2 Pd -","- C32 H46 N2 O2 Pd -","- C128 H184 N8 O8 Pd4 -","4","0.5","","Yuichi Shimazaki; Tatsuo Yajima; Fumito Tani; Satoru Karasawa; Koichi Fukui; Yoshinori Naruta; Osamu Yamauchi","Syntheses and Electronic Structures of One-Electron-Oxidized Group 10 Metal(II)-(Disalicylidene)diamine Complexes (Metal = Ni, Pd, Pt)","Journal of the American Chemical Society","2007","129","","2559","2568","10.1021/ja067022r","","","0.7107","MoKα","","","0.0609","","","","0.155","","","","","","1.326","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109138","26.78","0.01","11.036","0.005","10.181","0.005","90","","90","","90","","3009","2","133.2","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C32 H46 N2 O2 Pt -","- C32 H46 N2 O2 Pt -","- C128 H184 N8 O8 Pt4 -","4","0.5","","Yuichi Shimazaki; Tatsuo Yajima; Fumito Tani; Satoru Karasawa; Koichi Fukui; Yoshinori Naruta; Osamu Yamauchi","Syntheses and Electronic Structures of One-Electron-Oxidized Group 10 Metal(II)-(Disalicylidene)diamine Complexes (Metal = Ni, Pd, Pt)","Journal of the American Chemical Society","2007","129","","2559","2568","10.1021/ja067022r","","","0.7107","MoKα","","","0.0423","","","","0.1128","","","","","","0.992","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109139","22.498","0.002","22.498","0.002","5.9121","0.0011","90","","90","","90","","2992.5","0.7","193","2","193","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C9 H9 N O -","- C9 H9 N O -","- C144 H144 N16 O16 -","16","1","","Derrick L. J. Clive; Mai P. Pham; Rajendra Subedi","Carbocyclization by Radical Closure onto O-Trityl Oximes: Dramatic Effect of Diphenyl Diselenide","Journal of the American Chemical Society","2007","129","","2713","2717","10.1021/ja067117t","","","0.71073","MoKα","","0.096","0.0444","","","0.0982","0.1191","","","","","","0.997","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109140","10.7378","0.0006","11.807","0.0007","39.466","0.002","90","","90","","90","","5003.5","0.5","98","2","98","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C55 H57 Cl3 N6 Ni2 O3 -","- C55 H57 Cl3 N6 Ni2 O3 -","- C220 H228 Cl12 N24 Ni8 O12 -","4","1","","Vadim A. Soloshonok; Hisanori Ueki","Design, Synthesis, and Characterization of Binuclear Ni(II) Complexes with Inherent Helical Chirality","Journal of the American Chemical Society","2007","129","","2426","2427","10.1021/ja0671215","","","0.71073","MoKα","","0.0282","0.0271","","","0.0664","0.0668","","","","","","1.083","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109141","12.6201","0.0018","12.9334","0.0018","14.146","0.002","83.683","0.005","69.965","0.005","63.19","0.005","1933.3","0.5","97","2","97","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H42 N6 Ni2 O6 -","- C42 H42 N6 Ni2 O6 -","- C84 H84 N12 Ni4 O12 -","2","1","","Vadim A. Soloshonok; Hisanori Ueki","Design, Synthesis, and Characterization of Binuclear Ni(II) Complexes with Inherent Helical Chirality","Journal of the American Chemical Society","2007","129","","2426","2427","10.1021/ja0671215","","","0.71073","MoKα","","0.0619","0.0564","","","0.1567","0.1625","","","","","","1.004","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109142","9.7788","0.0016","14.374","0.002","15.608","0.002","89.393","0.005","74.856","0.005","80.224","0.005","2085.6","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H58.5 N6 Ni2 O2.25 -","- C46 H58.25 N6 Ni2 O2.25 -","- C92 H116.5 N12 Ni4 O4.5 -","2","1","","Vadim A. Soloshonok; Hisanori Ueki","Design, Synthesis, and Characterization of Binuclear Ni(II) Complexes with Inherent Helical Chirality","Journal of the American Chemical Society","2007","129","","2426","2427","10.1021/ja0671215","","","0.71073","MoKα","","0.0318","0.0281","","","0.0743","0.0765","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109143","15.11","0.003","15.309","0.003","20.414","0.003","90","","98.416","0.002","90","","4671.3","1.5","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C58 H50 N6 Ni2 O2 -","- C58 H50 N6 Ni2 O2 -","- C232 H200 N24 Ni8 O8 -","4","0.5","","Vadim A. Soloshonok; Hisanori Ueki","Design, Synthesis, and Characterization of Binuclear Ni(II) Complexes with Inherent Helical Chirality","Journal of the American Chemical Society","2007","129","","2426","2427","10.1021/ja0671215","","","0.71073","MoKα","","0.0744","0.0462","","","0.1049","0.1162","","","","","","1.01","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109144","15.6194","0.0011","21.1141","0.0015","24.6763","0.0018","90","","90","","90","","8138","1","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C44 H52 N6 Ni2 O3 -","- C44 H52 N6 Ni2 O3 -","- C352 H416 N48 Ni16 O24 -","8","1","","Vadim A. Soloshonok; Hisanori Ueki","Design, Synthesis, and Characterization of Binuclear Ni(II) Complexes with Inherent Helical Chirality","Journal of the American Chemical Society","2007","129","","2426","2427","10.1021/ja0671215","","","0.71073","MoKα","","0.0421","0.0315","","","0.0756","0.0815","","","","","","1.047","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109145","15.3554","0.0008","12.2744","0.0007","12.4945","0.0007","90","","90","","90","","2354.9","0.2","120","2","120","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C52 H50 Cl4 N6 Ni2 O2 -","- C52 H50 Cl4 N6 Ni2 O2 -","- C104 H100 Cl8 N12 Ni4 O4 -","2","0.5","","Vadim A. Soloshonok; Hisanori Ueki","Design, Synthesis, and Characterization of Binuclear Ni(II) Complexes with Inherent Helical Chirality","Journal of the American Chemical Society","2007","129","","2426","2427","10.1021/ja0671215","","","0.71073","MoKα","","0.0278","0.027","","","0.0712","0.0717","","","","","","1.065","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109146","24.756","0.004","24.756","0.004","24.756","0.004","90","","90","","90","","15172","4","238","","","","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C48 H36 Cd N16 O12 -","- C48 H36 Cd N12 O12 -","- C384 H288 Cd8 N96 O96 -","8","0.166667","","Shinpei Hasegawa; Satoshi Horike; Ryotaro Matsuda; Shuhei Furukawa; Katsunori Mochizuki; Yoshinori Kinoshita; Susumu Kitagawa","Three-Dimensional Porous Coordination Polymer Functionalized with Amide Groups Based on Tridentate Ligand: Selective Sorption and Catalysis","Journal of the American Chemical Society","2007","129","","2607","2614","10.1021/ja067374y","","","0.7107","MoKα","","","0.08","","","","0.216","","","","","","0.904","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109147","11.737","0.0002","17.826","0.0006","22.719","0.0006","90","","91.642","0.002","90","","4751.4","0.2","120","","120","","","","","","","","","3","P 1 c 1","P -2yc","7","","Si3C-bicyclo[1.1.0]butane","","- C37 H86 Si7 -","- C37 H86 Si7 -","- C148 H344 Si28 -","4","2","","Vladimir Ya. Lee; Hiroyuki Yasuda; Akira Sekiguchi","Interplay of EnE'3-nC Valence Isomers (E, E' = Si, Ge): Bicyclo[1.1.0]butanes with Very Short Bridging Bonds and Their Isomerization to Alkyl-Substituted Cyclopropenes","Journal of the American Chemical Society","2007","129","","2436","2437","10.1021/ja068229n","","","0.7107","MoKα","","0.0381","0.037","","","0.1012","0.1024","","","","","","1.083","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109148","13.352","0.003","13.409","0.003","16.143","0.003","85.04","0.03","73.27","0.03","64.51","0.03","2496.1","1.2","100","","293","2","","","","","","","","6","P -1","-P 1","2","","","","- Ge2 H74 Na16 Np2 O109 W18 -","- Ge2 Na16 Np2 O109 W18 -","- Ge2 Na16 Np2 O109 W18 -","1","0.5","","Catherine Talbot-Eeckelaers; Simon J. A. Pope; Amanda J. Hynes; Roy Copping; Chris J. Jones; Robin J. Taylor; Stephen Faulkner; Daniel Sykes; Francis R. Livens; Iain May","Luminescence from Neptunyl(VI) Species in Solution","Journal of the American Chemical Society","2007","129","","2442","2443","10.1021/ja068522n","","","0.71073","MoKα","","0.1291","0.0998","","","0.2391","0.2552","","","","","","1.016","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109149","27.9635","0.001","20.7892","0.0007","15.4264","0.0006","90","","105.65","0.001","90","","8635.5","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H56 O10 Os3 P2 Pt2 -","- C34 H56 O10 Os3 P2 Pt2 -","- C272 H448 O80 Os24 P16 Pt16 -","8","2","","Richard D. Adams; Burjor Captain; Lei Zhu","Facile Activation of Hydrogen by an Unsaturated Platinum-Osmium Cluster Complex","Journal of the American Chemical Society","2007","129","","2454","2455","10.1021/ja0688272","","","0.71073","MoKα","","0.0589","0.0394","","","0.0854","0.0943","","","","","","1.015","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109150","16.7485","0.0008","15.9787","0.0008","18.2023","0.0009","90","","103.787","0.001","90","","4730.9","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H63 O10.5 Os3 P2 Pt2 -","- C36 H63 O10.5 Os3 P2 Pt2 -","- C144 H252 O42 Os12 P8 Pt8 -","4","1","","Richard D. Adams; Burjor Captain; Lei Zhu","Facile Activation of Hydrogen by an Unsaturated Platinum-Osmium Cluster Complex","Journal of the American Chemical Society","2007","129","","2454","2455","10.1021/ja0688272","","","0.71073","MoKα","","0.0253","0.0229","","","0.0573","0.0581","","","","","","1.118","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109151","14.0665","0.0004","15.9725","0.0005","18.2569","0.0006","90","","90","","90","","4101.9","0.2","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C34 H54 O10 Os3 P2 -","- C34 H54 O10 Os3 P2 -","- C136 H216 O40 Os12 P8 -","4","1","","Richard D. Adams; Burjor Captain; Lei Zhu","Facile Activation of Hydrogen by an Unsaturated Platinum-Osmium Cluster Complex","Journal of the American Chemical Society","2007","129","","2454","2455","10.1021/ja0688272","","","0.71073","MoKα","","0.051","0.041","","","0.0936","0.0991","","","","","","1.059","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109152","12.8093","0.0004","20.1356","0.0006","9.2275","0.0003","90","","90","","90","","2379.98","0.13","294","2","294","2","","","","","","","","6","P n n 2","P 2 -2n","34","","","","- C40 H60 O10 Os3 P2 Pt2 -","- C40 H60 O10 Os3 P2 Pt2 -","- C80 H120 O20 Os6 P4 Pt4 -","2","0.5","","Richard D. Adams; Burjor Captain; Lei Zhu","Facile Activation of Hydrogen by an Unsaturated Platinum-Osmium Cluster Complex","Journal of the American Chemical Society","2007","129","","2454","2455","10.1021/ja0688272","","","0.71073","MoKα","","0.0375","0.0304","","","0.0605","0.0636","","","","","","1.033","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109153","20.4591","0.0009","21.318","0.001","36.871","0.002","90","","90","","90","","16081.2","1.4","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C82 H132 Cu9 F30 N24 O88 S10 -","- C82 H88 Cu9 F30 N24 O88 S10 -","- C328 H352 Cu36 F120 N96 O352 S40 -","4","1","","Donatella Armentano; Teresa F. Mastropietro; Miguel Julve; Rachele Rossi; Patrizia Rossi; Giovanni De Munno","A New Octanuclear Copper(II)-Nucleoside Wheel","Journal of the American Chemical Society","2007","129","","2740","2741","10.1021/ja068201b","","","1.54018","CuKα","","0.0926","0.0789","","","0.211","0.2268","","","","","","0.971","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109154","10.06","0.004","7.049","0.003","10.34","0.004","90","","93.678","0.006","90","","731.7","0.5","273.2","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H21 Br O -","- C16 H21 Br O -","- C32 H42 Br2 O2 -","2","1","","Britton K. Corkey; F. Dean Toste","Palladium-Catalyzed Enantioselective Cyclization of Silyloxy-1,6-Enynes","Journal of the American Chemical Society","2007","129","","2764","2765","10.1021/ja068723r","","","0.7107","MoKα","","0.1289","0.0667","","0.1104","","0.0829","","","","","","1.184","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109155","9.94","0.002","19.177","0.004","16","0.003","90","","107.734","0.002","90","","2905","1","153.2","","","","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C55 H46 Cl6 F6 O8 P2 Pd S2 -","- C54.8 H46 Cl6 F6 O8 P2 Pd S2 -","- C109.6 H92 Cl12 F12 O16 P4 Pd2 S4 -","2","1","","Britton K. Corkey; F. Dean Toste","Palladium-Catalyzed Enantioselective Cyclization of Silyloxy-1,6-Enynes","Journal of the American Chemical Society","2007","129","","2764","2765","10.1021/ja068723r","","","0.7107","MoKα","","0.0473","0.0344","","0.0394","","0.0373","","","","","","1.431","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109156","12.912","0.0002","23.553","0.0004","15.19","0.0003","90","","107.549","0.001","90","","4404.53","0.14","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H54 Mn3 N3 O12 -","- C42 H54 Mn3 N3 O12 -","- C168 H216 Mn12 N12 O48 -","4","1","","Constantinos J. Milios; Alina Vinslava; Wolfgang Wernsdorfer; Stephen Moggach; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","A Record Anisotropy Barrier for a Single-Molecule Magnet","Journal of the American Chemical Society","2007","129","","2754","2755","10.1021/ja068961m","","","0.71073","MoKα","","0.0927","0.0437","","0.1555","0.1055","0.1555","","","","","","1.0083","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109157","8.168","0.0017","6.5842","0.0014","9.3127","0.0014","90","","116.089","0.013","90","","449.81","0.16","571","2","571","2","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- Np2 O5 -","- Np2 O5 -","- Np8 O20 -","4","1","","Tori Z. Forbes; Peter C. Burns; S. Skanthakumar; L. Soderholm","Synthesis, Structure, and Magnetism of Np2O5","Journal of the American Chemical Society","2007","129","","2760","2761","10.1021/ja069250r","","","0.71073","MoKα","","0.0659","0.0291","","","0.0608","0.0635","","","","","","0.749","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109158","21.62","0.006","21.642","0.006","25.73","0.007","87.146","0.005","67.582","0.005","63.125","0.005","9817","5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H85 N2 O5 S Si8 -","- C42 H85 N2 O5 S Si8 -","- C252 H510 N12 O30 S6 Si48 -","6","3","","Matthew B. Boxer; Hisashi Yamamoto","""Super Silyl"" Group for Diastereoselective Sequential Reactions: Access to Complex Chiral Architecture in One Pot","Journal of the American Chemical Society","2007","129","","2762","2763","10.1021/ja0693542","","","0.71073","MoKα","","0.1816","0.1069","","","0.2754","0.3077","","","","","","0.939","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109159","10.13","0.002","17.035","0.003","27.695","0.007","90","","109.02","0.03","90","","4518.3","1.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H76 O3 Si8 -","- C31 H76 O3 Si8 -","- C124 H304 O12 Si32 -","4","1","","Matthew B. Boxer; Hisashi Yamamoto","""Super Silyl"" Group for Diastereoselective Sequential Reactions: Access to Complex Chiral Architecture in One Pot","Journal of the American Chemical Society","2007","129","","2762","2763","10.1021/ja0693542","","","0.41328","","","0.0633","0.038","","","0.0859","0.0955","","","","","","1.012","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109160","9.307","0.0019","10.423","0.002","21.794","0.004","84.92","0.03","78.75","0.03","79.41","0.03","2035.2","0.7","100","2","100","2","","","","","","","","4","P -1","-P 1","2","Peptoid cyclo[NpmNme]3","","","- C43 H58 N6 O10 -","- C43 H58 N6 O10 -","- C86 H116 N12 O20 -","2","1","","Shin, Sung Bin Y.; Yoo, Barney; Todaro, Louis J.; Kirshenbaum, Kent","Cyclic Peptoids","Journal of the American Chemical Society","2007","129","11","3218","3225","10.1021/ja066960o","","","0.71073","MoKα","","0.1344","0.0624","","","0.1093","0.1321","","","","","","1.023","","","","has coordinates","209505","2020-10-21","18:00:00",""
"4109161","15.587","0.003","18.811","0.004","20.237","0.004","91.76","0.03","101.95","0.03","106.63","0.03","5537","2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C56 H72 N8 O12 -","- C56 H72 N8 O12 -","- C224 H288 N32 O48 -","4","2","","Shin, Sung Bin Y.; Yoo, Barney; Todaro, Louis J.; Kirshenbaum, Kent","Cyclic Peptoids","Journal of the American Chemical Society","2007","129","11","3218","3225","10.1021/ja066960o","","","0.71073","MoKα","","0.085","0.0521","","","0.102","0.1149","","","","","","1.022","","","","has coordinates","209505","2020-10-21","18:00:00",""
"4109162","10.337","0.0003","9.568","0.0002","9.73","0.0002","90","","90","","90","","962.34","0.04","100","2","100","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C8 H18 Zn -","- C8 H18 Zn -","- C32 H72 Zn4 -","4","0.5","","Janusz Lewiński; Maciej Dranka; Wojciech Bury; Witold Śliwiński; Iwona Justyniak; Janusz Lipkowski","From Discrete Linear ZntBu2 Molecules to 1D Coordination Polymers and 2D Fabrics","Journal of the American Chemical Society","2007","129","","3096","3098","10.1021/ja067229k","","","0.71073","MoKα","","0.0299","0.0259","","","0.0695","0.0714","","","","","","1.188","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109163","16.217","0.0011","16.217","0.0011","29.604","0.003","90","","90","","90","","7785.6","1.1","100","2","100","2","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","","","- C20 H30 N2 Zn -","- C20 H30 N2 Zn -","- C320 H480 N32 Zn16 -","16","0.5","","Janusz Lewiński; Maciej Dranka; Wojciech Bury; Witold Śliwiński; Iwona Justyniak; Janusz Lipkowski","From Discrete Linear ZntBu2 Molecules to 1D Coordination Polymers and 2D Fabrics","Journal of the American Chemical Society","2007","129","","3096","3098","10.1021/ja067229k","","","0.71073","MoKα","","0.0704","0.0304","","","0.0687","0.0768","","","","","","0.89","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109164","14.689","0.0006","16.472","0.0006","8.354","0.0012","90","","90","","90","","2021.3","0.3","100","2","100","2","","","","","","","","4","P n n a","-P 2a 2bc","52","","","","- C20 H28 N2 Zn -","- C20 H28 N2 Zn -","- C80 H112 N8 Zn4 -","4","0.5","","Janusz Lewiński; Maciej Dranka; Wojciech Bury; Witold Śliwiński; Iwona Justyniak; Janusz Lipkowski","From Discrete Linear ZntBu2 Molecules to 1D Coordination Polymers and 2D Fabrics","Journal of the American Chemical Society","2007","129","","3096","3098","10.1021/ja067229k","","","0.71073","MoKα","","0.0555","0.0288","","","0.064","0.0685","","","","","","0.966","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109165","21.018","0.006","8.137","0.003","18.221","0.004","90","","119.049","0.012","90","","2724.2","1.4","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-(4-methoxy-2,6-dimethyl-phenyl)-3,5-dimethyl-pyridin-1-ol","","- C16 H19 N O2 -","- C16 H19 N O2 -","- C128 H152 N8 O16 -","8","1","","Hu Kang; Antonio Facchetti; Hua Jiang; Elena Cariati; Stefania Righetto; Renato Ugo; Cristiano Zuccaccia; Alceo Macchioni; Charlotte L. Stern; Zhifu Liu; Seng-Tiong Ho; Eric C. Brown; Mark A. Ratner; Tobin J. Marks","Ultralarge Hyperpolarizability Twisted π-Electron System Electro-Optic Chromophores: Synthesis, Solid-State and Solution-Phase Structural Characteristics, Electronic Structures, Linear and Nonlinear Optical Properties, and Computational Studies","Journal of the American Chemical Society","2007","129","","3267","3286","10.1021/ja0674690","","","0.71073","MoKα","","0.0653","0.0525","","","0.142","0.1552","","","","","","1.1","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109166","12.834","0.002","17.241","0.003","7.9026","0.0013","90","","100.799","0.011","90","","1717.6","0.5","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(4-Methoxy-2,6-dimethyl-phenyl)-1,3,5-trimethyl-pyridiniumiodide","","- C17 H22 I N O -","- C17 H22 I N O -","- C68 H88 I4 N4 O4 -","4","1","","Hu Kang; Antonio Facchetti; Hua Jiang; Elena Cariati; Stefania Righetto; Renato Ugo; Cristiano Zuccaccia; Alceo Macchioni; Charlotte L. Stern; Zhifu Liu; Seng-Tiong Ho; Eric C. Brown; Mark A. Ratner; Tobin J. Marks","Ultralarge Hyperpolarizability Twisted π-Electron System Electro-Optic Chromophores: Synthesis, Solid-State and Solution-Phase Structural Characteristics, Electronic Structures, Linear and Nonlinear Optical Properties, and Computational Studies","Journal of the American Chemical Society","2007","129","","3267","3286","10.1021/ja0674690","","","0.71073","MoKα","","0.0381","0.0288","","","0.0659","0.072","","","","","","1.067","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109167","21.927","0.006","29.244","0.004","8.089","0.002","90","","90","","90","","5187","2","153","2","153","2","","","","","","","","4","F d d 2","F 2 -2d","43","","4-(3,5-dimethyl-pyridin-4-yl)-3,5-dimethyl-phenol","","- C15 H17 N O -","- C15 H17 N O -","- C240 H272 N16 O16 -","16","1","","Hu Kang; Antonio Facchetti; Hua Jiang; Elena Cariati; Stefania Righetto; Renato Ugo; Cristiano Zuccaccia; Alceo Macchioni; Charlotte L. Stern; Zhifu Liu; Seng-Tiong Ho; Eric C. Brown; Mark A. Ratner; Tobin J. Marks","Ultralarge Hyperpolarizability Twisted π-Electron System Electro-Optic Chromophores: Synthesis, Solid-State and Solution-Phase Structural Characteristics, Electronic Structures, Linear and Nonlinear Optical Properties, and Computational Studies","Journal of the American Chemical Society","2007","129","","3267","3286","10.1021/ja0674690","","","0.71073","MoKα","","0.0431","0.0381","","","0.0982","0.1023","","","","","","1.067","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109168","27.251","0.007","11.561","0.0018","11.868","0.003","90","","109.661","0.015","90","","3521","1.4","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(4-Hydroxy-2,6-dimethyl-phenyl)-1,3,5-trimethyl-pyridiniumiodide","","- C16 H22 I N O2 -","- C16 H22 I N O2 -","- C128 H176 I8 N8 O16 -","8","1","","Hu Kang; Antonio Facchetti; Hua Jiang; Elena Cariati; Stefania Righetto; Renato Ugo; Cristiano Zuccaccia; Alceo Macchioni; Charlotte L. Stern; Zhifu Liu; Seng-Tiong Ho; Eric C. Brown; Mark A. Ratner; Tobin J. Marks","Ultralarge Hyperpolarizability Twisted π-Electron System Electro-Optic Chromophores: Synthesis, Solid-State and Solution-Phase Structural Characteristics, Electronic Structures, Linear and Nonlinear Optical Properties, and Computational Studies","Journal of the American Chemical Society","2007","129","","3267","3286","10.1021/ja0674690","","","0.71073","MoKα","","0.0455","0.032","","","0.0756","0.084","","","","","","1.029","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109169","12.235","0.0007","12.985","0.0007","12.7805","0.0007","90","","110.207","0.0008","90","","1905.48","0.18","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3,5-dimethyl-4-(1,3,5-trimethyl-1H-pyridin-4-ylidene)-cyclohexa-2,5-Dienone","","- C17 H23 I N Na O2 -","- C17 H23 I N Na O2 -","- C68 H92 I4 N4 Na4 O8 -","4","1","","Hu Kang; Antonio Facchetti; Hua Jiang; Elena Cariati; Stefania Righetto; Renato Ugo; Cristiano Zuccaccia; Alceo Macchioni; Charlotte L. Stern; Zhifu Liu; Seng-Tiong Ho; Eric C. Brown; Mark A. Ratner; Tobin J. Marks","Ultralarge Hyperpolarizability Twisted π-Electron System Electro-Optic Chromophores: Synthesis, Solid-State and Solution-Phase Structural Characteristics, Electronic Structures, Linear and Nonlinear Optical Properties, and Computational Studies","Journal of the American Chemical Society","2007","129","","3267","3286","10.1021/ja0674690","","","0.71073","MoKα","","0.0275","0.0236","","","0.0605","0.0634","","","","","","1.026","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109170","14.551","0.002","15.697","0.003","18.554","0.003","90","","103.107","0.002","90","","4127.5","1.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H64 N O4 -","- C42 H55 N O4 -","- C168 H220 N4 O16 -","4","1","","Hu Kang; Antonio Facchetti; Hua Jiang; Elena Cariati; Stefania Righetto; Renato Ugo; Cristiano Zuccaccia; Alceo Macchioni; Charlotte L. Stern; Zhifu Liu; Seng-Tiong Ho; Eric C. Brown; Mark A. Ratner; Tobin J. Marks","Ultralarge Hyperpolarizability Twisted π-Electron System Electro-Optic Chromophores: Synthesis, Solid-State and Solution-Phase Structural Characteristics, Electronic Structures, Linear and Nonlinear Optical Properties, and Computational Studies","Journal of the American Chemical Society","2007","129","","3267","3286","10.1021/ja0674690","","","0.71073","MoKα","","0.0981","0.0788","","","0.2067","0.22","","","","","","1.102","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109171","11.763","0.003","14.137","0.002","23.388","0.005","90","","103.99","0.02","90","","3773.9","1.4","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","TMC-1","","","- C20.5 H24 N3 O1.5 -","- C20.5 H24 N3 O1.5 -","- C164 H192 N24 O12 -","8","2","","Hu Kang; Antonio Facchetti; Hua Jiang; Elena Cariati; Stefania Righetto; Renato Ugo; Cristiano Zuccaccia; Alceo Macchioni; Charlotte L. Stern; Zhifu Liu; Seng-Tiong Ho; Eric C. Brown; Mark A. Ratner; Tobin J. Marks","Ultralarge Hyperpolarizability Twisted π-Electron System Electro-Optic Chromophores: Synthesis, Solid-State and Solution-Phase Structural Characteristics, Electronic Structures, Linear and Nonlinear Optical Properties, and Computational Studies","Journal of the American Chemical Society","2007","129","","3267","3286","10.1021/ja0674690","","","0.71073","MoKα","","0.0939","0.0543","","","0.1356","0.1581","","","","","","1.008","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109172","15.6106","0.0016","16.1279","0.0017","19.714","0.002","90","","90","","90","","4963.3","0.9","153","2","153","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","TMC","","","- C28 H37 N3 -","- C28 H36.079 N3 -","- C224 H288.632 N24 -","8","1","","Hu Kang; Antonio Facchetti; Hua Jiang; Elena Cariati; Stefania Righetto; Renato Ugo; Cristiano Zuccaccia; Alceo Macchioni; Charlotte L. Stern; Zhifu Liu; Seng-Tiong Ho; Eric C. Brown; Mark A. Ratner; Tobin J. Marks","Ultralarge Hyperpolarizability Twisted π-Electron System Electro-Optic Chromophores: Synthesis, Solid-State and Solution-Phase Structural Characteristics, Electronic Structures, Linear and Nonlinear Optical Properties, and Computational Studies","Journal of the American Chemical Society","2007","129","","3267","3286","10.1021/ja0674690","","","0.71073","MoKα","","0.1674","0.0865","","","0.2419","0.31","","","","","","1.041","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"4109173","20.335","0.003","10.4382","0.0014","13.599","0.0019","90","","122.496","0.003","90","","2434.6","0.6","293","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H34 B10 P2 Pt -","- C18 H34 B10 P2 Pt -","- C72 H136 B40 P8 Pt4 -","4","0.5","","Kelly J. Dalby; David Ellis; Stefan Erhardt; Ruaraidh D. McIntosh; Stuart A. Macgregor; Karen Rae; Georgina M. Rosair; Volker Settels; Alan J. Welch; Bruce E. Hodson; Thomas D. McGrath; F. Gordon A. Stone","The Conformations of 13-Vertex ML~2~C~2~B~10~ Metallacarboranes: Experimental and Computational Studies","Journal of the American Chemical Society","2007","129","","3302","3314","10.1021/ja067698m","","","0.71073","MoKα","","0.0378","0.0253","","","0.0501","0.0523","","","","","","0.923","","","","has coordinates,has disorder","178837","2020-10-21","18:00:00",""
"4109174","13.6694","0.0009","10.5522","0.0007","17.3895","0.0012","90","","100.028","0.003","90","","2470","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H34 B10 P2 Pt -","- C18 H34 B10 P2 Pt -","- C72 H136 B40 P8 Pt4 -","4","1","","Kelly J. Dalby; David Ellis; Stefan Erhardt; Ruaraidh D. McIntosh; Stuart A. Macgregor; Karen Rae; Georgina M. Rosair; Volker Settels; Alan J. Welch; Bruce E. Hodson; Thomas D. McGrath; F. Gordon A. Stone","The Conformations of 13-Vertex ML~2~C~2~B~10~ Metallacarboranes: Experimental and Computational Studies","Journal of the American Chemical Society","2007","129","","3302","3314","10.1021/ja067698m","","","0.71073","MoKα","","0.0182","0.0156","","","0.039","0.0397","","","","","","1.148","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109175","10.056","0.005","14.692","0.007","17.296","0.013","113.67","0.04","100.35","0.04","98.26","0.03","2235","2","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C46.5 H55 B10 Cl N P2 Rh -","- C46.5 H55 B10 Cl N P2 Rh -","- C93 H110 B20 Cl2 N2 P4 Rh2 -","2","1","","Kelly J. Dalby; David Ellis; Stefan Erhardt; Ruaraidh D. McIntosh; Stuart A. Macgregor; Karen Rae; Georgina M. Rosair; Volker Settels; Alan J. Welch; Bruce E. Hodson; Thomas D. McGrath; F. Gordon A. Stone","The Conformations of 13-Vertex ML~2~C~2~B~10~ Metallacarboranes: Experimental and Computational Studies","Journal of the American Chemical Society","2007","129","","3302","3314","10.1021/ja067698m","","","0.71073","MoKα","","0.0601","0.0439","","","0.1156","0.1199","","","","","","0.998","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109176","9.786","0.002","10.909","0.002","12.179","0.002","78.41","0.03","71.61","0.03","73.43","0.03","1173.7","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H27 N3 O7 Ti -","- C23 H27 N3 O7 Ti -","- C46 H54 N6 O14 Ti2 -","2","1","","Arthur D. Tinoco; Christopher D. Incarvito; Ann M. Valentine","Calorimetric, Spectroscopic, and Model Studies Provide Insight into the Transport of Ti(IV) by Human Serum Transferrin","Journal of the American Chemical Society","2007","129","","3444","3454","10.1021/ja068149j","","","0.71073","MoKα","","0.0932","0.0494","","","0.1162","0.1326","","","","","","1.004","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109177","38.1126","0.0017","25.3743","0.0011","27.1887","0.0012","90","","90","","90","","26294","2","150","2","150","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","","","- C76 H90 Mn5 N O42 Sb12 -","- C75.88 H62.9 Mn5 N O42 Sb12 -","- C607.04 H503.2 Mn40 N8 O336 Sb96 -","8","1","","Viswanathan Baskar; Maheswaran Shanmugam; Madeleine Helliwell; Simon J. Teat; Richard E. P. Winpenny","Reverse-Keggin Ions: Polycondensation of Antimonate Ligands Give Inorganic Cryptand","Journal of the American Chemical Society","2007","129","","3042","3043","10.1021/ja068214p","","","0.6709","synchrotron","","0.0824","0.0613","","","0.1852","0.2058","","","","","","1.083","","","","has coordinates,has disorder","178837","2020-10-21","18:00:00",""
"4109178","19.397","0.004","25.825","0.005","22.624","0.005","90","","101.24","0.03","90","","11116","4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C83 H84 Mn5 N4 O38 Sb12 -","- C82.88 H73.9 Mn5 N4 O38 Sb12 -","- C331.52 H295.6 Mn20 N16 O152 Sb48 -","4","1","","Viswanathan Baskar; Maheswaran Shanmugam; Madeleine Helliwell; Simon J. Teat; Richard E. P. Winpenny","Reverse-Keggin Ions: Polycondensation of Antimonate Ligands Give Inorganic Cryptand","Journal of the American Chemical Society","2007","129","","3042","3043","10.1021/ja068214p","","","0.71073","MoKα","","0.0812","0.0663","","","0.195","0.2095","","","","","","1.043","","","","has coordinates,has disorder","178837","2020-10-21","18:00:00",""
"4109179","31.874","0.007","17.852","0.004","28.471","0.006","90","","118.117","0.004","90","","14289","5","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C151 H204.5 N27.5 Na6 O49 Sb16 -","- C100 H86 N2 Na6 O48 Sb16 -","- C400 H344 N8 Na24 O192 Sb64 -","4","0.5","","Viswanathan Baskar; Maheswaran Shanmugam; Madeleine Helliwell; Simon J. Teat; Richard E. P. Winpenny","Reverse-Keggin Ions: Polycondensation of Antimonate Ligands Give Inorganic Cryptand","Journal of the American Chemical Society","2007","129","","3042","3043","10.1021/ja068214p","","","0.71073","MoKα","","0.1378","0.0677","","","0.1646","0.1881","","","","","","0.883","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109180","19.2278","0.0012","21.1616","0.0014","29.4465","0.0019","104.844","0.001","100.519","0.001","96.959","0.001","11207.8","1.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C157 H163.5 N6.5 Na9 O82.5 Sb24 -","- C157 H139.5 N6.5 Na9 O80.75 Sb24 -","- C314 H279 N13 Na18 O161.5 Sb48 -","2","1","","Viswanathan Baskar; Maheswaran Shanmugam; Madeleine Helliwell; Simon J. Teat; Richard E. P. Winpenny","Reverse-Keggin Ions: Polycondensation of Antimonate Ligands Give Inorganic Cryptand","Journal of the American Chemical Society","2007","129","","3042","3043","10.1021/ja068214p","","","0.71073","MoKα","","0.0972","0.0673","","","0.1648","0.1823","","","","","","1.068","","","","has coordinates,has disorder","286259","2023-09-07","06:04:30",""
"4109181","10.1041","0.0007","15.006","0.0009","10.2928","0.0006","90","","99.521","0.003","90","","1539.12","0.17","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H18 Cl N O2 Os -","- C16 H18 Cl N O2 Os -","- C64 H72 Cl4 N4 O8 Os4 -","4","1","","Anna F. A. Peacock; Simon Parsons; Peter J. Sadler","Tuning the Hydrolytic Aqueous Chemistry of Osmium Arene Complexes with N,O-Chelating Ligands to Achieve Cancer Cell Cytotoxicity","Journal of the American Chemical Society","2007","129","","3348","3357","10.1021/ja068335p","","","0.71073","MoKα","","0.0425","0.0333","","0.0873","0.0829","0.0873","","","","","","0.7603","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109182","10.5949","0.0003","13.274","0.0003","12.2343","0.0003","90","","102.031","0.001","90","","1682.8","0.07","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H20 Cl N O Os -","- C19 H20 Cl N O Os -","- C76 H80 Cl4 N4 O4 Os4 -","4","1","","Anna F. A. Peacock; Simon Parsons; Peter J. Sadler","Tuning the Hydrolytic Aqueous Chemistry of Osmium Arene Complexes with N,O-Chelating Ligands to Achieve Cancer Cell Cytotoxicity","Journal of the American Chemical Society","2007","129","","3348","3357","10.1021/ja068335p","","","0.71073","MoKα","","0.0244","0.0202","","0.0509","0.0493","0.0509","","","","","","0.8769","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109183","19.0626","0.0003","8.4908","0.0001","16.3786","0.0003","90","","90","","90","","2650.99","0.07","150","","150","","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C23 H27 F6 N6 O3 Os P -","- C23 H27 F6 N6 O3 Os P -","- C92 H108 F24 N24 O12 Os4 P4 -","4","1","","Anna F. A. Peacock; Simon Parsons; Peter J. Sadler","Tuning the Hydrolytic Aqueous Chemistry of Osmium Arene Complexes with N,O-Chelating Ligands to Achieve Cancer Cell Cytotoxicity","Journal of the American Chemical Society","2007","129","","3348","3357","10.1021/ja068335p","","","0.71073","MoKα","","0.0433","0.0334","","0.0805","0.0779","0.0805","","","","","","0.7572","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109184","12.2879","0.0004","15.9787","0.0005","15.1512","0.0005","90","","98.317","0.002","90","","2943.57","0.17","150","2","150","2","","","","","","","Anna Peacock AFAP63","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H32 F6 N6 O2.5 Os P -","- C25 H32 F6 N6 O2.5 Os P -","- C100 H128 F24 N24 O10 Os4 P4 -","4","1","","Anna F. A. Peacock; Simon Parsons; Peter J. Sadler","Tuning the Hydrolytic Aqueous Chemistry of Osmium Arene Complexes with N,O-Chelating Ligands to Achieve Cancer Cell Cytotoxicity","Journal of the American Chemical Society","2007","129","","3348","3357","10.1021/ja068335p","","","0.71073","MoKα","","0.0594","0.0444","","","0.1086","0.1118","","","","","","1.114","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4109185","14.449","","17.506","","23.235","","103.57","","100.73","","105.18","","5318.23","","153","2","153","2","","","","","","","synthesis as described","3","P -1","-P 1","2","","C60C6H4CCSiMe3_5_Me","","- C130 H84 Si5 -","- C130 H84 Si5 -","- C260 H168 Si10 -","2","1","","Yu-Wu Zhong; Yutaka Matsuo; Eiichi Nakamura","Lamellar Assembly of Conical Molecules Possessing a Fullerene Apex in Crystals and Liquid Crystals","Journal of the American Chemical Society","2007","129","","3052","3053","10.1021/ja068780k","","x-ray","0.71073","MoKα","","0.2962","0.1777","","","0.4183","0.4836","","","","","","1.304","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109186","18.546","","17.643","","32.427","","90","","100.44","","90","","10434.7","","153","2","153","2","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","","C60(C6H4CCSiMe2Bu)5Me","","- C131 H98 Si5 -","- C131 H98 Si5 -","- C524 H392 Si20 -","4","1","","Yu-Wu Zhong; Yutaka Matsuo; Eiichi Nakamura","Lamellar Assembly of Conical Molecules Possessing a Fullerene Apex in Crystals and Liquid Crystals","Journal of the American Chemical Society","2007","129","","3052","3053","10.1021/ja068780k","","x-ray","0.71073","MoKα","","0.2582","0.182","","","0.4432","0.5014","","","","","","1.598","","","","has coordinates,has disorder","178837","2020-10-21","18:00:00",""
"4109187","14.347","0.0007","6.471","0.0003","76.54","0.003","90","","92.998","0.004","90","","7096.2","0.6","297","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H6 I2 N Ni2 S20 -","- C18 H6 I2 N Ni2 S20 -","- C144 H48 I16 N8 Ni16 S160 -","8","1","","Yosuke Kosaka; Hiroshi M. Yamamoto; Akiko Nakao; Masafumi Tamura; Reizo Kato","Coexistence of Conducting and Magnetic Electrons Based on Molecular π-Electrons in the Supramolecular Conductor (Me-3,5-DIP)[Ni(dmit)2]2","Journal of the American Chemical Society","2007","129","","3054","3055","10.1021/ja0687825","","","0.7107","MoKα","","","0.0635","","","","0.1857","","","","","","1.048","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109188","7.7032","0.0005","8.2335","0.0005","20.6614","0.0013","90","","90","","90","","1310.43","0.14","193","2","193","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6-methyl-1-phenyl-7-vinyl-8-oxabicyclo[3.2.1]octane","","- C16 H20 O -","- C16 H20 O -","- C64 H80 O4 -","4","1","","Feng Peng; Dennis G. Hall","Simple, Stable, and Versatile Double-Allylation Reagents for the Stereoselective Preparation of Skeletally Diverse Compounds","Journal of the American Chemical Society","2007","129","","3070","3071","10.1021/ja068985t","","","0.71073","MoKα","","0.0359","0.0321","","","0.0786","0.0812","","","","","","1.084","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109189","11.45","0.0004","16.02","0.0005","20.61","0.0007","84.88","0.0019","80.9","0.002","82.22","0.002","3689.6","0.2","100","2","100","2","","","","","","","synthesized","4","P -1","-P 1","2","","","","- C89 H97 B6 Ir2 -","- C83 H82 B6 Ir2 -","- C166 H164 B12 Ir4 -","2","1","","Frédéric de Montigny; Ramón Macias; Bruce C. Noll; Thomas P. Fehlner; Karine Costuas; Jean-Yves Saillard; Jean-François Halet","Metallaborane Reactivity. A Stoichiometric Mechanism for the Insertion of Two Alkynes into an Iridaborane Framework via a Disposable Molybdenum Chaperone","Journal of the American Chemical Society","2007","129","","3392","3401","10.1021/ja068999z","","x-ray","0.71073","MoKα","","0.063","0.0394","","","0.0863","0.0945","","","","","","0.981","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109190","13.834","0.0017","15.171","0.002","18.296","0.003","108.04","0.016","101.599","0.016","108.211","0.015","3274.2","1.1","190","2","190","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H74 Fe P2 Pt S6 -","- C72 H63 Fe P2 Pt S6.524 -","- C144 H126 Fe2 P4 Pt2 S13.048 -","2","1","","Fan Zhang; Peter Bäuerle","A Controlled Approach to Well-Defined Oligothiophenes via Oxidatively Induced Reductive Elimination of Stable Pt(II) Oligothienyl Complexes","Journal of the American Chemical Society","2007","129","","3090","3091","10.1021/ja070083k","","","0.71073","MoKα","","0.1073","0.0536","","","0.1077","0.1224","","","","","","0.81","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109191","10.3506","0.0012","16.2481","0.0018","12.9422","0.0015","90","","107.794","0.002","90","","2072.5","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","06276","","","- C24 H31 N3 O4 -","- C24 H31 N3 O4 -","- C96 H124 N12 O16 -","4","1","","Barry M. Trost; Nicolai Cramer; Heiko Bernsmann","Concise Total Synthesis of (\±)-Marcfortine B","Journal of the American Chemical Society","2007","129","","3086","3087","10.1021/ja070142u","","","0.71073","MoKα","","0.0777","0.0458","","","0.1081","0.1282","","","","","","1.007","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109192","13.1473","0.0012","14.4545","0.0014","20.3119","0.0019","90","","103.38","0.002","90","","3755.3","0.6","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H48 N2 O10 Pd2 -","- C36 H48 N2 O10 Pd2 -","- C144 H192 N8 O40 Pd8 -","4","0.5","","Qingwei Yao; Mark Zabawa; Joyce Woo; Chong Zheng","Carbocyclic Carbene Ligands Derived from Aromatic Nitrones: Formation and Catalytic Activity of Their Pd(II) Complexes","Journal of the American Chemical Society","2007","129","","3088","3089","10.1021/ja0701659","","","0.71073","MoKα","","0.0313","0.0302","","","0.0628","0.0632","","","","","","1.413","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109193","9.439","0.0019","14.839","0.003","18.608","0.004","90","","90","","90","","2606.3","0.9","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H20 N2 O2 -","- C14 H20 N2 O2 -","- C112 H160 N16 O16 -","8","1","","Luke D. Elliott; Malcolm Berry; Andrew J. Orr-Ewing; Kevin I. Booker-Milburn","The Intramolecular Photometathesis of Pyrroles","Journal of the American Chemical Society","2007","129","","3078","3079","10.1021/ja070254l","","","0.71073","MoKα","","0.0868","0.0545","","","0.1116","0.1249","","","","","","1.021","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109194","12.6256","0.0017","17.061","0.002","17.386","0.002","90","","90","","90","","3745","0.8","180","2","180","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C24 H19 N3 Pt -","- C24 H19 N3 Pt -","- C192 H152 N24 Pt8 -","8","1","","Shu-Bin Zhao; Rui-Yao Wang; Suning Wang","Intramolecular C-H Activation Directed Self-Assembly of an Organoplatinum(II) Molecular Square","Journal of the American Chemical Society","2007","129","","3092","3093","10.1021/ja0702770","","","0.71073","MoKα","","0.0383","0.0309","","","0.0821","0.0898","","","","","","1","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109195","7.3661","0.0009","10.071","0.0012","10.636","0.0012","113.216","0.001","96.995","0.001","92.997","0.001","715.37","0.15","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H14 N4 Pt -","- C15 H14 N4 Pt -","- C30 H28 N8 Pt2 -","2","1","","Shu-Bin Zhao; Rui-Yao Wang; Suning Wang","Intramolecular C-H Activation Directed Self-Assembly of an Organoplatinum(II) Molecular Square","Journal of the American Chemical Society","2007","129","","3092","3093","10.1021/ja0702770","","","0.71073","MoKα","","0.0241","0.0213","","","0.0514","0.0526","","","","","","1","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109196","9.862","0.004","13.404","0.005","24.203","0.009","76.366","0.006","86.246","0.007","70.238","0.007","2926","2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C64 H56 N12 Pt4 -","- C64 H56 N12 Pt4 -","- C128 H112 N24 Pt8 -","2","1","","Shu-Bin Zhao; Rui-Yao Wang; Suning Wang","Intramolecular C-H Activation Directed Self-Assembly of an Organoplatinum(II) Molecular Square","Journal of the American Chemical Society","2007","129","","3092","3093","10.1021/ja0702770","","","0.71073","MoKα","","0.1191","0.0443","","","0.0508","0.0654","","","","","","0.639","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109197","27.932","0.006","11.207","0.002","15.052","0.003","90","","111.8","0.03","90","","4374.8","1.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H25 I Si2 -","- C21 H25 I Si2 -","- C168 H200 I8 Si16 -","8","1","","Chao Wang; Qian Luo; Hui Sun; Xiangyu Guo; Zhenfeng Xi","Lithio Siloles: Facile Synthesis and Applications","Journal of the American Chemical Society","2007","129","","3094","3095","10.1021/ja070404s","","","0.71073","MoKα","","0.053","0.0401","","","0.0935","0.0968","","","","","","1.013","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109198","10.2225","0.0006","11.5987","0.0007","12.5588","0.0006","83.651","0.002","74.953","0.002","75.664","0.002","1391.53","0.14","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H38 Br6 O4 P2 Re6 S6 -","- C36 H30 Br6 O4 P2 Re6 S6 -","- C36 H30 Br6 O4 P2 Re6 S6 -","1","0.5","","Michael A. Shestopalov; Yuri V. Mironov; Konstantin A. Brylev; Svetlana G. Kozlova; Vladimir E. Fedorov; Hartmut Spies; Hans-Jürgen Pietzsch; Holger Stephan; Gerhard Geipel; Gerd Bernhard","Cluster Core Controlled Reactions of Substitution of Terminal Bromide Ligands by Triphenylphosphine in Octahedral Rhenium Chalcobromide Complexes","Journal of the American Chemical Society","2007","129","","3714","3721","10.1021/ja0668062","","x-ray","0.71073","MoKα","","0.0833","0.0537","","","0.1625","0.1764","","","","","","1.043","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109199","12.4001","0.0003","16.1927","0.0004","19.1937","0.0005","90","","101.78","0.001","90","","3772.76","0.16","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C72 H60 Br2 P4 Re6 S8 -","- C72 H60 Br2 P4 Re6 S8 -","- C144 H120 Br4 P8 Re12 S16 -","2","0.5","","Michael A. Shestopalov; Yuri V. Mironov; Konstantin A. Brylev; Svetlana G. Kozlova; Vladimir E. Fedorov; Hartmut Spies; Hans-Jürgen Pietzsch; Holger Stephan; Gerhard Geipel; Gerd Bernhard","Cluster Core Controlled Reactions of Substitution of Terminal Bromide Ligands by Triphenylphosphine in Octahedral Rhenium Chalcobromide Complexes","Journal of the American Chemical Society","2007","129","","3714","3721","10.1021/ja0668062","","x-ray","0.71073","MoKα","","0.0438","0.0303","","","0.0747","0.079","","","","","","1.097","","","","has coordinates","178837","2020-10-21","18:00:00",""
"4109200","12.3444","0.0002","16.2377","0.0004","19.5427","0.0004","90","","102.103","0.001","90","","3830.16","0.14","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C72 H60 Br2 P4 Re6 Se8 -","- C72 H60 Br2 P4 Re6 Se8 -","- C144 H120 Br4 P8 Re12 Se16 -","2","0.5","","Michael A. Shestopalov; Yuri V. Mironov; Konstantin A. Brylev; Svetlana G. Kozlova; Vladimir E. Fedorov; Hartmut Spies; Hans-Jürgen Pietzsch; Holger Stephan; Gerhard Geipel; Gerd Bernhard","Cluster Core Controlled Reactions of Substitution of Terminal Bromide Ligands by Triphenylphosphine in Octahedral Rhenium Chalcobromide Complexes","Journal of the American Chemical Society","2007","129","","3714","3721","10.1021/ja0668062","","x-ray","0.71073","MoKα","","0.0503","0.0321","","","0.0744","0.0798","","","","","","1.071","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109201","11.6455","0.0003","14.8271","0.0004","20.1655","0.0005","76.738","0.001","74.951","0.001","67.853","0.001","3080.6","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H45 Br4 P3 Re6 S7 -","- C54 H45 Br4 P3 Re6 S7 -","- C108 H90 Br8 P6 Re12 S14 -","2","1","","Michael A. Shestopalov; Yuri V. Mironov; Konstantin A. Brylev; Svetlana G. Kozlova; Vladimir E. Fedorov; Hartmut Spies; Hans-Jürgen Pietzsch; Holger Stephan; Gerhard Geipel; Gerd Bernhard","Cluster Core Controlled Reactions of Substitution of Terminal Bromide Ligands by Triphenylphosphine in Octahedral Rhenium Chalcobromide Complexes","Journal of the American Chemical Society","2007","129","","3714","3721","10.1021/ja0668062","","x-ray","0.71073","MoKα","","0.0471","0.0313","","","0.0885","0.0947","","","","","","1.08","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109202","11.6642","0.0016","14.88","0.002","20.446","0.004","77.159","0.005","75.012","0.004","67.931","0.005","3145.6","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H45 Br4 P3 Re6 Se7 -","- C54 H45 Br4 P3 Re6 Se7 -","- C108 H90 Br8 P6 Re12 Se14 -","2","1","","Michael A. Shestopalov; Yuri V. Mironov; Konstantin A. Brylev; Svetlana G. Kozlova; Vladimir E. Fedorov; Hartmut Spies; Hans-Jürgen Pietzsch; Holger Stephan; Gerhard Geipel; Gerd Bernhard","Cluster Core Controlled Reactions of Substitution of Terminal Bromide Ligands by Triphenylphosphine in Octahedral Rhenium Chalcobromide Complexes","Journal of the American Chemical Society","2007","129","","3714","3721","10.1021/ja0668062","","x-ray","0.71073","MoKα","","0.0601","0.0341","","","0.0927","0.1025","","","","","","0.913","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109203","10.302","0.002","20.292","0.004","12.108","0.002","90","","105.38","0.03","90","","2440.5","0.9","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C36 H30 Br6 P2 Re6 S6 -","- C36 H30 Br6 P2 Re6 S6 -","- C72 H60 Br12 P4 Re12 S12 -","2","0.5","","Michael A. Shestopalov; Yuri V. Mironov; Konstantin A. Brylev; Svetlana G. Kozlova; Vladimir E. Fedorov; Hartmut Spies; Hans-Jürgen Pietzsch; Holger Stephan; Gerhard Geipel; Gerd Bernhard","Cluster Core Controlled Reactions of Substitution of Terminal Bromide Ligands by Triphenylphosphine in Octahedral Rhenium Chalcobromide Complexes","Journal of the American Chemical Society","2007","129","","3714","3721","10.1021/ja0668062","","","0.71073","MoKα","","0.2121","0.07","","","0.1575","0.1934","","","","","","0.789","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109204","16.408","0.0005","11.501","0.0005","17.164","0.0006","90","","107.08","0.002","90","","3096.1","0.2","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","SMK001","SMK001","","- C34 H48 N2 Pt -","- C34 H48 N2 Pt -","- C136 H192 N8 Pt4 -","4","1","","Susan M. Kloek; Karen I. Goldberg","Competitive C-H Bond Activation and β-Hydride Elimination at Platinum(II)","Journal of the American Chemical Society","2007","129","","3460","3461","10.1021/ja0669629","","","0.71073","MoKα","","0.1044","0.0422","","","0.0667","0.0794","","","","","","0.938","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109205","15.137","0.0007","9.235","0.0002","23.225","0.001","90","","91.05","0.0014","90","","3246.1","0.2","130","2","130","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","SMK002","SMK002","","- C38 H46 N2 Pt -","- C38 H46 N2 Pt -","- C152 H184 N8 Pt4 -","4","1","","Susan M. Kloek; Karen I. Goldberg","Competitive C-H Bond Activation and β-Hydride Elimination at Platinum(II)","Journal of the American Chemical Society","2007","129","","3460","3461","10.1021/ja0669629","","","0.71073","MoKα","","0.0932","0.0432","","","0.0873","0.096","","","","","","0.997","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109206","8.7819","0.0004","13.9862","0.0006","11.0182","0.0006","90","","128.476","0.002","90","","1059.47","0.09","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C2 H3 F2 N O Xe -","- C2 H3 F2 N O Xe -","- C16 H24 F16 N8 O8 Xe8 -","8","2","","David S. Brock; Vural Bilir; Hélène P. A. Mercier; Gary J. Schrobilgen","XeOF2, F2OXeN\τbCCH3, and XeOF2.nHF: Rare Examples of Xe(IV) Oxide Fluorides","Journal of the American Chemical Society","2007","129","","3598","3611","10.1021/ja0673480","","","0.71073","MoKα","","0.0428","0.0299","","","0.0642","0.0675","","","","","","1.4","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109207","18.452","0.006","18.452","0.006","44.933","0.006","90","0.011","90","0.011","120","0.011","13249","7","573","2","573","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- C24 H12 O13 Zn4 -","- C24 H12 O13 Zn4 -","- C288 H144 O156 Zn48 -","12","0.333333","","Jasmina Hafizovic; Morten Bjørgen; Unni Olsbye; Pascal D. C. Dietzel; Silvia Bordiga; Carmelo Prestipino; Carlo Lamberti; Karl Petter Lillerud","The Inconsistency in Adsorption Properties and Powder XRD Data of MOF-5 Is Rationalized by Framework Interpenetration and the Presence of Organic and Inorganic Species in the Nanocavities","Journal of the American Chemical Society","2007","129","","3612","3620","10.1021/ja0675447","","","0.38745","Synchrotron","","0.0685","0.0374","","","0.0898","0.1201","","","","","","1.163","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109208","18.382","0.012","18.382","0.012","44.97","0.02","90","","90","","120","","13159","13","293","2","293","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- C24 H12 O13 Zn4 -","- C24 H12 O13 Zn4 -","- C288 H144 O156 Zn48 -","12","0.333333","","Jasmina Hafizovic; Morten Bjørgen; Unni Olsbye; Pascal D. C. Dietzel; Silvia Bordiga; Carmelo Prestipino; Carlo Lamberti; Karl Petter Lillerud","The Inconsistency in Adsorption Properties and Powder XRD Data of MOF-5 Is Rationalized by Framework Interpenetration and the Presence of Organic and Inorganic Species in the Nanocavities","Journal of the American Chemical Society","2007","129","","3612","3620","10.1021/ja0675447","","","0.38745","Synchrotron","","0.0634","0.0575","","","0.1343","0.1421","","","","","","1.089","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109209","18.406","0.003","18.406","0.003","44.75","0.009","90","","90","","120","","13129","4","293","2","293","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- C24 H12 O13 Zn4 -","- C24 H12 O13 Zn4 -","- C144 H72 O78 Zn24 -","6","0.166667","","Jasmina Hafizovic; Morten Bjørgen; Unni Olsbye; Pascal D. C. Dietzel; Silvia Bordiga; Carmelo Prestipino; Carlo Lamberti; Karl Petter Lillerud","The Inconsistency in Adsorption Properties and Powder XRD Data of MOF-5 Is Rationalized by Framework Interpenetration and the Presence of Organic and Inorganic Species in the Nanocavities","Journal of the American Chemical Society","2007","129","","3612","3620","10.1021/ja0675447","","","0.71073","MoKα","","0.11","0.0823","","","0.224","0.2401","","","","","","1.1","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109210","16.6883","0.0009","17.6585","0.0009","24.283","0.0013","90","","90","","90","","7156","0.7","273","2","273","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C22 H36 Cl Fe3 N2 O23 -","- C22 H28 Cl Fe3 N2 O23 -","- C176 H224 Cl8 Fe24 N16 O184 -","8","1","","Sabbani Supriya; Samar K. Das","Reversible Single Crystal to Single Crystal Transformation through Fe-O(H)Me/Fe-OH2 Bond Formation/Bond Breaking in a Gas-Solid Reaction at an Ambient Condition","Journal of the American Chemical Society","2007","129","","3464","3465","10.1021/ja067572p","","","0.71073","MoKα","","0.0629","0.0443","","","0.1181","0.1253","","","","","","0.962","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109211","17.0064","0.0012","17.4079","0.0012","23.9382","0.0017","90","","90","","90","","7086.8","0.9","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C23 H38 Cl Fe3 N2 O23 -","- C23 H31 Cl Fe3 N2 O23 -","- C184 H248 Cl8 Fe24 N16 O184 -","8","1","","Sabbani Supriya; Samar K. Das","Reversible Single Crystal to Single Crystal Transformation through Fe-O(H)Me/Fe-OH2 Bond Formation/Bond Breaking in a Gas-Solid Reaction at an Ambient Condition","Journal of the American Chemical Society","2007","129","","3464","3465","10.1021/ja067572p","","","0.71073","MoKα","","0.0765","0.0481","","","0.1199","0.1449","","","","","","1.084","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109212","16.6966","0.001","17.6462","0.0011","24.2991","0.0015","90","","90","","90","","7159.3","0.8","273","2","273","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C22 H36 Cl Fe3 N2 O23 -","- C22 H28 Cl Fe3 N2 O23 -","- C176 H224 Cl8 Fe24 N16 O184 -","8","1","","Sabbani Supriya; Samar K. Das","Reversible Single Crystal to Single Crystal Transformation through Fe-O(H)Me/Fe-OH2 Bond Formation/Bond Breaking in a Gas-Solid Reaction at an Ambient Condition","Journal of the American Chemical Society","2007","129","","3464","3465","10.1021/ja067572p","","","0.71073","MoKα","","0.1276","0.0575","","","0.1374","0.1771","","","","","","1.057","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109213","11.216","0.004","12.711","0.006","14.318","0.005","95.62","0.03","106.15","0.03","91.1","0.03","1949","1.4","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H42 B9 Cl Os P2 -","- C38 H42 B9 Cl Os P2 -","- C76 H84 B18 Cl2 Os2 P4 -","2","1","","Elena V. Balagurova; Dmitri N. Cheredilin; Galina D. Kolomnikova; Oleg L. Tok; Fedor M. Dolgushin; Alexander I. Yanovsky; Igor T. Chizhevsky","Stable exo-nido-Metallacarboranes (M = OsIV) that Incorporatemeta-Carborane-Based Dicarbollide Ligands","Journal of the American Chemical Society","2007","129","","3745","3753","10.1021/ja067838s","","","0.71073","MoKα","","0.0623","0.0391","","","0.086","0.0908","","","","","","1.02","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4109214","12.819","0.003","12.963","0.003","13.787","0.003","75.405","0.016","62.997","0.015","69.875","0.016","1904","0.8","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H43 B9 Os P2 -","- C38 H43 B9 Os P2 -","- C76 H86 B18 Os2 P4 -","2","1","","Elena V. Balagurova; Dmitri N. Cheredilin; Galina D. Kolomnikova; Oleg L. Tok; Fedor M. Dolgushin; Alexander I. Yanovsky; Igor T. Chizhevsky","Stable exo-nido-Metallacarboranes (M = OsIV) that Incorporatemeta-Carborane-Based Dicarbollide Ligands","Journal of the American Chemical Society","2007","129","","3745","3753","10.1021/ja067838s","","","0.71073","MoKα","","0.116","0.0589","","","0.0795","0.0865","","","","","","1.065","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4109215","9.5182","0.0009","10.1237","0.001","19.7856","0.0019","80.437","0.002","78.666","0.002","80.784","0.002","1827.3","0.3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H43 B9 Os P2 -","- C38 H43 B9 Os P2 -","- C76 H86 B18 Os2 P4 -","2","1","","Elena V. Balagurova; Dmitri N. Cheredilin; Galina D. Kolomnikova; Oleg L. Tok; Fedor M. Dolgushin; Alexander I. Yanovsky; Igor T. Chizhevsky","Stable exo-nido-Metallacarboranes (M = OsIV) that Incorporatemeta-Carborane-Based Dicarbollide Ligands","Journal of the American Chemical Society","2007","129","","3745","3753","10.1021/ja067838s","","","0.71073","MoKα","","0.0729","0.0585","","","0.1162","0.1194","","","","","","0.887","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4109216","23.268","0.003","23.268","0.003","10.831","0.002","90","","90","","120","","5078.3","1.3","100","2","100","2","","","","","","","","5","P 61","P 61","169","","","","- C38 H31 N3 O4 Pd -","- C38 H31 N3 O4 Pd -","- C228 H186 N18 O24 Pd6 -","6","1","","Vadim A. Soloshonok; Hisanori Ueki; Jason L. Moore; Trevor K. Ellis","Design and Synthesis of Molecules with Switchable Chirality via Formation and Cleavage of Metal-Ligand Coordination Bonds","Journal of the American Chemical Society","2007","129","","3512","3513","10.1021/ja067995r","","","0.71073","MoKα","","0.0465","0.045","","","0.1294","0.1304","","","","","","1.092","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109217","8.594","0.002","13.463","0.003","15.7","0.004","85.732","0.003","78.608","0.003","80.402","0.003","1754.2","0.7","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H37 N3 Ni O6 -","- C41 H37 N3 Ni O6 -","- C82 H74 N6 Ni2 O12 -","2","1","","Vadim A. Soloshonok; Hisanori Ueki; Jason L. Moore; Trevor K. Ellis","Design and Synthesis of Molecules with Switchable Chirality via Formation and Cleavage of Metal-Ligand Coordination Bonds","Journal of the American Chemical Society","2007","129","","3512","3513","10.1021/ja067995r","","","0.71073","MoKα","","0.123","0.0872","","","0.2481","0.2779","","","","","","1.006","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109218","7.9498","0.001","23.927","0.003","15.737","0.002","90","","101.628","0.005","90","","2932","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H29 N3 O4 Pd -","- C37 H29 N3 O4 Pd -","- C148 H116 N12 O16 Pd4 -","4","1","","Vadim A. Soloshonok; Hisanori Ueki; Jason L. Moore; Trevor K. Ellis","Design and Synthesis of Molecules with Switchable Chirality via Formation and Cleavage of Metal-Ligand Coordination Bonds","Journal of the American Chemical Society","2007","129","","3512","3513","10.1021/ja067995r","","","0.71073","MoKα","","0.0419","0.0293","","","0.0661","0.071","","","","","","1.001","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109219","9.7132","0.0006","12.2015","0.0007","17.9219","0.001","90","","90","","90","","2124","0.2","128","2","128","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H25 Cl N2 O6 -","- C18 H25 Cl N2 O6 -","- C72 H100 Cl4 N8 O24 -","4","1","","Anand Singh; Ryan A. Yoder; Bo Shen; Jeffrey N. Johnston","Chiral Proton Catalysis: Enantioselective Brønsted Acid Catalyzed Additions of Nitroacetic Acid Derivatives as Glycine Equivalents","Journal of the American Chemical Society","2007","129","","3466","3467","10.1021/ja068073r","","","0.71073","MoKα","","0.0692","0.0461","","","0.0938","0.1033","","","","","","0.847","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109220","11.8206","0.0002","12.8609","0.0003","14.8464","0.0004","73.701","0.001","88.331","0.001","64.804","0.001","1949.55","0.08","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H36 N4 O6 U -","- C46 H36 N4 O6 U -","- C92 H72 N8 O12 U2 -","2","1","","Massimo Cametti; Maija Nissinen; Antonella Dalla Cort; Luigi Mandolini; Kari Rissanen","Ion Pair Recognition of Quaternary Ammonium and Iminium Salts by Uranyl-Salophen Compounds in Solution and in the Solid State","Journal of the American Chemical Society","2007","129","","3641","3648","10.1021/ja068561z","","","0.71069","MoKα","","0.0441","0.0356","","","0.0776","0.0814","","","","","","1.065","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109221","35.56","0.001","9.6555","0.0003","24.1012","0.0008","90","","112.397","0.002","90","","7650.9","0.4","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Compound X","","","- C42 H37 Br N4 O6 U -","- C42 H37 Br N4 O6 U -","- C336 H296 Br8 N32 O48 U8 -","8","1","","Massimo Cametti; Maija Nissinen; Antonella Dalla Cort; Luigi Mandolini; Kari Rissanen","Ion Pair Recognition of Quaternary Ammonium and Iminium Salts by Uranyl-Salophen Compounds in Solution and in the Solid State","Journal of the American Chemical Society","2007","129","","3641","3648","10.1021/ja068561z","","","0.71069","MoKα","","0.1126","0.0729","","","0.1458","0.1606","","","","","","1.143","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109222","12.3021","0.0001","16.8778","0.0002","26.4855","0.0003","72.561","0.0004","84.5141","0.0006","75.4356","0.0006","5076.67","0.09","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Compound X","","","- C106 H104 Cl2 N10 O16 U2 -","- C106 H104 Cl2 N10 O16 U2 -","- C212 H208 Cl4 N20 O32 U4 -","2","1","","Massimo Cametti; Maija Nissinen; Antonella Dalla Cort; Luigi Mandolini; Kari Rissanen","Ion Pair Recognition of Quaternary Ammonium and Iminium Salts by Uranyl-Salophen Compounds in Solution and in the Solid State","Journal of the American Chemical Society","2007","129","","3641","3648","10.1021/ja068561z","","","0.71073","MoKα","","0.0641","0.0467","","","0.1053","0.1137","","","","","","1.052","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109223","54.1597","0.0007","54.16","","33.1332","0.0002","90","","90","","120","","84168.4","1.2","173","2","173","2","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","","","- C198.33 H194.5 Cl5.33 N17.83 O24 U4 -","- C198.333 H194.49 Cl5.33333 N17.8333 O24 U4 -","- C3570 H3500.82 Cl96 N321 O432 U72 -","18","1","","Massimo Cametti; Maija Nissinen; Antonella Dalla Cort; Luigi Mandolini; Kari Rissanen","Ion Pair Recognition of Quaternary Ammonium and Iminium Salts by Uranyl-Salophen Compounds in Solution and in the Solid State","Journal of the American Chemical Society","2007","129","","3641","3648","10.1021/ja068561z","","","0.71073","MoKα","","0.0657","0.0451","","","0.0857","0.0951","","","","","","1.049","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109224","22.5983","0.0005","22.5983","0.0005","25.7313","0.0005","90","","90","","120","","11380","0.4","173","2","173","2","","","","","","","","6","R -3 :H","-R 3","148","Compound X","","","- C24.67 H27 Cl N3.33 O4 U -","- C24.6667 H26.99 Cl N3.33333 O4 U -","- C444 H485.82 Cl18 N60 O72 U18 -","18","1","","Massimo Cametti; Maija Nissinen; Antonella Dalla Cort; Luigi Mandolini; Kari Rissanen","Ion Pair Recognition of Quaternary Ammonium and Iminium Salts by Uranyl-Salophen Compounds in Solution and in the Solid State","Journal of the American Chemical Society","2007","129","","3641","3648","10.1021/ja068561z","","","0.71073","MoKα","","0.0637","0.0499","","","0.0931","0.0969","","","","","","1.276","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109225","11.5313","0.0007","16.3368","0.0009","13.0762","0.0008","90","","96.958","0.001","90","","2445.2","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","9-ally adenine AgNO3 salt at pH 8.3","","","- C16 H21 Ag2 N13 O6 -","- C16 H21 Ag2 N13 O6 -","- C64 H84 Ag8 N52 O24 -","4","1","","Chandra Shekhar Purohit; Sandeep Verma","Patterned Deposition of a Mixed-Coordination Adenine-Silver Helicate, Containing a π-Stacked Metallacycle, on a Graphite Surface","Journal of the American Chemical Society","2007","129","","3488","3489","10.1021/ja068892b","","","0.71073","MoKα","","0.0678","0.0481","","","0.1094","0.1668","","","","","","1.181","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109226","10.621","0.005","6.786","0.003","11.033","0.005","90","","105.688","0.008","90","","765.6","0.6","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H26 O2 -","- C16 H26 O2 -","- C32 H52 O4 -","2","0.5","","Sergiy V. Rosokha; Jay K. Kochi","Continuum of Outer- and Inner-Sphere Mechanisms for Organic Electron Transfer. Steric Modulation of the Precursor Complex in Paramagnetic (Ion-Radical) Self-Exchanges","Journal of the American Chemical Society","2007","129","","3683","3697","10.1021/ja069149m","","","0.71073","MoKα","","0.1172","0.0618","","","0.1474","0.1796","","","","","","0.979","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109227","9.466","0.004","9.92","0.004","10.639","0.005","106.772","0.009","106.409","0.008","95.298","0.009","901","0.7","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H62 B11 O2 -","- C29 H62 B11 O2 -","- C29 H62 B11 O2 -","1","0.5","","Sergiy V. Rosokha; Jay K. Kochi","Continuum of Outer- and Inner-Sphere Mechanisms for Organic Electron Transfer. Steric Modulation of the Precursor Complex in Paramagnetic (Ion-Radical) Self-Exchanges","Journal of the American Chemical Society","2007","129","","3683","3697","10.1021/ja069149m","","","0.71073","MoKα","","0.1122","0.0709","","","0.1749","0.1955","","","","","","1.231","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109228","13.1118","0.0015","16.378","0.002","18.01","0.002","99.396","0.002","110.047","0.003","102.147","0.003","3433.2","0.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","[(benzo-15-crown-5)2 K] (DDQ)3, (CH2Cl2)x","Bis(benzo-15-crown-5) potassium dichlorodicyanobenzoquinonide, dichloromethane solvate","","- C56 H48 Cl14 K N6 O16 -","- C56 H48 Cl14 K N6 O16 -","- C112 H96 Cl28 K2 N12 O32 -","2","1","","Sergiy V. Rosokha; Jay K. Kochi","Continuum of Outer- and Inner-Sphere Mechanisms for Organic Electron Transfer. Steric Modulation of the Precursor Complex in Paramagnetic (Ion-Radical) Self-Exchanges","Journal of the American Chemical Society","2007","129","","3683","3697","10.1021/ja069149m","","","0.71073","MoKα","","0.1217","0.0692","","","0.1857","0.2073","","","","","","0.986","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109229","9.142","0.008","9.238","0.005","10.094","0.007","74.14","0.03","66.7","0.03","87.18","0.03","751.5","1","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H50 B11 O2 -","- C23 H50 B11 O2 -","- C23 H50 B11 O2 -","1","0.5","","Sergiy V. Rosokha; Jay K. Kochi","Continuum of Outer- and Inner-Sphere Mechanisms for Organic Electron Transfer. Steric Modulation of the Precursor Complex in Paramagnetic (Ion-Radical) Self-Exchanges","Journal of the American Chemical Society","2007","129","","3683","3697","10.1021/ja069149m","","","0.71073","MoKα","","0.1389","0.0708","","","0.1478","0.1779","","","","","","0.981","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109230","17.87","0.02","25.24","0.05","10.08","0.02","90","","90","","90","","4546","14","298","2","298","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","Dibutyl-N-propyl-PHTZ","2,7-Di-tert-butyl-N-isopropyl-phenothiazine","","- C23 H31 N S -","- C23 H31 N S -","- C184 H248 N8 S8 -","8","1","","Sergiy V. Rosokha; Jay K. Kochi","Continuum of Outer- and Inner-Sphere Mechanisms for Organic Electron Transfer. Steric Modulation of the Precursor Complex in Paramagnetic (Ion-Radical) Self-Exchanges","Journal of the American Chemical Society","2007","129","","3683","3697","10.1021/ja069149m","","","0.71073","MoKα","","0.1521","0.069","","","0.2121","0.2404","","","","","","0.947","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109231","13.88","0.03","12.98","0.03","27.59","0.04","90","","101.11","0.07","90","","4878","17","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C43 H75 B11 N S -","- C43 H75 B11 N S -","- C172 H300 B44 N4 S4 -","4","1","","Sergiy V. Rosokha; Jay K. Kochi","Continuum of Outer- and Inner-Sphere Mechanisms for Organic Electron Transfer. Steric Modulation of the Precursor Complex in Paramagnetic (Ion-Radical) Self-Exchanges","Journal of the American Chemical Society","2007","129","","3683","3697","10.1021/ja069149m","","","0.71073","MoKα","","0.151","0.0594","","","0.1338","0.1555","","","","","","0.829","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109232","9.1694","0.0012","19.703","0.003","17.61","0.003","90","","100.382","0.013","90","","3129.4","0.8","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","PhTZ Car * H2O","Phenothiazolium dodecamethylcarboranate hydrate","","- C25 H47 B11 N O S -","- C25 H47 B11 N O S -","- C100 H188 B44 N4 O4 S4 -","4","1","","Sergiy V. Rosokha; Jay K. Kochi","Continuum of Outer- and Inner-Sphere Mechanisms for Organic Electron Transfer. Steric Modulation of the Precursor Complex in Paramagnetic (Ion-Radical) Self-Exchanges","Journal of the American Chemical Society","2007","129","","3683","3697","10.1021/ja069149m","","","0.71073","MoKα","","0.0819","0.062","","","0.1823","0.1974","","","","","","0.881","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109233","19.334","0.007","9.643","0.004","13.568","0.005","90","","90.29","0.008","90","","2529.6","1.7","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H32 Cl6 N2 Sb -","- C18 H32 Cl6 N2 Sb -","- C72 H128 Cl24 N8 Sb4 -","4","0.5","","Sergiy V. Rosokha; Jay K. Kochi","Continuum of Outer- and Inner-Sphere Mechanisms for Organic Electron Transfer. Steric Modulation of the Precursor Complex in Paramagnetic (Ion-Radical) Self-Exchanges","Journal of the American Chemical Society","2007","129","","3683","3697","10.1021/ja069149m","","","0.71073","MoKα","","0.1728","0.0677","","","0.1402","0.1757","","","","","","0.932","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109234","20.338","0.002","7.5857","0.0008","12.0204","0.0013","90","","98.046","0.002","90","","1836.2","0.3","243","2","243","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H27 I O3 Si -","- C15 H27 I O3 Si -","- C60 H108 I4 O12 Si4 -","4","1","","Mingji Dai; Samuel J. Danishefsky","The Total Synthesis of Spirotenuipesines A and B","Journal of the American Chemical Society","2007","129","","3498","3499","10.1021/ja069164r","","","0.71073","MoKα","","0.0822","0.0416","","","0.0993","0.124","","","","","","1.078","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109235","10.5","0.002","10.555","0.002","13.766","0.003","68.292","0.004","82.567","0.004","77.468","0.003","1381.7","0.5","243","2","243","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H22 O4 -","- C14.999 H22 O4 -","- C59.996 H88 O16 -","4","2","","Mingji Dai; Samuel J. Danishefsky","The Total Synthesis of Spirotenuipesines A and B","Journal of the American Chemical Society","2007","129","","3498","3499","10.1021/ja069164r","","","0.71073","MoKα","","0.1674","0.0723","","","0.1622","0.2054","","","","","","1.02","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109236","24.044","0.008","14.343","0.004","16.688","0.005","90","","100.552","0.004","90","","5658","3","243.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H63 Fe2 N21 Ni3 O6 -","- C30 H51 Fe2 N21 Ni3 O6 -","- C120 H204 Fe8 N84 Ni12 O24 -","4","0.5","","Nobuhiro Yanai; Wakako Kaneko; Ko Yoneda; Masaaki Ohba; Susumu Kitagawa","Reversible Water-Induced Magnetic and Structural Conversion of a Flexible Microporous Ni(II)Fe(III) Ferromagnet","Journal of the American Chemical Society","2007","129","","3496","3497","10.1021/ja069166b","","","0.7107","MoKα","","","0.063","","","","0.205","","","","","","1.064","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109237","10.977","0.0003","13.1258","0.0004","16.0022","0.0005","78.884","0.001","74.41","0.001","73.186","0.001","2109.24","0.11","223","2","223","2","","","","","","","","6","P -1","-P 1","2","bis-phenyl dirhodium caprolactamate","Bis-phenyl di-rhodium(III) tetra-caprolactamate","","- C38 H54 Cl4 N4 O4 Rh2 -","- C38 H54 Cl4 N4 O4 Rh2 -","- C76 H108 Cl8 N8 O8 Rh4 -","2","1","","Jason M. Nichols; Joffrey Wolf; Peter Zavalij; Bindhu Varughese; Michael P. Doyle","Bis(phenyl)dirhodium(III) Caprolactamate: A Dinuclear Paddlewheel Complex with No Metal-Metal Bond","Journal of the American Chemical Society","2007","129","","3504","3505","10.1021/ja070122s","","","0.71073","MoKα","","0.0361","0.03","","","0.0661","0.0687","","","","","","1","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109238","9.371","0.0008","15.8919","0.0013","23.994","0.002","90","","97.408","0.002","90","","3543.4","0.5","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","dirhodium caprolactamate acetonitrile","Di-rhodium(II) tetra-caprolactamate tetra-acetonitrile","","- C32 H52 N8 O4 Rh2 -","- C32 H52 N8 O4 Rh2 -","- C128 H208 N32 O16 Rh8 -","4","1","","Jason M. Nichols; Joffrey Wolf; Peter Zavalij; Bindhu Varughese; Michael P. Doyle","Bis(phenyl)dirhodium(III) Caprolactamate: A Dinuclear Paddlewheel Complex with No Metal-Metal Bond","Journal of the American Chemical Society","2007","129","","3504","3505","10.1021/ja070122s","","","0.71073","MoKα","","0.0594","0.0429","","","0.0875","0.0923","","","","","","1","","","","has coordinates,has disorder","212012","2020-10-21","18:00:00",""
"4109239","24.663","0.004","7.1764","0.0013","21.213","0.004","90","","121.245","0.003","90","","3210","1","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","dirhodium caprolactamate hydrate triflate","Di-rhodium(II/III) tetra-caprolactamate dihydrate triflate","","- C25 H44 F3 N4 O9 Rh2 S -","- C25 H44 F3 N4 O9 Rh2 S -","- C100 H176 F12 N16 O36 Rh8 S4 -","4","0.5","","Jason M. Nichols; Joffrey Wolf; Peter Zavalij; Bindhu Varughese; Michael P. Doyle","Bis(phenyl)dirhodium(III) Caprolactamate: A Dinuclear Paddlewheel Complex with No Metal-Metal Bond","Journal of the American Chemical Society","2007","129","","3504","3505","10.1021/ja070122s","","","0.71073","MoKα","","0.0478","0.0372","","","0.077","0.0796","","","","","","1","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109240","5.5767","0.0013","8.914","0.002","33.679","0.008","90","","90","","90","","1674.2","0.7","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H17 Br O2 -","- C19 H17 Br O2 -","- C76 H68 Br4 O8 -","4","1","","Pei-Chen Chiang; Juthanat Kaeobamrung; Jeffrey W. Bode","Enantioselective, Cyclopentene-Forming Annulations via NHC-Catalyzed Benzoin-Oxy-Cope Reactions","Journal of the American Chemical Society","2007","129","","3520","3521","10.1021/ja0705543","","","0.71073","MoKα","","0.1713","0.0632","","","0.1297","0.1758","","","","","","1.207","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109241","9.371","0.0008","15.8919","0.0013","23.994","0.002","90","","97.408","0.002","90","","3543.4","0.5","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","dirhodium caprolactamate acetonitrile","Di-rhodium tetra-caprolactamate tetra-acetonitrile","","- C32 H52 N8 O4 Rh2 -","- C32 H52 N8 O4 Rh2 -","- C128 H208 N32 O16 Rh8 -","4","1","","Jason M. Nichols; Joffrey Wolf; Peter Zavalij; Bindhu Varughese; Michael P. Doyle","Bis(phenyl)dirhodium(III) Caprolactamate: A Dinuclear Paddlewheel Complex with No Metal-Metal Bond","Journal of the American Chemical Society","2007","129","","3504","3505","10.1021/ja070122s","","","","","","","","","","","","","","","","","","","4109238","","has coordinates,has disorder","215354","2020-10-21","18:00:00",""
"4109242","11.3726","0.0017","12.3542","0.0015","14.5292","0.0018","71.271","0.006","67.97","0.008","75.177","0.006","1770.7","0.4","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C45 H45 O Ti -","- C45 H45 O Ti -","- C90 H90 O2 Ti2 -","2","1","","Thomas A. Manz; Khamphee Phomphrai; Grigori Medvedev; Balachandra B. Krishnamurthy; Shalini Sharma; Jesmin Haq; Krista A. Novstrup; Kendall T. Thomson; W. Nicholas Delgass; James M. Caruthers; Mahdi M. Abu-Omar","Structure-Activity Correlation in Titanium Single-Site Olefin Polymerization Catalysts Containing Mixed Cyclopentadienyl/Aryloxide Ligation","Journal of the American Chemical Society","2007","129","","3776","3777","10.1021/ja0640849","","","0.71073","MO-Kα","","0.118","0.052","","","0.114","0.142","","","","","","0.902","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109243","10.475","0.002","22.938","0.005","9.1934","0.0018","90","","113.49","0.03","90","","2025.9","0.8","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H23 N O4 S -","- C21 H23 N O4 S -","- C84 H92 N4 O16 S4 -","4","2","","Jennifer M. Schomaker; Andrea R. Geiser; Rui Huang; Babak Borhan","Tetrasubstituted Pyrrolidines via a Tandem Aza-Payne/Hydroamination Reaction","Journal of the American Chemical Society","2007","129","","3794","3795","10.1021/ja068077w","","","0.71073","MoKα","","0.0496","0.0339","","","0.0998","0.1116","","","","","","0.812","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109244","10.54","0.002","16.113","0.003","24.914","0.005","90","","90","","90","","4231.2","1.4","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C22 H25 N O4 S -","- C22 H25 N O4 S -","- C176 H200 N8 O32 S8 -","8","1","","Jennifer M. Schomaker; Andrea R. Geiser; Rui Huang; Babak Borhan","Tetrasubstituted Pyrrolidines via a Tandem Aza-Payne/Hydroamination Reaction","Journal of the American Chemical Society","2007","129","","3794","3795","10.1021/ja068077w","","","0.71073","MoKα","","0.1078","0.0535","","","0.1317","0.1589","","","","","","0.954","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109245","11.9369","0.0005","14.9994","0.0005","18.276","0.0008","89.172","0.003","86.881","0.003","87.947","0.003","3265.1","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C69 H57 B F24 N2 Pt -","- C69 H57 B F24 N2 Pt -","- C138 H114 B2 F48 N4 Pt2 -","2","1","","Masashi Shiotsuki; Peter S. White; Maurice Brookhart; Joseph L. Templeton","Mechanistic Studies of Platinum(II)-Catalyzed Ethylene Dimerization: Determination of Barriers to Migratory Insertion in Diimine Pt(II) Hydrido Ethylene and Ethyl Ethylene Intermediates","Journal of the American Chemical Society","2007","129","","4058","4067","10.1021/ja068118o","","","0.71073","MoKα","","0.0844","0.0528","","","0.1284","0.1473","","","","","","0.972","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109246","10.133","0.002","8.577","0.0017","10.561","0.002","90","","110.95","0.03","90","","857.2","0.3","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C18 H17 Cl F N O S -","- C18 H17 Cl F N O S -","- C36 H34 Cl2 F2 N2 O2 S2 -","2","1","","Qi-Xiang Guo; Hua Liu; Chang Guo; Shi-Wei Luo; Yi Gu; Liu-Zhu Gong","Chiral Brønsted Acid-Catalyzed Direct Asymmetric Mannich Reaction","Journal of the American Chemical Society","2007","129","","3790","3791","10.1021/ja068236b","","","0.71073","MoKα","","0.0404","0.0349","","","0.0822","0.0877","","","","","","1.107","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109247","6.9796","0.001","30.805","0.004","10.517","0.0014","90","","107.714","0.001","90","","2154","0.5","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H26 N6 Na2 O9 Ru -","- C14 H8 N6 Na2 O7 Ru -","- C56 H32 N24 Na8 O28 Ru4 -","4","1","","Theodore Lazarides; Timothy L. Easun; Claire Veyne-Marti; Wassim Z. Alsindi; Michael W. George; Nina Deppermann; Christopher A. Hunter; Harry Adams; Michael D. Ward","Structural and Photophysical Properties of Adducts of [Ru(bipy)(CN)4]2- with Different Metal Cations: Metallochromism and Its Use in Switching Photoinduced Energy Transfer","Journal of the American Chemical Society","2007","129","","4014","4027","10.1021/ja068436n","","","0.71073","MoKα","","0.0473","0.0408","","","0.1175","0.1245","","","","","","0.732","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109248","8.526","0.0008","8.7736","0.0008","13.8864","0.0014","104.58","0.004","95.632","0.004","103.688","0.004","962.92","0.16","103","2","103","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H12 Cs2 N6 O2 Ru -","- C14 H12 Cs2 N6 O2 Ru -","- C28 H24 Cs4 N12 O4 Ru2 -","2","1","","Theodore Lazarides; Timothy L. Easun; Claire Veyne-Marti; Wassim Z. Alsindi; Michael W. George; Nina Deppermann; Christopher A. Hunter; Harry Adams; Michael D. Ward","Structural and Photophysical Properties of Adducts of [Ru(bipy)(CN)4]2- with Different Metal Cations: Metallochromism and Its Use in Switching Photoinduced Energy Transfer","Journal of the American Chemical Society","2007","129","","4014","4027","10.1021/ja068436n","","","0.71073","MoKα","","0.0205","0.0194","","","0.0449","0.0456","","","","","","1.066","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109249","7.537","0.0008","9.9846","0.0011","13.435","0.002","103.383","0.007","94.459","0.007","106.479","0.005","932","0.2","103","2","103","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H14 K2 N6 O3 Ru -","- C14 H14 K2 N6 O3 Ru -","- C28 H28 K4 N12 O6 Ru2 -","2","1","","Theodore Lazarides; Timothy L. Easun; Claire Veyne-Marti; Wassim Z. Alsindi; Michael W. George; Nina Deppermann; Christopher A. Hunter; Harry Adams; Michael D. Ward","Structural and Photophysical Properties of Adducts of [Ru(bipy)(CN)4]2- with Different Metal Cations: Metallochromism and Its Use in Switching Photoinduced Energy Transfer","Journal of the American Chemical Society","2007","129","","4014","4027","10.1021/ja068436n","","","0.71073","MoKα","","0.0233","0.0225","","","0.0629","0.0638","","","","","","1.059","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109250","6.8534","0.0011","10.6185","0.0017","14.069","0.002","85.509","0.007","77.865","0.006","83.595","0.006","993.1","0.3","103","2","103","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H20 Ba N6 O6 Ru -","- C14 H20 Ba N6 O6 Ru -","- C28 H40 Ba2 N12 O12 Ru2 -","2","1","","Theodore Lazarides; Timothy L. Easun; Claire Veyne-Marti; Wassim Z. Alsindi; Michael W. George; Nina Deppermann; Christopher A. Hunter; Harry Adams; Michael D. Ward","Structural and Photophysical Properties of Adducts of [Ru(bipy)(CN)4]2- with Different Metal Cations: Metallochromism and Its Use in Switching Photoinduced Energy Transfer","Journal of the American Chemical Society","2007","129","","4014","4027","10.1021/ja068436n","","","0.71073","MoKα","","0.0181","0.018","","","0.0464","0.0466","","","","","","1.153","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109251","7.8843","0.0009","14.8087","0.0017","18.078","0.003","111.702","0.006","100.355","0.006","96.102","0.004","1894.4","0.5","100","2","103","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H16 K Li N6 O4 Ru -","- C14 H16 K Li N6 O4 Ru -","- C56 H64 K4 Li4 N24 O16 Ru4 -","4","2","","Theodore Lazarides; Timothy L. Easun; Claire Veyne-Marti; Wassim Z. Alsindi; Michael W. George; Nina Deppermann; Christopher A. Hunter; Harry Adams; Michael D. Ward","Structural and Photophysical Properties of Adducts of [Ru(bipy)(CN)4]2- with Different Metal Cations: Metallochromism and Its Use in Switching Photoinduced Energy Transfer","Journal of the American Chemical Society","2007","129","","4014","4027","10.1021/ja068436n","","","0.71073","MoKα","","0.0259","0.0247","","","0.0653","0.0665","","","","","","1.033","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109252","6.8956","0.0006","14.5781","0.0012","10.5162","0.0009","90","","103.531","0.004","90","","1027.8","0.15","123","2","123","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C14 H20 Li2 N6 O6 Ru -","- C14 H20 Li2 N6 O6 Ru -","- C28 H40 Li4 N12 O12 Ru2 -","2","0.5","","Theodore Lazarides; Timothy L. Easun; Claire Veyne-Marti; Wassim Z. Alsindi; Michael W. George; Nina Deppermann; Christopher A. Hunter; Harry Adams; Michael D. Ward","Structural and Photophysical Properties of Adducts of [Ru(bipy)(CN)4]2- with Different Metal Cations: Metallochromism and Its Use in Switching Photoinduced Energy Transfer","Journal of the American Chemical Society","2007","129","","4014","4027","10.1021/ja068436n","","","0.71073","MoKα","","0.0221","0.0207","","","0.0557","0.0571","","","","","","1.101","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109253","8.023","0.0016","15.755","0.003","9.998","0.002","90","","96.71","0.03","90","","1255.1","0.4","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C32 H26 O10 -","- C32 H26 O10 -","- C64 H52 O20 -","2","1","","K. C. Nicolaou; Yee Hwee Lim; Jared L. Piper; Charles D. Papageorgiou","Total Syntheses of 2,2'-epi-Cytoskyrin A, Rugulosin, and the Alleged Structure of Rugulin","Journal of the American Chemical Society","2007","129","","4001","4013","10.1021/ja0685708","","","0.71073","MoKα","","0.054","0.0515","","","0.1314","0.1336","","","","","","1.11","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109254","13.272","0.003","10.921","0.002","17.837","0.004","90","","103.66","0.03","90","","2512.2","1","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C32 H26 O10 -","- C32 H26 O10 -","- C128 H104 O40 -","4","1","","K. C. Nicolaou; Yee Hwee Lim; Jared L. Piper; Charles D. Papageorgiou","Total Syntheses of 2,2'-epi-Cytoskyrin A, Rugulosin, and the Alleged Structure of Rugulin","Journal of the American Chemical Society","2007","129","","4001","4013","10.1021/ja0685708","","","0.71073","MoKα","","0.1066","0.0541","","","0.1225","0.1461","","","","","","1.018","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109255","9.3701","0.0019","20.283","0.004","14.007","0.003","90","","108.28","0.03","90","","2527.7","1","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C32 H26 O10 -","- C32 H26 O10 -","- C128 H104 O40 -","4","0.5","","K. C. Nicolaou; Yee Hwee Lim; Jared L. Piper; Charles D. Papageorgiou","Total Syntheses of 2,2'-epi-Cytoskyrin A, Rugulosin, and the Alleged Structure of Rugulin","Journal of the American Chemical Society","2007","129","","4001","4013","10.1021/ja0685708","","","0.71073","MoKα","","0.1874","0.0808","","","0.1611","0.2145","","","","","","0.993","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109256","11.628","0.002","13.227","0.003","12.373","0.003","90","","115.55","0.03","90","","1716.9","0.8","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C36 H43 N O13 -","- C36 H37 N O13 -","- C72 H74 N2 O26 -","2","1","","K. C. Nicolaou; Yee Hwee Lim; Jared L. Piper; Charles D. Papageorgiou","Total Syntheses of 2,2'-epi-Cytoskyrin A, Rugulosin, and the Alleged Structure of Rugulin","Journal of the American Chemical Society","2007","129","","4001","4013","10.1021/ja0685708","","","0.71073","MoKα","","0.1102","0.0708","","","0.1419","0.1597","","","","","","1.041","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109257","10.56","0.002","17.366","0.004","22.721","0.005","90","","92.79","0.03","90","","4161.8","1.5","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C32.5 H25 O10.17 -","- C32.5 H25 O10.1667 -","- C195 H150 O61 -","6","3","","K. C. Nicolaou; Yee Hwee Lim; Jared L. Piper; Charles D. Papageorgiou","Total Syntheses of 2,2'-epi-Cytoskyrin A, Rugulosin, and the Alleged Structure of Rugulin","Journal of the American Chemical Society","2007","129","","4001","4013","10.1021/ja0685708","","","0.71073","MoKα","","0.1463","0.0779","","","0.1497","0.1765","","","","","","1.018","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109258","10.869","0.005","9.944","0.004","22.199","0.01","90","","90.303","0.007","90","","2399.3","1.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Boc-Ac6c-Gpn-OMe","","","- C22 H38 N2 O5 -","- C22 H38 N2 O5 -","- C88 H152 N8 O20 -","4","1","","Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin","Journal of the American Chemical Society","2007","129","","4039","4048","10.1021/ja068910p","","","0.71073","MoKα","","0.0687","0.049","","","0.13","0.1458","","","","","","1.049","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109259","18.445","0.007","9.743","0.004","12.405","0.005","90","","98.965","0.007","90","","2202.1","1.5","293","2","293","2","","","","","","","","4","P 1 c 1","P -2yc","7","Boc-Ac6c-Gpn-OH","","","- C21 H36 N2 O5 -","- C21 H36 N2 O5 -","- C84 H144 N8 O20 -","4","2","","Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin","Journal of the American Chemical Society","2007","129","","4039","4048","10.1021/ja068910p","","","0.71073","MoKα","","0.0753","0.0699","","","0.169","0.1734","","","","","","1.128","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109260","9.4184","0.0008","23.1859","0.0019","15.4165","0.0013","90","","90.805","0.005","90","","3366.2","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","Boc-Ala-Aib-Gpn-Aib-Ala-OMe","","","- C29 H51 N5 O8 -","- C29 H51 N5 O8 -","- C116 H204 N20 O32 -","4","2","","Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin","Journal of the American Chemical Society","2007","129","","4039","4048","10.1021/ja068910p","","","0.71073","MoKα","","0.1201","0.0855","","","0.1844","0.2","","","","","","1.124","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109261","9.14","0.006","15.953","0.01","22.952","0.015","90","","90","","90","","3347","4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Boc-betaPhe-Gpn-Phe-OMe","","","- C34 H47 N3 O6 -","- C34 H47 N3 O6 -","- C136 H188 N12 O24 -","4","1","","Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin","Journal of the American Chemical Society","2007","129","","4039","4048","10.1021/ja068910p","","","0.71073","MoKα","","0.0807","0.0541","","","0.1145","0.1251","","","","","","1.154","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109262","11.0742","0.0004","11.0742","0.0004","25.464","0.002","90","","90","","90","","3122.9","0.3","293","2","293","2","","","","","","","","4","P 41","P 4w","76","Boc-betaLeu-Gpn-Val-OMe","","","- C27 H49 N3 O6 -","- C27 H49 N3 O6 -","- C108 H196 N12 O24 -","4","1","","Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin","Journal of the American Chemical Society","2007","129","","4039","4048","10.1021/ja068910p","","","0.71073","MoKα","","0.0968","0.0855","","","0.1916","0.1982","","","","","","1.239","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109263","15.814","0.002","22.153","0.003","9.57","0.0014","90","","90","","90","","3352.6","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Boc-Gpn-betaPhe-Leu-OMe","","","- C31 H49 N3 O6 -","- C31 H49 N3 O6 -","- C124 H196 N12 O24 -","4","1","","Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin","Journal of the American Chemical Society","2007","129","","4039","4048","10.1021/ja068910p","","","0.71073","MoKα","","0.1473","0.0786","","","0.2016","0.2372","","","","","","1.123","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109264","19.7622","0.0019","20.478","0.002","16.3811","0.0016","90","","90","","90","","6629.3","1.1","293","2","293","2","","","","","","","","4","C 2 2 21","C 2c 2","20","Boc-Gpn-Gpn-Leu-OMe","","","- C30 H53 N3 O6.5 -","- C30 H53 N3 O6.5 -","- C240 H424 N24 O52 -","8","1","","Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin","Journal of the American Chemical Society","2007","129","","4039","4048","10.1021/ja068910p","","","0.71073","MoKα","","0.1088","0.0804","","","0.1858","0.2021","","","","","","1.179","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109265","30.027","0.004","12.1823","0.0018","20.453","0.003","90","","109.256","0.002","90","","7063.1","1.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Boc-Gpn-Aib-Gpn-Aib-OMe","","","- C32 H56 N4 O7 -","- C32 H56 N4 O7 -","- C256 H448 N32 O56 -","8","1","","Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin","Journal of the American Chemical Society","2007","129","","4039","4048","10.1021/ja068910p","","","0.71073","MoKα","","0.0887","0.0694","","","0.2053","0.2177","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109266","9.846","0.007","10.339","0.007","10.806","0.007","90","","110.974","0.01","90","","1027.1","1.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","Boc-Gpn-Aib-OH","","","- C18 H32 N2 O5 -","- C18 H32 N2 O5 -","- C36 H64 N4 O10 -","2","1","","Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin","Journal of the American Chemical Society","2007","129","","4039","4048","10.1021/ja068910p","","","0.71073","MoKα","","0.0413","0.0387","","","0.1006","0.1023","","","","","","1.119","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109267","6.712","0.003","15.323","0.007","26.306","0.012","90","","90","","90","","2706","2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Piv-Pro-Gpn-Val-OMe","","","- C25 H43 N3 O5 -","- C25 H43 N3 O5 -","- C100 H172 N12 O20 -","4","1","","Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin","Journal of the American Chemical Society","2007","129","","4039","4048","10.1021/ja068910p","","","0.71073","MoKα","","0.0646","0.0557","","","0.1344","0.1396","","","","","","1.157","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109268","9.3516","0.0008","13.5541","0.0012","24.864","0.002","90","","90","","90","","3151.6","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Boc-Aib-Gpn-betaPhg-NHMe","","","- C28 H46 N4 O6 -","- C28 H46 N4 O6 -","- C112 H184 N16 O24 -","4","1","","Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin","Journal of the American Chemical Society","2007","129","","4039","4048","10.1021/ja068910p","","","0.71073","MoKα","","0.0598","0.051","","","0.1293","0.1355","","","","","","1.113","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109269","6.813","0.004","7.416","0.004","14.072","0.008","81.121","0.009","76.345","0.008","83.5","0.009","680.4","0.7","293","2","293","2","","","","","","","","4","P 1","P 1","1","Boc-Val-Pro-Gpn-OH","","","- C24 H41 N3 O7 -","- C24 H41 N3 O7 -","- C24 H41 N3 O7 -","1","1","","Prema G. Vasudev; Kuppanna Ananda; Sunanda Chatterjee; Subrayashastry Aravinda; Narayanaswamy Shamala; Padmanabhan Balaram","Hybrid Peptide Design. Hydrogen Bonded Conformations in Peptides Containing the Stereochemically Constrained γ-Amino Acid Residue, Gabapentin","Journal of the American Chemical Society","2007","129","","4039","4048","10.1021/ja068910p","","","0.71073","MoKα","","0.0528","0.0514","","","0.1398","0.1416","","","","","","1.101","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109270","4.6184","0.0017","17.418","0.006","7.178","0.003","90","","90","","90","","577.4","0.4","120","2","120","2","","","","","","","","3","C m c 21","C 2c -2","36","","","","- Cd Sb2 Yb2 -","- Cd Sb2 Yb2 -","- Cd4 Sb8 Yb8 -","4","0.5","","Sheng-qing Xia; Svilen Bobev","Cation-Anion Interactions as Structure Directing Factors: Structure and Bonding of Ca2CdSb2 and Yb2CdSb2","Journal of the American Chemical Society","2007","129","","4049","4057","10.1021/ja069261k","","","0.71073","MoKα","","0.0216","0.0216","","","0.0463","0.0463","","","","","","1.111","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109271","7.2536","0.0013","4.603","0.0008","17.521","0.003","90","","90","","90","","585","0.18","120","2","120","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca2 Cd Sb2 -","- Ca2 Cd Sb2 -","- Ca8 Cd4 Sb8 -","4","0.5","","Sheng-qing Xia; Svilen Bobev","Cation-Anion Interactions as Structure Directing Factors: Structure and Bonding of Ca2CdSb2 and Yb2CdSb2","Journal of the American Chemical Society","2007","129","","4049","4057","10.1021/ja069261k","","","0.71073","MoKα","","0.0237","0.0222","","","0.0571","0.0578","","","","","","1.199","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109272","12.444","0.011","7.067","0.006","23.49","0.02","90","","97.447","0.015","90","","2048","3","443","2","443","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H48 N8 O6 -","- C46 H48 N8 O6 -","- C92 H96 N16 O12 -","2","0.5","","Ha Na Lee; Zhaochao Xu; Sook Kyung Kim; K. M. K. Swamy; Youngmee Kim; Sung-Jin Kim; Juyoung Yoon","Pyrophosphate-Selective Fluorescent Chemosensor at Physiological pH: Formation of a Unique Excimer upon Addition of Pyrophosphate","Journal of the American Chemical Society","2007","129","","3828","3829","10.1021/ja0700294","","","0.71073","MoKα","","0.0951","0.0634","","","0.1674","0.1894","","","","","","1.041","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109273","11.199","0.003","13.974","0.003","18.51","0.004","90.295","0.006","105.525","0.006","101.093","0.006","2734","1.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C60 H62 N10 O8 -","- C60 H62 N10 O8 -","- C120 H124 N20 O16 -","2","1","","Guzmán Gil-Ramírez; Jordi Benet-Buchholz; Eduardo C. Escudero-Adán; Pablo Ballester","Solid-State Self-Assembly of a Calix[4]pyrrole-Resorcinarene Hybrid into a Hexameric Cage","Journal of the American Chemical Society","2007","129","","3820","3821","10.1021/ja070037k","","","0.71073","MoKα","","0.1595","0.087","","","0.2321","0.277","","","","","","1.045","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109274","16.0984","0.0019","16.0984","0.0019","20.223","0.005","90","","90","","90","","5241","1.6","100","2","100","2","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- C56 H62 Cl N7 O8 -","- C56.04 H62.12 Cl N7 O8 -","- C224.16 H248.48 Cl4 N28 O32 -","4","0.25","","Guzmán Gil-Ramírez; Jordi Benet-Buchholz; Eduardo C. Escudero-Adán; Pablo Ballester","Solid-State Self-Assembly of a Calix[4]pyrrole-Resorcinarene Hybrid into a Hexameric Cage","Journal of the American Chemical Society","2007","129","","3820","3821","10.1021/ja070037k","","","0.71073","MoKα","","0.1486","0.1344","","","0.3453","0.3678","","","","","","1.198","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109275","21.8372","0.0018","21.8372","0.0018","69.813","0.011","90","","90","","120","","28831","6","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C61.33 H87 Cl3.33 N7.33 O9.83 -","- C61.3333 H87 Cl3.33333 N7.33333 O9.83333 -","- C1104 H1566 Cl60 N132 O177 -","18","1","","Guzmán Gil-Ramírez; Jordi Benet-Buchholz; Eduardo C. Escudero-Adán; Pablo Ballester","Solid-State Self-Assembly of a Calix[4]pyrrole-Resorcinarene Hybrid into a Hexameric Cage","Journal of the American Chemical Society","2007","129","","3820","3821","10.1021/ja070037k","","","0.71073","MoKα","","0.1043","0.0719","","","0.2098","0.2524","","","","","","1.049","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109276","11.6193","0.0007","15.4796","0.0009","16.0015","0.0009","90","","103.608","0.001","90","","2797.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H30 Cl2 Ni P2 -","- C30 H30 Cl2 Ni P2 -","- C120 H120 Cl8 Ni4 P8 -","4","1","","Azusa Kondoh; Hideki Yorimitsu; Koichiro Oshima","Copper-Catalyzed anti-Hydrophosphination Reaction of 1-Alkynylphosphines with Diphenylphosphine Providing (Z)-1,2-Diphosphino-1-alkenes","Journal of the American Chemical Society","2007","129","","4099","4104","10.1021/ja070048d","","","0.71073","MoKα","","0.0388","0.0342","","","0.1016","0.1074","","","","","","0.682","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109277","9.7113","0.0006","10.07","0.0006","11.5182","0.0007","110.21","0.001","92.947","0.001","112.21","0.001","956.91","0.1","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H19 Br O4 -","- C20 H19 Br O4 -","- C40 H38 Br2 O8 -","2","1","","Margaret M. Biddle; Michael Lin; Karl A. Scheidt","Catalytic Enantioselective Synthesis of Flavanones and Chromanones","Journal of the American Chemical Society","2007","129","","3830","3831","10.1021/ja070394v","","","0.71073","MoKα","","0.0408","0.037","","","0.0997","0.1018","","","","","","1.077","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109278","12.3573","0.0014","13.9491","0.0012","25.209","0.003","90","","99.277","0.005","90","","4288.5","0.8","90","","90","","","","","","","","local laboratory","3","P 1 21/n 1","-P 2yn","14","","","","- C67 H36 O2 -","- C67 H36 O2 -","- C268 H144 O8 -","4","1","","Andrzej Sygula; Frank R. Fronczek; Renata Sygula; Peter W. Rabideau; Marilyn M. Olmstead","A Double Concave Hydrocarbon Buckycatcher","Journal of the American Chemical Society","2007","129","","3842","3843","10.1021/ja070616p","","","0.71073","MoKα","","0.074","0.05","","","0.12","0.134","","","","","","1.017","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109279","9.773","0.0015","22.253","0.003","17.334","0.003","90","","98.202","0.007","90","","3731.2","1","100","","100","","","","","","","","local laboratory","2","P 1 21/m 1","-P 2yb","11","","","","- C134 H44 -","- C134 H44 -","- C268 H88 -","2","0.5","","Andrzej Sygula; Frank R. Fronczek; Renata Sygula; Peter W. Rabideau; Marilyn M. Olmstead","A Double Concave Hydrocarbon Buckycatcher","Journal of the American Chemical Society","2007","129","","3842","3843","10.1021/ja070616p","","","0.71073","MoKα","","0.098","0.066","","","0.157","0.178","","","","","","1.022","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109280","11.9924","0.0001","13.5197","0.0002","25.1994","0.0004","91.149","0.001","91.8","0.001","98.34","0.001","4039.22","0.09","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C82 H102 Cl5 Fe2 N5 O7 -","- C82 H102 Cl5 Fe2 N5 O7 -","- C164 H204 Cl10 Fe4 N10 O14 -","2","1","","Katharina Dürr; Brendan P. Macpherson; Ralf Warratz; Frank Hampel; Felix Tuczek; Matthias Helmreich; Norbert Jux; Ivana Ivanović-Burmazović","Iron(III) Complex of a Crown Ether-Porphyrin Conjugate and Reversible Binding of Superoxide to Its Iron(II) Form","Journal of the American Chemical Society","2007","129","","4217","4228","10.1021/ja064984p","","","0.71073","MoKα","","0.1069","0.0753","","","0.217","0.2429","","","","","","1.038","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109281","6.735","0.0013","14.265","0.003","19.583","0.004","90","","90","","90","","1881.4","0.7","253","2","253","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H16 Au N -","- C25 H16 Au N -","- C100 H64 Au4 N4 -","4","1","","Keith Man-Chung Wong; Ling-Ling Hung; Wai Han Lam; Nianyong Zhu; Vivian Wing-Wah Yam","A Class of Luminescent Cyclometalated Alkynylgold(III) Complexes: Synthesis, Characterization, and Electrochemical, Photophysical, and Computational Studies of [Au(C^N^C)(C\τbCR)] (C^N^C = κ3C,N,C Bis-cyclometalated 2,6-Diphenylpyridyl)","Journal of the American Chemical Society","2007","129","","4350","4365","10.1021/ja068264u","","","0.71069","MoKα","","0.0339","0.0262","","","0.0555","0.0569","","","","","","0.925","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109282","7.459","0.0015","9.641","0.0019","14.086","0.003","106.07","0.03","97.74","0.03","94.98","0.03","956.3","0.4","301","2","301","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H15 Au Cl N -","- C25 H15 Au Cl N -","- C50 H30 Au2 Cl2 N2 -","2","1","","Keith Man-Chung Wong; Ling-Ling Hung; Wai Han Lam; Nianyong Zhu; Vivian Wing-Wah Yam","A Class of Luminescent Cyclometalated Alkynylgold(III) Complexes: Synthesis, Characterization, and Electrochemical, Photophysical, and Computational Studies of [Au(C^N^C)(C\τbCR)] (C^N^C = κ3C,N,C Bis-cyclometalated 2,6-Diphenylpyridyl)","Journal of the American Chemical Society","2007","129","","4350","4365","10.1021/ja068264u","","","0.71073","MoKα","","0.0425","0.0386","","","0.0938","0.0949","","","","","","1.027","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109283","5.1","0.001","15.197","0.003","25.241","0.005","90","","95.58","0.03","90","","1947","0.7","253","2","253","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H15 Au N2 O2 -","- C25 H15 Au N2 O2 -","- C100 H60 Au4 N8 O8 -","4","1","","Keith Man-Chung Wong; Ling-Ling Hung; Wai Han Lam; Nianyong Zhu; Vivian Wing-Wah Yam","A Class of Luminescent Cyclometalated Alkynylgold(III) Complexes: Synthesis, Characterization, and Electrochemical, Photophysical, and Computational Studies of [Au(C^N^C)(C\τbCR)] (C^N^C = κ3C,N,C Bis-cyclometalated 2,6-Diphenylpyridyl)","Journal of the American Chemical Society","2007","129","","4350","4365","10.1021/ja068264u","","","0.71073","MoKα","","0.0571","0.0348","","","0.0749","0.079","","","","","","0.9","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109284","12.934","0.003","19.404","0.004","9.697","0.0019","90","","107.33","0.03","90","","2323.2","0.9","253","2","253","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H25 Au N O -","- C29 H25 Au N O -","- C116 H100 Au4 N4 O4 -","4","1","","Keith Man-Chung Wong; Ling-Ling Hung; Wai Han Lam; Nianyong Zhu; Vivian Wing-Wah Yam","A Class of Luminescent Cyclometalated Alkynylgold(III) Complexes: Synthesis, Characterization, and Electrochemical, Photophysical, and Computational Studies of [Au(C^N^C)(C\τbCR)] (C^N^C = κ3C,N,C Bis-cyclometalated 2,6-Diphenylpyridyl)","Journal of the American Chemical Society","2007","129","","4350","4365","10.1021/ja068264u","","","0.71073","MoKα","","0.0906","0.048","","","0.0974","0.1045","","","","","","0.807","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109285","8.282","0.0017","9.029","0.0018","13.87","0.003","84.67","0.03","81.18","0.03","84.33","0.03","1016.7","0.4","253","2","253","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H24 Au N -","- C25 H24 Au N -","- C50 H48 Au2 N2 -","2","1","","Keith Man-Chung Wong; Ling-Ling Hung; Wai Han Lam; Nianyong Zhu; Vivian Wing-Wah Yam","A Class of Luminescent Cyclometalated Alkynylgold(III) Complexes: Synthesis, Characterization, and Electrochemical, Photophysical, and Computational Studies of [Au(C^N^C)(C\τbCR)] (C^N^C = κ3C,N,C Bis-cyclometalated 2,6-Diphenylpyridyl)","Journal of the American Chemical Society","2007","129","","4350","4365","10.1021/ja068264u","","","0.71073","MoKα","","0.0524","0.05","","","0.1277","0.1286","","","","","","1.055","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109286","19.335","0.004","19.732","0.004","7.172","0.0014","90","","99.76","0.03","90","","2696.6","1","301","2","301","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C33 H32 Au N -","- C33 H32 Au N -","- C132 H128 Au4 N4 -","4","0.5","","Keith Man-Chung Wong; Ling-Ling Hung; Wai Han Lam; Nianyong Zhu; Vivian Wing-Wah Yam","A Class of Luminescent Cyclometalated Alkynylgold(III) Complexes: Synthesis, Characterization, and Electrochemical, Photophysical, and Computational Studies of [Au(C^N^C)(C\τbCR)] (C^N^C = κ3C,N,C Bis-cyclometalated 2,6-Diphenylpyridyl)","Journal of the American Chemical Society","2007","129","","4350","4365","10.1021/ja068264u","","","0.71073","MoKα","","0.0357","0.0262","","","0.0558","0.0572","","","","","","0.901","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109287","8.637","0.0017","20.419","0.004","18.93","0.004","90","","101.81","0.03","90","","3267.8","1.2","253","2","253","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C39 H36 Au Cl2 N -","- C39 H36 Au Cl2 N -","- C156 H144 Au4 Cl8 N4 -","4","1","","Keith Man-Chung Wong; Ling-Ling Hung; Wai Han Lam; Nianyong Zhu; Vivian Wing-Wah Yam","A Class of Luminescent Cyclometalated Alkynylgold(III) Complexes: Synthesis, Characterization, and Electrochemical, Photophysical, and Computational Studies of [Au(C^N^C)(C\τbCR)] (C^N^C = κ3C,N,C Bis-cyclometalated 2,6-Diphenylpyridyl)","Journal of the American Chemical Society","2007","129","","4350","4365","10.1021/ja068264u","","","0.71073","MoKα","","0.0369","0.0298","","","0.0925","0.0952","","","","","","1.15","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109288","22.158","0.007","14.303","0.003","23.344","0.005","90","","125.02","0.02","90","","6059","3","293","2","293","2","","","","","","","synthesis as described","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H42 N6 O -","- C32 H42 N6 O -","- C256 H336 N48 O8 -","8","1","","Cristina Nativi; Martina Cacciarini; Oscar Francesconi; Alberto Vacca; Gloriano Moneti; Andrea Ienco; Stefano Roelens","Pyrrolic Tripodal Receptors Effectively Recognizing Monosaccharides. Affinity Assessment through a Generalized Binding Descriptor","Journal of the American Chemical Society","2007","129","","4377","4385","10.1021/ja068754m","","x-ray","0.71069","MoKα","","0.1708","0.0545","","","0.1131","0.1472","","","","","","0.986","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109289","11.123","0.006","11.647","0.006","13.344","0.005","104.53","0.04","112.03","0.04","105.56","0.05","1419.1","1.6","150","2","150","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C30 H38 N6 O4 -","- C30 H38 N6 O4 -","- C60 H76 N12 O8 -","2","1","","Cristina Nativi; Martina Cacciarini; Oscar Francesconi; Alberto Vacca; Gloriano Moneti; Andrea Ienco; Stefano Roelens","Pyrrolic Tripodal Receptors Effectively Recognizing Monosaccharides. Affinity Assessment through a Generalized Binding Descriptor","Journal of the American Chemical Society","2007","129","","4377","4385","10.1021/ja068754m","","x-ray","1.54184","CuKα","","0.1995","0.0964","","","0.2354","0.3024","","","","","","0.993","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109290","18.373","0.005","6.8736","0.0018","24.778","0.006","90","","93.551","0.005","90","","3123.2","1.4","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H17 Br2 N -","- C16 H17 Br2 N -","- C128 H136 Br16 N8 -","8","1","","Shelli R. Waetzig; Jon A. Tunge","Regio- and Diastereoselective Decarboxylative Coupling of Heteroaromatic Alkanes","Journal of the American Chemical Society","2007","129","","4138","4139","10.1021/ja070116w","","","0.71073","MoKα","","0.1297","0.0675","","","0.1509","0.1678","","","","","","0.985","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109291","13.0417","0.0017","14.5598","0.0019","16.336","0.002","94.317","0.002","108.821","0.002","104.061","0.002","2808","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H23 B F36 N2 Ni -","- C53 H23 B F36 N2 Ni -","- C106 H46 B2 F72 N4 Ni2 -","2","1","","Abby R. O'Connor; Peter S. White; Maurice Brookhart","The Mechanism of Polymerization of Butadiene by ""Ligand-Free"" Nickel(II) Complexes","Journal of the American Chemical Society","2007","129","","4142","4143","10.1021/ja070364s","","","0.71073","MoKα","","0.135","0.0766","","","0.1294","0.1394","","","","","","1.898","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109292","17.6927","0.0006","19.4801","0.0006","26.9426","0.0009","90","","90","","90","","9285.9","0.5","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C47 H35 B F24 Ni -","- C47 H35 B F24 Ni -","- C376 H280 B8 F192 Ni8 -","8","1","","Abby R. O'Connor; Peter S. White; Maurice Brookhart","The Mechanism of Polymerization of Butadiene by ""Ligand-Free"" Nickel(II) Complexes","Journal of the American Chemical Society","2007","129","","4142","4143","10.1021/ja070364s","","","1.54178","CuKα","","0.1148","0.0973","","","0.2564","0.2744","","","","","","1.011","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109293","11.624","0.003","5.549","0.002","21.301","0.006","90","","104.981","0.005","90","","1327.2","0.7","163.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 O S -","- C16 H14 O S -","- C64 H56 O4 S4 -","4","1","","Nathan D. Shapiro; F. Dean Toste","Rearrangement of Alkynyl Sulfoxides Catalyzed by Gold(I) Complexes","Journal of the American Chemical Society","2007","129","","4160","4161","10.1021/ja070789e","","","0.7107","MoKα","","0.0752","0.0431","","0.057","","0.0499","","","","","","1.442","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109294","10.106","0.002","10.866","0.002","13.975","0.003","68.662","0.003","71.425","0.003","64.519","0.003","1266.2","0.4","163.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H16 O4 S -","- C13 H16 O4 S -","- C52 H64 O16 S4 -","4","2","","Nathan D. Shapiro; F. Dean Toste","Rearrangement of Alkynyl Sulfoxides Catalyzed by Gold(I) Complexes","Journal of the American Chemical Society","2007","129","","4160","4161","10.1021/ja070789e","","","0.7107","MoKα","","0.0612","0.0389","","0.0539","","0.0494","","","","","","1.653","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109295","5.4978","0.0003","17.7771","0.0007","13.4393","0.0006","90","","101.985","0.0015","90","","1284.86","0.1","173.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H23 Br N2 O8 -","- C27 H23 Br N2 O8 -","- C54 H46 Br2 N4 O16 -","2","1","","Masahiro Inoue; Masahisa Nakada","Structure Elucidation and Enantioselective Total Synthesis of the Potent HMG-CoA Reductase Inhibitor FR901512 via Catalytic Asymmetric Nozaki-Hiyama Reactions","Journal of the American Chemical Society","2007","129","","4164","4165","10.1021/ja070812w","","","0.71075","MoKα","","","0.0285","","","","0.0559","","","","","","0.674","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109296","14.71","0.003","15.829","0.004","16.253","0.004","116.874","0.004","96.699","0.004","100.299","0.004","3236.2","1.3","220","2","220","2","","","","","","","","8","P -1","-P 1","2","Platinum Tin cluster","Platinum Tin cluster","","- C78 H168 K4 N14 O24 P0 Pt2 Sn17 -","- C78 H168 K4 N14 O24 Pt1.9998 Sn16.9998 -","- C78 H168 K4 N14 O24 Pt1.9998 Sn16.9998 -","1","0.5","","Banu Kesanli; Jordan E. Halsig; Peter Zavalij; James C. Fettinger; Yiu-Fai Lam; Bryan W. Eichhorn","Cluster Growth and Fragmentation in the Highly Fluxional Platinum Derivatives of Sn94-: Synthesis, Characterization, and Solution Dynamics of Pt2@Sn174- and Pt@Sn9H3-","Journal of the American Chemical Society","2007","129","","4567","4574","10.1021/ja065764e","","","0.71073","MoKα","","0.0553","0.0372","","","0.0812","0.0879","","","","","","1","","","","has coordinates,has disorder","178838","2020-10-21","18:00:00",""
"4109297","8.043","0.001","8.214","0.001","26.677","0.002","90","","91.05","0.01","90","","1762.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(octahydro-indolizin-3-yl)-diphenyl-methanol","","- C21 H25 N O -","- C21 H25 N O -","- C84 H100 N4 O4 -","4","1","","Satinder V. Kessar; Paramjit Singh; Kamal Nain Singh; P. Venugopalan; Amarjit Kaur; Prasad V. Bharatam; Arvind K.Sharma","An Experimental and Computational Study of Stereoselectivity and Reactivity in Lewis Acid Promoted Lithiation-Substitution of Tertiary Amines","Journal of the American Chemical Society","2007","129","","4506","4507","10.1021/ja0675144","","","0.71073","MoKα","","0.0526","0.0393","","","0.0978","0.1062","","","","","","1.01","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109298","14.483","0.002","26.555","0.005","18.961","0.003","90","","95.12","0.02","90","","7263","2","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C61 H58 Cl13 P3 Pt3 S3 -","- C61 H58 Cl13 P3 Pt3 S3 -","- C244 H232 Cl52 P12 Pt12 S12 -","4","1","","Christian Albrecht; Sebastian Schwieger; Clemens Bruhn; Christoph Wagner; Ralph Kluge; Harry Schmidt; Dirk Steinborn","Alkylthio Bridged 44 cve Triangular Platinum Clusters: Synthesis, Oxidation, Degradation, Ligand Substitution, and Quantum Chemical Calculations","Journal of the American Chemical Society","2007","129","","4551","4566","10.1021/ja068476r","","","0.71073","MoKα","","0.041","0.0291","","","0.0674","0.0748","","","","","","1.024","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109299","9.194","0.002","17.693","0.003","16.586","0.004","90","","99.37","0.03","90","","2662","1","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H42 As2 Cl8 Pt2 S2 -","- C50 H42 As2 Cl8 Pt2 S2 -","- C100 H84 As4 Cl16 Pt4 S4 -","2","0.5","","Christian Albrecht; Sebastian Schwieger; Clemens Bruhn; Christoph Wagner; Ralph Kluge; Harry Schmidt; Dirk Steinborn","Alkylthio Bridged 44 cve Triangular Platinum Clusters: Synthesis, Oxidation, Degradation, Ligand Substitution, and Quantum Chemical Calculations","Journal of the American Chemical Society","2007","129","","4551","4566","10.1021/ja068476r","","","0.71073","MoKα","","0.0395","0.0286","","","0.0673","0.0709","","","","","","0.984","","","","has coordinates","178838","2020-10-21","18:00:00",""
"4109300","28.655","0.007","15.065","0.002","18.692","0.005","90","","88.07","0.03","90","","8065","3","223","2","223","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C78 H72 Cl O P3 Pt3 S4 -","- C78 H72 Cl O P3 Pt3 S4 -","- C312 H288 Cl4 O4 P12 Pt12 S16 -","4","1","","Christian Albrecht; Sebastian Schwieger; Clemens Bruhn; Christoph Wagner; Ralph Kluge; Harry Schmidt; Dirk Steinborn","Alkylthio Bridged 44 cve Triangular Platinum Clusters: Synthesis, Oxidation, Degradation, Ligand Substitution, and Quantum Chemical Calculations","Journal of the American Chemical Society","2007","129","","4551","4566","10.1021/ja068476r","","","0.71073","MoKα","","0.0679","0.0436","","","0.1116","0.1231","","","","","","0.956","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109301","11.2934","0.0014","29.191","0.005","16.471","0.002","90","","91.44","0.016","90","","5428.2","1.3","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H55 Cl P4 Pt2 S -","- C62 H55 Cl P4 Pt2 S -","- C248 H220 Cl4 P16 Pt8 S4 -","4","1","","Christian Albrecht; Sebastian Schwieger; Clemens Bruhn; Christoph Wagner; Ralph Kluge; Harry Schmidt; Dirk Steinborn","Alkylthio Bridged 44 cve Triangular Platinum Clusters: Synthesis, Oxidation, Degradation, Ligand Substitution, and Quantum Chemical Calculations","Journal of the American Chemical Society","2007","129","","4551","4566","10.1021/ja068476r","","","0.71073","MoKα","","0.0593","0.0439","","","0.108","0.1223","","","","","","1.036","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109302","11.35","0.002","13.561","0.003","14.212","0.003","98.75","0.02","112.4","0.02","92.88","0.03","1984.8","0.8","220","2","220","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H38 Br2 Cl2 P2 Pt2 S2 -","- C39 H38 Br2 Cl2 P2 Pt2 S2 -","- C78 H76 Br4 Cl4 P4 Pt4 S4 -","2","1","","Christian Albrecht; Sebastian Schwieger; Clemens Bruhn; Christoph Wagner; Ralph Kluge; Harry Schmidt; Dirk Steinborn","Alkylthio Bridged 44 cve Triangular Platinum Clusters: Synthesis, Oxidation, Degradation, Ligand Substitution, and Quantum Chemical Calculations","Journal of the American Chemical Society","2007","129","","4551","4566","10.1021/ja068476r","","","0.71073","MoKα","","0.0478","0.0423","","","0.1148","0.1218","","","","","","1.077","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109303","6.3059","0.0013","13.827","0.003","21.217","0.004","90","","90","","90","","1849.9","0.7","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H23 N O5 -","- C19 H23 N O5 -","- C76 H92 N4 O20 -","4","1","","Daniel P. O'Malley; Ke Li; Michael Maue; Alexandros L. Zografos; Phil S. Baran","Total Synthesis of Dimeric Pyrrole-Imidazole Alkaloids: Sceptrin, Ageliferin, Nagelamide E, Oxysceptrin, Nakamuric Acid, and the Axinellamine Carbon Skeleton","Journal of the American Chemical Society","2007","129","","4762","4775","10.1021/ja069035a","","","0.71073","MoKα","","0.0516","0.0422","","","0.0948","0.0993","","","","","","1.061","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109304","7.7393","0.0004","7.7393","0.0004","37.305","0.003","90","","90","","120","","1935.1","0.2","100","2","100","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C24 H38 Cl2 Mo Si2 -","- C24 H38 Cl2 Mo Si2 -","- C72 H114 Cl6 Mo3 Si6 -","3","0.5","","Holger Braunschweig; Nele Buggisch; Ulli Englert; Melanie Homberger; Thomas Kupfer; Dirk Leusser; Matthias Lutz; Krzysztof Radacki","Dilithiation of Bis(benzene)molybdenum and Subsequent Isolation of a Molybdenum-Containing Paracyclophane","Journal of the American Chemical Society","2007","129","","4840","4846","10.1021/ja0692130","","","0.71073","MoKα","","0.0383","0.0325","","","0.0806","0.0822","","","","","","1.226","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109305","14.22","0.005","13.712","0.005","25.833","0.009","90","","100.282","0.014","90","","4956","3","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H24 B N3 O -","- C34 H24 B N3 O -","- C272 H192 B8 N24 O8 -","8","2","","Yasuhide Inokuma; Zin Seok Yoon; Dongho Kim; Atsuhiro Osuka","meso-Aryl-Substituted Subporphyrins: Synthesis, Structures, and Large Substituent Effects on Their Electronic Properties","Journal of the American Chemical Society","2007","129","","4747","4761","10.1021/ja069324z","","","0.71075","MoKα","","0.1336","0.0769","","","0.194","0.2266","","","","","","1.066","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109306","28.712","0.002","16.7407","0.0013","22.2837","0.0017","90","","130.003","0.001","90","","8204.6","1.1","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H56 B N3 O3 -","- C48 H56 B N3 O3 -","- C384 H448 B8 N24 O24 -","8","1","","Yasuhide Inokuma; Zin Seok Yoon; Dongho Kim; Atsuhiro Osuka","meso-Aryl-Substituted Subporphyrins: Synthesis, Structures, and Large Substituent Effects on Their Electronic Properties","Journal of the American Chemical Society","2007","129","","4747","4761","10.1021/ja069324z","","","0.71073","MoKα","","0.0975","0.0675","","","0.1709","0.1881","","","","","","1.028","","","","has coordinates,has disorder","178839","2020-10-21","18:00:00",""
"4109307","8.017","0.007","21.24","0.02","16.75","0.02","90","","90.28","0.05","90","","2852","5","123","2","123","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C37 H21 B N6 O -","- C37 H21 B N6 O -","- C148 H84 B4 N24 O4 -","4","1","","Yasuhide Inokuma; Zin Seok Yoon; Dongho Kim; Atsuhiro Osuka","meso-Aryl-Substituted Subporphyrins: Synthesis, Structures, and Large Substituent Effects on Their Electronic Properties","Journal of the American Chemical Society","2007","129","","4747","4761","10.1021/ja069324z","","","0.71075","MoKα","","0.1589","0.0854","","","0.1701","0.2036","","","","","","1.023","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109308","14.2905","0.0011","14.3984","0.0012","16.4038","0.0013","79.206","0.001","81.292","0.001","73.63","0.002","3163.7","0.4","90","2","90","2","","","","","","","","6","P 1","P 1","1","","","","- C139 H87 B4 Cl9 N24 O28 -","- C139 H87 B4 Cl9 N24 O28 -","- C139 H87 B4 Cl9 N24 O28 -","1","1","","Yasuhide Inokuma; Zin Seok Yoon; Dongho Kim; Atsuhiro Osuka","meso-Aryl-Substituted Subporphyrins: Synthesis, Structures, and Large Substituent Effects on Their Electronic Properties","Journal of the American Chemical Society","2007","129","","4747","4761","10.1021/ja069324z","","","0.71073","MoKα","","0.0594","0.0479","","","0.1208","0.1327","","","","","","1.039","","","","has coordinates,has disorder","178839","2020-10-21","18:00:00",""
"4109309","12.663","0.0011","14.0703","0.0013","14.9534","0.0013","111.674","0.002","103.125","0.002","101.496","0.002","2290.2","0.4","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C45.63 H51.21 B Cl1.31 N3 O13.57 -","- C45.631 H51.21 B Cl1.314 N3 O13.569 -","- C91.262 H102.42 B2 Cl2.628 N6 O27.138 -","2","1","","Yasuhide Inokuma; Zin Seok Yoon; Dongho Kim; Atsuhiro Osuka","meso-Aryl-Substituted Subporphyrins: Synthesis, Structures, and Large Substituent Effects on Their Electronic Properties","Journal of the American Chemical Society","2007","129","","4747","4761","10.1021/ja069324z","","","0.71073","MoKα","","0.0934","0.0724","","","0.1831","0.1978","","","","","","1.032","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109310","9.802","0.004","13.13","0.005","13.752","0.005","61.55","0.015","83.001","0.016","80.696","0.017","1533.6","1","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H18 B Br3 F3 N3 O2 -","- C35 H18 B Br3 F3 N3 O2 -","- C70 H36 B2 Br6 F6 N6 O4 -","2","1","","Yasuhide Inokuma; Zin Seok Yoon; Dongho Kim; Atsuhiro Osuka","meso-Aryl-Substituted Subporphyrins: Synthesis, Structures, and Large Substituent Effects on Their Electronic Properties","Journal of the American Chemical Society","2007","129","","4747","4761","10.1021/ja069324z","","","0.71075","MoKα","","0.0662","0.0467","","","0.1427","0.1617","","","","","","1.087","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109311","8.8051","0.0011","14.0155","0.0017","19.182","0.002","90","","94.398","0.002","90","","2360.2","0.5","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H14 Ag F6 N4 O2 Sb -","- C22 H14 Ag F6 N4 O2 Sb -","- C88 H56 Ag4 F24 N16 O8 Sb4 -","4","1","","Yu-Bin Dong; You-Yun Jiang; Jie Li; Jian-Ping Ma; Feng-Ling Liu; Bo Tang; Ru-Qi Huang; Stuart R. Batten","Temperature-Dependent Synthesis of Metal-Organic Frameworks Based on a Flexible Tetradentate Ligand with Bidirectional Coordination Donors","Journal of the American Chemical Society","2007","129","","4520","4521","10.1021/ja0701917","","","0.71073","MoKα","","0.0306","0.0266","","","0.0602","0.0619","","","","","","1.033","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109312","16.042","0.004","12.199","0.003","15.05","0.004","90","","110.326","0.004","90","","2761.8","1.2","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22 H18 Ag2 B2 F8 N4 O4 -","- C22 H18 Ag2 B2 F8 N4 O4 -","- C88 H72 Ag8 B8 F32 N16 O16 -","4","0.5","","Yu-Bin Dong; You-Yun Jiang; Jie Li; Jian-Ping Ma; Feng-Ling Liu; Bo Tang; Ru-Qi Huang; Stuart R. Batten","Temperature-Dependent Synthesis of Metal-Organic Frameworks Based on a Flexible Tetradentate Ligand with Bidirectional Coordination Donors","Journal of the American Chemical Society","2007","129","","4520","4521","10.1021/ja0701917","","","0.71073","MoKα","","0.1059","0.0701","","","0.1745","0.1945","","","","","","1.053","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109313","17.0901","0.0009","17.0901","0.0009","23.987","0.002","90","","90","","90","","7005.9","0.8","298","2","298","2","","","","","","","","7","I 41 2 2","I 4bw 2bw","98","","","","- C22 H14 Ag F6 N4 O2 Sb -","- C22 H14 Ag F6 N4 O2 Sb -","- C176 H112 Ag8 F48 N32 O16 Sb8 -","8","0.5","","Yu-Bin Dong; You-Yun Jiang; Jie Li; Jian-Ping Ma; Feng-Ling Liu; Bo Tang; Ru-Qi Huang; Stuart R. Batten","Temperature-Dependent Synthesis of Metal-Organic Frameworks Based on a Flexible Tetradentate Ligand with Bidirectional Coordination Donors","Journal of the American Chemical Society","2007","129","","4520","4521","10.1021/ja0701917","","","0.71073","MoKα","","0.0692","0.0465","","","0.0965","0.1026","","","","","","0.98","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109314","31.483","0.003","7.3937","0.0008","28.16","0.003","90","","113.377","0.002","90","","6016.9","1.1","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C25 H17 Ag B F4 N4 O2 -","- C25 H17 Ag B F4 N4 O2 -","- C200 H136 Ag8 B8 F32 N32 O16 -","8","1","","Yu-Bin Dong; You-Yun Jiang; Jie Li; Jian-Ping Ma; Feng-Ling Liu; Bo Tang; Ru-Qi Huang; Stuart R. Batten","Temperature-Dependent Synthesis of Metal-Organic Frameworks Based on a Flexible Tetradentate Ligand with Bidirectional Coordination Donors","Journal of the American Chemical Society","2007","129","","4520","4521","10.1021/ja0701917","","","0.71073","MoKα","","0.1196","0.0733","","","0.1979","0.2177","","","","","","1.085","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109315","7.4166","0.0006","6.8485","0.0007","20.6409","0.0016","90","","100.035","0.005","90","","1032.37","0.16","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C48 H48 N8 O8 -","4","1","","Kew-Yu Chen; Yi-Ming Cheng; Cheng-Hsuan Lai; Cheng-Chih Hsu; Mei-Lin Ho; Gene-Hsiang Lee; Pi-Tai Chou","Ortho Green Fluorescence Protein Synthetic Chromophore; Excited-State Intramolecular Proton Transfer via a Seven-Membered-Ring Hydrogen-Bonding System","Journal of the American Chemical Society","2007","129","","4534","4535","10.1021/ja070880i","","","0.71073","MoKα","","0.097","0.0445","","","0.0945","0.1158","","","","","","0.975","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109316","9.262","0.0007","17.608","0.002","7.774","0.0006","89.996","0.007","90.668","0.007","89.993","0.007","1267.7","0.2","293.1","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 O -","- C18 H14 O -","- C72 H56 O4 -","4","1","","Takayuki Kudoh; Tomoko Mori; Mitsuhito Shirahama; Masashi Yamada; Teruhiko Ishikawa; Seiki Saito; Hisayoshi Kobayashi","Intramolecular Anionic Diels-Alder Reactions of 1-Aryl-4-oxahepta-1,6-diyne Systems in DMSO","Journal of the American Chemical Society","2007","129","","4939","4947","10.1021/ja066485u","","","1.5419","CuKα","","","0.054","","","","0.066","","","","","","12.468","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109317","9.429","0.008","11.85","0.01","11.96","0.02","69.63","0.04","66.86","0.07","84.08","0.05","1151","2","293.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C16 H12 O -","- C16 H12 O -","- C64 H48 O4 -","4","2","","Takayuki Kudoh; Tomoko Mori; Mitsuhito Shirahama; Masashi Yamada; Teruhiko Ishikawa; Seiki Saito; Hisayoshi Kobayashi","Intramolecular Anionic Diels-Alder Reactions of 1-Aryl-4-oxahepta-1,6-diyne Systems in DMSO","Journal of the American Chemical Society","2007","129","","4939","4947","10.1021/ja066485u","","","1.5419","CuKα","","","0.058","","","","0.056","","","","","","5.358","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109318","17.872","0.002","17.872","0.002","33.61","0.004","90","","90","","90","","10735","2","273.2","","","","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","","","- C46 H38 Cl Co N2 O2 Pd -","- C46 H38 Cl Co N2 O10.31 Pd -","- C368 H304 Cl8 Co8 N16 O82.48 Pd8 -","8","1","","Mary P. Watson; Larry E. Overman; Robert G. Bergman","Kinetic and Computational Analysis of the Palladium(II)-Catalyzed Asymmetric Allylic Trichloroacetimidate Rearrangement: Development of a Model for Enantioselectivity","Journal of the American Chemical Society","2007","129","","5031","5044","10.1021/ja0676962","","","0.7107","MoKα","","0.1095","0.0543","","0.0637","","0.0544","","","","","","1.752","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109319","19.89","0.004","13.46","0.003","14.7","0.003","90","","110.69","0.03","90","","3681.7","1.5","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H36 Cl2 Mn2 N4 O14 -","- C34 H36 Cl2 Mn2 N4 O14 -","- C136 H144 Cl8 Mn8 N16 O56 -","4","0.5","","Lollita Lecren; Wolfgang Wernsdorfer; Yang-Guang Li; Alessandro Vindigni; Hitoshi Miyasaka; Rodolphe Clérac","One-Dimensional Supramolecular Organization of Single-Molecule Magnets","Journal of the American Chemical Society","2007","129","","5045","5051","10.1021/ja067744i","","","0.71073","MoKα","","0.0661","0.0403","","","0.0955","0.1087","","","","","","1.034","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109320","12.9201","0.0006","14.0054","0.0007","18.2113","0.0009","90","","98.677","0.001","90","","3257.6","0.3","141","2","141","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H44 F2 N2 Th -","- C36 H44 F2 N2 Th -","- C144 H176 F8 N8 Th4 -","4","0.5","","Eric J. Schelter; Ping Yang; Brian L. Scott; Ryan E. Da Re; Kimberly C. Jantunen; Richard L. Martin; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger","Systematic Studies of Early Actinide Complexes: Thorium(IV) Fluoroketimides","Journal of the American Chemical Society","2007","129","","5139","5152","10.1021/ja0686458","","","0.71073","MoKα","","0.0197","0.018","","","0.0484","0.0488","","","","","","1.323","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109321","10.18","0.005","17.88","0.008","18.364","0.008","90","","90","","90","","3343","3","203","2","203","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C36 H44 F2 N2 Th -","- C36 H44 F2 N2 Th -","- C144 H176 F8 N8 Th4 -","4","1","","Eric J. Schelter; Ping Yang; Brian L. Scott; Ryan E. Da Re; Kimberly C. Jantunen; Richard L. Martin; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger","Systematic Studies of Early Actinide Complexes: Thorium(IV) Fluoroketimides","Journal of the American Chemical Society","2007","129","","5139","5152","10.1021/ja0686458","","","0.71073","MoKα","","0.0471","0.0359","","","0.0757","0.0794","","","","","","0.99","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109322","15.568","0.002","11.3893","0.0017","18.841","0.003","90","","90.668","0.003","90","","3340.4","0.8","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H42 F4 N2 Th -","- C36 H42 F4 N2 Th -","- C144 H168 F16 N8 Th4 -","4","1","","Eric J. Schelter; Ping Yang; Brian L. Scott; Ryan E. Da Re; Kimberly C. Jantunen; Richard L. Martin; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger","Systematic Studies of Early Actinide Complexes: Thorium(IV) Fluoroketimides","Journal of the American Chemical Society","2007","129","","5139","5152","10.1021/ja0686458","","","0.71073","MoKα","","0.0806","0.0413","","","0.0742","0.086","","","","","","0.981","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109323","13.087","0.003","13.927","0.003","18.783","0.005","90","","99.272","0.003","90","","3378.7","1.4","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H40 F6 N2 Th -","- C36 H40 F6 N2 Th -","- C144 H160 F24 N8 Th4 -","4","0.5","","Eric J. Schelter; Ping Yang; Brian L. Scott; Ryan E. Da Re; Kimberly C. Jantunen; Richard L. Martin; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger","Systematic Studies of Early Actinide Complexes: Thorium(IV) Fluoroketimides","Journal of the American Chemical Society","2007","129","","5139","5152","10.1021/ja0686458","","","0.71073","MoKα","","0.0172","0.0145","","","0.0362","0.0372","","","","","","1.185","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109324","10.729","0.0005","17.7108","0.0008","19.3565","0.0009","108.759","0.001","90.192","0.001","102.902","0.001","3383.5","0.3","141","2","141","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H42 F4 N2 Th -","- C36 H42 F4 N2 Th -","- C144 H168 F16 N8 Th4 -","4","2","","Eric J. Schelter; Ping Yang; Brian L. Scott; Ryan E. Da Re; Kimberly C. Jantunen; Richard L. Martin; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger","Systematic Studies of Early Actinide Complexes: Thorium(IV) Fluoroketimides","Journal of the American Chemical Society","2007","129","","5139","5152","10.1021/ja0686458","","","0.71073","MoKα","","0.071","0.0442","","","0.1002","0.1092","","","","","","1.157","","","","has coordinates,has disorder","189367","2020-10-21","18:00:00",""
"4109325","14.566","0.002","16.206","0.002","15.119","0.002","90","","94.027","0.002","90","","3560.1","0.8","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H40 F6 N2 Th -","- C36 H40 F6 N2 Th -","- C144 H160 F24 N8 Th4 -","4","0.5","","Eric J. Schelter; Ping Yang; Brian L. Scott; Ryan E. Da Re; Kimberly C. Jantunen; Richard L. Martin; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger","Systematic Studies of Early Actinide Complexes: Thorium(IV) Fluoroketimides","Journal of the American Chemical Society","2007","129","","5139","5152","10.1021/ja0686458","","","0.71073","MoKα","","0.0362","0.0309","","","0.0746","0.079","","","","","","1.123","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109326","16.066","0.003","16.393","0.003","26.997","0.005","90","","90","","90","","7110","2","141","2","141","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C36 H36 F10 N2 Th -","- C36 H36 F10 N2 Th -","- C288 H288 F80 N16 Th8 -","8","1","","Eric J. Schelter; Ping Yang; Brian L. Scott; Ryan E. Da Re; Kimberly C. Jantunen; Richard L. Martin; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger","Systematic Studies of Early Actinide Complexes: Thorium(IV) Fluoroketimides","Journal of the American Chemical Society","2007","129","","5139","5152","10.1021/ja0686458","","","0.71073","MoKα","","0.0583","0.0249","","","0.0518","0.0594","","","","","","1.006","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109327","8.138","0.0004","12.384","0.0008","16.028","0.001","75.343","0.002","78.788","0.002","78.105","0.003","1511.82","0.16","130","2","130","2","","","","","","","","4","P -1","-P 1","2","TEMPOH","TEMPOH","","- C9 H19.67 N O1.33 -","- C9 H19.6667 N O1.33333 -","- C54 H118 N6 O8 -","6","3","","Mader, Elizabeth A.; Davidson, Ernest R.; Mayer, James M.","Large Ground-State Entropy Changes for Hydrogen Atom Transfer Reactions of Iron Complexes","Journal of the American Chemical Society","2007","129","16","5153","5166","10.1021/ja0686918","","","0.71073","MoKα","","0.1321","0.0633","","","0.1208","0.1407","","","","","","1","","","","has coordinates","210882","2020-10-21","18:00:00",""
"4109328","9.906","0.003","21.996","0.007","19.615","0.006","90","","104.005","0.004","90","","4147","2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H55 Cl3 Fe N13 O13 -","- C29.216 H53.04 Cl3 Fe N13 O12.804 -","- C116.864 H212.16 Cl12 Fe4 N52 O51.216 -","4","1","","Elizabeth A. Mader; Ernest R. Davidson; James M. Mayer","Large Ground-State Entropy Changes for Hydrogen Atom Transfer Reactions of Iron Complexes","Journal of the American Chemical Society","2007","129","","5153","5166","10.1021/ja0686918","","","0.71073","MoKα","","0.0814","0.0687","","","0.1586","0.1656","","","","","","1.12","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109329","11.4362","0.0007","8.1087","0.0005","17.759","0.0019","90","","108.488","0.002","90","","1561.8","0.2","173.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 N O -","- C19 H19 N O -","- C76 H76 N4 O4 -","4","1","","Yoshihiro Yamauchi; Gen Onodera; Ken Sakata; Masahiro Yuki; Yoshihiro Miyake; Sakae Uemura; Yoshiaki Nishibayashi","Ruthenium-Catalyzed Reactions of 1-Cyclopropyl-2-propyn-1-ols with Anilines and Water via Allenylidene Intermediates: Selective Preparation of Tri- and Tetrasubstituted Conjugated Enynes","Journal of the American Chemical Society","2007","129","","5175","5179","10.1021/ja0687926","","","0.71069","MoKα","","","0.0574","","","","0.119","","","","","","1.023","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109330","13.1648","0.0004","17.9501","0.0007","16.4012","0.0007","90","","106.72","0.0019","90","","3711.9","0.2","173.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35 H46 Cl F3 O3 Ru2 S3 -","- C35 H46 Cl F3 O3 Ru2 S3 -","- C140 H184 Cl4 F12 O12 Ru8 S12 -","4","1","","Yoshihiro Yamauchi; Gen Onodera; Ken Sakata; Masahiro Yuki; Yoshihiro Miyake; Sakae Uemura; Yoshiaki Nishibayashi","Ruthenium-Catalyzed Reactions of 1-Cyclopropyl-2-propyn-1-ols with Anilines and Water via Allenylidene Intermediates: Selective Preparation of Tri- and Tetrasubstituted Conjugated Enynes","Journal of the American Chemical Society","2007","129","","5175","5179","10.1021/ja0687926","","","0.71069","MoKα","","","0.041","","","","0.0764","","","","","","0.958","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109331","10.2129","0.001","12.7886","0.0012","16.5713","0.0014","100.309","0.006","100.679","0.0019","105.315","0.002","1991.2","0.3","173.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H22 O1.5 P -","- C24 H21 O1.5 P -","- C96 H84 O6 P4 -","4","2","","Yoshihiro Yamauchi; Gen Onodera; Ken Sakata; Masahiro Yuki; Yoshihiro Miyake; Sakae Uemura; Yoshiaki Nishibayashi","Ruthenium-Catalyzed Reactions of 1-Cyclopropyl-2-propyn-1-ols with Anilines and Water via Allenylidene Intermediates: Selective Preparation of Tri- and Tetrasubstituted Conjugated Enynes","Journal of the American Chemical Society","2007","129","","5175","5179","10.1021/ja0687926","","","0.71069","MoKα","","","0.0647","","","","0.1739","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109332","11.4046","0.0009","11.4046","0.0009","27.538","0.004","90","","90","","90","","3581.7","0.7","298","2","298","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C64 H64 Cl La3 N16 O28 -","- C64 H64 Cl La3 N16 O28 -","- C128 H128 Cl2 La6 N32 O56 -","2","0.125","","Yu-Bin Dong; Peng Wang; Jian-Ping Ma; Xia-Xia Zhao; Hai-Ying Wang; Bo Tang; Ru-Qi Huang","Coordination-Driven Nanosized Lanthanide ""Molecular Lantern"" with Tunable Luminescent Properties","Journal of the American Chemical Society","2007","129","","4872","4873","10.1021/ja070058e","","","0.71073","MoKα","","0.0335","0.0297","","","0.0666","0.0683","","","","","","1.068","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109333","11.3839","0.0013","11.3839","0.0013","27.512","0.006","90","","90","","90","","3565.4","1","298","2","298","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C64 H64 Ce3 Cl N16 O28 -","- C64 H64 Ce3 Cl N16 O28 -","- C128 H128 Ce6 Cl2 N32 O56 -","2","0.125","","Yu-Bin Dong; Peng Wang; Jian-Ping Ma; Xia-Xia Zhao; Hai-Ying Wang; Bo Tang; Ru-Qi Huang","Coordination-Driven Nanosized Lanthanide ""Molecular Lantern"" with Tunable Luminescent Properties","Journal of the American Chemical Society","2007","129","","4872","4873","10.1021/ja070058e","","","0.71073","MoKα","","0.0293","0.0254","","","0.0634","0.0652","","","","","","1.059","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109334","11.3309","0.0016","11.3309","0.0016","27.469","0.007","90","","90","","90","","3526.7","1.1","298","2","298","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C64 H64 Cl N16 O28 Sm3 -","- C64 H64 Cl N16 O28 Sm3 -","- C128 H128 Cl2 N32 O56 Sm6 -","2","0.125","","Yu-Bin Dong; Peng Wang; Jian-Ping Ma; Xia-Xia Zhao; Hai-Ying Wang; Bo Tang; Ru-Qi Huang","Coordination-Driven Nanosized Lanthanide ""Molecular Lantern"" with Tunable Luminescent Properties","Journal of the American Chemical Society","2007","129","","4872","4873","10.1021/ja070058e","","","0.71073","MoKα","","0.0291","0.026","","","0.0645","0.0657","","","","","","1.096","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109335","11.3115","0.001","11.3115","0.001","27.413","0.004","90","","90","","90","","3507.5","0.7","298","2","298","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C64 H64 Cl Eu3 N16 O28 -","- C64 H64 Cl Eu3 N16 O28 -","- C128 H128 Cl2 Eu6 N32 O56 -","2","0.125","","Yu-Bin Dong; Peng Wang; Jian-Ping Ma; Xia-Xia Zhao; Hai-Ying Wang; Bo Tang; Ru-Qi Huang","Coordination-Driven Nanosized Lanthanide ""Molecular Lantern"" with Tunable Luminescent Properties","Journal of the American Chemical Society","2007","129","","4872","4873","10.1021/ja070058e","","","0.71073","MoKα","","0.0331","0.029","","","0.0707","0.0726","","","","","","1.058","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109336","11.3002","0.0006","11.3002","0.0006","27.361","0.003","90","","90","","90","","3493.8","0.5","298","2","298","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C64 H64 Cl N16 O28 Tb3 -","- C64 H64 Cl N16 O28 Tb3 -","- C128 H128 Cl2 N32 O56 Tb6 -","2","0.125","","Yu-Bin Dong; Peng Wang; Jian-Ping Ma; Xia-Xia Zhao; Hai-Ying Wang; Bo Tang; Ru-Qi Huang","Coordination-Driven Nanosized Lanthanide ""Molecular Lantern"" with Tunable Luminescent Properties","Journal of the American Chemical Society","2007","129","","4872","4873","10.1021/ja070058e","","","0.71073","MoKα","","0.0394","0.0375","","","0.1009","0.1024","","","","","","1.055","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109337","11.1813","0.0004","11.1813","0.0004","31.552","0.0013","90","","90","","90","","3944.7","0.3","100","2","100","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C34 H42 N4 Ni O14 -","- C34 H42 N4 Ni O14 -","- C136 H168 N16 Ni4 O56 -","4","0.5","","Zhuojia Lin; Alexandra M. Z. Slawin; Russell E. Morris","Chiral Induction in the Ionothermal Synthesis of a 3-D Coordination Polymer","Journal of the American Chemical Society","2007","129","","4880","4881","10.1021/ja070671y","","","0.71073","MoKα","","0.0275","0.0254","","","0.0617","0.0625","","","","","","1.068","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109338","11.1918","0.0016","11.1918","0.0016","31.561","0.006","90","","90","","90","","3953.2","1.1","150","2","150","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","SIMOF-4a","","","- C34 H42 N4 Ni O14 -","- C34 H32 N4 Ni O14 -","- C136 H128 N16 Ni4 O56 -","4","0.5","","Zhuojia Lin; Alexandra M. Z. Slawin; Russell E. Morris","Chiral Induction in the Ionothermal Synthesis of a 3-D Coordination Polymer","Journal of the American Chemical Society","2007","129","","4880","4881","10.1021/ja070671y","","","0.7848","synchrotron","","0.0631","0.0506","","","0.1199","0.1276","","","","","","1.039","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109339","6.5372","0.0009","8.6615","0.0012","23.493","0.003","90","","90","","90","","1330.2","0.3","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","05167a","","","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","- C64 H64 N8 O16 -","4","1","","Jiachang Gong; Shana J. Sturla","A Synthetic Nucleoside Probe that Discerns a DNA Adduct from Unmodified DNA","Journal of the American Chemical Society","2007","129","","4882","4883","10.1021/ja070688g","","","0.71073","MoKα","","0.0378","0.0336","","","0.0924","0.0969","","","","","","1.099","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109340","9.2189","0.0011","11.7583","0.0015","17.726","0.002","78.151","0.003","84.614","0.003","78.245","0.003","1838.4","0.4","125","2","125","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H57 N O P2 Ti -","- C38 H57 N O P2 Ti -","- C76 H114 N2 O2 P4 Ti2 -","2","1","","Brad C. Bailey; John C. Huffman; Daniel J. Mindiola","Intermolecular Activation of C-X (X = H, O, F) Bonds by a Ti\τbCtBu Linkage","Journal of the American Chemical Society","2007","129","","5302","5303","10.1021/ja0684646","","","0.71073","MoKα","","0.0579","0.0371","","","0.0849","0.0909","","","","","","0.953","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109341","9.6334","0.0005","12.3727","0.0007","15.9106","0.0009","98.381","0.002","93.99","0.002","92.012","0.002","1869.64","0.18","121","2","121","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H55 F2 N O P2 Ti -","- C38 H55 F2 N O P2 Ti -","- C76 H110 F4 N2 O2 P4 Ti2 -","2","1","","Brad C. Bailey; John C. Huffman; Daniel J. Mindiola","Intermolecular Activation of C-X (X = H, O, F) Bonds by a Ti\τbCtBu Linkage","Journal of the American Chemical Society","2007","129","","5302","5303","10.1021/ja0684646","","","0.71073","MoKα","","0.0837","0.0445","","","0.0923","0.1046","","","","","","0.847","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109342","19.536","0.005","18.424","0.004","22.264","0.006","90","","90","","90","","8014","3","128","2","128","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C38 H52 F5 N O P2 Ti -","- C38 H52 F5 N O P2 Ti -","- C304 H416 F40 N8 O8 P16 Ti8 -","8","1","","Brad C. Bailey; John C. Huffman; Daniel J. Mindiola","Intermolecular Activation of C-X (X = H, O, F) Bonds by a Ti\τbCtBu Linkage","Journal of the American Chemical Society","2007","129","","5302","5303","10.1021/ja0684646","","","0.71073","MoKα","","0.1184","0.0396","","","0.0751","0.0938","","","","","","0.767","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109343","11.9914","0.0011","12.9183","0.0012","14.0469","0.0013","75.355","0.002","80.673","0.002","78.61","0.002","2049.4","0.3","128","2","128","2","","","","","","","","6","P -1","-P 1","2","","","","- C39.5 H55 F6 N P2 Ti -","- C39.5 H54.5 F6 N P2 Ti -","- C79 H109 F12 N2 P4 Ti2 -","2","1","","Brad C. Bailey; John C. Huffman; Daniel J. Mindiola","Intermolecular Activation of C-X (X = H, O, F) Bonds by a Ti\τbCtBu Linkage","Journal of the American Chemical Society","2007","129","","5302","5303","10.1021/ja0684646","","","0.71073","MoKα","","0.0787","0.038","","","0.0779","0.0891","","","","","","0.884","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109344","12.0007","0.0008","19.8508","0.0013","17.3665","0.0012","90","","107.841","0.002","90","","3938.2","0.5","124","2","124","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H49 F8 N P2 Ti -","- C38 H49 F8 N P2 Ti -","- C152 H196 F32 N4 P8 Ti4 -","4","1","","Brad C. Bailey; John C. Huffman; Daniel J. Mindiola","Intermolecular Activation of C-X (X = H, O, F) Bonds by a Ti\τbCtBu Linkage","Journal of the American Chemical Society","2007","129","","5302","5303","10.1021/ja0684646","","","0.71073","MoKα","","0.0568","0.034","","","0.0806","0.0882","","","","","","0.945","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4109345","10.3246","0.001","10.512","0.001","18.6371","0.0018","74.369","0.002","81.009","0.002","76.569","0.002","1885.1","0.3","125","2","125","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H49 F8 N P2 Ti -","- C38 H49 F8 N P2 Ti -","- C76 H98 F16 N2 P4 Ti2 -","2","1","","Brad C. Bailey; John C. Huffman; Daniel J. Mindiola","Intermolecular Activation of C-X (X = H, O, F) Bonds by a Ti\τbCtBu Linkage","Journal of the American Chemical Society","2007","129","","5302","5303","10.1021/ja0684646","","","0.71073","MoKα","","0.0465","0.0384","","","0.1053","0.1099","","","","","","1.027","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109346","15.5934","0.0011","32.0613","0.0018","16.2353","0.0013","90","","105.16","0.006","90","","7834.3","1","208","2","208","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C173 H135 Cl3 N18 O20 -","- C173 H135 Cl3 N18 O20 -","- C346 H270 Cl6 N36 O40 -","2","0.5","","Pilar Hidalgo Ramos; Ruud G. E. Coumans; Alexander B. C. Deutman; Jan M. M. Smits; Rene de Gelder; Johannes A. A. W. Elemans; Roeland J. M. Nolte; Alan E. Rowan","Processive Rotaxane Systems. Studies on the Mechanism and Control of the Threading Process","Journal of the American Chemical Society","2007","129","","5699","5702","10.1021/ja068714i","","","0.71073","MoKα","","0.206","0.1286","","0.2939","0.2577","0.2939","","","1.109","","","1.109","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109347","25.544","0.002","32.347","0.004","12.809","0.002","90","","90","","90","","10584","2","110","","110","2","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C54 H58 B2 F8 Fe3 N10 O2 -","- C54 H58 B2 F8 Fe3 N10 O2 -","- C432 H464 B16 F64 Fe24 N80 O16 -","8","0.5","","Masayuki Nihei; Lingqin Han; Hiroki Oshio","Magnetic Bistability and Single-Crystal-to-Single-Crystal Transformation Induced by Guest Desorption","Journal of the American Chemical Society","2007","129","","5312","5313","10.1021/ja069120i","","","0.71073","MoKα","","0.07","0.0526","","","0.1354","0.1506","","","","","","1.026","","","","has coordinates","264242","2021-04-16","08:51:56",""
"4109348","25.04","0.02","12.792","0.012","19.806","0.019","90","","126.364","0.014","90","","5109","8","100","","110","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C50 H38 B2 F8 Fe3 N10 O -","- C49.68 H41.52 B2 F8 Fe3 N10 O2 -","- C198.72 H166.08 B8 F32 Fe12 N40 O8 -","4","0.5","","Masayuki Nihei; Lingqin Han; Hiroki Oshio","Magnetic Bistability and Single-Crystal-to-Single-Crystal Transformation Induced by Guest Desorption","Journal of the American Chemical Society","2007","129","","5312","5313","10.1021/ja069120i","","","0.71073","MoKα","","0.165","0.1317","","","0.3394","0.3631","","","","","","1.033","","","","has coordinates,has disorder","178839","2020-10-21","18:00:00",""
"4109349","25.42","0.02","12.686","0.012","20.653","0.019","90","","126.569","0.014","90","","5349","8","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C50 H34 B2 F8 Fe3 N10 O -","- C49 H40 B2 F8 Fe3 N10 O -","- C196 H160 B8 F32 Fe12 N40 O4 -","4","0.5","","Masayuki Nihei; Lingqin Han; Hiroki Oshio","Magnetic Bistability and Single-Crystal-to-Single-Crystal Transformation Induced by Guest Desorption","Journal of the American Chemical Society","2007","129","","5312","5313","10.1021/ja069120i","","","0.71073","MoKα","","0.167","0.1135","","","0.3457","0.3845","","","","","","1.238","","","","has coordinates,has disorder","178839","2020-10-21","18:00:00",""
"4109350","13.554","0.005","12.809","0.005","22.151","0.008","90","","99.081","0.005","90","","3798","2","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C54 H85 Cl4 N6 Ni3 O34 -","- C54 H85 Cl4 N6 Ni3 O34 -","- C108 H170 Cl8 N12 Ni6 O68 -","2","1","","Da-Wei Fu; Yu-Mei Song; Guo-Xi Wang; Qiong Ye; Ren-Gen Xiong; Tomoyuki Akutagawa; Takayoshi Nakamura; Philip Wai Hong Chan; Songping D. Huang","Dielectric Anisotropy of a Homochiral Trinuclear Nickel(II) Complex","Journal of the American Chemical Society","2007","129","","5346","5347","10.1021/ja0701816","","","0.71073","MoKα","","0.0872","0.0643","","","0.1364","0.1427","","","","","","1.033","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109351","8.9295","0.0009","10.2667","0.001","14.3876","0.0014","99.62","0.002","107.679","0.002","98.996","0.002","1208.5","0.2","120","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H48 P2 Pt -","- C20 H48 P2 Pt -","- C40 H96 P4 Pt2 -","2","1","","Raffaello Romeo; Giuseppina D'Amico; Emilia Sicilia; Nino Russo; Silvia Rizzato","β-Hydrogen Kinetic Effect","Journal of the American Chemical Society","2007","129","","5744","5755","10.1021/ja0702162","","","0.71073","MoKα","","0.0156","0.0148","","","0.0369","0.0372","","","","","","1.075","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109352","10.0845","0.0005","10.7797","0.0006","15.0195","0.0008","76.057","0.001","71.396","0.001","69.137","0.001","1430.94","0.13","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H24 N6 O7 Ru -","- C32 H24 N6 O7 Ru -","- C64 H48 N12 O14 Ru2 -","2","1","","Michael J. Rose; Marilyn M. Olmstead; Pradip K. Mascharak","Photosensitization via Dye Coordination: A New Strategy to Synthesize Metal Nitrosyls That Release NO under Visible Light","Journal of the American Chemical Society","2007","129","","5342","5343","10.1021/ja070247x","","","0.71073","MoKα","","0.0499","0.0348","","","0.0775","0.0839","","","","","","0.954","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109353","9.6421","0.0004","10.2603","0.0004","12.2844","0.0005","75.43","0.003","75.3","0.003","89.954","0.003","1135.14","0.08","90","2","90","2","","","","","","","","6","P -1","-P 1","2","[Ru(Me~2~bpb)(NO)(OH)]^.^DMSO","","","- C22 H23 N5 O5 Ru S -","- C22 H23 N5 O5 Ru S -","- C44 H46 N10 O10 Ru2 S2 -","2","1","","Michael J. Rose; Marilyn M. Olmstead; Pradip K. Mascharak","Photosensitization via Dye Coordination: A New Strategy to Synthesize Metal Nitrosyls That Release NO under Visible Light","Journal of the American Chemical Society","2007","129","","5342","5343","10.1021/ja070247x","","","0.71073","MoKα","","0.0213","0.0199","","","0.0522","0.0532","","","","","","1.054","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109354","10.278","0.001","10.278","0.001","10.278","0.001","90","","90","","90","","1085.74","0.18","","","","","","","","","","","","2","P m -3 n","-P 4n 2 3","223","K8-x Si46","","","- K6.95 Si46 -","- K6.952 Si46 -","- K6.952 Si46 -","1","0.0208333","","Bodo Böhme; Arnold Guloy; Zhongjia Tang; Walter Schnelle; Ulrich Burkhardt; Michael Baitinger; Yuri Grin","Oxidation of M4Si4 (M = Na, K) to Clathrates by HCl or H2O","Journal of the American Chemical Society","2007","129","","5348","5349","10.1021/ja0705691","powder diffraction","x-ray","0","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109355","10.199","0.001","10.199","0.001","10.199","0.001","90","","90","","90","","1060.9","0.18","","","","","","","","","","","","2","P m -3 n","-P 4n 2 3","223","","","","- Na6.19 Si46 -","- Na6.168 Si46 -","- Na6.168 Si46 -","1","0.0208333","","Bodo Böhme; Arnold Guloy; Zhongjia Tang; Walter Schnelle; Ulrich Burkhardt; Michael Baitinger; Yuri Grin","Oxidation of M4Si4 (M = Na, K) to Clathrates by HCl or H2O","Journal of the American Chemical Society","2007","129","","5348","5349","10.1021/ja0705691","powder diffraction","x-ray","1.54056","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109356","8.8625","0.0001","8.8625","0.0001","47.1249","0.0012","90","","90","","120","","3205.48","0.1","100","2","100","2","","","","","","","synthesis as described","3","P 31 2 1","P 31 2""","152","","","","- C25 H26 O4 -","- C25 H26 O4 -","- C150 H156 O24 -","6","1","","Luca Bernardi; Jesús López-Cantarero; Barbara Niess; Karl Anker Jørgensen","Organocatalytic Asymmetric 1,6-Additions of β-Ketoesters and Glycine Imine","Journal of the American Chemical Society","2007","129","","5772","5778","10.1021/ja0707097","","x-ray","1.54178","CuKα","","0.0283","0.0266","","","0.0641","0.0649","","","","","","1.022","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109357","31.0722","0.0006","31.0722","0.0006","9.8995","0.0004","90","","90","","90","","9557.8","0.5","293","2","293","2","","","","","","","","8","I 41/a c d :2","-I 4bd 2c","142","","","","- C8 H28 F Ga N2 O12 P4 Zn2 -","- C8 H10 F Ga N2 O12 P4 Zn2 -","- C128 H160 F16 Ga16 N32 O192 P64 Zn32 -","16","0.5","","Yu-Lun Lai; Kwang-Hwa Lii; Sue-Lein Wang","26-Ring-Channel Structure Constructed from Bimetal Phosphite Helical Chains","Journal of the American Chemical Society","2007","129","","5350","5351","10.1021/ja070733k","","","0.71073","MoKα","","0.0897","0.0462","","","0.1153","0.1274","","","","","","0.873","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109358","31.0134","0.0014","31.0134","0.0014","9.8348","0.0008","90","","90","","90","","9459.4","1","293","2","293","2","","","","","","","","8","I 41/a c d :2","-I 4bd 2c","142","","","","- C8 H28 Al F N2 O12 P4 Zn2 -","- C8 H10 Al F N2 O12 P4 Zn2 -","- C128 H160 Al16 F16 N32 O192 P64 Zn32 -","16","0.5","","Yu-Lun Lai; Kwang-Hwa Lii; Sue-Lein Wang","26-Ring-Channel Structure Constructed from Bimetal Phosphite Helical Chains","Journal of the American Chemical Society","2007","129","","5350","5351","10.1021/ja070733k","","","0.71073","MoKα","","0.1166","0.0547","","","0.1497","0.1706","","","","","","0.933","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109359","9.402","0.0007","10.0753","0.0007","10.88","0.0008","93.665","0.001","95.438","0.001","91.537","0.001","1023.34","0.13","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H24 N2 O2 -","- C26 H24 N2 O2 -","- C52 H48 N4 O4 -","2","1","","Audrey Chan; Karl A. Scheidt","Highly Stereoselective Formal [3 + 3] Cycloaddition of Enals and Azomethine Imines Catalyzed by N-Heterocyclic Carbenes","Journal of the American Chemical Society","2007","129","","5334","5335","10.1021/ja0709167","","","0.71073","MoKα","","0.0678","0.0612","","","0.1746","0.1805","","","","","","1.061","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109360","14.0875","0.0005","19.1557","0.0006","22.0078","0.0007","90","","90","","90","","5938.9","0.3","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C52 H94 Ga N6 Nd O Si3 -","- C52 H94 Ga N6 Nd O Si3 -","- C208 H376 Ga4 N24 Nd4 O4 Si12 -","4","1","","Polly L. Arnold; Stephen T. Liddle; Jonathan McMaster; Cameron Jones; David P. Mills","A Lanthanide-Gallium Complex Stabilized by the N-Heterocyclic Carbene Group","Journal of the American Chemical Society","2007","129","","5360","5361","10.1021/ja0710858","","","0.71073","MoKα","","0.0291","0.0259","","","0.0619","0.0632","","","","","","1.009","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109361","9.0412","0.0002","14.243","0.0003","15.6092","0.0004","90","","105.103","0.001","90","","1940.63","0.08","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H33 N O W -","- C19 H33 N O W -","- C76 H132 N4 O4 W4 -","4","1","","Jenkins Y. K. Tsang; Miriam S. A. Buschhaus; Peter Legzdins","Selective Activation and Functionalization of Linear Alkanes Initiated under Ambient Conditions by a Tungsten Allyl Nitrosyl Complex","Journal of the American Chemical Society","2007","129","","5372","5373","10.1021/ja0713633","","","0.71073","MoKα","","0.0222","0.0178","","","0.0411","0.0423","","","","","","1.08","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109362","8.9209","0.0005","18.9252","0.0009","11.3669","0.0006","90","","90.286","0.003","90","","1919.05","0.17","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H33 N O W -","- C19 H33 N O W -","- C76 H132 N4 O4 W4 -","4","1","","Jenkins Y. K. Tsang; Miriam S. A. Buschhaus; Peter Legzdins","Selective Activation and Functionalization of Linear Alkanes Initiated under Ambient Conditions by a Tungsten Allyl Nitrosyl Complex","Journal of the American Chemical Society","2007","129","","5372","5373","10.1021/ja0713633","","","0.71073","MoKα","","0.0316","0.0232","","","0.0495","0.0526","","","","","","1.038","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109363","8.1936","0.0004","15.3514","0.0008","14.9078","0.0007","90","","90.02","0.001","90","","1875.15","0.16","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H30 N O P W -","- C17 H30 N O P W -","- C68 H120 N4 O4 P4 W4 -","4","1","","Jenkins Y. K. Tsang; Miriam S. A. Buschhaus; Peter Legzdins","Selective Activation and Functionalization of Linear Alkanes Initiated under Ambient Conditions by a Tungsten Allyl Nitrosyl Complex","Journal of the American Chemical Society","2007","129","","5372","5373","10.1021/ja0713633","","","0.71073","MoKα","","0.0284","0.0216","","","0.051","0.0536","","","","","","1.014","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109364","11.8124","0.0003","15.508","0.0004","15.4175","0.0003","90","","99.9183","0.0015","90","","2782.07","0.12","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 Cl4 O7 S2 -","- C26 H22 Cl4 O7 S2 -","- C104 H88 Cl16 O28 S8 -","4","1","","Hongjun Ren; Guillaume Dunet; Peter Mayer; Paul Knochel","Highly Diastereoselective Synthesis of Homoallylic Alcohols Bearing Adjacent Quaternary Centers Using Substituted Allylic Zinc Reagents","Journal of the American Chemical Society","2007","129","","5376","5377","10.1021/ja071380s","","","0.71073","MoKα","","0.0782","0.0612","","","0.142","0.15","","","","","","1.128","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109365","10.0151","0.0003","9.6694","0.0002","11.7012","0.0003","90","","108.036","0.0015","90","","1077.46","0.05","200","2","200","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H28 N2 O6 -","- C22 H28 N2 O6 -","- C44 H56 N4 O12 -","2","1","","Hongjun Ren; Guillaume Dunet; Peter Mayer; Paul Knochel","Highly Diastereoselective Synthesis of Homoallylic Alcohols Bearing Adjacent Quaternary Centers Using Substituted Allylic Zinc Reagents","Journal of the American Chemical Society","2007","129","","5376","5377","10.1021/ja071380s","","","0.71073","MoKα","","0.0528","0.0401","","","0.0866","0.0943","","","","","","1.041","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109366","6.2036","0.0002","9.6857","0.0002","12.6242","0.0003","102.801","0.0017","95.8199","0.0016","97.0683","0.0015","727.55","0.03","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 Fe O -","- C18 H22 Fe O -","- C36 H44 Fe2 O2 -","2","1","","Hongjun Ren; Guillaume Dunet; Peter Mayer; Paul Knochel","Highly Diastereoselective Synthesis of Homoallylic Alcohols Bearing Adjacent Quaternary Centers Using Substituted Allylic Zinc Reagents","Journal of the American Chemical Society","2007","129","","5376","5377","10.1021/ja071380s","","","0.71073","MoKα","","0.0328","0.0268","","","0.0625","0.0659","","","","","","1.026","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109367","14.4586","0.0004","20.9241","0.001","13.0389","0.0005","90","","91.641","0.002","90","","3943.1","0.3","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 Br N3 O -","- C22 H22 Br N3 O -","- C176 H176 Br8 N24 O8 -","8","2","","Hongjun Ren; Guillaume Dunet; Peter Mayer; Paul Knochel","Highly Diastereoselective Synthesis of Homoallylic Alcohols Bearing Adjacent Quaternary Centers Using Substituted Allylic Zinc Reagents","Journal of the American Chemical Society","2007","129","","5376","5377","10.1021/ja071380s","","","0.71073","MoKα","","0.0738","0.0406","","","0.0752","0.0863","","","","","","1.035","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109368","11.3353","0.0003","18.1292","0.0006","18.4996","0.0006","103.686","0.001","103.877","0.001","101.685","0.001","3447.78","0.19","111","2","111","2","","","","","","","","6","P -1","-P 1","2","","","","- C32.5 H64 N P2 Re Si2 -","- C31.25 H58 N P2 Re Si2 -","- C125 H232 N4 P8 Re4 Si8 -","4","2","","Oleg V. Ozerov; Lori A. Watson; Maren Pink; Kenneth G. Caulton","Operationally Unsaturated Pincer/Rhenium Complexes Form Metal Carbenes from Cycloalkenes and Metal Carbynes from Alkanes","Journal of the American Chemical Society","2007","129","","6003","6016","10.1021/ja062327r","","","0.71073","MoKα","","0.0496","0.0286","","","0.0572","0.0653","","","","","","1.048","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109369","10.6899","0.0002","11.663","0.0003","16.4431","0.0004","78.732","0.001","85.921","0.001","68.273","0.001","1867.71","0.08","115","2","115","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H68 N P2 Re Si2 -","- C35 H68 N P2 Re Si2 -","- C70 H136 N2 P4 Re2 Si4 -","2","1","","Oleg V. Ozerov; Lori A. Watson; Maren Pink; Kenneth G. Caulton","Operationally Unsaturated Pincer/Rhenium Complexes Form Metal Carbenes from Cycloalkenes and Metal Carbynes from Alkanes","Journal of the American Chemical Society","2007","129","","6003","6016","10.1021/ja062327r","","","0.71073","MoKα","","0.0263","0.0216","","","0.0498","0.0521","","","","","","1.025","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4109370","12.4472","0.0007","35.944","0.002","8.7929","0.0005","90","","91.507","0.001","90","","3932.6","0.4","115","2","115","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H71 N P2 Re Si2 -","- C36 H71 N P2 Re Si2 -","- C144 H284 N4 P8 Re4 Si8 -","4","1","","Oleg V. Ozerov; Lori A. Watson; Maren Pink; Kenneth G. Caulton","Operationally Unsaturated Pincer/Rhenium Complexes Form Metal Carbenes from Cycloalkenes and Metal Carbynes from Alkanes","Journal of the American Chemical Society","2007","129","","6003","6016","10.1021/ja062327r","","","0.71073","MoKα","","0.0617","0.0415","","","0.0791","0.0849","","","","","","1.192","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4109371","9.5377","0.0002","17.6915","0.0004","18.1246","0.0004","90","","93.426","0.001","90","","3052.81","0.12","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H56 N P2 Re Si2 -","- C25 H56 N P2 Re Si2 -","- C100 H224 N4 P8 Re4 Si8 -","4","1","","Oleg V. Ozerov; Lori A. Watson; Maren Pink; Kenneth G. Caulton","Operationally Unsaturated Pincer/Rhenium Complexes Form Metal Carbenes from Cycloalkenes and Metal Carbynes from Alkanes","Journal of the American Chemical Society","2007","129","","6003","6016","10.1021/ja062327r","","","0.71073","MoKα","","0.0202","0.017","","","0.0424","0.0439","","","","","","1.059","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4109372","4.8834","0.0012","2.9197","0.0019","9.243","0.004","90","","88.82","0.03","90","","131.76","0.11","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Co0.012 H2 Ni0.988 O2 -","- Co0.012 H1.06 Ni0.988 O2 -","- Co0.048 H4.24 Ni3.952 O8 -","4","0.5","","Montse Casas-Cabanas; Jesús Canales-Vázquez; Juan Rodríguez-Carvajal; M. Rosa Palacín","Deciphering the Structural Transformations during Nickel Oxyhydroxide Electrode Operation","Journal of the American Chemical Society","2007","129","","5840","5842","10.1021/ja068433a","powder diffraction","neutron","1.2244","ConstantWavelengthNeutronDiffraction","","","","","","","","","2.683","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109373","6.7152","0.0003","15.2227","0.0007","19.6615","0.0009","89.651","0.002","88.84","0.002","79.481","0.002","1975.68","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H30 S4 Si2 -","- C24 H30 S4 Si2 -","- C72 H90 S12 Si6 -","3","1.5","","Haiyan Li; Anand Sundararaman; Krishnan Venkatasubbaiah; Frieder Jäkle","Organoborane Acceptor-Substituted Polythiophene via Side-Group Borylation","Journal of the American Chemical Society","2007","129","","5792","5793","10.1021/ja068771b","","","1.54178","CuKα","","0.0278","0.026","","","0.0701","0.0714","","","","","","1.045","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109374","8.3469","0.0001","11.5463","0.0002","13.6888","0.0002","100.787","0.001","90.246","0.001","98.711","0.001","1280.28","0.03","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C55 H57 B2 Cl3 S4 -","- C55 H57 B2 Cl3 S4 -","- C55 H57 B2 Cl3 S4 -","1","0.5","","Haiyan Li; Anand Sundararaman; Krishnan Venkatasubbaiah; Frieder Jäkle","Organoborane Acceptor-Substituted Polythiophene via Side-Group Borylation","Journal of the American Chemical Society","2007","129","","5792","5793","10.1021/ja068771b","","","1.54178","CuKα","","0.0404","0.0365","","","0.0957","0.0986","","","","","","1.029","","","","has coordinates,has disorder","178839","2020-10-21","18:00:00",""
"4109375","11.6923","0.0006","15.7382","0.0008","16.8933","0.0009","90","","106.055","0.001","90","","2987.4","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H36 Cl2 Hg N2 O10 S2 -","- C23 H36 Cl2 Hg N2 O10 S2 -","- C92 H144 Cl8 Hg4 N8 O40 S8 -","4","1","","Elizabeth M. Nolan; Stephen J. Lippard","Turn-On and Ratiometric Mercury Sensing in Water with a Red-Emitting Probe","Journal of the American Chemical Society","2007","129","","5910","5918","10.1021/ja068879r","","","0.71073","MoKα","","0.0255","0.023","","","0.0559","0.0575","","","","","","1.042","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109376","9.554","0.004","21.121","0.008","14.52","0.006","90","","103.265","0.007","90","","2852","2","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H28 Cl2 Hg N6 O8 -","- C26 H28 Cl2 Hg N6 O8 -","- C104 H112 Cl8 Hg4 N24 O32 -","4","1","","Elizabeth M. Nolan; Stephen J. Lippard","Turn-On and Ratiometric Mercury Sensing in Water with a Red-Emitting Probe","Journal of the American Chemical Society","2007","129","","5910","5918","10.1021/ja068879r","","","0.71073","MoKα","","0.0562","0.0405","","","0.0749","0.0799","","","","","","1.093","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109377","16.8241","0.0012","17.8745","0.0012","20.1482","0.0014","95.65","0.001","93.092","0.001","97.816","0.001","5959.6","0.7","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C200 H184 Hg4 N20.8 Nd12 O6 Se30 -","- C200 H184 Hg4 N20.8 Nd12 O6 Se30 -","- C200 H184 Hg4 N20.8 Nd12 O6 Se30 -","1","0.5","","Santanu Banerjee; G. Ajith Kumar; Richard E. Riman; Thomas J. Emge; John G. Brennan","Oxoclusters of the Lanthanides Begin to Resemble Solid-State Materials at Very Small Cluster Sizes: Structure and NIR Emission from Nd(III)","Journal of the American Chemical Society","2007","129","","5926","5931","10.1021/ja069000a","","","0.71073","MoKα","","0.1137","0.0655","","","0.1746","0.1922","","","","","","1.031","","","","has coordinates,has disorder","178839","2020-10-21","18:00:00",""
"4109378","13.5714","0.0002","7.3787","0.0001","19.5966","0.0004","90","","104.157","0.001","90","","1902.79","0.06","120","1","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C18 H27 N O2 S Si -","- C18 H27 N O2 S Si -","- C72 H108 N4 O8 S4 Si4 -","4","1","","Florian Monnier; Chloé Vovard-Le Bray; Dante Castillo; Vincent Aubert; Sylvie Dérien; Pierre H. Dixneuf; Loic Toupet; Andrea Ienco; Carlo Mealli","Selective Ruthenium-Catalyzed Transformations of Enynes with Diazoalkanes into Alkenylbicyclo[3.1.0]hexanes","Journal of the American Chemical Society","2007","129","","6037","6049","10.1021/ja0700146","","","0.71069","MoKα","","0.066","0.0509","","","0.1426","0.1579","","","","","","1.02","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109379","12.556","0.0002","12.583","0.0002","13.036","0.0002","90","","100.506","0.001","90","","2025.06","0.06","130","1","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C20 H29 N O2 S Si -","- C20 H29 N O2 S Si -","- C80 H116 N4 O8 S4 Si4 -","4","1","","Florian Monnier; Chloé Vovard-Le Bray; Dante Castillo; Vincent Aubert; Sylvie Dérien; Pierre H. Dixneuf; Loic Toupet; Andrea Ienco; Carlo Mealli","Selective Ruthenium-Catalyzed Transformations of Enynes with Diazoalkanes into Alkenylbicyclo[3.1.0]hexanes","Journal of the American Chemical Society","2007","129","","6037","6049","10.1021/ja0700146","","","0.71069","MoKα","","0.0415","0.0376","","","0.1024","0.1063","","","","","","1.056","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109380","18.624","0.004","8.143","0.004","29.188","0.007","90","","104.63","0.02","90","","4283","3","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C23 H25 N O4 S -","- C23 H25 N O4 S -","- C184 H200 N8 O32 S8 -","8","2","","Florian Monnier; Chloé Vovard-Le Bray; Dante Castillo; Vincent Aubert; Sylvie Dérien; Pierre H. Dixneuf; Loic Toupet; Andrea Ienco; Carlo Mealli","Selective Ruthenium-Catalyzed Transformations of Enynes with Diazoalkanes into Alkenylbicyclo[3.1.0]hexanes","Journal of the American Chemical Society","2007","129","","6037","6049","10.1021/ja0700146","","","0.71069","MoKα","","0.2309","0.0895","","","0.2064","0.2784","","","","","","0.966","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109381","27.4366","0.0018","16.311","0.0011","13.6021","0.0009","90","","90","","90","","6087.2","0.7","120","2","120","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C33 H35 N O4 S2 -","- C33 H35 N O4 S2 -","- C264 H280 N8 O32 S16 -","8","1","","Sabrina Castellano; Hannah D. G. Fiji; Sape S. Kinderman; Masaru Watanabe; Pablo de Leon; Fuyuhiko Tamanoi; Ohyun Kwon","Small-Molecule Inhibitors of Protein Geranylgeranyltransferase Type I","Journal of the American Chemical Society","2007","129","","5843","5845","10.1021/ja070274n","","","0.71073","MoKα","","0.0737","0.0524","","","0.1398","0.1547","","","","","","1.076","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109382","10.5254","0.0012","11.5269","0.0013","20.031","0.002","90","","98.234","0.002","90","","2405.2","0.5","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H27 N O4 S2 -","- C26 H27 N O4 S2 -","- C104 H108 N4 O16 S8 -","4","1","","Sabrina Castellano; Hannah D. G. Fiji; Sape S. Kinderman; Masaru Watanabe; Pablo de Leon; Fuyuhiko Tamanoi; Ohyun Kwon","Small-Molecule Inhibitors of Protein Geranylgeranyltransferase Type I","Journal of the American Chemical Society","2007","129","","5843","5845","10.1021/ja070274n","","","0.71073","MoKα","","0.0529","0.0349","","","0.0842","0.092","","","","","","1.031","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109383","12.123","0.002","12.451","0.003","17.383","0.004","99.53","0.03","93.1","0.03","96.14","0.03","2565.9","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H77 Mo6 N3 O18 -","- C35 H77 Mo6 N3 O18 -","- C70 H154 Mo12 N6 O36 -","2","1","","Qiang Li; Yongge Wei; Jian Hao; Yulin Zhu; Longsheng Wang","Unexpected CC Bond Formation via Doubly Dehydrogenative Coupling of Two Saturated sp3 C-H Bonds Activated with a Polymolybdate","Journal of the American Chemical Society","2007","129","","5810","5811","10.1021/ja070600z","","","0.71073","MoKα","","0.0469","0.0334","","","0.0856","0.0936","","","","","","1.08","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109384","11.875","0.002","12.894","0.003","18.939","0.004","76.39","0.03","89.96","0.03","80.54","0.03","2777.9","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36.5 H79 Mo6 N3 O18 -","- C36.5 H79 Mo6 N3 O18 -","- C73 H158 Mo12 N6 O36 -","2","1","","Qiang Li; Yongge Wei; Jian Hao; Yulin Zhu; Longsheng Wang","Unexpected CC Bond Formation via Doubly Dehydrogenative Coupling of Two Saturated sp3 C-H Bonds Activated with a Polymolybdate","Journal of the American Chemical Society","2007","129","","5810","5811","10.1021/ja070600z","","","0.71073","MoKα","","0.1313","0.0611","","","0.1564","0.1871","","","","","","1.02","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109385","9.0366","0.0005","17.4393","0.0009","11.3378","0.0006","90","","109.701","0.001","90","","1682.16","0.16","296","2","296","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C24 H30 O12 P Pt Re3 -","- C24 H30 O12 P Pt Re3 -","- C48 H60 O24 P2 Pt2 Re6 -","2","0.5","","Richard D. Adams; Burjor Captain; Mark D. Smith; Chad Beddie; Michael B. Hall","Unsaturated Platinum-Rhenium Cluster Complexes. Synthesis, Structures and Reactivity","Journal of the American Chemical Society","2007","129","","5981","5991","10.1021/ja070773o","","","0.71073","MoKα","","0.051","0.04","","","0.0864","0.0911","","","","","","1.062","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109386","27.395","0.003","14.3333","0.0016","19.087","0.002","90","","130.348","0.002","90","","5711.9","1.1","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H29 O9 P Pt Re2 -","- C21 H29 O9 P Pt Re2 -","- C168 H232 O72 P8 Pt8 Re16 -","8","1","","Richard D. Adams; Burjor Captain; Mark D. Smith; Chad Beddie; Michael B. Hall","Unsaturated Platinum-Rhenium Cluster Complexes. Synthesis, Structures and Reactivity","Journal of the American Chemical Society","2007","129","","5981","5991","10.1021/ja070773o","","","0.71073","MoKα","","0.0469","0.0385","","","0.0988","0.1083","","","","","","1.024","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109387","15.2359","0.0014","15.2464","0.0014","50.847","0.005","90","","90","","90","","11811.4","1.9","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C31 H54 O7 P2 Pt2 Re2 -","- C31 H54 O7 P2 Pt2 Re2 -","- C372 H648 O84 P24 Pt24 Re24 -","12","3","","Richard D. Adams; Burjor Captain; Mark D. Smith; Chad Beddie; Michael B. Hall","Unsaturated Platinum-Rhenium Cluster Complexes. Synthesis, Structures and Reactivity","Journal of the American Chemical Society","2007","129","","5981","5991","10.1021/ja070773o","","","0.71073","MoKα","","0.0853","0.0734","","","0.1747","0.1832","","","","","","1.057","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109388","14.7121","0.0009","17.2332","0.0011","17.1146","0.0011","90","","105.002","0.001","90","","4191.3","0.5","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31.5 H59 Cl O7 P2 Pt2 Re2 -","- C31.5 H59 Cl O7 P2 Pt2 Re2 -","- C126 H236 Cl4 O28 P8 Pt8 Re8 -","4","1","","Richard D. Adams; Burjor Captain; Mark D. Smith; Chad Beddie; Michael B. Hall","Unsaturated Platinum-Rhenium Cluster Complexes. Synthesis, Structures and Reactivity","Journal of the American Chemical Society","2007","129","","5981","5991","10.1021/ja070773o","","","0.71073","MoKα","","0.0247","0.0198","","","0.0467","0.0493","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109389","9.0728","0.0004","10.2568","0.0005","11.5861","0.0006","95.204","0.001","97.889","0.001","101.259","0.001","1039.73","0.09","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H58 O8 P2 Pt2 Re2 -","- C32 H58 O8 P2 Pt2 Re2 -","- C32 H58 O8 P2 Pt2 Re2 -","1","0.5","","Richard D. Adams; Burjor Captain; Mark D. Smith; Chad Beddie; Michael B. Hall","Unsaturated Platinum-Rhenium Cluster Complexes. Synthesis, Structures and Reactivity","Journal of the American Chemical Society","2007","129","","5981","5991","10.1021/ja070773o","","","0.71073","MoKα","","0.0227","0.02","","","0.0497","0.0507","","","","","","1.078","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109390","15.678","0.003","14.8","0.003","21.393","0.004","90","","107.201","0.005","90","","4741.9","1.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H36 Cl2 F12 N4 O -","- C52 H36 Cl1.8 F12 N4 O -","- C208 H144 Cl7.2 F48 N16 O4 -","4","1","","Chao Liu; Dong-Mei Shen; Qing-Yun Chen","Synthesis and Reactions of 20 π-Electron β-Tetrakis(trifluoromethyl)-meso-tetraphenylporphyrins","Journal of the American Chemical Society","2007","129","","5814","5815","10.1021/ja070855c","","","0.71073","MoKα","","0.2682","0.0993","","","0.2409","0.3135","","","","","","0.846","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109391","10.596","0.002","20.027","0.004","11.671","0.002","90","","91.524","0.004","90","","2475.8","0.8","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C52 H38 Cl2 F12 N4 O -","- C52 H38 Cl2 F12 N4 O -","- C104 H76 Cl4 F24 N8 O2 -","2","0.5","","Chao Liu; Dong-Mei Shen; Qing-Yun Chen","Synthesis and Reactions of 20 π-Electron β-Tetrakis(trifluoromethyl)-meso-tetraphenylporphyrins","Journal of the American Chemical Society","2007","129","","5814","5815","10.1021/ja070855c","","","0.71073","MoKα","","0.1477","0.0841","","","0.2366","0.2709","","","","","","0.954","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109392","14.44","0.015","22.28","0.02","15.994","0.016","90","","101.61","0.02","90","","5040","9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C53 H38 Cl2 F12 N4 -","- C53 H36 Cl2 F12 N4 -","- C212 H144 Cl8 F48 N16 -","4","1","","Chao Liu; Dong-Mei Shen; Qing-Yun Chen","Synthesis and Reactions of 20 π-Electron β-Tetrakis(trifluoromethyl)-meso-tetraphenylporphyrins","Journal of the American Chemical Society","2007","129","","5814","5815","10.1021/ja070855c","","","0.71073","MoKα","","0.2013","0.0876","","","0.2261","0.278","","","","","","0.911","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109393","11.6538","0.0009","9.9677","0.0007","17.1839","0.0012","90","","96.481","0.002","90","","1983.4","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C48 H26 F12 N4 Ni -","- C48 H26 F12 N4 Ni -","- C96 H52 F24 N8 Ni2 -","2","1","","Chao Liu; Dong-Mei Shen; Qing-Yun Chen","Synthesis and Reactions of 20 π-Electron β-Tetrakis(trifluoromethyl)-meso-tetraphenylporphyrins","Journal of the American Chemical Society","2007","129","","5814","5815","10.1021/ja070855c","","","0.71073","MoKα","","0.0902","0.0568","","","0.0932","0.108","","","","","","0.735","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109394","10.8654","0.0014","9.8741","0.0012","11.9102","0.0014","90","","91.465","0.002","90","","1277.4","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 Co N2 O5 -","- C12 H10 Co N2 O5 -","- C48 H40 Co4 N8 O20 -","4","1","","Jarrod F. Eubank; Victor Ch. Kravtsov; Mohamed Eddaoudi","Synthesis of Organic Photodimeric Cage Molecules Based on Cycloaddition via Metal-Ligand Directed Assembly","Journal of the American Chemical Society","2007","129","","5820","5821","10.1021/ja070924n","","","0.71073","MoKα","","0.0615","0.0499","","","0.1334","0.1406","","","","","","1.003","","","","has coordinates,has disorder","178839","2020-10-21","18:00:00",""
"4109395","8.738","0.003","10.188","0.004","10.76","0.004","63.08","0.007","83.713","0.008","76.77","0.007","831.4","0.5","571","2","571","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H14 Cu N2 O7 -","- C17 H14 Cu N2 O7 -","- C34 H28 Cu2 N4 O14 -","2","1","","Jarrod F. Eubank; Victor Ch. Kravtsov; Mohamed Eddaoudi","Synthesis of Organic Photodimeric Cage Molecules Based on Cycloaddition via Metal-Ligand Directed Assembly","Journal of the American Chemical Society","2007","129","","5820","5821","10.1021/ja070924n","","","0.71073","MoKα","","0.0999","0.0597","","","0.0913","0.1033","","","","","","0.939","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109396","8.586","0.002","9.954","0.003","10.576","0.003","62.738","0.004","87.681","0.004","77.07","0.004","781.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H4 Cu N2 O7 -","- C17 H14 Cu N2 O7 -","- C34 H28 Cu2 N4 O14 -","2","1","","Jarrod F. Eubank; Victor Ch. Kravtsov; Mohamed Eddaoudi","Synthesis of Organic Photodimeric Cage Molecules Based on Cycloaddition via Metal-Ligand Directed Assembly","Journal of the American Chemical Society","2007","129","","5820","5821","10.1021/ja070924n","","","0.71073","MoKα","","0.1449","0.0543","","","0.0953","0.1383","","","","","","1.003","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109397","7.729","0.003","8.805","0.003","9.393","0.003","62.493","0.006","81.809","0.006","68.261","0.006","526.3","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H12 Cu O11 -","- C7 H12 Cu O11 -","- C14 H24 Cu2 O22 -","2","1","","Jarrod F. Eubank; Victor Ch. Kravtsov; Mohamed Eddaoudi","Synthesis of Organic Photodimeric Cage Molecules Based on Cycloaddition via Metal-Ligand Directed Assembly","Journal of the American Chemical Society","2007","129","","5820","5821","10.1021/ja070924n","","","0.71073","MoKα","","0.0862","0.0525","","","0.125","0.1456","","","","","","1.001","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109398","7.297","0.003","16.347","0.007","11.99","0.004","90","","126.824","0.017","90","","1144.9","0.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H26 Na2 O22 -","- C14 H26 Na2 O22 -","- C28 H52 Na4 O44 -","2","0.5","","Jarrod F. Eubank; Victor Ch. Kravtsov; Mohamed Eddaoudi","Synthesis of Organic Photodimeric Cage Molecules Based on Cycloaddition via Metal-Ligand Directed Assembly","Journal of the American Chemical Society","2007","129","","5820","5821","10.1021/ja070924n","","","0.71073","MoKα","","0.0653","0.0613","","","0.1615","0.1645","","","","","","1.009","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109399","5.8325","0.0013","11.574","0.003","19.466","0.004","90","","97.913","0.003","90","","1301.5","0.5","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H13 N O5 -","- C14 H13 N O5 -","- C56 H52 N4 O20 -","4","1","","Leilani L. Welbes; Thomas W. Lyons; Katie A. Cychosz; Melanie S. Sanford","Synthesis of Cyclopropanes via Pd(II/IV)-Catalyzed Reactions of Enynes","Journal of the American Chemical Society","2007","129","","5836","5837","10.1021/ja071204j","","","0.71073","MoKα","","0.0501","0.0358","","","0.0942","0.1044","","","","","","1.045","","","","has coordinates","178839","2020-10-21","18:00:00",""
"4109400","9.1687","0.0015","11.3315","0.0019","11.5459","0.0019","90","","102.627","0.002","90","","1170.5","0.3","108","2","108","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H13 N O3 -","- C13 H13 N O3 -","- C52 H52 N4 O12 -","4","1","","Leilani L. Welbes; Thomas W. Lyons; Katie A. Cychosz; Melanie S. Sanford","Synthesis of Cyclopropanes via Pd(II/IV)-Catalyzed Reactions of Enynes","Journal of the American Chemical Society","2007","129","","5836","5837","10.1021/ja071204j","","","0.71073","MoKα","","0.0734","0.0557","","","0.1618","0.1749","","","","","","1.066","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109401","19.42","0.003","25.613","0.004","24.874","0.004","90","","97.498","0.003","90","","12267","3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Cr2 N24 Zn3 -","- C108 H96 Cr2 N24 Zn3 -","- C432 H384 Cr8 N96 Zn12 -","4","1","","Mikhail Shatruk; Alina Dragulescu-Andrasi; Kristen Chambers; Sebastian A. Stoian; Emile L. Bominaar; Catalina Achim; Kim R. Dunbar","Properties of Prussian Blue Materials Manifested in Molecular Complexes: Observation of Cyanide Linkage Isomerism and Spin-Crossover Behavior in Pentanuclear Cyanide Clusters","Journal of the American Chemical Society","2007","129","","6104","6116","10.1021/ja066273x","","","0.71073","MoKα","","0.1395","0.063","","","0.1312","0.1417","","","","","","1","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109402","19.425","0.003","25.331","0.004","24.729","0.004","90","","98.142","0.003","90","","12045","3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Fe2 N24 Zn3 -","- C108 H96 Fe2 N24 Zn3 -","- C432 H384 Fe8 N96 Zn12 -","4","1","","Mikhail Shatruk; Alina Dragulescu-Andrasi; Kristen Chambers; Sebastian A. Stoian; Emile L. Bominaar; Catalina Achim; Kim R. Dunbar","Properties of Prussian Blue Materials Manifested in Molecular Complexes: Observation of Cyanide Linkage Isomerism and Spin-Crossover Behavior in Pentanuclear Cyanide Clusters","Journal of the American Chemical Society","2007","129","","6104","6116","10.1021/ja066273x","","","0.71073","MoKα","","0.1488","0.0727","","","0.1582","0.172","","","","","","1.072","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109403","18.967","0.005","24.818","0.007","24.44","0.006","90","","97.682","0.006","90","","11401","5","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Fe5 N24 -","- C108 H96 Fe5 N24 -","- C432 H384 Fe20 N96 -","4","1","","Mikhail Shatruk; Alina Dragulescu-Andrasi; Kristen Chambers; Sebastian A. Stoian; Emile L. Bominaar; Catalina Achim; Kim R. Dunbar","Properties of Prussian Blue Materials Manifested in Molecular Complexes: Observation of Cyanide Linkage Isomerism and Spin-Crossover Behavior in Pentanuclear Cyanide Clusters","Journal of the American Chemical Society","2007","129","","6104","6116","10.1021/ja066273x","","","0.71073","MoKα","","0.2027","0.0877","","","0.187","0.2061","","","","","","0.981","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109404","19.113","0.004","24.925","0.004","24.674","0.005","90","","98.108","0.005","90","","11637","4","30","2","30","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Co2 Fe3 N24 -","- C108 H96 Co2 Fe3 N24 -","- C432 H384 Co8 Fe12 N96 -","4","1","","Mikhail Shatruk; Alina Dragulescu-Andrasi; Kristen Chambers; Sebastian A. Stoian; Emile L. Bominaar; Catalina Achim; Kim R. Dunbar","Properties of Prussian Blue Materials Manifested in Molecular Complexes: Observation of Cyanide Linkage Isomerism and Spin-Crossover Behavior in Pentanuclear Cyanide Clusters","Journal of the American Chemical Society","2007","129","","6104","6116","10.1021/ja066273x","","","0.71073","MoKα","","0.2143","0.1019","","","0.2354","0.2658","","","","","","0.889","","","","has coordinates","176810","2020-10-21","18:00:00",""
"4109405","19.159","0.004","24.952","0.005","24.709","0.005","90","","97.938","0.004","90","","11699","4","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Co2 Fe3 N24 -","- C108 H96 Co2 Fe3 N24 -","- C432 H384 Co8 Fe12 N96 -","4","1","","Mikhail Shatruk; Alina Dragulescu-Andrasi; Kristen Chambers; Sebastian A. Stoian; Emile L. Bominaar; Catalina Achim; Kim R. Dunbar","Properties of Prussian Blue Materials Manifested in Molecular Complexes: Observation of Cyanide Linkage Isomerism and Spin-Crossover Behavior in Pentanuclear Cyanide Clusters","Journal of the American Chemical Society","2007","129","","6104","6116","10.1021/ja066273x","","","0.71073","MoKα","","0.1547","0.0798","","","0.1758","0.1929","","","","","","1.003","","","","has coordinates","176810","2020-10-21","18:00:00",""
"4109406","19.241","0.016","25.1","0.03","24.89","0.03","90","","98.1","0.03","90","","11901","2","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Co2 Fe3 N24 -","- C108 H96 Co2 Fe3 N24 -","- C432 H384 Co8 Fe12 N96 -","4","1","","Mikhail Shatruk; Alina Dragulescu-Andrasi; Kristen Chambers; Sebastian A. Stoian; Emile L. Bominaar; Catalina Achim; Kim R. Dunbar","Properties of Prussian Blue Materials Manifested in Molecular Complexes: Observation of Cyanide Linkage Isomerism and Spin-Crossover Behavior in Pentanuclear Cyanide Clusters","Journal of the American Chemical Society","2007","129","","6104","6116","10.1021/ja066273x","","","0.71073","MoKα","","0.2132","0.0826","","","0.1721","0.1941","","","","","","0.988","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109407","19.485","0.014","25.326","0.018","25.145","0.02","90","","97.255","0.014","90","","12309","16","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Co2 Fe3 N24 -","- C108 H96 Co2 Fe3 N24 -","- C432 H384 Co8 Fe12 N96 -","4","1","","Mikhail Shatruk; Alina Dragulescu-Andrasi; Kristen Chambers; Sebastian A. Stoian; Emile L. Bominaar; Catalina Achim; Kim R. Dunbar","Properties of Prussian Blue Materials Manifested in Molecular Complexes: Observation of Cyanide Linkage Isomerism and Spin-Crossover Behavior in Pentanuclear Cyanide Clusters","Journal of the American Chemical Society","2007","129","","6104","6116","10.1021/ja066273x","","","0.71073","MoKα","","0.2575","0.0933","","","0.2187","0.3095","","","","","","0.685","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109408","24.8535","0.0012","24.8535","0.0012","20.228","0.002","90","","90","","120","","10820.8","1.3","150","2","150","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","","","- C108 H96 Cr2 Fe3 N24 -","- C108 H96 Cr2 Fe3 N24 -","- C324 H288 Cr6 Fe9 N72 -","3","0.5","","Mikhail Shatruk; Alina Dragulescu-Andrasi; Kristen Chambers; Sebastian A. Stoian; Emile L. Bominaar; Catalina Achim; Kim R. Dunbar","Properties of Prussian Blue Materials Manifested in Molecular Complexes: Observation of Cyanide Linkage Isomerism and Spin-Crossover Behavior in Pentanuclear Cyanide Clusters","Journal of the American Chemical Society","2007","129","","6104","6116","10.1021/ja066273x","","","0.71073","MoKα","","0.1049","0.0818","","","0.2061","0.2199","","","","","","0.99","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109409","23.414","0.005","15.225","0.003","15.071","0.003","90","","108.03","0.03","90","","5109","2","253","2","253","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H21 Cl N3 O3 Re S2 -","- C24 H21 Cl N3 O3 Re S2 -","- C192 H168 Cl8 N24 O24 Re8 S16 -","8","1","","Penny Ho-Man Lee; Chi-Chiu Ko; Nianyong Zhu; Vivian Wing-Wah Yam","Metal Coordination-Assisted Near-Infrared Photochromic Behavior: A Large Perturbation on Absorption Wavelength Properties of N,N-Donor Ligands Containing Diarylethene Derivatives by Coordination to the Rhenium(I) Metal Center","Journal of the American Chemical Society","2007","129","","6058","6059","10.1021/ja067425r","","","0.71073","MoKα","","0.0422","0.0272","","","0.0588","0.0613","","","","","","0.58","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109410","10.896","0.003","11.55","0.002","13.12","0.002","74.7","0.013","83.26","0.01","63.205","0.016","1421.6","0.6","153","2","153","2","","","","","","","","6","P -1","-P 1","2","[(CGC)Th[N(SiMe3)2]Cl]2","","","- C42 H90 Cl2 N4 Si6 Th2 -","- C42 H90 Cl2 N4 Si6 Th2 -","- C42 H90 Cl2 N4 Si6 Th2 -","1","0.5","","Bryan D. Stubbert; Tobin J. Marks","Mechanistic Investigation of Intramolecular Aminoalkene and Aminoalkyne Hydroamination/Cyclization Catalyzed by Highly Electrophilic, Tetravalent Constrained Geometry 4d and 5f Complexes. Evidence for an M-N σ-Bonded Insertive Pathway","Journal of the American Chemical Society","2007","129","","6149","6167","10.1021/ja0675898","","","0.71073","MoKα","","0.0206","0.02","","","0.0532","0.0535","","","","","","1.076","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109411","8.9653","0.0008","11.9961","0.0015","13.5399","0.001","99.175","0.007","90.657","0.009","95.203","0.008","1431.1","0.2","153","2","153","2","","","","","","","","6","P -1","-P 1","2","(CGC)U[N(SiMe3)2]Cl","","","- C21 H45 Cl N2 Si3 U -","- C21 H45 Cl N2 Si3 U -","- C42 H90 Cl2 N4 Si6 U2 -","2","1","","Bryan D. Stubbert; Tobin J. Marks","Mechanistic Investigation of Intramolecular Aminoalkene and Aminoalkyne Hydroamination/Cyclization Catalyzed by Highly Electrophilic, Tetravalent Constrained Geometry 4d and 5f Complexes. Evidence for an M-N σ-Bonded Insertive Pathway","Journal of the American Chemical Society","2007","129","","6149","6167","10.1021/ja0675898","","","0.71073","MoKα","","0.0296","0.0274","","","0.0726","0.0738","","","","","","1.098","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109412","8.465","0.004","8.78","0.002","15.839","0.006","82.11","0.03","74.85","0.03","63.74","0.04","1018.7","0.8","153","2","153","2","","","","","","","","6","P -1","-P 1","2","(CGC)Zr(NMe2)(Cl)","","","- C17 H33 Cl N2 Si Zr -","- C17 H33 Cl N2 Si Zr -","- C34 H66 Cl2 N4 Si2 Zr2 -","2","1","","Bryan D. Stubbert; Tobin J. Marks","Mechanistic Investigation of Intramolecular Aminoalkene and Aminoalkyne Hydroamination/Cyclization Catalyzed by Highly Electrophilic, Tetravalent Constrained Geometry 4d and 5f Complexes. Evidence for an M-N σ-Bonded Insertive Pathway","Journal of the American Chemical Society","2007","129","","6149","6167","10.1021/ja0675898","","","0.71073","MoKα","","0.0515","0.0429","","","0.1067","0.1107","","","","","","1.097","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109413","9.929","0.006","10.039","0.007","32.12","0.02","90","","96.41","0.04","90","","3182","4","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(CGC)Th(NMe2)OAr","","","- C31 H54 N2 O Si Th -","- C31 H54 N2 O Si Th -","- C124 H216 N8 O4 Si4 Th4 -","4","1","","Bryan D. Stubbert; Tobin J. Marks","Mechanistic Investigation of Intramolecular Aminoalkene and Aminoalkyne Hydroamination/Cyclization Catalyzed by Highly Electrophilic, Tetravalent Constrained Geometry 4d and 5f Complexes. Evidence for an M-N σ-Bonded Insertive Pathway","Journal of the American Chemical Society","2007","129","","6149","6167","10.1021/ja0675898","","","0.71073","MoKα","","0.0954","0.0476","","","0.0875","0.1007","","","","","","0.937","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109414","6.1608","0.0012","8.56","0.0016","13.163","0.003","89.066","0.004","79.916","0.004","89.669","0.004","683.4","0.2","103","1","103","1","","","","","","","","4","P -1","-P 1","2","","","","- C12 H20 N2 O6 -","- C12 H20 N2 O6 -","- C24 H40 N4 O12 -","2","1","","Maria J. Comin; Riad Agbaria; Tsipi Ben-Kasus; Mahmoud Huleihel; Chenzhong Liao; Guangyu Sun; Marc C. Nicklaus; Jeffrey R. Deschamps; Damon A. Parrish; Victor E. Marquez","Sculpting the Bicyclo[3.1.0]hexane Template of Carbocyclic Nucleosides to Improve Recognition by Herpes Thymidine Kinase","Journal of the American Chemical Society","2007","129","","6216","6222","10.1021/ja0688732","","","0.71073","MoKα","","0.0722","0.0508","","","0.1144","0.1236","","","","","","1.076","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109415","9.7786","0.0009","26.342","0.002","13.4644","0.0012","90","","102.476","0.001","90","","3386.4","0.5","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 O5 -","- C18 H12 O4 -","- C144 H96 O32 -","8","1","","John D. Harris; Alan B. Oelkers; David R. Tyler","The Solvent Cage Effect: Is There a Spin Barrier to Recombination of Transition Metal Radicals?","Journal of the American Chemical Society","2007","129","","6255","6262","10.1021/ja069295s","","","0.71073","MoKα","","0.0508","0.0456","","","0.126","0.1295","","","","","","1.06","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109416","8.0966","0.0006","19.5568","0.0013","14.0294","0.001","90","","94.738","0.002","90","","2213.9","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H26 B Ir N6 O2 -","- C20 H26 B Ir N6 O2 -","- C80 H104 B4 Ir4 N24 O8 -","4","1","","Margarita Gómez; Margarita Paneque; Manuel L. Poveda; Eleuterio Alvarez","Transition Metal Migration upon Attempting the Wolff Rearrangement of an Ir(III) Five-Membered Metallacycle","Journal of the American Chemical Society","2007","129","","6092","6093","10.1021/ja070360n","","","0.71073","MoKα","","0.0741","0.0679","","","0.1623","0.1645","","","","","","1.027","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109417","20.463","0.002","13.6577","0.0016","7.9547","0.0009","90","","90","","90","","2223.2","0.4","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C20 H26 B Ir N6 O3 -","- C20 H26 B Ir N6 O3 -","- C80 H104 B4 Ir4 N24 O12 -","4","0.5","","Margarita Gómez; Margarita Paneque; Manuel L. Poveda; Eleuterio Alvarez","Transition Metal Migration upon Attempting the Wolff Rearrangement of an Ir(III) Five-Membered Metallacycle","Journal of the American Chemical Society","2007","129","","6092","6093","10.1021/ja070360n","","","0.71073","MoKα","","0.082","0.0677","","","0.1224","0.1298","","","","","","1.067","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109418","9.8412","0.0002","17.0571","0.0003","15.9482","0.0004","90","","99.163","0.001","90","","2642.94","0.1","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C25 H32 B Ir N6 O3 -","- C25 H32 B Ir N6 O3 -","- C100 H128 B4 Ir4 N24 O12 -","4","2","","Margarita Gómez; Margarita Paneque; Manuel L. Poveda; Eleuterio Alvarez","Transition Metal Migration upon Attempting the Wolff Rearrangement of an Ir(III) Five-Membered Metallacycle","Journal of the American Chemical Society","2007","129","","6092","6093","10.1021/ja070360n","","","0.71073","MoKα","","0.0594","0.0462","","","0.101","0.1062","","","","","","1.01","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109419","9.7312","0.0009","27.14","0.002","18.5072","0.0017","90","","90.61","0.001","90","","4887.6","0.7","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H83 Cr O -","- C52 H83 Cr O -","- C208 H332 Cr4 O4 -","4","1","","Robert Wolf; Marcin Brynda; Chengbao Ni; Gary J. Long; Philip P. Power","Monomeric, Two-Coordinate, Univalent Chromium(I) Compounds: Steric Prevention of Metal-Metal Bond Formation","Journal of the American Chemical Society","2007","129","","6076","6077","10.1021/ja0710860","","","0.71073","MoKα","","0.0759","0.0668","","","0.1835","0.1877","","","","","","1.064","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109420","9.4141","0.0013","18.655","0.003","28.054","0.004","90","","98.097","0.002","90","","4877.7","1.2","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C51 H84 Cr P -","- C51 H84 Cr P -","- C204 H336 Cr4 P4 -","4","1","","Robert Wolf; Marcin Brynda; Chengbao Ni; Gary J. Long; Philip P. Power","Monomeric, Two-Coordinate, Univalent Chromium(I) Compounds: Steric Prevention of Metal-Metal Bond Formation","Journal of the American Chemical Society","2007","129","","6076","6077","10.1021/ja0710860","","","0.71073","MoKα","","0.061","0.0434","","","0.1269","0.1417","","","","","","0.942","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109421","17.125","0.0005","13.972","0.0004","34.877","0.0009","90","","91.236","0.002","90","","8343.1","0.4","120","0.1","120","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[Bis(1,4,7,10-tetraoxacyclododecane)lithium(I)] 1,1,3,3-tetra-tert-butyl-1,3-dimethyltrisilane-2-yl-2-ylide","","- C34 H74 Li O8 Si3 -","- C34 H74 Li O8 Si3 -","- C272 H592 Li8 O64 Si24 -","8","1","","Shigeyoshi Inoue; Masaaki Ichinohe; Akira Sekiguchi","Isolable Silylene Anion Radical: Structural Characteristics in the Solid State and in Solution","Journal of the American Chemical Society","2007","129","","6096","6097","10.1021/ja0711314","","","0.7107","MoKα","","0.0632","0.0479","","","0.1327","0.1446","","","","","","1.025","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109422","10.1425","0.0006","12.0361","0.0008","14.1564","0.0009","90","","90","","90","","1728.16","0.19","110","2","110","2","","","","","","","","7","P 21 21 2","P 2 2ab","18","","","","- C24 H48 F6 O10 P2 Pd S2 -","- C24 H48 F6 O10 P2 Pd S2 -","- C48 H96 F12 O20 P4 Pd2 S4 -","2","0.5","","Joaquín López-Serrano; Simon B. Duckett; Stuart Aiken; Karina Q. Almeida Leñero; Eite Drent; John P. Dunne; Denis Konya; Adrian C. Whitwood","Apara-Hydrogen Investigation of Palladium-Catalyzed Alkyne Hydrogenation","Journal of the American Chemical Society","2007","129","","6513","6527","10.1021/ja070331c","","","0.71073","MoKα","","0.0288","0.0272","","","0.0651","0.0658","","","","","","1.056","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109423","11.057","0.002","15.655","0.003","14.87","0.003","90","","109.911","0.004","90","","2420.1","0.8","115","2","115","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H38 Cl2 P2 Pd -","- C23 H38 Cl2 P2 Pd -","- C92 H152 Cl8 P8 Pd4 -","4","1","","Joaquín López-Serrano; Simon B. Duckett; Stuart Aiken; Karina Q. Almeida Leñero; Eite Drent; John P. Dunne; Denis Konya; Adrian C. Whitwood","Apara-Hydrogen Investigation of Palladium-Catalyzed Alkyne Hydrogenation","Journal of the American Chemical Society","2007","129","","6513","6527","10.1021/ja070331c","","","0.71073","MoKα","","0.0229","0.0204","","","0.0514","0.0525","","","","","","1.054","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109424","14.8608","0.0015","16.6018","0.0016","14.8694","0.0015","90","","108.403","0.002","90","","3480.9","0.6","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H46 F6 O10 P2 Pd S2 -","- C25 H46 F6 O10 P2 Pd S2 -","- C100 H184 F24 O40 P8 Pd4 S8 -","4","1","","Joaquín López-Serrano; Simon B. Duckett; Stuart Aiken; Karina Q. Almeida Leñero; Eite Drent; John P. Dunne; Denis Konya; Adrian C. Whitwood","Apara-Hydrogen Investigation of Palladium-Catalyzed Alkyne Hydrogenation","Journal of the American Chemical Society","2007","129","","6513","6527","10.1021/ja070331c","","","0.71073","MoKα","","0.0351","0.026","","","0.0614","0.0646","","","","","","1.029","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109425","9.3612","0.0003","12.8616","0.0004","13.8655","0.0005","107.441","0.002","96.022","0.002","95.548","0.002","1569.36","0.09","150","","150","","","","","","","","C. Milios","5","P -1","-P 1","2","","","","- C26 H32 Mn3 N3 O13 -","- C26 H32 Mn3 N3 O13 -","- C52 H64 Mn6 N6 O26 -","2","1","","Constantinos J. Milios; Alina Vinslava; Wolfgang Wernsdorfer; Alessandro Prescimone; Peter A. Wood; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Spin Switching via Targeted Structural Distortion","Journal of the American Chemical Society","2007","129","","6547","6561","10.1021/ja070411g","","","0.71073","MoKα","","0.0527","0.0363","","0.1063","0.091","0.1063","","","","","","0.9648","","","","has coordinates","264242","2021-04-16","08:51:59",""
"4109426","13.486","0.003","14.882","0.003","20.822","0.004","82.87","0.03","85.73","0.03","76.51","0.03","4027.7","1.5","150","","150","","","","","","","","C. Milios CM2439","5","P -1","-P 1","2","","","","- C74 H102 Mn6 N6 O23 -","- C74 H102 Mn6 N6 O23 -","- C148 H204 Mn12 N12 O46 -","2","1","","Constantinos J. Milios; Alina Vinslava; Wolfgang Wernsdorfer; Alessandro Prescimone; Peter A. Wood; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Spin Switching via Targeted Structural Distortion","Journal of the American Chemical Society","2007","129","","6547","6561","10.1021/ja070411g","","","0.71073","MoKα","","0.0969","0.0512","","0.0352","0.0282","0.0282","","","","","","1.1073","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109427","12.4947","0.0009","13.2846","0.0009","14.5047","0.0011","71.488","0.004","82.305","0.004","68.687","0.004","2126.4","0.3","150","","150","","","","","","","","C. Milios","5","P -1","-P 1","2","","","","- C40 H52 Mn3 N3 O13 -","- C40 H52 Mn3 N3 O13 -","- C80 H104 Mn6 N6 O26 -","2","1","","Constantinos J. Milios; Alina Vinslava; Wolfgang Wernsdorfer; Alessandro Prescimone; Peter A. Wood; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Spin Switching via Targeted Structural Distortion","Journal of the American Chemical Society","2007","129","","6547","6561","10.1021/ja070411g","","","0.71073","MoKα","","0.0589","0.0339","","0.1033","0.0796","0.1033","","","","","","0.969","","","","has coordinates","264242","2021-04-16","08:52:08",""
"4109428","38.367","0.014","6.363","0.003","23.663","0.009","90","","100.016","0.008","90","","5689","4","193","2","193","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C51 H59 N2 O10 -","- C51 H59 N2 O10 -","- C204 H236 N8 O40 -","4","1","","Scott T. Phillips; Matthew D. Shair","Syntheses of the Eastern Halves of Ritterazines B, F, G, and H, Leading to Reassignment of the 5,5-Spiroketal Stereochemistry of Ritterazines B and F","Journal of the American Chemical Society","2007","129","","6589","6598","10.1021/ja0705487","","","0.71073","MoKα","","0.1219","0.1044","","","0.2785","0.2915","","","","","","1.111","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109429","6.6933","0.0013","21.217","0.004","26.837","0.005","90","","90","","90","","3811.2","1.3","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C41 H50 N2 O10 -","- C41 H50 N2 O10 -","- C164 H200 N8 O40 -","4","1","","Scott T. Phillips; Matthew D. Shair","Syntheses of the Eastern Halves of Ritterazines B, F, G, and H, Leading to Reassignment of the 5,5-Spiroketal Stereochemistry of Ritterazines B and F","Journal of the American Chemical Society","2007","129","","6589","6598","10.1021/ja0705487","","","0.71073","MoKα","","0.1969","0.0398","","","0.0591","0.0776","","","","","","0.646","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109430","6.4444","0.0001","10.941","0.0002","16.0581","0.0003","70.9653","0.001","89.3442","0.001","89.8008","0.001","1070.25","0.03","294","","294","","","","","","","","","5","P 1","P 1","1","","","","- C8 H6.4 Cl N O3.2 -","- C8 H6.4 Cl N O3.2 -","- C40 H32 Cl5 N5 O16 -","5","5","","Yi Wang; Hongming Li; Yong-Qiang Wang; Yan Liu; Bruce M. Foxman; Li Deng","Asymmetric Diels-Alder Reactions of 2-Pyrones with a Bifunctional Organic Catalyst","Journal of the American Chemical Society","2007","129","","6364","6365","10.1021/ja070859h","","","0.71073","MoKα","","0.0602","0.0492","","0.1298","0.1236","0.1298","","","","","","0.954","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109431","8.1373","0.0002","8.1373","0.0002","13.013","0.0004","90","","90","","90","","861.66","0.04","294","","294","","","","","","","","","5","P 43","P 4cw","78","","","","- C8 H6 Cl N O3 -","- C8 H6 Cl N O3 -","- C32 H24 Cl4 N4 O12 -","4","1","","Yi Wang; Hongming Li; Yong-Qiang Wang; Yan Liu; Bruce M. Foxman; Li Deng","Asymmetric Diels-Alder Reactions of 2-Pyrones with a Bifunctional Organic Catalyst","Journal of the American Chemical Society","2007","129","","6364","6365","10.1021/ja070859h","","","0.71073","MoKα","","0.0315","0.029","","0.072","0.0712","0.072","","","","","","0.8536","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109432","11.348","0.004","6.44","0.002","13.186","0.005","90","","98.097","0.016","90","","954","0.6","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H26 I N O4 -","- C17 H26 I N O4 -","- C34 H52 I2 N2 O8 -","2","1","","Xin Jiang; Bo Liu; Sylvain Lebreton; Jef K. De Brabander","Total Synthesis and Structure Revision of the Marine Metabolite Palmerolide A","Journal of the American Chemical Society","2007","129","","6386","6387","10.1021/ja0715142","","","0.71069","MoKα","","0.042","0.0398","","","0.1072","0.1113","","","","","","0.84","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109433","8.3256","0.0005","15.1105","0.001","21.0117","0.0014","84.0995","0.0009","79.32","0.0009","78.8049","0.0009","2542","0.3","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H38 N P Ru -","- C27 H38 N P Ru -","- C108 H152 N4 P4 Ru4 -","4","2","","Matthew A. Rankin; Gabriele Schatte; Robert McDonald; Mark Stradiotto","Remarkably Facile and Reversible Ru-C(sp3) Bond Cleavage to Give a Reactive 16-Electron Cp*Ru(κ2-P,Carbene) Zwitterion","Journal of the American Chemical Society","2007","129","","6390","6391","10.1021/ja071684e","","","0.71073","MoKα","","0.0282","0.0247","","","0.0656","0.0691","","","","","","1.089","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109434","9.487","0.0017","11.844","0.002","16.851","0.004","98.505","0.01","101.4","0.008","107.029","0.009","1731.4","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H50 N P Ru Si -","- C39 H50 N P Ru Si -","- C78 H100 N2 P2 Ru2 Si2 -","2","1","","Matthew A. Rankin; Gabriele Schatte; Robert McDonald; Mark Stradiotto","Remarkably Facile and Reversible Ru-C(sp3) Bond Cleavage to Give a Reactive 16-Electron Cp*Ru(κ2-P,Carbene) Zwitterion","Journal of the American Chemical Society","2007","129","","6390","6391","10.1021/ja071684e","","","0.71073","MoKα","","0.0964","0.0631","","","0.1269","0.1436","","","","","","1.045","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109435","8.83","0.0003","10.96","0.0004","17.135","0.0005","87.246","0.002","83.675","0.002","69.536","0.002","1544.08","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H48 N3 P Ru -","- C34 H48 N3 P Ru -","- C68 H96 N6 P2 Ru2 -","2","1","","Matthew A. Rankin; Gabriele Schatte; Robert McDonald; Mark Stradiotto","Remarkably Facile and Reversible Ru-C(sp3) Bond Cleavage to Give a Reactive 16-Electron Cp*Ru(κ2-P,Carbene) Zwitterion","Journal of the American Chemical Society","2007","129","","6390","6391","10.1021/ja071684e","","","0.71073","MoKα","","0.0642","0.0459","","","0.0917","0.102","","","","","","1.043","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109436","9.3663","0.0009","16.4724","0.0015","23.583","0.002","107.988","0.001","93.323","0.002","100.872","0.001","3372.1","0.5","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C76 H90 Cl2 N6 O2 Zn -","- C76 H90 Cl2 N6 O2 Zn -","- C152 H180 Cl4 N12 O4 Zn2 -","2","1","","Shigeru Yamaguchi; Taisuke Katoh; Hiroshi Shinokubo; Atsuhiro Osuka","Porphyrin Pincer Complexes: Peripherally Cyclometalated Porphyrins and Their Catalytic Activities Controlled by Central Metals","Journal of the American Chemical Society","2007","129","","6392","6393","10.1021/ja072218s","","","0.71073","MoKα","","0.057","0.0473","","","0.1226","0.132","","","","","","1.069","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109437","19.161","0.003","13.9554","0.0018","49.017","0.006","90","","90","","90","","13107","3","90","2","90","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C74 H81 Cl3 Cu N6 O Pd -","- C74 H81 Cl3 Cu N6 O Pd -","- C592 H648 Cl24 Cu8 N48 O8 Pd8 -","8","1","","Shigeru Yamaguchi; Taisuke Katoh; Hiroshi Shinokubo; Atsuhiro Osuka","Porphyrin Pincer Complexes: Peripherally Cyclometalated Porphyrins and Their Catalytic Activities Controlled by Central Metals","Journal of the American Chemical Society","2007","129","","6392","6393","10.1021/ja072218s","","","0.71073","MoKα","","0.1061","0.0779","","","0.2023","0.2175","","","","","","1.043","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109438","14.106","0.005","19.03","0.005","48.863","0.005","90","0.005","90","0.005","90","0.005","13117","6","90","2","90","2","","","","","","","","5","P c a b","-P 2bc 2ac","61","","","","- C76 H86 Cl3 N7 Pd -","- C76 H86 Cl3 N7 Pd -","- C608 H688 Cl24 N56 Pd8 -","8","1","","Shigeru Yamaguchi; Taisuke Katoh; Hiroshi Shinokubo; Atsuhiro Osuka","Porphyrin Pincer Complexes: Peripherally Cyclometalated Porphyrins and Their Catalytic Activities Controlled by Central Metals","Journal of the American Chemical Society","2007","129","","6392","6393","10.1021/ja072218s","","","0.71069","MoKα","","0.1125","0.0883","","","0.208","0.2219","","","","","","1.052","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109439","13.698","0.003","19.25","0.003","33.159","0.006","90","","91.498","0.004","90","","8741","3","90","2","90","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C79.67 H82.51 Cl17 N7.84 Ni Pd -","- C79.672 H82.508 Cl17 N7.836 Ni Pd -","- C318.688 H330.032 Cl68 N31.344 Ni4 Pd4 -","4","1","","Shigeru Yamaguchi; Taisuke Katoh; Hiroshi Shinokubo; Atsuhiro Osuka","Porphyrin Pincer Complexes: Peripherally Cyclometalated Porphyrins and Their Catalytic Activities Controlled by Central Metals","Journal of the American Chemical Society","2007","129","","6392","6393","10.1021/ja072218s","","","0.71073","MoKα","","0.1184","0.0998","","","0.2655","0.2816","","","","","","1.151","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109440","13.3212","0.0012","7.5076","0.0007","18.8449","0.0017","90","","101.878","0.002","90","","1844.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H22 Cl N O6 -","- C18 H22 Cl N O6 -","- C72 H88 Cl4 N4 O24 -","4","1","","Wen-Jian Qian; Wan-Guo Wei; Yong-Xia Zhang; Zhu-Jun Yao","Total Synthesis, Assignment of Absolute Stereochemistry, and Structural Revision of Chlorofusin","Journal of the American Chemical Society","2007","129","","6400","6401","10.1021/ja072225g","","","0.71073","MoKα","","0.1521","0.0761","","","0.1833","0.2196","","","","","","0.962","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109441","11.7466","0.001","11.9119","0.001","14.2135","0.0012","95.435","0.002","98.953","0.002","93.593","0.002","1949.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 Cl N O6 -","- C18 H19 Cl N O6 -","- C72 H76 Cl4 N4 O24 -","4","2","","Wen-Jian Qian; Wan-Guo Wei; Yong-Xia Zhang; Zhu-Jun Yao","Total Synthesis, Assignment of Absolute Stereochemistry, and Structural Revision of Chlorofusin","Journal of the American Chemical Society","2007","129","","6400","6401","10.1021/ja072225g","","","0.71073","MoKα","","0.1756","0.0674","","","0.1645","0.2122","","","","","","0.815","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109442","9.0821","0.001","9.2067","0.001","16.5767","0.0018","83.235","0.002","76.777","0.002","77.024","0.002","1311.6","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H24 Cl N3 O11 -","- C25 H24 Cl N3 O11 -","- C50 H48 Cl2 N6 O22 -","2","1","","Wen-Jian Qian; Wan-Guo Wei; Yong-Xia Zhang; Zhu-Jun Yao","Total Synthesis, Assignment of Absolute Stereochemistry, and Structural Revision of Chlorofusin","Journal of the American Chemical Society","2007","129","","6400","6401","10.1021/ja072225g","","","0.71073","MoKα","","0.1167","0.065","","","0.1682","0.1999","","","","","","0.89","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109443","12.0794","0.001","14.4737","0.0012","15.115","0.0013","90","","94.749","0.002","90","","2633.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H24 Cl N3 O11 -","- C25 H24 Cl N3 O11 -","- C100 H96 Cl4 N12 O44 -","4","1","","Wen-Jian Qian; Wan-Guo Wei; Yong-Xia Zhang; Zhu-Jun Yao","Total Synthesis, Assignment of Absolute Stereochemistry, and Structural Revision of Chlorofusin","Journal of the American Chemical Society","2007","129","","6400","6401","10.1021/ja072225g","","","0.71073","MoKα","","0.1119","0.0521","","","0.092","0.1076","","","","","","0.815","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109444","11.247","0.0003","32.831","0.0004","16.065","0.0004","90","","90","","90","","5932","0.2","120","","120","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C34 H31 N O4 Si -","- C34 H31 N O4 Si -","- C272 H248 N8 O32 Si8 -","8","2","","Masahiro Yamanaka; Junji Itoh; Kohei Fuchibe; Takahiko Akiyama","Chiral Brønsted Acid Catalyzed Enantioselective Mannich-Type Reaction","Journal of the American Chemical Society","2007","129","","6756","6764","10.1021/ja0684803","","","0.71073","MoKα","","0.0427","0.0379","","","0.1021","0.1052","","","","","","1.298","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109445","14.0332","0.0009","15.9112","0.0011","18.8817","0.0012","90","","90","","90","","4216","0.5","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C15 H25 B N7 P Ru -","- C15 H25 B N7 P Ru -","- C120 H200 B8 N56 P8 Ru8 -","8","1","","Nicholas A. Foley; Marty Lail; John P. Lee; T. Brent Gunnoe; Thomas R. Cundari; Jeffrey L. Petersen","Comparative Reactivity of TpRu(L)(NCMe)Ph (L = CO or PMe3): Impact of Ancillary Ligand L on Activation of Carbon-Hydrogen Bonds Including Catalytic Hydroarylation and Hydrovinylation/Oligomerization of Ethylene","Journal of the American Chemical Society","2007","129","","6765","6781","10.1021/ja068542p","","","0.71073","MoKα","","0.0574","0.0435","","","0.1102","0.121","","","","","","1.045","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109446","18.9321","0.0011","13.6242","0.0007","15.8706","0.0009","90","","90.602","0.001","90","","4093.4","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H22 B Cl N7 P Ru -","- C14 H22 B Cl N7 P Ru -","- C112 H176 B8 Cl8 N56 P8 Ru8 -","8","2","","Nicholas A. Foley; Marty Lail; John P. Lee; T. Brent Gunnoe; Thomas R. Cundari; Jeffrey L. Petersen","Comparative Reactivity of TpRu(L)(NCMe)Ph (L = CO or PMe3): Impact of Ancillary Ligand L on Activation of Carbon-Hydrogen Bonds Including Catalytic Hydroarylation and Hydrovinylation/Oligomerization of Ethylene","Journal of the American Chemical Society","2007","129","","6765","6781","10.1021/ja068542p","","","0.71073","MoKα","","0.0542","0.0403","","","0.1035","0.1173","","","","","","1.116","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109447","9.8198","0.0009","13.232","0.0012","11.0184","0.001","90","","116.414","0.001","90","","1282.2","0.2","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C23 H33 B N7 P Ru -","- C23 H33 B N7 P Ru -","- C46 H66 B2 N14 P2 Ru2 -","2","1","","Nicholas A. Foley; Marty Lail; John P. Lee; T. Brent Gunnoe; Thomas R. Cundari; Jeffrey L. Petersen","Comparative Reactivity of TpRu(L)(NCMe)Ph (L = CO or PMe3): Impact of Ancillary Ligand L on Activation of Carbon-Hydrogen Bonds Including Catalytic Hydroarylation and Hydrovinylation/Oligomerization of Ethylene","Journal of the American Chemical Society","2007","129","","6765","6781","10.1021/ja068542p","","","0.71073","MoKα","","0.0484","0.0449","","","0.1097","0.1123","","","","","","1.028","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109448","15.152","0.002","15.152","0.002","15.152","0.002","90","","90","","90","","3478.6","0.8","293","2","293","2","","","","","","","","3","I m -3","-I 2 2 3","204","","","","- Au12.2 Ca3 In6.3 -","- Au12.168 Ca3 In6.298 -","- Au97.344 Ca24 In50.384 -","8","0.166667","","Qisheng Lin; John D. Corbett","Development of the Ca-Au-In Icosahedral Quasicrystal and Two Crystalline Approximants: Practice via Pseudogap Electronic Tuning","Journal of the American Chemical Society","2007","129","","6789","6797","10.1021/ja069143x","","","0.71073","MoKα","","0.0614","0.0498","","","0.1136","0.118","","","","","","1.079","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109449","24.632","0.003","24.632","0.003","24.632","0.003","90","","90","","90","","14945","3","293","2","293","2","","","","","","","","3","P a -3","-P 2ac 2ab 3","205","","","","- Au37 Ca12.6 In39.6 -","- Au37.003 Ca12.64 In39.609 -","- Au296.024 Ca101.12 In316.872 -","8","0.333333","","Qisheng Lin; John D. Corbett","Development of the Ca-Au-In Icosahedral Quasicrystal and Two Crystalline Approximants: Practice via Pseudogap Electronic Tuning","Journal of the American Chemical Society","2007","129","","6789","6797","10.1021/ja069143x","","","0.71073","MoKα","","0.098","0.0557","","","0.1242","0.1432","","","","","","1.023","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109450","8.6756","0.0008","15.8718","0.0014","18.6435","0.0016","72.523","0.001","82.943","0.002","85.424","0.002","2427.6","0.4","158","2","158","2","","","","","","","","5","P -1","-P 1","2","Ce12HOPO","","","- C20 H23 Ce N4 O11.5 -","- C20 H20 Ce N4 O11.5 -","- C80 H80 Ce4 N16 O46 -","4","2","","Anne E. V. Gorden; Jide Xu; Géza Szigethy; Allen Oliver; David K. Shuh; Kenneth N. Raymond","Characterization of a Mixed Salt of 1-Hydroxypyridin-2-one Pu(IV) Complexes1","Journal of the American Chemical Society","2007","129","","6674","6675","10.1021/ja070168l","","","0.71073","MoKα","","0.0456","0.0299","","","0.0677","0.0724","","","","","","0.99","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109451","8.8065","0.0014","20.935","0.003","11.1771","0.0018","90","","91.779","0.002","90","","2059.7","0.6","293","2","446","2","","","","","","","","6","P 1 21 1","P 2yb","4","Plutonium(IV) 1,2-HOPO complex","","","- C35 H32 Cl N7 O20 Pu2 -","- C35 H32 Cl N7 O20 Pu2 -","- C70 H64 Cl2 N14 O40 Pu4 -","2","1","","Anne E. V. Gorden; Jide Xu; Géza Szigethy; Allen Oliver; David K. Shuh; Kenneth N. Raymond","Characterization of a Mixed Salt of 1-Hydroxypyridin-2-one Pu(IV) Complexes1","Journal of the American Chemical Society","2007","129","","6674","6675","10.1021/ja070168l","","","0.71073","synchrotron","","0.0316","0.0312","","","0.0795","0.0797","","","","","","1.034","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109452","9.3903","0.0014","12.4608","0.0019","16.996","0.003","90","","93.718","0.003","90","","1984.5","0.5","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H31 P -","- C22 H31 P -","- C88 H124 P4 -","4","1","","Natalia F. Blank; Jillian R. Moncarz; Tim J. Brunker; Corina Scriban; Brian J. Anderson; Omar Amir; David S. Glueck; Lev N. Zakharov; James A. Golen; Christopher D. Incarvito; Arnold L. Rheingold","Palladium-Catalyzed Asymmetric Phosphination. Scope, Mechanism, and Origin of Enantioselectivity","Journal of the American Chemical Society","2007","129","","6847","6858","10.1021/ja070225a","","","0.71073","MoKα","","0.1052","0.0687","","","0.1836","0.2056","","","","","","1.224","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109453","14.0576","0.0015","14.3539","0.0015","15.6358","0.0016","90","","92.163","0.002","90","","3152.8","0.6","173","2","173","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C30 H32 D6 I N O2 P2 Pd -","- C30 H38 I N O2 P2 Pd -","- C120 H152 I4 N4 O8 P8 Pd4 -","4","2","","Natalia F. Blank; Jillian R. Moncarz; Tim J. Brunker; Corina Scriban; Brian J. Anderson; Omar Amir; David S. Glueck; Lev N. Zakharov; James A. Golen; Christopher D. Incarvito; Arnold L. Rheingold","Palladium-Catalyzed Asymmetric Phosphination. Scope, Mechanism, and Origin of Enantioselectivity","Journal of the American Chemical Society","2007","129","","6847","6858","10.1021/ja070225a","","","0.71073","MoKα","","0.0375","0.0331","","","0.0867","0.0901","","","","","","0.946","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109454","9.4976","0.0008","9.5461","0.0008","11.7991","0.001","90","","90.303","0.002","90","","1069.75","0.16","218","2","218","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H33 O P -","- C23 H33 O P -","- C46 H66 O2 P2 -","2","1","","Natalia F. Blank; Jillian R. Moncarz; Tim J. Brunker; Corina Scriban; Brian J. Anderson; Omar Amir; David S. Glueck; Lev N. Zakharov; James A. Golen; Christopher D. Incarvito; Arnold L. Rheingold","Palladium-Catalyzed Asymmetric Phosphination. Scope, Mechanism, and Origin of Enantioselectivity","Journal of the American Chemical Society","2007","129","","6847","6858","10.1021/ja070225a","","","0.71073","MoKα","","0.0612","0.0491","","","0.1328","0.1415","","","","","","0.79","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109455","9.0974","0.0008","16.3968","0.0014","13.6909","0.0012","90","","96.95","0.002","90","","2027.2","0.3","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H33 P -","- C23 H33 P -","- C92 H132 P4 -","4","1","","Natalia F. Blank; Jillian R. Moncarz; Tim J. Brunker; Corina Scriban; Brian J. Anderson; Omar Amir; David S. Glueck; Lev N. Zakharov; James A. Golen; Christopher D. Incarvito; Arnold L. Rheingold","Palladium-Catalyzed Asymmetric Phosphination. Scope, Mechanism, and Origin of Enantioselectivity","Journal of the American Chemical Society","2007","129","","6847","6858","10.1021/ja070225a","","","0.71073","MoKα","","0.082","0.0644","","","0.1862","0.2088","","","","","","0.988","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109456","9.8603","0.0009","16.3092","0.0015","14.0309","0.0013","90","","101.751","0.002","90","","2209.1","0.4","147","2","147","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H35 P -","- C24 H35 P -","- C96 H140 P4 -","4","1","","Natalia F. Blank; Jillian R. Moncarz; Tim J. Brunker; Corina Scriban; Brian J. Anderson; Omar Amir; David S. Glueck; Lev N. Zakharov; James A. Golen; Christopher D. Incarvito; Arnold L. Rheingold","Palladium-Catalyzed Asymmetric Phosphination. Scope, Mechanism, and Origin of Enantioselectivity","Journal of the American Chemical Society","2007","129","","6847","6858","10.1021/ja070225a","","","0.71073","MoKα","","0.0792","0.0541","","","0.145","0.1602","","","","","","1.014","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109457","9.53","0.0013","10.3374","0.0015","11.801","0.0017","72.103","0.003","87.885","0.003","87.702","0.003","1105.1","0.3","218","2","218","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H30 F3 P -","- C23 H30 F3 P -","- C46 H60 F6 P2 -","2","1","","Natalia F. Blank; Jillian R. Moncarz; Tim J. Brunker; Corina Scriban; Brian J. Anderson; Omar Amir; David S. Glueck; Lev N. Zakharov; James A. Golen; Christopher D. Incarvito; Arnold L. Rheingold","Palladium-Catalyzed Asymmetric Phosphination. Scope, Mechanism, and Origin of Enantioselectivity","Journal of the American Chemical Society","2007","129","","6847","6858","10.1021/ja070225a","","","0.71073","MoKα","","0.1033","0.09","","","0.2158","0.2246","","","","","","1.198","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109458","14.9713","0.001","9.4608","0.0006","15.0844","0.001","90","","102.237","0.001","90","","2088","0.2","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H33 O P -","- C23 H33 O P -","- C92 H132 O4 P4 -","4","2","","Natalia F. Blank; Jillian R. Moncarz; Tim J. Brunker; Corina Scriban; Brian J. Anderson; Omar Amir; David S. Glueck; Lev N. Zakharov; James A. Golen; Christopher D. Incarvito; Arnold L. Rheingold","Palladium-Catalyzed Asymmetric Phosphination. Scope, Mechanism, and Origin of Enantioselectivity","Journal of the American Chemical Society","2007","129","","6847","6858","10.1021/ja070225a","","","0.71073","MoKα","","0.04","0.0361","","","0.0924","0.0956","","","","","","1.013","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109459","12.332","0.004","17.224","0.005","13.244","0.004","90","","114.109","0.004","90","","2567.7","1.4","200","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C49 H76 F3 O5 P3 Pd S -","- C49 H76 F3 O5 P3 Pd S -","- C98 H152 F6 O10 P6 Pd2 S2 -","2","1","","Natalia F. Blank; Jillian R. Moncarz; Tim J. Brunker; Corina Scriban; Brian J. Anderson; Omar Amir; David S. Glueck; Lev N. Zakharov; James A. Golen; Christopher D. Incarvito; Arnold L. Rheingold","Palladium-Catalyzed Asymmetric Phosphination. Scope, Mechanism, and Origin of Enantioselectivity","Journal of the American Chemical Society","2007","129","","6847","6858","10.1021/ja070225a","","","0.71073","MoKα","","0.0686","0.0591","","","0.1151","0.1182","","","","","","1.138","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109460","6.1433","0.0019","16.535","0.007","18.466","0.008","65.844","0.01","86.374","0.015","89.887","0.018","1707.5","1.2","100","2","100","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C18 H22 N2 O3 -","- C18 H22 N2 O3 -","- C72 H88 N8 O12 -","4","2","","Jean-Philippe Ebran; Anders L. Hansen; Thomas M. Gøgsig; Troels Skrydstrup","Studies on the Heck Reaction with Alkenyl Phosphates: Can the 1,2-Migration Be Controlled? Scope and Limitations","Journal of the American Chemical Society","2007","129","","6931","6942","10.1021/ja070321b","","x-ray","0.71073","MoKα","","0.1292","0.0934","","","0.2789","0.3042","","","","","","1.088","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109461","10.823","0.003","13.265","0.004","23.208","0.006","105.6","0.005","100.232","0.005","91.152","0.005","3150","1.5","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H60 B4 Br4 N4 O17 -","- C56 H60 B4 Br4 N4 O17 -","- C112 H120 B8 Br8 N8 O34 -","2","1","","Eric P. Gillis; Martin D. Burke","A Simple and Modular Strategy for Small Molecule Synthesis: Iterative Suzuki-Miyaura Coupling of B-Protected Haloboronic Acid Building Blocks","Journal of the American Chemical Society","2007","129","","6716","6717","10.1021/ja0716204","","","0.71073","MoKα","","0.201","0.0635","","","0.154","0.1932","","","","","","0.919","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4109462","10.6813","0.0014","11.134","0.003","11.523","0.002","97.863","0.019","102.297","0.013","110.115","0.018","1223.9","0.5","","","110","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H25 Cl2 Cu N5 O9 -","- C20 H25 Cl2 Cu N5 O9 -","- C40 H50 Cl4 Cu2 N10 O18 -","2","1","","Debabrata Maiti; Amy A. Narducci Sarjeant; Kenneth D. Karlin","Copper(II)-Hydroperoxo Complex Induced Oxidative N-Dealkylation Chemistry","Journal of the American Chemical Society","2007","129","","6720","6721","10.1021/ja0719024","","","0.71073","MoKα","","0.0462","0.0354","","","0.0924","0.0947","","","","","","1.048","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109463","11.4124","0.0002","18.2874","0.0003","20.1532","0.0003","90","","97.804","0.001","90","","4167.08","0.12","","","110","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C43 H21 B Cl Cu F20 N5 -","- C43 H21 B Cl Cu F20 N5 -","- C172 H84 B4 Cl4 Cu4 F80 N20 -","4","1","","Debabrata Maiti; Amy A. Narducci Sarjeant; Kenneth D. Karlin","Copper(II)-Hydroperoxo Complex Induced Oxidative N-Dealkylation Chemistry","Journal of the American Chemical Society","2007","129","","6720","6721","10.1021/ja0719024","","","0.71073","MoKα","","0.0585","0.0333","","","0.0795","0.0904","","","","","","1.092","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109464","13.033","0.002","13.274","0.002","20.406","0.003","90","","90","","90","","3530.2","0.9","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H22 N O3 P -","- C19 H22 N O3 P -","- C152 H176 N8 O24 P8 -","8","1","","Xue-Feng Zhu; Christopher E. Henry; Ohyun Kwon","Stable Tetravalent Phosphonium Enolate Zwitterions","Journal of the American Chemical Society","2007","129","","6722","6723","10.1021/ja071990s","","","0.71073","MoKα","","0.0474","0.0373","","","0.0922","0.0984","","","","","","1.053","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109465","10.4874","0.0016","13.386","0.002","20.289","0.003","81.392","0.002","84.224","0.002","80.184","0.002","2766.7","0.7","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C61 H88 O6 P2 -","- C61 H88 O6 P2 -","- C122 H176 O12 P4 -","2","1","","Xue-Feng Zhu; Christopher E. Henry; Ohyun Kwon","Stable Tetravalent Phosphonium Enolate Zwitterions","Journal of the American Chemical Society","2007","129","","6722","6723","10.1021/ja071990s","","","0.71073","MoKα","","0.0721","0.0495","","","0.1217","0.1356","","","","","","1.047","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109466","18.996","0.004","10.762","0.002","23.331","0.005","90","","113.583","0.002","90","","4371.3","1.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H26 N O4 P -","- C24 H26 N O4 P -","- C192 H208 N8 O32 P8 -","8","2","","Xue-Feng Zhu; Christopher E. Henry; Ohyun Kwon","Stable Tetravalent Phosphonium Enolate Zwitterions","Journal of the American Chemical Society","2007","129","","6722","6723","10.1021/ja071990s","","","0.71073","MoKα","","0.0782","0.0472","","","0.0972","0.1104","","","","","","0.997","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109467","10.0806","0.0009","12.6747","0.0012","12.8077","0.001","73.376","0.01","67.246","0.009","66.989","0.01","1371.3","0.2","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","[Trans-hydrido-(2,3,5-trimethylphenylcarbyne)- bis(1,2-dimethylphosphino)ethane]tungsten","","- C22 H44 P4 W -","- C22 H44 P4 W -","- C44 H88 P8 W2 -","2","1","","Fenglou Zou; Franck Furno; Thomas Fox; Helmut W. Schmalle; Heinz Berke; Jürgen Eckert; Zema Chowdhury; Peter Burger","trans-W(Cmesityl)(dmpe)2H: Revealing a Highly Polar W-H Bond and H-Mobility in Liquid and Solid State","Journal of the American Chemical Society","2007","129","","7195","7205","10.1021/ja069140k","","","0.71073","MoKα","","0.0863","0.054","","","0.1322","0.14","","","","","","0.869","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109468","9.5196","0.0005","14.0844","0.0008","16.2632","0.0009","90","","90","","90","","2180.5","0.2","121","2","121","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H26 N2 O4 S -","- C24 H26 N2 O4 S -","- C96 H104 N8 O16 S4 -","4","1","","William L. Scott; Jacek G. Martynow; John C. Huffman; Martin J. O'Donnell","Solid-Phase Synthesis of Multiple Classes of Peptidomimetics from Versatile Resin-Bound Aldehyde Intermediates","Journal of the American Chemical Society","2007","129","","7077","7088","10.1021/ja069188y","","","0.71073","MoKα","","0.0331","0.0282","","","0.067","0.0692","","","","","","0.993","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109469","8.9769","0.001","12.873","0.0014","12.972","0.0015","87.302","0.004","79.571","0.003","76.007","0.003","1430.5","0.3","128","2","128","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H31 Cl2 N3 O3 -","- C31 H31 Cl2 N3 O3 -","- C62 H62 Cl4 N6 O6 -","2","1","","William L. Scott; Jacek G. Martynow; John C. Huffman; Martin J. O'Donnell","Solid-Phase Synthesis of Multiple Classes of Peptidomimetics from Versatile Resin-Bound Aldehyde Intermediates","Journal of the American Chemical Society","2007","129","","7077","7088","10.1021/ja069188y","","","0.71073","MoKα","","0.0829","0.0447","","","0.1008","0.1161","","","","","","0.875","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4109470","12.9652","0.0009","8.1963","0.0006","26.6271","0.0018","90","","93.3","0.002","90","","2824.9","0.3","130","2","130","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C31 H30 N2 O6 -","- C33.842 H30 N2 O6 -","- C135.368 H120 N8 O24 -","4","1","","William L. Scott; Jacek G. Martynow; John C. Huffman; Martin J. O'Donnell","Solid-Phase Synthesis of Multiple Classes of Peptidomimetics from Versatile Resin-Bound Aldehyde Intermediates","Journal of the American Chemical Society","2007","129","","7077","7088","10.1021/ja069188y","","","0.71073","MoKα","","0.136","0.0505","","","0.0978","0.1172","","","","","","0.803","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109471","9.6523","0.0019","11.259","0.002","12.919","0.003","113.04","0.03","100.21","0.03","101.66","0.03","1213.1","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H26 F3 N O5 -","- C26 H26 F3 N O5 -","- C52 H52 F6 N2 O10 -","2","1","","Zhenjie Lu; Yu Zhang; William D. Wulff","Direct Access to N-H-Aziridines from Asymmetric Catalytic Aziridination with Borate Catalysts Derived from Vaulted Binaphthol and Vaulted Biphenanthrol Ligands","Journal of the American Chemical Society","2007","129","","7185","7194","10.1021/ja069371r","","","0.71073","MoKα","","0.1725","0.0668","","","0.166","0.2037","","","","","","0.946","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109472","16.1661","0.0004","16.1661","0.0004","16.4796","0.0009","90","","90","","120","","3729.8","0.2","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C54 H44 N2 O14 Zn3 -","- C53.94 H43.86 N1.98 O13.98 Zn3 -","- C161.82 H131.58 N5.94 O41.94 Zn9 -","3","0.166667","","Christina A. Bauer; Tatiana V. Timofeeva; Thomas B. Settersten; Brian D. Patterson; Vincent H. Liu; Blake A. Simmons; Mark D. Allendorf","Influence of Connectivity and Porosity on Ligand-Based Luminescence in Zinc Metal-Organic Frameworks","Journal of the American Chemical Society","2007","129","","7136","7144","10.1021/ja0700395","","","0.71073","MoKα","","0.032","0.0242","","","0.0561","0.0586","","","","","","1.008","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109473","30.317","0.012","19.411","0.008","24.161","0.009","90","","90","","90","","14218","10","100","0.2","100","0.2","","","","","","","","4","P n n m","-P 2 2n","58","","","","- C48 H30 O13 Zn4 -","- C48 H30 O13 Zn4 -","- C192 H120 O52 Zn16 -","4","0.5","","Christina A. Bauer; Tatiana V. Timofeeva; Thomas B. Settersten; Brian D. Patterson; Vincent H. Liu; Blake A. Simmons; Mark D. Allendorf","Influence of Connectivity and Porosity on Ligand-Based Luminescence in Zinc Metal-Organic Frameworks","Journal of the American Chemical Society","2007","129","","7136","7144","10.1021/ja0700395","","","0.71073","MoKα","","0.1065","0.0656","","","0.1531","0.1662","","","","","","1.001","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109474","11.81","0.0008","13.3721","0.0009","12.2118","0.0008","90","","90","","90","","1928.5","0.2","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C17 H33 N Si Ti -","- C17 H33 N Si Ti -","- C68 H132 N4 Si4 Ti4 -","4","0.5","","Daniel J. Arriola; Marilyn Bokota; Richard E. Campbell; Jerzy Klosin; Robert E. LaPointe; O. David Redwine; Ravi B. Shankar; Francis J. Timmers; Khalil A. Abboud","Penultimate Effect in Ethylene-Styrene Copolymerization and the Discovery of Highly Active Ethylene-Styrene Catalysts with Increased Styrene Reactivity","Journal of the American Chemical Society","2007","129","","7065","7076","10.1021/ja070061y","","","0.71073","MoKα","","0.0398","0.0336","","","0.0951","0.099","","","","","","1.068","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109475","22.958","0.002","8.1979","0.0006","12.4332","0.0009","90","","97.321","0.001","90","","2320.9","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H33 N Si Ti -","- C25 H33 N Si Ti -","- C100 H132 N4 Si4 Ti4 -","4","1","","Daniel J. Arriola; Marilyn Bokota; Richard E. Campbell; Jerzy Klosin; Robert E. LaPointe; O. David Redwine; Ravi B. Shankar; Francis J. Timmers; Khalil A. Abboud","Penultimate Effect in Ethylene-Styrene Copolymerization and the Discovery of Highly Active Ethylene-Styrene Catalysts with Increased Styrene Reactivity","Journal of the American Chemical Society","2007","129","","7065","7076","10.1021/ja070061y","","","0.71073","MoKα","","0.0455","0.0371","","","0.0949","0.1011","","","","","","1.048","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109476","9.2143","0.0005","12.9784","0.0006","19.545","0.001","84.112","0.001","77.999","0.001","78.688","0.001","2237.2","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H31 N Si Ti -","- C25 H31 N Si Ti -","- C100 H124 N4 Si4 Ti4 -","4","2","","Daniel J. Arriola; Marilyn Bokota; Richard E. Campbell; Jerzy Klosin; Robert E. LaPointe; O. David Redwine; Ravi B. Shankar; Francis J. Timmers; Khalil A. Abboud","Penultimate Effect in Ethylene-Styrene Copolymerization and the Discovery of Highly Active Ethylene-Styrene Catalysts with Increased Styrene Reactivity","Journal of the American Chemical Society","2007","129","","7065","7076","10.1021/ja070061y","","","0.71073","MoKα","","0.0627","0.0477","","","0.1304","0.145","","","","","","1.031","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109477","14.282","0.001","14.388","0.001","16.505","0.001","68.603","0.002","82.91","0.001","81.242","0.002","3112.5","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H39 N Si Ti -","- C39 H39 N Si Ti -","- C156 H156 N4 Si4 Ti4 -","4","2","","Daniel J. Arriola; Marilyn Bokota; Richard E. Campbell; Jerzy Klosin; Robert E. LaPointe; O. David Redwine; Ravi B. Shankar; Francis J. Timmers; Khalil A. Abboud","Penultimate Effect in Ethylene-Styrene Copolymerization and the Discovery of Highly Active Ethylene-Styrene Catalysts with Increased Styrene Reactivity","Journal of the American Chemical Society","2007","129","","7065","7076","10.1021/ja070061y","","","0.71073","MoKα","","0.1389","0.0551","","","0.0808","0.0946","","","","","","0.971","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109478","9.8536","0.0006","12.7084","0.0007","18.994","0.001","71.511","0.001","89.515","0.001","77.149","0.001","2194.3","0.2","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C50 H54 K2 O4 -","- C50 H54 K2 O4 -","- C100 H108 K4 O8 -","2","1","","Daniel J. Arriola; Marilyn Bokota; Richard E. Campbell; Jerzy Klosin; Robert E. LaPointe; O. David Redwine; Ravi B. Shankar; Francis J. Timmers; Khalil A. Abboud","Penultimate Effect in Ethylene-Styrene Copolymerization and the Discovery of Highly Active Ethylene-Styrene Catalysts with Increased Styrene Reactivity","Journal of the American Chemical Society","2007","129","","7065","7076","10.1021/ja070061y","","","0.71073","MoKα","","0.1284","0.055","","","0.1162","0.1461","","","","","","0.994","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109479","9.5948","0.0004","9.3265","0.0004","16.441","0.0007","90","","92.895","0.001","90","","1469.36","0.11","100","2","100","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C40 H40 B N2 O2 -","- C40 H40 B N2 O2 -","- C80 H80 B2 N4 O4 -","2","0.5","","Sushanta K. Pal; Mikhail E. Itkis; Fook S. Tham; Robert W. Reed; Richard T. Oakley; Bruno Donnadieu; Robert C. Haddon","Phenalenyl-Based Neutral Radical Molecular Conductors: Substituent Effects on Solid-State Structures and Properties","Journal of the American Chemical Society","2007","129","","7163","7174","10.1021/ja070103i","","","0.71073","MoKα","","0.0621","0.0477","","","0.1362","0.148","","","","","","1.031","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109480","11.6514","0.0016","13.2224","0.0018","13.568","0.003","106.025","0.004","105.873","0.004","110.198","0.003","1720.7","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H47 B N3 O2 -","- C44 H47 B N3 O2 -","- C88 H94 B2 N6 O4 -","2","1","","Sushanta K. Pal; Mikhail E. Itkis; Fook S. Tham; Robert W. Reed; Richard T. Oakley; Bruno Donnadieu; Robert C. Haddon","Phenalenyl-Based Neutral Radical Molecular Conductors: Substituent Effects on Solid-State Structures and Properties","Journal of the American Chemical Society","2007","129","","7163","7174","10.1021/ja070103i","","","0.71073","MoKα","","0.078","0.0474","","","0.114","0.1287","","","","","","1.022","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109481","17.7417","0.0006","14.1192","0.0005","25.9092","0.0009","90","","99.119","0.001","90","","6408.2","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C84 H88 B2 N4 O4 -","- C84 H88 B2 N4 O4 -","- C336 H352 B8 N16 O16 -","4","0.5","","Sushanta K. Pal; Mikhail E. Itkis; Fook S. Tham; Robert W. Reed; Richard T. Oakley; Bruno Donnadieu; Robert C. Haddon","Phenalenyl-Based Neutral Radical Molecular Conductors: Substituent Effects on Solid-State Structures and Properties","Journal of the American Chemical Society","2007","129","","7163","7174","10.1021/ja070103i","","","0.71073","MoKα","","0.074","0.0497","","","0.1264","0.1413","","","","","","1.022","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109482","9.25","0.002","9.299","0.002","15.983","0.003","79.86","0.07","84.04","0.06","77.34","0.07","1317.4","0.6","293","2","293","2","","","","","","","","4","P 1","P 1","1","","Boc-(Aib)3-L-Ser(OAllyl)-(Aib)2-L-Ser(OAllyl)-Aib-OMe monohydrate","","- C42 H74 N8 O14 -","- C42 H74 N8 O14 -","- C42 H74 N8 O14 -","1","1","","Amie K. Boal; Ivan Guryanov; Alessandro Moretto; Marco Crisma; Erica L. Lanni; Claudio Toniolo; Robert H. Grubbs; Daniel J. O'Leary","Facile and E-Selective Intramolecular Ring-Closing Metathesis Reactions in 310-Helical Peptides: A 3D Structural Study","Journal of the American Chemical Society","2007","129","","6986","6987","10.1021/ja071148m","","","1.54178","CuKα","","0.0757","0.0624","","","0.1705","0.1947","","","","","","1.045","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109483","14.3934","0.0006","14.3934","0.0006","54.305","0.003","90","","90","","90","","11250.4","0.9","100","2","100","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C46 H84 N8 O15 -","- C46 H84 N8 O15 -","- C368 H672 N64 O120 -","8","1","","Amie K. Boal; Ivan Guryanov; Alessandro Moretto; Marco Crisma; Erica L. Lanni; Claudio Toniolo; Robert H. Grubbs; Daniel J. O'Leary","Facile and E-Selective Intramolecular Ring-Closing Metathesis Reactions in 310-Helical Peptides: A 3D Structural Study","Journal of the American Chemical Society","2007","129","","6986","6987","10.1021/ja071148m","","","0.71073","MoKα","","0.0605","0.0504","","","0.0708","0.0714","","","","","","1.968","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4109484","31.518","0.004","8.961","0.002","18.351","0.003","90","","105.47","0.07","90","","4995","2","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","Boc-(Aib)3-L-Ser-(Aib)2-L-Ser-Aib-OMe [O4G-(CH2)4-O7G bridged] monohydrate","","- C40 H72 N8 O14 -","- C40 H72 N8 O14 -","- C160 H288 N32 O56 -","4","1","","Amie K. Boal; Ivan Guryanov; Alessandro Moretto; Marco Crisma; Erica L. Lanni; Claudio Toniolo; Robert H. Grubbs; Daniel J. O'Leary","Facile and E-Selective Intramolecular Ring-Closing Metathesis Reactions in 310-Helical Peptides: A 3D Structural Study","Journal of the American Chemical Society","2007","129","","6986","6987","10.1021/ja071148m","","","1.54178","CuKα","","0.0536","0.0505","","","0.1375","0.1428","","","","","","1.046","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109485","6.9056","0.0003","8.8163","0.0005","19.4387","0.0011","83.675","0.004","88.903","0.004","88.855","0.004","1175.85","0.11","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H62 N4 O14 -","- C42 H62 N4 O14 -","- C42 H62 N4 O14 -","1","0.5","","James E. A. Webb; Maxwell J. Crossley; Peter Turner; Pall Thordarson","Pyromellitamide Aggregates and Their Response to Anion Stimuli","Journal of the American Chemical Society","2007","129","","7155","7162","10.1021/ja0713781","","","0.71073","MoKα","","0.1695","0.0655","","","0.1203","0.1298","","","","","","1.045","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109486","26.2759","0.0019","26.2759","0.0019","31.734","0.005","90","","90","","90","","21910","4","80","2","80","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C134 H167 N43 O111.5 Pd6 -","- C134.24 H167.44 N43 O111.52 Pd6 -","- C536.96 H669.76 N172 O446.08 Pd24 -","4","0.25","","Yuki Nishioka; Takumi Yamaguchi; Michito Yoshizawa; Makoto Fujita","Unusual [2+4] and [2+2] Cycloadditions of Arenes in the Confined Cavity of Self-Assembled Cages","Journal of the American Chemical Society","2007","129","","7000","7001","10.1021/ja071591x","","","0.71073","MoKα","","0.1076","0.0712","","","0.2021","0.2419","","","","","","1.026","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109487","26.283","0.012","26.283","0.012","32.15","0.03","90","","90","","90","","22209","3","82","2","82","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C138 H169 N43 O126 Pd6 -","- C138.24 H169.44 N43 O126 Pd6 -","- C552.96 H677.76 N172 O504 Pd24 -","4","0.25","","Yuki Nishioka; Takumi Yamaguchi; Michito Yoshizawa; Makoto Fujita","Unusual [2+4] and [2+2] Cycloadditions of Arenes in the Confined Cavity of Self-Assembled Cages","Journal of the American Chemical Society","2007","129","","7000","7001","10.1021/ja071591x","","","0.71073","MoKα","","0.1218","0.0812","","","0.2162","0.2602","","","","","","1.053","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109488","16.498","0.002","11.7373","0.0007","17.08","0.002","90","","92.733","0.011","90","","3303.6","0.6","110","","110","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H36 Cl2 Cu N4 O9 -","- C31 H36 Cl2 Cu N4 O9 -","- C124 H144 Cl8 Cu4 N16 O36 -","4","1","","Debabrata Maiti; Heather R. Lucas; Amy A. Narducci Sarjeant; Kenneth D. Karlin","Aryl Hydroxylation from a Mononuclear Copper-Hydroperoxo Species","Journal of the American Chemical Society","2007","129","","6998","6999","10.1021/ja071704c","","","0.71073","MoKα","","0.0434","0.0302","","","0.0776","0.082","","","","","","1.047","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109489","16.787","0.003","17.9931","0.0011","17.6323","0.0013","90","","100.026","0.01","90","","5244.5","1.1","","","110","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C56 H40 B Cu F20 N4 O -","- C56 H40 B Cu F20 N4 O -","- C224 H160 B4 Cu4 F80 N16 O4 -","4","1","","Debabrata Maiti; Heather R. Lucas; Amy A. Narducci Sarjeant; Kenneth D. Karlin","Aryl Hydroxylation from a Mononuclear Copper-Hydroperoxo Species","Journal of the American Chemical Society","2007","129","","6998","6999","10.1021/ja071704c","","","0.71073","MoKα","","0.0594","0.0371","","","0.0868","0.0982","","","","","","1.056","","","","has coordinates,has disorder","178840","2020-10-21","18:00:00",""
"4109490","8.6604","0.0015","22.787","0.004","16.7","0.003","90","","90.361","0.01","90","","3295.6","1","110","2","110","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C31 H39 Fe2 N2 O4 P S2 -","- C31 H39 Fe2 N2 O4 P S2 -","- C124 H156 Fe8 N8 O16 P4 S8 -","4","1","","Tianbiao Liu; Marcetta Y. Darensbourg","A Mixed-Valent, Fe(II)Fe(I), Diiron Complex Reproduces the Unique Rotated State of the [FeFe]Hydrogenase Active Site","Journal of the American Chemical Society","2007","129","","7008","7009","10.1021/ja071851a","","","1.54178","CuKα","","0.1475","0.0694","","","0.1072","0.1276","","","","","","1.017","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109491","14.064","0.008","12.023","0.007","22.618","0.013","90","","103.136","0.009","90","","3724","4","110","2","110","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C31 H33 F6 Fe2 N2 O4 P2 S2 -","- C31 H33 F6 Fe2 N2 O4 P2 S2 -","- C124 H132 F24 Fe8 N8 O16 P8 S8 -","4","1","","Tianbiao Liu; Marcetta Y. Darensbourg","A Mixed-Valent, Fe(II)Fe(I), Diiron Complex Reproduces the Unique Rotated State of the [FeFe]Hydrogenase Active Site","Journal of the American Chemical Society","2007","129","","7008","7009","10.1021/ja071851a","","","0.71073","MoKα","","0.0675","0.0561","","","0.138","0.1561","","","","","","1.082","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109492","29.927","0.003","29.927","0.003","39.912","0.008","90","","90","","120","","30957","8","123","2","123","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C132 H348 La20 N36 Ni30 O288 -","- C132 H150 La20 N36 Ni30 O216 -","- C396 H450 La60 N108 Ni90 O648 -","3","0.166667","","Xiang-Jian Kong; Yan-Ping Ren; La-Sheng Long; Zhiping Zheng; Rong-Bin Huang; Lan-Sun Zheng","A Keplerate Magnetic Cluster Featuring an Icosidodecahedron of Ni(II) Ions Encapsulating a Dodecahedron of La(III) Ions","Journal of the American Chemical Society","2007","129","","7016","7017","10.1021/ja0726198","","","0.71073","MoKα","","0.0573","0.0498","","","0.1338","0.1375","","","","","","1.103","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109493","6.6952","0.0004","18.1555","0.0014","7.956","0.0006","90","","96.612","0.003","90","","960.66","0.12","99.1","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C24 H24 N2 O2 -","- C24 H24 N2 O2 -","- C48 H48 N4 O4 -","2","0.5","","Suguru Kenmoku; Yasuteru Urano; Hirotatsu Kojima; Tetsuo Nagano","Development of a Highly Specific Rhodamine-Based Fluorescence Probe for Hypochlorous Acid and Its Application to Real-Time Imaging of Phagocytosis","Journal of the American Chemical Society","2007","129","","7313","7318","10.1021/ja068740g","","","0.71075","MoKα","","","0.0489","","","","0.1203","","","","","","0.89","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109494","13.571","0.008","14.252","0.008","27.108","0.015","97.841","0.012","91.323","0.012","106.338","0.012","4974","5","133","2","133","2","","","","","","","","7","P -1","-P 1","2","","","","- C84 H101 F24 N11 O6 P4 S8 -","- C84 H101 F24 N11 O6 P4 S8 -","- C168 H202 F48 N22 O12 P8 S16 -","2","1","","Sune Nygaard; Stinne W. Hansen; John C. Huffman; Frank Jensen; Amar H. Flood; Jan O. Jeppesen","Two Classes of Alongside Charge-Transfer Interactions Defined in One [2]Catenane","Journal of the American Chemical Society","2007","129","","7354","7363","10.1021/ja069047w","","","0.71073","MoKα","","0.2626","0.0887","","","0.2033","0.2497","","","","","","0.81","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4109495","18.3507","0.0011","11.3702","0.0007","18.7766","0.0012","90","","111.727","0.002","90","","3639.4","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H53 Fe N5 Si -","- C37 H53 Fe N5 Si -","- C148 H212 Fe4 N20 Si4 -","4","1","","Suzanne C. Bart; Amanda C. Bowman; Emil Lobkovsky; Paul J. Chirik","Iron Diazoalkane Chemistry: N-N Bond Hydrogenation and Intramolecular C-H Activation","Journal of the American Chemical Society","2007","129","","7212","7213","10.1021/ja070056u","","","0.71073","MoKα","","0.0614","0.0395","","","0.1078","0.1178","","","","","","1.086","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109496","12.1273","0.0008","11.6776","0.0006","20.8845","0.0012","90","","101.101","0.002","90","","2902.3","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H41 Fe N5 -","- C33 H41 Fe N5 -","- C132 H164 Fe4 N20 -","4","1","","Suzanne C. Bart; Amanda C. Bowman; Emil Lobkovsky; Paul J. Chirik","Iron Diazoalkane Chemistry: N-N Bond Hydrogenation and Intramolecular C-H Activation","Journal of the American Chemical Society","2007","129","","7212","7213","10.1021/ja070056u","","","0.71073","MoKα","","0.0538","0.0354","","","0.087","0.0953","","","","","","1.015","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109497","10.6004","0.0006","16.711","0.0008","20.0606","0.0011","90","","92.255","0.001","90","","3550.8","0.3","198","2","198","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H30 F3 O3 P5 S -","- C37 H30 F3 O3 P5 S -","- C148 H120 F12 O12 P20 S4 -","4","1","","C. Adam Dyker; Susanne D. Riegel; Neil Burford; Michael D. Lumsden; Andreas Decken","Cyclotetraphosphinophosphonium Ions: Synthesis, Structures, and Pseudorotation","Journal of the American Chemical Society","2007","129","","7464","7474","10.1021/ja070764f","","","0.71073","MoKα","","0.0502","0.0343","","","0.0861","0.093","","","","","","1.053","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109498","20.0981","0.0015","34.842","0.003","9.6712","0.0007","90","","94.697","0.001","90","","6749.6","0.9","213","1","213","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H50 F3 O3 P5 S -","- C27 H50 F3 O3 P5 S -","- C216 H400 F24 O24 P40 S8 -","8","2","","C. Adam Dyker; Susanne D. Riegel; Neil Burford; Michael D. Lumsden; Andreas Decken","Cyclotetraphosphinophosphonium Ions: Synthesis, Structures, and Pseudorotation","Journal of the American Chemical Society","2007","129","","7464","7474","10.1021/ja070764f","","","0.71073","MoKα","","0.0848","0.0528","","","0.1306","0.1389","","","","","","1.079","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109499","11.5785","0.0007","12.1458","0.0007","24.5466","0.0013","90","","90","","90","","3452","0.3","193","1","193","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C7 H18 F3 O3 P5 S -","- C7 H18 F3 O3 P5 S -","- C56 H144 F24 O24 P40 S8 -","8","2","","C. Adam Dyker; Susanne D. Riegel; Neil Burford; Michael D. Lumsden; Andreas Decken","Cyclotetraphosphinophosphonium Ions: Synthesis, Structures, and Pseudorotation","Journal of the American Chemical Society","2007","129","","7464","7474","10.1021/ja070764f","","x-ray","0.71073","MoKα","","0.0538","0.0412","","","0.1018","0.1104","","","","","","1.061","","","","has coordinates","178840","2020-10-21","18:00:00",""
"4109500","9.9468","0.0012","12.7582","0.0015","12.9535","0.0015","109.358","0.002","97.345","0.002","104.076","0.002","1464.8","0.3","198","1","198","1","","","","","","","","6","P -1","-P 1","2","","","","- C27 H26 F3 O3 P5 S -","- C27 H26 F3 O3 P5 S -","- C54 H52 F6 O6 P10 S2 -","2","1","","C. Adam Dyker; Susanne D. Riegel; Neil Burford; Michael D. Lumsden; Andreas Decken","Cyclotetraphosphinophosphonium Ions: Synthesis, Structures, and Pseudorotation","Journal of the American Chemical Society","2007","129","","7464","7474","10.1021/ja070764f","","x-ray","0.71073","MoKα","","0.0581","0.0364","","","0.062","0.0647","","","","","","0.832","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109501","10.2161","0.0012","11.7132","0.0014","16.928","0.002","82.232","0.002","80.76","0.002","66.707","0.002","1830.7","0.4","198","1","198","1","","","","","","","","5","P -1","-P 1","2","","","","- C34 H34 Cl4 Ga P5 -","- C34 H34 Cl4 Ga P5 -","- C68 H68 Cl8 Ga2 P10 -","2","1","","C. Adam Dyker; Susanne D. Riegel; Neil Burford; Michael D. Lumsden; Andreas Decken","Cyclotetraphosphinophosphonium Ions: Synthesis, Structures, and Pseudorotation","Journal of the American Chemical Society","2007","129","","7464","7474","10.1021/ja070764f","","x-ray","0.71073","MoKα","","0.0486","0.0329","","","0.0774","0.0893","","","","","","1.06","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109502","6.433","0.002","5.4926","0.0017","16.535","0.005","90","","97.711","0.005","90","","579","0.3","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C11 H14 N2 O3 -","- C11 H14 N2 O3 -","- C22 H28 N4 O6 -","2","1","","Dushyant Mukkamala; Yong Zhang; Eric Oldfield","A Solid State 13C NMR, Crystallographic, and Quantum Chemical Investigation of Phenylalanine and Tyrosine Residues in Dipeptides and Proteins","Journal of the American Chemical Society","2007","129","","7385","7392","10.1021/ja071227y","","","0.71073","MoKα","","0.0674","0.0399","","","0.0854","0.0954","","","","","","1.041","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4109503","5.4527","0.0009","12.754","0.002","23.021","0.003","90","","90","","90","","1601","0.4","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H20 N2 O4 -","- C18 H20 N2 O4 -","- C72 H80 N8 O16 -","4","1","","Dushyant Mukkamala; Yong Zhang; Eric Oldfield","A Solid State 13C NMR, Crystallographic, and Quantum Chemical Investigation of Phenylalanine and Tyrosine Residues in Dipeptides and Proteins","Journal of the American Chemical Society","2007","129","","7385","7392","10.1021/ja071227y","","","0.71073","MoKα","","0.0981","0.0526","","","0.1109","0.1317","","","","","","0.987","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109504","8.5224","0.0002","8.8972","0.0002","22.2197","0.0005","90","","90","","90","","1684.82","0.07","120","0.1","120","0.1","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","2004uv08sd01","","","- C21 H23 N O3 -","- C21 H23 N O3 -","- C84 H92 N4 O12 -","4","1","","Sergio Abad; Francisco Boscá; Luis R. Domingo; Salvador Gil; Uwe Pischel; Miguel A. Miranda","Triplet Reactivity and Regio-/Stereoselectivity in the Macrocyclization of Diastereomeric Ketoprofen-Quencher Conjugates via Remote Hydrogen Abstractions","Journal of the American Chemical Society","2007","129","","7407","7420","10.1021/ja0712827","","x-ray","1.5418","CuKα","","0.0375","0.037","","","0.0956","0.0966","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109505","8.207","0.002","27.329","0.007","15.559","0.002","90","","104.792","0.01","90","","3374.1","1.3","120","0.1","120","0.1","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","2004uv09sd02","","","- C21 H23 N O3 -","- C21 H23 N O3 -","- C168 H184 N8 O24 -","8","4","","Sergio Abad; Francisco Boscá; Luis R. Domingo; Salvador Gil; Uwe Pischel; Miguel A. Miranda","Triplet Reactivity and Regio-/Stereoselectivity in the Macrocyclization of Diastereomeric Ketoprofen-Quencher Conjugates via Remote Hydrogen Abstractions","Journal of the American Chemical Society","2007","129","","7407","7420","10.1021/ja0712827","","x-ray","1.5418","CuKα","","0.0673","0.0585","","","0.1478","0.1636","","","","","","1.064","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109506","8.46","0.005","10.152","0.005","11.884","0.005","71.846","0.005","83.081","0.005","71.356","0.005","918.7","0.8","120","2","120","2","","","","","","","synthesis as described","4","P 1","P 1","1","","","","- C43 H50 N2 O7 -","- C43 H50 N2 O7 -","- C43 H50 N2 O7 -","1","1","","Sergio Abad; Francisco Boscá; Luis R. Domingo; Salvador Gil; Uwe Pischel; Miguel A. Miranda","Triplet Reactivity and Regio-/Stereoselectivity in the Macrocyclization of Diastereomeric Ketoprofen-Quencher Conjugates via Remote Hydrogen Abstractions","Journal of the American Chemical Society","2007","129","","7407","7420","10.1021/ja0712827","","x-ray","0.71069","MoKα","","0.0509","0.0386","","","0.0802","0.0865","","","","","","1.062","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109507","7.572","0.005","10.001","0.005","11.441","0.005","90","0.005","101.246","0.005","90","0.005","849.8","0.8","293","2","120","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C21 H23 N O3 -","- C21 H23 N O3 -","- C42 H46 N2 O6 -","2","1","","Sergio Abad; Francisco Boscá; Luis R. Domingo; Salvador Gil; Uwe Pischel; Miguel A. Miranda","Triplet Reactivity and Regio-/Stereoselectivity in the Macrocyclization of Diastereomeric Ketoprofen-Quencher Conjugates via Remote Hydrogen Abstractions","Journal of the American Chemical Society","2007","129","","7407","7420","10.1021/ja0712827","","x-ray","0.71069","MoKα","","0.033","0.0305","","","0.0757","0.0775","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109508","7.911","0.005","10.919","0.005","20.202","0.005","90","0.005","90","0.005","90","0.005","1745.1","1.4","120","2","120","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H23 N O3 -","- C21 H23 N O3 -","- C84 H92 N4 O12 -","4","1","","Sergio Abad; Francisco Boscá; Luis R. Domingo; Salvador Gil; Uwe Pischel; Miguel A. Miranda","Triplet Reactivity and Regio-/Stereoselectivity in the Macrocyclization of Diastereomeric Ketoprofen-Quencher Conjugates via Remote Hydrogen Abstractions","Journal of the American Chemical Society","2007","129","","7407","7420","10.1021/ja0712827","","x-ray","0.71069","MoKα","","0.0389","0.0341","","","0.0894","0.0938","","","","","","1.067","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109509","12.3969","0.0005","5.3641","0.0002","16.9165","0.0007","90","","103.524","0.002","90","","1093.73","0.08","293","2","293","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","2006sa04si04","","","- C27 H27 N O4 -","- C27 H27 N O4 -","- C54 H54 N2 O8 -","2","1","","Sergio Abad; Francisco Boscá; Luis R. Domingo; Salvador Gil; Uwe Pischel; Miguel A. Miranda","Triplet Reactivity and Regio-/Stereoselectivity in the Macrocyclization of Diastereomeric Ketoprofen-Quencher Conjugates via Remote Hydrogen Abstractions","Journal of the American Chemical Society","2007","129","","7407","7420","10.1021/ja0712827","","x-ray","1.5418","CuKα","","0.077","0.0756","","","0.1793","0.1813","","","","","","1.128","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109510","11.4707","0.0005","11.4707","0.0005","19.7124","0.0018","90","","90","","90","","2593.7","0.3","100","2","100","2","","","","","","","synthesis as described","5","P 43","P 4cw","78","","","","- C28 H29 Cl2 N O4 -","- C28 H29 Cl2 N O4 -","- C112 H116 Cl8 N4 O16 -","4","1","","Sergio Abad; Francisco Boscá; Luis R. Domingo; Salvador Gil; Uwe Pischel; Miguel A. Miranda","Triplet Reactivity and Regio-/Stereoselectivity in the Macrocyclization of Diastereomeric Ketoprofen-Quencher Conjugates via Remote Hydrogen Abstractions","Journal of the American Chemical Society","2007","129","","7407","7420","10.1021/ja0712827","","x-ray","0.7107","MoKα","","0.056","0.0427","","","0.0828","0.0872","","","","","","1.039","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109511","12.3586","0.0019","5.6122","0.0006","16.2206","0.0023","90","","98.289","0.009","90","","1113.3","0.3","293","2","293","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C27 H27 N O4 -","- C27 H27 N O4 -","- C54 H54 N2 O8 -","2","1","","Sergio Abad; Francisco Boscá; Luis R. Domingo; Salvador Gil; Uwe Pischel; Miguel A. Miranda","Triplet Reactivity and Regio-/Stereoselectivity in the Macrocyclization of Diastereomeric Ketoprofen-Quencher Conjugates via Remote Hydrogen Abstractions","Journal of the American Chemical Society","2007","129","","7407","7420","10.1021/ja0712827","","x-ray","1.5418","CuKα","","0.0889","0.0386","","","0.0877","0.1065","","","","","","1.011","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109512","9.359","0.003","10.3678","0.0008","11.941","0.002","90","","104.583","0.016","90","","1121.3","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H27 N O4 -","- C27 H27 N O4 -","- C54 H54 N2 O8 -","2","1","","Sergio Abad; Francisco Boscá; Luis R. Domingo; Salvador Gil; Uwe Pischel; Miguel A. Miranda","Triplet Reactivity and Regio-/Stereoselectivity in the Macrocyclization of Diastereomeric Ketoprofen-Quencher Conjugates via Remote Hydrogen Abstractions","Journal of the American Chemical Society","2007","129","","7407","7420","10.1021/ja0712827","","x-ray","1.54184","CuKα","","0.0738","0.0501","","","0.1137","0.1284","","","","","","1.079","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109513","6.345","0.005","8.183","0.005","11.894","0.005","72.862","0.005","84.838","0.005","68.755","0.005","549.9","0.6","273","2","273","2","","","","","","","synthesis as described","4","P 1","P 1","1","","","","- C27 H27 N O4 -","- C27 H27 N O4 -","- C27 H27 N O4 -","1","1","","Sergio Abad; Francisco Boscá; Luis R. Domingo; Salvador Gil; Uwe Pischel; Miguel A. Miranda","Triplet Reactivity and Regio-/Stereoselectivity in the Macrocyclization of Diastereomeric Ketoprofen-Quencher Conjugates via Remote Hydrogen Abstractions","Journal of the American Chemical Society","2007","129","","7407","7420","10.1021/ja0712827","","x-ray","0.71069","MoKα","","0.0697","0.0515","","","0.1341","0.1428","","","","","","1.075","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109514","9.1634","0.0005","10.9182","0.0006","11.5433","0.0006","90","","112.823","0.002","90","","1064.46","0.1","100","2","100","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C27 H27 N O4 -","- C27 H27 N O4 -","- C54 H54 N2 O8 -","2","1","","Sergio Abad; Francisco Boscá; Luis R. Domingo; Salvador Gil; Uwe Pischel; Miguel A. Miranda","Triplet Reactivity and Regio-/Stereoselectivity in the Macrocyclization of Diastereomeric Ketoprofen-Quencher Conjugates via Remote Hydrogen Abstractions","Journal of the American Chemical Society","2007","129","","7407","7420","10.1021/ja0712827","","x-ray","0.71073","MoKα","","0.0737","0.0487","","","0.0852","0.0921","","","","","","0.993","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109515","11.5577","0.0015","13.9554","0.0013","14.1742","0.0014","90","","90","","90","","2286.2","0.4","293","","293","","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C27 H27 N O4 -","- C27 H27 N O4 -","- C108 H108 N4 O16 -","4","1","","Sergio Abad; Francisco Boscá; Luis R. Domingo; Salvador Gil; Uwe Pischel; Miguel A. Miranda","Triplet Reactivity and Regio-/Stereoselectivity in the Macrocyclization of Diastereomeric Ketoprofen-Quencher Conjugates via Remote Hydrogen Abstractions","Journal of the American Chemical Society","2007","129","","7407","7420","10.1021/ja0712827","","x-ray","1.54184","Cukα","","0.0729","0.0638","","","0.2103","0.2262","","","","","","1.19","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109516","8.876","0.006","10.754","0.008","19.208","0.014","85.69","0.02","88.43","0.02","77.14","0.03","1782","2","153.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C33 H28 Cl2 Cu N6 O13 -","- C33 H28 Cl2 Cu N6 O13 -","- C66 H56 Cl4 Cu2 N12 O26 -","2","1","","Atsushi Kunishita; Junji Teraoka; Joseph D. Scanlon; Takahiro Matsumoto; Masatatsu Suzuki; Christopher J. Cramer; Shinobu Itoh","Aromatic Hydroxylation Reactivity of a Mononuclear Cu(II)-Alkylperoxo Complex","Journal of the American Chemical Society","2007","129","","7248","7249","10.1021/ja071623g","","","0.71075","MoKα","","","0.0499","","","","0.0528","","","","","","0.955","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109517","9.43","0.011","11.586","0.008","16.939","0.014","86.89","0.03","74.54","0.04","85.12","0.03","1776","3","153.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C33 H28 Cl4 Cu N4 O9 -","- C33 H28 Cl4 Cu N4 O9 -","- C66 H56 Cl8 Cu2 N8 O18 -","2","1","","Atsushi Kunishita; Junji Teraoka; Joseph D. Scanlon; Takahiro Matsumoto; Masatatsu Suzuki; Christopher J. Cramer; Shinobu Itoh","Aromatic Hydroxylation Reactivity of a Mononuclear Cu(II)-Alkylperoxo Complex","Journal of the American Chemical Society","2007","129","","7248","7249","10.1021/ja071623g","","","0.71075","MoKα","","","0.0598","","","","0.1882","","","","","","1.07","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109518","23.675","0.015","16.448","0.01","17.832","0.01","90","","101.21","0.03","90","","6811","7","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33 H30 Cl2 Cu N4 O8 -","- C33 H30 Cl2 Cu N4 O8 -","- C264 H240 Cl16 Cu8 N32 O64 -","8","1","","Atsushi Kunishita; Junji Teraoka; Joseph D. Scanlon; Takahiro Matsumoto; Masatatsu Suzuki; Christopher J. Cramer; Shinobu Itoh","Aromatic Hydroxylation Reactivity of a Mononuclear Cu(II)-Alkylperoxo Complex","Journal of the American Chemical Society","2007","129","","7248","7249","10.1021/ja071623g","","","0.71075","MoKα","","","0.0618","","","","0.0922","","","","","","0.996","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109519","11.253","0.004","10.105","0.004","31.07","0.014","90","","94.776","0.018","90","","3521","2","153.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H34 Cl2 Cu N4 O9 -","- C35 H34 Cl2 Cu N4 O9 -","- C140 H136 Cl8 Cu4 N16 O36 -","4","1","","Atsushi Kunishita; Junji Teraoka; Joseph D. Scanlon; Takahiro Matsumoto; Masatatsu Suzuki; Christopher J. Cramer; Shinobu Itoh","Aromatic Hydroxylation Reactivity of a Mononuclear Cu(II)-Alkylperoxo Complex","Journal of the American Chemical Society","2007","129","","7248","7249","10.1021/ja071623g","","","0.71075","MoKα","","","0.0434","","","","0.0452","","","","","","0.842","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109520","11.714","0.005","15.177","0.009","16.059","0.009","90","","109.692","0.02","90","","2688","2","153.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H26 Cl Cu N3 O5 -","- C31 H26 Cl Cu N3 O5 -","- C124 H104 Cl4 Cu4 N12 O20 -","4","1","","Atsushi Kunishita; Junji Teraoka; Joseph D. Scanlon; Takahiro Matsumoto; Masatatsu Suzuki; Christopher J. Cramer; Shinobu Itoh","Aromatic Hydroxylation Reactivity of a Mononuclear Cu(II)-Alkylperoxo Complex","Journal of the American Chemical Society","2007","129","","7248","7249","10.1021/ja071623g","","","0.71075","MoKα","","","0.0426","","","","0.0571","","","","","","1.017","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109521","32.42","0.07","5.567","0.012","16.32","0.03","90","","93.19","0.03","90","","2941","10","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H23 N O4 S -","- C13 H23 N O4 S -","- C104 H184 N8 O32 S8 -","8","1","","Valentine P. Ananikov; Nikolay V. Orlov; Irina P. Beletskaya; Victor N. Khrustalev; Mikhail Yu. Antipin; Tatiana V. Timofeeva","New Approach for Size- and Shape-Controlled Preparation of Pd Nanoparticles with Organic Ligands. Synthesis and Application in Catalysis","Journal of the American Chemical Society","2007","129","","7252","7253","10.1021/ja071727r","","","0.71073","MoKα","","0.2627","0.0832","","","0.111","0.1521","","","","","","1","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109522","17.3964","0.0008","26.4065","0.0012","8.6732","0.0002","90","","103.518","0.001","90","","3873.9","0.3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C48 H58 N2 -","- C48 H58 N2 -","- C192 H232 N8 -","4","1","","Andrzej Rajca; Kouichi Shiraishi; Maren Pink; Suchada Rajca","Triplet (S= 1) Ground State Aminyl Diradical","Journal of the American Chemical Society","2007","129","","7232","7233","10.1021/ja071881d","","","0.49594","synchrotron","","0.0942","0.0685","","","0.1723","0.1919","","","","","","1.048","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4109523","12.583","0.004","16.903","0.006","19.953","0.007","90","","90","","90","","4244","3","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C42 H60 N4 O11 Si -","- C42 H60 N4 O11 Si -","- C168 H240 N16 O44 Si4 -","4","1","","Francis Dhoro; Tor E. Kristensen; Vegar Stockmann; Glenn P. A. Yap; Marcus A. Tius","Asymmetric Amine-Intercepted Nazarov Cyclization","Journal of the American Chemical Society","2007","129","","7256","7257","10.1021/ja0718873","","","0.71073","MoKα","","0.0757","0.0495","","","0.1046","0.114","","","","","","1.034","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109524","6.9438","0.0012","7.6221","0.0016","21.557","0.004","90","","94.07","0.02","90","","1138.1","0.4","180","2","180","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","rac-(3S,4R)-3.4-Dihydroxy-6-phenylhexan-2-one","","- C12 H16 O3 -","- C12 H16 O3 -","- C48 H64 O12 -","4","1","","Morris Markert; Michael Mulzer; Bernd Schetter; Rainer Mahrwald","Amine-Catalyzed Direct Aldol Addition","Journal of the American Chemical Society","2007","129","","7258","7259","10.1021/ja071926a","","","0.71073","MoKα","","0.0958","0.0736","","","0.185","0.2058","","","","","","0.978","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109525","11.2404","0.0008","6.328","0.0005","23.5861","0.0019","90","","102.04","0.006","90","","1640.8","0.2","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","rac-(2R,6R)-2,6-Dicyclohexyl-4-hydroxymethyl-(1,3)dioxane-(4S,5S)-4,5-diol","","- C17 H30 O5 -","- C17 H30 O5 -","- C68 H120 O20 -","4","1","","Morris Markert; Michael Mulzer; Bernd Schetter; Rainer Mahrwald","Amine-Catalyzed Direct Aldol Addition","Journal of the American Chemical Society","2007","129","","7258","7259","10.1021/ja071926a","","","0.71073","MoKα","","0.1135","0.0726","","","0.2102","0.2251","","","","","","1.047","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109526","11.967","0.003","12.44","0.003","21.006","0.002","78.249","0.013","75.127","0.015","69.87","0.02","2814.8","1.1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C61 H88 N4 O2 Si2 -","- C61 H88 N4 O2 Si2 -","- C122 H176 N8 O4 Si4 -","2","1","","Shenglai Yao; Yun Xiong; Markus Brym","An Isolable Silanoic Ester by Oxygenation of a Stable Silylene","Journal of the American Chemical Society","2007","129","","7268","7269","10.1021/ja072425s","","","0.71073","MoKα","","0.0989","0.0542","","","0.1243","0.1386","","","","","","0.989","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109527","11.627","0.005","13.155","0.004","21.083","0.011","99.44","0.03","94.68","0.04","115.22","0.04","2836","2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C123 H172 N8 O6 Si4 -","- C123 H172 N8 O6 Si4 -","- C123 H172 N8 O6 Si4 -","1","0.5","","Shenglai Yao; Yun Xiong; Markus Brym","An Isolable Silanoic Ester by Oxygenation of a Stable Silylene","Journal of the American Chemical Society","2007","129","","7268","7269","10.1021/ja072425s","","","0.71073","MoKα","","0.2156","0.0734","","","0.0812","0.1068","","","","","","0.877","","","","has coordinates,has disorder","178841","2020-10-21","18:00:00",""
"4109528","9.6568","0.0005","10.8775","0.0005","11.3053","0.0006","67.83","0.001","89.132","0.001","83.812","0.001","1092.91","0.1","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H16 O4 Ru Sn -","- C22 H16 O4 Ru Sn -","- C44 H32 O8 Ru2 Sn2 -","2","1","","Richard D. Adams; Burjor Captain; Eszter Trufan; Lei Zhu","Activation of Metal Hydride Complexes by Tri-tert-butylphosphine-Platinum and -Palladium Groups","Journal of the American Chemical Society","2007","129","","7545","7556","10.1021/ja070617h","","","0.71073","MoKα","","0.043","0.0304","","","0.0686","0.0745","","","","","","1.047","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109529","15.261","0.0015","15.4146","0.0015","21.044","0.002","76.544","0.002","73.541","0.002","76.415","0.002","4540.9","0.8","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H49 O4 Os P Pt Sn -","- C42 H49 O4 Os P Pt Sn -","- C168 H196 O16 Os4 P4 Pt4 Sn4 -","4","2","","Richard D. Adams; Burjor Captain; Eszter Trufan; Lei Zhu","Activation of Metal Hydride Complexes by Tri-tert-butylphosphine-Platinum and -Palladium Groups","Journal of the American Chemical Society","2007","129","","7545","7556","10.1021/ja070617h","","","0.71073","MoKα","","0.0624","0.0405","","","0.123","0.1444","","","","","","1.051","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109530","15.3785","0.0008","12.0732","0.0006","20.6568","0.001","90","","108.841","0.001","90","","3629.8","0.3","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C34 H43 O4 Os P Pt Sn -","- C34 H43 O4 Os P Pt Sn -","- C136 H172 O16 Os4 P4 Pt4 Sn4 -","4","1","","Richard D. Adams; Burjor Captain; Eszter Trufan; Lei Zhu","Activation of Metal Hydride Complexes by Tri-tert-butylphosphine-Platinum and -Palladium Groups","Journal of the American Chemical Society","2007","129","","7545","7556","10.1021/ja070617h","","","0.71073","MoKα","","0.0539","0.0376","","","0.0961","0.1087","","","","","","1.031","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109531","12.9837","0.0003","13.3071","0.0003","14.9483","0.0004","98.206","0.001","90.739","0.001","104.088","0.001","2476.32","0.1","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C51 H58 O4 P Pt Ru Sn -","- C51 H58 O4 P Pt Ru Sn -","- C102 H116 O8 P2 Pt2 Ru2 Sn2 -","2","1","","Richard D. Adams; Burjor Captain; Eszter Trufan; Lei Zhu","Activation of Metal Hydride Complexes by Tri-tert-butylphosphine-Platinum and -Palladium Groups","Journal of the American Chemical Society","2007","129","","7545","7556","10.1021/ja070617h","","","0.71073","MoKα","","0.0473","0.0339","","","0.0773","0.084","","","","","","1.039","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109532","10.3182","0.0002","12.2019","0.0003","18.4334","0.0004","78.227","0.001","78.186","0.001","66.084","0.001","2057.51","0.08","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H49 O4 P Pt Ru Sn -","- C42 H49 O4 P Pt Ru Sn -","- C84 H98 O8 P2 Pt2 Ru2 Sn2 -","2","1","","Richard D. Adams; Burjor Captain; Eszter Trufan; Lei Zhu","Activation of Metal Hydride Complexes by Tri-tert-butylphosphine-Platinum and -Palladium Groups","Journal of the American Chemical Society","2007","129","","7545","7556","10.1021/ja070617h","","","0.71073","MoKα","","0.0444","0.0322","","","0.0638","0.0714","","","","","","1.024","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109533","11.5256","0.0005","12.7825","0.0006","17.0037","0.0008","101.212","0.001","106.474","0.001","103.063","0.001","2248.67","0.18","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H49 O4 P Pd Ru Sn -","- C42 H49 O4 P Pd Ru Sn -","- C84 H98 O8 P2 Pd2 Ru2 Sn2 -","2","1","","Richard D. Adams; Burjor Captain; Eszter Trufan; Lei Zhu","Activation of Metal Hydride Complexes by Tri-tert-butylphosphine-Platinum and -Palladium Groups","Journal of the American Chemical Society","2007","129","","7545","7556","10.1021/ja070617h","","","0.71073","MoKα","","0.0672","0.0469","","","0.1532","0.1729","","","","","","1.042","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109534","10.3198","0.0004","12.1676","0.0005","18.4225","0.0008","78.148","0.001","78.187","0.001","65.989","0.001","2048.97","0.15","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H49 O4 Os P Pt Sn -","- C42 H49 O4 Os P Pt Sn -","- C84 H98 O8 Os2 P2 Pt2 Sn2 -","2","1","","Richard D. Adams; Burjor Captain; Eszter Trufan; Lei Zhu","Activation of Metal Hydride Complexes by Tri-tert-butylphosphine-Platinum and -Palladium Groups","Journal of the American Chemical Society","2007","129","","7545","7556","10.1021/ja070617h","","","0.71073","MoKα","","0.0351","0.027","","","0.0628","0.0694","","","","","","1.031","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109535","9.9318","0.0003","12.019","0.0003","19.9237","0.0005","94.884","0.001","91.471","0.001","106.541","0.001","2268.49","0.11","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C49 H55 O3 Os P Pt Sn -","- C49 H55 O3 Os P Pt Sn -","- C98 H110 O6 Os2 P2 Pt2 Sn2 -","2","1","","Richard D. Adams; Burjor Captain; Eszter Trufan; Lei Zhu","Activation of Metal Hydride Complexes by Tri-tert-butylphosphine-Platinum and -Palladium Groups","Journal of the American Chemical Society","2007","129","","7545","7556","10.1021/ja070617h","","","0.71073","MoKα","","0.055","0.0381","","","0.0753","0.0878","","","","","","1.065","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109536","18.545","0.004","16.868","0.003","25.24","0.005","90","","90","","90","","7896","3","100","0.1","100","0.1","","","","","","","","6","P b c a","-P 2ac 2ab","61","jontl01","Ni(dippe)(CH2CN)Cl","","- C16 H34 Cl N Ni P2 -","- C16 H34 Cl N Ni P2 -","- C256 H544 Cl16 N16 Ni16 P32 -","16","2","","Tülay A. Ateşin; Ting Li; Sébastien Lachaize; William W. Brennessel; Juventino J. García; William D. Jones","Experimental and Theoretical Examination of C-CN and C-H Bond Activations of Acetonitrile Using Zerovalent Nickel","Journal of the American Chemical Society","2007","129","","7562","7569","10.1021/ja0707153","","","0.71073","MoKα","","0.057","0.0332","","","0.0731","0.0831","","","","","","1.012","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109537","9.0897","0.0013","20.487","0.003","43.135","0.006","90","","90","","90","","8033","2","100","0.1","100","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","jontl04","Ni(dippe)(CH3CNBEt3)","","- C22 H50 B N Ni P2 -","- C22 H50 B N Ni P2 -","- C264 H600 B12 N12 Ni12 P24 -","12","3","","Tülay A. Ateşin; Ting Li; Sébastien Lachaize; William W. Brennessel; Juventino J. García; William D. Jones","Experimental and Theoretical Examination of C-CN and C-H Bond Activations of Acetonitrile Using Zerovalent Nickel","Journal of the American Chemical Society","2007","129","","7562","7569","10.1021/ja0707153","","","0.71073","MoKα","","0.0492","0.0397","","","0.0814","0.0843","","","","","","1.074","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109538","9.8347","0.0002","17.9417","0.0005","23.5508","0.0007","87.965","0.001","84.739","0.001","89.151","0.001","4135.17","0.19","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C55 H44 N2 O4 -","- C55 H44 N2 O4 -","- C220 H176 N8 O16 -","4","2","","Yi Wei; Chien-Tien Chen","Doubly Ortho-Linked cis-4,4'-Bis(diarylamino)stilbene/Fluorene Hybrids as Efficient Nondoped, Sky-Blue Fluorescent Materials for Optoelectronic Applications","Journal of the American Chemical Society","2007","129","","7478","7479","10.1021/ja070822x","","","0.71073","MoKα","","0.2361","0.0816","","","0.1725","0.2469","","","","","","0.943","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109539","5.499","0.003","11.661","0.005","11.909","0.005","64.67","0.04","78","0.04","84.17","0.04","675.1","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H15 N O6 -","- C13 H15 N O6 -","- C26 H30 N2 O12 -","2","1","","Martin Klussmann; Toshiko Izumi; Andrew J. P. White; Alan Armstrong; Donna G. Blackmond","Emergence of Solution-Phase Homochirality via Crystal Engineering of Amino Acids","Journal of the American Chemical Society","2007","129","","7657","7660","10.1021/ja0708870","","","1.54248","CuKα","","0.0769","0.05","","","0.1256","0.1326","","","","","","0.921","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109540","13.3754","0.0012","15.3953","0.0014","15.7098","0.0015","70.609","0.002","70.501","0.002","67.214","0.002","2733.9","0.4","153","2","153","2","","","","","","","","5","P 1","P 1","1","","","","- C57.5 H69.5 N4.5 Ni2 O9 -","- C57.5 H63.5 N4.5 Ni2 O9 -","- C115 H127 N9 Ni4 O18 -","2","2","","You-Moon Jeon; Jungseok Heo; Chad A. Mirkin","Dynamic Interconversion of Amorphous Microparticles and Crystalline Rods in Salen-Based Homochiral Infinite Coordination Polymers","Journal of the American Chemical Society","2007","129","","7480","7481","10.1021/ja071046w","","","0.71073","MoKα","","0.1351","0.0762","","","0.2018","0.2447","","","","","","1.028","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4109541","16.999","0.001","10.017","0.001","23.406","0.001","90","","96.89","0.01","90","","3956.8","0.5","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H42 Cl2 Fe N5 O15 Zn -","- C34 H35 Cl2 Fe N5 O15 Zn -","- C136 H140 Cl8 Fe4 N20 O60 Zn4 -","4","1","","Ademir Neves; Mauricio Lanznaster; Adailton J. Bortoluzzi; Rosely A. Peralta; Annelise Casellato; Eduardo Ernesto Castellano; Paul Herrald; Mark J. Riley; Gerhard Schenk","An Unprecedented FeIII(μ-OH)ZnII Complex that Mimics the Structural and Functional Properties of Purple Acid Phosphatases","Journal of the American Chemical Society","2007","129","","7486","7487","10.1021/ja071184l","","","0.71073","MoKα","","0.1033","0.08","","","0.2247","0.2509","","","","","","1.115","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109542","19.218","0.001","15.928","0.001","27.62","0.001","90","","106.36","0.01","90","","8112.3","0.8","120","2","120","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C80 H72 Cl2 Fe2 N14 Na O26 P Zn2 -","- C80 H72 Cl2 Fe2 N14 Na O26 P Zn2 -","- C320 H288 Cl8 Fe8 N56 Na4 O104 P4 Zn8 -","4","0.5","","Ademir Neves; Mauricio Lanznaster; Adailton J. Bortoluzzi; Rosely A. Peralta; Annelise Casellato; Eduardo Ernesto Castellano; Paul Herrald; Mark J. Riley; Gerhard Schenk","An Unprecedented FeIII(μ-OH)ZnII Complex that Mimics the Structural and Functional Properties of Purple Acid Phosphatases","Journal of the American Chemical Society","2007","129","","7486","7487","10.1021/ja071184l","","","0.71073","MoKα","","0.0806","0.0632","","","0.1721","0.1864","","","","","","1.063","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109543","7.8274","0.0008","28.355","0.003","8.0627","0.0008","90","","97.861","0.002","90","","1772.7","0.3","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H19 Cl N2 O2 -","- C21 H19 Cl N2 O2 -","- C84 H76 Cl4 N8 O8 -","4","2","","Jonathan Clayden; Jérémy Dufour; Damian M. Grainger; Madeleine Helliwell","Substituted Diarylmethylamines by Stereospecific Intramolecular Electrophilic Arylation of Lithiated Ureas","Journal of the American Chemical Society","2007","129","","7488","7489","10.1021/ja071523a","","","0.71073","MoKα","","0.0495","0.0441","","","0.1027","0.1055","","","","","","1.046","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109544","10.4248","0.0004","12.8075","0.0004","11.7988","0.0004","90","","112.968","0.002","90","","1450.44","0.09","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H50 N4 O2 -","- C28 H50 N4 O2 -","- C56 H100 N8 O4 -","2","0.5","","Haifeng Du; Weicheng Yuan; Baoguo Zhao; Yian Shi","A Pd(0)-Catalyzed Diamination of Terminal Olefins at Allylic and Homoallylic Carbons via Formal C-H Activation under Solvent-Free Conditions","Journal of the American Chemical Society","2007","129","","7496","7497","10.1021/ja072080d","","","0.71073","MoKα","","0.0874","0.052","","","0.1199","0.1377","","","","","","1.006","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109545","15.5328","0.0006","15.6066","0.0006","24.5182","0.0008","90","","90","","90","","5943.6","0.4","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H50 N4 O2 -","- C28 H50 N4 O2 -","- C224 H400 N32 O16 -","8","2","","Haifeng Du; Weicheng Yuan; Baoguo Zhao; Yian Shi","A Pd(0)-Catalyzed Diamination of Terminal Olefins at Allylic and Homoallylic Carbons via Formal C-H Activation under Solvent-Free Conditions","Journal of the American Chemical Society","2007","129","","7496","7497","10.1021/ja072080d","","","0.71073","MoKα","","0.0966","0.0542","","","0.1176","0.1358","","","","","","1.026","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109546","17.64","","17.3703","0.0012","17.6396","0.0013","90","","90","","90","","5405","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H46 N4 O2 -","- C26 H46 N4 O2 -","- C208 H368 N32 O16 -","8","2","","Haifeng Du; Weicheng Yuan; Baoguo Zhao; Yian Shi","A Pd(0)-Catalyzed Diamination of Terminal Olefins at Allylic and Homoallylic Carbons via Formal C-H Activation under Solvent-Free Conditions","Journal of the American Chemical Society","2007","129","","7496","7497","10.1021/ja072080d","","","0.71073","MoKα","","0.1831","0.0583","","","0.106","0.1471","","","","","","0.632","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109547","14.629","0.002","10.5454","0.0015","34.763","0.005","90","","100.912","0.006","90","","5265.9","1.3","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H32 Ir O P -","- C33 H32 Ir O P -","- C264 H256 Ir8 O8 P8 -","8","2","","Takahiro Nishimura; Yuichi Yasuhara; Tamio Hayashi","Iridium-Catalyzed [3 + 2] Annulation of 1,3-Dienes with ortho-Carbonylated Phenylboronic Acids. A Catalytic Process Involving Regioselective 1,2-Addition","Journal of the American Chemical Society","2007","129","","7506","7507","10.1021/ja072369v","","","0.71075","MoKα","","0.0541","0.046","","","0.1316","0.137","","","","","","1.173","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109548","14.133","0.007","5.25","0.003","16.352","0.008","90","","96.172","0.018","90","","1206.3","1.1","123","2","123","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C14 H16 O2 -","- C14 H16 O2 -","- C56 H64 O8 -","4","1","","Takahiro Nishimura; Yuichi Yasuhara; Tamio Hayashi","Iridium-Catalyzed [3 + 2] Annulation of 1,3-Dienes with ortho-Carbonylated Phenylboronic Acids. A Catalytic Process Involving Regioselective 1,2-Addition","Journal of the American Chemical Society","2007","129","","7506","7507","10.1021/ja072369v","","","0.71075","MoKα","","0.0621","0.0506","","","0.1249","0.136","","","","","","1.08","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109549","14.94","0.003","8.2549","0.0018","20.299","0.004","90","","107.649","0.004","90","","2385.6","0.9","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H66 B2 N2 O2 -","- C46 H50 B2 N2 -","- C92 H100 B4 N4 -","2","0.5","","Yi Sun; Nicole Ross; Shu-Bin Zhao; Krista Huszarik; Wen-Li Jia; Rui-Yao Wang; Donal Macartney; Suning Wang","Enhancing Electron Accepting Ability of Triarylboron via π-Conjugation with 2,2'-Bipy and Metal Chelation: 5,5'-Bis(BMes2)-2,2'-bipy and Its Metal Complexes","Journal of the American Chemical Society","2007","129","","7510","7511","10.1021/ja0725652","","","0.71073","MoKα","","0.1418","0.0601","","","0.0842","0.09","","","","","","0.962","","","","has coordinates,has disorder","178841","2020-10-21","18:00:00",""
"4109550","11.402","0.003","17.934","0.005","21.197","0.005","78.656","0.003","77.688","0.003","72.65","0.003","4000.7","1.8","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C79 H124 B2 Cl2 F2 N4 -","- C78 H122 B2 F2 N4 -","- C156 H244 B4 F4 N8 -","2","1","","Yi Sun; Nicole Ross; Shu-Bin Zhao; Krista Huszarik; Wen-Li Jia; Rui-Yao Wang; Donal Macartney; Suning Wang","Enhancing Electron Accepting Ability of Triarylboron via π-Conjugation with 2,2'-Bipy and Metal Chelation: 5,5'-Bis(BMes2)-2,2'-bipy and Its Metal Complexes","Journal of the American Chemical Society","2007","129","","7510","7511","10.1021/ja0725652","","","0.71073","MoKα","","0.1936","0.0991","","","0.2551","0.2949","","","","","","1","","","","has coordinates,has disorder","178841","2020-10-21","18:00:00",""
"4109551","24.9145","0.0014","13.3642","0.0008","18.6362","0.001","90","","90","","90","","6205.2","0.6","180","2","180","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C64 H80 B2 N2 O1.5 Pt -","- C58 H60 B2 N2 Pt -","- C232 H240 B8 N8 Pt4 -","4","0.5","","Yi Sun; Nicole Ross; Shu-Bin Zhao; Krista Huszarik; Wen-Li Jia; Rui-Yao Wang; Donal Macartney; Suning Wang","Enhancing Electron Accepting Ability of Triarylboron via π-Conjugation with 2,2'-Bipy and Metal Chelation: 5,5'-Bis(BMes2)-2,2'-bipy and Its Metal Complexes","Journal of the American Chemical Society","2007","129","","7510","7511","10.1021/ja0725652","","","0.71073","MoKα","","0.0371","0.0241","","","0.0703","0.0738","","","","","","1.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109552","13.302","0.003","13.302","0.003","9.662","0.004","90","","90","","90","","1709.6","0.9","120","2","120","2","","","","","","","","4","I 4/m","-I 4","87","","","","- C44 H28 Ge N4 -","- C44 H28 Ge N4 -","- C88 H56 Ge2 N8 -","2","0.125","","Julie A. Cissell; Thomas P. Vaid; Glenn P. A. Yap","Reversible Oxidation State Change in Germanium(tetraphenylporphyrin) Induced by a Dative Ligand: Aromatic GeII(TPP) and Antiaromatic GeIV(TPP)(pyridine)2","Journal of the American Chemical Society","2007","129","","7841","7847","10.1021/ja070794i","","","0.71073","MoKα","","0.0611","0.0605","","","0.1575","0.1577","","","","","","1.078","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109553","9.603","0.003","11.992","0.004","20.484","0.007","90.185","0.005","101.13","0.005","104.608","0.005","2236.4","1.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C59 H43 Ge N7 -","- C59 H43 Ge N7 -","- C118 H86 Ge2 N14 -","2","1","","Julie A. Cissell; Thomas P. Vaid; Glenn P. A. Yap","Reversible Oxidation State Change in Germanium(tetraphenylporphyrin) Induced by a Dative Ligand: Aromatic GeII(TPP) and Antiaromatic GeIV(TPP)(pyridine)2","Journal of the American Chemical Society","2007","129","","7841","7847","10.1021/ja070794i","","","0.71073","MoKα","","0.0476","0.0397","","","0.0938","0.1001","","","","","","1.037","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109554","17.003","0.003","17.824","0.004","20.177","0.003","90","","99.981","0.01","90","","6022.3","1.9","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C67 H35 F24 Ge N7 -","- C62 H30 F24 Ge N6 -","- C248 H120 F96 Ge4 N24 -","4","1","","Julie A. Cissell; Thomas P. Vaid; Glenn P. A. Yap","Reversible Oxidation State Change in Germanium(tetraphenylporphyrin) Induced by a Dative Ligand: Aromatic GeII(TPP) and Antiaromatic GeIV(TPP)(pyridine)2","Journal of the American Chemical Society","2007","129","","7841","7847","10.1021/ja070794i","","","0.71073","MoKα","","0.0844","0.0566","","","0.1351","0.1465","","","","","","1.04","","","","has coordinates,has disorder","178841","2020-10-21","18:00:00",""
"4109555","8.42","0.0005","10.9803","0.0007","15.4279","0.0009","90","","90","","90","","1426.37","0.15","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C14 H20 O6 -","- C14 H20 O6 -","- C56 H80 O24 -","4","1","","Shuangyi Wan; Hakan Gunaydin; K. N. Houk; Paul E. Floreancig","An Experimental and Computational Approach to Defining Structure/Reactivity Relationships for Intramolecular Addition Reactions to Bicyclic Epoxonium Ions","Journal of the American Chemical Society","2007","129","","7915","7923","10.1021/ja0709674","","","0.71073","MoKα","","0.0645","0.058","","","0.1366","0.1409","","","","","","1.311","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109556","10.2817","0.0018","10.6501","0.0018","11.88","0.002","90","","90","","90","","1300.9","0.4","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H18 O6 -","- C13 H18 O6 -","- C52 H72 O24 -","4","1","","Shuangyi Wan; Hakan Gunaydin; K. N. Houk; Paul E. Floreancig","An Experimental and Computational Approach to Defining Structure/Reactivity Relationships for Intramolecular Addition Reactions to Bicyclic Epoxonium Ions","Journal of the American Chemical Society","2007","129","","7915","7923","10.1021/ja0709674","","","0.71073","MoKα","","0.117","0.0566","","","0.1197","0.1395","","","","","","0.893","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109557","21.0795","0.0006","18.9497","0.0005","22.5312","0.0005","90","","99.782","0.002","90","","8869.2","0.4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(K-crypt)3[Bi3Ni4(CO)6]*en*tol","","- C69 H124 Bi3 K3 N8 Ni4 O24 -","- C69 H124.02 Bi3 K3 N8 Ni4 O24 -","- C276 H496.08 Bi12 K12 N32 Ni16 O96 -","4","1","","Jose M. Goicoechea; Michael W. Hull; Slavi C. Sevov","Heteroatomic Deltahedral Clusters: Synthesis and Structures of closo-[Bi3Ni4(CO)6]3-, closo-[Bi4Ni4(CO)6]2-, the Open Cluster [Bi3Ni6(CO)9]3-, and the Intermetalloid closo-[Nix@{Bi6Ni6(CO)8}]4-","Journal of the American Chemical Society","2007","129","","7885","7893","10.1021/ja071044b","","","0.71073","MoKα","","0.0984","0.067","","","0.1784","0.1952","","","","","","1.089","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109558","21.0938","0.0008","18.9442","0.0007","22.6611","0.0008","90","","99.628","0.001","90","","8927.9","0.6","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(K-crypt)3[Sb3Ni4(CO)6]*en*tol","","- C69 H124 K3 N8 Ni4 O24 Sb3 -","- C69 H124.02 K3 N8 Ni4 O24 Sb3 -","- C276 H496.08 K12 N32 Ni16 O96 Sb12 -","4","1","","Jose M. Goicoechea; Michael W. Hull; Slavi C. Sevov","Heteroatomic Deltahedral Clusters: Synthesis and Structures of closo-[Bi3Ni4(CO)6]3-, closo-[Bi4Ni4(CO)6]2-, the Open Cluster [Bi3Ni6(CO)9]3-, and the Intermetalloid closo-[Nix@{Bi6Ni6(CO)8}]4-","Journal of the American Chemical Society","2007","129","","7885","7893","10.1021/ja071044b","","","0.71073","MoKα","","0.1128","0.0646","","","0.1667","0.1927","","","","","","1.038","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109559","11.7566","0.0018","48.054","0.007","22.508","0.003","90","","90.448","0.002","90","","12716","3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(K-crypt)4(Bi4Ni4(CO)6)2*tol","","- C91 H152 Bi8 K4 N8 Ni8 O36 -","- C91 H152 Bi8 K4 N8 Ni8 O36 -","- C364 H608 Bi32 K16 N32 Ni32 O144 -","4","1","","Jose M. Goicoechea; Michael W. Hull; Slavi C. Sevov","Heteroatomic Deltahedral Clusters: Synthesis and Structures of closo-[Bi3Ni4(CO)6]3-, closo-[Bi4Ni4(CO)6]2-, the Open Cluster [Bi3Ni6(CO)9]3-, and the Intermetalloid closo-[Nix@{Bi6Ni6(CO)8}]4-","Journal of the American Chemical Society","2007","129","","7885","7893","10.1021/ja071044b","","","0.71073","MoKα","","0.0601","0.0455","","","0.097","0.1005","","","","","","1.101","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109560","13.7111","0.0003","14.3075","0.0004","15.4124","0.0006","111.699","0.002","91.646","0.002","118.149","0.001","2399.6","0.14","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","(K-18crown6)4(Ni@Bi6Ni6(CO)8)*3en","","- C62 H120 Bi6 K4 N6 Ni6.33 O32 -","- C62 H120.06 Bi6 K4 N6 Ni6.334 O32 -","- C62 H120.06 Bi6 K4 N6 Ni6.334 O32 -","1","0.5","","Jose M. Goicoechea; Michael W. Hull; Slavi C. Sevov","Heteroatomic Deltahedral Clusters: Synthesis and Structures of closo-[Bi3Ni4(CO)6]3-, closo-[Bi4Ni4(CO)6]2-, the Open Cluster [Bi3Ni6(CO)9]3-, and the Intermetalloid closo-[Nix@{Bi6Ni6(CO)8}]4-","Journal of the American Chemical Society","2007","129","","7885","7893","10.1021/ja071044b","","","0.71073","MoKα","","0.0627","0.0464","","","0.1141","0.1196","","","","","","1.029","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109561","12.4407","0.0007","12.7175","0.0007","22.9792","0.0013","86.716","0.002","89.544","0.002","82.269","0.002","3596.7","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","(K-18crown6)3(Bi3Ni6(CO)9)*en*0.5tol","","- C50.5 H84 Bi3 K3 N2 Ni6 O27 -","- C50.5 H83.5 Bi3 K3 N2 Ni6 O27 -","- C101 H167 Bi6 K6 N4 Ni12 O54 -","2","1","","Jose M. Goicoechea; Michael W. Hull; Slavi C. Sevov","Heteroatomic Deltahedral Clusters: Synthesis and Structures of closo-[Bi3Ni4(CO)6]3-, closo-[Bi4Ni4(CO)6]2-, the Open Cluster [Bi3Ni6(CO)9]3-, and the Intermetalloid closo-[Nix@{Bi6Ni6(CO)8}]4-","Journal of the American Chemical Society","2007","129","","7885","7893","10.1021/ja071044b","","","0.71073","MoKα","","0.1038","0.056","","","0.112","0.1229","","","","","","1.079","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109562","9.675","0.002","6.0983","0.0013","22.524","0.005","90","","102.402","0.003","90","","1297.9","0.5","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C32 H32 O3 -","- C32 H32 O3 -","- C64 H64 O6 -","2","1","","Wen-Hua Zheng; Bao-Hui Zheng; Yan Zhang; Xue-Long Hou","Highly Regio-, Diastereo-, and Enantioselective Pd-Catalyzed Allylic Alkylation of Acyclic Ketone Enolates with Monosubstituted Allyl Substrates","Journal of the American Chemical Society","2007","129","","7718","7719","10.1021/ja071098l","","","0.71073","MoKα","","0.0891","0.0459","","","0.0897","0.1043","","","","","","0.767","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109563","9.244","0.002","6.5344","0.0017","27.035","0.007","90","","90.004","0.004","90","","1633","0.7","88","2","88","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H3 N4 S4 -","- C5 H3 N4 S4 -","- C40 H24 N32 S32 -","8","2","","Alicea A. Leitch; Robert W. Reed; Craig M. Robertson; James F. Britten; Xueyang Yu; Richard A. Secco; Richard T. Oakley","An Alternating π-Stacked Bisdithiazolyl Radical Conductor","Journal of the American Chemical Society","2007","129","","7903","7914","10.1021/ja071218p","","","0.71073","MoKα","","0.193","0.072","","","0.1398","0.1836","","","","","","0.999","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109564","6.5456","0.0006","9.2558","0.0008","27.04","0.002","90","","90","","90","","1638.2","0.2","123","2","123","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C5 H3 N4 S4 -","- C5 H3 N4 S4 -","- C40 H24 N32 S32 -","8","1","","Alicea A. Leitch; Robert W. Reed; Craig M. Robertson; James F. Britten; Xueyang Yu; Richard A. Secco; Richard T. Oakley","An Alternating π-Stacked Bisdithiazolyl Radical Conductor","Journal of the American Chemical Society","2007","129","","7903","7914","10.1021/ja071218p","","","1.54178","CuKα","","0.0625","0.057","","","0.1617","0.1654","","","","","","1.208","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109565","6.6488","0.0002","27.2177","0.0005","9.2797","0.0002","90","","90","","90","","1679.3","0.07","295","2","295","2","","","","","","","","4","C m c a","-C 2ac 2","64","","","","- C5 H3 N4 S4 -","- C5 H3 N4 S4 -","- C40 H24 N32 S32 -","8","","","Alicea A. Leitch; Robert W. Reed; Craig M. Robertson; James F. Britten; Xueyang Yu; Richard A. Secco; Richard T. Oakley","An Alternating π-Stacked Bisdithiazolyl Radical Conductor","Journal of the American Chemical Society","2007","129","","7903","7914","10.1021/ja071218p","","","1.54178","CuKα","","0.0447","0.0386","","","0.1105","0.1148","","","","","","1.067","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109566","9.8774","0.0004","10.0035","0.0005","12.77","0.0006","85.158","0.001","74.304","0.001","63.535","0.001","1086.48","0.09","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H42 Cl O3 P -","- C19 H42 Cl O3 P -","- C38 H84 Cl2 O6 P2 -","2","1","","Soon Hyeok Hong; Anna G. Wenzel; Tina T. Salguero; Michael W. Day; Robert H. Grubbs","Decomposition of Ruthenium Olefin Metathesis Catalysts","Journal of the American Chemical Society","2007","129","","7961","7968","10.1021/ja0713577","","","0.71073","MoKα","","0.0618","0.0383","","","0.0724","0.0772","","","","","","1.307","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4109567","9.8735","0.0006","10.7053","0.0007","11.8315","0.0007","100.828","0.002","98.018","0.002","116.447","0.001","1063.77","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H58 Cl2 N4 Ru2 -","- C46 H58 Cl2 N4 Ru2 -","- C46 H58 Cl2 N4 Ru2 -","1","0.5","","Soon Hyeok Hong; Anna G. Wenzel; Tina T. Salguero; Michael W. Day; Robert H. Grubbs","Decomposition of Ruthenium Olefin Metathesis Catalysts","Journal of the American Chemical Society","2007","129","","7961","7968","10.1021/ja0713577","","","0.71073","MoKα","","0.0724","0.0422","","","0.0667","0.0714","","","","","","1.146","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4109568","11.3376","0.0007","13.3755","0.0008","21.4203","0.0014","90","","90","","90","","3248.3","0.4","98","2","98","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C36 H41 Cl2 N5 Ru -","- C36 H41 Cl2 N5 Ru -","- C144 H164 Cl8 N20 Ru4 -","4","0.5","","Soon Hyeok Hong; Anna G. Wenzel; Tina T. Salguero; Michael W. Day; Robert H. Grubbs","Decomposition of Ruthenium Olefin Metathesis Catalysts","Journal of the American Chemical Society","2007","129","","7961","7968","10.1021/ja0713577","","","0.71073","MoKα","","0.0481","0.032","","","0.0498","0.0509","","","","","","1.716","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4109569","20.7728","0.0008","20.7728","0.0008","18.1437","0.0016","90","","90","","120","","6780.3","0.7","108","2","108","2","","","","","","","","7","P 61","P 61","169","","","","- C41.33 H62.67 Cl3 N2 O0.33 P Ru -","- C40 H60 Cl3 N2 P Ru -","- C240 H360 Cl18 N12 P6 Ru6 -","6","1","","Marisa L. Macnaughtan; Marc J. A. Johnson; Jeff W. Kampf","Olefin Metathesis Reactions with Vinyl Halides: Formation, Observation, Interception, and Fate of the Ruthenium-Monohalomethylidene Moiety","Journal of the American Chemical Society","2007","129","","7708","7709","10.1021/ja0715952","","","0.71073","MoKα","","0.0587","0.044","","","0.0922","0.0968","","","","","","1.005","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109570","18.238","0.0014","18.238","0.0014","14.286","0.002","90","","90","","120","","4115.2","0.7","153","2","153","2","","","","","","","","5","P 32","P 32","145","","","","- C51.5 H52.5 Cu2 N4 O11.75 -","- C51.5 H30 Cu2 N4 O11.75 -","- C154.5 H90 Cu6 N12 O35.25 -","3","1","","Jungseok Heo; You-Moon Jeon; Chad A. Mirkin","Reversible Interconversion of Homochiral Triangular Macrocycles and Helical Coordination Polymers","Journal of the American Chemical Society","2007","129","","7712","7713","10.1021/ja0716812","","","0.71073","MoKα","","0.1064","0.0665","","","0.1755","0.2154","","","","","","0.752","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109571","18.2101","0.0011","18.2101","0.0011","14.2785","0.0018","90","","90","","120","","4100.5","0.6","153","2","153","2","","","","","","","","5","P 31","P 31","144","","","","- C50.5 H53.5 Cu2 N4 O12.5 -","- C50.5 H30 Cu2 N4 O12.5 -","- C151.5 H90 Cu6 N12 O37.5 -","3","1","","Jungseok Heo; You-Moon Jeon; Chad A. Mirkin","Reversible Interconversion of Homochiral Triangular Macrocycles and Helical Coordination Polymers","Journal of the American Chemical Society","2007","129","","7712","7713","10.1021/ja0716812","","","0.71073","MoKα","","0.1132","0.0647","","","0.1474","0.169","","","","","","0.94","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109572","27.7103","0.001","27.7103","0.001","24.1747","0.0017","90","","90","","120","","16075.9","1.4","153","2","153","2","","","","","","","","5","R 3 :H","R 3","146","","","","- C76 H62 Cu2 N10 O7 -","- C76 H40 Cu2 N10 O7 -","- C684 H360 Cu18 N90 O63 -","9","1","","Jungseok Heo; You-Moon Jeon; Chad A. Mirkin","Reversible Interconversion of Homochiral Triangular Macrocycles and Helical Coordination Polymers","Journal of the American Chemical Society","2007","129","","7712","7713","10.1021/ja0716812","","","0.71073","MoKα","","0.1331","0.0728","","","0.1912","0.2358","","","","","","0.84","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109573","27.7575","0.0015","27.7575","0.0015","24.198","0.003","90","","90","","120","","16146","2","153","2","153","2","","","","","","","","5","R 3 :H","R 3","146","","","","- C76 H61.33 Cu2 N10 O6.67 -","- C76 H60 Cu2 N10 O6.66667 -","- C684 H540 Cu18 N90 O60 -","9","1","","Jungseok Heo; You-Moon Jeon; Chad A. Mirkin","Reversible Interconversion of Homochiral Triangular Macrocycles and Helical Coordination Polymers","Journal of the American Chemical Society","2007","129","","7712","7713","10.1021/ja0716812","","","0.71073","MoKα","","0.1768","0.0792","","","0.1973","0.2259","","","","","","1.026","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109574","9.9162","0.0002","12.3631","0.0003","15.313","0.0004","89.386","0.001","84.283","0.001","69.609","0.001","1750.33","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C67 H6 O4 S2 -","- C67 H6 O4 S2 -","- C134 H12 O8 S4 -","2","1","","Wei Zhang; Timothy M. Swager","Functionalization of Single-Walled Carbon Nanotubes and Fullerenes via a Dimethyl Acetylenedicarboxylate-4-Dimethylaminopyridine Zwitterion Approach","Journal of the American Chemical Society","2007","129","","7714","7715","10.1021/ja0717212","","","0.71073","MoKα","","0.0753","0.0699","","","0.1835","0.188","","","","","","1.051","","","","has coordinates,has disorder","178841","2020-10-21","18:00:00",""
"4109575","30.7329","0.0005","12.1699","0.0002","15.1349","0.0002","90","","90","","90","","5660.7","0.15","93.1","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C31 H36 N2 O4 S2 -","- C31 H36 N2 O4 S2 -","- C248 H288 N16 O32 S16 -","8","1","","Daisuke Tanaka; Yoshihiro Sato; Miwako Mori","Ruthenium-Catalyzed [2 + 2 + 2] Cocyclization of Diene-yne","Journal of the American Chemical Society","2007","129","","7730","7731","10.1021/ja071954t","","","1.54187","CuKα","","","0.0495","","","","0.1457","","","","","","1.106","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109576","6.28801","0.00017","12.0898","0.0004","16.3874","0.0005","79.995","0.002","80.8101","0.0019","85.537","0.003","1209.48","0.06","93.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H32 N2 O4 S2 -","- C26 H32 N2 O4 S2 -","- C52 H64 N4 O8 S4 -","2","1","","Daisuke Tanaka; Yoshihiro Sato; Miwako Mori","Ruthenium-Catalyzed [2 + 2 + 2] Cocyclization of Diene-yne","Journal of the American Chemical Society","2007","129","","7730","7731","10.1021/ja071954t","","","1.54187","CuKα","","","0.0362","","","","0.0999","","","","","","1.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109577","12.778","0.003","21.822","0.004","20.534","0.004","90","","96.34","0.03","90","","5691","2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C65 H74 N2 O4 P2 Pd -","- C65 H74 N2 O4 P2 Pd -","- C260 H296 N8 O16 P8 Pd4 -","4","1","","Qilong Shen; John F. Hartwig","Lewis Acid Acceleration of C-N Bond-Forming Reductive Elimination from Heteroarylpalladium Complexes and Catalytic Amidation of Heteroaryl Bromides","Journal of the American Chemical Society","2007","129","","7734","7735","10.1021/ja0722473","","","0.71073","MoKα","","0.0963","0.0546","","","0.1459","0.1651","","","","","","1.01","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109578","15.447","0.003","14.8077","0.0016","19.75","0.003","90","","95.002","0.006","90","","4500.3","1.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C51 H52 B4 O8 -","- C51 H52 B4 O8 -","- C204 H208 B16 O32 -","4","1","","Nobuharu Iwasawa; Hiroki Takahagi","Boronic Esters as a System for Crystallization-Induced Dynamic Self-Assembly Equipped with an ""On-Off"" Switch for Equilibration","Journal of the American Chemical Society","2007","129","","7754","7755","10.1021/ja072319q","","","0.71073","MoKα","","0.0856","0.0743","","","0.2126","0.2167","","","","","","1.133","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109579","12.361","0.003","15.078","0.003","19.743","0.004","90","","99.06","0.003","90","","3633.8","1.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H48 Au Cl2 F N2 -","- C37 H48 Au Cl2 F N2 -","- C148 H192 Au4 Cl8 F4 N8 -","4","1","","Jennifer A. Akana; Koyel X. Bhattacharyya; Peter Müller; Joseph P. Sadighi","Reversible C-F Bond Formation and the Au-Catalyzed Hydrofluorination of Alkynes","Journal of the American Chemical Society","2007","129","","7736","7737","10.1021/ja0723784","","","0.71073","MoKα","","0.0319","0.0256","","","0.0637","0.0674","","","","","","1.024","","","","has coordinates,has disorder","178841","2020-10-21","18:00:00",""
"4109580","10.606","0.0012","7.1299","0.0008","24.583","0.003","90","","94.177","0.003","90","","1854","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H21 N O6 -","- C21 H21 N O6 -","- C84 H84 N4 O24 -","4","1","","Shun Su; John A. Porco","Synthesis of Pyrrolo-isoquinolines Related to the Lamellarins Using Silver-Catalyzed Cycloisomerization/Dipolar Cycloaddition","Journal of the American Chemical Society","2007","129","","7744","7745","10.1021/ja072737v","","","0.71073","MoKα","","0.0522","0.0381","","","0.1071","0.1138","","","","","","1.058","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109581","8.0265","0.0008","9.2144","0.0008","10.8224","0.001","104.461","0.003","103.518","0.003","108.685","0.003","689.92","0.11","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H15 N O4 -","- C17 H15 N O4 -","- C34 H30 N2 O8 -","2","1","","Shun Su; John A. Porco","Synthesis of Pyrrolo-isoquinolines Related to the Lamellarins Using Silver-Catalyzed Cycloisomerization/Dipolar Cycloaddition","Journal of the American Chemical Society","2007","129","","7744","7745","10.1021/ja072737v","","","0.71073","MoKα","","0.0527","0.0396","","","0.0978","0.1039","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109582","15.4051","0.0016","8.4192","0.0008","20.955","0.002","90","","97.664","0.005","90","","2693.6","0.5","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H37 N O4 Si -","- C27 H37 N O4 Si -","- C108 H148 N4 O16 Si4 -","4","1","","Shun Su; John A. Porco","Synthesis of Pyrrolo-isoquinolines Related to the Lamellarins Using Silver-Catalyzed Cycloisomerization/Dipolar Cycloaddition","Journal of the American Chemical Society","2007","129","","7744","7745","10.1021/ja072737v","","","0.71073","MoKα","","0.0787","0.0486","","","0.1301","0.146","","","","","","1.059","","","","has coordinates,has disorder","178841","2020-10-21","18:00:00",""
"4109583","11.879","0.0003","16.205","0.0006","29.367","0.0009","90","","90.886","0.002","90","","5652.4","0.3","120","0.1","120","0.1","","","","","","","","3","C 1 c 1","C -2yc","9","","trans-1,2-Bis{bis[bis(trimethylsilyl)methyl]isopropylsilyl}- 3,4-dimethyl-1,2-disilacyclobutene","","- C38 H98 Si12 -","- C38 H98 Si12 -","- C152 H392 Si48 -","4","1","","Rei Kinjo; Masaaki Ichinohe; Akira Sekiguchi; Nozomi Takagi; Michinori Sumimoto; Shigeru Nagase","Reactivity of a Disilyne RSi\τbSiR (R = SiiPr[CH(SiMe3)2]2) toward π-Bonds: Stereospecific Addition and a New Route to an Isolable 1,2-Disilabenzene","Journal of the American Chemical Society","2007","129","","7766","7767","10.1021/ja072759h","","","0.7107","MoKα","","0.0412","0.0381","","","0.0965","0.0992","","","","","","1.021","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109584","11.964","0.001","14.311","0.0016","20.267","0.002","110.482","0.005","91.712","0.006","92.014","0.006","3245.4","0.6","120","0.1","120","0.1","","","","","","","","3","P -1","-P 1","2","","1,2-bis[bis{bis(trimethylsilyl)methyl}isopropyl}- 3,4-diphenyl-1,2-disilabenzene","","- C50 H102 Si12 -","- C50 H102 Si12 -","- C100 H204 Si24 -","2","1","","Rei Kinjo; Masaaki Ichinohe; Akira Sekiguchi; Nozomi Takagi; Michinori Sumimoto; Shigeru Nagase","Reactivity of a Disilyne RSi\τbSiR (R = SiiPr[CH(SiMe3)2]2) toward π-Bonds: Stereospecific Addition and a New Route to an Isolable 1,2-Disilabenzene","Journal of the American Chemical Society","2007","129","","7766","7767","10.1021/ja072759h","","","0.7107","MoKα","","0.1193","0.0662","","","0.1577","0.1877","","","","","","0.978","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109585","9.2821","0.0009","17.5262","0.0011","13.815","0.001","90","","101.407","0.0014","90","","2203","0.3","103","2","103","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 O5 P Pd S -","- C23 H23 O5 P Pd S -","- C92 H92 O20 P4 Pd4 S4 -","4","1","","Takuya Kochi; Akifumi Nakamura; Hirotsugu Ida; Kyoko Nozaki","Alternating Copolymerization of Vinyl Acetate with Carbon Monoxide","Journal of the American Chemical Society","2007","129","","7770","7771","10.1021/ja072859n","","","0.7107","MoKα","","0.0252","0.0241","","","0.0603","0.061","","","","","","1.072","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109586","67.154","0.013","19.104","0.004","32.685","0.007","90","","106.96","0.03","90","","40108","16","110","2","110","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C190.5 H178.75 Cl4 N19.25 Ni4 P12 Re4 -","- C190.5 H178.75 Cl4 N19.25 Ni4 P12 Re4 -","- C1524 H1430 Cl32 N154 Ni32 P96 Re32 -","8","1","","Eric J. Schelter; Ferdi Karadas; Carolina Avendano; Andrey V. Prosvirin; Wolfgang Wernsdorfer; Kim R. Dunbar","A Family of Mixed-Metal Cyanide Cubes with Alternating Octahedral and Tetrahedral Corners Exhibiting a Variety of Magnetic Behaviors Including Single Molecule Magnetism","Journal of the American Chemical Society","2007","129","","8139","8149","10.1021/ja0683281","","","0.71073","MoKα","","0.1876","0.1016","","","0.2224","0.2574","","","","","","1.044","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109587","67.056","0.013","18.895","0.004","32.549","0.007","90","","106.68","0.03","90","","39505","15","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C200.45 H184.25 Cl4 N19 O2.7 P12 Re4 Zn4 -","- C200.45 H184.25 Cl4 N19 O2.7 P12 Re4 Zn4 -","- C1603.6 H1474 Cl32 N152 O21.6 P96 Re32 Zn32 -","8","1","","Eric J. Schelter; Ferdi Karadas; Carolina Avendano; Andrey V. Prosvirin; Wolfgang Wernsdorfer; Kim R. Dunbar","A Family of Mixed-Metal Cyanide Cubes with Alternating Octahedral and Tetrahedral Corners Exhibiting a Variety of Magnetic Behaviors Including Single Molecule Magnetism","Journal of the American Chemical Society","2007","129","","8139","8149","10.1021/ja0683281","","","0.71073","MoKα","","0.0609","0.0482","","","0.1207","0.1265","","","","","","1.112","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109588","67.243","0.013","18.813","0.004","32.616","0.007","90","","106.44","0.03","90","","39574","15","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C194.5 H192 Cl3.5 Fe4 N19.5 O1.5 P12 Re4 -","- C194.5 H192 Cl3.5 Fe4 N19.5 O1.5 P12 Re4 -","- C1556 H1536 Cl28 Fe32 N156 O12 P96 Re32 -","8","1","","Eric J. Schelter; Ferdi Karadas; Carolina Avendano; Andrey V. Prosvirin; Wolfgang Wernsdorfer; Kim R. Dunbar","A Family of Mixed-Metal Cyanide Cubes with Alternating Octahedral and Tetrahedral Corners Exhibiting a Variety of Magnetic Behaviors Including Single Molecule Magnetism","Journal of the American Chemical Society","2007","129","","8139","8149","10.1021/ja0683281","","","0.71073","MoKα","","0.1053","0.08","","","0.1867","0.1972","","","","","","1.168","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109589","17.4307","0.0013","5.3287","0.0003","26.7589","0.0019","90","","90","","90","","2485.4","0.3","295","2","295","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C13 H12 N2 O5 -","- C13 H12 N2 O5 -","- C104 H96 N16 O40 -","8","1","","Tamara L. Church; Christopher M. Byrne; Emil B. Lobkovsky; Geoffrey W. Coates","A New Multicomponent Reaction Catalyzed by a [Lewis Acid]+[Co(CO)4]- Catalyst: Stereospecific Synthesis of 1,3-Oxazinane-2,4-diones from Epoxides, Isocyanates, and CO","Journal of the American Chemical Society","2007","129","","8156","8162","10.1021/ja069065d","","","0.71073","MoKα","","0.0619","0.0379","","","0.0981","0.1149","","","","","","1.021","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109590","5.3536","0.0004","9.2517","0.0007","22.0423","0.0016","90","","90","","90","","1091.75","0.14","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H10 Br N O3 -","- C11 H10 Br N O3 -","- C44 H40 Br4 N4 O12 -","4","1","","Tamara L. Church; Christopher M. Byrne; Emil B. Lobkovsky; Geoffrey W. Coates","A New Multicomponent Reaction Catalyzed by a [Lewis Acid]+[Co(CO)4]- Catalyst: Stereospecific Synthesis of 1,3-Oxazinane-2,4-diones from Epoxides, Isocyanates, and CO","Journal of the American Chemical Society","2007","129","","8156","8162","10.1021/ja069065d","","","0.71073","MoKα","","0.0397","0.0277","","","0.0578","0.0611","","","","","","0.964","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109591","22.938","0.004","10.2673","0.0017","19.629","0.003","90","","115.543","0.002","90","","4171","1.2","100","0.1","100","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","holas19","","","- C47 H63 Fe N4 -","- C47 H63 Fe N4 -","- C188 H252 Fe4 N16 -","4","0.5","","Azwana R. Sadique; Elizabeth A. Gregory; William W. Brennessel; Patrick L. Holland","Mechanistic Insight into NN Cleavage by a Low-Coordinate Iron(II) Hydride Complex","Journal of the American Chemical Society","2007","129","","8112","8121","10.1021/ja069199r","","","0.71073","MoKα","","0.0512","0.0384","","","0.0965","0.1035","","","","","","1.054","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109592","50.91","0.003","14.3387","0.0009","28.6998","0.0018","90","","123.668","0.001","90","","17436.2","1.9","100","0.1","100","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","holas09","","","- C96 H148 Fe2 N4 -","- C96 H148 Fe2 N4 -","- C768 H1184 Fe16 N32 -","8","1","","Azwana R. Sadique; Elizabeth A. Gregory; William W. Brennessel; Patrick L. Holland","Mechanistic Insight into NN Cleavage by a Low-Coordinate Iron(II) Hydride Complex","Journal of the American Chemical Society","2007","129","","8112","8121","10.1021/ja069199r","","","0.71073","MoKα","","0.0607","0.0467","","","0.1235","0.1328","","","","","","1.017","","","","has coordinates,has disorder","178841","2020-10-21","18:00:00",""
"4109593","17.521","0.005","21.541","0.006","8.296","0.002","90","","91.057","0.006","90","","3130.5","1.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H21 B F9 N3 O -","- C37 H21 B F9 N3 O -","- C148 H84 B4 F36 N12 O4 -","4","1","","Yuichi Takeuchi; Atsushi Matsuda; Nagao Kobayashi","Synthesis and Characterization of meso-Triarylsubporphyrins","Journal of the American Chemical Society","2007","129","","8271","8281","10.1021/ja0712120","","","0.7107","MoKα","","0.0801","0.0714","","","0.1427","0.1473","","","","","","1.226","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109594","10.057","0.003","28.505","0.009","9.464","0.002","90","","108.676","0.005","90","","2570.2","1.2","150","2","173.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H29 B N2 O3 -","- C32 H29 B N2 O3 -","- C128 H116 B4 N8 O12 -","4","1","","Yuichi Takeuchi; Atsushi Matsuda; Nagao Kobayashi","Synthesis and Characterization of meso-Triarylsubporphyrins","Journal of the American Chemical Society","2007","129","","8271","8281","10.1021/ja0712120","","","0.7107","MoKα","","0.0881","0.0733","","","0.1525","0.1604","","","","","","1.194","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109595","15.304","0.007","15.316","0.007","21.776","0.014","95.059","0.007","106.489","0.007","116.953","0.005","4220","4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C73 H83 F24 N13 O7 P4 -","- C73 H83 F24 N13 O7 P4 -","- C146 H166 F48 N26 O14 P8 -","2","1","","Ognjen Š. Miljanić; William R. Dichtel; Saeed I. Khan; Shahab Mortezaei; James R. Heath; J. Fraser Stoddart","Structural and Co-conformational Effects of Alkyne-Derived Subunits in Charged Donor-Acceptor [2]Catenanes","Journal of the American Chemical Society","2007","129","","8236","8246","10.1021/ja071319n","","","0.71073","MoKα","","0.2035","0.0762","","","0.1827","0.2387","","","","","","1.028","","","","has coordinates,has disorder","178841","2020-10-21","18:00:00",""
"4109596","13.69","0.002","13.848","0.002","24.046","0.004","84.815","0.002","85.732","0.002","67.626","0.003","4194.2","1.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C76 H84 F24 N10 O8 P4 -","- C76 H84 F24 N10 O8 P4 -","- C152 H168 F48 N20 O16 P8 -","2","1","","Ognjen Š. Miljanić; William R. Dichtel; Saeed I. Khan; Shahab Mortezaei; James R. Heath; J. Fraser Stoddart","Structural and Co-conformational Effects of Alkyne-Derived Subunits in Charged Donor-Acceptor [2]Catenanes","Journal of the American Chemical Society","2007","129","","8236","8246","10.1021/ja071319n","","","0.71073","MoKα","","0.0988","0.0763","","","0.2042","0.2218","","","","","","1.034","","","","has coordinates,has disorder","178841","2020-10-21","18:00:00",""
"4109597","14.021","0.003","14.121","0.003","22.21","0.005","94.628","0.002","93.4","0.002","93.554","0.003","4365.5","1.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C80 H92 F24 N10 O10 P4 -","- C80 H92 F24 N10 O10 P4 -","- C160 H184 F48 N20 O20 P8 -","2","1","","Ognjen Š. Miljanić; William R. Dichtel; Saeed I. Khan; Shahab Mortezaei; James R. Heath; J. Fraser Stoddart","Structural and Co-conformational Effects of Alkyne-Derived Subunits in Charged Donor-Acceptor [2]Catenanes","Journal of the American Chemical Society","2007","129","","8236","8246","10.1021/ja071319n","","","0.71073","MoKα","","0.1212","0.0845","","","0.2417","0.2746","","","","","","1.041","","","","has coordinates,has disorder","178841","2020-10-21","18:00:00",""
"4109598","10.163","0.003","12.669","0.004","14.245","0.005","99.963","0.004","107.12","0.003","112.522","0.003","1532","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H60 F24 N4 O6 P4 -","- C60 H60 F24 N4 O6 P4 -","- C60 H60 F24 N4 O6 P4 -","1","0.5","","Ognjen Š. Miljanić; William R. Dichtel; Saeed I. Khan; Shahab Mortezaei; James R. Heath; J. Fraser Stoddart","Structural and Co-conformational Effects of Alkyne-Derived Subunits in Charged Donor-Acceptor [2]Catenanes","Journal of the American Chemical Society","2007","129","","8236","8246","10.1021/ja071319n","","","0.71073","MoKα","","0.0928","0.0595","","","0.1365","0.1551","","","","","","1.012","","","","has coordinates","178841","2020-10-21","18:00:00",""
"4109599","15.3679","0.0003","17.1148","0.0003","18.7696","0.0002","89.655","0.001","75.018","0.001","78.53","0.001","4668.32","0.14","200","1","200","1","","","","","","","","5","P -1","-P 1","2","","","","- C105 H105 F10 P4 Pt2 -","- C105 H105 F10 P4 Pt2 -","- C210 H210 F20 P8 Pt4 -","2","1","","Jürgen Stahl; Wolfgang Mohr; Laura de Quadras; Thomas B. Peters; James C. Bohling; José Miguel Martín-Alvarez; Gareth R. Owen; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Coordination-Driven Self-Assembly of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages","Journal of the American Chemical Society","2007","129","","8282","8295","10.1021/ja0716103","","","0.71073","MoKα","","0.032","0.032","","","0.0683","0.0683","","","","","","1.043","","","","has coordinates,has disorder","178841","2020-10-21","18:00:00",""
"4109600","15.217","0.003","17.213","0.003","18.597","0.004","92.48","0.03","104.45","0.03","101.24","0.03","4604.8","1.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C106.5 H108 F10 P4 Pt2 -","- C106.5 H104 F10 P4 Pt2 -","- C213 H208 F20 P8 Pt4 -","2","1","","Jürgen Stahl; Wolfgang Mohr; Laura de Quadras; Thomas B. Peters; James C. Bohling; José Miguel Martín-Alvarez; Gareth R. Owen; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Coordination-Driven Self-Assembly of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages","Journal of the American Chemical Society","2007","129","","8282","8295","10.1021/ja0716103","","","0.71073","MoKα","","0.0515","0.0342","","","0.0782","0.0983","","","","","","0.91","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109601","15.2004","0.0003","16.8315","0.0003","19.6584","0.0004","82.548","0.001","87.58","0.001","70.936","0.001","4713.52","0.16","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C104 H112 F10 P4 Pt2 -","- C104 H112 F10 P4 Pt2 -","- C208 H224 F20 P8 Pt4 -","2","1","","Jürgen Stahl; Wolfgang Mohr; Laura de Quadras; Thomas B. Peters; James C. Bohling; José Miguel Martín-Alvarez; Gareth R. Owen; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Coordination-Driven Self-Assembly of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages","Journal of the American Chemical Society","2007","129","","8282","8295","10.1021/ja0716103","","","0.71073","MoKα","","0.0898","0.0415","","","0.0871","0.1143","","","","","","1.064","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109602","15.882","0.003","30.726","0.006","13.287","0.003","90","","96.31","0.03","90","","6445","2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C142 H176 F10 P4 Pt2 -","- C142 H176 F10 P4 Pt2 -","- C284 H352 F20 P8 Pt4 -","2","0.5","","Jürgen Stahl; Wolfgang Mohr; Laura de Quadras; Thomas B. Peters; James C. Bohling; José Miguel Martín-Alvarez; Gareth R. Owen; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Coordination-Driven Self-Assembly of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages","Journal of the American Chemical Society","2007","129","","8282","8295","10.1021/ja0716103","","","0.71073","MoKα","","0.0971","0.0498","","","0.1032","0.1231","","","","","","0.951","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109603","18.225","0.0002","20.9677","0.0002","22.198","0.0002","110.275","0.001","101.084","0.001","95.346","0.001","7690.11","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C166.5 H204 F10 P4 Pt2 -","- C166.5 H203.5 F10 P4 Pt2 -","- C333 H407 F20 P8 Pt4 -","2","1","","Jürgen Stahl; Wolfgang Mohr; Laura de Quadras; Thomas B. Peters; James C. Bohling; José Miguel Martín-Alvarez; Gareth R. Owen; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Coordination-Driven Self-Assembly of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages","Journal of the American Chemical Society","2007","129","","8282","8295","10.1021/ja0716103","","","0.71073","MoKα","","0.092","0.0437","","","0.0954","0.1114","","","","","","1.017","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109604","10.768","0.002","18.49","0.004","21.761","0.004","87.21","0.03","82.72","0.03","84.57","0.03","4275.5","1.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C90 H82 Cl6 F10 P4 Pt2 -","- C90 H82 Cl6 F10 P4 Pt2 -","- C180 H164 Cl12 F20 P8 Pt4 -","2","1","","Jürgen Stahl; Wolfgang Mohr; Laura de Quadras; Thomas B. Peters; James C. Bohling; José Miguel Martín-Alvarez; Gareth R. Owen; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Coordination-Driven Self-Assembly of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages","Journal of the American Chemical Society","2007","129","","8282","8295","10.1021/ja0716103","","","0.71073","MoKα","","0.0503","0.0355","","","0.0925","0.1038","","","","","","0.996","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109605","17.7012","0.0001","30.9833","0.0003","18.7178","0.0002","90","","103.174","0.001","90","","9995.45","0.16","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C116 H112 F10 P4 Pt2 -","- C116.001 H111 F10 P4 Pt2 -","- C464.004 H444 F40 P16 Pt8 -","4","1","","Jürgen Stahl; Wolfgang Mohr; Laura de Quadras; Thomas B. Peters; James C. Bohling; José Miguel Martín-Alvarez; Gareth R. Owen; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Coordination-Driven Self-Assembly of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages","Journal of the American Chemical Society","2007","129","","8282","8295","10.1021/ja0716103","","","0.71073","MoKα","","0.1171","0.0488","","","0.1029","0.1351","","","","","","0.995","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109606","10.9876","0.0001","17.2761","0.0002","24.8047","0.0002","77.828","0.0006","79.3644","0.0006","87.8733","0.0005","4523.57","0.08","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C94.5 H93 Cl5 F10 P4 Pt2 -","- C94.519 H93 Cl5 F10 P4 Pt2 -","- C189.038 H186 Cl10 F20 P8 Pt4 -","2","1","","Jürgen Stahl; Wolfgang Mohr; Laura de Quadras; Thomas B. Peters; James C. Bohling; José Miguel Martín-Alvarez; Gareth R. Owen; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Coordination-Driven Self-Assembly of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages","Journal of the American Chemical Society","2007","129","","8282","8295","10.1021/ja0716103","","","0.71073","MoKα","","0.0482","0.0396","","","0.104","0.1117","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109607","12.1498","0.0003","23.1843","0.0006","26.5928","0.0008","89.091","0.001","82.586","0.001","83.366","0.001","7378.4","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C108.67 H113.33 Cl1.33 F10 P4 Pt2 -","- C108.667 H113.333 Cl1.33333 F10 P4 Pt2 -","- C326 H340 Cl4 F30 P12 Pt6 -","3","1.5","","Jürgen Stahl; Wolfgang Mohr; Laura de Quadras; Thomas B. Peters; James C. Bohling; José Miguel Martín-Alvarez; Gareth R. Owen; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Coordination-Driven Self-Assembly of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages","Journal of the American Chemical Society","2007","129","","8282","8295","10.1021/ja0716103","","","0.71073","MoKα","","0.1524","0.0757","","","0.1467","0.1781","","","","","","1.1","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109608","11.5289","0.0002","15.3365","0.0002","28.3205","0.0003","84.848","0.001","88.311","0.001","85.263","0.001","4968.94","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H61 F5 P2 Pt Si -","- C53.0015 H61 F5 P2 Pt Si -","- C212.006 H244 F20 P8 Pt4 Si4 -","4","2","","Laura de Quadras; Eike B. Bauer; Wolfgang Mohr; James C. Bohling; Thomas B. Peters; José Miguel Martín-Alvarez; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Directed Syntheses of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages via Alkene Metathesis","Journal of the American Chemical Society","2007","129","","8296","8309","10.1021/ja071612n","","","0.71073","MoKα","","0.0531","0.0354","","","0.0886","0.1059","","","","","","1.038","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109609","11.123","0.002","13.502","0.003","16.601","0.003","71.73","0.03","84.61","0.03","78.49","0.03","2318.6","0.9","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C98 H102 F10 O P4 Pt2 -","- C98 H102 F10 O P4 Pt2 -","- C98 H102 F10 O P4 Pt2 -","1","0.5","","Laura de Quadras; Eike B. Bauer; Wolfgang Mohr; James C. Bohling; Thomas B. Peters; José Miguel Martín-Alvarez; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Directed Syntheses of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages via Alkene Metathesis","Journal of the American Chemical Society","2007","129","","8296","8309","10.1021/ja071612n","","","0.71073","MoKα","","0.078","0.0426","","","0.0956","0.115","","","","","","1.029","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109610","11.506","0.002","13.742","0.003","17.183","0.003","79.89","0.001","89.511","0.001","66.203","0.001","2441.5","0.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C110 H124 F10 P4 Pt2 -","- C110 H124 F10 P4 Pt2 -","- C110 H124 F10 P4 Pt2 -","1","0.5","","Laura de Quadras; Eike B. Bauer; Wolfgang Mohr; James C. Bohling; Thomas B. Peters; José Miguel Martín-Alvarez; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Directed Syntheses of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages via Alkene Metathesis","Journal of the American Chemical Society","2007","129","","8296","8309","10.1021/ja071612n","","","0.71073","MoKα","","0.0363","0.0292","","","0.0737","0.0774","","","","","","1.012","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109611","11.4","0.0002","14.377","0.0003","15.114","0.0003","83.968","0.001","80.358","0.001","80.128","0.001","2398.55","0.08","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C108 H120 F10 P4 Pt2 -","- C108 H120 F10 P4 Pt2 -","- C108 H120 F10 P4 Pt2 -","1","0.5","","Laura de Quadras; Eike B. Bauer; Wolfgang Mohr; James C. Bohling; Thomas B. Peters; José Miguel Martín-Alvarez; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Directed Syntheses of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages via Alkene Metathesis","Journal of the American Chemical Society","2007","129","","8296","8309","10.1021/ja071612n","","","0.71073","MoKα","","0.0395","0.0303","","","0.0712","0.0748","","","","","","1.019","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109612","39.914","0.008","11.143","0.002","22.639","0.005","90","","102.57","0.03","90","","9828","4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H120 F10 P4 Pt2 -","- C108 H120 F10 P4 Pt2 -","- C432 H480 F40 P16 Pt8 -","4","1","","Laura de Quadras; Eike B. Bauer; Wolfgang Mohr; James C. Bohling; Thomas B. Peters; José Miguel Martín-Alvarez; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Directed Syntheses of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages via Alkene Metathesis","Journal of the American Chemical Society","2007","129","","8296","8309","10.1021/ja071612n","","","0.71073","MoKα","","0.078","0.0429","","","0.0998","0.1146","","","","","","0.977","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109613","11.802","0.0003","16.751","0.0003","25.733","0.0004","90","","91.186","0.0012","90","","5086.2","0.18","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C112 H120 F10 P4 Pt2 -","- C112 H120 F10 P4 Pt2 -","- C224 H240 F20 P8 Pt4 -","2","0.5","","Laura de Quadras; Eike B. Bauer; Wolfgang Mohr; James C. Bohling; Thomas B. Peters; José Miguel Martín-Alvarez; Frank Hampel; John A. Gladysz","sp Carbon Chains Surrounded by sp3 Carbon Double Helices: Directed Syntheses of Wirelike Pt(C\τbC)nPt Moieties That Are Spanned by Two P(CH2)mP Linkages via Alkene Metathesis","Journal of the American Chemical Society","2007","129","","8296","8309","10.1021/ja071612n","","","0.71073","MoKα","","0.0813","0.0492","","","0.1187","0.1344","","","","","","1.06","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109614","6.947","0.0012","9.8537","0.0017","14.9","0.003","75.203","0.002","89.945","0.002","78.979","0.002","966.7","0.3","100","0.1","100","0.2","","","","","","","","3","P -1","-P 1","2","frojh01","","","- C21 H26 O6 -","- C21 H26 O6 -","- C42 H52 O12 -","2","1","","Jie Huang; Alison J. Frontier","Development of a Nazarov Cyclization/Wagner-Meerwein Rearrangement Sequence for the Stereoselective Synthesis of Spirocycles","Journal of the American Chemical Society","2007","129","","8060","8061","10.1021/ja0716148","","","0.71073","MoKα","","0.0449","0.0353","","","0.0946","0.0997","","","","","","1.052","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109615","15.7112","0.0017","10.68","0.0012","11.8647","0.0013","90","","110.342","0.001","90","","1866.7","0.4","100","0.1","100","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","frojh04","","","- C21 H24 O6 -","- C21 H24 O6 -","- C84 H96 O24 -","4","1","","Jie Huang; Alison J. Frontier","Development of a Nazarov Cyclization/Wagner-Meerwein Rearrangement Sequence for the Stereoselective Synthesis of Spirocycles","Journal of the American Chemical Society","2007","129","","8060","8061","10.1021/ja0716148","","","0.71073","MoKα","","0.0436","0.0373","","","0.1017","0.1069","","","","","","1.036","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109616","12.621","0.0006","15.9424","0.0007","14.1817","0.0008","90","","104.468","0.002","90","","2763","0.2","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H41 Cr N2 O2 -","- C29 H41 Cr N2 O2 -","- C116 H164 Cr4 N8 O8 -","4","1","","Yi-Chou Tsai; Po-Yang Wang; Shin-An Chen; Jin-Ming Chen","Inverted-Sandwich Dichromium(I) Complexes Supported by Two β-Diketiminates: A Multielectron Reductant and Syntheses of Chromium Dioxo and Imido","Journal of the American Chemical Society","2007","129","","8066","8067","10.1021/ja072003i","","","0.71073","MoKα","","0.1599","0.085","","","0.1931","0.2504","","","","","","1.109","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109617","10.6436","0.0001","27.3407","0.0004","15.3227","0.0002","90","","101.695","0.001","90","","4366.39","0.1","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C47 H63 Cr N4 -","- C47 H63 Cr N4 -","- C188 H252 Cr4 N16 -","4","1","","Yi-Chou Tsai; Po-Yang Wang; Shin-An Chen; Jin-Ming Chen","Inverted-Sandwich Dichromium(I) Complexes Supported by Two β-Diketiminates: A Multielectron Reductant and Syntheses of Chromium Dioxo and Imido","Journal of the American Chemical Society","2007","129","","8066","8067","10.1021/ja072003i","","","0.71073","MoKα","","0.1016","0.0692","","","0.1766","0.2083","","","","","","1.096","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109618","12.136","0.0003","12.864","0.0005","13.146","0.0005","89.143","0.001","66.039","0.001","68.073","0.002","1717.02","0.11","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C76 H106 Cr2 N6 -","- C76 H106 Cr2 N6 -","- C76 H106 Cr2 N6 -","1","0.5","","Yi-Chou Tsai; Po-Yang Wang; Shin-An Chen; Jin-Ming Chen","Inverted-Sandwich Dichromium(I) Complexes Supported by Two β-Diketiminates: A Multielectron Reductant and Syntheses of Chromium Dioxo and Imido","Journal of the American Chemical Society","2007","129","","8066","8067","10.1021/ja072003i","","","0.71073","MoKα","","0.1607","0.0943","","","0.2298","0.2728","","","","","","1.083","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109619","17.7158","0.0002","15.384","0.0002","24.9281","0.0004","90","","107.906","0.001","90","","6464.82","0.16","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C65 H90 Cr2 N4 -","- C65 H90 Cr2 N4 -","- C260 H360 Cr8 N16 -","4","1","","Yi-Chou Tsai; Po-Yang Wang; Shin-An Chen; Jin-Ming Chen","Inverted-Sandwich Dichromium(I) Complexes Supported by Two β-Diketiminates: A Multielectron Reductant and Syntheses of Chromium Dioxo and Imido","Journal of the American Chemical Society","2007","129","","8066","8067","10.1021/ja072003i","","","0.71073","MoKα","","0.1093","0.064","","","0.1613","0.1815","","","","","","0.99","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109620","9.982","0.0003","17.5147","0.0006","24.8092","0.0008","99.753","0.002","92.355","0.002","103.755","0.002","4137.1","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C42.5 H46 Cl6 Sb -","- C42.5 H46 Cl6 Sb -","- C170 H184 Cl24 Sb4 -","4","2","","Moloy Banerjee; Sergey V. Lindeman; Rajendra Rathore","Structural Characterization of Quaterphenyl Cation Radical: X-ray Crystallographic Evidence of Quinoidal Charge Delocalization in Poly-p-phenylene Cation Radicals","Journal of the American Chemical Society","2007","129","","8070","8071","10.1021/ja0720356","","","1.54178","CuKα","","0.0308","0.0261","","","0.0648","0.0669","","","","","","1.013","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109621","11.7185","0.0002","11.7394","0.0002","34.3511","0.0005","90","","92.989","0.001","90","","4719.19","0.13","100","2","100","2","","","","","","","","2","C 1 c 1","C -2yc","9","","","","- C32 H34 -","- C32 H34 -","- C256 H272 -","8","2","","Moloy Banerjee; Sergey V. Lindeman; Rajendra Rathore","Structural Characterization of Quaterphenyl Cation Radical: X-ray Crystallographic Evidence of Quinoidal Charge Delocalization in Poly-p-phenylene Cation Radicals","Journal of the American Chemical Society","2007","129","","8070","8071","10.1021/ja0720356","","","1.54178","CuKα","","0.0317","0.0313","","","0.0853","0.0858","","","","","","1.011","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109622","16.526","0.003","19.362","0.004","13.161","0.003","90","","126.411","0.003","90","","3389.1","1.2","200","2","200","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","[(i-Pr2Ph)2nacnacCr]2(N2)","","","- C68 H106 Cr2 N6 -","- C68 H106 Cr2 N6 -","- C136 H212 Cr4 N12 -","2","0.25","","Wesley H. Monillas; Glenn P. A. Yap; Leonard A. MacAdams; Klaus H. Theopold","Binding and Activation of Small Molecules by Three-Coordinate Cr(I)","Journal of the American Chemical Society","2007","129","","8090","8091","10.1021/ja0725549","","","0.71073","MoKα","","0.0649","0.0496","","","0.1287","0.1419","","","","","","1.052","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109623","13.824","0.005","21.1","0.009","21.238","0.008","90","","93.91","0.03","90","","6180","4","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[(i-Pr2Ph)2nacnacCr]2(CO)3","","","- C66 H94 Cr2 N4 O3 -","- C61 H82 Cr2 N4 O3 -","- C244 H328 Cr8 N16 O12 -","4","1","","Wesley H. Monillas; Glenn P. A. Yap; Leonard A. MacAdams; Klaus H. Theopold","Binding and Activation of Small Molecules by Three-Coordinate Cr(I)","Journal of the American Chemical Society","2007","129","","8090","8091","10.1021/ja0725549","","","0.71073","MoKα","","0.0756","0.0485","","","0.0915","0.0975","","","","","","1.016","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109624","8.9247","0.0014","14.565","0.002","21.197","0.003","90","","91.209","0.003","90","","2754.7","0.7","170","2","170","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[(i-Pr2Ph)2nacnacCr]2(C2H4)","","","- C60 H86 Cr2 N4 -","- C60 H86 Cr2 N4 -","- C120 H172 Cr4 N8 -","2","0.5","","Wesley H. Monillas; Glenn P. A. Yap; Leonard A. MacAdams; Klaus H. Theopold","Binding and Activation of Small Molecules by Three-Coordinate Cr(I)","Journal of the American Chemical Society","2007","129","","8090","8091","10.1021/ja0725549","","","0.71073","MoKα","","0.0772","0.0523","","","0.1342","0.1573","","","","","","1.015","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109625","12.6122","0.0003","15.9622","0.0003","14.1845","0.0001","90","","104.439","0.001","90","","2765.4","0.09","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H41 Cr N2 O2 -","- C29 H41 Cr N2 O2 -","- C116 H164 Cr4 N8 O8 -","4","1","","Wesley H. Monillas; Glenn P. A. Yap; Leonard A. MacAdams; Klaus H. Theopold","Binding and Activation of Small Molecules by Three-Coordinate Cr(I)","Journal of the American Chemical Society","2007","129","","8090","8091","10.1021/ja0725549","","","0.71073","MoKα","","0.0965","0.0679","","","0.2418","0.2927","","","","","","1.071","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109626","17.737","0.008","19.148","0.008","23.533","0.008","90","","98.279","0.007","90","","7909","6","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[(i-Pr2Ph)2nacnacCr]2(NPh)2","","","- C77.5 H107 Cr2 N6 O1.5 -","- C70 H92 Cr2 N6 -","- C280 H368 Cr8 N24 -","4","0.5","","Wesley H. Monillas; Glenn P. A. Yap; Leonard A. MacAdams; Klaus H. Theopold","Binding and Activation of Small Molecules by Three-Coordinate Cr(I)","Journal of the American Chemical Society","2007","129","","8090","8091","10.1021/ja0725549","","","0.71073","MoKα","","0.1473","0.0794","","","0.1789","0.1982","","","","","","1.139","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109627","8.77","0.0006","20.3186","0.0013","7.8056","0.0005","90","","110.552","0.001","90","","1302.39","0.15","100","2","100","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C36 H30 -","- C36 H30 -","- C72 H60 -","2","0.5","","Vincent J. Chebny; Rajendra Rathore","Convergent Synthesis of Alternating Fluorene-p-xylene Oligomers and Delineation of the (Silver) Cation-Induced Folding","Journal of the American Chemical Society","2007","129","","8458","8465","10.1021/ja0687522","","","0.71073","MoKα","","0.0454","0.0404","","","0.0974","0.1009","","","","","","1.012","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109628","8.884","0.008","10.569","0.002","18.114","0.002","82.1","0.02","88.22","0.02","84.79","0.01","1677.4","1.6","113.1","","","","","","","","","","","6","P 1","P 1","1","","","","- C44 H46 Cl10 Mn S16 Se8 -","- C44 H46 Cl10 Mn S16 Se8 -","- C44 H46 Cl10 Mn S16 Se8 -","1","1","","Hiroshi Ito; Daichi Suzuki; Harutaka Watanabe; Hisaaki Tanaka; Shin-ichi Kuroda; Masamichi Umemiya; Norihito Kobayashi; Makoto Goto; Ken-ichi Sugiura; Hitoshi Miyasaka; Shinya Takaishi; Takashi Kajiwara; Masahiro Yamashita; Eiji Ohmichi; Toshihito Osada","Metal-Insulator Transition of Charge-Transfer Salts Based on Unsymmetrical Donor DMET and Metal Halide Anions (DMET)4(MCl4)(TCE)2 (M = Mn, Co, Cu, Zn; TCE = 1,1,2-trichloroethane)","Journal of the American Chemical Society","2007","129","","8510","8518","10.1021/ja070672q","","","0.7107","MoKα","","","0.03","","","","0.082","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109629","8.919","0.005","10.512","0.002","17.912","0.002","83.21","0.02","88.43","0.02","84.81","0.01","1660.5","1","113.1","","","","","","","","","","","6","P 1","P 1","1","","","","- C44 H46 Cl10 Cu S16 Se8 -","- C44 H46 Cl10 Cu S16 Se8 -","- C44 H46 Cl10 Cu S16 Se8 -","1","1","","Hiroshi Ito; Daichi Suzuki; Harutaka Watanabe; Hisaaki Tanaka; Shin-ichi Kuroda; Masamichi Umemiya; Norihito Kobayashi; Makoto Goto; Ken-ichi Sugiura; Hitoshi Miyasaka; Shinya Takaishi; Takashi Kajiwara; Masahiro Yamashita; Eiji Ohmichi; Toshihito Osada","Metal-Insulator Transition of Charge-Transfer Salts Based on Unsymmetrical Donor DMET and Metal Halide Anions (DMET)4(MCl4)(TCE)2 (M = Mn, Co, Cu, Zn; TCE = 1,1,2-trichloroethane)","Journal of the American Chemical Society","2007","129","","8510","8518","10.1021/ja070672q","","","0.7107","MoKα","","","0.029","","","","0.08","","","","","","1.016","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109630","8.866","0.002","10.561","0.002","18.086","0.004","82.19","0.02","88.02","0.02","84.76","0.01","1670.3","0.6","113.1","","","","","","","","","","","6","P 1","P 1","1","","","","- C44 H46 Cl10 Co S16 Se8 -","- C44 H46 Cl10 Co S16 Se8 -","- C44 H46 Cl10 Co S16 Se8 -","1","1","","Hiroshi Ito; Daichi Suzuki; Harutaka Watanabe; Hisaaki Tanaka; Shin-ichi Kuroda; Masamichi Umemiya; Norihito Kobayashi; Makoto Goto; Ken-ichi Sugiura; Hitoshi Miyasaka; Shinya Takaishi; Takashi Kajiwara; Masahiro Yamashita; Eiji Ohmichi; Toshihito Osada","Metal-Insulator Transition of Charge-Transfer Salts Based on Unsymmetrical Donor DMET and Metal Halide Anions (DMET)4(MCl4)(TCE)2 (M = Mn, Co, Cu, Zn; TCE = 1,1,2-trichloroethane)","Journal of the American Chemical Society","2007","129","","8510","8518","10.1021/ja070672q","","","0.7107","MoKα","","","0.03","","","","0.083","","","","","","1.016","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109631","8.8579","0.001","10.5377","0.0011","18.06","0.002","82.204","0.003","88.008","0.003","84.742","0.003","1662.7","0.3","113.1","","","","","","","","","","","6","P 1","P 1","1","","","","- C44 H46 Cl10 S16 Se8 Zn -","- C44 H46 Cl10 S16 Se8 Zn -","- C44 H46 Cl10 S16 Se8 Zn -","1","1","","Hiroshi Ito; Daichi Suzuki; Harutaka Watanabe; Hisaaki Tanaka; Shin-ichi Kuroda; Masamichi Umemiya; Norihito Kobayashi; Makoto Goto; Ken-ichi Sugiura; Hitoshi Miyasaka; Shinya Takaishi; Takashi Kajiwara; Masahiro Yamashita; Eiji Ohmichi; Toshihito Osada","Metal-Insulator Transition of Charge-Transfer Salts Based on Unsymmetrical Donor DMET and Metal Halide Anions (DMET)4(MCl4)(TCE)2 (M = Mn, Co, Cu, Zn; TCE = 1,1,2-trichloroethane)","Journal of the American Chemical Society","2007","129","","8510","8518","10.1021/ja070672q","","","0.7107","MoKα","","","0.037","","","","0.106","","","","","","1.043","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109632","19.0403","0.0007","19.0403","0.0007","6.8527","0.0004","90","","90","","90","","2484.33","0.19","293","2","293","2","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","","","- C9 H12 Cu O7 -","- C9 H12 Cu O7 -","- C72 H96 Cu8 O56 -","8","0.5","","Ru-Qiang Zou; Hiroaki Sakurai; Song Han; Rui-Qin Zhong; Qiang Xu","Probing the Lewis Acid Sites and CO Catalytic Oxidation Activity of the Porous Metal-Organic Polymer [Cu(5-methylisophthalate)]","Journal of the American Chemical Society","2007","129","","8402","8403","10.1021/ja071662s","","","0.71069","MoKα","","0.0611","0.0517","","","0.1387","0.147","","","","","","1.084","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109633","8.1827","0.0016","11.172","0.002","12.991","0.003","72.06","0.03","88.64","0.03","75.98","0.03","1094.5","0.5","143","2","143","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H32 N2 O2 -","- C25 H32 N2 O2 -","- C50 H64 N4 O4 -","2","1","","Wonhee Jeong; James L. Hedrick; Robert M. Waymouth","Organic Spirocyclic Initiators for the Ring-Expansion Polymerization of β-Lactones","Journal of the American Chemical Society","2007","129","","8414","8415","10.1021/ja072037q","","","0.71073","MoKα","","0.119","0.0688","","","0.1894","0.2209","","","","","","1.046","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109634","19.7205","0.0003","19.7205","0.0003","22.9816","0.0004","90","","90","","120","","7740.1","0.2","273","2","273","2","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","","","","- C98.67 H99.33 Cd8 S15 -","- C98 Cd8 S17 -","- C294 Cd24 S51 -","3","0.25","","Qichun Zhang; Xianhui Bu; Jian Zhang; Tao Wu; Pingyun Feng","Chiral Semiconductor Frameworks from Cadmium Sulfide Clusters","Journal of the American Chemical Society","2007","129","","8412","8413","10.1021/ja072274t","","","0.71073","MoKα","","0.0788","0.061","","","0.1643","0.1843","","","","","","1.039","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109635","27.919","0.002","27.919","0.002","30.995","0.005","90","","90","","120","","20923","4","273","2","273","2","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","","","","- C182 H182 Cd17 S30 -","- C28 Cd17 S30 -","- C84 Cd51 S90 -","3","0.25","","Qichun Zhang; Xianhui Bu; Jian Zhang; Tao Wu; Pingyun Feng","Chiral Semiconductor Frameworks from Cadmium Sulfide Clusters","Journal of the American Chemical Society","2007","129","","8412","8413","10.1021/ja072274t","","","0.71073","MoKα","","0.1736","0.1516","","","0.4061","0.4248","","","","","","1.944","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109636","62.8179","0.0007","20.1911","0.0002","41.4214","0.0005","90","","127.74","0.001","90","","41546.3","1","273","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C324 H270 Cd33 S60 -","- C366 Cd33 S60 -","- C1464 Cd132 S240 -","4","0.5","","Qichun Zhang; Xianhui Bu; Jian Zhang; Tao Wu; Pingyun Feng","Chiral Semiconductor Frameworks from Cadmium Sulfide Clusters","Journal of the American Chemical Society","2007","129","","8412","8413","10.1021/ja072274t","","","0.71073","MoKα","","0.1207","0.0741","","","0.2138","0.255","","","","","","1.044","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109637","34.1978","0.0003","34.1978","0.0003","45.9516","0.0005","90","","90","","120","","46540.1","0.8","273","2","273","2","","","","","","","","4","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C98.67 H99.33 Cd8 S15 -","- C98.6667 H99.3333 Cd8 S15 -","- C1776 H1788 Cd144 S270 -","18","1.5","","Qichun Zhang; Xianhui Bu; Jian Zhang; Tao Wu; Pingyun Feng","Chiral Semiconductor Frameworks from Cadmium Sulfide Clusters","Journal of the American Chemical Society","2007","129","","8412","8413","10.1021/ja072274t","","","0.71073","MoKα","","0.0828","0.0444","","","0.0987","0.1212","","","","","","1.063","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109638","12.756","0.003","15.622","0.003","18.567","0.004","98.15","0.03","109.09","0.03","93.92","0.03","3435","1.5","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H15 B F16 N4 O6 S2 -","- C29 H15 B F16 N4 O6 S2 -","- C116 H60 B4 F64 N16 O24 S8 -","4","2","","Dragoslav Vidovic; Michael Findlater; Alan H. Cowley","A β-Diketiminate-Supported Boron Dication","Journal of the American Chemical Society","2007","129","","8436","8437","10.1021/ja072865j","","","0.71073","MoKα","","0.2818","0.0777","","","0.178","0.2902","","","","","","0.941","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109639","7.7912","0.0016","13.764","0.003","24.388","0.005","90","","96","0.03","90","","2601","1","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H7 B F16 N2 O6 S2 -","- C19 H7 B F16 N2 O6 S2 -","- C76 H28 B4 F64 N8 O24 S8 -","4","1","","Dragoslav Vidovic; Michael Findlater; Alan H. Cowley","A β-Diketiminate-Supported Boron Dication","Journal of the American Chemical Society","2007","129","","8436","8437","10.1021/ja072865j","","","0.71073","MoKα","","0.1786","0.0671","","","0.1501","0.2174","","","","","","1.018","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109640","10.4084","0.001","13.4073","0.0012","13.5183","0.0012","95.107","0.002","101.913","0.001","105.403","0.001","1758.7","0.3","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H43 Cl4 N4 O13 Pt2 S2 -","- C16 H43 Cl4 N4 O13 Pt2 S2 -","- C32 H86 Cl8 N8 O26 Pt4 S4 -","2","1","","Rodney P. Feazell; Nozomi Nakayama-Ratchford; Hongjie Dai; Stephen J. Lippard","Soluble Single-Walled Carbon Nanotubes as Longboat Delivery Systems for Platinum(IV) Anticancer Drug Design","Journal of the American Chemical Society","2007","129","","8438","8439","10.1021/ja073231f","","","0.71073","MoKα","","0.0657","0.0483","","","0.1241","0.1316","","","","","","0.997","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109641","19.4766","0.001","11.8014","0.0005","9.9226","0.0006","90","","90","","90","","2280.7","0.2","200","","","","","","","","","","","7","P b a n :2","-P 2ab 2b","50","","","","- C40 H44 B2 Cu2 F8 N8 O8 -","- C40 H44 B2 Cu2 F8 N8 O8 -","- C80 H88 B4 Cu4 F16 N16 O16 -","2","0.25","","Marie Hutin; Christopher J. Cramer; Laura Gagliardi; Abdul Rehaman Moughal Shahi; Gérald Bernardinelli; Radovan Cerny; Jonathan R. Nitschke","Self-Sorting Chiral Subcomponent Rearrangement During Crystallization","Journal of the American Chemical Society","2007","129","","8774","8780","10.1021/ja070320j","","","0.71073","MoKα","","","0.037","","","","0.037","","","","","","1.84","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109642","10.076","0.006","15.656","0.007","7.341","0.003","90","","111.081","0.007","90","","1080.5","0.9","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H13 N O2 S -","- C11 H13 N O2 S -","- C44 H52 N4 O8 S4 -","4","1","","Bani Kanta Sarma; Govindasamy Mugesh","Redox Regulation of Protein Tyrosine Phosphatase 1B (PTP1B): A Biomimetic Study on the Unexpected Formation of a Sulfenyl Amide Intermediate","Journal of the American Chemical Society","2007","129","","8872","8881","10.1021/ja070410o","","","0.71073","MoKα","","0.0623","0.0588","","","0.1814","0.1871","","","","","","0.796","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109643","9.4859","0.0014","9.7695","0.0015","10.9072","0.0017","90.233","0.002","112.003","0.002","117.918","0.002","808","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H20 N2 O3 S -","- C16 H20 N2 O3 S -","- C32 H40 N4 O6 S2 -","2","1","","Bani Kanta Sarma; Govindasamy Mugesh","Redox Regulation of Protein Tyrosine Phosphatase 1B (PTP1B): A Biomimetic Study on the Unexpected Formation of a Sulfenyl Amide Intermediate","Journal of the American Chemical Society","2007","129","","8872","8881","10.1021/ja070410o","","","0.71073","MoKα","","0.0466","0.0381","","","0.1131","0.1203","","","","","","0.931","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109644","14.756","0.003","12.877","0.003","21.175","0.004","90","","105.42","0.03","90","","3878.7","1.5","124","2","124","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H57 N P2 Si Ti -","- C37 H57 N P2 Si Ti -","- C148 H228 N4 P8 Si4 Ti4 -","4","1","","Brad C. Bailey; Hongjun Fan; John C. Huffman; Mu-Hyun Baik; Daniel J. Mindiola","Intermolecular C-H Bond Activation Reactions Promoted by Transient Titanium Alkylidynes. Synthesis, Reactivity, Kinetic, and Theoretical Studies of the Ti\τbC Linkage","Journal of the American Chemical Society","2007","129","","8781","8793","10.1021/ja070989q","","","0.71073","MoKα","","0.0861","0.0366","","","0.0785","0.0906","","","","","","0.84","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109645","10.2211","0.0008","13.1095","0.0011","15.5962","0.0013","71.05","0.002","81.016","0.002","81.334","0.002","1941.1","0.3","128","2","128","2","","","","","","","","5","P -1","-P 1","2","","","","- C41.5 H57 N P2 Ti -","- C41.48 H56.952 N P2 Ti -","- C82.96 H113.904 N2 P4 Ti2 -","2","1","","Brad C. Bailey; Hongjun Fan; John C. Huffman; Mu-Hyun Baik; Daniel J. Mindiola","Intermolecular C-H Bond Activation Reactions Promoted by Transient Titanium Alkylidynes. Synthesis, Reactivity, Kinetic, and Theoretical Studies of the Ti\τbC Linkage","Journal of the American Chemical Society","2007","129","","8781","8793","10.1021/ja070989q","","","0.71073","MoKα","","0.0581","0.0395","","","0.0939","0.1017","","","","","","0.931","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4109646","18.246","0.004","10.605","0.002","20.861","0.004","90","","115.05","0.004","90","","3656.9","1.3","119","2","119","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H54 F N P2 Ti -","- C37 H54 F N P2 Ti -","- C148 H216 F4 N4 P8 Ti4 -","4","1","","Brad C. Bailey; Hongjun Fan; John C. Huffman; Mu-Hyun Baik; Daniel J. Mindiola","Intermolecular C-H Bond Activation Reactions Promoted by Transient Titanium Alkylidynes. Synthesis, Reactivity, Kinetic, and Theoretical Studies of the Ti\τbC Linkage","Journal of the American Chemical Society","2007","129","","8781","8793","10.1021/ja070989q","","","0.71073","MoKα","","0.0804","0.0706","","","0.1321","0.1357","","","","","","1.334","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109647","18.394","0.006","10.618","0.003","21.012","0.005","90","","115.348","0.012","90","","3708.7","1.9","125","2","125","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H53 F2 N P2 Ti -","- C37 H53 F2 N P2 Ti -","- C148 H212 F8 N4 P8 Ti4 -","4","1","","Brad C. Bailey; Hongjun Fan; John C. Huffman; Mu-Hyun Baik; Daniel J. Mindiola","Intermolecular C-H Bond Activation Reactions Promoted by Transient Titanium Alkylidynes. Synthesis, Reactivity, Kinetic, and Theoretical Studies of the Ti\τbC Linkage","Journal of the American Chemical Society","2007","129","","8781","8793","10.1021/ja070989q","","","0.71073","MoKα","","0.0538","0.0331","","","0.0785","0.0889","","","","","","0.965","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109648","9.8171","0.0006","11.5483","0.0007","17.3755","0.0011","107.337","0.002","100.478","0.002","100.705","0.002","1787.59","0.19","121","2","121","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H53 F2 N P2 Ti -","- C37 H53 F2 N P2 Ti -","- C74 H106 F4 N2 P4 Ti2 -","2","1","","Brad C. Bailey; Hongjun Fan; John C. Huffman; Mu-Hyun Baik; Daniel J. Mindiola","Intermolecular C-H Bond Activation Reactions Promoted by Transient Titanium Alkylidynes. Synthesis, Reactivity, Kinetic, and Theoretical Studies of the Ti\τbC Linkage","Journal of the American Chemical Society","2007","129","","8781","8793","10.1021/ja070989q","","","0.71073","MoKα","","0.0469","0.0324","","","0.081","0.0873","","","","","","0.971","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109649","12.0708","0.0015","12.3733","0.0015","16.301","0.002","86.114","0.003","81.525","0.003","86.766","0.003","2399.9","0.5","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H73 N O2 P2 Si4 Ti -","- C38 H73 N O2 P2 Si4 Ti -","- C76 H146 N2 O4 P4 Si8 Ti2 -","2","1","","Brad C. Bailey; Hongjun Fan; John C. Huffman; Mu-Hyun Baik; Daniel J. Mindiola","Intermolecular C-H Bond Activation Reactions Promoted by Transient Titanium Alkylidynes. Synthesis, Reactivity, Kinetic, and Theoretical Studies of the Ti\τbC Linkage","Journal of the American Chemical Society","2007","129","","8781","8793","10.1021/ja070989q","","","0.71073","MoKα","","0.0476","0.0332","","","0.0854","0.0917","","","","","","0.968","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109650","19.8779","0.0018","12.7806","0.0013","16.4494","0.0017","90","","112.072","0.003","90","","3872.7","0.7","128","2","128","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H43 F10 N P2 Ti -","- C40 H43 F10 N P2 Ti -","- C160 H172 F40 N4 P8 Ti4 -","4","1","","Brad C. Bailey; Hongjun Fan; John C. Huffman; Mu-Hyun Baik; Daniel J. Mindiola","Intermolecular C-H Bond Activation Reactions Promoted by Transient Titanium Alkylidynes. Synthesis, Reactivity, Kinetic, and Theoretical Studies of the Ti\τbC Linkage","Journal of the American Chemical Society","2007","129","","8781","8793","10.1021/ja070989q","","","0.71073","MoKα","","0.086","0.0398","","","0.0718","0.0811","","","","","","0.739","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109651","11.545","0.003","29.626","0.007","12.883","0.003","90","","94.026","0.007","90","","4395.5","1.9","130","2","130","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C35 H65 F3 N3 O3 Os P2 S Si2 -","- C35 H65 F3 N3 O3 Os P2 S Si2 -","- C140 H260 F12 N12 O12 Os4 P8 S4 Si8 -","4","1","","Joo-Ho Lee; Maren Pink; John Tomaszewski; Hongjun Fan; Kenneth G. Caulton","Facile Hydrogenation of N2O by an Operationally Unsaturated Osmium Polyhydride","Journal of the American Chemical Society","2007","129","","8706","8707","10.1021/ja071452f","","","0.71073","MoKα","","0.099","0.0593","","","0.1559","0.2142","","","","","","1.161","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109652","11.4598","0.0013","14.7501","0.0016","19.338","0.002","95.346","0.002","93.168","0.002","91.184","0.002","3248.5","0.6","193","2","193","2","","","","","","","","4","P -1","-P 1","2","jonag01","Ni(dippe)(PhCCPh), 1","","- C33.5 H51.5 P2 Pt -","- C33.5 H51.5 P2 Pt -","- C134 H206 P8 Pt4 -","4","2","","Ahmet Gunay; William D. Jones","Cleavage of Carbon-Carbon Bonds of Diphenylacetylene and Its Derivatives via Photolysis of Pt Complexes: Tuning the C-C Bond Formation Energy toward Selective C-C Bond Activation","Journal of the American Chemical Society","2007","129","","8729","8735","10.1021/ja071698k","","","0.71073","MoKα","","0.0893","0.0409","","","0.0504","0.0582","","","","","","0.98","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109653","11.295","0.0007","14.0515","0.0009","19.2277","0.0012","90","","90","","90","","3051.7","0.3","100","0.1","100","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","jonag04","Ni(dippe)(Ph)(CCPh), 2","","- C32 H50 P2 Pt -","- C32 H50 P2 Pt -","- C128 H200 P8 Pt4 -","4","1","","Ahmet Gunay; William D. Jones","Cleavage of Carbon-Carbon Bonds of Diphenylacetylene and Its Derivatives via Photolysis of Pt Complexes: Tuning the C-C Bond Formation Energy toward Selective C-C Bond Activation","Journal of the American Chemical Society","2007","129","","8729","8735","10.1021/ja071698k","","","0.71073","MoKα","","0.0137","0.0136","","","0.0343","0.0343","","","","","","1.071","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109654","11.5387","0.0006","30.3901","0.0014","21.5616","0.001","90","","103.6","0.001","90","","7348.8","0.6","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","jonag09","Ni(dippe)(xyly-lCC-xylyl), 3","","- C37.25 H61 P2 Pt -","- C37.25 H61 P2 Pt -","- C298 H488 P16 Pt8 -","8","2","","Ahmet Gunay; William D. Jones","Cleavage of Carbon-Carbon Bonds of Diphenylacetylene and Its Derivatives via Photolysis of Pt Complexes: Tuning the C-C Bond Formation Energy toward Selective C-C Bond Activation","Journal of the American Chemical Society","2007","129","","8729","8735","10.1021/ja071698k","","","0.71073","MoKα","","0.0631","0.0352","","","0.0649","0.0718","","","","","","1.023","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109655","18.761","0.003","8.497","0.0011","21.895","0.003","90","","90","","90","","3490.3","0.9","150","0.1","150","0.1","","","","","","","","4","P c a 21","P 2c -2ac","29","jonag16","Ni(dippe)(xylyl)(CCxylyl), 4","","- C36 H58 P2 Pt -","- C36 H58 P2 Pt -","- C144 H232 P8 Pt4 -","4","1","","Ahmet Gunay; William D. Jones","Cleavage of Carbon-Carbon Bonds of Diphenylacetylene and Its Derivatives via Photolysis of Pt Complexes: Tuning the C-C Bond Formation Energy toward Selective C-C Bond Activation","Journal of the American Chemical Society","2007","129","","8729","8735","10.1021/ja071698k","","","0.71073","MoKα","","0.0585","0.0461","","","0.1063","0.1104","","","","","","1.063","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109656","11.5771","0.0011","15.9774","0.0016","17.4246","0.0017","87.828","0.002","79.322","0.002","86.895","0.002","3161.3","0.5","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","jonag11","Ni(dippe)(C6H4F-CC-C6H4F), 5","","- C32 H48 F2 P2 Pt -","- C32 H48 F2 P2 Pt -","- C128 H192 F8 P8 Pt4 -","4","2","","Ahmet Gunay; William D. Jones","Cleavage of Carbon-Carbon Bonds of Diphenylacetylene and Its Derivatives via Photolysis of Pt Complexes: Tuning the C-C Bond Formation Energy toward Selective C-C Bond Activation","Journal of the American Chemical Society","2007","129","","8729","8735","10.1021/ja071698k","","","0.71073","MoKα","","0.0206","0.0187","","","0.0481","0.0494","","","","","","1.043","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109657","11.165","0.003","16.904","0.004","17.303","0.004","83.378","0.004","79.094","0.004","80.893","0.004","3153.9","1.3","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","jonag18","Ni(dippe)(C6H4F)(CCC6H4F), 6","","- C32 H48 F2 P2 Pt -","- C32 H48 F2 P2 Pt -","- C128 H192 F8 P8 Pt4 -","4","2","","Ahmet Gunay; William D. Jones","Cleavage of Carbon-Carbon Bonds of Diphenylacetylene and Its Derivatives via Photolysis of Pt Complexes: Tuning the C-C Bond Formation Energy toward Selective C-C Bond Activation","Journal of the American Chemical Society","2007","129","","8729","8735","10.1021/ja071698k","","","0.71073","MoKα","","0.0999","0.0524","","","0.0867","0.094","","","","","","0.988","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109658","14.704","0.0004","20.8268","0.0004","11.4067","0.0002","90","","107.311","0.001","90","","3334.93","0.13","150","0.1","150","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","jonag15","Ni(dippe)(C6F5-CC-C6F5) , 7","","- C32 H40 F10 P2 Pt -","- C32 H40 F10 P2 Pt -","- C128 H160 F40 P8 Pt4 -","4","0.5","","Ahmet Gunay; William D. Jones","Cleavage of Carbon-Carbon Bonds of Diphenylacetylene and Its Derivatives via Photolysis of Pt Complexes: Tuning the C-C Bond Formation Energy toward Selective C-C Bond Activation","Journal of the American Chemical Society","2007","129","","8729","8735","10.1021/ja071698k","","","0.71073","MoKα","","0.0289","0.0287","","","0.0713","0.0714","","","","","","1.043","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109659","13.7736","0.0004","11.3542","0.0003","21.5728","0.0006","90","","104.269","0.001","90","","3269.65","0.16","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","jonag06","Ni(dippe)(C6F5)(-CC-C6F5), 8","","- C32 H40 F10 P2 Pt -","- C32 H40 F10 P2 Pt -","- C128 H160 F40 P8 Pt4 -","4","1","","Ahmet Gunay; William D. Jones","Cleavage of Carbon-Carbon Bonds of Diphenylacetylene and Its Derivatives via Photolysis of Pt Complexes: Tuning the C-C Bond Formation Energy toward Selective C-C Bond Activation","Journal of the American Chemical Society","2007","129","","8729","8735","10.1021/ja071698k","","","0.71073","MoKα","","0.0152","0.0135","","","0.0323","0.0328","","","","","","1.037","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109660","31.7594","0.0016","18.1394","0.0009","16.7047","0.0008","90","","95.896","0.001","90","","9572.6","0.8","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","jonag14","Ni(dippe)(C6H4F-CC-C6H4Me) , 9","","- C33 H51 F P2 Pt -","- C33 H51 F P2 Pt -","- C396 H612 F12 P24 Pt12 -","12","3","","Ahmet Gunay; William D. Jones","Cleavage of Carbon-Carbon Bonds of Diphenylacetylene and Its Derivatives via Photolysis of Pt Complexes: Tuning the C-C Bond Formation Energy toward Selective C-C Bond Activation","Journal of the American Chemical Society","2007","129","","8729","8735","10.1021/ja071698k","","","0.71073","MoKα","","0.0826","0.0472","","","0.1052","0.1161","","","","","","1.028","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109661","44.003","0.003","9.1458","0.0007","16.5713","0.0013","90","","106.285","0.001","90","","6401.4","0.8","150","0.1","150","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","jonag17","Ni(dippe)(C6H4Me)(-CC-C6H4F), 11","","- C33 H51 F P2 Pt -","- C33 H51 F P2 Pt -","- C264 H408 F8 P16 Pt8 -","8","1","","Ahmet Gunay; William D. Jones","Cleavage of Carbon-Carbon Bonds of Diphenylacetylene and Its Derivatives via Photolysis of Pt Complexes: Tuning the C-C Bond Formation Energy toward Selective C-C Bond Activation","Journal of the American Chemical Society","2007","129","","8729","8735","10.1021/ja071698k","","","0.71073","MoKα","","0.1089","0.051","","","0.092","0.1058","","","","","","1.015","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109662","11.18","0.002","12.7666","0.0012","14.9496","0.0008","82.42","0.006","76.793","0.009","81.588","0.012","2044.2","0.4","","","110","","","","","","","","","7","P -1","-P 1","2","","","","- C44 H22 B Cu F20 N4 O -","- C44 H22 B Cu F20 N4 O -","- C88 H44 B2 Cu2 F40 N8 O2 -","2","1","","Debabrata Maiti; Julia S. Woertink; Michael A. Vance; Ashley E. Milligan; Amy A. Narducci Sarjeant; Edward I. Solomon; Kenneth D. Karlin","Copper(I)/S8 Reversible Reactions Leading to an End-On Bound Dicopper(II) Disulfide Complex: Nucleophilic Reactivity and Analogies to Copper-Dioxygen Chemistry","Journal of the American Chemical Society","2007","129","","8882","8892","10.1021/ja071968z","","","0.71073","MoKα","","0.0683","0.0464","","","0.1214","0.1352","","","","","","1.034","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109663","11.5209","0.0012","18.2716","0.0018","20.591","0.002","90","","98.764","0.009","90","","4283.9","0.7","110","","110","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C44 H22 B Br Cu F20 N4 O -","- C44 H22 B Br Cu F20 N4 O -","- C176 H88 B4 Br4 Cu4 F80 N16 O4 -","4","1","","Debabrata Maiti; Julia S. Woertink; Michael A. Vance; Ashley E. Milligan; Amy A. Narducci Sarjeant; Edward I. Solomon; Kenneth D. Karlin","Copper(I)/S8 Reversible Reactions Leading to an End-On Bound Dicopper(II) Disulfide Complex: Nucleophilic Reactivity and Analogies to Copper-Dioxygen Chemistry","Journal of the American Chemical Society","2007","129","","8882","8892","10.1021/ja071968z","","","0.71073","MoKα","","0.1185","0.0822","","","0.112","0.1261","","","","","","1.203","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109664","11.431","0.0015","18.2","0.002","20.593","0.003","90","","99.343","0.011","90","","4227.4","1","110","","110","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C44 H22 B Cl Cu F20 N4 O -","- C44 H22 B Cl Cu F20 N4 O -","- C176 H88 B4 Cl4 Cu4 F80 N16 O4 -","4","1","","Debabrata Maiti; Julia S. Woertink; Michael A. Vance; Ashley E. Milligan; Amy A. Narducci Sarjeant; Edward I. Solomon; Kenneth D. Karlin","Copper(I)/S8 Reversible Reactions Leading to an End-On Bound Dicopper(II) Disulfide Complex: Nucleophilic Reactivity and Analogies to Copper-Dioxygen Chemistry","Journal of the American Chemical Society","2007","129","","8882","8892","10.1021/ja071968z","","","0.71073","MoKα","","0.1096","0.0499","","","0.0903","0.1098","","","","","","0.962","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109665","18.323","0.002","18.073","0.002","17.688","0.002","90","","93.657","0.002","90","","5845.5","1.1","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C61.25 H81.5 B Cl0.5 N2 Os P2 -","- C61.255 H81 B Cl0.5 N2 Os P2 -","- C245.02 H324 B4 Cl2 N8 Os4 P8 -","4","1","","Tamara Bolaño; Ricardo Castarlenas; Miguel A. Esteruelas; Enrique Oñate","Sequential and Selective Hydrogenation of the Cα-Cβ and M-Cα Double Bonds of an Allenylidene Ligand Coordinated to Osmium: New Reaction Patterns between an Allenylidene Complex and Alcohols","Journal of the American Chemical Society","2007","129","","8850","8859","10.1021/ja071972a","","","0.71073","MoKα","","0.1134","0.0668","","","0.1518","0.1735","","","","","","1.043","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109666","14.6813","0.0019","13.9813","0.0017","21.656","0.003","90","","90.816","0.002","90","","4444.7","1","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C43 H67 B F4 N O1.5 Os P2 -","- C43 H67 B F4 N O1.5 Os P2 -","- C172 H268 B4 F16 N4 O6 Os4 P8 -","4","1","","Tamara Bolaño; Ricardo Castarlenas; Miguel A. Esteruelas; Enrique Oñate","Sequential and Selective Hydrogenation of the Cα-Cβ and M-Cα Double Bonds of an Allenylidene Ligand Coordinated to Osmium: New Reaction Patterns between an Allenylidene Complex and Alcohols","Journal of the American Chemical Society","2007","129","","8850","8859","10.1021/ja071972a","","","0.71073","MoKα","","0.0748","0.0453","","","0.0684","0.0753","","","","","","0.884","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109667","7.2836","0.0002","16.2898","0.0004","35.9526","0.0009","90","","91.434","0.002","90","","4264.38","0.19","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H50 N6 O19 S3 -","- C28 H46 N6 O19 S3 -","- C112 H184 N24 O76 S12 -","4","1","","Victor W. Day; Md. Alamgir Hossain; Sung Ok Kang; Douglas Powell; Gerald Lushington; Kristin Bowman-James","Encircled Proton","Journal of the American Chemical Society","2007","129","","8692","8693","10.1021/ja0724745","","","0.71073","MoKα","","0.097","0.0764","","","0.1986","0.2103","","","","","","1.064","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109668","10.2885","0.0003","28.3264","0.0009","18.4643","0.0006","90","","94.224","0.002","90","","5366.5","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H84 Cr2 Li4 O8 -","- C56 H84 Cr2 Li4 O8 -","- C224 H336 Cr8 Li16 O32 -","4","1","","Holger Braunschweig; Thomas Kupfer; Matthias Lutz; Krzysztof Radacki","Ansa [1]Trochrocenophanes and Their Related Unstrained 1,1'-Disubstituted Counterparts: Synthesis and Electronic Structure","Journal of the American Chemical Society","2007","129","","8893","8906","10.1021/ja0724947","","","0.71073","MoKα","","0.0765","0.0675","","","0.1837","0.2253","","","","","","1.15","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4109669","6.4925","0.0003","9.8498","0.0004","15.5959","0.0007","104.538","0.002","99.734","0.002","93.165","0.002","946.52","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H28 B Cr N Si2 -","- C18 H28 B Cr N Si2 -","- C36 H56 B2 Cr2 N2 Si4 -","2","1","","Holger Braunschweig; Thomas Kupfer; Matthias Lutz; Krzysztof Radacki","Ansa [1]Trochrocenophanes and Their Related Unstrained 1,1'-Disubstituted Counterparts: Synthesis and Electronic Structure","Journal of the American Chemical Society","2007","129","","8893","8906","10.1021/ja0724947","","","0.71073","MoKα","","0.058","0.0417","","","0.1018","0.1099","","","","","","1.085","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109670","10.8739","0.0002","14.2066","0.0003","16.5281","0.0004","90","","99.753","0.001","90","","2516.38","0.09","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C24 H38 B2 Cl2 Cr N2 -","- C24 H38 B2 Cl2 Cr N2 -","- C96 H152 B8 Cl8 Cr4 N8 -","4","2","","Holger Braunschweig; Thomas Kupfer; Matthias Lutz; Krzysztof Radacki","Ansa [1]Trochrocenophanes and Their Related Unstrained 1,1'-Disubstituted Counterparts: Synthesis and Electronic Structure","Journal of the American Chemical Society","2007","129","","8893","8906","10.1021/ja0724947","","","0.71073","MoKα","","0.0302","0.0286","","","0.0703","0.0709","","","","","","1.091","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109671","10.905","0.0006","7.8237","0.0005","14.4488","0.0008","90","","92.614","0.003","90","","1231.45","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 Cr Ge -","- C14 H16 Cr Ge -","- C56 H64 Cr4 Ge4 -","4","1","","Holger Braunschweig; Thomas Kupfer; Matthias Lutz; Krzysztof Radacki","Ansa [1]Trochrocenophanes and Their Related Unstrained 1,1'-Disubstituted Counterparts: Synthesis and Electronic Structure","Journal of the American Chemical Society","2007","129","","8893","8906","10.1021/ja0724947","","","0.71073","MoKα","","0.0402","0.0338","","","0.0791","0.0818","","","","","","1.118","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109672","10.7402","0.0008","7.7821","0.0006","15.8286","0.0011","90","","97.715","0.004","90","","1311","0.17","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C18 H16 Cr -","- C18 H16 Cr -","- C72 H64 Cr4 -","4","2","","Holger Braunschweig; Thomas Kupfer; Matthias Lutz; Krzysztof Radacki","Ansa [1]Trochrocenophanes and Their Related Unstrained 1,1'-Disubstituted Counterparts: Synthesis and Electronic Structure","Journal of the American Chemical Society","2007","129","","8893","8906","10.1021/ja0724947","","","0.71073","MoKα","","0.0336","0.0314","","","0.0854","0.0879","","","","","","1.134","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109673","10.2779","0.0006","12.5838","0.0007","18.0772","0.001","84.103","0.004","84.059","0.005","68.424","0.005","2157.2","0.2","110","","110","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C45 H81 B P2 Ru -","- C45 H81 B P2 Ru -","- C90 H162 B2 P4 Ru2 -","2","1","","Gilles Alcaraz; Eric Clot; Ulrike Helmstedt; Laure Vendier; Sylviane Sabo-Etienne","Mesitylborane as a Bis(σ-B-H) Ligand: An Unprecedented Bonding Mode to a Metal Center","Journal of the American Chemical Society","2007","129","","8704","8705","10.1021/ja0733538","","","","MoKα","","0.0829","0.0408","","","0.0823","0.0946","","","","","","0.96","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109674","9.846","0.0004","25.7081","0.0013","15.1519","0.0006","90","","91.535","0.002","90","","3833.9","0.3","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C34 H30 B2 Cl4 Co F4 N6 O4 -","- C34 H30 B2 Cl4 Co F4 N6 O4 -","- C136 H120 B8 Cl16 Co4 F16 N24 O16 -","4","0.5","","Xile Hu; Bruce S. Brunschwig; Jonas C. Peters","Electrocatalytic Hydrogen Evolution at Low Overpotentials by Cobalt Macrocyclic Glyoxime and Tetraimine Complexes","Journal of the American Chemical Society","2007","129","","8988","8998","10.1021/ja067876b","","","0.71073","MoKα","","0.1344","0.0619","","","0.0901","0.1009","","","","","","1.316","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109675","12.444","0.002","14.709","0.003","29.884","0.006","90","","93.319","0.005","90","","5460.8","1.8","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C40.44 H47.33 B1.6 Co0.8 F3.2 N4.6 Na0.8 O10.21 -","- C40.4384 H45.8096 B1.6 Co0.8 F3.2 N4.6032 Na0.8 O10.208 -","- C202.192 H229.048 B8 Co4 F16 N23.016 Na4 O51.04 -","5","1.25","","Xile Hu; Bruce S. Brunschwig; Jonas C. Peters","Electrocatalytic Hydrogen Evolution at Low Overpotentials by Cobalt Macrocyclic Glyoxime and Tetraimine Complexes","Journal of the American Chemical Society","2007","129","","8988","8998","10.1021/ja067876b","","","0.71073","MoKα","","0.1016","0.0554","","","0.1489","0.1727","","","","","","1.042","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109676","17.4769","0.0019","17.0447","0.0018","17.628","0.002","90","","113.106","0.012","90","","4829.9","1","293","2","293","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C47 H43 Cl6 N2 Ni O2 Sb -","- C47 H43 Cl6 N2 Ni O2 Sb -","- C188 H172 Cl24 N8 Ni4 O8 Sb4 -","4","0.5","","Dieter Meinhard; Marcus Wegner; Georgy Kipiani; Andrew Hearley; Peter Reuter; Stefan Fischer; Othmar Marti; Bernhard Rieger","New Nickel(II) Diimine Complexes and the Control of Polyethylene Microstructure by Catalyst Design","Journal of the American Chemical Society","2007","129","","9182","9191","10.1021/ja070224i","","","0.71073","MoKα","","0.0789","0.052","","","0.1371","0.1481","","","","","","1.052","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109677","12.1837","0.0013","28.421","0.003","26.328","0.003","90","","99.123","0.014","90","","9001.4","1.7","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Gosha - Name","","","- C85 H71 B F20 N2 Ni O2 -","- C85 H71 B F20 N2 Ni O2 -","- C340 H284 B4 F80 N8 Ni4 O8 -","4","1","","Dieter Meinhard; Marcus Wegner; Georgy Kipiani; Andrew Hearley; Peter Reuter; Stefan Fischer; Othmar Marti; Bernhard Rieger","New Nickel(II) Diimine Complexes and the Control of Polyethylene Microstructure by Catalyst Design","Journal of the American Chemical Society","2007","129","","9182","9191","10.1021/ja070224i","","","0.71073","MoKα","","0.1378","0.0788","","","0.2282","0.2601","","","","","","1.033","","","","has coordinates","209531","2020-10-21","18:00:00",""
"4109678","13.518","0.003","14.663","0.003","16.499","0.003","92.87","0.03","90.92","0.03","94.06","0.03","3257.4","1.2","293","2","293","2","","","","","","","","8","P 1","P 1","1","","","","- C70 H33 B Cl2 F28 N2 Ni O2 -","- C70 H33 B Cl2 F28 N2 Ni O2 -","- C140 H66 B2 Cl4 F56 N4 Ni2 O4 -","2","2","","Dieter Meinhard; Marcus Wegner; Georgy Kipiani; Andrew Hearley; Peter Reuter; Stefan Fischer; Othmar Marti; Bernhard Rieger","New Nickel(II) Diimine Complexes and the Control of Polyethylene Microstructure by Catalyst Design","Journal of the American Chemical Society","2007","129","","9182","9191","10.1021/ja070224i","","","0.71073","MoKα","","0.1031","0.0379","","","0.0593","0.0722","","","","","","0.777","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109679","11.8808","0.0013","14.4953","0.0014","17.514","0.002","88.999","0.013","80.451","0.013","78.963","0.012","2919.1","0.6","223","2","223","2","","","","","","","","7","P -1","-P 1","2","Add Name","","","- C54 H57 Cl8 N2 Ni O2 Sb -","- C54 H57 Cl8 N2 Ni O2 Sb -","- C108 H114 Cl16 N4 Ni2 O4 Sb2 -","2","1","","Dieter Meinhard; Marcus Wegner; Georgy Kipiani; Andrew Hearley; Peter Reuter; Stefan Fischer; Othmar Marti; Bernhard Rieger","New Nickel(II) Diimine Complexes and the Control of Polyethylene Microstructure by Catalyst Design","Journal of the American Chemical Society","2007","129","","9182","9191","10.1021/ja070224i","","","0.71073","MoKα","","0.0716","0.0377","","","0.0844","0.0936","","","","","","0.785","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109680","7.4025","0.0012","11.353","0.0018","11.4856","0.0018","105.207","0.003","96.995","0.003","94.425","0.003","918.5","0.3","93","2","93","2","","","","","","","","6","P -1","-P 1","2","SSZ-35/C11H24N","","","- C11 H24 F N O32 Si16 -","- C11 H24 F N O32 Si16 -","- C11 H24 F N O32 Si16 -","1","0.5","","Stacey I. Zones; Allen W. Burton; Greg S. Lee; Marilyn M. Olmstead","A Study of Piperidinium Structure-Directing Agents in the Synthesis of Silica Molecular Sieves under Fluoride-Based Conditions","Journal of the American Chemical Society","2007","129","","9066","9079","10.1021/ja0709122","","","0.71073","MoKα","","0.0562","0.0405","","","0.0952","0.1001","","","","","","0.583","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109681","15.5818","0.0017","13.1046","0.0015","9.34","0.001","90","","90","","90","","1907.2","0.4","153","2","153","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C17 H19 Cl N O7 P -","- C17 H19 Cl N O7 P -","- C68 H76 Cl4 N4 O28 P4 -","4","0.5","","Bradley O. Ashburn; Rich G. Carter; Lev N. Zakharov","Synthesis of Tetra-ortho-substituted, Phosphorus-Containing and Carbonyl-Containing Biaryls Utilizing a Diels-Alder Approach","Journal of the American Chemical Society","2007","129","","9109","9116","10.1021/ja071163r","","","0.71073","MoKα","","0.091","0.072","","","0.1978","0.2173","","","","","","1.088","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109682","10.1113","0.0004","10.0065","0.0004","27.0271","0.0011","90","","93.783","0.001","90","","2728.61","0.19","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H25 Br N O5 P -","- C32 H25 Br N O5 P -","- C128 H100 Br4 N4 O20 P4 -","4","1","","Bradley O. Ashburn; Rich G. Carter; Lev N. Zakharov","Synthesis of Tetra-ortho-substituted, Phosphorus-Containing and Carbonyl-Containing Biaryls Utilizing a Diels-Alder Approach","Journal of the American Chemical Society","2007","129","","9109","9116","10.1021/ja071163r","","","0.71073","MoKα","","0.0481","0.0361","","","0.0905","0.0962","","","","","","1.032","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109683","10.0387","0.0006","12.4249","0.0008","14.4052","0.0009","95.172","0.001","108.764","0.001","112.644","0.001","1522.32","0.17","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H37 Br N O5 P -","- C32 H37 Br N O5 P -","- C64 H74 Br2 N2 O10 P2 -","2","1","","Bradley O. Ashburn; Rich G. Carter; Lev N. Zakharov","Synthesis of Tetra-ortho-substituted, Phosphorus-Containing and Carbonyl-Containing Biaryls Utilizing a Diels-Alder Approach","Journal of the American Chemical Society","2007","129","","9109","9116","10.1021/ja071163r","","","0.71073","MoKα","","0.1115","0.0539","","","0.118","0.1397","","","","","","1.015","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109684","27.0204","0.0014","13.7732","0.0007","18.9387","0.001","90","","108.597","0.001","90","","6680.2","0.6","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H46 N O4 P -","- C39 H46 N O4 P -","- C312 H368 N8 O32 P8 -","8","1","","Bradley O. Ashburn; Rich G. Carter; Lev N. Zakharov","Synthesis of Tetra-ortho-substituted, Phosphorus-Containing and Carbonyl-Containing Biaryls Utilizing a Diels-Alder Approach","Journal of the American Chemical Society","2007","129","","9109","9116","10.1021/ja071163r","","","0.71073","MoKα","","0.0566","0.0448","","","0.1101","0.1194","","","","","","1.024","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109685","11.473","0.0009","8.8646","0.0007","36.722","0.003","90","","93.992","0.001","90","","3725.7","0.5","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C43 H53 N O5 P -","- C40 H46 N O5 P -","- C160 H184 N4 O20 P4 -","4","1","","Bradley O. Ashburn; Rich G. Carter; Lev N. Zakharov","Synthesis of Tetra-ortho-substituted, Phosphorus-Containing and Carbonyl-Containing Biaryls Utilizing a Diels-Alder Approach","Journal of the American Chemical Society","2007","129","","9109","9116","10.1021/ja071163r","","","0.71073","MoKα","","0.0669","0.0559","","","0.1378","0.1439","","","","","","1.081","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109686","24.6647","0.0012","19.1622","0.0009","16.6761","0.0008","90","","90","","90","","7881.6","0.7","153","2","153","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C42 H45 F5 N O7 P -","- C38 H37 F5 N O5 P -","- C304 H296 F40 N8 O40 P8 -","8","1","","Bradley O. Ashburn; Rich G. Carter; Lev N. Zakharov","Synthesis of Tetra-ortho-substituted, Phosphorus-Containing and Carbonyl-Containing Biaryls Utilizing a Diels-Alder Approach","Journal of the American Chemical Society","2007","129","","9109","9116","10.1021/ja071163r","","","0.71073","MoKα","","0.0605","0.0429","","","0.107","0.1149","","","","","","1.055","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109687","13.837","0.003","17.027","0.004","19.476","0.004","74.472","0.004","77.403","0.004","80.086","0.004","4283","1.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H53 Cl N O2 P -","- C42 H53 Cl N O2 P -","- C168 H212 Cl4 N4 O8 P4 -","4","2","","Bradley O. Ashburn; Rich G. Carter; Lev N. Zakharov","Synthesis of Tetra-ortho-substituted, Phosphorus-Containing and Carbonyl-Containing Biaryls Utilizing a Diels-Alder Approach","Journal of the American Chemical Society","2007","129","","9109","9116","10.1021/ja071163r","","","0.71073","MoKα","","0.0912","0.0652","","","0.1651","0.1775","","","","","","1.052","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109688","17.8051","0.0019","7.8616","0.0009","11.3272","0.0012","90","","100.09","0.002","90","","1561","0.3","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 Br N O5 -","- C16 H14 Br N O5 -","- C64 H56 Br4 N4 O20 -","4","1","","Bradley O. Ashburn; Rich G. Carter; Lev N. Zakharov","Synthesis of Tetra-ortho-substituted, Phosphorus-Containing and Carbonyl-Containing Biaryls Utilizing a Diels-Alder Approach","Journal of the American Chemical Society","2007","129","","9109","9116","10.1021/ja071163r","","","0.71073","MoKα","","0.0504","0.0409","","","0.0953","0.0983","","","","","","1.153","","","","has coordinates,has disorder","178842","2020-10-21","18:00:00",""
"4109689","10.5941","0.0013","10.6543","0.0013","11.8832","0.0015","96.817","0.002","116.02","0.002","104.097","0.002","1129.2","0.2","123","2","123","2","","","","","","","","5","P 1","P 1","1","","","","- C24 H19 Br N2 O6 -","- C24 H19 Br N2 O6 -","- C48 H38 Br2 N4 O12 -","2","2","","Bradley O. Ashburn; Rich G. Carter; Lev N. Zakharov","Synthesis of Tetra-ortho-substituted, Phosphorus-Containing and Carbonyl-Containing Biaryls Utilizing a Diels-Alder Approach","Journal of the American Chemical Society","2007","129","","9109","9116","10.1021/ja071163r","","","0.71073","MoKα","","0.0415","0.0347","","","0.0767","0.0789","","","","","","0.981","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109690","9.788","0.002","9.0708","0.0018","14.037","0.003","90","","100.856","0.003","90","","1224","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 Br N O2 -","- C14 H10 Br N O2 -","- C56 H40 Br4 N4 O8 -","4","1","","Bradley O. Ashburn; Rich G. Carter; Lev N. Zakharov","Synthesis of Tetra-ortho-substituted, Phosphorus-Containing and Carbonyl-Containing Biaryls Utilizing a Diels-Alder Approach","Journal of the American Chemical Society","2007","129","","9109","9116","10.1021/ja071163r","","","0.71073","MoKα","","0.0427","0.0386","","","0.1016","0.1039","","","","","","1.043","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109691","10.2444","0.0014","32.499","0.004","6.9136","0.0007","90","","90","","90","","2301.8","0.5","150","","150","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C21 H34 O4 S Si -","- C21 H34 O4 S Si -","- C84 H136 O16 S4 Si4 -","4","1","","Ahmad El-Awa; Xavier Mollat du Jourdin; Philip L. Fuchs","Asymmetric Synthesis of All Eight Seven-Carbon Dipropionate Stereotetrads","Journal of the American Chemical Society","2007","129","","9086","9093","10.1021/ja071217x","","","0.71073","MO-Kα","","0.119","0.063","","","0.125","0.151","","","","","","1.054","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109692","6.7613","0.0008","11.2542","0.0017","15.2264","0.001","90","","93.112","0.006","90","","1156.9","0.2","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H34 O4 S Si -","- C21 H34 O4 S Si -","- C42 H68 O8 S2 Si2 -","2","1","","Ahmad El-Awa; Xavier Mollat du Jourdin; Philip L. Fuchs","Asymmetric Synthesis of All Eight Seven-Carbon Dipropionate Stereotetrads","Journal of the American Chemical Society","2007","129","","9086","9093","10.1021/ja071217x","","","0.71073","MO-Kα","","0.101","0.049","","","0.098","0.122","","","","","","0.971","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109693","6.6816","0.0005","7.5785","0.0007","25.49","0.002","87.798","0.005","86.717","0.006","64.962","0.005","1167.37","0.17","150","","150","","","","","","","","","5","P 1","P 1","1","","","","- C21 H34 O4 S Si -","- C21 H34 O4 S Si -","- C42 H68 O8 S2 Si2 -","2","2","","Ahmad El-Awa; Xavier Mollat du Jourdin; Philip L. Fuchs","Asymmetric Synthesis of All Eight Seven-Carbon Dipropionate Stereotetrads","Journal of the American Chemical Society","2007","129","","9086","9093","10.1021/ja071217x","","","0.71073","MO-Kα","","0.085","0.072","","","0.19","0.203","","","","","","1.047","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109694","6.9589","0.0005","9.7764","0.0007","16.7107","0.0013","90","","90.564","0.003","90","","1136.82","0.15","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H34 O4 S Si -","- C21 H34 O4 S Si -","- C42 H68 O8 S2 Si2 -","2","1","","Ahmad El-Awa; Xavier Mollat du Jourdin; Philip L. Fuchs","Asymmetric Synthesis of All Eight Seven-Carbon Dipropionate Stereotetrads","Journal of the American Chemical Society","2007","129","","9086","9093","10.1021/ja071217x","","","0.71073","MO-Kα","","0.088","0.076","","","0.132","0.138","","","","","","1.233","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109695","12.3332","0.0007","6.8353","0.0005","15.6695","0.0011","90","","100.822","0.005","90","","1297.46","0.15","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H36 O5 S Si -","- C23 H36 O5 S Si -","- C46 H72 O10 S2 Si2 -","2","1","","Ahmad El-Awa; Xavier Mollat du Jourdin; Philip L. Fuchs","Asymmetric Synthesis of All Eight Seven-Carbon Dipropionate Stereotetrads","Journal of the American Chemical Society","2007","129","","9086","9093","10.1021/ja071217x","","","0.71073","MO-Kα","","0.058","0.04","","","0.087","0.096","","","","","","1.011","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109696","11.3503","0.0009","15.1148","0.0012","18.0032","0.0014","87.766","0.002","72.397","0.002","87.527","0.002","2940.1","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H50 N10 O12 Zn2 -","- C68 H50 N10 O12 Zn2 -","- C136 H100 N20 O24 Zn4 -","2","1","","Gregory J. McManus; John J. Perry; Mark Perry; Brian D. Wagner; Michael J. Zaworotko","Exciplex Fluorescence as a Diagnostic Probe of Structure in Coordination Polymers of Zn2+and 4,4'-Bipyridine Containing Intercalated Pyrene and Enclathrated Aromatic Solvent Guests","Journal of the American Chemical Society","2007","129","","9094","9101","10.1021/ja071271d","","","0.71073","MoKα","","0.0628","0.0435","","","0.0956","0.1058","","","","","","1.029","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109697","11.3895","0.0011","15.1659","0.0014","17.8768","0.0016","88.365","0.002","73.96","0.002","87.75","0.002","2964.9","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C69 H44 N10 O12 Zn2 -","- C68.99 H44 N10 O12 Zn2 -","- C137.98 H88 N20 O24 Zn4 -","2","1","","Gregory J. McManus; John J. Perry; Mark Perry; Brian D. Wagner; Michael J. Zaworotko","Exciplex Fluorescence as a Diagnostic Probe of Structure in Coordination Polymers of Zn2+and 4,4'-Bipyridine Containing Intercalated Pyrene and Enclathrated Aromatic Solvent Guests","Journal of the American Chemical Society","2007","129","","9094","9101","10.1021/ja071271d","","","0.71073","MoKα","","0.0975","0.0657","","","0.1732","0.1962","","","","","","0.906","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109698","11.3718","0.0009","15.1633","0.0012","17.9472","0.0015","88.393","0.002","73.215","0.001","87.949","0.002","2960.5","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C70 H54 N10 O12 Zn2 -","- C70 H54 N10 O12 Zn2 -","- C140 H108 N20 O24 Zn4 -","2","1","","Gregory J. McManus; John J. Perry; Mark Perry; Brian D. Wagner; Michael J. Zaworotko","Exciplex Fluorescence as a Diagnostic Probe of Structure in Coordination Polymers of Zn2+and 4,4'-Bipyridine Containing Intercalated Pyrene and Enclathrated Aromatic Solvent Guests","Journal of the American Chemical Society","2007","129","","9094","9101","10.1021/ja071271d","","","0.71073","MoKα","","0.0574","0.0418","","","0.1034","0.1134","","","","","","0.975","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109699","11.3364","0.0012","15.1363","0.0016","18.0214","0.0019","87.884","0.002","72.04","0.002","88.328","0.002","2939.1","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H49 Cl N10 O12 Zn2 -","- C68 H49 Cl N10 O12 Zn2 -","- C136 H98 Cl2 N20 O24 Zn4 -","2","1","","Gregory J. McManus; John J. Perry; Mark Perry; Brian D. Wagner; Michael J. Zaworotko","Exciplex Fluorescence as a Diagnostic Probe of Structure in Coordination Polymers of Zn2+and 4,4'-Bipyridine Containing Intercalated Pyrene and Enclathrated Aromatic Solvent Guests","Journal of the American Chemical Society","2007","129","","9094","9101","10.1021/ja071271d","","","0.71073","MoKα","","0.0456","0.0386","","","0.0987","0.1033","","","","","","1.043","","","","has coordinates","178842","2020-10-21","18:00:00",""
"4109700","16.5243","0.0017","11.4671","0.0011","22.731","0.002","90","","99.12","0.002","90","","4252.8","0.7","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H34 Cl4 N6 O6 Zn -","- C48 H34 Cl4 N6 O6 Zn -","- C192 H136 Cl16 N24 O24 Zn4 -","4","0.5","","Gregory J. McManus; John J. Perry; Mark Perry; Brian D. Wagner; Michael J. Zaworotko","Exciplex Fluorescence as a Diagnostic Probe of Structure in Coordination Polymers of Zn2+and 4,4'-Bipyridine Containing Intercalated Pyrene and Enclathrated Aromatic Solvent Guests","Journal of the American Chemical Society","2007","129","","9094","9101","10.1021/ja071271d","","","0.71073","MoKα","","0.0374","0.0338","","","0.094","0.0969","","","","","","0.806","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109701","19.352","0.003","9.5462","0.0016","25.387","0.004","90","","90.593","0.002","90","","4689.7","1.3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H28 N4 O5 -","- C24 H28 N4 O5 -","- C192 H224 N32 O40 -","8","1","","Benjamin C. Gorske; Brent L. Bastian; Grant D. Geske; Helen E. Blackwell","Local and Tunable n\ρightarrowπ* Interactions Regulate Amide Isomerism in the Peptoid Backbone","Journal of the American Chemical Society","2007","129","","8928","8929","10.1021/ja071310l","","","0.71073","Mo-Kα","","0.0543","0.0379","","","0.0994","0.1099","","","","","","1.035","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109702","8.496","0.003","20.619","0.007","8.291","0.003","90","","102.946","0.005","90","","1415.5","0.9","296","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C12 H22 F3 O P -","- C12 H22 F3 O P -","- C48 H88 F12 O4 P4 -","4","1","","Alex S. Ionkin; William J. Marshall; Brian M. Fish; Matthew F. Schiffhauer; Fredric Davidson","A Stabilized β-Oxaphosphoniumbetaine: An Elusive Zwitterion","Journal of the American Chemical Society","2007","129","","9210","9215","10.1021/ja071644a","","","0.71073","MoKα","","0.0586","0.052","","","0.1326","0.1413","","","","","","1.087","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109703","30.271","0.004","9.6309","0.0011","14.2728","0.0017","90","","106.203","0.003","90","","3995.8","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H55 F12 I O3 P2 -","- C30 H47 F12 I O3 P2 -","- C120 H188 F48 I4 O12 P8 -","4","0.5","","Alex S. Ionkin; William J. Marshall; Brian M. Fish; Matthew F. Schiffhauer; Fredric Davidson","A Stabilized β-Oxaphosphoniumbetaine: An Elusive Zwitterion","Journal of the American Chemical Society","2007","129","","9210","9215","10.1021/ja071644a","","","0.71069","MoKα","","0.0505","0.0401","","","0.1288","0.1349","","","","","","1.078","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109704","17.242","0.003","13.711","0.002","17.917","0.003","90","","117.952","0.002","90","","3741.5","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H24 F6 I O P -","- C13 H24 F6 I O P -","- C104 H192 F48 I8 O8 P8 -","8","2","","Alex S. Ionkin; William J. Marshall; Brian M. Fish; Matthew F. Schiffhauer; Fredric Davidson","A Stabilized β-Oxaphosphoniumbetaine: An Elusive Zwitterion","Journal of the American Chemical Society","2007","129","","9210","9215","10.1021/ja071644a","","","0.71073","MoKα","","0.052","0.0354","","","0.0746","0.0825","","","","","","1.041","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109705","31.237","0.009","50.033","0.014","9.128","0.003","90","","90","","90","","14266","7","293","2","293","2","","","","","","","","7","C c c 2","C 2 -2c","37","","","","- C11 H19 F6 I N O P -","- C11.635 H16 F6 I N0.5 O P -","- C372.32 H512 F192 I32 N16 O32 P32 -","32","4","","Alex S. Ionkin; William J. Marshall; Brian M. Fish; Matthew F. Schiffhauer; Fredric Davidson","A Stabilized β-Oxaphosphoniumbetaine: An Elusive Zwitterion","Journal of the American Chemical Society","2007","129","","9210","9215","10.1021/ja071644a","","","0.71073","MoKα","","0.0685","0.0418","","","0.1191","0.1395","","","","","","1.001","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109706","8.693","0.002","23.126","0.006","9.831","0.003","90","","114.995","0.005","90","","1791.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H27 F6 O2 P -","- C14 H27 F6 O2 P -","- C56 H108 F24 O8 P4 -","4","1","","Alex S. Ionkin; William J. Marshall; Brian M. Fish; Matthew F. Schiffhauer; Fredric Davidson","A Stabilized β-Oxaphosphoniumbetaine: An Elusive Zwitterion","Journal of the American Chemical Society","2007","129","","9210","9215","10.1021/ja071644a","","","0.71073","MoKα","","0.0663","0.0403","","","0.0945","0.1063","","","","","","1.035","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109707","5.553","0.003","17.278","0.01","19.305","0.012","81.686","0.007","82.767","0.007","80.819","0.007","1799.2","1.8","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","","","- C46 H52 N2 -","- C46 H52 N2 -","- C92 H104 N4 -","2","1","","Pierre-Luc T. Boudreault; Salem Wakim; Nicolas Blouin; Michel Simard; Christian Tessier; Ye Tao; Mario Leclerc","Synthesis, Characterization, and Application of Indolo[3,2-b]carbazole Semiconductors","Journal of the American Chemical Society","2007","129","","9125","9136","10.1021/ja071923y","","","0.71073","MoKα","","0.2202","0.087","","","0.1876","0.2235","","","","","","0.872","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109708","15.2682","0.0009","5.2745","0.0003","17.6381","0.001","90","","96.92","0.001","90","","1410.09","0.14","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C34 H44 N2 -","- C34 H44 N2 -","- C68 H88 N4 -","2","0.5","","Pierre-Luc T. Boudreault; Salem Wakim; Nicolas Blouin; Michel Simard; Christian Tessier; Ye Tao; Mario Leclerc","Synthesis, Characterization, and Application of Indolo[3,2-b]carbazole Semiconductors","Journal of the American Chemical Society","2007","129","","9125","9136","10.1021/ja071923y","","","0.71073","MoKα","","0.0441","0.0375","","","0.1172","0.1229","","","","","","1.634","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109709","20.2822","0.0016","20.4888","0.0016","22.2315","0.0018","63.813","0.001","87.3","0.001","62.565","0.001","7214.9","1","200","2","200","2","","","","","","","","3","P -1","-P 1","2","5,11-bis(p-octylphenyl)indolocarbazole","","","- C46 H52 N2 -","- C46 H52 N2 -","- C368 H416 N16 -","8","4","","Pierre-Luc T. Boudreault; Salem Wakim; Nicolas Blouin; Michel Simard; Christian Tessier; Ye Tao; Mario Leclerc","Synthesis, Characterization, and Application of Indolo[3,2-b]carbazole Semiconductors","Journal of the American Chemical Society","2007","129","","9125","9136","10.1021/ja071923y","","","0.71073","MoKα","","0.2102","0.0657","","","0.1303","0.1901","","","","","","0.945","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109710","10.0608","0.0002","14.1458","0.0003","11.202","0.0002","90","","98.249","0.001","90","","1577.75","0.05","220","2","220","2","","","","","","","Synthesized by the authors. See text","3","P 1 21/n 1","-P 2yn","14","","","","- C42 H44 N2 -","- C42 H44 N2 -","- C84 H88 N4 -","2","0.5","","Pierre-Luc T. Boudreault; Salem Wakim; Nicolas Blouin; Michel Simard; Christian Tessier; Ye Tao; Mario Leclerc","Synthesis, Characterization, and Application of Indolo[3,2-b]carbazole Semiconductors","Journal of the American Chemical Society","2007","129","","9125","9136","10.1021/ja071923y","","","1.54178","CuKα","","0.0436","0.0428","","","0.1135","0.1143","","","","","","1.041","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109711","17.9131","0.001","9.5697","0.0006","18.8066","0.0011","90","","95.011","0.003","90","","3211.6","0.3","220","2","220","2","","","","","","","Synthesized by the authors. See text","4","P 1 21/n 1","-P 2yn","14","","","","- C38 H40 N2 S2 -","- C38 H40 N2 S2 -","- C152 H160 N8 S8 -","4","1","","Pierre-Luc T. Boudreault; Salem Wakim; Nicolas Blouin; Michel Simard; Christian Tessier; Ye Tao; Mario Leclerc","Synthesis, Characterization, and Application of Indolo[3,2-b]carbazole Semiconductors","Journal of the American Chemical Society","2007","129","","9125","9136","10.1021/ja071923y","","","1.54178","CuKα","","0.0687","0.0472","","","0.1261","0.1366","","","","","","0.998","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109712","10.3511","0.0002","17.6271","0.0003","21.9274","0.0004","108.129","0.002","103.637","0.001","90.219","0.001","3682.15","0.13","200","2","200","2","","","","","","","Synthesized by the authors. See text","3","P -1","-P 1","2","","","","- C46 H52 N2 -","- C46 H52 N2 -","- C184 H208 N8 -","4","2","","Pierre-Luc T. Boudreault; Salem Wakim; Nicolas Blouin; Michel Simard; Christian Tessier; Ye Tao; Mario Leclerc","Synthesis, Characterization, and Application of Indolo[3,2-b]carbazole Semiconductors","Journal of the American Chemical Society","2007","129","","9125","9136","10.1021/ja071923y","","","1.54178","CuKα","","0.0872","0.0736","","","0.2188","0.2284","","","","","","1.021","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109713","14.0429","0.0005","18.2532","0.0006","29.4389","0.0009","88.593","0.001","79.918","0.001","72.778","0.001","7093.4","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H47 F6 N O8 P -","- C32 H47 F6 N O8 P -","- C256 H376 F48 N8 O64 P8 -","8","4","","Erin N. Guidry; Jean Li; J. Fraser Stoddart; Robert H. Grubbs","Bifunctional [c2]Daisy-Chains and Their Incorporation into Mechanically Interlocked Polymers","Journal of the American Chemical Society","2007","129","","8944","8945","10.1021/ja0725100","","","0.71073","MoKα","","0.181","0.1327","","","0.3472","0.376","","","","","","2.495","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4109714","11.647","0.005","10.623","0.004","21.468","0.008","90","","99.2218","0.0015","90","","2621.8","1.8","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 N O5 P Pd S -","- C28 H30 N O5 P Pd S -","- C112 H120 N4 O20 P4 Pd4 S4 -","4","1","","Takuya Kochi; Shusuke Noda; Kenji Yoshimura; Kyoko Nozaki","Formation of Linear Copolymers of Ethylene and Acrylonitrile Catalyzed by Phosphine Sulfonate Palladium Complexes","Journal of the American Chemical Society","2007","129","","8948","8949","10.1021/ja0725504","","","0.7107","MoKα","","0.045","0.038","","","0.0886","0.0933","","","","","","1.106","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109715","8.4588","0.0017","14.389","0.003","21.438","0.004","90","","90","","90","","2609.3","0.9","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H50 Li2 N4 -","- C22 H50 Li2 N4 -","- C88 H200 Li8 N16 -","4","1","","Carsten Strohmann; Viktoria H. Gessner","Crystal Structures of the Chiral Diamine (R,R)-TMCDA with the Commonly Used Alkyllithium Bases Methyllithium, iso-Propyllithium, and sec-Butyllithium","Journal of the American Chemical Society","2007","129","","8952","8953","10.1021/ja072970t","","","0.71073","MoKα","","0.1029","0.0567","","","0.1258","0.1428","","","","","","1.037","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109716","9.1739","0.0014","28.015","0.007","11.8908","0.0019","90","","104.154","0.018","90","","2963.2","1","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H58 Li2 N4 -","- C26 H58 Li2 N4 -","- C104 H232 Li8 N16 -","4","2","","Carsten Strohmann; Viktoria H. Gessner","Crystal Structures of the Chiral Diamine (R,R)-TMCDA with the Commonly Used Alkyllithium Bases Methyllithium, iso-Propyllithium, and sec-Butyllithium","Journal of the American Chemical Society","2007","129","","8952","8953","10.1021/ja072970t","","","0.71073","MoKα","","0.0891","0.0522","","","0.0996","0.1093","","","","","","1.053","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109717","7.9625","0.0014","13.777","0.003","14.599","0.003","90","","90","","90","","1601.5","0.6","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H31 Li N2 -","- C14 H31 Li N2 -","- C56 H124 Li4 N8 -","4","1","","Carsten Strohmann; Viktoria H. Gessner","Crystal Structures of the Chiral Diamine (R,R)-TMCDA with the Commonly Used Alkyllithium Bases Methyllithium, iso-Propyllithium, and sec-Butyllithium","Journal of the American Chemical Society","2007","129","","8952","8953","10.1021/ja072970t","","","0.71073","MoKα","","0.0958","0.0514","","","0.0917","0.101","","","","","","1.072","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109718","30.55","0.02","11.514","0.008","10.562","0.007","90","","97.58","0.013","90","","3683","4","173","2","173","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C25 H57 B11 Na O8 -","- C25 H51 B11 Na O8 -","- C100 H204 B44 Na4 O32 -","4","0.5","","Xiaodu Fu; Hoi-Shan Chan; Zuowei Xie","Synthesis and Crystal Structure of a 13-Vertex Carborane Radical Anion with 2n+ 3 Framework Electrons","Journal of the American Chemical Society","2007","129","","8964","8965","10.1021/ja073390z","","","0.71073","MoKα","","0.1213","0.0881","","","0.2227","0.248","","","","","","1.093","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109719","3.3935","0.001","4.3687","0.001","11.9851","0.001","90","","90","","90","","177.68","0.07","293","2","293","2","","","","","","","see text","3","I m m m","-I 2 2","71","","","","- C4 Co Sc3 -","- C4 Co Sc3 -","- C8 Co2 Sc6 -","2","0.125","","Benjamin Rohrmoser; Georg Eickerling; Manuel Presnitz; Wolfgang Scherer; Volker Eyert; Rolf-Dieter Hoffmann; Ute Ch. Rodewald; Christian Vogt; Rainer Pöttgen","Experimental Electron Density of the Complex Carbides Sc3[Fe(C2)2] and Sc3[Co(C2)2]","Journal of the American Chemical Society","2007","129","","9356","9365","10.1021/ja068137y","","","0.71073","MoKa","","0.0214","0.0122","","","","0.0081","","","","","","1.1971","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109720","3.3689","0.001","4.3818","0.001","12.0959","0.001","90","","90","","90","","178.56","0.07","293","2","293","2","","","","","","","see text","3","I m m m","-I 2 2","71","","","","- C4 Fe Sc3 -","- C4 Fe Sc3 -","- C8 Fe2 Sc6 -","2","0.125","","Benjamin Rohrmoser; Georg Eickerling; Manuel Presnitz; Wolfgang Scherer; Volker Eyert; Rolf-Dieter Hoffmann; Ute Ch. Rodewald; Christian Vogt; Rainer Pöttgen","Experimental Electron Density of the Complex Carbides Sc3[Fe(C2)2] and Sc3[Co(C2)2]","Journal of the American Chemical Society","2007","129","","9356","9365","10.1021/ja068137y","","","0.71073","MoKa","","0.0299","0.0155","","","","0.0133","","","","","","1.1083","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109721","38.937","0.003","48","0.004","9.5196","0.0007","90","","90","","90","","17792","2","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C94 H98 Mn N10 O28 Rh2 -","- C94 H98 Mn N10 O28 Rh2 -","- C752 H784 Mn8 N80 O224 Rh16 -","8","0.5","","Elena Cariati; Roberto Macchi; Dominique Roberto; Renato Ugo; Simona Galli; Nicola Casati; Piero Macchi; Angelo Sironi; Lapo Bogani; Andrea Caneschi; Dante Gatteschi","Polyfunctional Inorganic-Organic Hybrid Materials: An Unusual Kind of NLO Active Layered Mixed Metal Oxalates with Tunable Magnetic Properties and Very Large Second Harmonic Generation","Journal of the American Chemical Society","2007","129","","9410","9420","10.1021/ja0710712","","","0.71069","MoKα","","0.0703","0.0468","","","0.1106","0.1274","","","","","","1.067","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109722","39.406","0.003","48.573","0.004","9.4673","0.0008","90","","90","","90","","18121","3","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C94 H98 Fe2 Mn N10 O28 -","- C94 H98 Fe2 Mn N10 O28 -","- C752 H784 Fe16 Mn8 N80 O224 -","8","0.5","","Elena Cariati; Roberto Macchi; Dominique Roberto; Renato Ugo; Simona Galli; Nicola Casati; Piero Macchi; Angelo Sironi; Lapo Bogani; Andrea Caneschi; Dante Gatteschi","Polyfunctional Inorganic-Organic Hybrid Materials: An Unusual Kind of NLO Active Layered Mixed Metal Oxalates with Tunable Magnetic Properties and Very Large Second Harmonic Generation","Journal of the American Chemical Society","2007","129","","9410","9420","10.1021/ja0710712","","","0.71073","MoKα","","0.0849","0.0507","","","0.1212","0.1441","","","","","","1.046","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109723","39.299","0.002","48.612","0.003","9.4962","0.0006","90","","90","","90","","18141.6","1.8","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C94 H98 Cr2 Mn N10 O28 -","- C94 H98 Cr2 Mn N10 O28 -","- C752 H784 Cr16 Mn8 N80 O224 -","8","0.5","","Elena Cariati; Roberto Macchi; Dominique Roberto; Renato Ugo; Simona Galli; Nicola Casati; Piero Macchi; Angelo Sironi; Lapo Bogani; Andrea Caneschi; Dante Gatteschi","Polyfunctional Inorganic-Organic Hybrid Materials: An Unusual Kind of NLO Active Layered Mixed Metal Oxalates with Tunable Magnetic Properties and Very Large Second Harmonic Generation","Journal of the American Chemical Society","2007","129","","9410","9420","10.1021/ja0710712","","","0.71073","MoKα","","0.2281","0.0864","","","0.2069","0.2838","","","","","","0.969","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109724","14.418","0.0006","15.4727","0.0006","20.7604","0.0008","101.139","0.001","96.411","0.001","100.493","0.001","4416","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C86 H53.5 I2 N10 O18 Rh -","- C86 H94.8 I2 N10 O18 Rh -","- C172 H189.6 I4 N20 O36 Rh2 -","2","1","","Elena Cariati; Roberto Macchi; Dominique Roberto; Renato Ugo; Simona Galli; Nicola Casati; Piero Macchi; Angelo Sironi; Lapo Bogani; Andrea Caneschi; Dante Gatteschi","Polyfunctional Inorganic-Organic Hybrid Materials: An Unusual Kind of NLO Active Layered Mixed Metal Oxalates with Tunable Magnetic Properties and Very Large Second Harmonic Generation","Journal of the American Chemical Society","2007","129","","9410","9420","10.1021/ja0710712","","","0.71073","MoKα","","0.0544","0.041","","","0.1188","0.1356","","","","","","1.047","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109725","15.8893","0.001","17.5285","0.0011","27.2474","0.0017","86.985","0.001","78.083","0.001","72.737","0.001","7090.5","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C111 H157.6 Gd2 Mn11 N15 O58.4 -","- C87 H121.6 Gd2 Mn11 N3 O58.4 -","- C174 H243.2 Gd4 Mn22 N6 O116.8 -","2","1","","Valeriu M. Mereacre; Ayuk M. Ako; Rodolphe Clérac; Wolfgang Wernsdorfer; George Filoti; Juan Bartolomé; Christopher E. Anson; Annie K. Powell","A Bell-Shaped Mn11Gd2 Single-Molecule Magnet","Journal of the American Chemical Society","2007","129","","9248","9249","10.1021/ja071073m","","","0.71073","MoKα","","0.0719","0.0409","","","0.0857","0.0907","","","","","","0.992","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109726","10.4849","0.0018","11.872","0.002","18.977","0.004","89.715","0.014","80.764","0.012","67.58","0.016","2151.2","0.7","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C52 H48 Ni P4 -","- C52 H48 Ni P4 -","- C104 H96 Ni2 P8 -","2","1","","Nathan A. Eckert; William G. Dougherty; Glenn P. A. Yap; Charles G. Riordan","Methyl Transfer from Methylcobaloxime to (Triphos)Ni(PPh3): Relevance to the Mechanism of Acetyl Coenzyme A Synthase","Journal of the American Chemical Society","2007","129","","9286","9287","10.1021/ja072063o","","","0.71073","MoKα","","0.0849","0.0565","","","0.1178","0.1337","","","","","","1.024","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109727","17.25","0.004","9.099","0.003","38.847","0.008","90","","97.928","0.017","90","","6039","3","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H33 Ni O P3 -","- C35 H33 Ni O P3 -","- C280 H264 Ni8 O8 P24 -","8","1","","Nathan A. Eckert; William G. Dougherty; Glenn P. A. Yap; Charles G. Riordan","Methyl Transfer from Methylcobaloxime to (Triphos)Ni(PPh3): Relevance to the Mechanism of Acetyl Coenzyme A Synthase","Journal of the American Chemical Society","2007","129","","9286","9287","10.1021/ja072063o","","","0.71073","MoKα","","0.0857","0.0522","","","0.0989","0.1121","","","","","","1.014","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109728","12.34","0.005","12.599","0.005","13.255","0.005","112.424","0.004","102.063","0.005","104.137","0.005","1739.2","1.2","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H36 F3 Ni O3 P3 S -","- C36 H36 F3 Ni O3 P3 S -","- C72 H72 F6 Ni2 O6 P6 S2 -","2","1","","Nathan A. Eckert; William G. Dougherty; Glenn P. A. Yap; Charles G. Riordan","Methyl Transfer from Methylcobaloxime to (Triphos)Ni(PPh3): Relevance to the Mechanism of Acetyl Coenzyme A Synthase","Journal of the American Chemical Society","2007","129","","9286","9287","10.1021/ja072063o","","","0.71073","MoKα","","0.1687","0.0781","","","0.138","0.183","","","","","","1.029","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109729","12.986","0.005","14.978","0.006","23.15","0.01","90","","93.82","0.02","90","","4493","3","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H30 Cl Mn3 N6 O14 -","- C27 H30 Cl Mn3 N6 O14 -","- C108 H120 Cl4 Mn12 N24 O56 -","4","1","","Theocharis C. Stamatatos; Dolos Foguet-Albiol; Sheng-Chiang Lee; Constantinos C. Stoumpos; Catherine P. Raptopoulou; Aris Terzis; Wolfgang Wernsdorfer; Stephen O. Hill; Spyros P. Perlepes; George Christou","""Switching On"" the Properties of Single-Molecule Magnetism in Triangular Manganese(III) Complexes","Journal of the American Chemical Society","2007","129","","9484","9499","10.1021/ja072194p","","","0.71073","MoKα","","0.0701","0.0556","","","0.1515","0.1606","","","","","","1.052","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109730","12.988","0.005","15.111","0.006","23.74","0.01","90","","94.82","0.01","90","","4643","3","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H36 Cl Mn3 N6 O14 -","- C30 H36 Cl Mn3 N6 O14 -","- C120 H144 Cl4 Mn12 N24 O56 -","4","1","","Theocharis C. Stamatatos; Dolos Foguet-Albiol; Sheng-Chiang Lee; Constantinos C. Stoumpos; Catherine P. Raptopoulou; Aris Terzis; Wolfgang Wernsdorfer; Stephen O. Hill; Spyros P. Perlepes; George Christou","""Switching On"" the Properties of Single-Molecule Magnetism in Triangular Manganese(III) Complexes","Journal of the American Chemical Society","2007","129","","9484","9499","10.1021/ja072194p","","","0.71073","MoKα","","0.0769","0.0606","","","0.1654","0.1765","","","","","","1.065","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109731","19.7","0.009","10.746","0.005","28.614","0.014","90","","107.53","0.02","90","","5776","5","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H36 Cl Mn3 N6 O14 -","- C42 H36 Cl Mn3 N6 O14 -","- C168 H144 Cl4 Mn12 N24 O56 -","4","1","","Theocharis C. Stamatatos; Dolos Foguet-Albiol; Sheng-Chiang Lee; Constantinos C. Stoumpos; Catherine P. Raptopoulou; Aris Terzis; Wolfgang Wernsdorfer; Stephen O. Hill; Spyros P. Perlepes; George Christou","""Switching On"" the Properties of Single-Molecule Magnetism in Triangular Manganese(III) Complexes","Journal of the American Chemical Society","2007","129","","9484","9499","10.1021/ja072194p","","","1.5418","CuKα","","0.0722","0.0563","","","0.147","0.1559","","","","","","1.007","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109732","18.869","0.002","18.869","0.002","23.021","0.004","90","","90","","90","","8196.4","1.9","223","2","223","2","","","","","","","","5","I 41/a :2","-I 4ad","88","Ta-dimer","","","- C36 H64 Cl2 N6 Ta2 -","- C36 H64 Cl2 N6 Ta2 -","- C288 H512 Cl16 N48 Ta16 -","8","0.5","","Masakazu Hirotsu; Philip P. Fontaine; Albert Epshteyn; Lawrence R. Sita","Dinitrogen Activation at Ambient Temperatures: New Modes of H2 and PhSiH3 Additions for an ""End-On-Bridged"" [Ta(IV)]2(μ-η1:η1-N2) Complex and for the Bis(μ-nitrido) [Ta(V)(μ-N)]2 Product Derived from Facile N\τbN Bond Cleavage","Journal of the American Chemical Society","2007","129","","9284","9285","10.1021/ja072248v","","","0.71073","MoKα","","0.0563","0.031","","","0.0638","0.0893","","","","","","1","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109733","9.5286","0.0009","10.4229","0.001","11.4967","0.0011","106.169","0.002","99.013","0.002","112.78","0.001","964.95","0.16","220","2","220","2","","","","","","","","4","P -1","-P 1","2","Ta-N=N-Ta","","","- C36 H64 N6 Ta2 -","- C36 H64 N6 Ta2 -","- C36 H64 N6 Ta2 -","1","0.5","","Masakazu Hirotsu; Philip P. Fontaine; Albert Epshteyn; Lawrence R. Sita","Dinitrogen Activation at Ambient Temperatures: New Modes of H2 and PhSiH3 Additions for an ""End-On-Bridged"" [Ta(IV)]2(μ-η1:η1-N2) Complex and for the Bis(μ-nitrido) [Ta(V)(μ-N)]2 Product Derived from Facile N\τbN Bond Cleavage","Journal of the American Chemical Society","2007","129","","9284","9285","10.1021/ja072248v","","","0.71073","MoKα","","0.0207","0.0176","","","0.0418","0.0432","","","","","","1","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109734","11.8563","0.0008","18.9391","0.0012","18.9815","0.0012","112.382","0.001","90.926","0.001","102.882","0.001","3817.7","0.4","220","2","220","2","","","","","","","","4","P -1","-P 1","2","Dizirconium-dinitrogen yellow complex","Dizirconium-dinitrogen yellow complex","","- C36 H64 N6 Ta2 -","- C36 H64 N6 Ta2 -","- C144 H256 N24 Ta8 -","4","2","","Masakazu Hirotsu; Philip P. Fontaine; Albert Epshteyn; Lawrence R. Sita","Dinitrogen Activation at Ambient Temperatures: New Modes of H2 and PhSiH3 Additions for an ""End-On-Bridged"" [Ta(IV)]2(μ-η1:η1-N2) Complex and for the Bis(μ-nitrido) [Ta(V)(μ-N)]2 Product Derived from Facile N\τbN Bond Cleavage","Journal of the American Chemical Society","2007","129","","9284","9285","10.1021/ja072248v","","","0.71073","MoKα","","0.0394","0.0283","","","0.0674","0.0719","","","","","","1","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109735","9.7044","0.001","15.7168","0.0016","12.2488","0.0013","90","","92.7557","0.0015","90","","1866.1","0.3","220","2","220","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","trans-ditantalum-dinitrogen complex","","","- C36 H64 N6 Ta2 -","- C36 H64 N6 Ta2 -","- C72 H128 N12 Ta4 -","2","0.5","","Masakazu Hirotsu; Philip P. Fontaine; Albert Epshteyn; Lawrence R. Sita","Dinitrogen Activation at Ambient Temperatures: New Modes of H2 and PhSiH3 Additions for an ""End-On-Bridged"" [Ta(IV)]2(μ-η1:η1-N2) Complex and for the Bis(μ-nitrido) [Ta(V)(μ-N)]2 Product Derived from Facile N\τbN Bond Cleavage","Journal of the American Chemical Society","2007","129","","9284","9285","10.1021/ja072248v","","","0.71073","MoKα","","0.0408","0.0308","","","0.0635","0.0656","","","","","","1","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109736","10.7416","0.0005","12.3472","0.0006","19.2441","0.0009","81.137","0.001","81.316","0.001","73.391","0.001","2401.2","0.2","220","2","220","2","","","","","","","","5","P -1","-P 1","2","","","","- C89 H156 N12 Si2 Ta4 -","- C89 H156 N12 Si2 Ta4 -","- C89 H156 N12 Si2 Ta4 -","1","0.5","","Masakazu Hirotsu; Philip P. Fontaine; Albert Epshteyn; Lawrence R. Sita","Dinitrogen Activation at Ambient Temperatures: New Modes of H2 and PhSiH3 Additions for an ""End-On-Bridged"" [Ta(IV)]2(μ-η1:η1-N2) Complex and for the Bis(μ-nitrido) [Ta(V)(μ-N)]2 Product Derived from Facile N\τbN Bond Cleavage","Journal of the American Chemical Society","2007","129","","9284","9285","10.1021/ja072248v","","","0.71073","MoKα","","0.0394","0.0278","","","0.0577","0.0623","","","","","","1","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109737","14.506","0.003","14.123","0.002","20.514","0.004","90","","107.176","0.003","90","","4015.2","1.3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Tantalum nitrogen hydrogen complex","","","- C36 H66 N6 Ta2 -","- C36 H66 N6 Ta2 -","- C144 H264 N24 Ta8 -","4","0.5","","Masakazu Hirotsu; Philip P. Fontaine; Albert Epshteyn; Lawrence R. Sita","Dinitrogen Activation at Ambient Temperatures: New Modes of H2 and PhSiH3 Additions for an ""End-On-Bridged"" [Ta(IV)]2(μ-η1:η1-N2) Complex and for the Bis(μ-nitrido) [Ta(V)(μ-N)]2 Product Derived from Facile N\τbN Bond Cleavage","Journal of the American Chemical Society","2007","129","","9284","9285","10.1021/ja072248v","","","0.71073","MoKα","","0.0359","0.0221","","","0.0454","0.0495","","","","","","1","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109738","10.6823","0.0008","10.9599","0.0008","20.1009","0.0015","97.2","0.001","99.515","0.001","95.836","0.001","2284.6","0.3","220","2","220","2","","","","","","","","5","P -1","-P 1","2","","Ditantalum mu-nitrogen hydrogen complex","","- C42 H72 N6 Si Ta2 -","- C42 H72 N6 Si Ta2 -","- C84 H144 N12 Si2 Ta4 -","2","1","","Masakazu Hirotsu; Philip P. Fontaine; Albert Epshteyn; Lawrence R. Sita","Dinitrogen Activation at Ambient Temperatures: New Modes of H2 and PhSiH3 Additions for an ""End-On-Bridged"" [Ta(IV)]2(μ-η1:η1-N2) Complex and for the Bis(μ-nitrido) [Ta(V)(μ-N)]2 Product Derived from Facile N\τbN Bond Cleavage","Journal of the American Chemical Society","2007","129","","9284","9285","10.1021/ja072248v","","","0.71073","MoKα","","0.0458","0.0264","","","0.0546","0.0599","","","","","","1.001","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109739","9.2069","0.0003","13.3959","0.0004","13.5754","0.0003","110.073","0.002","90.698","0.002","96.944","0.002","1558.49","0.08","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H46 Ga Mo N Si3 -","- C29 H46 Ga Mo N Si3 -","- C58 H92 Ga2 Mo2 N2 Si6 -","2","1","","Clinton L. Lund; Jörg A. Schachner; J. Wilson Quail; Jens Müller","[1]Molybdarenophanes: Strained Metallarenophanes with Aluminum, Gallium, and Silicon in Bridging Positions","Journal of the American Chemical Society","2007","129","","9313","9320","10.1021/ja072747w","","","0.71073","MoKα","","0.0655","0.0441","","","0.0986","0.1107","","","","","","1.041","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109740","9.005","0.0004","9.793","0.0005","17.0803","0.0008","98.873","0.003","97.435","0.002","96.174","0.003","1463.15","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H88 Al2 Mo2 N2 Si6 -","- C53 H88 Al2 Mo2 N2 Si6 -","- C53 H88 Al2 Mo2 N2 Si6 -","1","0.5","","Clinton L. Lund; Jörg A. Schachner; J. Wilson Quail; Jens Müller","[1]Molybdarenophanes: Strained Metallarenophanes with Aluminum, Gallium, and Silicon in Bridging Positions","Journal of the American Chemical Society","2007","129","","9313","9320","10.1021/ja072747w","","","0.71073","MoKα","","0.0935","0.054","","","0.122","0.1459","","","","","","1.072","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109741","9.2936","0.0005","9.7991","0.0005","17.2637","0.001","90.071","0.004","102.786","0.003","92.141","0.004","1532.06","0.15","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H46 Ga Mo N Si3 -","- C29 H46 Ga Mo N Si3 -","- C58 H92 Ga2 Mo2 N2 Si6 -","2","1","","Clinton L. Lund; Jörg A. Schachner; J. Wilson Quail; Jens Müller","[1]Molybdarenophanes: Strained Metallarenophanes with Aluminum, Gallium, and Silicon in Bridging Positions","Journal of the American Chemical Society","2007","129","","9313","9320","10.1021/ja072747w","","","0.71073","MoKα","","0.1053","0.069","","","0.1584","0.1785","","","","","","1.065","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109742","7.879","0.0005","18.5687","0.0013","14.5051","0.0009","90","","120.59","0.004","90","","1826.8","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 Mo Si -","- C24 H20 Mo Si -","- C96 H80 Mo4 Si4 -","4","1","","Clinton L. Lund; Jörg A. Schachner; J. Wilson Quail; Jens Müller","[1]Molybdarenophanes: Strained Metallarenophanes with Aluminum, Gallium, and Silicon in Bridging Positions","Journal of the American Chemical Society","2007","129","","9313","9320","10.1021/ja072747w","","","0.71073","MoKα","","0.1169","0.0633","","","0.1002","0.1167","","","","","","1.056","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109743","9.702","0.002","12.89","0.003","18.27","0.004","90","","92.647","0.003","90","","2282.4","0.9","110","2","110","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 Cl Mn N4 O7 -","- C22 H16 Cl Mn N4 O7 -","- C88 H64 Cl4 Mn4 N16 O28 -","4","1","","Javier Ruiz; Bernabé F. Perandones","Base-Promoted Tautomerization of Imidazole Ligands to N-Heterocyclic Carbenes and Subsequent Transmetalation Reaction","Journal of the American Chemical Society","2007","129","","9298","9299","10.1021/ja073144n","","x-ray","0.7107","MoKα","","0.041","0.0315","","","0.0791","0.0835","","","","","","1.085","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109744","12.875","0.003","9.1942","0.0019","21.33","0.004","90","","103.882","0.003","90","","2451.2","0.9","110","2","110","2","","","","","","","synthesis as described","8","P 1 21/c 1","-P 2ybc","14","","","","- C45 H34 Cl2 F12 Mn2 N8 O6 P2 -","- C45 H34 Cl2 F12 Mn2 N8 O6 P2 -","- C90 H68 Cl4 F24 Mn4 N16 O12 P4 -","2","0.5","","Javier Ruiz; Bernabé F. Perandones","Base-Promoted Tautomerization of Imidazole Ligands to N-Heterocyclic Carbenes and Subsequent Transmetalation Reaction","Journal of the American Chemical Society","2007","129","","9298","9299","10.1021/ja073144n","","x-ray","0.7107","MoKα","","0.0639","0.0383","","","0.0838","0.0933","","","","","","1.068","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109745","10.9629","0.0002","11.2933","0.0002","18.6298","0.0004","95.881","0.001","103.728","0.001","112.324","0.001","2024.52","0.07","100","2","100","2","","","","","","","synthesis as described","9","P -1","-P 1","2","","","","- C41 H32 Au Cl2 F6 Mn N4 O3 P2 -","- C41 H32 Au Cl2 F6 Mn N4 O3 P2 -","- C82 H64 Au2 Cl4 F12 Mn2 N8 O6 P4 -","2","1","","Javier Ruiz; Bernabé F. Perandones","Base-Promoted Tautomerization of Imidazole Ligands to N-Heterocyclic Carbenes and Subsequent Transmetalation Reaction","Journal of the American Chemical Society","2007","129","","9298","9299","10.1021/ja073144n","","x-ray","0.7107","MoKα","","0.0377","0.0327","","","0.075","0.0769","","","","","","1.058","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109746","24.3978","0.0015","24.3978","0.0015","7.1468","0.0009","90","","90","","120","","3684.2","0.6","298","2","298","2","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","","","- Eu Na2 Se4 Si -","- Eu Na2 Se4 Si -","- Eu18 Na36 Se72 Si18 -","18","1","","Amitava Choudhury; Peter K. Dorhout","An Ordered Assembly of Filled Nanoscale Tubules of Europium Seleno-silicate in the Crystal Structure of a Quaternary Compound","Journal of the American Chemical Society","2007","129","","9270","9271","10.1021/ja073335q","","","0.71073","MoKα","","0.0375","0.029","","","0.0469","0.0487","","","","","","1.006","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109747","14.913","0.003","15.93","0.003","16.27","0.003","115.71","0.03","98.62","0.03","100.53","0.03","3307.3","1.7","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C78 H168 K4 N14 O24 Pd2 Sn18 -","- C78 H168 K4 N14 O24 Pd2 Sn18 -","- C78 H168 K4 N14 O24 Pd2 Sn18 -","1","0.5","","Zhong-Ming Sun; Hai Xiao; Jun Li; Lai-Sheng Wang","Pd2@Sn184-: Fusion of Two Endohedral Stannaspherenes","Journal of the American Chemical Society","2007","129","","9560","9561","10.1021/ja0728674","","","1.54178","CuKα","","0.069","0.0499","","","0.1204","0.1322","","","","","","1.027","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109748","13.305","0.006","13.785","0.006","19.459","0.008","90","","90","","90","","3569","3","103.15","","103","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C34 H52 B Br Mg N2 O2 -","- C34 H52 B Br Mg N2 O2 -","- C136 H208 B4 Br4 Mg4 N8 O8 -","4","1","","Makoto Yamashita; Yuta Suzuki; Yasutomo Segawa; Kyoko Nozaki","Synthesis, Structure of Borylmagnesium, and Its Reaction with Benzaldehyde to Form Benzoylborane","Journal of the American Chemical Society","2007","129","","9570","9571","10.1021/ja073037t","","","0.7107","MoKα","","0.0892","0.0741","","","0.1301","0.1365","","","","","","1.142","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109749","26.5116","0.0015","10.9036","0.0009","28.9821","0.0017","90","","90","","90","","8377.9","1","103.15","","103","2","","","","","","","","8","P c a 21","P 2c -2ac","29","","","","- C38 H60 B Br2 Li Mg N2 O3 -","- C38 H60 B Br2 Li Mg N2 O3 -","- C304 H480 B8 Br16 Li8 Mg8 N16 O24 -","8","2","","Makoto Yamashita; Yuta Suzuki; Yasutomo Segawa; Kyoko Nozaki","Synthesis, Structure of Borylmagnesium, and Its Reaction with Benzaldehyde to Form Benzoylborane","Journal of the American Chemical Society","2007","129","","9570","9571","10.1021/ja073037t","","","0.7107","MoKα","","0.0566","0.0509","","","0.0928","0.0948","","","","","","1.143","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109750","25.376","0.002","41.133","0.005","10.9179","0.0011","90","","90","","90","","11396","2","103","2","103","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C60 H88 B2 Mg N4 O2 -","- C60 H88 B2 Mg N4 O2 -","- C480 H704 B16 Mg8 N32 O16 -","8","0.5","","Makoto Yamashita; Yuta Suzuki; Yasutomo Segawa; Kyoko Nozaki","Synthesis, Structure of Borylmagnesium, and Its Reaction with Benzaldehyde to Form Benzoylborane","Journal of the American Chemical Society","2007","129","","9570","9571","10.1021/ja073037t","","","0.7107","MoKα","","0.0702","0.0695","","","0.1795","0.1799","","","","","","1.156","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109751","12.66","0.006","15.48","0.008","14.755","0.007","90","0.002","90.479","0.002","90","0.002","2892","2","103.15","","103","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C33 H41 B N2 O -","- C33 H41 B N2 O -","- C132 H164 B4 N8 O4 -","4","1","","Makoto Yamashita; Yuta Suzuki; Yasutomo Segawa; Kyoko Nozaki","Synthesis, Structure of Borylmagnesium, and Its Reaction with Benzaldehyde to Form Benzoylborane","Journal of the American Chemical Society","2007","129","","9570","9571","10.1021/ja073037t","","","0.7107","MoKα","","0.0782","0.0572","","","0.1295","0.1415","","","","","","1.122","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109752","6.446","0.002","9.071","0.003","29.058","0.009","90","","90","","90","","1699.1","0.9","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H19 Br O2 -","- C20 H19 Br O2 -","- C80 H76 Br4 O8 -","4","1","","Joshua N. Payette; Hisashi Yamamoto","Regioselective and Asymmetric Diels-Alder Reaction of 1- and 2-Substituted Cyclopentadienes Catalyzed by a Brønsted Acid Activated Chiral Oxazaborolidine","Journal of the American Chemical Society","2007","129","","9536","9537","10.1021/ja0735958","","","0.71073","MoKα","","0.0641","0.0444","","","0.0779","0.084","","","","","","0.921","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109753","6.5293","0.0016","8.022","0.002","27.132","0.007","90","","90","","90","","1421.1","0.6","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H17 Br O3 -","- C16 H17 Br O3 -","- C64 H68 Br4 O12 -","4","1","","Joshua N. Payette; Hisashi Yamamoto","Regioselective and Asymmetric Diels-Alder Reaction of 1- and 2-Substituted Cyclopentadienes Catalyzed by a Brønsted Acid Activated Chiral Oxazaborolidine","Journal of the American Chemical Society","2007","129","","9536","9537","10.1021/ja0735958","","","0.71073","MoKα","","0.0439","0.0319","","","0.0574","0.0592","","","","","","0.886","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109754","9.6596","0.0016","21.302","0.004","26.248","0.004","90","","90","","90","","5401","1.6","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C31 H37 N O2 Si -","- C31 H37 N O2 Si -","- C248 H296 N8 O16 Si8 -","8","1","","David A. Evans; Yimon Aye","Aluminum-Catalyzed Enantio- and Diastereoselective Carbonyl Addition of Propargylsilanes. A New Approach to Enantioenriched Vinyl Epoxides","Journal of the American Chemical Society","2007","129","","9606","9607","10.1021/ja0740420","","","0.71073","MoKα","","0.101","0.0699","","","0.1525","0.1689","","","","","","1.074","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109755","14.094","0.002","18.133","0.003","10.0075","0.0014","90","","108.656","0.003","90","","2423.2","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H33 N O2 Si -","- C25 H33 N O2 Si -","- C100 H132 N4 O8 Si4 -","4","1","","David A. Evans; Yimon Aye","Aluminum-Catalyzed Enantio- and Diastereoselective Carbonyl Addition of Propargylsilanes. A New Approach to Enantioenriched Vinyl Epoxides","Journal of the American Chemical Society","2007","129","","9606","9607","10.1021/ja0740420","","","0.71073","MoKα","","0.2004","0.0468","","","0.0553","0.0775","","","","","","0.664","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109756","9.5087","0.0017","21.076","0.004","26.118","0.005","90","","90","","90","","5234.2","1.7","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C30 H35 N O2 Si -","- C30 H35 N O2 Si -","- C240 H280 N8 O16 Si8 -","8","1","","David A. Evans; Yimon Aye","Aluminum-Catalyzed Enantio- and Diastereoselective Carbonyl Addition of Propargylsilanes. A New Approach to Enantioenriched Vinyl Epoxides","Journal of the American Chemical Society","2007","129","","9606","9607","10.1021/ja0740420","","","0.71073","MoKα","","0.1235","0.0781","","","0.176","0.2004","","","","","","1.053","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109757","10.697","0.004","11.566","0.004","17.418","0.007","81.656","0.006","84.628","0.007","63.194","0.006","1902.1","1.2","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C64 H80 Co2 F24 N4 O14 -","- C64 H80 Co2 F24 N4 O14 -","- C64 H80 Co2 F24 N4 O14 -","1","1","","Youhei Numata; Katsuya Inoue; Nikolai Baranov; Mohamedally Kurmoo; Koichi Kikuchi","Field-Induced Ferrimagnetic State in a Molecule-Based Magnet Consisting of a CoIII on and a Chiral Triplet Bis(nitroxide) Radical","Journal of the American Chemical Society","2007","129","","9902","9909","10.1021/ja064828i","","","0.71073","MoKα","","0.0804","0.0709","","","0.1881","0.1949","","","","","","0.992","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109758","9.748","0.002","12.943","0.002","20.949","0.003","105.117","0.002","94.607","0.003","94.565","0.003","2529.5","0.7","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H26 F7 N O2 -","- C27 H26 F7 N O2 -","- C108 H104 F28 N4 O8 -","4","2","","Hendrich A. Chiong; Quynh-Nhu Pham; Olafs Daugulis","Two Methods for Direct ortho-Arylation of Benzoic Acids","Journal of the American Chemical Society","2007","129","","9879","9884","10.1021/ja071845e","","","0.71073","MoKα","","0.1606","0.0591","","","0.1471","0.1978","","","","","","0.912","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109759","23.181","0.002","13.0498","0.0013","4.795","0.0005","90","","90","","90","","1450.5","0.2","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Cd4.49 Sb9 Sr9 -","- Cd4.492 Sb9 Sr9 -","- Cd8.984 Sb18 Sr18 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0299","0.0263","","","0.0516","0.0526","","","","","","1.148","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109760","22.499","0.003","12.7079","0.0019","4.7229","0.0007","90","","90","","90","","1350.3","0.3","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Ca9 Cd4.06 -","- Bi9 Ca9 Cd4.058 -","- Bi18 Ca18 Cd8.116 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0291","0.0279","","","0.0618","0.0623","","","","","","1.185","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109761","22.426","0.003","12.629","0.0018","4.72","0.0007","90","","90","","90","","1336.8","0.3","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Cd4 Yb9 -","- Bi9 Cd4.012 Yb9 -","- Bi18 Cd8.024 Yb18 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0412","0.0367","","","0.0731","0.0744","","","","","","1.255","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109762","23.402","0.004","13.186","0.002","4.8906","0.0009","90","","90","","90","","1509.1","0.4","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Cd4.27 Sr9 -","- Bi9 Cd4.266 Sr9 -","- Bi18 Cd8.532 Sr18 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0495","0.0409","","","0.0818","0.0851","","","","","","1.168","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109763","23.1615","0.0015","13.0114","0.0009","4.8588","0.0003","90","","90","","90","","1464.27","0.17","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Cd4.21 Eu9 -","- Bi9 Cd4.21 Eu9 -","- Bi18 Cd8.42 Eu18 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0286","0.0266","","","0.0552","0.0561","","","","","","1.137","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109764","21.997","0.003","12.5243","0.0014","4.6283","0.0005","90","","90","","90","","1275.1","0.3","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Yb9 Zn4.03 -","- Bi9 Yb9 Zn4.028 -","- Bi18 Yb18 Zn8.056 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0486","0.0362","","","0.0813","0.0856","","","","","","1.091","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109765","22.0688","0.0016","12.5898","0.0006","4.6336","0.0004","90","","90","","90","","1287.41","0.16","120","2","120","2","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Bi9 Ca9 Zn4.09 -","- Bi9 Ca9 Zn4.102 -","- Bi18 Ca18 Zn8.204 -","2","0.25","","Sheng-qing Xia; Svilen Bobev","Interplay between Size and Electronic Effects in Determining the Homogeneity Range of the A9Zn4+xPn9 and A9Cd4+xPn9 Phases (0 <=x<= 0.5), A = Ca, Sr, Yb, Eu; Pn = Sb, Bi","Journal of the American Chemical Society","2007","129","","10011","10018","10.1021/ja0728425","","","0.71073","MoKα","","0.0187","0.0174","","","0.0394","0.0397","","","","","","1.218","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109766","25.696","0.006","13.639","0.003","8.651","0.002","90","","95.556","0.005","90","","3017.7","1.2","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N2 O S2 -","- C16 H18 N2 O S2 -","- C128 H144 N16 O8 S16 -","8","2","","David A. Evans; Keith R. Fandrick; Hyun-Ji Song; Karl A. Scheidt; Risheng Xu","Enantioselective Friedel-Crafts Alkylations Catalyzed by Bis(oxazolinyl)pyridine-Scandium(III) Triflate Complexes","Journal of the American Chemical Society","2007","129","","10029","10041","10.1021/ja072976i","","","0.71073","MoKα","","0.0783","0.0661","","","0.1336","0.139","","","","","","1.232","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109767","6.9","0.0006","10.5226","0.001","34.483","0.003","90","","90","","90","","2503.7","0.4","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 O3 -","- C15 H18 O3 -","- C120 H144 O24 -","8","2","","Arunkumar Natarajan; C. K. Tsai; Saeed I. Khan; Patrick McCarren; K. N. Houk; Miguel A. Garcia-Garibay","The Photoarrangement of α-Santonin is a Single-Crystal-to-Single-Crystal Reaction: A Long Kept Secret in Solid-State Organic Chemistry Revealed","Journal of the American Chemical Society","2007","129","","9846","9847","10.1021/ja073189o","","","0.71073","MoKα","","0.0361","0.0324","","","0.0811","0.0832","","","","","","1.136","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109768","6.9317","0.0007","10.8194","0.001","34.414","0.003","90","","90","","90","","2580.9","0.4","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 O3 -","- C15 H18 O3 -","- C120 H144 O24 -","8","2","","Arunkumar Natarajan; C. K. Tsai; Saeed I. Khan; Patrick McCarren; K. N. Houk; Miguel A. Garcia-Garibay","The Photoarrangement of α-Santonin is a Single-Crystal-to-Single-Crystal Reaction: A Long Kept Secret in Solid-State Organic Chemistry Revealed","Journal of the American Chemical Society","2007","129","","9846","9847","10.1021/ja073189o","","","0.71073","MoKα","","0.1592","0.0871","","","0.1902","0.22","","","","","","1.228","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109769","14.56","0.009","7.622","0.005","12.513","0.008","90","","90","","90","","1388.6","1.5","298","2","298","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","","","- C31 H40 O7 -","- C31 H40 O7 -","- C62 H80 O14 -","2","0.5","","Arunkumar Natarajan; C. K. Tsai; Saeed I. Khan; Patrick McCarren; K. N. Houk; Miguel A. Garcia-Garibay","The Photoarrangement of α-Santonin is a Single-Crystal-to-Single-Crystal Reaction: A Long Kept Secret in Solid-State Organic Chemistry Revealed","Journal of the American Chemical Society","2007","129","","9846","9847","10.1021/ja073189o","","","0.71073","MoKα","","0.1277","0.0648","","","0.1705","0.2125","","","","","","1.007","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109770","7.792","0.003","14.885","0.005","25.707","0.009","90","","90","","90","","2981.6","1.8","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C34 H44 O8 -","- C34 H44 O8 -","- C136 H176 O32 -","4","1","","Arunkumar Natarajan; C. K. Tsai; Saeed I. Khan; Patrick McCarren; K. N. Houk; Miguel A. Garcia-Garibay","The Photoarrangement of α-Santonin is a Single-Crystal-to-Single-Crystal Reaction: A Long Kept Secret in Solid-State Organic Chemistry Revealed","Journal of the American Chemical Society","2007","129","","9846","9847","10.1021/ja073189o","","","0.71073","MoKα","","0.074","0.0561","","","0.1395","0.1524","","","","","","1.039","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109771","14.1676","0.0009","14.1676","0.0009","10.8602","0.0013","90","","90","","120","","1887.8","0.3","100","2","100","2","","","","","","","","3","P 32 2 1","P 32 2""","154","","","","- C30 H36 O6 -","- C30 H36 O6 -","- C90 H108 O18 -","3","0.5","","Arunkumar Natarajan; C. K. Tsai; Saeed I. Khan; Patrick McCarren; K. N. Houk; Miguel A. Garcia-Garibay","The Photoarrangement of α-Santonin is a Single-Crystal-to-Single-Crystal Reaction: A Long Kept Secret in Solid-State Organic Chemistry Revealed","Journal of the American Chemical Society","2007","129","","9846","9847","10.1021/ja073189o","","","0.71073","MoKα","","0.0572","0.0313","","","0.06","0.0679","","","","","","0.938","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109772","12.6962","0.0016","17.318","0.002","18.741","0.003","81.343","0.002","77.927","0.002","75.815","0.002","3885.2","0.9","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H1.07 Cl Fe N0.29 O -","- C7.71429 Cl0.428571 Fe0.571429 N1.71429 O2.5 -","- C108 Cl6 Fe8 N24 O35 -","14","7","","Theocharis C. Stamatatos; Alexander G. Christou; Candace M. Jones; Brian J. O'Callaghan; Khalil A. Abboud; Ted A. O'Brien; George Christou","""Squaring the Circle"": Molecular Squares and Rectangles from Chelate-Induced Structural Transformations of Known Fe10 and New Fe12 Ferric Wheels","Journal of the American Chemical Society","2007","129","","9840","9841","10.1021/ja073236c","","","0.71073","MoKα","","0.2864","0.1728","","","0.3894","0.4325","","","","","","1.846","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109773","19.293","0.007","19.914","0.008","26.176","0.01","85.786","0.009","81.646","0.008","89.639","0.007","9923","7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C176 H186 Cl8 Fe12 N34 O60 -","- C156 H157 Cl8 Fe12 N24 O60 -","- C312 H314 Cl16 Fe24 N48 O120 -","2","1","","Theocharis C. Stamatatos; Alexander G. Christou; Candace M. Jones; Brian J. O'Callaghan; Khalil A. Abboud; Ted A. O'Brien; George Christou","""Squaring the Circle"": Molecular Squares and Rectangles from Chelate-Induced Structural Transformations of Known Fe10 and New Fe12 Ferric Wheels","Journal of the American Chemical Society","2007","129","","9840","9841","10.1021/ja073236c","","","0.71073","MoKα","","0.2621","0.0867","","","0.1866","0.2172","","","","","","0.68","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109774","19.248","0.001","19.248","0.001","17.868","0.019","90","","90","","120","","5733","6","173","2","173","2","","","","","","","","4","P -3 1 c","-P 3 2c","163","","","","- C80 H154 Fe12 O50 -","- C72 H132 Fe12 O48 -","- C144 H264 Fe24 O96 -","2","0.166667","","Theocharis C. Stamatatos; Alexander G. Christou; Candace M. Jones; Brian J. O'Callaghan; Khalil A. Abboud; Ted A. O'Brien; George Christou","""Squaring the Circle"": Molecular Squares and Rectangles from Chelate-Induced Structural Transformations of Known Fe10 and New Fe12 Ferric Wheels","Journal of the American Chemical Society","2007","129","","9840","9841","10.1021/ja073236c","","","0.71073","MoKα","","0.1078","0.0519","","","0.113","0.1212","","","","","","0.869","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109775","7.5319","0.0015","11.179","0.002","12.639","0.003","99.22","0.03","94.76","0.03","93.14","0.03","1044.3","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 Cl N O6 -","- C22 H22 Cl N O6 -","- C44 H44 Cl2 N2 O12 -","2","1","","Sang Yeul Lee; Ryan C. Clark; Dale L. Boger","Total Synthesis, Stereochemical Reassignment, and Absolute Configuration of Chlorofusin","Journal of the American Chemical Society","2007","129","","9860","9861","10.1021/ja073264v","","","0.71073","MoKα","","0.0883","0.0629","","","0.1419","0.1554","","","","","","1.071","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109776","7.9229","0.0016","20.997","0.004","25.787","0.005","90","","96.12","0.03","90","","4265.4","1.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 Cl N O6 -","- C22 H22 Cl N O6 -","- C176 H176 Cl8 N8 O48 -","8","2","","Sang Yeul Lee; Ryan C. Clark; Dale L. Boger","Total Synthesis, Stereochemical Reassignment, and Absolute Configuration of Chlorofusin","Journal of the American Chemical Society","2007","129","","9860","9861","10.1021/ja073264v","","","0.71073","MoKα","","0.0976","0.0675","","","0.1345","0.1486","","","","","","1.098","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109777","10.747","0.002","14.12","0.003","16.719","0.003","107.93","0.03","107.91","0.03","90.12","0.03","2283.7","1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H28 Cl N O6 -","- C21 H28 Cl N O6 -","- C84 H112 Cl4 N4 O24 -","4","2","","Sang Yeul Lee; Ryan C. Clark; Dale L. Boger","Total Synthesis, Stereochemical Reassignment, and Absolute Configuration of Chlorofusin","Journal of the American Chemical Society","2007","129","","9860","9861","10.1021/ja073264v","","","0.71073","MoKα","","0.1341","0.0932","","","0.2253","0.2497","","","","","","1.104","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109778","19.163","0.013","19.74","0.012","22.708","0.012","90","","106.49","0.03","90","","8237","9","153","2","153","2","","","","","","","","9","P 1 21 1","P 2yb","4","","","","- C136 H144 B0.67 F2 N4 O4 P4 Rh2 S4 -","- C136 H128 N4 O4 P4 Rh2 S4 -","- C272 H256 N8 O8 P8 Rh4 S8 -","2","1","","Martin S. Masar; Nathan C. Gianneschi; Christopher G. Oliveri; Charlotte L. Stern; SonBinh T. Nguyen; Chad A. Mirkin","Allosterically Regulated Supramolecular Catalysis of Acyl Transfer Reactions for Signal Amplification and Detection of Small Molecules","Journal of the American Chemical Society","2007","129","","10149","10158","10.1021/ja0711516","","","0.71073","MoKα","","0.2303","0.0861","","","0.2157","0.2787","","","","","","0.876","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109779","8.7862","0.0009","8.0998","0.0008","24.1","0.002","90","","92.679","0.003","90","","1713.2","0.3","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H26 N2 O4 -","- C18 H26 N2 O4 -","- C72 H104 N8 O16 -","4","1","","Andrzej Rajca; Masahiro Takahashi; Maren Pink; Gaëlle Spagnol; Suchada Rajca","Conformationally Constrained, Stable, Triplet Ground State (S=1) Nitroxide Diradicals. Antiferromagnetic Chains of S=1 Diradicals","Journal of the American Chemical Society","2007","129","","10159","10170","10.1021/ja0712017","","","0.71073","MoKα","","0.047","0.0368","","","0.0922","0.1031","","","","","","1.03","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109780","8.658","0.005","20.436","0.011","28.965","0.017","90","","90","","90","","5125","5","95","2","95","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C28 H38 N2 O4 -","- C28 H38 N2 O4 -","- C224 H304 N16 O32 -","8","1","","Andrzej Rajca; Masahiro Takahashi; Maren Pink; Gaëlle Spagnol; Suchada Rajca","Conformationally Constrained, Stable, Triplet Ground State (S=1) Nitroxide Diradicals. Antiferromagnetic Chains of S=1 Diradicals","Journal of the American Chemical Society","2007","129","","10159","10170","10.1021/ja0712017","","","0.43321","synchrotron","","0.1937","0.1178","","","0.2739","0.3285","","","","","","0.993","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109781","25.4534","0.0011","12.5714","0.0006","17.357","0.0008","90","","131.308","0.001","90","","4172","0.3","130","2","130","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C38 H56 Cl4 N4 O8 -","- C38 H56 Cl4 N4 O8 -","- C152 H224 Cl16 N16 O32 -","4","1","","Andrzej Rajca; Masahiro Takahashi; Maren Pink; Gaëlle Spagnol; Suchada Rajca","Conformationally Constrained, Stable, Triplet Ground State (S=1) Nitroxide Diradicals. Antiferromagnetic Chains of S=1 Diradicals","Journal of the American Chemical Society","2007","129","","10159","10170","10.1021/ja0712017","","","0.71073","MoKα","","0.0625","0.057","","","0.1617","0.1699","","","","","","1.056","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109782","12.046","0.0017","14.3395","0.0019","18.279","0.003","85.068","0.003","87.92","0.003","68.748","0.003","2931.7","0.7","130","2","130","2","","","","","","","","7","P -1","-P 1","2","","","","- C50.5 H65 Cl1.5 Co F12 N4 O14.25 -","- C50.494 H64.988 Cl1.506 Co F12 N4 O14.247 -","- C100.988 H129.976 Cl3.012 Co2 F24 N8 O28.494 -","2","1","","Andrzej Rajca; Masahiro Takahashi; Maren Pink; Gaëlle Spagnol; Suchada Rajca","Conformationally Constrained, Stable, Triplet Ground State (S=1) Nitroxide Diradicals. Antiferromagnetic Chains of S=1 Diradicals","Journal of the American Chemical Society","2007","129","","10159","10170","10.1021/ja0712017","","","0.71073","MoKα","","0.0789","0.0517","","","0.1311","0.1502","","","","","","1.022","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109783","8.6264","0.0017","11.231","0.002","14.416","0.003","90","","98.86","0.03","90","","1380","0.5","293","2","293","2","","","","","","","synthesis","3","P 1 21/n 1","-P 2yn","14","5+2+1 product","cis-1-methyl-6-oxo-3-phenyl-10-oxabicyclo[6.3.0]undec-2-ene","","- C17 H20 O2 -","- C17 H20 O2 -","- C68 H80 O8 -","4","1","","Yuanyuan Wang; Jingxin Wang; Jiachun Su; Feng Huang; Lei Jiao; Yong Liang; Dazhi Yang; Shiwei Zhang; Paul A. Wender; Zhi-Xiang Yu","A Computationally Designed Rh(I)-Catalyzed Two-Component [5+2+1] Cycloaddition of Ene-vinylcyclopropanes and CO for the Synthesis of Cyclooctenones","Journal of the American Chemical Society","2007","129","","10060","10061","10.1021/ja072505w","","x-ray","0.71073","MoKα","","0.082","0.0427","","","0.0914","0.0981","","","","","","0.987","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109784","13.355","0.003","7.8404","0.0016","15.21","0.003","90","","104.52","0.03","90","","1541.7","0.6","293","2","293","2","","","","","","","synthetic","3","P 1 21/n 1","-P 2yn","14","[5+2+1] cycloadduct","Dimethyl trans-3-oxo-7-methylbicyclo[6.3.0]undec-6-ene-10,10-dicarboxylate","","- C16 H22 O5 -","- C16 H22 O5 -","- C64 H88 O20 -","4","1","","Yuanyuan Wang; Jingxin Wang; Jiachun Su; Feng Huang; Lei Jiao; Yong Liang; Dazhi Yang; Shiwei Zhang; Paul A. Wender; Zhi-Xiang Yu","A Computationally Designed Rh(I)-Catalyzed Two-Component [5+2+1] Cycloaddition of Ene-vinylcyclopropanes and CO for the Synthesis of Cyclooctenones","Journal of the American Chemical Society","2007","129","","10060","10061","10.1021/ja072505w","","x-ray","0.71073","MoKα","","0.0859","0.0557","","","0.1518","0.1652","","","","","","1.01","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109785","6.0392","0.0012","18.492","0.004","16.3","0.003","90","","97.27","0.03","90","","1805.7","0.6","293","2","293","2","","","","","","","synthetic","5","P 1 21/n 1","-P 2yn","14","[5+2+1] cycloadduct","cis-N-p-toluenesulfonyl-7-methyl-3-oxo-10-azabicyclo[6.3.0]undec-6-ene","","- C18 H23 N O3 S -","- C18 H23 N O3 S -","- C72 H92 N4 O12 S4 -","4","1","","Yuanyuan Wang; Jingxin Wang; Jiachun Su; Feng Huang; Lei Jiao; Yong Liang; Dazhi Yang; Shiwei Zhang; Paul A. Wender; Zhi-Xiang Yu","A Computationally Designed Rh(I)-Catalyzed Two-Component [5+2+1] Cycloaddition of Ene-vinylcyclopropanes and CO for the Synthesis of Cyclooctenones","Journal of the American Chemical Society","2007","129","","10060","10061","10.1021/ja072505w","","x-ray","0.71073","MoKα","","0.0717","0.0407","","","0.0848","0.0899","","","","","","1.005","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109786","15.646","0.0004","15.646","0.0004","12.5656","0.0007","90","","90","","120","","2663.92","0.18","293","2","293","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- H26 Mn Mo9 O45 Zn3 -","- Mn Mo9 O45 Zn3 -","- Mn3 Mo27 O135 Zn9 -","3","0.166667","","Huaqiao Tan; Yangguang Li; Zhiming Zhang; Chao Qin; Xinlong Wang; Enbo Wang; Zhongmin Su","Chiral Polyoxometalate-Induced Enantiomerically 3D Architectures: A New Route for Synthesis of High-Dimensional Chiral Compounds","Journal of the American Chemical Society","2007","129","","10066","10067","10.1021/ja073153w","","","0.71073","MoKα","","0.0487","0.0469","","","0.1383","0.1406","","","","","","1.063","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109787","15.6562","0.0004","15.6562","0.0004","12.5757","0.0007","90","","90","","120","","2669.53","0.18","293","2","293","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- H26 Mn Mo9 O45 Zn3 -","- Mn Mo9 O45 Zn3 -","- Mn3 Mo27 O135 Zn9 -","3","0.166667","","Huaqiao Tan; Yangguang Li; Zhiming Zhang; Chao Qin; Xinlong Wang; Enbo Wang; Zhongmin Su","Chiral Polyoxometalate-Induced Enantiomerically 3D Architectures: A New Route for Synthesis of High-Dimensional Chiral Compounds","Journal of the American Chemical Society","2007","129","","10066","10067","10.1021/ja073153w","","","0.71073","MoKα","","0.0504","0.0477","","","0.1394","0.1427","","","","","","1.063","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109788","15.957","0.002","15.957","0.002","12.415","0.003","90","","90","","120","","2737.7","0.8","150","2","150","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- H36 Mn Mo9 N6 O38 -","- Mn Mo9 N6 O38 -","- Mn3 Mo27 N18 O114 -","3","0.166667","","Huaqiao Tan; Yangguang Li; Zhiming Zhang; Chao Qin; Xinlong Wang; Enbo Wang; Zhongmin Su","Chiral Polyoxometalate-Induced Enantiomerically 3D Architectures: A New Route for Synthesis of High-Dimensional Chiral Compounds","Journal of the American Chemical Society","2007","129","","10066","10067","10.1021/ja073153w","","","0.71073","MoKα","","0.0211","0.0196","","","0.0517","0.0528","","","","","","1.054","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109789","15.802","0.002","15.802","0.002","12.404","0.003","90","","90","","120","","2682.4","0.8","150","2","150","2","","","","","","","","6","R 3 2 :H","R 3 2""","155","","","","- H30 K3 Mn Mo9 N3 O41 -","- K3 Mn Mo9 N3 O41 -","- K9 Mn3 Mo27 N9 O123 -","3","0.166667","","Huaqiao Tan; Yangguang Li; Zhiming Zhang; Chao Qin; Xinlong Wang; Enbo Wang; Zhongmin Su","Chiral Polyoxometalate-Induced Enantiomerically 3D Architectures: A New Route for Synthesis of High-Dimensional Chiral Compounds","Journal of the American Chemical Society","2007","129","","10066","10067","10.1021/ja073153w","","","0.71073","MoKα","","0.0294","0.0288","","","0.0841","0.0848","","","","","","1.13","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109790","12.8811","0.0014","14.1571","0.0016","20.189","0.002","80.497","0.002","73.345","0.002","87.151","0.002","3478.8","0.6","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C149 H98 B2 Cl2 F48 O4 P4 Rh2 -","- C149 H96 B2 Cl2 F48 O4 P4 Rh2 -","- C149 H96 B2 Cl2 F48 O4 P4 Rh2 -","1","0.5","","Junpei Kuwabara; Charlotte L. Stern; Chad A. Mirkin","A Coordination Chemistry Approach to a Multieffector Enzyme Mimic","Journal of the American Chemical Society","2007","129","","10074","10075","10.1021/ja073447h","","","0.71073","MoKα","","0.0765","0.06","","","0.1577","0.1727","","","","","","1.041","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"4109791","12.6353","0.0008","12.8743","0.0008","13.2207","0.0008","109.004","0.001","101.647","0.001","94.507","0.001","1967.2","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C88 H76 Cl6 O6 P4 Rh2 -","- C88 H76 Cl6 O6 P4 Rh2 -","- C88 H76 Cl6 O6 P4 Rh2 -","1","0.5","","Junpei Kuwabara; Charlotte L. Stern; Chad A. Mirkin","A Coordination Chemistry Approach to a Multieffector Enzyme Mimic","Journal of the American Chemical Society","2007","129","","10074","10075","10.1021/ja073447h","","","0.71073","MoKα","","0.0788","0.0516","","","0.1277","0.1416","","","","","","1.024","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"4109792","28.885","0.004","28.885","0.004","28.305","0.006","90","","90","","90","","23616","7","100","2","100","2","","","","","","","","5","I 4 2 2","I 4 2","97","","","","- C304 H216 Cu24 O144 S8 -","- C304 H216 Cu24 O171.56 S8 -","- C608 H432 Cu48 O343.12 S16 -","2","0.125","","John J. Perry; Victor Ch. Kravtsov; Gregory J. McManus; Michael J. Zaworotko","Bottom up Synthesis That Does Not Start at the Bottom: Quadruple Covalent Cross-Linking of Nanoscale Faceted Polyhedra","Journal of the American Chemical Society","2007","129","","10076","10077","10.1021/ja0734952","","","0.71073","MoKα","","0.282","0.1032","","","0.257","0.2874","","","","","","1","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109793","11.1692","0.0003","11.2436","0.0003","11.382","0.0003","88.696","0.003","75.996","0.002","75.586","0.002","1342.17","0.06","125","2","125","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H20 O5 -","- C14 H20 O5 -","- C56 H80 O20 -","4","2","","Sun-Joon Min; Gavin O. Jones; K. N. Houk; Samuel J. Danishefsky","Creating Quaternary Centers with High Exo Stereoselectivity Using Activated α-Alkynyl Dienophiles","Journal of the American Chemical Society","2007","129","","10078","10079","10.1021/ja073528d","","","0.71073","MoKα","","0.1003","0.053","","","0.1081","0.1347","","","","","","1.03","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109794","19.569","0.002","11.8063","0.0014","24.76","0.003","90","","100.108","0.002","90","","5631.7","1.1","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C57.5 H54.5 Au Cl3 F6 O1.5 P5 Pt -","- C57.38 H54.52 Au Cl3 F6 O1.38 P5 Pt -","- C229.52 H218.08 Au4 Cl12 F24 O5.52 P20 Pt4 -","4","1","","Timothy R. Cook; Arthur J. Esswein; Daniel G. Nocera","Metal-Halide Bond Photoactivation from a PtIII-AuII Complex","Journal of the American Chemical Society","2007","129","","10094","10095","10.1021/ja073908z","","","0.71073","MoKα","","0.0373","0.0275","","","0.0639","0.072","","","","","","1.142","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109795","44.296","0.002","11.0985","0.0006","27.3766","0.0014","90","","115.861","0.001","90","","12111","1.1","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C59 H55 Au Cl7 F6 P5 Pt -","- C59 H55 Au Cl7 F6 P5 Pt -","- C472 H440 Au8 Cl56 F48 P40 Pt8 -","8","1","","Timothy R. Cook; Arthur J. Esswein; Daniel G. Nocera","Metal-Halide Bond Photoactivation from a PtIII-AuII Complex","Journal of the American Chemical Society","2007","129","","10094","10095","10.1021/ja073908z","","","0.71073","MoKα","","0.0529","0.0477","","","0.1131","0.1152","","","","","","1.165","","","","has coordinates,has disorder","178843","2020-10-21","18:00:00",""
"4109796","16.767","0.013","6.055","0.005","20.972","0.016","90","","97.944","0.014","90","","2109","3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 N2 O4 -","- C26 H26 N2 O4 -","- C104 H104 N8 O16 -","4","1","","Mohammad Movassaghi; Matthew D. Hill; Omar K. Ahmad","Direct Synthesis of Pyridine Derivatives","Journal of the American Chemical Society","2007","129","","10096","10097","10.1021/ja073912a","","","0.71073","MoKα","","0.0617","0.0415","","","0.0997","0.1107","","","","","","1.032","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109797","10.9609","0.0007","12.4178","0.0008","14.4607","0.0009","90","","107.539","0.001","90","","1876.7","0.2","100","1","295","1","","","","","","","see text","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H31 Ta -","- C22 H31 Ta -","- C88 H124 Ta4 -","4","1","","Edwin Otten; Auke Meetsma; Bart Hessen","Structure and Reactivity of the β-Agostic [ansa-Cp-arene]Ta(nPr) Cation: Ambivalent Behavior Induced by Intramolecular Arene Coordination","Journal of the American Chemical Society","2007","129","","10100","10101","10.1021/ja073956j","","","0.71073","MoKα","","0.0282","0.0248","","","0.0554","0.0565","","","","","","1.114","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109798","16.061","0.005","18.029","0.005","17.237","0.005","90","","117.258","0.005","90","","4437","2","100","1","100","1","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H31 B Br F20 Ta -","- C49 H31 B Br F20 Ta -","- C196 H124 B4 Br4 F80 Ta4 -","4","1","","Edwin Otten; Auke Meetsma; Bart Hessen","Structure and Reactivity of the β-Agostic [ansa-Cp-arene]Ta(nPr) Cation: Ambivalent Behavior Induced by Intramolecular Arene Coordination","Journal of the American Chemical Society","2007","129","","10100","10101","10.1021/ja073956j","","","0.71073","MoKα","","0.0899","0.0489","","","0.0997","0.1139","","","","","","0.996","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109799","18.087","0.006","11.022","0.004","21.191","0.007","90","","110.293","0.005","90","","3962","2","100","1","100","1","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H28 B F20 O Ta -","- C44 H28 B F20 O Ta -","- C176 H112 B4 F80 O4 Ta4 -","4","1","","Edwin Otten; Auke Meetsma; Bart Hessen","Structure and Reactivity of the β-Agostic [ansa-Cp-arene]Ta(nPr) Cation: Ambivalent Behavior Induced by Intramolecular Arene Coordination","Journal of the American Chemical Society","2007","129","","10100","10101","10.1021/ja073956j","","","0.71073","MoKα","","0.1214","0.0411","","","0.0792","0.1082","","","","","","0.936","","","","has coordinates","178843","2020-10-21","18:00:00",""
"4109800","14.8967","0.0008","15.2744","0.0008","17.686","0.001","90","","94.5624","0.0009","90","","4011.5","0.4","100","1","100","1","","","","","","","see text","7","P 1 21/n 1","-P 2yn","14","","","","- C43.73 H25.38 B Br0.09 F20 O Ta -","- C43.733 H25.377 B Br0.089 F20 O Ta -","- C174.932 H101.508 B4 Br0.356 F80 O4 Ta4 -","4","1","","Edwin Otten; Auke Meetsma; Bart Hessen","Structure and Reactivity of the β-Agostic [ansa-Cp-arene]Ta(nPr) Cation: Ambivalent Behavior Induced by Intramolecular Arene Coordination","Journal of the American Chemical Society","2007","129","","10100","10101","10.1021/ja073956j","","","0.71073","MoKα","","0.0443","0.0334","","","0.0777","0.082","","","","","","1.068","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109801","11.101","0.006","7.937","0.004","14.958","0.008","90","","90.927","0.009","90","","1317.8","1.2","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H10 N O2 -","- C18 H16 O2 -","- C72 H64 O8 -","4","1","","Manabu Wadamoto; Eric M. Phillips; Troy E. Reynolds; Karl A. Scheidt","Enantioselective Synthesis of α,α-Disubstituted Cyclopentenes by an N-Heterocyclic Carbene-Catalyzed Desymmetrization of 1,3-Diketones","Journal of the American Chemical Society","2007","129","","10098","10099","10.1021/ja073987e","","","0.71073","MoKα","","0.1488","0.0826","","","0.1707","0.1955","","","","","","0.969","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109802","6.765","0.002","18.967","0.006","7.707","0.002","90","","90.286","0.005","90","","988.9","0.5","153","2","153","2","","","","","","","","3","P 1 21 1","P 2yb","4","Tricyclic Lactone","","","- C11 H13 O3 -","- C11 H14 O3 -","- C44 H56 O12 -","4","2","","Manabu Wadamoto; Eric M. Phillips; Troy E. Reynolds; Karl A. Scheidt","Enantioselective Synthesis of α,α-Disubstituted Cyclopentenes by an N-Heterocyclic Carbene-Catalyzed Desymmetrization of 1,3-Diketones","Journal of the American Chemical Society","2007","129","","10098","10099","10.1021/ja073987e","","","0.71073","MoKα","","0.1871","0.1608","","","0.4399","0.4531","","","","","","1.655","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109803","9.2308","0.0005","23.025","0.0013","10.6007","0.0006","90","","92.971","0.001","90","","2250","0.2","153","2","153","2","","","","","","","","5","P 1 21 1","P 2yb","4","Cyclopentene Absolute Structure","","","- C26 H24 Br N O2 -","- C26 H24 Br N O2 -","- C104 H96 Br4 N4 O8 -","4","2","","Manabu Wadamoto; Eric M. Phillips; Troy E. Reynolds; Karl A. Scheidt","Enantioselective Synthesis of α,α-Disubstituted Cyclopentenes by an N-Heterocyclic Carbene-Catalyzed Desymmetrization of 1,3-Diketones","Journal of the American Chemical Society","2007","129","","10098","10099","10.1021/ja073987e","","","0.71073","MoKα","","0.0356","0.0305","","","0.0772","0.0798","","","","","","0.836","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109804","5.68908","0.00008","4.75461","0.00008","5.51948","0.00012","90","","121.453","0.0011","90","","127.361","0.004","295","","295","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","Technetium dioxide","Technetium (IV) oxide","","- O7.9 Tc4 -","- O7.9 Tc4.0044 -","- O7.9 Tc4.0044 -","1","0.25","","Efrain E. Rodriguez; Frederic Poineau; Anna Llobet; Alfred P. Sattelberger; Joydeep Bhattacharjee; Umesh V. Waghmare; Thomas Hartmann; Anthony K. Cheetham","Structural Studies of TcO2 by Neutron Powder Diffraction and First-Principles Calculations","Journal of the American Chemical Society","2007","129","33","10244","10248","10.1021/ja0727363","powder diffraction","neutron","","","","","","","","","","0.07578","","1.58","","","","","","","has coordinates,has Fobs","181959","2020-10-21","18:00:00",""
"4109805","10.809","0.0004","14.582","0.0005","14.614","0.0006","100.011","0.0014","101.937","0.0014","91.6","0.0015","2214.41","0.14","130","2","130","2","","","","","","","","7","P -1","-P 1","2","avpPtIVSulf","avpPtIVSulf","","- C47 H55.87 N O3 P2 Pt S -","- C47 H55.866 N O3 P2 Pt S -","- C94 H111.732 N2 O6 P4 Pt2 S2 -","2","1","","Andrew V. Pawlikowski; April D. Getty; Karen I. Goldberg","Alkyl Carbon-Nitrogen Reductive Elimination from Platinum(IV)-Sulfonamide Complexes","Journal of the American Chemical Society","2007","129","","10382","10393","10.1021/ja069191h","","","0.71073","MoKα","","0.0733","0.0467","","","0.1041","0.1147","","","","","","0.973","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109806","11.2082","0.0011","17.1248","0.0016","27.882","0.003","90","","90","","90","","5351.6","0.9","90","2","90","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Y3N@C80adduct.0.5benzene.0.5chloroform","","","- C100.5 H17.5 Cl1.5 N O4 Y3 -","- C100.5 H17.5 Cl1.5 N O4 Y3 -","- C402 H70 Cl6 N4 O16 Y12 -","4","1","","Olena Lukoyanova; Claudia M. Cardona; José Rivera; Leyda Z. Lugo-Morales; Christopher J. Chancellor; Marilyn M. Olmstead; Antonio Rodríguez-Fortea; Josep M. Poblet; Alan L. Balch; Luis Echegoyen","""Open Rather than Closed"" Malonate Methano-Fullerene Derivatives. The Formation of Methanofulleroid Adducts of Y3N@C80","Journal of the American Chemical Society","2007","129","","10423","10430","10.1021/ja071733n","","","0.71073","MoKα","","0.1508","0.1013","","","0.262","0.3006","","","","","","1.143","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109807","16.748","0.002","10.335","0.002","17.844","0.002","90","","114.051","0.001","90","","2820.5","0.7","293","2","293","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","[Me4N]Fe(NS3)(NO)]","tetramethylammonium iron-tri-(2-thiobenzyl)aminenitrosyl","","- C26 H34 Fe N3 O2 S3 -","- C26 H34 Fe N3 O2 S3 -","- C104 H136 Fe4 N12 O8 S12 -","4","1","","Jeanet Conradie; Duncan A. Quarless; Hua-Fen Hsu; Todd C. Harrop; Stephen J. Lippard; Stephen A. Koch; Abhik Ghosh","Electronic Structure and FeNO Conformation of Nonheme Iron-Thiolate-NO Complexes: An Experimental and DFT Study","Journal of the American Chemical Society","2007","129","","10446","10456","10.1021/ja0719982","","x-ray","0.71069","MoKα","","0.1294","0.0633","","","0.1301","0.1493","","","","","","1.038","","","","has coordinates,has disorder","178844","2020-10-21","18:00:00",""
"4109808","17.59","0.001","17.765","0.001","19.847","0.002","90","","90","","90","","6201.9","0.8","293","","273.2","","","","","","","","","7","P b c a","-P 2ac 2ab","61","Fe(PS3*)(NO)","tris(3-phenyl-2-phenylthiolate)phosphine Iron nitrosyl","","- C36 H24 Fe N O P S3 -","- C36 H24 Fe N O P S3 -","- C288 H192 Fe8 N8 O8 P8 S24 -","8","1","","Jeanet Conradie; Duncan A. Quarless; Hua-Fen Hsu; Todd C. Harrop; Stephen J. Lippard; Stephen A. Koch; Abhik Ghosh","Electronic Structure and FeNO Conformation of Nonheme Iron-Thiolate-NO Complexes: An Experimental and DFT Study","Journal of the American Chemical Society","2007","129","","10446","10456","10.1021/ja0719982","","x-ray","0.7107","MoKalpha","","","0.0406","","","0.0242","","","","","2.237","2.237","","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109809","21.3875","0.0006","22.6852","0.0005","18.1795","0.0005","90","","91.494","0.002","90","","8817.3","0.4","220","2","220","2","","","","","","","Synthesized by the authors. See text","6","C 1 2/c 1","-C 2yc","15","","","","- C85 H66 B2 N6 O2 Ru -","- C85 H66 B2 N6 O2 Ru -","- C340 H264 B8 N24 O8 Ru4 -","4","0.5","","Michael W. Cooke; Garry S. Hanan; Frédérique Loiseau; Sebastiano Campagna; Masashi Watanabe; Yasutaka Tanaka","Self-Assembled Light-Harvesting Systems: Ru(II) Complexes Assembled about Rh-Rh Cores","Journal of the American Chemical Society","2007","129","","10479","10488","10.1021/ja072153t","","","1.54178","CuKα","","0.0549","0.0466","","","0.1136","0.1163","","","","","","0.954","","","","has coordinates,has disorder","178844","2020-10-21","18:00:00",""
"4109810","12.9474","0.0003","13.3066","0.0003","19.128","0.0004","90.348","0.002","93.154","0.001","110.644","0.001","3078.06","0.12","220","2","220","2","","","","","","","Synthesized by the authors. See text","8","P -1","-P 1","2","","","","- C69 H54 B F6 N10 O2 P Ru -","- C69 H54 B F6 N10 O2 P Ru -","- C138 H108 B2 F12 N20 O4 P2 Ru2 -","2","1","","Michael W. Cooke; Garry S. Hanan; Frédérique Loiseau; Sebastiano Campagna; Masashi Watanabe; Yasutaka Tanaka","Self-Assembled Light-Harvesting Systems: Ru(II) Complexes Assembled about Rh-Rh Cores","Journal of the American Chemical Society","2007","129","","10479","10488","10.1021/ja072153t","","","1.54178","CuKα","","0.0662","0.0536","","","0.1361","0.1437","","","","","","0.99","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109811","9.5166","0.0007","13.4933","0.001","26.5103","0.0017","89.659","0.004","82.213","0.004","71.513","0.004","3196.3","0.4","220","2","220","2","","","","","","","Synthesized by the authors. See text","8","P -1","-P 1","2","","","","- C130 H102 B4 F8 N14 O8 Rh2 Ru2 -","- C130 H102 B4 F8 N14 O8 Rh2 Ru2 -","- C130 H102 B4 F8 N14 O8 Rh2 Ru2 -","1","0.5","","Michael W. Cooke; Garry S. Hanan; Frédérique Loiseau; Sebastiano Campagna; Masashi Watanabe; Yasutaka Tanaka","Self-Assembled Light-Harvesting Systems: Ru(II) Complexes Assembled about Rh-Rh Cores","Journal of the American Chemical Society","2007","129","","10479","10488","10.1021/ja072153t","","","1.54178","CuKα","","0.1616","0.0708","","","0.1656","0.1905","","","","","","0.852","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109812","12.378","0.002","22.072","0.004","13.876","0.002","90","","92.644","0.002","90","","3787","1.1","173.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C85 H79 Fe2 S4 -","- C85 H79 Fe2 S4 -","- C170 H158 Fe4 S8 -","2","0.5","","Yasuhiro Ohki; Yohei Ikagawa; Kazuyuki Tatsumi","Synthesis of New [8Fe-7S] Clusters: A Topological Link between the Core Structures of P-Cluster, FeMo-co, and FeFe-co of Nitrogenases","Journal of the American Chemical Society","2007","129","","10457","10465","10.1021/ja072256b","","","0.7107","MoKα","","","0.0578","","","","0.0838","","","","","","1.035","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109813","12.48","0.003","15.646","0.004","36.535","0.008","98.077","0.003","89.789","0.002","101.688","0.003","6914","3","113.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C133.5 H149 Fe8 O2 S12 Si4 -","- C133.5 H149 Fe8 O2 S12 Si4 -","- C267 H298 Fe16 O4 S24 Si8 -","2","1","","Yasuhiro Ohki; Yohei Ikagawa; Kazuyuki Tatsumi","Synthesis of New [8Fe-7S] Clusters: A Topological Link between the Core Structures of P-Cluster, FeMo-co, and FeFe-co of Nitrogenases","Journal of the American Chemical Society","2007","129","","10457","10465","10.1021/ja072256b","","","0.7107","MoKα","","","0.0647","","","","0.1351","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109814","28.225","0.006","21.307","0.004","22.393","0.005","90","","123.519","0.002","90","","11227","4","173.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C84 H114 Fe8 N S11 Si2 -","- C84 H114 Fe8 N S11 Si2 -","- C336 H456 Fe32 N4 S44 Si8 -","4","0.5","","Yasuhiro Ohki; Yohei Ikagawa; Kazuyuki Tatsumi","Synthesis of New [8Fe-7S] Clusters: A Topological Link between the Core Structures of P-Cluster, FeMo-co, and FeFe-co of Nitrogenases","Journal of the American Chemical Society","2007","129","","10457","10465","10.1021/ja072256b","","","0.7107","MoKα","","","0.0924","","","","0.1458","","","","","","1.011","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109815","9.763","0.005","11.61","0.005","12.004","0.005","90","","94.268","0.008","90","","1356.9","1.1","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","bis(3,6-di-tert-butyl-o-benzosemiquinonato)copper(II)","","- C28 H40 Cu O4 -","- C28 H40 Cu O4 -","- C56 H80 Cu2 O8 -","2","0.5","","Victor I. Ovcharenko; Elena V. Gorelik; Sergey V. Fokin; Galina V. Romanenko; Vladimir N. Ikorskii; Anna V. Krashilina; Vladimir K. Cherkasov; Gleb A. Abakumov","Ligand Effects on the Ferro- to Antiferromagnetic Exchange Ratio in Bis(o-Semiquinonato)copper(II)","Journal of the American Chemical Society","2007","129","","10512","10521","10.1021/ja072463b","","","0.71073","MoKα","","0.0302","0.0282","","","0.086","0.091","","","","","","0.512","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109816","9.859","0.002","11.654","0.003","12.09","0.003","90","","94.391","0.005","90","","1385","0.6","240","2","240","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","bis(3,6-di-tert-butyl-o-benzosemiquinonato)copper(II)","","- C28 H40 Cu O4 -","- C28 H40 Cu O4 -","- C56 H80 Cu2 O8 -","2","0.5","","Victor I. Ovcharenko; Elena V. Gorelik; Sergey V. Fokin; Galina V. Romanenko; Vladimir N. Ikorskii; Anna V. Krashilina; Vladimir K. Cherkasov; Gleb A. Abakumov","Ligand Effects on the Ferro- to Antiferromagnetic Exchange Ratio in Bis(o-Semiquinonato)copper(II)","Journal of the American Chemical Society","2007","129","","10512","10521","10.1021/ja072463b","","","0.71073","MoKα","","0.0402","0.0358","","","0.1018","0.111","","","","","","0.57","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109817","10.341","0.0017","17.855","0.003","10.3418","0.0017","90","","90.073","0.002","90","","1909.5","0.5","298","2","298","2","","","","","","","","5","P 1 m 1","P -2y","6","","[bis(3,6-di-tert-butyl-o-benzosemiquinonato)(pyridine)copper(II)] ester solvate","","- C37 H55 Cu N O5 -","- C37 H45 Cu N O5 -","- C74 H90 Cu2 N2 O10 -","2","1","","Victor I. Ovcharenko; Elena V. Gorelik; Sergey V. Fokin; Galina V. Romanenko; Vladimir N. Ikorskii; Anna V. Krashilina; Vladimir K. Cherkasov; Gleb A. Abakumov","Ligand Effects on the Ferro- to Antiferromagnetic Exchange Ratio in Bis(o-Semiquinonato)copper(II)","Journal of the American Chemical Society","2007","129","","10512","10521","10.1021/ja072463b","","","0.71073","MoKα","","0.0568","0.0536","","","0.1252","0.1275","","","","","","1.019","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109818","10.3509","0.0015","10.3509","0.0015","36.281","0.007","90","","90","","90","","3887.2","1.1","293","2","293","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","[bis(3,6-di-tert-butyl-o-benzosemiquinonato)(pyridine)copper(II)] toluene solvate","","- C40 H52 Cu N O4 -","- C40 H45 Cu N O4 -","- C160 H180 Cu4 N4 O16 -","4","0.5","","Victor I. Ovcharenko; Elena V. Gorelik; Sergey V. Fokin; Galina V. Romanenko; Vladimir N. Ikorskii; Anna V. Krashilina; Vladimir K. Cherkasov; Gleb A. Abakumov","Ligand Effects on the Ferro- to Antiferromagnetic Exchange Ratio in Bis(o-Semiquinonato)copper(II)","Journal of the American Chemical Society","2007","129","","10512","10521","10.1021/ja072463b","","","0.71073","MoKα","","0.0854","0.0749","","","0.1697","0.178","","","","","","1.059","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109819","19.725","0.012","7.996","0.004","13.812","0.01","90","","126.653","0.017","90","","1747.7","1.9","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","[bis(3,6-di-tert-butyl-o-benzosemiquinonato) (1,4-diazabicyclo(2,2,2)octane)copper(II)]","","- C34 H52 Cu N2 O4 -","- C34 H40 Cu N2 O4 -","- C68 H80 Cu2 N4 O8 -","2","0.5","","Victor I. Ovcharenko; Elena V. Gorelik; Sergey V. Fokin; Galina V. Romanenko; Vladimir N. Ikorskii; Anna V. Krashilina; Vladimir K. Cherkasov; Gleb A. Abakumov","Ligand Effects on the Ferro- to Antiferromagnetic Exchange Ratio in Bis(o-Semiquinonato)copper(II)","Journal of the American Chemical Society","2007","129","","10512","10521","10.1021/ja072463b","","","0.71073","MoKα","","0.1014","0.0654","","","0.1258","0.1405","","","","","","0.969","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109820","22.851","0.003","11.908","0.0017","17.448","0.003","90","","108.99","0.003","90","","4489.4","1.2","240","2","240","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[bis(3,6-di-tert-butyl-o-benzosemiquinonato) (2-(pyridine-3-yl)-4,4,5,5-tetramethyl-4,5-dihydro-1H-imidazole-3-oxide-1-oxyl)) copper(II)] benzene solvate","","- C46 H62 Cu N3 O6 -","- C46 H62 Cu N3 O6 -","- C184 H248 Cu4 N12 O24 -","4","1","","Victor I. Ovcharenko; Elena V. Gorelik; Sergey V. Fokin; Galina V. Romanenko; Vladimir N. Ikorskii; Anna V. Krashilina; Vladimir K. Cherkasov; Gleb A. Abakumov","Ligand Effects on the Ferro- to Antiferromagnetic Exchange Ratio in Bis(o-Semiquinonato)copper(II)","Journal of the American Chemical Society","2007","129","","10512","10521","10.1021/ja072463b","","","0.71073","MoKα","","0.0715","0.058","","","0.1586","0.1754","","","","","","0.672","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109821","7.1324","0.0007","17.6776","0.0017","18.2915","0.0017","90","","90","","90","","2306.3","0.4","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[bis(3,6-di-tert-butyl-catechalato)(1-methylimidazole))copper(II)]","","- C44 H64 Cu2 N8 O4 -","- C44 H64 Cu2 N8 O4 -","- C88 H128 Cu4 N16 O8 -","2","0.5","","Victor I. Ovcharenko; Elena V. Gorelik; Sergey V. Fokin; Galina V. Romanenko; Vladimir N. Ikorskii; Anna V. Krashilina; Vladimir K. Cherkasov; Gleb A. Abakumov","Ligand Effects on the Ferro- to Antiferromagnetic Exchange Ratio in Bis(o-Semiquinonato)copper(II)","Journal of the American Chemical Society","2007","129","","10512","10521","10.1021/ja072463b","","","0.71073","MoKα","","0.0356","0.0328","","","0.0824","0.0847","","","","","","0.955","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109822","5.958","","7.596","","15.6096","","81.25","","86.56","","89.8","","696.952","","293","","293","","","","0.00000001","","","","sigma Aldrich","2","P -1","-P 1","2","pentacene","pentacene","","- C22 H14 -","- C22 H14 -","- C44 H28 -","2","1","","Stefan Schiefer; Martin Huth; Alexander Dobrinevski; Bert Nickel","Determination of the Crystal Structure of Substrate-Induced Pentacene Polymorphs in Fiber Structured Thin Films","Journal of the American Chemical Society","2007","129","","10316","10317","10.1021/ja0730516","","x-ray","1.181","synchrotron","","","","","","","","","","","","","","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109823","11.2634","0.0005","13.24","0.0006","16.9092","0.0008","83.795","0.002","86.868","0.002","85.173","0.002","2495.3","0.2","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C52 H80 N2 P4 Pd2 -","- C52 H80 N2 P4 Pd2 -","- C104 H160 N4 P8 Pd4 -","2","1","","Claudia M. Fafard; Debashis Adhikari; Bruce M. Foxman; Daniel J. Mindiola; Oleg V. Ozerov","Addition of Ammonia, Water, and Dihydrogen Across a Single Pd-Pd Bond","Journal of the American Chemical Society","2007","129","","10318","10319","10.1021/ja0731571","","","0.71073","MoKα","","0.0636","0.0414","","0.1181","0.0901","0.1181","","","","","","0.9786","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109824","14.2616","0.0004","16.1525","0.0005","16.4867","0.0005","90","","90","","90","","3797.9","0.2","90","2","90","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C22 H12 Co3 O16 -","- C22 H12 Co3 O16 -","- C88 H48 Co12 O64 -","4","0.5","","Zhuojia Lin; David S. Wragg; John E. Warren; Russell E. Morris","Anion Control in the Ionothermal Synthesis of Coordination Polymers","Journal of the American Chemical Society","2007","129","","10334","10335","10.1021/ja0737671","","","0.6713","synchrotron","","0.0363","0.0315","","","0.0994","0.1019","","","","","","0.923","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109825","15.425","0.002","12.1842","0.0016","16.059","0.002","90","","90","","90","","3018.1","0.7","113","2","113","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C29 H25 Co1.3 Li1.4 N4 O12 -","- C29 H25 Co1.3 Li1.4 N4 O12 -","- C116 H100 Co5.2 Li5.6 N16 O48 -","4","0.5","","Zhuojia Lin; David S. Wragg; John E. Warren; Russell E. Morris","Anion Control in the Ionothermal Synthesis of Coordination Polymers","Journal of the American Chemical Society","2007","129","","10334","10335","10.1021/ja0737671","","","0.71073","MoKα","","0.1091","0.0882","","","0.2111","0.2199","","","","","","1.198","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109826","23.705","0.003","23.705","0.003","11.409","0.002","90","","90","","90","","6411","1.6","113","2","113","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C16 H26 Co5 O21 -","- C16 H26 Co5 O21 -","- C128 H208 Co40 O168 -","8","0.5","","Zhuojia Lin; David S. Wragg; John E. Warren; Russell E. Morris","Anion Control in the Ionothermal Synthesis of Coordination Polymers","Journal of the American Chemical Society","2007","129","","10334","10335","10.1021/ja0737671","","","0.71073","MoKα","","0.1034","0.0846","","","0.2071","0.2224","","","","","","1.11","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109827","6.5794","0.001","16.775","0.003","27.264","0.004","90","","93.944","0.004","90","","3002","0.8","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H35 Co2 N4 O24 -","- C56 H35 Co2 N4 O24 -","- C112 H70 Co4 N8 O48 -","2","0.5","","Zhuojia Lin; David S. Wragg; John E. Warren; Russell E. Morris","Anion Control in the Ionothermal Synthesis of Coordination Polymers","Journal of the American Chemical Society","2007","129","","10334","10335","10.1021/ja0737671","","","0.71073","MoKα","","0.0918","0.0772","","","0.1907","0.2012","","","","","","1.065","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109828","9.932","0.0005","11.929","0.0006","21.983","0.0006","82.796","0.003","87.779","0.003","81.784","0.002","2556.9","0.2","120","","120","","","","","","","","","5","P -1","-P 1","2","","(Me5C5)Fe[(t-Bu2MeSi)3PhGeSi2C2], Heavy Ferrocene","","- C45 H84 Fe Ge Si5 -","- C45 H84 Fe Ge Si5 -","- C90 H168 Fe2 Ge2 Si10 -","2","1","","Vladimir Ya. Lee; Risa Kato; Akira Sekiguchi; Andreas Krapp; Gernot Frenking","Heavy Ferrocene: A Sandwich Complex Containing Si and Ge Atoms","Journal of the American Chemical Society","2007","129","","10340","10341","10.1021/ja0740162","","","0.7107","MoKα","","0.0702","0.0524","","","0.1461","0.1567","","","","","","1.034","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109829","12.467","0.003","15.301","0.004","14.892","0.004","90","","90.615","0.005","90","","2840.6","1.3","103","2","103","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H22 N O5 -","- C14 H22 N O5 -","- C112 H176 N8 O40 -","8","2","","Ilia Korboukh; Praveen Kumar; Steven M. Weinreb","Construction of Bridged and Fused Ring Systems via Intramolecular Michael Reactions of Vinylnitroso Compounds","Journal of the American Chemical Society","2007","129","","10342","10343","10.1021/ja074108r","","","0.71073","MoKα","","0.1498","0.1072","","","0.223","0.24","","","","","","1.193","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109830","6.0259","0.0009","8.3222","0.0013","16.08","0.003","90","","98.31","0.002","90","","797.9","0.2","193","2","193","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H24 O3 -","- C19 H24 O3 -","- C38 H48 O6 -","2","1","","Ying-Yeung Yeung; Rong-Jie Chein; E. J. Corey","Conversion of Torgov's Synthesis of Estrone into a Highly Enantioselective and Efficient Process","Journal of the American Chemical Society","2007","129","","10346","10347","10.1021/ja0742434","","","0.71073","MoKα","","0.0493","0.0469","","","0.1218","0.1236","","","","","","1.039","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109831","20.2511","0.0005","16.419","0.0004","28.0348","0.0007","90","","90","","90","","9321.6","0.4","98","2","98","2","","","","","","","","10","P b c a","-P 2ac 2ab","61","","","","- C39 H75 Al B Br Cl3 N P2 Pt Si -","- C39 H75 Al B Br Cl3 N P2 Pt Si -","- C312 H600 Al8 B8 Br8 Cl24 N8 P16 Pt8 Si8 -","8","1","","Holger Braunschweig; Krzysztof Radacki; Daniela Rais; Achim Schneider; Fabian Seeler","Reactivity of a Platinum Iminoboryl Complex toward Lewis and Brønsted Acids","Journal of the American Chemical Society","2007","129","","10350","10351","10.1021/ja0742636","","","0.71073","MoKα","","0.0215","0.0163","","","0.0391","0.0429","","","","","","1.125","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4109832","12.5197","0.0003","13.0247","0.0003","27.1871","0.0006","90","","96.61","0.001","90","","4403.8","0.18","97","2","97","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C40 H78 B Br N O P2 Pt Si -","- C40 H78 B Br N O P2 Pt Si -","- C160 H312 B4 Br4 N4 O4 P8 Pt4 Si4 -","4","1","","Holger Braunschweig; Krzysztof Radacki; Daniela Rais; Achim Schneider; Fabian Seeler","Reactivity of a Platinum Iminoboryl Complex toward Lewis and Brønsted Acids","Journal of the American Chemical Society","2007","129","","10350","10351","10.1021/ja0742636","","","0.71073","MoKα","","0.0275","0.0209","","","0.0456","0.048","","","","","","1.016","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109833","5.958","","7.596","","15.6096","","81.25","","86.56","","89.8","","696.952","","293","","293","","","","0.00000001","","","","sigma Aldrich","2","P -1","-P 1","2","pentacene","pentacene","","- C22 H14 -","- C22 H14 -","- C44 H28 -","2","1","","Stefan Schiefer; Martin Huth; Alexander Dobrinevski; Bert Nickel","Determination of the Crystal Structure of Substrate-Induced Pentacene Polymorphs in Fiber Structured Thin Films","Journal of the American Chemical Society","2007","129","","10316","10317","10.1021/ja0730516","","x-ray","1.181","synchrotron","","","","","","","","","","","","","","","4109822","","has coordinates","215354","2020-10-21","18:00:00",""
"4109834","5.959","","7.596","","15.6096","","81.25","","86.56","","89.8","","697.069","","293","","293","","","","0.00000001","","","","sigma Aldrich","2","P -1","-P 1","2","pentacene","pentacene","","- C22 H14 -","- C22 H14 -","- C44 H28 -","2","1","","Stefan Schiefer; Martin Huth; Alexander Dobrinevski; Bert Nickel","Determination of the Crystal Structure of Substrate-Induced Pentacene Polymorphs in Fiber Structured Thin Films","Journal of the American Chemical Society","2007","129","","10316","10317","10.1021/ja0730516","","x-ray","1.181","synchrotron","","","","","","","","","","","","","","","4109822","","has coordinates","215354","2020-10-21","18:00:00",""
"4109835","21.481","0.005","21.481","0.005","15.148","0.005","90","","90","","90","","6990","3","150","2","150","2","","","","","","","","4","I -4","I -4","82","Mn12tert-butyl-acetate","","","- C101 H191 Mn12 O49 -","- C101 H191 Mn12 O49 -","- C202 H382 Mn24 O98 -","2","0.25","","Anne-Laure Barra; Andrea Caneschi; Andrea Cornia; Dante Gatteschi; Lapo Gorini; Leo-Philipp Heiniger; Roberta Sessoli; Lorenzo Sorace","The Origin of Transverse Anisotropy in Axially Symmetric Single Molecule Magnets","Journal of the American Chemical Society","2007","129","","10754","10762","10.1021/ja0717921","","","0.71073","MoKα","","0.0686","0.0568","","","0.145","0.1632","","","","","","1.167","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109836","9.9385","0.0004","18.2555","0.0007","18.91","0.0007","90","","90","","90","","3430.9","0.2","90","1","90","1","","","","","","","","3","P b c a","-P 2ac 2ab","61","C20H30O3","","","- C20 H30 O3 -","- C20 H30 O3 -","- C160 H240 O24 -","8","1","","Joachim Nikolai; Øystein Loe; Paulina M. Dominiak; Oksana O. Gerlitz; Jochen Autschbach; Huw M. L. Davies","Mechanistic Studies of UV Assisted [4 + 2] Cycloadditions in Synthetic Efforts toward Vibsanin E","Journal of the American Chemical Society","2007","129","","10763","10772","10.1021/ja072090e","","","0.71073","MoKα","","0.0531","0.0392","","","0.0945","0.109","","","","","","1.084","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109837","8.5877","0.0003","14.5481","0.0005","10.6914","0.0003","90","","111.76","0.001","90","","1240.55","0.07","90","2","90","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","7,7,11-Trimethyl-6-oxa-tetracyclo[6.3.2.0*4,13*.0*2,11*] tridecan-3-one","","- C15 H22 O2 -","- C15 H22 O2 -","- C60 H88 O8 -","4","1","","Joachim Nikolai; Øystein Loe; Paulina M. Dominiak; Oksana O. Gerlitz; Jochen Autschbach; Huw M. L. Davies","Mechanistic Studies of UV Assisted [4 + 2] Cycloadditions in Synthetic Efforts toward Vibsanin E","Journal of the American Chemical Society","2007","129","","10763","10772","10.1021/ja072090e","","","0.71073","MoKα","","0.0393","0.0369","","","0.0974","0.1001","","","","","","1.041","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109838","10.923","0.002","16.311","0.003","18.734","0.003","75.545","0.002","76.371","0.002","77.167","0.002","3093.4","0.9","90","2","90","2","","","","","","","","4","P -1","-P 1","2","Sc3N@C78[D3h(78:5)](CH2N(C(C6H5)3)CH2)","","","- C114 H34 N2 Sc3 -","- C114 H34 N2 Sc3 -","- C228 H68 N4 Sc6 -","2","1","","Ting Cai; Liaosa Xu; Harry W. Gibson; Harry C. Dorn; Christopher J. Chancellor; Marilyn M. Olmstead; Alan L. Balch","Sc3N@C78: Encapsulated Cluster Regiocontrol of Adduct Docking on an Ellipsoidal Metallofullerene Sphere","Journal of the American Chemical Society","2007","129","","10795","10800","10.1021/ja072345o","","","0.71073","MoKα","","0.1802","0.0679","","","0.1222","0.1469","","","","","","0.816","","","","has coordinates,has disorder","178844","2020-10-21","18:00:00",""
"4109839","11.0587","0.0012","11.3607","0.0013","13.9423","0.0015","76.804","0.001","84.652","0.001","89.438","0.001","1697.8","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H54 La2 Mn N16 O23 -","- C64 H54 La2 Mn N16 O23 -","- C64 H54 La2 Mn N16 O23 -","1","0.5","","Peng Wang; Jian-Ping Ma; Yu-Bin Dong; Ru-Qi Huang","Tunable Luminescent Lanthanide Coordination Polymers Based on Reversible Solid-State Ion-Exchange Monitored by Ion-Dependent Photoinduced Emission Spectra","Journal of the American Chemical Society","2007","129","","10620","10621","10.1021/ja072442h","","","0.71073","MoKα","","0.0388","0.0367","","","0.0953","0.0965","","","","","","1.078","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109840","11.122","0.0011","11.1502","0.0011","27.107","0.003","79.744","0.001","86.15","0.001","89.992","0.001","3300.2","0.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C128 H106 Gd4 Mn2 N32 O45 -","- C128 H106 Gd4 Mn2 N32 O45 -","- C128 H106 Gd4 Mn2 N32 O45 -","1","0.5","","Peng Wang; Jian-Ping Ma; Yu-Bin Dong; Ru-Qi Huang","Tunable Luminescent Lanthanide Coordination Polymers Based on Reversible Solid-State Ion-Exchange Monitored by Ion-Dependent Photoinduced Emission Spectra","Journal of the American Chemical Society","2007","129","","10620","10621","10.1021/ja072442h","","","0.71073","MoKα","","0.0465","0.038","","","0.1011","0.1058","","","","","","1.018","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109841","11.139","0.003","11.154","0.003","27.17","0.008","79.687","0.005","86.145","0.004","89.942","0.005","3313.5","1.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C128 H104 Eu4 Mn2 N32 O44 -","- C128 H104 Eu4 Mn2 N32 O44 -","- C128 H104 Eu4 Mn2 N32 O44 -","1","0.5","","Peng Wang; Jian-Ping Ma; Yu-Bin Dong; Ru-Qi Huang","Tunable Luminescent Lanthanide Coordination Polymers Based on Reversible Solid-State Ion-Exchange Monitored by Ion-Dependent Photoinduced Emission Spectra","Journal of the American Chemical Society","2007","129","","10620","10621","10.1021/ja072442h","","","0.71073","MoKα","","0.1365","0.1244","","","0.2636","0.2694","","","","","","1.293","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109842","11.1188","0.0016","11.1414","0.0016","27.065","0.004","79.742","0.002","86.224","0.002","89.898","0.002","3291.9","0.8","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C128 H106 Mn2 N32 O45 Tb4 -","- C128 H106 Mn2 N32 O45 Tb4 -","- C128 H106 Mn2 N32 O45 Tb4 -","1","0.5","","Peng Wang; Jian-Ping Ma; Yu-Bin Dong; Ru-Qi Huang","Tunable Luminescent Lanthanide Coordination Polymers Based on Reversible Solid-State Ion-Exchange Monitored by Ion-Dependent Photoinduced Emission Spectra","Journal of the American Chemical Society","2007","129","","10620","10621","10.1021/ja072442h","","","0.71073","MoKα","","0.0461","0.0394","","","0.0989","0.1023","","","","","","1.042","","","","has coordinates,has disorder","178844","2020-10-21","18:00:00",""
"4109843","11.7663","0.0013","11.9389","0.0013","19.363","0.002","91.531","0.002","96.811","0.002","114.129","0.002","2456.4","0.5","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H37.33 N10.67 U1.33 -","- C29 H37.3333 N10.6667 U1.33333 -","- C87 H112 N32 U4 -","3","1.5","","Stosh A. Kozimor; Bart M. Bartlett; Jeffrey D. Rinehart; Jeffrey R. Long","Magnetic Exchange Coupling in Chloride-Bridged 5f-3d Heterometallic Complexes Generated via Insertion into a Uranium(IV) Dimethylpyrazolate Dimer","Journal of the American Chemical Society","2007","129","","10672","10674","10.1021/ja0725044","","","0.71073","MoKα","","0.0759","0.0441","","","0.0907","0.0992","","","","","","1.026","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109844","8.6148","0.0008","18.0404","0.0017","8.8525","0.0008","90","","91.258","0.002","90","","1375.5","0.2","170","2","170","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C24 H36 N8 O U -","- C24 H28 N8 O U -","- C48 H56 N16 O2 U2 -","2","0.5","","Stosh A. Kozimor; Bart M. Bartlett; Jeffrey D. Rinehart; Jeffrey R. Long","Magnetic Exchange Coupling in Chloride-Bridged 5f-3d Heterometallic Complexes Generated via Insertion into a Uranium(IV) Dimethylpyrazolate Dimer","Journal of the American Chemical Society","2007","129","","10672","10674","10.1021/ja0725044","","","0.71073","MoKα","","0.0421","0.0323","","","0.0721","0.0746","","","","","","1.007","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109845","11.486","0.002","12.158","0.002","14.894","0.003","72.521","0.002","76.769","0.003","73.953","0.002","1882.3","0.6","143","2","143","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H88 Cl10 N20 Ni U2 -","- C54 H88 Cl10 N20 Ni U2 -","- C54 H88 Cl10 N20 Ni U2 -","1","0.5","","Stosh A. Kozimor; Bart M. Bartlett; Jeffrey D. Rinehart; Jeffrey R. Long","Magnetic Exchange Coupling in Chloride-Bridged 5f-3d Heterometallic Complexes Generated via Insertion into a Uranium(IV) Dimethylpyrazolate Dimer","Journal of the American Chemical Society","2007","129","","10672","10674","10.1021/ja0725044","","","0.71073","MoKα","","0.057","0.0479","","","0.1343","0.1444","","","","","","1.097","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109846","11.4245","0.0015","12.2422","0.0016","14.9852","0.0019","72.148","0.002","76.875","0.002","73.823","0.002","1892.8","0.4","165","","165","","","","","","","","","6","P -1","-P 1","2","","","","- C54 H88 Cl10 Cu N20 U2 -","- C54 H88 Cl10 Cu N20 U2 -","- C54 H88 Cl10 Cu N20 U2 -","1","0.5","","Stosh A. Kozimor; Bart M. Bartlett; Jeffrey D. Rinehart; Jeffrey R. Long","Magnetic Exchange Coupling in Chloride-Bridged 5f-3d Heterometallic Complexes Generated via Insertion into a Uranium(IV) Dimethylpyrazolate Dimer","Journal of the American Chemical Society","2007","129","","10672","10674","10.1021/ja0725044","","","0.71073","MoKα","","0.0687","0.0472","","","0.0965","0.1024","","","","","","1.001","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109847","11.4596","0.0014","12.2197","0.0015","14.9748","0.0018","72.156","0.002","76.694","0.002","73.785","0.002","1892.6","0.4","165","2","165","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H88 Cl10 N20 U2 Zn -","- C54 H88 Cl10 N20 U2 Zn -","- C54 H88 Cl10 N20 U2 Zn -","1","0.5","","Stosh A. Kozimor; Bart M. Bartlett; Jeffrey D. Rinehart; Jeffrey R. Long","Magnetic Exchange Coupling in Chloride-Bridged 5f-3d Heterometallic Complexes Generated via Insertion into a Uranium(IV) Dimethylpyrazolate Dimer","Journal of the American Chemical Society","2007","129","","10672","10674","10.1021/ja0725044","","","0.71073","MoKα","","0.0565","0.042","","","0.0901","0.0941","","","","","","1.041","","","","has coordinates,has disorder","178844","2020-10-21","18:00:00",""
"4109848","11.813","0.002","18.933","0.004","46.577","0.009","90","","90","","90","","10417","3","113","2","113","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C29 H42.67 K N10 O U -","- C29 H42.6667 K N10 O U -","- C348 H512 K12 N120 O12 U12 -","12","3","","Stosh A. Kozimor; Bart M. Bartlett; Jeffrey D. Rinehart; Jeffrey R. Long","Magnetic Exchange Coupling in Chloride-Bridged 5f-3d Heterometallic Complexes Generated via Insertion into a Uranium(IV) Dimethylpyrazolate Dimer","Journal of the American Chemical Society","2007","129","","10672","10674","10.1021/ja0725044","","","0.71073","MoKα","","0.1046","0.0697","","","0.1252","0.1333","","","","","","1.11","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109849","10.026","0.003","10.8","0.003","12.502","0.003","75.06","0.02","80.43","0.02","87.14","0.02","1289.7","0.6","293","","293","","","","","","","","","4","P -1","-P 1","2","TTFIm-Me2TCNQ","","","- C25 H17 N7 S4 -","- C25 H17 N7 S4 -","- C50 H34 N14 S8 -","2","1","","Tsuyoshi Murata; Yasushi Morita; Yumi Yakiyama; Kozo Fukui; Hideki Yamochi; Gunzi Saito; Kazuhiro Nakasuji","Hydrogen-Bond Interaction in Organic Conductors: Redox Activation, Molecular Recognition, Structural Regulation, and Proton Transfer in Donor-Acceptor Charge-Transfer Complexes of TTF-Imidazole","Journal of the American Chemical Society","2007","129","","10837","10846","10.1021/ja072607m","","","0.71073","MoKα","","0.1245","0.0515","","","0.1177","0.1537","","","","","","0.995","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109850","3.7573","0.0002","12.2435","0.0004","15.8037","0.0005","93.996","0.003","85.915","0.003","82.138","0.003","716.02","0.05","293.1","","","","","","","","","","","6","P -1","-P 1","2","TTFIm-QCl4","","","- C24 H12 Cl4 N4 O2 S8 -","- C24 H12 Cl4 N4 O2 S8 -","- C24 H12 Cl4 N4 O2 S8 -","1","0.5","","Tsuyoshi Murata; Yasushi Morita; Yumi Yakiyama; Kozo Fukui; Hideki Yamochi; Gunzi Saito; Kazuhiro Nakasuji","Hydrogen-Bond Interaction in Organic Conductors: Redox Activation, Molecular Recognition, Structural Regulation, and Proton Transfer in Donor-Acceptor Charge-Transfer Complexes of TTF-Imidazole","Journal of the American Chemical Society","2007","129","","10837","10846","10.1021/ja072607m","","","1.5418","CuKα","","","0.058","","","","0.171","","","","","","1.068","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109851","26.714","0.005","7.2769","0.0015","28.486","0.006","90","","109.406","0.009","90","","5222.9","1.8","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","TTFIm-TENF","","","- C46 H23 N13 O18 S8 -","- C46 H23 N13 O18 S8 -","- C184 H92 N52 O72 S32 -","4","1","","Tsuyoshi Murata; Yasushi Morita; Yumi Yakiyama; Kozo Fukui; Hideki Yamochi; Gunzi Saito; Kazuhiro Nakasuji","Hydrogen-Bond Interaction in Organic Conductors: Redox Activation, Molecular Recognition, Structural Regulation, and Proton Transfer in Donor-Acceptor Charge-Transfer Complexes of TTF-Imidazole","Journal of the American Chemical Society","2007","129","","10837","10846","10.1021/ja072607m","","","0.71075","MoKα","","0.0851","0.0479","","","0.1182","0.1277","","","","","","0.917","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109852","9.915","0.004","11.356","0.004","19.254","0.007","73.67","0.02","81.53","0.02","74.6","0.02","1999.6","1.3","200","2","200","2","","","","","","","","5","P -1","-P 1","2","TTFIm-I5","","","- C18 H12 I10 N4 S8 -","- C18 H12 I10 N4 S8 -","- C36 H24 I20 N8 S16 -","2","1","","Tsuyoshi Murata; Yasushi Morita; Yumi Yakiyama; Kozo Fukui; Hideki Yamochi; Gunzi Saito; Kazuhiro Nakasuji","Hydrogen-Bond Interaction in Organic Conductors: Redox Activation, Molecular Recognition, Structural Regulation, and Proton Transfer in Donor-Acceptor Charge-Transfer Complexes of TTF-Imidazole","Journal of the American Chemical Society","2007","129","","10837","10846","10.1021/ja072607m","","","0.71075","MoKα","","0.115","0.0714","","","0.1741","0.2094","","","","","","0.878","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109853","25.3","0.019","3.799","0.003","21.166","0.016","90","","90","","90","","2034","3","113","2","113","2","","","","","","","","6","P n a 21","P 2c -2n","33","TTFIm-HCA","","","- C15 H10 Cl2 N2 O5 S4 -","- C15 H8 Cl2 N2 O5 S4 -","- C60 H32 Cl8 N8 O20 S16 -","4","1","","Tsuyoshi Murata; Yasushi Morita; Yumi Yakiyama; Kozo Fukui; Hideki Yamochi; Gunzi Saito; Kazuhiro Nakasuji","Hydrogen-Bond Interaction in Organic Conductors: Redox Activation, Molecular Recognition, Structural Regulation, and Proton Transfer in Donor-Acceptor Charge-Transfer Complexes of TTF-Imidazole","Journal of the American Chemical Society","2007","129","","10837","10846","10.1021/ja072607m","","","0.7107","MoKα","","0.1128","0.0721","","","0.1771","0.2207","","","","","","0.99","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109854","9.543","0.004","11.055","0.005","11.867","0.005","81.89","0.02","66.33","0.02","65.98","0.02","1047","0.8","200.2","","","","","","","","","","","5","P -1","-P 1","2","TTFIm-NA","","","- C17 H10 N5 O8 S4 -","- C17 H10 N5 O8 S4 -","- C34 H20 N10 O16 S8 -","2","1","","Tsuyoshi Murata; Yasushi Morita; Yumi Yakiyama; Kozo Fukui; Hideki Yamochi; Gunzi Saito; Kazuhiro Nakasuji","Hydrogen-Bond Interaction in Organic Conductors: Redox Activation, Molecular Recognition, Structural Regulation, and Proton Transfer in Donor-Acceptor Charge-Transfer Complexes of TTF-Imidazole","Journal of the American Chemical Society","2007","129","","10837","10846","10.1021/ja072607m","","","0.7107","MoKα","","","0.0636","","","","0.1538","","","","","","2.525","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109855","13.9561","0.0004","22.5253","0.0006","24.9183","0.0006","90","","121.322","0.003","90","","6691.8","0.4","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Compound 1","","","- C74 H90 I2 Zn2 -","- C74 H90 I2 Zn2 -","- C296 H360 I8 Zn8 -","4","1","","Zhongliang Zhu; Marcin Brynda; Robert J. Wright; Roland C. Fischer; W. Alexander Merrill; Eric Rivard; Robert Wolf; James C. Fettinger; Marilyn M. Olmstead; Philip P. Power","Synthesis and Characterization of the Homologous M-M Bonded Series Ar'MMAr' (M = Zn, Cd, or Hg; Ar' = C6H3-2,6-(C6H3-2,6-Pri2)2) and Related Arylmetal Halides and Hydride Species","Journal of the American Chemical Society","2007","129","","10847","10857","10.1021/ja072682x","","","0.71073","MoKα","","0.0583","0.0317","","","0.0737","0.0841","","","","","","1.013","","","","has coordinates,has disorder","178844","2020-10-21","18:00:00",""
"4109856","11.2906","0.0008","18.915","0.0012","26.6677","0.0017","90","","90","","90","","5695.2","0.7","90","2","90","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Compound 2","","","- C60 H74 Cd2 I2 -","- C60 H74 Cd2 I2 -","- C240 H296 Cd8 I8 -","4","1","","Zhongliang Zhu; Marcin Brynda; Robert J. Wright; Roland C. Fischer; W. Alexander Merrill; Eric Rivard; Robert Wolf; James C. Fettinger; Marilyn M. Olmstead; Philip P. Power","Synthesis and Characterization of the Homologous M-M Bonded Series Ar'MMAr' (M = Zn, Cd, or Hg; Ar' = C6H3-2,6-(C6H3-2,6-Pri2)2) and Related Arylmetal Halides and Hydride Species","Journal of the American Chemical Society","2007","129","","10847","10857","10.1021/ja072682x","","","0.71073","MoKα","","0.059","0.0407","","","0.0804","0.0879","","","","","","1.103","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109857","16.7028","0.0018","20.891","0.002","7.9572","0.0009","90","","90","","90","","2776.6","0.5","90","2","90","2","","","","","","","","4","P n m a","-P 2ac 2n","62","Compound 3","","","- C30 H37 Hg I -","- C30 H37 Hg I -","- C120 H148 Hg4 I4 -","4","0.5","","Zhongliang Zhu; Marcin Brynda; Robert J. Wright; Roland C. Fischer; W. Alexander Merrill; Eric Rivard; Robert Wolf; James C. Fettinger; Marilyn M. Olmstead; Philip P. Power","Synthesis and Characterization of the Homologous M-M Bonded Series Ar'MMAr' (M = Zn, Cd, or Hg; Ar' = C6H3-2,6-(C6H3-2,6-Pri2)2) and Related Arylmetal Halides and Hydride Species","Journal of the American Chemical Society","2007","129","","10847","10857","10.1021/ja072682x","","","0.71073","MoKα","","0.0364","0.0302","","","0.0718","0.0753","","","","","","1.118","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109858","15.243","0.0009","17.3351","0.0011","15.0018","0.0009","90","","120.534","0.001","90","","3414.4","0.4","223","2","223","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","Compound 5","","","- C78 H92 Cd2 -","- C78 H96 Cd2 -","- C156 H192 Cd4 -","2","0.25","","Zhongliang Zhu; Marcin Brynda; Robert J. Wright; Roland C. Fischer; W. Alexander Merrill; Eric Rivard; Robert Wolf; James C. Fettinger; Marilyn M. Olmstead; Philip P. Power","Synthesis and Characterization of the Homologous M-M Bonded Series Ar'MMAr' (M = Zn, Cd, or Hg; Ar' = C6H3-2,6-(C6H3-2,6-Pri2)2) and Related Arylmetal Halides and Hydride Species","Journal of the American Chemical Society","2007","129","","10847","10857","10.1021/ja072682x","","","0.71073","MoKα","","0.0569","0.0363","","","0.0915","0.1018","","","","","","1.045","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109859","17.2416","0.0009","25.4186","0.0013","15.1465","0.0008","90","","90","","90","","6638.1","0.6","90","2","90","2","","","","","","","","4","C c c a :2","-C 2a 2ac","68","Compound 6","","","- C78 H74 D18 Hg2 -","- C78 H74 D18 Hg2 -","- C312 H296 D72 Hg8 -","4","0.25","","Zhongliang Zhu; Marcin Brynda; Robert J. Wright; Roland C. Fischer; W. Alexander Merrill; Eric Rivard; Robert Wolf; James C. Fettinger; Marilyn M. Olmstead; Philip P. Power","Synthesis and Characterization of the Homologous M-M Bonded Series Ar'MMAr' (M = Zn, Cd, or Hg; Ar' = C6H3-2,6-(C6H3-2,6-Pri2)2) and Related Arylmetal Halides and Hydride Species","Journal of the American Chemical Society","2007","129","","10847","10857","10.1021/ja072682x","","","0.71073","MoKα","","0.0447","0.0192","","","0.0404","0.0508","","","","","","1.13","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109860","20.5438","0.0008","15.7065","0.0006","16.3757","0.0006","90","","90","","90","","5284","0.3","90","2","90","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","Compound 9","","","- C60 H76 Cd2 -","- C60 H76 Cd2 -","- C240 H304 Cd8 -","4","0.5","","Zhongliang Zhu; Marcin Brynda; Robert J. Wright; Roland C. Fischer; W. Alexander Merrill; Eric Rivard; Robert Wolf; James C. Fettinger; Marilyn M. Olmstead; Philip P. Power","Synthesis and Characterization of the Homologous M-M Bonded Series Ar'MMAr' (M = Zn, Cd, or Hg; Ar' = C6H3-2,6-(C6H3-2,6-Pri2)2) and Related Arylmetal Halides and Hydride Species","Journal of the American Chemical Society","2007","129","","10847","10857","10.1021/ja072682x","","","0.71073","MoKα","","0.0766","0.0487","","","0.1176","0.1437","","","","","","1.052","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109861","12.3128","0.0018","8.821","0.0013","18.775","0.003","90","","106.79","0.003","90","","1952.2","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H23 Br O2 -","- C22 H23 Br O2 -","- C88 H92 Br4 O8 -","4","1","","Zhenhua Gu; Xinke Wang; Wei Shu; Shengming Ma","Palladium Acetate-Catalyzed Cyclization Reaction of 2,3-Allenoic Acids in the Presence of Simple Allenes: An Efficient Synthesis of 4-(1'-Bromoalk-2'(Z)-en-2'-yl)furan-2(5H)-one Derivatives and the Synthetic Application","Journal of the American Chemical Society","2007","129","","10948","10956","10.1021/ja072790j","","","0.71073","MoKα","","0.1407","0.0685","","","0.1974","0.2226","","","","","","0.834","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109862","7.8406","0.001","11.7468","0.0015","12.4428","0.0016","76.331","0.002","75.28","0.002","89.708","0.002","1075.2","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H26 Br2 O2 -","- C23 H26 Br2 O2 -","- C46 H52 Br4 O4 -","2","1","","Zhenhua Gu; Xinke Wang; Wei Shu; Shengming Ma","Palladium Acetate-Catalyzed Cyclization Reaction of 2,3-Allenoic Acids in the Presence of Simple Allenes: An Efficient Synthesis of 4-(1'-Bromoalk-2'(Z)-en-2'-yl)furan-2(5H)-one Derivatives and the Synthetic Application","Journal of the American Chemical Society","2007","129","","10948","10956","10.1021/ja072790j","","","0.71073","MoKα","","0.0871","0.0603","","","0.1625","0.1837","","","","","","0.935","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109863","27.7307","0.0011","9.6208","0.0004","14.9968","0.0005","90","","90","","90","","4001","0.3","100","2","100","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C18 H17 Cl2 N O5 W -","- C18 H17 Cl2 N O5 W -","- C144 H136 Cl16 N8 O40 W8 -","8","1","","Andrew B. Jackson; Cynthia K. Schauer; Peter S. White; Joseph L. Templeton","Tungsten(II) Monocarbonyl Bis(acetylacetonate): A Fourteen-Electron Docking Site for η2Four-Electron Donor Ligands","Journal of the American Chemical Society","2007","129","","10628","10629","10.1021/ja0728270","","","0.71073","MoKα","","0.0468","0.041","","","0.0944","0.0977","","","","","","1.072","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109864","8.9096","0.0002","39.8596","0.0009","13.1378","0.0003","90","","97.651","0.001","90","","4624.13","0.18","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H25 N O5 W -","- C24 H25 N O5 W -","- C192 H200 N8 O40 W8 -","8","2","","Andrew B. Jackson; Cynthia K. Schauer; Peter S. White; Joseph L. Templeton","Tungsten(II) Monocarbonyl Bis(acetylacetonate): A Fourteen-Electron Docking Site for η2Four-Electron Donor Ligands","Journal of the American Chemical Society","2007","129","","10628","10629","10.1021/ja0728270","","","0.71073","MoKα","","0.0733","0.0425","","","0.0714","0.0798","","","","","","1.024","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109865","7.7644","0.0004","8.5412","0.0004","29.7831","0.0013","90","","90","","90","","1975.13","0.16","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H18 Cl2 O6 W -","- C18 H18 Cl2 O6 W -","- C72 H72 Cl8 O24 W4 -","4","1","","Andrew B. Jackson; Cynthia K. Schauer; Peter S. White; Joseph L. Templeton","Tungsten(II) Monocarbonyl Bis(acetylacetonate): A Fourteen-Electron Docking Site for η2Four-Electron Donor Ligands","Journal of the American Chemical Society","2007","129","","10628","10629","10.1021/ja0728270","","","0.71073","MoKα","","0.025","0.0219","","","0.0423","0.0433","","","","","","1.039","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109866","8.9457","0.0001","13.5475","0.0002","26.6866","0.0004","90","","90","","90","","3234.2","0.08","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H20 O6 W -","- C14 H20 O6 W -","- C112 H160 O48 W8 -","8","2","","Andrew B. Jackson; Cynthia K. Schauer; Peter S. White; Joseph L. Templeton","Tungsten(II) Monocarbonyl Bis(acetylacetonate): A Fourteen-Electron Docking Site for η2Four-Electron Donor Ligands","Journal of the American Chemical Society","2007","129","","10628","10629","10.1021/ja0728270","","","0.71073","MoKα","","0.0516","0.0437","","","0.0898","0.0929","","","","","","1.107","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109867","8.9216","0.0008","6.9662","0.0006","11.5578","0.001","90","","99.224","0.004","90","","709.02","0.11","228","2","228","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H13 N O7 -","- C14 H13 N O7 -","- C28 H26 N2 O14 -","2","1","","Hexin Xie; Liansuo Zu; Hao Li; Jian Wang; Wei Wang","Organocatalytic Enantioselective Cascade Michael-Alkylation Reactions: Synthesis of Chiral Cyclopropanes and Investigation of Unexpected Organocatalyzed Stereoselective Ring Opening of Cyclopropanes","Journal of the American Chemical Society","2007","129","","10886","10894","10.1021/ja073262a","","","0.71073","MoKα","","0.0367","0.0337","","","0.0763","0.0786","","","","","","0.966","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109868","11.5548","0.0007","14.7492","0.0008","11.6438","0.0007","90","","92.817","0.003","90","","1982","0.2","228","2","228","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H18 Br N O5 -","- C20 H18 Br N O5 -","- C80 H72 Br4 N4 O20 -","4","2","","Hexin Xie; Liansuo Zu; Hao Li; Jian Wang; Wei Wang","Organocatalytic Enantioselective Cascade Michael-Alkylation Reactions: Synthesis of Chiral Cyclopropanes and Investigation of Unexpected Organocatalyzed Stereoselective Ring Opening of Cyclopropanes","Journal of the American Chemical Society","2007","129","","10886","10894","10.1021/ja073262a","","","0.71073","MoKα","","0.1093","0.0353","","","0.0515","0.062","","","","","","0.742","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109869","6.6841","0.0006","16.1119","0.0016","29.872","0.003","90","","90","","90","","3217","0.5","143","1","143","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C32 H50 O11 -","- C32 H50 O11 -","- C128 H200 O44 -","4","1","","Amos B. Smith; Dongjoo Lee","Total Synthesis of (+)-Tedanolide","Journal of the American Chemical Society","2007","129","","10957","10962","10.1021/ja073329u","","","0.71073","MoKα","","0.1126","0.065","","","0.142","0.1779","","","","","","1.062","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109870","9.2216","0.0001","11.5343","0.0002","19.5329","0.0003","86.908","0.001","78.177","0.001","76.05","0.001","1973.54","0.05","173","2","173","2","","","","","","","","6","P -1","-P 1","2","[NPN]*ZrTMS","","","- C42 H49 N2 P Si Zr -","- C42 H49 N2 P Si Zr -","- C84 H98 N4 P2 Si2 Zr2 -","2","1","","Erin A. MacLachlan; Fiona M. Hess; Brian O. Patrick; Michael D. Fryzuk","New Side-On Bound Dinitrogen Complexes of Zirconium Supported by an Arene-Bridged Diamidophosphine Ligand and Their Reactivity with Dihydrogen","Journal of the American Chemical Society","2007","129","","10895","10905","10.1021/ja073753v","","","0.71073","MoKα","","0.0492","0.0349","","","0.0916","0.0973","","","","","","1.109","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109871","19.6395","0.0007","19.7497","0.0008","27.0757","0.0012","90","","91.79","0.001","90","","10496.8","0.7","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","{[NPN]*Zr(Py)}2(N2)","","","- C86 H88 N8 P2 Zr2 -","- C86 H88 N8 P2 Zr2 -","- C344 H352 N32 P8 Zr8 -","4","1","","Erin A. MacLachlan; Fiona M. Hess; Brian O. Patrick; Michael D. Fryzuk","New Side-On Bound Dinitrogen Complexes of Zirconium Supported by an Arene-Bridged Diamidophosphine Ligand and Their Reactivity with Dihydrogen","Journal of the American Chemical Society","2007","129","","10895","10905","10.1021/ja073753v","","","0.71073","MoKα","","0.0791","0.0561","","","0.1497","0.163","","","","","","1.02","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109872","23.7417","0.0008","15.2378","0.0005","23.7851","0.0008","90","","98.896","0.002","90","","8501.3","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","{[NPN]*Zr}(N2){[NPN]*Zr(PMe2Ph)}","","","- C84 H88 N6 P3 Zr2 -","- C84 H88 N6 P3 Zr2 -","- C336 H352 N24 P12 Zr8 -","4","1","","Erin A. MacLachlan; Fiona M. Hess; Brian O. Patrick; Michael D. Fryzuk","New Side-On Bound Dinitrogen Complexes of Zirconium Supported by an Arene-Bridged Diamidophosphine Ligand and Their Reactivity with Dihydrogen","Journal of the American Chemical Society","2007","129","","10895","10905","10.1021/ja073753v","","","0.71073","MoKα","","0.0615","0.0396","","","0.0966","0.1045","","","","","","1.017","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109873","11.752","0.004","20.105","0.007","25.035","0.009","97.411","0.007","94.372","0.006","97.689","0.007","5787","4","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C38 H98 Si14 -","- C38 H98 Si14 -","- C152 H392 Si56 -","4","2","","Kei Uchiyama; Selvarajan Nagendran; Shintaro Ishida; Takeaki Iwamoto; Mitsuo Kira","Thermal and Photochemical Cleavage of SiSi Double Bond in Tetrasila-1,3-diene","Journal of the American Chemical Society","2007","129","","10638","10639","10.1021/ja0741473","","","0.7107","MoKα","","0.1123","0.0905","","","0.1703","0.1814","","","","","","1.219","","","","has coordinates,has disorder","178844","2020-10-21","18:00:00",""
"4109874","17.045","0.003","16.461","0.003","12.918","0.002","90","","91.207","0.002","90","","3623.7","1.1","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H58 Si9 -","- C22 H58 Si9 -","- C88 H232 Si36 -","4","1","","Kei Uchiyama; Selvarajan Nagendran; Shintaro Ishida; Takeaki Iwamoto; Mitsuo Kira","Thermal and Photochemical Cleavage of SiSi Double Bond in Tetrasila-1,3-diene","Journal of the American Chemical Society","2007","129","","10638","10639","10.1021/ja0741473","","","0.71073","MoKα","","0.0253","0.0225","","","0.0623","0.0654","","","","","","1.052","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109875","16.7121","0.0006","18.3146","0.0006","22.235","0.0007","90","","110.742","0.002","90","","6364.5","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C106 H21 Dy O4 P -","- C106 H21 Dy O4 P -","- C424 H84 Dy4 O16 P4 -","4","1","","Xiaofang Li; Louzhen Fan; Dongfang Liu; Herman H. Y. Sung; Ian D. Williams; Shihe Yang; Kai Tan; Xin Lu","Synthesis of a Dy@C82 Derivative Bearing a Single Phosphorus Substituent via a Zwitterion Approach","Journal of the American Chemical Society","2007","129","","10636","10637","10.1021/ja074321n","","","0.71073","MoKα","","0.1039","0.0754","","","0.1854","0.2022","","","","","","0.965","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109876","6.894","0.0009","6.886","0.0009","17.7229","0.0016","90","","90","","90","","841.34","0.17","","","","","","","","","","","","4","I m m a","-I 2b 2","74","","","","- Ce N2 O8 P2 -","- Ce N2 O8 P2 -","- Ce4 N8 O32 P8 -","4","0.25","","Miguel A. Salvadó; Pilar Pertierra; Camino Trobajo; José R. García","Crystal Structure of a Cerium(IV) Bis(phosphate) Derivative","Journal of the American Chemical Society","2007","129","","10970","10971","10.1021/ja0710297","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","0.15538","","2.26","","","","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109877","28.594","0.004","31.866","0.004","38.241","0.005","90","","90","","90","","34844","8","173","2","173","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- Au H54 K15 O95 P2 W18 -","- Au K9 O91.5 P2 W18 -","- Au16 K144 O1464 P32 W288 -","16","0.5","","Rui Cao; Travis M. Anderson; Paula M. B. Piccoli; Arthur J. Schultz; Thomas F. Koetzle; Yurii V. Geletii; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Xikui Fang; Martin L. Kirk; Sushilla Knottenbelt; Paul Kögerler; Djamaladdin G. Musaev; Keiji Morokuma; Masashi Takahashi; Craig L. Hill","Terminal Gold-Oxo Complexes","Journal of the American Chemical Society","2007","129","","11118","11133","10.1021/ja072456n","","","0.71073","MoKα","","0.0628","0.054","","","0.2293","0.241","","","","","","1.048","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109878","16.173","0.0009","16.173","0.0009","19.7659","0.0015","90","","90","","120","","4477.4","0.5","173","2","173","2","","","","","","","","6","P 63/m m c","-P 6c 2c","194","","","","- Au1.05 H62 K7.5 O101 P2 W19.95 -","- Au1.05 K7.5 O85.5 P2 W19.95 -","- Au2.1 K15 O171 P4 W39.9 -","2","0.0833333","","Rui Cao; Travis M. Anderson; Paula M. B. Piccoli; Arthur J. Schultz; Thomas F. Koetzle; Yurii V. Geletii; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Xikui Fang; Martin L. Kirk; Sushilla Knottenbelt; Paul Kögerler; Djamaladdin G. Musaev; Keiji Morokuma; Masashi Takahashi; Craig L. Hill","Terminal Gold-Oxo Complexes","Journal of the American Chemical Society","2007","129","","11118","11133","10.1021/ja072456n","","","0.71073","MoKα","","0.0639","0.0634","","","0.2677","0.2683","","","","","","1.248","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109879","25.956","0.002","19.0818","0.0015","33.801","0.003","90","","90","","90","","16741","2","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- H65.5 K18.5 O172.75 P4 W40 -","- K18.5 O172.75 P4 W40 -","- K74 O691 P16 W160 -","4","1","","Rui Cao; Travis M. Anderson; Paula M. B. Piccoli; Arthur J. Schultz; Thomas F. Koetzle; Yurii V. Geletii; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Xikui Fang; Martin L. Kirk; Sushilla Knottenbelt; Paul Kögerler; Djamaladdin G. Musaev; Keiji Morokuma; Masashi Takahashi; Craig L. Hill","Terminal Gold-Oxo Complexes","Journal of the American Chemical Society","2007","129","","11118","11133","10.1021/ja072456n","","","0.71073","MoKα","","0.0542","0.0483","","","0.1172","0.1209","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109880","28.605","0.005","31.857","0.005","38.273","0.006","90","","90","","90","","34877","10","96","2","96","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- Au H57 K9 O93.5 P2 W18 -","- Au K9 O93.5 P2 W18 -","- Au16 K144 O1496 P32 W288 -","16","0.5","","Rui Cao; Travis M. Anderson; Paula M. B. Piccoli; Arthur J. Schultz; Thomas F. Koetzle; Yurii V. Geletii; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Xikui Fang; Martin L. Kirk; Sushilla Knottenbelt; Paul Kögerler; Djamaladdin G. Musaev; Keiji Morokuma; Masashi Takahashi; Craig L. Hill","Terminal Gold-Oxo Complexes","Journal of the American Chemical Society","2007","129","","11118","11133","10.1021/ja072456n","","","0.71073","MoKα","","0.093","0.0552","","","0.1234","0.1309","","","","","","1.037","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109881","28.721","0.018","31.61","0.04","39.159","0.014","90","","90","","90","","35551","5","30","","30","","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- Au0.88 H20 K12.5 O80 P2 W18 -","- Au0.88 H20 K12.5 O80 P2 W18 -","- Au14.08 H320 K200 O1280 P32 W288 -","16","0.5","","Rui Cao; Travis M. Anderson; Paula M. B. Piccoli; Arthur J. Schultz; Thomas F. Koetzle; Yurii V. Geletii; Elena Slonkina; Britt Hedman; Keith O. Hodgson; Kenneth I. Hardcastle; Xikui Fang; Martin L. Kirk; Sushilla Knottenbelt; Paul Kögerler; Djamaladdin G. Musaev; Keiji Morokuma; Masashi Takahashi; Craig L. Hill","Terminal Gold-Oxo Complexes","Journal of the American Chemical Society","2007","129","","11118","11133","10.1021/ja072456n","powder diffraction","neutron","","neutron,whitebeam","","0.193","0.186","","","","0.104","","","2.99","","","2.99","","","","has coordinates,has Fobs","176467","2020-10-21","18:00:00",""
"4109882","12.3545","0.0011","26.745","0.002","10.6674","0.0009","90","","97.018","0.002","90","","3498.3","0.5","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 La N7 O11 -","- C36 H30 La N7 O11 -","- C144 H120 La4 N28 O44 -","4","1","","Michael Seitz; Allen G. Oliver; Kenneth N. Raymond","The Lanthanide Contraction Revisited","Journal of the American Chemical Society","2007","129","","11153","11160","10.1021/ja072750f","","","0.71073","MoKα","","0.0897","0.061","","","0.1474","0.1598","","","","","","1.05","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109883","12.3482","0.0014","26.594","0.003","10.6089","0.0012","90","","96.581","0.002","90","","3460.9","0.7","157","2","157","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 N7 O11 Pr -","- C36 H30 N7 O11 Pr -","- C144 H120 N28 O44 Pr4 -","4","1","","Michael Seitz; Allen G. Oliver; Kenneth N. Raymond","The Lanthanide Contraction Revisited","Journal of the American Chemical Society","2007","129","","11153","11160","10.1021/ja072750f","","","0.71073","MoKα","","0.086","0.0507","","","0.1086","0.1194","","","","","","1.035","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109884","12.355","0.005","26.521","0.005","10.605","0.005","90","0.005","96.512","0.005","90","0.005","3452","2","156","2","156","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 N7 Nd O11 -","- C36 H30 N7 Nd O11 -","- C144 H120 N28 Nd4 O44 -","4","1","","Michael Seitz; Allen G. Oliver; Kenneth N. Raymond","The Lanthanide Contraction Revisited","Journal of the American Chemical Society","2007","129","","11153","11160","10.1021/ja072750f","","","0.71073","MoKα","","0.0951","0.053","","","0.113","0.1264","","","","","","1.03","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109885","12.38","0.003","26.314","0.005","10.612","0.002","90","","96.47","0.004","90","","3435","1.2","158","2","158","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 Eu N7 O11 -","- C36 H30 Eu N7 O11 -","- C144 H120 Eu4 N28 O44 -","4","1","","Michael Seitz; Allen G. Oliver; Kenneth N. Raymond","The Lanthanide Contraction Revisited","Journal of the American Chemical Society","2007","129","","11153","11160","10.1021/ja072750f","","","0.71073","MoKα","","0.112","0.0584","","","0.1183","0.1345","","","","","","1.008","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109886","12.359","0.0018","26.307","0.004","10.5933","0.0015","90","","96.343","0.003","90","","3423.1","0.9","164","2","164","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 Gd N7 O11 -","- C36 H30 Gd N7 O11 -","- C144 H120 Gd4 N28 O44 -","4","1","","Michael Seitz; Allen G. Oliver; Kenneth N. Raymond","The Lanthanide Contraction Revisited","Journal of the American Chemical Society","2007","129","","11153","11160","10.1021/ja072750f","","","0.71073","MoKα","","0.1054","0.0564","","","0.1138","0.1285","","","","","","1.003","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109887","12.3216","0.0014","26.295","0.003","10.5618","0.0012","90","","96.335","0.002","90","","3401.1","0.7","159","2","159","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 N7 O11 Tb -","- C36 H30 N7 O11 Tb -","- C144 H120 N28 O44 Tb4 -","4","1","","Michael Seitz; Allen G. Oliver; Kenneth N. Raymond","The Lanthanide Contraction Revisited","Journal of the American Chemical Society","2007","129","","11153","11160","10.1021/ja072750f","","","0.71073","MoKα","","0.0849","0.0517","","","0.1189","0.1299","","","","","","1.024","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109888","12.3472","0.0015","26.188","0.003","10.5624","0.0012","90","","96.22","0.002","90","","3395.2","0.7","162","2","162","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 Dy N7 O11 -","- C36 H30 Dy N7 O11 -","- C144 H120 Dy4 N28 O44 -","4","1","","Michael Seitz; Allen G. Oliver; Kenneth N. Raymond","The Lanthanide Contraction Revisited","Journal of the American Chemical Society","2007","129","","11153","11160","10.1021/ja072750f","","","0.71073","MoKα","","0.0725","0.0456","","","0.1027","0.1121","","","","","","1.037","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109889","12.345","0.002","26.153","0.004","10.5557","0.0017","90","","96.306","0.003","90","","3387.4","0.9","161","2","161","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 Ho N7 O11 -","- C36 H30 Ho N7 O11 -","- C144 H120 Ho4 N28 O44 -","4","1","","Michael Seitz; Allen G. Oliver; Kenneth N. Raymond","The Lanthanide Contraction Revisited","Journal of the American Chemical Society","2007","129","","11153","11160","10.1021/ja072750f","","","0.71073","MoKα","","0.1045","0.0551","","","0.1079","0.1219","","","","","","1.013","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109890","12.3589","0.0018","26.132","0.004","10.5565","0.0015","90","","96.277","0.002","90","","3388.9","0.9","165","2","165","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 Er N7 O11 -","- C36 H30 Er N7 O11 -","- C144 H120 Er4 N28 O44 -","4","1","","Michael Seitz; Allen G. Oliver; Kenneth N. Raymond","The Lanthanide Contraction Revisited","Journal of the American Chemical Society","2007","129","","11153","11160","10.1021/ja072750f","","","0.71073","MoKα","","0.0976","0.0489","","","0.0986","0.1118","","","","","","0.993","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109891","12.392","0.0013","26.162","0.003","10.5522","0.0012","90","","96.357","0.003","90","","3400","0.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 N7 O11 Tm -","- C36 H30 N7 O11 Tm -","- C144 H120 N28 O44 Tm4 -","4","1","","Michael Seitz; Allen G. Oliver; Kenneth N. Raymond","The Lanthanide Contraction Revisited","Journal of the American Chemical Society","2007","129","","11153","11160","10.1021/ja072750f","","","0.7749","synchrotron","","0.0597","0.0474","","","0.1107","0.1149","","","","","","1.096","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109892","12.336","0.005","26.006","0.01","10.546","0.004","90","","96.443","0.005","90","","3362","2","158","2","158","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 N7 O11 Yb -","- C36 H30 N7 O11 Yb -","- C144 H120 N28 O44 Yb4 -","4","1","","Michael Seitz; Allen G. Oliver; Kenneth N. Raymond","The Lanthanide Contraction Revisited","Journal of the American Chemical Society","2007","129","","11153","11160","10.1021/ja072750f","","","0.71073","MoKα","","0.1432","0.0594","","","0.1059","0.1312","","","","","","0.964","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109893","12.417","0.002","26.193","0.004","10.5619","0.0017","90","","96.436","0.004","90","","3413.5","0.9","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 Lu N7 O11 -","- C36 H30 Lu N7 O11 -","- C144 H120 Lu4 N28 O44 -","4","1","","Michael Seitz; Allen G. Oliver; Kenneth N. Raymond","The Lanthanide Contraction Revisited","Journal of the American Chemical Society","2007","129","","11153","11160","10.1021/ja072750f","","","0.7749","synchrotron","","0.034","0.0313","","","0.0804","0.082","","","","","","1.097","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109894","12.264","0.009","14.08","0.002","8.444","0.001","101.07","0.008","88.617","0.006","108.563","0.009","1355.4","1","293","2","293","2","","","","","","","","3","P 1","P 1","1","","","","- C56 H72 O18 -","- C56 H68 O18 -","- C56 H68 O18 -","1","1","","Bruno Botta; Ilaria D'Acquarica; Giuliano Delle Monache; Laura Nevola; Danila Tullo; Franco Ugozzoli; Marco Pierini","Nitrosonium Complexes of Resorc[4]arenes: Spectral, Kinetic, and Theoretical Studies","Journal of the American Chemical Society","2007","129","","11202","11212","10.1021/ja072855i","","","1.54178","CuKα","","0.1976","0.0795","","","0.2006","0.2526","","","","","","0.821","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109895","7.9203","0.0002","12.4358","0.0006","13.6015","0.0006","90","","90","","90","","1339.68","0.09","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H18 O3 S -","- C14 H18 O3 S -","- C56 H72 O12 S4 -","4","1","","Mohammad N. Noshi; Ahmad El-Awa; Eduardo Torres; Philip L. Fuchs","Conversion of Cyclic Vinyl Sulfones to Transposed Vinyl Phosphonates","Journal of the American Chemical Society","2007","129","","11242","11247","10.1021/ja072890p","","","0.71073","Mo-Kα","","0.035","0.031","","","0.076","0.078","","","","","","1.052","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109896","9.9976","0.0006","8.4008","0.0003","10.7974","0.0006","90","","108.986","0.003","90","","857.52","0.08","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H23 O5 P S -","- C16 H23 O5 P S -","- C32 H46 O10 P2 S2 -","2","1","","Mohammad N. Noshi; Ahmad El-Awa; Eduardo Torres; Philip L. Fuchs","Conversion of Cyclic Vinyl Sulfones to Transposed Vinyl Phosphonates","Journal of the American Chemical Society","2007","129","","11242","11247","10.1021/ja072890p","","","0.71073","Mo-Kα","","0.047","0.039","","","0.091","0.096","","","","","","1.054","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109897","3.9046","0.0001","3.9046","0.0001","34.4682","0.0013","90","","90","","90","","525.5","0.03","293","2","293","2","","","","","","","synthesis as described","5","I 4/m m m","-I 4 2","139","","Strontium manganese copper oxide sulfide","","- Cu2 Mn2.94 O7.42 S2 Sr4 -","- Cu2 Mn2.936 O7.424 S2 Sr4 -","- Cu4 Mn5.872 O14.848 S4 Sr8 -","2","0.0625","","Geoffrey Hyett; Nicolas Barrier; Simon J. Clarke; Joke Hadermann","Topotactic Oxidative and Reductive Control of the Structures and Properties of Layered Manganese Oxychalcogenides","Journal of the American Chemical Society","2007","129","","11192","11201","10.1021/ja073048m","","x-ray","0.71073","MoKα","","0.049","0.0312","","","0.074","0.0814","","","","","","1.05","","","","has coordinates","178844","2020-10-21","18:00:00",""
"4109898","20.5755","0.0008","20.5755","0.0008","13.6392","0.001","90","","90","","90","","5774.2","0.5","240","2","240","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C31.5 H30 N3 O3 -","- C31 H28 N3 O2.5 -","- C248 H224 N24 O20 -","8","1","","Joseph P. Leonard; Paul Jensen; Thomas McCabe; John E. O'Brien; Robert D. Peacock; Paul E. Kruger; Thorfinnur Gunnlaugsson","Self-Assembly of Chiral Luminescent Lanthanide Coordination Bundles","Journal of the American Chemical Society","2007","129","","10986","10987","10.1021/ja073049e","","","0.71073","MoKα","","0.0589","0.0451","","","0.1104","0.1176","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109899","20.423","0.002","20.423","0.002","13.688","0.003","90","","90","","90","","5709.3","1.5","173","2","173","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C32 H32 N3 O3.5 -","- C31 H28 N3 O2.5 -","- C248 H224 N24 O20 -","8","1","","Joseph P. Leonard; Paul Jensen; Thomas McCabe; John E. O'Brien; Robert D. Peacock; Paul E. Kruger; Thorfinnur Gunnlaugsson","Self-Assembly of Chiral Luminescent Lanthanide Coordination Bundles","Journal of the American Chemical Society","2007","129","","10986","10987","10.1021/ja073049e","","","0.71073","MoKα","","0.0617","0.046","","","0.0948","0.1006","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109900","22.9408","0.0007","22.9408","0.0007","12.998","0.0008","90","","90","","120","","5924.1","0.4","298","2","298","2","","","","","","","","7","P 63 2 2","P 6c 2c","182","","","","- C108.5 H131 F9 N9 O27.5 S3 Tb -","- C96 H81 F9 N9 O15 S3 Tb -","- C192 H162 F18 N18 O30 S6 Tb2 -","2","0.166667","","Joseph P. Leonard; Paul Jensen; Thomas McCabe; John E. O'Brien; Robert D. Peacock; Paul E. Kruger; Thorfinnur Gunnlaugsson","Self-Assembly of Chiral Luminescent Lanthanide Coordination Bundles","Journal of the American Chemical Society","2007","129","","10986","10987","10.1021/ja073049e","","","0.71073","MoKα","","0.0354","0.0339","","","0.0847","0.0855","","","","","","1.116","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109901","22.944","0.001","22.944","0.001","13.002","0.001","90","","90","","120","","5927.6","0.6","298","2","298","2","","","","","","","","7","P 63 2 2","P 6c 2c","182","","","","- C108.5 H131 Eu F9 N9 O27.5 S3 -","- C96 H81 Eu F9 N9 O15 S3 -","- C192 H162 Eu2 F18 N18 O30 S6 -","2","0.166667","","Joseph P. Leonard; Paul Jensen; Thomas McCabe; John E. O'Brien; Robert D. Peacock; Paul E. Kruger; Thorfinnur Gunnlaugsson","Self-Assembly of Chiral Luminescent Lanthanide Coordination Bundles","Journal of the American Chemical Society","2007","129","","10986","10987","10.1021/ja073049e","","","0.71073","MoKα","","0.0346","0.0332","","","0.0857","0.0865","","","","","","1.129","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109902","22.8459","0.0006","22.8459","0.0006","12.8911","0.0004","90","","90","","120","","5826.9","0.3","153","2","153","2","","","","","","","","7","P 63 2 2","P 6c 2c","182","","","","- C109.5 H135 F9 N9 O28.5 S3 Sm -","- C96 H81 F9 N9 O15 S3 Sm -","- C192 H162 F18 N18 O30 S6 Sm2 -","2","0.166667","","Joseph P. Leonard; Paul Jensen; Thomas McCabe; John E. O'Brien; Robert D. Peacock; Paul E. Kruger; Thorfinnur Gunnlaugsson","Self-Assembly of Chiral Luminescent Lanthanide Coordination Bundles","Journal of the American Chemical Society","2007","129","","10986","10987","10.1021/ja073049e","","","0.71073","MoKα","","0.0576","0.0551","","","0.1363","0.1382","","","","","","1.188","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109903","23.098","0.002","23.098","0.002","12.99","0.002","90","","90","","120","","6001.9","1.2","298","2","298","2","","","","","","","","7","P 63 2 2","P 6c 2c","182","","","","- C96 H81 F9 N9 Nd O15 S3 -","- C96 H81 F9 N9 Nd O15 S3 -","- C192 H162 F18 N18 Nd2 O30 S6 -","2","0.166667","","Joseph P. Leonard; Paul Jensen; Thomas McCabe; John E. O'Brien; Robert D. Peacock; Paul E. Kruger; Thorfinnur Gunnlaugsson","Self-Assembly of Chiral Luminescent Lanthanide Coordination Bundles","Journal of the American Chemical Society","2007","129","","10986","10987","10.1021/ja073049e","","","0.71073","MoKα","","0.0521","0.0445","","","0.1179","0.1231","","","","","","1.084","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109904","14.404","0.01","31","0.02","31.23","0.02","90","","90","","90","","13945","16","233","2","233","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","CB10-diamine diiodide hydrate","","","- C86 H168 I2 N52 O62 -","- C86 H88 I2 N52 O22 -","- C344 H352 I8 N208 O88 -","4","0.5","","Simin Liu; Peter Y. Zavalij; Yiu-Fai Lam; Lyle Isaacs","Refolding Foldamers: Triazene-Arylene Oligomers That Change Shape with Chemical Stimuli","Journal of the American Chemical Society","2007","129","","11232","11241","10.1021/ja073320s","","","0.71073","MoKα","","0.147","0.1282","","","0.2711","0.2809","","","","","","1","","","","has coordinates,has disorder","211408","2020-10-21","18:00:00",""
"4109905","14.1949","0.0006","31.3303","0.0012","31.2811","0.0012","90","","90","","90","","13911.7","1","220","2","220","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","CB10","","","- C86 H145 I2 N54 O47.5 -","- C86 H90 I2 N54 O47.5 -","- C344 H360 I8 N216 O190 -","4","0.5","","Simin Liu; Peter Y. Zavalij; Yiu-Fai Lam; Lyle Isaacs","Refolding Foldamers: Triazene-Arylene Oligomers That Change Shape with Chemical Stimuli","Journal of the American Chemical Society","2007","129","","11232","11241","10.1021/ja073320s","","","0.71073","MoKα","","0.0995","0.0792","","","0.1565","0.1625","","","","","","1","","","","has coordinates,has disorder","211408","2020-10-21","18:00:00",""
"4109906","30.756","0.003","14.2653","0.0013","31.74","0.003","90","","90","","90","","13926","2","220","2","220","2","","","","","","","","5","P c a 21","P 2c -2ac","29","CB10 melanime","","","- C90 H189 I2 N52 O71.5 -","- C90 H90 I2 N52 O22 -","- C360 H360 I8 N208 O88 -","4","1","","Simin Liu; Peter Y. Zavalij; Yiu-Fai Lam; Lyle Isaacs","Refolding Foldamers: Triazene-Arylene Oligomers That Change Shape with Chemical Stimuli","Journal of the American Chemical Society","2007","129","","11232","11241","10.1021/ja073320s","","","0.71073","MoKα","","0.0677","0.0532","","","0.119","0.1251","","","","","","1","","","","has coordinates,has disorder","211408","2020-10-21","18:00:00",""
"4109907","17.524","0.002","12.6638","0.0015","34.84","0.004","90","","90.641","0.002","90","","7731.2","1.6","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2CB7<L>I2.30H2O","","","- C114 H178 I2 N68 O62 -","- C114 H118 I1.7362 N68 O32 -","- C228 H236 I3.4724 N136 O64 -","2","0.5","","Simin Liu; Peter Y. Zavalij; Yiu-Fai Lam; Lyle Isaacs","Refolding Foldamers: Triazene-Arylene Oligomers That Change Shape with Chemical Stimuli","Journal of the American Chemical Society","2007","129","","11232","11241","10.1021/ja073320s","","","0.71073","MoKα","","0.0709","0.048","","","0.0919","0.0981","","","","","","1","","","","has coordinates,has disorder","211408","2020-10-21","18:00:00",""
"4109908","5.5649","0.0011","14.526","0.003","27.408","0.006","90","","90","","90","","2215.5","0.8","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H25 Br N2 O2 -","- C28 H25 Br N2 O2 -","- C112 H100 Br4 N8 O8 -","4","1","","Bryan J. Cowen; Scott J. Miller","Enantioselective [3 + 2]-Cycloadditions Catalyzed by a Protected, Multifunctional Phosphine-Containing α-Amino Acid","Journal of the American Chemical Society","2007","129","","10988","10989","10.1021/ja0734243","","","0.71073","MoKα","","0.1273","0.0612","","","0.106","0.1294","","","","","","1.013","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109909","11.361","0.005","12.645","0.006","14.775","0.007","90","","90","","90","","2122.6","1.7","223.1","","","","","","","","","","","4","P c c m","-P 2 2c","49","","","","- C40 H22 N10 Zn -","- C40 H22 N10 Zn -","- C80 H44 N20 Zn2 -","2","0.25","","Satoru Shimomura; Satoshi Horike; Ryotaro Matsuda; Susumu Kitagawa","Guest-Specific Function of a Flexible Undulating Channel in a 7,7,8,8-Tetracyano-p-quinodimethane Dimer-Based Porous Coordination Polymer","Journal of the American Chemical Society","2007","129","","10990","10991","10.1021/ja073505z","","","0.7107","MoKα","","","0.0586","","","","0.0591","","","","","","1.082","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109910","18.813","0.003","17.134","0.003","22.355","0.004","90","","104.37","0.07","90","","6981","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Fmoc-(Aib)2-TOAC-(Aib)2-TOAC-Aib-OMe 2,2,2-trifuoroethanol disolvate","","- C60 H89 F6 N9 O14 -","- C60 H89 F6 N9 O14 -","- C240 H356 F24 N36 O56 -","4","1","","Silvia Carlotto; Paola Cimino; Mirco Zerbetto; Lorenzo Franco; Carlo Corvaja; Marco Crisma; Fernando Formaggio; Claudio Toniolo; Antonino Polimeno; Vincenzo Barone","Unraveling Solvent-Driven Equilibria between α- and 310-Helices through an Integrated Spin Labeling and Computational Approach","Journal of the American Chemical Society","2007","129","","11248","11258","10.1021/ja073516s","","","1.54178","CuKα","","0.1142","0.089","","","0.2441","0.2672","","","","","","1.14","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109911","8.3953","0.0012","9.4464","0.0014","12.695","0.0018","91.388","0.003","102.358","0.003","114.027","0.002","891.2","0.2","153","2","153","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H30 Al2 -","- C15 H30 Al2 -","- C30 H60 Al4 -","2","1","","Werner Uhl; Andrej Vinogradov; Stefan Grimme","C-H Bond Activation by Hyperconjugation with Al-C Bonds and by Chelating Coordination of the Hydride Ion","Journal of the American Chemical Society","2007","129","","11259","11264","10.1021/ja073657u","","","0.71073","MoKα","","0.0814","0.0612","","","0.1479","0.1592","","","","","","1.062","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109912","9.3371","0.001","11.4499","0.0012","11.7615","0.0012","78.416","0.002","85.403","0.002","89.98","0.002","1227.7","0.2","153","2","153","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H42 Al4 -","- C18 H42 Al4 -","- C36 H84 Al8 -","2","1","","Werner Uhl; Andrej Vinogradov; Stefan Grimme","C-H Bond Activation by Hyperconjugation with Al-C Bonds and by Chelating Coordination of the Hydride Ion","Journal of the American Chemical Society","2007","129","","11259","11264","10.1021/ja073657u","","","0.71073","MoKα","","0.082","0.0575","","","0.138","0.1514","","","","","","1.008","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109913","12.452","0.002","16.517","0.003","18.408","0.003","90","","90","","90","","3786","1.1","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C34 H59 B F4 O2 Os P2 -","- C34 H59 B F4 O2 Os P2 -","- C136 H236 B4 F16 O8 Os4 P8 -","4","1","","María L. Buil; Miguel A. Esteruelas; Karin Garcés; Montserrat Oliván; Enrique Oñate","Understanding the Formation of N-H Tautomers from α-Substituted Pyridines: Tautomerization of 2-Ethylpyridine Promoted by Osmium","Journal of the American Chemical Society","2007","129","","10998","10999","10.1021/ja073673r","","","0.71073","MoKα","","0.0843","0.065","","","0.1179","0.1246","","","","","","1.059","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109914","23.589","0.002","20.399","0.002","19.951","0.002","90","","125.574","0.002","90","","7808.5","1.3","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C38 H62 B F4 N O Os P2 -","- C38 H62 B F4 N O Os P2 -","- C304 H496 B8 F32 N8 O8 Os8 P16 -","8","1","","María L. Buil; Miguel A. Esteruelas; Karin Garcés; Montserrat Oliván; Enrique Oñate","Understanding the Formation of N-H Tautomers from α-Substituted Pyridines: Tautomerization of 2-Ethylpyridine Promoted by Osmium","Journal of the American Chemical Society","2007","129","","10998","10999","10.1021/ja073673r","","","0.71073","MoKα","","0.0688","0.0396","","","0.07","0.0756","","","","","","0.82","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109915","14.752","0.002","12.051","0.002","29.708","0.005","90","","95.005","0.003","90","","5261.2","1.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C53 H78 B N3 Os P2 -","- C53 H78 B N3 Os P2 -","- C212 H312 B4 N12 Os4 P8 -","4","1","","María L. Buil; Miguel A. Esteruelas; Karin Garcés; Montserrat Oliván; Enrique Oñate","Understanding the Formation of N-H Tautomers from α-Substituted Pyridines: Tautomerization of 2-Ethylpyridine Promoted by Osmium","Journal of the American Chemical Society","2007","129","","10998","10999","10.1021/ja073673r","","","0.71073","MoKα","","0.0804","0.0575","","","0.1096","0.1166","","","","","","1.183","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109916","12.015","0.004","20.5","0.006","14.826","0.005","90","","99.001","0.005","90","","3607","2","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C33 H56 B F4 N O Os P2 -","- C33 H56 B F4 N O Os P2 -","- C132 H224 B4 F16 N4 O4 Os4 P8 -","4","1","","María L. Buil; Miguel A. Esteruelas; Karin Garcés; Montserrat Oliván; Enrique Oñate","Understanding the Formation of N-H Tautomers from α-Substituted Pyridines: Tautomerization of 2-Ethylpyridine Promoted by Osmium","Journal of the American Chemical Society","2007","129","","10998","10999","10.1021/ja073673r","","","0.71073","MoKα","","0.0618","0.033","","","0.0529","0.0571","","","","","","0.774","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109917","16.871","0.003","17.435","0.003","17.808","0.003","69.54","0.02","68.67","0.02","69.36","0.02","4416.5","1.5","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C29.5 H37.5 B Cl7.5 N7 O4 P W -","- C29.5 H37.5 B Cl7.5 N7 O4 P W -","- C118 H150 B4 Cl30 N28 O16 P4 W4 -","4","2","","Michael A. Todd; Michal Sabat; William H. Myers; W. Dean Harman","[2+2] Cycloaddition Reactions with a Tungsten-Stabilized 2H-Phenol","Journal of the American Chemical Society","2007","129","","11010","11011","10.1021/ja0739279","","","0.71073","MoKα","","0.1166","0.0726","","","0.2031","0.2272","","","","","","1.028","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109918","10.1058","0.0004","13.1552","0.0006","13.5335","0.0005","90","","93.511","0.0011","90","","1795.82","0.13","153","2","153","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C37 H56 N2 O2 Ru2 -","- C37 H36 N2 O2 Ru2 -","- C74 H72 N4 O4 Ru4 -","2","0.5","","Takashi Kawashima; Toshiro Takao; Hiroharu Suzuki","Dehydrogenative Coupling of 4-Substituted Pyridines Catalyzed by Diruthenium Complexes","Journal of the American Chemical Society","2007","129","","11006","11007","10.1021/ja074224u","","","0.71069","MoKα","","0.0652","0.0501","","","0.1251","0.1386","","","","","","1.111","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109919","9.0276","0.0006","9.6462","0.0005","18.1425","0.0009","96.3139","0.0015","94.4097","0.0018","103.372","0.0019","1519.16","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H45 N2 P Ru2 -","- C32 H45 N2 P Ru2 -","- C64 H90 N4 P2 Ru4 -","2","1","","Takashi Kawashima; Toshiro Takao; Hiroharu Suzuki","Dehydrogenative Coupling of 4-Substituted Pyridines Catalyzed by Diruthenium Complexes","Journal of the American Chemical Society","2007","129","","11006","11007","10.1021/ja074224u","","","0.71069","MoKα","","0.0478","0.0347","","","0.0743","0.08","","","","","","1.033","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109920","8.68","0.0006","25.0903","0.0015","11.0863","0.0007","90","","101.55","0.004","90","","2365.5","0.3","153","2","153","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C24 H48 N18 O21 Ru3 Yb2 -","- C24 H22 N18 O21 Ru3 Yb2 -","- C48 H44 N36 O42 Ru6 Yb4 -","2","0.5","","Juan-Manuel Herrera; Simon J. A. Pope; Anthony J. H. M. Meijer; Timothy L. Easun; Harry Adams; Wassim Z. Alsindi; Xue-Zhong Sun; Michael W. George; Stephen Faulkner; Michael D. Ward","Photophysical and Structural Properties of Cyanoruthenate Complexes of Hexaazatriphenylene","Journal of the American Chemical Society","2007","129","","11491","11504","10.1021/ja072672w","","","0.71073","MoKα","","0.0715","0.0487","","","0.1167","0.1416","","","","","","1.176","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4109921","9.862","0.003","16.668","0.005","13.171","0.004","90","","107.354","0.005","90","","2066.5","1.1","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 N10 Na2 O4 Ru -","- C16 H14 N10 Na2 O4 Ru -","- C64 H56 N40 Na8 O16 Ru4 -","4","1","","Juan-Manuel Herrera; Simon J. A. Pope; Anthony J. H. M. Meijer; Timothy L. Easun; Harry Adams; Wassim Z. Alsindi; Xue-Zhong Sun; Michael W. George; Stephen Faulkner; Michael D. Ward","Photophysical and Structural Properties of Cyanoruthenate Complexes of Hexaazatriphenylene","Journal of the American Chemical Society","2007","129","","11491","11504","10.1021/ja072672w","","","0.71073","MoKα","","0.0464","0.0317","","","0.0697","0.0753","","","","","","1.076","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109922","33.824","0.006","13.26","0.002","19.672","0.004","90","","124.627","0.003","90","","7260","2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H70 Eu2 N30 O26 Ru3 -","- C48 H38 Eu2 N30 O26 Ru3 -","- C192 H152 Eu8 N120 O104 Ru12 -","4","0.5","","Juan-Manuel Herrera; Simon J. A. Pope; Anthony J. H. M. Meijer; Timothy L. Easun; Harry Adams; Wassim Z. Alsindi; Xue-Zhong Sun; Michael W. George; Stephen Faulkner; Michael D. Ward","Photophysical and Structural Properties of Cyanoruthenate Complexes of Hexaazatriphenylene","Journal of the American Chemical Society","2007","129","","11491","11504","10.1021/ja072672w","","","0.71073","MoKα","","0.1142","0.0706","","","0.171","0.1934","","","","","","1.035","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109923","33.057","0.01","13.055","0.004","19.39","0.006","90","","124.669","0.004","90","","6882","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H60 N30 O21 Ru3 Sm2 -","- C48 H38 N30 O21 Ru3 Sm2 -","- C192 H152 N120 O84 Ru12 Sm8 -","4","0.5","","Juan-Manuel Herrera; Simon J. A. Pope; Anthony J. H. M. Meijer; Timothy L. Easun; Harry Adams; Wassim Z. Alsindi; Xue-Zhong Sun; Michael W. George; Stephen Faulkner; Michael D. Ward","Photophysical and Structural Properties of Cyanoruthenate Complexes of Hexaazatriphenylene","Journal of the American Chemical Society","2007","129","","11491","11504","10.1021/ja072672w","","","0.71073","MoKα","","0.1232","0.0746","","","0.1733","0.2188","","","","","","1.048","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109924","33.778","0.014","13.233","0.006","19.647","0.008","90","","124.616","0.006","90","","7227","5","423","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H70 Gd2 N30 O26 Ru3 -","- C48 H38 Gd2 N30 O26 Ru3 -","- C192 H152 Gd8 N120 O104 Ru12 -","4","0.5","","Juan-Manuel Herrera; Simon J. A. Pope; Anthony J. H. M. Meijer; Timothy L. Easun; Harry Adams; Wassim Z. Alsindi; Xue-Zhong Sun; Michael W. George; Stephen Faulkner; Michael D. Ward","Photophysical and Structural Properties of Cyanoruthenate Complexes of Hexaazatriphenylene","Journal of the American Chemical Society","2007","129","","11491","11504","10.1021/ja072672w","","","0.71073","MoKα","","0.0593","0.0546","","","0.147","0.1499","","","","","","1.066","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109925","33.916","0.007","13.304","0.003","19.723","0.004","90","","124.7","0.03","90","","7317","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H74 N30 Nd2 O28 Ru3 -","- C48 H38 N30 Nd2 O28 Ru3 -","- C192 H152 N120 Nd8 O112 Ru12 -","4","0.5","","Juan-Manuel Herrera; Simon J. A. Pope; Anthony J. H. M. Meijer; Timothy L. Easun; Harry Adams; Wassim Z. Alsindi; Xue-Zhong Sun; Michael W. George; Stephen Faulkner; Michael D. Ward","Photophysical and Structural Properties of Cyanoruthenate Complexes of Hexaazatriphenylene","Journal of the American Chemical Society","2007","129","","11491","11504","10.1021/ja072672w","","","0.71073","MoKα","","0.0973","0.0561","","","0.1264","0.1462","","","","","","1.029","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109926","10.68","0.002","14.001","0.003","14.272","0.003","76.75","0.03","79.5","0.03","76.25","0.03","1999.3","0.8","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H37 N14 O27.5 Ru Yb2 -","- C16 H24 N14 O27.5 Ru Yb2 -","- C32 H48 N28 O55 Ru2 Yb4 -","2","1","","Juan-Manuel Herrera; Simon J. A. Pope; Anthony J. H. M. Meijer; Timothy L. Easun; Harry Adams; Wassim Z. Alsindi; Xue-Zhong Sun; Michael W. George; Stephen Faulkner; Michael D. Ward","Photophysical and Structural Properties of Cyanoruthenate Complexes of Hexaazatriphenylene","Journal of the American Chemical Society","2007","129","","11491","11504","10.1021/ja072672w","","","0.71073","MoKα","","0.0347","0.0292","","","0.0726","0.0757","","","","","","1.016","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109927","11.4801","0.0005","15.8855","0.0006","22.8864","0.001","97.127","0.002","100.46","0.002","103.133","0.002","3937","0.3","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C80 H152 N58 O70 Ru8 Yb6 -","- C80 H72 N58 O70 Ru8 Yb6 -","- C80 H72 N58 O70 Ru8 Yb6 -","1","0.5","","Juan-Manuel Herrera; Simon J. A. Pope; Anthony J. H. M. Meijer; Timothy L. Easun; Harry Adams; Wassim Z. Alsindi; Xue-Zhong Sun; Michael W. George; Stephen Faulkner; Michael D. Ward","Photophysical and Structural Properties of Cyanoruthenate Complexes of Hexaazatriphenylene","Journal of the American Chemical Society","2007","129","","11491","11504","10.1021/ja072672w","","","0.71073","MoKα","","0.0776","0.0584","","","0.159","0.1729","","","","","","1","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109928","12.31","0.003","14.197","0.003","16.002","0.003","91.1","0.005","107.63","0.005","98.136","0.005","2632.7","1","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C78 H10 F30 -","- C78 H10 F30 -","- C156 H20 F60 -","2","1","","Alexey A. Popov; Ivan E. Kareev; Natalia B. Shustova; Evgeny B. Stukalin; Sergey F. Lebedkin; Konrad Seppelt; Steven H. Strauss; Olga V. Boltalina; Lothar Dunsch","Electrochemical, Spectroscopic, and DFT Study of C60(CF3)n Frontier Orbitals (n= 2-18): The Link between Double Bonds in Pentagons and Reduction Potentials","Journal of the American Chemical Society","2007","129","","11551","11568","10.1021/ja073181e","","","0.71073","MoKα","","0.0833","0.0494","","","0.118","0.138","","","","","","1.014","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109929","24.367","0.002","8.1958","0.0007","30.325","0.003","90","","90","","90","","6056.1","0.9","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C40 H32 O4 -","- C40 H32 O4 -","- C320 H256 O32 -","8","1","","Xuefeng Jiang; Shengming Ma","trans-RhCl(CO)(PPh3)2-Catalyzed Monomeric and Dimeric Cycloisomerization of Propargylic 2,3-Dienoates. Establishment of α,β-Unsaturated δ-Lactone Rings by Cyclometallation","Journal of the American Chemical Society","2007","129","","11600","11607","10.1021/ja073582u","","","0.71073","MoKα","","0.0999","0.0506","","","0.1099","0.1265","","","","","","0.85","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109930","11.4483","0.0013","30.37","0.003","8.4474","0.001","90","","98.854","0.003","90","","2902","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C40 H32 O4 -","- C40 H32 O4 -","- C160 H128 O16 -","4","1","","Xuefeng Jiang; Shengming Ma","trans-RhCl(CO)(PPh3)2-Catalyzed Monomeric and Dimeric Cycloisomerization of Propargylic 2,3-Dienoates. Establishment of α,β-Unsaturated δ-Lactone Rings by Cyclometallation","Journal of the American Chemical Society","2007","129","","11600","11607","10.1021/ja073582u","","","0.71073","MoKα","","0.2057","0.0854","","","0.1591","0.2011","","","","","","0.908","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109931","8.6809","0.0014","15.504","0.002","21.838","0.003","93.347","0.004","92.725","0.004","94.441","0.003","2921.3","0.7","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H36 O4 -","- C34 H32 O4 -","- C136 H128 O16 -","4","2","","Xuefeng Jiang; Shengming Ma","trans-RhCl(CO)(PPh3)2-Catalyzed Monomeric and Dimeric Cycloisomerization of Propargylic 2,3-Dienoates. Establishment of α,β-Unsaturated δ-Lactone Rings by Cyclometallation","Journal of the American Chemical Society","2007","129","","11600","11607","10.1021/ja073582u","","","0.71073","MoKα","","0.2184","0.09","","","0.2104","0.2722","","","","","","0.867","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109932","28.98","0.008","9.097","0.002","21.175","0.005","90","","90","","90","","5582","2","293","2","293","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C34 H36 O4 -","- C34 H36 O4 -","- C272 H288 O32 -","8","2","","Xuefeng Jiang; Shengming Ma","trans-RhCl(CO)(PPh3)2-Catalyzed Monomeric and Dimeric Cycloisomerization of Propargylic 2,3-Dienoates. Establishment of α,β-Unsaturated δ-Lactone Rings by Cyclometallation","Journal of the American Chemical Society","2007","129","","11600","11607","10.1021/ja073582u","","","0.71073","MoKα","","0.1616","0.0765","","","0.1711","0.2112","","","","","","0.803","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109933","6.0205","0.0007","16.6705","0.0018","17.5656","0.0019","90","","90","","90","","1763","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C22 H20 O2 -","- C22 H20 O2 -","- C88 H80 O8 -","4","1","","Xuefeng Jiang; Shengming Ma","trans-RhCl(CO)(PPh3)2-Catalyzed Monomeric and Dimeric Cycloisomerization of Propargylic 2,3-Dienoates. Establishment of α,β-Unsaturated δ-Lactone Rings by Cyclometallation","Journal of the American Chemical Society","2007","129","","11600","11607","10.1021/ja073582u","","","0.71073","MoKα","","0.0629","0.0592","","","0.1473","0.15","","","","","","1.152","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109934","15.432","0.002","14.14","0.002","8.4535","0.0012","90","","102.317","0.003","90","","1802.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 Br O3 -","- C20 H21 Br O3 -","- C80 H84 Br4 O12 -","4","1","","Xuefeng Jiang; Shengming Ma","trans-RhCl(CO)(PPh3)2-Catalyzed Monomeric and Dimeric Cycloisomerization of Propargylic 2,3-Dienoates. Establishment of α,β-Unsaturated δ-Lactone Rings by Cyclometallation","Journal of the American Chemical Society","2007","129","","11600","11607","10.1021/ja073582u","","","0.71073","MoKα","","0.1034","0.0581","","","0.1345","0.1637","","","","","","0.823","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109935","15.946","0.006","27.927","0.011","9.417","0.004","90","","90","","90","","4194","3","193","2","193","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C20 H26 Br2 N2 Ni -","- C20 H26 Br2 N2 Ni -","- C160 H208 Br16 N16 Ni8 -","8","2","","David A. Evans; Shizue Mito; Daniel Seidel","Scope and Mechanism of Enantioselective Michael Additions of 1,3-Dicarbonyl Compounds to Nitroalkenes Catalyzed by Nickel(II)-Diamine Complexes","Journal of the American Chemical Society","2007","129","","11583","11592","10.1021/ja0735913","","","0.71073","MoKα","","0.0406","0.0309","","","0.0584","0.0615","","","","","","0.987","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109936","7.706","0.005","19.351","0.012","10.746","0.007","90","","102.946","0.01","90","","1561.7","1.7","193","2","193","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C27 H39 Br3 N2 Ni O4 -","- C27 H39 Br3 N2 Ni O4 -","- C54 H78 Br6 N4 Ni2 O8 -","2","1","","David A. Evans; Shizue Mito; Daniel Seidel","Scope and Mechanism of Enantioselective Michael Additions of 1,3-Dicarbonyl Compounds to Nitroalkenes Catalyzed by Nickel(II)-Diamine Complexes","Journal of the American Chemical Society","2007","129","","11583","11592","10.1021/ja0735913","","","0.71073","MoKα","","0.0622","0.0563","","","0.1495","0.1531","","","","","","1.114","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109937","10.9883","0.00003","13.2389","0.0003","18.4296","0.0005","92.625","0.002","99.99","0.002","97.269","0.002","2612.83","0.1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Dichloro[bis(3,5-bis(3',4',5'-trimethoxyphenyl)pyrazole-1-yl)methane]zinc(II)","","- C46 H54 Cl8 N4 O12 Zn -","- C46 H54 Cl8 N4 O12 Zn -","- C92 H108 Cl16 N8 O24 Zn2 -","2","1","","Emma Cavero; Santiago Uriel; Pilar Romero; José Luis Serrano; Raquel Giménez","Tetrahedral Zinc Complexes with Liquid Crystalline and Luminescent Properties: Interplay Between Nonconventional Molecular Shapes and Supramolecular Mesomorphic Order","Journal of the American Chemical Society","2007","129","","11608","11618","10.1021/ja073639c","","","0.71073","MoKα","","0.0456","0.0305","","","0.0724","0.076","","","","","","0.989","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109938","10.8967","0.0004","14.546","0.0007","16.0768","0.0009","80.091","0.004","69.48","0.004","74.809","0.004","2294.1","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Dichlorobis(3,5-bis(3,4,5-trimethoxyphenyl)-1H-pyrazole)zinc(II)","","- C43 H50 Cl4 N4 O12 Zn -","- C43 H50 Cl4 N4 O12 Zn -","- C86 H100 Cl8 N8 O24 Zn2 -","2","1","","Emma Cavero; Santiago Uriel; Pilar Romero; José Luis Serrano; Raquel Giménez","Tetrahedral Zinc Complexes with Liquid Crystalline and Luminescent Properties: Interplay Between Nonconventional Molecular Shapes and Supramolecular Mesomorphic Order","Journal of the American Chemical Society","2007","129","","11608","11618","10.1021/ja073639c","","","0.71073","MoKα","","0.0918","0.0394","","","0.0756","0.0824","","","","","","0.84","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109939","22.641","0.003","13.976","0.003","17.924","0.003","90","","90","","90","","5671.7","1.7","173","2","173","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C30 H39 N3 O2 Zn -","- C30 H39 N3 O2 Zn -","- C240 H312 N24 O16 Zn8 -","8","2","","Ryan C. Jeske; Angela M. DiCiccio; Geoffrey W. Coates","Alternating Copolymerization of Epoxides and Cyclic Anhydrides: An Improved Route to Aliphatic Polyesters","Journal of the American Chemical Society","2007","129","","11330","11331","10.1021/ja0737568","","","0.71073","MoKα","","0.0596","0.0489","","","0.1193","0.1247","","","","","","1.028","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109940","22.3215","0.0013","17.8938","0.0011","17.856","0.001","90","","105.162","0.001","90","","6883.7","0.7","173","2","173","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C32 H43 N3 O2 Zn -","- C32 H43 N3 O2 Zn -","- C256 H344 N24 O16 Zn8 -","8","1","","Ryan C. Jeske; Angela M. DiCiccio; Geoffrey W. Coates","Alternating Copolymerization of Epoxides and Cyclic Anhydrides: An Improved Route to Aliphatic Polyesters","Journal of the American Chemical Society","2007","129","","11330","11331","10.1021/ja0737568","","","0.71073","MoKα","","0.081","0.0525","","","0.1238","0.137","","","","","","1.095","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109941","11.8724","0.0016","14.0342","0.0017","15.446","0.002","77.49","0.002","70.893","0.003","73.312","0.003","2307.9","0.5","","","","","","","","","","","","8","P -1","-P 1","2","","","","- C37 H59 Cu2 F6 N6 O11 P S2 -","- C37 H59 Cu2 F6 N6 O11 P S2 -","- C74 H118 Cu4 F12 N12 O22 P2 S4 -","2","1","","Zhong-Lin Lu; C. Tony Liu; Alexei A. Neverov; R. Stan Brown","Rapid Three-Step Cleavage of RNA and DNA Model Systems Promoted by a Dinuclear Cu(II) Complex in Methanol. Energetic Origins of the Catalytic Efficacy","Journal of the American Chemical Society","2007","129","","11642","11652","10.1021/ja073780l","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109942","17.647","0.004","14.23","0.003","16.367","0.004","90","","96.196","0.005","90","","4086","1.6","","","","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C27 H54 Cu2 F9 N6 O13 S3 -","- C23.5 H50 Cu2 F9.06 N6 O10.5 S2.5 -","- C94 H200 Cu8 F36.24 N24 O42 S10 -","4","0.5","","Zhong-Lin Lu; C. Tony Liu; Alexei A. Neverov; R. Stan Brown","Rapid Three-Step Cleavage of RNA and DNA Model Systems Promoted by a Dinuclear Cu(II) Complex in Methanol. Energetic Origins of the Catalytic Efficacy","Journal of the American Chemical Society","2007","129","","11642","11652","10.1021/ja073780l","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109943","32.8615","0.0008","32.8615","0.0008","32.8615","0.0008","90","","90","","90","","35486.4","1.5","100","2","100","2","","","","","","","","6","I m -3","-I 2 2 3","204","Platinum/Palladium Carbonyl Phosphine cluster","","","- C450 H336 O78 P20 Pd157.2 Pt7.8 -","- C468 O84 P20 Pd157.16 Pt7.84 -","- C936 O168 P40 Pd314.32 Pt15.68 -","2","0.0416667","","Evgueni G. Mednikov; Matthew C. Jewell; Lawrence F. Dahl","Nanosized (μ12-Pt)Pd164-xPtx(CO)72(PPh3)20 (x ~ 7) Containing Pt-Centered Four-Shell 165-Atom Pd-Pt Core with Unprecedented Intershell Bridging Carbonyl Ligands: Comparative Analysis of Icosahedral Shell-Growth Patterns with Geometrically Related Pd145(CO)x(PEt3)30 (x ~ 60) Containing Capped Three-Shell Pd145 Core","Journal of the American Chemical Society","2007","129","","11619","11630","10.1021/ja073945q","","","0.71073","MoKα","","0.1671","0.1112","","","0.3026","0.3553","","","","","","1.374","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109944","16.1046","0.001","20.927","0.0013","22.4266","0.0012","116.022","0.004","99.677","0.004","99.965","0.004","6430.3","0.7","293","2","183","2","","","","","","","","4","P -1","-P 1","2","ND05","","","- C113.5 H121 N16 O34 -","- C115.44 H121 N16 O31 -","- C230.88 H242 N32 O62 -","2","1","","Nicolas Delsuc; Frédéric Godde; Brice Kauffmann; Jean-Michel Léger; Ivan Huc","The Herringbone Helix: A Noncanonical Folding in Aromatic-Aliphatic Peptides","Journal of the American Chemical Society","2007","129","","11348","11349","10.1021/ja074285s","","","1.5418","CuKα","","0.1211","0.0946","","","0.3067","0.3243","","","","","","1.091","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109945","15.2156","0.0013","17.4112","0.0015","18.4238","0.0016","68.587","0.001","88.406","0.001","71.424","0.001","4285.5","0.6","90","2","90","2","","","","","","","","7","P -1","-P 1","2","","","","- C73 H2 Au2 Br8 Cl11 F30 N6 -","- C73 H2 Au2 Br8 Cl11 F30 N6 -","- C146 H4 Au4 Br16 Cl22 F60 N12 -","2","1","","Shigeki Mori; Kil Suk Kim; Zin Seok Yoon; Su Bum Noh; Dongho Kim; Atsuhiro Osuka","Peripheral Fabrications of a Bis-Gold(III) Complex of [26]Hexaphyrin(1.1.1.1.1.1) and Aromatic versus Antiaromatic Effect on Two-Photon Absorption Cross Section","Journal of the American Chemical Society","2007","129","","11344","11345","10.1021/ja0744908","","","0.71073","MoKα","","0.0878","0.068","","","0.1948","0.212","","","","","","1.043","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109946","25.078","0.005","33.677","0.006","25.573","0.005","90","","105.052","0.004","90","","20857","7","90","2","90","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C121.5 H56 Au2 Cl F30 N6 O1.5 -","- C121.5 H56 Au2 Cl F30 N6 O1.5 -","- C972 H448 Au16 Cl8 F240 N48 O12 -","8","1","","Shigeki Mori; Kil Suk Kim; Zin Seok Yoon; Su Bum Noh; Dongho Kim; Atsuhiro Osuka","Peripheral Fabrications of a Bis-Gold(III) Complex of [26]Hexaphyrin(1.1.1.1.1.1) and Aromatic versus Antiaromatic Effect on Two-Photon Absorption Cross Section","Journal of the American Chemical Society","2007","129","","11344","11345","10.1021/ja0744908","","","0.71073","MoKα","","0.1604","0.0847","","","0.1948","0.2434","","","","","","1.061","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109947","17.1064","0.0018","18.4071","0.0019","21.029","0.002","109.458","0.002","97.07","0.002","104.393","0.002","5891.8","1","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","","","- C137 H48 Au2 F30 N6 -","- C137 H48 Au2 F30 N6 -","- C274 H96 Au4 F60 N12 -","2","1","","Shigeki Mori; Kil Suk Kim; Zin Seok Yoon; Su Bum Noh; Dongho Kim; Atsuhiro Osuka","Peripheral Fabrications of a Bis-Gold(III) Complex of [26]Hexaphyrin(1.1.1.1.1.1) and Aromatic versus Antiaromatic Effect on Two-Photon Absorption Cross Section","Journal of the American Chemical Society","2007","129","","11344","11345","10.1021/ja0744908","","","0.71073","MoKα","","0.1102","0.0655","","","0.1889","0.2176","","","","","","1.079","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109948","7.9387","0.0002","9.9181","0.0002","10.4955","0.0002","93.249","0.001","107.568","0.001","94.082","0.001","783.18","0.03","100","2","100","2","","","","","","","","4","P -1","-P 1","2","2","","","- C19 H23 N O2 -","- C19 H23 N O2 -","- C38 H46 N2 O4 -","2","1","","Guozhu Zhang; Vincent J. Catalano; Liming Zhang","PtCl2-Catalyzed Rapid Access to Tetracyclic 2,3-Indoline-Fused Cyclopentenes: Reactivity Divergent from Cationic Au(I) Catalysis and Synthetic Potential","Journal of the American Chemical Society","2007","129","","11358","11359","10.1021/ja074536x","","","0.71073","MoKα","","0.0469","0.0442","","","0.1233","0.1256","","","","","","1.087","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109949","13.8869","0.0004","8.9296","0.0004","26.3746","0.0008","90","","90","","90","","3270.6","0.2","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C27 H52 O3 Si4 W -","- C27 H52 O3 Si4 W -","- C108 H208 O12 Si16 W4 -","4","1","","Takahito Watanabe; Hisako Hashimoto; Hiromi Tobita","Reactions of Hydrido(hydrosilylene)tungsten Complexes with α,β-Unsaturated Carbonyl Compounds: Selective Formation of (η3-Siloxyallyl)tungsten Complexes","Journal of the American Chemical Society","2007","129","","11338","11339","10.1021/ja074629e","","","0.71073","MoKα","","0.0374","0.0313","","","0.0781","0.0851","","","","","","1.286","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109950","8.2146","0.0004","31.6002","0.0011","14.2624","0.0003","90","","89.5622","0.0018","90","","3702.2","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H56 O3 Si4 W -","- C33 H56 O3 Si4 W -","- C132 H224 O12 Si16 W4 -","4","1","","Takahito Watanabe; Hisako Hashimoto; Hiromi Tobita","Reactions of Hydrido(hydrosilylene)tungsten Complexes with α,β-Unsaturated Carbonyl Compounds: Selective Formation of (η3-Siloxyallyl)tungsten Complexes","Journal of the American Chemical Society","2007","129","","11338","11339","10.1021/ja074629e","","","0.71073","MoKα","","0.0469","0.0404","","","0.0988","0.1052","","","","","","1.35","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109951","8.8185","0.0005","25.7459","0.0008","14.5946","0.0007","90","","96.0911","0.0014","90","","3294.9","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H52 O4 Si4 W -","- C27 H52 O4 Si4 W -","- C108 H208 O16 Si16 W4 -","4","1","","Takahito Watanabe; Hisako Hashimoto; Hiromi Tobita","Reactions of Hydrido(hydrosilylene)tungsten Complexes with α,β-Unsaturated Carbonyl Compounds: Selective Formation of (η3-Siloxyallyl)tungsten Complexes","Journal of the American Chemical Society","2007","129","","11338","11339","10.1021/ja074629e","","","0.71073","MoKα","","0.0575","0.0505","","","0.1292","0.1375","","","","","","1.247","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109952","12.0791","0.001","13.6712","0.0012","28.205","0.002","90","","98.959","0.002","90","","4600.8","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56.5 H58 N2 O3 Ru -","- C56.5 H58 N2 O3 Ru -","- C226 H232 N8 O12 Ru4 -","4","1","","Charles P. Casey; Timothy B. Clark; Ilia A. Guzei","Intramolecular Trapping of an Intermediate in the Reduction of Imines by a Hydroxycyclopentadienyl Ruthenium Hydride: Support for a Concerted Outer Sphere Mechanism","Journal of the American Chemical Society","2007","129","","11821","11827","10.1021/ja073370x","","","0.71073","Mo-Kα","","0.0887","0.0486","","","0.1112","0.1414","","","","","","1.058","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4109953","9.898","0.002","10.507","0.002","21.638","0.004","80.245","0.003","87.922","0.004","81.829","0.003","2195.1","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C104 H98 Cl8 N2 O6 Ru2 -","- C88 H78 Cl4 N2 O6 Ru2 -","- C88 H78 Cl4 N2 O6 Ru2 -","1","0.5","","Charles P. Casey; Timothy B. Clark; Ilia A. Guzei","Intramolecular Trapping of an Intermediate in the Reduction of Imines by a Hydroxycyclopentadienyl Ruthenium Hydride: Support for a Concerted Outer Sphere Mechanism","Journal of the American Chemical Society","2007","129","","11821","11827","10.1021/ja073370x","","","0.71073","Mo-Kα","","0.044","0.0353","","","0.0844","0.0882","","","","","","0.84","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4109954","14.752","0.003","14.752","0.003","32.249","0.008","90","","90","","90","","7018","3","120","2","120","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C80 H96 N6 Ni O12 -","- C80 H96 N6 Ni O12 -","- C320 H384 N24 Ni4 O48 -","4","0.5","","Zhenzhen Dong; Glenn P. A. Yap; Joseph M. Fox","trans-Cyclohexane-1,2-diamine Is a Weak Director of Absolute Helicity in Chiral Nickel-Salen Complexes","Journal of the American Chemical Society","2007","129","","11850","11853","10.1021/ja073900p","","","0.71073","MoKα","","0.0542","0.0475","","","0.1138","0.118","","","","","","1.057","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109955","14.797","0.004","14.844","0.004","32.462","0.008","90","","90","","90","","7130","3","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C80 H97 N6 Ni O12 -","- C80 H97 N6 Ni O12 -","- C320 H388 N24 Ni4 O48 -","4","1","","Zhenzhen Dong; Glenn P. A. Yap; Joseph M. Fox","trans-Cyclohexane-1,2-diamine Is a Weak Director of Absolute Helicity in Chiral Nickel-Salen Complexes","Journal of the American Chemical Society","2007","129","","11850","11853","10.1021/ja073900p","","","0.71073","MoKα","","0.0695","0.0587","","","0.1485","0.1587","","","","","","1.054","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109956","14.246","0.004","18.017","0.004","17.078","0.004","90","","108.182","0.011","90","","4164.6","1.8","298.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H25 Cl N4 -","- C23 H25 Cl N4 -","- C184 H200 Cl8 N32 -","8","2","","Tamotsu Takahashi; Zhiyi Song; Kimihiko Sato; Yuichi Kuzuba; Kiyohiko Nakajima; Ken-ichiro Kanno","1-Chloro-4,5,6,7-tetraalkyldihydroindene Formation by Reaction of Bis(cyclopentadienyl)titanacyclopentadienes with Titanium Chloride","Journal of the American Chemical Society","2007","129","","11678","11679","10.1021/ja074180p","","","0.71075","MoKα","","","0.0635","","","","0.0913","","","","","","1.223","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109957","24.456","0.005","11.441","0.002","25.36","0.005","90","","110.31","0.03","90","","6655","3","153","2","153","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C68 H92 Cu F12 N4 P2 Ru4 -","- C68 H92 Cu F12 N4 P2 Ru4 -","- C272 H368 Cu4 F48 N16 P8 Ru16 -","4","0.5","","Luciano Cuesta; Dustin Gross; Vincent M. Lynch; Zhongping Ou; Wiroaj Kajonkijya; Kei Ohkubo; Shunichi Fukuzumi; Karl M. Kadish; Jonathan L. Sessler","Design and Synthesis of Polymetallic Complexes Based on meso-Calix[4]pyrrole: Platforms for Multielectron Chemistry","Journal of the American Chemical Society","2007","129","","11696","11697","10.1021/ja075613r","","","0.71073","MoKα","","0.2704","0.1165","","","0.1579","0.1824","","","","","","1.48","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109958","14.0813","0.0012","19.2182","0.0017","24.208","0.002","84.39","0.004","73.528","0.004","83.845","0.004","6230.4","0.9","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C146 H181 N5 O6 -","- C146 H181 N5 O6 -","- C292 H362 N10 O12 -","2","1","","Vincent Aucagne; José Berná; James D. Crowley; Stephen M. Goldup; Kevin D. Hänni; David A. Leigh; Paul J. Lusby; Vicki E. Ronaldson; Alexandra M. Z. Slawin; Aurélien Viterisi; D. Barney Walker","Catalytic ""Active-Metal"" Template Synthesis of [2]Rotaxanes, [3]Rotaxanes, and Molecular Shuttles, and Some Observations on the Mechanism of the Cu(I)-Catalyzed Azide-Alkyne 1,3-Cycloaddition","Journal of the American Chemical Society","2007","129","","11950","11963","10.1021/ja073513f","","","1.54178","CuKα","","0.2049","0.1765","","","0.4507","0.4713","","","","","","1.819","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109959","8.9107","0.0008","16.1875","0.0015","23.213","0.002","109.811","0.001","95.603","0.001","90.453","0.001","3132.1","0.5","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C31.5 H39 B F3 N O3 S -","- C31.5 H39 B F3 N O3 S -","- C126 H156 B4 F12 N4 O12 S4 -","4","2","","Todd W. Hudnall; François P. Gabbaï","Ammonium Boranes for the Selective Complexation of Cyanide or Fluoride Ions in Water","Journal of the American Chemical Society","2007","129","","11978","11986","10.1021/ja073793z","","","0.71073","MoKα","","0.1094","0.0526","","","0.1054","0.1172","","","","","","1.024","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4109960","14.061","0.004","12.976","0.003","16.329","0.004","90","","113.423","0.005","90","","2733.8","1.2","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H35 B F3 N O3 S -","- C28 H35 B F3 N O3 S -","- C112 H140 B4 F12 N4 O12 S4 -","4","1","","Todd W. Hudnall; François P. Gabbaï","Ammonium Boranes for the Selective Complexation of Cyanide or Fluoride Ions in Water","Journal of the American Chemical Society","2007","129","","11978","11986","10.1021/ja073793z","","","0.71073","MoKα","","0.1105","0.0707","","","0.1466","0.1604","","","","","","1.024","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109961","9.3438","0.0017","12.777","0.002","23.658","0.004","90","","99.547","0.002","90","","2785.3","0.8","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H41 B N2 O -","- C31 H41 B N2 O -","- C124 H164 B4 N8 O4 -","4","1","","Todd W. Hudnall; François P. Gabbaï","Ammonium Boranes for the Selective Complexation of Cyanide or Fluoride Ions in Water","Journal of the American Chemical Society","2007","129","","11978","11986","10.1021/ja073793z","","","0.71073","MoKα","","0.0622","0.0497","","","0.1293","0.1364","","","","","","1.002","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4109962","8.4441","0.0011","15.338","0.002","8.825","0.0011","90","","95.774","0.002","90","","1137.2","0.3","110","2","110","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H35 B F N -","- C27 H35 B F N -","- C54 H70 B2 F2 N2 -","2","1","","Todd W. Hudnall; François P. Gabbaï","Ammonium Boranes for the Selective Complexation of Cyanide or Fluoride Ions in Water","Journal of the American Chemical Society","2007","129","","11978","11986","10.1021/ja073793z","","","0.71073","MoKα","","0.0668","0.0535","","","0.1419","0.1485","","","","","","1.004","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4109963","9.1474","0.0008","18.2345","0.0016","12.1173","0.001","90","","111.935","0.004","90","","1874.8","0.3","133","2","133","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C17 H29 N3 Si -","- C17 H29 N3 Si -","- C68 H116 N12 Si4 -","4","2","","Cheuk-Wai So; Herbert W. Roesky; Prabhuodeyara M. Gurubasavaraj; Rainer B. Oswald; Michael T. Gamer; Peter G. Jones; Steffen Blaurock","Synthesis and Structures of Heteroleptic Silylenes","Journal of the American Chemical Society","2007","129","","12049","12054","10.1021/ja074019e","","","0.71073","MoKα","","0.0935","0.0493","","","0.072","0.0798","","","","","","0.881","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109964","9.0623","0.0018","10.209","0.002","12.72","0.003","90","","94.17","0.03","90","","1173.7","0.4","170","2","170","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H37 N2 P Si -","- C21 H37 N2 P Si -","- C42 H74 N4 P2 Si2 -","2","1","","Cheuk-Wai So; Herbert W. Roesky; Prabhuodeyara M. Gurubasavaraj; Rainer B. Oswald; Michael T. Gamer; Peter G. Jones; Steffen Blaurock","Synthesis and Structures of Heteroleptic Silylenes","Journal of the American Chemical Society","2007","129","","12049","12054","10.1021/ja074019e","","","0.71073","MoKα","","0.0322","0.0283","","","0.0671","0.0683","","","","","","0.962","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109965","21.2473","0.0015","8.9149","0.0005","18.8561","0.0014","90","","90.016","0.006","90","","3571.7","0.4","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H46 Cl2 N4 Si5 -","- C26 H46 Cl2 N4 Si5 -","- C104 H184 Cl8 N16 Si20 -","4","0.5","","Cheuk-Wai So; Herbert W. Roesky; Prabhuodeyara M. Gurubasavaraj; Rainer B. Oswald; Michael T. Gamer; Peter G. Jones; Steffen Blaurock","Synthesis and Structures of Heteroleptic Silylenes","Journal of the American Chemical Society","2007","129","","12049","12054","10.1021/ja074019e","","","0.71073","MoKα","","0.0433","0.0321","","","0.0812","0.0857","","","","","","1.027","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109966","18.048","0.002","30.881","0.004","28.104","0.004","90","","96.9055","0.0017","90","","15550","3","93.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C198 H186 Cl8 Ir2 N8 O4 -","- C198 H186 Cl8 Ir2 N8 O4 -","- C792 H744 Cl32 Ir8 N32 O16 -","4","0.5","","Makoto Yanagisawa; Kentaro Tashiro; Mikio Yamasaki; Takuzo Aida","Hosting Fullerenes by Dynamic Bond Formation with an Iridium Porphyrin Cyclic Dimer: A ""Chemical Friction"" for Rotary Guest Motions","Journal of the American Chemical Society","2007","129","","11912","11913","10.1021/ja0747526","","","0.7107","MoKα","","","0.0452","","","","0.1184","","","","","","1.103","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109967","12.0083","0.0014","18.205","0.002","15.6133","0.0018","90","","99.049","0.001","90","","3370.8","0.7","120","1","120","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H52 N S U -","- C38 H52 N S U -","- C152 H208 N4 S4 U4 -","4","1","","Christopher R. Graves; Brian L. Scott; David E. Morris; Jaqueline L. Kiplinger","Facile Access to Pentavalent Uranium Organometallics: One-Electron Oxidation of Uranium(IV) Imido Complexes with Copper(I) Salts","Journal of the American Chemical Society","2007","129","","11914","11915","10.1021/ja074889w","","","0.71073","MoKα","","0.0458","0.0316","","","0.083","0.1038","","","","","","1.305","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109968","11.4776","0.0009","13.8658","0.0011","13.1682","0.001","90","","103.987","0.001","90","","2033.5","0.3","141","2","141","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C41 H73 I N U -","- C38 H59 I N U -","- C76 H118 I2 N2 U2 -","2","0.5","","Christopher R. Graves; Brian L. Scott; David E. Morris; Jaqueline L. Kiplinger","Facile Access to Pentavalent Uranium Organometallics: One-Electron Oxidation of Uranium(IV) Imido Complexes with Copper(I) Salts","Journal of the American Chemical Society","2007","129","","11914","11915","10.1021/ja074889w","","","0.71073","MoKα","","0.0462","0.0358","","","0.0857","0.0901","","","","","","0.999","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109969","16.5588","0.0009","18.7054","0.001","19.5958","0.001","90","","90","","90","","6069.6","0.6","141","2","141","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H47 I N U -","- C32 H47 I N U -","- C256 H376 I8 N8 U8 -","8","2","","Christopher R. Graves; Brian L. Scott; David E. Morris; Jaqueline L. Kiplinger","Facile Access to Pentavalent Uranium Organometallics: One-Electron Oxidation of Uranium(IV) Imido Complexes with Copper(I) Salts","Journal of the American Chemical Society","2007","129","","11914","11915","10.1021/ja074889w","","","0.71073","MoKα","","0.049","0.0373","","","0.0662","0.0708","","","","","","1.023","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109970","10.005","0.002","10.514","0.002","17.37","0.004","76.628","0.002","77.703","0.002","68.935","0.002","1641.8","0.6","120","1","120","1","","","","","","","","7","P -1","-P 1","2","","","","- C33 H47 F3 N O3 S U -","- C33 H47 F3 N O3 S U -","- C66 H94 F6 N2 O6 S2 U2 -","2","1","","Christopher R. Graves; Brian L. Scott; David E. Morris; Jaqueline L. Kiplinger","Facile Access to Pentavalent Uranium Organometallics: One-Electron Oxidation of Uranium(IV) Imido Complexes with Copper(I) Salts","Journal of the American Chemical Society","2007","129","","11914","11915","10.1021/ja074889w","","","0.71073","MoKα","","0.0594","0.0429","","","0.0955","0.111","","","","","","1.065","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109971","10.726","0.005","5.892","0.002","10.546","0.007","90","","113.55","0.007","90","","611","0.5","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","(S)-3,3,3-trifluoro-2-hydroxy-2-methylpropionic acid","","- C4 H5 F3 O3 -","- C4 H5 F3 O3 -","- C16 H20 F12 O12 -","4","1","","Vadim A. Soloshonok; Hisanori Ueki; Manabu Yasumoto; Shekar Mekala; Jennifer S. Hirschi; Daniel A. Singleton","Phenomenon of Optical Self-Purification of Chiral Non-Racemic Compounds","Journal of the American Chemical Society","2007","129","","12112","12113","10.1021/ja065603a","","","0.71073","MoKα","","0.0502","0.0463","","","0.12","0.123","","","","","","1.007","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109972","5.8633","0.0018","5.9866","0.0018","9.609","0.003","94.583","0.006","91.888","0.006","116.698","0.006","299.47","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","(R/S)-3,3,3-trifluoro-2-hydroxy-2-methylpropionic acid","","- C4 H5 F3 O3 -","- C4 H5 F3 O3 -","- C8 H10 F6 O6 -","2","1","","Vadim A. Soloshonok; Hisanori Ueki; Manabu Yasumoto; Shekar Mekala; Jennifer S. Hirschi; Daniel A. Singleton","Phenomenon of Optical Self-Purification of Chiral Non-Racemic Compounds","Journal of the American Chemical Society","2007","129","","12112","12113","10.1021/ja065603a","","","0.71073","MoKα","","0.0378","0.0343","","","0.0871","0.0898","","","","","","1.006","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109973","24.367","0.005","15.987","0.003","35.379","0.008","90","","91.155","0.004","90","","13779","5","150","2","150","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C98 H222 N6 O38 W10 Zr2 -","- C66 H144 N4 O38 W10 Zr2 -","- C264 H576 N16 O152 W40 Zr8 -","4","0.5","","R. John Errington; Sagar S. Petkar; Paul S. Middleton; William McFarlane; William Clegg; Robert A. Coxall; Ross W. Harrington","Synthesis and Reactivity of the Methoxozirconium Pentatungstate (nBu4N)6[{(μ-MeO)ZrW5O18}2]: Insights into Proton-Transfer Reactions, Solution Dynamics, and Assembly of {ZrW5O18}2- Building Blocks","Journal of the American Chemical Society","2007","129","","12181","12196","10.1021/ja0725495","","","0.69","synchrotron","","0.1051","0.0874","","","0.2574","0.2882","","","","","","1.242","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109974","42.705","0.009","16.063","0.004","24.531","0.01","90","","123.664","0.014","90","","14006","8","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C98 H221 N7 O38 W10 Zr2 -","- C98 H216 N7 O38 W10 Zr2 -","- C392 H864 N28 O152 W40 Zr8 -","4","0.5","","R. John Errington; Sagar S. Petkar; Paul S. Middleton; William McFarlane; William Clegg; Robert A. Coxall; Ross W. Harrington","Synthesis and Reactivity of the Methoxozirconium Pentatungstate (nBu4N)6[{(μ-MeO)ZrW5O18}2]: Insights into Proton-Transfer Reactions, Solution Dynamics, and Assembly of {ZrW5O18}2- Building Blocks","Journal of the American Chemical Society","2007","129","","12181","12196","10.1021/ja0725495","","","0.71073","MoKα","","0.0966","0.0543","","","0.1258","0.1622","","","","","","1.119","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109975","17.5165","0.0006","17.6777","0.0006","24.2402","0.0009","74.861","0.002","70.185","0.002","79.242","0.002","6776.6","0.4","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C192 H432 N12 O89 W26 Zr2 -","- C192 H432 N12 O89 W26 Zr2 -","- C192 H432 N12 O89 W26 Zr2 -","1","0.5","","R. John Errington; Sagar S. Petkar; Paul S. Middleton; William McFarlane; William Clegg; Robert A. Coxall; Ross W. Harrington","Synthesis and Reactivity of the Methoxozirconium Pentatungstate (nBu4N)6[{(μ-MeO)ZrW5O18}2]: Insights into Proton-Transfer Reactions, Solution Dynamics, and Assembly of {ZrW5O18}2- Building Blocks","Journal of the American Chemical Society","2007","129","","12181","12196","10.1021/ja0725495","","","0.71073","MoKα","","0.0656","0.0434","","","0.0935","0.1033","","","","","","1.025","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109976","16.2557","0.0007","23.8817","0.0011","18.4678","0.0008","90","","90.018","0.002","90","","7169.5","0.5","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H113 N3 O19 W5 Zr -","- C54 H113 N3 O19 W5 Zr -","- C216 H452 N12 O76 W20 Zr4 -","4","1","","R. John Errington; Sagar S. Petkar; Paul S. Middleton; William McFarlane; William Clegg; Robert A. Coxall; Ross W. Harrington","Synthesis and Reactivity of the Methoxozirconium Pentatungstate (nBu4N)6[{(μ-MeO)ZrW5O18}2]: Insights into Proton-Transfer Reactions, Solution Dynamics, and Assembly of {ZrW5O18}2- Building Blocks","Journal of the American Chemical Society","2007","129","","12181","12196","10.1021/ja0725495","","","0.71073","MoKα","","0.0753","0.0408","","","0.0901","0.1012","","","","","","0.977","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109977","23.8193","0.0011","17.1071","0.0008","17.2814","0.0008","90","","90","","90","","7041.8","0.6","150","2","150","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C55 H115 N3 O19 W5 Zr -","- C55 H115 N3 O19 W5 Zr -","- C220 H460 N12 O76 W20 Zr4 -","4","0.5","","R. John Errington; Sagar S. Petkar; Paul S. Middleton; William McFarlane; William Clegg; Robert A. Coxall; Ross W. Harrington","Synthesis and Reactivity of the Methoxozirconium Pentatungstate (nBu4N)6[{(μ-MeO)ZrW5O18}2]: Insights into Proton-Transfer Reactions, Solution Dynamics, and Assembly of {ZrW5O18}2- Building Blocks","Journal of the American Chemical Society","2007","129","","12181","12196","10.1021/ja0725495","","","0.6934","synchrotron","","0.1098","0.0995","","","0.2147","0.2178","","","","","","1.344","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109978","24.7085","0.0009","36.0065","0.0012","33.1734","0.0011","90","","90","","90","","29513.3","1.8","150","2","150","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C56 H114.5 N3.5 O20 W5 Zr -","- C56 H113 N3.5 O20 W5 Zr -","- C896 H1808 N56 O320 W80 Zr16 -","16","2","","R. John Errington; Sagar S. Petkar; Paul S. Middleton; William McFarlane; William Clegg; Robert A. Coxall; Ross W. Harrington","Synthesis and Reactivity of the Methoxozirconium Pentatungstate (nBu4N)6[{(μ-MeO)ZrW5O18}2]: Insights into Proton-Transfer Reactions, Solution Dynamics, and Assembly of {ZrW5O18}2- Building Blocks","Journal of the American Chemical Society","2007","129","","12181","12196","10.1021/ja0725495","","","0.69","synchrotron","","0.0645","0.0518","","","0.1174","0.127","","","","","","1.275","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4109979","16.9153","0.0007","24.9724","0.001","17.949","0.0007","90","","90.054","0.002","90","","7581.9","0.5","160","2","160","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C57 H125 N3 O21 W5 Zr -","- C57 H120 N3 O20.5 W5 Zr -","- C228 H480 N12 O82 W20 Zr4 -","4","2","","R. John Errington; Sagar S. Petkar; Paul S. Middleton; William McFarlane; William Clegg; Robert A. Coxall; Ross W. Harrington","Synthesis and Reactivity of the Methoxozirconium Pentatungstate (nBu4N)6[{(μ-MeO)ZrW5O18}2]: Insights into Proton-Transfer Reactions, Solution Dynamics, and Assembly of {ZrW5O18}2- Building Blocks","Journal of the American Chemical Society","2007","129","","12181","12196","10.1021/ja0725495","","","0.71073","MoKα","","0.0541","0.0351","","","0.0617","0.0677","","","","","","1.017","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109980","15.857","0.003","23.723","0.005","18.663","0.004","90","","90.33","0.03","90","","7020","2","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H111 N3 O20 W5 Zr -","- C51.38 H108 N3.69 O20 W5 Zr -","- C205.52 H432 N14.76 O80 W20 Zr4 -","4","1","","R. John Errington; Sagar S. Petkar; Paul S. Middleton; William McFarlane; William Clegg; Robert A. Coxall; Ross W. Harrington","Synthesis and Reactivity of the Methoxozirconium Pentatungstate (nBu4N)6[{(μ-MeO)ZrW5O18}2]: Insights into Proton-Transfer Reactions, Solution Dynamics, and Assembly of {ZrW5O18}2- Building Blocks","Journal of the American Chemical Society","2007","129","","12181","12196","10.1021/ja0725495","","","0.71073","MoKα","","0.0526","0.0348","","","0.074","0.0847","","","","","","1.059","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109981","66.456","0.006","15.6607","0.0014","32.988","0.003","90","","93.722","0.002","90","","34260","5","150","2","150","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C119 H265.5 N10.5 O56 W15 Zr3 -","- C119 H255 N10.5 O56 W15 Zr3 -","- C952 H2040 N84 O448 W120 Zr24 -","8","2","","R. John Errington; Sagar S. Petkar; Paul S. Middleton; William McFarlane; William Clegg; Robert A. Coxall; Ross W. Harrington","Synthesis and Reactivity of the Methoxozirconium Pentatungstate (nBu4N)6[{(μ-MeO)ZrW5O18}2]: Insights into Proton-Transfer Reactions, Solution Dynamics, and Assembly of {ZrW5O18}2- Building Blocks","Journal of the American Chemical Society","2007","129","","12181","12196","10.1021/ja0725495","","","0.69","synchrotron","","0.0763","0.0519","","","0.1111","0.1223","","","","","","1.029","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109982","23.445","0.001","21.683","0.001","13.647","0.0006","90","","110.28","0.02","90","","6507.5","1","110","2","110","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C61 H64 Br N O16 -","- C61 H64 Br N O16 -","- C244 H256 Br4 N4 O64 -","4","1","","Satyamaheshwar Peddibhotla; Yongjun Dang; Jun O. Liu; Daniel Romo","Simultaneous Arming and Structure/Activity Studies of Natural Products Employing O-H Insertions: An Expedient and Versatile Strategy for Natural Products-Based Chemical Genetics","Journal of the American Chemical Society","2007","129","","12222","12231","10.1021/ja0733686","","","1.54178","CuKα","","0.0605","0.0538","","","0.1435","0.149","","","","","","1.052","","","","has coordinates,has disorder","178845","2020-10-21","18:00:00",""
"4109983","10.6274","0.0003","11.7059","0.0004","15.3407","0.0006","90","","93.78","0.001","90","","1904.28","0.11","153","2","153","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C37 H45 Br N4 O11 -","- C37 H45 Br N4 O11 -","- C74 H90 Br2 N8 O22 -","2","1","","Chi-Ming Cheung; Frederick W. Goldberg; Philip Magnus; Claire J. Russell; Rachel Turnbull; Vince Lynch","An Expedient Formal Total Synthesis of (-)-Diazonamide A via a Powerful, Stereoselective O-Aryl to C-Aryl Migration To Form the C10 Quaternary Center","Journal of the American Chemical Society","2007","129","","12320","12327","10.1021/ja0744448","","","0.71073","MoKα","","0.1407","0.0663","","","0.1099","0.1343","","","","","","1.051","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109984","24.8837","0.0011","16.4642","0.0007","25.8863","0.0011","90","","117.634","0.001","90","","9395.6","0.7","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C45 H30 O9 Ru3 Sn3 -","- C45 H30 O9 Ru3 Sn3 -","- C360 H240 O72 Ru24 Sn24 -","8","2","","Richard D. Adams; Burjor Captain; Michael B. Hall; Eszter Trufan; Xinzheng Yang","Synthesis, Characterization, and Electronic Structures of a Series of Two-Dimensional Trimetallic Cluster Complexes, Ru3(CO)9(μ-SnPh2)3[Pt(PBut3)]x, x = 0-3","Journal of the American Chemical Society","2007","129","","12328","12340","10.1021/ja074527o","","","0.71073","MoKα","","0.1081","0.0485","","","0.0878","0.1124","","","","","","1","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109985","13.7703","0.0004","13.9457","0.0004","19.3885","0.0006","77.485","0.001","85.194","0.001","61.818","0.001","3203.18","0.17","294","2","294","2","","","","","","","","8","P -1","-P 1","2","","","","- C58 H59 Cl2 O9 P Pt Ru3 Sn3 -","- C58 H59 Cl2 O9 P Pt Ru3 Sn3 -","- C116 H118 Cl4 O18 P2 Pt2 Ru6 Sn6 -","2","1","","Richard D. Adams; Burjor Captain; Michael B. Hall; Eszter Trufan; Xinzheng Yang","Synthesis, Characterization, and Electronic Structures of a Series of Two-Dimensional Trimetallic Cluster Complexes, Ru3(CO)9(μ-SnPh2)3[Pt(PBut3)]x, x = 0-3","Journal of the American Chemical Society","2007","129","","12328","12340","10.1021/ja074527o","","","0.71073","MoKα","","0.0498","0.0379","","","0.1045","0.1143","","","","","","1.046","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109986","18.326","0.0008","18.6782","0.0008","23.4249","0.001","90","","101.171","0.001","90","","7866.3","0.6","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C72 H91 O9 P2 Pt2 Ru3 Sn3 -","- C72 H91 O9 P2 Pt2 Ru3 Sn3 -","- C288 H364 O36 P8 Pt8 Ru12 Sn12 -","4","1","","Richard D. Adams; Burjor Captain; Michael B. Hall; Eszter Trufan; Xinzheng Yang","Synthesis, Characterization, and Electronic Structures of a Series of Two-Dimensional Trimetallic Cluster Complexes, Ru3(CO)9(μ-SnPh2)3[Pt(PBut3)]x, x = 0-3","Journal of the American Chemical Society","2007","129","","12328","12340","10.1021/ja074527o","","","0.71073","MoKα","","0.088","0.0457","","","0.1006","0.1266","","","","","","1.018","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4109987","18.5176","0.0002","18.5176","0.0002","16.4848","0.0003","90","","90","","120","","4895.35","0.12","273","2","273","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C81 H111 O9 P3 Pt3 Ru3 Sn3 -","- C81 H111 O9 P3 Pt3 Ru3 Sn3 -","- C162 H222 O18 P6 Pt6 Ru6 Sn6 -","2","0.166667","","Richard D. Adams; Burjor Captain; Michael B. Hall; Eszter Trufan; Xinzheng Yang","Synthesis, Characterization, and Electronic Structures of a Series of Two-Dimensional Trimetallic Cluster Complexes, Ru3(CO)9(μ-SnPh2)3[Pt(PBut3)]x, x = 0-3","Journal of the American Chemical Society","2007","129","","12328","12340","10.1021/ja074527o","","","0.71073","MoKα","","0.052","0.0366","","","0.1263","0.1428","","","","","","1.187","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109988","11.261","0.003","7.6685","0.0013","5.8855","0.0012","90","","92.597","0.018","90","","507.72","0.19","298.1","","","","","","","","","","","3","P 1 a 1","P -2ya","7","","","","- C13 H11 N -","- C13 H11 N -","- C26 H22 N2 -","2","1","","Shinji Yamada; Naoko Uematsu; Kaori Yamashita","Role of Cation-π Interactions in the Photodimerization of trans-4-Styrylpyridines","Journal of the American Chemical Society","2007","129","","12100","12101","10.1021/ja074874y","","","1.54178","CuKα","","","0.0434","","","","0.1316","","","","","","1.091","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109989","9.675","0.002","17.749","0.003","7.8416","0.0014","90","","95.659","0.016","90","","1340","0.4","298.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H16 Cl N O2 -","- C13 H16 Cl N O2 -","- C52 H64 Cl4 N4 O8 -","4","1","","Shinji Yamada; Naoko Uematsu; Kaori Yamashita","Role of Cation-π Interactions in the Photodimerization of trans-4-Styrylpyridines","Journal of the American Chemical Society","2007","129","","12100","12101","10.1021/ja074874y","","","1.54178","CuKα","","","0.0474","","","","0.135","","","","","","1.104","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109990","9.9292","0.0011","9.5362","0.0011","11.6631","0.0013","90","","113.75","0.007","90","","1010.8","0.2","296.1","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C26 H22 N2 -","- C26 H22 N2 -","- C52 H44 N4 -","2","1","","Shinji Yamada; Naoko Uematsu; Kaori Yamashita","Role of Cation-π Interactions in the Photodimerization of trans-4-Styrylpyridines","Journal of the American Chemical Society","2007","129","","12100","12101","10.1021/ja074874y","","","1.54187","CuKα","","","0.0762","","","","0.2389","","","","","","1.005","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4109991","14.3478","0.0003","9.3575","0.0002","16.7753","0.0004","90","","90.5394","0.0013","90","","2252.14","0.09","123.1","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C26 H24 Cl2 N2 -","- C26 H24 Cl2 N2 -","- C104 H96 Cl8 N8 -","4","1","","Shinji Yamada; Naoko Uematsu; Kaori Yamashita","Role of Cation-π Interactions in the Photodimerization of trans-4-Styrylpyridines","Journal of the American Chemical Society","2007","129","","12100","12101","10.1021/ja074874y","","","1.54187","CuKα","","","0.0779","","","","0.2454","","","","","","1.072","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109992","16.1494","0.0003","17.4113","0.0004","17.4162","0.0003","118.072","0.0009","93.396","0.001","103.083","0.0011","4129.83","0.15","298.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C26 H22 N2 -","- C26 H20 N2 -","- C208 H160 N16 -","8","4","","Shinji Yamada; Naoko Uematsu; Kaori Yamashita","Role of Cation-π Interactions in the Photodimerization of trans-4-Styrylpyridines","Journal of the American Chemical Society","2007","129","","12100","12101","10.1021/ja074874y","","","1.54187","CuKα","","","0.0653","","","","0.2577","","","","","","0.895","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109993","20.246","0.0004","7.51826","0.00014","14.7745","0.0003","90","","101.643","0.001","90","","2202.62","0.08","113","","113","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C28 H26 O7 -","- C28 H26 O7 -","- C112 H104 O28 -","4","0.5","","Ken Tanaka; Akiyoshi Kamisawa; Takeshi Suda; Keiichi Noguchi; Masao Hirano","Rh-Catalyzed Synthesis of Helically Chiral and Ladder-Type Molecules via [2 + 2 + 2] and Formal [2 + 1 + 2 + 1] Cycloadditions Involving C-C Triple Bond Cleavage","Journal of the American Chemical Society","2007","129","","12078","12079","10.1021/ja074914y","","","1.54187","CuKα","","0.0325","0.0304","","","0.0832","0.0848","","","","","","1.072","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4109994","41.62","0.04","13.645","0.013","16.763","0.016","90","","99.127","0.018","90","","9399","16","95","","95","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C32 H22 O6 -","- C32 H22 O6 -","- C512 H352 O96 -","16","2","","Ken Tanaka; Akiyoshi Kamisawa; Takeshi Suda; Keiichi Noguchi; Masao Hirano","Rh-Catalyzed Synthesis of Helically Chiral and Ladder-Type Molecules via [2 + 2 + 2] and Formal [2 + 1 + 2 + 1] Cycloadditions Involving C-C Triple Bond Cleavage","Journal of the American Chemical Society","2007","129","","12078","12079","10.1021/ja074914y","","","1","synchrotron","","0.1144","0.0911","","","0.2404","0.2566","","","","","","0.993","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109995","12.8633","0.0007","11.9036","0.0006","15.9329","0.0008","90","","94.89","0.004","90","","2430.8","0.2","193","","193","","","","","","","","","3","P 1 21 1","P 2yb","4","(M)-(-)-helicene-like-molecule","","","- C32 H22 O6 -","- C32 H22 O6 -","- C128 H88 O24 -","4","2","","Ken Tanaka; Akiyoshi Kamisawa; Takeshi Suda; Keiichi Noguchi; Masao Hirano","Rh-Catalyzed Synthesis of Helically Chiral and Ladder-Type Molecules via [2 + 2 + 2] and Formal [2 + 1 + 2 + 1] Cycloadditions Involving C-C Triple Bond Cleavage","Journal of the American Chemical Society","2007","129","","12078","12079","10.1021/ja074914y","","","1.54187","CuKα","","0.0542","0.04","","","0.0959","0.1059","","","","","","1.062","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109996","22.0418","0.0018","15.4524","0.0013","17.4014","0.0014","90","","90","","90","","5926.9","0.8","295","2","295","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C28 H44 N2 O4 Ti -","- C28 H44 N2 O4 Ti -","- C224 H352 N16 O32 Ti8 -","8","0.5","","Michal Shavit; Dani Peri; Cesar M. Manna; Jacob S. Alexander; Edit Y. Tshuva","Active Cytotoxic Reagents Based on Non-metallocene Non-diketonato Well-Defined C2-Symmetrical Titanium Complexes of Tetradentate Bis(phenolato) Ligands","Journal of the American Chemical Society","2007","129","","12098","12099","10.1021/ja0753086","","","0.71073","MoKα","","0.0346","0.034","","","0.0867","0.0872","","","","","","1.108","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109997","10.0635","0.0006","17.306","0.001","18.661","0.001","90","","90","","90","","3250","0.3","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H28 N2 O4 Ti -","- C12 H28 N2 O4 Ti -","- C96 H224 N16 O32 Ti8 -","8","1","","Michal Shavit; Dani Peri; Cesar M. Manna; Jacob S. Alexander; Edit Y. Tshuva","Active Cytotoxic Reagents Based on Non-metallocene Non-diketonato Well-Defined C2-Symmetrical Titanium Complexes of Tetradentate Bis(phenolato) Ligands","Journal of the American Chemical Society","2007","129","","12098","12099","10.1021/ja0753086","","","0.71073","MoKα","","0.0394","0.0382","","","0.0986","0.0996","","","","","","1.13","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109998","13.862","0.005","13.862","0.005","13.784","0.005","90","","90","","120","","2293.8","1.4","173","2","173","2","","","","","","","","6","P -3","-P 3","147","[Ni(tame)2]1(PES)2","bis(1,1,1-tris(aminomethyl)ethane)nickel(II)di(2-phenylethynesulfonate)","","- C26 H39.94 N6 Ni O6 S2 -","- C26 H39.94 N6 Ni O6 S2 -","- C78 H119.82 N18 Ni3 O18 S6 -","3","0.5","","Sean A. Dalrymple; George K. H. Shimizu","Crystal Engineering of a Permanently Porous Network Sustained Exclusively by Charge-Assisted Hydrogen Bonds","Journal of the American Chemical Society","2007","129","","12114","12116","10.1021/ja076094v","","","0.71069","MoKα","","0.0689","0.0398","","","0.0989","0.1127","","","","","","1.045","","","","has coordinates","178845","2020-10-21","18:00:00",""
"4109999","7.43","0.002","8.883","0.002","26.604","0.007","90","","90","","90","","1755.9","0.8","193","2","193","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H32 O2 -","- C21 H32 O2 -","- C84 H128 O8 -","4","1","","Arnab Roy; Frank G. Roberts; P. Ross Wilderman; Ke Zhou; Reuben J. Peters; Robert M. Coates","16-Aza-ent-beyerane and 16-Aza-ent-trachylobane: Potent Mechanism-Based Inhibitors of Recombinantent-Kaurene Synthase from Arabidopsis thaliana","Journal of the American Chemical Society","2007","129","","12453","12460","10.1021/ja072447e","","","0.71073","MoKα","","0.059","0.0487","","","0.1307","0.1401","","","","","","1.041","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4110000","7.903","0.006","9.454","0.007","11.846","0.009","90","","97.736","0.012","90","","877","1.1","193","2","193","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H31 N -","- C20 H31 N -","- C40 H62 N2 -","2","1","","Arnab Roy; Frank G. Roberts; P. Ross Wilderman; Ke Zhou; Reuben J. Peters; Robert M. Coates","16-Aza-ent-beyerane and 16-Aza-ent-trachylobane: Potent Mechanism-Based Inhibitors of Recombinantent-Kaurene Synthase from Arabidopsis thaliana","Journal of the American Chemical Society","2007","129","","12453","12460","10.1021/ja072447e","","","0.71073","MoKα","","0.0616","0.0462","","","0.1138","0.1241","","","","","","0.911","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4110001","10.701","0.005","7.179","0.003","16.525","0.008","90","","104.052","0.007","90","","1231.5","1","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H34 N4 O7 -","- C25 H34 N4 O7 -","- C50 H68 N8 O14 -","2","1","","Arnab Roy; Frank G. Roberts; P. Ross Wilderman; Ke Zhou; Reuben J. Peters; Robert M. Coates","16-Aza-ent-beyerane and 16-Aza-ent-trachylobane: Potent Mechanism-Based Inhibitors of Recombinantent-Kaurene Synthase from Arabidopsis thaliana","Journal of the American Chemical Society","2007","129","","12453","12460","10.1021/ja072447e","","","0.71073","MoKα","","0.0687","0.0443","","","0.1036","0.112","","","","","","1.028","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4110002","16.743","0.009","14.723","0.008","14.352","0.008","90","","90","","90","","3538","3","150","2","150","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C26 H30 Cu F6 N4 O9 S2 -","- C26 H30 Cu F6 N4 O9 S2 -","- C104 H120 Cu4 F24 N16 O36 S8 -","4","1","","Atsushi Kondo; Hiroshi Noguchi; Lucia Carlucci; Davide M. Proserpio; Gianfranco Ciani; Hiroshi Kajiro; Tomonori Ohba; Hirofumi Kanoh; Katsumi Kaneko","Double-Step Gas Sorption of a Two-Dimensional Metal-Organic Framework","Journal of the American Chemical Society","2007","129","","12362","12363","10.1021/ja073568h","","","0.71073","MoKα","","0.0661","0.0579","","0.1727","0.1652","","","","1.058","","","","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110003","15.319","0.003","16.158","0.003","13.688","0.003","90","","90","","90","","3388.1","1.2","150","2","150","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C22 H16 Cu F6 N4 O6 S2 -","- C22 H16 Cu F6 N4 O6 S2 -","- C88 H64 Cu4 F24 N16 O24 S8 -","4","0.5","","Atsushi Kondo; Hiroshi Noguchi; Lucia Carlucci; Davide M. Proserpio; Gianfranco Ciani; Hiroshi Kajiro; Tomonori Ohba; Hirofumi Kanoh; Katsumi Kaneko","Double-Step Gas Sorption of a Two-Dimensional Metal-Organic Framework","Journal of the American Chemical Society","2007","129","","12362","12363","10.1021/ja073568h","","","0.71073","MoKα","","0.0583","0.042","","0.1175","0.1114","","","","1.048","","","","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110004","27.08","0.02","15.096","0.014","16.136","0.015","90","","111.344","0.011","90","","6144","9","298","","298","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22 H16 Cu F6 N4 O6 S2 -","- C21.458 H16 Cu F4.374 N4 O6 S2 -","- C171.664 H128 Cu8 F34.992 N32 O48 S16 -","8","1","","Atsushi Kondo; Hiroshi Noguchi; Lucia Carlucci; Davide M. Proserpio; Gianfranco Ciani; Hiroshi Kajiro; Tomonori Ohba; Hirofumi Kanoh; Katsumi Kaneko","Double-Step Gas Sorption of a Two-Dimensional Metal-Organic Framework","Journal of the American Chemical Society","2007","129","","12362","12363","10.1021/ja073568h","","","0.71073","MoKα","","0.3117","0.1415","","0.4225","0.3556","","","","0.945","","","","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110005","9.3612","0.0003","12.8616","0.0004","13.8655","0.0005","107.441","0.002","96.022","0.002","95.548","0.002","1569.36","0.09","150","","150","","","","","","","","C. Milios","5","P -1","-P 1","2","","","","- C26 H32 Mn3 N3 O13 -","- C26 H32 Mn3 N3 O13 -","- C52 H64 Mn6 N6 O26 -","2","1","","Constantinos J. Milios; Ross Inglis; Alina Vinslava; Rashmi Bagai; Wolfgang Wernsdorfer; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Toward a Magnetostructural Correlation for a Family of Mn6SMMs","Journal of the American Chemical Society","2007","129","","12505","12511","10.1021/ja0736616","","","0.71073","MoKα","","0.0527","0.0363","","0.1063","0.091","0.1063","","","","","","0.9648","","","","has coordinates","264242","2021-04-16","08:52:11",""
"4110006","22.6018","0.0004","15.0024","0.0003","29.9529","0.0006","90","","106.89","0.001","90","","9718.4","0.3","150","","150","","","","","","","","C.Milios CM2722","5","C 1 2/c 1","-C 2yc","15","","","","- C100 H108 Mn6 N6 O24 -","- C100 H108 Mn6 N6 O24 -","- C400 H432 Mn24 N24 O96 -","4","0.5","","Constantinos J. Milios; Ross Inglis; Alina Vinslava; Rashmi Bagai; Wolfgang Wernsdorfer; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Toward a Magnetostructural Correlation for a Family of Mn6SMMs","Journal of the American Chemical Society","2007","129","","12505","12511","10.1021/ja0736616","","","0.71073","MoKα","","0.085","0.0394","","0.0751","0.0419","0.0419","","","","","","1.1007","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110007","13.486","0.003","14.882","0.003","20.822","0.004","82.87","0.03","85.73","0.03","76.51","0.03","4027.7","1.5","150","","150","","","","","","","","C. Milios CM2439","5","P -1","-P 1","2","","","","- C74 H102 Mn6 N6 O23 -","- C74 H102 Mn6 N6 O23 -","- C148 H204 Mn12 N12 O46 -","2","1","","Constantinos J. Milios; Ross Inglis; Alina Vinslava; Rashmi Bagai; Wolfgang Wernsdorfer; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Toward a Magnetostructural Correlation for a Family of Mn6SMMs","Journal of the American Chemical Society","2007","129","","12505","12511","10.1021/ja0736616","","","0.71073","MoKα","","0.0969","0.0512","","0.0352","0.0282","0.0282","","","","","","1.1073","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110008","21.074","0.01","13.495","0.006","32.383","0.018","90","","106.722","0.007","90","","8820","8","293","","293","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C88 H90 Mn6 N6 O24 -","- C88 H90 Mn6 N6 O24 -","- C352 H360 Mn24 N24 O96 -","4","0.5","","Constantinos J. Milios; Ross Inglis; Alina Vinslava; Rashmi Bagai; Wolfgang Wernsdorfer; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Toward a Magnetostructural Correlation for a Family of Mn6SMMs","Journal of the American Chemical Society","2007","129","","12505","12511","10.1021/ja0736616","","","0.71073","MoKα","","0.1188","0.0815","","0.0529","0.0499","0.0499","","","","","","1.0028","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110009","12.5755","0.0005","13.1557","0.0005","15.3021","0.0006","90.254","0.002","92.248","0.002","108.341","0.002","2400.74","0.16","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C46 H56 Mn3 N3 O14 -","- C46 H56 Mn3 N3 O14 -","- C92 H112 Mn6 N6 O28 -","2","1","","Constantinos J. Milios; Ross Inglis; Alina Vinslava; Rashmi Bagai; Wolfgang Wernsdorfer; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Toward a Magnetostructural Correlation for a Family of Mn6SMMs","Journal of the American Chemical Society","2007","129","","12505","12511","10.1021/ja0736616","","","0.71073","MoKα","","0.0397","0.0313","","0.0849","0.0828","0.0849","","","","","","0.9677","","","","has coordinates","264242","2021-04-16","08:52:16",""
"4110010","12.2619","0.0002","12.4095","0.0003","14.2027","0.0003","98.437","0.001","90.726","0.001","104.693","0.001","2065.03","0.08","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C74 H86 Br2 Mn6 N6 O24 -","- C74 H86 Br2 Mn6 N6 O24 -","- C74 H86 Br2 Mn6 N6 O24 -","1","0.5","","Constantinos J. Milios; Ross Inglis; Alina Vinslava; Rashmi Bagai; Wolfgang Wernsdorfer; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Toward a Magnetostructural Correlation for a Family of Mn6SMMs","Journal of the American Chemical Society","2007","129","","12505","12511","10.1021/ja0736616","","","0.71073","MoKα","","0.068","0.0552","","0.069","0.0646","0.0646","","","","","","1.0983","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110011","12.4947","0.0009","13.2846","0.0009","14.5047","0.0011","71.488","0.004","82.305","0.004","68.687","0.004","2126.4","0.3","150","","150","","","","","","","","C. Milios","5","P -1","-P 1","2","","","","- C40 H52 Mn3 N3 O13 -","- C40 H52 Mn3 N3 O13 -","- C80 H104 Mn6 N6 O26 -","2","1","","Constantinos J. Milios; Ross Inglis; Alina Vinslava; Rashmi Bagai; Wolfgang Wernsdorfer; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Toward a Magnetostructural Correlation for a Family of Mn6SMMs","Journal of the American Chemical Society","2007","129","","12505","12511","10.1021/ja0736616","","","0.71073","MoKα","","0.0589","0.0339","","0.1033","0.0796","0.1033","","","","","","0.969","","","","has coordinates","264242","2021-04-16","08:52:16",""
"4110012","12.912","0.0002","23.553","0.0004","15.19","0.0003","90","","107.549","0.001","90","","4404.53","0.14","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C84 H108 Mn6 N6 O24 -","- C84 H108 Mn6 N6 O24 -","- C168 H216 Mn12 N12 O48 -","2","0.5","","Constantinos J. Milios; Ross Inglis; Alina Vinslava; Rashmi Bagai; Wolfgang Wernsdorfer; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Toward a Magnetostructural Correlation for a Family of Mn6SMMs","Journal of the American Chemical Society","2007","129","","12505","12511","10.1021/ja0736616","","x-ray","0.71073","MoKα","","0.0904","0.0414","","0.1425","0.0944","0.1425","","","","","","1.0197","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110013","12.7121","0.0004","13.198","0.0004","15.2785","0.0005","75.593","0.002","78.672","0.002","68.389","0.002","2292.53","0.13","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C88 H120 Mn6 N6 O24 -","- C88 H106 Mn6 N6 O24 -","- C88 H106 Mn6 N6 O24 -","1","0.5","","Constantinos J. Milios; Ross Inglis; Alina Vinslava; Rashmi Bagai; Wolfgang Wernsdorfer; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Toward a Magnetostructural Correlation for a Family of Mn6SMMs","Journal of the American Chemical Society","2007","129","","12505","12511","10.1021/ja0736616","","","0.71073","MoKα","","0.07","0.0426","","0.0995","0.0923","0.0995","","","","","","0.863","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110014","11.1507","0.0003","13.9643","0.0003","14.3862","0.0003","67.693","0.001","70.479","0.001","75.741","0.001","1934.91","0.08","150","2","150","2","","","","","","","C.Milios reaction CM2680","6","P -1","-P 1","2","","","","- C70 H88 Mn6 N6 O26 S2 -","- C70 H88 Mn6 N6 O26 S2 -","- C70 H88 Mn6 N6 O26 S2 -","1","0.5","","Constantinos J. Milios; Ross Inglis; Alina Vinslava; Rashmi Bagai; Wolfgang Wernsdorfer; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Toward a Magnetostructural Correlation for a Family of Mn6SMMs","Journal of the American Chemical Society","2007","129","","12505","12511","10.1021/ja0736616","","","0.71073","MoKα","","0.0816","0.0658","","","0.1406","0.1473","","","","","","1.181","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110015","12.6159","0.0003","13.0159","0.0002","14.585","0.0003","105.679","0.001","92.625","0.001","105.169","0.001","2207.95","0.08","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C82 H108 Mn6 N6 O26 -","- C82 H108 Mn6 N6 O26 -","- C82 H108 Mn6 N6 O26 -","1","0.5","","Constantinos J. Milios; Ross Inglis; Alina Vinslava; Rashmi Bagai; Wolfgang Wernsdorfer; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Toward a Magnetostructural Correlation for a Family of Mn6SMMs","Journal of the American Chemical Society","2007","129","","12505","12511","10.1021/ja0736616","","","0.71073","MoKα","","0.0537","0.0366","","0.0892","0.0858","0.0892","","","","","","0.8861","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110016","12.9841","0.0003","13.2178","0.0003","15.9543","0.0004","77.164","0.002","69.377","0.001","64.128","0.001","2298.15","0.1","150","2","150","2","","","","","","","C.Milios CM3229","5","P -1","-P 1","2","","","","- C90 H128 Mn6 N6 O26 -","- C90 H128 Mn6 N6 O26 -","- C90 H128 Mn6 N6 O26 -","1","0.5","","Constantinos J. Milios; Ross Inglis; Alina Vinslava; Rashmi Bagai; Wolfgang Wernsdorfer; Simon Parsons; Spyros P. Perlepes; George Christou; Euan K. Brechin","Toward a Magnetostructural Correlation for a Family of Mn6SMMs","Journal of the American Chemical Society","2007","129","","12505","12511","10.1021/ja0736616","","","0.71073","MoKα","","0.0489","0.0356","","","0.091","0.0949","","","","","","1.053","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4110017","9.509","0.004","12.566","0.006","12.51","0.008","90","","106.781","0.018","90","","1431.2","1.3","123.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C33 H30 Cl N O5 -","- C33 H30 Cl N O5 -","- C66 H60 Cl2 N2 O10 -","2","1","","Ryo Shintani; Masataka Murakami; Tamio Hayashi","γ-Methylidene-δ-valerolactones as a Coupling Partner for Cycloaddition: Palladium-Catalyzed [4 + 3] Cycloaddition with Nitrones","Journal of the American Chemical Society","2007","129","","12356","12357","10.1021/ja073997f","","","0.71075","MoKα","","","0.052","","","","0.0597","","","","","","0.909","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110018","10.979","0.004","14.52","0.006","14.534","0.006","90","","108.12","0.014","90","","2202","1.5","123.1","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C24 H23 F3 N2 O3 -","- C24 H23 F3 N2 O3 -","- C96 H92 F12 N8 O12 -","4","1","","Ryo Shintani; Masataka Murakami; Tamio Hayashi","γ-Methylidene-δ-valerolactones as a Coupling Partner for Cycloaddition: Palladium-Catalyzed [4 + 3] Cycloaddition with Nitrones","Journal of the American Chemical Society","2007","129","","12356","12357","10.1021/ja073997f","","","0.71075","MoKα","","","0.068","","","","0.0829","","","","","","1.07","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110019","25.8074","0.0018","25.8074","0.0018","25.8074","0.0018","90","","90","","90","","17188","2","296","2","296","2","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- C0.01 H0 O0.01 Zn0 -","- C0.447552 H0.167832 O0.34965 Zn0.0559441 -","- C256 H96 O200 Zn32 -","572","2.97917","","Zhenqiang Wang; Seth M. Cohen","Postsynthetic Covalent Modification of a Neutral Metal-Organic Framework","Journal of the American Chemical Society","2007","129","","12368","12369","10.1021/ja074366o","","","0.71073","MoKα","","0.1685","0.1173","","","0.3458","0.4259","","","","","","1.648","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110020","15.1323","0.0004","7.9402","0.0002","16.5539","0.0004","90","","116.197","0.001","90","","1784.7","0.08","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H24 N2 Pt -","- C20 H24 N2 Pt -","- C80 H96 N8 Pt4 -","4","1","","Nathan M. West; Peter S. White; Joseph L. Templeton","Facile Dehydrogenation of Ethers and Alkanes with aβ-Diiminate Pt Fragment","Journal of the American Chemical Society","2007","129","","12372","12373","10.1021/ja074488g","","","0.71073","MoKα","","0.0197","0.0164","","","0.0348","0.0358","","","","","","1.036","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110021","9.335","0.0007","10.3431","0.0007","20.4134","0.0018","99.063","0.001","93.37","0.001","115.353","0.001","1741.2","0.2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H20 N2 O Pt -","- C19 H20 N2 O Pt -","- C76 H80 N8 O4 Pt4 -","4","2","","Nathan M. West; Peter S. White; Joseph L. Templeton","Facile Dehydrogenation of Ethers and Alkanes with aβ-Diiminate Pt Fragment","Journal of the American Chemical Society","2007","129","","12372","12373","10.1021/ja074488g","","","0.71073","MoKα","","0.0449","0.0357","","","0.0873","0.0929","","","","","","1.024","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110022","6.791","0.0007","13.8156","0.0013","8.818","0.0009","90","","95.531","0.002","90","","823.47","0.14","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","07153a","","","- C18 H17 Cl N2 O3 -","- C18 H17 Cl N2 O3 -","- C36 H34 Cl2 N4 O6 -","2","1","","Barry M. Trost; Nicolai Cramer; Steven M. Silverman","Enantioselective Construction of Spirocyclic Oxindolic Cyclopentanes by Palladium-Catalyzed Trimethylenemethane-[3+2]-Cycloaddition","Journal of the American Chemical Society","2007","129","","12396","12397","10.1021/ja075335w","","","0.71073","MoKα","","0.0301","0.0283","","","0.0717","0.0731","","","","","","1.046","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110023","5.824","0.0006","12.8616","0.0012","20.943","0.002","90","","90","","90","","1568.8","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","07159a","","","- C16 H20 Cl N O2 -","- C16 H20 Cl N O2 -","- C64 H80 Cl4 N4 O8 -","4","1","","Barry M. Trost; Steven M. Silverman; James P. Stambuli","Palladium-Catalyzed Asymmetric [3+2] Cycloaddition of Trimethylenemethane with Imines","Journal of the American Chemical Society","2007","129","","12398","12399","10.1021/ja0753389","","","0.71073","MoKα","","0.0414","0.0335","","","0.0729","0.0765","","","","","","1.061","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110024","22.6391","0.0005","10.4105","0.0005","21.8924","0.0008","90","","112.59","0.0014","90","","4763.8","0.3","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H72 N4 Zr -","- C52 H72 N4 Zr -","- C208 H288 N16 Zr4 -","4","1","","Corneliu Stanciu; Mary E. Jones; Phillip E. Fanwick; Mahdi M. Abu-Omar","Multi-electron Activation of Dioxygen on Zirconium(IV) to Give an Unprecedented Bisperoxo Complex","Journal of the American Chemical Society","2007","129","","12400","12401","10.1021/ja075396u","","","0.71073","MO-Kα","","0.082","0.043","","","0.096","0.113","","","","","","0.94","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110025","11.6553","0.0002","22.845","0.0005","21.8219","0.0006","90","","95.986","0.004","90","","5778.7","0.2","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H88 N4 O6 Zr -","- C60 H88 N4 O6 Zr -","- C240 H352 N16 O24 Zr4 -","4","1","","Corneliu Stanciu; Mary E. Jones; Phillip E. Fanwick; Mahdi M. Abu-Omar","Multi-electron Activation of Dioxygen on Zirconium(IV) to Give an Unprecedented Bisperoxo Complex","Journal of the American Chemical Society","2007","129","","12400","12401","10.1021/ja075396u","","","0.71073","MO-Kα","","0.12","0.086","","","0.143","0.156","","","","","","1.155","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110026","5.841","0.001","13.469","0.003","20.984","0.005","90","","90.625","0.003","90","","1650.8","0.6","138.2","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H22 O4 -","- C19 H22 O4 -","- C76 H88 O16 -","4","1","","Michael R. Luzung; Pablo Mauleón; F. Dean Toste","Gold(I)-Catalyzed [2 + 2]-Cycloaddition of Allenenes","Journal of the American Chemical Society","2007","129","","12402","12403","10.1021/ja075412n","","","0.7107","MoKα","","0.0757","0.0394","","0.0486","","0.0435","","","","","","1.796","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110027","7.597","0.003","10.378","0.004","15.152","0.006","99.237","0.007","98.206","0.006","94.922","0.006","1159.8","0.8","100.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C24 H32 O5 -","- C24 H32 O5 -","- C48 H64 O10 -","2","1","","Michael R. Luzung; Pablo Mauleón; F. Dean Toste","Gold(I)-Catalyzed [2 + 2]-Cycloaddition of Allenenes","Journal of the American Chemical Society","2007","129","","12402","12403","10.1021/ja075412n","","","0.7107","MoKα","","0.1271","0.0728","","","","0.103","","","","","","1.821","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110028","14.277","0.003","7.424","0.001","18","0.003","90","","93.883","0.003","90","","1903.5","0.6","119.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H25 N O2 S -","- C22 H25 N O2 S -","- C88 H100 N4 O8 S4 -","4","1","","Michael R. Luzung; Pablo Mauleón; F. Dean Toste","Gold(I)-Catalyzed [2 + 2]-Cycloaddition of Allenenes","Journal of the American Chemical Society","2007","129","","12402","12403","10.1021/ja075412n","","","0.7107","MoKα","","0.0802","0.0428","","0.0516","","0.0465","","","","","","1.813","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110029","10.1936","0.0005","19.8023","0.0009","14.7695","0.0007","90","","100.61","0.001","90","","2930.4","0.2","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H36 B Br3 N2 -","- C27 H36 B Br3 N2 -","- C108 H144 B4 Br12 N8 -","4","1","","Yuzhong Wang; Brandon Quillian; Pingrong Wei; Chaitanya S. Wannere; Yaoming Xie; R. Bruce King; Henry F. Schaefer; Paul V. R. Schleyer; Gregory H. Robinson","A Stable Neutral Diborene Containing a BB Double Bond","Journal of the American Chemical Society","2007","129","","12412","12413","10.1021/ja075932i","","","0.71073","MoKα","","0.0937","0.0464","","","0.1122","0.136","","","","","","1.003","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110030","12.8024","0.0017","14.372","0.002","14.466","0.002","90","","110.296","0.002","90","","2496.4","0.6","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C54 H76 B2 N4 -","- C54 H76 B2 N4 -","- C108 H152 B4 N8 -","2","0.5","","Yuzhong Wang; Brandon Quillian; Pingrong Wei; Chaitanya S. Wannere; Yaoming Xie; R. Bruce King; Henry F. Schaefer; Paul V. R. Schleyer; Gregory H. Robinson","A Stable Neutral Diborene Containing a BB Double Bond","Journal of the American Chemical Society","2007","129","","12412","12413","10.1021/ja075932i","","","0.71073","MoKα","","0.0971","0.0532","","","0.1294","0.1548","","","","","","1.014","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110031","12.3979","0.0016","21.067","0.003","39.689","0.005","90","","90","","90","","10366","2","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C54 H74 B2 N4 -","- C54 H74 B2 N4 -","- C432 H592 B16 N32 -","8","2","","Yuzhong Wang; Brandon Quillian; Pingrong Wei; Chaitanya S. Wannere; Yaoming Xie; R. Bruce King; Henry F. Schaefer; Paul V. R. Schleyer; Gregory H. Robinson","A Stable Neutral Diborene Containing a BB Double Bond","Journal of the American Chemical Society","2007","129","","12412","12413","10.1021/ja075932i","","","0.71073","MoKα","","0.3218","0.0792","","","0.1176","0.1861","","","","","","1.016","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110032","19.622","0.003","6.9958","0.0012","20.174","0.004","90","","101.398","0.002","90","","2714.7","0.8","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H39 B N2 -","- C27 H39 B N2 -","- C108 H156 B4 N8 -","4","1","","Yuzhong Wang; Brandon Quillian; Pingrong Wei; Chaitanya S. Wannere; Yaoming Xie; R. Bruce King; Henry F. Schaefer; Paul V. R. Schleyer; Gregory H. Robinson","A Stable Neutral Diborene Containing a BB Double Bond","Journal of the American Chemical Society","2007","129","","12412","12413","10.1021/ja075932i","","","0.71073","MoKα","","0.1276","0.0703","","","0.1741","0.2079","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110033","6.769","0.0001","15.6651","0.0003","14.3623","0.0003","90","","97.6867","0.0008","90","","1509.25","0.05","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H28 Li N Zn -","- C13 H28 Li N Zn -","- C52 H112 Li4 N4 Zn4 -","4","1","","Yoshinori Kondo; James V. Morey; Jacqueline C. Morgan; Hiroshi Naka; Daisuke Nobuto; Paul R. Raithby; Masanobu Uchiyama; Andrew E. H. Wheatley","On the Kinetic and Thermodynamic Reactivity of Lithium Di(alkyl)amidozincate Bases in Directed Ortho Metalation","Journal of the American Chemical Society","2007","129","","12734","12738","10.1021/ja072118m","","","0.71073","MoKα","","0.0335","0.0267","","","0.0674","0.0709","","","","","","1.032","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110034","12.8642","0.0002","18.0785","0.0003","18.0714","0.0003","90","","92.01","0.001","90","","4200.2","0.12","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H61 Li N2 O4 Zn -","- C44 H61 Li N2 O4 Zn -","- C176 H244 Li4 N8 O16 Zn4 -","4","1","","Yoshinori Kondo; James V. Morey; Jacqueline C. Morgan; Hiroshi Naka; Daisuke Nobuto; Paul R. Raithby; Masanobu Uchiyama; Andrew E. H. Wheatley","On the Kinetic and Thermodynamic Reactivity of Lithium Di(alkyl)amidozincate Bases in Directed Ortho Metalation","Journal of the American Chemical Society","2007","129","","12734","12738","10.1021/ja072118m","","","0.71073","MoKα","","0.0734","0.0496","","","0.1173","0.1324","","","","","","1.03","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110035","14.0803","0.0002","11.6398","0.0002","26.2134","0.0005","90","","97.485","0.001","90","","4259.56","0.13","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H62 Li N3 O4 Zn -","- C43 H62 Li N3 O4 Zn -","- C172 H248 Li4 N12 O16 Zn4 -","4","1","","Yoshinori Kondo; James V. Morey; Jacqueline C. Morgan; Hiroshi Naka; Daisuke Nobuto; Paul R. Raithby; Masanobu Uchiyama; Andrew E. H. Wheatley","On the Kinetic and Thermodynamic Reactivity of Lithium Di(alkyl)amidozincate Bases in Directed Ortho Metalation","Journal of the American Chemical Society","2007","129","","12734","12738","10.1021/ja072118m","","","0.71073","MoKα","","0.0891","0.0539","","","0.1064","0.1224","","","","","","1.042","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110036","10.4889","0.001","14.5745","0.0013","17.6357","0.0016","90","","90.986","0.002","90","","2695.6","0.4","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H42 N2 O5 Si -","- C25 H42 N2 O5 Si -","- C100 H168 N8 O20 Si4 -","4","1","","Laura E. Bourque; Pamela A. Cleary; K. A. Woerpel","Metal-Catalyzed Silylene Insertions of Allylic Ethers: Stereoselective Formation of Chiral Allylic Silanes","Journal of the American Chemical Society","2007","129","","12602","12603","10.1021/ja073758s","","","0.71073","MoKα","","0.0527","0.0358","","","0.0884","0.1006","","","","","","1.033","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110037","11.8218","0.0006","19.2336","0.0012","12.5458","0.0008","90","","107.123","0.004","90","","2726.2","0.3","160","1","160","1","","","","","","","","2","P 1 n 1","P -2yac","7","","","","- C70 H70 -","- C70 H70 -","- C140 H140 -","2","1","","Tomoharu Hayama; Yao-Ting Wu; Anthony Linden; Kim K. Baldridge; Jay S. Siegel","Synthesis, Structure, and Isomerization of Decapentynylcorannulene: Enediyne Cyclization/Interconversion of C40R10 Isomers","Journal of the American Chemical Society","2007","129","","12612","12613","10.1021/ja074403b","","","0.71073","MoKα","","0.0795","0.0592","","","0.1412","0.1569","","","","","","1.044","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110038","35.385","0.001","19.86","0.001","22.686","0.001","90","","96.436","0.001","90","","15842","1.2","100","1","100","1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C70 H70 -","- C70 H70 -","- C840 H840 -","12","3","","Tomoharu Hayama; Yao-Ting Wu; Anthony Linden; Kim K. Baldridge; Jay S. Siegel","Synthesis, Structure, and Isomerization of Decapentynylcorannulene: Enediyne Cyclization/Interconversion of C40R10 Isomers","Journal of the American Chemical Society","2007","129","","12612","12613","10.1021/ja074403b","","","0.775","synchrotron","","0.1493","0.1242","","","0.3547","0.3785","","","","","","2.031","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110039","12.4011","0.0009","24.8971","0.0018","8.7794","0.0005","90","","92.262","0.003","90","","2708.5","0.3","250","2","250","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 La N9 O14 -","- C18 H12 La N9 O14 -","- C72 H48 La4 N36 O56 -","4","1","","Thomas Devic; Olivier David; Marion Valls; Jérôme Marrot; François Couty; Gérard Férey","An Illustration of the Limit of the Metal Organic Framework's Isoreticular Principle Using a Semirigid Tritopic Linker Obtained by ""Click"" Chemistry","Journal of the American Chemical Society","2007","129","","12614","12615","10.1021/ja0744091","","","0.71073","MoKα","","0.0815","0.0442","","","0.1006","0.1284","","","","","","1.189","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110040","13.0998","0.0008","17.614","0.001","19.082","0.001","90","","90","","90","","4403","0.4","168.2","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C42 H60 Au2 Cl2 O6 P2 -","- C42.25 H41 Au2 Cl2 O6.5 P2 -","- C169 H164 Au8 Cl8 O26 P8 -","4","1","","Asa D. Melhado; Marco Luparia; F. Dean Toste","Au(I)-Catalyzed Enantioselective 1,3-Dipolar Cycloadditions of Münchnones with Electron-Deficient Alkenes","Journal of the American Chemical Society","2007","129","","12638","12639","10.1021/ja074824t","","","0.7107","MoKα","","0.0392","0.0298","","0.0391","","0.0369","","","","","","1.151","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110041","5.2609","0.0008","12.219","0.002","36.953","0.005","90","","90","","90","","2375.4","0.6","154.2","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H25 N3 O3 -","- C28 H25 N3 O3 -","- C112 H100 N12 O12 -","4","1","","Asa D. Melhado; Marco Luparia; F. Dean Toste","Au(I)-Catalyzed Enantioselective 1,3-Dipolar Cycloadditions of Münchnones with Electron-Deficient Alkenes","Journal of the American Chemical Society","2007","129","","12638","12639","10.1021/ja074824t","","","0.7107","MoKα","","0.0662","0.0532","","0.0639","","0.0621","","","","","","2.473","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110042","7.0064","0.0009","13.373","0.001","21.334","0.003","107.146","0.003","98.682","0.004","92.615","0.005","1879.6","0.4","296.1","","","","","","","","","","","8","P -1","-P 1","2","","","","- C23 H14 Br4 Cl Fe O6 S8 Se4 -","- C23 H14 Br4 Cl Fe O6 S8 Se4 -","- C46 H28 Br8 Cl2 Fe2 O12 S16 Se8 -","2","1","","Xunwen Xiao; Toshiki Hayashi; Hideki Fujiwara; Toyonari Sugimoto; Satoru Noguchi; Yufeng Weng; Harukazu Yoshino; Keizo Murata; Hiroko Aruga Katori","An Antiferromagnetic Molecular Metal Based on a New Bent-Donor Molecule","Journal of the American Chemical Society","2007","129","","12618","12619","10.1021/ja074840q","","","0.7107","MoKα","","","0.097","","","","0.106","","","","","","1.093","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110043","5.8187","0.0012","9.1892","0.0018","18.204","0.004","71.03","0.03","82.3","0.03","78.49","0.03","899.5","0.4","295","2","295","2","","","","","","","","2","P -1","-P 1","2","phenylacetylene, polymorph beta","Ethynylbenzene, polymorph beta at 0.4 GPa","","- C8 H6 -","- C8 H6 -","- C48 H36 -","6","3","","Kamil Dziubek; Marcin Podsiadło; Andrzej Katrusiak","Nearly Isostructural Polymorphs of Ethynylbenzene: Resolution of \τbCH...π(arene) and Cooperative \τbCH...π(C\τbC) Interactions by Pressure Freezing","Journal of the American Chemical Society","2007","129","","12620","12621","10.1021/ja074885r","","","0.71073","MoKα","","0.0794","0.0375","","","0.0693","0.0786","","","","","","0.972","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110044","5.8037","0.0012","9.1671","0.0018","18.163","0.004","71.08","0.03","82.33","0.03","78.47","0.03","893.2","0.4","295","2","295","2","","","","","","","","2","P -1","-P 1","2","phenylacetylene, polymorph beta at 0.43 GPa","Ethynylbenzene, polymorph beta at 0.43 GPa","","- C8 H6 -","- C8 H6 -","- C48 H36 -","6","3","","Kamil Dziubek; Marcin Podsiadło; Andrzej Katrusiak","Nearly Isostructural Polymorphs of Ethynylbenzene: Resolution of \τbCH...π(arene) and Cooperative \τbCH...π(C\τbC) Interactions by Pressure Freezing","Journal of the American Chemical Society","2007","129","","12620","12621","10.1021/ja074885r","","","0.71073","MoKα","","0.0654","0.0364","","","0.0816","0.091","","","","","","1.094","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110045","5.7459","0.0011","9.1349","0.0018","18.135","0.004","71.18","0.03","82.34","0.03","78.48","0.03","880.4","0.4","295","2","295","2","","","","","","","","2","P -1","-P 1","2","phenylacetylene, polymorph beta at 0.51 GPa","Ethynylbenzene, polymorph beta at 0.51 GPa","","- C8 H6 -","- C8 H6 -","- C48 H36 -","6","3","","Kamil Dziubek; Marcin Podsiadło; Andrzej Katrusiak","Nearly Isostructural Polymorphs of Ethynylbenzene: Resolution of \τbCH...π(arene) and Cooperative \τbCH...π(C\τbC) Interactions by Pressure Freezing","Journal of the American Chemical Society","2007","129","","12620","12621","10.1021/ja074885r","","","0.71073","MoKα","","0.0779","0.0496","","","0.126","0.1436","","","","","","1.117","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110046","5.7175","0.0011","9.0544","0.0018","17.832","0.004","71.11","0.03","82.44","0.03","78.38","0.03","853.3","0.3","295","2","295","2","","","","","","","","2","P -1","-P 1","2","phenylacetylene, polymorph beta at 0.76 GPa","Ethynylbenzene, polymorph beta at 0.76 GPa","","- C8 H6 -","- C8 H6 -","- C48 H36 -","6","3","","Kamil Dziubek; Marcin Podsiadło; Andrzej Katrusiak","Nearly Isostructural Polymorphs of Ethynylbenzene: Resolution of \τbCH...π(arene) and Cooperative \τbCH...π(C\τbC) Interactions by Pressure Freezing","Journal of the American Chemical Society","2007","129","","12620","12621","10.1021/ja074885r","","","0.71073","MoKα","","0.0784","0.0395","","","0.0791","0.0918","","","","","","0.979","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110047","5.6592","0.0011","8.9711","0.0018","17.701","0.004","71.09","0.03","82.67","0.03","78.28","0.03","830.6","0.3","295","2","295","2","","","","","","","","2","P -1","-P 1","2","phenylacetylene, polymorph beta at 1.25 GPa","Ethynylbenzene, polymorph beta at 1.25 GPa","","- C8 H6 -","- C8 H6 -","- C48 H36 -","6","3","","Kamil Dziubek; Marcin Podsiadło; Andrzej Katrusiak","Nearly Isostructural Polymorphs of Ethynylbenzene: Resolution of \τbCH...π(arene) and Cooperative \τbCH...π(C\τbC) Interactions by Pressure Freezing","Journal of the American Chemical Society","2007","129","","12620","12621","10.1021/ja074885r","","","0.71073","MoKα","","0.0857","0.0425","","","0.0683","0.0807","","","","","","1.053","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110048","5.7585","0.0012","9.1743","0.0018","15.417","0.003","77.59","0.03","81.62","0.03","80.75","0.03","779.9","0.3","100","2","295","2","","","","","","","","2","P -1","-P 1","2","phenylacetylene, polymorph alpha at 100K","Ethynylbenzene, polymorph alpha at 100K","","- C8 H6 -","- C8 H5.4 -","- C40 H27 -","5","2.5","","Kamil Dziubek; Marcin Podsiadło; Andrzej Katrusiak","Nearly Isostructural Polymorphs of Ethynylbenzene: Resolution of \τbCH...π(arene) and Cooperative \τbCH...π(C\τbC) Interactions by Pressure Freezing","Journal of the American Chemical Society","2007","129","","12620","12621","10.1021/ja074885r","","","0.71073","MoKα","","0.2622","0.1087","","","0.3042","0.3882","","","","","","1.084","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110049","5.863","0.0012","9.1863","0.0018","15.474","0.003","76.81","0.03","81.68","0.03","80.32","0.03","795","0.3","225","2","295","2","","","","","","","","2","P -1","-P 1","2","phenylacetylene, polymorph alpha at 225 K","Ethynylbenzene, polymorph alpha at 225 K","","- C8 H6 -","- C8 H5.6 -","- C40 H28 -","5","2.5","","Kamil Dziubek; Marcin Podsiadło; Andrzej Katrusiak","Nearly Isostructural Polymorphs of Ethynylbenzene: Resolution of \τbCH...π(arene) and Cooperative \τbCH...π(C\τbC) Interactions by Pressure Freezing","Journal of the American Chemical Society","2007","129","","12620","12621","10.1021/ja074885r","","","0.71073","MoKα","","0.3585","0.08","","","0.1772","0.3331","","","","","","0.784","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110050","16.14097","0.00018","16.8563","0.0003","15.227","0.0004","90","","90","","90","","4142.92","0.14","150","2","150","2","","","","","","","","5","C m c 21","C 2c -2","36","","","","- C46 H36 Cl6 P2 Pt -","- C45 H34 Cl4 P2 Pt -","- C180 H136 Cl16 P8 Pt4 -","4","0.5","","Laura Bini; Christian Müller; Jos Wilting; Lars von Chrzanowski; Anthony L. Spek; Dieter Vogt","Highly Selective Hydrocyanation of Butadiene toward 3-Pentenenitrile","Journal of the American Chemical Society","2007","129","","12622","12623","10.1021/ja074922e","","","0.71073","MoKα","","0.0272","0.0268","","","0.07","0.0702","","","","","","1.037","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110051","9.3586","0.0002","9.8599","0.0002","11.6271","0.0003","93.428","0.001","97.556","0.001","101.899","0.001","1036.53","0.04","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H58 Fe2 K N4 O12 S2 -","- C28 H58 Fe2 K N4 O12 S2 -","- C28 H58 Fe2 K N4 O12 S2 -","1","0.5","","Chih-Chin Tsou; Tsai-Te Lu; Wen-Feng Liaw","EPR, UV-Vis, IR, and X-ray Demonstration of the Anionic Dimeric Dinitrosyl Iron Complex [(NO)2Fe(μ-StBu)2Fe(NO)2]-: Relevance to the Products of Nitrosylation of Cytosolic and Mitochondrial Aconitases, and High-Potential Iron Proteins","Journal of the American Chemical Society","2007","129","","12626","12627","10.1021/ja0751375","","","0.71073","MoKα","","0.0548","0.0414","","","0.1087","0.1221","","","","","","1.07","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110052","13.7977","0.0014","10.515","0.001","29.192","0.003","90","","100.057","0.002","90","","4170.2","0.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H48 Fe N3 O2 P2 S2 -","- C44 H48 Fe N3 O2 P2 S2 -","- C176 H192 Fe4 N12 O8 P8 S8 -","4","1","","Chih-Chin Tsou; Tsai-Te Lu; Wen-Feng Liaw","EPR, UV-Vis, IR, and X-ray Demonstration of the Anionic Dimeric Dinitrosyl Iron Complex [(NO)2Fe(μ-StBu)2Fe(NO)2]-: Relevance to the Products of Nitrosylation of Cytosolic and Mitochondrial Aconitases, and High-Potential Iron Proteins","Journal of the American Chemical Society","2007","129","","12626","12627","10.1021/ja0751375","","","0.71073","MoKα","","0.0637","0.0404","","","0.0841","0.0891","","","","","","0.897","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110053","6.276","0.0012","13.602","0.003","21.238","0.004","90","","90","","90","","1813","0.6","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H20 N2 O2 -","- C23 H20 N2 O2 -","- C92 H80 N8 O8 -","4","1","","Yang S. Tran; Ohyun Kwon","Phosphine-Catalyzed [4 + 2] Annulation: Synthesis of Cyclohexenes","Journal of the American Chemical Society","2007","129","","12632","12633","10.1021/ja0752181","","","0.71073","MoKα","","0.0377","0.0293","","","0.0598","0.0636","","","","","","1.006","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110054","7.644","0.002","18.09","0.005","12.853","0.003","90","","106.354","0.003","90","","1705.4","0.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H19 N3 O2 -","- C20 H19 N3 O2 -","- C80 H76 N12 O8 -","4","1","","Yang S. Tran; Ohyun Kwon","Phosphine-Catalyzed [4 + 2] Annulation: Synthesis of Cyclohexenes","Journal of the American Chemical Society","2007","129","","12632","12633","10.1021/ja0752181","","","0.71073","MoKα","","0.133","0.0564","","","0.109","0.1356","","","","","","0.99","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110055","9.635","0.002","10.147","0.002","16.414","0.004","90","","105.077","0.004","90","","1549.5","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 N O3 -","- C19 H19 N O3 -","- C76 H76 N4 O12 -","4","1","","Yang S. Tran; Ohyun Kwon","Phosphine-Catalyzed [4 + 2] Annulation: Synthesis of Cyclohexenes","Journal of the American Chemical Society","2007","129","","12632","12633","10.1021/ja0752181","","","0.71073","MoKα","","0.047","0.0406","","","0.1046","0.1092","","","","","","1.027","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110056","10.3382","0.0007","17.7093","0.0013","23.8765","0.0017","90","","97.699","0.001","90","","4332","0.5","220","2","220","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","cmpd 1","Dizirconium dinitrogen complex","","- C38 H70 N8 Zr2 -","- C38 H70 N8 Zr2 -","- C152 H280 N32 Zr8 -","4","1","","Masakazu Hirotsu; Philip P. Fontaine; Peter Y. Zavalij; Lawrence R. Sita","Extreme N\τbN Bond Elongation and Facile N-Atom Functionalization Reactions within Two Structurally Versatile New Families of Group 4 Bimetallic ""Side-on-Bridged"" Dinitrogen Complexes for Zirconium and Hafnium","Journal of the American Chemical Society","2007","129","","12690","12692","10.1021/ja0752989","","","0.71073","MoKα","","0.0408","0.0283","","","0.0621","0.0685","","","","","","0.999","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110057","10.3346","0.0006","17.8529","0.0011","23.6247","0.0014","90","","96.842","0.001","90","","4327.8","0.4","220","2","220","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","cmpd_2","","","- C38 H70 Hf2 N8 -","- C38 H70 Hf2 N8 -","- C152 H280 Hf8 N32 -","4","1","","Masakazu Hirotsu; Philip P. Fontaine; Peter Y. Zavalij; Lawrence R. Sita","Extreme N\τbN Bond Elongation and Facile N-Atom Functionalization Reactions within Two Structurally Versatile New Families of Group 4 Bimetallic ""Side-on-Bridged"" Dinitrogen Complexes for Zirconium and Hafnium","Journal of the American Chemical Society","2007","129","","12690","12692","10.1021/ja0752989","","","0.71073","MoKα","","0.0304","0.0234","","","0.0523","0.055","","","","","","1","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110058","17.0487","0.001","18.9416","0.0011","25.4574","0.0016","90","","90","","90","","8220.9","0.9","220","2","220","2","","","","","","","","4","P c a 21","P 2c -2ac","29","cmpd_3","","","- C36 H66 Hf2 N8 -","- C36 H66 Hf2 N8 -","- C288 H528 Hf16 N64 -","8","2","","Masakazu Hirotsu; Philip P. Fontaine; Peter Y. Zavalij; Lawrence R. Sita","Extreme N\τbN Bond Elongation and Facile N-Atom Functionalization Reactions within Two Structurally Versatile New Families of Group 4 Bimetallic ""Side-on-Bridged"" Dinitrogen Complexes for Zirconium and Hafnium","Journal of the American Chemical Society","2007","129","","12690","12692","10.1021/ja0752989","","","0.71073","MoKα","","0.0332","0.0253","","","0.0552","0.0586","","","","","","1","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110059","13.9712","0.001","22.8383","0.0017","14.6871","0.0011","90","","105.059","0.001","90","","4525.4","0.6","220","2","220","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","cmpd_4","","","- C41 H76 Hf2 N6 -","- C41 H64 Hf2 N6 -","- C164 H256 Hf8 N24 -","4","0.5","","Masakazu Hirotsu; Philip P. Fontaine; Peter Y. Zavalij; Lawrence R. Sita","Extreme N\τbN Bond Elongation and Facile N-Atom Functionalization Reactions within Two Structurally Versatile New Families of Group 4 Bimetallic ""Side-on-Bridged"" Dinitrogen Complexes for Zirconium and Hafnium","Journal of the American Chemical Society","2007","129","","12690","12692","10.1021/ja0752989","","","0.71073","MoKα","","0.0226","0.0187","","","0.0456","0.0482","","","","","","1","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110060","15.0967","0.0007","16.03","0.0008","31.8146","0.0015","90","","90","","90","","7699.1","0.6","220","2","220","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","cmpd_5","","","- C34 H60 Hf2 N6 -","- C34 H60 Hf2 N6 -","- C272 H480 Hf16 N48 -","8","1","","Masakazu Hirotsu; Philip P. Fontaine; Peter Y. Zavalij; Lawrence R. Sita","Extreme N\τbN Bond Elongation and Facile N-Atom Functionalization Reactions within Two Structurally Versatile New Families of Group 4 Bimetallic ""Side-on-Bridged"" Dinitrogen Complexes for Zirconium and Hafnium","Journal of the American Chemical Society","2007","129","","12690","12692","10.1021/ja0752989","","","0.71073","MoKα","","0.0342","0.0224","","","0.0492","0.0547","","","","","","0.998","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110061","12.7984","0.0009","16.6686","0.0011","17.2329","0.0012","90","","96.292","0.001","90","","3654.2","0.4","220","2","220","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","cmpd_6","","","- C32 H56 Hf2 N6 -","- C32 H56 Hf2 N6 -","- C128 H224 Hf8 N24 -","4","1","","Masakazu Hirotsu; Philip P. Fontaine; Peter Y. Zavalij; Lawrence R. Sita","Extreme N\τbN Bond Elongation and Facile N-Atom Functionalization Reactions within Two Structurally Versatile New Families of Group 4 Bimetallic ""Side-on-Bridged"" Dinitrogen Complexes for Zirconium and Hafnium","Journal of the American Chemical Society","2007","129","","12690","12692","10.1021/ja0752989","","","0.71073","MoKα","","0.0451","0.0274","","","0.0574","0.0651","","","","","","1","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110062","40.804","0.002","45.984","0.002","9.8364","0.0005","90","","90","","90","","18456.3","1.5","220","2","220","2","","","","","","","","5","F d d 2","F 2 -2d","43","cmpd_7a","","","- C42 H74 Hf2 N8 Si -","- C42 H74 Hf2 N8 Si -","- C672 H1184 Hf32 N128 Si16 -","16","1","","Masakazu Hirotsu; Philip P. Fontaine; Peter Y. Zavalij; Lawrence R. Sita","Extreme N\τbN Bond Elongation and Facile N-Atom Functionalization Reactions within Two Structurally Versatile New Families of Group 4 Bimetallic ""Side-on-Bridged"" Dinitrogen Complexes for Zirconium and Hafnium","Journal of the American Chemical Society","2007","129","","12690","12692","10.1021/ja0752989","","","0.71073","MoKα","","0.042","0.0367","","","0.0712","0.0728","","","","","","1","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110063","11.2318","0.0007","11.8589","0.0007","31.064","0.002","90","","96.233","0.001","90","","4113.2","0.4","220","2","220","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","cmpd_8a","","","- C36 H68 Hf2 N8 -","- C36 H68 Hf2 N8 -","- C144 H272 Hf8 N32 -","4","1","","Masakazu Hirotsu; Philip P. Fontaine; Peter Y. Zavalij; Lawrence R. Sita","Extreme N\τbN Bond Elongation and Facile N-Atom Functionalization Reactions within Two Structurally Versatile New Families of Group 4 Bimetallic ""Side-on-Bridged"" Dinitrogen Complexes for Zirconium and Hafnium","Journal of the American Chemical Society","2007","129","","12690","12692","10.1021/ja0752989","","","0.71073","MoKα","","0.0247","0.0194","","","0.0407","0.0423","","","","","","1","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110064","10.1039","0.0006","12.1053","0.0007","16.7525","0.001","108.998","0.001","92.159","0.001","90.871","0.001","1935.2","0.2","220","2","220","2","","","","","","","","5","P -1","-P 1","2","cmpd_9a","","","- C36 H65 Br Hf2 N6 -","- C36 H65 Br Hf2 N6 -","- C72 H130 Br2 Hf4 N12 -","2","1","","Masakazu Hirotsu; Philip P. Fontaine; Peter Y. Zavalij; Lawrence R. Sita","Extreme N\τbN Bond Elongation and Facile N-Atom Functionalization Reactions within Two Structurally Versatile New Families of Group 4 Bimetallic ""Side-on-Bridged"" Dinitrogen Complexes for Zirconium and Hafnium","Journal of the American Chemical Society","2007","129","","12690","12692","10.1021/ja0752989","","","0.71073","MoKα","","0.0346","0.0262","","","0.0566","0.0595","","","","","","1","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110065","9.0206","0.0006","17.6707","0.0012","23.9453","0.0016","90","","93.368","0.001","90","","3810.3","0.4","220","2","220","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","cmpd_9b","","","- C34 H61 Br Hf2 N6 -","- C34 H61 Br Hf2 N6 -","- C136 H244 Br4 Hf8 N24 -","4","1","","Masakazu Hirotsu; Philip P. Fontaine; Peter Y. Zavalij; Lawrence R. Sita","Extreme N\τbN Bond Elongation and Facile N-Atom Functionalization Reactions within Two Structurally Versatile New Families of Group 4 Bimetallic ""Side-on-Bridged"" Dinitrogen Complexes for Zirconium and Hafnium","Journal of the American Chemical Society","2007","129","","12690","12692","10.1021/ja0752989","","","0.71073","MoKα","","0.0672","0.0435","","","0.0837","0.0899","","","","","","1","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110066","10.5064","0.001","32.344","0.003","11.6972","0.0011","90","","95.079","0.001","90","","3959.3","0.6","220","2","220","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","cmpd_10","","","- C34 H60 Br2 Hf2 N6 -","- C34 H60 Br2 Hf2 N6 -","- C136 H240 Br8 Hf8 N24 -","4","1","","Masakazu Hirotsu; Philip P. Fontaine; Peter Y. Zavalij; Lawrence R. Sita","Extreme N\τbN Bond Elongation and Facile N-Atom Functionalization Reactions within Two Structurally Versatile New Families of Group 4 Bimetallic ""Side-on-Bridged"" Dinitrogen Complexes for Zirconium and Hafnium","Journal of the American Chemical Society","2007","129","","12690","12692","10.1021/ja0752989","","","0.71073","MoKα","","0.03","0.0211","","","0.0424","0.045","","","","","","1.001","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110067","10.3477","0.0004","9.7315","0.0004","17.1742","0.0009","90","","96.03","0.002","90","","1719.85","0.13","153","2","153","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C17 H18 Br N O2 S -","- C17 H18 Br N O2 S -","- C68 H72 Br4 N4 O8 S4 -","4","2","","Ming-Yu Ngai; Andriy Barchuk; Michael J. Krische","Enantioselective Iridium-Catalyzed Imine Vinylation: Optically Enriched Allylic Amines via Alkyne-Imine Reductive Coupling Mediated by Hydrogen","Journal of the American Chemical Society","2007","129","","12644","12645","10.1021/ja075438e","","","0.71073","MoKα","","0.09","0.0586","","","0.1153","0.1293","","","","","","1.079","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110068","14.3108","0.0004","6.9979","0.0009","11.4476","0.0007","90","","90","","90","","1146.43","0.17","12","1","12","1","","","","","","","","6","C m c m","-C 2c 2","63","","","","- C4 H4 Co N2 O10 V4 -","- C4 H4 Co N2 O10 V4 -","- C16 H16 Co4 N8 O40 V16 -","4","0.25","","Bangbo Yan; Marilyn M. Olmstead; Paul A. Maggard","Effect of Spin-Ladder Topology on 2D Charge Ordering: Toward New Spin-Antiferroelectric Transitions","Journal of the American Chemical Society","2007","129","","12646","12647","10.1021/ja0754709","","","0.71073","MoKα","","0.0371","0.033","","","0.0785","0.079","","","","","","1.341","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110069","14.438","0.001","6.9788","0.0005","11.4743","0.0008","90","","90","","90","","1156.15","0.14","10","2","10","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C4 H4 N2 O10 V4 Zn -","- C4 H4 N2 O10 V4 Zn -","- C16 H16 N8 O40 V16 Zn4 -","4","0.5","","Bangbo Yan; Marilyn M. Olmstead; Paul A. Maggard","Effect of Spin-Ladder Topology on 2D Charge Ordering: Toward New Spin-Antiferroelectric Transitions","Journal of the American Chemical Society","2007","129","","12646","12647","10.1021/ja0754709","","","0.71073","MoKα","","0.0378","0.0354","","","0.0944","0.0955","","","","","","1.107","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110070","11.762","0.003","22.614","0.005","13.619","0.003","90","","95.454","0.004","90","","3606.1","1.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H54 Mo N2 O -","- C40 H54 Mo N2 O -","- C160 H216 Mo4 N8 O4 -","4","1","","Rojendra Singh; Richard R. Schrock; Peter Müller; Amir H. Hoveyda","Synthesis of Monoalkoxide Monopyrrolyl Complexes Mo(NR)(CHR')(OR'')(pyrrolyl): Enyne Metathesis with High Oxidation State Catalysts","Journal of the American Chemical Society","2007","129","","12654","12655","10.1021/ja075569f","","","0.71073","MoKα","","0.0308","0.025","","","0.061","0.0647","","","","","","1.038","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110071","13.4226","0.0006","14.0327","0.0006","15.1067","0.0007","72.376","0.003","75.702","0.002","77.404","0.002","2596","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C49 H46 B F20 Ir O3 P2 -","- C49 H46 B F20 Ir O3 P2 -","- C98 H92 B2 F40 Ir2 O6 P4 -","2","1","","Jian Yang; Maurice Brookhart","Iridium-Catalyzed Reduction of Alkyl Halides by Triethylsilane","Journal of the American Chemical Society","2007","129","","12656","12657","10.1021/ja075725i","","","1.54178","CuKα","","0.0327","0.0293","","","0.0694","0.0712","","","","","","1.059","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110072","13.901","0.0002","20.785","0.0006","35.331","0.0009","90","","90","","90","","10208.3","0.4","150","0.1","150","0.1","","","","","","","","3","P b c a","-P 2ac 2ab","61","","3-(1-Adamantyl)-1,1,2-tris(tri-tert-butylsilyl)- 1,2-disilacycloprop-2-ene","","- C47 H96 Si5 -","- C47 H96 Si5 -","- C376 H768 Si40 -","8","1","","Masayasu Igarashi; Masaaki Ichinohe; Akira Sekiguchi","Air-Stable Disilacyclopropene with a SiC Bond and Its Conversion to Disilacyclopropenylium Ion: Silicon-Carbon Hybrid 2π-Electron Systems","Journal of the American Chemical Society","2007","129","","12660","12661","10.1021/ja075740n","","","0.7107","MoKα","","0.0823","0.0564","","","0.1634","0.1819","","","","","","1.006","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110073","6.1617","0.0009","9.7621","0.0015","16.39","0.003","75.69","0.012","80.24","0.012","80.226","0.012","933","0.3","94","1","94","1","","","","","","","","4","P -1","-P 1","2","","","","- C20 H27 N O4 -","- C20 H27 N O4 -","- C40 H54 N2 O8 -","2","1","","Edouard Godineau; Yannick Landais","Multicomponent Radical Processes: Synthesis of Substituted Piperidinones","Journal of the American Chemical Society","2007","129","","12662","12663","10.1021/ja075755l","","","0.71073","MoKα","","0.0696","0.0493","","","0.1126","0.1244","","","","","","1.036","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110074","22.6","0.002","23.58","0.002","17.3563","0.0018","90","","98.448","0.002","90","","9149","1.5","30","2","30","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Ru2(DPhF)3(OAc)(H2O)](CF3SO3), thf","","","- C46 H46 F3 N6 O7 Ru2 S -","- C46 H46 F3 N6 O7 Ru2 S -","- C368 H368 F24 N48 O56 Ru16 S8 -","8","2","","F. Albert Cotton; Santiago Herrero; Reyes Jiménez-Aparicio; Carlos A. Murillo; Francisco A. Urbanos; Dino Villagrán; Xiaoping Wang","How Small Variations in Crystal Interactions Affect Macroscopic Properties","Journal of the American Chemical Society","2007","129","","12666","12667","10.1021/ja075808z","","","0.71073","MoKα","","0.0933","0.0617","","","0.1442","0.1703","","","","","","1.133","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110075","22.6714","0.0014","23.5666","0.0015","17.4698","0.0011","90","","98.426","0.001","90","","9233.2","1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Ru2(DPhF)3(OAc)(H2O)](CF3SO3), thf","","","- C46 H46 F3 N6 O7 Ru2 S -","- C46 H46 F3 N6 O7 Ru2 S -","- C368 H368 F24 N48 O56 Ru16 S8 -","8","2","","F. Albert Cotton; Santiago Herrero; Reyes Jiménez-Aparicio; Carlos A. Murillo; Francisco A. Urbanos; Dino Villagrán; Xiaoping Wang","How Small Variations in Crystal Interactions Affect Macroscopic Properties","Journal of the American Chemical Society","2007","129","","12666","12667","10.1021/ja075808z","","","0.71073","MoKα","","0.067","0.05","","","0.1202","0.1396","","","","","","1.114","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110076","22.7333","0.0016","23.5731","0.0016","17.5445","0.0012","90","","98.522","0.001","90","","9298.2","1.1","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Ru2(DPhF)3(OAc)(H2O)](CF3SO3), thf","","","- C46 H46 F3 N6 O7 Ru2 S -","- C46 H46 F3 N6 O7 Ru2 S -","- C368 H368 F24 N48 O56 Ru16 S8 -","8","2","","F. Albert Cotton; Santiago Herrero; Reyes Jiménez-Aparicio; Carlos A. Murillo; Francisco A. Urbanos; Dino Villagrán; Xiaoping Wang","How Small Variations in Crystal Interactions Affect Macroscopic Properties","Journal of the American Chemical Society","2007","129","","12666","12667","10.1021/ja075808z","","","0.71073","MoKα","","0.0665","0.0491","","","0.1191","0.1376","","","","","","1.09","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110077","22.7962","0.0014","23.6044","0.0014","17.6247","0.0011","90","","98.615","0.001","90","","9376.7","1","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Ru2(DPhF)3(OAc)(H2O)](CF3SO3), thf","","","- C46 H46 F3 N6 O7 Ru2 S -","- C46 H46 F3 N6 O7 Ru2 S -","- C368 H368 F24 N48 O56 Ru16 S8 -","8","2","","F. Albert Cotton; Santiago Herrero; Reyes Jiménez-Aparicio; Carlos A. Murillo; Francisco A. Urbanos; Dino Villagrán; Xiaoping Wang","How Small Variations in Crystal Interactions Affect Macroscopic Properties","Journal of the American Chemical Society","2007","129","","12666","12667","10.1021/ja075808z","","","0.71073","MoKα","","0.0606","0.0346","","","0.0745","0.0909","","","","","","1.081","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110078","22.897","0.003","23.641","0.004","17.736","0.003","90","","98.89","0.003","90","","9485","3","243","2","243","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Ru2(DPhF)3(OAc)(H2O)](CF3SO3), thf","","","- C46 H46 F3 N6 O7 Ru2 S -","- C46 H46 F3 N6 O7 Ru2 S -","- C368 H368 F24 N48 O56 Ru16 S8 -","8","2","","F. Albert Cotton; Santiago Herrero; Reyes Jiménez-Aparicio; Carlos A. Murillo; Francisco A. Urbanos; Dino Villagrán; Xiaoping Wang","How Small Variations in Crystal Interactions Affect Macroscopic Properties","Journal of the American Chemical Society","2007","129","","12666","12667","10.1021/ja075808z","","","0.71073","MoKα","","0.0696","0.0363","","","0.0769","0.0964","","","","","","1.075","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110079","22.9779","0.0016","23.6451","0.0017","17.8121","0.0013","90","","99.267","0.001","90","","9551.3","1.2","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Ru2(DPhF)3(OAc)(H2O)](CF3SO3), thf","","","- C46 H46 F3 N6 O7 Ru2 S -","- C46 H46 F3 N6 O7 Ru2 S -","- C368 H368 F24 N48 O56 Ru16 S8 -","8","2","","F. Albert Cotton; Santiago Herrero; Reyes Jiménez-Aparicio; Carlos A. Murillo; Francisco A. Urbanos; Dino Villagrán; Xiaoping Wang","How Small Variations in Crystal Interactions Affect Macroscopic Properties","Journal of the American Chemical Society","2007","129","","12666","12667","10.1021/ja075808z","","","0.71073","MoKα","","0.0821","0.0379","","","0.0739","0.0981","","","","","","1.084","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110080","7.2668","0.0001","13.4135","0.0003","23.4946","0.0004","90","","90","","90","","2290.09","0.07","100","","100","","","","","","","","CH2Cl2/AcOEt","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H26 Cl F4 N2 Rh -","- C26 H26 Cl F4 N2 Rh -","- C104 H104 Cl4 F16 N8 Rh4 -","4","1","","Alois Fürstner; Manuel Alcarazo; Helga Krause; Christian W. Lehmann","Effective Modulation of the Donor Properties of N-Heterocyclic Carbene Ligands by ""Through-Space"" Communication within a Planar Chiral Scaffold","Journal of the American Chemical Society","2007","129","","12676","12677","10.1021/ja076028t","","","0.71073","MoKα","","0.0266","0.0244","","","0.0727","0.0739","","","","","","1.166","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4110081","8.1878","0.0002","14.1611","0.0004","14.4546","0.0004","90","","92.692","0.001","90","","1674.14","0.08","100","","100","","","","","","","","CH2Cl2/Et2O","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H21 N3 O2 -","- C19 H21 N3 O2 -","- C76 H84 N12 O8 -","4","1","","Alois Fürstner; Manuel Alcarazo; Helga Krause; Christian W. Lehmann","Effective Modulation of the Donor Properties of N-Heterocyclic Carbene Ligands by ""Through-Space"" Communication within a Planar Chiral Scaffold","Journal of the American Chemical Society","2007","129","","12676","12677","10.1021/ja076028t","","","1.54178","CuKα","","0.0404","0.0348","","","0.0842","0.0882","","","","","","1.101","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110082","19.2002","0.0002","6.9127","0.0001","18.6081","0.0002","90","","117.46","","90","","2191.5","0.05","100","","100","","","","","","","","AcOEt","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H30 Cl N2 Rh -","- C26 H30 Cl N2 Rh -","- C104 H120 Cl4 N8 Rh4 -","4","1","","Alois Fürstner; Manuel Alcarazo; Helga Krause; Christian W. Lehmann","Effective Modulation of the Donor Properties of N-Heterocyclic Carbene Ligands by ""Through-Space"" Communication within a Planar Chiral Scaffold","Journal of the American Chemical Society","2007","129","","12676","12677","10.1021/ja076028t","","","0.71073","MoKα","","0.0466","0.046","","","0.1789","0.1791","","","","","","1.646","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110083","6.6388","0.001","7.1089","0.0011","7.1799","0.0011","78.937","0.002","74.844","0.002","62.838","0.002","289.96","0.08","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C4 H12 B10 O4 -","- C4 H12 B10 O4 -","- C4 H12 B10 O4 -","1","0.5","","Omar K. Farha; Alexander M. Spokoyny; Karen L. Mulfort; M. Frederick Hawthorne; Chad A. Mirkin; Joseph T. Hupp","Synthesis and Hydrogen Sorption Properties of Carborane Based Metal-Organic Framework Materials","Journal of the American Chemical Society","2007","129","","12680","12681","10.1021/ja076167a","","","0.71073","MoKα","","0.0581","0.0523","","","0.1398","0.1479","","","","","","1.076","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110084","39.356","0.005","14.5154","0.0018","21.629","0.003","90","","90","","90","","12356","3","153","2","153","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C25 H59 B25 N3 O15 Zn3 -","- C25 H59 B25 N3 O15 Zn3 -","- C200 H472 B200 N24 O120 Zn24 -","8","1","","Omar K. Farha; Alexander M. Spokoyny; Karen L. Mulfort; M. Frederick Hawthorne; Chad A. Mirkin; Joseph T. Hupp","Synthesis and Hydrogen Sorption Properties of Carborane Based Metal-Organic Framework Materials","Journal of the American Chemical Society","2007","129","","12680","12681","10.1021/ja076167a","","","0.71073","MoKα","","0.0866","0.0655","","","0.1807","0.1892","","","","","","1.048","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110085","10.838","0.0005","11.4593","0.0005","14.8502","0.0006","72.325","0.002","86.301","0.002","88.173","0.002","1753.46","0.13","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H0 Br O9 -","- C40 H41 Br O9 -","- C80 H82 Br2 O18 -","2","1","","Ji Qi; John A. Porco","Rapid Access to Polyprenylated Phloroglucinols via Alkylative Dearomatization-Annulation: Total Synthesis of (\±)-Clusianone1","Journal of the American Chemical Society","2007","129","","12682","12683","10.1021/ja0762339","","","0.71073","MoKα","","0.0537","0.0349","","","0.0944","0.102","","","","","","1.039","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110086","12.8741","0.0005","14.0942","0.0005","11.3501","0.0004","90","","90","","90","","2059.48","0.13","100","2","100","2","","","","","","","","6","P n n 2","P 2 -2n","34","CrCrFe(dpa)4Cl2.CH2Cl2","","","- C41 H34 Cl4 Cr2 Fe N12 -","- C41 H34 Cl4 Cr2 Fe N12 -","- C82 H68 Cl8 Cr4 Fe2 N24 -","2","0.5","","Michael Nippe; John F. Berry","Introducing a Metal-Metal Multiply Bonded Group as an ""Axial Ligand"" to Iron: Synthetic Design of a Linear Cr-Cr...Fe Framework","Journal of the American Chemical Society","2007","129","","12684","12685","10.1021/ja076337j","","","0.71073","Mo-Kα","","0.0257","0.0254","","","0.0757","0.076","","","","","","0.993","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4110087","16.0078","0.0009","15.7414","0.0009","17.0067","0.001","90","","98.241","0.001","90","","4241.2","0.4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","CrCrFe(dpa)4Cl2.0.965Et2O.0.035CH2Cl2","","","- C43.9 H41.72 Cl2.07 Cr2 Fe N12 O0.96 -","- C43.91 H41.76 Cl2.06 Cr2 Fe N12 O0.97 -","- C175.64 H167.04 Cl8.24 Cr8 Fe4 N48 O3.88 -","4","1","","Michael Nippe; John F. Berry","Introducing a Metal-Metal Multiply Bonded Group as an ""Axial Ligand"" to Iron: Synthetic Design of a Linear Cr-Cr...Fe Framework","Journal of the American Chemical Society","2007","129","","12684","12685","10.1021/ja076337j","","","0.71073","MoKα","","0.0465","0.0357","","","0.0921","0.0988","","","","","","1.031","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4110088","5.1605","0.0013","7.972","0.002","29.258","0.007","90","","90","","90","","1203.7","0.5","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H14 Br N O2 -","- C13 H14 Br N O2 -","- C52 H56 Br4 N4 O8 -","4","1","","Eda Canales; E. J. Corey","Highly Enantioselective [2+2]-Cycloaddition Reactions Catalyzed by a Chiral Aluminum Bromide Complex","Journal of the American Chemical Society","2007","129","","12686","12687","10.1021/ja0765262","","","0.71073","MoKα","","0.0438","0.0423","","","0.0775","0.078","","","","","","1.025","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110089","9.066","0.0003","14.5671","0.0005","20.5696","0.0008","74.904","0.001","89.009","0.001","81.677","0.001","2594.57","0.16","193","2","193","2","","","","","","","chemical synthesis","5","P 1","P 1","1","","(1S,7R,8S)-(7-Hydroxybicyclo[5.2.0]nonan-8-yl)methyl 4-Bromophenylcarbamate","","- C17 H22.67 Br N O3.33 -","- C17 H22.6667 Br N O3.33333 -","- C102 H136 Br6 N6 O20 -","6","6","","Eda Canales; E. J. Corey","Highly Enantioselective [2+2]-Cycloaddition Reactions Catalyzed by a Chiral Aluminum Bromide Complex","Journal of the American Chemical Society","2007","129","","12686","12687","10.1021/ja0765262","","","0.71073","MoKα","","0.0491","0.0313","","","0.0639","0.0699","","","","","","0.87","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110090","8.3944","0.0002","8.0872","0.0001","10.3921","0.0002","90","","90.616","0.001","90","","705.45","0.02","193","2","193","2","","","","","","","chemical synthesis","4","P 1 21 1","P 2yb","4","","(4aS)-(E)-2-(4a-methyl-3,4,4a,5,6,7,8,9-octahydrobenzo[7]annulen-2- ylidene)hydrazinecarbothioamide","","- C13 H21 N3 S -","- C13 H21 N3 S -","- C26 H42 N6 S2 -","2","1","","Eda Canales; E. J. Corey","Highly Enantioselective [2+2]-Cycloaddition Reactions Catalyzed by a Chiral Aluminum Bromide Complex","Journal of the American Chemical Society","2007","129","","12686","12687","10.1021/ja0765262","","","0.71073","MoKα","","0.0333","0.0297","","","0.0761","0.0788","","","","","","1.038","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110091","16.0334","0.0008","16.0334","0.0008","4.109","0.0004","90","","90","","90","","1056.3","0.13","298","2","298","2","","","","","","","","6","P -4 21 m","P -4 2ab","113","ClBPTSEt","","","- C7 H5 Cl N3 S2 Se2 -","- C7 H5 Cl N3 S2 Se2 -","- C28 H20 Cl4 N12 S8 Se8 -","4","0.5","","Craig M. Robertson; Daniel J. T. Myles; Alicea A. Leitch; Robert W. Reed; Brynn M. Dooley; Natia L. Frank; Paul A. Dube; Laurence K. Thompson; Richard T. Oakley","Ferromagnetism in a Heavy Atom Heterocyclic Radical Conductor","Journal of the American Chemical Society","2007","129","","12688","12689","10.1021/ja076841o","","","0.71073","MoKα","","0.0507","0.0447","","","0.1003","0.1029","","","","","","1.099","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110092","11.2779","0.0005","15.8314","0.0007","17.6683","0.0008","76.531","0.001","83.363","0.001","79.656","0.001","3009","0.2","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C33 H53 P -","- C33 H53 P -","- C132 H212 P4 -","4","2","","Takashi Ikawa; Timothy E. Barder; Mark R. Biscoe; Stephen L. Buchwald","Pd-Catalyzed Amidations of Aryl Chlorides Using Monodentate Biaryl Phosphine Ligands: A Kinetic, Computational, and Synthetic Investigation","Journal of the American Chemical Society","2007","129","","13001","13007","10.1021/ja0717414","","","0.71073","MoKα","","0.0667","0.0602","","","0.1657","0.174","","","","","","1.03","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110093","7.5926","0.0007","10.815","0.001","8.5288","0.0008","90","","115.828","0.002","90","","630.37","0.1","223","2","223","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C11 H20 Cu P -","- C11 H20 Cu P -","- C22 H40 Cu2 P2 -","2","0.5","","Joel A. Tang; Bobby D. Ellis; Timothy H. Warren; John V. Hanna; Charles L. B. Macdonald; Robert W. Schurko","Solid-State 63Cu and 65Cu NMR Spectroscopy of Inorganic and Organometallic Copper(I) Complexes","Journal of the American Chemical Society","2007","129","","13049","13065","10.1021/ja073238x","","","0.71073","MoKα","","0.0775","0.0747","","","0.1646","0.1659","","","","","","1.374","","","","has coordinates,has disorder","178871","2020-10-21","18:00:00",""
"4110094","15.842","0.002","10.1071","0.0014","14.466","0.002","90","","90","","90","","2316.2","0.5","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C27 H28 Cu P -","- C27 H28 Cu P -","- C108 H112 Cu4 P4 -","4","1","","Joel A. Tang; Bobby D. Ellis; Timothy H. Warren; John V. Hanna; Charles L. B. Macdonald; Robert W. Schurko","Solid-State 63Cu and 65Cu NMR Spectroscopy of Inorganic and Organometallic Copper(I) Complexes","Journal of the American Chemical Society","2007","129","","13049","13065","10.1021/ja073238x","","","0.71073","MoKα","","0.0827","0.0696","","","0.1257","0.1333","","","","","","1.206","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110095","18.795","0.003","15.553","0.003","17.69","0.003","90","","111.492","0.002","90","","4811.6","1.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 Cu P -","- C28 H30 Cu P -","- C224 H240 Cu8 P8 -","8","2","","Joel A. Tang; Bobby D. Ellis; Timothy H. Warren; John V. Hanna; Charles L. B. Macdonald; Robert W. Schurko","Solid-State 63Cu and 65Cu NMR Spectroscopy of Inorganic and Organometallic Copper(I) Complexes","Journal of the American Chemical Society","2007","129","","13049","13065","10.1021/ja073238x","","","0.71073","MoKα","","0.0945","0.0528","","","0.1013","0.1176","","","","","","1.045","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110096","8.0125","0.0013","11.2771","0.0018","19.268","0.003","90","","98.652","0.002","90","","1721.2","0.5","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H23 N O5 S -","- C16 H23 N O5 S -","- C64 H92 N4 O20 S4 -","4","2","","Vardhineedi Sriramurthy; Gregg A. Barcan; Ohyun Kwon","Bisphosphine-Catalyzed Mixed Double-Michael Reactions: Asymmetric Synthesis of Oxazolidines, Thiazolidines, and Pyrrolidines","Journal of the American Chemical Society","2007","129","","12928","12929","10.1021/ja073754n","","","0.71073","MoKα","","0.0592","0.0416","","","0.0776","0.085","","","","","","1.003","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110097","8.149","0.004","9.248","0.004","11.916","0.005","90","","97.912","0.005","90","","889.5","0.7","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H23 N O5 S -","- C16 H23 N O5 S -","- C32 H46 N2 O10 S2 -","2","1","","Vardhineedi Sriramurthy; Gregg A. Barcan; Ohyun Kwon","Bisphosphine-Catalyzed Mixed Double-Michael Reactions: Asymmetric Synthesis of Oxazolidines, Thiazolidines, and Pyrrolidines","Journal of the American Chemical Society","2007","129","","12928","12929","10.1021/ja073754n","","","0.71073","MoKα","","0.0359","0.0328","","","0.0853","0.0886","","","","","","1.037","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110098","11.7766","0.0007","8.3887","0.0005","53.66","0.003","90","","90.134","0.003","90","","5301.1","0.5","150","","150","","","","","","","","Yi Wang","2","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 -","- C24 H24 -","- C288 H288 -","12","3","","Yi Wang; Andrew D Stretton; Mark C McConnell; Peter A. Wood; Simon Parsons; John B Henry; Andrew R Mount; Trent H Galow","1,4,5,8,9,12-Hexamethyltriphenylene. A Molecule with a Flipping Twist","Journal of the American Chemical Society","2007","129","","13193","13200","10.1021/ja074120j","","","0.71073","MoKα","","0.1211","0.0652","","0.2025","0.1615","0.2025","","","","","","0.9719","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110099","14.974","0.0032","14.974","","3.3986","0.0009","90","","90","","120","","659.9","0.2","","","","","","","","","","","","4","P -6 m 2","P -6 2","187","","COF-6","","- C8 H3 B O2 -","- C8 H3 B O2 -","- C24 H9 B3 O6 -","3","0.25","","Adrien P. Côté; Hani M. El-Kaderi; Hiroyasu Furukawa; Joseph R. Hunt; Omar M. Yaghi","Reticular Synthesis of Microporous and Mesoporous 2D Covalent Organic Frameworks","Journal of the American Chemical Society","2007","129","","12914","12915","10.1021/ja0751781","powder diffraction","","","","","","","","","","","","","4.85","","","","","","","has coordinates","178871","2020-10-21","18:00:00",""
"4110100","36.028","0.027","36.028","","3.526","0.012","90","","90","","120","","3964","14","","","","","","","","","","","","3","P 6 m m","P 6 -2","183","","COF-8","","- C12 B O2 -","- C12 B O2 -","- C72 B6 O12 -","6","0.5","","Adrien P. Côté; Hani M. El-Kaderi; Hiroyasu Furukawa; Joseph R. Hunt; Omar M. Yaghi","Reticular Synthesis of Microporous and Mesoporous 2D Covalent Organic Frameworks","Journal of the American Chemical Society","2007","129","","12914","12915","10.1021/ja0751781","powder diffraction","","","","","","","","","","","","","29.57","","","","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110101","22.013","0.0029","22.013","","3.63","0.004","90","","90","","120","","1523.3","1.7","","","","","","","","","","","","3","P -6 m 2","P -6 2","187","","COF-8","","- C14 B O2 -","- C14 B O2 -","- C42 B3 O6 -","3","0.25","","Adrien P. Côté; Hani M. El-Kaderi; Hiroyasu Furukawa; Joseph R. Hunt; Omar M. Yaghi","Reticular Synthesis of Microporous and Mesoporous 2D Covalent Organic Frameworks","Journal of the American Chemical Society","2007","129","","12914","12915","10.1021/ja0751781","powder diffraction","","","","","","","","","","","","","4.1","","","","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110102","17.0412","0.0015","19.8622","0.0016","19.9519","0.0017","89.227","0.002","77.146","0.002","77.433","0.002","6421.9","0.9","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C121 H126 Fe9 N13 O38 -","- C103.408 H99.408 Fe9 N4 O38 -","- C206.816 H198.816 Fe18 N8 O76 -","2","1","","Rashmi Bagai; Wolfgang Wernsdorfer; Khalil A. Abboud; George Christou","Exchange-Biased Dimers of Single-Molecule Magnets in OFF and ON States","Journal of the American Chemical Society","2007","129","","12918","12919","10.1021/ja075382o","","","0.71073","MoKα","","0.1366","0.0747","","","0.1828","0.2063","","","","","","0.919","","","","has coordinates,has disorder","178872","2020-10-21","18:00:00",""
"4110103","12.422","0.006","3.849","0.006","16.981","0.012","90","","107.83","0.04","90","","772.9","1.4","300","2","300","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Phenazine-Chloranilicacid","Phenazine-Chloranilicacid","","- C18 H10 Cl2 N2 O4 -","- C18 H10 Cl2 N2 O4 -","- C36 H20 Cl4 N4 O8 -","2","0.5","","Reiji Kumai; Sachio Horiuchi; Hajime Sagayama; Taka-hisa Arima; Masashi Watanabe; Yukio Noda; Yoshinori Tokura","Structural Assignment of Polarization in Hydrogen-Bonded Supramolecular Ferroelectrics","Journal of the American Chemical Society","2007","129","","12920","12921","10.1021/ja075406r","","neutron","1.243","Neutron","","0.0659","0.0531","","","0.1134","0.1285","","","","","","1.008","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110104","12.423","0.004","3.788","0.008","16.914","0.006","90","","107.89","0.03","90","","757.5","1.6","160","1","160","1","","","","","","","","5","P 1 21 1","P 2yb","4","Phenazine-Chloranilicacid","Phenazine-Chloranilicacid","","- C18 H10 Cl2 N2 O4 -","- C18 H10 Cl2 N2 O4 -","- C36 H20 Cl4 N4 O8 -","2","1","","Reiji Kumai; Sachio Horiuchi; Hajime Sagayama; Taka-hisa Arima; Masashi Watanabe; Yukio Noda; Yoshinori Tokura","Structural Assignment of Polarization in Hydrogen-Bonded Supramolecular Ferroelectrics","Journal of the American Chemical Society","2007","129","","12920","12921","10.1021/ja075406r","","neutron","1.243","Neutron","","0.0499","0.0488","","","0.1086","0.1092","","","","","","1.07","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110105","12.386","0.005","3.908","0.005","17.433","0.007","90","","107.86","0.03","90","","803.2","1.1","300","2","300","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Phenazine-Bromanilicacid","Phenazine-Bromanilicacid","","- C18 H10 Br2 N2 O4 -","- C18 H10 Br2 N2 O4 -","- C36 H20 Br4 N4 O8 -","2","0.5","","Reiji Kumai; Sachio Horiuchi; Hajime Sagayama; Taka-hisa Arima; Masashi Watanabe; Yukio Noda; Yoshinori Tokura","Structural Assignment of Polarization in Hydrogen-Bonded Supramolecular Ferroelectrics","Journal of the American Chemical Society","2007","129","","12920","12921","10.1021/ja075406r","","neutron","1.243","Neutron","","0.0498","0.0427","","","0.0933","0.1054","","","","","","1.123","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110106","12.371","0.004","3.845","0.003","17.342","0.005","90","","107.74","0.02","90","","785.7","0.7","110","1","110","1","","","","","","","","5","P 1 21 1","P 2yb","4","Phenazine-Bromanilicacid","Phenazine-Bromanilicacid","","- C18 H10 Br2 N2 O4 -","- C18 H10 Br2 N2 O4 -","- C36 H20 Br4 N4 O8 -","2","1","","Reiji Kumai; Sachio Horiuchi; Hajime Sagayama; Taka-hisa Arima; Masashi Watanabe; Yukio Noda; Yoshinori Tokura","Structural Assignment of Polarization in Hydrogen-Bonded Supramolecular Ferroelectrics","Journal of the American Chemical Society","2007","129","","12920","12921","10.1021/ja075406r","","neutron","1.2453","Neutron","","0.0397","0.0387","","","0.0937","0.0947","","","","","","1.09","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110107","9.3519","0.0007","9.8917","0.0008","14.0682","0.0011","93.853","0.002","104.897","0.002","108.327","0.002","1178.22","0.16","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H32 B9 N O2 Zr -","- C17 H32 B9 N O2 Zr -","- C34 H64 B18 N2 O4 Zr2 -","2","1","","Hao Shen; Hoi-Shan Chan; Zuowei Xie","Reaction of [σ:η5-(C9H6)C2B9H10]Zr(NMe2)(DME) with Guanidines: Metallacarborane-Mediated C-N Bond Cleavage and 1,5-Sigmatropic Rearrangement","Journal of the American Chemical Society","2007","129","","12934","12935","10.1021/ja0754498","","","0.71073","MoKα","","0.0781","0.066","","","0.1912","0.1999","","","","","","1.17","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110108","20.613","0.004","19.343","0.004","21.189","0.004","90","","118.46","0.03","90","","7427","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H57 B9 N6 Zr -","- C29 H57 B9 N6 Zr -","- C232 H456 B72 N48 Zr8 -","8","2","","Hao Shen; Hoi-Shan Chan; Zuowei Xie","Reaction of [σ:η5-(C9H6)C2B9H10]Zr(NMe2)(DME) with Guanidines: Metallacarborane-Mediated C-N Bond Cleavage and 1,5-Sigmatropic Rearrangement","Journal of the American Chemical Society","2007","129","","12934","12935","10.1021/ja0754498","","","0.71073","MoKα","","0.1316","0.0875","","","0.2258","0.2943","","","","","","1.156","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110109","15.9845","0.0018","11.8691","0.0014","21.506","0.003","90","","93.426","0.003","90","","4072.9","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H58 B9 N5 Zr -","- C34 H58 B9 N5 Zr -","- C136 H232 B36 N20 Zr4 -","4","1","","Hao Shen; Hoi-Shan Chan; Zuowei Xie","Reaction of [σ:η5-(C9H6)C2B9H10]Zr(NMe2)(DME) with Guanidines: Metallacarborane-Mediated C-N Bond Cleavage and 1,5-Sigmatropic Rearrangement","Journal of the American Chemical Society","2007","129","","12934","12935","10.1021/ja0754498","","","0.71073","MoKα","","0.1138","0.0686","","","0.1651","0.1981","","","","","","0.932","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110110","11.3305","0.0013","15.3191","0.0018","28.606","0.003","90","","100.053","0.003","90","","4889","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H74 B9 N5 Zr -","- C46 H74 B9 N5 Zr -","- C184 H296 B36 N20 Zr4 -","4","1","","Hao Shen; Hoi-Shan Chan; Zuowei Xie","Reaction of [σ:η5-(C9H6)C2B9H10]Zr(NMe2)(DME) with Guanidines: Metallacarborane-Mediated C-N Bond Cleavage and 1,5-Sigmatropic Rearrangement","Journal of the American Chemical Society","2007","129","","12934","12935","10.1021/ja0754498","","","0.71073","MoKα","","0.0857","0.0446","","","0.1047","0.1292","","","","","","1.059","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110111","10.992","0.002","16.856","0.003","18.66","0.004","90","","98.78","0.03","90","","3416.8","1.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H50 B9 N5 Zr -","- C27 H50 B9 N5 Zr -","- C108 H200 B36 N20 Zr4 -","4","1","","Hao Shen; Hoi-Shan Chan; Zuowei Xie","Reaction of [σ:η5-(C9H6)C2B9H10]Zr(NMe2)(DME) with Guanidines: Metallacarborane-Mediated C-N Bond Cleavage and 1,5-Sigmatropic Rearrangement","Journal of the American Chemical Society","2007","129","","12934","12935","10.1021/ja0754498","","","0.71073","MoKα","","0.0972","0.0474","","","0.1171","0.1347","","","","","","1.009","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110112","21.341","0.004","22.538","0.005","16.423","0.003","90","","92.19","0.03","90","","7893","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H54 B9 N5 Zr -","- C29 H54 B9 N5 Zr -","- C232 H432 B72 N40 Zr8 -","8","2","","Hao Shen; Hoi-Shan Chan; Zuowei Xie","Reaction of [σ:η5-(C9H6)C2B9H10]Zr(NMe2)(DME) with Guanidines: Metallacarborane-Mediated C-N Bond Cleavage and 1,5-Sigmatropic Rearrangement","Journal of the American Chemical Society","2007","129","","12934","12935","10.1021/ja0754498","","","0.71073","MoKα","","0.202","0.087","","","0.2606","0.3301","","","","","","1.013","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110113","11.4278","0.0014","13.7018","0.0017","17.121","0.002","109.726","0.002","102.317","0.002","95.824","0.003","2421.2","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H74 B9 N5 O Zr -","- C43 H74 B9 N5 O Zr -","- C86 H148 B18 N10 O2 Zr2 -","2","1","","Hao Shen; Hoi-Shan Chan; Zuowei Xie","Reaction of [σ:η5-(C9H6)C2B9H10]Zr(NMe2)(DME) with Guanidines: Metallacarborane-Mediated C-N Bond Cleavage and 1,5-Sigmatropic Rearrangement","Journal of the American Chemical Society","2007","129","","12934","12935","10.1021/ja0754498","","","0.71073","MoKα","","0.0884","0.0549","","","0.1252","0.1495","","","","","","0.994","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110114","13.0591","0.0002","9.8448","0.0002","8.9487","0.0002","90","","93.0748","0.0007","90","","1148.83","0.04","93.1","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C8 H4 Br F6 N O2 S -","- C8 H4 Br F6 N O2 S -","- C32 H16 Br4 F24 N4 O8 S4 -","4","1","","Masahito Ochiai; Takao Kaneaki; Norihiro Tada; Kazunori Miyamoto; Hiroshi Chuman; Motoo Shiro; Satoko Hayashi; Waro Nakanishi","A New Type of Imido Group Donor: Synthesis and Characterization of Sulfonylimino-λ3-bromane that Acts as a Nitrenoid in the Aziridination of Olefins at Room Temperature under Metal-Free Conditions","Journal of the American Chemical Society","2007","129","","12938","12939","10.1021/ja075811i","","","1.54187","CuKα","","","0.0293","","","","0.0734","","","","","","1.115","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110115","22.6163","0.0005","9.1104","0.0002","15.1209","0.0003","90","","126.134","0.001","90","","2516.25","0.1","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C25 H28 Cl N O4 Si -","- C25 H28 Cl N O4 Si -","- C100 H112 Cl4 N4 O16 Si4 -","4","1","","Mary R. Garrett; James C. Tarr; Jeffrey S. Johnson","Enantioselective Metallophosphite-Catalyzed C-Acylation of Nitrones","Journal of the American Chemical Society","2007","129","","12944","12945","10.1021/ja076095n","","","0.71073","MoKα","","0.0323","0.0304","","","0.0782","0.0799","","","","","","1.042","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110116","9.2609","0.0012","10.9845","0.0014","15.0837","0.0019","90","","90","","90","","1534.4","0.3","90","1","90","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","sulfonamide2","","","- C17 H23 N O2 S -","- C17 H23 N O2 S -","- C68 H92 N4 O8 S4 -","4","1","","Wei Zeng; Sherry R. Chemler","Copper(II)-Catalyzed Enantioselective Intramolecular Carboamination of Alkenes","Journal of the American Chemical Society","2007","129","","12948","12949","10.1021/ja0762240","","x-ray","0.71073","MoKα","","0.0249","0.0245","","","0.0703","0.0708","","","","","","1.083","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4110117","11.2301","0.0008","9.3234","0.0007","22.775","0.0017","90","","92.51","0.002","90","","2382.3","0.3","90","1","90","1","","","","","","","","5","P 1 21 1","P 2yb","4","sulfonamide1","","","- C11 H15 N O2 S2 -","- C11 H15 N O2 S2 -","- C88 H120 N8 O16 S16 -","8","4","","Wei Zeng; Sherry R. Chemler","Copper(II)-Catalyzed Enantioselective Intramolecular Carboamination of Alkenes","Journal of the American Chemical Society","2007","129","","12948","12949","10.1021/ja0762240","","x-ray","0.71073","MoKα","","0.0317","0.0309","","","0.0796","0.0802","","","","","","1.105","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4110118","6.2677","0.0002","11.085","0.0004","34.9451","0.0015","90","","90","","90","","2427.9","0.16","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C27 H24 Br2 O5 -","- C27 H24 Br2 O5 -","- C108 H96 Br8 O20 -","4","1","","Axel B. Machotta; Bernd F. Straub; Martin Oestreich","Oxygen Donor-Mediated Equilibration of Diastereomeric Alkene-Palladium(II) Intermediates in Enantioselective Desymmetrizing Heck Cyclizations","Journal of the American Chemical Society","2007","129","","13455","13463","10.1021/ja072571y","","","0.71073","MoKα","","0.0871","0.04","","","0.0506","0.0588","","","","","","0.882","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110119","6.4091","0.0013","14.59","0.003","18.406","0.004","90.37","0.03","94.69","0.03","100.75","0.03","1684.8","0.6","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C19 H26 O3 -","- C19 H26 O3 -","- C76 H104 O12 -","4","2","","Jie Huang; Chunrui Wu; William D. Wulff","Total Synthesis of (\±)-Phomactin B2 via an Intramolecular Cyclohexadienone Annulation of a Chromium Carbene Complex","Journal of the American Chemical Society","2007","129","","13366","13367","10.1021/ja074275r","","","0.71073","MoKα","","0.062","0.0514","","","0.1508","0.1559","","","","","","1.093","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110120","12.384","0.003","12.584","0.003","18.686","0.004","90","","107.07","0.03","90","","2783.7","1.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H46 O3 Si -","- C28 H46 O3 Si -","- C112 H184 O12 Si4 -","4","1","","Jie Huang; Chunrui Wu; William D. Wulff","Total Synthesis of (\±)-Phomactin B2 via an Intramolecular Cyclohexadienone Annulation of a Chromium Carbene Complex","Journal of the American Chemical Society","2007","129","","13366","13367","10.1021/ja074275r","","","0.71073","MoKα","","0.0857","0.0495","","","0.1429","0.1602","","","","","","1.011","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110121","11.515","0.004","13.02","0.005","12.428","0.004","90","","98.304","0.013","90","","1843.7","1.1","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H17 B F2 N2 O2 -","- C23 H17 B F2 N2 O2 -","- C92 H68 B4 F8 N8 O8 -","4","1","","Hiromitsu Maeda; Yohei Haketa; Takashi Nakanishi","Aryl-Substituted C3-Bridged Oligopyrroles as Anion Receptors for Formation of Supramolecular Organogels","Journal of the American Chemical Society","2007","129","","13661","13674","10.1021/ja074435z","","","0.71075","MoKα","","0.0464","0.0368","","","0.0906","0.0947","","","","","","1.091","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110122","12.443","0.006","13.305","0.005","25.211","0.009","90","","102.175","0.017","90","","4080","3","123","2","123","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C25 H21 B F2 N2 O2 -","- C25 H21 B F2 N2 O2 -","- C200 H168 B8 F16 N16 O16 -","8","2","","Hiromitsu Maeda; Yohei Haketa; Takashi Nakanishi","Aryl-Substituted C3-Bridged Oligopyrroles as Anion Receptors for Formation of Supramolecular Organogels","Journal of the American Chemical Society","2007","129","","13661","13674","10.1021/ja074435z","","","0.71075","MoKα","","0.123","0.0641","","","0.1865","0.2475","","","","","","1.005","","","","has coordinates,has disorder","178872","2020-10-21","18:00:00",""
"4110123","14.768","0.006","12.991","0.005","26.114","0.01","90","","101.722","0.015","90","","4906","3","123","2","123","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C55 H52 B2 Cl2 F4 N4 O4 -","- C55 H52 B2 Cl2 F4 N4 O4 -","- C220 H208 B8 Cl8 F16 N16 O16 -","4","1","","Hiromitsu Maeda; Yohei Haketa; Takashi Nakanishi","Aryl-Substituted C3-Bridged Oligopyrroles as Anion Receptors for Formation of Supramolecular Organogels","Journal of the American Chemical Society","2007","129","","13661","13674","10.1021/ja074435z","","","0.71075","MoKα","","0.1529","0.087","","","0.2129","0.2675","","","","","","1.016","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110124","11.57","0.008","13.387","0.007","12.969","0.006","90","","97.95","0.02","90","","1989","2","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H21 B F2 N2 O2 -","- C25 H21 B F2 N2 O2 -","- C100 H84 B4 F8 N8 O8 -","4","1","","Hiromitsu Maeda; Yohei Haketa; Takashi Nakanishi","Aryl-Substituted C3-Bridged Oligopyrroles as Anion Receptors for Formation of Supramolecular Organogels","Journal of the American Chemical Society","2007","129","","13661","13674","10.1021/ja074435z","","","0.71075","MoKα","","0.1119","0.0773","","","0.2184","0.248","","","","","","1.072","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110125","19.008","0.003","19.009","0.004","28.644","0.005","108.952","0.007","91.954","0.006","96.686","0.006","9694","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C29.3 H29.6 B Cl0.286 F2 N2 O7.78 -","- C29.2857 H29.5714 B Cl0.285714 F2 N2 O8.20571 -","- C410 H414 B14 Cl4 F28 N28 O114.88 -","14","7","","Hiromitsu Maeda; Yohei Haketa; Takashi Nakanishi","Aryl-Substituted C3-Bridged Oligopyrroles as Anion Receptors for Formation of Supramolecular Organogels","Journal of the American Chemical Society","2007","129","","13661","13674","10.1021/ja074435z","","","0.71075","MoKα","","0.2363","0.1019","","","0.2457","0.3422","","","","","","1.003","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110126","12.775","0.004","8.536","0.003","35.084","0.011","90","","92.675","0.011","90","","3822","2","123","2","123","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C37 H49 B Cl3 F2 N3 O2 -","- C37 H49 B Cl3 F2 N3 O2 -","- C148 H196 B4 Cl12 F8 N12 O8 -","4","1","","Hiromitsu Maeda; Yohei Haketa; Takashi Nakanishi","Aryl-Substituted C3-Bridged Oligopyrroles as Anion Receptors for Formation of Supramolecular Organogels","Journal of the American Chemical Society","2007","129","","13661","13674","10.1021/ja074435z","","","0.71075","MoKα","","0.2008","0.0724","","","0.119","0.1535","","","","","","0.856","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110127","12.138","0.003","20.055","0.006","20.264","0.005","85.48","0.011","78.711","0.009","80.498","0.01","4765","2","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H67 B Cl2 F2 N3 O8 -","- C46 H67 B Cl2 F2 N3 O8 -","- C184 H268 B4 Cl8 F8 N12 O32 -","4","2","","Hiromitsu Maeda; Yohei Haketa; Takashi Nakanishi","Aryl-Substituted C3-Bridged Oligopyrroles as Anion Receptors for Formation of Supramolecular Organogels","Journal of the American Chemical Society","2007","129","","13661","13674","10.1021/ja074435z","","","0.71075","MoKα","","0.1712","0.0816","","","0.1919","0.2359","","","","","","1.032","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110128","19.8783","0.0001","19.8783","0.0001","19.8783","0.0001","90","","90","","90","","7854.85","0.07","100","2","100","2","","","","","","","","5","I 2 3","I 2 2 3","197","","","","- C31 H42 Mg2 N2 O18 -","- C30 H39 Mg2 O15 -","- C240 H312 Mg16 O120 -","8","0.333333","","Jeffrey A. Rood; William C. Boggess; Bruce C. Noll; Kenneth W. Henderson","Assembly of a Homochiral, Body-Centered Cubic Network Composed of Vertex-Shared Mg12 Cages: Use of Electrospray Ionization Mass Spectrometry to Monitor Metal Carboxylate Nucleation","Journal of the American Chemical Society","2007","129","","13675","13682","10.1021/ja074558j","","","1.54178","CuKα","","0.0578","0.0571","","","0.1686","0.1694","","","","","","1.054","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4110129","16.0139","0.0003","18.4185","0.0004","6.397","0.0001","90","","90","","90","","1886.81","0.06","296","2","100","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C16 H30 Mg O8 -","- C16 H30 Mg O8 -","- C64 H120 Mg4 O32 -","4","1","","Jeffrey A. Rood; William C. Boggess; Bruce C. Noll; Kenneth W. Henderson","Assembly of a Homochiral, Body-Centered Cubic Network Composed of Vertex-Shared Mg12 Cages: Use of Electrospray Ionization Mass Spectrometry to Monitor Metal Carboxylate Nucleation","Journal of the American Chemical Society","2007","129","","13675","13682","10.1021/ja074558j","","","1.54178","CuKα","","0.0332","0.0301","","","0.0716","0.0721","","","","","","1.447","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110130","7.681","0.003","14.498","0.005","16.598","0.006","90","","97.326","0.005","90","","1833.3","1.2","243.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H17 Cr Mn N8 O2 -","- C10 H17 Cr Mn N8 O2 -","- C40 H68 Cr4 Mn4 N32 O8 -","4","1","","Wakako Kaneko; Masaaki Ohba; Susumu Kitagawa","A Flexible Coordination Polymer Crystal Providing Reversible Structural and Magnetic Conversions","Journal of the American Chemical Society","2007","129","","13706","13712","10.1021/ja074915q","","","0.7107","MoKα","","","0.0612","","","","0.0792","","","","","","0.666","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110131","7.85","0.01","14.31","0.03","12.97","0.02","90","","90.1","0.03","90","","1457","4","343.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H13 Cr Mn N8 -","- C10.05 H13 Cr Mn N8 -","- C40.2 H52 Cr4 Mn4 N32 -","4","1","","Wakako Kaneko; Masaaki Ohba; Susumu Kitagawa","A Flexible Coordination Polymer Crystal Providing Reversible Structural and Magnetic Conversions","Journal of the American Chemical Society","2007","129","","13706","13712","10.1021/ja074915q","","","0.7107","MoKα","","","0.0957","","","","0.1146","","","","","","1.174","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110132","9.628","0.003","12.277","0.003","12.009","0.003","90","","92.147","0.004","90","","1418.5","0.7","273","2","273","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C26 H42 Li2 N4 -","- C26 H42 Li2 N4 -","- C52 H84 Li4 N8 -","2","0.5","","Brandon Quillian; Yuzhong Wang; Pingrong Wei; Chaitanya S. Wannere; Paul V. R. Schleyer; Gregory H. Robinson","Gallepins. Neutral Gallium Analogues of the Tropylium Ion: Synthesis, Structure, and Aromaticity","Journal of the American Chemical Society","2007","129","","13380","13381","10.1021/ja075428d","","","0.71073","MoKα","","0.128","0.0561","","","0.1581","0.2043","","","","","","1.011","","","","has coordinates,has disorder","178872","2020-10-21","18:00:00",""
"4110133","26.8548","0.001","7.6807","0.0003","16.9633","0.0006","90","","113.404","0.001","90","","3211","0.2","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H36 Cl2 Ga2 N2 -","- C34 H36 Cl2 Ga2 N2 -","- C136 H144 Cl8 Ga8 N8 -","4","0.5","","Brandon Quillian; Yuzhong Wang; Pingrong Wei; Chaitanya S. Wannere; Paul V. R. Schleyer; Gregory H. Robinson","Gallepins. Neutral Gallium Analogues of the Tropylium Ion: Synthesis, Structure, and Aromaticity","Journal of the American Chemical Society","2007","129","","13380","13381","10.1021/ja075428d","","","0.71073","MoKα","","0.0371","0.0261","","","0.0642","0.0693","","","","","","1.012","","","","has coordinates,has disorder","178872","2020-10-21","18:00:00",""
"4110134","49.557","0.002","28.581","0.0011","27.063","0.0011","90","","90","","90","","38332","3","100","1","100","1","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C246 H253 Cl38 Cu26 Fe13 N10 O2 P65 -","- C246 H226 Cl38 Cu26 Fe13 N10 O2 P65 -","- C984 H904 Cl152 Cu104 Fe52 N40 O8 P260 -","4","0.5","","Manfred Scheer; Andrea Schindler; Roger Merkle; Brian P. Johnson; Michael Linseis; Rainer Winter; Christopher E. Anson; Alexander V. Virovets","Fullerene C60 as an Endohedral Molecule within an Inorganic Supramolecule","Journal of the American Chemical Society","2007","129","","13386","13387","10.1021/ja075926m","","","0.71073","MoKα","","0.2575","0.1115","","","0.3187","0.3917","","","","","","0.997","","","","has coordinates,has disorder","178872","2020-10-21","18:00:00",""
"4110135","12.795","0.004","13.528","0.005","18.54","0.006","80.228","0.005","87.238","0.006","89.993","0.005","3158.8","1.8","193","2","193","2","","","","","","","chemical synthesis","5","P 1","P 1","1","","","","- C14 H13 Br N2 O -","- C14 H13 Br N2 O -","- C140 H130 Br10 N20 O10 -","10","10","","Izzat T. Raheem; Parvinder S. Thiara; Emily A. Peterson; Eric N. Jacobsen","Enantioselective Pictet-Spengler-Type Cyclizations of Hydroxylactams: H-Bond Donor Catalysis by Anion Binding","Journal of the American Chemical Society","2007","129","","13404","13405","10.1021/ja076179w","","","0.71073","MoKα","","0.0797","0.0436","","","0.0927","0.1072","","","","","","0.931","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110136","4.978","0.002","23.537","0.01","8.118","0.004","90","","103.978","0.006","90","","923","0.7","148","","148","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 O2 -","- C12 H12 O2 -","- C48 H48 O8 -","4","1","","Paul A. Wender; Justin P. Christy","Nickel(0)-Catalyzed [2 + 2 + 2 + 2] Cycloadditions of Terminal Diynes for the Synthesis of Substituted Cyclooctatetraenes","Journal of the American Chemical Society","2007","129","","13402","13403","10.1021/ja0763044","","","0.71073","MoKα","","0.0576","0.0387","","","0.0919","0.0998","","","","","","1.015","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110137","11.108","0.002","13.109","0.002","15.107","0.003","89.981","0.002","109.888","0.002","95.894","0.002","2056.3","0.6","128","","128","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H24 O8.5 -","- C22 H24 O8.25 -","- C88 H96 O33 -","4","2","","Paul A. Wender; Justin P. Christy","Nickel(0)-Catalyzed [2 + 2 + 2 + 2] Cycloadditions of Terminal Diynes for the Synthesis of Substituted Cyclooctatetraenes","Journal of the American Chemical Society","2007","129","","13402","13403","10.1021/ja0763044","","","0.71073","MoKα","","0.0719","0.0435","","","0.107","0.121","","","","","","1.016","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110138","4.8412","0.0003","12.2193","0.0009","27.993","0.002","90","","92.191","0.001","90","","1654.7","0.2","173","2","173","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","07213","","","- C24 H20 -","- C24 H20 -","- C96 H80 -","4","1","","Paul A. Wender; Justin P. Christy","Nickel(0)-Catalyzed [2 + 2 + 2 + 2] Cycloadditions of Terminal Diynes for the Synthesis of Substituted Cyclooctatetraenes","Journal of the American Chemical Society","2007","129","","13402","13403","10.1021/ja0763044","","","0.71073","MoKα","","0.0834","0.0463","","","0.1037","0.1235","","","","","","1.015","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110139","4.2896","0.0003","5.9991","0.0004","15.3706","0.001","80.976","0.003","84.419","0.004","88.344","0.003","388.76","0.05","143","2","143","2","","","","","","","","6","P -1","-P 1","2","","NSoximeBr 4-Br-F4-PhCH=NOH","","- C7 H2 Br F4 N O -","- C7 H2 Br F4 N O -","- C14 H4 Br2 F8 N2 O2 -","2","1","","Christer B. Aakeröy; Meg Fasulo; Nate Schultheiss; John Desper; Curtis Moore","Structural Competition between Hydrogen Bonds and Halogen Bonds","Journal of the American Chemical Society","2007","129","","13772","13773","10.1021/ja073201c","","","0.71073","MoKα","","0.0275","0.0215","","","0.0429","0.0453","","","","","","1.037","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110140","4.3885","0.0001","6.0001","0.0001","31.9307","0.0007","90","","93.903","0.001","90","","838.83","0.03","143","2","143","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","NSoximeI 4-I-F4-PhCH=NOH","","- C7 H2 F4 I N O -","- C7 H2 F4 I N O -","- C28 H8 F16 I4 N4 O4 -","4","1","","Christer B. Aakeröy; Meg Fasulo; Nate Schultheiss; John Desper; Curtis Moore","Structural Competition between Hydrogen Bonds and Halogen Bonds","Journal of the American Chemical Society","2007","129","","13772","13773","10.1021/ja073201c","","","0.71073","MoKα","","0.0276","0.0254","","","0.0485","0.0495","","","","","","1.252","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110141","6.8616","0.0008","7.6589","0.0008","34.632","0.004","90","","90","","90","","1820","0.4","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","MF-24-57 1-methyl-2-(4-pyridyl)benzimidazole, F5-benzaldehyde oxime","","- C20 H13 F5 N4 O -","- C20 H13 F5 N4 O -","- C80 H52 F20 N16 O4 -","4","1","","Christer B. Aakeröy; Meg Fasulo; Nate Schultheiss; John Desper; Curtis Moore","Structural Competition between Hydrogen Bonds and Halogen Bonds","Journal of the American Chemical Society","2007","129","","13772","13773","10.1021/ja073201c","","","0.71073","MoKα","","0.071","0.0482","","","0.1104","0.1212","","","","","","0.991","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110142","6.8554","0.0003","7.9485","0.0004","34.9508","0.0015","90","","90","","90","","1904.47","0.15","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","MF-24-58 1-methyl-2-(4-pyridyl)benzimidazole, 4-Br-F4-PhCH=NOH","","- C20 H13 Br F4 N4 O -","- C20 H13 Br F4 N4 O -","- C80 H52 Br4 F16 N16 O4 -","4","1","","Christer B. Aakeröy; Meg Fasulo; Nate Schultheiss; John Desper; Curtis Moore","Structural Competition between Hydrogen Bonds and Halogen Bonds","Journal of the American Chemical Society","2007","129","","13772","13773","10.1021/ja073201c","","","0.71073","MoKα","","0.0476","0.0317","","","0.0658","0.0709","","","","","","1.048","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110143","7.2257","0.0005","10.0969","0.0008","13.752","0.0011","81.535","0.006","81.846","0.004","74.495","0.004","950.72","0.13","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","MF-24-57 1-methyl-2-(4-pyridyl)benzimidazole, 4-I-F4-PhCH=NOH","","- C20 H13 F4 I N4 O -","- C20 H13 F4 I N4 O -","- C40 H26 F8 I2 N8 O2 -","2","1","","Christer B. Aakeröy; Meg Fasulo; Nate Schultheiss; John Desper; Curtis Moore","Structural Competition between Hydrogen Bonds and Halogen Bonds","Journal of the American Chemical Society","2007","129","","13772","13773","10.1021/ja073201c","","","0.71073","MoKα","","0.0664","0.0604","","","0.1715","0.1796","","","","","","1.031","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110144","26.035","0.005","13.18","0.005","12.91","0.005","90","","116.6","0.01","90","","3961","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H36 Mn3 Mo2 N16 O6 -","- C24 H36 Mn3 Mo2 N16 O6 -","- C96 H144 Mn12 Mo8 N64 O24 -","4","0.5","","Julie Milon; Marie-Christine Daniel; Abdellah Kaiba; Philippe Guionneau; Stéphane Brandès; Jean-Pascal Sutter","Nanoporous Magnets of Chiral and Racemic [{Mn(HL)}2Mn{Mo(CN)7}2] with Switchable Ordering Temperatures (TC= 85 K \λeftarrow→106 K) Driven by H2O Sorption (L = N,N-Dimethylalaninol)","Journal of the American Chemical Society","2007","129","","13872","13878","10.1021/ja073612t","","","0.71069","MoKα","","0.0437","0.0372","","","0.0954","0.0992","","","","","","1.037","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110145","26.085","0.005","13.16","0.002","12.889","0.002","90","","116.32","0.01","90","","3965.8","1.2","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C24 H36 Mn3 Mo2 N16 O6 -","- C24 H36 Mn3 Mo2 N16 O6 -","- C96 H144 Mn12 Mo8 N64 O24 -","4","1","","Julie Milon; Marie-Christine Daniel; Abdellah Kaiba; Philippe Guionneau; Stéphane Brandès; Jean-Pascal Sutter","Nanoporous Magnets of Chiral and Racemic [{Mn(HL)}2Mn{Mo(CN)7}2] with Switchable Ordering Temperatures (TC= 85 K \λeftarrow→106 K) Driven by H2O Sorption (L = N,N-Dimethylalaninol)","Journal of the American Chemical Society","2007","129","","13872","13878","10.1021/ja073612t","","","0.71069","MoKα","","0.0337","0.0289","","","0.0688","0.0716","","","","","","1.032","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110146","6.5209","0.0002","10.761","0.0002","7.3062","0.0002","90","","102.058","0.002","90","","501.37","0.02","20","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H8 N8 O8 -","- C4 H8 N8 O8 -","- C8 H16 N16 O16 -","2","0.5","","Elizabeth A. Zhurova; Vladimir V. Zhurov; A. Alan Pinkerton","Structure and Bonding in β-HMX-Characterization of a Trans-Annular N...N Interaction","Journal of the American Chemical Society","2007","129","","13887","13893","10.1021/ja073801b","","","0.71073","MoKα","","","0.0111","","","","0.0093","","","","","","1.09","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110147","8.3155","0.0007","13.3176","0.0011","11.1314","0.0009","90","","90","","90","","1232.72","0.18","153","2","153","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- Cs F5 Na Nb O -","- Cs F5 Na Nb O -","- Cs8 F40 Na8 Nb8 O8 -","8","1","","Michael R. Marvel; Julien Lesage; Jaewook Baek; P. Shiv Halasyamani; Charlotte L. Stern; Kenneth R. Poeppelmeier","Cation-Anion Interactions and Polar Structures in the Solid State","Journal of the American Chemical Society","2007","129","","13963","13969","10.1021/ja074659h","","","0.71073","MoKα","","0.0293","0.0266","","","0.0666","0.068","","","","","","1.132","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110148","11.8653","0.0011","5.8826","0.0006","8.1258","0.0008","90","","90","","90","","567.17","0.1","153","2","153","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- F5 K Na Nb O -","- F5 K Na Nb O -","- F20 K4 Na4 Nb4 O4 -","4","1","","Michael R. Marvel; Julien Lesage; Jaewook Baek; P. Shiv Halasyamani; Charlotte L. Stern; Kenneth R. Poeppelmeier","Cation-Anion Interactions and Polar Structures in the Solid State","Journal of the American Chemical Society","2007","129","","13963","13969","10.1021/ja074659h","","","0.71073","MoKα","","0.0433","0.0419","","","0.1127","0.1132","","","","","","1.257","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110149","34.334","0.005","10.251","0.005","13.999","0.005","90","0.005","90","0.005","90","0.005","4927","3","100","2","100","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C42 H36 F24 N8 O0 P4 -","- C42 H36 F24 N8 P4 -","- C168 H144 F96 N32 P16 -","4","0.25","","Víctor Blanco; Marcos Chas; Dolores Abella; Carlos Peinador; José M. Quintela","Molecular Catenation via Metal-Directed Self-Assembly and π-Donor/π-Acceptor Interactions: Efficient One-Pot Synthesis, Characterization, and Crystal Structures of [3]Catenanes Based on Pd or Pt Dinuclear Metallocycles","Journal of the American Chemical Society","2007","129","","13978","13986","10.1021/ja074721a","","","0.71073","MoKα","","0.0782","0.065","","","0.1383","0.1479","","","","","","1.061","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110150","10.7113","0.0012","14.2665","0.0017","36.27","0.004","90","","98.144","0.002","90","","5486.6","1.1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C51 H50 F12 N7 O8 P2 -","- C51 H50 F12 N7 O8 P2 -","- C204 H200 F48 N28 O32 P8 -","4","1","","Víctor Blanco; Marcos Chas; Dolores Abella; Carlos Peinador; José M. Quintela","Molecular Catenation via Metal-Directed Self-Assembly and π-Donor/π-Acceptor Interactions: Efficient One-Pot Synthesis, Characterization, and Crystal Structures of [3]Catenanes Based on Pd or Pt Dinuclear Metallocycles","Journal of the American Chemical Society","2007","129","","13978","13986","10.1021/ja074721a","","","0.71073","MoKα","","0.1842","0.0806","","","0.188","0.2479","","","","","","0.985","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110151","16.779","0.005","21.728","0.005","19.777","0.005","90","0.005","108.108","0.005","90","0.005","6853","3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C51 H58 F24 N8 O11 P4 Pt -","- C51 H58 F24 N8 O11 P4 Pt -","- C204 H232 F96 N32 O44 P16 Pt4 -","4","1","","Víctor Blanco; Marcos Chas; Dolores Abella; Carlos Peinador; José M. Quintela","Molecular Catenation via Metal-Directed Self-Assembly and π-Donor/π-Acceptor Interactions: Efficient One-Pot Synthesis, Characterization, and Crystal Structures of [3]Catenanes Based on Pd or Pt Dinuclear Metallocycles","Journal of the American Chemical Society","2007","129","","13978","13986","10.1021/ja074721a","","","0.71073","MoKα","","0.1261","0.0882","","","0.2265","0.2581","","","","","","1.034","","","","has coordinates,has disorder","178872","2020-10-21","18:00:00",""
"4110152","15.821","0.004","16.112","0.004","19.211","0.004","111.089","0.004","100.668","0.004","98.214","0.004","4371.3","1.8","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C146 H140 F48 N26 O20 P8 Pd2 S0 -","- C146 H140 F48 N26 O20 P8 Pd2 -","- C146 H140 F48 N26 O20 P8 Pd2 -","1","0.5","","Víctor Blanco; Marcos Chas; Dolores Abella; Carlos Peinador; José M. Quintela","Molecular Catenation via Metal-Directed Self-Assembly and π-Donor/π-Acceptor Interactions: Efficient One-Pot Synthesis, Characterization, and Crystal Structures of [3]Catenanes Based on Pd or Pt Dinuclear Metallocycles","Journal of the American Chemical Society","2007","129","","13978","13986","10.1021/ja074721a","","","0.71073","MoKα","","0.0685","0.0547","","","0.1493","0.1606","","","","","","1.037","","","","has coordinates,has disorder","178872","2020-10-21","18:00:00",""
"4110153","38.981","0.005","21.921","0.005","24.767","0.005","90","0.005","125.982","0.005","90","0.005","17126","6","293","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C264 H280 F96 N38 O48 P16 Pt4 -","- C264 H280 F96 N38 O48 P16 Pt4 -","- C528 H560 F192 N76 O96 P32 Pt8 -","2","0.5","","Víctor Blanco; Marcos Chas; Dolores Abella; Carlos Peinador; José M. Quintela","Molecular Catenation via Metal-Directed Self-Assembly and π-Donor/π-Acceptor Interactions: Efficient One-Pot Synthesis, Characterization, and Crystal Structures of [3]Catenanes Based on Pd or Pt Dinuclear Metallocycles","Journal of the American Chemical Society","2007","129","","13978","13986","10.1021/ja074721a","","","0.71073","MoKα","","0.1005","0.066","","","0.1619","0.1909","","","","","","0.971","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110154","18.292","0.003","20.433","0.003","20.878","0.003","76.237","0.004","78.635","0.004","79.9","0.004","7362.8","1.9","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C112 H132 F29 N12 O42 P4 Pd2 S4 -","- C112 H132 F29 N12 O42 P4 Pd2 S4 -","- C224 H264 F58 N24 O84 P8 Pd4 S8 -","2","1","","Víctor Blanco; Marcos Chas; Dolores Abella; Carlos Peinador; José M. Quintela","Molecular Catenation via Metal-Directed Self-Assembly and π-Donor/π-Acceptor Interactions: Efficient One-Pot Synthesis, Characterization, and Crystal Structures of [3]Catenanes Based on Pd or Pt Dinuclear Metallocycles","Journal of the American Chemical Society","2007","129","","13978","13986","10.1021/ja074721a","","","0.71073","MoKα","","0.274","0.1589","","","0.4089","0.4637","","","","","","1.34","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110155","37.8491","0.001","37.8491","0.001","33.4157","0.0017","90","","90","","120","","41456","3","100","2","100","2","","","","","","","","8","R -3 :H","-R 3","148","","","","- C112.5 H136.25 F36 N12 O26 P6 Pd1.5 S0 -","- C112.5 H136.254 F36.06 N12 O26 P6.01 Pd1.5 -","- C1350 H1635.05 F432.72 N144 O312 P72.12 Pd18 -","12","0.666667","","Víctor Blanco; Marcos Chas; Dolores Abella; Carlos Peinador; José M. Quintela","Molecular Catenation via Metal-Directed Self-Assembly and π-Donor/π-Acceptor Interactions: Efficient One-Pot Synthesis, Characterization, and Crystal Structures of [3]Catenanes Based on Pd or Pt Dinuclear Metallocycles","Journal of the American Chemical Society","2007","129","","13978","13986","10.1021/ja074721a","","","0.71073","MoKα","","0.1882","0.0816","","","0.2154","0.2623","","","","","","0.918","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4110156","27.761","0.004","18.604","0.003","10.2474","0.0015","90","","90","","90","","5292.4","1.4","100","2","100","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C51 H78 N8 O11 -","- C51 H78 N8 O11 -","- C204 H312 N32 O44 -","4","1","","Soo Hyuk Choi; Ilia A. Guzei; Samuel H. Gellman","Crystallographic Characterization of the α/β-Peptide 14/15-Helix","Journal of the American Chemical Society","2007","129","","13780","13781","10.1021/ja0753344","","","0.71073","Mo-Kα","","0.0518","0.0487","","","0.1326","0.1366","","","","","","1.005","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4110157","14.7772","0.0007","14.7772","0.0007","56.444","0.005","90","","90","","90","","12325.4","1.4","100","2","100","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C56 H90 N9 O13.5 -","- C56 H90 N9 O13.5 -","- C448 H720 N72 O108 -","8","1","","Soo Hyuk Choi; Ilia A. Guzei; Samuel H. Gellman","Crystallographic Characterization of the α/β-Peptide 14/15-Helix","Journal of the American Chemical Society","2007","129","","13780","13781","10.1021/ja0753344","","","0.71073","Mo-Kα","","0.0712","0.0617","","","0.1576","0.1638","","","","","","1.214","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4110158","10.704","0.006","12.403","0.008","14.597","0.009","102.176","0.015","91.346","0.019","112.839","0.012","1733.8","1.8","100","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H116 N4 Ni2 O2 -","- C74 H116 N4 Ni2 O2 -","- C74 H116 N4 Ni2 O2 -","1","0.5","","Chang Hoon Lee; David S. Laitar; Peter Mueller; Joseph P. Sadighi","Generation of a Doubly Bridging CO2 Ligand and Deoxygenation of CO2 by an (NHC)Ni(0) Complex","Journal of the American Chemical Society","2007","129","","13802","13803","10.1021/ja075630g","","","0.71073","MoKα","","0.0549","0.0413","","","0.1003","0.1074","","","","","","1.027","","","","has coordinates,has disorder","178872","2020-10-21","18:00:00",""
"4110159","13.154","0.003","14.404","0.003","27.869","0.005","90","","92.47","0.003","90","","5275.4","1.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H72 N4 Ni2 O3 -","- C56 H72 N4 Ni2 O3 -","- C224 H288 N16 Ni8 O12 -","4","1","","Chang Hoon Lee; David S. Laitar; Peter Mueller; Joseph P. Sadighi","Generation of a Doubly Bridging CO2 Ligand and Deoxygenation of CO2 by an (NHC)Ni(0) Complex","Journal of the American Chemical Society","2007","129","","13802","13803","10.1021/ja075630g","","","0.71073","MoKα","","0.0531","0.033","","","0.0708","0.0789","","","","","","1.017","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110160","28.1093","0.0017","17.2503","0.0011","20.5848","0.0012","90","","124.607","0.001","90","","8215.4","0.9","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H48 N4 Ni2 O3 -","- C44 H48 N4 Ni2 O3 -","- C352 H384 N32 Ni16 O24 -","8","1","","Chang Hoon Lee; David S. Laitar; Peter Mueller; Joseph P. Sadighi","Generation of a Doubly Bridging CO2 Ligand and Deoxygenation of CO2 by an (NHC)Ni(0) Complex","Journal of the American Chemical Society","2007","129","","13802","13803","10.1021/ja075630g","","","0.71073","MoKα","","0.0638","0.0404","","","0.0886","0.0987","","","","","","1.03","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110161","17.9874","0.0004","25.3631","0.0005","32.8163","0.0005","90","","90","","90","","14971.3","0.5","100","2","0","","","","","","","","","6","P n a 21","P 2c -2n","33","","dodecakis(μ~3~-Oxo)-hexadecakis(μ~2~-neopentanoato)-tetra-ethanol-tetra- manganese(iv)-octa-manganese(iii) chloroform solvate","","- C123.72 H82.4 Cl13.03 F16 Mn12 O48 -","- C123.725 H82.395 Cl13.028 F16 Mn12 O48 -","- C494.9 H329.58 Cl52.112 F64 Mn48 O192 -","4","1","","Michael Burgert; Sönke Voss; Simon Herr; Mikhail Fonin; Ulrich Groth; Ulrich Rüdiger","Single-Molecule Magnets: A New Approach To Investigate the Electronic Structure of Mn12 Molecules by Scanning Tunneling Spectroscopy","Journal of the American Chemical Society","2007","129","","14362","14366","10.1021/ja074884z","","","0.71073","MoKα","","0.1187","0.058","","","0.1174","0.1354","","","","","","0.815","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4110162","14.6527","0.0014","4.1102","0.0004","37.163","0.004","90","","92.642","0.002","90","","2235.8","0.4","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C41 H50 Br2 N2 O S6 -","- C41 H46 Br2 N2 O S6 -","- C82 H92 Br4 N4 O2 S12 -","2","0.5","","Wai-Yeung Wong; Xing-Zhu Wang; Ze He; Kwok-Kwan Chan; Aleksandra B. Djurišić; Kai-Yin Cheung; Cho-Tung Yip; Alan Man-Ching Ng; Yan Yan Xi; Chris S. K. Mak; Wai-Kin Chan","Tuning the Absorption, Charge Transport Properties, and Solar Cell Efficiency with the Number of Thienyl Rings in Platinum-Containing Poly(aryleneethynylene)s","Journal of the American Chemical Society","2007","129","","14372","14380","10.1021/ja074959z","","","0.71073","MoKα","","0.0973","0.059","","","0.1428","0.1635","","","","","","1.026","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110163","17.079","0.006","12.092","0.004","16.206","0.005","90","","90","","90","","3346.9","1.9","173","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","Tantalum","Tantalum tetra(dimethyl)amide Hydroamide","","- C10 H30 N5 O Ta -","- C10 H30 N5 O Ta -","- C80 H240 N40 O8 Ta8 -","8","2","","Shu-Jian Chen; Xin-Hao Zhang; Xianghua Yu; He Qiu; Glenn P. A. Yap; Ilia A. Guzei; Zhenyang Lin; Yun-Dong Wu; Zi-Ling Xue","Reaction of Ta(NMe2)5 with O2: Formation of Aminoxy and Unusual (Aminomethyl)amide Oxo Complexes and Theoretical Studies of the Mechanistic Pathways","Journal of the American Chemical Society","2007","129","","14408","14421","10.1021/ja075076a","","","0.71073","MoKα","","0.0536","0.0388","","","0.0945","0.1229","","","","","","1.163","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110164","8.273","0.009","13.077","0.014","16.25","0.017","90","","99.88","0.018","90","","1732","3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","tantalum","tantalum amide hydroamide","","- C10 H30 N5 O2 Ta -","- C10 H30 N5 O2 Ta -","- C40 H120 N20 O8 Ta4 -","4","1","","Shu-Jian Chen; Xin-Hao Zhang; Xianghua Yu; He Qiu; Glenn P. A. Yap; Ilia A. Guzei; Zhenyang Lin; Yun-Dong Wu; Zi-Ling Xue","Reaction of Ta(NMe2)5 with O2: Formation of Aminoxy and Unusual (Aminomethyl)amide Oxo Complexes and Theoretical Studies of the Mechanistic Pathways","Journal of the American Chemical Society","2007","129","","14408","14421","10.1021/ja075076a","","","0.71073","MoKα","","0.036","0.0248","","","0.062","0.0882","","","","","","1.167","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110165","11.435","0.006","13.712","0.008","8.616","0.005","90","","107.534","0.007","90","","1288.2","1.3","120","2","120","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C16 H46 N8 O2 Ta2 -","- C16 H46 N8 O2 Ta2 -","- C32 H92 N16 O4 Ta4 -","2","0.25","","Shu-Jian Chen; Xin-Hao Zhang; Xianghua Yu; He Qiu; Glenn P. A. Yap; Ilia A. Guzei; Zhenyang Lin; Yun-Dong Wu; Zi-Ling Xue","Reaction of Ta(NMe2)5 with O2: Formation of Aminoxy and Unusual (Aminomethyl)amide Oxo Complexes and Theoretical Studies of the Mechanistic Pathways","Journal of the American Chemical Society","2007","129","","14408","14421","10.1021/ja075076a","","","0.71073","MoKα","","0.0576","0.0566","","","0.1576","0.1591","","","","","","1.06","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110166","9.8785","0.0005","11.5811","0.0005","19.2869","0.0009","77.972","0.001","82.666","0.001","66.618","0.001","1978.35","0.16","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C25.5 H68 N11 O4 Ta3 -","- C22 H64 N11 O4 Ta3 -","- C44 H128 N22 O8 Ta6 -","2","1","","Shu-Jian Chen; Xin-Hao Zhang; Xianghua Yu; He Qiu; Glenn P. A. Yap; Ilia A. Guzei; Zhenyang Lin; Yun-Dong Wu; Zi-Ling Xue","Reaction of Ta(NMe2)5 with O2: Formation of Aminoxy and Unusual (Aminomethyl)amide Oxo Complexes and Theoretical Studies of the Mechanistic Pathways","Journal of the American Chemical Society","2007","129","","14408","14421","10.1021/ja075076a","","","0.71073","Mo-Kα","","0.0238","0.0201","","","0.0493","0.0505","","","","","","1.045","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4110167","10.055","0.0005","12.9426","0.0006","13.8766","0.0007","82.188","0.002","84.577","0.002","78.367","0.002","1748.17","0.15","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H43 B Ir N7 -","- C41 H43 B Ir N7 -","- C82 H86 B2 Ir2 N14 -","2","1","","Eleuterio Álvarez; Salvador Conejero; Patricia Lara; Jorge A. López; Margarita Paneque; Ana Petronilho; Manuel L. Poveda; Diego del Río; Oracio Serrano; Ernesto Carmona","Rearrangement of Pyridine to Its 2-Carbene Tautomer Mediated by Iridium","Journal of the American Chemical Society","2007","129","","14130","14131","10.1021/ja075685i","","","0.71073","MoKα","","0.0337","0.0271","","","0.0612","0.0641","","","","","","1.051","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110168","9.7191","0.0016","7.6773","0.0012","14.461","0.002","90","","100.581","0.004","90","","1060.7","0.3","143","1","143","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C18 H26 N2 O5 S Si -","- C18 H26 N2 O5 S Si -","- C36 H52 N4 O10 S2 Si2 -","2","1","","Erin M. Forbeck; Cory D. Evans; John A. Gilleran; Pixu Li; Madeleine M. Joullié","A Regio- and Stereoselective Approach to Quaternary Centers from Chiral Trisubstituted Aziridines","Journal of the American Chemical Society","2007","129","","14463","14469","10.1021/ja0758077","","","0.71073","MoKα","","0.0534","0.0437","","","0.0931","0.101","","","","","","1.138","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110169","10.5237","0.0014","10.5852","0.0013","12.6006","0.0019","90","","104.634","0.003","90","","1358.1","0.3","143","1","143","1","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C24 H31 Br N2 O6 S Si -","- C24 H31 Br N2 O6 S Si -","- C48 H62 Br2 N4 O12 S2 Si2 -","2","1","","Erin M. Forbeck; Cory D. Evans; John A. Gilleran; Pixu Li; Madeleine M. Joullié","A Regio- and Stereoselective Approach to Quaternary Centers from Chiral Trisubstituted Aziridines","Journal of the American Chemical Society","2007","129","","14463","14469","10.1021/ja0758077","","","0.71069","MoKα","","0.027","0.0203","","","0.0375","0.039","","","","","","0.807","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110170","17.5634","0.0015","7.9314","0.0006","15.64","0.0014","90","","105.345","0.002","90","","2101","0.3","143","1","143","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H26 N2 O5 S Si -","- C18 H26 N2 O5 S Si -","- C72 H104 N8 O20 S4 Si4 -","4","1","","Erin M. Forbeck; Cory D. Evans; John A. Gilleran; Pixu Li; Madeleine M. Joullié","A Regio- and Stereoselective Approach to Quaternary Centers from Chiral Trisubstituted Aziridines","Journal of the American Chemical Society","2007","129","","14463","14469","10.1021/ja0758077","","","0.71069","MoKα","","0.068","0.0566","","","0.1821","0.201","","","","","","1.227","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110171","9.9782","0.0009","13.6465","0.0013","18.8212","0.0017","90","","90","","90","","2562.8","0.4","143","1","143","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H32 N2 O6 S Si -","- C24 H32 N2 O6 S Si -","- C96 H128 N8 O24 S4 Si4 -","4","1","","Erin M. Forbeck; Cory D. Evans; John A. Gilleran; Pixu Li; Madeleine M. Joullié","A Regio- and Stereoselective Approach to Quaternary Centers from Chiral Trisubstituted Aziridines","Journal of the American Chemical Society","2007","129","","14463","14469","10.1021/ja0758077","","","0.71069","MoKα","","0.0402","0.037","","","0.0894","0.0929","","","","","","1.105","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110172","10.6317","0.0013","10.5468","0.0012","12.4854","0.0016","90","","105.631","0.003","90","","1348.2","0.3","143","1","143","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C25 H34 N2 O6 S Si -","- C25 H34 N2 O6 S Si -","- C50 H68 N4 O12 S2 Si2 -","2","1","","Erin M. Forbeck; Cory D. Evans; John A. Gilleran; Pixu Li; Madeleine M. Joullié","A Regio- and Stereoselective Approach to Quaternary Centers from Chiral Trisubstituted Aziridines","Journal of the American Chemical Society","2007","129","","14463","14469","10.1021/ja0758077","","","0.71069","MoKα","","0.0328","0.0314","","","0.0742","0.0758","","","","","","1.066","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110173","10.4164","0.0008","10.692","0.0008","25.187","0.002","90","","90","","90","","2805.1","0.4","143","1","143","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H31 N3 O6 S Si -","- C25 H31 N3 O6 S Si -","- C100 H124 N12 O24 S4 Si4 -","4","1","","Erin M. Forbeck; Cory D. Evans; John A. Gilleran; Pixu Li; Madeleine M. Joullié","A Regio- and Stereoselective Approach to Quaternary Centers from Chiral Trisubstituted Aziridines","Journal of the American Chemical Society","2007","129","","14463","14469","10.1021/ja0758077","","","0.71069","MoKα","","0.0426","0.0368","","","0.0754","0.0796","","","","","","1.09","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110174","10.6499","0.0017","9.4449","0.0016","10.9071","0.0018","90","","97.876","0.003","90","","1086.8","0.3","143","1","143","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C18 H22 Cl N3 O7 S -","- C18 H22 Cl N3 O7 S -","- C36 H44 Cl2 N6 O14 S2 -","2","1","","Erin M. Forbeck; Cory D. Evans; John A. Gilleran; Pixu Li; Madeleine M. Joullié","A Regio- and Stereoselective Approach to Quaternary Centers from Chiral Trisubstituted Aziridines","Journal of the American Chemical Society","2007","129","","14463","14469","10.1021/ja0758077","","","0.71069","MoKα","","0.0329","0.0315","","","0.0734","0.0749","","","","","","1.093","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110175","8.551","0.006","11.819","0.009","12.611","0.008","90","","99.94","0.02","90","","1255.4","1.5","143","1","143","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C26 H24 N2 O7 S -","- C26 H24 N2 O7 S -","- C52 H48 N4 O14 S2 -","2","1","","Erin M. Forbeck; Cory D. Evans; John A. Gilleran; Pixu Li; Madeleine M. Joullié","A Regio- and Stereoselective Approach to Quaternary Centers from Chiral Trisubstituted Aziridines","Journal of the American Chemical Society","2007","129","","14463","14469","10.1021/ja0758077","","","0.71073","MoKα","","0.0411","0.0376","","","0.091","0.1014","","","","","","1.13","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110176","27.816","0.004","27.816","0.004","26.484","0.005","90","","90","","120","","17746","5","103","2","103","2","","","","","","","","5","P 63","P 6c","173","","","","- C258 H198 Mn15 N36 O60 -","- C258 H135 Mn15 N36 O60 -","- C516 H270 Mn30 N72 O120 -","2","0.333333","","Rohith P. John; Mira Park; Dohyun Moon; Kyungjin Lee; Seunghee Hong; Yang Zou; Chang Seop Hong; Myoung Soo Lah","A Chiral Pentadecanuclear Metallamacrocycle with a Sextuple Twisted Möbius Topology","Journal of the American Chemical Society","2007","129","","14142","14143","10.1021/ja075945w","","","0.7","synchrotron","","0.1341","0.0897","","","0.2418","0.2676","","","","","","0.859","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110177","8.958","0.003","11.008","0.004","19.141","0.011","78.74","0.04","78.76","0.04","66.24","0.04","1680","1.4","273","2","273","2","","","","","","","","5","P -1","-P 1","2","[L(Me)Cu(O2CC(O)Mes)]","","","- C38 H43 Cu N2 O3 -","- C38 H43 Cu N2 O3 -","- C76 H86 Cu2 N4 O6 -","2","1","","Sungjun Hong; Stefan M. Huber; Laura Gagliardi; Christopher C. Cramer; William B. Tolman","Copper(I)-α-Ketocarboxylate Complexes: Characterization and O2 Reactions That Yield Copper-Oxygen Intermediates Capable of Hydroxylating Arenes","Journal of the American Chemical Society","2007","129","","14190","14192","10.1021/ja0760426","","","0.71073","MoKα","","0.0513","0.0356","","","0.0893","0.1013","","","","","","1.059","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110178","10.2026","0.0012","12.1789","0.0014","15.242","0.0018","67.379","0.002","85.964","0.002","65.239","0.002","1578.2","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","[(N2Ph)Cu(BF)].CH2Cl2","","","- C34 H35 Cl2 Cu N2 O3 -","- C34 H35 Cl2 Cu N2 O3 -","- C68 H70 Cl4 Cu2 N4 O6 -","2","1","","Sungjun Hong; Stefan M. Huber; Laura Gagliardi; Christopher C. Cramer; William B. Tolman","Copper(I)-α-Ketocarboxylate Complexes: Characterization and O2 Reactions That Yield Copper-Oxygen Intermediates Capable of Hydroxylating Arenes","Journal of the American Chemical Society","2007","129","","14190","14192","10.1021/ja0760426","","","0.71073","MoKα","","0.0518","0.0378","","","0.0799","0.0853","","","","","","1.043","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110179","13.812","0.01","14.651","0.009","15.986","0.009","90","","109.14","0.03","90","","3056","3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[(N2XY)Cu(BF)]","","","- C35 H37 Cu N2 O3 -","- C35 H37 Cu N2 O3 -","- C140 H148 Cu4 N8 O12 -","4","1","","Sungjun Hong; Stefan M. Huber; Laura Gagliardi; Christopher C. Cramer; William B. Tolman","Copper(I)-α-Ketocarboxylate Complexes: Characterization and O2 Reactions That Yield Copper-Oxygen Intermediates Capable of Hydroxylating Arenes","Journal of the American Chemical Society","2007","129","","14190","14192","10.1021/ja0760426","","","0.71073","MoKα","","0.0415","0.0303","","","0.0779","0.0866","","","","","","1.062","","","","has coordinates,has disorder","178872","2020-10-21","18:00:00",""
"4110180","10.1018","0.0011","11.7821","0.0013","12.884","0.0014","86.043","0.002","73.753","0.002","88.886","0.002","1468.7","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","[(L-mOMe)Cu(BF)]","","","- C34 H35 Cu N2 O4 -","- C34 H35 Cu N2 O4 -","- C68 H70 Cu2 N4 O8 -","2","1","","Sungjun Hong; Stefan M. Huber; Laura Gagliardi; Christopher C. Cramer; William B. Tolman","Copper(I)-α-Ketocarboxylate Complexes: Characterization and O2 Reactions That Yield Copper-Oxygen Intermediates Capable of Hydroxylating Arenes","Journal of the American Chemical Society","2007","129","","14190","14192","10.1021/ja0760426","","","0.71073","MoKα","","0.0644","0.0451","","","0.1067","0.1143","","","","","","1.061","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110181","13.4571","0.0011","13.8773","0.001","15.433","0.0012","90","","99.702","0.002","90","","2840.9","0.4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[(N2-XY)Cu(OTf)]","","","- C28 H32 Cu F3 N2 O3 S -","- C28 H32 Cu F3 N2 O3 S -","- C112 H128 Cu4 F12 N8 O12 S4 -","4","1","","Sungjun Hong; Stefan M. Huber; Laura Gagliardi; Christopher C. Cramer; William B. Tolman","Copper(I)-α-Ketocarboxylate Complexes: Characterization and O2 Reactions That Yield Copper-Oxygen Intermediates Capable of Hydroxylating Arenes","Journal of the American Chemical Society","2007","129","","14190","14192","10.1021/ja0760426","","","0.71073","MoKα","","0.0567","0.0509","","","0.1118","0.1157","","","","","","1.053","","","","has coordinates,has disorder","178872","2020-10-21","18:00:00",""
"4110182","15.6134","0.0008","17.8813","0.0007","14.8643","0.0007","90","","115.723","0.0005","90","","3738.7","0.3","296.1","","","","","","","","","","","8","C 1 2/m 1","-C 2y","12","","","","- C22 H24 B2 Br Cl2 N16 O2 Ru2 -","- C22 H22 B2 Br Cl2 N16 O2 Ru2 -","- C88 H88 B8 Br4 Cl8 N64 O8 Ru8 -","4","0.5","","Yasuhiro Arikawa; Taiki Asayama; Yusuke Moriguchi; Shoko Agari; Masayoshi Onishi","Reversible N-N Coupling of NO Ligands on Dinuclear Ruthenium Complexes and Subsequent N2O Evolution: Relevance to Nitric Oxide Reductase","Journal of the American Chemical Society","2007","129","","14160","14161","10.1021/ja0763504","","","0.7107","MoKα","","","0.0337","","","","0.1011","","","","","","1.008","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110183","16.198","0.002","14.5225","0.0019","16.624","0.002","90","","106.924","0.0002","90","","3741.2","0.8","296.1","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C29 H33 B2 Cl N16 O2 Ru2 -","- C29 H33 B2 Cl N16 O2 Ru2 -","- C116 H132 B8 Cl4 N64 O8 Ru8 -","4","1","","Yasuhiro Arikawa; Taiki Asayama; Yusuke Moriguchi; Shoko Agari; Masayoshi Onishi","Reversible N-N Coupling of NO Ligands on Dinuclear Ruthenium Complexes and Subsequent N2O Evolution: Relevance to Nitric Oxide Reductase","Journal of the American Chemical Society","2007","129","","14160","14161","10.1021/ja0763504","","","0.7107","MoKα","","","0.0354","","","","0.1053","","","","","","1.006","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110184","11.3955","0.0007","30.7747","0.0014","11.7111","0.0007","90","","115.888","0.0007","90","","3694.9","0.4","296.1","","","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","","","- C21 H23 B4 Cl F8 N16 O2 Ru2 -","- C21 H23 B4 Cl F8 N16 O2 Ru2 -","- C84 H92 B16 Cl4 F32 N64 O8 Ru8 -","4","1","","Yasuhiro Arikawa; Taiki Asayama; Yusuke Moriguchi; Shoko Agari; Masayoshi Onishi","Reversible N-N Coupling of NO Ligands on Dinuclear Ruthenium Complexes and Subsequent N2O Evolution: Relevance to Nitric Oxide Reductase","Journal of the American Chemical Society","2007","129","","14160","14161","10.1021/ja0763504","","","0.7107","MoKα","","","0.0789","","","","0.2543","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110185","15.8308","0.0011","16.2176","0.0009","16.1017","0.0011","90","","107.992","0.0009","90","","3931.8","0.4","296.1","","","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","","","- C23 H24 B2 Br Cl7 N14 O Ru2 -","- C23 H23 B2 Br Cl7 N14 O Ru2 -","- C92 H92 B8 Br4 Cl28 N56 O4 Ru8 -","4","1","","Yasuhiro Arikawa; Taiki Asayama; Yusuke Moriguchi; Shoko Agari; Masayoshi Onishi","Reversible N-N Coupling of NO Ligands on Dinuclear Ruthenium Complexes and Subsequent N2O Evolution: Relevance to Nitric Oxide Reductase","Journal of the American Chemical Society","2007","129","","14160","14161","10.1021/ja0763504","","","0.7107","MoKα","","","0.0628","","","","0.1989","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110186","16.248","0.004","18.476","0.005","16.988","0.004","90","","94.269","0.005","90","","5086","2","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C52 H72 Cl2 Cr2 N4 -","- C52 H72 Cl2 Cr2 N4 -","- C208 H288 Cl8 Cr8 N16 -","4","1","","Kevin A. Kreisel; Glenn P. A. Yap; Olga Dmitrenko; Clark R. Landis; Klaus H. Theopold","The Shortest Metal-Metal Bond Yet: Molecular and Electronic Structure of a Dinuclear Chromium Diazadiene Complex","Journal of the American Chemical Society","2007","129","","14162","14163","10.1021/ja076356t","","","0.71073","MoKα","","0.1163","0.069","","","0.1373","0.1554","","","","","","1.061","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110187","22.387","0.008","9.742","0.003","24.917","0.007","90","","112.718","0.018","90","","5013","3","120","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C52 H72 Cr2 N4 -","- C52 H72 Cr2 N4 -","- C208 H288 Cr8 N16 -","4","0.5","","Kevin A. Kreisel; Glenn P. A. Yap; Olga Dmitrenko; Clark R. Landis; Klaus H. Theopold","The Shortest Metal-Metal Bond Yet: Molecular and Electronic Structure of a Dinuclear Chromium Diazadiene Complex","Journal of the American Chemical Society","2007","129","","14162","14163","10.1021/ja076356t","","","0.71073","MoKα","","0.0549","0.047","","","0.1205","0.1282","","","","","","1.018","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110188","12.639","0.005","14.481","0.005","16.752","0.007","90","","105.982","0.006","90","","2948","2","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-1,2-Bis{(1,1,3,3,5,5,7,7-octaethyl-s-hydrindacene-4-yl)}- 1,2-diphenyldisilene","","- C68 H100 Si2 -","- C68 H100 Si2 -","- C136 H200 Si4 -","2","0.5","","Aiko Fukazawa; Yongming Li; Shigehiro Yamaguchi; Hayato Tsuji; Kohei Tamao","Coplanar Oligo(p-phenylenedisilenylene)s Based on the Octaethyl-Substituteds-Hydrindacenyl Groups","Journal of the American Chemical Society","2007","129","","14164","14165","10.1021/ja0764207","","","0.7107","MoKα","","0.0854","0.0779","","","0.1792","0.1835","","","","","","1.228","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110189","11.6011","0.0006","16.155","0.0008","17.1708","0.0009","114.671","0.001","99.85","0.002","95.161","0.002","2834","0.3","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","1,4-Bis{1,2-Bis((E)-1,1,3,3,5,5,7,7-octaethyl-s-hydrindacen-4-yl) -2-phenyldisilenyl}benzene","","- C130 H194 Si4 -","- C130 H194 Si4 -","- C130 H194 Si4 -","1","0.5","","Aiko Fukazawa; Yongming Li; Shigehiro Yamaguchi; Hayato Tsuji; Kohei Tamao","Coplanar Oligo(p-phenylenedisilenylene)s Based on the Octaethyl-Substituteds-Hydrindacenyl Groups","Journal of the American Chemical Society","2007","129","","14164","14165","10.1021/ja0764207","","","0.71075","MoKα","","0.1669","0.1055","","","0.2568","0.3108","","","","","","1.024","","","","has coordinates,has disorder","178872","2020-10-21","18:00:00",""
"4110190","15.219","0.009","10.322","0.006","18.063","0.011","90","","91.762","0.013","90","","2836","3","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-Bis{(1,1,3,3,5,5,7,7-octaethyl-s-hydrindacen-4-yl)silyl}benzene","","- C62 H98 Si2 -","- C62 H98 Si2 -","- C124 H196 Si4 -","2","0.5","","Aiko Fukazawa; Yongming Li; Shigehiro Yamaguchi; Hayato Tsuji; Kohei Tamao","Coplanar Oligo(p-phenylenedisilenylene)s Based on the Octaethyl-Substituteds-Hydrindacenyl Groups","Journal of the American Chemical Society","2007","129","","14164","14165","10.1021/ja0764207","","","0.7107","MoKα","","0.0815","0.0717","","","0.135","0.1398","","","","","","1.189","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110191","15.1281","0.0001","15.1281","0.0001","7.716","0.0001","90","","90","","120","","1529.3","0.02","273","2","273","2","","","","","","","","4","P 32","P 32","145","","","","- C14 H18 Mn3 O12 -","- C14 H16 Mn3 O12 -","- C42 H48 Mn9 O36 -","3","1","","Jian Zhang; Shumei Chen; Henry Valle; Matthew Wong; Cristina Austria; Maria Cruz; Xianhui Bu","Manganese and Magnesium Homochiral Materials: Decoration of Honeycomb Channels with Homochiral Chains","Journal of the American Chemical Society","2007","129","","14168","14169","10.1021/ja076532y","","","0.71073","MoKα","","0.0932","0.0662","","","0.1568","0.1706","","","","","","1.043","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110192","14.8724","0.0003","14.8724","0.0003","7.3333","0.0004","90","","90","","120","","1404.73","0.09","273","2","273","2","","","","","","","","4","P 32","P 32","145","","","","- C14 H18 Mg3 O12 -","- C14 H15 Mg3 O12 -","- C42 H45 Mg9 O36 -","3","1","","Jian Zhang; Shumei Chen; Henry Valle; Matthew Wong; Cristina Austria; Maria Cruz; Xianhui Bu","Manganese and Magnesium Homochiral Materials: Decoration of Honeycomb Channels with Homochiral Chains","Journal of the American Chemical Society","2007","129","","14168","14169","10.1021/ja076532y","","","0.71073","MoKα","","0.098","0.0751","","","0.1901","0.2033","","","","","","1.021","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110193","9.6693","0.0002","13.2688","0.0003","13.2744","0.0003","90","","108.627","0.001","90","","1613.89","0.06","273","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H46 Mn2 N2 O10 -","- C28 H42 Mn2 N2 O10 -","- C56 H84 Mn4 N4 O20 -","2","1","","Jian Zhang; Shumei Chen; Henry Valle; Matthew Wong; Cristina Austria; Maria Cruz; Xianhui Bu","Manganese and Magnesium Homochiral Materials: Decoration of Honeycomb Channels with Homochiral Chains","Journal of the American Chemical Society","2007","129","","14168","14169","10.1021/ja076532y","","","0.71073","MoKα","","0.1032","0.0847","","","0.2273","0.2442","","","","","","1.053","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110194","8.8724","0.0003","13.7075","0.0005","14.4409","0.0006","90","","97.746","0.002","90","","1740.25","0.11","273","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H44 Mn3 N2 O14 -","- C28 H35 Mn3 N2 O14 -","- C56 H70 Mn6 N4 O28 -","2","1","","Jian Zhang; Shumei Chen; Henry Valle; Matthew Wong; Cristina Austria; Maria Cruz; Xianhui Bu","Manganese and Magnesium Homochiral Materials: Decoration of Honeycomb Channels with Homochiral Chains","Journal of the American Chemical Society","2007","129","","14168","14169","10.1021/ja076532y","","","0.71073","MoKα","","0.0726","0.0646","","","0.1722","0.1858","","","","","","0.991","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110195","6.8678","0.0011","12.566","0.002","12.782","0.002","90","","103.462","0.004","90","","1072.8","0.3","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H28 Mn2 O8 -","- C20 H28 Mn2 O8 -","- C40 H56 Mn4 O16 -","2","1","","Jian Zhang; Shumei Chen; Henry Valle; Matthew Wong; Cristina Austria; Maria Cruz; Xianhui Bu","Manganese and Magnesium Homochiral Materials: Decoration of Honeycomb Channels with Homochiral Chains","Journal of the American Chemical Society","2007","129","","14168","14169","10.1021/ja076532y","","","0.71073","MoKα","","0.0497","0.0389","","","0.0842","0.0886","","","","","","0.891","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110196","15.831","0.001","24.262","0.001","26.818","0.002","90","","91.52","0.01","90","","10296.9","1.1","198","2","198","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C98 H105.5 F3 K N12.5 O16 S Yb2 -","- C98 H103.5 F3 K N12.5 O16 S Yb2 -","- C392 H414 F12 K4 N50 O64 S4 Yb8 -","4","1","","Markus Albrecht; Olga Osetska; Roland Fröhlich; Jean-Claude G. Bünzli; Annina Aebischer; Frédéric Gumy; Josef Hamacek","Highly Efficient Near-IR Emitting Yb/Yb and Yb/Al Helicates","Journal of the American Chemical Society","2007","129","","14178","14179","10.1021/ja0768688","","","0.71073","MoKα","","0.2868","0.1398","","","0.3086","0.3867","","","","","","1.056","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4110197","10.6657","0.0011","15.3695","0.0017","38.351","0.004","90","","96.596","0.001","90","","6245.1","1.1","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C54 H75 N4 P12 -","- C54 H75 N4 P12 -","- C216 H300 N16 P48 -","4","1","","Jason D. Masuda; Wolfgang W. Schoeller; Bruno Donnadieu; Guy Bertrand","NHC-Mediated Aggregation of P4: Isolation of a P12 Cluster","Journal of the American Chemical Society","2007","129","","14180","14181","10.1021/ja077296u","","","0.71073","MoKα","","0.0942","0.0535","","","0.1093","0.1246","","","","","","1.025","","","","has coordinates","178872","2020-10-21","18:00:00",""
"4110198","9.8011","0.0003","12.7402","0.0004","14.6788","0.0005","69.595","0.002","79.441","0.002","69.863","0.001","1608.72","0.09","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C33 H48 N2 P4 -","- C33 H48 N2 P4 -","- C66 H96 N4 P8 -","2","1","","Jason D. Masuda; Wolfgang W. Schoeller; Bruno Donnadieu; Guy Bertrand","NHC-Mediated Aggregation of P4: Isolation of a P12 Cluster","Journal of the American Chemical Society","2007","129","","14180","14181","10.1021/ja077296u","","","0.71073","MoKα","","0.0413","0.0325","","","0.0901","0.0958","","","","","","1.119","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110199","11.982","0.008","13.397","0.009","23.717","0.016","74.896","0.009","80.328","0.009","70.51","0.008","3451","4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C74 H102 N4 P4 -","- C74 H102 N4 P4 -","- C148 H204 N8 P8 -","2","1","","Jason D. Masuda; Wolfgang W. Schoeller; Bruno Donnadieu; Guy Bertrand","NHC-Mediated Aggregation of P4: Isolation of a P12 Cluster","Journal of the American Chemical Society","2007","129","","14180","14181","10.1021/ja077296u","","","0.71073","MoKα","","0.2041","0.0842","","","0.1522","0.2016","","","","","","0.944","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110200","29.635","0.004","20.97","0.003","19.375","0.003","90","","95.606","0.003","90","","11983","3","153","2","153","2","","","","","","","","11","P 1 21/c 1","-P 2ybc","14","","","","- C73 H58.67 B1.33 Cl7.33 F5.33 N4 O4 P2.67 Rh1.33 S2.67 Zn1.33 -","- C73 H58.6667 B1.33333 Cl7.33333 F5.33333 N4 O4 P2.66667 Rh1.33333 S2.66667 Zn1.33333 -","- C438 H352 B8 Cl44 F32 N24 O24 P16 Rh8 S16 Zn8 -","6","1.5","","Hyo Jae Yoon; Jungseok Heo; Chad A. Mirkin","Allosteric Regulation of Phosphate Diester Transesterification Based upon a Dinuclear Zinc Catalyst Assembled via the Weak-Link Approach","Journal of the American Chemical Society","2007","129","","14182","14183","10.1021/ja077467v","","","0.71073","MoKα","","0.4146","0.1367","","","0.3066","0.4143","","","","","","0.913","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110201","5.5792","0.0001","9.1278","0.0003","13.4765","0.0003","90","","95.89","0.002","90","","682.68","0.03","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H21 Br O2 -","- C15 H21 Br O2 -","- C30 H42 Br2 O4 -","2","1","","Guang Y. Fang; Olov A. Wallner; Nadia Di Blasio; Xavier Ginesta; Jeremy N. Harvey; Varinder K. Aggarwal","Asymmetric Sulfur Ylide Reactions with Boranes: Scope and Limitations, Mechanism and Understanding","Journal of the American Chemical Society","2007","129","","14632","14639","10.1021/ja074110i","","","0.71073","MoKα","","0.0304","0.028","","","0.0929","0.0971","","","","","","0.819","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110202","20.044","0.004","7.464","0.0016","8.63","0.002","90","","90","","90","","1291.1","0.5","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","guanidinium 2,3,4-trimethylbenzenesulfonate","","","- C10 H17 N3 O3 S -","- C10 H17 N3 O3 S -","- C40 H68 N12 O12 S4 -","4","0.5","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.1051","0.0474","","","0.1142","0.1311","","","","","","0.96","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110203","18.513","0.002","7.4798","0.0008","9.3991","0.001","90","","90","","90","","1301.5","0.2","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","guanidinium 2,4,5-trimethylbenzenesulfonate","","","- C10 H17 N3 O3 S -","- C10 H17 N3 O3 S -","- C40 H68 N12 O12 S4 -","4","0.5","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0402","0.035","","","0.0917","0.0946","","","","","","1.103","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110204","7.3912","0.0012","12.0564","0.0019","14.037","0.002","90","","90","","90","","1250.9","0.3","173","2","173","2","","","","","","","","5","P m c 21","P 2c -2","26","guanidinium 2,4-dimethylbenzenesulfonate","","","- C9 H15 N3 O3 S -","- C9 H15 N3 O3 S -","- C36 H60 N12 O12 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0274","0.0252","","","0.068","0.0688","","","","","","1.158","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110205","16.621","0.003","7.4457","0.0015","9.6016","0.0019","90","","90","","90","","1188.2","0.4","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","guanidinium 2,5-dimethylbenzenesulfonate","","","- C9 H15 N3 O3 S -","- C9 H15 N3 O3 S -","- C36 H60 N12 O12 S4 -","4","0.5","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0557","0.0432","","","0.114","0.1223","","","","","","1.043","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110206","7.121","0.005","7.347","0.005","11.661","0.005","80.198","0.005","83.673","0.005","63.966","0.005","539.7","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","guanidinium 2-fluorobenzenesulfonate","","","- C7 H10 Cl N3 O3 S -","- C7 H10 Cl N3 O3 S -","- C14 H20 Cl2 N6 O6 S2 -","2","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71069","MoKα","","0.0335","0.0312","","","0.085","0.0864","","","","","","1.08","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110207","12.5613","0.0018","7.4686","0.0011","22.99","0.003","90","","94.984","0.002","90","","2148.7","0.5","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","guanidinium 2-fluorobenzenesulfonate","","","- C7 H10 F N3 O3 S -","- C7 H10 F N3 O3 S -","- C56 H80 F8 N24 O24 S8 -","8","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.053","0.0382","","","0.0849","0.0906","","","","","","1.071","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110208","7.262","0.0008","18.062","0.002","12.1437","0.0014","90","","90.069","0.002","90","","1592.8","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","guanidinium sulfonate clathrate","","","- C26 H40 N6 O6 S2 -","- C26 H40 N6 O6 S2 -","- C52 H80 N12 O12 S4 -","2","0.5","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0529","0.0409","","","0.1011","0.106","","","","","","1.105","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110209","16.315","0.002","7.5145","0.001","9.2773","0.0013","90","","90","","90","","1137.4","0.3","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","guanidinium 2-fluorobenzenesulfonate","","","- C8 H13 N3 O3 S -","- C8 H13 N3 O3 S -","- C32 H52 N12 O12 S4 -","4","0.5","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0472","0.0402","","","0.0938","0.0967","","","","","","1.122","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110210","18.695","0.003","7.3907","0.001","8.5401","0.0012","90","","90","","90","","1180","0.3","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","guanidinium 3,4-dimethylbenzenesulfonate","","","- C9 H15 N3 O3 S -","- C9 H15 N3 O3 S -","- C36 H60 N12 O12 S4 -","4","0.5","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0871","0.0502","","","0.1239","0.1367","","","","","","1.084","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110211","7.3158","0.0015","7.3242","0.0015","12.272","0.003","73.749","0.003","72.979","0.003","62.076","0.003","547.6","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C7 H10 Cl N3 O3 S -","- C7 H10 Cl N3 O3 S -","- C14 H20 Cl2 N6 O6 S2 -","2","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0444","0.0388","","","0.1009","0.1036","","","","","","1.08","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110212","7.169","0.005","7.304","0.005","11.532","0.005","72.377","0.005","85.075","0.005","62.944","0.005","511.6","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","guanidinium 3-fluorobenzenesulfonate","","","- C7 H10 F N3 O3 S -","- C7 H10 F N3 O3 S -","- C14 H20 F2 N6 O6 S2 -","2","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71069","MoKα","","0.0361","0.0309","","","0.0813","0.0836","","","","","","1.047","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110213","7.4439","0.0005","11.6454","0.0007","21.0703","0.0013","90","","90","","90","","1826.5","0.2","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","guanidinium sulfonate clathrate","","","- C16 H23 N3 O3 S -","- C16 H23 N3 O3 S -","- C64 H92 N12 O12 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0966","0.067","","","0.1813","0.2072","","","","","","0.946","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110214","7.4409","0.0014","20.364","0.004","12.248","0.002","90","","93.075","0.003","90","","1853.2","0.6","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","guanidinium sulfonate clathrate","","","- C16 H23 N3 O4 S -","- C16 H23 N3 O4 S -","- C64 H92 N12 O16 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0362","0.0302","","","0.0698","0.0717","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110215","11.7808","0.0017","22.579","0.003","7.5023","0.001","90","","90","","90","","1995.6","0.5","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 Br N3 O4 S -","- C16 H22 Br N3 O4 S -","- C64 H88 Br4 N12 O16 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0673","0.044","","","0.0796","0.0855","","","","","","1.02","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110216","7.7431","0.0004","11.2471","0.0006","19.8076","0.0012","90","","90","","90","","1724.99","0.17","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","guanidinium sulfonate chlathrate","","","- C14 H18 Br N3 O4 S -","- C14 H18 Br N3 O4 S -","- C56 H72 Br4 N12 O16 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0324","0.0274","","","0.0665","0.0684","","","","","","1.024","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110217","7.4786","0.0006","19.3589","0.0015","11.5539","0.0009","90","","91.208","0.002","90","","1672.4","0.2","173","2","173","2","","","","","","","","6","C 1 c 1","C -2yc","9","guanidinium sulfonate chlathrate","","","- C13 H10 Br N3 O3 S -","- C13 H10 Br N3 O3 S -","- C52 H40 Br4 N12 O12 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0504","0.0444","","","0.1124","0.1154","","","","","","1","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110218","18.52","0.003","22.903","0.004","7.7707","0.0012","90","","90","","90","","3296","0.9","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H34 Br2 N6 O6 S2 -","- C24 H20 Br2 N6 O6 S2 -","- C96 H80 Br8 N24 O24 S8 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0495","0.0382","","","0.0906","0.0944","","","","","","1.054","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110219","21.0695","0.0019","12.6553","0.0012","7.4141","0.0007","90","","90","","90","","1976.9","0.3","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","guanidinium sulfonate clathrate","","","- C16 H20 Br N5 O3 S -","- C16 H20 Br N5 O3 S -","- C64 H80 Br4 N20 O12 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0341","0.0291","","","0.0727","0.0742","","","","","","1.037","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110220","19.786","0.003","7.5257","0.0013","11.448","0.002","90","","90","","90","","1704.6","0.5","173","2","173","2","","","","","","","","6","P c a 21","P 2c -2ac","29","guanidinium sulfonate clathrate","","","- C14 H18 Br N3 O3 S -","- C14 H18 Br N3 O3 S -","- C56 H72 Br4 N12 O12 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.7107","MoKα","","0.0768","0.0518","","","0.1138","0.1207","","","","","","0.922","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110221","7.4688","0.0015","12.316","0.002","20.948","0.004","90","","90","","90","","1926.9","0.6","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","guanidinium sulfonate clathrate","","","- C15 H20 Cl N5 O5 S -","- C15 H20 Cl N5 O5 S -","- C60 H80 Cl4 N20 O20 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0552","0.0402","","","0.0823","0.0858","","","","","","0.918","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110222","18.3983","0.001","22.8237","0.0012","7.7169","0.0004","90","","90","","90","","3240.5","0.3","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","guanidinium sulfonate clathrate","","","- C24 H34 Cl2 N6 O6 S2 -","- C24 H34 Cl2 N6 O6 S2 -","- C96 H136 Cl8 N24 O24 S8 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.067","0.0498","","","0.0963","0.1022","","","","","","1.037","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110223","7.508","0.0014","20.473","0.004","12.377","0.002","90","","92.765","0.003","90","","1900.3","0.6","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","guanidinium sulfonate clathrate","","","- C17 H25 N3 O3 S -","- C17 H25 N3 O3 S -","- C68 H100 N12 O12 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0446","0.0362","","","0.0839","0.0867","","","","","","0.999","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110224","32.565","0.014","7.455","0.003","12.308","0.005","90","","90","","90","","2988","2","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","guanidinium sulfonate clathrate","","","- C24 H34 F2 N6 O6 S2 -","- C24 H34 F2 N6 O6 S2 -","- C96 H136 F8 N24 O24 S8 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.1689","0.1262","","","0.3038","0.3309","","","","","","1.085","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110225","7.4288","0.0012","15.813","0.002","12.3793","0.0019","90","","90.603","0.003","90","","1454.1","0.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","guanidinium sulfonate clathrate","","","- C23 H32 F2 N6 O6 S2 -","- C23 H32 F2 N6 O6 S2 -","- C46 H64 F4 N12 O12 S4 -","2","0.5","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0554","0.0479","","","0.1263","0.1296","","","","","","1.17","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110226","7.5332","0.0003","11.9412","0.0005","20.206","0.0009","90","","90","","90","","1817.64","0.13","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","guanidinium sulfonate clathrate","","","- C15 H21 F N4 O3 S -","- C15 H21 F N4 O3 S -","- C60 H84 F4 N16 O12 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0343","0.0299","","","0.0774","0.0794","","","","","","1.06","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110227","7.4694","0.0011","38.233","0.006","11.2721","0.0018","90","","93.007","0.003","90","","3214.6","0.9","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","guanidinium 4-fluorobenzenesulfonate","","","- C7 H10 F N3 O3 S -","- C7 H10 F N3 O3 S -","- C84 H120 F12 N36 O36 S12 -","12","3","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.069","0.0525","","","0.1315","0.1375","","","","","","1.155","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110228","7.5106","0.0004","11.8486","0.0007","22.9872","0.0013","90","","90","","90","","2045.6","0.2","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","guanidinium sulfonate clathrate","","","- C16 H22 I N3 O4 S -","- C16 H22 I N3 O4 S -","- C64 H88 I4 N12 O16 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0654","0.0423","","","0.11","0.1212","","","","","","1.087","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110229","21.335","0.0012","12.5958","0.0007","7.442","0.0004","90","","90","","90","","1999.9","0.19","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","guanidinium sulfonate clathrate","","","- C16 H20 I N5 O3 S -","- C16 H20 I N5 O3 S -","- C64 H80 I4 N20 O12 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0216","0.0196","","","0.049","0.0497","","","","","","1.03","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110230","22.527","0.005","7.555","0.005","6.765","0.005","90","0.005","90","0.005","90","0.005","1151.3","1.2","173","2","173","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C7 H10 I N3 O3 S -","- C7 H10 I N3 O3 S -","- C28 H40 I4 N12 O12 S4 -","4","0.5","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71069","MoKα","","0.0492","0.0394","","","0.0851","0.0908","","","","","","1.14","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110231","12.3765","0.0019","22.114","0.003","56.385","0.009","90","","90","","90","","15432","4","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","guanidinium 4-tert-butylbenzenesulfonate","","","- C11 H19.8 N3 O3.4 S -","- C11 H19.8 N3 O3.4 S -","- C440 H792 N120 O136 S40 -","40","5","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.2184","0.1318","","","0.2782","0.3244","","","","","","1.077","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110232","18.965","0.003","21.733","0.003","13.832","0.002","90","","101.781","0.003","90","","5581","1.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C92 H141 N18 O18 S6 -","- C92 H141 N18 O18 S6 -","- C184 H282 N36 O36 S12 -","2","0.5","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.1008","0.0611","","","0.1368","0.1494","","","","","","1.034","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110233","14.501","0.005","12.686","0.005","47.584","0.005","90","","90","","90","","8754","5","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H17 N3 O3 S -","- C10 H15.8333 N3 O3 S -","- C240 H380 N72 O72 S24 -","24","3","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71069","MoKα","","0.1042","0.0755","","","0.2108","0.2236","","","","","","1.111","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110234","7.4622","0.0004","11.8703","0.0006","22.1066","0.0011","90","","90","","90","","1958.17","0.17","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","guanidinium monosulfonate clathrate","","","- C17 H25 N3 O4 S -","- C17 H25 N3 O4 S -","- C68 H100 N12 O16 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0483","0.0402","","","0.1104","0.1155","","","","","","1.081","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110235","18.757","0.003","23.471","0.004","7.4865","0.0012","90","","90","","90","","3295.9","0.9","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","guanidinium sulfonate clathrate","","","- C26 H40 N6 O6 S2 -","- C26 H40 N6 O6 S2 -","- C104 H160 N24 O24 S8 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0936","0.0618","","","0.128","0.1389","","","","","","1.058","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110236","22.9819","0.0017","7.427","0.0006","19.0067","0.0014","90","","114.426","0.001","90","","2953.8","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","guanidinium sulfonate clathrate","","","- C22 H30 N8 O10 S2 -","- C22 H30 N8 O10 S2 -","- C88 H120 N32 O40 S8 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.1245","0.0728","","","0.2191","0.2593","","","","","","1.055","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110237","11.2544","0.0009","7.7474","0.0006","13.0949","0.001","90","","110.85","0.001","90","","1067.01","0.14","173","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","guanidinium 4-nitrobenzenesulfonate","","","- C7 H10 N4 O5 S -","- C7 H10 N4 O5 S -","- C28 H40 N16 O20 S4 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0391","0.0329","","","0.0918","0.0954","","","","","","1.074","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110238","19.169","0.002","22.004","0.003","13.2277","0.0016","90","","103.582","0.002","90","","5423.3","1.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H69 N9 O9 S3 -","- C45 H69 N9 O9 S3 -","- C180 H276 N36 O36 S12 -","4","1","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.0986","0.0617","","","0.1739","0.1895","","","","","","1.132","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110239","13.668","0.003","12.334","0.002","22.015","0.004","90","","91.03","0.003","90","","3710.7","1.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","guanidinium sulfonate clathrate","","","- C58 H98 N12 O12 S4 -","- C58 H98 N12 O12 S4 -","- C116 H196 N24 O24 S8 -","2","0.5","","Matthew J. Horner; K. Travis Holman; Michael D. Ward","Architectural Diversity and Elastic Networks in Hydrogen-Bonded Host Frameworks: From Molecular Jaws to Cylinders","Journal of the American Chemical Society","2007","129","","14640","14660","10.1021/ja0741574","","","0.71073","MoKα","","0.1579","0.126","","","0.3323","0.3498","","","","","","1.036","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110240","10.957","0.001","13.367","0.001","16.473","0.002","68.791","0.002","78.608","0.002","69.184","0.001","2095.8","0.4","273.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C44 H39 Cl I O3 P2 Re -","- C45 H42 Cl2 I O3 P2 Re -","- C90 H84 Cl4 I2 O6 P4 Re2 -","2","1","","Kristine A. Nolin; Jennifer R. Krumper; Michael D. Pluth; Robert G. Bergman; F. Dean Toste","Analysis of an Unprecedented Mechanism for the Catalytic Hydrosilylation of Carbonyl Compounds","Journal of the American Chemical Society","2007","129","","14684","14696","10.1021/ja074477n","","","0.7107","MoKα","","0.029","0.029","","0.0337","","0.0337","","","","","","1.313","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110241","15.599","0.003","12.87","0.003","17.763","0.003","90","","104.936","0.003","90","","3445.6","1.2","108.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H34 I O2 P2 Re -","- C37 H33 I1.01 O2 P2 Re -","- C148 H132 I4.04 O8 P8 Re4 -","4","1","","Kristine A. Nolin; Jennifer R. Krumper; Michael D. Pluth; Robert G. Bergman; F. Dean Toste","Analysis of an Unprecedented Mechanism for the Catalytic Hydrosilylation of Carbonyl Compounds","Journal of the American Chemical Society","2007","129","","14684","14696","10.1021/ja074477n","","","0.7107","MoKα","","0.0448","0.0448","","0.0562","","0.0562","","","","","","2.334","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110242","30.7027","","15.4502","0.0009","10.8585","0.0006","90","","90","","90","","5150.9","0.4","143.2","","","","","","","","","","","8","P n a 21","P 2c -2n","33","","","","- C51 H48 Cl4 I O2 P2 Re Si -","- C51 Cl4 I O2 P2 Re Si -","- C204 Cl16 I4 O8 P8 Re4 Si4 -","4","1","","Kristine A. Nolin; Jennifer R. Krumper; Michael D. Pluth; Robert G. Bergman; F. Dean Toste","Analysis of an Unprecedented Mechanism for the Catalytic Hydrosilylation of Carbonyl Compounds","Journal of the American Chemical Society","2007","129","","14684","14696","10.1021/ja074477n","","","0.7107","MoKα","","","0.0403","","","","0.0447","","","","","","1.302","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110243","8.4847","0.0004","13.9643","0.0007","16.1353","0.0008","90","","90","","90","","1911.76","0.16","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","06275","","","- C23 H21 N O S -","- C23 H21 N O S -","- C92 H84 N4 O4 S4 -","4","1","","Barry M. Trost; Yong Zhang","Mo-Catalyzed Regio-, Diastereo-, and Enantioselective Allylic Alkylation of 3-Aryloxindoles","Journal of the American Chemical Society","2007","129","","14548","14549","10.1021/ja0755717","","","0.71073","MoKα","","0.0423","0.0367","","","0.0953","0.1003","","","","","","1.019","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110244","8.838","0.0002","11.013","0.0004","27.049","0.0009","90","","108.654","0.002","90","","2494.45","0.14","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 N2 O4 S2 -","- C28 H24 N2 O4 S2 -","- C112 H96 N8 O16 S8 -","4","1","","Kilian Muñiz","Advancing Palladium-Catalyzed C-N Bond Formation: Bisindoline Construction from Successive Amide Transfer to Internal Alkenes","Journal of the American Chemical Society","2007","129","","14542","14543","10.1021/ja075655f","","","0.71073","MoKα","","0.0812","0.0467","","","0.1125","0.1309","","","","","","1.058","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110245","29.417","0.0007","9.92","0.0003","20.789","0.0006","90","","115.097","0.0017","90","","5493.8","0.3","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H36 N4 O9 S2 -","- C24 H26 N4 O8 S2 -","- C192 H208 N32 O64 S16 -","8","1","","Andrew J. Boydston; Cory S. Pecinovsky; Steven T. Chao; Christopher W. Bielawski","Phase-Tunable Fluorophores Based upon Benzobis(imidazolium) Salts","Journal of the American Chemical Society","2007","129","","14550","14551","10.1021/ja075963d","","","0.71073","MoKα","","0.094","0.056","","","0.1428","0.1573","","","","","","1.056","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110246","15.6675","0.0009","8.5227","0.0005","19.2498","0.0013","90","","113.028","0.003","90","","2365.6","0.3","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20.6 H26.2 N4 O8.4 S2 -","- C20.6 H25.8 N4 O8.4 S2 -","- C82.4 H103.2 N16 O33.6 S8 -","4","1","","Andrew J. Boydston; Cory S. Pecinovsky; Steven T. Chao; Christopher W. Bielawski","Phase-Tunable Fluorophores Based upon Benzobis(imidazolium) Salts","Journal of the American Chemical Society","2007","129","","14550","14551","10.1021/ja075963d","","","0.71073","MoKα","","0.1567","0.0797","","","0.1614","0.1925","","","","","","1.056","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4110247","8.4326","0.0008","9.5389","0.0011","19.364","0.002","98.805","0.006","97.397","0.008","99.781","0.004","1497.6","0.3","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H104 B2 F8 N4 -","- C56 H104 B2 F8 N4 -","- C56 H104 B2 F8 N4 -","1","0.5","","Andrew J. Boydston; Cory S. Pecinovsky; Steven T. Chao; Christopher W. Bielawski","Phase-Tunable Fluorophores Based upon Benzobis(imidazolium) Salts","Journal of the American Chemical Society","2007","129","","14550","14551","10.1021/ja075963d","","","0.71073","MoKα","","0.1652","0.0811","","","0.1535","0.1754","","","","","","1.398","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110248","6.987","0.0014","24.587","0.005","11.022","0.002","90","","90.99","0.03","90","","1893.2","0.6","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H18 Br N O2 -","- C23 H18 Br N O2 -","- C92 H72 Br4 N4 O8 -","4","2","","John D. Huber; James L. Leighton","Highly Enantioselective Imine Cinnamylation with a Remarkable Diastereochemical Switch","Journal of the American Chemical Society","2007","129","","14552","14553","10.1021/ja076035h","","","0.71073","MoKα","","0.0984","0.0779","","","0.1667","0.1781","","","","","","1.107","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110249","15.392","0.0008","22.7497","0.0014","16.0554","0.0009","90","","109.497","0.001","90","","5299.6","0.5","243","2","243","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H36 N O3 -","- C25 H29 N O3 -","- C200 H232 N8 O24 -","8","4","","John D. Huber; James L. Leighton","Highly Enantioselective Imine Cinnamylation with a Remarkable Diastereochemical Switch","Journal of the American Chemical Society","2007","129","","14552","14553","10.1021/ja076035h","","","0.71073","MoKα","","0.1398","0.0513","","","0.0827","0.0911","","","","","","1.02","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110250","18.344","0.004","12.128","0.002","15.01","0.003","90","","90","","90","","3339.4","1.1","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C26 H32 Cl11 Sb -","- C26 H32 Cl12 Sb -","- C104 H128 Cl48 Sb4 -","4","0.5","","Akira Matsuura; Tohru Nishinaga; Koichi Komatsu","Structural Studies on the Radical Cations of Benzene, Naphthalene, Biphenylene, and Anthracene Fully Annelated with Bicyclo[2.2.2]octene Frameworks [J.Am. Chem.Soc.2000,122, 10007-10016].","Journal of the American Chemical Society","2007","129","","14830","14830","10.1021/ja077519g","","","0.71073","MoKα","","0.0425","0.036","","","0.0945","0.098","","","","","","1.045","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110251","12.8433","0.0003","14.5296","0.0004","7.6465","0.0002","90","","99.806","0.001","90","","1406.05","0.06","100","","100","","","","","","","","methanole","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H13 Cl2 N -","- C17 H13 Cl2 N -","- C68 H52 Cl8 N4 -","4","1","","Christophe Aïssa; Alois Fürstner","A Rhodium-Catalyzed C-H Activation/Cycloisomerization Tandem","Journal of the American Chemical Society","2007","129","","14836","14837","10.1021/ja0746316","","","0.71073","MoKα","","0.0614","0.0395","","","0.0898","0.099","","","","","","1.003","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4110252","16.5383","0.0002","15.399","0.0003","20.8194","0.0004","90","","104.896","0.001","90","","5123.96","0.16","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C59 H51 F6 O3 P3 Ru -","- C59 H51 F6 O3 P3 Ru -","- C236 H204 F24 O12 P12 Ru4 -","4","1","","Cheng-Wei Cheng; Yi-Chun Kuo; Shu-Hao Chang; Ying-Chih Lin; Yi-Hong Liu; Yu Wang","Intramolecular Cyclization of Ruthenium Vinylidene Complexes with a Tethering Vinyl Group: Facile Cleavage and Reconstruction of the C-C Double Bond","Journal of the American Chemical Society","2007","129","","14974","14980","10.1021/ja074951p","","","0.71073","MoKα","","0.1145","0.0527","","","0.105","0.1291","","","","","","0.997","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110253","7.2982","0.0005","7.2982","0.0005","19.0019","0.0016","90","","90","","120","","876.51","0.11","100","2","293","2","","","","","","","","3","P 31 2 1","P 31 2""","152","","","","- P2 Rb2 Se6 -","- P2 Rb2 Se6 -","- P6 Rb6 Se18 -","3","0.5","","In Chung; Christos D. Malliakas; Joon I. Jang; Christian G. Canlas; David P. Weliky; Mercouri G. Kanatzidis","Helical Polymer 1/\ιnfty[P2Se62-]: Strong Second Harmonic Generation Response and Phase-Change Properties of Its K and Rb Salts","Journal of the American Chemical Society","2007","129","","14996","15006","10.1021/ja075096c","","","0.71073","MoKα","","0.0474","0.0387","","","0.0456","0.047","","","","","","0.976","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110254","7.2746","0.0008","7.2746","0.0008","18.871","0.004","90","","90","","120","","864.9","0.2","298","2","298","2","","","","","","","","3","P 31 2 1","P 31 2""","152","","","","- K2 P2 Se6 -","- K2 P2 Se6 -","- K6 P6 Se18 -","3","0.5","","In Chung; Christos D. Malliakas; Joon I. Jang; Christian G. Canlas; David P. Weliky; Mercouri G. Kanatzidis","Helical Polymer 1/\ιnfty[P2Se62-]: Strong Second Harmonic Generation Response and Phase-Change Properties of Its K and Rb Salts","Journal of the American Chemical Society","2007","129","","14996","15006","10.1021/ja075096c","","","0.71073","MoKα","","0.0264","0.0234","","","0.0511","0.0524","","","","","","1.078","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110255","14.4916","0.0007","14.4916","0.0007","18.7999","0.0017","90","","90","","120","","3419.2","0.4","173","2","173","2","","","","","","","","3","P 31","P 31","144","","","","- K2 P2 Se6 -","- K2 P2 Se6 -","- K24 P24 Se72 -","12","4","","In Chung; Christos D. Malliakas; Joon I. Jang; Christian G. Canlas; David P. Weliky; Mercouri G. Kanatzidis","Helical Polymer 1/\ιnfty[P2Se62-]: Strong Second Harmonic Generation Response and Phase-Change Properties of Its K and Rb Salts","Journal of the American Chemical Society","2007","129","","14996","15006","10.1021/ja075096c","","","0.71073","MoKα","","0.1492","0.0461","","","0.0817","0.1143","","","","","","0.974","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110256","6.8384","0.0001","14.49","0.0002","23.5088","0.0004","90","","90","","90","","2329.45","0.06","20","1","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C15 H10 O5 -","- C15 H10 O5 -","- C120 H80 O40 -","8","1","","Eric J. Yearley; Elizabeth A. Zhurova; Vladimir V. Zhurov; A. Alan Pinkerton","Binding of Genistein to the Estrogen Receptor Based on an Experimental Electron Density Study","Journal of the American Chemical Society","2007","129","","15013","15021","10.1021/ja075211j","","","0.71073","MoKα","","","0.0175","","","","0.0323","","","","","","1.0211","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110257","10.5116","0.0003","13.4898","0.0004","13.9436","0.0004","104.169","0.002","90.708","0.002","105.057","0.002","1845.13","0.1","100","2","100","2","","","","","","","synthesized","5","P -1","-P 1","2","","","","- C72 H60 Cl18 N8 O6 -","- C68 H56 Cl6 N8 O6 -","- C68 H56 Cl6 N8 O6 -","1","0.5","","Jeremiah J. Gassensmith; Easwaran Arunkumar; Lorna Barr; Jeffrey M. Baumes; Kristy M. DiVittorio; James R. Johnson; Bruce C. Noll; Bradley D. Smith","Self-Assembly of Fluorescent Inclusion Complexes in Competitive Media Including the Interior of Living Cells","Journal of the American Chemical Society","2007","129","","15054","15059","10.1021/ja075567v","","","0.71073","MoKα","","0.0725","0.056","","","0.1618","0.1712","","","","","","1.113","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4110258","11.704","0.0006","9.6398","0.0004","14.8049","0.0007","90","","113.283","0.001","90","","1534.32","0.13","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 Au Cl N2 -","- C14 H18 Au Cl N2 -","- C56 H72 Au4 Cl4 N8 -","4","1","","Sriparna Ray; Renu Mohan; Jay K. Singh; Manoja K. Samantaray; Mobin M. Shaikh; Dulal Panda; Prasenjit Ghosh","Anticancer and Antimicrobial Metallopharmaceutical Agents Based on Palladium, Gold, and Silver N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2007","129","","15042","15053","10.1021/ja075889z","","","0.71073","MoKα","","0.0639","0.0404","","","0.0867","0.0951","","","","","","0.943","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110259","10.2107","0.0006","13.9758","0.0006","10.6444","0.0006","90","","115.07","0.007","90","","1375.88","0.15","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 Cl N2 Pd0.5 -","- C14 H18 Cl N2 Pd0.5 -","- C56 H72 Cl4 N8 Pd2 -","4","1","","Sriparna Ray; Renu Mohan; Jay K. Singh; Manoja K. Samantaray; Mobin M. Shaikh; Dulal Panda; Prasenjit Ghosh","Anticancer and Antimicrobial Metallopharmaceutical Agents Based on Palladium, Gold, and Silver N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2007","129","","15042","15053","10.1021/ja075889z","","","0.71073","MoKα","","0.0575","0.0471","","","0.1206","0.1279","","","","","","0.999","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110260","8.719","0.0002","12.1235","0.0003","13.4064","0.0003","90","","91.957","0.002","90","","1416.29","0.06","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 Ag Cl N2 -","- C14 H18 Ag Cl N2 -","- C56 H72 Ag4 Cl4 N8 -","4","1","","Sriparna Ray; Renu Mohan; Jay K. Singh; Manoja K. Samantaray; Mobin M. Shaikh; Dulal Panda; Prasenjit Ghosh","Anticancer and Antimicrobial Metallopharmaceutical Agents Based on Palladium, Gold, and Silver N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2007","129","","15042","15053","10.1021/ja075889z","","","0.71073","MoKα","","0.0435","0.0408","","","0.1087","0.1126","","","","","","1.047","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110261","13.3056","0.0003","10.0597","0.0003","15.6576","0.0003","90","","104.898","0.002","90","","2025.33","0.09","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H23 Cl2 N3 Pd -","- C19 H23 Cl2 N3 Pd -","- C76 H92 Cl8 N12 Pd4 -","4","1","","Sriparna Ray; Renu Mohan; Jay K. Singh; Manoja K. Samantaray; Mobin M. Shaikh; Dulal Panda; Prasenjit Ghosh","Anticancer and Antimicrobial Metallopharmaceutical Agents Based on Palladium, Gold, and Silver N-Heterocyclic Carbene Complexes","Journal of the American Chemical Society","2007","129","","15042","15053","10.1021/ja075889z","","","0.71073","MoKα","","0.0277","0.0223","","","0.0563","0.059","","","","","","1.055","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110262","10.166","0.002","11.161","0.002","19.386","0.004","90","","90","","90","","2199.6","0.7","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H29 N O6 -","- C25 H29 N O6 -","- C100 H116 N4 O24 -","4","1","","K. C. Nicolaou; Yefeng Tang; Jianhua Wang; Antonia F. Stepan; Ang Li; Ana Montero","Total Synthesis and Antibacterial Properties of Carbaplatensimycin","Journal of the American Chemical Society","2007","129","","14850","14851","10.1021/ja076126e","","","0.71073","MoKα","","0.073","0.053","","","0.114","0.1232","","","","","","1.055","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110263","14.437","0.006","18.314","0.006","16.522","0.006","90","","112.17","0.009","90","","4045","3","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H56 N4 O4 Pd -","- C44 H56 N4 O4 Pd -","- C176 H224 N16 O16 Pd4 -","4","1","","James D. Crowley; David A. Leigh; Paul J. Lusby; Roy T. McBurney; Laure-Emmanuelle Perret-Aebi; Christiane Petzold; Alexandra M. Z. Slawin; Mark D. Symes","A Switchable Palladium-Complexed Molecular Shuttle and Its Metastable Positional Isomers","Journal of the American Chemical Society","2007","129","","15085","15090","10.1021/ja076570h","","","0.71073","MoKα","","0.2561","0.0937","","","0.1565","0.1982","","","","","","0.953","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110264","18.098","0.002","18.151","0.002","12.7405","0.0014","90","","91.62","0.03","90","","4183.5","0.8","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H61 N5 O4 Pd -","- C46 H61 N5 O4 Pd -","- C184 H244 N20 O16 Pd4 -","4","1","","James D. Crowley; David A. Leigh; Paul J. Lusby; Roy T. McBurney; Laure-Emmanuelle Perret-Aebi; Christiane Petzold; Alexandra M. Z. Slawin; Mark D. Symes","A Switchable Palladium-Complexed Molecular Shuttle and Its Metastable Positional Isomers","Journal of the American Chemical Society","2007","129","","15085","15090","10.1021/ja076570h","","","0.71073","","","0.0642","0.0512","","","0.1178","0.1268","","","","","","1.125","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110265","5.955","0.003","11.936","0.007","27.882","0.015","90","","90","","90","","1981.8","1.9","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H20 Br N O -","- C22 H20 Br N O -","- C88 H80 Br4 N4 O4 -","4","1","","Scott E. Denmark; Tyler W. Wilson; Matthew T. Burk; John R. Heemstra","Enantioselective Construction of Quaternary Stereogenic Carbons by the Lewis Base Catalyzed Additions of Silyl Ketene Imines to Aldehydes","Journal of the American Chemical Society","2007","129","","14864","14865","10.1021/ja077134y","","","0.71073","MoKα","","0.0701","0.035","","","0.0642","0.0702","","","","","","0.894","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4110266","25.14","0.04","7.838","0.019","15.2","0.03","90","","90","","90","","2995","11","123.1","","","","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C18 H20 O3 -","- C18 H20 O3 -","- C144 H160 O24 -","8","1","","Ryo Shintani; Soyoung Park; Tamio Hayashi","Palladium-Catalyzed Synthesis of Spiro[2.4]heptanes: Ligand-Dependent Position Control in the Nucleophilic Attack to a π-Allylpalladium Intermediate","Journal of the American Chemical Society","2007","129","","14866","14867","10.1021/ja077236o","","","0.71075","MoKα","","","0.0641","","","","0.1848","","","","","","1.066","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110267","24.204","0.011","11.794","0.005","16.099","0.007","90","","131.987","0.016","90","","3416","3","123.1","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C21 H22 O4 -","- C28 H29.3333 O5.33333 -","- C168 H176 O32 -","6","0.75","","Ryo Shintani; Soyoung Park; Tamio Hayashi","Palladium-Catalyzed Synthesis of Spiro[2.4]heptanes: Ligand-Dependent Position Control in the Nucleophilic Attack to a π-Allylpalladium Intermediate","Journal of the American Chemical Society","2007","129","","14866","14867","10.1021/ja077236o","","","0.71075","MoKα","","","0.0469","","","","0.0552","","","","","","0.858","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110268","7.328","0.005","8.183","0.005","12.226","0.01","72.48","0.03","88.5","0.03","76.67","0.02","679.5","0.8","123.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C16 H18 O4 -","- C16 H18 O4 -","- C32 H36 O8 -","2","1","","Ryo Shintani; Soyoung Park; Tamio Hayashi","Palladium-Catalyzed Synthesis of Spiro[2.4]heptanes: Ligand-Dependent Position Control in the Nucleophilic Attack to a π-Allylpalladium Intermediate","Journal of the American Chemical Society","2007","129","","14866","14867","10.1021/ja077236o","","","0.71075","MoKα","","","0.0437","","","","0.1366","","","","","","1.129","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110269","12.722","0.0015","13.0859","0.0015","14.9523","0.0017","90","","90","","90","","2489.2","0.5","143","1","143","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C11 H20 O3 -","- C11 H20 O3 -","- C88 H160 O24 -","8","2","","Amos B. Smith; Kallol Basu; Todd Bosanac","Total Synthesis of (-)-Okilactomycin","Journal of the American Chemical Society","2007","129","","14872","14874","10.1021/ja077569l","","","0.71069","MoKα","","0.0552","0.0472","","","0.1189","0.1268","","","","","","1.044","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110270","10.8093","0.0009","11.143","0.001","20.0215","0.0019","90","","90","","90","","2411.6","0.4","143","1","143","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H37 I O4 -","- C24 H37 I O4 -","- C96 H148 I4 O16 -","4","1","","Amos B. Smith; Kallol Basu; Todd Bosanac","Total Synthesis of (-)-Okilactomycin","Journal of the American Chemical Society","2007","129","","14872","14874","10.1021/ja077569l","","","0.71069","MoKα","","0.0359","0.0332","","","0.0746","0.0778","","","","","","1.063","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110271","31.074","0.002","15.349","0.0013","24.411","0.002","90","","116.615","0.001","90","","10409.2","1.4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","05162a","","","- C106 H60 B2 F48 N6 Ru -","- C106 H60 B2 F48 N6 Ru -","- C424 H240 B8 F192 N24 Ru4 -","4","0.5","","Kari A. McGee; David J. Veltkamp; Brian J. Marquardt; Kent R. Mann","Porous Crystalline Ruthenium Complexes Are Oxygen Sensors","Journal of the American Chemical Society","2007","129","","15092","15093","10.1021/ja0681772","","","0.71069","MoKα","","0.0705","0.0608","","","0.1368","0.142","","","","","","1.148","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110272","12.8314","0.0006","12.8314","0.0006","44.695","0.004","90","","90","","90","","7358.8","0.8","173","2","173","2","","","","","","","","6","P 41","P 4w","76","05151x","","","- C84 H24 B2 F40 N6 Ru -","- C84 H24 B2 F40 N6 Ru -","- C336 H96 B8 F160 N24 Ru4 -","4","1","","Kari A. McGee; David J. Veltkamp; Brian J. Marquardt; Kent R. Mann","Porous Crystalline Ruthenium Complexes Are Oxygen Sensors","Journal of the American Chemical Society","2007","129","","15092","15093","10.1021/ja0681772","","","0.71073","MoKα","","0.0709","0.057","","","0.104","0.1083","","","","","","1.104","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110273","30.846","0.002","14.903","0.001","24.201","0.0016","90","","119.436","0.001","90","","9689","1.1","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","05060x","","","- C100 H48 B2 F48 N6 Ru -","- C100 H48 B2 F48 N6 Ru -","- C400 H192 B8 F192 N24 Ru4 -","4","0.5","","Kari A. McGee; David J. Veltkamp; Brian J. Marquardt; Kent R. Mann","Porous Crystalline Ruthenium Complexes Are Oxygen Sensors","Journal of the American Chemical Society","2007","129","","15092","15093","10.1021/ja0681772","","","0.71073","MoKα","","0.0567","0.0469","","","0.1198","0.129","","","","","","1.028","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110274","22.196","0.005","42.772","0.009","13.683","0.003","90","","90","","90","","12990","5","173","2","173","2","","","","","","","","6","F d d 2","F 2 -2d","43","06246b","","","- C30 H24 B2 F8 N6 Ru -","- C30 H24 B2 F8 N6 Ru -","- C480 H384 B32 F128 N96 Ru16 -","16","1","","Kari A. McGee; David J. Veltkamp; Brian J. Marquardt; Kent R. Mann","Porous Crystalline Ruthenium Complexes Are Oxygen Sensors","Journal of the American Chemical Society","2007","129","","15092","15093","10.1021/ja0681772","","","0.71073","MoKα","","0.1067","0.0912","","","0.2428","0.2531","","","","","","1.075","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110275","13.102","0.004","26.279","0.009","26.104","0.006","90","","93.923","0.005","90","","8967","5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Tb1","","","- C45.5 H41 N6.5 O28.25 Tb V6 -","- C45.2 H44.8 N6.4 O27.4 Tb V6 -","- C180.8 H179.2 N25.6 O109.6 Tb4 V24 -","4","1","","Jong Woo Han; Craig L. Hill","A Coordination Network That Catalyzes O2-Based Oxidations","Journal of the American Chemical Society","2007","129","","15094","15095","10.1021/ja069319v","","","0.71073","MoKα","","0.1161","0.0827","","","0.2058","0.2198","","","","","","1.007","","","","has coordinates","212017","2020-10-21","18:00:00",""
"4110276","8.4351","0.0017","11.136","0.002","14.463","0.003","90.08","0.03","93.13","0.03","101.75","0.03","1328","0.5","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H88 Cu2 Li4 N6 O2 -","- C46 H88 Cu2 Li4 N6 O2 -","- C46 H88 Cu2 Li4 N6 O2 -","1","0.5","","Shinya Usui; Yuichi Hashimoto; James V. Morey; Andrew E. H. Wheatley; Masanobu Uchiyama","Direct ortho Cupration: A New Route to Regioselectively Functionalized Aromatics","Journal of the American Chemical Society","2007","129","","15102","15103","10.1021/ja074669i","","","0.71073","MoKα","","0.0493","0.0388","","","0.1091","0.118","","","","","","0.971","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110277","6.8531","0.0004","8.8684","0.0005","15.2047","0.0008","90","","90","","90","","924.08","0.09","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H12 Cl N3 O3 -","- C6 H12 Cl N3 O3 -","- C24 H48 Cl4 N12 O12 -","4","1","","Loren B. Andreas; Anil K. Mehta; Manish A. Mehta","Determination of Global Structure from Distance and Orientation Constraints in Biological Solids Using Solid-State NMR Spectroscopy","Journal of the American Chemical Society","2007","129","","15233","15239","10.1021/ja074789q","","","0.71073","MoKα","","0.0229","0.0228","","","0.0601","0.0602","","","","","","1.105","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110278","17.64","0.002","17.64","0.002","45.187","0.011","90","","90","","120","","12177","4","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C36 H145 Cl16 Cu12 Gd7 N18 O142 -","- C36 H74 Cl16 Cu12 Gd7 N18 O142.002 -","- C108 H222 Cl48 Cu36 Gd21 N54 O426.006 -","3","0.166667","","Shengchang Xiang; Shengmin Hu; Tianlu Sheng; Ruibiao Fu; Xintao Wu; Xudong Zhang","A Fan-Shaped Polynuclear Gd6Cu12 Amino Acid Cluster: A ""Hollow"" and Ferromagnetic [Gd6(μ3-OH)8] Octahedral Core Encapsulated by Six [Cu2] Glycinato Blade Fragments","Journal of the American Chemical Society","2007","129","","15144","15146","10.1021/ja0760832","","","0.71073","MoKα","","0.0491","0.0457","","","0.1193","0.1219","","","","","","1.095","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4110279","13.596","0.001","13.596","0.001","55.303","0.005","90","","90","","120","","8853.2","1.2","168.2","","","","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","","","- C61 H83 Fe N4 Na O7 -","- C61.02 H75 Fe N4 Na O6.99 -","- C366.12 H450 Fe6 N24 Na6 O41.94 -","6","0.333333","","W. Hill Harman; Christopher J. Chang","N~2~O Activation and Oxidation Reactivity from a Non-Heme Iron Pyrrole Platform","Journal of the American Chemical Society","2007","129","","15128","15129","10.1021/ja076842g","","","0.7107","MoKα","","0.0538","0.0416","","0.0536","","0.0515","","","","","","2.009","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110280","11.994","0.002","16.762","0.003","23.8","0.005","90","","100.615","0.003","90","","4703","1.5","160.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H62 Fe N4 Na O7 -","- C49 H55 Fe N4 Na O7 -","- C196 H220 Fe4 N16 Na4 O28 -","4","1","","W. Hill Harman; Christopher J. Chang","N2O Activation and Oxidation Reactivity from a Non-Heme Iron Pyrrole Platform","Journal of the American Chemical Society","2007","129","","15128","15129","10.1021/ja076842g","","","0.7107","MoKα","","0.1198","0.0633","","0.0799","","0.0698","","","","","","2.059","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4110281","17.625","0.005","13.84","0.004","24.177","0.006","90","","95.855","0.004","90","","5867","3","141.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58 H85 Fe K N4 O8 -","- C58 H85 Fe K N4 O8 -","- C232 H340 Fe4 K4 N16 O32 -","4","1","","W. Hill Harman; Christopher J. Chang","N2O Activation and Oxidation Reactivity from a Non-Heme Iron Pyrrole Platform","Journal of the American Chemical Society","2007","129","","15128","15129","10.1021/ja076842g","","","0.7107","MoKα","","0.0774","0.0398","","0.0534","","0.0472","","","","","","1.665","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110282","30.7996","0.0014","13.3966","0.0006","21.7807","0.001","90","","107.379","0.001","90","","8576.7","0.7","168.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H56 Fe K N4 O3 -","- C46 H56 Fe K N4 O3 -","- C368 H448 Fe8 K8 N32 O24 -","8","2","","W. Hill Harman; Christopher J. Chang","N2O Activation and Oxidation Reactivity from a Non-Heme Iron Pyrrole Platform","Journal of the American Chemical Society","2007","129","","15128","15129","10.1021/ja076842g","","","0.7107","MoKα","","0.0837","0.0452","","0.0615","","0.0531","","","","","","1.72","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110283","14.0114","0.0004","9.3901","0.0003","11.5641","0.0004","90","","106.168","0.002","90","","1461.3","0.08","150","2","150","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C11 H20 Cl2 Ge N2 -","- C11 H20 Cl2 Ge N2 -","- C44 H80 Cl8 Ge4 N8 -","4","1","","Paul A. Rupar; Viktor N. Staroverov; Paul J. Ragogna; Kim M. Baines","A Germanium(II)-Centered Dication","Journal of the American Chemical Society","2007","129","","15138","15139","10.1021/ja0775725","","x-ray","0.71073","MoKα","","0.03","0.0291","","","0.0707","0.0715","","","","","","1.031","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110284","16.3681","0.0003","16.3681","0.0003","16.3681","0.0003","90","","90","","90","","4385.25","0.14","150","2","150","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- C38 H65 Ge I2 N7 -","- C37.95 H64.95 Ge I1.99 N6.99 -","- C151.8 H259.8 Ge4 I7.96 N27.96 -","4","0.333333","","Paul A. Rupar; Viktor N. Staroverov; Paul J. Ragogna; Kim M. Baines","A Germanium(II)-Centered Dication","Journal of the American Chemical Society","2007","129","","15138","15139","10.1021/ja0775725","","","0.71073","MoKα","","0.0652","0.0632","","","0.1418","0.1427","","","","","","1.199","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110285","21.4774","0.0007","8.6709","0.0003","20.2449","0.0007","90","","100.794","0.0014","90","","3703.5","0.2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H23 Ge I2 N2 -","- C14 H23 Ge I2 N2 -","- C112 H184 Ge8 I16 N16 -","8","1","","Paul A. Rupar; Viktor N. Staroverov; Paul J. Ragogna; Kim M. Baines","A Germanium(II)-Centered Dication","Journal of the American Chemical Society","2007","129","","15138","15139","10.1021/ja0775725","","","0.71073","MoKα","","0.0402","0.0354","","","0.09","0.0927","","","","","","1.062","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110286","9.264","0.005","12.458","0.007","16.136","0.009","73.298","0.007","87.149","0.007","75.923","0.008","1729.7","1.7","108","2","108","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H23 Cl10 N3 O2 Pd -","- C29 H23 Cl10 N3 O2 Pd -","- C58 H46 Cl20 N6 O4 Pd2 -","2","1","","Salena R. Whitfield; Melanie S. Sanford","Reactivity of Pd(II) Complexes with Electrophilic Chlorinating Reagents: Isolation of Pd(IV) Products and Observation of C-Cl Bond-Forming Reductive Elimination","Journal of the American Chemical Society","2007","129","","15142","15143","10.1021/ja077866q","","","0.71073","MoKα","","0.0608","0.0459","","","0.1249","0.1338","","","","","","1.054","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110287","13.102","0.004","26.279","0.009","26.104","0.006","90","","93.923","0.005","90","","8967","5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Tb1","","","- C45.5 H41 N6.5 O28.25 Tb V6 -","- C45.2 H44.8 N6.4 O27.4 Tb V6 -","- C180.8 H179.2 N25.6 O109.6 Tb4 V24 -","4","1","","Jong Woo Han; Craig L. Hill","A Coordination Network That Catalyzes O2-Based Oxidations","Journal of the American Chemical Society","2007","129","","15094","15095","10.1021/ja069319v","","","0.71073","MoKα","","0.1666","0.1318","","","0.3367","0.3582","","","","","","1.137","","4110275","","has coordinates","215354","2020-10-21","18:00:00",""
"4110288","27.596","0.006","13.69","0.003","45.419","0.009","90","","90","","90","","17159","6","80","2","80","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C78.39 H56 I6 N16 O10 Zn3 -","- C78.379 H56 I6 N16 O10 Zn3 -","- C627.032 H448 I48 N128 O80 Zn24 -","8","1","","Masaki Kawano; Takehide Kawamichi; Tsuyoshi Haneda; Takahiro Kojima; Makoto Fujita","The Modular Synthesis of Functional Porous Coordination Networks","Journal of the American Chemical Society","2007","129","","15418","15419","10.1021/ja0752540","","","0.689","synchrotron","","0.0778","0.0529","","","0.142","0.1539","","","","","","0.957","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110289","27.123","0.004","13.6817","0.0018","45.995","0.006","90","","90","","90","","17068","4","90","2","90","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C79 H60 I6 N16 O10 Zn3 -","- C79 H60 I6 N16 O10 Zn3 -","- C632 H480 I48 N128 O80 Zn24 -","8","1","","Masaki Kawano; Takehide Kawamichi; Tsuyoshi Haneda; Takahiro Kojima; Makoto Fujita","The Modular Synthesis of Functional Porous Coordination Networks","Journal of the American Chemical Society","2007","129","","15418","15419","10.1021/ja0752540","","","0.71073","MoKα","","0.0811","0.0382","","","0.0742","0.0867","","","","","","1.03","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110290","27.122","0.004","13.692","0.002","45.963","0.007","90","","90","","90","","17069","4","80","2","80","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C78 H57 I6 N17 O8 Zn3 -","- C78 H57 I6 N17 O8 Zn3 -","- C624 H456 I48 N136 O64 Zn24 -","8","1","","Masaki Kawano; Takehide Kawamichi; Tsuyoshi Haneda; Takahiro Kojima; Makoto Fujita","The Modular Synthesis of Functional Porous Coordination Networks","Journal of the American Chemical Society","2007","129","","15418","15419","10.1021/ja0752540","","","0.71073","MoKα","","0.0775","0.0455","","","0.0946","0.1077","","","","","","1.041","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110291","27.286","0.003","13.6997","0.0017","45.829","0.006","90","","90","","90","","17131","4","80","2","80","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C79.82 H58.51 I6 N17.3 O8.59 Zn3 -","- C78.18 H57.152 I6 N17.032 O8.066 Zn3 -","- C625.44 H457.216 I48 N136.256 O64.528 Zn24 -","8","1","","Masaki Kawano; Takehide Kawamichi; Tsuyoshi Haneda; Takahiro Kojima; Makoto Fujita","The Modular Synthesis of Functional Porous Coordination Networks","Journal of the American Chemical Society","2007","129","","15418","15419","10.1021/ja0752540","","","0.71073","MoKα","","0.0865","0.0709","","","0.1579","0.1651","","","","","","1.158","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4110292","27.424","0.003","13.7934","0.0014","45.907","0.005","90","","90","","90","","17365","3","80","2","80","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C78 H55 I6 N17 O10 Zn3 -","- C78 H55 I6 N17 O10 Zn3 -","- C624 H440 I48 N136 O80 Zn24 -","8","1","","Masaki Kawano; Takehide Kawamichi; Tsuyoshi Haneda; Takahiro Kojima; Makoto Fujita","The Modular Synthesis of Functional Porous Coordination Networks","Journal of the American Chemical Society","2007","129","","15418","15419","10.1021/ja0752540","","","0.71073","MoKα","","0.0761","0.05","","","0.1286","0.1444","","","","","","0.98","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110293","27.881","0.006","13.675","0.003","45.714","0.009","90","","90","","90","","17429","6","90","2","90","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C79.2 H79.4 I6 N13 O2 Zn3 -","- C80.082 H81.164 I6 N13 O2 Zn3 -","- C640.656 H649.312 I48 N104 O16 Zn24 -","8","1","","Masaki Kawano; Takehide Kawamichi; Tsuyoshi Haneda; Takahiro Kojima; Makoto Fujita","The Modular Synthesis of Functional Porous Coordination Networks","Journal of the American Chemical Society","2007","129","","15418","15419","10.1021/ja0752540","","","0.71073","MoKα","","0.0697","0.048","","","0.1124","0.1228","","","","","","1.101","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4110294","27.449","0.004","13.707","0.002","45.248","0.007","90","","90","","90","","17024","4","82","2","82","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C75 H84 I6 N12 O5.07 Zn3 -","- C75 H84 I6 N12 O5.118 Zn3 -","- C600 H672 I48 N96 O40.944 Zn24 -","8","1","","Masaki Kawano; Takehide Kawamichi; Tsuyoshi Haneda; Takahiro Kojima; Makoto Fujita","The Modular Synthesis of Functional Porous Coordination Networks","Journal of the American Chemical Society","2007","129","","15418","15419","10.1021/ja0752540","","","0.71073","MoKα","","0.1122","0.0645","","","0.1578","0.1811","","","","","","1.12","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110295","27.59","0.006","13.673","0.003","45.606","0.009","90","","90","","90","","17204","6","82","2","82","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C79.19 H90.83 I6 N12 O3.22 Zn3 -","- C79.371 H91.356 I6 N12 O3.307 Zn3 -","- C634.968 H730.848 I48 N96 O26.456 Zn24 -","8","1","","Masaki Kawano; Takehide Kawamichi; Tsuyoshi Haneda; Takahiro Kojima; Makoto Fujita","The Modular Synthesis of Functional Porous Coordination Networks","Journal of the American Chemical Society","2007","129","","15418","15419","10.1021/ja0752540","","","0.71073","MoKα","","0.0847","0.0442","","","0.0917","0.107","","","","","","1.007","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110296","6.0975","0.0002","8.3422","0.0002","28.8836","0.001","90","","95.5451","0.0012","90","","1462.33","0.08","90","","90","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H36 F2 N O14.5 -","- C25 H35 F2 N O14.5 -","- C50 H70 F4 N2 O29 -","2","1","","Go Hirai; Toru Watanabe; Kazunori Yamaguchi; Taeko Miyagi; Mikiko Sodeoka","Stereocontrolled and Convergent Entry to CF2-Sialosides: Synthesis of CF2-Linked Ganglioside GM4","Journal of the American Chemical Society","2007","129","","15420","15421","10.1021/ja075738w","","","0.71073","MoKα","","0.0394","0.0325","","","0.0795","0.0835","","","","","","1.032","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110297","7.6498","0.0004","16.9929","0.001","27.4065","0.0017","90","","90","","90","","3562.6","0.4","273","2","273","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C19 H24 O2 Si -","- C19 H24 O2 Si -","- C152 H192 O16 Si8 -","8","1","","Jhih-Meng Tang; Sabyasachi Bhunia; Shariar Md. Abu Sohel; Ming-Yuan Lin; Hsin-Yi Liao; Swarup Datta; Arindam Das; Rai-Shung Liu","The Skeletal Rearrangement of Gold- and Platinum-Catalyzed Cycloisomerization of cis-4,6-Dien-1-yn-3-ols: Pinacol Rearrangement and Formation of Bicyclo[4.1.0]heptenone and Reorganized Styrene Derivatives","Journal of the American Chemical Society","2007","129","","15677","15683","10.1021/ja076175r","","","0.71073","MoKα","","0.0826","0.0514","","","0.1438","0.1893","","","","","","1.131","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110298","24.512","0.006","10.257","0.002","34.311","0.009","90","","110.95","0.04","90","","8056","4","293","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Ac-[L-(αMe)Val]7-NHiPr","","- C47 H88 N8 O8 -","- C47 H88 N8 O8 -","- C282 H528 N48 O48 -","6","3","","Marco Crisma; Michele Saviano; Alessandro Moretto; Quirinus B. Broxterman; Bernard Kaptein; Claudio Toniolo","Peptide α/310-Helix Dimorphism in the Crystal State","Journal of the American Chemical Society","2007","129","","15471","15473","10.1021/ja076656a","","","1.54178","CuKα","","0.159","0.1212","","","0.3041","0.3649","","","","","","1.411","","","","has coordinates","178873","2020-10-21","18:00:00",""
"4110299","30.677","0.004","11.02","0.002","38.639","0.005","90","","94.53","0.08","90","","13022","4","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","Ac-[L-(αMe)Val]7-NHiPr 1,1,1,3,3,3-hexafluoropropan-2-ol bis-solvate","","- C106 H184 F24 N16 O20 -","- C106 H184 F24 N16 O20 -","- C424 H736 F96 N64 O80 -","4","1","","Marco Crisma; Michele Saviano; Alessandro Moretto; Quirinus B. Broxterman; Bernard Kaptein; Claudio Toniolo","Peptide α/310-Helix Dimorphism in the Crystal State","Journal of the American Chemical Society","2007","129","","15471","15473","10.1021/ja076656a","","","1.54178","CuKα","","0.174","0.0878","","","0.2153","0.2639","","","","","","0.927","","","","has coordinates,has disorder","178873","2020-10-21","18:00:00",""
"4110300","13.4273","0.0007","13.4273","0.0007","39.175","0.004","90","","90","","90","","7063","0.9","100","2","100","2","","","","","","","","4","I -4 2 d","I -4 2bw","122","","","","- C24 Ag6 F36 N18 -","- C24 Ag6 F36 N18 -","- C96 Ag24 F144 N72 -","4","0.25","","Chi Yang; Xiaoping Wang; Mohammad A. Omary","Fluorous Metal-Organic Frameworks for High-Density Gas Adsorption","Journal of the American Chemical Society","2007","129","","15454","15455","10.1021/ja0775265","","","0.71073","MoKα","","0.0768","0.0554","","","0.1417","0.1785","","","","","","1.196","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110301","5.864","0.005","7.74","0.007","37.91","0.03","90","0.003","90.589","0.003","90","0.003","1721","3","294.2","","294.2","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","BTBT-C12","BTBT-C12","","- C38 H56 S2 -","- C38 H56 S2 -","- C76 H112 S4 -","2","0.5","","Hideaki Ebata; Takafumi Izawa; Eigo Miyazaki; Kazuo Takimiya; Masaaki Ikeda; Hirokazu Kuwabara; Tatsuto Yui","Highly Soluble [1]Benzothieno[3,2-b]benzothiophene (BTBT) Derivatives for High-Performance, Solution-Processed Organic Field-Effect Transistors","Journal of the American Chemical Society","2007","129","","15732","15733","10.1021/ja074841i","","","0.7107","MoKα","","0.0957","0.0608","","","0.1405","0.1646","","","","","","0.818","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110302","8.004","0.0006","17.2811","0.0014","9.5685","0.0008","90","","111.599","0.001","90","","1230.56","0.17","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H20 Co2 N8 O8 -","- C22 H20 Co2 N8 O8 -","- C44 H40 Co4 N16 O16 -","2","0.5","","Xiao-Ning Cheng; Wei-Xiong Zhang; Xiao-Ming Chen","Single Crystal-to-Single Crystal Transformation from Ferromagnetic Discrete Molecules to a Spin-Canting Antiferromagnetic Layer","Journal of the American Chemical Society","2007","129","","15738","15739","10.1021/ja074962i","","","0.71073","MoKα","","0.0463","0.0394","","","0.0919","0.095","","","","","","1.113","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110303","9.722","0.003","7.723","0.002","15.01","0.004","90","","91.352","0.005","90","","1126.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 Co2 N8 O6 -","- C22 H16 Co2 N8 O6 -","- C44 H32 Co4 N16 O12 -","2","0.5","","Xiao-Ning Cheng; Wei-Xiong Zhang; Xiao-Ming Chen","Single Crystal-to-Single Crystal Transformation from Ferromagnetic Discrete Molecules to a Spin-Canting Antiferromagnetic Layer","Journal of the American Chemical Society","2007","129","","15738","15739","10.1021/ja074962i","","","0.71073","MoKα","","0.0612","0.0457","","","0.0957","0.102","","","","","","1.108","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110304","18.3532","0.0011","18.3532","0.0011","40.667","0.003","90","","90","","120","","11863.1","1.3","295","2","295","2","","","","","","","","4","P 63/m m c","-P 6c 2c","194","UMCM-150","","","- C30 H14 Cu3 O14 -","- C30 H14 Cu3 O14 -","- C180 H84 Cu18 O84 -","6","0.25","","Antek G. Wong-Foy; Olivier Lebel; Adam J. Matzger","Porous Crystal Derived from a Tricarboxylate Linker with Two Distinct Binding Motifs","Journal of the American Chemical Society","2007","129","","15740","15741","10.1021/ja0753952","","","1.5418","CuKα","","0.1576","0.0898","","","0.1912","0.2217","","","","","","1.089","","","","has coordinates,has disorder","178874","2020-10-21","18:00:00",""
"4110305","10.9503","0.0004","17.684","0.001","23.9264","0.0012","104.52","0.002","96.031","0.003","91.682","0.003","4453","0.4","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C97 H60 Cl5 F18 N5 O15 S2 -","- C96.7 H55.8 Cl5 F17.4 N5 O14.9 S2 -","- C193.4 H111.6 Cl10 F34.8 N10 O29.8 S4 -","2","1","","Howard M. Colquhoun; Zhixue Zhu; Christine J. Cardin; Yu Gan; Michael G. B. Drew","Sterically Controlled Recognition of Macromolecular Sequence Information by Molecular Tweezers","Journal of the American Chemical Society","2007","129","","16163","16174","10.1021/ja0759996","","","0.71073","MoKα","","0.171","0.1393","","","0.3912","0.4179","","","","","","1.695","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110306","14.688","0.017","25.33","0.03","20.85","0.02","90","","101.701","0.01","90","","7596","15","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C82 H50 F30 N4 O11 -","- C82 H48 F30 N4 O11 -","- C328 H192 F120 N16 O44 -","4","1","","Howard M. Colquhoun; Zhixue Zhu; Christine J. Cardin; Yu Gan; Michael G. B. Drew","Sterically Controlled Recognition of Macromolecular Sequence Information by Molecular Tweezers","Journal of the American Chemical Society","2007","129","","16163","16174","10.1021/ja0759996","","","1.54178","CuKα","","0.1719","0.139","","","0.3862","0.4211","","","","","","1.607","","","","has coordinates,has disorder","178874","2020-10-21","18:00:00",""
"4110307","12.631","0.003","6.1265","0.0013","13.649","0.003","90","","91.167","0.005","90","","1056","0.4","143","1","143","1","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H26 O4 -","- C25 H26 O4 -","- C50 H52 O8 -","2","1","","Luca Salvi; Sang-Jin Jeon; Ethan L. Fisher; Patrick J. Carroll; Patrick J. Walsh","Catalytic Asymmetric Generation of (Z)-Disubstituted Allylic Alcohols","Journal of the American Chemical Society","2007","129","","16119","16125","10.1021/ja0762285","","","0.71073","MoKα","","0.0542","0.0437","","","0.0888","0.0971","","","","","","1.099","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110308","6.4191","0.0008","12.2108","0.0016","27.39","0.004","90","","90","","90","","2146.9","0.5","143","1","143","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C25 H26 O5 -","- C25 H26 O5 -","- C100 H104 O20 -","4","1","","Luca Salvi; Sang-Jin Jeon; Ethan L. Fisher; Patrick J. Carroll; Patrick J. Walsh","Catalytic Asymmetric Generation of (Z)-Disubstituted Allylic Alcohols","Journal of the American Chemical Society","2007","129","","16119","16125","10.1021/ja0762285","","","0.71073","MoKα","","0.0693","0.0501","","","0.1049","0.1225","","","","","","1.119","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110309","24.831","0.005","13.989","0.003","19.483","0.004","90","","111.7","0.03","90","","6288","3","143","2","143","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C82 H59 N O14 -","- C82 H59 N O14 -","- C328 H236 N4 O56 -","4","1","","Zuo Xiao; Jiayao Yao; Dazhi Yang; Fudong Wang; Shaohua Huang; Liangbing Gan; Zhenshan Jia; Zhongping Jiang; Xiaobing Yang; Bo Zheng; Gu Yuan; Shiwei Zhang; Zheming Wang","Synthesis of [59]Fullerenones through Peroxide-Mediated Stepwise Cleavage of Fullerene Skeleton Bonds and X-ray Structures of Their Water-Encapsulated Open-Cage Complexes","Journal of the American Chemical Society","2007","129","","16149","16162","10.1021/ja0763798","","","0.71073","MoKα","","0.1989","0.0796","","","0.1678","0.1953","","","","","","1.027","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110310","13.586","0.003","17.026","0.003","17.336","0.004","87.21","0.03","77.5","0.03","75.58","0.03","3791.6","1.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C90 H46 Cl12 N2 O13 -","- C90 H46 Cl12 N2 O13 -","- C180 H92 Cl24 N4 O26 -","2","1","","Zuo Xiao; Jiayao Yao; Dazhi Yang; Fudong Wang; Shaohua Huang; Liangbing Gan; Zhenshan Jia; Zhongping Jiang; Xiaobing Yang; Bo Zheng; Gu Yuan; Shiwei Zhang; Zheming Wang","Synthesis of [59]Fullerenones through Peroxide-Mediated Stepwise Cleavage of Fullerene Skeleton Bonds and X-ray Structures of Their Water-Encapsulated Open-Cage Complexes","Journal of the American Chemical Society","2007","129","","16149","16162","10.1021/ja0763798","","","0.71073","MoKα","","0.1283","0.0789","","","0.2143","0.2411","","","","","","1.013","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110311","11.6078","0.0003","14.2697","0.0004","14.6697","0.0004","87.253","0.002","85.787","0.002","88.37","0.001","2419.78","0.11","200","2","200","","","","","","","","","7","P -1","-P 1","2","","","","- C72 H18 Br Cl2 N O8 S2 -","- C72 H18 Br Cl2 N O8 S2 -","- C144 H36 Br2 Cl4 N2 O16 S4 -","2","1","","Zuo Xiao; Jiayao Yao; Dazhi Yang; Fudong Wang; Shaohua Huang; Liangbing Gan; Zhenshan Jia; Zhongping Jiang; Xiaobing Yang; Bo Zheng; Gu Yuan; Shiwei Zhang; Zheming Wang","Synthesis of [59]Fullerenones through Peroxide-Mediated Stepwise Cleavage of Fullerene Skeleton Bonds and X-ray Structures of Their Water-Encapsulated Open-Cage Complexes","Journal of the American Chemical Society","2007","129","","16149","16162","10.1021/ja0763798","","","0.71073","MoKα","","0.1244","0.0497","","","0.1108","0.1258","","","","","","0.914","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110312","14.3254","0.0002","14.6236","0.0002","15.6704","0.0003","78.9479","0.0009","67.0876","0.0009","62.6231","0.0007","2684.79","0.08","200","","200","","","","","","","","","7","P -1","-P 1","2","","","","- C72 H15.65 Br Cl9 D3 N O8.83 -","- C72 H17 Br Cl9 N O8.826 -","- C144 H34 Br2 Cl18 N2 O17.652 -","2","1","","Zuo Xiao; Jiayao Yao; Dazhi Yang; Fudong Wang; Shaohua Huang; Liangbing Gan; Zhenshan Jia; Zhongping Jiang; Xiaobing Yang; Bo Zheng; Gu Yuan; Shiwei Zhang; Zheming Wang","Synthesis of [59]Fullerenones through Peroxide-Mediated Stepwise Cleavage of Fullerene Skeleton Bonds and X-ray Structures of Their Water-Encapsulated Open-Cage Complexes","Journal of the American Chemical Society","2007","129","","16149","16162","10.1021/ja0763798","","","0.71073","MoKα","","0.0869","0.0465","","","0.1108","0.1213","","","","","","1.06","","","","has coordinates,has disorder","178874","2020-10-21","18:00:00",""
"4110313","12.7939","0.0003","14.6804","0.0003","14.8585","0.0004","80.4622","0.0009","89.7112","0.001","69.6389","0.0009","2576","0.11","200","","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C69 H7 Cl12 D4 N O7 -","- C69 H11 Cl12 N O7 -","- C138 H22 Cl24 N2 O14 -","2","1","","Zuo Xiao; Jiayao Yao; Dazhi Yang; Fudong Wang; Shaohua Huang; Liangbing Gan; Zhenshan Jia; Zhongping Jiang; Xiaobing Yang; Bo Zheng; Gu Yuan; Shiwei Zhang; Zheming Wang","Synthesis of [59]Fullerenones through Peroxide-Mediated Stepwise Cleavage of Fullerene Skeleton Bonds and X-ray Structures of Their Water-Encapsulated Open-Cage Complexes","Journal of the American Chemical Society","2007","129","","16149","16162","10.1021/ja0763798","","","0.71073","MoKα","","0.1223","0.0658","","","0.1863","0.2127","","","","","","1.044","","","","has coordinates,has disorder","178874","2020-10-21","18:00:00",""
"4110314","15.8356","0.0008","15.1379","0.0008","26.5935","0.0014","90","","90","","90","","6374.9","0.6","90","2","90","2","","","","","","","","4","P n a 21","P 2c -2n","33","Compound 6","","","- C74 H92 O2 Sn2 -","- C74 H92 O2 Sn2 -","- C296 H368 O8 Sn8 -","4","1","","Eric Rivard; Roland C. Fischer; Robert Wolf; Yang Peng; W. Alexander Merrill; Nathan D. Schley; Zhongliang Zhu; Lihung Pu; James C. Fettinger; Simon J. Teat; Isreal Nowik; Rolfe H. Herber; Nozomi Takagi; Shigeru Nagase; Philip P. Power","Isomeric Forms of Heavier Main Group Hydrides: Experimental and Theoretical Studies of the [Sn(Ar)H]2 (Ar = Terphenyl) System","Journal of the American Chemical Society","2007","129","","16197","16208","10.1021/ja076453m","","","0.71073","MoKα","","0.0519","0.0425","","","0.1012","0.1058","","","","","","1.068","","","","has coordinates,has disorder","178874","2020-10-21","18:00:00",""
"4110315","17.488","0.003","11.6926","0.0017","17.666","0.003","90","","94.351","0.003","90","","3601.9","1","90","2","90","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Compound 10","","","- C80 H104 Sn2 -","- C80 H104 Sn2 -","- C160 H208 Sn4 -","2","0.5","","Eric Rivard; Roland C. Fischer; Robert Wolf; Yang Peng; W. Alexander Merrill; Nathan D. Schley; Zhongliang Zhu; Lihung Pu; James C. Fettinger; Simon J. Teat; Isreal Nowik; Rolfe H. Herber; Nozomi Takagi; Shigeru Nagase; Philip P. Power","Isomeric Forms of Heavier Main Group Hydrides: Experimental and Theoretical Studies of the [Sn(Ar)H]2 (Ar = Terphenyl) System","Journal of the American Chemical Society","2007","129","","16197","16208","10.1021/ja076453m","","","0.71073","MoKα","","0.1089","0.0674","","","0.1629","0.187","","","","","","1.065","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110316","11.436","0.0007","25.5484","0.0015","12.8457","0.0007","90","","114.757","0.001","90","","3408.2","0.3","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Compound 14","","","- C70 H102 O Si2 Sn2 -","- C70 H102 O Si2 Sn2 -","- C140 H204 O2 Si4 Sn4 -","2","0.5","","Eric Rivard; Roland C. Fischer; Robert Wolf; Yang Peng; W. Alexander Merrill; Nathan D. Schley; Zhongliang Zhu; Lihung Pu; James C. Fettinger; Simon J. Teat; Isreal Nowik; Rolfe H. Herber; Nozomi Takagi; Shigeru Nagase; Philip P. Power","Isomeric Forms of Heavier Main Group Hydrides: Experimental and Theoretical Studies of the [Sn(Ar)H]2 (Ar = Terphenyl) System","Journal of the American Chemical Society","2007","129","","16197","16208","10.1021/ja076453m","","","0.71073","MoKα","","0.0439","0.0327","","","0.0821","0.0868","","","","","","1.077","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110317","33.9416","0.0013","33.9416","0.0013","14.7839","0.0012","90","","90","","90","","17031.5","1.7","90","2","90","2","","","","","","","","3","P 42/n :2","-P 4bc","86","Compound 16","","","- C87 H131 Sn2 -","- C87 H129 Sn2 -","- C696 H1032 Sn16 -","8","1","","Eric Rivard; Roland C. Fischer; Robert Wolf; Yang Peng; W. Alexander Merrill; Nathan D. Schley; Zhongliang Zhu; Lihung Pu; James C. Fettinger; Simon J. Teat; Isreal Nowik; Rolfe H. Herber; Nozomi Takagi; Shigeru Nagase; Philip P. Power","Isomeric Forms of Heavier Main Group Hydrides: Experimental and Theoretical Studies of the [Sn(Ar)H]2 (Ar = Terphenyl) System","Journal of the American Chemical Society","2007","129","","16197","16208","10.1021/ja076453m","","","0.7749","","","0.0748","0.0679","","","0.192","0.1956","","","","","","1.141","","","","has coordinates,has disorder","178874","2020-10-21","18:00:00",""
"4110318","11.394","0.002","5.1116","0.0011","16.983","0.004","90","","100.583","0.005","90","","972.3","0.4","298.1","","","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C28 H26 -","- C28 H26 -","- C56 H52 -","2","0.5","","Tamotsu Takahashi; Ken Kashima; Shi Li; Kiyohiko Nakajima; Ken-ichiro Kanno","Isolation of 6,13-Dipropylpentacene and Its Tautomerization","Journal of the American Chemical Society","2007","129","","15752","15753","10.1021/ja076819v","","","0.71075","MoKα","","","0.0998","","","","0.1084","","","","","","1.013","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4110319","10.9062","0.001","22.998","0.002","16.7888","0.0014","90","","102.656","0.002","90","","4108.7","0.6","180","2","180","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H47 F9 N6 O11 S3 Zn2 -","- C25 H47 F8.998 N6 O11 S3 Zn2 -","- C100 H188 F35.992 N24 O44 S12 Zn8 -","4","1","","Shannon E. Bunn; C. Tony Liu; Zhong-Lin Lu; Alexei A. Neverov; R. Stan Brown","The Dinuclear Zn(II) Complex Catalyzed Cyclization of a Series of 2-Hydroxypropyl Aryl Phosphate RNA Models: Progressive Change in Mechanism from Rate-Limiting P-O Bond Cleavage to Substrate Binding","Journal of the American Chemical Society","2007","129","","16238","16248","10.1021/ja076847d","","","0.71073","MoKα","","0.0573","0.0373","","","0.094","0.1005","","","","","","1","","","","has coordinates,has disorder","178874","2020-10-21","18:00:00",""
"4110320","13.8412","0.0011","14.239","0.0011","32.135","0.002","90","","93.3721","0.0011","90","","6322.4","0.8","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H48 N P Ru Si -","- C33 H48 N P Ru Si -","- C264 H384 N8 P8 Ru8 Si8 -","8","2","","Matthew A. Rankin; Darren F. MacLean; Gabriele Schatte; Robert McDonald; Mark Stradiotto","Silylene Extrusion from Organosilanes via Double Geminal Si-H Bond Activation by a Cp*Ru(κ2-P,N)+ Complex: Observation of a Key Stoichiometric Step in the Glaser-Tilley Alkene Hydrosilylation Mechanism","Journal of the American Chemical Society","2007","129","","15855","15864","10.1021/ja0768800","","","0.71073","MoKα","","0.04","0.031","","","0.0752","0.0806","","","","","","1.113","","","","has coordinates,has disorder","178874","2020-10-21","18:00:00",""
"4110321","12.618","0.0003","13.539","0.0003","19.453","0.0004","90","","117.927","0.0013","90","","2936.24","0.12","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C28 H41 F3 N O3 P Ru S -","- C28 H41 F3 N O3 P Ru S -","- C112 H164 F12 N4 O12 P4 Ru4 S4 -","4","1","","Matthew A. Rankin; Darren F. MacLean; Gabriele Schatte; Robert McDonald; Mark Stradiotto","Silylene Extrusion from Organosilanes via Double Geminal Si-H Bond Activation by a Cp*Ru(κ2-P,N)+ Complex: Observation of a Key Stoichiometric Step in the Glaser-Tilley Alkene Hydrosilylation Mechanism","Journal of the American Chemical Society","2007","129","","15855","15864","10.1021/ja0768800","","","0.71073","MoKα","","0.0393","0.0319","","","0.0709","0.0749","","","","","","1.065","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110322","11.181","0.0002","17.826","0.0004","17.899","0.0004","90","","97.091","0.0014","90","","3540.21","0.13","173","2","173","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C34 H49 F3 N O3 P Ru S Si -","- C34 H49 F3 N O3 P Ru S Si -","- C136 H196 F12 N4 O12 P4 Ru4 S4 Si4 -","4","1","","Matthew A. Rankin; Darren F. MacLean; Gabriele Schatte; Robert McDonald; Mark Stradiotto","Silylene Extrusion from Organosilanes via Double Geminal Si-H Bond Activation by a Cp*Ru(κ2-P,N)+ Complex: Observation of a Key Stoichiometric Step in the Glaser-Tilley Alkene Hydrosilylation Mechanism","Journal of the American Chemical Society","2007","129","","15855","15864","10.1021/ja0768800","","","0.71073","MoKα","","0.0835","0.069","","","0.1486","0.1539","","","","","","1.293","","","","has coordinates,has disorder","178874","2020-10-21","18:00:00",""
"4110323","10.8889","0.0003","19.4246","0.0005","19.38","0.0007","90","","110.163","0.002","90","","3847.9","0.2","173","2","173","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C40 H53 F3 N O3 P Ru S Si -","- C40 H53 F3 N O3 P Ru S Si -","- C160 H212 F12 N4 O12 P4 Ru4 S4 Si4 -","4","1","","Matthew A. Rankin; Darren F. MacLean; Gabriele Schatte; Robert McDonald; Mark Stradiotto","Silylene Extrusion from Organosilanes via Double Geminal Si-H Bond Activation by a Cp*Ru(κ2-P,N)+ Complex: Observation of a Key Stoichiometric Step in the Glaser-Tilley Alkene Hydrosilylation Mechanism","Journal of the American Chemical Society","2007","129","","15855","15864","10.1021/ja0768800","","","0.71073","MoKα","","0.0687","0.0442","","","0.0844","0.0947","","","","","","1.035","","","","has coordinates,has disorder","178874","2020-10-21","18:00:00",""
"4110324","9.4515","0.0003","12.7981","0.0003","29.7747","0.001","90","","97.4604","0.0014","90","","3571.1","0.19","173","2","173","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C34 H49 F3 N O3 P Ru S Si -","- C34 H49 F3 N O3 P Ru S Si -","- C136 H196 F12 N4 O12 P4 Ru4 S4 Si4 -","4","1","","Matthew A. Rankin; Darren F. MacLean; Gabriele Schatte; Robert McDonald; Mark Stradiotto","Silylene Extrusion from Organosilanes via Double Geminal Si-H Bond Activation by a Cp*Ru(κ2-P,N)+ Complex: Observation of a Key Stoichiometric Step in the Glaser-Tilley Alkene Hydrosilylation Mechanism","Journal of the American Chemical Society","2007","129","","15855","15864","10.1021/ja0768800","","","0.71073","MoKα","","0.074","0.0444","","","0.0848","0.0982","","","","","","1.05","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4110325","7.927","0.0003","13.6459","0.0005","19.4939","0.0008","90","","90","","90","","2108.68","0.14","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H36 O6 -","- C19 H36 O6 -","- C76 H144 O24 -","4","1","","Andrew K. Dilger; Vijay Gopalsamuthiram; Steven D. Burke","A Two-Directional Approach to a (-)-Dictyostatin C11-C23 Segment: Development of a Highly Diastereoselective, Kinetically-Controlled Meerwein-Ponndorf-Verley Reduction","Journal of the American Chemical Society","2007","129","","16273","16277","10.1021/ja077336u","","","0.71073","Mo-Kα","","0.0308","0.0296","","","0.0784","0.0801","","","","","","1.018","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4110326","16.046","0.006","9.509","0.004","17.196","0.006","90","","115.585","0.005","90","","2366.5","1.6","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H24 F6 Fe N4 O6 S2 -","- C16 H24 F6 Fe N4 O6 S2 -","- C64 H96 F24 Fe4 N16 O24 S8 -","4","1","","Anna Company; Laura Gómez; Mireia Güell; Xavi Ribas; Josep M. Luis; Lawrence Que; Miquel Costas","Alkane Hydroxylation by a Nonheme Iron Catalyst that Challenges the Heme Paradigm for Oxygenase Action","Journal of the American Chemical Society","2007","129","","15766","15767","10.1021/ja077761n","","","0.71073","MoKα","","0.1496","0.0663","","","0.1533","0.1973","","","","","","0.997","","","","has coordinates","178874","2020-10-21","18:00:00",""
"4111325","7.8384","0.0004","7.8384","0.0004","27.668","0.003","90","","90","","120","","1472.19","0.19","100","2","100","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","","","- C20 H20 Cl2 O Zr2 -","- C20 H20 Cl2 O Zr2 -","- C60 H60 Cl6 O3 Zr6 -","3","0.5","","Jared T. Spletstoser; Jonathan M. White; Ashok Rao Tunoori; Gunda I. Georg","Mild and Selective Hydrozirconation of Amides to Aldehydes Using Cp2Zr(H)Cl: Scope and Mechanistic Insight","Journal of the American Chemical Society","2007","129","","3408","3419","10.1021/ja066362+","","","0.71073","MoKα","","0.0289","0.0281","","","0.0704","0.0709","","","","","","1.078","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111326","25.2024","0.0008","15.4733","0.0005","19.9878","0.0007","90","","92.545","0.001","90","","7786.8","0.4","90","2","90","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","Tb3N@C86.NiOEP.3benzene","","","- C134 H56 N5 Ni Tb3 -","- C134 H56 N5 Ni Tb2.994 -","- C536 H224 N20 Ni4 Tb11.976 -","4","0.5","","Tianming Zuo; Christine M. Beavers; James C. Duchamp; Anne Campbell; Harry C. Dorn; Marilyn M. Olmstead; Alan L. Balch","Isolation and Structural Characterization of a Family of Endohedral Fullerenes Including the Large, Chiral Cage Fullerenes Tb3N@C88 and Tb3N@C86 as well as the Ih and D5h Isomers of Tb3N@C80","Journal of the American Chemical Society","2007","129","","2035","2043","10.1021/ja066437+","","","0.71073","MoKα","","0.0728","0.0539","","","0.129","0.1413","","","","","","1.054","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4111327","25.2505","0.0007","15.1262","0.0004","19.7335","0.0005","90","","95.438","0.003","90","","7503.2","0.3","90","2","90","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","Tb3N@C80(D5h).NiOEP.2benzene","","","- C128 H56 N5 Ni Tb3 -","- C130 H56 N5 Ni Tb2.9992 -","- C520 H224 N20 Ni4 Tb11.9968 -","4","0.5","","Tianming Zuo; Christine M. Beavers; James C. Duchamp; Anne Campbell; Harry C. Dorn; Marilyn M. Olmstead; Alan L. Balch","Isolation and Structural Characterization of a Family of Endohedral Fullerenes Including the Large, Chiral Cage Fullerenes Tb3N@C88 and Tb3N@C86 as well as the Ih and D5h Isomers of Tb3N@C80","Journal of the American Chemical Society","2007","129","","2035","2043","10.1021/ja066437+","","","0.71073","MoKα","","0.0972","0.0794","","","0.2183","0.2343","","","","","","1.089","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4111328","25.3036","0.0008","15.0584","0.0005","39.3947","0.0013","90","","95.203","0.001","90","","14948.8","0.8","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Tb3N@C80(Ih).NiOEP.2benzene","","","- C128 H56 N5 Ni Tb3 -","- C128 H56 N5 Ni Tb3 -","- C1024 H448 N40 Ni8 Tb24 -","8","1","","Tianming Zuo; Christine M. Beavers; James C. Duchamp; Anne Campbell; Harry C. Dorn; Marilyn M. Olmstead; Alan L. Balch","Isolation and Structural Characterization of a Family of Endohedral Fullerenes Including the Large, Chiral Cage Fullerenes Tb3N@C88 and Tb3N@C86 as well as the Ih and D5h Isomers of Tb3N@C80","Journal of the American Chemical Society","2007","129","","2035","2043","10.1021/ja066437+","","","0.71073","MoKα","","0.0539","0.0349","","","0.0763","0.0825","","","","","","1.043","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4111329","14.99","0.003","16.795","0.003","18.408","0.003","77.94","0.003","76.268","0.003","65.161","0.003","4053.9","1.3","90","2","90","2","","","","","","","","5","P -1","-P 1","2","Tb3N@(D2-35)C88.NiOEP.2.5benzene","","","- C139 H59 N5 Ni Tb3 -","- C139 H59 N5 Ni Tb3 -","- C278 H118 N10 Ni2 Tb6 -","2","1","","Tianming Zuo; Christine M. Beavers; James C. Duchamp; Anne Campbell; Harry C. Dorn; Marilyn M. Olmstead; Alan L. Balch","Isolation and Structural Characterization of a Family of Endohedral Fullerenes Including the Large, Chiral Cage Fullerenes Tb3N@C88 and Tb3N@C86 as well as the Ih and D5h Isomers of Tb3N@C80","Journal of the American Chemical Society","2007","129","","2035","2043","10.1021/ja066437+","","","0.71073","MoKα","","0.1138","0.0555","","","0.1126","0.1209","","","","","","0.836","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4111330","7.7608","0.0003","13.4612","0.0004","23.7464","0.0007","90","","90","","90","","2480.78","0.14","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C29 H38 O2 -","- C29 H38 O2 -","- C116 H152 O8 -","4","1","","Yu-Jun Zhao; Shu-Sin Chng; Teck-Peng Loh","Lewis Acid-Promoted Intermolecular Acetal-Initiated Cationic Polyene Cyclizations","Journal of the American Chemical Society","2007","129","","492","493","10.1021/ja067660+","","","0.71073","MoKα","","0.0643","0.0425","","","0.111","0.1335","","","","","","1.09","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111331","8.8496","0.0006","10.7161","0.0006","19.1133","0.0012","90","","90","","90","","1812.6","0.2","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H19 N O4 S -","- C20 H19 N O4 S -","- C80 H76 N4 O16 S4 -","4","1","","Liansuo Zu; Jian Wang; Hao Li; Hexin Xie; Wei Jiang; Wei Wang","Cascade Michael-Aldol Reactions Promoted by Hydrogen Bonding Mediated Catalysis","Journal of the American Chemical Society","2007","129","","1036","1037","10.1021/ja067781+","","","0.71073","MoKα","","0.0381","0.032","","","0.0842","0.0895","","","","","","1.075","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111332","14.5548","0.0003","5.8943","0.0002","20.2866","0.0006","90","","103.128","0.001","90","","1694.91","0.08","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H25 N O3 -","- C19 H25 N O3 -","- C76 H100 N4 O12 -","4","1","","Barbora Bajtos; Ming Yu; Hongda Zhao; Brian L. Pagenkopf","C-2/C-3 Annulation and C-2 Alkylation of Indoles with 2-Alkoxycyclopropanoate Esters","Journal of the American Chemical Society","2007","129","","9631","9634","10.1021/ja067821+","","","0.71073","MoKα","","0.1037","0.0465","","","0.107","0.1276","","","","","","1.003","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111333","12.3471","0.0005","5.4389","0.0002","12.4747","0.0005","90","","95.172","0.003","90","","834.32","0.06","153","2","153","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H20 I N O3 -","- C17 H20 I N O3 -","- C34 H40 I2 N2 O6 -","2","1","","Barbora Bajtos; Ming Yu; Hongda Zhao; Brian L. Pagenkopf","C-2/C-3 Annulation and C-2 Alkylation of Indoles with 2-Alkoxycyclopropanoate Esters","Journal of the American Chemical Society","2007","129","","9631","9634","10.1021/ja067821+","","","0.7107","MoKα","","0.0529","0.0457","","","0.1086","0.1138","","","","","","1.156","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111334","30.5704","0.001","16.5037","0.0005","9.4954","0.0003","90","","94.119","0.002","90","","4778.3","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 N O4 -","- C17 H21 N O4 -","- C204 H252 N12 O48 -","12","3","","Barbora Bajtos; Ming Yu; Hongda Zhao; Brian L. Pagenkopf","C-2/C-3 Annulation and C-2 Alkylation of Indoles with 2-Alkoxycyclopropanoate Esters","Journal of the American Chemical Society","2007","129","","9631","9634","10.1021/ja067821+","","","0.71073","MoKα","","0.127","0.0672","","","0.1667","0.2055","","","","","","1.025","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111335","8.5625","0.0002","8.6438","0.0002","19.5105","0.0007","85.69","0.002","78.443","0.002","65.331","0.002","1285.57","0.07","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H17 N O -","- C17 H17 N O -","- C68 H68 N4 O4 -","4","2","","Barbora Bajtos; Ming Yu; Hongda Zhao; Brian L. Pagenkopf","C-2/C-3 Annulation and C-2 Alkylation of Indoles with 2-Alkoxycyclopropanoate Esters","Journal of the American Chemical Society","2007","129","","9631","9634","10.1021/ja067821+","","","0.71073","MoKα","","0.1552","0.0536","","","0.105","0.1354","","","","","","0.977","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111336","27.3241","0.0004","13.5169","0.0002","24.5145","0.0004","90","","116.008","0.0007","90","","8137.2","0.2","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C13.33 H15 N1.67 O5 -","- C17 H19 N O -","- C408 H456 N24 O24 -","24","3","","Barbora Bajtos; Ming Yu; Hongda Zhao; Brian L. Pagenkopf","C-2/C-3 Annulation and C-2 Alkylation of Indoles with 2-Alkoxycyclopropanoate Esters","Journal of the American Chemical Society","2007","129","","9631","9634","10.1021/ja067821+","","","0.71073","MoKα","","0.1368","0.0498","","","0.0832","0.0947","","","","","","1.269","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111337","7.091","0.003","24.868","0.012","12.256","0.006","90","","102.575","0.005","90","","2109.4","1.7","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,2-bis(2-methyl-5-phenyl-3-thienyl)perfluorocyclopentene (23%) and 1,2-bis(5-methyl-2-phenyl-4-thiazolyl)perfluorocyclopentene (77%)","","- C25.46 H16.46 F6 N1.54 S2 -","- C25.34 H16.34 F6 N1.66 S2 -","- C101.36 H65.36 F24 N6.64 S8 -","4","1","","Shizuka Takami; Lumi Kuroki; Masahiro Irie","Photochromism of Mixed Crystals Containing Bisthienyl-, Bisthiazolyl-, and Bisoxazolylethene Derivatives","Journal of the American Chemical Society","2007","129","","7319","7326","10.1021/ja068786+","","","0.71073","MoKα","","0.0953","0.071","","","0.1649","0.1775","","","","","","1.104","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4111338","11.808","0.003","13.568","0.003","14.917","0.003","81.763","0.003","82.255","0.003","82.303","0.003","2327.6","0.9","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","1,2-bis(2-methyl-5-phenyl-3-thienyl)perfluorocyclopentene (73%) and 1,2-bis(5-methyl-2-phenyl-4-thiazolyl)perfluorocyclopentene (27%)","","- C26.46 H17.46 F6 N0.54 S2 -","- C26.372 H17.372 F6 N0.628 S2 -","- C105.488 H69.488 F24 N2.512 S8 -","4","2","","Shizuka Takami; Lumi Kuroki; Masahiro Irie","Photochromism of Mixed Crystals Containing Bisthienyl-, Bisthiazolyl-, and Bisoxazolylethene Derivatives","Journal of the American Chemical Society","2007","129","","7319","7326","10.1021/ja068786+","","","0.71073","MoKα","","0.0743","0.0444","","","0.0975","0.1105","","","","","","1.038","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4111339","7.288","0.003","25.792","0.01","12.586","0.005","90","","102.519","0.006","90","","2309.6","1.6","123","","123","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1,2-bis(2-methyl-5-phenyl-3-thienyl)perfluorocyclopentene (32%) and 1,2-bis(5-methyl-2-phenyl-4-thiazolyl)perfluorocyclopentene (53%) and 1,2-bis(5-methyl-2-phenyl-4-oxazolyl)perfluorocyclopentene (15%)","","- C25.63 H16.63 F6 N1.37 O0.3 S1.7 -","- C25.624 H16.624 F6 N1.376 O0.426 S1.574 -","- C102.496 H66.496 F24 N5.504 O1.704 S6.296 -","4","1","","Shizuka Takami; Lumi Kuroki; Masahiro Irie","Photochromism of Mixed Crystals Containing Bisthienyl-, Bisthiazolyl-, and Bisoxazolylethene Derivatives","Journal of the American Chemical Society","2007","129","","7319","7326","10.1021/ja068786+","","","0.71073","MoKα","","0.1397","0.0724","","","0.1489","0.1694","","","","","","1.306","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4111340","7.362","0.0012","26.25","0.004","12.701","0.002","90","","103.271","0.002","90","","2389","0.7","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Photoirradiated mixed crystal (1,2-bis(2-methyl-5-phenyl-3-thienyl)perfluorocyclopentene (20%) and 1,2-bis(5-methyl-2-phenyl-4-thiazolyl)perfluorocyclopentene (80%))","","- C25.4 H16.4 F6 N1.6 S2 -","- C25.46 H16.46 F6 N1.54 S2 -","- C101.84 H65.84 F24 N6.16 S8 -","4","1","","Shizuka Takami; Lumi Kuroki; Masahiro Irie","Photochromism of Mixed Crystals Containing Bisthienyl-, Bisthiazolyl-, and Bisoxazolylethene Derivatives","Journal of the American Chemical Society","2007","129","","7319","7326","10.1021/ja068786+","","","0.71073","MoKα","","0.1906","0.0521","","","0.1264","0.1973","","","","","","0.82","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4111341","9.1824","0.0004","10.6533","0.0005","13.0707","0.0006","90","","90","","90","","1278.61","0.1","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H22 O3 -","- C13 H22 O3 -","- C52 H88 O12 -","4","1","","Rongbiao Tong; Jason C. Valentine; Frank E. McDonald; Rui Cao; Xikui Fang; Kenneth I. Hardcastle","Total Syntheses of Durgamone, Nakorone, and Abudinol B via Biomimetic Oxa- and Carbacyclizations","Journal of the American Chemical Society","2007","129","","1050","1051","10.1021/ja068826+","","","1.54178","CuKα\","","0.0503","0.0377","","","0.0876","0.1045","","","","","","1.064","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111342","7.1883","0.0005","9.8601","0.0007","23.4975","0.0016","90","","90","","90","","1665.4","0.2","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H30 O2 -","- C19 H30 O2 -","- C76 H120 O8 -","4","1","","Rongbiao Tong; Jason C. Valentine; Frank E. McDonald; Rui Cao; Xikui Fang; Kenneth I. Hardcastle","Total Syntheses of Durgamone, Nakorone, and Abudinol B via Biomimetic Oxa- and Carbacyclizations","Journal of the American Chemical Society","2007","129","","1050","1051","10.1021/ja068826+","","","1.54178","CuKα","","0.0344","0.0322","","","0.0761","0.0774","","","","","","1.083","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111343","13.008","0.002","7.6273","0.0011","22.235","0.003","90","","106.982","0.003","90","","2109.9","0.5","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","bis-silyl ether of abudinol","","","- C39 H72 O4 Si2 -","- C39 H72 O4 Si2 -","- C78 H144 O8 Si4 -","2","1","","Rongbiao Tong; Jason C. Valentine; Frank E. McDonald; Rui Cao; Xikui Fang; Kenneth I. Hardcastle","Total Syntheses of Durgamone, Nakorone, and Abudinol B via Biomimetic Oxa- and Carbacyclizations","Journal of the American Chemical Society","2007","129","","1050","1051","10.1021/ja068826+","","","0.71073","MoKα","","0.1065","0.0887","","","0.2032","0.2156","","","","","","1.051","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111344","18.0285","0.0003","16.6735","0.0003","21.7549","0.0004","90","","90","","90","","6539.5","0.2","150","","150","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C36 H31 Cl2 O P2 Re -","- C36 H31 Cl2 O P2 Re -","- C288 H248 Cl16 O8 P16 Re8 -","8","1","","Guodong Du; Phillip E. Fanwick; Mahdi M. Abu-Omar","Mechanistic Insight into Hydrosilylation Reactions Catalyzed by High Valent Re\τbX (X = O, NAr, or N) Complexes: The Silane (SiH) Does Not Add across the Metal-Ligand Multiple Bond","Journal of the American Chemical Society","2007","129","","5180","5187","10.1021/ja068872+","","","0.71073","MO-Kα","","0.092","0.055","","","0.146","0.163","","","","","","1.033","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4111345","15.368","0.0003","19.168","0.0003","15.9227","0.0004","90","","103.293","0.0007","90","","4564.74","0.16","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H51 Cl2 N P2 Re -","- C54 H51 Cl2 N P2 Re -","- C216 H204 Cl8 N4 P8 Re4 -","4","1","","Guodong Du; Phillip E. Fanwick; Mahdi M. Abu-Omar","Mechanistic Insight into Hydrosilylation Reactions Catalyzed by High Valent Re\τbX (X = O, NAr, or N) Complexes: The Silane (SiH) Does Not Add across the Metal-Ligand Multiple Bond","Journal of the American Chemical Society","2007","129","","5180","5187","10.1021/ja068872+","","","0.71073","MO-Kα","","0.082","0.042","","","0.069","0.075","","","","","","1.016","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4111346","11.8396","0.0005","12.8071","0.0005","13.6137","0.0007","72.664","0.002","76.118","0.002","70.558","0.002","1835.27","0.14","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C39 H42 Cl3 N2 P Re -","- C39 H42 Cl3 N2 P Re -","- C78 H84 Cl6 N4 P2 Re2 -","2","1","","Guodong Du; Phillip E. Fanwick; Mahdi M. Abu-Omar","Mechanistic Insight into Hydrosilylation Reactions Catalyzed by High Valent Re\τbX (X = O, NAr, or N) Complexes: The Silane (SiH) Does Not Add across the Metal-Ligand Multiple Bond","Journal of the American Chemical Society","2007","129","","5180","5187","10.1021/ja068872+","","","0.71073","MO-Kα","","0.041","0.031","","","0.057","0.059","","","","","","1.02","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4111347","11.419","0.002","24.83","0.004","30.005","0.004","90","","90","","90","","8507","2","296","1","","","","","","","","","","6","I b a m","-I 2 2c","72","","","","- C24 H24 Cu3 N20 O8 W2 -","- C24 H8 Cu3 N20 O8 W2 -","- C192 H64 Cu24 N160 O64 W16 -","8","0.5","","Shin-ichi Ohkoshi; Yoshihide Tsunobuchi; Hitomi Takahashi; Toshiya Hozumi; Motoo Shiro; Kazuhito Hashimoto","Synthesis and Alcohol Vapor Sensitivity of a Ferromagnetic Copper-Tungsten Bimetallic Assembly","Journal of the American Chemical Society","2007","129","","3084","3085","10.1021/ja069353+","","","0.71075","MoKα","","","0.0253","","","","0.0614","","","","","","1.071","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4111348","14.761","0.002","25.593","0.004","11.5284","0.0019","90","","90","","90","","4355.2","1.2","90","1","","","","","","","","","","6","P m m n :2","-P 2ab 2a","59","","","","- C28.5 H24.5 Cu3 N20 O3.75 W2 -","- C28.5 H8 Cu3 N20 O3.75 W2 -","- C114 H32 Cu12 N80 O15 W8 -","4","0.5","","Shin-ichi Ohkoshi; Yoshihide Tsunobuchi; Hitomi Takahashi; Toshiya Hozumi; Motoo Shiro; Kazuhito Hashimoto","Synthesis and Alcohol Vapor Sensitivity of a Ferromagnetic Copper-Tungsten Bimetallic Assembly","Journal of the American Chemical Society","2007","129","","3084","3085","10.1021/ja069353+","","","0.71075","MoKα","","","0.0441","","","","0.1244","","","","","","1.084","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4111349","9.2969","0.0009","12.2219","0.0011","15.8158","0.0016","90","","90","","90","","1797.1","0.3","143","1","143","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H25 N O4 -","- C21 H25 N O4 -","- C84 H100 N4 O16 -","4","1","","Douglas C. Beshore; Amos B. Smith","Total Syntheses of (+)-Lyconadin A and (-)-Lyconadin B","Journal of the American Chemical Society","2007","129","","4148","4149","10.1021/ja070336+","","","0.71069","MoKα","","0.0409","0.0386","","","0.0895","0.0912","","","","","","1.078","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111350","9.5676","0.0009","8.9088","0.0007","11.0762","0.0009","90","","108.677","0.001","90","","894.37","0.13","143","1","143","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H29 N O4 -","- C18 H29 N O4 -","- C36 H58 N2 O8 -","2","1","","Douglas C. Beshore; Amos B. Smith","Total Syntheses of (+)-Lyconadin A and (-)-Lyconadin B","Journal of the American Chemical Society","2007","129","","4148","4149","10.1021/ja070336+","","","0.71069","MoKα","","0.0322","0.031","","","0.0773","0.0785","","","","","","1.078","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111351","11.5465","0.0008","16.9259","0.0007","27.4768","0.0015","90","","91.208","0.002","90","","5368.7","0.5","143","1","143","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C13 H20 I N O -","- C13 H20 I N O -","- C208 H320 I16 N16 O16 -","16","8","","Douglas C. Beshore; Amos B. Smith","Total Syntheses of (+)-Lyconadin A and (-)-Lyconadin B","Journal of the American Chemical Society","2007","129","","4148","4149","10.1021/ja070336+","","","0.71069","MoKα","","0.056","0.0504","","","0.1286","0.1369","","","","","","1.039","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111352","9.747","0.002","7.882","0.001","20.522","0.004","90","","102.46","0.002","90","","1539.5","0.5","273.2","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H18 O5 -","- C17 H18 O5 -","- C68 H72 O20 -","4","1","","Cole A. Witham; Pablo Mauleón; Nathan D. Shapiro; Benjamin D. Sherry; F. Dean Toste","Gold(I)-Catalyzed Oxidative Rearrangements","Journal of the American Chemical Society","2007","129","","5838","5839","10.1021/ja071231+","","","0.7107","MoKα","","0.0564","0.0397","","0.0534","","0.0509","","","","","","2.288","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4111353","9.228","0.003","9.228","0.003","17.826","0.005","90","","90","","120","","1314.6","0.7","213","2","213","2","","","","","","","","6","R -3 m :H","-R 3 2""","166","","","","- C8 H18 F6 O6 P2 S2 -","- C8 H18 F6 O6 P2 S2 -","- C24 H54 F18 O18 P6 S6 -","3","0.0833333","","Jan J. Weigand; Susanne D. Riegel; Neil Burford; Andreas Decken","Prototypical Phosphorus Analogues of Ethane: General and Versatile Synthetic Approaches to Hexaalkylated P-P Diphosphonium Cations","Journal of the American Chemical Society","2007","129","","7969","7976","10.1021/ja071306+","","x-ray","0.71073","MoKα","","0.0429","0.0391","","","0.0999","0.1061","","","","","","1.381","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111354","15.765","0.006","11.994","0.005","24.584","0.008","90","","114.619","0.005","90","","4226","3","173","1","173","1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C11 H24 F6 O6 P2 S2 -","- C11 H24 F6 O6 P2 S2 -","- C88 H192 F48 O48 P16 S16 -","8","2","","Jan J. Weigand; Susanne D. Riegel; Neil Burford; Andreas Decken","Prototypical Phosphorus Analogues of Ethane: General and Versatile Synthetic Approaches to Hexaalkylated P-P Diphosphonium Cations","Journal of the American Chemical Society","2007","129","","7969","7976","10.1021/ja071306+","","x-ray","0.71073","MoKα","","0.0652","0.04","","","0.0976","0.1177","","","","","","1.047","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4111355","8.75","0.003","11.566","0.004","12.245","0.005","88.744","0.006","74.948","0.004","76.431","0.004","1162.3","0.7","198","1","198","1","","","","","","","","6","P -1","-P 1","2","","","","- C14 H30 F6 O6 P2 S2 -","- C14 H30 F6 O6 P2 S2 -","- C28 H60 F12 O12 P4 S4 -","2","1","","Jan J. Weigand; Susanne D. Riegel; Neil Burford; Andreas Decken","Prototypical Phosphorus Analogues of Ethane: General and Versatile Synthetic Approaches to Hexaalkylated P-P Diphosphonium Cations","Journal of the American Chemical Society","2007","129","","7969","7976","10.1021/ja071306+","","x-ray","0.71073","MoKα","","0.0587","0.0479","","","0.1284","0.1413","","","","","","1.059","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4111356","17.749","0.002","10.2043","0.0014","14.494","0.002","90","","90","","90","","2625.1","0.6","198","1","198","1","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C12 H30 Cl8 Ga2 P2 -","- C12 H30 Cl8 Ga2 P2 -","- C48 H120 Cl32 Ga8 P8 -","4","1","","Jan J. Weigand; Susanne D. Riegel; Neil Burford; Andreas Decken","Prototypical Phosphorus Analogues of Ethane: General and Versatile Synthetic Approaches to Hexaalkylated P-P Diphosphonium Cations","Journal of the American Chemical Society","2007","129","","7969","7976","10.1021/ja071306+","","x-ray","0.71073","MoKα","","0.0658","0.0376","","","0.0762","0.0819","","","","","","0.99","","","","has coordinates","178884","2020-10-21","18:00:00",""
"4111357","11.585","0.001","20.8836","0.0017","15.2368","0.0012","90","","102.415","0.002","90","","3600.1","0.5","93","2","93","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C37 H33 Li O6 Sn -","- C37 H33 Li O6 Sn -","- C148 H132 Li4 O24 Sn4 -","4","0.5","","Masaichi Saito; Sanae Imaizumi; Tomoyuki Tajima; Kazuya Ishimura; Shigeru Nagase","Synthesis and Structure of Pentaorganostannate Having Five Carbon Substituents","Journal of the American Chemical Society","2007","129","","10974","10975","10.1021/ja072478+","","","0.71069","MoKα","","0.0789","0.067","","","0.139","0.1472","","","","","","1.115","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4111358","11.0044","0.0006","16.4067","0.001","11.104","0.0007","90","","95.425","0.001","90","","1995.8","0.2","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","(M,S)-3a","","","- C41 H54 Cl N4 O3 P -","- C41 H51 Cl N4 O3 P -","- C82 H102 Cl2 N8 O6 P2 -","2","1","","Daisuke Uraguchi; Sawako Sakaki; Takashi Ooi","Chiral Tetraaminophosphonium Salt-Mediated Asymmetric Direct Henry Reaction","Journal of the American Chemical Society","2007","129","","12392","12393","10.1021/ja075152+","","","0.71073","MoKα","","0.0468","0.0459","","","0.1278","0.1292","","","","","","1.056","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4111359","16.84","0.003","16.541","0.004","16.309","0.003","90","","104.57","0.03","90","","4396.8","1.7","101","2","101","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","EuIII complex","","","- C33 H26 Eu F9 N6 O16 S5 -","- C33 H26 Eu F9 N6 O16 S5 -","- C132 H104 Eu4 F36 N24 O64 S20 -","4","0.5","","Ana de Bettencourt-Dias; Subha Viswanathan; Alexandra Rollett","Thiophene-Derivatized Pybox and Its Highly Luminescent Lanthanide Ion Complexes","Journal of the American Chemical Society","2007","129","","15436","15437","10.1021/ja076485+","","","0.71073","MoKα","","0.0547","0.0504","","","0.1335","0.1373","","","","","","1.029","","","","has coordinates,has disorder","178884","2020-10-21","18:00:00",""
"4121514","4.614","0.001","4.614","0.001","4.614","0.001","90","","90","","90","","98.23","0.04","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Lithium Oxide","","- Li2 O -","- Li2 O -","- Li8 O4 -","4","0.0208333","","David, William I. F.; Jones, Martin O.; Gregory, Duncan H.; Jewell, Catherine M.; Johnson, Simon R.; Walton, Allan; Edwards, Peter P.","A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction","Journal of the American Chemical Society","2007","129","6","1594","1601","10.1021/ja066016s","","","","","","0.0766","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4121515","4.6124","0.0001","4.6124","0.0001","4.6124","0.0001","90","","90","","90","","98.125","0.004","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Lithium Oxide","","- Li2 O -","- Li2 O -","- Li8 O4 -","4","0.0208333","","David, W. I. F.; Jones, M. O.; Gregory, D. H.; Jewell, C. M.; Johnson, S. R.; Walton, A.; Edwards, P. P.","A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction","Journal of the American Chemical Society","2007","129","","1594","1601","10.1021/ja066016s","","","","","","0.0724","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4124005","5.04309","","5.04309","","10.2262","","90","","90","","90","","260.08","","","","","","","","","","","","","3","I -4","I -4","82","","Li N H2","","- H2 Li N -","- H2 Li N -","- H16 Li8 N8 -","8","1","","David, W.I.F.; Jones, M.O.; Gregory, D.H.; Jewell, C.M.; Edwards, P.P.; Johnson, S.R.; Walton, A.","A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction","Journal of the American Chemical Society","2007","129","","1594","1601","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124006","5.0713","","5.0713","","5.0713","","90","","90","","90","","130.424","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Li1.08 N H1.92","","- H1.92 Li1.08 N -","- Li1.0792 N -","- Li4.3168 N4 -","4","0.0208333","","David, W.I.F.; Jones, M.O.; Johnson, S.R.; Gregory, D.H.; Jewell, C.M.; Edwards, P.P.; Walton, A.","A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction","Journal of the American Chemical Society","2007","129","","1594","1601","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124007","5.318","","5.318","","5.318","","90","","90","","90","","150.399","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Li1.40 N H1.60","","- H1.6 Li1.4 N -","- Li1.399 N -","- Li5.596 N4 -","4","0.0208333","","David, W.I.F.; Gregory, D.H.; Jones, M.O.; Jewell, C.M.; Walton, A.; Johnson, S.R.; Edwards, P.P.","A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction","Journal of the American Chemical Society","2007","129","","1594","1601","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124008","5.0628","","5.0628","","5.0628","","90","","90","","90","","129.769","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Li1.23 N H1.77","","- H1.77 Li1.23 N -","- Li1.2312 N -","- Li4.9248 N4 -","4","0.0208333","","David, W.I.F.; Jewell, C.M.; Gregory, D.H.; Jones, M.O.; Johnson, S.R.; Walton, A.; Edwards, P.P.","A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction","Journal of the American Chemical Society","2007","129","","1594","1601","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124009","5.0418","","5.0418","","5.0418","","90","","90","","90","","128.161","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Li1.39 N H1.61","","- H1.61 Li1.39 N -","- Li1.388 N -","- Li5.552 N4 -","4","0.0208333","","David, W.I.F.; Jones, M.O.; Jewell, C.M.; Gregory, D.H.; Johnson, S.R.; Walton, A.; Edwards, P.P.","A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction","Journal of the American Chemical Society","2007","129","","1594","1601","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124010","5.0207","","5.0207","","5.0207","","90","","90","","90","","126.559","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Li1.54 N H1.46","","- H1.46 Li1.54 N -","- Li1.5448 N -","- Li6.1792 N4 -","4","0.0208333","","David, W.I.F.; Jones, M.O.; Gregory, D.H.; Johnson, S.R.; Jewell, C.M.; Walton, A.; Edwards, P.P.","A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction","Journal of the American Chemical Society","2007","129","","1594","1601","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124011","4.9996","","4.9996","","4.9996","","90","","90","","90","","124.97","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Li1.70 N H1.30","","- H1.3 Li1.7 N -","- Li1.7016 N -","- Li6.8064 N4 -","4","0.0208333","","David, W.I.F.; Gregory, D.H.; Jones, M.O.; Jewell, C.M.; Johnson, S.R.; Edwards, P.P.; Walton, A.","A mechanism for non-stoichiometry in the lithium amide/lithium imide hydrogen storage reaction","Journal of the American Chemical Society","2007","129","","1594","1601","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124087","3.804","","9.6486","","9.8688","","90","","90","","90","","362.217","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Ti2.85 O4 N","","- N O4 Ti2.85 -","- N O4 Ti2.849 -","- N4 O16 Ti11.396 -","4","0.25","","Hyett, G.; Green, M.A.; Parkin, I.P.","The use of combinatorial chemical vapor deposition in the synthesis of Ti(3-delta) O4 N with 0.06 < delta < 0.25: a titanium oxynitride phase isostructural to anosovite","Journal of the American Chemical Society","2007","129","","15541","15548","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124088","13.7948","","13.7061","","6.5916","","90","","90","","90","","1246.29","","","","","","","","","","","","","5","I 21 21 21","I 2b 2c","24","","K8.16 Ga8.2 Si11.8 O40 (H2 O)11.5","","- Ga8.2 H23 K8.16 O51.5 Si11.8 -","- Ga8.2 K8.16 O51.52 Si11.8 -","- Ga8.2 K8.16 O51.52 Si11.8 -","1","0.125","","Lee Yongjae; Celestian, A.J.; Kim Sun Jin; Bull, I.; Kao Chichang; Parise, J.B.; Vogt, T.","Dehydration-induced water disordering in a synthetic potassium gallosilicate natrolite","Journal of the American Chemical Society","2007","129","","13744","13748","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124089","13.7298","","13.5815","","6.5589","","90","","90","","90","","1223.05","","","","","","","","","","","","","5","I 21 21 21","I 2b 2c","24","","K8 Ga8.2 Si11.8 O40 (H2 O)11.3","","- Ga8.2 H22.6 K8 O51.3 Si11.8 -","- Ga8.2 K8 O51.28 Si11.8 -","- Ga8.2 K8 O51.28 Si11.8 -","1","0.125","","Lee Yongjae; Kim Sun Jin; Bull, I.; Kao Chichang; Celestian, A.J.; Parise, J.B.; Vogt, T.","Dehydration-induced water disordering in a synthetic potassium gallosilicate natrolite","Journal of the American Chemical Society","2007","129","","13744","13748","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124090","13.7587","","13.655","","6.5728","","90","","90","","90","","1234.86","","","","","","","","","","","","","5","I 21 21 21","I 2b 2c","24","","K8 Ga8.2 Si11.8 O40 (H2 O)11.6","","- Ga8.2 H23.2 K8 O51.6 Si11.8 -","- Ga8.2 K8 O51.6 Si11.8 -","- Ga8.2 K8 O51.6 Si11.8 -","1","0.125","","Lee Yongjae; Kim Sun Jin; Celestian, A.J.; Bull, I.; Parise, J.B.; Kao Chichang; Vogt, T.","Dehydration-induced water disordering in a synthetic potassium gallosilicate natrolite","Journal of the American Chemical Society","2007","129","","13744","13748","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124091","13.7026","","13.7026","","6.56","","90","","90","","90","","1231.71","","","","","","","","","","","","","5","I -4 2 d","I -4 2bw","122","","K8.32 Ga8.2 Si11.8 O40 (H2 O)9.8","","- Ga8.2 H19.6 K8.32 O49.8 Si11.8 -","- Ga8.2 K8.32 O49.84 Si11.8 -","- Ga8.2 K8.32 O49.84 Si11.8 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Celestian, A.J.; Bull, I.; Parise, J.B.; Kao Chichang; Vogt, T.","Dehydration-induced water disordering in a synthetic potassium gallosilicate natrolite","Journal of the American Chemical Society","2007","129","","13744","13748","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124092","13.6873","","13.6873","","6.5445","","90","","90","","90","","1226.06","","","","","","","","","","","","","5","I -4 2 d","I -4 2bw","122","","K8.08 Ga8.2 Si11.8 O40 (H2 O)8.6","","- Ga8.2 H17.2 K8.08 O48.6 Si11.8 -","- Ga8.2 K8.08 O48.56 Si11.8 -","- Ga8.2 K8.08 O48.56 Si11.8 -","1","0.0625","","Lee Yongjae; Vogt, T.; Bull, I.; Celestian, A.J.; Kim Sun Jin; Parise, J.B.; Kao Chichang","Dehydration-induced water disordering in a synthetic potassium gallosilicate natrolite","Journal of the American Chemical Society","2007","129","","13744","13748","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124093","12.7372","","12.7372","","6.563","","90","","90","","90","","1064.76","","","","","","","","","","","","","4","I -4 2 d","I -4 2bw","122","","K7.36 Ga8.2 Si11.8 O40","","- Ga8.2 K7.36 O40 Si11.8 -","- Ga8.2 K7.36 O40 Si11.8 -","- Ga8.2 K7.36 O40 Si11.8 -","1","0.0625","","Lee Yongjae; Kim Sun Jin; Celestian, A.J.; Bull, I.; Parise, J.B.; Kao Chichang; Vogt, T.","Dehydration-induced water disordering in a synthetic potassium gallosilicate natrolite","Journal of the American Chemical Society","2007","129","","13744","13748","","","","","","","","","","","","","","","","","","","","","","has coordinates","151233","2020-10-21","18:00:00",""
"4124108","5.68908","","4.75461","","5.51948","","90","","121.453","","90","","127.361","","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","Tc O2","","- O2 Tc -","- O2 Tc -","- O8 Tc4 -","4","1","","Rodriguez, E.E.; Poineau, F.; Llobet, A.; Sattelberger, A.P.; Bhattacharjee, J.; Waghmare, U.V.; Hartmann, T.; Cheetham, A.K.","Structural studies of Tc O2 by neutron powder diffraction and first-principles calculation","Journal of the American Chemical Society","2007","129","","10244","10248","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124109","7.0325","","7.0325","","16.6798","","90","","90","","90","","824.917","","","","","","","","","","","","","4","I 41/a m d :1","I 4bw 2bw -1bw","141","","K2 Ce (P O4)2","","- Ce K2 O8 P2 -","- Ce K2 O8 P2 -","- Ce4 K8 O32 P8 -","4","0.125","","Salvado, M.A.; Trobajo, C.; Pertierra, P.; Garcia, J.R.","Crystal structure of a cerium(IV) bis(phosphate) derivative","Journal of the American Chemical Society","2007","129","","10970","10971","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124117","9.115429","","9.115429","","8.8639","","81.3651","","98.6349","","69.0757","","663.38","","","","","","","","","","","","","2","P 1","P 1","1","","Si O2","","- O2.33333 Si -","- O2.33333 Si -","- O14 Si6 -","6","6","","Zicovich-Wilson, C.M.; Durand-Niconoff, J.S.; San-Roman, M.L.; Camblor, M.A.; Pascale, F.","Structure, vibrational analysis, and insights into host-guest interactions in as-synthesized pure silica ITQ-12 zeolite by periodic B3LYP calculations","Journal of the American Chemical Society","2007","129","","11512","11523","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124118","9.208837","","9.174551","","8.984374","","81.0227","","98.2014","","68.4861","","680.826","","","","","","","","","","","","","2","P 1","P 1","1","","Si O2","","- O2 Si -","- O2 Si -","- O24 Si12 -","12","12","","Zicovich-Wilson, C.M.; San-Roman, M.L.; Camblor, M.A.; Pascale, F.; Durand-Niconoff, J.S.","Structure, vibrational analysis, and insights into host-guest interactions in as-synthesized pure silica ITQ-12 zeolite by periodic B3LYP calculations","Journal of the American Chemical Society","2007","129","","11512","11523","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4306829","9.572","0.002","10.422","0.002","20.06","0.003","90.13","0.02","90.55","0.02","114.14","0.02","1826","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H57 Al N2 O Ti -","- C41 H57 Al N2 O Ti -","- C82 H114 Al2 N4 O2 Ti2 -","2","1","","Prabhuodeyara M. Gurubasavaraj; Swadhin K. Mandal; Herbert W. Roesky; Rainer B. Oswald; Aritra Pal; Mathias Noltemeyer","Synthesis, Structural Characterization, Catalytic Properties, and Theoretical Study of Compounds Containing an Al-O-M (M = Ti, Hf) Core","Inorganic Chemistry","2007","46","","1056","1061","10.1021/ic060538r","","","1.54178","CuKα","","0.076","0.0603","","","0.1205","0.1265","","","","","","1.195","","","","has coordinates,has disorder","179106","2020-10-21","18:00:00",""
"4306830","9.921","0.002","10.276","0.002","19.616","0.003","88.28","0.02","87.17","0.02","68.47","0.02","1857.9","0.6","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H57 Al Hf N2 O -","- C41 H57 Al Hf N2 O -","- C82 H114 Al2 Hf2 N4 O2 -","2","1","","Prabhuodeyara M. Gurubasavaraj; Swadhin K. Mandal; Herbert W. Roesky; Rainer B. Oswald; Aritra Pal; Mathias Noltemeyer","Synthesis, Structural Characterization, Catalytic Properties, and Theoretical Study of Compounds Containing an Al-O-M (M = Ti, Hf) Core","Inorganic Chemistry","2007","46","","1056","1061","10.1021/ic060538r","","","0.71073","MoKα","","0.0221","0.0178","","","0.0369","0.0375","","","","","","1.028","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306831","13.4412","0.0006","18.846","0.0008","19.6663","0.0008","90","","102.264","0.001","90","","4868","0.4","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C41 H36 Br4 Fe Mn2 N11 O7 -","- C41 H30 Br4 Fe Mn2 N11 O7 -","- C164 H120 Br16 Fe4 Mn8 N44 O28 -","4","1","","Wei-Wei Ni; Zhong-Hai Ni; Ai-Li Cui; Xin Liang; Hui-Zhong Kou","Cyanide-Bridged Mn(III)-Fe(III) Bimetallic Complexes Based on the Pentacyano(1-methylimidazole)ferrate(III) Building Block: Structure and Magnetic Characterizations","Inorganic Chemistry","2007","46","","22","33","10.1021/ic060575i","","","0.71073","MoKα","","0.1263","0.0585","","","0.1198","0.1362","","","","","","0.965","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306832","11.265","0.003","13.885","0.004","15.027","0.004","90","","92.039","0.001","90","","2349","1.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C41 H36 Cl4 Fe Mn2 N11 O7 -","- C41 H27 Cl4 Fe Mn2 N11 O7 -","- C82 H54 Cl8 Fe2 Mn4 N22 O14 -","2","0.5","","Wei-Wei Ni; Zhong-Hai Ni; Ai-Li Cui; Xin Liang; Hui-Zhong Kou","Cyanide-Bridged Mn(III)-Fe(III) Bimetallic Complexes Based on the Pentacyano(1-methylimidazole)ferrate(III) Building Block: Structure and Magnetic Characterizations","Inorganic Chemistry","2007","46","","22","33","10.1021/ic060575i","","","0.7107","MoKα","","0.0848","0.0725","","","0.1552","0.1604","","","","","","1.091","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306833","14.966","0.007","14.423","0.007","25.709","0.01","90","","92.97","0.02","90","","5542","4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C50 H54 Br4 Fe Mn2 N11 O7 -","- C50 H46 Br4 Fe Mn2 N11 O7 -","- C200 H184 Br16 Fe4 Mn8 N44 O28 -","4","1","","Wei-Wei Ni; Zhong-Hai Ni; Ai-Li Cui; Xin Liang; Hui-Zhong Kou","Cyanide-Bridged Mn(III)-Fe(III) Bimetallic Complexes Based on the Pentacyano(1-methylimidazole)ferrate(III) Building Block: Structure and Magnetic Characterizations","Inorganic Chemistry","2007","46","","22","33","10.1021/ic060575i","","","0.71075","MoKα","","0.1114","0.0497","","","0.1165","0.1344","","","","","","0.921","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306834","14.892","0.003","14.443","0.003","25.42","0.005","90","","93","0.03","90","","5460","1.9","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C49 H52 Cl4 Fe Mn2 N11 O7 -","- C49 H46 Cl4 Fe Mn2 N11 O7 -","- C196 H184 Cl16 Fe4 Mn8 N44 O28 -","4","1","","Wei-Wei Ni; Zhong-Hai Ni; Ai-Li Cui; Xin Liang; Hui-Zhong Kou","Cyanide-Bridged Mn(III)-Fe(III) Bimetallic Complexes Based on the Pentacyano(1-methylimidazole)ferrate(III) Building Block: Structure and Magnetic Characterizations","Inorganic Chemistry","2007","46","","22","33","10.1021/ic060575i","","","0.71073","MoKα","","0.1205","0.057","","","0.086","0.0926","","","","","","0.969","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306836","11.994","0.003","18.333","0.004","17.22","0.004","90","","90","","90","","3786.4","1.5","123","2","123","2","","","","","","","","6","P b c m","-P 2c 2b","57","","","","- C29 H56 Fe Mn N10 O8 -","- C29 H24 Fe Mn N10 O8 -","- C116 H96 Fe4 Mn4 N40 O32 -","4","0.5","","Wei-Wei Ni; Zhong-Hai Ni; Ai-Li Cui; Xin Liang; Hui-Zhong Kou","Cyanide-Bridged Mn(III)-Fe(III) Bimetallic Complexes Based on the Pentacyano(1-methylimidazole)ferrate(III) Building Block: Structure and Magnetic Characterizations","Inorganic Chemistry","2007","46","","22","33","10.1021/ic060575i","","","0.71073","MoKα","","0.0832","0.0735","","","0.1573","0.1619","","","","","","1.16","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306837","18.805","0.003","18.805","0.003","27.473","0.006","90","","90","","90","","9715","3","173","2","173","2","","","","","","","","7","I 4/m","-I 4","87","","","","- C89 H112 Cl2 Fe Mn4 N15 O25 -","- C89 H88 Cl2 Fe Mn4 N15 O25 -","- C356 H352 Cl8 Fe4 Mn16 N60 O100 -","4","0.25","","Wei-Wei Ni; Zhong-Hai Ni; Ai-Li Cui; Xin Liang; Hui-Zhong Kou","Cyanide-Bridged Mn(III)-Fe(III) Bimetallic Complexes Based on the Pentacyano(1-methylimidazole)ferrate(III) Building Block: Structure and Magnetic Characterizations","Inorganic Chemistry","2007","46","","22","33","10.1021/ic060575i","","","0.71073","MoKα","","0.1674","0.1326","","","0.264","0.2855","","","","","","1.046","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306838","10.8664","0.0015","11.4769","0.0015","15.069","0.002","102.347","0.01","96.032","0.01","110.426","0.01","1686.9","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","Tp*MoO{2-(ethylthio)phenolate}2","bis{2-(ethylthio)phenolato}{hydrotris(3,5-dimethylpyrazol-1-yl)borato}oxomolybdenum(V)","","- C31 H40 B Mo N6 O3 S2 -","- C31 H40 B Mo N6 O3 S2 -","- C62 H80 B2 Mo2 N12 O6 S4 -","2","1","","Simon C. Drew; Jason P. Hill; Ian Lane; Graeme R. Hanson; Robert W. Gable; Charles G. Young","Synthesis, Structural Characterization, and Multifrequency Electron Paramagnetic Resonance Studies of Mononuclear Thiomolybdenyl Complexes","Inorganic Chemistry","2007","46","","2373","2387","10.1021/ic060585j","","","0.71073","MoKα","","0.0429","0.0316","","","0.0703","0.075","","","","","","1.048","","","","has coordinates,has disorder","179106","2020-10-21","18:00:00",""
"4306839","14.0547","0.0012","10.085","0.002","24.747","0.004","90","","90.183","0.009","90","","3507.7","0.9","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Tp*MoS(2-propylphenolate)2","{hydrotris(3,5-dimethylpyrazol-1-yl)borato}bis{2-propylphenolato}sulfidomolybdenum(V)","","- C33 H44 B Mo N6 O2 S -","- C33 H44 B Mo N6 O2 S -","- C132 H176 B4 Mo4 N24 O8 S4 -","4","1","","Simon C. Drew; Jason P. Hill; Ian Lane; Graeme R. Hanson; Robert W. Gable; Charles G. Young","Synthesis, Structural Characterization, and Multifrequency Electron Paramagnetic Resonance Studies of Mononuclear Thiomolybdenyl Complexes","Inorganic Chemistry","2007","46","","2373","2387","10.1021/ic060585j","","","0.71073","MoKα","","0.0396","0.0314","","","0.0819","0.087","","","","","","1.042","","","","has coordinates,has disorder","179106","2020-10-21","18:00:00",""
"4306840","14.167","0.003","18.89","0.005","17.547","0.004","90","","90","","90","","4695.8","1.9","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","Tp*MoS(catecholate)","(catecholato}{hydrotris(3,5-dimethylpyrazol-1-yl)borato}sulfidomolybdenum(V)","","- C21 H26 B Mo N6 O2 S -","- C21.021 B1.001 Mo1.001 N6.006 O2.002 S1.001 -","- C168.168 B8.008 Mo8.008 N48.048 O16.016 S8.008 -","8","1","","Simon C. Drew; Jason P. Hill; Ian Lane; Graeme R. Hanson; Robert W. Gable; Charles G. Young","Synthesis, Structural Characterization, and Multifrequency Electron Paramagnetic Resonance Studies of Mononuclear Thiomolybdenyl Complexes","Inorganic Chemistry","2007","46","","2373","2387","10.1021/ic060585j","","","0.71073","MoKα","","0.1152","0.0903","","","0.2435","0.2769","","","","","","1.135","","","","has coordinates,has disorder","179106","2020-10-21","18:00:00",""
"4306841","11.264","0.002","12.56","0.003","18.618","0.004","84.166","0.004","79.112","0.004","67.478","0.004","2388.1","0.9","","","","","","","","","","","","7","P -1","-P 1","2","","","","?","- C84 H74 F36 N30 O2 P4 Ru2 -","- C84 H74 F36 N30 O2 P4 Ru2 -","","","","Simon P. Foxon; Clive Metcalfe; Harry Adams; Michelle Webb; Jim A. Thomas","Electrochemical and Photophysical Properties of DNA Metallo-intercalators Containing the Ruthenium(II) Tris(1-pyrazolyl)methane Unit","Inorganic Chemistry","2007","46","","409","416","10.1021/ic0607134","","","","","","","","","","","","","","","","","","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306842","16.205","0.003","17.827","0.003","18.731","0.003","90","","90","","90","","5411.1","1.6","173.2","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C28 H33 Cl Cu N3 O5 -","- C28 H33 Cl Cu N3 O5 -","- C224 H264 Cl8 Cu8 N24 O40 -","8","1","","Masato Kujime; Takuya Kurahashi; Masaaki Tomura; Hiroshi Fujii","63Cu NMR Spectroscopy of Copper(I) Complexes with Various Tridentate Ligands: CO as a Useful 63Cu NMR Probe for Sharpening 63Cu NMR Signals and Analyzing the Electronic Donor Effect of a Ligand","Inorganic Chemistry","2007","46","","541","551","10.1021/ic060745r","","","0.7107","MoKα","","","0.0889","","","","0.1687","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306843","17.289","0.002","22.316","0.004","8.866","0.001","90","","90","","90","","3420.7","0.8","173.2","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H38 Cl5 Cu N6 O6 -","- C25 H38 Cl5 Cu N6 O6 -","- C100 H152 Cl20 Cu4 N24 O24 -","4","1","","Masato Kujime; Takuya Kurahashi; Masaaki Tomura; Hiroshi Fujii","63Cu NMR Spectroscopy of Copper(I) Complexes with Various Tridentate Ligands: CO as a Useful 63Cu NMR Probe for Sharpening 63Cu NMR Signals and Analyzing the Electronic Donor Effect of a Ligand","Inorganic Chemistry","2007","46","","541","551","10.1021/ic060745r","","","0.7107","MoKα","","","0.0429","","","","0.1109","","","","","","1.46","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306844","11.3362","0.0011","11.3362","0.0011","11.3362","0.0011","90","","90","","90","","1456.8","0.2","173","2","173","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","","","","- C10 H21 Cl Cu N3 O5 -","- C10 H21 Cl Cu N3 O5 -","- C40 H84 Cl4 Cu4 N12 O20 -","4","0.333333","","Masato Kujime; Takuya Kurahashi; Masaaki Tomura; Hiroshi Fujii","63Cu NMR Spectroscopy of Copper(I) Complexes with Various Tridentate Ligands: CO as a Useful 63Cu NMR Probe for Sharpening 63Cu NMR Signals and Analyzing the Electronic Donor Effect of a Ligand","Inorganic Chemistry","2007","46","","541","551","10.1021/ic060745r","","","0.7107","MoKα","","0.02","0.0198","","","0.0517","0.0518","","","","","","1.043","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306845","10.389","0.002","18.465","0.003","12.439","0.002","90","","111.02","0.02","90","","2227.4","0.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","fac-Tricarbonyl(Diclhoro)(Thiazole)Ruthenium(II)","","- C6 H3 Cl2 N O3 Ru S -","- C6 H3 Cl2 N O3 Ru S -","- C48 H24 Cl16 N8 O24 Ru8 S8 -","8","2","","Renzo Cini; Sandra Defazio; Gabriella Tamasi; Mario Casolaro; Luigi Messori; Angela Casini; Margherita Morpurgo; Michael Hursthouse","fac-{Ru(CO)3}2±Core Complexes and Design of Metal-Based Drugs. Synthesis, Structure, and Reactivity of Ru-Thiazole Derivative with Serum Proteins and Absorption-Release Studies with Acryloyl and Silica Hydrogels as Carriers in Physiological Media","Inorganic Chemistry","2007","46","","79","92","10.1021/ic060755s","","","0.71073","MoKα","","0.0575","0.0458","","","0.1187","0.1267","","","","","","1.056","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306846","7.256","0.001","14.497","0.002","13.004","0.001","90","","92.85","0.01","90","","1366.2","0.3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","trans,cis,cis-dicloro-bis(carbonyl)bis(thiazole)ruthenium(II)","","- C8 H6 Cl2 N2 O2 Ru S2 -","- C8.02 H6.02 Cl2 N2 O2 Ru S1.98 -","- C32.08 H24.08 Cl8 N8 O8 Ru4 S7.92 -","4","0.5","","Renzo Cini; Sandra Defazio; Gabriella Tamasi; Mario Casolaro; Luigi Messori; Angela Casini; Margherita Morpurgo; Michael Hursthouse","fac-{Ru(CO)3}2±Core Complexes and Design of Metal-Based Drugs. Synthesis, Structure, and Reactivity of Ru-Thiazole Derivative with Serum Proteins and Absorption-Release Studies with Acryloyl and Silica Hydrogels as Carriers in Physiological Media","Inorganic Chemistry","2007","46","","79","92","10.1021/ic060755s","","","0.71073","MoKα","","0.0366","0.0275","","","0.0613","0.066","","","","","","1.074","","","","has coordinates,has disorder","179106","2020-10-21","18:00:00",""
"4306847","7.1876","0.0014","14.348","0.003","12.76","0.003","90","","93.21","0.03","90","","1313.8","0.5","120","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","trans,cis,cis-dicloro-bis(carbonyl)bis(thiazole)ruthenium(II)","","- C8 H6 Cl2 N2 O2 Ru S2 -","- C8.012 H6.012 Cl2 N2 O2 Ru S1.988 -","- C32.048 H24.048 Cl8 N8 O8 Ru4 S7.952 -","4","0.5","","Renzo Cini; Sandra Defazio; Gabriella Tamasi; Mario Casolaro; Luigi Messori; Angela Casini; Margherita Morpurgo; Michael Hursthouse","fac-{Ru(CO)3}2±Core Complexes and Design of Metal-Based Drugs. Synthesis, Structure, and Reactivity of Ru-Thiazole Derivative with Serum Proteins and Absorption-Release Studies with Acryloyl and Silica Hydrogels as Carriers in Physiological Media","Inorganic Chemistry","2007","46","","79","92","10.1021/ic060755s","","","0.71073","MoKα","","0.0232","0.0223","","","0.0519","0.0524","","","","","","1.113","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306848","11.61","0.01","19.11","0.03","24.36","0.02","90","","98.29","0.04","90","","5348","11","296.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C60 H48 Cu2 I2 P4 -","- C60 H48 Cu2 I2 P4 -","- C240 H192 Cu8 I8 P16 -","4","2","","Akira Tsuboyama; Katsuaki Kuge; Manabu Furugori; Shinjiro Okada; Mikio Hoshino; Kazunori Ueno","Photophysical Properties of Highly Luminescent Copper(I) Halide Complexes Chelated with 1,2-Bis(diphenylphosphino)benzene","Inorganic Chemistry","2007","46","","1992","2001","10.1021/ic0608086","","","0.7107","MoKα","","","0.032","","","","0.067","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306849","11.2","0.01","18.73","0.02","12.12","0.01","90","","97.59","0.04","90","","2520","4","100.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C60 H48 Br2 Cu2 P4 -","- C60 H48 Br2 Cu2 P4 -","- C120 H96 Br4 Cu4 P8 -","2","1","","Akira Tsuboyama; Katsuaki Kuge; Manabu Furugori; Shinjiro Okada; Mikio Hoshino; Kazunori Ueno","Photophysical Properties of Highly Luminescent Copper(I) Halide Complexes Chelated with 1,2-Bis(diphenylphosphino)benzene","Inorganic Chemistry","2007","46","","1992","2001","10.1021/ic0608086","","","0.7107","MoKα","","","0.045","","","","0.109","","","","","","1.396","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306850","11.137","0.008","18.74","0.02","12.303","0.008","90","","97.45","0.03","90","","2546","4","293.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C60 H48 Cl2 Cu2 P4 -","- C60 H48 Cl2 Cu2 P4 -","- C120 H96 Cl4 Cu4 P8 -","2","1","","Akira Tsuboyama; Katsuaki Kuge; Manabu Furugori; Shinjiro Okada; Mikio Hoshino; Kazunori Ueno","Photophysical Properties of Highly Luminescent Copper(I) Halide Complexes Chelated with 1,2-Bis(diphenylphosphino)benzene","Inorganic Chemistry","2007","46","","1992","2001","10.1021/ic0608086","","","0.7107","MoKα","","","0.042","","","","0.052","","","","","","0.96","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306851","15.11","0.01","14.67","0.01","18.33","0.02","90","","99.6","0.04","90","","4006","6","100.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C48 H40 Cu I P3 -","- C48 H39 Cu I P3 -","- C192 H156 Cu4 I4 P12 -","4","2","","Akira Tsuboyama; Katsuaki Kuge; Manabu Furugori; Shinjiro Okada; Mikio Hoshino; Kazunori Ueno","Photophysical Properties of Highly Luminescent Copper(I) Halide Complexes Chelated with 1,2-Bis(diphenylphosphino)benzene","Inorganic Chemistry","2007","46","","1992","2001","10.1021/ic0608086","","","0.7107","MoKα","","","0.037","","","","0.082","","","","","","1.269","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306852","23.608","0.005","11.054","0.005","22.55","0.005","90","0.005","109.74","0.005","90","0.005","5539","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H24 Co11 N4 O26 Rh -","- C38 H12 Co10.564 N4 O26 Rh1.436 -","- C152 H48 Co42.256 N16 O104 Rh5.744 -","4","0.5","","Michela Costa; Roberto Della Pergola; Alessandro Fumagalli; Franco Laschi; Serena Losi; Piero Macchi; Angelo Sironi; Piero Zanello","Mixed Co-Rh Nitrido-Encapsulated Carbonyl Clusters. Synthesis, Solid-State Structure, and Electrochemical/EPR Characterization of the Anions [Co10Rh(N)2(CO)21]3-, [Co10Rh2(N)2(CO)24]2-, and [Co11Rh(N)2(CO)24]2-","Inorganic Chemistry","2007","46","","552","560","10.1021/ic0608288","","","0.71073","MoKα","","0.0362","0.025","","","0.0716","0.0746","","","","","","1.082","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306853","12.02","0.005","18.37","0.005","12.84","0.005","90","0.005","108.5","0.005","90","0.005","2688.7","1.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H40 Co10 N4 O24 Rh2 -","- C40 H40 Co9.9982 N4 O24 Rh2.0018 -","- C80 H80 Co19.9964 N8 O48 Rh4.0036 -","2","0.5","","Michela Costa; Roberto Della Pergola; Alessandro Fumagalli; Franco Laschi; Serena Losi; Piero Macchi; Angelo Sironi; Piero Zanello","Mixed Co-Rh Nitrido-Encapsulated Carbonyl Clusters. Synthesis, Solid-State Structure, and Electrochemical/EPR Characterization of the Anions [Co10Rh(N)2(CO)21]3-, [Co10Rh2(N)2(CO)24]2-, and [Co11Rh(N)2(CO)24]2-","Inorganic Chemistry","2007","46","","552","560","10.1021/ic0608288","","","0.71073","MoKα","","0.0697","0.0415","","","0.0866","0.0969","","","","","","0.981","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4306854","17.223","0.004","14.6","0.002","22.326","0.006","90","0.005","102.22","0.02","90","0.005","5487","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H42 Co10 N5 O22 Rh -","- C36 H6 Co10 N5 O22 Rh -","- C144 H24 Co40 N20 O88 Rh4 -","4","1","","Michela Costa; Roberto Della Pergola; Alessandro Fumagalli; Franco Laschi; Serena Losi; Piero Macchi; Angelo Sironi; Piero Zanello","Mixed Co-Rh Nitrido-Encapsulated Carbonyl Clusters. Synthesis, Solid-State Structure, and Electrochemical/EPR Characterization of the Anions [Co10Rh(N)2(CO)21]3-, [Co10Rh2(N)2(CO)24]2-, and [Co11Rh(N)2(CO)24]2-","Inorganic Chemistry","2007","46","","552","560","10.1021/ic0608288","","x-ray","0.71073","MoKα","","0.1799","0.0487","","","0.1224","0.163","","","","","","0.96","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306855","20.014","0.002","6.4738","0.0008","11.5786","0.0014","90","","91.574","0.002","90","","1499.6","0.3","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C11 H11 Ag Cl N5 O5 -","- C11 H11 Ag Cl N5 O5 -","- C44 H44 Ag4 Cl4 N20 O20 -","4","0.5","","Ying Wang; Bin Ding; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Tuned Triazolatesilver(I) Luminescent Complexes from Zero- to Three-Dimensionality Based on Bi- to Tetratopic Bridged Ligands","Inorganic Chemistry","2007","46","","2002","2010","10.1021/ic060855y","","","0.71073","MoKα","","0.0539","0.0487","","","0.1538","0.1615","","","","","","1.166","","","","has coordinates,has disorder","179106","2020-10-21","18:00:00",""
"4306856","9.0524","0.0014","10.0477","0.0016","14.264","0.002","90.998","0.002","108.058","0.002","115.308","0.002","1098","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H18 Ag B F4 N8 O3 -","- C18 H18 Ag B F4 N8 O3 -","- C36 H36 Ag2 B2 F8 N16 O6 -","2","1","","Ying Wang; Bin Ding; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Tuned Triazolatesilver(I) Luminescent Complexes from Zero- to Three-Dimensionality Based on Bi- to Tetratopic Bridged Ligands","Inorganic Chemistry","2007","46","","2002","2010","10.1021/ic060855y","","","0.71073","MoKα","","0.0485","0.0331","","","0.0812","0.0855","","","","","","1.057","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306857","7.8128","0.0018","10.954","0.003","13.092","0.003","70.034","0.002","74.568","0.003","86.273","0.003","1014.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 Ag N9 O5 -","- C18 H16 Ag N9 O5 -","- C36 H32 Ag2 N18 O10 -","2","1","","Ying Wang; Bin Ding; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Tuned Triazolatesilver(I) Luminescent Complexes from Zero- to Three-Dimensionality Based on Bi- to Tetratopic Bridged Ligands","Inorganic Chemistry","2007","46","","2002","2010","10.1021/ic060855y","","","0.71073","MoKα","","0.029","0.0249","","","0.0726","0.0745","","","","","","1.075","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306858","14.676","0.004","15.821","0.004","15.985","0.004","68.894","0.003","67.259","0.003","87.049","0.004","3176.7","1.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H44.5 Ag4 Cl4 N25.5 O18 -","- C45 H40.5 Ag4 Cl4 N25.5 O18 -","- C90 H81 Ag8 Cl8 N51 O36 -","2","1","","Ying Wang; Bin Ding; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Tuned Triazolatesilver(I) Luminescent Complexes from Zero- to Three-Dimensionality Based on Bi- to Tetratopic Bridged Ligands","Inorganic Chemistry","2007","46","","2002","2010","10.1021/ic060855y","","","0.71073","MoKα","","0.0873","0.05","","","0.1356","0.1529","","","","","","1.019","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4306859","9.259","0.006","11.977","0.008","16.373","0.011","89.136","0.009","77.588","0.008","81.274","0.008","1752","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H24 Ag2 B2 F8 N16 -","- C28 H24 Ag2 B2 F8 N16 -","- C56 H48 Ag4 B4 F16 N32 -","2","1","","Ying Wang; Bin Ding; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Tuned Triazolatesilver(I) Luminescent Complexes from Zero- to Three-Dimensionality Based on Bi- to Tetratopic Bridged Ligands","Inorganic Chemistry","2007","46","","2002","2010","10.1021/ic060855y","","","0.71073","MoKα","","0.0514","0.037","","","0.1068","0.1133","","","","","","1.059","","","","has coordinates,has disorder","179106","2020-10-21","18:00:00",""
"4306860","15.777","0.002","8.2118","0.0011","18.983","0.002","90","","98.442","0.002","90","","2432.7","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H15 Ag2 Cl2 N9 O8 -","- C16 H15 Ag2 Cl2 N9 O8 -","- C64 H60 Ag8 Cl8 N36 O32 -","4","1","","Ying Wang; Bin Ding; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Tuned Triazolatesilver(I) Luminescent Complexes from Zero- to Three-Dimensionality Based on Bi- to Tetratopic Bridged Ligands","Inorganic Chemistry","2007","46","","2002","2010","10.1021/ic060855y","","","0.71073","MoKα","","0.0352","0.0308","","","0.0955","0.0986","","","","","","0.977","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306861","9.341","0.002","7.9006","0.0018","14.698","0.003","90","","97.987","0.003","90","","1074.2","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C7 H6 Ag B F4 N4 -","- C7 H6 Ag B F4 N4 -","- C28 H24 Ag4 B4 F16 N16 -","4","1","","Ying Wang; Bin Ding; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Tuned Triazolatesilver(I) Luminescent Complexes from Zero- to Three-Dimensionality Based on Bi- to Tetratopic Bridged Ligands","Inorganic Chemistry","2007","46","","2002","2010","10.1021/ic060855y","","","0.71073","MoKα","","0.0401","0.0329","","","0.0965","0.1016","","","","","","1.071","","","","has coordinates,has disorder","179106","2020-10-21","18:00:00",""
"4306862","10.5853","0.0016","13.746","0.002","14.809","0.002","90","","103.151","0.003","90","","2098.3","0.5","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C7 H8 Ag N5 O4 -","- C7 H6 Ag N5 O4.02 -","- C56 H48 Ag8 N40 O32.16 -","8","1","","Ying Wang; Bin Ding; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Tuned Triazolatesilver(I) Luminescent Complexes from Zero- to Three-Dimensionality Based on Bi- to Tetratopic Bridged Ligands","Inorganic Chemistry","2007","46","","2002","2010","10.1021/ic060855y","","","0.71073","MoKα","","0.054","0.0458","","","0.1199","0.1253","","","","","","1.186","","","","has coordinates,has disorder","179106","2020-10-21","18:00:00",""
"4306863","4.87","0.0008","18.833","0.003","13.78","0.002","90","","93.757","0.002","90","","1261.1","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 Ag Cl N7 O4 -","- C9 H7 Ag Cl N7 O4 -","- C36 H28 Ag4 Cl4 N28 O16 -","4","1","","Ying Wang; Bin Ding; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Tuned Triazolatesilver(I) Luminescent Complexes from Zero- to Three-Dimensionality Based on Bi- to Tetratopic Bridged Ligands","Inorganic Chemistry","2007","46","","2002","2010","10.1021/ic060855y","","","0.71073","MoKα","","0.0415","0.0348","","","0.0968","0.1001","","","","","","1.134","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306864","10.0407","0.001","16.386","0.0016","11.8742","0.0012","90","","108.979","0.002","90","","1847.4","0.3","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","HOLJV49","","","- C38 H59 Fe N3 -","- C38 H59 Fe N3 -","- C76 H118 Fe2 N6 -","2","1","","Javier Vela; Jordi Cirera; Jeremy M. Smith; Rene J. Lachicotte; Christine J. Flaschenriem; Santiago Alvarez; Patrick L. Holland","Quantitative Geometric Descriptions of the Belt Iron Atoms of the Iron-Molybdenum Cofactor of Nitrogenase and Synthetic Iron(II) Model Complexes","Inorganic Chemistry","2007","46","","60","71","10.1021/ic0609148","","","0.71073","MoKα","","0.0339","0.0292","","","0.0699","0.0721","","","","","","1.035","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306865","10.3029","0.0007","16.3575","0.0011","11.8844","0.0008","90","","104.83","0.001","90","","1936.2","0.2","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","HOLJV54","","","- C39 H61 Fe N3 -","- C39 H61 Fe N3 -","- C78 H122 Fe2 N6 -","2","1","","Javier Vela; Jordi Cirera; Jeremy M. Smith; Rene J. Lachicotte; Christine J. Flaschenriem; Santiago Alvarez; Patrick L. Holland","Quantitative Geometric Descriptions of the Belt Iron Atoms of the Iron-Molybdenum Cofactor of Nitrogenase and Synthetic Iron(II) Model Complexes","Inorganic Chemistry","2007","46","","60","71","10.1021/ic0609148","","","0.71073","MoKα","","0.0349","0.0315","","","0.0758","0.0772","","","","","","1.041","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306866","12.7967","0.0017","17.485","0.002","17.643","0.002","88.453","0.002","76.926","0.002","89.798","0.002","3843.9","0.8","193","2","293","2","","","","","","","","5","P -1","-P 1","2","HOLJS104","","","- C39.5 H54 Cl Fe N3 -","- C39.5 H54 Cl Fe N3 -","- C158 H216 Cl4 Fe4 N12 -","4","2","","Javier Vela; Jordi Cirera; Jeremy M. Smith; Rene J. Lachicotte; Christine J. Flaschenriem; Santiago Alvarez; Patrick L. Holland","Quantitative Geometric Descriptions of the Belt Iron Atoms of the Iron-Molybdenum Cofactor of Nitrogenase and Synthetic Iron(II) Model Complexes","Inorganic Chemistry","2007","46","","60","71","10.1021/ic0609148","","","0.71073","MoKα","","0.1427","0.0579","","","0.1253","0.1523","","","","","","0.964","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306867","12.8392","0.0007","18.2881","0.001","19.5619","0.0011","113.493","0.001","97.623","0.001","92.43","0.001","4152.3","0.4","193","2","193","2","","","","","","","","5","P -1","-P 1","2","HOLJS18","","","- C42 H68 Cl Fe N3 -","- C42 H68 Cl Fe N3 -","- C168 H272 Cl4 Fe4 N12 -","4","2","","Javier Vela; Jordi Cirera; Jeremy M. Smith; Rene J. Lachicotte; Christine J. Flaschenriem; Santiago Alvarez; Patrick L. Holland","Quantitative Geometric Descriptions of the Belt Iron Atoms of the Iron-Molybdenum Cofactor of Nitrogenase and Synthetic Iron(II) Model Complexes","Inorganic Chemistry","2007","46","","60","71","10.1021/ic0609148","","","0.71073","MoKα","","0.1449","0.0758","","","0.1592","0.1824","","","","","","1.019","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306868","9.7581","0.0012","17.336","0.002","21.989","0.003","90","","95.194","0.002","90","","3704.5","0.8","193","2","193","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C36 H53 F3 Fe N2 O3 S -","- C36 H53 F3 Fe N2 O3 S -","- C144 H212 F12 Fe4 N8 O12 S4 -","4","1","","Javier Vela; Jordi Cirera; Jeremy M. Smith; Rene J. Lachicotte; Christine J. Flaschenriem; Santiago Alvarez; Patrick L. Holland","Quantitative Geometric Descriptions of the Belt Iron Atoms of the Iron-Molybdenum Cofactor of Nitrogenase and Synthetic Iron(II) Model Complexes","Inorganic Chemistry","2007","46","","60","71","10.1021/ic0609148","","","0.71073","MoKα","","0.1635","0.0984","","","0.1662","0.1892","","","","","","1.143","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306869","13.049","0.007","15.47","0.007","16.613","0.009","93.584","0.017","95.48","0.007","108.102","0.008","3158","3","213","2","213","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H83 Cl2 Cu Fe N4 O6 -","- C58 H75 Cl2 Cu Fe N4 O4 -","- C116 H150 Cl4 Cu2 Fe2 N8 O8 -","2","1","","Maurício Lanznaster; Mary Jane Heeg; Gordon T. Yee; Bruce R. McGarvey; Claudio N. Verani","Design of Molecular Scaffolds Based on Unusual Geometries for Magnetic Modulation of Spin-Diverse Complexes with Selective Redox Response","Inorganic Chemistry","2007","46","","72","78","10.1021/ic060944a","","","0.71073","MoKα","","0.2747","0.0773","","","0.1667","0.2055","","","","","","0.724","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306870","13.3191","0.0015","14.8139","0.0018","15.9524","0.0018","113.382","0.003","92.588","0.004","94.931","0.002","2867.5","0.6","208","2","208","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H72.5 Fe N4.5 O3 -","- C57 H71 Fe N4 O3 -","- C114 H142 Fe2 N8 O6 -","2","1","","Maurício Lanznaster; Mary Jane Heeg; Gordon T. Yee; Bruce R. McGarvey; Claudio N. Verani","Design of Molecular Scaffolds Based on Unusual Geometries for Magnetic Modulation of Spin-Diverse Complexes with Selective Redox Response","Inorganic Chemistry","2007","46","","72","78","10.1021/ic060944a","","","0.71073","MoKα","","0.1001","0.0654","","","0.1792","0.1948","","","","","","1.08","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4306871","12.962","0.002","10.0892","0.0017","16.049","0.002","90","","116.516","0.011","90","","1878.1","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H40 Mn2 N10 O10 P2 -","- C34 H40 Mn2 N10 O10 P2 -","- C68 H80 Mn4 N20 O20 P4 -","2","0.5","","Deng-Ke Cao; Jing Xiao; Jian-Wei Tong; Yi-Zhi Li; Li-Min Zheng","Metal Phosphonates Based on Bis(benzimidazol-2-ylmethyl)imino Methylenephosphonate: From Discrete Dimer to Two-Dimensional Network Containing Metallomacrocycles","Inorganic Chemistry","2007","46","","428","436","10.1021/ic060990a","","","0.71073","MoKα","","0.0709","0.0515","","","0.1032","0.1078","","","","","","1.122","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306872","20.617","0.004","13.973","0.004","14.04","0.003","90","","120.515","0.005","90","","3484.5","1.4","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H34 Cd2 N10 O7 P2 -","- C34 H34 Cd2 N10 O7 P2 -","- C136 H136 Cd8 N40 O28 P8 -","4","0.5","","Deng-Ke Cao; Jing Xiao; Jian-Wei Tong; Yi-Zhi Li; Li-Min Zheng","Metal Phosphonates Based on Bis(benzimidazol-2-ylmethyl)imino Methylenephosphonate: From Discrete Dimer to Two-Dimensional Network Containing Metallomacrocycles","Inorganic Chemistry","2007","46","","428","436","10.1021/ic060990a","","","0.71073","MoKα","","0.0509","0.0381","","","0.0906","0.0952","","","","","","0.982","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306873","9.5807","0.0014","9.9959","0.0015","11.423","0.0017","84.33","0.003","85.224","0.003","62.268","0.003","962.7","0.2","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C34 H34 Fe2 N10 O7 P2 -","- C34 H34 Fe2 N10 O7 P2 -","- C34 H34 Fe2 N10 O7 P2 -","1","1","","Deng-Ke Cao; Jing Xiao; Jian-Wei Tong; Yi-Zhi Li; Li-Min Zheng","Metal Phosphonates Based on Bis(benzimidazol-2-ylmethyl)imino Methylenephosphonate: From Discrete Dimer to Two-Dimensional Network Containing Metallomacrocycles","Inorganic Chemistry","2007","46","","428","436","10.1021/ic060990a","","","0.71073","MoKα","","0.0727","0.0617","","","0.1394","0.1428","","","","","","1.079","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306874","11.4778","0.0014","13.1159","0.0015","24.903","0.003","90","","102.761","0.003","90","","3656.3","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H34 Cu2 N10 O6 P2 -","- C34 H34 Cu2 N10 O6 P2 -","- C136 H136 Cu8 N40 O24 P8 -","4","1","","Deng-Ke Cao; Jing Xiao; Jian-Wei Tong; Yi-Zhi Li; Li-Min Zheng","Metal Phosphonates Based on Bis(benzimidazol-2-ylmethyl)imino Methylenephosphonate: From Discrete Dimer to Two-Dimensional Network Containing Metallomacrocycles","Inorganic Chemistry","2007","46","","428","436","10.1021/ic060990a","","","0.71073","MoKα","","0.1107","0.0587","","","0.1094","0.1197","","","","","","1.018","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306875","7.3557","0.0015","7.3557","0.0015","8.4779","0.0017","90","","90","","120","","397.25","0.14","293","2","293","2","","","","","","","","5","P 63 2 2","P 6c 2c","182","","","","- C3 H7 Mn N O6 -","- C3 H7.02 Mn N O6 -","- C6 H14.04 Mn2 N2 O12 -","2","0.166667","","Zheming Wang; Bin Zhang; Katsuya Inoue; Hideki Fujiwara; Takeo Otsuka; Hayao Kobayashi; Mohamedally Kurmoo","Occurrence of a Rare 49.66 Structural Topology, Chirality, and Weak Ferromagnetism in the [NH4][MII(HCOO)3] (M = Mn, Co, Ni) Frameworks","Inorganic Chemistry","2007","46","","437","445","10.1021/ic0610031","","","0.71073","MoKα","","0.0216","0.0195","","","0.0441","0.0443","","","","","","1.152","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306876","7.297","0.002","7.297","0.002","8.179","0.002","90","","90","","120","","377.15","0.17","293","2","293","2","","","","","","","","5","P 63 2 2","P 6c 2c","182","","","","- C3 H7 Co N O6 -","- C3 H7.02 Co N O6 -","- C6 H14.04 Co2 N2 O12 -","2","0.166667","","Zheming Wang; Bin Zhang; Katsuya Inoue; Hideki Fujiwara; Takeo Otsuka; Hayao Kobayashi; Mohamedally Kurmoo","Occurrence of a Rare 49.66 Structural Topology, Chirality, and Weak Ferromagnetism in the [NH4][MII(HCOO)3] (M = Mn, Co, Ni) Frameworks","Inorganic Chemistry","2007","46","","437","445","10.1021/ic0610031","","","0.71073","MoKα","","0.0166","0.0157","","","0.0413","0.0415","","","","","","1.192","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306877","7.2861","0.0013","7.2861","0.0013","8.0207","0.0016","90","","90","","120","","368.75","0.12","293","2","293","2","","","","","","","","5","P 63 2 2","P 6c 2c","182","","","","- C3 H7 N Ni O6 -","- C3 H7.02 N Ni O6 -","- C6 H14.04 N2 Ni2 O12 -","2","0.166667","","Zheming Wang; Bin Zhang; Katsuya Inoue; Hideki Fujiwara; Takeo Otsuka; Hayao Kobayashi; Mohamedally Kurmoo","Occurrence of a Rare 49.66 Structural Topology, Chirality, and Weak Ferromagnetism in the [NH4][MII(HCOO)3] (M = Mn, Co, Ni) Frameworks","Inorganic Chemistry","2007","46","","437","445","10.1021/ic0610031","","","0.71073","MoKα","","0.018","0.0168","","","0.0418","0.0421","","","","","","1.172","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306878","18.365","0.005","16.886","0.004","15.569","0.004","90","","104.217","0.004","90","","4680","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H36 Fe4 O10 P2 S4 -","- C42 H36 Fe4 O10 P2 S4 -","- C168 H144 Fe16 O40 P8 S16 -","4","0.5","","Weiming Gao; Jesper Ekström; Jianhui Liu; Changneng Chen; Lars Eriksson; Linhong Weng; Björn Åkermark; Licheng Sun","Binuclear Iron-Sulfur Complexes with Bidentate Phosphine Ligands as Active Site Models of Fe-Hydrogenase and Their Catalytic Proton Reduction","Inorganic Chemistry","2007","46","","1981","1991","10.1021/ic0610278","","","0.71073","MoKα","","0.1207","0.0796","","","0.1328","0.1456","","","","","","1.171","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306879","10.9583","0.0002","11.2692","0.0002","12.8333","0.0003","104.378","0.001","93.111","0.001","118.539","0.001","1320.5","0.05","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H46 Fe4 N2 O10 P2 S4 -","- C46 H46 Fe4 N2 O10 P2 S4 -","- C46 H46 Fe4 N2 O10 P2 S4 -","1","0.5","","Weiming Gao; Jesper Ekström; Jianhui Liu; Changneng Chen; Lars Eriksson; Linhong Weng; Björn Åkermark; Licheng Sun","Binuclear Iron-Sulfur Complexes with Bidentate Phosphine Ligands as Active Site Models of Fe-Hydrogenase and Their Catalytic Proton Reduction","Inorganic Chemistry","2007","46","","1981","1991","10.1021/ic0610278","","","0.71073","MoKα","","0.0541","0.049","","","0.1413","0.148","","","","","","1.074","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306880","16.776","0.007","13.903","0.006","33.67","0.013","90","","96.909","0.006","90","","7796","6","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C36 H35 Fe2 N O5 P2 S3 -","- C36 H35 Fe2 N O5 P2 S3 -","- C288 H280 Fe16 N8 O40 P16 S24 -","8","1","","Weiming Gao; Jesper Ekström; Jianhui Liu; Changneng Chen; Lars Eriksson; Linhong Weng; Björn Åkermark; Licheng Sun","Binuclear Iron-Sulfur Complexes with Bidentate Phosphine Ligands as Active Site Models of Fe-Hydrogenase and Their Catalytic Proton Reduction","Inorganic Chemistry","2007","46","","1981","1991","10.1021/ic0610278","","","0.71073","MoKα","","0.1194","0.0593","","","0.1244","0.147","","","","","","1.015","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306881","9.848","0.001","14.3088","0.0015","23.615","0.002","90.027","0.008","90.938","0.008","89.991","0.008","3327.2","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H25 Fe2 O4 P2 S2 -","- C33 H28 Fe2 O5 P2 S2 -","- C132 H112 Fe8 O20 P8 S8 -","4","1","","Weiming Gao; Jesper Ekström; Jianhui Liu; Changneng Chen; Lars Eriksson; Linhong Weng; Björn Åkermark; Licheng Sun","Binuclear Iron-Sulfur Complexes with Bidentate Phosphine Ligands as Active Site Models of Fe-Hydrogenase and Their Catalytic Proton Reduction","Inorganic Chemistry","2007","46","","1981","1991","10.1021/ic0610278","","","0.71073","MoKα","","0.2303","0.048","","","0.0874","0.1269","","","","","","0.821","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306882","16.4811","0.0005","41.0436","0.001","21.3835","0.0007","90","","90","","90","","14464.7","0.7","293","2","293","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C64 H56 Cl0 Fe4 O8 P4 S4 -","- C64 H50 Cl8 Fe4 O8 P4 S4 -","- C512 H400 Cl64 Fe32 O64 P32 S32 -","8","1","","Weiming Gao; Jesper Ekström; Jianhui Liu; Changneng Chen; Lars Eriksson; Linhong Weng; Björn Åkermark; Licheng Sun","Binuclear Iron-Sulfur Complexes with Bidentate Phosphine Ligands as Active Site Models of Fe-Hydrogenase and Their Catalytic Proton Reduction","Inorganic Chemistry","2007","46","","1981","1991","10.1021/ic0610278","","","0.71073","MoKα","","0.468","0.0821","","","0.1714","0.3037","","","","","","0.792","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306883","11.6388","0.0003","10.639","0.0003","29.4414","0.0007","90","","98.448","0.001","90","","3606.03","0.16","273","2","273","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H33 Fe2 N O5 P2 S2 -","- C35 H33 Fe2 N O5 P2 S2 -","- C140 H132 Fe8 N4 O20 P8 S8 -","4","1","","Weiming Gao; Jesper Ekström; Jianhui Liu; Changneng Chen; Lars Eriksson; Linhong Weng; Björn Åkermark; Licheng Sun","Binuclear Iron-Sulfur Complexes with Bidentate Phosphine Ligands as Active Site Models of Fe-Hydrogenase and Their Catalytic Proton Reduction","Inorganic Chemistry","2007","46","","1981","1991","10.1021/ic0610278","","","0.71073","MoKα","","0.0687","0.0433","","","0.1023","0.1167","","","","","","1.009","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306884","21.5441","0.001","9.7792","0.0004","16.8278","0.0007","90","","98.837","0.003","90","","3503.3","0.3","273","2","273","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H33 Fe2 N O4 P2 S2 -","- C34 H33 Fe2 N O4 P2 S2 -","- C136 H132 Fe8 N4 O16 P8 S8 -","4","1","","Weiming Gao; Jesper Ekström; Jianhui Liu; Changneng Chen; Lars Eriksson; Linhong Weng; Björn Åkermark; Licheng Sun","Binuclear Iron-Sulfur Complexes with Bidentate Phosphine Ligands as Active Site Models of Fe-Hydrogenase and Their Catalytic Proton Reduction","Inorganic Chemistry","2007","46","","1981","1991","10.1021/ic0610278","","","0.71073","MoKα","","0.0657","0.0437","","","0.1285","0.1492","","","","","","0.999","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306885","9.978","0.002","14.061","0.003","20.115","0.006","90","","90","","90","","2822.1","1.2","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C13 H14 Cl2 N2 Pt -","- C13 H14 Cl2 N2 Pt -","- C104 H112 Cl16 N16 Pt8 -","8","1","","Virginia Diez; José V. Cuevas; Gabriel García-Herbosa; Gabriel Aullón; Jonathan P. H. Charmant; Arancha Carbayo; Asunción Muñoz","1H NMR Direct Observation of Enantiomeric Exchange in Palladium(II) and Platinum(II) Complexes Containing N,N' Bidentate Aryl-pyridin-2-ylmethyl-amine Ligands","Inorganic Chemistry","2007","46","","568","577","10.1021/ic061060u","","","0.71073","MoKα","","0.0344","0.0226","","","0.0513","0.0562","","","","","","1.078","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306886","10.1689","0.0011","12.88","0.002","11.736","0.002","90","","109.516","0.012","90","","1448.8","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 Cl2 N2 Pd -","- C14 H16 Cl2 N2 Pd -","- C56 H64 Cl8 N8 Pd4 -","4","1","","Virginia Diez; José V. Cuevas; Gabriel García-Herbosa; Gabriel Aullón; Jonathan P. H. Charmant; Arancha Carbayo; Asunción Muñoz","1H NMR Direct Observation of Enantiomeric Exchange in Palladium(II) and Platinum(II) Complexes Containing N,N' Bidentate Aryl-pyridin-2-ylmethyl-amine Ligands","Inorganic Chemistry","2007","46","","568","577","10.1021/ic061060u","","","0.71073","MoKα","","0.0442","0.0321","","","0.0703","0.0748","","","","","","1.036","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306887","8.101","0.002","20.147","0.006","14.063","0.004","90","","106.182","0.005","90","","2204.3","1.1","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ag0.31 Ge4 Na7.69 Se10 -","- Ag0.312 Ge4 Na7.688 Se10 -","- Ag1.248 Ge16 Na30.752 Se40 -","4","0.5","","Amitava Choudhury; Sabine Strobel; Benjamin R. Martin; Angela L. Karst; Peter K. Dorhout","Synthesis of a Family of Solids through the Building-Block Approach: A Case Study with Ag+ Substitution in the Ternary Na-Ge-Se System","Inorganic Chemistry","2007","46","","2017","2027","10.1021/ic061064z","","","0.71073","MoKα","","0.1451","0.0507","","","0.1137","0.1532","","","","","","0.984","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306888","8.1043","0.0012","20.163","0.003","13.998","0.002","90","","105.861","0.003","90","","2200.3","0.6","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ag0.67 Ge4 Na7.33 Se10 -","- Ag0.672 Ge4 Na7.328 Se10 -","- Ag2.688 Ge16 Na29.312 Se40 -","4","0.5","","Amitava Choudhury; Sabine Strobel; Benjamin R. Martin; Angela L. Karst; Peter K. Dorhout","Synthesis of a Family of Solids through the Building-Block Approach: A Case Study with Ag+ Substitution in the Ternary Na-Ge-Se System","Inorganic Chemistry","2007","46","","2017","2027","10.1021/ic061064z","","","0.71073","MoKα","","0.0528","0.0332","","","0.0768","0.086","","","","","","1.006","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306889","8.104","0.002","20.156","0.005","13.985","0.004","90","","105.757","0.004","90","","2198.5","1","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ag0.77 Ge4 Na7.23 Se10 -","- Ag0.764 Ge4 Na7.236 Se10 -","- Ag3.056 Ge16 Na28.944 Se40 -","4","0.5","","Amitava Choudhury; Sabine Strobel; Benjamin R. Martin; Angela L. Karst; Peter K. Dorhout","Synthesis of a Family of Solids through the Building-Block Approach: A Case Study with Ag+ Substitution in the Ternary Na-Ge-Se System","Inorganic Chemistry","2007","46","","2017","2027","10.1021/ic061064z","","","0.71073","MoKα","","0.0739","0.0551","","","0.1317","0.1424","","","","","","1.086","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306890","8.103","0.0011","20.155","0.003","13.9665","0.0019","90","","105.699","0.002","90","","2195.9","0.5","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ag0.87 Ge4 Na7.13 Se10 -","- Ag0.87 Ge4 Na7.13 Se10 -","- Ag3.48 Ge16 Na28.52 Se40 -","4","0.5","","Amitava Choudhury; Sabine Strobel; Benjamin R. Martin; Angela L. Karst; Peter K. Dorhout","Synthesis of a Family of Solids through the Building-Block Approach: A Case Study with Ag+ Substitution in the Ternary Na-Ge-Se System","Inorganic Chemistry","2007","46","","2017","2027","10.1021/ic061064z","","","0.71073","MoKα","","0.0714","0.0455","","","0.0842","0.0917","","","","","","1.049","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306891","8.098","0.004","20.131","0.009","13.922","0.006","90","","105.547","0.009","90","","2186.5","1.7","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ag1.04 Ge4 Na6.95 Se10 -","- Ag1.05 Ge4 Na6.95 Se10 -","- Ag4.2 Ge16 Na27.8 Se40 -","4","0.5","","Amitava Choudhury; Sabine Strobel; Benjamin R. Martin; Angela L. Karst; Peter K. Dorhout","Synthesis of a Family of Solids through the Building-Block Approach: A Case Study with Ag+ Substitution in the Ternary Na-Ge-Se System","Inorganic Chemistry","2007","46","","2017","2027","10.1021/ic061064z","","","0.71073","MoKα","","0.0708","0.0476","","","0.0873","0.0945","","","","","","1.066","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306892","8.1013","0.0007","20.1342","0.0018","13.9213","0.0013","90","","105.541","0.002","90","","2187.7","0.3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ag1.09 Ge4 Na6.91 Se10 -","- Ag1.086 Ge4 Na6.914 Se10 -","- Ag4.344 Ge16 Na27.656 Se40 -","4","0.5","","Amitava Choudhury; Sabine Strobel; Benjamin R. Martin; Angela L. Karst; Peter K. Dorhout","Synthesis of a Family of Solids through the Building-Block Approach: A Case Study with Ag+ Substitution in the Ternary Na-Ge-Se System","Inorganic Chemistry","2007","46","","2017","2027","10.1021/ic061064z","","","0.71073","MoKα","","0.0646","0.044","","","0.0869","0.0935","","","","","","1.068","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306893","9.7234","0.0018","10.547","0.002","15.236","0.003","90","","102.985","0.003","90","","1522.5","0.5","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ag1.76 Ge2 Na4.24 Se7 -","- Ag1.76 Ge2 Na4.24 Se7 -","- Ag7.04 Ge8 Na16.96 Se28 -","4","0.5","","Amitava Choudhury; Sabine Strobel; Benjamin R. Martin; Angela L. Karst; Peter K. Dorhout","Synthesis of a Family of Solids through the Building-Block Approach: A Case Study with Ag+ Substitution in the Ternary Na-Ge-Se System","Inorganic Chemistry","2007","46","","2017","2027","10.1021/ic061064z","","","0.71073","MoKα","","0.0661","0.0429","","","0.1033","0.1131","","","","","","1.082","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306894","15.3236","0.0016","15.4411","0.0017","21.331","0.003","111.181","0.003","106.205","0.004","92.444","0.003","4460.8","0.9","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C86 H107 K N11 O16.25 Y -","- C86 H106 K N11 O16.25 Y -","- C172 H212 K2 N22 O32.5 Y2 -","2","1","","Luca Maretti; Marilena Ferbinteanu; Fanica Cimpoesu; Saiful S. M. Islam; Yasunori Ohba; Takashi Kajiwara; Masahiro Yamashita; Seigo Yamauchi","Spin Coupling in the Supramolecular Structure of a New Tetra(Quinoline-TEMPO)Yttrium(III) Complex","Inorganic Chemistry","2007","46","","660","669","10.1021/ic0610841","","","0.71073","MoKα","","0.1297","0.0575","","","0.1518","0.1724","","","","","","0.718","","","","has coordinates","179106","2020-10-21","18:00:00",""
"4306895","19.869","0.001","26.65","0.001","25.843","0.001","90","","90","","90","","13684.1","1","180","2","180","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C215.6 H83.6 Cl8.8 Co N9.6 -","- C215.6 H83.6 Cl8.8 Co N9.6 -","- C862.4 H334.4 Cl35.2 Co4 N38.4 -","4","0.5","","Dmitri V. Konarev; Salavat S. Khasanov; Akihiro Otsuka; Gunzi Saito; Rimma N. Lyubovskaya","Formation of Antiferromagnetically Coupled C60.- and Diamagnetic (C70-)2 Dimers in Ionic Complexes of Fullerenes with (MDABCO+)2.MIITPP (M = Zn, Co, Mn, and Fe) Assemblies","Inorganic Chemistry","2007","46","","2261","2271","10.1021/ic0611138","","","0.71073","MoKα","","0.0796","0.0583","","","0.1454","0.1608","","","","","","1.018","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4306896","20.025","0.001","25.95","0.001","25.938","0.002","90","","90","","90","","13478.6","1.3","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C215.8 H83.8 Cl8.4 Mn N9.8 -","- C215.8 H83.8 Cl8.4 Mn N9.8 -","- C863.2 H335.2 Cl33.6 Mn4 N39.2 -","4","0.5","","Dmitri V. Konarev; Salavat S. Khasanov; Akihiro Otsuka; Gunzi Saito; Rimma N. Lyubovskaya","Formation of Antiferromagnetically Coupled C60.- and Diamagnetic (C70-)2 Dimers in Ionic Complexes of Fullerenes with (MDABCO+)2.MIITPP (M = Zn, Co, Mn, and Fe) Assemblies","Inorganic Chemistry","2007","46","","2261","2271","10.1021/ic0611138","","","0.71073","MoKα","","0.093","0.0593","","","0.131","0.1479","","","","","","1.008","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4306897","19.117","0.001","19.566","0.001","20.731","0.001","67.606","0.003","81.629","0.003","63.61","0.003","6419.7","0.6","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","","","- C421.6 H136 Cl12 Mn N16.8 -","- C421.6 H136 Cl12 Mn N16.8 -","- C421.6 H136 Cl12 Mn N16.8 -","1","0.5","","Dmitri V. Konarev; Salavat S. Khasanov; Akihiro Otsuka; Gunzi Saito; Rimma N. Lyubovskaya","Formation of Antiferromagnetically Coupled C60.- and Diamagnetic (C70-)2 Dimers in Ionic Complexes of Fullerenes with (MDABCO+)2.MIITPP (M = Zn, Co, Mn, and Fe) Assemblies","Inorganic Chemistry","2007","46","","2261","2271","10.1021/ic0611138","","","0.71073","MoKα","","0.0959","0.0694","","","0.1664","0.1834","","","","","","1.021","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4306898","13.667","0.002","14.036","0.003","15.665","0.002","64.577","0.008","68.486","0.009","73.64","0.008","2497.2","0.8","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C43 H43 B Cl F20 P4 W -","- C43 H43 B Cl F20 P4 W -","- C86 H86 B2 Cl2 F40 P8 W2 -","2","1","","Edwin F. van der Eide; Warren E. Piers; Masood Parvez; Robert McDonald","Synthesis and Characterization of Cationic Tungsten(V) Methylidynes","Inorganic Chemistry","2007","46","","14","21","10.1021/ic0611342","","","0.71073","MoKα","","0.0513","0.0366","","","0.0697","0.0757","","","","","","1.055","","","","has coordinates,has disorder","179106","2020-10-21","18:00:00",""
"4306899","27.5938","0.0018","11.9743","0.0008","13.3408","0.0009","90","","90","","90","","4408","0.5","193","2","193","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C37 H33 B Cl F20 P4 W -","- C37 H33 B Cl F20 P4 W -","- C148 H132 B4 Cl4 F80 P16 W4 -","4","1","","Edwin F. van der Eide; Warren E. Piers; Masood Parvez; Robert McDonald","Synthesis and Characterization of Cationic Tungsten(V) Methylidynes","Inorganic Chemistry","2007","46","","14","21","10.1021/ic0611342","","","0.71073","MoKα","","0.0304","0.0243","","","0.0528","0.0548","","","","","","1.007","","","","has coordinates,has disorder","179106","2020-10-21","18:00:00",""
"4306900","30.889","0.011","8.924","0.002","15.485","0.006","90","","94.582","0.017","90","","4255","2","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C13 H36 P4 W -","- C13 H36 P4 W -","- C104 H288 P32 W8 -","8","1","","Edwin F. van der Eide; Warren E. Piers; Masood Parvez; Robert McDonald","Synthesis and Characterization of Cationic Tungsten(V) Methylidynes","Inorganic Chemistry","2007","46","","14","21","10.1021/ic0611342","","","0.71073","MoKα","","0.0512","0.0323","","","0.069","0.076","","","","","","1.038","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306901","7.86023","0.00014","7.86023","","11.9051","0.0004","90","","90","","90","","735.54","0.03","","","","","","","","","","","","6","P 42/m c m","-P 4c 2c","132","","","","- Cs0.38 D2.8 H0.83 O8 Si Ti2 -","- Cs0.375 D2.795 H0.83 O8 Si Ti2 -","- Cs1.5 D11.18 H3.32 O32 Si4 Ti8 -","4","0.25","","Aaron J. Celestian; John B. Parise; Ronald I. Smith; Brian H. Toby; Abraham Clearfield","Role of the Hydroxyl-Water Hydrogen-Bond Network in Structural Transitions and Selectivity toward Cesium in Cs0.38(D1.08H0.54)SiTi2O7.(D0.86H0.14)2O Crystalline Silicotitanate","Inorganic Chemistry","2007","46","","1081","1089","10.1021/ic0611387","powder diffraction","","","","","","","","","","","","","2.53","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306902","11.07041","0.00031","11.07041","","11.8917","0.0005","90","","90","","90","","1457.38","0.07","","","","","","","","","","","","5","P 42/m b c","-P 4c 2ab","135","","","","- D4.52 H0.48 O8.5 Si Ti2 -","- D4.518 H2.8 O8.5 Si Ti2 -","- D36.144 H22.4 O68 Si8 Ti16 -","8","0.5","","Aaron J. Celestian; John B. Parise; Ronald I. Smith; Brian H. Toby; Abraham Clearfield","Role of the Hydroxyl-Water Hydrogen-Bond Network in Structural Transitions and Selectivity toward Cesium in Cs0.38(D1.08H0.54)SiTi2O7.(D0.86H0.14)2O Crystalline Silicotitanate","Inorganic Chemistry","2007","46","","1081","1089","10.1021/ic0611387","powder diffraction","","","","","","","","","","","","","2.01","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306903","10.734","0.002","29.802","0.003","8.411","0.002","90","","109.964","0.01","90","","2528.9","0.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H28 B Mo N6 O2 S -","- C22 H28 B Mo N6 O2 S -","- C88 H112 B4 Mo4 N24 O8 S4 -","4","1","","Katrina Peariso; Matthew E. Helton; Eileen N. Duesler; Susan E. Shadle; Martin L. Kirk","Sulfur K-edge Spectroscopic Investigation of Second Coordination Sphere Effects in Oxomolybdenum-Thiolates: Relationship to Molybdenum-Cysteine Covalency and Electron Transfer in Sulfite Oxidase","Inorganic Chemistry","2007","46","","1259","1267","10.1021/ic061150z","","","0.71073","MoKα","","0.0577","0.0398","","","0.0885","0.0955","","","","","","1.035","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306904","25.245","0.004","25.245","0.004","15.488","0.003","90","","90","","120","","8548","3","293","2","293","2","","","","","","","","5","P 6/m c c","-P 6 2c","192","","","","- C12 H24 Cu4 I4 N4 -","- C12 H24 Cu4 I4 N4 -","- C144 H288 Cu48 I48 N48 -","12","0.5","","Minghui Bi; Guanghua Li; Yongchun Zou; Zhan Shi; Shouhua Feng","Zeolite-like Copper Iodide Framework with New 66 Topology","Inorganic Chemistry","2007","46","","604","606","10.1021/ic061163c","","","0.71073","MoKα","","0.0933","0.0776","","","0.2494","0.2639","","","","","","1.068","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306905","11.2579","0.001","13.2668","0.0011","13.8772","0.0012","74.468","0.002","77.592","0.002","67.561","0.002","1830.9","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C90 H58 Cl6 Cu2 N8 O2 -","- C90 H58 Cl6 Cu2 N8 O1.996 -","- C90 H58 Cl6 Cu2 N8 O1.996 -","1","0.5","","Fuh-An Yang; Chih-Wei Guo; Yao-Jung Chen; Jyh-Horung Chen; Shin-Shin Wang; Jo-Yu Tung; Lian-Pin Hwang; Shanmugam Elango","ESR, Zero-Field Splitting, and Magnetic Exchange of Exchange-Coupled Copper(II)-Copper(II) Pairs in Copper(II) Tetraphenylporphyrin N-Oxide#","Inorganic Chemistry","2007","46","","578","585","10.1021/ic0611802","","","0.71073","MoKα","","0.1446","0.0746","","","0.211","0.2363","","","","","","0.954","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306906","11.2537","0.0008","13.1197","0.0009","13.8526","0.001","73.07","0.001","77.825","0.002","66.589","0.001","1785","0.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C93 H56 N9 O2 Zn2 -","- C93 H56 N9 O1.998 Zn2 -","- C93 H56 N9 O1.998 Zn2 -","1","0.5","","Fuh-An Yang; Chih-Wei Guo; Yao-Jung Chen; Jyh-Horung Chen; Shin-Shin Wang; Jo-Yu Tung; Lian-Pin Hwang; Shanmugam Elango","ESR, Zero-Field Splitting, and Magnetic Exchange of Exchange-Coupled Copper(II)-Copper(II) Pairs in Copper(II) Tetraphenylporphyrin N-Oxide#","Inorganic Chemistry","2007","46","","578","585","10.1021/ic0611802","","","0.71073","MoKα","","0.1108","0.0709","","","0.2029","0.2195","","","","","","1.036","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306907","17.727","0.0004","17.8283","0.0004","24.6899","0.0006","69.394","0.005","89.774","0.005","65.875","0.005","6575.9","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C62.25 H92.5 Au Cl4.5 N S4 -","- C62.25 H92.5 Au Cl4.5 N S4 -","- C249 H370 Au4 Cl18 N4 S16 -","4","2","","Swarnalatha Kokatam; Kallol Ray; Joseph Pap; Eckhard Bill; William E. Geiger; Robert J. LeSuer; Philip H. Rieger; Thomas Weyhermüller; Frank Neese; Karl Wieghardt","Molecular and Electronic Structure of Square-Planar Gold Complexes Containing Two 1,2-Di(4-tert-butylphenyl)ethylene-1,2-dithiolato Ligands: [Au(2L)2]1+/0/1-/2-. A Combined Experimental and Computational Study","Inorganic Chemistry","2007","46","","1100","1111","10.1021/ic061181u","","","0.71073","MoKα","","0.0426","0.0338","","","0.0784","0.083","","","","","","1.033","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4306908","11.705","0.001","11.705","0.001","64.778","0.005","90","","90","","90","","8875","1.3","100","2","100","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C45 H54 Au Cl2 S4 -","- C45 H54 Au Cl2 S4 -","- C360 H432 Au8 Cl16 S32 -","8","1","","Swarnalatha Kokatam; Kallol Ray; Joseph Pap; Eckhard Bill; William E. Geiger; Robert J. LeSuer; Philip H. Rieger; Thomas Weyhermüller; Frank Neese; Karl Wieghardt","Molecular and Electronic Structure of Square-Planar Gold Complexes Containing Two 1,2-Di(4-tert-butylphenyl)ethylene-1,2-dithiolato Ligands: [Au(2L)2]1+/0/1-/2-. A Combined Experimental and Computational Study","Inorganic Chemistry","2007","46","","1100","1111","10.1021/ic061181u","","","0.71073","MoKα","","0.1641","0.0746","","","0.0971","0.1196","","","","","","1.029","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306909","11.9728","0.0005","35.8262","0.0014","11.1766","0.0004","90","","90","","90","","4794.1","0.3","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C47.5 H56 Pd S4 -","- C47.5 H52 Pd S4 -","- C190 H208 Pd4 S16 -","4","1","","Swarnalatha Kokatam; Kallol Ray; Joseph Pap; Eckhard Bill; William E. Geiger; Robert J. LeSuer; Philip H. Rieger; Thomas Weyhermüller; Frank Neese; Karl Wieghardt","Molecular and Electronic Structure of Square-Planar Gold Complexes Containing Two 1,2-Di(4-tert-butylphenyl)ethylene-1,2-dithiolato Ligands: [Au(2L)2]1+/0/1-/2-. A Combined Experimental and Computational Study","Inorganic Chemistry","2007","46","","1100","1111","10.1021/ic061181u","","","0.71073","MoKα","","0.0531","0.0395","","","0.0804","0.0849","","","","","","1.041","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306910","10.667","0.004","9.608","0.003","24.859","0.01","90","","100.65","0.03","90","","2503.9","1.6","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H23 Cl2 N3 O5 U -","- C24 H23 Cl2 N3 O5 U -","- C96 H92 Cl8 N12 O20 U4 -","4","1","","Koichiro Takao; Yasuhisa Ikeda","Structural Characterization and Reactivity of UO2(salophen)L and [UO2(salophen)]2: Dimerization of UO2(salophen) Fragments in Noncoordinating Solvents (salophen =N,N'-Disalicylidene-o-phenylenediaminate, L =N,N-Dimethylformamide, Dimethyl Sulfoxide)","Inorganic Chemistry","2007","46","","1550","1562","10.1021/ic0611950","","","0.71075","MoKα","","0.0291","0.0258","","","0.0633","0.065","","","","","","1.119","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306911","13.303","0.007","9.422","0.004","17.205","0.008","90","","94.45","0.05","90","","2150","1.8","113","2","113","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C22 H20 N2 O5 S U -","- C22 H20 N2 O5 S U -","- C88 H80 N8 O20 S4 U4 -","4","2","","Koichiro Takao; Yasuhisa Ikeda","Structural Characterization and Reactivity of UO2(salophen)L and [UO2(salophen)]2: Dimerization of UO2(salophen) Fragments in Noncoordinating Solvents (salophen =N,N'-Disalicylidene-o-phenylenediaminate, L =N,N-Dimethylformamide, Dimethyl Sulfoxide)","Inorganic Chemistry","2007","46","","1550","1562","10.1021/ic0611950","","","0.71075","MoKα","","0.0313","0.0267","","","0.0658","0.0677","","","","","","1.088","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306912","15.717","0.005","15.993","0.007","17.619","0.005","67.45","0.03","77.99","0.03","81.66","0.03","3990","3","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C40.5 H29 Cl N4 O8 U2 -","- C40.5 H29 Cl N4 O8 U2 -","- C162 H116 Cl4 N16 O32 U8 -","4","2","","Koichiro Takao; Yasuhisa Ikeda","Structural Characterization and Reactivity of UO2(salophen)L and [UO2(salophen)]2: Dimerization of UO2(salophen) Fragments in Noncoordinating Solvents (salophen =N,N'-Disalicylidene-o-phenylenediaminate, L =N,N-Dimethylformamide, Dimethyl Sulfoxide)","Inorganic Chemistry","2007","46","","1550","1562","10.1021/ic0611950","","","0.71075","MoKα","","0.0978","0.0594","","","0.1161","0.1297","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306913","15.689","0.007","16.044","0.005","17.642","0.007","67","0.03","78.25","0.03","81.72","0.03","3992","3","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H28 N4 O8 U2 -","- C40 H28 N4 O8 U2 -","- C160 H112 N16 O32 U8 -","4","2","","Koichiro Takao; Yasuhisa Ikeda","Structural Characterization and Reactivity of UO2(salophen)L and [UO2(salophen)]2: Dimerization of UO2(salophen) Fragments in Noncoordinating Solvents (salophen =N,N'-Disalicylidene-o-phenylenediaminate, L =N,N-Dimethylformamide, Dimethyl Sulfoxide)","Inorganic Chemistry","2007","46","","1550","1562","10.1021/ic0611950","","","0.71075","MoKα","","0.0983","0.0578","","","0.0974","0.1082","","","","","","1.022","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306914","5.7163","0.0004","14.054","0.0009","18.941","0.0012","102.739","0.002","91.825","0.002","93.739","0.002","1479.37","0.17","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H30 N3 O3 P -","- C35 H30 N3 O3 P -","- C70 H60 N6 O6 P2 -","2","1","","Sean E. Durran; Mark R. J. Elsegood; Shelly R. Hammond; Martin B. Smith","Coordination Studies of a New Unsymmetrical κ4-PNN'N''-Tetradentate Ligand: Stepwise Formation and Structural Characterization","Inorganic Chemistry","2007","46","","2755","2766","10.1021/ic061196s","","","0.71073","MoKα","","0.0589","0.0399","","","0.0917","0.1035","","","","","","1.014","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306915","10.2646","0.0003","24.5437","0.0008","25.2894","0.0008","90","","90","","90","","6371.2","0.3","150","2","150","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C35 H30 Au Cl N3 O3 P -","- C35 H30 Au Cl N3 O3 P -","- C280 H240 Au8 Cl8 N24 O24 P8 -","8","2","","Sean E. Durran; Mark R. J. Elsegood; Shelly R. Hammond; Martin B. Smith","Coordination Studies of a New Unsymmetrical κ4-PNN'N''-Tetradentate Ligand: Stepwise Formation and Structural Characterization","Inorganic Chemistry","2007","46","","2755","2766","10.1021/ic061196s","","","0.71073","MoKα","","0.0608","0.0368","","","0.0671","0.0773","","","","","","1.054","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306916","10.2631","0.0004","12.6371","0.0005","13.9101","0.0005","108.757","0.002","107.033","0.002","90.723","0.002","1621.93","0.11","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H30 Cl2 N3 O3 P Pt -","- C35 H30 Cl2 N3 O3 P Pt -","- C70 H60 Cl4 N6 O6 P2 Pt2 -","2","1","","Sean E. Durran; Mark R. J. Elsegood; Shelly R. Hammond; Martin B. Smith","Coordination Studies of a New Unsymmetrical κ4-PNN'N''-Tetradentate Ligand: Stepwise Formation and Structural Characterization","Inorganic Chemistry","2007","46","","2755","2766","10.1021/ic061196s","","","0.71073","MoKα","","0.0204","0.0173","","","0.0377","0.039","","","","","","1.033","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306917","10.9918","0.0004","20.1329","0.0008","16.9331","0.0006","90","","101.717","0.002","90","","3669.2","0.2","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C40 H42 N3 O4 P Pt -","- C40 H42 N3 O4 P Pt -","- C160 H168 N12 O16 P4 Pt4 -","4","2","","Sean E. Durran; Mark R. J. Elsegood; Shelly R. Hammond; Martin B. Smith","Coordination Studies of a New Unsymmetrical κ4-PNN'N''-Tetradentate Ligand: Stepwise Formation and Structural Characterization","Inorganic Chemistry","2007","46","","2755","2766","10.1021/ic061196s","","","0.71073","MoKα","","0.0385","0.0282","","","0.0469","0.0503","","","","","","0.869","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306918","12.1259","0.0006","12.3708","0.0006","12.7204","0.0006","88.533","0.002","86.397","0.002","63.724","0.002","1707.6","0.15","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H29 Cl3 N3 O3 P Pt -","- C36 H29 Cl3 N3 O3 P Pt -","- C72 H58 Cl6 N6 O6 P2 Pt2 -","2","1","","Sean E. Durran; Mark R. J. Elsegood; Shelly R. Hammond; Martin B. Smith","Coordination Studies of a New Unsymmetrical κ4-PNN'N''-Tetradentate Ligand: Stepwise Formation and Structural Characterization","Inorganic Chemistry","2007","46","","2755","2766","10.1021/ic061196s","","","0.71073","MoKα","","0.0331","0.0262","","","0.0581","0.0612","","","","","","1.07","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306919","10.541","0.0007","12.7066","0.0009","22.8534","0.0016","90","","94.996","0.002","90","","3049.4","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H30 N3 O4 P Pt -","- C35 H30 N3 O4 P Pt -","- C140 H120 N12 O16 P4 Pt4 -","4","1","","Sean E. Durran; Mark R. J. Elsegood; Shelly R. Hammond; Martin B. Smith","Coordination Studies of a New Unsymmetrical κ4-PNN'N''-Tetradentate Ligand: Stepwise Formation and Structural Characterization","Inorganic Chemistry","2007","46","","2755","2766","10.1021/ic061196s","","","0.71073","MoKα","","0.0352","0.0215","","","0.0407","0.0449","","","","","","1.055","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306920","12.1068","0.0006","12.4003","0.0006","12.6708","0.0006","88.378","0.002","86.176","0.002","63.823","0.002","1703.34","0.15","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H29 Cl3 N3 O3 P Pd -","- C36 H29 Cl3 N3 O3 P Pd -","- C72 H58 Cl6 N6 O6 P2 Pd2 -","2","1","","Sean E. Durran; Mark R. J. Elsegood; Shelly R. Hammond; Martin B. Smith","Coordination Studies of a New Unsymmetrical κ4-PNN'N''-Tetradentate Ligand: Stepwise Formation and Structural Characterization","Inorganic Chemistry","2007","46","","2755","2766","10.1021/ic061196s","","","0.71073","MoKα","","0.0386","0.0311","","","0.0735","0.0776","","","","","","1.068","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306921","11.8195","0.0005","12.3734","0.0005","12.4974","0.0005","89.552","0.002","65.19","0.002","85.84","0.002","1654.13","0.12","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H30 Cl2 N3 Ni O3 P -","- C36 H30 Cl2 N3 Ni O3 P -","- C72 H60 Cl4 N6 Ni2 O6 P2 -","2","1","","Sean E. Durran; Mark R. J. Elsegood; Shelly R. Hammond; Martin B. Smith","Coordination Studies of a New Unsymmetrical κ4-PNN'N''-Tetradentate Ligand: Stepwise Formation and Structural Characterization","Inorganic Chemistry","2007","46","","2755","2766","10.1021/ic061196s","","","0.71073","MoKα","","0.0506","0.0378","","","0.0912","0.1","","","","","","1.048","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306922","10.153","0.004","20.993","0.003","13.985","0.002","90","","91.81","0.02","90","","2979.3","1.3","293","","293","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C27 H32 B Mo N6 O P S3 -","- C27 H32 B Mo N6 O P S3 -","- C108 H128 B4 Mo4 N24 O4 P4 S12 -","4","1","","Les J. Laughlin; Aston A. Eagle; Graham N. George; Edward R. T. Tiekink; Charles G. Young","Synthesis, Characterization, and Biomimetic Chemistry of cis-Oxosulfidomolybdenum(VI) Complexes Stabilized by an Intramolecular Mo(O)S...S Interaction","Inorganic Chemistry","2007","46","","939","948","10.1021/ic061213d","","","0.7107","MoKalpha","","","0.044","","","0.039","","","","","1.45","1.45","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306923","12.601","0.001","10.899","0.001","20.595","0.003","90","","90.09","0.01","90","","2828.5","0.5","293","","293","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C21 H36 B Mo N6 O P S3 -","- C21 H36 B Mo N6 O P S3 -","- C84 H144 B4 Mo4 N24 O4 P4 S12 -","4","1","","Les J. Laughlin; Aston A. Eagle; Graham N. George; Edward R. T. Tiekink; Charles G. Young","Synthesis, Characterization, and Biomimetic Chemistry of cis-Oxosulfidomolybdenum(VI) Complexes Stabilized by an Intramolecular Mo(O)S...S Interaction","Inorganic Chemistry","2007","46","","939","948","10.1021/ic061213d","","","0.7107","MoKalpha","","","0.041","","","0.041","","","","","0","0","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306924","7.5841","0.0007","10.4083","0.001","10.5056","0.001","113.784","0.001","93.111","0.002","99.851","0.002","740.65","0.12","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H10 Hg I2 N4 -","- C10 H10 Hg I2 N4 -","- C20 H20 Hg2 I4 N8 -","2","1","","K. K. Sarker; B. G. Chand; K. Suwa; J. Cheng; T.-H. Lu; J. Otsuki; C. Sinha","Structural Studies and Photochromism of Mercury(II)-Iodo Complexes of (Arylazo)imidazoles","Inorganic Chemistry","2007","46","","670","680","10.1021/ic061221u","","","0.71073","MoKα","","0.0453","0.0302","","","0.0743","0.0793","","","","","","0.989","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306925","11.6496","0.0013","14.3615","0.0016","12.8105","0.0014","90","","109.002","0.002","90","","2026.5","0.4","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H16 Hg I2 N4 -","- C17 H16 Hg I2 N4 -","- C68 H64 Hg4 I8 N16 -","4","1","","K. K. Sarker; B. G. Chand; K. Suwa; J. Cheng; T.-H. Lu; J. Otsuki; C. Sinha","Structural Studies and Photochromism of Mercury(II)-Iodo Complexes of (Arylazo)imidazoles","Inorganic Chemistry","2007","46","","670","680","10.1021/ic061221u","","","0.71073","MoKα","","0.1903","0.0398","","","0.0529","0.062","","","","","","0.75","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306926","18.349","0.004","11.471","0.002","22.932","0.005","90","","92.26","0.03","90","","4823","1.7","293","2","293","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C50 H62 As6 Mo6 N10 O41 Zn3 -","- C50 H36 As6 Mo6 N10 O41 Zn3 -","- C100 H72 As12 Mo12 N20 O82 Zn6 -","2","0.5","","Chunyan Sun; Yangguang Li; Enbo Wang; Dongrong Xiao; Haiyan An; Lin Xu","A Series of New Organic-Inorganic Molybdenum Arsenate Complexes Based on [(ZnO6)(As3O3)2Mo6O18]4- and [HxAs2Mo6O26](6-x)- Clusters as SBUs","Inorganic Chemistry","2007","46","","1563","1574","10.1021/ic061227j","","","0.71073","MoKα","","0.132","0.0531","","","0.082","0.0964","","","","","","0.869","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306927","10.493","0.002","10.781","0.002","15.639","0.003","77.55","0.03","77.86","0.03","78.81","0.03","1668.3","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H44 As6 Mo6 N8 O36 Zn3 -","- C48 H32 As6 Mo6 N8 O36 Zn3 -","- C48 H32 As6 Mo6 N8 O36 Zn3 -","1","0.5","","Chunyan Sun; Yangguang Li; Enbo Wang; Dongrong Xiao; Haiyan An; Lin Xu","A Series of New Organic-Inorganic Molybdenum Arsenate Complexes Based on [(ZnO6)(As3O3)2Mo6O18]4- and [HxAs2Mo6O26](6-x)- Clusters as SBUs","Inorganic Chemistry","2007","46","","1563","1574","10.1021/ic061227j","","","0.71073","MoKα","","0.112","0.058","","","0.1149","0.1368","","","","","","1.073","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306928","18.117","0.004","9.3968","0.0019","19.658","0.004","90","","94.08","0.03","90","","3338.1","1.2","293","2","293","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C40 H44 As6 Mo6 N8 O36 Zn3 -","- C40 H32 As6 Mo6 N8 O36 Zn3 -","- C80 H64 As12 Mo12 N16 O72 Zn6 -","2","0.5","","Chunyan Sun; Yangguang Li; Enbo Wang; Dongrong Xiao; Haiyan An; Lin Xu","A Series of New Organic-Inorganic Molybdenum Arsenate Complexes Based on [(ZnO6)(As3O3)2Mo6O18]4- and [HxAs2Mo6O26](6-x)- Clusters as SBUs","Inorganic Chemistry","2007","46","","1563","1574","10.1021/ic061227j","","","0.71073","MoKα","","0.0691","0.05","","","0.1376","0.1506","","","","","","0.994","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306929","9.3252","0.0019","12.051","0.002","14.174","0.003","114.93","0.03","93.63","0.03","105.82","0.03","1360.4","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H42 As6 Mo6 N4 O42 Zn2 -","- C20 H18 As6 Mo6 N4 O42 Zn2 -","- C20 H18 As6 Mo6 N4 O42 Zn2 -","1","0.5","","Chunyan Sun; Yangguang Li; Enbo Wang; Dongrong Xiao; Haiyan An; Lin Xu","A Series of New Organic-Inorganic Molybdenum Arsenate Complexes Based on [(ZnO6)(As3O3)2Mo6O18]4- and [HxAs2Mo6O26](6-x)- Clusters as SBUs","Inorganic Chemistry","2007","46","","1563","1574","10.1021/ic061227j","","","0.71073","MoKα","","0.1282","0.0783","","","0.1672","0.1945","","","","","","1.011","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306930","10.852","0.002","11.389","0.002","11.976","0.002","66.89","0.03","84.75","0.03","64.78","0.03","1226.5","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H30 As2 Cu2 Mo6 N6 O27 -","- C30 H26 As2 Cu2 Mo6 N6 O27 -","- C30 H26 As2 Cu2 Mo6 N6 O27 -","1","0.5","","Chunyan Sun; Yangguang Li; Enbo Wang; Dongrong Xiao; Haiyan An; Lin Xu","A Series of New Organic-Inorganic Molybdenum Arsenate Complexes Based on [(ZnO6)(As3O3)2Mo6O18]4- and [HxAs2Mo6O26](6-x)- Clusters as SBUs","Inorganic Chemistry","2007","46","","1563","1574","10.1021/ic061227j","","","0.71073","MoKα","","0.1145","0.0785","","","0.1934","0.221","","","","","","1.103","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306931","14.691","0.003","18.645","0.004","10.623","0.002","90","","127.52","0.03","90","","2307.9","1.2","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C30 H38 As2 Mo6 N6 O30 -","- C30 H38 As2 Mo6 N6 O30 -","- C60 H76 As4 Mo12 N12 O60 -","2","0.25","","Chunyan Sun; Yangguang Li; Enbo Wang; Dongrong Xiao; Haiyan An; Lin Xu","A Series of New Organic-Inorganic Molybdenum Arsenate Complexes Based on [(ZnO6)(As3O3)2Mo6O18]4- and [HxAs2Mo6O26](6-x)- Clusters as SBUs","Inorganic Chemistry","2007","46","","1563","1574","10.1021/ic061227j","","","0.71073","MoKα","","0.0298","0.0247","","","0.0538","0.0545","","","","","","1.017","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306932","11.795","0.002","24.301","0.005","17.028","0.003","90","","94.64","0.03","90","","4864.7","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H40 As2 Mo6 N6 O31 -","- C30 H30 As2 Mo6 N6 O31 -","- C120 H120 As8 Mo24 N24 O124 -","4","1","","Chunyan Sun; Yangguang Li; Enbo Wang; Dongrong Xiao; Haiyan An; Lin Xu","A Series of New Organic-Inorganic Molybdenum Arsenate Complexes Based on [(ZnO6)(As3O3)2Mo6O18]4- and [HxAs2Mo6O26](6-x)- Clusters as SBUs","Inorganic Chemistry","2007","46","","1563","1574","10.1021/ic061227j","","","0.71073","MoKα","","0.0496","0.0389","","","0.0955","0.1","","","","","","1.037","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306933","11.225","0.002","14.065","0.003","15.201","0.003","100.15","0.03","93.02","0.03","111.94","0.03","2172.7","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H32.5 As2 Mo6 N5 O29.25 -","- C25 H20 As2 Mo6 N5 O29.25 -","- C50 H40 As4 Mo12 N10 O58.5 -","2","1","","Chunyan Sun; Yangguang Li; Enbo Wang; Dongrong Xiao; Haiyan An; Lin Xu","A Series of New Organic-Inorganic Molybdenum Arsenate Complexes Based on [(ZnO6)(As3O3)2Mo6O18]4- and [HxAs2Mo6O26](6-x)- Clusters as SBUs","Inorganic Chemistry","2007","46","","1563","1574","10.1021/ic061227j","","","0.71073","MoKα","","0.0704","0.0468","","","0.1005","0.1132","","","","","","1.013","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4306934","13.2189","0.0014","18.2919","0.0018","19.1575","0.0019","66.529","0.005","70.892","0.008","77.054","0.007","3991.4","0.7","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","bis(dodecanethiolato)palladium(II)","","- C24 H50 Pd S2 -","- C24 H50 Pd S2 -","- C144 H300 Pd6 S12 -","6","3","","Zhiqiang Yang; Alexander B. Smetana; Christopher M. Sorensen; Kenneth J. Klabunde","Synthesis and Characterization of a New Tiara Pd(II) Thiolate Complex, [Pd(SC12H25)2]6, and Its Solution-Phase Thermolysis to Prepare Nearly Monodisperse Palladium Sulfide Nanoparticles","Inorganic Chemistry","2007","46","","2427","2431","10.1021/ic061242o","","","0.71073","MoKα","","0.1456","0.0618","","","0.1342","0.1616","","","","","","0.859","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306935","10.794","0.011","14.392","0.015","25.75","0.03","82.564","0.017","85.443","0.018","82.614","0.019","3926","7","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C85 H95 Au5 N10 O2 -","- C85 H93 Au5 N10 O2 -","- C170 H186 Au10 N20 O4 -","2","1","","Hanan E. Abdou; Ahmed A. Mohamed; John P. Fackler","Syntheses of Mixed-Ligand Tetranuclear Gold(I)-Nitrogen Clusters by Ligand Exchange Reactions with the Dinuclear Gold(I) Formamidinate Complex Au2(2,6-Me2Ph-form)2","Inorganic Chemistry","2007","46","","141","146","10.1021/ic0612449","","","0.71073","MoKα","","0.178","0.0924","","","0.1595","0.1843","","","","","","0.985","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306936","11.5747","0.0019","25.497","0.004","21.221","0.003","90","","96.979","0.003","90","","6216.3","1.7","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C140 H120 Au8 N16 O3 -","- C140 H120 Au8 N16 O3 -","- C280 H240 Au16 N32 O6 -","2","0.5","","Hanan E. Abdou; Ahmed A. Mohamed; John P. Fackler","Syntheses of Mixed-Ligand Tetranuclear Gold(I)-Nitrogen Clusters by Ligand Exchange Reactions with the Dinuclear Gold(I) Formamidinate Complex Au2(2,6-Me2Ph-form)2","Inorganic Chemistry","2007","46","","141","146","10.1021/ic0612449","","","0.71073","MoKα","","0.1226","0.0566","","","0.1227","0.1368","","","","","","0.77","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306937","23.058","0.005","14.314","0.003","18.528","0.004","90","","90.94","0.03","90","","6114","2","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C66 H60 Au4 N8 O -","- C66 H60 Au4 N8 O -","- C264 H240 Au16 N32 O4 -","4","1","","Hanan E. Abdou; Ahmed A. Mohamed; John P. Fackler","Syntheses of Mixed-Ligand Tetranuclear Gold(I)-Nitrogen Clusters by Ligand Exchange Reactions with the Dinuclear Gold(I) Formamidinate Complex Au2(2,6-Me2Ph-form)2","Inorganic Chemistry","2007","46","","141","146","10.1021/ic0612449","","","0.71073","MoKα","","0.0988","0.0589","","","0.1374","0.1796","","","","","","1.178","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306938","16.646","0.002","11.094","0.002","5.2417","0.0008","90","","90","","90","","968","0.3","298","2","298","2","","","","","","","","3","P b a n :2","-P 2ab 2b","50","","","","- O3 Te Tl2 -","- O3 Te Tl2 -","- O24 Te8 Tl16 -","8","1","","Franziska Rieger; Anja-Verena Mudring","Phase Transition in Tl2TeO3: Influence and Origin of the Thallium Lone Pair Distortion","Inorganic Chemistry","2007","46","","446","452","10.1021/ic061273j","","","0.71073","MoKα","","0.1866","0.0913","","","0.1829","0.2313","","","","","","0.809","","","","has coordinates","270822","2021-11-23","08:36:47",""
"4306939","16.6","0.01","11.078","0.006","5.238","0.003","90","","90","","90","","963.2","1","","","","","","","","","","","","3","P b a n :2","-P 2ab 2b","50","","Dithallium Tellurate(IV)","","- O3 Te Tl2 -","- O3 Te Tl2 -","- O24 Te8 Tl16 -","8","1","","Franziska Rieger; Anja-Verena Mudring","Phase Transition in Tl2TeO3: Influence and Origin of the Thallium Lone Pair Distortion","Inorganic Chemistry","2007","46","","446","452","10.1021/ic061273j","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306940","16.6","0.01","11.078","0.006","5.238","0.001","90","","90","","90","","963.2","0.8","","","","","","","","","","","","3","P b a n :2","-P 2ab 2b","50","","Dithallium(I) Tellurate(IV)","","- O3 Te Tl2 -","- O3 Te Tl2 -","- O24 Te8 Tl16 -","8","1","","Franziska Rieger; Anja-Verena Mudring","Phase Transition in Tl2TeO3: Influence and Origin of the Thallium Lone Pair Distortion","Inorganic Chemistry","2007","46","","446","452","10.1021/ic061273j","","","","","","0.1087","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306941","11.0233","0.0015","12.527","0.003","13.66","0.003","108.132","0.005","100.31","0.009","98.311","0.011","1722.8","0.6","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","complex 2","","- C32 H29 B2 F8 N9 Ru -","- C32 H29 B2 F7.92 N9 Ru -","- C64 H58 B4 F15.84 N18 Ru2 -","2","1","","Akiko Inagaki; Shinichi Yatsuda; Shinichi Edure; Akiko Suzuki; Takeshi Takahashi; Munetaka Akita","Synthesis of Pd Complexes Combined with Photosensitizing of a Ruthenium(II) Polypyridyl Moiety through a Series of Substituted Bipyrimidine Bridges. Substituent Effect of the Bridging Ligand on the Photocatalytic Dimerization of α-Methylstyrene","Inorganic Chemistry","2007","46","","2432","2445","10.1021/ic0612909","","","0.71075","MoKα","","0.0837","0.0552","","","0.1337","0.1504","","","","","","1.032","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306942","10.872","0.008","13.654","0.011","14.259","0.011","63.27","0.03","89.01","0.03","83.05","0.03","1875","3","213","2","213","2","","","","","","","","8","P -1","-P 1","2","","complex 3","","- C29 H24 B3 Br2 F12 N9 O2 Ru -","- C29 H24 B3 Br2 F11.96 N9 O2 Ru -","- C58 H48 B6 Br4 F23.92 N18 O4 Ru2 -","2","1","","Akiko Inagaki; Shinichi Yatsuda; Shinichi Edure; Akiko Suzuki; Takeshi Takahashi; Munetaka Akita","Synthesis of Pd Complexes Combined with Photosensitizing of a Ruthenium(II) Polypyridyl Moiety through a Series of Substituted Bipyrimidine Bridges. Substituent Effect of the Bridging Ligand on the Photocatalytic Dimerization of α-Methylstyrene","Inorganic Chemistry","2007","46","","2432","2445","10.1021/ic0612909","","","0.71075","MoKα","","0.1585","0.0927","","","0.2387","0.2742","","","","","","1.005","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306943","13.247","0.003","23.613","0.006","12.127","0.003","90","","99.452","0.018","90","","3741.8","1.6","123","2","123","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","complex4","","- C33 H32 F12 N8 O P2 Ru -","- C33 H26 F11.94 N8 O P2 Ru -","- C132 H104 F47.76 N32 O4 P8 Ru4 -","4","1","","Akiko Inagaki; Shinichi Yatsuda; Shinichi Edure; Akiko Suzuki; Takeshi Takahashi; Munetaka Akita","Synthesis of Pd Complexes Combined with Photosensitizing of a Ruthenium(II) Polypyridyl Moiety through a Series of Substituted Bipyrimidine Bridges. Substituent Effect of the Bridging Ligand on the Photocatalytic Dimerization of α-Methylstyrene","Inorganic Chemistry","2007","46","","2432","2445","10.1021/ic0612909","","","0.71069","MoKα","","0.0677","0.0511","","","0.1392","0.1499","","","","","","1.03","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306944","18.1853","0.0003","13.9041","0.0004","28.1028","0.0009","90","","90","","90","","7105.8","0.3","213","2","213","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","complex5","","- C32 H30 F12 N8 P2 Ru -","- C32 H30 F11.9 N8 P2 Ru -","- C256 H240 F95.2 N64 P16 Ru8 -","8","1","","Akiko Inagaki; Shinichi Yatsuda; Shinichi Edure; Akiko Suzuki; Takeshi Takahashi; Munetaka Akita","Synthesis of Pd Complexes Combined with Photosensitizing of a Ruthenium(II) Polypyridyl Moiety through a Series of Substituted Bipyrimidine Bridges. Substituent Effect of the Bridging Ligand on the Photocatalytic Dimerization of α-Methylstyrene","Inorganic Chemistry","2007","46","","2432","2445","10.1021/ic0612909","","","0.71075","MoKα","","0.051","0.0446","","","0.1192","0.1239","","","","","","1.041","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306945","9.526","0.007","11.29","0.009","20.075","0.016","100.42","0.03","102.89","0.03","96.73","0.03","2042","3","213","2","213","2","","","","","","","","9","P -1","-P 1","2","","complex6","","- C31 H31 Cl F12 N10 O4 P2 Pd Ru -","- C31 H28 Cl F12 N10 O4 P2 Pd Ru -","- C62 H56 Cl2 F24 N20 O8 P4 Pd2 Ru2 -","2","1","","Akiko Inagaki; Shinichi Yatsuda; Shinichi Edure; Akiko Suzuki; Takeshi Takahashi; Munetaka Akita","Synthesis of Pd Complexes Combined with Photosensitizing of a Ruthenium(II) Polypyridyl Moiety through a Series of Substituted Bipyrimidine Bridges. Substituent Effect of the Bridging Ligand on the Photocatalytic Dimerization of α-Methylstyrene","Inorganic Chemistry","2007","46","","2432","2445","10.1021/ic0612909","","","0.71075","MoKα","","0.2865","0.0687","","","0.1187","0.1728","","","","","","0.766","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306946","25.738","0.002","14.9871","0.0014","18.8759","0.0018","90","","121.038","0.002","90","","6238.7","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C56 H56 Mn4 N28 O2 S4 -","- C56 H56 Mn4 N28 O2 S4 -","- C224 H224 Mn16 N112 O8 S16 -","4","0.5","","Lin Cheng; Wei-Xiong Zhang; Bao-Hui Ye; Jian-Bin Lin; Xiao-Ming Chen","In Situ Solvothermal Generation of 1,2,4-Triazolates and Related Compounds from Organonitrile and Hydrazine Hydrate: A Mechanism Study","Inorganic Chemistry","2007","46","","1135","1143","10.1021/ic061303i","","","0.71073","MoKα","","0.0917","0.0694","","","0.1742","0.1903","","","","","","1.024","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306947","12.7851","0.0017","15.0878","0.0019","27.705","0.004","90","","90","","90","","5344.3","1.2","293","2","293","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C24 H20 Cl2 Mn2 N10 O2 -","- C24 H20 Cl2 Mn2 N10 O2 -","- C192 H160 Cl16 Mn16 N80 O16 -","8","1","","Lin Cheng; Wei-Xiong Zhang; Bao-Hui Ye; Jian-Bin Lin; Xiao-Ming Chen","In Situ Solvothermal Generation of 1,2,4-Triazolates and Related Compounds from Organonitrile and Hydrazine Hydrate: A Mechanism Study","Inorganic Chemistry","2007","46","","1135","1143","10.1021/ic061303i","","","0.71073","MoKα","","0.1138","0.0713","","","0.1152","0.1296","","","","","","0.969","","","","has coordinates","271475","2021-12-16","11:44:44",""
"4306948","11.4967","0.001","11.4967","0.001","18.224","0.004","90","","90","","90","","2408.7","0.6","293","2","293","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C12 H8 Cu N5 -","- C12 H8 Cu N5 -","- C96 H64 Cu8 N40 -","8","1","","Lin Cheng; Wei-Xiong Zhang; Bao-Hui Ye; Jian-Bin Lin; Xiao-Ming Chen","In Situ Solvothermal Generation of 1,2,4-Triazolates and Related Compounds from Organonitrile and Hydrazine Hydrate: A Mechanism Study","Inorganic Chemistry","2007","46","","1135","1143","10.1021/ic061303i","","","0.71073","MoKα","","0.1012","0.0673","","","0.127","0.1395","","","","","","1.079","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306949","27.612","0.003","7.5526","0.0009","15.0059","0.0017","90","","107.841","0.002","90","","2978.9","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H20 Mn2 N12 O2 S2 -","- C26 H20 Mn2 N12 O2 S2 -","- C104 H80 Mn8 N48 O8 S8 -","4","0.5","","Lin Cheng; Wei-Xiong Zhang; Bao-Hui Ye; Jian-Bin Lin; Xiao-Ming Chen","In Situ Solvothermal Generation of 1,2,4-Triazolates and Related Compounds from Organonitrile and Hydrazine Hydrate: A Mechanism Study","Inorganic Chemistry","2007","46","","1135","1143","10.1021/ic061303i","","","0.71073","MoKα","","0.0688","0.0516","","","0.1137","0.1218","","","","","","1.079","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306950","12.4385","0.0011","16.8446","0.0015","18.7956","0.0013","90","","131.062","0.004","90","","2969.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H54 Mn4 N34 O2 -","- C56 H54 Mn4 N34 O2 -","- C112 H108 Mn8 N68 O4 -","2","0.5","","Lin Cheng; Wei-Xiong Zhang; Bao-Hui Ye; Jian-Bin Lin; Xiao-Ming Chen","In Situ Solvothermal Generation of 1,2,4-Triazolates and Related Compounds from Organonitrile and Hydrazine Hydrate: A Mechanism Study","Inorganic Chemistry","2007","46","","1135","1143","10.1021/ic061303i","","","0.71073","MoKα","","0.0796","0.0654","","","0.1736","0.1842","","","","","","1.039","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306951","13.0013","0.0007","13.2584","0.0007","19.6224","0.0008","90","","111.617","0.003","90","","3144.5","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H54 Mn4 N34 O2 -","- C56 H54 Mn4 N34 O2 -","- C112 H108 Mn8 N68 O4 -","2","0.5","","Lin Cheng; Wei-Xiong Zhang; Bao-Hui Ye; Jian-Bin Lin; Xiao-Ming Chen","In Situ Solvothermal Generation of 1,2,4-Triazolates and Related Compounds from Organonitrile and Hydrazine Hydrate: A Mechanism Study","Inorganic Chemistry","2007","46","","1135","1143","10.1021/ic061303i","","","0.71073","MoKα","","0.0664","0.0581","","","0.1585","0.1647","","","","","","1.089","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306952","10.5071","0.0007","13.0548","0.0007","13.1799","0.0009","85.927","0.005","85.955","0.004","75.668","0.004","1744.55","0.19","130","1","130","1","","","","","","","","6","P -1","-P 1","2","","","","- C26 H47 Mo N5 O S6 -","- C26 H47 Mo N5 O S6 -","- C52 H94 Mo2 N10 O2 S12 -","2","1","","Manzur, Carolina; Millán, Lorena; Fuentealba, Mauricio; Hamon, Jean-René; Toupet, Loïc; Kahlal, Samia; Saillard, Jean-Yves; Carrillo, David","Iron‒Molybdenum Charge-Transfer Hybrids Containing Organometallic and Inorganic Fragments Bridged by Aryldiazenido Ligands in a μ-η6:η1 Coordination Mode: Syntheses, Characterization, X-ray Structures, Electrochemistry, and Theoretical Investigation","Inorganic Chemistry","2007","46","4","1123","1134","10.1021/ic0613098","","","0.71069","MoKα","","0.1015","0.0555","","","0.1069","0.1266","","","","","","1.033","","","","has coordinates","210311","2020-10-21","18:00:00",""
"4306953","10.0854","0.0003","16.2396","0.0007","25.236","0.0009","92.994","0.003","93.952","0.003","107.908","0.003","3911.9","0.3","120","1","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C27 H42 F6 Fe Mo N5 O P S6 -","- C27 H42 F6 Fe Mo N5 O P S6 -","- C108 H168 F24 Fe4 Mo4 N20 O4 P4 S24 -","4","2","","Manzur, Carolina; Millán, Lorena; Fuentealba, Mauricio; Hamon, Jean-René; Toupet, Loïc; Kahlal, Samia; Saillard, Jean-Yves; Carrillo, David","Iron‒Molybdenum Charge-Transfer Hybrids Containing Organometallic and Inorganic Fragments Bridged by Aryldiazenido Ligands in a μ-η6:η1 Coordination Mode: Syntheses, Characterization, X-ray Structures, Electrochemistry, and Theoretical Investigation","Inorganic Chemistry","2007","46","4","1123","1134","10.1021/ic0613098","","","0.71069","MoKα","","0.1732","0.0776","","","0.1578","0.1942","","","","","","1.119","","","","has coordinates","210311","2020-10-21","18:00:00",""
"4306954","14.452","0.001","13.254","0.001","16.386","0.003","90","","109.158","0.009","90","","2964.9","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H36 Cl2 Cu2 N6 O11 -","- C21 H36 Cl2 Cu2 N6 O11 -","- C84 H144 Cl8 Cu8 N24 O44 -","4","1","","Nicolás A. Rey; Ademir Neves; Adailton J. Bortoluzzi; Claus T. Pich; Hernán Terenzi","Catalytic Promiscuity in Biomimetic Systems: Catecholase-like Activity, Phosphatase-like Activity, and Hydrolytic DNA Cleavage Promoted by a New Dicopper(II) Hydroxo-Bridged Complex","Inorganic Chemistry","2007","46","","348","350","10.1021/ic0613107","","","0.71069","MoKα","","0.1223","0.0598","","","0.1637","0.188","","","","","","1.048","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306955","7.999","0.0003","23.0146","0.0008","8.709","0.0003","90","","90","","90","","1603.27","0.1","120","0.2","120","0.2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(dimethylsilyl)(dimethylfluorosilyl)niobocene hydrid","bis(cyclopentadienyl)(dimethylsilyl) (dimethylfluorosilyl)(hydrido) niobium (V)","","- C14 H23 F Nb Si2 -","- C14 H23 F Nb Si2 -","- C56 H92 F4 Nb4 Si8 -","4","1","","Konstantin Yu. Dorogov; Muhammed Yousufuddin; Nam-Nhat Ho; Andrei V. Churakov; Lyudmila G. Kuzmina; Arthur J. Schultz; Sax A. Mason; Judith A. K. Howard; Dmitry A. Lemenovskii; Robert Bau; Georgii I. Nikonov","Syntheses and Structures of Asymmetric Bis(silyl) Niobocene Hydrides","Inorganic Chemistry","2007","46","","147","160","10.1021/ic061314b","","","0.71073","MoKα","","0.0278","0.0262","","","0.0643","0.0653","","","","","","1.053","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306956","13.6876","0.0004","8.5767","0.0003","14.5354","0.0004","90","","93.627","0.002","90","","1702.96","0.09","120","0.2","120","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(dimethylsilyl)(dimethylchlorosilyl)niobocene hydrid","bis(cyclopentadienyl)(dimethylsilyl) (dimethylchlorosilyl)(hydrido) niobium (V)","","- C14 H24 Cl Nb Si2 -","- C14 H24 Cl Nb Si2 -","- C56 H96 Cl4 Nb4 Si8 -","4","1","","Konstantin Yu. Dorogov; Muhammed Yousufuddin; Nam-Nhat Ho; Andrei V. Churakov; Lyudmila G. Kuzmina; Arthur J. Schultz; Sax A. Mason; Judith A. K. Howard; Dmitry A. Lemenovskii; Robert Bau; Georgii I. Nikonov","Syntheses and Structures of Asymmetric Bis(silyl) Niobocene Hydrides","Inorganic Chemistry","2007","46","","147","160","10.1021/ic061314b","","","0.71073","MoKα","","0.0266","0.0247","","","0.0677","0.0691","","","","","","1.155","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306957","14.9449","0.0005","8.933","0.0003","26.0528","0.0009","90","","99.408","0.002","90","","3431.3","0.2","120","0.2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","(dimethylsilyl)(dimethylbromosilyl)niobocene hydrid","bis(cyclopentadienyl)(dimethylsilyl) (dimethylbromosilyl)(hydrido) niobium (V)","","- C14 H24 Br Nb Si2 -","- C14 H24 Br Nb Si2 -","- C112 H192 Br8 Nb8 Si16 -","8","1","","Konstantin Yu. Dorogov; Muhammed Yousufuddin; Nam-Nhat Ho; Andrei V. Churakov; Lyudmila G. Kuzmina; Arthur J. Schultz; Sax A. Mason; Judith A. K. Howard; Dmitry A. Lemenovskii; Robert Bau; Georgii I. Nikonov","Syntheses and Structures of Asymmetric Bis(silyl) Niobocene Hydrides","Inorganic Chemistry","2007","46","","147","160","10.1021/ic061314b","","","0.71073","MoKα","","0.1004","0.065","","0.169","0.1535","","","","1.183","1.28","1.28","","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306958","15.0574","0.001","8.9249","0.0005","26.0929","0.0018","90","","98.113","0.002","90","","3471.4","0.4","123","2","120","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","(dimethylsilyl)(dimethyliodosilyl)niobocene hydrid","bis(cyclopentadienyl)(dimethylsilyl) (dimethyliodosilyl)(hydrido) niobium (V)","","- C14 H24 I Nb Si2 -","- C14 H24 I Nb Si2 -","- C112 H192 I8 Nb8 Si16 -","8","1","","Konstantin Yu. Dorogov; Muhammed Yousufuddin; Nam-Nhat Ho; Andrei V. Churakov; Lyudmila G. Kuzmina; Arthur J. Schultz; Sax A. Mason; Judith A. K. Howard; Dmitry A. Lemenovskii; Robert Bau; Georgii I. Nikonov","Syntheses and Structures of Asymmetric Bis(silyl) Niobocene Hydrides","Inorganic Chemistry","2007","46","","147","160","10.1021/ic061314b","","","0.71073","MoKα","","0.0314","0.025","","","0.0669","0.0703","","","","","","1.004","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306959","13.7575","0.0004","8.2799","0.0002","16.7677","0.0005","90","","101.738","0.001","90","","1870.08","0.09","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(dimethyliodosilyl)(trimethylsilyl)niobocene hydrid","bis(cyclopentadienyl)(dimethyliodosilyl) (trimethylsilyl)(hydrido) niobium (V)","","- C15 H26 I Nb Si2 -","- C15 H26 I Nb Si2 -","- C60 H104 I4 Nb4 Si8 -","4","1","","Konstantin Yu. Dorogov; Muhammed Yousufuddin; Nam-Nhat Ho; Andrei V. Churakov; Lyudmila G. Kuzmina; Arthur J. Schultz; Sax A. Mason; Judith A. K. Howard; Dmitry A. Lemenovskii; Robert Bau; Georgii I. Nikonov","Syntheses and Structures of Asymmetric Bis(silyl) Niobocene Hydrides","Inorganic Chemistry","2007","46","","147","160","10.1021/ic061314b","","","0.71073","MoKα","","0.0306","0.024","","","0.0528","0.0547","","","","","","1.036","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306960","14.6577","0.0005","9.0181","0.0003","25.8731","0.0009","90","","99.76","0.001","90","","3370.5","0.2","120","0.2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","(dimethylchlorosilyl)(dimethylfluorosilyl)niobocene hydrid","bis(cyclopentadienyl)(dimethylchlorosilyl) (dimethylfluorosilyl)(hydrido) niobium (V)","","- C14 H23 Cl F Nb Si2 -","- C14 H23 Cl F Nb Si2 -","- C112 H184 Cl8 F8 Nb8 Si16 -","8","1","","Konstantin Yu. Dorogov; Muhammed Yousufuddin; Nam-Nhat Ho; Andrei V. Churakov; Lyudmila G. Kuzmina; Arthur J. Schultz; Sax A. Mason; Judith A. K. Howard; Dmitry A. Lemenovskii; Robert Bau; Georgii I. Nikonov","Syntheses and Structures of Asymmetric Bis(silyl) Niobocene Hydrides","Inorganic Chemistry","2007","46","","147","160","10.1021/ic061314b","","","0.71073","MoKα","","0.0493","0.0355","","","0.069","0.0727","","","","","","1.058","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306961","14.994","0.0004","8.9459","0.0002","25.9221","0.0007","90","","99.387","0.001","90","","3430.5","0.15","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","(dimethylfluorosilyl)(dimethylbromosilyl)niobocene hydrid","bis(cyclopentadienyl)(dimethylfluorosilyl) (dimethylbromosilyl)(hydrido) niobium (V)","","- C14 H23 Br1.08 F0.92 Nb Si2 -","- C14 H23 Br F0.953 Nb Si2 -","- C112 H184 Br8 F7.624 Nb8 Si16 -","8","1","","Konstantin Yu. Dorogov; Muhammed Yousufuddin; Nam-Nhat Ho; Andrei V. Churakov; Lyudmila G. Kuzmina; Arthur J. Schultz; Sax A. Mason; Judith A. K. Howard; Dmitry A. Lemenovskii; Robert Bau; Georgii I. Nikonov","Syntheses and Structures of Asymmetric Bis(silyl) Niobocene Hydrides","Inorganic Chemistry","2007","46","","147","160","10.1021/ic061314b","","","0.71073","MoKα","","0.0534","0.0442","","","0.096","0.1002","","","","","","1.077","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306962","15.1427","0.001","8.9369","0.001","26.143","0.002","90","","98.304","0.002","90","","3500.8","0.5","133","2","133","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","(dimethylfluorosilyl)(dimethyliodosilyl)niobocene hydrid","bis(cyclopentadienyl)(dimethylfluorosilyl) (dimethyliodosilyl)(hydrido) niobium (V)","","- C14 H22 F I Nb Si2 -","- C14 H22 F I Nb Si2 -","- C112 H176 F8 I8 Nb8 Si16 -","8","1","","Konstantin Yu. Dorogov; Muhammed Yousufuddin; Nam-Nhat Ho; Andrei V. Churakov; Lyudmila G. Kuzmina; Arthur J. Schultz; Sax A. Mason; Judith A. K. Howard; Dmitry A. Lemenovskii; Robert Bau; Georgii I. Nikonov","Syntheses and Structures of Asymmetric Bis(silyl) Niobocene Hydrides","Inorganic Chemistry","2007","46","","147","160","10.1021/ic061314b","","","0.71073","MoKα","","0.0339","0.0292","","","0.0703","0.0719","","","","","","1.029","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306963","16.6006","0.0005","13.1582","0.0004","8.4922","0.0002","90","","90","","90","","1854.99","0.09","123","2","123","2","","","","","","","","6","P n m a","-P 2ac 2n","62","(dimethylbromosilyl)(dimethylchlorosilyl)niobocene hydrid","bis(cyclopentadienyl)(dimethylbromosilyl) (dimethylchlorosilyl)(hydrido) niobium (V)","","- C14 H23 Br Cl Nb Si2 -","- C14 H23 Br0.9526 Cl1.0474 Nb Si2 -","- C56 H92 Br3.8104 Cl4.1896 Nb4 Si8 -","4","0.5","","Konstantin Yu. Dorogov; Muhammed Yousufuddin; Nam-Nhat Ho; Andrei V. Churakov; Lyudmila G. Kuzmina; Arthur J. Schultz; Sax A. Mason; Judith A. K. Howard; Dmitry A. Lemenovskii; Robert Bau; Georgii I. Nikonov","Syntheses and Structures of Asymmetric Bis(silyl) Niobocene Hydrides","Inorganic Chemistry","2007","46","","147","160","10.1021/ic061314b","","","0.71073","MoKα","","0.0228","0.0176","","","0.0404","0.0419","","","","","","1.029","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306964","8.6829","0.0002","16.902","0.0004","13.1647","0.0002","90","","90","","90","","1932.03","0.07","120","0.2","100","2","","","","","","","","6","P b n m","-P 2c 2ab","62","(dimethylbromosilyl)(dimethyliodosilyl)niobocene hydrid","bis(cyclopentadienyl)(dimethylbromosilyl) (dimethyliodosilyl)(hydrido) niobium (V)","","- C14 H23 Br I Nb Si2 -","- C14 H23 Br I Nb Si2 -","- C56 H92 Br4 I4 Nb4 Si8 -","4","0.5","","Konstantin Yu. Dorogov; Muhammed Yousufuddin; Nam-Nhat Ho; Andrei V. Churakov; Lyudmila G. Kuzmina; Arthur J. Schultz; Sax A. Mason; Judith A. K. Howard; Dmitry A. Lemenovskii; Robert Bau; Georgii I. Nikonov","Syntheses and Structures of Asymmetric Bis(silyl) Niobocene Hydrides","Inorganic Chemistry","2007","46","","147","160","10.1021/ic061314b","","","0.71073","MoKα","","0.0289","0.0231","","","0.0514","0.0534","","","","","","1.103","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306965","11.8284","0.001","26.167","0.002","18.98","0.0012","90","","127.331","0.004","90","","4671.1","0.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[V4(H2O)8(m-OOCCF3)4(m-OH)4]Cl4 (1)","","","- C8 H35 Cl4 F12 O27.5 V4 -","- C8 H20 Cl4 F12 O20 V4 -","- C32 H80 Cl16 F48 O80 V16 -","4","1","","Riya Mukherjee; Brenda A. Dougan; Fiona H. Fry; Scott D. Bunge; Christopher J. Ziegler; Nicola E. Brasch","Structural and Spectroscopic Evidence for the Formation of Trinuclear and Tetranuclear Vanadium(III)/Carboxylate Complexes of Acetate and Related Derivatives in Aqueous Solution","Inorganic Chemistry","2007","46","","1575","1585","10.1021/ic0613210","","","0.71073","MoKα","","0.0865","0.0654","","","0.1349","0.1425","","","","","","1.098","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306966","11.0342","0.0018","11.3901","0.0019","14.607","0.002","67.527","0.003","70.775","0.003","66.979","0.003","1526","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","[V3(m3-O)(m-OOCCH2CH3)6(H2O)3]Cl*2H2O (5)","","","- C18 H40 Cl O18 V3 -","- C18 H25 Cl O16 V3 -","- C36 H50 Cl2 O32 V6 -","2","1","","Riya Mukherjee; Brenda A. Dougan; Fiona H. Fry; Scott D. Bunge; Christopher J. Ziegler; Nicola E. Brasch","Structural and Spectroscopic Evidence for the Formation of Trinuclear and Tetranuclear Vanadium(III)/Carboxylate Complexes of Acetate and Related Derivatives in Aqueous Solution","Inorganic Chemistry","2007","46","","1575","1585","10.1021/ic0613210","","","0.71073","MoKα","","0.0491","0.0386","","","0.0981","0.1084","","","","","","0.427","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306967","13.699","0.004","14.218","0.004","18.674","0.006","90","","107.652","0.007","90","","3465.9","1.8","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","[V3(m3-O)(m-OOCCH2Br)6(OH2)3][CF3SO3]H2O (4)","","","- C13 H20 Br6 F3 O20 S V3 -","- C13 H14 Br6 F3 O20 S V3 -","- C52 H56 Br24 F12 O80 S4 V12 -","4","1","","Riya Mukherjee; Brenda A. Dougan; Fiona H. Fry; Scott D. Bunge; Christopher J. Ziegler; Nicola E. Brasch","Structural and Spectroscopic Evidence for the Formation of Trinuclear and Tetranuclear Vanadium(III)/Carboxylate Complexes of Acetate and Related Derivatives in Aqueous Solution","Inorganic Chemistry","2007","46","","1575","1585","10.1021/ic0613210","","","0.71073","MoKα","","0.1081","0.0798","","","0.2252","0.24","","","","","","1.602","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306968","13.4904","0.0012","14.0237","0.0012","18.0199","0.0016","90","","107.065","0.002","90","","3259","0.5","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","[V3(m3-O)(m-OOCCH2Cl)6(H2O)3][CF3SO3]H2O (7)","","","- C13 H20 Cl6 F3 O20 S V3 -","- C13 H12 Cl6 F3 O19 S V3 -","- C52 H48 Cl24 F12 O76 S4 V12 -","4","2","","Riya Mukherjee; Brenda A. Dougan; Fiona H. Fry; Scott D. Bunge; Christopher J. Ziegler; Nicola E. Brasch","Structural and Spectroscopic Evidence for the Formation of Trinuclear and Tetranuclear Vanadium(III)/Carboxylate Complexes of Acetate and Related Derivatives in Aqueous Solution","Inorganic Chemistry","2007","46","","1575","1585","10.1021/ic0613210","","","0.71073","MoKα","","0.1512","0.0751","","","0.1582","0.1946","","","","","","0.83","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306969","9.602","0.01","17.119","0.005","7.339","0.005","90","","109.437","0.013","90","","1137.6","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 Cl2 N2 Pt -","- C12 H8 Cl2 N2 Pt -","- C48 H32 Cl8 N8 Pt4 -","4","1","","Adam L. Grzesiak; Adam J. Matzger","Selection and Discovery of Polymorphs of Platinum Complexes Facilitated by Polymer-Induced Heteronucleation","Inorganic Chemistry","2007","46","","453","457","10.1021/ic061323k","","","0.71073","MoKα","","0.0545","0.0358","","","0.0827","0.0881","","","","","","0.98","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306970","18.257","0.01","9.167","0.005","6.866","0.004","90","","90","","90","","1149.1","1.1","123","2","123","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C12 H8 Cl2 N2 Pt -","- C12 H8 Cl2 N2 Pt -","- C48 H32 Cl8 N8 Pt4 -","4","1","","Adam L. Grzesiak; Adam J. Matzger","Selection and Discovery of Polymorphs of Platinum Complexes Facilitated by Polymer-Induced Heteronucleation","Inorganic Chemistry","2007","46","","453","457","10.1021/ic061323k","","","0.71073","MoKα","","0.034","0.0251","","","0.0561","0.0585","","","","","","1.104","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306971","24.8884","0.0002","14.9206","0.0002","20.5194","0.0002","90","","125.443","0.001","90","","6207.86","0.14","115","2","115","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C76 H78 N8 O Zn2 -","- C76 H78 N8 O Zn2 -","- C304 H312 N32 O4 Zn8 -","4","1","","Claude P. Gros; Frédéric Brisach; Anastasia Meristoudi; Enrique Espinosa; Roger Guilard; Pierre D. Harvey","Modulation of the Singlet-Singlet Through-Space Energy Transfer Rates in Cofacial Bisporphyrin and Porphyrin-Corrole Dyads","Inorganic Chemistry","2007","46","","125","135","10.1021/ic0613558","","","0.71069","MoKα","","0.0486","0.0338","","","0.0794","0.0868","","","","","","1.017","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306972","24.828","0.0003","14.9492","0.0002","20.3763","0.0003","90","","124.285","0.001","90","","6248.77","0.16","115","2","115","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C76 H80 N8 O Zn -","- C76 H78 N8 O Zn -","- C304 H312 N32 O4 Zn4 -","4","1","","Claude P. Gros; Frédéric Brisach; Anastasia Meristoudi; Enrique Espinosa; Roger Guilard; Pierre D. Harvey","Modulation of the Singlet-Singlet Through-Space Energy Transfer Rates in Cofacial Bisporphyrin and Porphyrin-Corrole Dyads","Inorganic Chemistry","2007","46","","125","135","10.1021/ic0613558","","","0.71069","MoKα","","0.0673","0.0496","","","0.1164","0.1251","","","","","","1.063","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306973","15.205","0.003","8.952","0.0018","26.552","0.005","90","","91.49","0.03","90","","3612.9","1.2","253","2","253","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H32 Cl2 N2 S4 Zn -","- C37 H32 Cl2 N2 S4 Zn -","- C148 H128 Cl8 N8 S16 Zn4 -","4","1","","Tung-Wan Ngan; Chi-Chiu Ko; Nianyong Zhu; Vivian Wing-Wah Yam","Syntheses, Luminescence Switching, and Electrochemical Studies of Photochromic Dithienyl-1,10-phenanthroline Zinc(II) Bis(thiolate) Complexes","Inorganic Chemistry","2007","46","","1144","1152","10.1021/ic061359c","","","0.71073","MoKα","","0.0776","0.0376","","","0.0765","0.0828","","","","","","0.847","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306974","25.168","0.005","14.457","0.003","17.048","0.003","90","","91.28","0.03","90","","6201","2","301","2","301","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H26 N2 S4 Zn -","- C34 H26 N2 S4 Zn -","- C272 H208 N16 S32 Zn8 -","8","2","","Tung-Wan Ngan; Chi-Chiu Ko; Nianyong Zhu; Vivian Wing-Wah Yam","Syntheses, Luminescence Switching, and Electrochemical Studies of Photochromic Dithienyl-1,10-phenanthroline Zinc(II) Bis(thiolate) Complexes","Inorganic Chemistry","2007","46","","1144","1152","10.1021/ic061359c","","","0.71073","MoKα","","0.0864","0.0422","","","0.0956","0.1039","","","","","","0.883","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306975","9.123","0.004","15.099","0.006","18.519","0.007","69.01","0.009","86.773","0.009","76.679","0.009","2316.6","1.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H55 N3 O4 Pd3 S -","- C51 H55 N3 O4 Pd3 S -","- C102 H110 N6 O8 Pd6 S2 -","2","1","","Rut Benavente; Pablo Espinet; José M. Martín-Álvarez; Jesús A. Miguel; Gabriel Aullón","Genuine Examples of Tetrahedral Tetradentate Sulfide Ligand Bridging Four Pd Atoms: Controlled Formation of [(μ4-S){(μ2-X)Pd2(C^N)2}2] (X = OH or Cl; HC^N =p-C2H5OC6H4CHNC6H4-p-C2H5) Complexes","Inorganic Chemistry","2007","46","","2035","2040","10.1021/ic061367t","","","0.71073","MoKα","","0.0512","0.0348","","","0.086","0.1012","","","","","","1.002","","","","has coordinates","258736","2020-11-05","08:57:04",""
"4306976","10.4576","0.0017","13.229","0.002","23.965","0.004","85.723","0.003","81.829","0.004","72.474","0.004","3127.6","0.9","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H64 N4 O6 Pd4 S -","- C68 H64 N4 O6 Pd4 S -","- C136 H128 N8 O12 Pd8 S2 -","2","1","","Rut Benavente; Pablo Espinet; José M. Martín-Álvarez; Jesús A. Miguel; Gabriel Aullón","Genuine Examples of Tetrahedral Tetradentate Sulfide Ligand Bridging Four Pd Atoms: Controlled Formation of [(μ4-S){(μ2-X)Pd2(C^N)2}2] (X = OH or Cl; HC^N =p-C2H5OC6H4CHNC6H4-p-C2H5) Complexes","Inorganic Chemistry","2007","46","","2035","2040","10.1021/ic061367t","","","0.71073","MoKα","","0.0591","0.0368","","","0.0843","0.0982","","","","","","1.025","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306977","18.395","0.004","16.08","0.003","22.437","0.005","90","","104.752","0.005","90","","6418","2","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C68 H72 Cl2 N4 O4 Pd4 S -","- C68 H72 Cl2 N4 O4 Pd4 S -","- C272 H288 Cl8 N16 O16 Pd16 S4 -","4","1","","Rut Benavente; Pablo Espinet; José M. Martín-Álvarez; Jesús A. Miguel; Gabriel Aullón","Genuine Examples of Tetrahedral Tetradentate Sulfide Ligand Bridging Four Pd Atoms: Controlled Formation of [(μ4-S){(μ2-X)Pd2(C^N)2}2] (X = OH or Cl; HC^N =p-C2H5OC6H4CHNC6H4-p-C2H5) Complexes","Inorganic Chemistry","2007","46","","2035","2040","10.1021/ic061367t","","","0.71073","MoKα","","0.0843","0.0382","","","0.0927","0.1294","","","","","","1.003","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306978","10.177","0.007","11.416","0.012","11.033","0.003","90","","110.72","0.05","90","","1198.9","1.6","298","2","298","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","catena-tetrakis(N,N'-pyrimidin-2-olate)-biscopper(ii)-potassium nitrate- -hydrate-methanol solvate","","- C8.5 H9 Cu K0.5 N4.5 O4.5 -","- C8.5 H6 Cu K0.5 N4.5 O4.5 -","- C34 H24 Cu4 K2 N18 O18 -","4","1","","Jorge A. R. Navarro; Elisa Barea; Juan M. Salas; Norberto Masciocchi; Simona Galli; Angelo Sironi","Structural and Magnetic Properties of Layered Copper(II) Coordination Polymers Intercalating s and f Metal Ions","Inorganic Chemistry","2007","46","","2988","2997","10.1021/ic061384i","","","0.71073","MoKα","","0.0991","0.0877","","","0.2132","0.2199","","","","","","1.211","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306979","19.0696","0.0014","11.0596","0.0008","11.4266","0.0009","90","","90","","90","","2409.9","0.3","298","2","298","2","","","","","","","","6","P n a m","-P 2c 2n","62","","catena-tetrakis(N,N'-pyrimidin-2-olate)-biscopper(ii)-rubidium nitrate- -hydrate-methanol solvate","","- C8.5 H9 Cu N4.5 O4.5 Rb0.5 -","- C8.5 H5 Cu N4.417 O4.168 Rb0.417 -","- C68 H40 Cu8 N35.336 O33.344 Rb3.336 -","8","1","","Jorge A. R. Navarro; Elisa Barea; Juan M. Salas; Norberto Masciocchi; Simona Galli; Angelo Sironi","Structural and Magnetic Properties of Layered Copper(II) Coordination Polymers Intercalating s and f Metal Ions","Inorganic Chemistry","2007","46","","2988","2997","10.1021/ic061384i","","","0.71073","MoKα","","0.1133","0.0788","","","0.2081","0.2436","","","","","","1.112","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306980","19.044","0.002","11.037","0.001","11.451","0.003","90","","90","","90","","2406.9","0.7","298","2","298","2","","","","","","","","6","P n a m","-P 2c 2n","62","","catena-tetrakis(N,N'-pyrimidin-2-olate)-biscopper(ii)-tallium nitrate- -methanol solvate","","- C8.5 H8 Cu N4.5 O4 Tl0.5 -","- C8.5 H6 Cu N4.408 O3.724 Tl0.408 -","- C68 H48 Cu8 N35.264 O29.792 Tl3.264 -","8","1","","Jorge A. R. Navarro; Elisa Barea; Juan M. Salas; Norberto Masciocchi; Simona Galli; Angelo Sironi","Structural and Magnetic Properties of Layered Copper(II) Coordination Polymers Intercalating s and f Metal Ions","Inorganic Chemistry","2007","46","","2988","2997","10.1021/ic061384i","","","0.71073","MoKα","","0.1019","0.0622","","","0.1423","0.1622","","","","","","1.073","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4306981","11.808","0.0002","13.364","0.0003","13.728","0.0003","70.246","0.001","67.28","0.001","71.364","0.001","1835.5","0.07","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H104 Cl12 Mn7 N6 O12 -","- C49.998 H102 Cl12 Mn7 N6 O12 -","- C49.998 H102 Cl12 Mn7 N6 O12 -","1","0.5","","Rolf W. Saalfrank; Andreas Scheurer; Raju Prakash; Frank W. Heinemann; Takayuki Nakajima; Frank Hampel; Roland Leppin; Bernd Pilawa; Holger Rupp; Paul Müller","Synthesis, Redox, and Magnetic Properties of a Neutral, Mixed-Valent Heptanuclear Manganese Wheel with S= 27/2 High-Spin Ground State,","Inorganic Chemistry","2007","46","","1586","1592","10.1021/ic0614059","","","0.71073","MoKα","","0.0467","0.0367","","","0.0965","0.1033","","","","","","1.01","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306982","11.531","0.001","13.297","0.002","13.464","0.002","70.16","0.007","81.607","0.004","89.674","0.006","1918.9","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H126 Cl6 Mn7 N6 O15 -","- C60 H118 Cl6 Mn7 N6 O15 -","- C60 H118 Cl6 Mn7 N6 O15 -","1","0.5","","Rolf W. Saalfrank; Andreas Scheurer; Raju Prakash; Frank W. Heinemann; Takayuki Nakajima; Frank Hampel; Roland Leppin; Bernd Pilawa; Holger Rupp; Paul Müller","Synthesis, Redox, and Magnetic Properties of a Neutral, Mixed-Valent Heptanuclear Manganese Wheel with S= 27/2 High-Spin Ground State,","Inorganic Chemistry","2007","46","","1586","1592","10.1021/ic0614059","","","0.71073","MoKα","","0.0567","0.0301","","","0.0721","0.0818","","","","","","1.057","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306983","12.852","0.002","13.046","0.002","13.196","0.003","65.167","0.004","76.711","0.005","79.219","0.005","1943.9","0.6","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C66 H52 Cl6 Cu3 N24 O2 -","- C66 H52.002 Cl6 Cu3 N24 O2.001 -","- C66 H52.002 Cl6 Cu3 N24 O2.001 -","1","1","","Jingwen Chen; Xiaoyong Wang; Ying Shao; Jianhui Zhu; Yangguang Zhu; Yizhi Li; Qiang Xu; Zijian Guo","A Trinuclear Copper(II) Complex of 2,4,6-Tris(di-2-pyridylamine)-1,3,5-triazine Shows Prominent DNA Cleavage Activity","Inorganic Chemistry","2007","46","","3306","3312","10.1021/ic0614162","","","0.71073","MoKα","","0.0652","0.055","","","0.1267","0.1299","","","","","","1.047","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306984","10.927","0.002","11.573","0.002","19.952","0.004","90","","90","","90","","2523.1","0.8","","","100","2","","","","","","","","4","I m m 2","I 2 -2","44","","","","- Ge K10 Nb14 O50 -","- Ge K8.76 Nb14 O53 -","- Ge2 K17.52 Nb28 O106 -","2","0.25","","May Nyman; James P. Larentzos; Edward J. Maginn; Margaret E. Welk; David Ingersoll; Hyunsoo Park; John B. Parise; Ivor Bull; François Bonhomme","Experimental and Theoretical Methods to Investigate Extraframework Species in a Layered Material of Dodecaniobate Anions","Inorganic Chemistry","2007","46","","2067","2079","10.1021/ic061454l","","x-ray","0.49595","synchrotron","","0.0543","0.0543","","","0.1493","0.1493","","","","","","1.086","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306985","23.0103","0.0009","20.1843","0.0008","46.1854","0.0018","90","","98.535","0.002","90","","21213.1","1.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[K(18-crown-6)][Fe(TMP)(CN)2]","","","- C230.4 H270.6 Fe3 K3 N18 O24 -","- C230.4 H266.8 Fe3 K3 N18 O24 -","- C921.6 H1067.2 Fe12 K12 N72 O96 -","4","1","","Jianfeng Li; Bruce C. Noll; Charles E. Schulz; W. Robert Scheidt","New Insights on the Electronic and Molecular Structure of Cyanide-Ligated Iron(III) Porphyrinates","Inorganic Chemistry","2007","46","","2286","2298","10.1021/ic061463u","","","0.71073","MoKα","","0.0992","0.0789","","","0.1979","0.21","","","","","","1.1","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4306986","20.7612","0.0003","9.7535","0.0001","26.5363","0.0004","90","","121.109","0.001","90","","4600.67","0.12","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Fe(TPP)(CN)(1-MeIm)]","","","- C54 H41 Cl3 Fe N9 -","- C54 H41 Cl3 Fe N9 -","- C216 H164 Cl12 Fe4 N36 -","4","1","","Jianfeng Li; Bruce C. Noll; Charles E. Schulz; W. Robert Scheidt","New Insights on the Electronic and Molecular Structure of Cyanide-Ligated Iron(III) Porphyrinates","Inorganic Chemistry","2007","46","","2286","2298","10.1021/ic061463u","","","0.71073","MoKα","","0.0765","0.0462","","","0.1281","0.138","","","","","","1.111","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306987","13.1214","0.0002","23.5538","0.0004","14.0324","0.0002","90","","102.606","0.001","90","","4232.29","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[Fe(TPP)(CN)(Py)]0.4Py 0.25Py","","","- C53.25 H36.25 Fe N6.65 -","- C53.25 H36.25 Fe N6.65 -","- C213 H145 Fe4 N26.6 -","4","1","","Jianfeng Li; Bruce C. Noll; Charles E. Schulz; W. Robert Scheidt","New Insights on the Electronic and Molecular Structure of Cyanide-Ligated Iron(III) Porphyrinates","Inorganic Chemistry","2007","46","","2286","2298","10.1021/ic061463u","","","0.71073","MoKα","","0.0543","0.0515","","","0.1511","0.1531","","","","","","1.044","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306988","16.4839","0.0002","17.696","0.0003","20.0081","0.0003","90","","99.032","0.001","90","","5763.98","0.15","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Fe(TMP)(CN)(1-MeIm)]","","","- C62.8 H59.8 Cl5.4 Fe N7 -","- C62.8 H59.3 Cl5.4 Fe N7 -","- C251.2 H237.2 Cl21.6 Fe4 N28 -","4","1","","Jianfeng Li; Bruce C. Noll; Charles E. Schulz; W. Robert Scheidt","New Insights on the Electronic and Molecular Structure of Cyanide-Ligated Iron(III) Porphyrinates","Inorganic Chemistry","2007","46","","2286","2298","10.1021/ic061463u","","","0.71073","MoKα","","0.0896","0.0513","","","0.1221","0.1292","","","","","","0.923","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4306989","11.4905","0.0015","11.7732","0.0015","17.234","0.002","90","","102.564","0.002","90","","2275.6","0.5","100","0.1","100","0.1","","","","","","","","7","P 1 21 1","P 2yb","4","eisaa01","","","- C46 H32 F6 Ir O2 P2 Sb -","- C46 H32 F6 Ir O2 P2 Sb -","- C92 H64 F12 Ir2 O4 P4 Sb2 -","2","1","","Abdurrahman Ç. Atesin; Simon B. Duckett; Christine Flaschenriem; William W. Brennessel; Richard Eisenberg","Diastereoselective Oxidative Addition of Dihydrogen to IrI(CO)((R)-BINAP) and [Ir(CO)2((R)-BINAP)][SbF6]","Inorganic Chemistry","2007","46","","1196","1204","10.1021/ic061471a","","","0.71073","MoKα","","0.0438","0.0343","","","0.0796","0.0825","","","","","","1.013","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306990","12.0023","0.001","12.0023","0.001","26.132","0.004","90","","90","","90","","3764.5","0.7","100","0.1","100","0.1","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","eisaa03","","","- C45 H32 I Ir O P2 -","- C45 H32 I Ir O P2 -","- C180 H128 I4 Ir4 O4 P8 -","4","0.5","","Abdurrahman Ç. Atesin; Simon B. Duckett; Christine Flaschenriem; William W. Brennessel; Richard Eisenberg","Diastereoselective Oxidative Addition of Dihydrogen to IrI(CO)((R)-BINAP) and [Ir(CO)2((R)-BINAP)][SbF6]","Inorganic Chemistry","2007","46","","1196","1204","10.1021/ic061471a","","","0.71073","MoKα","","0.0729","0.0353","","","0.0598","0.0689","","","","","","1.01","","","","has coordinates,has disorder","179107","2020-10-21","18:00:00",""
"4306991","10.955","0.001","14.075","0.001","40.522","0.004","90","","90","","90","","6248.2","1","293","","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C22 H38 Cl2 N6 O12 Zn2 -","- C22 H34 Cl2 N6 O12 Zn2 -","- C176 H272 Cl16 N48 O96 Zn16 -","8","1","","Gianluca Ambrosi; Mauro Formica; Vieri Fusi; Luca Giorgi; Annalisa Guerri; Mauro Micheloni; Paola Paoli; Roberto Pontellini; Patrizia Rossi","Modulating the M-M Distance in Dinuclear Complexes. New Ligand with a 2,2'-Biphenol Fragment as Key Unit: Synthesis, Coordination Behavior, and Crystal Structures of Cu(II) and Zn(II) Dinuclear Complexes","Inorganic Chemistry","2007","46","","309","320","10.1021/ic061474n","","","1.54184","CuKα","","0.1591","0.0777","","","0.1974","0.2545","","","","","","0.895","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306992","7.5752","0.0008","12.311","0.0004","16.698","0.002","90","","93.465","0.006","90","","1554.4","0.3","293","","293","","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C22 H38 Cl2 Cu2 N6 O12 -","- C22 H28 Cl2 Cu2 N6 O12 -","- C44 H56 Cl4 Cu4 N12 O24 -","2","1","","Gianluca Ambrosi; Mauro Formica; Vieri Fusi; Luca Giorgi; Annalisa Guerri; Mauro Micheloni; Paola Paoli; Roberto Pontellini; Patrizia Rossi","Modulating the M-M Distance in Dinuclear Complexes. New Ligand with a 2,2'-Biphenol Fragment as Key Unit: Synthesis, Coordination Behavior, and Crystal Structures of Cu(II) and Zn(II) Dinuclear Complexes","Inorganic Chemistry","2007","46","","309","320","10.1021/ic061474n","","","1.5418","CuKα","","0.1215","0.0565","","","0.1377","0.1653","","","","","","0.887","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306993","8.467","0.005","11.6","0.007","27.87","0.016","90","","90","","90","","2737","3","110","2","110","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C20 H40 Br Cu N4 Ni2 O4 S4 -","- C20 H40 Br Cu N4 Ni2 O4 S4 -","- C80 H160 Br4 Cu4 N16 Ni8 O16 S16 -","4","1","","Stephen P. Jeffery; Michael L. Singleton; Joseph H. Reibenspies; Marcetta Y. Darensbourg","Control of S-Based Aggregation: Designed Synthesis of NiM2 and Ni2M Trinuclear Complexes","Inorganic Chemistry","2007","46","","179","185","10.1021/ic061475f","","","0.71073","MoKα","","0.1353","0.077","","","0.1451","0.1682","","","","","","1.019","","","","has coordinates","255805","2020-10-21","18:00:00",""
"4306994","10.4829","0.0007","10.5887","0.0007","13.7992","0.0008","106.304","0.005","96.606","0.004","112.242","0.004","1317.83","0.16","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H20 N2 Ni O10 S2 W2 -","- C20 H20 N2 Ni O10 S2 W2 -","- C40 H40 N4 Ni2 O20 S4 W4 -","2","1","","Stephen P. Jeffery; Michael L. Singleton; Joseph H. Reibenspies; Marcetta Y. Darensbourg","Control of S-Based Aggregation: Designed Synthesis of NiM2 and Ni2M Trinuclear Complexes","Inorganic Chemistry","2007","46","","179","185","10.1021/ic061475f","","","1.54178","CuKα","","0.0562","0.0376","","","0.0849","0.0942","","","","","","1.079","","","","has coordinates","258736","2020-11-05","08:57:04",""
"4306995","7.4188","0.0013","13.712","0.002","20.111","0.004","90","","94.62","0.003","90","","2039.2","0.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","N-2W(CO)5","","","- C15 H20 N2 Ni O7 S2 W -","- C15 H20 N2 Ni O7 S2 W -","- C60 H80 N8 Ni4 O28 S8 W4 -","4","1","","Stephen P. Jeffery; Michael L. Singleton; Joseph H. Reibenspies; Marcetta Y. Darensbourg","Control of S-Based Aggregation: Designed Synthesis of NiM2 and Ni2M Trinuclear Complexes","Inorganic Chemistry","2007","46","","179","185","10.1021/ic061475f","","","0.71073","MoKα","","0.0616","0.0496","","","0.1122","0.1192","","","","","","1.047","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306996","6.8016","0.0015","4.7123","0.001","14.614","0.003","90","","97.089","0.003","90","","464.82","0.17","153","2","153","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- B4 Cu3 O11 Pb2 -","- B4 Cu3 O11 Pb2 -","- B8 Cu6 O22 Pb4 -","2","0.5","","Shilie Pan; Byron Watkins; Jared P. Smit; Michael R. Marvel; Ian Saratovsky; Kenneth R. Poeppelmeier","Structure and Magnetic Properties of Pb2Cu3B4O11: a New Copper Borate Featuring [Cu3O8]10- Units","Inorganic Chemistry","2007","46","","3851","3855","10.1021/ic0614824","","","0.71073","MoKα","","0.0386","0.0345","","","0.094","0.0965","","","","","","1.12","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306997","9.864","0.004","15.393","0.008","7.995","0.004","90","","110.32","0.03","90","","1138.4","1","297","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C16 H32 Cu N8 Ni O2 -","- C16 H28 Cu N8 Ni O2 -","- C32 H56 Cu2 N16 Ni2 O4 -","2","1","","Jean-Sébastien M. Lehn; Saba Javed; David M. Hoffman","Synthesis of Zirconium, Hafnium, and Tantalum Complexes with Sterically Demanding Hydrazide Ligands","Inorganic Chemistry","2007","46","","993","1000","10.1021/ic061483w","","","0.71073","MoKα","","0.0588","0.0392","","","0.1049","0.1214","","","","","","0.885","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306998","9.899","0.003","15.541","0.004","8.102","0.002","90","","111.02","0.02","90","","1163.5","0.6","297","2","297","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C16 H32 Cu N8 O2 Pt -","- C16 H28 Cu N8 O2 Pt -","- C32 H56 Cu2 N16 O4 Pt2 -","2","1","","Jean-Sébastien M. Lehn; Saba Javed; David M. Hoffman","Synthesis of Zirconium, Hafnium, and Tantalum Complexes with Sterically Demanding Hydrazide Ligands","Inorganic Chemistry","2007","46","","993","1000","10.1021/ic061483w","","","0.71073","MoKα","","0.0339","0.0278","","","0.0785","0.0869","","","","","","0.769","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4306999","12.341","0.002","26.649","0.004","10.6206","0.0017","90","","96.753","0.003","90","","3468.6","0.9","189","2","189","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 Ce N7 O11 -","- C36 H30 Ce N7 O11 -","- C144 H120 Ce4 N28 O44 -","4","1","","Michael Seitz; Michael D. Pluth; Kenneth N. Raymond","1,2-HOIQO a Highly Versatile 1,2-HOPO Analogue","Inorganic Chemistry","2007","46","","351","353","10.1021/ic0614869","","","0.71073","MoKα","","0.0997","0.0505","","","0.0983","0.107","","","","","","0.887","","","","has coordinates","179107","2020-10-21","18:00:00",""
"4307000","7.473","0.002","7.939","0.003","10.195","0.003","73.012","0.005","69.945","0.005","68.208","0.004","518.1","0.3","155","2","155","2","","","","","","","","4","P -1","-P 1","2","","5-Nitro-isocoumarin-3-carboxylic acid methyl ester","","- C11 H7 N O6 -","- C11 H7 N O6 -","- C22 H14 N2 O12 -","2","1","","Michael Seitz; Michael D. Pluth; Kenneth N. Raymond","1,2-HOIQO a Highly Versatile 1,2-HOPO Analogue","Inorganic Chemistry","2007","46","","351","353","10.1021/ic0614869","","","0.71073","MoKα","","0.071","0.0473","","","0.1216","0.1321","","","","","","0.99","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307001","15.8162","0.0002","12.9136","0.0002","16.8236","0.0002","90","","114.075","0.001","90","","3137.22","0.08","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C29 H21 Cl2 Cu N5 O10 S2 -","- C29 H21 Cl2 Cu N5 O10 S2 -","- C116 H84 Cl8 Cu4 N20 O40 S8 -","4","1","","John C. Jeffery; Thomas Riis-Johannessen; Callum J. Anderson; Christopher J. Adams; Adam Robinson; Stephen P. Argent; Michael D. Ward; Craig R. Rice","Localization and Delocalization in a Mixed-Valence Dicopper Helicate","Inorganic Chemistry","2007","46","","2417","2426","10.1021/ic061504m","","","1.54178","CuKα","","0.0355","0.0315","","","0.0826","0.0853","","","","","","1.034","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307002","18.7741","0.0008","19.6516","0.0008","17.3283","0.0008","90","","115.311","0.002","90","","5779.4","0.4","100","2","100","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C59 H42 Cu2 F12 N10 O2 P2 S4 -","- C57 H39 Cu2 F9 N9 O2 P1.5 S4 -","- C228 H156 Cu8 F36 N36 O8 P6 S16 -","4","1","","John C. Jeffery; Thomas Riis-Johannessen; Callum J. Anderson; Christopher J. Adams; Adam Robinson; Stephen P. Argent; Michael D. Ward; Craig R. Rice","Localization and Delocalization in a Mixed-Valence Dicopper Helicate","Inorganic Chemistry","2007","46","","2417","2426","10.1021/ic061504m","","","1.54178","CuKα","","0.0985","0.0567","","","0.1304","0.1455","","","","","","1.046","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307003","27.2491","0.0006","18.7615","0.0005","24.5663","0.0006","90","","121.939","0.001","90","","10657.8","0.5","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C56 H36.63 B3 Cu2 F12 N8 O0.25 S4 -","- C56 H36 B3 Cu2 F12 N8 O0.3 S4 -","- C448 H288 B24 Cu16 F96 N64 O2.4 S32 -","8","1","","John C. Jeffery; Thomas Riis-Johannessen; Callum J. Anderson; Christopher J. Adams; Adam Robinson; Stephen P. Argent; Michael D. Ward; Craig R. Rice","Localization and Delocalization in a Mixed-Valence Dicopper Helicate","Inorganic Chemistry","2007","46","","2417","2426","10.1021/ic061504m","","","1.54178","CuKα","","0.0444","0.0404","","","0.1121","0.1155","","","","","","1.046","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307004","9.257","0.002","13.092","0.003","22.265","0.005","90.74","0.03","98.33","0.03","101.94","0.03","2609.6","1.1","301","2","301","2","","","","","","","","8","P -1","-P 1","2","","","","- C44 H47 F12 N6.5 O3 P2 Ru S3 -","- C44 H38 F12 N6.5 O2.75 P2 Ru S3 -","- C88 H76 F24 N13 O5.5 P4 Ru2 S6 -","2","1","","Mei-Jin Li; Ben Wai-Kin Chu; Nianyong Zhu; Vivian Wing-Wah Yam","Synthesis, Structure, Photophysics, Electrochemistry, and Ion-Binding Studies of Ruthenium(II) 1,10-Phenanthroline Complexes Containing Thia-, Selena-, and Aza-Crown Pendants","Inorganic Chemistry","2007","46","","720","733","10.1021/ic061507z","","","0.71073","MoKα","","0.0901","0.0605","","","0.154","0.1789","","","","","","0.914","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307005","12.101","0.002","12.517","0.002","18.818","0.004","91.05","0.03","103.92","0.03","114.18","0.03","2501.8","1.1","301","2","301","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H49 Cl2 N7 O14 Ru S2 -","- C44 H42 Cl2 N7 O14 Ru S2 -","- C88 H84 Cl4 N14 O28 Ru2 S4 -","2","1","","Mei-Jin Li; Ben Wai-Kin Chu; Nianyong Zhu; Vivian Wing-Wah Yam","Synthesis, Structure, Photophysics, Electrochemistry, and Ion-Binding Studies of Ruthenium(II) 1,10-Phenanthroline Complexes Containing Thia-, Selena-, and Aza-Crown Pendants","Inorganic Chemistry","2007","46","","720","733","10.1021/ic061507z","","","0.71073","MoKα","","0.1069","0.0721","","","0.192","0.211","","","","","","0.987","","","","has coordinates,has disorder","179108","2020-10-21","18:00:00",""
"4307006","11.9425","0.0017","11.9425","0.0017","33.669","0.007","90","","90","","90","","4802","1.4","253","2","253","2","","","","","","","","7","P 41 21 2","P 4abw 2nw","92","","","","- C44 H44 Cl2 N8 O12 Ru S -","- C44 H38 Cl2 N8 O12 Ru S -","- C176 H152 Cl8 N32 O48 Ru4 S4 -","4","0.5","","Mei-Jin Li; Ben Wai-Kin Chu; Nianyong Zhu; Vivian Wing-Wah Yam","Synthesis, Structure, Photophysics, Electrochemistry, and Ion-Binding Studies of Ruthenium(II) 1,10-Phenanthroline Complexes Containing Thia-, Selena-, and Aza-Crown Pendants","Inorganic Chemistry","2007","46","","720","733","10.1021/ic061507z","","","0.71073","MoKα","","0.1227","0.0731","","","0.2003","0.2192","","","","","","0.906","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307007","11.977","0.0017","11.977","0.0017","33.623","0.007","90","","90","","90","","4823.2","1.4","253","2","253","2","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","","","- C44 H44 Cl2 N8 O12 Ru Se -","- C44 H38 Cl2 N8 O12 Ru Se -","- C176 H152 Cl8 N32 O48 Ru4 Se4 -","4","0.5","","Mei-Jin Li; Ben Wai-Kin Chu; Nianyong Zhu; Vivian Wing-Wah Yam","Synthesis, Structure, Photophysics, Electrochemistry, and Ion-Binding Studies of Ruthenium(II) 1,10-Phenanthroline Complexes Containing Thia-, Selena-, and Aza-Crown Pendants","Inorganic Chemistry","2007","46","","720","733","10.1021/ic061507z","","","0.71073","MoKα","","0.1158","0.0645","","","0.1669","0.1824","","","","","","0.892","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307008","20.324","0.005","20.324","0.005","47.623","0.005","90","0.005","90","0.005","120","0.005","17036","6","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C113 H95 Cu3 N13 O18 S6 -","- C114 H96 Cu3 N12 O18 S6 -","- C684 H576 Cu18 N72 O108 S36 -","6","0.166667","","Amir H. Mahmoudkhani; George K. H. Shimizu","Three Guest-Including Coordination Solids from a Single Crystallization: A Discrete Cage and Open-Channel Networks from 1-D Ladders and 1-D Ribbons","Inorganic Chemistry","2007","46","","1593","1602","10.1021/ic0615123","","","0.71069","MoKα","","0.1239","0.1096","","","0.3136","0.3288","","","","","","1.17","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307009","10.51","0.002","14.158","0.003","21.748","0.004","108.91","0.03","93.16","0.03","90.43","0.03","3055.7","1.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C115 H99 Cu3 N13.4 O19 S6 -","- C115 H97 Cu3 N13.4 O19 S6 -","- C115 H97 Cu3 N13.4 O19 S6 -","1","0.5","","Amir H. Mahmoudkhani; George K. H. Shimizu","Three Guest-Including Coordination Solids from a Single Crystallization: A Discrete Cage and Open-Channel Networks from 1-D Ladders and 1-D Ribbons","Inorganic Chemistry","2007","46","","1593","1602","10.1021/ic0615123","","","0.71073","MoKα","","0.111","0.079","","","0.223","0.249","","","","","","1.047","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307010","17.793","0.004","39.817","0.008","10.563","0.002","90","","112.07","0.03","90","","6935","3","123","2","123","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C47 H41 Cu N4.6 O10 S3 -","- C47 H39 Cu N4.6 O10 S3 -","- C188 H156 Cu4 N18.4 O40 S12 -","4","1","","Amir H. Mahmoudkhani; George K. H. Shimizu","Three Guest-Including Coordination Solids from a Single Crystallization: A Discrete Cage and Open-Channel Networks from 1-D Ladders and 1-D Ribbons","Inorganic Chemistry","2007","46","","1593","1602","10.1021/ic0615123","","","0.71073","MoKα","","0.108","0.093","","","0.253","0.273","","","","","","1.155","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307011","17.118","0.0002","21.266","0.0003","21.872","0.0004","99.079","0.001","109.795","0.001","102.655","0.001","7072.4","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H35 Cu N4 O11.25 S3 -","- C44 H35 Cu N4 O11.2 S3 -","- C176 H140 Cu4 N16 O44.8 S12 -","4","2","","Amir H. Mahmoudkhani; George K. H. Shimizu","Three Guest-Including Coordination Solids from a Single Crystallization: A Discrete Cage and Open-Channel Networks from 1-D Ladders and 1-D Ribbons","Inorganic Chemistry","2007","46","","1593","1602","10.1021/ic0615123","","","0.71073","MoKα","","0.1519","0.1343","","","0.3454","0.3698","","","","","","1.472","","","","has coordinates,has disorder","179108","2020-10-21","18:00:00",""
"4307012","9.8934","0.0003","15.7855","0.0004","15.7627","0.0004","90","","90.837","0.0011","90","","2461.43","0.12","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Ir-complex","Ir-complex","","- C28 H21 F4 Ir N4 -","- C28 H21 F4 Ir N4 -","- C112 H84 F16 Ir4 N16 -","4","1","","Kenneth Dedeian; Jianmin Shi; Eric Forsythe; David C. Morton; Peter Y. Zavalij","Blue Phosphorescence from Mixed Cyano-Isocyanide Cyclometalated Iridium(III) Complexes","Inorganic Chemistry","2007","46","","1603","1611","10.1021/ic061513v","","","0.71073","MoKα","","0.026","0.021","","","0.0449","0.0472","","","","","","1","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307013","8.2962","0.0009","10.279","0.0012","16.3298","0.0019","76.422","0.002","83.913","0.002","80.958","0.002","1333.3","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","Ir-complex","Ir-complex","","- C32 H21 F4 Ir N4 -","- C32 H21 F4 Ir N4 -","- C64 H42 F8 Ir2 N8 -","2","1","","Kenneth Dedeian; Jianmin Shi; Eric Forsythe; David C. Morton; Peter Y. Zavalij","Blue Phosphorescence from Mixed Cyano-Isocyanide Cyclometalated Iridium(III) Complexes","Inorganic Chemistry","2007","46","","1603","1611","10.1021/ic061513v","","","0.71073","MoKα","","0.0209","0.0183","","","0.0439","0.0457","","","","","","1","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307014","10.971","0.005","17.243","0.007","11.768","0.005","90","","105.971","0.005","90","","2140.3","1.6","150.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 F6 O5 S2 -","- C19 H16 F6 O5 S2 -","- C76 H64 F24 O20 S8 -","4","1","","Jing Han; Masahiko Maekawa; Yusaku Suenaga; Hideaki Ebisu; Atsuhiro Nabei; Takayoshi Kuroda-Sowa; Megumu Munakata","Photochromism of Novel Metal Coordination Polymers with 1,2-Bis(2'-methyl-5'-(carboxylic acid)-3'-thienyl)perfluorocyclopentene in the Crystalline Phase","Inorganic Chemistry","2007","46","","3313","3321","10.1021/ic0615168","","","0.7107","MoKα","","","0.0774","","","","0.2077","","","","","","1.171","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307015","15.695","0.006","22.081","0.008","8.969","0.003","90","","90","","90","","3108.3","1.9","150.2","","","","","","","","","","","7","P n n a","-P 2a 2bc","52","","","","- C29 H26 Co F6 N2 O6 S2 -","- C29 H26 Co F6 N2 O6 S2 -","- C116 H104 Co4 F24 N8 O24 S8 -","4","0.5","","Jing Han; Masahiko Maekawa; Yusaku Suenaga; Hideaki Ebisu; Atsuhiro Nabei; Takayoshi Kuroda-Sowa; Megumu Munakata","Photochromism of Novel Metal Coordination Polymers with 1,2-Bis(2'-methyl-5'-(carboxylic acid)-3'-thienyl)perfluorocyclopentene in the Crystalline Phase","Inorganic Chemistry","2007","46","","3313","3321","10.1021/ic0615168","","","0.7107","MoKα","","","0.0538","","","","0.098","","","","","","1.303","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307016","16.0646","0.0009","24.026","0.002","11.9054","0.0007","90","","90","","90","","4595.1","0.5","200.2","","","","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C43 H38 Cu F6 N4.8 O5 S2 -","- C43 H38 Cu F6 N4.8 O5 S2 -","- C172 H152 Cu4 F24 N19.2 O20 S8 -","4","1","","Jing Han; Masahiko Maekawa; Yusaku Suenaga; Hideaki Ebisu; Atsuhiro Nabei; Takayoshi Kuroda-Sowa; Megumu Munakata","Photochromism of Novel Metal Coordination Polymers with 1,2-Bis(2'-methyl-5'-(carboxylic acid)-3'-thienyl)perfluorocyclopentene in the Crystalline Phase","Inorganic Chemistry","2007","46","","3313","3321","10.1021/ic0615168","","","0.7107","MoKα","","","0.0639","","","","0.1265","","","","","","1.119","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307017","15.47","0.01","11.611","0.008","17.05","0.01","90","","110.892","0.007","90","","2861","3","150.2","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C29 H18 F6 N2 O5 S2 Zn -","- C29 H18 F6 N2 O5 S2 Zn -","- C116 H72 F24 N8 O20 S8 Zn4 -","4","1","","Jing Han; Masahiko Maekawa; Yusaku Suenaga; Hideaki Ebisu; Atsuhiro Nabei; Takayoshi Kuroda-Sowa; Megumu Munakata","Photochromism of Novel Metal Coordination Polymers with 1,2-Bis(2'-methyl-5'-(carboxylic acid)-3'-thienyl)perfluorocyclopentene in the Crystalline Phase","Inorganic Chemistry","2007","46","","3313","3321","10.1021/ic0615168","","","0.7107","MoKα","","","0.1122","","","","0.2021","","","","","","1.162","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307018","13.356","0.003","14.821","0.003","17.251","0.004","77.47","0.03","75.69","0.03","67.17","0.03","3021.5","1.4","300","2","300","2","","","","","","","","7","P -1","-P 1","2","","","","- C54 H67 F12 N11 O0.5 P2 Ru -","- C54 H57 F12 N11 O0.5 P2 Ru -","- C108 H114 F24 N22 O P4 Ru2 -","2","1","","Dik-Lung Ma; Chi-Ming Che; Fung-Ming Siu; Mengsu Yang; Kwok-Yin Wong","DNA Binding and Cytotoxicity of Ruthenium(II) and Rhenium(I) Complexes of 2-Amino-4-phenylamino-6-(2-pyridyl)-1,3,5-triazine","Inorganic Chemistry","2007","46","","740","749","10.1021/ic061518s","","","0.71073","MoKα","","0.1188","0.0955","","","0.2609","0.2897","","","","","","1.138","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307019","13.8","0.002","8.022","0.002","18.044","0.003","90","","102.84","0.02","90","","1947.6","0.7","273.2","","273.2","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C17 H12 Cl N6 O3 Re -","- C17 H13 Cl N6 O3 Re -","- C68 H52 Cl4 N24 O12 Re4 -","4","1","","Dik-Lung Ma; Chi-Ming Che; Fung-Ming Siu; Mengsu Yang; Kwok-Yin Wong","DNA Binding and Cytotoxicity of Ruthenium(II) and Rhenium(I) Complexes of 2-Amino-4-phenylamino-6-(2-pyridyl)-1,3,5-triazine","Inorganic Chemistry","2007","46","","740","749","10.1021/ic061518s","","","0.7107","MoKalpha","","","0.0467","","","0.0605","","","","","2.329","2.329","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307020","11.8246","0.0005","17.8044","0.0008","27.1111","0.0012","90","","90.167","0.001","90","","5707.7","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) perfluorotetraphenylborate","","- C64 H48 B Cu F20 N4 -","- C64 H48 B Cu F20 N4 -","- C256 H192 B4 Cu4 F80 N16 -","4","1","","Bhavesh A. Gandhi; Omar Green; Judith N. Burstyn","Facile Oxidation-Based Synthesis of Sterically Encumbered Four-Coordinate Bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) and Related Three-Coordinate Copper(I) Complexes","Inorganic Chemistry","2007","46","","3816","3825","10.1021/ic0615224","","","0.71073","MoKα","","0.0365","0.0294","","","0.0752","0.0797","","","","","","1.033","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307021","14.7039","0.0014","25.882","0.003","16.7036","0.0016","90","","108.057","0.002","90","","6043.7","1.1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) perfluorotetraphenylborate dichloromethane","","- C65 H50 B Cl2 Cu F20 N4 -","- C65 H50 B Cl2 Cu F20 N4 -","- C260 H200 B4 Cl8 Cu4 F80 N16 -","4","1","","Bhavesh A. Gandhi; Omar Green; Judith N. Burstyn","Facile Oxidation-Based Synthesis of Sterically Encumbered Four-Coordinate Bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) and Related Three-Coordinate Copper(I) Complexes","Inorganic Chemistry","2007","46","","3816","3825","10.1021/ic0615224","","","0.71073","MoKα","","0.0882","0.0552","","","0.1274","0.1447","","","","","","1.025","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307022","14.7544","0.0009","15.1383","0.0009","17.9557","0.0011","90.459","0.0011","91.19","0.0012","98.885","0.0012","3961.3","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) tetrafluoroborate dichloromethane","","- C41 H50 B Cl2 Cu F4 N4 -","- C41 H50 B Cl2 Cu F4 N4 -","- C164 H200 B4 Cl8 Cu4 F16 N16 -","4","2","","Bhavesh A. Gandhi; Omar Green; Judith N. Burstyn","Facile Oxidation-Based Synthesis of Sterically Encumbered Four-Coordinate Bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) and Related Three-Coordinate Copper(I) Complexes","Inorganic Chemistry","2007","46","","3816","3825","10.1021/ic0615224","","","0.71073","MoKα","","0.0637","0.0539","","","0.1425","0.1489","","","","","","1.065","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307023","12.1995","0.0005","13.6275","0.0006","14.4027","0.0006","92.833","0.001","109.737","0.001","107.814","0.001","2114.31","0.16","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) hexafluoroantimonate","","- C40 H48 Cu F6 N4 Sb -","- C40 H48 Cu F6 N4 Sb -","- C80 H96 Cu2 F12 N8 Sb2 -","2","1","","Bhavesh A. Gandhi; Omar Green; Judith N. Burstyn","Facile Oxidation-Based Synthesis of Sterically Encumbered Four-Coordinate Bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) and Related Three-Coordinate Copper(I) Complexes","Inorganic Chemistry","2007","46","","3816","3825","10.1021/ic0615224","","","0.71073","MoKα","","0.0398","0.0315","","","0.0753","0.0785","","","","","","1","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307024","11.4137","0.0005","14.6454","0.0006","15.1002","0.0006","110.647","0.001","94.118","0.001","111.127","0.001","2145.27","0.16","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","bis(2,9-di-tert-butyl-1,10-phenanthroline copper(I))chloride hexafluoroantimonate","","- C40 H48 Cl Cu2 F6 N4 Sb -","- C40 H48 Cl Cu2 F6 N4 Sb -","- C80 H96 Cl2 Cu4 F12 N8 Sb2 -","2","1","","Bhavesh A. Gandhi; Omar Green; Judith N. Burstyn","Facile Oxidation-Based Synthesis of Sterically Encumbered Four-Coordinate Bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) and Related Three-Coordinate Copper(I) Complexes","Inorganic Chemistry","2007","46","","3816","3825","10.1021/ic0615224","","","0.71073","MoKα","","0.043","0.0354","","","0.0909","0.0943","","","","","","1.046","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307025","6.7997","0.0009","19.943","0.003","14.0353","0.0018","90","","92.709","0.002","90","","1901.1","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,9-di-tert-butyl-1,10-phenanthroline copper(I) tetrafluoroborate","","- C20 H24 B Cu F4 N2 -","- C20 H24 B Cu F4 N2 -","- C80 H96 B4 Cu4 F16 N8 -","4","1","","Bhavesh A. Gandhi; Omar Green; Judith N. Burstyn","Facile Oxidation-Based Synthesis of Sterically Encumbered Four-Coordinate Bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) and Related Three-Coordinate Copper(I) Complexes","Inorganic Chemistry","2007","46","","3816","3825","10.1021/ic0615224","","","0.71073","MoKα","","0.0683","0.0489","","","0.117","0.1278","","","","","","1.035","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307026","11.1025","0.0007","10.3858","0.0007","19.158","0.0012","90","","97.848","0.001","90","","2188.4","0.2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","2,9-di-tert-butyl-1,10-phenanthroline copper(I) triflate","","- C21 H24 Cu F3 N2 O3 S -","- C21 H24 Cu F3 N2 O3 S -","- C84 H96 Cu4 F12 N8 O12 S4 -","4","1","","Bhavesh A. Gandhi; Omar Green; Judith N. Burstyn","Facile Oxidation-Based Synthesis of Sterically Encumbered Four-Coordinate Bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) and Related Three-Coordinate Copper(I) Complexes","Inorganic Chemistry","2007","46","","3816","3825","10.1021/ic0615224","","","0.71073","MoKα","","0.0375","0.0309","","","0.0787","0.0827","","","","","","1.026","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307027","14.3373","0.0018","6.8138","0.0009","26.391","0.003","90","","104.818","0.002","90","","2492.4","0.5","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","2,9-di-tert-butyl-1,10-phenanthroline copper(I) acetonato hexafluoroantimonate","","- C23 H30 Cu F6 N2 O Sb -","- C23 H30 Cu F6 N2 O Sb -","- C92 H120 Cu4 F24 N8 O4 Sb4 -","4","1","","Bhavesh A. Gandhi; Omar Green; Judith N. Burstyn","Facile Oxidation-Based Synthesis of Sterically Encumbered Four-Coordinate Bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) and Related Three-Coordinate Copper(I) Complexes","Inorganic Chemistry","2007","46","","3816","3825","10.1021/ic0615224","","","0.71073","MoKα","","0.0514","0.0389","","","0.0913","0.0976","","","","","","1.031","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307028","14.3921","0.0007","15.0667","0.0008","11.6954","0.0006","90","","112.52","0.001","90","","2342.7","0.2","273","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,9-di-tert-butyl-1,10-phenanthroline copper(I) acetonitrilato hexafluorophosphate","","- C22 H27 Cu F6 N3 P -","- C22 H27 Cu F6 N3 P -","- C88 H108 Cu4 F24 N12 P4 -","4","1","","Bhavesh A. Gandhi; Omar Green; Judith N. Burstyn","Facile Oxidation-Based Synthesis of Sterically Encumbered Four-Coordinate Bis(2,9-di-tert-butyl-1,10-phenanthroline)copper(I) and Related Three-Coordinate Copper(I) Complexes","Inorganic Chemistry","2007","46","","3816","3825","10.1021/ic0615224","","","0.71073","MoKα","","0.0439","0.0418","","","0.1152","0.1174","","","","","","1","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307029","7.6204","0.0004","14.3138","0.0005","9.7129","0.0004","90","","100.477","0.002","90","","1041.79","0.08","200.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 N4 Ni O2 S4 -","- C16 H22 N4 Ni O2 S4 -","- C32 H44 N8 Ni2 O4 S8 -","2","0.5","","Sota Shibahara; Hiroshi Kitagawa; Yoshiki Ozawa; Koshiro Toriumi; Takashi Kubo; Kazuhiro Nakasuji","Syntheses and Unusual Segregated-Alternated Hybrid Stacking Structure of Hydrogen-Bonded Charge-Transfer Complexes Composed of Bis[2,3-pyridinedithiolate]metal Complexes","Inorganic Chemistry","2007","46","","1162","1170","10.1021/ic0615269","","","0.7107","MoKα","","","0.0253","","","","0.0642","","","","","","1.027","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307030","7.593","0.004","14.365","0.007","9.764","0.005","90","","98.74","0.02","90","","1052.6","0.9","200.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 N4 O2 Pd S4 -","- C16 H22 N4 O2 Pd S4 -","- C32 H44 N8 O4 Pd2 S8 -","2","0.5","","Sota Shibahara; Hiroshi Kitagawa; Yoshiki Ozawa; Koshiro Toriumi; Takashi Kubo; Kazuhiro Nakasuji","Syntheses and Unusual Segregated-Alternated Hybrid Stacking Structure of Hydrogen-Bonded Charge-Transfer Complexes Composed of Bis[2,3-pyridinedithiolate]metal Complexes","Inorganic Chemistry","2007","46","","1162","1170","10.1021/ic0615269","","","0.7107","MoKα","","","0.0317","","","","0.0762","","","","","","1.048","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307031","7.373","0.0006","8.485","0.001","9.866","0.0011","70.565","0.006","80.957","0.006","69.641","0.006","545.09","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H12 N6 Ni S4 -","- C22 H12 N6 Ni S4 -","- C22 H12 N6 Ni S4 -","1","0.5","","Sota Shibahara; Hiroshi Kitagawa; Yoshiki Ozawa; Koshiro Toriumi; Takashi Kubo; Kazuhiro Nakasuji","Syntheses and Unusual Segregated-Alternated Hybrid Stacking Structure of Hydrogen-Bonded Charge-Transfer Complexes Composed of Bis[2,3-pyridinedithiolate]metal Complexes","Inorganic Chemistry","2007","46","","1162","1170","10.1021/ic0615269","","","0.5592","","","0.0601","0.0495","","","0.1291","0.1378","","","","","","1.187","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307032","7.636","0.007","14.37","0.02","9.695","0.009","90","","97.96","0.09","90","","1054","2","200.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 N4 O2 Pt S4 -","- C16 H22 N4 O2 Pt S4 -","- C32 H44 N8 O4 Pt2 S8 -","2","0.5","","Sota Shibahara; Hiroshi Kitagawa; Yoshiki Ozawa; Koshiro Toriumi; Takashi Kubo; Kazuhiro Nakasuji","Syntheses and Unusual Segregated-Alternated Hybrid Stacking Structure of Hydrogen-Bonded Charge-Transfer Complexes Composed of Bis[2,3-pyridinedithiolate]metal Complexes","Inorganic Chemistry","2007","46","","1162","1170","10.1021/ic0615269","","","0.7107","MoKα","","","0.0222","","","","0.0493","","","","","","0.985","","","","has coordinates","193981","2020-10-21","18:00:00",""
"4307033","30.74","0.01","14.53","0.01","14.246","0.007","89","","89","","90","","6361","6","296.2","","","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C26 H48 N4 Ni O2 S4 -","- C26 H48 N4 Ni O2 S4 -","- C208 H384 N32 Ni8 O16 S32 -","8","1","","Sota Shibahara; Hiroshi Kitagawa; Yoshiki Ozawa; Koshiro Toriumi; Takashi Kubo; Kazuhiro Nakasuji","Syntheses and Unusual Segregated-Alternated Hybrid Stacking Structure of Hydrogen-Bonded Charge-Transfer Complexes Composed of Bis[2,3-pyridinedithiolate]metal Complexes","Inorganic Chemistry","2007","46","","1162","1170","10.1021/ic0615269","","","0.7107","MoKα","","","0.0504","","","","0.167","","","","","","1.012","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307034","7.5745","0.0003","8.6899","0.0007","9.9095","0.0005","69.27","0.04","80.71","0.05","68.98","0.04","569","0.2","200.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H12 N6 Pd S4 -","- C44 H24 N12 Pd S8 -","- C44 H24 N12 Pd S8 -","1","0.5","","Sota Shibahara; Hiroshi Kitagawa; Yoshiki Ozawa; Koshiro Toriumi; Takashi Kubo; Kazuhiro Nakasuji","Syntheses and Unusual Segregated-Alternated Hybrid Stacking Structure of Hydrogen-Bonded Charge-Transfer Complexes Composed of Bis[2,3-pyridinedithiolate]metal Complexes","Inorganic Chemistry","2007","46","","1162","1170","10.1021/ic0615269","","","0.7107","MoKα","","","0.0685","","","","0.1289","","","","","","1.141","","","","has coordinates","193981","2020-10-21","18:00:00",""
"4307035","9.432","0.001","14.584","0.002","16.973","0.003","90","","95.846","0.008","90","","2322.6","0.6","200.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H78 N4 Pd S4 -","- C42 H78 N4 Pd S4 -","- C84 H156 N8 Pd2 S8 -","2","0.5","","Sota Shibahara; Hiroshi Kitagawa; Yoshiki Ozawa; Koshiro Toriumi; Takashi Kubo; Kazuhiro Nakasuji","Syntheses and Unusual Segregated-Alternated Hybrid Stacking Structure of Hydrogen-Bonded Charge-Transfer Complexes Composed of Bis[2,3-pyridinedithiolate]metal Complexes","Inorganic Chemistry","2007","46","","1162","1170","10.1021/ic0615269","","","0.7107","MoKα","","","0.027","","","","0.024","","","","","","1.069","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307036","15.0339","0.0007","15.0339","0.0007","14.7107","0.0013","90","","90","","90","","3324.9","0.4","293","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H27 Gd3 N4 O24 -","- C24 H20 Gd3 N8 O24 -","- C96 H80 Gd12 N32 O96 -","4","0.25","","You-gui Huang; Ben-lai Wu; Da-qiang Yuan; Yan-qing Xu; Fei-long Jiang; Mao-chun Hong","New Lanthanide Hybrid as Clustered Infinite Nanotunnel with 3D Ln-O-Ln Framework and (3,4)-Connected Net","Inorganic Chemistry","2007","46","","1171","1176","10.1021/ic0615271","","","0.71073","MoKα","","0.0613","0.0599","","","0.1281","0.1287","","","","","","1.275","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307037","14.9695","0.0008","14.9695","0.0008","14.6577","0.0016","90","","90","","90","","3284.6","0.4","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H27 Dy3 N4 O24 -","- C24 H20 Dy3 N8 O24 -","- C96 H80 Dy12 N32 O96 -","4","0.25","","You-gui Huang; Ben-lai Wu; Da-qiang Yuan; Yan-qing Xu; Fei-long Jiang; Mao-chun Hong","New Lanthanide Hybrid as Clustered Infinite Nanotunnel with 3D Ln-O-Ln Framework and (3,4)-Connected Net","Inorganic Chemistry","2007","46","","1171","1176","10.1021/ic0615271","","","0.71073","MoKα","","0.1051","0.1038","","","0.2388","0.2395","","","","","","1.245","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307038","14.815","0.0008","14.815","0.0008","14.6396","0.0014","90","","90","","90","","3213.2","0.4","130","2","130","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H27 Er3 N8 O24 -","- C24 H20 Er3 N8 O24 -","- C96 H80 Er12 N32 O96 -","4","0.25","","You-gui Huang; Ben-lai Wu; Da-qiang Yuan; Yan-qing Xu; Fei-long Jiang; Mao-chun Hong","New Lanthanide Hybrid as Clustered Infinite Nanotunnel with 3D Ln-O-Ln Framework and (3,4)-Connected Net","Inorganic Chemistry","2007","46","","1171","1176","10.1021/ic0615271","","","0.71073","MoKα","","0.0673","0.0645","","","0.1263","0.1277","","","","","","1.149","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307039","14.9759","0.0007","14.9759","0.0007","14.731","0.0013","90","","90","","90","","3303.8","0.4","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H27 Eu3 N4 O24 -","- C28 H20 Eu3 N4 O24 -","- C112 H80 Eu12 N16 O96 -","4","0.25","","You-gui Huang; Ben-lai Wu; Da-qiang Yuan; Yan-qing Xu; Fei-long Jiang; Mao-chun Hong","New Lanthanide Hybrid as Clustered Infinite Nanotunnel with 3D Ln-O-Ln Framework and (3,4)-Connected Net","Inorganic Chemistry","2007","46","","1171","1176","10.1021/ic0615271","","","0.71073","MoKα","","0.0507","0.0478","","","0.1043","0.1058","","","","","","1.264","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307040","15.0751","0.0006","15.0751","0.0006","14.7426","0.0007","90","","90","","90","","3350.4","0.2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C24 H27 N8 O24 Sm3 -","- C24 H20 N8 O24 Sm3 -","- C96 H80 N32 O96 Sm12 -","4","0.25","","You-gui Huang; Ben-lai Wu; Da-qiang Yuan; Yan-qing Xu; Fei-long Jiang; Mao-chun Hong","New Lanthanide Hybrid as Clustered Infinite Nanotunnel with 3D Ln-O-Ln Framework and (3,4)-Connected Net","Inorganic Chemistry","2007","46","","1171","1176","10.1021/ic0615271","","","0.71073","MoKα","","","0.052","","","0.146","0.1482","","","","","","1.224","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307041","14.9579","0.0008","14.9579","0.0008","14.6505","0.0015","90","","90","","90","","3277.9","0.4","173","2","173","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C28 H27 N4 O24 Y3 -","- C24 H20 N8 O24 Y3 -","- C96 H80 N32 O96 Y12 -","4","0.25","","You-gui Huang; Ben-lai Wu; Da-qiang Yuan; Yan-qing Xu; Fei-long Jiang; Mao-chun Hong","New Lanthanide Hybrid as Clustered Infinite Nanotunnel with 3D Ln-O-Ln Framework and (3,4)-Connected Net","Inorganic Chemistry","2007","46","","1171","1176","10.1021/ic0615271","","","0.71073","MoKα","","0.0799","0.0751","","","0.1922","0.1953","","","","","","1.163","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307042","9.3927","0.0017","8.9618","0.0016","11.08","0.002","90","","95.567","0.003","90","","928.3","0.3","273","2","273","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C17 H20 Cd N4 O5 -","- C17 H20 Cd N4 O5 -","- C34 H40 Cd2 N8 O10 -","2","1","","Biing-Chiau Tzeng; Yung-Chi Huang; Bo-So Chen; Wan-Min Wu; Shih-Yang Lee; Gene-Hsiang Lee; Shie-Ming Peng","Crystal-Engineering Studies of Coordination Polymers and a Molecular-Looped Complex Containing Dipyridyl-Amide Ligands","Inorganic Chemistry","2007","46","","186","195","10.1021/ic061528t","","","0.71073","MoKα","","0.0381","0.0301","","","0.0569","0.0595","","","","","","0.991","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307043","16.2445","0.0015","15.4718","0.0014","8.8337","0.0008","90","","98.718","0.002","90","","2194.5","0.3","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H40 Cd2 N8 O14 -","- C36 H40 Cd2 N8 O14 -","- C72 H80 Cd4 N16 O28 -","2","0.25","","Biing-Chiau Tzeng; Yung-Chi Huang; Bo-So Chen; Wan-Min Wu; Shih-Yang Lee; Gene-Hsiang Lee; Shie-Ming Peng","Crystal-Engineering Studies of Coordination Polymers and a Molecular-Looped Complex Containing Dipyridyl-Amide Ligands","Inorganic Chemistry","2007","46","","186","195","10.1021/ic061528t","","","0.71073","MoKα","","0.0422","0.0386","","","0.0967","0.099","","","","","","1.095","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307044","10.929","0.003","11.975","0.003","19.959","0.005","90","","105.827","0.005","90","","2513.1","1.1","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H21 Cd N8 O9 -","- C21 H21 Cd N8 O9 -","- C84 H84 Cd4 N32 O36 -","4","1","","Biing-Chiau Tzeng; Yung-Chi Huang; Bo-So Chen; Wan-Min Wu; Shih-Yang Lee; Gene-Hsiang Lee; Shie-Ming Peng","Crystal-Engineering Studies of Coordination Polymers and a Molecular-Looped Complex Containing Dipyridyl-Amide Ligands","Inorganic Chemistry","2007","46","","186","195","10.1021/ic061528t","","","0.71073","MoKα","","0.119","0.0674","","","0.1207","0.138","","","","","","1.025","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307045","14.6089","0.0014","4.4707","0.0004","15.1422","0.0014","90","","106.779","0.002","90","","946.86","0.15","273","2","273","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C6.5 H7 Cl Hg0.5 N2 O0.5 -","- C6.5 H7 Cl Hg0.5 N2 O0.5 -","- C26 H28 Cl4 Hg2 N8 O2 -","4","1","","Biing-Chiau Tzeng; Yung-Chi Huang; Bo-So Chen; Wan-Min Wu; Shih-Yang Lee; Gene-Hsiang Lee; Shie-Ming Peng","Crystal-Engineering Studies of Coordination Polymers and a Molecular-Looped Complex Containing Dipyridyl-Amide Ligands","Inorganic Chemistry","2007","46","","186","195","10.1021/ic061528t","","","0.71073","MoKα","","0.0504","0.0463","","","0.1319","0.1361","","","","","","1.137","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307046","17.5587","0.0005","8.0411","0.0003","15.9135","0.0005","90","","118.9","0.0015","90","","1967.04","0.11","150","1","150","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H22 Cl2 Cu N4 O4 -","- C16 H22 Cl2 Cu N4 O4 -","- C64 H88 Cl8 Cu4 N16 O16 -","4","0.5","","Biing-Chiau Tzeng; Yung-Chi Huang; Bo-So Chen; Wan-Min Wu; Shih-Yang Lee; Gene-Hsiang Lee; Shie-Ming Peng","Crystal-Engineering Studies of Coordination Polymers and a Molecular-Looped Complex Containing Dipyridyl-Amide Ligands","Inorganic Chemistry","2007","46","","186","195","10.1021/ic061528t","","","0.71073","MoKα","","0.1184","0.0916","","","0.2735","0.2959","","","","","","1.116","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307047","10.0358","0.0001","17.9641","0.0002","19.8571","0.0003","63.172","0.0007","85.068","0.0007","76.8756","0.0006","3110.59","0.07","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C58.5 H64.5 Cl2 N11.5 O14.5 Pd2 -","- C58.5 H64.5 Cl2 N11.5 O14.5 Pd2 -","- C117 H129 Cl4 N23 O29 Pd4 -","2","1","","Biing-Chiau Tzeng; Yung-Chi Huang; Bo-So Chen; Wan-Min Wu; Shih-Yang Lee; Gene-Hsiang Lee; Shie-Ming Peng","Crystal-Engineering Studies of Coordination Polymers and a Molecular-Looped Complex Containing Dipyridyl-Amide Ligands","Inorganic Chemistry","2007","46","","186","195","10.1021/ic061528t","","","0.71073","MoKα","","0.1089","0.0616","","","0.1687","0.194","","","","","","1.013","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307048","21.772","0.0006","18.6154","0.0006","16.0027","0.0004","90","","95.344","0.002","90","","6457.6","0.3","90","0.5","90","0.5","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C14 H46.33 Br Gd2 K O51.17 S14 W6 -","- C14 Br Gd2 K O51.16 S14 W6 -","- C56 Br4 Gd8 K4 O204.64 S56 W24 -","4","0.5","","Maxim N. Sokolov; Artem L. Gushchin; Konstantin A. Kovalenko; Eugenia V. Peresypkina; Alexander V. Virovets; Joaquin Sanchiz; Vladimir P. Fedin","Triangular Oxalate Clusters [W3(μ3-S)(μ2-S2)3(C2O4)3]2- as Building Blocks for Coordination Polymers and Nanosized Complexes","Inorganic Chemistry","2007","46","","2115","2123","10.1021/ic061540l","","","0.71073","MoKα","","0.0414","0.0323","","","0.082","0.0871","","","","","","1.036","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307049","25.4465","0.0003","25.4465","0.0003","13.2492","0.0003","90","","90","","120","","7429.8","0.2","90","0.2","90","0.2","","","","","","","","7","P 3 2 1","P 3 2""","150","","","","- C24 H84.7 Br La3 O90.35 S28 W12 -","- C24 Br La3 O90.345 S28 W12 -","- C48 Br2 La6 O180.69 S56 W24 -","2","0.333333","","Maxim N. Sokolov; Artem L. Gushchin; Konstantin A. Kovalenko; Eugenia V. Peresypkina; Alexander V. Virovets; Joaquin Sanchiz; Vladimir P. Fedin","Triangular Oxalate Clusters [W3(μ3-S)(μ2-S2)3(C2O4)3]2- as Building Blocks for Coordination Polymers and Nanosized Complexes","Inorganic Chemistry","2007","46","","2115","2123","10.1021/ic061540l","","","0.71073","MoKα","","0.0275","0.0247","","","0.0638","0.065","","","","","","1.037","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307050","25.3218","0.0006","25.3218","0.0006","13.2303","0.0005","90","","90","","120","","7346.7","0.4","90","2","90","2","","","","","","","","7","P 3 2 1","P 3 2""","150","","","","- C24 H85.9 Br Ce3 O90.95 S28 W12 -","- C24 Br Ce3 O90.96 S28 W12 -","- C48 Br2 Ce6 O181.92 S56 W24 -","2","0.333333","","Maxim N. Sokolov; Artem L. Gushchin; Konstantin A. Kovalenko; Eugenia V. Peresypkina; Alexander V. Virovets; Joaquin Sanchiz; Vladimir P. Fedin","Triangular Oxalate Clusters [W3(μ3-S)(μ2-S2)3(C2O4)3]2- as Building Blocks for Coordination Polymers and Nanosized Complexes","Inorganic Chemistry","2007","46","","2115","2123","10.1021/ic061540l","","","0.71073","MoKα","","0.0464","0.0363","","","0.0849","0.0925","","","","","","0.751","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307051","22.0999","0.0006","18.6732","0.0005","16.4904","0.0006","90","","100.746","0.001","90","","6685.9","0.4","90","0.5","90","0.5","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C14 H49.4 Br K O52.7 Pr2 S14 W6 -","- C14 Br K O52.7 Pr2 S14 W6 -","- C56 Br4 K4 O210.8 Pr8 S56 W24 -","4","0.5","","Maxim N. Sokolov; Artem L. Gushchin; Konstantin A. Kovalenko; Eugenia V. Peresypkina; Alexander V. Virovets; Joaquin Sanchiz; Vladimir P. Fedin","Triangular Oxalate Clusters [W3(μ3-S)(μ2-S2)3(C2O4)3]2- as Building Blocks for Coordination Polymers and Nanosized Complexes","Inorganic Chemistry","2007","46","","2115","2123","10.1021/ic061540l","","","0.71073","MoKα","","0.0745","0.0416","","","0.0876","0.1003","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307052","21.9015","0.0004","18.8307","0.0004","16.3162","0.0003","90","","99.249","0.001","90","","6641.7","0.2","90","0.5","90","0.5","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C14 H48 Br K Nd2 O52 S14 W6 -","- C14 Br K Nd2 O52 S14 W6 -","- C56 Br4 K4 Nd8 O208 S56 W24 -","4","0.5","","Maxim N. Sokolov; Artem L. Gushchin; Konstantin A. Kovalenko; Eugenia V. Peresypkina; Alexander V. Virovets; Joaquin Sanchiz; Vladimir P. Fedin","Triangular Oxalate Clusters [W3(μ3-S)(μ2-S2)3(C2O4)3]2- as Building Blocks for Coordination Polymers and Nanosized Complexes","Inorganic Chemistry","2007","46","","2115","2123","10.1021/ic061540l","","","0.71073","MoKα","","0.0517","0.0359","","","0.0828","0.0896","","","","","","1.02","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307053","22.0847","0.0005","18.543","0.0005","16.5508","0.0004","90","","100.853","0.001","90","","6656.6","0.3","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C14 H46.66 Br K O51.33 S14 Sm2 W6 -","- C14 Br K O51.34 S14 Sm2 W6 -","- C56 Br4 K4 O205.36 S56 Sm8 W24 -","4","0.5","","Maxim N. Sokolov; Artem L. Gushchin; Konstantin A. Kovalenko; Eugenia V. Peresypkina; Alexander V. Virovets; Joaquin Sanchiz; Vladimir P. Fedin","Triangular Oxalate Clusters [W3(μ3-S)(μ2-S2)3(C2O4)3]2- as Building Blocks for Coordination Polymers and Nanosized Complexes","Inorganic Chemistry","2007","46","","2115","2123","10.1021/ic061540l","","","0.71073","MoKα","","0.04","0.0284","","","0.0692","0.0742","","","","","","1.067","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307054","14.1102","0.0007","14.2403","0.0006","14.8756","0.0012","106.73","0.003","102.71","0.003","109.409","0.002","2529.6","0.3","90","2","90","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H50.66 K2 O74.33 S28 Th2 W12 -","- C24 K2 O74.34 S28 Th2 W12 -","- C24 K2 O74.34 S28 Th2 W12 -","1","0.5","","Maxim N. Sokolov; Artem L. Gushchin; Konstantin A. Kovalenko; Eugenia V. Peresypkina; Alexander V. Virovets; Joaquin Sanchiz; Vladimir P. Fedin","Triangular Oxalate Clusters [W3(μ3-S)(μ2-S2)3(C2O4)3]2- as Building Blocks for Coordination Polymers and Nanosized Complexes","Inorganic Chemistry","2007","46","","2115","2123","10.1021/ic061540l","","","0.71073","MoKα","","0.0988","0.0469","","","0.078","0.0943","","","","","","1","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307055","19.4167","0.0015","23.8824","0.0019","37.771","0.003","90","","90","","90","","17515","2","173","2","173","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C58 H126 Cl2 Cu N3 O56.5 -","- C58 H97 Cl2 Cu N3 O56.5 -","- C464 H776 Cl16 Cu8 N24 O452 -","8","1","","Ying-Hua Zhou; Heng Fu; Wei-Xi Zhao; Wei-Lin Chen; Cheng-Yong Su; Hongzhe Sun; Liang-Nian Ji; Zong-Wan Mao","Synthesis, Structure, and Activity of Supramolecular Mimics for the Active Site and Arg141 Residue of Copper, Zinc-Superoxide Dismutase","Inorganic Chemistry","2007","46","","734","739","10.1021/ic061541d","","","0.71073","MoKα","","0.0785","0.073","","","0.1931","0.1996","","","","","","1.017","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307056","10.494","0.0009","12.8533","0.0012","12.9951","0.0012","87.272","0.002","77.782","0.002","76.324","0.002","1664.5","0.3","143","2","143","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H40 Ir N2 O2 -","- C38 H40 Ir N2 O2 -","- C76 H80 Ir2 N4 O4 -","2","1","","Bhavna Hirani; Jian Li; Peter I. Djurovich; Muhammed Yousufuddin; Jonas Oxgaard; Petter Persson; Scott R. Wilson; Robert Bau; William A. Goddard; Mark E. Thompson","Cyclometallated Iridium and Platinum Complexes with Noninnocent Ligands","Inorganic Chemistry","2007","46","","3865","3875","10.1021/ic061556b","","","0.71073","MoKα","","0.0401","0.0341","","","0.0814","0.0844","","","","","","1.005","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307057","28.4405","0.0012","6.8183","0.0003","23.5381","0.0011","90","","97.029","0.002","90","","4530.1","0.3","193","2","193","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C25 H26 F2 N O2 Pt -","- C25 H26.5 F2 N O2 Pt -","- C200 H212 F16 N8 O16 Pt8 -","8","1","","Bhavna Hirani; Jian Li; Peter I. Djurovich; Muhammed Yousufuddin; Jonas Oxgaard; Petter Persson; Scott R. Wilson; Robert Bau; William A. Goddard; Mark E. Thompson","Cyclometallated Iridium and Platinum Complexes with Noninnocent Ligands","Inorganic Chemistry","2007","46","","3865","3875","10.1021/ic061556b","","","0.71073","MoKα","","0.0925","0.0441","","","0.0928","0.1041","","","","","","0.901","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4307058","4.952","0.001","10.753","0.002","23.947","0.005","90","","95.67","0.03","90","","1268.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis(Tropolonato)-lead(II)","bis((μ~2~-Tropolonato-O,O,O')-(tropolonato-O,O')-lead(II))","","- C14 H10 O4 Pb -","- C14 H10 O4 Pb -","- C56 H40 O16 Pb4 -","4","1","","Krzysztof Lyczko; Wojciech Starosta; Ingmar Persson","Influence of pH and Counteranion on the Structure of Tropolonato-Lead(II) Complexes: Structural and Infrared Characterization of Formed Lead Compounds","Inorganic Chemistry","2007","46","","4402","4410","10.1021/ic061561f","","","0.71073","MoKα","","0.1091","0.0661","","","0.1893","0.2092","","","","","","1.088","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307059","7.685","0.0015","8.2317","0.0016","9.959","0.002","84.92","0.03","77.81","0.03","87.29","0.03","613.1","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-(Aqua-(μ~2~-trifluoromethanesulfonato-O,O') (μ~3~-tropolonato-O,O,O',O')-lead(II))","","- C8 H7 F3 O6 Pb S -","- C8 H7 F3 O6 Pb S -","- C16 H14 F6 O12 Pb2 S2 -","2","1","","Krzysztof Lyczko; Wojciech Starosta; Ingmar Persson","Influence of pH and Counteranion on the Structure of Tropolonato-Lead(II) Complexes: Structural and Infrared Characterization of Formed Lead Compounds","Inorganic Chemistry","2007","46","","4402","4410","10.1021/ic061561f","","","0.71073","MoKα","","0.055","0.0403","","","0.1046","0.1105","","","","","","1.065","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307060","12.03","0.002","9.0607","0.0018","14.652","0.003","90","","101.72","0.03","90","","1563.8","0.5","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","catena-(tetrakis(μ~3~-Tropolonato-O,O,O',O')-(μ~3~-perchlorato-O,O',O'',O''') (μ~2~-perchlorato-O,O',O'',O''')-tri-lead(II))","","- C14 H10 Cl O8 Pb1.5 -","- C14 H10 Cl O8 Pb1.5 -","- C56 H40 Cl4 O32 Pb6 -","4","1","","Krzysztof Lyczko; Wojciech Starosta; Ingmar Persson","Influence of pH and Counteranion on the Structure of Tropolonato-Lead(II) Complexes: Structural and Infrared Characterization of Formed Lead Compounds","Inorganic Chemistry","2007","46","","4402","4410","10.1021/ic061561f","","","0.71073","MoKα","","0.1039","0.0474","","","0.1252","0.1565","","","","","","1.009","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307061","7.422","0.0015","10.171","0.002","12.872","0.003","90.3","0.03","97.11","0.03","94.97","0.03","960.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-((μ~3~Tropolonato-O,O,O',O')-(μ~2~-tropolonato-O,O,O') (μ~2~-nitrato-O,O,O',O'')-(nitrato-O,O')-methanolato-di-lead(II))","","- C15 H14 N2 O11 Pb2 -","- C15 H14 N2 O11 Pb2 -","- C30 H28 N4 O22 Pb4 -","2","1","","Krzysztof Lyczko; Wojciech Starosta; Ingmar Persson","Influence of pH and Counteranion on the Structure of Tropolonato-Lead(II) Complexes: Structural and Infrared Characterization of Formed Lead Compounds","Inorganic Chemistry","2007","46","","4402","4410","10.1021/ic061561f","","","0.71073","MoKα","","0.0824","0.049","","","0.1374","0.1521","","","","","","0.971","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307062","7.4508","0.0002","14.7225","0.0003","16.3562","0.0003","90","","99.5855","0.0008","90","","1769.13","0.07","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","diacetyl-2-(4-N-ethyl-3-thiosemicarbazonato)- 3-(4-N-allyl-3-thiosemicarbazonato) zinc(II)","","- C12 H22 N6 O S2 Zn -","- C12 H22 N6 O S2 Zn -","- C48 H88 N24 O4 S8 Zn4 -","4","1","","Jason P. Holland; Franklin I. Aigbirhio; Helen M. Betts; Paul D. Bonnitcha; Paul Burke; Martin Christlieb; Grant C. Churchill; Andrew R. Cowley; Jonathan R. Dilworth; Paul S. Donnelly; Jennifer C. Green; Josephine M. Peach; Sridhar R. Vasudevan; John E. Warren","Functionalized Bis(thiosemicarbazonato) Complexes of Zinc and Copper: Synthetic Platforms Toward Site-Specific Radiopharmaceuticals","Inorganic Chemistry","2007","46","","465","485","10.1021/ic0615628","","","0.71073","MoKα","","0.0742","0.0386","","0.061","0.0453","0.0453","","","","","","1.128","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307063","6.8603","0.0002","17.3868","0.0004","8.5281","0.0002","90","","90.1257","0.0011","90","","1017.22","0.04","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","diacetyl-2-(4-N-allyl-3-thiosemicarbazone)","","- C8 H13 N3 O S -","- C8 H13 N3 O S -","- C32 H52 N12 O4 S4 -","4","1","","Jason P. Holland; Franklin I. Aigbirhio; Helen M. Betts; Paul D. Bonnitcha; Paul Burke; Martin Christlieb; Grant C. Churchill; Andrew R. Cowley; Jonathan R. Dilworth; Paul S. Donnelly; Jennifer C. Green; Josephine M. Peach; Sridhar R. Vasudevan; John E. Warren","Functionalized Bis(thiosemicarbazonato) Complexes of Zinc and Copper: Synthetic Platforms Toward Site-Specific Radiopharmaceuticals","Inorganic Chemistry","2007","46","","465","485","10.1021/ic0615628","","","0.71073","MoKα","","0.0609","0.0345","","0.0619","0.0381","0.0381","","","","","","1.1063","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307064","9.7912","0.0002","14.1514","0.0004","9.4058","0.0002","90","","116.433","0.0016","90","","1167.01","0.05","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","?","5","P 1 21/c 1","-P 2ybc","14","","diacetyl-2-(4-N-ethyl-3-thiosemicarbazone)-3-(4-N-allyl-3-thiosemicarbazone)","","- C15 H32 N6 O2 S4 -","- C15 H32 N6 O2 S4 -","- C30 H64 N12 O4 S8 -","2","0.5","","Jason P. Holland; Franklin I. Aigbirhio; Helen M. Betts; Paul D. Bonnitcha; Paul Burke; Martin Christlieb; Grant C. Churchill; Andrew R. Cowley; Jonathan R. Dilworth; Paul S. Donnelly; Jennifer C. Green; Josephine M. Peach; Sridhar R. Vasudevan; John E. Warren","Functionalized Bis(thiosemicarbazonato) Complexes of Zinc and Copper: Synthetic Platforms Toward Site-Specific Radiopharmaceuticals","Inorganic Chemistry","2007","46","","465","485","10.1021/ic0615628","","","0.71073","MoKα","","0.0508","0.04","","0.0511","0.0472","0.0472","","","","","","1.0685","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307065","9.8643","0.0014","14.627","0.002","17.117","0.002","90","","90","","90","","2469.7","0.6","150","","150","","","","","","","","synthesis as discussed","5","P n a 21","P 2c -2n","33","","diacetyl-2-(4-N-methyl-3-thiosemicarbazonato)- 3-(4-N-amino-3-thiosemicarbazonato) zinc(II)","","- C7 H13 N7 S2 Zn -","- C7 H13 N7 S2 Zn -","- C56 H104 N56 S16 Zn8 -","8","2","","Jason P. Holland; Franklin I. Aigbirhio; Helen M. Betts; Paul D. Bonnitcha; Paul Burke; Martin Christlieb; Grant C. Churchill; Andrew R. Cowley; Jonathan R. Dilworth; Paul S. Donnelly; Jennifer C. Green; Josephine M. Peach; Sridhar R. Vasudevan; John E. Warren","Functionalized Bis(thiosemicarbazonato) Complexes of Zinc and Copper: Synthetic Platforms Toward Site-Specific Radiopharmaceuticals","Inorganic Chemistry","2007","46","","465","485","10.1021/ic0615628","","","0.8457","synchrotron","","0.0628","0.038","","0.0607","0.0433","0.0433","","","","","","1.1044","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307066","14.567","0.003","26.263","0.002","7.251","0.004","90","","115.94","0.02","90","","2494.6","1.5","200","2","200","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C20 H28 Ba O10 -","- C20 H28 Ba O10 -","- C80 H112 Ba4 O40 -","4","1","","Alberto Albinati; Francesco Faccini; Silvia Gross; Guido Kickelbick; Silvia Rizzato; Alfonso Venzo","New Methacrylate-Functionalized Ba and Ba-Ti Oxoclusters as Potential Nanosized Building Blocks for Inorganic-Organic Hybrid Materials: Synthesis and Characterization","Inorganic Chemistry","2007","46","","3459","3466","10.1021/ic0615630","","","0.71069","MoKα","","0.0877","0.0768","","0.1636","0.1574","","","","1.14","","","","","","","has coordinates","273129","2022-02-23","10:11:33",""
"4307067","14.4641","0.0005","31.1688","0.0011","31.0116","0.0011","90","","92.991","0.001","90","","13961.9","0.8","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C88 H118 Ba2 O57 Ti10 -","- C88 H118 Ba2 O57 Ti10 -","- C352 H472 Ba8 O228 Ti40 -","4","1","","Alberto Albinati; Francesco Faccini; Silvia Gross; Guido Kickelbick; Silvia Rizzato; Alfonso Venzo","New Methacrylate-Functionalized Ba and Ba-Ti Oxoclusters as Potential Nanosized Building Blocks for Inorganic-Organic Hybrid Materials: Synthesis and Characterization","Inorganic Chemistry","2007","46","","3459","3466","10.1021/ic0615630","","","0.71069","MoKα","","0.1381","0.0726","","","0.1811","0.2176","","","","","","1.038","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307068","12.8015","0.0013","11.9842","0.0012","18.8456","0.0019","90","","106.481","0.002","90","","2772.4","0.5","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H86 F12 Fe N2 O8 P6 -","- C40 H86 F12 Fe N2 O8 P6 -","- C80 H172 F24 Fe2 N4 O16 P12 -","2","0.5","","John D. Gilbertson; Nathaniel K. Szymczak; Justin L. Crossland; Warren K. Miller; David K. Lyon; Bruce M. Foxman; Joclyn Davis; David R. Tyler","Coordination Chemistry of H2 and N2 in Aqueous Solution. Reactivity and Mechanistic Studies Using trans-FeII(P2)2X2-Type Complexes (P2= a Chelating, Water-Solubilizing Phosphine)","Inorganic Chemistry","2007","46","","1205","1214","10.1021/ic061570o","","","0.71073","MoKα","","0.0737","0.0419","","","0.0867","0.0976","","","","","","0.987","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307069","25.5544","0.0019","14.0778","0.001","41.888","0.003","90","","106.718","0.002","90","","14432.3","1.8","153","","153","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C54 H119.5 Cl2 Fe O20 P6 -","- C54 H119.496 Cl2 Fe O20 P6 -","- C432 H955.966 Cl16 Fe8 O160 P48 -","8","1","","John D. Gilbertson; Nathaniel K. Szymczak; Justin L. Crossland; Warren K. Miller; David K. Lyon; Bruce M. Foxman; Joclyn Davis; David R. Tyler","Coordination Chemistry of H2 and N2 in Aqueous Solution. Reactivity and Mechanistic Studies Using trans-FeII(P2)2X2-Type Complexes (P2= a Chelating, Water-Solubilizing Phosphine)","Inorganic Chemistry","2007","46","","1205","1214","10.1021/ic061570o","","","0.71073","MoKα","","0.1094","0.0585","","0.1516","0.128","0.128","","","","","","0.9435","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307070","14.379","0.003","15.967","0.005","19.943","0.003","90","","94.83","0.02","90","","4562.4","1.9","296","","296","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H56 Fe O12 P4 S -","- C36 H56 Fe O12 P4 S -","- C144 H224 Fe4 O48 P16 S4 -","4","1","","John D. Gilbertson; Nathaniel K. Szymczak; Justin L. Crossland; Warren K. Miller; David K. Lyon; Bruce M. Foxman; Joclyn Davis; David R. Tyler","Coordination Chemistry of H2 and N2 in Aqueous Solution. Reactivity and Mechanistic Studies Using trans-FeII(P2)2X2-Type Complexes (P2= a Chelating, Water-Solubilizing Phosphine)","Inorganic Chemistry","2007","46","","1205","1214","10.1021/ic061570o","","","0.71073","MoKα","","0.158","0.0787","","0.1712","0.0876","0.0876","","","","","","1.1222","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307071","10.23","0.0008","10.886","0.0008","12.657","0.001","109.794","0.0014","105.79","0.0014","95.411","0.0014","1248.85","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H24 N4 O9.5 Zn1.5 -","- C23 H24 N4 O9.5 Zn1.5 -","- C46 H48 N8 O19 Zn3 -","2","1","","Ying-Ying Liu; Jian-Fang Ma; Jin Yang; Zhong-Min Su","Syntheses and Characterization of Six Coordination Polymers of Zinc(II) and Cobalt(II) with 1,3,5-Benzenetricarboxylate Anion and Bis(imidazole) Ligands","Inorganic Chemistry","2007","46","","3027","3037","10.1021/ic061575l","","","0.71069","MoKα","","0.0955","0.0546","","","0.1322","0.1689","","","","","","1.041","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307072","40.364","0.0008","8.341","0.0008","18.743","0.001","90","","112.685","0.001","90","","5822.1","0.7","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C60 H48 N12 O12 Zn3 -","- C60 H48 N12 O12 Zn3 -","- C240 H192 N48 O48 Zn12 -","4","1","","Ying-Ying Liu; Jian-Fang Ma; Jin Yang; Zhong-Min Su","Syntheses and Characterization of Six Coordination Polymers of Zinc(II) and Cobalt(II) with 1,3,5-Benzenetricarboxylate Anion and Bis(imidazole) Ligands","Inorganic Chemistry","2007","46","","3027","3037","10.1021/ic061575l","","","0.71069","MoKα","","0.0574","0.0411","","","0.0804","0.0859","","","","","","1.031","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307073","9.316","0.0008","13.67","0.0012","16.355","0.0014","70.022","0.0013","74.565","0.0013","83.573","0.0015","1886.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H31 N6 O14 Zn3 -","- C33 H31 N6 O14 Zn3 -","- C66 H62 N12 O28 Zn6 -","2","1","","Ying-Ying Liu; Jian-Fang Ma; Jin Yang; Zhong-Min Su","Syntheses and Characterization of Six Coordination Polymers of Zinc(II) and Cobalt(II) with 1,3,5-Benzenetricarboxylate Anion and Bis(imidazole) Ligands","Inorganic Chemistry","2007","46","","3027","3037","10.1021/ic061575l","","","0.71069","MoKα","","0.0636","0.0413","","","0.1022","0.1082","","","","","","0.92","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307074","16.07","0.004","19.567","0.004","22.659","0.004","74.255","0.007","80.665","0.008","67.87","0.007","6338","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C120 H120 Co6 N24 O36 -","- C120 H98 Co6 N24 O36 -","- C240 H196 Co12 N48 O72 -","2","1","","Ying-Ying Liu; Jian-Fang Ma; Jin Yang; Zhong-Min Su","Syntheses and Characterization of Six Coordination Polymers of Zinc(II) and Cobalt(II) with 1,3,5-Benzenetricarboxylate Anion and Bis(imidazole) Ligands","Inorganic Chemistry","2007","46","","3027","3037","10.1021/ic061575l","","","0.71069","MoKα","","0.123","0.0627","","","0.1711","0.2043","","","","","","1.018","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307075","15.942","0.007","12.172","0.004","30.831","0.009","90","","99.478","0.005","90","","5901","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24.5 Co1.5 N6 O6.25 -","- C30 H9 Co1.5 N6 O6.25 -","- C240 H72 Co12 N48 O50 -","8","1","","Ying-Ying Liu; Jian-Fang Ma; Jin Yang; Zhong-Min Su","Syntheses and Characterization of Six Coordination Polymers of Zinc(II) and Cobalt(II) with 1,3,5-Benzenetricarboxylate Anion and Bis(imidazole) Ligands","Inorganic Chemistry","2007","46","","3027","3037","10.1021/ic061575l","","","0.71069","MoKα","","0.1658","0.0769","","","0.194","0.2459","","","","","","0.962","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307076","11.074","0.002","11.462","0.002","18.048","0.004","83.61","0.03","84.85","0.03","73.03","0.03","2173.5","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H47 Co4 N8 O19.5 -","- C38 H46 Co4 N8 O19.5 -","- C76 H92 Co8 N16 O39 -","2","1","","Ying-Ying Liu; Jian-Fang Ma; Jin Yang; Zhong-Min Su","Syntheses and Characterization of Six Coordination Polymers of Zinc(II) and Cobalt(II) with 1,3,5-Benzenetricarboxylate Anion and Bis(imidazole) Ligands","Inorganic Chemistry","2007","46","","3027","3037","10.1021/ic061575l","","","0.71073","MoKα","","0.0832","0.0661","","","0.1956","0.2077","","","","","","1.103","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307077","12.917","0.0002","6.121","0.0005","12.093","0.0006","90","","90","","90","","956.13","0.09","298","2","298","2","","","","","","","","3","P b c m","-P 2c 2b","57","","","","- Ce Ni Sb3 -","- Ce Ni Sb3 -","- Ce8 Ni8 Sb24 -","8","1","","Evan Lyle Thomas; Dixie P. Gautreaux; Han-Oh Lee; Zachary Fisk; Julia Y. Chan","Discovery of β-LnNiSb3 (Ln = La, Ce): Crystal Growth, Structure, and Magnetic and Transport Behavior","Inorganic Chemistry","2007","46","","3010","3016","10.1021/ic0615832","","","0.71073","MoKα","","0.0311","0.0282","","","0.0716","0.0729","","","","","","1.188","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307078","13.097","0.0002","6.14","0.0004","12.127","0.0004","90","","90","","90","","975.2","0.07","298","2","298","2","","","","","","","","3","P b c m","-P 2c 2b","57","","","","- La Ni Sb3 -","- La Ni Sb3 -","- La8 Ni8 Sb24 -","8","1","","Evan Lyle Thomas; Dixie P. Gautreaux; Han-Oh Lee; Zachary Fisk; Julia Y. Chan","Discovery of β-LnNiSb3 (Ln = La, Ce): Crystal Growth, Structure, and Magnetic and Transport Behavior","Inorganic Chemistry","2007","46","","3010","3016","10.1021/ic0615832","","","0.71073","MoKα","","0.0704","0.0627","","","0.1779","0.1926","","","","","","1.11","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307079","15.446","0.003","11.05","0.002","18.125","0.006","90","","114.55","0.02","90","","2813.9","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H40 N6 Si2 Zr -","- C24 H40 N6 Si2 Zr -","- C96 H160 N24 Si8 Zr4 -","4","1","","Humberto Ferreira; Alberto R. Dias; M. Teresa Duarte; José R. Ascenso; Ana M. Martins","Amido/Amine Triazacyclononane-Based Zirconium Complexes: Syntheses, Reactivity, and Structures","Inorganic Chemistry","2007","46","","750","755","10.1021/ic061588z","","","0.71069","MoKα","","0.1001","0.0513","","","0.1165","0.1723","","","","","","1.042","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307080","23.6195","0.0018","10.7047","0.0008","15.6798","0.0012","90","","95.113","0.001","90","","3948.7","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","04043r","","","- C42 H50 Cu2 N4 S2 -","- C42 H50 Cu2 N4 S2 -","- C168 H200 Cu8 N16 S8 -","4","0.5","","Eric C. Brown; Itsik Bar-Nahum; John T. York; Nermeen W. Aboelella; William B. Tolman","Ligand Structural Effects on Cu2S2 Bonding and Reactivity in Side-On Disulfido-Bridged Dicopper Complexes","Inorganic Chemistry","2007","46","","486","496","10.1021/ic061589r","","","0.71073","MoKα","","0.0461","0.0321","","","0.0788","0.087","","","","","","1.059","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307081","21.2278","0.0015","21.663","0.0013","15.853","0.0011","90","","98.757","0.001","90","","7205.1","0.8","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","01362s","","","- C70 H106 Cu2 N4 S2 -","- C70 H106 Cu2 N4 S2 -","- C280 H424 Cu8 N16 S8 -","4","0.5","","Eric C. Brown; Itsik Bar-Nahum; John T. York; Nermeen W. Aboelella; William B. Tolman","Ligand Structural Effects on Cu2S2 Bonding and Reactivity in Side-On Disulfido-Bridged Dicopper Complexes","Inorganic Chemistry","2007","46","","486","496","10.1021/ic061589r","","","0.71073","MoKα","","0.0757","0.045","","","0.0957","0.1031","","","","","","1.021","","","","has coordinates,has disorder","179108","2020-10-21","18:00:00",""
"4307082","12.857","0.005","8.352","0.003","24.115","0.009","90","","94.563","0.007","90","","2581.3","1.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","05031","","","- C58 H66 Cu2 N4 S2 -","- C58 H66 Cu2 N4 S2 -","- C116 H132 Cu4 N8 S4 -","2","0.5","","Eric C. Brown; Itsik Bar-Nahum; John T. York; Nermeen W. Aboelella; William B. Tolman","Ligand Structural Effects on Cu2S2 Bonding and Reactivity in Side-On Disulfido-Bridged Dicopper Complexes","Inorganic Chemistry","2007","46","","486","496","10.1021/ic061589r","","","0.71073","MoKα","","0.0513","0.0386","","","0.0784","0.0825","","","","","","1.051","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307083","11.7632","0.0009","12.8233","0.0009","13.2525","0.001","111.428","0.001","90.919","0.001","104.947","0.001","1784.3","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","05172m","","","- C80 H98 Cu2 N4 S2 -","- C80 H98 Cu2 N4 S2 -","- C80 H98 Cu2 N4 S2 -","1","0.5","","Eric C. Brown; Itsik Bar-Nahum; John T. York; Nermeen W. Aboelella; William B. Tolman","Ligand Structural Effects on Cu2S2 Bonding and Reactivity in Side-On Disulfido-Bridged Dicopper Complexes","Inorganic Chemistry","2007","46","","486","496","10.1021/ic061589r","","","0.71073","MoKα","","0.0456","0.0348","","","0.0713","0.0747","","","","","","1.04","","","","has coordinates,has disorder","179108","2020-10-21","18:00:00",""
"4307084","8.3136","0.0009","12.5947","0.0013","14.2544","0.0015","103.694","0.002","105.738","0.002","105.08","0.002","1309.1","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","05178m","","","- C54 H46 Cu2 F12 N4 S2 -","- C54 H46 Cu2 F12 N4 S2 -","- C54 H46 Cu2 F12 N4 S2 -","1","0.5","","Eric C. Brown; Itsik Bar-Nahum; John T. York; Nermeen W. Aboelella; William B. Tolman","Ligand Structural Effects on Cu2S2 Bonding and Reactivity in Side-On Disulfido-Bridged Dicopper Complexes","Inorganic Chemistry","2007","46","","486","496","10.1021/ic061589r","","","0.71073","MoKα","","0.055","0.0419","","","0.0915","0.0962","","","","","","1.057","","","","has coordinates,has disorder","179108","2020-10-21","18:00:00",""
"4307085","12.317","0.005","13.019","0.005","13.915","0.005","81.263","0.005","81.293","0.005","78.555","0.005","2144.6","1.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","05183s","","","- C70 H78 Cu2 F12 N4 S2 -","- C70 H78 Cu2 F12 N4 S2 -","- C70 H78 Cu2 F12 N4 S2 -","1","0.5","","Eric C. Brown; Itsik Bar-Nahum; John T. York; Nermeen W. Aboelella; William B. Tolman","Ligand Structural Effects on Cu2S2 Bonding and Reactivity in Side-On Disulfido-Bridged Dicopper Complexes","Inorganic Chemistry","2007","46","","486","496","10.1021/ic061589r","","","0.71069","MoKα","","0.0443","0.038","","","0.1007","0.1039","","","","","","1.059","","","","has coordinates,has disorder","179108","2020-10-21","18:00:00",""
"4307086","16.0272","0.0018","15.9956","0.0018","20.072","0.002","90","","90","","90","","5145.8","1","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C60 H62 Cu2 N4 S2 -","- C60 H62 Cu2 N4 S2 -","- C240 H248 Cu8 N16 S8 -","4","0.5","","Eric C. Brown; Itsik Bar-Nahum; John T. York; Nermeen W. Aboelella; William B. Tolman","Ligand Structural Effects on Cu2S2 Bonding and Reactivity in Side-On Disulfido-Bridged Dicopper Complexes","Inorganic Chemistry","2007","46","","486","496","10.1021/ic061589r","","","0.71073","MoKα","","0.0547","0.041","","","0.0945","0.0997","","","","","","1.08","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307087","25.048","0.004","25.048","0.004","8.611","0.003","90","","90","","90","","5403","2","173","2","173","2","","","","","","","","5","I 4","I 4","79","05308s","","","- C84 H100 Cu4 N8 S4 -","- C84 H100 Cu4 N8 S4 -","- C168 H200 Cu8 N16 S8 -","2","0.25","","Eric C. Brown; Itsik Bar-Nahum; John T. York; Nermeen W. Aboelella; William B. Tolman","Ligand Structural Effects on Cu2S2 Bonding and Reactivity in Side-On Disulfido-Bridged Dicopper Complexes","Inorganic Chemistry","2007","46","","486","496","10.1021/ic061589r","","","0.71073","MoKα","","0.073","0.057","","","0.1272","0.1326","","","","","","1.074","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307088","19.927","0.003","19.811","0.003","17.578","0.003","90","","104.346","0.003","90","","6722.9","1.8","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","06055s","","","- C64 H82 Cu2 N4 S2 -","- C64 H82 Cu2 N4 S2 -","- C256 H328 Cu8 N16 S8 -","4","0.5","","Eric C. Brown; Itsik Bar-Nahum; John T. York; Nermeen W. Aboelella; William B. Tolman","Ligand Structural Effects on Cu2S2 Bonding and Reactivity in Side-On Disulfido-Bridged Dicopper Complexes","Inorganic Chemistry","2007","46","","486","496","10.1021/ic061589r","","","0.71073","MoKα","","0.0707","0.0446","","","0.1104","0.1183","","","","","","1.011","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307089","7.7001","0.0017","6.7769","0.0015","14.851","0.003","90","","90","","90","","775","0.3","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C5 H5 Cu N3 O5 -","- C5 H5 Cu N3 O5 -","- C20 H20 Cu4 N12 O20 -","4","0.5","","J. L. Manson; T. Lancaster; J. A. Schlueter; S. J. Blundell; M. L. Brooks; F. L. Pratt; C. L. Nygren; H.-J. Koo; D. Dai; M.-H. Whangbo","Characterization of the Crystal and Magnetic Structures of the Mixed-Anion Coordination Polymer Cu(HCO2)(NO3)(pyz) {pyz = Pyrazine} by X-ray Diffraction, ac Magnetic Susceptibility, dc Magnetization, Muon-Spin Relaxation, and Spin Dimer Analysis","Inorganic Chemistry","2007","46","","213","220","10.1021/ic061590q","","","0.71073","MoKα","","0.0243","0.0218","","","0.0635","0.065","","","","","","1.057","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307090","28.3701","0.0014","5.457","0.0002","28.1226","0.0013","90","","98.289","0.002","90","","4308.3","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H24 Cu3 N6 O7 -","- C15 H24 Cu3 N6 O7 -","- C120 H192 Cu24 N48 O56 -","8","1","","Corrado Di Nicola; Yauhen Yu. Karabach; Alexander M. Kirillov; Magda Monari; Luciano Pandolfo; Claudio Pettinari; Armando J. L. Pombeiro","Supramolecular Assemblies of Trinuclear Triangular Copper(II) Secondary Building Units through Hydrogen Bonds. Generation of Different Metal-Organic Frameworks, Valuable Catalysts for Peroxidative Oxidation of Alkanes","Inorganic Chemistry","2007","46","","221","230","10.1021/ic061595n","","","0.71073","MoKα","","0.0999","0.0541","","","0.1251","0.1456","","","","","","0.987","","","","has coordinates,has disorder","179108","2020-10-21","18:00:00",""
"4307091","8.0167","0.0009","10.259","0.0011","13.4531","0.0015","69.777","0.003","88.217","0.003","80.496","0.003","1023.6","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H22 Cu3 N6 O6 -","- C15 H22 Cu3 N6 O6 -","- C30 H44 Cu6 N12 O12 -","2","1","","Corrado Di Nicola; Yauhen Yu. Karabach; Alexander M. Kirillov; Magda Monari; Luciano Pandolfo; Claudio Pettinari; Armando J. L. Pombeiro","Supramolecular Assemblies of Trinuclear Triangular Copper(II) Secondary Building Units through Hydrogen Bonds. Generation of Different Metal-Organic Frameworks, Valuable Catalysts for Peroxidative Oxidation of Alkanes","Inorganic Chemistry","2007","46","","221","230","10.1021/ic061595n","","","0.71073","MoKα","","0.0936","0.0753","","","0.2038","0.2186","","","","","","1.027","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307092","9.745","0.001","10.221","0.001","10.287","0.001","60.877","0.002","61.959","0.001","81.087","0.002","786.38","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H8 Cu3 I3 N2 S -","- C10 H8 Cu3 I3 N2 S -","- C20 H16 Cu6 I6 N4 S2 -","2","1","","Jing Wang; Shao-Liang Zheng; Sheng Hu; Yue-Hua Zhang; Ming-Liang Tong","New In Situ Cleavage of Both S-S and S-C(sp2) Bonds and Rearrangement Reactions toward the Construction of Copper(I) Cluster-Based Coordination Networks","Inorganic Chemistry","2007","46","","795","800","10.1021/ic0616028","","","0.71073","MoKα","","0.0362","0.033","","","0.0783","0.0801","","","","","","1.078","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307093","8.0037","0.0011","10.3851","0.0013","18.407","0.003","90","","93.33","0.002","90","","1527.4","0.4","293","2","293","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C20 H16 Cu4 I4 N4 S2 -","- C20 H16 Cu4 I4 N4 S2 -","- C40 H32 Cu8 I8 N8 S4 -","2","0.5","","Jing Wang; Shao-Liang Zheng; Sheng Hu; Yue-Hua Zhang; Ming-Liang Tong","New In Situ Cleavage of Both S-S and S-C(sp2) Bonds and Rearrangement Reactions toward the Construction of Copper(I) Cluster-Based Coordination Networks","Inorganic Chemistry","2007","46","","795","800","10.1021/ic0616028","","","0.71073","MoKα","","0.0472","0.0388","","","0.0949","0.0998","","","","","","1.044","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307094","36.073","0.003","11.6925","0.0009","14.6242","0.0012","90","","96.524","0.002","90","","6128.3","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 Cu5 I5 N4 S2 -","- C20 H16 Cu5 I5 N4 S2 -","- C160 H128 Cu40 I40 N32 S16 -","8","1","","Jing Wang; Shao-Liang Zheng; Sheng Hu; Yue-Hua Zhang; Ming-Liang Tong","New In Situ Cleavage of Both S-S and S-C(sp2) Bonds and Rearrangement Reactions toward the Construction of Copper(I) Cluster-Based Coordination Networks","Inorganic Chemistry","2007","46","","795","800","10.1021/ic0616028","","","0.71073","MoKα","","0.0577","0.044","","","0.0932","0.0992","","","","","","1.02","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307095","14.174","0.003","6.7095","0.0014","10.095","0.003","90","","127.624","0.016","90","","760.4","0.4","293","","293","2","","","","","","","","3","C 1 c 1","C -2yc","9","dysprosium metaphosphat","","","- Dy O9 P3 -","- Dy O9 P3 -","- Dy4 O36 P12 -","4","1","","Henning A. Höppe; Stefan J. Sedlmaier","Crystal Structures of Incommensurately Modulated Ln(PO3)3 (Ln = Tb-Yb) and Commensurate Gd(PO3)3 and Lu(PO3)3","Inorganic Chemistry","2007","46","","3467","3474","10.1021/ic0616030","","","0.71073","MoKα","","0.1981","0.0574","","","0.0707","0.0921","","","","1.54","1.54","1.04","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307096","13.972","0.0013","20.018","0.0016","9.9556","0.0009","90","","127.351","0.006","90","","2213.5","0.4","293","2","293","2","","","","","","","","3","C 1 c 1","C -2yc","9","lutetium metaphosphate","","","- Lu O9 P3 -","- Lu O9 P3 -","- Lu12 O108 P36 -","12","3","","Henning A. Höppe; Stefan J. Sedlmaier","Crystal Structures of Incommensurately Modulated Ln(PO3)3 (Ln = Tb-Yb) and Commensurate Gd(PO3)3 and Lu(PO3)3","Inorganic Chemistry","2007","46","","3467","3474","10.1021/ic0616030","","","0.71073","MoKα","","0.0649","0.0417","","","0.0901","0.0966","","","","","","0.9","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307097","26.0171","0.0017","13.5114","0.0008","10.084","0.0007","90","","119.311","0.006","90","","3091","0.4","293","2","293","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","gadolinium metaphosphate","","","- Gd O9 P3 -","- Gd O9 P3 -","- Gd16 O144 P48 -","16","2","","Henning A. Höppe; Stefan J. Sedlmaier","Crystal Structures of Incommensurately Modulated Ln(PO3)3 (Ln = Tb-Yb) and Commensurate Gd(PO3)3 and Lu(PO3)3","Inorganic Chemistry","2007","46","","3467","3474","10.1021/ic0616030","","","0.71073","MoKα","","0.065","0.0386","","","0.0857","0.0919","","","","","","0.889","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307098","14.9846","0.0014","13.7509","0.0012","15.3843","0.0015","90","","108.075","0.004","90","","3013.5","0.5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","La(DMSO)4(H2O)3Fe(CN)6.H2O","La(DMSO)4(H2O)3Fe(CN)6.H2O","","- C14 H32 Fe La N6 O8 S4 -","- C14 H4 Fe La N6 O8 S3.9925 -","- C56 H16 Fe4 La4 N24 O32 S15.97 -","4","1","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.0861","0.0471","","","0.1053","0.1271","","","","","","1.004","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307099","14.917","0.003","13.701","0.003","15.386","0.003","90","","108.384","0.004","90","","2984.1","1.1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Pr(DMSO)4(H2O)3Fe(CN)6.H2O","Pr(DMSO)4(H2O)3Fe(CN)6.H2O","","- C14 H32 Fe N6 O8 Pr S4 -","- C14 H4 Fe N6 O8 Pr S3.997 -","- C56 H16 Fe4 N24 O32 Pr4 S15.988 -","4","1","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.0493","0.0445","","","0.1245","0.1295","","","","","","1.008","","","","has coordinates","179108","2020-10-21","18:00:00",""
"4307100","14.882","0.005","13.661","0.004","15.292","0.005","90","","108.049","0.003","90","","2955.9","1.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Pr(DMSO)4(H2O)3Co(CN)6.H2O","Pr(DMSO)4(H2O)3Co(CN)6.H2O","","- C14 H32 Co N6 O8 Pr S4 -","- C14 H20 Co N6 O8 Pr S3.998 -","- C56 H80 Co4 N24 O32 Pr4 S15.992 -","4","1","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.0815","0.0619","","","0.1889","0.206","","","","","","1.006","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307101","14.899","0.005","13.693","0.005","15.399","0.005","90","","108.498","0.004","90","","2979.3","1.8","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Nd(DMSO)4(H2O)3Fe(CN)6.H2O","Nd(DMSO)4(H2O)3Fe(CN)6.H2O","","- C14 H32 Fe N6 Nd O8 S4 -","- C14 H4 Fe N6 Nd O8 S4.0021 -","- C56 H16 Fe4 N24 Nd4 O32 S16.0084 -","4","1","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.0876","0.0433","","","0.0904","0.1116","","","","","","1.007","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307102","14.74","0.003","13.574","0.003","15.123","0.003","90","","107.633","0.004","90","","2883.7","1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Nd(DMSO)4(H2O)3Co(CN)6.H2O","Nd(DMSO)4(H2O)3Co(CN)6.H2O","","- C14 H32 Co N6 Nd O8 S4 -","- C14 H4 Co N6 Nd O8 S4.0062 -","- C56 H16 Co4 N24 Nd4 O32 S16.0248 -","4","1","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.0386","0.031","","","0.0747","0.078","","","","","","0.998","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307103","14.87","0.008","13.644","0.007","15.369","0.008","90","","108.648","0.008","90","","2954","3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Sm(DMSO)4(H2O)3Fe(CN)6.H2O","Sm(DMSO)4(H2O)3Fe(CN)6.H2O","","- C14 H32 Fe N6 O8 S4 Sm -","- C14 H4 Fe N6 O8 S4.0003 Sm -","- C56 H16 Fe4 N24 O32 S16.0012 Sm4 -","4","1","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.1377","0.064","","","0.1111","0.1367","","","","","","0.995","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307104","14.819","0.003","13.617","0.003","15.296","0.003","90","","108.338","0.002","90","","2929.8","1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Sm(DMSO)4(H2O)3Co(CN)6.H2O","Sm(DMSO)4(H2O)3Co(CN)6.H2O","","- C14 H32 Co N6 O8 S4 Sm -","- C14 H4 Co N6 O8 S3.9985 Sm -","- C56 H16 Co4 N24 O32 S15.994 Sm4 -","4","1","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.0501","0.0298","","","0.0577","0.0639","","","","","","0.992","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307105","7.9208","0.0011","10.7515","0.0013","11.2499","0.0018","90","","97.007","0.003","90","","950.9","0.2","293","2","293","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","La(DMSO)2(H2O)Fe(CN)6","La(DMSO)2(H2O)Fe(CN)6","","- C10 H14 Fe La N6 O3 S2 -","- C10 H Fe La N6 O3 S1.996 -","- C20 H2 Fe2 La2 N12 O6 S3.992 -","2","0.5","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.0516","0.0423","","","0.1088","0.113","","","","","","1.016","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307106","7.8106","0.0003","10.6967","0.0004","11.1162","0.0001","90","","97.035","0.002","90","","921.74","0.05","293","2","293","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","Pr(DMSO)2(H2O)Fe(CN)6","Pr(DMSO)2(H2O)Fe(CN)6","","- C10 H14 Fe N6 O3 Pr S2 -","- C10 H Fe N6 O3 Pr S2 -","- C20 H2 Fe2 N12 O6 Pr2 S4 -","2","0.5","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.0747","0.0568","","","0.1338","0.149","","","","","","1.007","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307107","7.7856","0.001","10.6289","0.0013","11.0777","0.0013","90","","96.692","0.006","90","","910.46","0.19","293","2","293","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","Pr(DMSO)2(H2O)Co(CN)6","Pr(DMSO)2(H2O)Co(CN)6","","- C10 H14 Co N6 O3 Pr S2 -","- C10 H Co N6 O3 Pr S2 -","- C20 H2 Co2 N12 O6 Pr2 S4 -","2","0.5","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.0328","0.0309","","","0.076","0.0773","","","","","","0.993","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307108","7.8223","0.001","10.707","0.0013","11.0979","0.0014","90","","96.905","0.001","90","","922.7","0.2","293","2","293","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","Nd(DMSO)2(H2O)Fe(CN)6","Nd(DMSO)2(H2O)Fe(CN)6","","- C10 H14 Fe N6 Nd O3 S2 -","- C10 H Fe N6 Nd O3 S2 -","- C20 H2 Fe2 N12 Nd2 O6 S4 -","2","0.5","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.0737","0.0591","","","0.1402","0.1481","","","","","","0.994","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307109","7.772","0.004","10.614","0.006","11.043","0.008","90","","96.592","0.002","90","","904.9","1","293","2","293","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","Nd(DMSO)2(H2O)Co(CN)6","Nd(DMSO)2(H2O)Co(CN)6","","- C10 H14 Co N6 Nd O3 S2 -","- C10 Co N6 Nd O4.008 S2 -","- C20 Co2 N12 Nd2 O8.016 S4 -","2","0.5","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.035","0.0332","","","0.0819","0.0832","","","","","","1.018","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307110","7.7637","0.001","10.6874","0.0014","11.0488","0.0014","90","","97.084","0.009","90","","909.8","0.2","293","2","293","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","Sm(DMSO)2(H2O)Fe(CN)6","Sm(DMSO)2(H2O)Fe(CN)6","","- C10 H14 Fe N6 O3 S2 Sm -","- C10 H Fe N6 O3 S2 Sm -","- C20 H2 Fe2 N12 O6 S4 Sm2 -","2","0.5","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.0429","0.0375","","","0.087","0.0901","","","","","","1.007","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307111","7.7719","0.0006","10.6882","0.0009","11.0306","0.0009","90","","97.033","0.003","90","","909.39","0.13","293","2","293","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","Sm(DMSO)2(H2O)Co(CN)6","Sm(DMSO)2(H2O)Co(CN)6","","- C10 H14 Co N6 O3 S2 Sm -","- C10 H Co N6 O3 S2 Sm -","- C20 H2 Co2 N12 O6 S4 Sm2 -","2","0.5","","Wen-Tong Chen; Guo-Cong Guo; Ming-Sheng Wang; Gang Xu; Li-Zhen Cai; Takashiro Akitsu; Motoko Akita-Tanaka; Akiyuki Matsushita; Jin-Shun Huang","Self-Assembly and Characterization of Cyano-Bridged Bimetallic [Ln-Fe] and [Ln-Co] Complexes (Ln = La, Pr, Nd and Sm). Nature of the Magnetic Interactions between the Ln3+ and Fe3+ Ions","Inorganic Chemistry","2007","46","","2105","2114","10.1021/ic061609p","","","0.71073","MoKα","","0.0587","0.0532","","","0.1198","0.1236","","","","","","1.003","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307112","14.2593","0.0007","14.2593","0.0007","9.2726","0.0008","90","","90","","120","","1632.78","0.18","298","2","298","2","","","","","","","","3","P 63/m c m","-P 6c 2","193","","","","- Au2 Ba7 Te14 -","- Au1.995 Ba7 Te14 -","- Au3.99 Ba14 Te28 -","2","0.0833333","","Yanjie Cui; Abdeljalil Assoud; Jianxiao Xu; Holger Kleinke","Structures and Physical Properties of New Semiconducting Gold and Copper Polytellurides: Ba7Au2Te14 and Ba6.76Cu2.42Te14","Inorganic Chemistry","2007","46","","1215","1221","10.1021/ic061616d","","","0.71073","MoKα","","0.0403","0.0369","","","0.0702","0.0715","","","","","","1.207","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307113","14.1332","0.0004","14.1332","0.0004","9.2108","0.0006","90","","90","","120","","1593.34","0.12","298","2","298","2","","","","","","","","3","P 63/m c m","-P 6c 2","193","","","","- Ba6.76 Cu2.42 Te14 -","- Ba6.763 Cu2.421 Te14 -","- Ba13.526 Cu4.842 Te28 -","2","0.0833333","","Yanjie Cui; Abdeljalil Assoud; Jianxiao Xu; Holger Kleinke","Structures and Physical Properties of New Semiconducting Gold and Copper Polytellurides: Ba7Au2Te14 and Ba6.76Cu2.42Te14","Inorganic Chemistry","2007","46","","1215","1221","10.1021/ic061616d","","","0.71073","MoKα","","0.0378","0.0369","","","0.0799","0.0803","","","","","","1.243","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307114","15.6873","0.0013","8.8288","0.0007","18.3278","0.0015","90","","98.424","0.001","90","","2511","0.4","273","2","273","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C15 H18 N6 O18 Pr2 -","- C15 H16 N6 O18 Pr2 -","- C60 H64 N24 O72 Pr8 -","4","1","","Jun Xia; Bin Zhao; Hong-Sheng Wang; Wei Shi; Yue Ma; Hai-Bin Song; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Two- and Three-Dimensional Lanthanide Complexes: Synthesis, Crystal Structures, and Properties","Inorganic Chemistry","2007","46","","3450","3458","10.1021/ic061620p","","","0.71073","MoKα","","0.0179","0.0174","","","0.0405","0.0406","","","","","","1.034","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307115","15.648","0.002","8.8089","0.0013","18.303","0.003","90","","98.421","0.002","90","","2495.7","0.6","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C15 H18 N6 Nd2 O18 -","- C15 H18 N6 Nd2 O18 -","- C60 H72 N24 Nd8 O72 -","4","1","","Jun Xia; Bin Zhao; Hong-Sheng Wang; Wei Shi; Yue Ma; Hai-Bin Song; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Two- and Three-Dimensional Lanthanide Complexes: Synthesis, Crystal Structures, and Properties","Inorganic Chemistry","2007","46","","3450","3458","10.1021/ic061620p","","","0.71073","MoKα","","0.0164","0.016","","","0.0356","0.0357","","","","","","1.024","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307116","15.543","0.003","8.765","0.0015","18.219","0.003","90","","98.372","0.002","90","","2455.6","0.8","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C15 H18 N6 O18 Sm2 -","- C15 H16 N6 O18 Sm2 -","- C60 H64 N24 O72 Sm8 -","4","1","","Jun Xia; Bin Zhao; Hong-Sheng Wang; Wei Shi; Yue Ma; Hai-Bin Song; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Two- and Three-Dimensional Lanthanide Complexes: Synthesis, Crystal Structures, and Properties","Inorganic Chemistry","2007","46","","3450","3458","10.1021/ic061620p","","","0.71073","MoKα","","0.0153","0.0149","","","0.0318","0.0319","","","","","","0.931","","","","has coordinates,has disorder","179109","2020-10-21","18:00:00",""
"4307117","10.941","0.003","10.169","0.002","10.546","0.003","90","","100.13","0.003","90","","1155","0.5","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 Eu2 N6 O18 -","- C15 H18 Eu2 N6 O18 -","- C30 H36 Eu4 N12 O36 -","2","0.5","","Jun Xia; Bin Zhao; Hong-Sheng Wang; Wei Shi; Yue Ma; Hai-Bin Song; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Two- and Three-Dimensional Lanthanide Complexes: Synthesis, Crystal Structures, and Properties","Inorganic Chemistry","2007","46","","3450","3458","10.1021/ic061620p","","","0.71073","MoKα","","0.0301","0.023","","","0.0547","0.0569","","","","","","1.029","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307118","10.988","0.0018","10.2056","0.0017","10.5712","0.0017","90","","100.224","0.002","90","","1166.6","0.3","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 Gd2 N6 O18 -","- C15 H18 Gd2 N6 O18 -","- C30 H36 Gd4 N12 O36 -","2","0.5","","Jun Xia; Bin Zhao; Hong-Sheng Wang; Wei Shi; Yue Ma; Hai-Bin Song; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Two- and Three-Dimensional Lanthanide Complexes: Synthesis, Crystal Structures, and Properties","Inorganic Chemistry","2007","46","","3450","3458","10.1021/ic061620p","","","0.71073","MoKα","","0.0234","0.0201","","","0.0481","0.0494","","","","","","1.028","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307119","10.9584","0.0012","10.1701","0.0011","10.5284","0.0012","90","","100.236","0.001","90","","1154.7","0.2","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 N6 O18 Tb2 -","- C15 H18 N6 O18 Tb2 -","- C30 H36 N12 O36 Tb4 -","2","0.5","","Jun Xia; Bin Zhao; Hong-Sheng Wang; Wei Shi; Yue Ma; Hai-Bin Song; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Two- and Three-Dimensional Lanthanide Complexes: Synthesis, Crystal Structures, and Properties","Inorganic Chemistry","2007","46","","3450","3458","10.1021/ic061620p","","","0.71073","MoKα","","0.0228","0.0188","","","0.0448","0.0455","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307120","10.862","0.003","9.282","0.003","14.23","0.004","90","","104.968","0.004","90","","1386","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H9 Dy N4 O10 -","- C10 H9 Dy N4 O10 -","- C40 H36 Dy4 N16 O40 -","4","1","","Jun Xia; Bin Zhao; Hong-Sheng Wang; Wei Shi; Yue Ma; Hai-Bin Song; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Two- and Three-Dimensional Lanthanide Complexes: Synthesis, Crystal Structures, and Properties","Inorganic Chemistry","2007","46","","3450","3458","10.1021/ic061620p","","","0.71073","MoKα","","0.0333","0.0251","","","0.061","0.0639","","","","","","1.048","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307121","10.861","0.006","9.295","0.005","14.259","0.007","90","","104.901","0.007","90","","1391.1","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H9 Ho N4 O10 -","- C10 H9 Ho N4 O10 -","- C40 H36 Ho4 N16 O40 -","4","1","","Jun Xia; Bin Zhao; Hong-Sheng Wang; Wei Shi; Yue Ma; Hai-Bin Song; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Two- and Three-Dimensional Lanthanide Complexes: Synthesis, Crystal Structures, and Properties","Inorganic Chemistry","2007","46","","3450","3458","10.1021/ic061620p","","","0.71073","MoKα","","0.021","0.0162","","","0.0366","0.0374","","","","","","1.086","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307122","10.8421","0.0013","9.2566","0.0011","14.2362","0.0017","90","","104.872","0.002","90","","1380.9","0.3","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H7 Er N4 O10 -","- C10 H7 Er N4 O10 -","- C40 H28 Er4 N16 O40 -","4","1","","Jun Xia; Bin Zhao; Hong-Sheng Wang; Wei Shi; Yue Ma; Hai-Bin Song; Peng Cheng; Dai-Zheng Liao; Shi-Ping Yan","Two- and Three-Dimensional Lanthanide Complexes: Synthesis, Crystal Structures, and Properties","Inorganic Chemistry","2007","46","","3450","3458","10.1021/ic061620p","","","0.71073","MoKα","","0.0327","0.0273","","","0.0714","0.0744","","","","","","1.028","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307123","6.2672","0.001","8.6204","0.0014","12.936","0.002","105.314","0.002","90.439","0.002","105.081","0.002","648.65","0.18","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H16 N2 Nd4 O31 -","- C8 H6 N2 Nd4 O31 -","- C8 H6 N2 Nd4 O31 -","1","0.5","","Li-Zhi Zhang; Wen Gu; Bing Li; Xin Liu; Dai-Zheng Liao","{[Nd4(ox)4(NO3)2(OH)2(H2O)2].5H2O}n: A Porous 3D Lanthanide-Based Coordination Polymer with a Special Luminescent Property","Inorganic Chemistry","2007","46","","622","624","10.1021/ic061635n","","","0.71073","MoKα","","0.0352","0.0276","","","0.0659","0.0693","","","","","","1.032","","","","has coordinates,has disorder","179109","2020-10-21","18:00:00",""
"4307124","8.8565","0.0004","8.8565","0.0004","8.8565","0.0004","90","","90","","90","","694.68","0.05","","","","","","","","","","","","2","I -4 3 m","I -4 2 3","217","","","","- Cu5.59 Zn7.41 -","- Cu5.6 Zn7.4 -","- Cu22.4 Zn29.6 -","4","0.0833333","","Olivier Gourdon; Delphine Gout; Darrick J. Williams; Thomas Proffen; Sara Hobbs; Gordon J. Miller","Atomic Distributions in the γ-Brass Structure of the Cu-Zn System: A Structural and Theoretical Study","Inorganic Chemistry","2007","46","","251","260","10.1021/ic0616380","","","","","","","","","","","","","","","","","","","","","has coordinates","192062","2020-10-21","18:00:00",""
"4307125","8.8601","0.0005","8.8601","0.0005","8.8601","0.0005","90","","90","","90","","695.53","0.07","","","","","","","","","","","","2","I -4 3 m","I -4 2 3","217","","","","- Cu5.31 Zn7.69 -","- Cu5.36 Zn7.64 -","- Cu21.44 Zn30.56 -","4","0.0833333","","Olivier Gourdon; Delphine Gout; Darrick J. Williams; Thomas Proffen; Sara Hobbs; Gordon J. Miller","Atomic Distributions in the γ-Brass Structure of the Cu-Zn System: A Structural and Theoretical Study","Inorganic Chemistry","2007","46","","251","260","10.1021/ic0616380","","","","","","","","","","","","","","","","","","","","","has coordinates","192062","2020-10-21","18:00:00",""
"4307126","8.8664","0.0003","8.8664","0.0003","8.8664","0.0003","90","","90","","90","","697.01","0.04","","","","","","","","","","","","2","I -4 3 m","I -4 2 3","217","","","","- Cu5 Zn8 -","- Cu5 Zn8 -","- Cu20 Zn32 -","4","0.0833333","","Olivier Gourdon; Delphine Gout; Darrick J. Williams; Thomas Proffen; Sara Hobbs; Gordon J. Miller","Atomic Distributions in the γ-Brass Structure of the Cu-Zn System: A Structural and Theoretical Study","Inorganic Chemistry","2007","46","","251","260","10.1021/ic0616380","","","","","","","","","","","","","","","","","","","","","has coordinates","192062","2020-10-21","18:00:00",""
"4307127","8.8744","0.0004","8.8744","0.0004","8.8744","0.0004","90","","90","","90","","698.9","0.05","","","","","","","","","","","","2","I -4 3 m","I -4 2 3","217","","","","- Cu4.56 Zn8.44 -","- Cu4.55 Zn8.45 -","- Cu18.2 Zn33.8 -","4","0.0833333","","Olivier Gourdon; Delphine Gout; Darrick J. Williams; Thomas Proffen; Sara Hobbs; Gordon J. Miller","Atomic Distributions in the γ-Brass Structure of the Cu-Zn System: A Structural and Theoretical Study","Inorganic Chemistry","2007","46","","251","260","10.1021/ic0616380","","","","","","","","","","","","","","","","","","","","","has coordinates","192062","2020-10-21","18:00:00",""
"4307128","8.8829","0.0007","8.8829","0.0007","8.8829","0.0007","90","","90","","90","","700.91","0.1","","","","","","","","","","","","2","I -4 3 m","I -4 2 3","217","","","","- Cu4.21 Zn8.79 -","- Cu4.19 Zn8.81 -","- Cu16.76 Zn35.24 -","4","0.0833333","","Olivier Gourdon; Delphine Gout; Darrick J. Williams; Thomas Proffen; Sara Hobbs; Gordon J. Miller","Atomic Distributions in the γ-Brass Structure of the Cu-Zn System: A Structural and Theoretical Study","Inorganic Chemistry","2007","46","","251","260","10.1021/ic0616380","","","","","","","","","","","","","","","","","","","","","has coordinates","192062","2020-10-21","18:00:00",""
"4307129","13.4864","0.0009","11.1","0.0008","9.0925","0.0007","90","","120.335","0.003","90","","1174.78","0.15","110","2","110","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C10 H7 Cu N O4 -","- C10 H7 Cu N O4 -","- C40 H28 Cu4 N4 O16 -","4","0.5","","Banglin Chen; Shengqian Ma; Fatima Zapata; Frank R. Fronczek; Emil B. Lobkovsky; Hong-Cai Zhou","Rationally Designed Micropores within a Metal-Organic Framework for Selective Sorption of Gas Molecules","Inorganic Chemistry","2007","46","","1233","1236","10.1021/ic0616434","","","0.71073","MoKα","","0.0423","0.0324","","","0.084","0.0861","","","","","","1.077","","","","has coordinates,has disorder","179109","2020-10-21","18:00:00",""
"4307130","8.7534","0.0004","8.5519","0.0005","28.833","0.002","90","","93.5582","0.0007","90","","2154.2","0.2","298.1","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 Cl F6 N4 O2 P Ru -","- C17 H16 Cl F6 N4 O2 P Ru -","- C68 H64 Cl4 F24 N16 O8 P4 Ru4 -","4","1","","Hirotaka Nagao; Keiji Enomoto; Yuuki Wakabayashi; Gen Komiya; Toshiyuki Hirano; Takao Oi","Synthesis of Nitrosylruthenium Complexes Containing 2,2':6',2''-Terpyridine by Reactions of Alkoxo Complexes with Acids","Inorganic Chemistry","2007","46","","1431","1439","10.1021/ic061644w","","","0.7107","MoKα","","","0.042","","","","0.138","","","","","","1.006","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307131","10.6","0.002","17.042","0.003","13.817","0.003","90","","106.23","0.0009","90","","2396.5","0.8","123.1","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C20 H21 Cl F6 N5 O2 P Ru -","- C20 H21 Cl F6 N5 O2 P Ru -","- C80 H84 Cl4 F24 N20 O8 P4 Ru4 -","4","1","","Hirotaka Nagao; Keiji Enomoto; Yuuki Wakabayashi; Gen Komiya; Toshiyuki Hirano; Takao Oi","Synthesis of Nitrosylruthenium Complexes Containing 2,2':6',2''-Terpyridine by Reactions of Alkoxo Complexes with Acids","Inorganic Chemistry","2007","46","","1431","1439","10.1021/ic061644w","","","0.7107","MoKα","","","0.0372","","","","0.1033","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307132","8.0868","0.0005","9.2038","0.0005","27.511","0.002","90","","90","","90","","2047.6","0.2","298.1","","","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C16 H11 Cl2 F3 N4 O4 Ru S -","- C16 H11 Cl2 F3 N4 O4 Ru S -","- C64 H44 Cl8 F12 N16 O16 Ru4 S4 -","4","1","","Hirotaka Nagao; Keiji Enomoto; Yuuki Wakabayashi; Gen Komiya; Toshiyuki Hirano; Takao Oi","Synthesis of Nitrosylruthenium Complexes Containing 2,2':6',2''-Terpyridine by Reactions of Alkoxo Complexes with Acids","Inorganic Chemistry","2007","46","","1431","1439","10.1021/ic061644w","","","0.7107","MoKα","","","0.043","","","","0.116","","","","","","1.012","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307133","12.439","0.003","12.048","0.003","17.201","0.004","90","","91.0075","0.0009","90","","2577.4","1.1","298.1","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C17 H14 Cl F12 N5 O P2 Ru -","- C17 H14 Cl F12 N5 O P2 Ru -","- C68 H56 Cl4 F48 N20 O4 P8 Ru4 -","4","1","","Hirotaka Nagao; Keiji Enomoto; Yuuki Wakabayashi; Gen Komiya; Toshiyuki Hirano; Takao Oi","Synthesis of Nitrosylruthenium Complexes Containing 2,2':6',2''-Terpyridine by Reactions of Alkoxo Complexes with Acids","Inorganic Chemistry","2007","46","","1431","1439","10.1021/ic061644w","","","0.7107","MoKα","","","0.0522","","","","0.1735","","","","","","0.974","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307134","15.5804","0.0008","15.5804","0.0008","20.8694","0.0011","90","","90","","120","","4387.3","0.4","100","2","100","2","","","","","","","","5","P 3 1 c","P 3 -2c","159","","","","- C63 H126 Fe7 N3 O33 -","- C63 H126 Fe7 N3 O33 -","- C126 H252 Fe14 N6 O66 -","2","0.333333","","Ayuk M. Ako; Oliver Waldmann; Valeriu Mereacre; Frederik Klöwer; Ian J. Hewitt; Christopher E. Anson; Hans U. Güdel; Annie K. Powell","Odd-Numbered FeIII Complexes: Synthesis, Molecular Structure, Reactivity, and Magnetic Properties","Inorganic Chemistry","2007","46","","756","766","10.1021/ic061650s","","","0.71073","MoKα","","0.0358","0.0338","","","0.0859","0.0869","","","","","","1.051","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307135","63.351","0.003","10.4329","0.0005","31.409","0.0016","90","","115.078","0.001","90","","18802.4","1.6","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C69.5 H138 Cl Fe7 N3 O30 -","- C69.5 H137 Cl Fe7 N3 O30 -","- C556 H1096 Cl8 Fe56 N24 O240 -","8","1","","Ayuk M. Ako; Oliver Waldmann; Valeriu Mereacre; Frederik Klöwer; Ian J. Hewitt; Christopher E. Anson; Hans U. Güdel; Annie K. Powell","Odd-Numbered FeIII Complexes: Synthesis, Molecular Structure, Reactivity, and Magnetic Properties","Inorganic Chemistry","2007","46","","756","766","10.1021/ic061650s","","","0.71073","MoKα","","0.0635","0.038","","","0.0786","0.0822","","","","","","0.986","","","","has coordinates,has disorder","179109","2020-10-21","18:00:00",""
"4307136","10.6609","0.0005","31.595","0.0014","27.2343","0.0011","90","","90.12","0.001","90","","9173.3","0.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C75 H126 Fe7 N3 O30 -","- C75 H126 Fe7 N3 O30 -","- C300 H504 Fe28 N12 O120 -","4","1","","Ayuk M. Ako; Oliver Waldmann; Valeriu Mereacre; Frederik Klöwer; Ian J. Hewitt; Christopher E. Anson; Hans U. Güdel; Annie K. Powell","Odd-Numbered FeIII Complexes: Synthesis, Molecular Structure, Reactivity, and Magnetic Properties","Inorganic Chemistry","2007","46","","756","766","10.1021/ic061650s","","","0.71073","MoKα","","0.0659","0.0457","","","0.1307","0.138","","","","","","1.036","","","","has coordinates,has disorder","179109","2020-10-21","18:00:00",""
"4307137","23.6121","0.0008","15.0975","0.0005","44.6731","0.0014","90","","94.523","0.001","90","","15875.6","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C55 H107.5 Fe8 N13.5 O27.5 -","- C55 H106.32 Fe8 N13.5 O27.5 -","- C440 H850.56 Fe64 N108 O220 -","8","2","","Ayuk M. Ako; Oliver Waldmann; Valeriu Mereacre; Frederik Klöwer; Ian J. Hewitt; Christopher E. Anson; Hans U. Güdel; Annie K. Powell","Odd-Numbered FeIII Complexes: Synthesis, Molecular Structure, Reactivity, and Magnetic Properties","Inorganic Chemistry","2007","46","","756","766","10.1021/ic061650s","","","0.71073","MoKα","","0.0956","0.0504","","","0.1173","0.1276","","","","","","0.978","","","","has coordinates,has disorder","179109","2020-10-21","18:00:00",""
"4307138","55.495","0.002","15.4971","0.0009","21.1361","0.0009","90","","111","0.003","90","","16970","1.4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C61 H111 Fe8 N9 O27 S3 -","- C61 H104.78 Fe8 N9 O27 S3 -","- C488 H838.24 Fe64 N72 O216 S24 -","8","1","","Ayuk M. Ako; Oliver Waldmann; Valeriu Mereacre; Frederik Klöwer; Ian J. Hewitt; Christopher E. Anson; Hans U. Güdel; Annie K. Powell","Odd-Numbered FeIII Complexes: Synthesis, Molecular Structure, Reactivity, and Magnetic Properties","Inorganic Chemistry","2007","46","","756","766","10.1021/ic061650s","","","0.71073","MoKα","","0.0817","0.0516","","","0.1171","0.1254","","","","","","1.012","","","","has coordinates,has disorder","179109","2020-10-21","18:00:00",""
"4307139","12.996","0.0014","6.9495","0.0007","16.16","0.0017","90","","102.368","0.002","90","","1425.6","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H48 N2 Ni O10 -","- C22 H48 N2 Ni O10 -","- C44 H96 N4 Ni2 O20 -","2","0.5","","Ayuk M. Ako; Oliver Waldmann; Valeriu Mereacre; Frederik Klöwer; Ian J. Hewitt; Christopher E. Anson; Hans U. Güdel; Annie K. Powell","Odd-Numbered FeIII Complexes: Synthesis, Molecular Structure, Reactivity, and Magnetic Properties","Inorganic Chemistry","2007","46","","756","766","10.1021/ic061650s","","","0.71073","MoKα","","0.0437","0.0299","","","0.0629","0.0649","","","","","","1.002","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307140","15.51","0.003","16.661","0.003","25.943","0.005","86.253","0.004","81.86","0.004","66.513","0.003","6086","2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C74 H152 K4 N10 Ni5 O24 Sb17 -","- C74 H152.02 K4 N10 Ni5 O24 Sb17 -","- C148 H304.04 K8 N20 Ni10 O48 Sb34 -","2","1","","Melanie J. Moses; James C. Fettinger; Bryan W. Eichhorn","[Ni5Sb17]4-Transition-Metal Zintl Ion Complex: Crossing the Zintl Border in Molecular Intermetalloid Clusters","Inorganic Chemistry","2007","46","","1036","1038","10.1021/ic0616535","","","0.71073","MoKα","","0.0768","0.0443","","","0.1072","0.1168","","","","","","1.074","","","","has coordinates,has disorder","179109","2020-10-21","18:00:00",""
"4307141","11.3864","0.0003","14.2809","0.0003","16.9416","0.0004","103.412","0.0003","91.5691","0.0003","101.357","0.0003","2619.52","0.11","141","1","141","1","","","","","","","","6","P -1","-P 1","2","","","","- C44 H56 Mo2 O6 P2 Te2 -","- C44 H56 Mo2 O6 P2 Te2 -","- C88 H112 Mo4 O12 P4 Te4 -","2","1","","John J. Weir; James E. McDonough; George Fortman; Derek Isrow; Carl D. Hoff; Brian Scott; Gregory J. Kubas","Synthesis, Structure, and Thermochemistry of the Formation of the Metal-Metal Bonded Dimers [Mo(μ-TeAr)(CO)3(PiP3)]2 (Ar = Phenyl, Naphthyl) by Phosphine Elimination from .Mo(TePh)(CO)3(PiPr3)2","Inorganic Chemistry","2007","46","","652","659","10.1021/ic061654x","","","0.71073","MoKα","","0.0449","0.0283","","","0.0833","0.1217","","","","","","0.992","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307142","9.1658","0.0018","12.681","0.003","9.6882","0.0019","90","","106.74","0.03","90","","1078.4","0.4","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Co2 H4 O14 P2 -","- Co2 H4 O14 P4 -","- Co8 H16 O56 P16 -","4","1","","Tao Yang; Jing Ju; Guobao Li; Sihai Yang; Junliang Sun; Fuhui Liao; Jianhua Lin; Juns Sasaki; Naoki Toyota","MH2P2O7 (M = Co, Ni): Metamagnetic Interaction between the Zigzag Octahedral Chains","Inorganic Chemistry","2007","46","","2342","2344","10.1021/ic061665q","","","0.71073","MoKα","","0.0521","0.0454","","","0.1665","0.1831","","","","","","1","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307143","9.096","0.0018","12.593","0.003","9.5999","0.0019","90","","106.47","0.03","90","","1054.5","0.4","290","2","290","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- H4 Ni2 O14 P4 -","- H4 Ni2 O14 P4 -","- H16 Ni8 O56 P16 -","4","1","","Tao Yang; Jing Ju; Guobao Li; Sihai Yang; Junliang Sun; Fuhui Liao; Jianhua Lin; Juns Sasaki; Naoki Toyota","MH2P2O7 (M = Co, Ni): Metamagnetic Interaction between the Zigzag Octahedral Chains","Inorganic Chemistry","2007","46","","2342","2344","10.1021/ic061665q","","","0.71073","MoKα","","0.0482","0.032","","","0.1024","0.1128","","","","","","1","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307144","18.568","0.003","11.63","0.002","19.741","0.004","90","","107.202","0.004","90","","4072.3","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Tb(BTC)(DMF)2(H2O)","","","- C15 H19 N2 O9 Tb -","- C15 H17 N2 O9 Tb -","- C120 H136 N16 O72 Tb8 -","8","1","","Zhongyue Li; Guangshan Zhu; Xiaodan Guo; Xiaojun Zhao; Zhao Jin; Shilun Qiu","Synthesis, Structure, and Luminescent and Magnetic Properties of Novel Lanthanide Metal-Organic Frameworks with Zeolite-like Topology","Inorganic Chemistry","2007","46","","5174","5178","10.1021/ic061666i","","","0.71073","MoKα","","0.0532","0.0402","","","0.1088","0.1148","","","","","","1.05","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307145","18.493","0.018","11.58","0.018","19.51","0.02","90","","107.22","0.03","90","","3991","8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Dy(BTC)(DMF)2(H2O)","","","- C15 H19 Dy N2 O9 -","- C15 H17 Dy N2 O9 -","- C120 H136 Dy8 N16 O72 -","8","1","","Zhongyue Li; Guangshan Zhu; Xiaodan Guo; Xiaojun Zhao; Zhao Jin; Shilun Qiu","Synthesis, Structure, and Luminescent and Magnetic Properties of Novel Lanthanide Metal-Organic Frameworks with Zeolite-like Topology","Inorganic Chemistry","2007","46","","5174","5178","10.1021/ic061666i","","","0.71073","MoKα","","0.0893","0.0494","","","0.1127","0.1198","","","","","","1.006","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307146","18.44","0.004","11.647","0.002","19.698","0.004","90","","107.06","0.03","90","","4044.4","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Ho(BTC)(DMF)2(H2O)","","","- C15 H19 Ho N2 O9 -","- C15 H18 Ho N2 O9 -","- C120 H144 Ho8 N16 O72 -","8","1","","Zhongyue Li; Guangshan Zhu; Xiaodan Guo; Xiaojun Zhao; Zhao Jin; Shilun Qiu","Synthesis, Structure, and Luminescent and Magnetic Properties of Novel Lanthanide Metal-Organic Frameworks with Zeolite-like Topology","Inorganic Chemistry","2007","46","","5174","5178","10.1021/ic061666i","","","0.71073","MoKα","","0.0593","0.0401","","","0.1104","0.1238","","","","","","0.998","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307147","18.4014","0.001","11.6492","0.001","19.6803","0.0013","90","","106.979","0.002","90","","4034.8","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Er(BTC)(DMF)2 (H2O)","","","- C15 H19 Er N2 O9 -","- C15 H17 Er N2 O9 -","- C120 H136 Er8 N16 O72 -","8","1","","Zhongyue Li; Guangshan Zhu; Xiaodan Guo; Xiaojun Zhao; Zhao Jin; Shilun Qiu","Synthesis, Structure, and Luminescent and Magnetic Properties of Novel Lanthanide Metal-Organic Frameworks with Zeolite-like Topology","Inorganic Chemistry","2007","46","","5174","5178","10.1021/ic061666i","","","0.71073","MoKα","","0.0602","0.0509","","","0.1211","0.1287","","","","","","0.943","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307148","18.382","0.002","11.5929","0.0015","19.632","0.003","90","","107.086","0.002","90","","3998.9","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Tm(BTC)(DMF)2(H2O)","","","- C15 H19 N2 O9 Tm -","- C15 H17 N2 O9 Tm -","- C120 H136 N16 O72 Tm8 -","8","1","","Zhongyue Li; Guangshan Zhu; Xiaodan Guo; Xiaojun Zhao; Zhao Jin; Shilun Qiu","Synthesis, Structure, and Luminescent and Magnetic Properties of Novel Lanthanide Metal-Organic Frameworks with Zeolite-like Topology","Inorganic Chemistry","2007","46","","5174","5178","10.1021/ic061666i","","","0.71073","MoKα","","0.0892","0.0593","","","0.1079","0.124","","","","","","1.023","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307149","18.299","0.004","11.592","0.002","19.557","0.004","90","","107.01","0.03","90","","3967","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Yb(BTC)(DMF)2(H2O)","","","- C15 H19 N2 O9 Yb -","- C15 H17 N2 O9 Yb -","- C120 H136 N16 O72 Yb8 -","8","1","","Zhongyue Li; Guangshan Zhu; Xiaodan Guo; Xiaojun Zhao; Zhao Jin; Shilun Qiu","Synthesis, Structure, and Luminescent and Magnetic Properties of Novel Lanthanide Metal-Organic Frameworks with Zeolite-like Topology","Inorganic Chemistry","2007","46","","5174","5178","10.1021/ic061666i","","","0.71073","MoKα","","0.0626","0.0531","","","0.1429","0.1508","","","","","","1.007","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307150","14.44","0.001","13.423","0.001","23.497","0.003","90","","104.44","0.01","90","","4410.5","0.7","295","2","295","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C44 H68 Cu4 N8 O66 Si W12 -","- C44 H32 Cu4 N8 O66 Si W12 -","- C88 H64 Cu8 N16 O132 Si2 W24 -","2","0.5","","Santiago Reinoso; Pablo Vitoria; Leire San Felices; Ainara Montero; Luis Lezama; Juan M. Gutiérrez-Zorrilla","Tetrahydroxy-p-benzoquinone as a Source of Polydentate O-Donor Ligands. Synthesis, Crystal Structure, and Magnetic Properties of the [Cu(bpy)(dhmal)]2 Dimer and the Two-Dimensional [{SiW12O40}{Cu2(bpy)2(H2O)(ox)}2].16H2O Inorganic-Metalorganic Hybrid","Inorganic Chemistry","2007","46","","1237","1249","10.1021/ic061671m","","x-ray","0.71073","MoKα","","0.2079","0.0736","","","0.1039","0.1323","","","","","","0.977","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307151","8.4965","0.0006","9.3315","0.0011","9.7891","0.001","60.807","0.011","68.977","0.008","88.397","0.007","622.07","0.14","295","2","295","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C26 H20 Cu2 N4 O12 -","- C26 H20 Cu2 N4 O12 -","- C26 H20 Cu2 N4 O12 -","1","0.5","","Santiago Reinoso; Pablo Vitoria; Leire San Felices; Ainara Montero; Luis Lezama; Juan M. Gutiérrez-Zorrilla","Tetrahydroxy-p-benzoquinone as a Source of Polydentate O-Donor Ligands. Synthesis, Crystal Structure, and Magnetic Properties of the [Cu(bpy)(dhmal)]2 Dimer and the Two-Dimensional [{SiW12O40}{Cu2(bpy)2(H2O)(ox)}2].16H2O Inorganic-Metalorganic Hybrid","Inorganic Chemistry","2007","46","","1237","1249","10.1021/ic061671m","","x-ray","","MoKα","","0.0755","0.0393","","","0.0709","0.0754","","","","","","0.875","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307152","11.9236","0.0015","11.8939","0.0015","25.68","0.003","90","","100.805","0.003","90","","3577.3","0.8","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H36 B Fe Mn N11 O6 -","- C32 H36 B Fe Mn N11 O6 -","- C128 H144 B4 Fe4 Mn4 N44 O24 -","4","1","","Shi Wang; Marilena Ferbinteanu; Masahiro Yamashita","Cyanide-Bridged Fe(III)-Mn(III) Chain with Metamagnetic Properties and Significant Magnetic Anisotropy","Inorganic Chemistry","2007","46","","610","612","10.1021/ic061681n","","","0.71073","MoKα","","0.0671","0.049","","","0.1381","0.144","","","","","","0.988","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307153","30.38","0.04","10.368","0.014","43.3","0.06","90","","94.66","0.03","90","","13594","3","223","2","223","2","","","","","","","","8","I 1 2/a 1","-I 2ya","15","","","","- C70 H58 Cl Co F8 Fe N8 O7 -","- C62 H38 Cl Co F8 Fe N8 O5 -","- C496 H304 Cl8 Co8 F64 Fe8 N64 O40 -","8","1","","Eduardo E. Chufán; Claudio N. Verani; Simona C. Puiu; Eva Rentschler; Ulrich Schatzschneider; Christopher Incarvito; Arnold L. Rheingold; Kenneth D. Karlin","Generation and Characterization of [(P)M-(X)-Co(TMPA)]n+ Assemblies; P = Porphyrinate, M = FeIII and CoIII, X = O2-, OH-, O22-, and TMPA = Tris(2-pyridylmethyl)amine","Inorganic Chemistry","2007","46","","3017","3026","10.1021/ic061686k","","","0.71073","MoKα","","0.0988","0.0844","","","0.2291","0.2347","","","","","","1.651","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307154","13.151","0.001","13.199","0.001","17.441","0.002","102.02","0.01","96.16","0.01","119.12","0.01","2508.5","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H86 B Cl2 O3 Si3 Ta -","- C42 H86 B Cl2 O3 Si3 Ta -","- C84 H172 B2 Cl4 O6 Si6 Ta2 -","2","1","","Jeffrey B. Bonanno; Thomas P. Henry; Peter T. Wolczanski; Aaron W. Pierpont; Thomas R. Cundari","Evidence for Strong Tantalum-to-Boron Dative Interactions in (silox)3Ta(BH3) and (silox)3Ta(η2-B,Cl-BCl2Ph) (silox =tBu3SiO)1","Inorganic Chemistry","2007","46","","1222","1232","10.1021/ic0616885","","","0.71073","MoKα","","0.056","0.0433","","0.1174","0.1047","","","","1.04","1.038","1.038","","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307155","7.081","0.001","12.252","0.002","8.699","0.001","90","","90","","90","","754.69","0.18","293","2","293","2","","","","","","","","3","I 2 c m","I -2c 2","46","","","","- Ag Sc Sn -","- Ag Sc Sn -","- Ag12 Sc12 Sn12 -","12","1.5","","C. Peter Sebastian; Long Zhang; Constanze Fehse; Rolf-Dieter Hoffmann; Hellmut Eckert; Rainer Pöttgen","New Stannide ScAgSn: Determination of the Superstructure via Two-Dimensional 45Sc Solid State NMR","Inorganic Chemistry","2007","46","","771","779","10.1021/ic061691o","","","0.71073","MoKα","","0.0477","0.0371","","","0.0739","0.0787","","","","","","1.022","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307156","7.082","0.002","7.082","0.002","4.339","0.001","90","","90","","120","","188.47","0.09","293","2","293","2","","","","","","","","3","P -6 2 m","P -6 -2","189","","","","- Ag Sc Sn -","- Ag Sc Sn -","- Ag3 Sc3 Sn3 -","3","0.25","","C. Peter Sebastian; Long Zhang; Constanze Fehse; Rolf-Dieter Hoffmann; Hellmut Eckert; Rainer Pöttgen","New Stannide ScAgSn: Determination of the Superstructure via Two-Dimensional 45Sc Solid State NMR","Inorganic Chemistry","2007","46","","771","779","10.1021/ic061691o","","","0.71073","MoKα","","0.0578","0.0569","","","0.126","0.1264","","","","","","1.332","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307157","16.5172","0.0016","9.7901","0.0009","16.2392","0.0015","90","","114.288","0.001","90","","2393.5","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H32 Br4 Fe Mg O4 -","- C16 H32 Br4 Fe Mg O4 -","- C64 H128 Br16 Fe4 Mg4 O16 -","4","1","","Minoru Kobayashi; Akito Takashima; Tomohiko Ishii; Hiroshi Naka; Masanobu Uchiyama; Kentaro Yamaguchi","Reverse Photochromic Behavior of an Iron-Magnesium Complex","Inorganic Chemistry","2007","46","","1039","1041","10.1021/ic0616986","","","0.71073","MoKα","","0.0607","0.0446","","","0.1289","0.1379","","","","","","1.057","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307158","11.1891","0.0015","40.21","0.005","12.596","0.003","90","","97.934","0.008","90","","5612.9","1.7","193","2","193","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C44 H82 B Fe3 Mo N11 S4 -","- C44 H76 B Fe3 Mo N11 S4 -","- C176 H304 B4 Fe12 Mo4 N44 S16 -","4","1","","Russell P. Pesavento; Curtis P. Berlinguette; R. H. Holm","Stabilization of Reduced Molybdenum-Iron-Sulfur Single- and Double-Cubane Clusters by Cyanide Ligation","Inorganic Chemistry","2007","46","","510","516","10.1021/ic061704y","","","0.71073","MoKα","","0.0682","0.0541","","","0.1387","0.1484","","","","","","1.045","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307159","12.79","0.005","13.476","0.007","17.12","0.006","89.51","0.04","75.03","0.03","66.86","0.03","2607","2","193","2","193","2","","","","","","","","7","P -1","-P 1","2","(Et4N)3(C9BH10N6)MoFe3S4(CN)3(MeCN)","","","- C38 H73 B Fe3 Mo N13 S4 -","- C38 H53 B Fe3 Mo N13 S4 -","- C76 H106 B2 Fe6 Mo2 N26 S8 -","2","1","","Russell P. Pesavento; Curtis P. Berlinguette; R. H. Holm","Stabilization of Reduced Molybdenum-Iron-Sulfur Single- and Double-Cubane Clusters by Cyanide Ligation","Inorganic Chemistry","2007","46","","510","516","10.1021/ic061704y","","","0.71073","MoKα","","0.0678","0.055","","","0.1465","0.1577","","","","","","1.051","","","","has coordinates,has disorder","179109","2020-10-21","18:00:00",""
"4307160","12.022","0.005","14.269","0.007","15.745","0.008","112.4","0.04","96.86","0.06","107.08","0.04","2304","2","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C66 H118 B2 Fe6 Mo2 N26 S8 -","- C66 H118 B2 Fe6 Mo2 N26 S8 -","- C66 H118 B2 Fe6 Mo2 N26 S8 -","1","0.5","","Russell P. Pesavento; Curtis P. Berlinguette; R. H. Holm","Stabilization of Reduced Molybdenum-Iron-Sulfur Single- and Double-Cubane Clusters by Cyanide Ligation","Inorganic Chemistry","2007","46","","510","516","10.1021/ic061704y","","","0.71073","MoKα","","0.0836","0.0583","","","0.1302","0.1414","","","","","","1.09","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307161","9.738","0.0002","9.738","0.0002","55.5716","0.0015","90","","90","","120","","4563.76","0.18","294","2","294","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- Na3 O36 Pr14 Ru6 -","- Na3 O36 Pr14 Ru6 -","- Na18 O216 Pr84 Ru36 -","6","0.166667","","William R. Gemmill; Mark D. Smith; Hans-Conrad zur Loye","Ln14Na3Ru6O36 (Ln = Pr, Nd): Two New Complex Lanthanide-Containing Oxides of Ruthenium","Inorganic Chemistry","2007","46","","2132","2138","10.1021/ic0617083","","","0.71073","MoKα","","0.0417","0.0368","","","0.0727","0.0744","","","","","","1.087","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307162","9.6781","0.0002","9.6781","0.0002","55.4156","0.0018","90","","90","","120","","4495.1","0.2","293","2","293","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- Na3 Nd14 O36 Ru6 -","- Na3 Nd14 O36 Ru6 -","- Na18 Nd84 O216 Ru36 -","6","0.166667","","William R. Gemmill; Mark D. Smith; Hans-Conrad zur Loye","Ln14Na3Ru6O36 (Ln = Pr, Nd): Two New Complex Lanthanide-Containing Oxides of Ruthenium","Inorganic Chemistry","2007","46","","2132","2138","10.1021/ic0617083","","","0.71073","MoKα","","0.0325","0.032","","","0.0677","0.0679","","","","","","1.165","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307163","13.894","0.002","27.684","0.005","16.744","0.003","90","","106.879","0.003","90","","6163","1.8","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C104 H96 Bi4 Br12 N8 O8 S12 Zn -","- C104 H96 Bi4 Br12 N8 O8 S12 Zn -","- C208 H192 Bi8 Br24 N16 O16 S24 Zn2 -","2","0.5","","Kunhao Li; Guo Huang; Zhengtao Xu; Mingliang Zhang; Matthias Zeller; Allen D. Hunter; Stephen Sin-Yin Chui; Chi-Ming Che; Wai-Yeung Wong","Multiple Bismuth(III)-Thioether Secondary Interactions Integrate Metalloporphyrin Ligands into Functional Networks","Inorganic Chemistry","2007","46","","4844","4849","10.1021/ic061711m","","","0.71073","MoKα","","0.0372","0.031","","","0.0756","0.078","","","","","","1.056","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307164","13.949","0.0019","27.592","0.004","16.714","0.002","90","","107.134","0.002","90","","6147.4","1.4","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C104 H96 Bi4 Br12 Cu N8 O8 S12 -","- C104 H96 Bi4 Br12 Cu N8 O8 S12 -","- C208 H192 Bi8 Br24 Cu2 N16 O16 S24 -","2","0.5","","Kunhao Li; Guo Huang; Zhengtao Xu; Mingliang Zhang; Matthias Zeller; Allen D. Hunter; Stephen Sin-Yin Chui; Chi-Ming Che; Wai-Yeung Wong","Multiple Bismuth(III)-Thioether Secondary Interactions Integrate Metalloporphyrin Ligands into Functional Networks","Inorganic Chemistry","2007","46","","4844","4849","10.1021/ic061711m","","","0.71073","MoKα","","0.0348","0.0257","","","0.0566","0.0594","","","","","","1.044","","","","has coordinates,has disorder","179109","2020-10-21","18:00:00",""
"4307165","13.3","0.004","13.3","0.004","11.247","0.007","90","","90","","120","","1722.9","1.3","120","2","120","2","","","","","","","","7","P -3","-P 3","147","","","","- C27.5 H16.5 B Br6 Cl1.5 N6 Tl -","- C27 H16 B Br6 N6 Tl -","- C54 H32 B2 Br12 N12 Tl2 -","2","0.333333","","Glen P. A. Yap; Fernando Jove; Juan Urbano; Eleuterio Alvarez; Swiatoslaw Trofimenko; M. Mar Díaz-Requejo; Pedro J. Pérez","Unusual Polybrominated Polypyrazolylborates and Their Copper(I) Complexes: Synthesis, Characterization, and Catalytic Activity","Inorganic Chemistry","2007","46","","780","787","10.1021/ic061714z","","","0.71073","MoKα","","0.0411","0.0309","","","0.0605","0.0629","","","","","","1.056","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307166","13.153","0.002","13.153","0.002","12.841","0.005","90","","90","","120","","1923.9","0.9","120","2","120","2","","","","","","","","7","P -3","-P 3","147","","","","- C32 H30 B Br6 N6 O2 Tl -","- C30 H22 B Br6 N6 Tl -","- C60 H44 B2 Br12 N12 Tl2 -","2","0.333333","","Glen P. A. Yap; Fernando Jove; Juan Urbano; Eleuterio Alvarez; Swiatoslaw Trofimenko; M. Mar Díaz-Requejo; Pedro J. Pérez","Unusual Polybrominated Polypyrazolylborates and Their Copper(I) Complexes: Synthesis, Characterization, and Catalytic Activity","Inorganic Chemistry","2007","46","","780","787","10.1021/ic061714z","","","0.71073","MoKα","","0.0181","0.0173","","","0.0429","0.0432","","","","","","1.028","","","","has coordinates,has disorder","179109","2020-10-21","18:00:00",""
"4307167","13.062","0.007","12.861","0.007","23.588","0.013","90","","94.843","0.009","90","","3948","4","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H21 B Br6 Cl3 N6 Tl -","- C34 H21 B Br6 Cl3 N6 Tl -","- C136 H84 B4 Br24 Cl12 N24 Tl4 -","4","1","","Glen P. A. Yap; Fernando Jove; Juan Urbano; Eleuterio Alvarez; Swiatoslaw Trofimenko; M. Mar Díaz-Requejo; Pedro J. Pérez","Unusual Polybrominated Polypyrazolylborates and Their Copper(I) Complexes: Synthesis, Characterization, and Catalytic Activity","Inorganic Chemistry","2007","46","","780","787","10.1021/ic061714z","","","0.71073","MoKα","","0.1281","0.0826","","","0.2013","0.2274","","","","","","1.046","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307168","10.39","0.004","11.299","0.004","15.977","0.006","99.3","0.005","95","0.005","103.33","0.005","1785.9","1.2","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H21 B Br3 Cl4 N6 Tl -","- C33 H21 B Br3 Cl4 N6 Tl -","- C66 H42 B2 Br6 Cl8 N12 Tl2 -","2","1","","Glen P. A. Yap; Fernando Jove; Juan Urbano; Eleuterio Alvarez; Swiatoslaw Trofimenko; M. Mar Díaz-Requejo; Pedro J. Pérez","Unusual Polybrominated Polypyrazolylborates and Their Copper(I) Complexes: Synthesis, Characterization, and Catalytic Activity","Inorganic Chemistry","2007","46","","780","787","10.1021/ic061714z","","","0.71073","MoKα","","0.0874","0.0858","","","0.226","0.2284","","","","","","1.061","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307169","18.3335","0.0018","18.3335","0.0018","8.0474","0.0012","90","","90","","120","","2342.5","0.5","298","2","298","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C30 H25 B Br3 N6 Tl -","- C30 H25 B Br3 N6 Tl -","- C90 H75 B3 Br9 N18 Tl3 -","3","0.333333","","Glen P. A. Yap; Fernando Jove; Juan Urbano; Eleuterio Alvarez; Swiatoslaw Trofimenko; M. Mar Díaz-Requejo; Pedro J. Pérez","Unusual Polybrominated Polypyrazolylborates and Their Copper(I) Complexes: Synthesis, Characterization, and Catalytic Activity","Inorganic Chemistry","2007","46","","780","787","10.1021/ic061714z","","","0.71073","MoKα","","0.0571","0.045","","","0.0773","0.0809","","","","","","1.05","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307170","20.948","0.009","10.025","0.004","34.381","0.015","90","","90","","90","","7220","5","100","2","100","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C33 H27 B Br6 Cl2 Cu N7 -","- C33 H27 B Br6 Cl2 Cu N7 -","- C264 H216 B8 Br48 Cl16 Cu8 N56 -","8","2","","Glen P. A. Yap; Fernando Jove; Juan Urbano; Eleuterio Alvarez; Swiatoslaw Trofimenko; M. Mar Díaz-Requejo; Pedro J. Pérez","Unusual Polybrominated Polypyrazolylborates and Their Copper(I) Complexes: Synthesis, Characterization, and Catalytic Activity","Inorganic Chemistry","2007","46","","780","787","10.1021/ic061714z","","","0.71073","MoKα","","0.1117","0.0565","","","0.1204","0.14","","","","","","1.03","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307171","18.878","0.002","10.3822","0.0011","19.223","0.002","90","","106.492","0.004","90","","3612.6","0.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C70 H65 B2 Br6 Cu2 N17 -","- C70 H65 B2 Br6 Cu2 N17 -","- C140 H130 B4 Br12 Cu4 N34 -","2","0.5","","Glen P. A. Yap; Fernando Jove; Juan Urbano; Eleuterio Alvarez; Swiatoslaw Trofimenko; M. Mar Díaz-Requejo; Pedro J. Pérez","Unusual Polybrominated Polypyrazolylborates and Their Copper(I) Complexes: Synthesis, Characterization, and Catalytic Activity","Inorganic Chemistry","2007","46","","780","787","10.1021/ic061714z","","","0.71073","MoKα","","0.0891","0.0697","","","0.1392","0.1475","","","","","","1.097","","","","has coordinates,has disorder","179109","2020-10-21","18:00:00",""
"4307172","8.748","0.002","10.528","0.002","12.232","0.003","101.13","0.02","94.29","0.02","111.49","0.02","1015.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","bis[mu2-glutarato,O,O'-aquo-(2,2'bipyridine)-copper(II)] bis(orthoboric acid) tetrahydrated","","- C30 H46 B2 Cu2 N4 O20 -","- C30 H46 B2 Cu2 N4 O20 -","- C30 H46 B2 Cu2 N4 O20 -","1","0.5","","A. K. Ghosh; D. Ghoshal; E. Zangrando; J. Ribas; N. Ray Chaudhuri","Syntheses, Crystal Structures, and Magnetic Properties of Metal-Organic Hybrid Materials of Cu(II): Effect of a Long Chain Dicarboxylate Backbone, and Counteranion in Their Structural Diversity","Inorganic Chemistry","2007","46","","3057","3071","10.1021/ic061720v","","","0.71073","Mokα","","0.0462","0.0381","","","0.1066","0.1111","","","","","","1.002","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307173","9.224","0.003","18.761","0.004","18.889","0.004","90","","103.87","0.02","90","","3173.5","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis(mu4-glutarato,O,O',O'',O''')-tetra(copper(II)-(2,2'bipyridine)-aquo) tetra(perchlorate)","","- C50 H52 Cl4 Cu4 N8 O28 -","- C50 H52 Cl4 Cu4 N8 O28 -","- C100 H104 Cl8 Cu8 N16 O56 -","2","0.5","","A. K. Ghosh; D. Ghoshal; E. Zangrando; J. Ribas; N. Ray Chaudhuri","Syntheses, Crystal Structures, and Magnetic Properties of Metal-Organic Hybrid Materials of Cu(II): Effect of a Long Chain Dicarboxylate Backbone, and Counteranion in Their Structural Diversity","Inorganic Chemistry","2007","46","","3057","3071","10.1021/ic061720v","","","0.71073","MoKα","","0.0784","0.0478","","","0.1288","0.1407","","","","","","0.913","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307174","10.619","0.003","11.937","0.002","14.12","0.003","79.52","0.02","77.65","0.02","66.99","0.03","1599.7","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","bis(mu4-glutarato,O,O',O'',O''')-tetra(copper(II)- -(1,10phenanthroline,N,N'))-bis((perchlorate)-(aquo)) bis(perchlorate)","","- C29 H24 Cl2 Cu2 N4 O13 -","- C29 H24 Cl2 Cu2 N4 O13 -","- C58 H48 Cl4 Cu4 N8 O26 -","2","1","","A. K. Ghosh; D. Ghoshal; E. Zangrando; J. Ribas; N. Ray Chaudhuri","Syntheses, Crystal Structures, and Magnetic Properties of Metal-Organic Hybrid Materials of Cu(II): Effect of a Long Chain Dicarboxylate Backbone, and Counteranion in Their Structural Diversity","Inorganic Chemistry","2007","46","","3057","3071","10.1021/ic061720v","","","0.71073","Mokα","","0.1088","0.0636","","","0.1604","0.1983","","","","","","1.041","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307175","19.313","0.004","12.849","0.004","34.762","0.006","90","","90.94","0.02","90","","8625","4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","tetra-(mu4-adipato,O,O',O'',O''')-dodeca(1,10phenanthroline)- -octacopper(II) octa(tetrafluoroborate) dihydrated","","- C168 H132 B8 Cu8 F32 N24 O18 -","- C168 H128 B8 Cu8 F32 N24 O18 -","- C336 H256 B16 Cu16 F64 N48 O36 -","2","0.5","","A. K. Ghosh; D. Ghoshal; E. Zangrando; J. Ribas; N. Ray Chaudhuri","Syntheses, Crystal Structures, and Magnetic Properties of Metal-Organic Hybrid Materials of Cu(II): Effect of a Long Chain Dicarboxylate Backbone, and Counteranion in Their Structural Diversity","Inorganic Chemistry","2007","46","","3057","3071","10.1021/ic061720v","","","0.71073","MoKα","","0.1429","0.0737","","","0.2","0.2317","","","","","","0.901","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307176","6.876","0.002","10.482","0.0007","12.39","0.003","85.4","0.03","82.72","0.02","73.77","0.03","849.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-(2,2'bipyridine)-(aquo)-copper(II)- -(mu2-adipato,O,O') hydrated","","- C16 H20 Cu N2 O6 -","- C16 H20 Cu N2 O6 -","- C32 H40 Cu2 N4 O12 -","2","1","","A. K. Ghosh; D. Ghoshal; E. Zangrando; J. Ribas; N. Ray Chaudhuri","Syntheses, Crystal Structures, and Magnetic Properties of Metal-Organic Hybrid Materials of Cu(II): Effect of a Long Chain Dicarboxylate Backbone, and Counteranion in Their Structural Diversity","Inorganic Chemistry","2007","46","","3057","3071","10.1021/ic061720v","","","0.71073","Mokα","","0.0606","0.0413","","","0.1082","0.1154","","","","","","0.933","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307177","15.01","0.003","11.733","0.001","18.454","0.003","90","","95.374","0.002","90","","3235.7","0.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-bis[(2,2'bipyridine)-copper(II)]-(aquo)-(perchlorate) -(mu4-adipato,O,O',O'',O''') perchlorate hydrated","","- C26 H28 Cl2 Cu2 N4 O14 -","- C26 H28 Cl2 Cu2 N4 O14 -","- C104 H112 Cl8 Cu8 N16 O56 -","4","1","","A. K. Ghosh; D. Ghoshal; E. Zangrando; J. Ribas; N. Ray Chaudhuri","Syntheses, Crystal Structures, and Magnetic Properties of Metal-Organic Hybrid Materials of Cu(II): Effect of a Long Chain Dicarboxylate Backbone, and Counteranion in Their Structural Diversity","Inorganic Chemistry","2007","46","","3057","3071","10.1021/ic061720v","","","0.71073","Mokα","","0.2487","0.0538","","","0.0986","0.1266","","","","","","0.906","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307178","12.122","0.003","14.368","0.003","21.533","0.004","90","","100.2","0.03","90","","3691.1","1.4","293","2","293","2","","","","","","","","7","C 1 2 1","C 2y","5","","catena-(copper(II)-(2,2'bipyridine)-mu3-adipate,O,O',O'')- -(copper(II)-(2,2'bipyridine)-hydrogenadipate,O',O'',O''') (tetrafluoroborate) hydrated","","- C32 H39 B Cu2 F4 N4 O11 -","- C32 H38 B Cu2 F4 N4 O11 -","- C128 H152 B4 Cu8 F16 N16 O44 -","4","1","","A. K. Ghosh; D. Ghoshal; E. Zangrando; J. Ribas; N. Ray Chaudhuri","Syntheses, Crystal Structures, and Magnetic Properties of Metal-Organic Hybrid Materials of Cu(II): Effect of a Long Chain Dicarboxylate Backbone, and Counteranion in Their Structural Diversity","Inorganic Chemistry","2007","46","","3057","3071","10.1021/ic061720v","","","1.54178","CuKα","","0.0593","0.0564","","","0.1538","0.1598","","","","","","1.056","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307179","13.198","0.003","16.373","0.004","18.34","0.005","115.59","0.02","98.7","0.02","101.8","0.03","3367.5","1.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-tetra-(copper(II)-(1,10phenanthroline)- -bis(mu2-adipato,O,O')-(mu4-adipato,O,O',O'',O''') diperchlorate hydrated","","- C66 H58 Cl2 Cu4 N8 O21 -","- C66 H56 Cl2 Cu4 N8 O21 -","- C132 H112 Cl4 Cu8 N16 O42 -","2","1","","A. K. Ghosh; D. Ghoshal; E. Zangrando; J. Ribas; N. Ray Chaudhuri","Syntheses, Crystal Structures, and Magnetic Properties of Metal-Organic Hybrid Materials of Cu(II): Effect of a Long Chain Dicarboxylate Backbone, and Counteranion in Their Structural Diversity","Inorganic Chemistry","2007","46","","3057","3071","10.1021/ic061720v","","","0.71073","Mokα","","0.101","0.0465","","","0.1044","0.1188","","","","","","0.956","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307180","8.166","0.011","13.243","0.017","17.79","0.02","76.911","0.015","87.722","0.016","74.166","0.016","1802","4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H39 N6 Yb3 -","- C39 H39 N6 Yb3 -","- C78 H78 N12 Yb6 -","2","1","","Jie Zhang; Ruifang Cai; Zhenxia Chen; Xigeng Zhou","Facile Construction of Lanthanide Metallomacrocycles with the Bridging Imidazolate and Triazolate Ligands and Their Ring Expansions","Inorganic Chemistry","2007","46","","321","327","10.1021/ic061722f","","","0.71073","MoKα","","0.136","0.1157","","","0.2971","0.3125","","","","","","1.088","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307181","15.476","0.014","16.26","0.015","17.212","0.016","102.261","0.013","105.411","0.013","115.058","0.012","3511","6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H92 Dy4 N8 O5 -","- C72 H92 Dy4 N8 O5 -","- C144 H184 Dy8 N16 O10 -","2","1","","Jie Zhang; Ruifang Cai; Zhenxia Chen; Xigeng Zhou","Facile Construction of Lanthanide Metallomacrocycles with the Bridging Imidazolate and Triazolate Ligands and Their Ring Expansions","Inorganic Chemistry","2007","46","","321","327","10.1021/ic061722f","","","0.71073","MoKα","","0.1086","0.0587","","","0.1608","0.2097","","","","","","1.019","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307182","30.451","0.005","30.451","0.005","13.919","0.003","90","","90","","120","","11177","4","298","2","298","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C60 H54 N9 O3 Yb3 -","- C60 H54 N9 O3 Yb3 -","- C360 H324 N54 O18 Yb18 -","6","0.333333","","Jie Zhang; Ruifang Cai; Zhenxia Chen; Xigeng Zhou","Facile Construction of Lanthanide Metallomacrocycles with the Bridging Imidazolate and Triazolate Ligands and Their Ring Expansions","Inorganic Chemistry","2007","46","","321","327","10.1021/ic061722f","","","0.71073","MoKα","","0.1419","0.0633","","","0.1778","0.2148","","","","","","0.97","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307183","30.575","0.006","30.575","0.006","13.945","0.004","90","","90","","120","","11290","5","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C60 H54 Dy3 N9 O3 -","- C60 H54 Dy3 N9 O3 -","- C360 H324 Dy18 N54 O18 -","6","0.333333","","Jie Zhang; Ruifang Cai; Zhenxia Chen; Xigeng Zhou","Facile Construction of Lanthanide Metallomacrocycles with the Bridging Imidazolate and Triazolate Ligands and Their Ring Expansions","Inorganic Chemistry","2007","46","","321","327","10.1021/ic061722f","","","0.71073","MoKα","","0.1266","0.0769","","","0.2403","0.2903","","","","","","1.118","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307184","8.291","0.003","13.404","0.005","18.008","0.007","76.802","0.005","87.691","0.005","74.09","0.005","1873.2","1.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H39 Er3 N6 -","- C39 H39 Er3 N6 -","- C78 H78 Er6 N12 -","2","1","","Jie Zhang; Ruifang Cai; Zhenxia Chen; Xigeng Zhou","Facile Construction of Lanthanide Metallomacrocycles with the Bridging Imidazolate and Triazolate Ligands and Their Ring Expansions","Inorganic Chemistry","2007","46","","321","327","10.1021/ic061722f","","","0.71073","MoKα","","0.0538","0.0405","","","0.1071","0.1122","","","","","","1.031","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307185","27.827","0.003","27.827","0.003","27.827","0.003","90","","90","","90","","21548","4","293","2","293","2","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C64 H80 N12 O2 Yb4 -","- C64 H80 N12 O2 Yb4 -","- C768 H960 N144 O24 Yb48 -","12","0.25","","Jie Zhang; Ruifang Cai; Zhenxia Chen; Xigeng Zhou","Facile Construction of Lanthanide Metallomacrocycles with the Bridging Imidazolate and Triazolate Ligands and Their Ring Expansions","Inorganic Chemistry","2007","46","","321","327","10.1021/ic061722f","","","0.71073","MoKα","","0.0849","0.0474","","","0.111","0.1353","","","","","","1.083","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307186","11.7697","0.0011","11.7697","0.0011","11.7697","0.0011","90","","90","","90","","1630.4","0.3","293","2","293","2","","","","","","","","4","I m -3","-I 2 2 3","204","ferric formate","","","- C3.75 H3.5 Fe O7.75 -","- C3.75 H3 Fe O7.75 -","- C30 H24 Fe8 O62 -","8","0.166667","","Yun-Qi Tian; Yu-Ming Zhao; Hai-Jun Xu; Cheng-Yu Chi","CO2 Template Synthesis of Metal Formates with a ReO3 Net","Inorganic Chemistry","2007","46","","1612","1616","10.1021/ic0617240","","","0.71073","MoKα","","0.0824","0.0798","","","0.1792","0.1802","","","","","","1.104","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307187","11.4477","0.0006","11.4477","0.0006","11.4477","0.0006","90","","90","","90","","1500.22","0.14","293","2","293","2","","","","","","","","4","I m -3","-I 2 2 3","204","aluminum formate","","","- C3.75 H3.5 Al O7.75 -","- C3.75 H3 Al O7.75 -","- C30 H24 Al8 O62 -","8","0.166667","","Yun-Qi Tian; Yu-Ming Zhao; Hai-Jun Xu; Cheng-Yu Chi","CO2 Template Synthesis of Metal Formates with a ReO3 Net","Inorganic Chemistry","2007","46","","1612","1616","10.1021/ic0617240","","","0.71073","MoKα","","0.0713","0.063","","","0.1763","0.1841","","","","","","1.19","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307188","11.54","0.008","11.54","0.008","11.54","0.008","90","","90","","90","","1536.8","1.8","293","2","293","2","","","","","","","","4","I m -3","-I 2 2 3","204","gallium formate","","","- C3.75 H3.5 Ga O7.75 -","- C3.75 H3 Ga O7.75 -","- C30 H24 Ga8 O62 -","8","0.166667","","Yun-Qi Tian; Yu-Ming Zhao; Hai-Jun Xu; Cheng-Yu Chi","CO2 Template Synthesis of Metal Formates with a ReO3 Net","Inorganic Chemistry","2007","46","","1612","1616","10.1021/ic0617240","","","0.71073","MoKα","","0.0501","0.0331","","","0.0726","0.0808","","","","","","1.108","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307189","12.161","0.002","12.161","0.002","12.161","0.002","90","","90","","90","","1798.5","0.5","293","2","293","2","","","","","","","","4","I m -3","-I 2 2 3","204","Indium formate","","","- C3.75 H3.5 In O7.75 -","- C3.75 H3 In O7.75 -","- C30 H24 In8 O62 -","8","0.166667","","Yun-Qi Tian; Yu-Ming Zhao; Hai-Jun Xu; Cheng-Yu Chi","CO2 Template Synthesis of Metal Formates with a ReO3 Net","Inorganic Chemistry","2007","46","","1612","1616","10.1021/ic0617240","","","0.71073","MoKα","","0.0666","0.0593","","","0.1378","0.1411","","","","","","1.245","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307190","11.784","0.004","11.784","0.004","8.527","0.004","90","","90","","120","","1025.4","0.7","298","2","298","2","","","","","","","","5","P 63","P 6c","173","","","","- C12 H18 Cu4 I N9 -","- C12 H18 Cu4 I N9 -","- C24 H36 Cu8 I2 N18 -","2","0.333333","","Xi-He Huang; Tian-Lu Sheng; Sheng-Chang Xiang; Rui-Biao Fu; Sheng-Min Hu; Ya-Min Li; Xin-Tao Wu","{[Cu(mtz)]3(CuI)}n: An Unprecedented Non-interpenetrated (123)(122.14)3 Network with Triple-Stranded Helices","Inorganic Chemistry","2007","46","","497","500","10.1021/ic0617341","","","0.71073","MoKα","","0.0218","0.0215","","","0.0546","0.0548","","","","","","1.05","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307191","25.3783","0.0009","21.3325","0.0006","38.3131","0.0014","90","","90","","90","","20742","1.2","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- H46 K9 Lu O101 Si2 W22 -","- K9 Lu O101 Si2 W22 -","- K72 Lu8 O808 Si16 W176 -","8","1","","Bassem S. Bassil; Michael H. Dickman; Bernd von der Kammer; Ulrich Kortz","The Monolanthanide-Containing Silicotungstates [Ln(β2-SiW11O39)2]13- (Ln = La, Ce, Sm, Eu, Gd, Tb, Yb, Lu): A Synthetic and Structural Investigation","Inorganic Chemistry","2007","46","","2452","2458","10.1021/ic061737d","","","0.71073","MoKα","","0.0832","0.0598","","","0.1544","0.1726","","","","","","1.054","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307192","18.73","0.0013","20.0384","0.0011","27.5289","0.0019","90","","96.966","0.004","90","","10255.9","1.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- H15.75 K9 La O93.75 Si2 W22 -","- K9 La O93.75 Si2 W22 -","- K36 La4 O375 Si8 W88 -","4","1","","Bassem S. Bassil; Michael H. Dickman; Bernd von der Kammer; Ulrich Kortz","The Monolanthanide-Containing Silicotungstates [Ln(β2-SiW11O39)2]13- (Ln = La, Ce, Sm, Eu, Gd, Tb, Yb, Lu): A Synthetic and Structural Investigation","Inorganic Chemistry","2007","46","","2452","2458","10.1021/ic061737d","","","0.71073","MoKα","","0.0923","0.0629","","","0.1735","0.1969","","","","","","1.049","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307193","18.6232","0.0013","19.9618","0.0012","27.4783","0.0013","90","","97.12","0.003","90","","10136.4","1.1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- Ce H25 K8.5 O90.5 Si2 W22 -","- Ce K8.5 O90.5 Si2 W22 -","- Ce4 K34 O362 Si8 W88 -","4","1","","Bassem S. Bassil; Michael H. Dickman; Bernd von der Kammer; Ulrich Kortz","The Monolanthanide-Containing Silicotungstates [Ln(β2-SiW11O39)2]13- (Ln = La, Ce, Sm, Eu, Gd, Tb, Yb, Lu): A Synthetic and Structural Investigation","Inorganic Chemistry","2007","46","","2452","2458","10.1021/ic061737d","","","0.71073","MoKα","","0.133","0.0683","","","0.1825","0.2224","","","","","","1.041","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307194","18.7442","0.0005","20.047","0.0005","27.3945","0.0005","90","","97.439","0.001","90","","10207.3","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- H23 K8.25 O89.5 Si2 Sm W22 -","- K8.25 O89.5 Si2 Sm W22 -","- K33 O358 Si8 Sm4 W88 -","4","1","","Bassem S. Bassil; Michael H. Dickman; Bernd von der Kammer; Ulrich Kortz","The Monolanthanide-Containing Silicotungstates [Ln(β2-SiW11O39)2]13- (Ln = La, Ce, Sm, Eu, Gd, Tb, Yb, Lu): A Synthetic and Structural Investigation","Inorganic Chemistry","2007","46","","2452","2458","10.1021/ic061737d","","","0.71073","MoKα","","0.1708","0.085","","","0.2157","0.2697","","","","","","1.029","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307195","18.7596","0.0005","20.0516","0.0005","27.3865","0.0005","90","","97.536","0.001","90","","10212.7","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- Eu H34 K8 O95 Si2 W22 -","- Eu K8 O95 Si2 W22 -","- Eu4 K32 O380 Si8 W88 -","4","1","","Bassem S. Bassil; Michael H. Dickman; Bernd von der Kammer; Ulrich Kortz","The Monolanthanide-Containing Silicotungstates [Ln(β2-SiW11O39)2]13- (Ln = La, Ce, Sm, Eu, Gd, Tb, Yb, Lu): A Synthetic and Structural Investigation","Inorganic Chemistry","2007","46","","2452","2458","10.1021/ic061737d","","","0.71073","MoKα","","0.1017","0.0676","","","0.1753","0.2021","","","","","","1.021","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307196","18.7494","0.001","20.061","0.0009","27.3796","0.0014","90","","97.586","0.003","90","","10208.2","0.9","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- Gd H27 K8.5 O91.5 Si2 W22 -","- Gd K8.51 O91.5 Si2 W22 -","- Gd4 K34.04 O366 Si8 W88 -","4","1","","Bassem S. Bassil; Michael H. Dickman; Bernd von der Kammer; Ulrich Kortz","The Monolanthanide-Containing Silicotungstates [Ln(β2-SiW11O39)2]13- (Ln = La, Ce, Sm, Eu, Gd, Tb, Yb, Lu): A Synthetic and Structural Investigation","Inorganic Chemistry","2007","46","","2452","2458","10.1021/ic061737d","","","0.71073","MoKα","","0.1853","0.0879","","","0.2268","0.2846","","","","","","1.061","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307197","18.7191","0.0006","20.0259","0.0005","27.3498","0.0006","90","","97.612","0.001","90","","10162.2","0.5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- H25 K7.5 O90.5 Si2 Tb W22 -","- K7.5 O90.5 Si2 Tb W22 -","- K30 O362 Si8 Tb4 W88 -","4","1","","Bassem S. Bassil; Michael H. Dickman; Bernd von der Kammer; Ulrich Kortz","The Monolanthanide-Containing Silicotungstates [Ln(β2-SiW11O39)2]13- (Ln = La, Ce, Sm, Eu, Gd, Tb, Yb, Lu): A Synthetic and Structural Investigation","Inorganic Chemistry","2007","46","","2452","2458","10.1021/ic061737d","","","0.71073","MoKα","","0.119","0.0731","","","0.1894","0.2205","","","","","","1.02","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307198","21.3738","0.0005","38.3275","0.001","25.3172","0.0007","90","","90","","90","","20740","0.9","163","2","163","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- H46 K10.5 O101 Si2 W22 Yb -","- K10.5 O101 Si2 W22 Yb -","- K84 O808 Si16 W176 Yb8 -","8","1","","Bassem S. Bassil; Michael H. Dickman; Bernd von der Kammer; Ulrich Kortz","The Monolanthanide-Containing Silicotungstates [Ln(β2-SiW11O39)2]13- (Ln = La, Ce, Sm, Eu, Gd, Tb, Yb, Lu): A Synthetic and Structural Investigation","Inorganic Chemistry","2007","46","","2452","2458","10.1021/ic061737d","","","0.71073","MoKα","","0.0962","0.0639","","","0.1531","0.1745","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307199","11.972","0.002","15.663","0.003","7.581","0.0016","90","","95.01","0.003","90","","1416.1","0.5","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H48 F24 N8 O8 V8 -","- C6 H6 F3 N O V -","- C48 H48 F24 N8 O8 V8 -","8","1","","David W. Aldous; Richard J. Goff; J. Paul Attfield; Philip Lightfoot","Novel Vanadium(IV) Oxyfluorides with 'Spin-Ladder'-Like Structures, and Their Relationship to (VO)2P2O7","Inorganic Chemistry","2007","46","","1277","1282","10.1021/ic0617386","","","0.8462","synchrotron","","0.1135","0.0712","","","0.1625","0.1866","","","","","","1.018","","","","has coordinates","179109","2020-10-21","18:00:00",""
"4307200","9.0036","0.0016","11.703","0.002","3.9092","0.0007","90","","90","","90","","411.91","0.13","150","2","150","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- Cs F3 O V -","- Cs F3 O V -","- Cs4 F12 O4 V4 -","4","0.5","","David W. Aldous; Richard J. Goff; J. Paul Attfield; Philip Lightfoot","Novel Vanadium(IV) Oxyfluorides with 'Spin-Ladder'-Like Structures, and Their Relationship to (VO)2P2O7","Inorganic Chemistry","2007","46","","1277","1282","10.1021/ic0617386","","","0.8462","synchrotron","","0.0458","0.0384","","","0.0912","0.0958","","","","","","0.997","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307201","8.559","0.004","11.526","0.006","3.8591","0.0019","90","","90","","90","","380.7","0.3","93","2","93","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- F3 O Rb V -","- F3 O Rb V -","- F12 O4 Rb4 V4 -","4","0.5","","David W. Aldous; Richard J. Goff; J. Paul Attfield; Philip Lightfoot","Novel Vanadium(IV) Oxyfluorides with 'Spin-Ladder'-Like Structures, and Their Relationship to (VO)2P2O7","Inorganic Chemistry","2007","46","","1277","1282","10.1021/ic0617386","","","0.7107","MoKα","","0.0813","0.0607","","","0.1414","0.1572","","","","","","1.134","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307202","8.781","0.003","10.217","0.003","14.543","0.004","71.276","0.007","82.684","0.007","81.593","0.007","1217.9","0.6","154","2","154","2","","","","","","","","8","P -1","-P 1","2","[Ni(PNP)(SCH2CH2SMe)](OTf)","","","- C15 H34 F3 N Ni O3 P2 S3 -","- C15 H34 F3 N Ni O3 P2 S3 -","- C30 H68 F6 N2 Ni2 O6 P4 S6 -","2","1","","Kendra Redin; Aaron D. Wilson; Rachel Newell; M. Rakowski DuBois; Daniel L. DuBois","Studies of Structural Effects on the Half-Wave Potentials of Mononuclear and Dinuclear Nickel(II) Diphosphine/Dithiolate Complexes","Inorganic Chemistry","2007","46","","1268","1276","10.1021/ic061740x","","","0.71073","MoKα","","0.1526","0.0978","","","0.2568","0.3083","","","","","","1.045","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307203","12.1836","0.0005","47.75","0.002","10.3067","0.0004","90","","107.914","0.001","90","","5705.4","0.4","143","2","143","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","[(SC3H6S)(Nidppe)2](BF4)2","","","- C57 H57 B2 F8 N Ni2 P4 S2 -","- C57 H57 B2 F8 N Ni2 P4 S2 -","- C228 H228 B8 F32 N4 Ni8 P16 S8 -","4","1","","Kendra Redin; Aaron D. Wilson; Rachel Newell; M. Rakowski DuBois; Daniel L. DuBois","Studies of Structural Effects on the Half-Wave Potentials of Mononuclear and Dinuclear Nickel(II) Diphosphine/Dithiolate Complexes","Inorganic Chemistry","2007","46","","1268","1276","10.1021/ic061740x","","","0.71073","MoKα","","0.1783","0.0808","","","0.1621","0.1885","","","","","","0.951","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307204","10.7942","0.0005","25.6412","0.0011","17.261","0.0007","90","","98.174","0.001","90","","4728.9","0.4","157","2","157","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(PNP)2Ni","","","- C54 H54 N2 Ni P4 -","- C54 H54 N2 Ni P4 -","- C216 H216 N8 Ni4 P16 -","4","1","","Kendra Redin; Aaron D. Wilson; Rachel Newell; M. Rakowski DuBois; Daniel L. DuBois","Studies of Structural Effects on the Half-Wave Potentials of Mononuclear and Dinuclear Nickel(II) Diphosphine/Dithiolate Complexes","Inorganic Chemistry","2007","46","","1268","1276","10.1021/ic061740x","","","0.71073","MoKα","","0.0657","0.0528","","","0.1334","0.142","","","","","","1.034","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307205","11.9028","0.0006","20.1254","0.0011","19.618","0.0011","90","","97.64","0.001","90","","4657.7","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Ru(Cp*)(H)~2~{κ^2^-P,P-(^i^Pr)~2~PNH(CH~2~)~2~NHP(^i^Pr)~2~}]BPh~4~","(Pentahapto-pentamethylcyclopentadienyl)-(dihydride)- {bis(diisopropylphosphino-N,N')ethylenediamine-κ^2^-P,P'}-ruthenium tetraphenylborate","","- C48 H71 B N2 P2 Ru -","- C48 H71 B N2 P2 Ru -","- C192 H284 B4 N8 P8 Ru4 -","4","1","","Manuel Jiménez-Tenorio; M. Dolores Palacios Tejero; M.Carmen Puerta; Pedro Valerga","Half-Sandwich Hydride Complexes of Ruthenium with Bidentate Phosphinoamine Ligands: Proton-Transfer Reactions to [(C5R5)RuH(L)] [R = H, Me; L = dippae, (R,R)-dippach]","Inorganic Chemistry","2007","46","","1001","1012","10.1021/ic061745u","","x-ray","0.71073","MoKα","","0.0667","0.0537","","","0.1176","0.1245","","","","","","1.059","","","","has coordinates","194597","2020-10-21","18:00:00",""
"4307206","5.38062","0.00011","7.35553","0.00015","5.77509","0.00005","90","","90","","90","","228.563","0.007","293","","","","","","","","","","","2","P n n m","-P 2 2n","58","Gamma Aluminium Hydride","Alane","","- Al H3 -","- Al H3 -","- Al6 H18 -","6","0.75","","Volodymyr A. Yartys; Roman V. Denys; Jan Petter Maehlen; Christoph Frommen; Maximilian Fichtner; Boris M. Bulychev; Hermann Emerich","Double-Bridge Bonding of Aluminium and Hydrogen in the Crystal Structure of γ-AlH3","Inorganic Chemistry","2007","46","","1051","1055","10.1021/ic0617487","powder diffraction","","","","","","","","","","","","","1.44","","","","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307207","8.826","0.005","10.92","0.005","11.763","0.005","112.304","0.005","93.821","0.005","106.374","0.005","986.9","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H32 Al N5 -","- C17 H32 Al N5 -","- C34 H64 Al2 N10 -","2","1","","Bing Lian; Christophe M. Thomas; Osvaldo L. Casagrande; Christian W. Lehmann; Thierry Roisnel; Jean-François Carpentier","Aluminum and Zinc Complexes Based on an Amino-Bis(pyrazolyl) Ligand: Synthesis, Structures, and Use in MMA and Lactide Polymerization","Inorganic Chemistry","2007","46","","328","340","10.1021/ic061749z","","","0.71069","MoKα","","0.0538","0.0462","","","0.1382","0.1478","","","","","","1.04","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307208","13.02","0.0003","9.5441","0.0002","14.5474","0.0003","90","","94.804","0.001","90","","1801.37","0.07","100","","100","","","","","","","","pentane","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H28 Al N5 -","- C16 H28 Al N5 -","- C64 H112 Al4 N20 -","4","1","","Bing Lian; Christophe M. Thomas; Osvaldo L. Casagrande; Christian W. Lehmann; Thierry Roisnel; Jean-François Carpentier","Aluminum and Zinc Complexes Based on an Amino-Bis(pyrazolyl) Ligand: Synthesis, Structures, and Use in MMA and Lactide Polymerization","Inorganic Chemistry","2007","46","","328","340","10.1021/ic061749z","","","0.71073","MoKα","","0.0587","0.0461","","","0.1073","0.114","","","","","","1.039","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307209","7.822","0.005","11.327","0.005","12.25","0.005","83.801","0.005","78.221","0.005","72.077","0.005","1009.7","0.9","373","2","373","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C17 H31 Al Li N5 -","- C17 H31 Al Li N5 -","- C34 H62 Al2 Li2 N10 -","2","1","","Bing Lian; Christophe M. Thomas; Osvaldo L. Casagrande; Christian W. Lehmann; Thierry Roisnel; Jean-François Carpentier","Aluminum and Zinc Complexes Based on an Amino-Bis(pyrazolyl) Ligand: Synthesis, Structures, and Use in MMA and Lactide Polymerization","Inorganic Chemistry","2007","46","","328","340","10.1021/ic061749z","","x-ray","0.71069","MoKα","","0.0726","0.0526","","","0.1548","0.1654","","","","","","1.06","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307210","8.145","0.005","8.494","0.005","15.292","0.005","99.522","0.005","104.599","0.005","97.946","0.005","991.6","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H33 N5 Zn -","- C18 H33 N5 Zn -","- C36 H66 N10 Zn2 -","2","1","","Bing Lian; Christophe M. Thomas; Osvaldo L. Casagrande; Christian W. Lehmann; Thierry Roisnel; Jean-François Carpentier","Aluminum and Zinc Complexes Based on an Amino-Bis(pyrazolyl) Ligand: Synthesis, Structures, and Use in MMA and Lactide Polymerization","Inorganic Chemistry","2007","46","","328","340","10.1021/ic061749z","","","0.71069","MoKα","","0.0757","0.0585","","","0.135","0.1453","","","","","","1.154","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307211","8.9577","0.0002","9.226","0.0003","13.0692","0.0004","75.905","0.001","80.472","0.001","67.06","0.001","961.7","0.05","100","","100","","","","","","","","deuterated benzene","4","P -1","-P 1","2","","","","- C38 H60 N10 Zn2 -","- C38 H60 N10 Zn2 -","- C38 H60 N10 Zn2 -","1","0.5","","Bing Lian; Christophe M. Thomas; Osvaldo L. Casagrande; Christian W. Lehmann; Thierry Roisnel; Jean-François Carpentier","Aluminum and Zinc Complexes Based on an Amino-Bis(pyrazolyl) Ligand: Synthesis, Structures, and Use in MMA and Lactide Polymerization","Inorganic Chemistry","2007","46","","328","340","10.1021/ic061749z","","","0.71073","MoKα","","0.0326","0.0291","","","0.0693","0.0708","","","","","","1.075","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307212","8.7921","0.0002","28.5056","0.0007","9.3278","0.0002","90","","96.228","0.001","90","","2323.97","0.09","100","","100","","","","","","","","toluene","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H37 N5 Zn2 -","- C20 H37 N5 Zn2 -","- C80 H148 N20 Zn8 -","4","1","","Bing Lian; Christophe M. Thomas; Osvaldo L. Casagrande; Christian W. Lehmann; Thierry Roisnel; Jean-François Carpentier","Aluminum and Zinc Complexes Based on an Amino-Bis(pyrazolyl) Ligand: Synthesis, Structures, and Use in MMA and Lactide Polymerization","Inorganic Chemistry","2007","46","","328","340","10.1021/ic061749z","","","0.71073","MoKα","","0.0956","0.0781","","","0.1499","0.156","","","","","","1.259","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307213","8.739","0.005","9.505","0.005","14.631","0.005","83.137","0.005","81.479","0.005","77.207","0.005","1167.3","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H48 N7.5 O0 Zn3 -","- C20 H37 N5 O Zn2 -","- C40 H74 N10 O2 Zn4 -","2","1","","Bing Lian; Christophe M. Thomas; Osvaldo L. Casagrande; Christian W. Lehmann; Thierry Roisnel; Jean-François Carpentier","Aluminum and Zinc Complexes Based on an Amino-Bis(pyrazolyl) Ligand: Synthesis, Structures, and Use in MMA and Lactide Polymerization","Inorganic Chemistry","2007","46","","328","340","10.1021/ic061749z","","","0.71069","MoKα","","0.0616","0.0415","","","0.109","0.1187","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307214","8.675","0.002","21.637","0.005","12.645","0.003","90","","106.436","0.012","90","","2276.5","0.9","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H32 Cl N5 Zn -","- C22 H32 Cl N5 Zn -","- C88 H128 Cl4 N20 Zn4 -","4","1","","Bing Lian; Christophe M. Thomas; Osvaldo L. Casagrande; Christian W. Lehmann; Thierry Roisnel; Jean-François Carpentier","Aluminum and Zinc Complexes Based on an Amino-Bis(pyrazolyl) Ligand: Synthesis, Structures, and Use in MMA and Lactide Polymerization","Inorganic Chemistry","2007","46","","328","340","10.1021/ic061749z","","x-ray","0.71073","MoKα","","0.0298","0.026","","","0.0716","0.0736","","","","","","1.045","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307215","8.1075","0.0006","9.8961","0.0007","10.142","0.0008","111.655","0.001","111.51","0.01","93.206","0.001","686.19","0.11","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C4 H20 F N4 Nb O9 P2 -","- C4 H20 F N4 Nb O9 P2 -","- C8 H40 F2 N8 Nb2 O18 P4 -","2","1","","Guang-Zhen Liu; Shou-Tian Zheng; Guo-Yu Yang","Two Organically Templated Niobium and Zinconiobium Fluorophosphates: Low Temperature Hydrothermal Syntheses of NbOF(PO4)2(C2H10N2)2 and Zn3(NbOF)(PO4)4(C2H10N2)2","Inorganic Chemistry","2007","46","","231","237","10.1021/ic061752i","","","0.71073","MoKα","","0.0514","0.0461","","","0.1072","0.1123","","","","","","1.204","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307216","9.1928","0.0002","14.209","0.0001","32.2971","0.0006","90","","90","","90","","4218.66","0.12","293","2","293","2","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C4 H20 F N4 Nb O17 P4 Zn3 -","- C4 H6 F2 N4 Nb O16 P4 Zn3 -","- C32 H48 F16 N32 Nb8 O128 P32 Zn24 -","8","0.25","","Guang-Zhen Liu; Shou-Tian Zheng; Guo-Yu Yang","Two Organically Templated Niobium and Zinconiobium Fluorophosphates: Low Temperature Hydrothermal Syntheses of NbOF(PO4)2(C2H10N2)2 and Zn3(NbOF)(PO4)4(C2H10N2)2","Inorganic Chemistry","2007","46","","231","237","10.1021/ic061752i","","","0.71073","MoKα","","0.0796","0.0793","","","0.17","0.1701","","","","","","1.291","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307217","6.8158","0.0006","10.9599","0.0009","12.8039","0.001","90","","95.531","0.005","90","","952","0.14","173","2","173","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C10 H20 B10 F3 N O3 S -","- C10 H20 B10 F3 N O3 S -","- C20 H40 B20 F6 N2 O6 S2 -","2","1","","Andrea F. Armstrong; John F. Valliant","Microwave-Assisted Synthesis of Tricarbonyl Rhenacarboranes: Steric and Electronic Effects on the 1,2 →1,7 Carborane Cage Isomerization","Inorganic Chemistry","2007","46","","2148","2158","10.1021/ic0617543","","","1.54178","CuKα","","0.0429","0.0417","","","0.1121","0.1138","","","","","","1.019","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307218","7.4","0.0002","15.493","0.0004","15.3055","0.0004","90","","92.328","0.002","90","","1753.3","0.08","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H19 B9 N O3 Re -","- C12 H19 B9 N O3 Re -","- C48 H76 B36 N4 O12 Re4 -","4","1","","Andrea F. Armstrong; John F. Valliant","Microwave-Assisted Synthesis of Tricarbonyl Rhenacarboranes: Steric and Electronic Effects on the 1,2 →1,7 Carborane Cage Isomerization","Inorganic Chemistry","2007","46","","2148","2158","10.1021/ic0617543","","","0.71073","MoKα","","0.0452","0.0265","","","0.0477","0.0514","","","","","","1.075","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307219","9.4919","0.0002","12.8949","0.0003","15.9481","0.0004","90","","96.733","0.001","90","","1938.54","0.08","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H21 B9 N O4 Re -","- C12 H21 B9 N O4 Re -","- C48 H84 B36 N4 O16 Re4 -","4","1","","Andrea F. Armstrong; John F. Valliant","Microwave-Assisted Synthesis of Tricarbonyl Rhenacarboranes: Steric and Electronic Effects on the 1,2 →1,7 Carborane Cage Isomerization","Inorganic Chemistry","2007","46","","2148","2158","10.1021/ic0617543","","","0.71073","MoKα","","0.0862","0.0463","","","0.0586","0.0656","","","","","","1.037","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307220","9.0495","0.0017","17.355","0.003","15.57","0.003","90","","102.57","0.003","90","","2386.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Lanthanum carboxylate","","","- C21 H15 La2 N3 O15 -","- C21 H9 La2 N3 O15 -","- C84 H36 La8 N12 O60 -","4","1","","Partha Mahata; Srinivasan Natarajan","A New Series of Three-Dimensional Metal-Organic Framework, [M2(H2O)][C5N1H3(COO)2]3.2H2O, M = La, Pr, and Nd: Synthesis, Structure, and Properties","Inorganic Chemistry","2007","46","","1250","1258","10.1021/ic0617644","","","0.71073","MoKα","","0.0978","0.0591","","","0.124","0.14","","","","","","1.07","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307221","8.9814","0.0018","17.278","0.004","15.462","0.003","90","","102.233","0.004","90","","2344.9","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Praseodymium carboxylate","","","- C21 H15 N3 O15 Pr2 -","- C21 H9 N3 O15 Pr2 -","- C84 H36 N12 O60 Pr8 -","4","1","","Partha Mahata; Srinivasan Natarajan","A New Series of Three-Dimensional Metal-Organic Framework, [M2(H2O)][C5N1H3(COO)2]3.2H2O, M = La, Pr, and Nd: Synthesis, Structure, and Properties","Inorganic Chemistry","2007","46","","1250","1258","10.1021/ic0617644","","","0.71073","MoKα","","0.0946","0.0593","","","0.1004","0.1111","","","","","","1.082","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307222","8.9586","0.0019","17.246","0.004","15.406","0.003","90","","102.033","0.004","90","","2327.9","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Neodymium carboxylate","","","- C21 H15 N3 Nd2 O15 -","- C21 H9 N3 Nd2 O15 -","- C84 H36 N12 Nd8 O60 -","4","1","","Partha Mahata; Srinivasan Natarajan","A New Series of Three-Dimensional Metal-Organic Framework, [M2(H2O)][C5N1H3(COO)2]3.2H2O, M = La, Pr, and Nd: Synthesis, Structure, and Properties","Inorganic Chemistry","2007","46","","1250","1258","10.1021/ic0617644","","","0.71073","MoKα","","0.1119","0.077","","","0.1225","0.1328","","","","","","1.173","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307223","9.2456","0.0008","5.5854","0.0005","14.784","0.0013","90","","90.178","0.002","90","","763.45","0.12","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Disilver(I) monofluorophosphate(V)","","- Ag2 F O3 P -","- Ag2 F O3 P -","- Ag16 F8 O24 P8 -","8","1","","Matthias Weil; Michael Puchberger; Ekkehard Füglein; Enrique J. Baran; Julia Vannahme; Hans J. Jakobsen; Jørgen Skibsted","Single-Crystal Growth and Characterization of Disilver(I) Monofluorophosphate(V), Ag2PO3F: Crystal Structure, Thermal Behavior, Vibrational Spectroscopy, and Solid-State 19F, 31P, and 109Ag MAS NMR Spectroscopy","Inorganic Chemistry","2007","46","","801","808","10.1021/ic061765w","","","0.71073","MoKα","","0.0289","0.0268","","","0.0653","0.0665","","","","","","1.133","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307224","7.9717","0.0011","11.9277","0.0017","8.4298","0.0012","90","","102.161","0.002","90","","783.55","0.19","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H4 Cu N2 O4 Re -","- C4 H4 Cu N2 O4 Re -","- C16 H16 Cu4 N8 O16 Re4 -","4","1","","Haisheng Lin; Paul A. Maggard","Copper(I)-Rhenate Hybrids: Syntheses, Structures, and Optical Properties","Inorganic Chemistry","2007","46","","1283","1290","10.1021/ic061767g","","","0.71073","MoKα","","0.0569","0.0556","","","0.1501","0.1521","","","","","","1.073","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307225","8.2533","0.0018","6.8406","0.0018","18.256","0.006","90","","101.371","0.015","90","","1010.5","0.5","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C6.67 H4 Cu N0.67 O2.67 Re0.33 -","- C6.66667 H4 Cu N0.666667 O2.66667 Re0.333333 -","- C40 H24 Cu6 N4 O16 Re2 -","6","3","","Haisheng Lin; Paul A. Maggard","Copper(I)-Rhenate Hybrids: Syntheses, Structures, and Optical Properties","Inorganic Chemistry","2007","46","","1283","1290","10.1021/ic061767g","","","0.71073","MoKα","","0.0301","0.0291","","","0.0785","0.0798","","","","","","1.029","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307226","5.7263","0.0002","10.6104","0.0004","11.5533","0.0005","76.615","0.001","77.619","0.001","87.937","0.001","666.94","0.04","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H9 La O8 S2 -","- C10 H9 La O8 S2 -","- C20 H18 La2 O16 S4 -","2","1","","Felipe Gándara; Alberto García-Cortés; Concepción Cascales; Berta Gómez-Lor; Enrique Gutiérrez-Puebla; Marta Iglesias; Angeles Monge; Natalia Snejko","Rare Earth Arenedisulfonate Metal-Organic Frameworks: An Approach toward Polyhedral Diversity and Variety of Functional Compounds","Inorganic Chemistry","2007","46","","3475","3484","10.1021/ic0617689","","","0.71073","MoKα","","0.0438","0.0339","","0.0753","0.0711","","","","0.792","0.813","0.813","","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307227","5.6309","0.0003","10.5165","0.0005","11.3974","0.0005","76.32","0.001","77.35","0.001","88.063","0.001","639.74","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H9 Eu O8 S2 -","- C10 H9 Eu O8 S2 -","- C20 H18 Eu2 O16 S4 -","2","1","","Felipe Gándara; Alberto García-Cortés; Concepción Cascales; Berta Gómez-Lor; Enrique Gutiérrez-Puebla; Marta Iglesias; Angeles Monge; Natalia Snejko","Rare Earth Arenedisulfonate Metal-Organic Frameworks: An Approach toward Polyhedral Diversity and Variety of Functional Compounds","Inorganic Chemistry","2007","46","","3475","3484","10.1021/ic0617689","","","0.71073","MoKα","","0.0579","0.0496","","","0.1286","0.1338","","","","","","1.263","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307228","19.5105","0.0014","10.5594","0.0008","25.3401","0.0018","90","","98.448","0.001","90","","5163.9","0.7","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","LnPF-2","","- C40 H36 Nd4 O32 S8 -","- C40 H36 Nd4 O32 S8 -","- C160 H144 Nd16 O128 S32 -","4","1","","Felipe Gándara; Alberto García-Cortés; Concepción Cascales; Berta Gómez-Lor; Enrique Gutiérrez-Puebla; Marta Iglesias; Angeles Monge; Natalia Snejko","Rare Earth Arenedisulfonate Metal-Organic Frameworks: An Approach toward Polyhedral Diversity and Variety of Functional Compounds","Inorganic Chemistry","2007","46","","3475","3484","10.1021/ic0617689","","","0.71073","MoKα","","0.0557","0.0406","","","0.0823","0.0866","","","","","","0.993","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307229","34.228","0.004","5.9374","0.0007","24.332","0.003","90","","110.395","0.002","90","","4634.9","1","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H19.5 Nd2.5 O16.5 S3 -","- C15 H19.5 Nd2.5 O16.5 S3 -","- C120 H156 Nd20 O132 S24 -","8","1","","Felipe Gándara; Alberto García-Cortés; Concepción Cascales; Berta Gómez-Lor; Enrique Gutiérrez-Puebla; Marta Iglesias; Angeles Monge; Natalia Snejko","Rare Earth Arenedisulfonate Metal-Organic Frameworks: An Approach toward Polyhedral Diversity and Variety of Functional Compounds","Inorganic Chemistry","2007","46","","3475","3484","10.1021/ic0617689","","","0.71073","MoKα","","0.0747","0.0546","","","0.1217","0.1371","","","","","","1.164","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307230","33.9331","0.0014","5.8571","0.0002","24.148","0.001","90","","110.237","0.001","90","","4503.1","0.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H19.5 Eu2.5 O16.5 S3 -","- C15 H19.5 Eu2.5 O16.5 S3 -","- C120 H156 Eu20 O132 S24 -","8","1","","Felipe Gándara; Alberto García-Cortés; Concepción Cascales; Berta Gómez-Lor; Enrique Gutiérrez-Puebla; Marta Iglesias; Angeles Monge; Natalia Snejko","Rare Earth Arenedisulfonate Metal-Organic Frameworks: An Approach toward Polyhedral Diversity and Variety of Functional Compounds","Inorganic Chemistry","2007","46","","3475","3484","10.1021/ic0617689","","","0.71073","MoKα","","0.0907","0.0617","","","0.1003","0.1087","","","","","","1.15","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307231","5.6745","0.0008","10.5508","0.0015","11.45","0.002","76.456","0.002","77.484","0.002","88.034","0.002","650.52","0.17","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H9 Nd O8 S2 -","- C10 H9 Nd O8 S2 -","- C20 H18 Nd2 O16 S4 -","2","1","","Felipe Gándara; Alberto García-Cortés; Concepción Cascales; Berta Gómez-Lor; Enrique Gutiérrez-Puebla; Marta Iglesias; Angeles Monge; Natalia Snejko","Rare Earth Arenedisulfonate Metal-Organic Frameworks: An Approach toward Polyhedral Diversity and Variety of Functional Compounds","Inorganic Chemistry","2007","46","","3475","3484","10.1021/ic0617689","","","0.71073","MoKα","","0.0926","0.054","","0.134","0.118","","","","0.639","0.721","0.721","","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307232","8.09","0.0016","8.88","0.0018","9.0028","0.0018","97.29","0.03","91.07","0.03","116.57","0.03","571.7","0.3","298","","298","","","","","","","","","3","P -1","-P 1","2","","","","- Cl6 O16 Th2 -","- Cl6 H30 O16 Th2 -","- Cl6 H30 O16 Th2 -","1","0.5","","Richard E. Wilson; S. Skanthakumar; Ginger Sigmon; Peter C. Burns; L. Soderholm","Structures of Dimeric Hydrolysis Products of Thorium","Inorganic Chemistry","2007","46","","2368","2372","10.1021/ic0617691","","","0.71073","MoKα","","0.045","0.043","","","0.1502","0.1516","","","","","","1.232","","","","has coordinates","189301","2020-10-21","18:00:00",""
"4307233","6.792","0.002","11.71","0.004","13.778","0.005","90","","102.714","0.005","90","","1069","0.6","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- H16 N6 O26 Th2 -","- H18 N6 O28 Th2 -","- H36 N12 O56 Th4 -","2","0.5","","Richard E. Wilson; S. Skanthakumar; Ginger Sigmon; Peter C. Burns; L. Soderholm","Structures of Dimeric Hydrolysis Products of Thorium","Inorganic Chemistry","2007","46","","2368","2372","10.1021/ic0617691","","","0.71073","MoKα","","0.0745","0.0357","","","0.0922","0.1276","","","","","","0.878","","","","has coordinates","189301","2020-10-21","18:00:00",""
"4307234","6.9256","0.0003","7.2067","0.0004","21.5023","0.0011","90","","96.38","0.001","90","","1066.55","0.09","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- H18 N6 O26 Th2 -","- H18 N6 O28 Th2 -","- H36 N12 O56 Th4 -","2","0.5","","Richard E. Wilson; S. Skanthakumar; Ginger Sigmon; Peter C. Burns; L. Soderholm","Structures of Dimeric Hydrolysis Products of Thorium","Inorganic Chemistry","2007","46","","2368","2372","10.1021/ic0617691","","","0.71073","MoKα","","0.0397","0.0261","","","0.0568","0.0612","","","","","","1.008","","","","has coordinates","189301","2020-10-21","18:00:00",""
"4307235","6.483","0.008","21.523","0.004","18.769","0.004","90","","99.394","0.004","90","","2584","3","296.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H8 Br4 Fe S11 -","- C13 H8 Br4 Fe S11 -","- C52 H32 Br16 Fe4 S44 -","4","1","","Mingxing Wang; Xunwen Xiao; Hideki Fujiwara; Toyonari Sugimoto; Satoru Noguchi; Takekazu Ishida; Takehiko Mori; Hiroko Aruga Katori","Antiferromagnetic or Canted Antiferromagnetic Orderings of Fe(III) d Spins of FeX4- Ions in BEDT-TTFVO(S).FeX4 (X = Cl, Br) [BEDT-TTFVO(S) = Bis(ethylenedithio)tetrathiafulvalenoquinone(-thioquinone)-1,3-dithiolemethide]","Inorganic Chemistry","2007","46","","3049","3056","10.1021/ic0617700","","","0.7107","MoKα","","","0.035","","","","0.048","","","","","","1.048","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307236","6.298","0.002","21.508","0.008","17.948","0.007","90","","99.075","0.002","90","","2400.8","1.5","293","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H8 Cl4 Fe O S10 -","- C13 H8 Cl4 Fe O S10 -","- C52 H32 Cl16 Fe4 O4 S40 -","4","1","","Mingxing Wang; Xunwen Xiao; Hideki Fujiwara; Toyonari Sugimoto; Satoru Noguchi; Takekazu Ishida; Takehiko Mori; Hiroko Aruga Katori","Antiferromagnetic or Canted Antiferromagnetic Orderings of Fe(III) d Spins of FeX4- Ions in BEDT-TTFVO(S).FeX4 (X = Cl, Br) [BEDT-TTFVO(S) = Bis(ethylenedithio)tetrathiafulvalenoquinone(-thioquinone)-1,3-dithiolemethide]","Inorganic Chemistry","2007","46","","3049","3056","10.1021/ic0617700","","","0.7107","MoKα","","","0.038","","","","0.038","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307237","6.367","0.006","21.33","0.03","18.45","0.02","90","0.006","99.732","0.006","90","0.006","2470","5","293.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H8 Cl4 Fe S11 -","- C13 H8 Cl4 Fe S11 -","- C52 H32 Cl16 Fe4 S44 -","4","1","","Mingxing Wang; Xunwen Xiao; Hideki Fujiwara; Toyonari Sugimoto; Satoru Noguchi; Takekazu Ishida; Takehiko Mori; Hiroko Aruga Katori","Antiferromagnetic or Canted Antiferromagnetic Orderings of Fe(III) d Spins of FeX4- Ions in BEDT-TTFVO(S).FeX4 (X = Cl, Br) [BEDT-TTFVO(S) = Bis(ethylenedithio)tetrathiafulvalenoquinone(-thioquinone)-1,3-dithiolemethide]","Inorganic Chemistry","2007","46","","3049","3056","10.1021/ic0617700","","","0.7107","MoKα","","","0.051","","","","0.051","","","","","","1.674","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307238","6.371","0.004","21.565","0.013","18.391","0.012","90","0.002","98.807","0.003","90","0.002","2497","3","293.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H8 Br4 Fe O S10 -","- C13 H8 Br4 Fe O S10 -","- C52 H32 Br16 Fe4 O4 S40 -","4","1","","Mingxing Wang; Xunwen Xiao; Hideki Fujiwara; Toyonari Sugimoto; Satoru Noguchi; Takekazu Ishida; Takehiko Mori; Hiroko Aruga Katori","Antiferromagnetic or Canted Antiferromagnetic Orderings of Fe(III) d Spins of FeX4- Ions in BEDT-TTFVO(S).FeX4 (X = Cl, Br) [BEDT-TTFVO(S) = Bis(ethylenedithio)tetrathiafulvalenoquinone(-thioquinone)-1,3-dithiolemethide]","Inorganic Chemistry","2007","46","","3049","3056","10.1021/ic0617700","","","0.7107","MoKα","","","0.031","","","","0.021","","","","","","1.393","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307239","16.4966","0.001","20.177","0.003","14.2793","0.0015","90","","115.634","0.006","90","","4285.1","0.8","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H56 N2 O28 U2 -","- C30 H44 N2 O28 U2 -","- C120 H176 N8 O112 U8 -","4","0.5","","Pierre Thuéry","Uranyl Ion Complexation by Citric and Citramalic Acids in the Presence of Diamines","Inorganic Chemistry","2007","46","","2307","2315","10.1021/ic061772k","","","0.71073","MoKα","","0.089","0.0586","","","0.1569","0.1734","","","","","","1.015","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307240","9.3098","0.0004","13.862","0.0006","11.0229","0.0003","90","","99.809","0.002","90","","1401.74","0.09","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H32 N2 O22 U2 -","- C18 H32 N2 O22 U2 -","- C36 H64 N4 O44 U4 -","2","0.5","","Pierre Thuéry","Uranyl Ion Complexation by Citric and Citramalic Acids in the Presence of Diamines","Inorganic Chemistry","2007","46","","2307","2315","10.1021/ic061772k","","","0.71073","MoKα","","0.0244","0.0211","","","0.0435","0.0441","","","","","","1.165","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307241","8.3086","0.0004","10.3366","0.0003","14.0153","0.0007","90","","100.247","0.003","90","","1184.47","0.09","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H24 N2 O14 U2 -","- C16 H24 N2 O14 U2 -","- C32 H48 N4 O28 U4 -","2","1","","Pierre Thuéry","Uranyl Ion Complexation by Citric and Citramalic Acids in the Presence of Diamines","Inorganic Chemistry","2007","46","","2307","2315","10.1021/ic061772k","","","0.71073","MoKα","","0.0448","0.0442","","","0.1157","0.1161","","","","","","1.055","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307242","7.3131","0.0005","8.5411","0.0003","11.2793","0.0007","97.375","0.004","98.767","0.003","106.632","0.004","656.07","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H20 N2 O18 U2 -","- C22 H20 N2 O18 U2 -","- C22 H20 N2 O18 U2 -","1","0.5","","Pierre Thuéry","Uranyl Ion Complexation by Citric and Citramalic Acids in the Presence of Diamines","Inorganic Chemistry","2007","46","","2307","2315","10.1021/ic061772k","","","0.71073","MoKα","","0.0177","0.0157","","","0.0366","0.0371","","","","","","1.052","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307243","19.2801","0.0013","11.0723","0.0008","14.2972","0.0008","90","","110.252","0.004","90","","2863.4","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 N2 O17 U2 -","- C20 H21 N2 O17 U2 -","- C80 H84 N8 O68 U8 -","4","1","","Pierre Thuéry","Uranyl Ion Complexation by Citric and Citramalic Acids in the Presence of Diamines","Inorganic Chemistry","2007","46","","2307","2315","10.1021/ic061772k","","","0.71073","MoKα","","0.0875","0.0725","","","0.1477","0.153","","","","","","1.213","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307244","17.3514","0.0015","17.2886","0.0017","15.45","0.0011","90","","118.538","0.005","90","","4071.6","0.6","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H38 N4 O23 U2 -","- C32 H26 N4 O23 U2 -","- C128 H104 N16 O92 U8 -","4","0.5","","Pierre Thuéry","Uranyl Ion Complexation by Citric and Citramalic Acids in the Presence of Diamines","Inorganic Chemistry","2007","46","","2307","2315","10.1021/ic061772k","","","0.71073","MoKα","","0.066","0.0402","","","0.0923","0.1013","","","","","","1.026","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307245","8.6825","0.0005","11.6053","0.0007","17.119","0.001","90","","90","","90","","1724.96","0.18","223","2","223","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C13 H21 Cl2 N Ru S2 -","- C13 H21 Cl2 N Ru S2 -","- C52 H84 Cl8 N4 Ru4 S8 -","4","1","","Elaine Phuay Leng Tay; Seah Ling Kuan; Weng Kee Leong; Lai Yoong Goh","Synthetic and X-ray Structural and Reactivity Studies of Cp*RuIV Complexes Containing Bidentate Dithiocarbonate, Xanthate, Carbonate, and Phosphinate Ligands (Cp* = η5-C5Me5)","Inorganic Chemistry","2007","46","","1440","1450","10.1021/ic061781t","","","0.71073","MoKα","","0.0631","0.0444","","","0.0688","0.0734","","","","","","0.869","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307246","15.3251","0.0008","13.9017","0.0007","8.7026","0.0005","90","","90","","90","","1854.04","0.17","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C15 H25 Cl2 N Ru S2 -","- C15 H25 Cl2 N Ru S2 -","- C60 H100 Cl8 N4 Ru4 S8 -","4","0.5","","Elaine Phuay Leng Tay; Seah Ling Kuan; Weng Kee Leong; Lai Yoong Goh","Synthetic and X-ray Structural and Reactivity Studies of Cp*RuIV Complexes Containing Bidentate Dithiocarbonate, Xanthate, Carbonate, and Phosphinate Ligands (Cp* = η5-C5Me5)","Inorganic Chemistry","2007","46","","1440","1450","10.1021/ic061781t","","","0.71073","MoKα","","0.0491","0.0383","","","0.0797","0.0839","","","","","","1.057","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307247","17.9211","0.0011","7.0721","0.0004","15.0124","0.0009","90","","110.696","0.001","90","","1779.89","0.18","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H22 Cl2 O Ru S2 -","- C14 H22 Cl2 O Ru S2 -","- C56 H88 Cl8 O4 Ru4 S8 -","4","1","","Elaine Phuay Leng Tay; Seah Ling Kuan; Weng Kee Leong; Lai Yoong Goh","Synthetic and X-ray Structural and Reactivity Studies of Cp*RuIV Complexes Containing Bidentate Dithiocarbonate, Xanthate, Carbonate, and Phosphinate Ligands (Cp* = η5-C5Me5)","Inorganic Chemistry","2007","46","","1440","1450","10.1021/ic061781t","","","0.71073","MoKα","","0.0492","0.0365","","","0.0807","0.0946","","","","","","1.048","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307248","11.1679","0.0004","12.8682","0.0005","13.0374","0.0005","64.5","0.001","78.267","0.001","80.564","0.001","1649.56","0.11","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H33 Cl7 N2 Ru S4 -","- C20 H33 Cl7 N2 Ru S4 -","- C40 H66 Cl14 N4 Ru2 S8 -","2","1","","Elaine Phuay Leng Tay; Seah Ling Kuan; Weng Kee Leong; Lai Yoong Goh","Synthetic and X-ray Structural and Reactivity Studies of Cp*RuIV Complexes Containing Bidentate Dithiocarbonate, Xanthate, Carbonate, and Phosphinate Ligands (Cp* = η5-C5Me5)","Inorganic Chemistry","2007","46","","1440","1450","10.1021/ic061781t","","","0.71073","MoKα","","0.0471","0.0435","","","0.1049","0.1074","","","","","","1.098","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307249","8.8077","0.0003","24.5807","0.001","8.8818","0.0004","90","","113.711","0.001","90","","1760.58","0.12","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H21 N O Ru S4 -","- C14 H21 N O Ru S4 -","- C56 H84 N4 O4 Ru4 S16 -","4","1","","Elaine Phuay Leng Tay; Seah Ling Kuan; Weng Kee Leong; Lai Yoong Goh","Synthetic and X-ray Structural and Reactivity Studies of Cp*RuIV Complexes Containing Bidentate Dithiocarbonate, Xanthate, Carbonate, and Phosphinate Ligands (Cp* = η5-C5Me5)","Inorganic Chemistry","2007","46","","1440","1450","10.1021/ic061781t","","","0.71073","MoKα","","0.0469","0.041","","","0.0927","0.0955","","","","","","1.124","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307250","15.5154","0.0006","29.6852","0.0012","10.0847","0.0004","90","","122.352","0.001","90","","3923.8","0.3","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H25 N O Ru S4 -","- C16 H25 N O Ru S4 -","- C128 H200 N8 O8 Ru8 S32 -","8","1","","Elaine Phuay Leng Tay; Seah Ling Kuan; Weng Kee Leong; Lai Yoong Goh","Synthetic and X-ray Structural and Reactivity Studies of Cp*RuIV Complexes Containing Bidentate Dithiocarbonate, Xanthate, Carbonate, and Phosphinate Ligands (Cp* = η5-C5Me5)","Inorganic Chemistry","2007","46","","1440","1450","10.1021/ic061781t","","","0.71073","MoKα","","0.0428","0.0369","","","0.0827","0.0859","","","","","","1.133","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307251","23.7047","0.0005","17.9199","0.0004","20.3108","0.0004","90","","123.456","0.001","90","","7198.2","0.3","183","2","183","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C34 H41.5 Cl2 N2.5 O0.5 P Ru S2 -","- C34 H41.5 Cl2 N2.5 O0.5 P Ru S2 -","- C272 H332 Cl16 N20 O4 P8 Ru8 S16 -","8","1","","Elaine Phuay Leng Tay; Seah Ling Kuan; Weng Kee Leong; Lai Yoong Goh","Synthetic and X-ray Structural and Reactivity Studies of Cp*RuIV Complexes Containing Bidentate Dithiocarbonate, Xanthate, Carbonate, and Phosphinate Ligands (Cp* = η5-C5Me5)","Inorganic Chemistry","2007","46","","1440","1450","10.1021/ic061781t","","","0.71073","MoKα","","0.0745","0.0593","","","0.1567","0.1661","","","","","","1.092","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307252","11.5644","0.0003","28.4673","0.0008","11.961","0.0003","90","","93.921","0.001","90","","3928.43","0.18","223","2","223","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C40 H50 B Cl N P Ru S2 -","- C40 H50 B Cl N P Ru S2 -","- C160 H200 B4 Cl4 N4 P4 Ru4 S8 -","4","1","","Elaine Phuay Leng Tay; Seah Ling Kuan; Weng Kee Leong; Lai Yoong Goh","Synthetic and X-ray Structural and Reactivity Studies of Cp*RuIV Complexes Containing Bidentate Dithiocarbonate, Xanthate, Carbonate, and Phosphinate Ligands (Cp* = η5-C5Me5)","Inorganic Chemistry","2007","46","","1440","1450","10.1021/ic061781t","","","0.71073","MoKα","","0.0792","0.0723","","","0.1499","0.153","","","","","","1.352","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307253","14.6555","0.0002","11.1636","0.0002","18.7075","0.0003","90","","101.676","0.001","90","","2997.37","0.08","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H37 O P Ru S2 -","- C32 H37 O P Ru S2 -","- C128 H148 O4 P4 Ru4 S8 -","4","1","","Elaine Phuay Leng Tay; Seah Ling Kuan; Weng Kee Leong; Lai Yoong Goh","Synthetic and X-ray Structural and Reactivity Studies of Cp*RuIV Complexes Containing Bidentate Dithiocarbonate, Xanthate, Carbonate, and Phosphinate Ligands (Cp* = η5-C5Me5)","Inorganic Chemistry","2007","46","","1440","1450","10.1021/ic061781t","","","0.71073","MoKα","","0.0505","0.0459","","","0.1026","0.1052","","","","","","1.156","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307254","9.3769","0.0005","11.4486","0.0006","15.4189","0.0009","87.427","0.001","81.352","0.001","86.416","0.001","1632.18","0.15","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H21 N O Ru S2 -","- C14 H21 N O Ru S2 -","- C56 H84 N4 O4 Ru4 S8 -","4","2","","Elaine Phuay Leng Tay; Seah Ling Kuan; Weng Kee Leong; Lai Yoong Goh","Synthetic and X-ray Structural and Reactivity Studies of Cp*RuIV Complexes Containing Bidentate Dithiocarbonate, Xanthate, Carbonate, and Phosphinate Ligands (Cp* = η5-C5Me5)","Inorganic Chemistry","2007","46","","1440","1450","10.1021/ic061781t","","","0.71073","MoKα","","0.0343","0.0295","","","0.0736","0.0758","","","","","","1.034","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307255","10.656","0.001","19.077","0.002","16.153","0.002","90","","100.617","0.002","90","","3227.4","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Chloro(η^5^-cyclopentadienyl)(bis(o-diphenylphosphino phenyl)ether)ruthenium(II)","","- C41 H33 Cl O P2 Ru -","- C41 H33 Cl O P2 Ru -","- C164 H132 Cl4 O4 P8 Ru4 -","4","1","","Ramalingam Venkateswaran; Joel T. Mague; Maravanji S. Balakrishna","Ruthenium(II) Complexes Containing Bis(2-(diphenylphosphino)phenyl) Ether and Their Catalytic Activity in Hydrogenation Reactions","Inorganic Chemistry","2007","46","","809","817","10.1021/ic061782l","","","0.71073","MoKα","","0.0358","0.0301","","","0.0724","0.0752","","","","","","1.046","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307256","22.863","0.002","15.076","0.001","14.352","0.001","90","","90","","90","","4946.9","0.6","100","2","100","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","μ-(2,2'-Bis(diphenylphosphinophenyl)ether)bis(η^6^-(1- i-propyl-4-methylbenzene)dichlororuthenium(II))","","- C56 H56 Cl4 O P2 Ru2 -","- C56 H56 Cl4 O P2 Ru2 -","- C224 H224 Cl16 O4 P8 Ru8 -","4","0.5","","Ramalingam Venkateswaran; Joel T. Mague; Maravanji S. Balakrishna","Ruthenium(II) Complexes Containing Bis(2-(diphenylphosphino)phenyl) Ether and Their Catalytic Activity in Hydrogenation Reactions","Inorganic Chemistry","2007","46","","809","817","10.1021/ic061782l","","","0.71073","MoKα","","0.0615","0.0471","","","0.1046","0.1103","","","","","","1.111","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307257","11.4515","0.0009","13.868","0.001","15.372","0.001","92.377","0.001","106.488","0.001","96.296","0.001","2320","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","cis-Dichloro(dimethylsulfoxide)(bis(2-diphenylphosphino phenyl)ether)ruthenium(II) Dichloromethane solvate","","- C41 H40 Cl8 O2 P2 Ru S -","- C41 H40 Cl8 O2 P2 Ru S -","- C82 H80 Cl16 O4 P4 Ru2 S2 -","2","1","","Ramalingam Venkateswaran; Joel T. Mague; Maravanji S. Balakrishna","Ruthenium(II) Complexes Containing Bis(2-(diphenylphosphino)phenyl) Ether and Their Catalytic Activity in Hydrogenation Reactions","Inorganic Chemistry","2007","46","","809","817","10.1021/ic061782l","","","0.71073","MoKα","","0.0556","0.0436","","","0.1093","0.1146","","","","","","1.032","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307258","10.9687","0.0007","11.9749","0.0008","35.24","0.002","90","","94.482","0.001","90","","4614.6","0.5","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","trans-dichlorobis(pyridine)(2,2'-bis(diphenylphosphino phenyl)ether-κP:κP')ruthenium(II) Chloroform solvate","","- C48 H40 Cl8 N2 O P2 Ru -","- C48 H40 Cl8 N2 O P2 Ru -","- C192 H160 Cl32 N8 O4 P8 Ru4 -","4","1","","Ramalingam Venkateswaran; Joel T. Mague; Maravanji S. Balakrishna","Ruthenium(II) Complexes Containing Bis(2-(diphenylphosphino)phenyl) Ether and Their Catalytic Activity in Hydrogenation Reactions","Inorganic Chemistry","2007","46","","809","817","10.1021/ic061782l","","","0.71073","MoKα","","0.0632","0.0489","","","0.11","0.1168","","","","","","1.033","","","","has coordinates,has disorder","179110","2020-10-21","18:00:00",""
"4307259","26.076","0.003","9.732","0.001","33.932","0.004","90","","90","","90","","8611","1.7","100","2","100","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","cis-Dichloro[bis(2-diphenylphosphinophenyl)ether- κP:κP'](2,2'-bipyridyl-κN:κN')ruthenium(II) Dichloromethane solvate","","- C47 H38 Cl4 N2 O P2 Ru -","- C47 H38 Cl4 N2 O P2 Ru -","- C376 H304 Cl32 N16 O8 P16 Ru8 -","8","2","","Ramalingam Venkateswaran; Joel T. Mague; Maravanji S. Balakrishna","Ruthenium(II) Complexes Containing Bis(2-(diphenylphosphino)phenyl) Ether and Their Catalytic Activity in Hydrogenation Reactions","Inorganic Chemistry","2007","46","","809","817","10.1021/ic061782l","","","0.71073","MoKα","","0.152","0.105","","","0.2511","0.2797","","","","","","1.093","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307260","12.252","0.001","36.228","0.004","12.19","0.001","90","","108.018","0.001","90","","5145.4","0.8","100","2","373","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Dichloro(triphenylphosphine)(di(2- diphenylphosphinophenyl)ether)ruthenium(II) chloroform solvate","","- C55.5 H44.5 Cl7 O P3 Ru -","- C55.5 H44.5 Cl7 O P3 Ru -","- C222 H178 Cl28 O4 P12 Ru4 -","4","1","","Ramalingam Venkateswaran; Joel T. Mague; Maravanji S. Balakrishna","Ruthenium(II) Complexes Containing Bis(2-(diphenylphosphino)phenyl) Ether and Their Catalytic Activity in Hydrogenation Reactions","Inorganic Chemistry","2007","46","","809","817","10.1021/ic061782l","","","0.71073","MoKα","","0.0856","0.0655","","","0.1542","0.1617","","","","","","1.13","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307261","11.0985","0.0007","12.2786","0.0008","15.715","0.001","81.44","0.001","83.965","0.001","81.457","0.001","2086.6","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","cis-Dichloroaquo(acetonitrile)(2,2'-bis(diphenylphosphino- phenyl)ether)ruthenium(II) Dichloromethane solvate","","- C39 H35 Cl4 N O2 P2 Ru -","- C39 H35 Cl4 N O2 P2 Ru -","- C78 H70 Cl8 N2 O4 P4 Ru2 -","2","1","","Ramalingam Venkateswaran; Joel T. Mague; Maravanji S. Balakrishna","Ruthenium(II) Complexes Containing Bis(2-(diphenylphosphino)phenyl) Ether and Their Catalytic Activity in Hydrogenation Reactions","Inorganic Chemistry","2007","46","","809","817","10.1021/ic061782l","","","0.71073","MoKα","","0.0635","0.0531","","","0.1296","0.135","","","","","","1.046","","","","has coordinates,has disorder","179110","2020-10-21","18:00:00",""
"4307262","39.131","0.009","13.082","0.003","28.121","0.007","90","","114.53","0.004","90","","13096","5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52 H48 Cu2 Mn N14 O14 -","- C52 H44 Cu2 Mn N14 O14.01 -","- C416 H352 Cu16 Mn8 N112 O112.08 -","8","1","","Li-Na Zhu; Na Xu; Wei Zhang; Dai-Zheng Liao; Kazuyoshi Yoshimura; Ko Mibu; Zong-Hui Jiang; Shi-Ping Yan; Peng Cheng","Heteronuclear Complexes of Macrocyclic Oxamide with Co-ligands: Syntheses, Crystal Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","1297","1304","10.1021/ic061792m","","","0.71073","MoKα","","0.1571","0.0792","","","0.2258","0.2819","","","","","","1.033","","","","has coordinates,has disorder","179110","2020-10-21","18:00:00",""
"4307263","21.229","0.006","14.169","0.004","17.183","0.005","90","","95.085","0.005","90","","5148","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C50 H44 Cu2 Mn N10 O12 S2 -","- C50 H44 Cu2 Mn N10 O12 S2 -","- C200 H176 Cu8 Mn4 N40 O48 S8 -","4","0.5","","Li-Na Zhu; Na Xu; Wei Zhang; Dai-Zheng Liao; Kazuyoshi Yoshimura; Ko Mibu; Zong-Hui Jiang; Shi-Ping Yan; Peng Cheng","Heteronuclear Complexes of Macrocyclic Oxamide with Co-ligands: Syntheses, Crystal Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","1297","1304","10.1021/ic061792m","","","0.71073","MoKα","","0.0989","0.0466","","","0.0969","0.1265","","","","","","1.018","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307264","10.763","0.004","11.936","0.004","12.51","0.007","101.378","0.006","106.967","0.006","116.291","0.004","1274.3","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H22 Cu Fe N10 O6 -","- C24 H22 Cu Fe N10 O6 -","- C48 H44 Cu2 Fe2 N20 O12 -","2","1","","Li-Na Zhu; Na Xu; Wei Zhang; Dai-Zheng Liao; Kazuyoshi Yoshimura; Ko Mibu; Zong-Hui Jiang; Shi-Ping Yan; Peng Cheng","Heteronuclear Complexes of Macrocyclic Oxamide with Co-ligands: Syntheses, Crystal Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","1297","1304","10.1021/ic061792m","","","0.71073","MoKα","","0.0583","0.0407","","","0.1137","0.121","","","","","","1.071","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307265","21.208","0.007","14.214","0.005","17.062","0.006","90","","95.396","0.005","90","","5121","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C50 H44 Cu2 N10 O12 S2 Zn -","- C50 H44 Cu2 N10 O12 S2 Zn -","- C200 H176 Cu8 N40 O48 S8 Zn4 -","4","0.5","","Li-Na Zhu; Na Xu; Wei Zhang; Dai-Zheng Liao; Kazuyoshi Yoshimura; Ko Mibu; Zong-Hui Jiang; Shi-Ping Yan; Peng Cheng","Heteronuclear Complexes of Macrocyclic Oxamide with Co-ligands: Syntheses, Crystal Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","1297","1304","10.1021/ic061792m","","","0.71073","MoKα","","0.0471","0.031","","","0.0754","0.0814","","","","","","1.045","","","","has coordinates,has disorder","179110","2020-10-21","18:00:00",""
"4307266","16.455","0.003","16.776","0.003","18.4","0.004","77.43","0.03","75.31","0.03","66.2","0.03","4457.1","1.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","1,2-bis(21'-(5',10',15',20'-tetratolyl-2'-aza- 21'-carbaporphyrinatonickel(II)-methyl)benzene","","- C112 H89 Cl4 N8 Ni2 -","- C112 H89 Cl4 N8 Ni2 -","- C224 H178 Cl8 N16 Ni4 -","2","1","","Piotr J. Chmielewski","Synthesis, Structure, and Redox Properties of N-Confused Bis(porphyrinatonickel(II)) Linked byo-Xylene","Inorganic Chemistry","2007","46","","1617","1626","10.1021/ic061793e","","","1.54178","CuKα","","0.1378","0.0903","","","0.2308","0.2732","","","","","","1.011","","","","has coordinates,has disorder","179110","2020-10-21","18:00:00",""
"4307267","13.86","0.002","13.86","0.002","7.33","0.0015","90","","90","","120","","1219.4","0.4","100","2","100","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C3 H18 Cm F9 O18 S3 -","- C3 H18 Cm F9 O18 S3 -","- C6 H36 Cm2 F18 O36 S6 -","2","0.166667","","S. Skanthakumar; Mark R. Antonio; Richard E. Wilson; L. Soderholm","The Curium Aqua Ion","Inorganic Chemistry","2007","46","","3485","3491","10.1021/ic061798b","","","0.71073","MoKα","","0.0115","0.0112","","","0.0286","0.0286","","","","","","1.157","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307268","9.6766","0.0019","14.893","0.003","15.93","0.004","99.946","0.005","93.953","0.006","94.277","0.004","2247.1","0.8","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C45.5 H74 N2 O4 Yb -","- C45.5 H70 N2 O4 Yb -","- C91 H140 N4 O8 Yb2 -","2","1","","Hui Zhou; Huadong Guo; Yingming Yao; Liying Zhou; Hongmei Sun; Hongting Sheng; Yong Zhang; Qi Shen","Ytterbium(II) Complex Bearing a Diaminobis(phenolate) Ligand: Synthesis, Structure, and One-Electron-Transfer and ε-Caprolactone Polymerization Reactions","Inorganic Chemistry","2007","46","","958","964","10.1021/ic061805w","","","0.7107","MoKα","","0.0326","0.03","","","0.0739","0.0761","","","","","","1.085","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307269","11.7955","0.001","14.2426","0.0013","16.2769","0.0014","80.499","0.004","76.699","0.004","86.179","0.004","2623.5","0.4","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C106 H166 N6 O12 Yb2 -","- C106 H150 N6 O12 Yb2 -","- C106 H150 N6 O12 Yb2 -","1","0.5","","Hui Zhou; Huadong Guo; Yingming Yao; Liying Zhou; Hongmei Sun; Hongting Sheng; Yong Zhang; Qi Shen","Ytterbium(II) Complex Bearing a Diaminobis(phenolate) Ligand: Synthesis, Structure, and One-Electron-Transfer and ε-Caprolactone Polymerization Reactions","Inorganic Chemistry","2007","46","","958","964","10.1021/ic061805w","","","0.7107","MoKα","","0.0273","0.0253","","","0.0604","0.0616","","","","","","1.086","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307270","20.1597","0.0018","10.5615","0.0008","23.409","0.002","90","","114.011","0.002","90","","4552.9","0.7","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H69 N2 O4 Yb -","- C46 H69 N2 O4 Yb -","- C184 H276 N8 O16 Yb4 -","4","1","","Hui Zhou; Huadong Guo; Yingming Yao; Liying Zhou; Hongmei Sun; Hongting Sheng; Yong Zhang; Qi Shen","Ytterbium(II) Complex Bearing a Diaminobis(phenolate) Ligand: Synthesis, Structure, and One-Electron-Transfer and ε-Caprolactone Polymerization Reactions","Inorganic Chemistry","2007","46","","958","964","10.1021/ic061805w","","","0.7107","MoKα","","0.0283","0.0252","","","0.0576","0.0592","","","","","","1.08","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307271","22.417","0.003","22.417","0.003","30.021","0.007","90","","90","","120","","13065","4","193","2","193","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C211 H135 F27 N41 Nd7 O51 S9 -","- C210.96 H120 F19.95 N40.98 Nd7 O43.97 S8.98 -","- C421.92 H240 F39.9 N81.96 Nd14 O87.94 S17.96 -","2","0.166667","","Xiao-Yan Chen; Yann Bretonnière; Jacques Pécaut; Daniel Imbert; Jean-Claude Bünzli; Marinella Mazzanti","Selective Self-Assembly of Hexameric Homo- and Heteropolymetallic Lanthanide Wheels: Synthesis, Structure, and Photophysical Studies","Inorganic Chemistry","2007","46","","625","637","10.1021/ic061806o","","","0.71073","MoKα","","0.1388","0.1246","","","0.2751","0.2822","","","","","","1.403","","","","has coordinates,has disorder","179110","2020-10-21","18:00:00",""
"4307272","22.9958","0.0007","22.9958","0.0007","31.3192","0.0017","90","","90","","120","","14342.9","1","223","2","223","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C221 H150 F27 Gd7 N46 O51 S9 -","- C218.07 H120 F15 Gd7 N46.05 O45.02 S8.97 -","- C436.14 H240 F30 Gd14 N92.1 O90.04 S17.94 -","2","0.166667","","Xiao-Yan Chen; Yann Bretonnière; Jacques Pécaut; Daniel Imbert; Jean-Claude Bünzli; Marinella Mazzanti","Selective Self-Assembly of Hexameric Homo- and Heteropolymetallic Lanthanide Wheels: Synthesis, Structure, and Photophysical Studies","Inorganic Chemistry","2007","46","","625","637","10.1021/ic061806o","","","0.71073","MoKα","","0.222","0.0695","","","0.1947","0.2535","","","","","","0.836","","","","has coordinates,has disorder","179110","2020-10-21","18:00:00",""
"4307273","22.368","0.004","22.368","0.004","30.072","0.011","90","","90","","120","","13030","6","193","2","193","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C218 H156 Eu6 F27 Lu N42 O55 S9 -","- C217.98 H150.96 Eu6 F27.06 Lu N42 O55.04 S9.02 -","- C435.96 H301.92 Eu12 F54.12 Lu2 N84 O110.08 S18.04 -","2","0.166667","","Xiao-Yan Chen; Yann Bretonnière; Jacques Pécaut; Daniel Imbert; Jean-Claude Bünzli; Marinella Mazzanti","Selective Self-Assembly of Hexameric Homo- and Heteropolymetallic Lanthanide Wheels: Synthesis, Structure, and Photophysical Studies","Inorganic Chemistry","2007","46","","625","637","10.1021/ic061806o","","","0.71073","MoKα","","0.0858","0.0748","","","0.1757","0.1809","","","","","","1.301","","","","has coordinates,has disorder","179110","2020-10-21","18:00:00",""
"4307274","8.4114","0.0013","26.655","0.004","8.742","0.0013","90","","109.885","0.002","90","","1843.1","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2-methoxybenzyl)diphenyltinchloride","","- C20 H19 Cl O Sn -","- C20 H19 Cl O Sn -","- C80 H76 Cl4 O4 Sn4 -","4","1","","Teresita Munguia; Marcela López-Cardoso; Francisco Cervantes-Lee; Keith H. Pannell","Intramolecular Chalcogen-Tin Interactions in (o-MeE-C6H4)CH2SnPh3-nCln (E = S, O; n= 0, 1, 2), Characterized by X-ray Diffraction and 119Sn Solution and Solid-State NMR","Inorganic Chemistry","2007","46","","1305","1314","10.1021/ic061811s","","","0.71073","MoKα","","0.0452","0.0406","","","0.0802","0.0816","","","","","","1.279","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307275","7.7795","0.0013","19.78","0.003","9.8816","0.0016","90","","94.183","0.003","90","","1516.5","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2-methoxybenzyl)phenyltindichloride","","- C14 H14 Cl2 O Sn -","- C14 H14 Cl2 O Sn -","- C56 H56 Cl8 O4 Sn4 -","4","1","","Teresita Munguia; Marcela López-Cardoso; Francisco Cervantes-Lee; Keith H. Pannell","Intramolecular Chalcogen-Tin Interactions in (o-MeE-C6H4)CH2SnPh3-nCln (E = S, O; n= 0, 1, 2), Characterized by X-ray Diffraction and 119Sn Solution and Solid-State NMR","Inorganic Chemistry","2007","46","","1305","1314","10.1021/ic061811s","","","0.71073","MoKα","","0.0344","0.0284","","","0.0731","0.0763","","","","","","1.04","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307276","19.066","0.004","14.766","0.003","7.9109","0.0017","90","","98.743","0.005","90","","2201.3","0.8","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(2-thiomethylbenzyl)triphenyltin","","- C26 H24 S Sn -","- C26 H24 S Sn -","- C104 H96 S4 Sn4 -","4","1","","Teresita Munguia; Marcela López-Cardoso; Francisco Cervantes-Lee; Keith H. Pannell","Intramolecular Chalcogen-Tin Interactions in (o-MeE-C6H4)CH2SnPh3-nCln (E = S, O; n= 0, 1, 2), Characterized by X-ray Diffraction and 119Sn Solution and Solid-State NMR","Inorganic Chemistry","2007","46","","1305","1314","10.1021/ic061811s","","","0.71073","MoKα","","0.0791","0.0522","","","0.0991","0.1099","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307277","8.8031","0.0006","27.5903","0.0018","8.5728","0.0006","90","","113.822","0.001","90","","1904.8","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2-thiomethylbenzyl)triphenyltin","","- C20 H19 Cl S Sn -","- C20 H19 Cl S Sn -","- C80 H76 Cl4 S4 Sn4 -","4","1","","Teresita Munguia; Marcela López-Cardoso; Francisco Cervantes-Lee; Keith H. Pannell","Intramolecular Chalcogen-Tin Interactions in (o-MeE-C6H4)CH2SnPh3-nCln (E = S, O; n= 0, 1, 2), Characterized by X-ray Diffraction and 119Sn Solution and Solid-State NMR","Inorganic Chemistry","2007","46","","1305","1314","10.1021/ic061811s","","","0.71073","MoKα","","0.0382","0.0292","","","0.0764","0.0919","","","","","","0.425","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307278","9.646","0.001","9.656","0.002","16.592","0.003","90","","90","","90","","1545.4","0.5","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H14 Cl2 S Sn -","- C14 H14 Cl2 S Sn -","- C56 H56 Cl8 S4 Sn4 -","4","1","","Teresita Munguia; Marcela López-Cardoso; Francisco Cervantes-Lee; Keith H. Pannell","Intramolecular Chalcogen-Tin Interactions in (o-MeE-C6H4)CH2SnPh3-nCln (E = S, O; n= 0, 1, 2), Characterized by X-ray Diffraction and 119Sn Solution and Solid-State NMR","Inorganic Chemistry","2007","46","","1305","1314","10.1021/ic061811s","","","0.71073","MoKα","","0.0381","0.0376","","","0.0997","0.1005","","","","","","0.986","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307279","16.9091","0.0015","15.8687","0.0014","8.1595","0.0007","90","","90","","90","","2189.4","0.3","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","(2-methoxybenzyl)triphenyltin","","- C26 H24 O Sn -","- C26 H24 O Sn -","- C104 H96 O4 Sn4 -","4","1","","Teresita Munguia; Marcela López-Cardoso; Francisco Cervantes-Lee; Keith H. Pannell","Intramolecular Chalcogen-Tin Interactions in (o-MeE-C6H4)CH2SnPh3-nCln (E = S, O; n= 0, 1, 2), Characterized by X-ray Diffraction and 119Sn Solution and Solid-State NMR","Inorganic Chemistry","2007","46","","1305","1314","10.1021/ic061811s","","","0.71073","MoKα","","0.0226","0.0221","","","0.0584","0.0587","","","","","","1.067","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307280","11.73","0.008","18.139","0.013","13.679","0.005","90","","94.6","0.03","90","","2901","3","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37 H25 N3 Ni S3 -","- C37 H25 N3 Ni S3 -","- C148 H100 N12 Ni4 S12 -","4","1","","Tatsuya Kawamoto; Kazunori Takeda; Masato Nishiwaki; Takashi Aridomi; Takumi Konno","Square-Planar N2S2NiII Complexes with an Extended π-Conjugated System","Inorganic Chemistry","2007","46","","4239","4247","10.1021/ic0618246","","","0.71075","MoKα","","0.143","0.0579","","","0.1031","0.1216","","","","","","0.878","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307281","12.507","0.002","13.842","0.003","18.215","0.003","90","","91.916","0.014","90","","3151.7","1","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C35 H26 Cl2 N2 Ni S2 -","- C35 H24 Cl2 N2 Ni S2 -","- C140 H96 Cl8 N8 Ni4 S8 -","4","1","","Tatsuya Kawamoto; Kazunori Takeda; Masato Nishiwaki; Takashi Aridomi; Takumi Konno","Square-Planar N2S2NiII Complexes with an Extended π-Conjugated System","Inorganic Chemistry","2007","46","","4239","4247","10.1021/ic0618246","","","0.71069","MoKα","","0.1904","0.0451","","","0.1111","0.1535","","","","","","0.954","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307282","11.375","0.008","12.467","0.01","15.068","0.011","97.94","0.06","109.01","0.05","93.77","0.06","1987","3","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H30 Cl4 N4 Ni S4 -","- C42 H26 Cl3.96 N4 Ni S4 -","- C84 H52 Cl7.92 N8 Ni2 S8 -","2","1","","Tatsuya Kawamoto; Kazunori Takeda; Masato Nishiwaki; Takashi Aridomi; Takumi Konno","Square-Planar N2S2NiII Complexes with an Extended π-Conjugated System","Inorganic Chemistry","2007","46","","4239","4247","10.1021/ic0618246","","","0.71075","MoKα","","0.1132","0.0689","","","0.185","0.2114","","","","","","0.912","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307283","11.85","0.03","12.63","0.04","19.59","0.05","95","0.3","102.3","0.2","113.6","0.2","2576","14","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C45 H29 Cl12 N5 Ni O S4 -","- C45 H18 Cl12 N5 Ni O S4 -","- C90 H36 Cl24 N10 Ni2 O2 S8 -","2","1","","Tatsuya Kawamoto; Kazunori Takeda; Masato Nishiwaki; Takashi Aridomi; Takumi Konno","Square-Planar N2S2NiII Complexes with an Extended π-Conjugated System","Inorganic Chemistry","2007","46","","4239","4247","10.1021/ic0618246","","","0.71075","MoKα","","0.1704","0.0795","","","0.2013","0.2467","","","","","","0.865","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307284","9.892","0.002","9.193","0.002","9.772","0.002","90","","116.933","0.003","90","","792.3","0.3","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C7 H13 N3 -","- C7 H13 N3 -","- C28 H52 N12 -","4","1","","Finith E. Jernigan; Nathan A. Sieracki; Michael T. Taylor; Aaron S. Jenkins; Sharon E. Engel; Brittany W. Rowe; Fernando A. Jové; Glenn P. A. Yap; Elizabeth T. Papish; Gregory M. Ferrence","Sterically Bulky Tris(triazolyl)borate Ligands as Water-Soluble Analogues of Tris(pyrazolyl)borate","Inorganic Chemistry","2007","46","","360","362","10.1021/ic061828a","","","0.71073","MoKα","","0.0549","0.048","","","0.1227","0.1283","","","","","","1.068","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307285","9.764","0.004","33.236","0.007","9.82","0.003","90","","114.61","0.03","90","","2897.3","1.7","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H42 B N9 O3 Zn -","- C23 H42 B N9 O3 Zn -","- C92 H168 B4 N36 O12 Zn4 -","4","1","","Finith E. Jernigan; Nathan A. Sieracki; Michael T. Taylor; Aaron S. Jenkins; Sharon E. Engel; Brittany W. Rowe; Fernando A. Jové; Glenn P. A. Yap; Elizabeth T. Papish; Gregory M. Ferrence","Sterically Bulky Tris(triazolyl)borate Ligands as Water-Soluble Analogues of Tris(pyrazolyl)borate","Inorganic Chemistry","2007","46","","360","362","10.1021/ic061828a","","","0.71073","MoKα","","0.0903","0.0773","","","0.2353","0.2471","","","","","","1.016","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307286","11.731","0.003","13.281","0.004","17.836","0.005","90","","90","","90","","2778.8","1.3","120","2","120","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C21 H37 B Co N10 O3 -","- C21 H37 B Co N10 O3 -","- C84 H148 B4 Co4 N40 O12 -","4","0.5","","Finith E. Jernigan; Nathan A. Sieracki; Michael T. Taylor; Aaron S. Jenkins; Sharon E. Engel; Brittany W. Rowe; Fernando A. Jové; Glenn P. A. Yap; Elizabeth T. Papish; Gregory M. Ferrence","Sterically Bulky Tris(triazolyl)borate Ligands as Water-Soluble Analogues of Tris(pyrazolyl)borate","Inorganic Chemistry","2007","46","","360","362","10.1021/ic061828a","","","0.71073","MoKα","","0.0475","0.0381","","","0.0974","0.1024","","","","","","1.046","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307287","9.6047","0.0019","21.543","0.004","9.32","0.0019","90","","105.398","0.016","90","","1859.2","0.6","120","2","120","2","","","","","","","","6","C 1 m 1","C -2y","8","","","","- C23 H39 B Cl7 Co N9 -","- C23 H39 B Cl7 Co N9 -","- C46 H78 B2 Cl14 Co2 N18 -","2","0.5","","Finith E. Jernigan; Nathan A. Sieracki; Michael T. Taylor; Aaron S. Jenkins; Sharon E. Engel; Brittany W. Rowe; Fernando A. Jové; Glenn P. A. Yap; Elizabeth T. Papish; Gregory M. Ferrence","Sterically Bulky Tris(triazolyl)borate Ligands as Water-Soluble Analogues of Tris(pyrazolyl)borate","Inorganic Chemistry","2007","46","","360","362","10.1021/ic061828a","","","0.71073","MoKα","","0.0651","0.049","","","0.0906","0.0955","","","","","","1.016","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307288","5.65","0.0011","4.78","0.001","15.33","0.003","90","","98.5","0.03","90","","409.47","0.15","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C H4 Co O4 P -","- C4 H16 Co4 O16 P4 -","- C4 H16 Co4 O16 P4 -","1","0.25","","Crystal A. Merrill; Anthony K. Cheetham","Inorganic-Organic Framework Structures; M(II) Ethylenediphosphonates (M = Co, Ni, Mn) and a Mn(II) Ethylenediphosphonato-phenanthroline","Inorganic Chemistry","2007","46","","278","284","10.1021/ic0618302","","","0.71073","MoKα","","0.0557","0.0548","","","0.1447","0.1452","","","","","","1.273","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307289","5.5807","0.0011","4.7205","0.0009","15.25","0.003","90","","98.55","0.03","90","","397.28","0.14","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C H4 Ni O4 P -","- C H4 Ni O4 P -","- C4 H16 Ni4 O16 P4 -","4","1","","Crystal A. Merrill; Anthony K. Cheetham","Inorganic-Organic Framework Structures; M(II) Ethylenediphosphonates (M = Co, Ni, Mn) and a Mn(II) Ethylenediphosphonato-phenanthroline","Inorganic Chemistry","2007","46","","278","284","10.1021/ic0618302","","","0.71073","MoKα","","0.073","0.0719","","","0.1905","0.1912","","","","","","1.128","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307290","12.173","0.002","15.393","0.003","9.867","0.002","90","","108.78","0.03","90","","1750.4","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H18 Mn N2 O8 P2 -","- C14 H18 Mn N2 O8 P2 -","- C56 H72 Mn4 N8 O32 P8 -","4","0.5","","Crystal A. Merrill; Anthony K. Cheetham","Inorganic-Organic Framework Structures; M(II) Ethylenediphosphonates (M = Co, Ni, Mn) and a Mn(II) Ethylenediphosphonato-phenanthroline","Inorganic Chemistry","2007","46","","278","284","10.1021/ic0618302","","","0.71073","MoKα","","0.0303","0.0265","","","0.0712","0.0733","","","","","","1.072","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307291","5.498","0.005","7.715","0.006","8.093","0.007","82.986","0.012","75.565","0.012","80.582","0.012","326.8","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C2 H6 Mn O6 P2 -","- C2 H6 Mn O6 P2 -","- C4 H12 Mn2 O12 P4 -","2","1","","Crystal A. Merrill; Anthony K. Cheetham","Inorganic-Organic Framework Structures; M(II) Ethylenediphosphonates (M = Co, Ni, Mn) and a Mn(II) Ethylenediphosphonato-phenanthroline","Inorganic Chemistry","2007","46","","278","284","10.1021/ic0618302","","","0.71073","MoKα","","0.0259","0.0251","","","0.0666","0.0671","","","","","","1.117","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307292","10.958","0.005","13.411","0.005","14.512","0.007","68.578","0.014","73.43","0.016","84.413","0.014","1902.8","1.5","163.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H42 N Ni O6 S10 -","- C28 H42 N Ni O6 S10 -","- C56 H84 N2 Ni2 O12 S20 -","2","1","","Daisuke Sato; Tomoyuki Akutagawa; Sadamu Takeda; Shin-ichiro Noro; Takayoshi Nakamura","Supramolecular Rotor: Adamantylammonium([18]crown-6) in [Ni(dmit)2]- Salt","Inorganic Chemistry","2007","46","","363","365","10.1021/ic061831u","","","0.71075","MoKα","","","0.0661","","","","0.1343","","","","","","0.919","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307293","11.049","0.005","13.49","0.008","14.673","0.009","68.231","0.02","72.82","0.02","83.22","0.02","1940.3","1.9","296.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H42 N Ni O6 S10 -","- C28 H42 N Ni O6 S10 -","- C56 H84 N2 Ni2 O12 S20 -","2","1","","Daisuke Sato; Tomoyuki Akutagawa; Sadamu Takeda; Shin-ichiro Noro; Takayoshi Nakamura","Supramolecular Rotor: Adamantylammonium([18]crown-6) in [Ni(dmit)2]- Salt","Inorganic Chemistry","2007","46","","363","365","10.1021/ic061831u","","","0.71075","MoKα","","","0.0542","","","","0.0648","","","","","","1.195","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307294","15.9792","0.0013","12.0218","0.0011","15.0858","0.0013","90","","116.73","0.002","90","","2588.3","0.4","293","","293","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C22 H34 Br0.64 Cl0.36 Fe N2 O Si2 -","- C22 H34 Br0.64 Cl0.36 Fe N2 O Si2 -","- C88 H136 Br2.56 Cl1.44 Fe4 N8 O4 Si8 -","4","1","","Anjan Kumar Das; Zohreh Moatazedi; Garry Mund; Andrew J. Bennet; Raymond J. Batchelor; Daniel B. Leznoff","Chelating or Bridging? Halide-Controlled Binding Mode of Diamido Donor Ligands in Iron(III) Complexes","Inorganic Chemistry","2007","46","","366","368","10.1021/ic061832m","","","1.5418","CuKα","","0.0949","0.0541","","0.094","0.0648","0.0671","","","","","","0.8786","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307295","11.468","0.003","11.575","0.004","19.84","0.004","74.48","0.03","77.39","0.02","74.71","0.03","2416.6","1.2","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H68 Fe2 N4 O2 Si4 -","- C44 H68 Fe2 N4 O2 Si4 -","- C88 H136 Fe4 N8 O4 Si8 -","2","1","","Anjan Kumar Das; Zohreh Moatazedi; Garry Mund; Andrew J. Bennet; Raymond J. Batchelor; Daniel B. Leznoff","Chelating or Bridging? Halide-Controlled Binding Mode of Diamido Donor Ligands in Iron(III) Complexes","Inorganic Chemistry","2007","46","","366","368","10.1021/ic061832m","","","0.7093","MoKα","","0.131","0.039","","0.0596","0.0354","0.0354","","","","","","1.8195","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307296","16.098","0.002","15.199","0.002","21.481","0.002","90","","90","","90","","5255.8","1.1","293","","293","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C22 H34 Fe I N2 O Si2 -","- C22 H34 Fe I N2 O Si2 -","- C176 H272 Fe8 I8 N16 O8 Si16 -","8","1","","Anjan Kumar Das; Zohreh Moatazedi; Garry Mund; Andrew J. Bennet; Raymond J. Batchelor; Daniel B. Leznoff","Chelating or Bridging? Halide-Controlled Binding Mode of Diamido Donor Ligands in Iron(III) Complexes","Inorganic Chemistry","2007","46","","366","368","10.1021/ic061832m","","","0.7093","MoKα","","0.1723","0.0423","","0.06","0.0476","0.0476","","","","","","1.1633","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307297","15.99","0.007","12.009","0.002","15.105","0.005","90","","117.06","0.03","90","","2583","1.6","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H34 Br Fe N2 O Si2 -","- C22 H34 Br Fe N2 O Si2 -","- C88 H136 Br4 Fe4 N8 O4 Si8 -","4","1","","Anjan Kumar Das; Zohreh Moatazedi; Garry Mund; Andrew J. Bennet; Raymond J. Batchelor; Daniel B. Leznoff","Chelating or Bridging? Halide-Controlled Binding Mode of Diamido Donor Ligands in Iron(III) Complexes","Inorganic Chemistry","2007","46","","366","368","10.1021/ic061832m","","","0.7093","MoKα","","0.2025","0.0482","","0.0517","0.0431","0.0431","","","","","","1.5026","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307298","9.6976","0.0002","15.4428","0.0004","27.4205","0.0006","90","","90","","90","","4106.44","0.16","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C10 H20 Eu2 O20 -","- C10 H12 Eu2 O20 -","- C80 H96 Eu16 O160 -","8","0.25","","Wen-Hua Zhu; Zhe-Ming Wang; Song Gao","Two 3D Porous Lanthanide-Fumarate-Oxalate Frameworks Exhibiting Framework Dynamics and Luminescent Change upon Reversible De- and Rehydration","Inorganic Chemistry","2007","46","","1337","1342","10.1021/ic061833e","","","0.71073","MoKα","","0.0455","0.0275","","","0.0607","0.0641","","","","","","0.974","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307299","9.6648","0.0002","15.4844","0.0003","27.1305","0.0006","90","","90","","90","","4060.18","0.15","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C10 H20 O20 Tb2 -","- C10 H12 O20 Tb2 -","- C80 H96 O160 Tb16 -","8","0.25","","Wen-Hua Zhu; Zhe-Ming Wang; Song Gao","Two 3D Porous Lanthanide-Fumarate-Oxalate Frameworks Exhibiting Framework Dynamics and Luminescent Change upon Reversible De- and Rehydration","Inorganic Chemistry","2007","46","","1337","1342","10.1021/ic061833e","","","0.71073","MoKα","","0.0294","0.0212","","","0.0542","0.0563","","","","","","1.034","","","","has coordinates","179110","2020-10-21","18:00:00",""
"4307300","6.436","0.001","7.9","0.001","8.21","0.002","80.21","0.02","81.8","0.03","73.57","0.02","392.58","0.13","296","2","296","2","","","","","","","","5","P -1","-P 1","2","compound_1","calcium glycinate monohydrate","","- C4 H10 Ca N2 O5 -","- C4 H10 Ca N2 O5 -","- C8 H20 Ca2 N4 O10 -","2","1","","Stefan Fox; Insa Büsching; Walter Barklage; Henry Strasdeit","Coordination of Biologically Important α-Amino Acids to Calcium(II) at High pH: Insights from Crystal Structures of Calcium α-Aminocarboxylates","Inorganic Chemistry","2007","46","","818","824","10.1021/ic061838b","","","0.71073","MoKα","","0.0356","0.0326","","","0.0832","0.0868","","","","","","1.14","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307301","14.143","0.001","6.433","0.001","13.814","0.001","90","","109.15","0.01","90","","1187.3","0.2","213","2","213","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","compound_2","calcium alaninate trihydrate","","- C6 H18 Ca N2 O7 -","- C6 H18 Ca N2 O7 -","- C24 H72 Ca4 N8 O28 -","4","0.5","","Stefan Fox; Insa Büsching; Walter Barklage; Henry Strasdeit","Coordination of Biologically Important α-Amino Acids to Calcium(II) at High pH: Insights from Crystal Structures of Calcium α-Aminocarboxylates","Inorganic Chemistry","2007","46","","818","824","10.1021/ic061838b","","","0.71073","MoKα","","0.0294","0.0289","","","0.0753","0.0756","","","","","","1.096","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307302","24.21","0.002","6.29","0.001","9.841","0.001","90","","98.97","0.01","90","","1480.3","0.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","compound_3","calcium valinate monohydrate","","- C10 H22 Ca N2 O5 -","- C10 H20 Ca N2 O5 -","- C40 H80 Ca4 N8 O20 -","4","0.5","","Stefan Fox; Insa Büsching; Walter Barklage; Henry Strasdeit","Coordination of Biologically Important α-Amino Acids to Calcium(II) at High pH: Insights from Crystal Structures of Calcium α-Aminocarboxylates","Inorganic Chemistry","2007","46","","818","824","10.1021/ic061838b","","","0.71073","MoKα","","0.0494","0.0371","","","0.0988","0.1035","","","","","","1.079","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307303","7.595","0.001","8.433","0.001","15.127","0.003","83.89","0.01","80.81","0.02","77.48","0.01","931.1","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","compound_4","calcium leucinate trihydrate","","- C12 H30 Ca N2 O7 -","- C12 H28 Ca N2 O7 -","- C24 H56 Ca2 N4 O14 -","2","1","","Stefan Fox; Insa Büsching; Walter Barklage; Henry Strasdeit","Coordination of Biologically Important α-Amino Acids to Calcium(II) at High pH: Insights from Crystal Structures of Calcium α-Aminocarboxylates","Inorganic Chemistry","2007","46","","818","824","10.1021/ic061838b","","","0.71073","MoKα","","0.0757","0.0469","","","0.0998","0.111","","","","","","1.048","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307304","9.6731","0.0005","9.8194","0.0005","9.8842","0.0004","99.394","0.003","108.736","0.002","106.614","0.003","817.63","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H50 K2 O28 V -","- C24 H50 K2 O28 V -","- C24 H50 K2 O28 V -","1","0.5","","Bernd Morgenstern; Barbara Kutzky; Christian Neis; Stefan Stucky; Kaspar Hegetschweiler; Eugenio Garribba; Giovanni Micera","Synthesis and Characterization of Vanadium(IV) Complexes with cis-Inositol in Aqueous Solution and in the Solid-State","Inorganic Chemistry","2007","46","","3903","3915","10.1021/ic0618504","","","0.71073","MoKα","","0.0557","0.0383","","","0.0947","0.1024","","","","","","1.039","","","","has coordinates","187017","2020-10-21","18:00:00",""
"4307305","9.548","0.001","9.548","0.001","27.314","0.005","90","","90","","120","","2156.5","0.5","200","2","200","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C12 H30 Na6 O26 S2 V -","- C12 H30 Na6 O26 S2 V -","- C36 H90 Na18 O78 S6 V3 -","3","0.166667","","Bernd Morgenstern; Barbara Kutzky; Christian Neis; Stefan Stucky; Kaspar Hegetschweiler; Eugenio Garribba; Giovanni Micera","Synthesis and Characterization of Vanadium(IV) Complexes with cis-Inositol in Aqueous Solution and in the Solid-State","Inorganic Chemistry","2007","46","","3903","3915","10.1021/ic0618504","","","0.71073","MoKα","","0.0637","0.0557","","","0.1661","0.1723","","","","","","1.166","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307306","10.7054","0.0003","11.0467","0.0006","11.5675","0.0008","62.296","0.005","78.953","0.004","67.855","0.003","1121.58","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C16.78 H32.56 Cl2 Mn N5 O2 -","- C16.778 H32.112 Cl2 Mn N5 O2.001 -","- C33.556 H64.224 Cl4 Mn2 N10 O4.002 -","2","1","","Anne Dees; Achim Zahl; Ralph Puchta; Nico J. R. van Eikema Hommes; Frank W. Heinemann; Ivana Ivanović-Burmazović","Water Exchange on Seven-Coordinate Mn(II) Complexes with Macrocyclic Pentadentate Ligands: Insight in the Mechanism of Mn(II) SOD Mimetics","Inorganic Chemistry","2007","46","","2459","2470","10.1021/ic061852o","","","0.71073","MoKα","","0.0579","0.0353","","","0.0763","0.083","","","","","","1.027","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4307307","16.451","0.003","16.451","0.003","16.451","0.003","90","","90","","90","","4452.2","1.4","293","2","293","2","","","","","","","","7","P 21 3","P 2ac 2ab 3","198","","","","- C19.5 H49 Cl7 Mo3 Ni P6 S4 -","- C19.5 H48 Cl7 Mo3 Ni P6 S4 -","- C78 H192 Cl28 Mo12 Ni4 P24 S16 -","4","0.333333","","Juan Andrés; Marta Feliz; Jordi Fraxedas; Victor Hernández; Juan T. López-Navarrete; Rosa Llusar; Guillaume Sauthier; Fabricio R. Sensato; Bernard Silvi; Carles Bo; Josep M. Campanera","Combined Theoretical and Experimental Analysis of the Bonding in the Heterobimetallic Cubane-Type Mo3NiS4 and Mo3CuS4 Core Clusters","Inorganic Chemistry","2007","46","","2159","2166","10.1021/ic061853g","","","0.71073","MoKα","","0.0512","0.0363","","","0.0898","0.0947","","","","","","1.021","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307308","19.4485","0.0018","25.589","0.002","25.047","0.002","90","","98.153","0.002","90","","12339.1","1.8","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Co2 Mn3 N24 -","- C108 H96 Co2 Mn3 N24 -","- C432 H384 Co8 Mn12 N96 -","4","1","","Mikhail Shatruk; Kristen E. Chambers; Andrey V. Prosvirin; Kim R. Dunbar","Systematic Investigation of Trigonal-Bipyramidal Cyanide-Bridged Clusters of the First-Row Transition Metals","Inorganic Chemistry","2007","46","","5155","5165","10.1021/ic061856t","","","0.71073","MoKα","","0.0962","0.0543","","","0.1167","0.1241","","","","","","1.054","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307309","19.494","0.002","25.075","0.003","24.727","0.003","90","","98.979","0.002","90","","11939","2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C115.25 H96 Co5 N24 O11 -","- C115.25 H96 Co5 N24 O8.75 -","- C461 H384 Co20 N96 O35 -","4","1","","Mikhail Shatruk; Kristen E. Chambers; Andrey V. Prosvirin; Kim R. Dunbar","Systematic Investigation of Trigonal-Bipyramidal Cyanide-Bridged Clusters of the First-Row Transition Metals","Inorganic Chemistry","2007","46","","5155","5165","10.1021/ic061856t","","","0.71073","MoKα","","0.1536","0.0776","","","0.2183","0.2676","","","","","","1.004","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307310","19.225","0.002","25.009","0.003","24.716","0.003","90","","98.031","0.002","90","","11767","2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Co2 N24 Ni3 -","- C108 H96 Co2 N24 Ni3 -","- C432 H384 Co8 N96 Ni12 -","4","1","","Mikhail Shatruk; Kristen E. Chambers; Andrey V. Prosvirin; Kim R. Dunbar","Systematic Investigation of Trigonal-Bipyramidal Cyanide-Bridged Clusters of the First-Row Transition Metals","Inorganic Chemistry","2007","46","","5155","5165","10.1021/ic061856t","","","0.71073","MoKα","","0.1237","0.0678","","","0.1473","0.1596","","","","","","1.07","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307311","19.348","0.005","25.48","0.007","25.186","0.007","90","","97.888","0.004","90","","12299","6","150","2","423","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Co2 N24 Zn3 -","- C108 H96 Co2 N24 Zn3 -","- C432 H384 Co8 N96 Zn12 -","4","1","","Mikhail Shatruk; Kristen E. Chambers; Andrey V. Prosvirin; Kim R. Dunbar","Systematic Investigation of Trigonal-Bipyramidal Cyanide-Bridged Clusters of the First-Row Transition Metals","Inorganic Chemistry","2007","46","","5155","5165","10.1021/ic061856t","","","0.71073","MoKα","","0.2525","0.1065","","","0.2153","0.2437","","","","","","1.014","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307312","19.556","0.007","25.089","0.008","24.66","0.008","90","","97.151","0.007","90","","12005","7","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Cr5 N24 -","- C108 H96 Cr5 N24 -","- C432 H384 Cr20 N96 -","4","1","","Mikhail Shatruk; Kristen E. Chambers; Andrey V. Prosvirin; Kim R. Dunbar","Systematic Investigation of Trigonal-Bipyramidal Cyanide-Bridged Clusters of the First-Row Transition Metals","Inorganic Chemistry","2007","46","","5155","5165","10.1021/ic061856t","","","0.71073","MoKα","","0.1906","0.1221","","","0.2744","0.3","","","","","","0.967","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307313","19.247","0.012","25.349","0.01","24.717","0.013","90","","97.82","0.03","90","","11947","11","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Co3 Cr2 N24 -","- C108 H96 Co3 Cr2 N24 -","- C432 H384 Co12 Cr8 N96 -","4","1","","Mikhail Shatruk; Kristen E. Chambers; Andrey V. Prosvirin; Kim R. Dunbar","Systematic Investigation of Trigonal-Bipyramidal Cyanide-Bridged Clusters of the First-Row Transition Metals","Inorganic Chemistry","2007","46","","5155","5165","10.1021/ic061856t","","","0.71073","MoKα","","0.2299","0.0892","","","0.1765","0.1995","","","","","","1.015","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307314","19.498","0.014","25.12","0.02","24.674","0.019","90","","98.17","0.03","90","","11962","16","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C108 H96 Cr2 N24 Ni3 -","- C108 H96 Cr2 N24 Ni3 -","- C432 H384 Cr8 N96 Ni12 -","4","1","","Mikhail Shatruk; Kristen E. Chambers; Andrey V. Prosvirin; Kim R. Dunbar","Systematic Investigation of Trigonal-Bipyramidal Cyanide-Bridged Clusters of the First-Row Transition Metals","Inorganic Chemistry","2007","46","","5155","5165","10.1021/ic061856t","","","0.71073","MoKα","","0.146","0.0694","","","0.1351","0.1499","","","","","","1.059","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307315","19.57","0.03","25.36","0.04","24.57","0.03","90","","99.11","0.05","90","","12040","3","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C119 H96 Fe2 Mn3 N29.5 O2.5 -","- C119 H96 Fe2 Mn3 N29.5 O2.5 -","- C476 H384 Fe8 Mn12 N118 O10 -","4","1","","Mikhail Shatruk; Kristen E. Chambers; Andrey V. Prosvirin; Kim R. Dunbar","Systematic Investigation of Trigonal-Bipyramidal Cyanide-Bridged Clusters of the First-Row Transition Metals","Inorganic Chemistry","2007","46","","5155","5165","10.1021/ic061856t","","","0.71073","MoKα","","0.2195","0.0993","","","0.252","0.3313","","","","","","0.984","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307316","19.541","0.003","22.6","0.004","18.76","0.003","90","","91.981","0.002","90","","8280","2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C60 H68 Cu5 Ge N12 O41 W8 -","- C60 H48 Cu5 Ge N12 O41 W8 -","- C240 H192 Cu20 Ge4 N48 O164 W32 -","4","1","","Chun-Mei Wang; Shou-Tian Zheng; Guo-Yu Yang","Novel Copper-Complex-Substituted Tungstogermanates","Inorganic Chemistry","2007","46","","616","618","10.1021/ic0618605","","","0.71073","MoKα","","0.0471","0.0382","","","0.0907","0.097","","","","","","1.056","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307317","41.336","0.002","18.493","0.0007","20.0884","0.001","90","","107.931","0.002","90","","14610.2","1.2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C100 H98 Cu10 Ge2 N20 O77 W18 -","- C100 H80 Cu10 Ge2 N20 O77 W18 -","- C400 H320 Cu40 Ge8 N80 O308 W72 -","4","0.5","","Chun-Mei Wang; Shou-Tian Zheng; Guo-Yu Yang","Novel Copper-Complex-Substituted Tungstogermanates","Inorganic Chemistry","2007","46","","616","618","10.1021/ic0618605","","","0.71073","MoKα","","0.0424","0.0374","","","0.0763","0.0785","","","","","","1.171","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307318","10.379","0.003","12.7","0.003","17.441","0.003","89.34","0.002","87.933","0.002","75.752","0.002","2226.8","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H62 B F4 N3 Pt Si -","- C41 H62 B F4 N3 Pt Si -","- C82 H124 B2 F8 N6 Pt2 Si2 -","2","1","","Elena Shikhova; Evgeny O. Danilov; Solen Kinayyigit; Irina E. Pomestchenko; Alexander D. Tregubov; Frank Camerel; Pascal Retailleau; Raymond Ziessel; Felix N. Castellano","Excited-State Absorption Properties of Platinum(II) Terpyridyl Acetylides","Inorganic Chemistry","2007","46","","3038","3048","10.1021/ic0618652","","","0.71073","MoKα","","0.0518","0.0396","","","0.0958","0.1028","","","","","","1.043","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307319","20.1","0.011","22.556","0.013","14.617","0.009","90","","123.276","0.01","90","","5540","6","113","2","113","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C18 H20 Ag F3 N2 O4.5 S3 -","- C17 H17 Ag N2 S2 -","- C136 H136 Ag8 N16 S16 -","8","1","","David B. Cordes; Lyall R. Hanton","Structural Invariance in Silver(I) Coordination Networks Formed Using Flexible Four-Armed Thiopyridine Ligands","Inorganic Chemistry","2007","46","","1634","1644","10.1021/ic061867m","","","0.71073","MoKα","","0.1591","0.0597","","","0.1068","0.112","","","","","","1.08","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307320","12.55","0.005","13.508","0.005","22.083","0.005","90","","90","","90","","3744","2","113","2","113","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C17 H17 Ag Cl N2 O4 S2 -","- C17 H17 Ag Cl N2 O4 S2 -","- C136 H136 Ag8 Cl8 N16 O32 S16 -","8","1","","David B. Cordes; Lyall R. Hanton","Structural Invariance in Silver(I) Coordination Networks Formed Using Flexible Four-Armed Thiopyridine Ligands","Inorganic Chemistry","2007","46","","1634","1644","10.1021/ic061867m","","","0.71069","MoKα","","0.0854","0.0616","","","0.1712","0.1963","","","","","","1.073","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307321","12.708","0.005","13.699","0.005","22.252","0.005","90","","90","","90","","3874","2","118","2","118","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C17 H17 Ag F6 N2 P S2 -","- C17 H17 Ag F6 N2 P S2 -","- C136 H136 Ag8 F48 N16 P8 S16 -","8","1","","David B. Cordes; Lyall R. Hanton","Structural Invariance in Silver(I) Coordination Networks Formed Using Flexible Four-Armed Thiopyridine Ligands","Inorganic Chemistry","2007","46","","1634","1644","10.1021/ic061867m","","","0.71069","MoKα","","0.0902","0.0448","","","0.0817","0.0865","","","","","","0.743","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307322","12.887","0.005","14.284","0.005","21.617","0.005","90","","90","","90","","3979","2","98","2","98","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C19 H17 Ag F3 N2 O2 S2 -","- C19 H17 Ag F3 N2 O2 S2 -","- C152 H136 Ag8 F24 N16 O16 S16 -","8","1","","David B. Cordes; Lyall R. Hanton","Structural Invariance in Silver(I) Coordination Networks Formed Using Flexible Four-Armed Thiopyridine Ligands","Inorganic Chemistry","2007","46","","1634","1644","10.1021/ic061867m","","","0.71069","MoKα","","0.0361","0.0274","","","0.0651","0.0689","","","","","","1.069","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307323","14.085","0.002","16.293","0.002","12.489","0.001","90","","112.425","0.001","90","","2649.3","0.5","163","2","163","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 Ag Cl4 N3 O4 S2 -","- C20 H21 Ag Cl4 N3 O4 S2 -","- C80 H84 Ag4 Cl16 N12 O16 S8 -","4","1","","David B. Cordes; Lyall R. Hanton","Structural Invariance in Silver(I) Coordination Networks Formed Using Flexible Four-Armed Thiopyridine Ligands","Inorganic Chemistry","2007","46","","1634","1644","10.1021/ic061867m","","","0.71073","MoKα","","0.052","0.043","","","0.1212","0.1267","","","","","","1.056","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307324","14.044","0.003","16.321","0.003","13.627","0.003","90","","115.186","0.002","90","","2826.5","1","163","2","163","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 Ag F6 N5 P S2 -","- C23 H26 Ag F6 N5 P S2 -","- C92 H104 Ag4 F24 N20 P4 S8 -","4","1","","David B. Cordes; Lyall R. Hanton","Structural Invariance in Silver(I) Coordination Networks Formed Using Flexible Four-Armed Thiopyridine Ligands","Inorganic Chemistry","2007","46","","1634","1644","10.1021/ic061867m","","","0.71073","MoKα","","0.0428","0.0411","","","0.093","0.0939","","","","","","1.223","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307325","8.4196","0.0009","12.2966","0.0018","9.8194","0.0008","90","","109.048","0.007","90","","961","0.2","296","2","296","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C7 H24 Cd Cl4 Co N5 O3 S -","- C7 H22 Cd Cl4 Co N5 O3 S -","- C14 H44 Cd2 Cl8 Co2 N10 O6 S2 -","2","1","","Takashi Aridomi; Tatsuya Kawamoto; Takumi Konno","Controlled Binding of al-Cysteinato Cobalt(III) Octahedron to a Cadmium(II) Center","Inorganic Chemistry","2007","46","","1343","1353","10.1021/ic061868e","","","0.71069","MoKα","","0.0266","0.0219","","","0.0538","0.0553","","","","","","1.07","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307326","8.5719","0.0015","12.6077","0.0016","10.165","0.002","90","","108.481","0.015","90","","1041.9","0.3","296","2","296","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C7 H24 Br4 Cd Co N5 O3 S -","- C7 H22 Br4 Cd Co N5 O3 S -","- C14 H44 Br8 Cd2 Co2 N10 O6 S2 -","2","1","","Takashi Aridomi; Tatsuya Kawamoto; Takumi Konno","Controlled Binding of al-Cysteinato Cobalt(III) Octahedron to a Cadmium(II) Center","Inorganic Chemistry","2007","46","","1343","1353","10.1021/ic061868e","","","0.71069","MoKα","","0.0625","0.0319","","","0.0687","0.0762","","","","","","1.022","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307327","12.2302","0.0015","12.2302","0.0015","24.401","0.005","90","","90","","90","","3649.8","1","293","2","293","2","","","","","","","","8","P 41 21 2","P 4abw 2nw","92","","","","- C7 H21.5 Br3.5 Cd Co N5 O2 S -","- C7 H21.5 Br3.5 Cd Co N5 O2 S -","- C56 H172 Br28 Cd8 Co8 N40 O16 S8 -","8","1","","Takashi Aridomi; Tatsuya Kawamoto; Takumi Konno","Controlled Binding of al-Cysteinato Cobalt(III) Octahedron to a Cadmium(II) Center","Inorganic Chemistry","2007","46","","1343","1353","10.1021/ic061868e","","","0.71069","MoKα","","0.1227","0.0428","","","0.1016","0.1251","","","","","","1.017","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307328","8.773","0.001","15.0669","0.0018","8.9374","0.0011","90","","102.767","0.009","90","","1152.2","0.2","293","2","293","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C7 H24 Cd Co I4 N5 O3 S -","- C7 H22 Cd Co I4 N5 O3 S -","- C14 H44 Cd2 Co2 I8 N10 O6 S2 -","2","1","","Takashi Aridomi; Tatsuya Kawamoto; Takumi Konno","Controlled Binding of al-Cysteinato Cobalt(III) Octahedron to a Cadmium(II) Center","Inorganic Chemistry","2007","46","","1343","1353","10.1021/ic061868e","","","0.71069","MoKα","","0.035","0.028","","","0.0721","0.0755","","","","","","1.064","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307329","27.0324","0.0014","12.7921","0.0005","23.5524","0.0011","90","","98.243","0.001","90","","8060.3","0.6","153","2","153","2","","","","","","","","9","C 1 2 1","C 2y","5","","","","- C28 H108 Cd4 Cl13 Co4 N20 Na O20 S4 -","- C28 H84 Cd4 Cl13 Co4 N20 Na O20 S4 -","- C112 H336 Cd16 Cl52 Co16 N80 Na4 O80 S16 -","4","1","","Takashi Aridomi; Tatsuya Kawamoto; Takumi Konno","Controlled Binding of al-Cysteinato Cobalt(III) Octahedron to a Cadmium(II) Center","Inorganic Chemistry","2007","46","","1343","1353","10.1021/ic061868e","","","0.7107","MoKα","","0.0774","0.0532","","","0.1389","0.1837","","","","","","1.279","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307330","13.2328","0.0018","13.365","0.002","12.723","0.002","90","","90","","90","","2250.1","0.6","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C10 H25 Cd Co N8 O4 S4 -","- C10 H21 Cd Co N8 O4 S4 -","- C40 H84 Cd4 Co4 N32 O16 S16 -","4","1","","Takashi Aridomi; Tatsuya Kawamoto; Takumi Konno","Controlled Binding of al-Cysteinato Cobalt(III) Octahedron to a Cadmium(II) Center","Inorganic Chemistry","2007","46","","1343","1353","10.1021/ic061868e","","","0.71069","MoKα","","0.1555","0.0461","","","0.0894","0.1119","","","","","","1.003","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307331","11.219","0.007","11.505","0.007","18.994","0.012","88.297","0.01","74.23","0.01","66.601","0.009","2157","2","193","2","193","2","","","","","","","","8","P -1","-P 1","2","","","","- C41 H48 Cl2 Fe2 N2 O3 P2 S2 -","- C41 H48 Cl2 Fe2 N2 O3 P2 S2 -","- C82 H96 Cl4 Fe4 N4 O6 P4 S4 -","2","1","","Aaron K. Justice; Giuseppe Zampella; Luca De Gioia; Thomas B. Rauchfuss; Jarl Ivar van der Vlugt; Scott R. Wilson","Chelate Control of Diiron(I) Dithiolates Relevant to the [Fe-Fe]- Hydrogenase Active Site","Inorganic Chemistry","2007","46","","1655","1664","10.1021/ic0618706","","","0.71073","MoKα","","0.0603","0.0374","","","0.0862","0.0944","","","","","","1.026","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4307332","9.5119","0.0015","12.1329","0.0019","28.71","0.005","79.242","0.003","89.738","0.003","83.877","0.003","3236.1","0.9","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C135 H112 Fe8 O16 P8 S8 -","- C135 H112 Fe8 O16 P8 S8 -","- C135 H112 Fe8 O16 P8 S8 -","1","0.5","","Aaron K. Justice; Giuseppe Zampella; Luca De Gioia; Thomas B. Rauchfuss; Jarl Ivar van der Vlugt; Scott R. Wilson","Chelate Control of Diiron(I) Dithiolates Relevant to the [Fe-Fe]- Hydrogenase Active Site","Inorganic Chemistry","2007","46","","1655","1664","10.1021/ic0618706","","","0.71073","MoKα","","0.1268","0.0513","","","0.0901","0.107","","","","","","0.916","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307333","10.4617","0.001","12.3125","0.001","15.2256","0.0013","76.276","0.005","88.122","0.005","89.143","0.004","1904.1","0.3","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H37 Cl2 Fe2 O3 P3 S2 -","- C35 H37 Cl2 Fe2 O3 P3 S2 -","- C70 H74 Cl4 Fe4 O6 P6 S4 -","2","1","","Aaron K. Justice; Giuseppe Zampella; Luca De Gioia; Thomas B. Rauchfuss; Jarl Ivar van der Vlugt; Scott R. Wilson","Chelate Control of Diiron(I) Dithiolates Relevant to the [Fe-Fe]- Hydrogenase Active Site","Inorganic Chemistry","2007","46","","1655","1664","10.1021/ic0618706","","","0.71073","MoKα","","0.0824","0.0518","","","0.1357","0.1532","","","","","","1.048","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307334","12.587","0.004","34.246","0.009","6.952","0.002","90","","90","","90","","2996.7","1.5","293","2","293","2","","","","","","","","6","P n c a","-P 2a 2n","60","","","","- C8 H4 Br4 Fe0.5 O2 S4 -","- C8 H4 Br4 Fe0.5 O2 S4 -","- C64 H32 Br32 Fe4 O16 S32 -","8","1","","A. Miyazaki; H. Yamazaki; M. Aimatsu; T. Enoki; R. Watanabe; E. Ogura; Y. Kuwatani; M. Iyoda","Crystal Structure and Physical Properties of Conducting Molecular Antiferromagnets with a Halogen-Substituted Donor: (EDO-TTFBr2)2FeX4 (X = Cl, Br)","Inorganic Chemistry","2007","46","","3353","3366","10.1021/ic061871y","","","0.71069","MoKα","","0.276","0.0866","","","0.217","0.2619","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307335","12.587","0.004","34.246","0.009","6.952","0.002","90","","90","","90","","2996.7","1.5","293","2","293","2","","","","","","","","7","P n c a","-P 2a 2n","60","","","","- C8 H4 Br2 Cl2 Fe0.5 O2 S4 -","- C8 H4 Br2 Cl2 Fe0.5 O2 S4 -","- C64 H32 Br16 Cl16 Fe4 O16 S32 -","8","1","","A. Miyazaki; H. Yamazaki; M. Aimatsu; T. Enoki; R. Watanabe; E. Ogura; Y. Kuwatani; M. Iyoda","Crystal Structure and Physical Properties of Conducting Molecular Antiferromagnets with a Halogen-Substituted Donor: (EDO-TTFBr2)2FeX4 (X = Cl, Br)","Inorganic Chemistry","2007","46","","3353","3366","10.1021/ic061871y","","","0.71069","MoKα","","0.1701","0.05","","","0.1332","0.1651","","","","","","0.97","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307336","12.679","0.005","35.217","0.013","6.992","0.003","90","","90","","90","","3122","2","293","2","293","2","","","","","","","","6","P n c a","-P 2a 2n","60","","","","- C8 H4 Br2 Ga0.5 O2 S4 -","- C8 Br4 Ga0.5 O2 S4 -","- C64 Br32 Ga4 O16 S32 -","8","1","","A. Miyazaki; H. Yamazaki; M. Aimatsu; T. Enoki; R. Watanabe; E. Ogura; Y. Kuwatani; M. Iyoda","Crystal Structure and Physical Properties of Conducting Molecular Antiferromagnets with a Halogen-Substituted Donor: (EDO-TTFBr2)2FeX4 (X = Cl, Br)","Inorganic Chemistry","2007","46","","3353","3366","10.1021/ic061871y","","","0.71069","MoKα","","0.1656","0.1596","","","0.3991","0.4","","","","","","2.879","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307337","12.587","0.004","34.246","0.009","6.952","0.002","90","","90","","90","","2996.7","1.5","293","2","293","2","","","","","","","","7","P n c a","-P 2a 2n","60","","","","- C8 H4 Br2 Cl2 Ga0.5 O2 S4 -","- C8 H4 Br2 Cl2 Ga0.5 O2 S4 -","- C64 H32 Br16 Cl16 Ga4 O16 S32 -","8","1","","A. Miyazaki; H. Yamazaki; M. Aimatsu; T. Enoki; R. Watanabe; E. Ogura; Y. Kuwatani; M. Iyoda","Crystal Structure and Physical Properties of Conducting Molecular Antiferromagnets with a Halogen-Substituted Donor: (EDO-TTFBr2)2FeX4 (X = Cl, Br)","Inorganic Chemistry","2007","46","","3353","3366","10.1021/ic061871y","","","0.71069","MoKα","","0.2174","0.0588","","","0.1516","0.2055","","","","","","1.095","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307338","17.0132","0.0005","21.5449","0.0006","16.204","0.0005","90","","90","","90","","5939.5","0.3","100","2","100","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C32 H28 Fe N O S4 -","- C32 H28 Fe N O S4 -","- C256 H224 Fe8 N8 O8 S32 -","8","1","","Prasanta Ghosh; Keira Stobie; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Michael D. Ward; Jon A. McCleverty; Karl Wieghardt","Electronic Structure of Nitric Oxide Adducts of Bis(diaryl-1,2-dithiolene)iron Compounds: Four-Membered Electron-Transfer Series [Fe(NO)(L)2]z (z= 1+, 0, 1-, 2-)","Inorganic Chemistry","2007","46","","522","532","10.1021/ic061874a","","","0.71073","MoKα","","0.0858","0.0666","","","0.1236","0.1303","","","","","","1.202","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307339","18.7178","0.0004","23.4237","0.0006","21.2816","0.0006","90","","95.555","0.006","90","","9286.9","0.4","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C52.75 H37.5 Cl1.5 Fe N O S4 -","- C52.75 H37.5 Cl1.5 Fe N O S4 -","- C422 H300 Cl12 Fe8 N8 O8 S32 -","8","1","","Prasanta Ghosh; Keira Stobie; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Michael D. Ward; Jon A. McCleverty; Karl Wieghardt","Electronic Structure of Nitric Oxide Adducts of Bis(diaryl-1,2-dithiolene)iron Compounds: Four-Membered Electron-Transfer Series [Fe(NO)(L)2]z (z= 1+, 0, 1-, 2-)","Inorganic Chemistry","2007","46","","522","532","10.1021/ic061874a","","","0.71073","MoKα","","0.0542","0.0504","","","0.1374","0.1403","","","","","","1.052","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307340","8.7605","0.0003","14.7549","0.0005","15.04","0.0006","90","","91.709","0.004","90","","1943.21","0.12","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C42 H38 Co Fe N O S4 -","- C42 H38 Co Fe N O S4 -","- C84 H76 Co2 Fe2 N2 O2 S8 -","2","1","","Prasanta Ghosh; Keira Stobie; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Michael D. Ward; Jon A. McCleverty; Karl Wieghardt","Electronic Structure of Nitric Oxide Adducts of Bis(diaryl-1,2-dithiolene)iron Compounds: Four-Membered Electron-Transfer Series [Fe(NO)(L)2]z (z= 1+, 0, 1-, 2-)","Inorganic Chemistry","2007","46","","522","532","10.1021/ic061874a","","","0.71073","MoKα","","0.0299","0.0274","","","0.0631","0.0644","","","","","","1.044","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307341","18.2005","0.0002","8.38085","0.00008","3.6573","0.00004","90","","94.167","0.003","90","","556.394","0.01","300","","300","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","acetonitriledichloroiron(II)","","- C2 H3 Cl2 Fe N -","- C2 H3 Cl2 Fe N -","- C8 H12 Cl8 Fe4 N4 -","4","1","","Konstantin I. Pokhodnya; Michael Bonner; Antonio G. DiPasquale; Arnold L. Rheingold; Jae-Hyuk Her; Peter W. Stephens; Jong-Won Park; Bretni S. Kennon; Atta M. Arif; Joel S. Miller","Structural and Magnetic Properties of MCl2 (M = Fe, Mn, Co): Acetonitrile Solvates","Inorganic Chemistry","2007","46","","2471","2477","10.1021/ic061877n","powder diffraction","","0.6908","synchrotron","","","","","","","","","0.015","1.715","","","","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307342","8.0558","0.0003","13.3799","0.0004","3.7029","0.0001","90","","90","","90","","399.12","0.02","150","1","150","1","","","","","","","","5","P b a m","-P 2 2ab","55","","acetonitriledichloroiron(II)","","- C4 H6 Cl2 Fe N2 -","- C4 H6 Cl2 Fe N2 -","- C8 H12 Cl4 Fe2 N4 -","2","0.25","","Konstantin I. Pokhodnya; Michael Bonner; Antonio G. DiPasquale; Arnold L. Rheingold; Jae-Hyuk Her; Peter W. Stephens; Jong-Won Park; Bretni S. Kennon; Atta M. Arif; Joel S. Miller","Structural and Magnetic Properties of MCl2 (M = Fe, Mn, Co): Acetonitrile Solvates","Inorganic Chemistry","2007","46","","2471","2477","10.1021/ic061877n","","","0.71069","MoKα","","0.0179","0.0167","","","0.0415","0.0423","","","","","","1.125","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307343","8.125","0.003","13.368","0.005","3.743","0.0015","90","","90","","90","","406.5","0.3","100","2","100","2","","","","","","","","5","P b a m","-P 2 2ab","55","","acetonitriledichloroiron(II)","","- C4 H6 Cl2 Mn N2 -","- C4 H6 Cl2 Mn N2 -","- C8 H12 Cl4 Mn2 N4 -","2","0.25","","Konstantin I. Pokhodnya; Michael Bonner; Antonio G. DiPasquale; Arnold L. Rheingold; Jae-Hyuk Her; Peter W. Stephens; Jong-Won Park; Bretni S. Kennon; Atta M. Arif; Joel S. Miller","Structural and Magnetic Properties of MCl2 (M = Fe, Mn, Co): Acetonitrile Solvates","Inorganic Chemistry","2007","46","","2471","2477","10.1021/ic061877n","","","0.71073","MoKα","","0.0239","0.0228","","","0.0592","0.0598","","","","","","1.167","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307344","7.2674","0.0005","13.274","0.0009","8.2674","0.0005","90","","90.018","0.001","90","","797.54","0.09","100","2","100","2","","","","","","","","5","P 1 n 1","P -2yac","7","","acetonitriledichloroiron(II)","","- C10 H23 Cl3 Co N2 -","- C10 H23 Cl3 Co N2 -","- C20 H46 Cl6 Co2 N4 -","2","1","","Konstantin I. Pokhodnya; Michael Bonner; Antonio G. DiPasquale; Arnold L. Rheingold; Jae-Hyuk Her; Peter W. Stephens; Jong-Won Park; Bretni S. Kennon; Atta M. Arif; Joel S. Miller","Structural and Magnetic Properties of MCl2 (M = Fe, Mn, Co): Acetonitrile Solvates","Inorganic Chemistry","2007","46","","2471","2477","10.1021/ic061877n","","","0.71073","MoKα","","0.0473","0.0443","","","0.1145","0.1179","","","","","","1.015","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307345","10.185","0.002","22.944","0.006","10.047","0.002","90","","91.516","0.018","90","","2347","0.9","168","2","168","2","","","","","","","","5","C 1 c 1","C -2yc","9","(3) Ti(OPy)2(ONep)2","","","- C22 H34 N2 O4 Ti -","- C22 H34 N2 O4 Ti -","- C88 H136 N8 O16 Ti4 -","4","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.0901","0.0478","","","0.099","0.1166","","","","","","1.013","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307346","11.268","0.002","14.82","0.003","12.104","0.002","90","","92.635","0.004","90","","2019.1","0.6","168","2","168","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(4) Ti(OPy)2(OPri)2","","","- C18 H26 N2 O4 Ti -","- C18 H26 N2 O4 Ti -","- C72 H104 N8 O16 Ti4 -","4","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.0789","0.0592","","","0.1327","0.1411","","","","","","1.091","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307347","15.122","0.004","17.851","0.005","16.628","0.004","90","","101.728","0.005","90","","4395","2","168","2","168","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(5) Ti(Opy)2(Obut)2","","","- C20 H30 N2 O4 Ti -","- C20 H30 N2 O4 Ti -","- C160 H240 N16 O32 Ti8 -","8","2","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.1605","0.0888","","","0.2042","0.2465","","","","","","1.01","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307348","9.0231","0.0016","12.405","0.002","18.676","0.003","90","","99.375","0.003","90","","2062.5","0.6","152","2","152","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(6a) (OPy)2Ti(OPri)(OPrMe)","","","- C19 H28 N2 O4 Ti -","- C19 H28 N2 O4 Ti -","- C76 H112 N8 O16 Ti4 -","4","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.1151","0.085","","","0.2033","0.2242","","","","","","1.057","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307349","14.9826","0.001","17.7669","0.0012","15.9923","0.0011","90","","111.492","0.001","90","","3961.1","0.5","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(7) Ti(OPy)2(DPE)2","","","- C47 H46 N2 O4 Ti -","- C47 H46 N2 O4 Ti -","- C188 H184 N8 O16 Ti4 -","4","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.0559","0.0434","","","0.1086","0.1169","","","","","","1.037","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307350","12.663","0.008","13.221","0.008","14.489","0.012","63.106","0.011","82.596","0.019","89.942","0.013","2141","3","203","2","203","2","","","","","","","","5","P -1","-P 1","2","8","","","- C44 H50 N2 O4 Ti -","- C44 H50 N2 O4 Ti -","- C88 H100 N4 O8 Ti2 -","2","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.2014","0.0885","","","0.177","0.2142","","","","","","0.911","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307351","12.144","0.0017","14.409","0.002","16.027","0.002","90","","97.499","0.002","90","","2780.5","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(10) Ti(OPy)2(oPP)2","","","- C30 H34 N2 O4 Ti -","- C30 H34 N2 O4 Ti -","- C120 H136 N8 O16 Ti4 -","4","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.0989","0.066","","","0.1416","0.1568","","","","","","1.075","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307352","10.3667","0.0016","13.955","0.002","14.328","0.002","69.324","0.003","85.345","0.003","68.971","0.003","1807.7","0.5","167","2","167","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H38 N2 O4 Ti -","- C32 H38 N2 O4 Ti -","- C64 H76 N4 O8 Ti2 -","2","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.0571","0.0439","","","0.1042","0.1102","","","","","","0.985","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307353","26.126","0.004","11.7662","0.0016","19.326","0.003","90","","121.224","0.002","90","","5080.3","1.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","(12) Ti(OPy)2(DMP)2","","","- C28 H30 N2 O4 Ti -","- C28 H30 N2 O4 Ti -","- C224 H240 N16 O32 Ti8 -","8","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.0394","0.0348","","","0.0897","0.0931","","","","","","1.042","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307354","13.142","0.004","15.747","0.004","17.206","0.005","90","","110.007","0.004","90","","3345.8","1.6","157","2","157","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(13) Ti(OPy)2(DIP)2","","","- C36 H46 N2 O4 Ti -","- C36 H46 N2 O4 Ti -","- C144 H184 N8 O16 Ti4 -","4","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.0384","0.0346","","","0.0895","0.0926","","","","","","1.034","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307355","17.035","0.004","12.937","0.003","19.793","0.004","90","","98.875","0.004","90","","4309.8","1.7","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(15) Ti(OPy)2(DPP)2","","","- C53 H46 N4 O4 Ti -","- C55 H46 N2 O4 Ti -","- C220 H184 N8 O16 Ti4 -","4","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.071","0.0476","","","0.1004","0.1104","","","","","","1.05","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307356","8.995","0.018","11.89","0.02","12.11","0.02","95.62","0.03","90.64","0.03","102.69","0.03","1257","4","297","2","297","2","","","","","","","","6","P -1","-P 1","2","(16) Ti(OPy)2(2BP)2","","","- C24 H20 Br2 N2 O4 Ti -","- C24 H20 Br2 N2 O4 Ti -","- C48 H40 Br4 N4 O8 Ti2 -","2","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.1966","0.0787","","","0.1728","0.2603","","","","","","0.886","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307357","14.5686","0.0011","8.4738","0.0006","26.0177","0.0019","90","","95.68","0.001","90","","3196.2","0.4","203","2","203","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","17 (OPy)2Ti(TCP)2","","","- C24 H16 Cl6 N2 O4 Ti -","- C24 H16 Cl6 N2 O4 Ti -","- C96 H64 Cl24 N8 O16 Ti4 -","4","0.5","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.0495","0.0424","","","0.0994","0.1029","","","","","","1.117","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307358","8.406","0.0013","10.4494","0.0016","14.278","0.002","104.405","0.003","90.34","0.003","99.668","0.003","1196","0.3","203","2","203","2","","","","","","","","6","P 1","P 1","1","18 Ti(OPy)2(4-MP)2","","","- C24 H22 N2 O4 S2 Ti -","- C24 H22 N2 O4 S2 Ti -","- C48 H44 N4 O8 S4 Ti2 -","2","2","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.0821","0.0766","","","0.1442","0.1492","","","","","","1.064","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307359","12.5716","0.0018","12.8307","0.0019","16.406","0.002","90","","90","","90","","2646.3","0.6","273","2","273","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","(19) Ti(OPy)2(4AP)2","","","- C29 H29 N5 O4 Ti -","- C29 H29 N5 O4 Ti -","- C116 H116 N20 O16 Ti4 -","4","0.5","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.1244","0.075","","","0.1207","0.1374","","","","","","1.107","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307360","13.045","0.003","12.353","0.002","18.017","0.004","90","","94.391","0.004","90","","2894.8","1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(20) Ti(OPy)2(DAP)2","","","- C29 H31 N7 O4 Ti -","- C29 H31 N7 O4 Ti -","- C116 H124 N28 O16 Ti4 -","4","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.1371","0.0728","","","0.1338","0.1598","","","","","","1.043","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307361","9.931","0.0015","14.414","0.002","21.413","0.003","90.701","0.003","92.43","0.003","101.664","0.003","2998.5","0.7","203","2","203","2","","","","","","","","6","P -1","-P 1","2","(22) Ti(OPy)2(DMBS)2","","","- C24 H42 N2 O4 Si2 Ti -","- C24 H42 N2 O4 Si2 Ti -","- C96 H168 N8 O16 Si8 Ti4 -","4","2","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.1519","0.0863","","","0.1955","0.2367","","","","","","1.038","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307362","13.5219","0.0015","15.4673","0.0017","20.153","0.002","90","","100.152","0.002","90","","4149","0.8","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(23) OPy2Ti(TPS)2","","","- C48 H42 N2 O4 Si2 Ti -","- C48 H42 N2 O4 Si2 Ti -","- C192 H168 N8 O16 Si8 Ti4 -","4","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.0694","0.0491","","","0.1074","0.1173","","","","","","1.053","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307363","9.198","0.006","14.46","0.009","18.529","0.012","108.046","0.009","97.543","0.009","103.088","0.01","2228","2","203","2","203","2","","","","","","","","6","P -1","-P 1","2","(24) Ti(OPy)2(TOBS)2","","","- C36 H66 N2 O10 Si2 Ti -","- C36 H66 N2 O10 Si2 Ti -","- C72 H132 N4 O20 Si4 Ti2 -","2","1","","Timothy J. Boyle; Robin M. Sewell; Leigh Anna M. Ottley; Harry D. Pratt; Christopher J. Quintana; Scott D. Bunge","Controlled Synthesis of a Structurally Characterized Family of Sterically Constrained Heterocyclic Alkoxy-Modified Titanium Alkoxides","Inorganic Chemistry","2007","46","","1825","1835","10.1021/ic0618798","","","0.71073","MoKα","","0.1023","0.0965","","","0.2633","0.2655","","","","","","1.16","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307364","17.6105","0.0004","15.5432","0.0005","29.3316","0.0009","90","","91.475","0.003","90","","8026.1","0.4","120","2","120","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C54 H124 I Mo6 N5 O26 -","- C54 H124 I Mo6 N5 O26 -","- C216 H496 I4 Mo24 N20 O104 -","4","1","","Daisuke Honda; Shusaku Ikegami; Tomoaki Inoue; Tomoji Ozeki; Atsushi Yagasaki","Protonation and Methylation of an Anderson-Type Polyoxoanion [IMo6O24]5-","Inorganic Chemistry","2007","46","","1464","1470","10.1021/ic061881z","","","0.71073","MoKα","","0.0937","0.0588","","","0.1708","0.1842","","","","","","1.004","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307365","33.6101","0.0003","15.2575","0.0001","24.0294","0.0002","90","","126.957","0.0003","90","","9846.7","0.14","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C80 H180 I Mo6 N5 O24 -","- C80 H180 I Mo6 N5 O24 -","- C320 H720 I4 Mo24 N20 O96 -","4","0.5","","Daisuke Honda; Shusaku Ikegami; Tomoaki Inoue; Tomoji Ozeki; Atsushi Yagasaki","Protonation and Methylation of an Anderson-Type Polyoxoanion [IMo6O24]5-","Inorganic Chemistry","2007","46","","1464","1470","10.1021/ic061881z","","","0.71073","MoKα","","0.0234","0.0189","","","0.049","0.0502","","","","","","1.072","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307366","9.5587","0.0001","24.1364","0.0002","18.2788","0.0002","90","","90.156","0.001","90","","4217.13","0.07","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C64 H145 I Mo6 N4 O24 -","- C64 H144 I Mo6 N4 O24 -","- C128 H288 I2 Mo12 N8 O48 -","2","0.5","","Daisuke Honda; Shusaku Ikegami; Tomoaki Inoue; Tomoji Ozeki; Atsushi Yagasaki","Protonation and Methylation of an Anderson-Type Polyoxoanion [IMo6O24]5-","Inorganic Chemistry","2007","46","","1464","1470","10.1021/ic061881z","","","0.71073","MoKα","","0.0426","0.0346","","","0.0904","0.0936","","","","","","0.993","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307367","10.4009","0.0001","14.6658","0.0003","23.5395","0.0004","90","","100.324","0.001","90","","3532.52","0.1","83","2","83","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H114 I Mo6 N3 O24 -","- C50 H114 I Mo6 N3 O24 -","- C100 H228 I2 Mo12 N6 O48 -","2","0.5","","Daisuke Honda; Shusaku Ikegami; Tomoaki Inoue; Tomoji Ozeki; Atsushi Yagasaki","Protonation and Methylation of an Anderson-Type Polyoxoanion [IMo6O24]5-","Inorganic Chemistry","2007","46","","1464","1470","10.1021/ic061881z","","","0.71073","MoKα","","0.0393","0.0343","","","0.0761","0.0791","","","","","","1.199","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307368","17.0679","0.0004","25.6998","0.0006","20.7428","0.0004","90","","90","","90","","9098.7","0.3","120","2","120","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C65 H153 I Mo6 N4 O27 -","- C65 H144 I Mo6 N4 O27 -","- C260 H576 I4 Mo24 N16 O108 -","4","0.5","","Daisuke Honda; Shusaku Ikegami; Tomoaki Inoue; Tomoji Ozeki; Atsushi Yagasaki","Protonation and Methylation of an Anderson-Type Polyoxoanion [IMo6O24]5-","Inorganic Chemistry","2007","46","","1464","1470","10.1021/ic061881z","","","0.71073","MoKα","","0.0683","0.041","","","0.1074","0.1278","","","","","","1.016","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307369","22.696","0.006","10.693","0.003","14.954","0.004","90","","100.844","0.005","90","","3564.4","1.7","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H32 N2 O Pt S8 -","- C26 H32 N2 O Pt S8 -","- C104 H128 N8 O4 Pt4 S32 -","4","1","","Yong Ji; Rui Zhang; Yu-Jia Li; Yi-Zhi Li; Jing-Lin Zuo; Xiao-Zeng You","Syntheses, Structures, and Electrochemical Properties of Platinum(II) Complexes Containing Di-tert-butylbipyridine and Crown Ether Annelated Dithiolate Ligands","Inorganic Chemistry","2007","46","","866","873","10.1021/ic061882r","","","0.71073","MoKα","","0.0832","0.0574","","","0.1279","0.1338","","","","","","1.103","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307370","40.239","0.011","13.491","0.004","8.126","0.002","90","","99.236","0.007","90","","4354","2","298","2","298","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C64 H86 N4 O9 Pt2 S16 -","- C64 H86 N4 O9 Pt2 S16 -","- C128 H172 N8 O18 Pt4 S32 -","2","0.25","","Yong Ji; Rui Zhang; Yu-Jia Li; Yi-Zhi Li; Jing-Lin Zuo; Xiao-Zeng You","Syntheses, Structures, and Electrochemical Properties of Platinum(II) Complexes Containing Di-tert-butylbipyridine and Crown Ether Annelated Dithiolate Ligands","Inorganic Chemistry","2007","46","","866","873","10.1021/ic061882r","","","0.71073","MoKα","","0.0727","0.0494","","","0.0855","0.0898","","","","","","1.084","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307371","24.79","0.04","11.45","0.02","14.39","0.03","90","","95.57","0.04","90","","4065","13","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H44 N2 O4 Pt S8 -","- C34 H44 N2 O4 Pt S8 -","- C136 H176 N8 O16 Pt4 S32 -","4","1","","Yong Ji; Rui Zhang; Yu-Jia Li; Yi-Zhi Li; Jing-Lin Zuo; Xiao-Zeng You","Syntheses, Structures, and Electrochemical Properties of Platinum(II) Complexes Containing Di-tert-butylbipyridine and Crown Ether Annelated Dithiolate Ligands","Inorganic Chemistry","2007","46","","866","873","10.1021/ic061882r","","","0.71073","MoKα","","0.0818","0.0545","","","0.1216","0.1297","","","","","","1.012","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307372","9.6569","0.0019","10.571","0.002","16.174","0.003","95.221","0.004","97.852","0.004","116.704","0.004","1439.3","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H28 N2 O4 S8 -","- C22 H28 N2 O4 S8 -","- C44 H56 N4 O8 S16 -","2","1","","Yong Ji; Rui Zhang; Yu-Jia Li; Yi-Zhi Li; Jing-Lin Zuo; Xiao-Zeng You","Syntheses, Structures, and Electrochemical Properties of Platinum(II) Complexes Containing Di-tert-butylbipyridine and Crown Ether Annelated Dithiolate Ligands","Inorganic Chemistry","2007","46","","866","873","10.1021/ic061882r","","","0.71073","MoKα","","0.0992","0.0654","","","0.1331","0.1432","","","","","","1.015","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307373","21.358","0.002","18.497","0.001","22.614","0.002","90","","90","","90","","8933.9","1.2","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","Bis(acetonitrile)di(μ~2~-iodo)(μ~2~-bis(bis(o- methoxyphenyl)phosphino)phenylamine)dicopper(I) acetonitrile solvate","","- C40 H42 Cu2 I2 N4 O8 P2 -","- C40 H42 Cu2 I2 N4 O8 P2 -","- C320 H336 Cu16 I16 N32 O64 P16 -","8","1","","Chelladurai Ganesamoorthy; Maravanji S. Balakrishna; Paulose P. George; Joel T. Mague","Di- and Tetranuclear Copper(I) Complexes Containing Phenylaminobis(phosphonite), PhN{P(OC6H4OMe-o)2}2, and Their Reactivity toward Bipyridyl Ligands","Inorganic Chemistry","2007","46","","848","858","10.1021/ic061883j","","","0.71073","MoKα","","0.0433","0.0345","","","0.0755","0.0793","","","","","","1.046","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307374","10.8096","0.0007","11.2597","0.0008","16.097","0.001","90.985","0.001","93.765","0.001","90.897","0.001","1954.4","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","bis((μ~3~-chloro)(μ~2~-chloro)(μ~2~-bis(bis(o- methoxyphenyl)phosphino)phenylamine)dicopper(I) tetrahydrofuran solvate","","- C38 H41 Cl2 Cu2 N O9 P2 -","- C38 H41 Cl2 Cu2 N O9 P2 -","- C76 H82 Cl4 Cu4 N2 O18 P4 -","2","1","","Chelladurai Ganesamoorthy; Maravanji S. Balakrishna; Paulose P. George; Joel T. Mague","Di- and Tetranuclear Copper(I) Complexes Containing Phenylaminobis(phosphonite), PhN{P(OC6H4OMe-o)2}2, and Their Reactivity toward Bipyridyl Ligands","Inorganic Chemistry","2007","46","","848","858","10.1021/ic061883j","","","0.71073","MoKα","","0.0354","0.0308","","","0.078","0.0807","","","","","","1.039","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307375","11.6883","0.0008","13.4616","0.0009","15.865","0.001","75.309","0.001","89.169","0.001","69.062","0.001","2247.2","0.3","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","Bis((μ~3~-bromo)(μ~2~-bromo)(μ~2~-bis(bis(o- methoxyphenyl)phosphino)phenylamine)dicopper(I)) deuterochloroform solvate","","- C35.5 H34.5 Br2 Cl4.5 Cu2 N O8 P2 -","- C35.5 H34 Br2 Cl4.5 Cu2 N O8 P2 -","- C71 H68 Br4 Cl9 Cu4 N2 O16 P4 -","2","1","","Chelladurai Ganesamoorthy; Maravanji S. Balakrishna; Paulose P. George; Joel T. Mague","Di- and Tetranuclear Copper(I) Complexes Containing Phenylaminobis(phosphonite), PhN{P(OC6H4OMe-o)2}2, and Their Reactivity toward Bipyridyl Ligands","Inorganic Chemistry","2007","46","","848","858","10.1021/ic061883j","","","0.71073","MoKα","","0.07","0.0553","","","0.1633","0.1744","","","","","","1.049","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307376","16.612","0.001","16.612","0.001","20.53","0.002","90","","90","","90","","5665.4","0.7","100","2","100","2","","","","","","","","7","P 41 21 2","P 4abw 2nw","92","","μ-Diiodo-μ-(bis(bis(o-methoxyphenoxy)phosphino)phenylamine) bis(pyridine)dicopper(I) Water solvate","","- C44 H47 Cu2 I2 N3 O10 P2 -","- C44 H43 Cu2 I2 N3 O10 P2 -","- C176 H172 Cu8 I8 N12 O40 P8 -","4","0.5","","Chelladurai Ganesamoorthy; Maravanji S. Balakrishna; Paulose P. George; Joel T. Mague","Di- and Tetranuclear Copper(I) Complexes Containing Phenylaminobis(phosphonite), PhN{P(OC6H4OMe-o)2}2, and Their Reactivity toward Bipyridyl Ligands","Inorganic Chemistry","2007","46","","848","858","10.1021/ic061883j","","","0.71073","MoKα","","0.0484","0.0466","","","0.1438","0.1454","","","","","","1.164","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307377","13.177","0.001","21.533","0.002","17.116","0.002","90","","98.129","0.001","90","","4807.7","0.8","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Iodo-μ-~2~-iodo(μ~2~-(bis(o-methoxyphenyl)phosphino) phenylamine)(κ,κ':N,N'-2,2'bipyridine)dicopper(I)","","- C46 H44 Cu2 I2 N4 O8 P2 -","- C46 H44 Cu2 I2 N4 O8 P2 -","- C184 H176 Cu8 I8 N16 O32 P8 -","4","1","","Chelladurai Ganesamoorthy; Maravanji S. Balakrishna; Paulose P. George; Joel T. Mague","Di- and Tetranuclear Copper(I) Complexes Containing Phenylaminobis(phosphonite), PhN{P(OC6H4OMe-o)2}2, and Their Reactivity toward Bipyridyl Ligands","Inorganic Chemistry","2007","46","","848","858","10.1021/ic061883j","","","0.71073","MoKα","","0.0509","0.0413","","","0.0902","0.0943","","","","","","1.036","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307378","21.648","0.002","23.023","0.002","28.375","0.002","90","","90","","90","","14142","2","100","2","100","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","μ-Iodo-μ-(bis(bis(o-methoxyphenoxy)phosphino)phenylamine) -1κP:2κP'-bis(2,2'-bipyridyl)-1κ^2^N,N'; 2κ^2^N,N'- dicopper Iodide Chloroform Solvate","","- C58 H53 Cl12 Cu2 I2 N5 O8 P2 -","- C58 H53 Cl12 Cu2 I2 N5 O8 P2 -","- C464 H424 Cl96 Cu16 I16 N40 O64 P16 -","8","1","","Chelladurai Ganesamoorthy; Maravanji S. Balakrishna; Paulose P. George; Joel T. Mague","Di- and Tetranuclear Copper(I) Complexes Containing Phenylaminobis(phosphonite), PhN{P(OC6H4OMe-o)2}2, and Their Reactivity toward Bipyridyl Ligands","Inorganic Chemistry","2007","46","","848","858","10.1021/ic061883j","","","0.71073","MoKα","","0.0844","0.0643","","","0.157","0.1702","","","","","","1.076","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307379","11.7794","0.0008","18.399","0.001","22.135","0.002","90","","90","","90","","4797.3","0.6","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","Bromo-1κ-μ-bromo-μ(bis(bis-o-methoxyphenoxy)phosphino) phenylamine-1κP:2κP')(2,2'-bipyridyl-2κ^2^N,N') dicopper(I) Chloroform solvate","","- C45 H42 Br2 Cl3 Cu2 N3 O8 P2 -","- C45 H42 Br2 Cl3 Cu2 N3 O8 P2 -","- C180 H168 Br8 Cl12 Cu8 N12 O32 P8 -","4","1","","Chelladurai Ganesamoorthy; Maravanji S. Balakrishna; Paulose P. George; Joel T. Mague","Di- and Tetranuclear Copper(I) Complexes Containing Phenylaminobis(phosphonite), PhN{P(OC6H4OMe-o)2}2, and Their Reactivity toward Bipyridyl Ligands","Inorganic Chemistry","2007","46","","848","858","10.1021/ic061883j","","","0.71073","MoKα","","0.0486","0.0391","","","0.09","0.0945","","","","","","1.036","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307380","11.7184","0.0008","22.114","0.001","20.745","0.001","90","","94.063","0.001","90","","5362.4","0.5","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","catena-poly[[(1,2-di-μ-bromo)(μ-bis(bis(2-methoxy- phenoxy)phosphino)phenylamine-1κP,2κP')dicopper(I)]- 1:2-μ-4,4'-bipyridyl]","","- C52 H53 Br2 Cu2 N7 O8 P2 -","- C52 H53 Br2 Cu2 N7 O8 P2 -","- C208 H212 Br8 Cu8 N28 O32 P8 -","4","1","","Chelladurai Ganesamoorthy; Maravanji S. Balakrishna; Paulose P. George; Joel T. Mague","Di- and Tetranuclear Copper(I) Complexes Containing Phenylaminobis(phosphonite), PhN{P(OC6H4OMe-o)2}2, and Their Reactivity toward Bipyridyl Ligands","Inorganic Chemistry","2007","46","","848","858","10.1021/ic061883j","","","0.71073","MoKα","","0.0438","0.0304","","","0.0688","0.0739","","","","","","1.036","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307381","6.5007","0.0002","9.3467","0.0004","18.9815","0.0006","90","","98.563","0.002","90","","1140.46","0.07","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H36 Cl2 N8 Pt -","- C16 H36 Cl2 N8 Pt -","- C32 H72 Cl4 N16 Pt2 -","2","0.5","","Pavel V. Gushchin; Nadezhda A. Bokach; Konstantin V. Luzyanin; Alexey A. Nazarov; Matti Haukka; Vadim Yu. Kukushkin","PtII-Mediated Nitrile-Tetramethylguanidine Coupling as a Key Step for a Novel Synthesis of 1,6-Dihydro-1,3,5-triazines","Inorganic Chemistry","2007","46","","1684","1693","10.1021/ic061884b","","","0.71073","MoKα","","0.0306","0.0201","","","0.0403","0.0435","","","","","","1.062","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307382","10.4573","0.0008","11.2403","0.0012","12.2694","0.0008","90","","112.07","0.007","90","","1336.5","0.2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H36 Cl2 N8 Pt -","- C24 H36 Cl2 N8 Pt -","- C48 H72 Cl4 N16 Pt2 -","2","0.5","","Pavel V. Gushchin; Nadezhda A. Bokach; Konstantin V. Luzyanin; Alexey A. Nazarov; Matti Haukka; Vadim Yu. Kukushkin","PtII-Mediated Nitrile-Tetramethylguanidine Coupling as a Key Step for a Novel Synthesis of 1,6-Dihydro-1,3,5-triazines","Inorganic Chemistry","2007","46","","1684","1693","10.1021/ic061884b","","","0.71073","MoKα","","0.0454","0.0253","","","0.0515","0.0571","","","","","","1.033","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307383","10.1658","0.0008","11.2026","0.0008","15.1162","0.001","75.797","0.005","85.33","0.007","65.379","0.006","1516.7","0.2","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H77 Cl7 N16 O2 Pt2 -","- C49 H77 Cl7 N16 O2 Pt2 -","- C49 H77 Cl7 N16 O2 Pt2 -","1","0.5","","Pavel V. Gushchin; Nadezhda A. Bokach; Konstantin V. Luzyanin; Alexey A. Nazarov; Matti Haukka; Vadim Yu. Kukushkin","PtII-Mediated Nitrile-Tetramethylguanidine Coupling as a Key Step for a Novel Synthesis of 1,6-Dihydro-1,3,5-triazines","Inorganic Chemistry","2007","46","","1684","1693","10.1021/ic061884b","","","0.71073","MoKα","","0.065","0.0334","","","0.0688","0.0789","","","","","","1.014","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307384","17.583","0.0008","12.507","0.0007","12.385","0.0004","90","","113.346","0.002","90","","2500.6","0.2","105","2","105","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H33 Cl5 N8 Pt -","- C15 H33 Cl5 N8 Pt -","- C60 H132 Cl20 N32 Pt4 -","4","0.5","","Pavel V. Gushchin; Nadezhda A. Bokach; Konstantin V. Luzyanin; Alexey A. Nazarov; Matti Haukka; Vadim Yu. Kukushkin","PtII-Mediated Nitrile-Tetramethylguanidine Coupling as a Key Step for a Novel Synthesis of 1,6-Dihydro-1,3,5-triazines","Inorganic Chemistry","2007","46","","1684","1693","10.1021/ic061884b","","","0.71073","MoKα","","0.0481","0.0293","","","0.0521","0.0582","","","","","","1.096","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307385","19.0947","0.0011","12.4624","0.0008","12.5981","0.0006","90","","107.268","0.004","90","","2862.8","0.3","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H37 Cl5 N8 Pt -","- C17 H37 Cl5 N8 Pt -","- C68 H148 Cl20 N32 Pt4 -","4","0.5","","Pavel V. Gushchin; Nadezhda A. Bokach; Konstantin V. Luzyanin; Alexey A. Nazarov; Matti Haukka; Vadim Yu. Kukushkin","PtII-Mediated Nitrile-Tetramethylguanidine Coupling as a Key Step for a Novel Synthesis of 1,6-Dihydro-1,3,5-triazines","Inorganic Chemistry","2007","46","","1684","1693","10.1021/ic061884b","","","0.71073","MoKα","","0.0422","0.0303","","","0.058","0.061","","","","","","1.057","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307386","10.2649","0.0004","15.1605","0.0007","12.3997","0.0004","90","","104.013","0.003","90","","1872.23","0.13","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H25 N5 -","- C21 H25 N5 -","- C84 H100 N20 -","4","1","","Pavel V. Gushchin; Nadezhda A. Bokach; Konstantin V. Luzyanin; Alexey A. Nazarov; Matti Haukka; Vadim Yu. Kukushkin","PtII-Mediated Nitrile-Tetramethylguanidine Coupling as a Key Step for a Novel Synthesis of 1,6-Dihydro-1,3,5-triazines","Inorganic Chemistry","2007","46","","1684","1693","10.1021/ic061884b","","","0.71073","MoKα","","0.0758","0.0453","","","0.1036","0.1166","","","","","","1.031","","","","has coordinates,has disorder","201982","2020-10-21","18:00:00",""
"4307387","6.0506","0.0001","16.3902","0.0004","21.2859","0.0005","90","","93.688","0.001","90","","2106.56","0.08","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H25 N5 -","- C25 H25 N5 -","- C100 H100 N20 -","4","1","","Pavel V. Gushchin; Nadezhda A. Bokach; Konstantin V. Luzyanin; Alexey A. Nazarov; Matti Haukka; Vadim Yu. Kukushkin","PtII-Mediated Nitrile-Tetramethylguanidine Coupling as a Key Step for a Novel Synthesis of 1,6-Dihydro-1,3,5-triazines","Inorganic Chemistry","2007","46","","1684","1693","10.1021/ic061884b","","","0.71073","MoKα","","0.0738","0.0439","","","0.1007","0.1143","","","","","","1.047","","","","has coordinates,has disorder","201982","2020-10-21","18:00:00",""
"4307388","6.969","0.0002","13.108","0.0004","9.2807","0.0003","90","","104.757","0.002","90","","819.82","0.04","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H14 Cl N3 -","- C5 H14 Cl N3 -","- C20 H56 Cl4 N12 -","4","1","","Pavel V. Gushchin; Nadezhda A. Bokach; Konstantin V. Luzyanin; Alexey A. Nazarov; Matti Haukka; Vadim Yu. Kukushkin","PtII-Mediated Nitrile-Tetramethylguanidine Coupling as a Key Step for a Novel Synthesis of 1,6-Dihydro-1,3,5-triazines","Inorganic Chemistry","2007","46","","1684","1693","10.1021/ic061884b","","","0.71073","MoKα","","0.0375","0.0286","","","0.0697","0.0733","","","","","","1.057","","","","has coordinates,has disorder","201982","2020-10-21","18:00:00",""
"4307389","10.9609","0.0003","14.4602","0.0004","14.578","0.0004","85.006","0.002","78.845","0.002","83.0191","0.0012","2245.31","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H16 Cl2 Fe N O4 -","- C8 H16 Cl2 Fe N O4 -","- C48 H96 Cl12 Fe6 N6 O24 -","6","3","","Hong-Bin Xu; Zhe-Ming Wang; Tao Liu; Song Gao","Synthesis, Structure, and Magnetic Properties of (A)[FeIII(oxalate)Cl2] (A = Alkyl Ammonium Cations) with Anionic 1D [FeIII(oxalate)Cl2]- Chains","Inorganic Chemistry","2007","46","","3089","3096","10.1021/ic0618854","","","0.71073","MoKα","","0.1862","0.0672","","","0.2125","0.2611","","","","","","0.885","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307390","13.5878","0.0003","37.972","0.001","10.821","0.0002","90","","90","","90","","5583.2","0.2","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C8 H16 Cl2 Fe N O4 -","- C8 H16 Cl2 Fe N O4 -","- C128 H256 Cl32 Fe16 N16 O64 -","16","1","","Hong-Bin Xu; Zhe-Ming Wang; Tao Liu; Song Gao","Synthesis, Structure, and Magnetic Properties of (A)[FeIII(oxalate)Cl2] (A = Alkyl Ammonium Cations) with Anionic 1D [FeIII(oxalate)Cl2]- Chains","Inorganic Chemistry","2007","46","","3089","3096","10.1021/ic0618854","","","0.71073","MoKα","","0.082","0.0403","","","0.089","0.0979","","","","","","0.986","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307391","7.9441","0.0003","8.6093","0.0003","17.8251","0.0007","90","","91.869","0.002","90","","1218.47","0.08","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H12 Cl2 Fe N O4 -","- C6 H12 Cl2 Fe N O4 -","- C24 H48 Cl8 Fe4 N4 O16 -","4","1","","Hong-Bin Xu; Zhe-Ming Wang; Tao Liu; Song Gao","Synthesis, Structure, and Magnetic Properties of (A)[FeIII(oxalate)Cl2] (A = Alkyl Ammonium Cations) with Anionic 1D [FeIII(oxalate)Cl2]- Chains","Inorganic Chemistry","2007","46","","3089","3096","10.1021/ic0618854","","","0.71073","MoKα","","0.0881","0.034","","","0.0689","0.0789","","","","","","0.902","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307392","8.8836","0.0004","15.1939","0.0008","17.9685","0.0012","90","","91.556","0.002","90","","2424.4","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H36 Cl2 Fe N O4 -","- C18 H36 Cl2 Fe N O4 -","- C72 H144 Cl8 Fe4 N4 O16 -","4","1","","Hong-Bin Xu; Zhe-Ming Wang; Tao Liu; Song Gao","Synthesis, Structure, and Magnetic Properties of (A)[FeIII(oxalate)Cl2] (A = Alkyl Ammonium Cations) with Anionic 1D [FeIII(oxalate)Cl2]- Chains","Inorganic Chemistry","2007","46","","3089","3096","10.1021/ic0618854","","","0.71073","MoKα","","0.2739","0.0613","","","0.1024","0.1437","","","","","","0.811","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307393","14.636","0.0005","23.7333","0.0003","17.3278","0.0005","90","","97.851","0.001","90","","5962.6","0.3","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C49 H58 Cl12 Cu P3 S Si -","- C49 H58 Cl12 Cu P3 S Si -","- C196 H232 Cl48 Cu4 P12 S4 Si4 -","4","1","","Aneta Borecki; John F. Corrigan","New Copper and Silver Trimethylsilylchalcogenolates","Inorganic Chemistry","2007","46","","2478","2484","10.1021/ic0618910","","","0.71073","MoKα","","0.098","0.0619","","","0.1544","0.1797","","","","","","1.014","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307394","12.2407","0.0002","16.8474","0.0004","20.9558","0.0006","90","","104.764","0.001","90","","4178.91","0.17","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C37 H64 Cu O P3 Se Si -","- C37 H64 Cu O P3 Se Si -","- C148 H256 Cu4 O4 P12 Se4 Si4 -","4","1","","Aneta Borecki; John F. Corrigan","New Copper and Silver Trimethylsilylchalcogenolates","Inorganic Chemistry","2007","46","","2478","2484","10.1021/ic0618910","","","0.71073","MoKα","","0.1118","0.0584","","","0.1359","0.1582","","","","","","0.976","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307395","13.2461","0.0003","13.5048","0.0003","17.459","0.0005","90","","90","","90","","3123.17","0.13","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C30 H46 Cu P3 Se -","- C30 H46 Cu P3 Se -","- C120 H184 Cu4 P12 Se4 -","4","1","","Aneta Borecki; John F. Corrigan","New Copper and Silver Trimethylsilylchalcogenolates","Inorganic Chemistry","2007","46","","2478","2484","10.1021/ic0618910","","","0.71073","MoKα","","0.0748","0.0431","","","0.0836","0.0933","","","","","","1.063","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307396","13.8231","0.0004","16.1207","0.0007","16.8049","0.0006","90.908","0.002","96.312","0.002","114.197","0.002","3387.4","0.2","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C132 H162 Ag3 Cu9 O5 P8 S6 -","- C132 H162 Ag3 Cu9 O5 P8 S6 -","- C132 H162 Ag3 Cu9 O5 P8 S6 -","1","0.5","","Aneta Borecki; John F. Corrigan","New Copper and Silver Trimethylsilylchalcogenolates","Inorganic Chemistry","2007","46","","2478","2484","10.1021/ic0618910","","","0.71073","MoKα","","0.1096","0.0637","","","0.1653","0.1911","","","","","","1.024","","","","has coordinates,has disorder","179111","2020-10-21","18:00:00",""
"4307397","10.286","0.002","11.324","0.003","13.701","0.003","94.593","0.004","107.18","0.004","116.76","0.003","1318.2","0.5","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H16 Mn2 N16 -","- C24 H16 Mn2 N16 -","- C48 H32 Mn4 N32 -","2","1","","Fu-Chen Liu; Yong-Fei Zeng; Jiong-Peng Zhao; Bo-Wen Hu; Xian-He Bu; Joan Ribas; Joan Cano","An Unusual 1D Manganese Azido Complex with Novel EO/EO/EO/EE Coordination Mode: Synthesis, Structure, and Magnetic Properties","Inorganic Chemistry","2007","46","","1520","1522","10.1021/ic061892s","","","0.71073","MoKα","","0.0885","0.0506","","","0.1263","0.1476","","","","","","1.016","","","","has coordinates","179111","2020-10-21","18:00:00",""
"4307398","15.4387","0.0018","5.8627","0.0007","10.1603","0.0012","90","","101.818","0.002","90","","900.14","0.18","294","2","294","2","","","","","","","see text","4","C 1 2/c 1","-C 2yc","15","","","","- H13 N3 O8 S2 -","- H13 N3 O8 S2 -","- H52 N12 O32 S8 -","4","0.5","","Diptikanta Swain; Tayur N. Guru Row","Analysis of Phase Transition Pathways in X3H(SO4)2 (X = Rb, NH4, K, Na): Variable Temperature Single-Crystal X-ray Diffraction Studies#","Inorganic Chemistry","2007","46","","4411","4421","10.1021/ic061901x","","","0.71073","MoKα","","0.0356","0.034","","","0.1027","0.1041","","","","","","1.206","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307399","5.9061","0.0004","5.9061","0.0004","22.608","0.003","90","","90","","120","","682.96","0.11","420","2","420","2","","","","","","","see text","4","R -3 m :H","-R 3 2""","166","","","","- H13 N3 O8 S2 -","- H13.04 N3 O8 S2 -","- H39.12 N9 O24 S6 -","3","0.0833333","","Diptikanta Swain; Tayur N. Guru Row","Analysis of Phase Transition Pathways in X3H(SO4)2 (X = Rb, NH4, K, Na): Variable Temperature Single-Crystal X-ray Diffraction Studies#","Inorganic Chemistry","2007","46","","4411","4421","10.1021/ic061901x","","","0.71073","MoKα","","0.0605","0.0581","","","0.1656","0.1681","","","","","","1.202","","","","has coordinates","200438","2020-10-21","18:00:00",""
"4307400","14.5676","0.0017","5.6506","0.0007","9.7094","0.0011","90","","103.011","0.002","90","","778.72","0.16","100","2","100","2","","","","","","","see text","4","C 1 2/c 1","-C 2yc","15","","","","- H K3 O8 S2 -","- H K3 O8 S2 -","- H4 K12 O32 S8 -","4","0.5","","Diptikanta Swain; Tayur N. Guru Row","Analysis of Phase Transition Pathways in X3H(SO4)2 (X = Rb, NH4, K, Na): Variable Temperature Single-Crystal X-ray Diffraction Studies#","Inorganic Chemistry","2007","46","","4411","4421","10.1021/ic061901x","","","0.71073","MoKα","","0.0256","0.0251","","","0.0641","0.0643","","","","","","1.184","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307401","14.7033","0.0016","5.6841","0.0006","9.7756","0.0011","90","","102.981","0.002","90","","796.12","0.15","294","2","294","2","","","","","","","see text","4","C 1 2/c 1","-C 2yc","15","","","","- H K3 O8 S2 -","- H K3 O8 S2 -","- H4 K12 O32 S8 -","4","0.5","","Diptikanta Swain; Tayur N. Guru Row","Analysis of Phase Transition Pathways in X3H(SO4)2 (X = Rb, NH4, K, Na): Variable Temperature Single-Crystal X-ray Diffraction Studies#","Inorganic Chemistry","2007","46","","4411","4421","10.1021/ic061901x","","","0.71073","MoKα","","0.0262","0.0251","","","0.0633","0.0639","","","","","","1.212","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307402","8.6362","0.0008","9.6156","0.0009","9.0702","0.0008","90","","108.746","0.001","90","","713.25","0.11","100","2","100","2","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","","","","- H Na3 O8 S2 -","- H Na3 O8 S2 -","- H4 Na12 O32 S8 -","4","1","","Diptikanta Swain; Tayur N. Guru Row","Analysis of Phase Transition Pathways in X3H(SO4)2 (X = Rb, NH4, K, Na): Variable Temperature Single-Crystal X-ray Diffraction Studies#","Inorganic Chemistry","2007","46","","4411","4421","10.1021/ic061901x","","x-ray","0.71073","MoKα","","0.0228","0.0222","","","0.0662","0.0667","","","","","","1.157","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307403","8.6436","0.0014","9.6408","0.0015","9.1386","0.0014","90","","108.792","0.002","90","","720.9","0.2","294","2","294","2","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","","","","- H Na3 O8 S2 -","- H Na3 O8 S2 -","- H4 Na12 O32 S8 -","4","1","","Diptikanta Swain; Tayur N. Guru Row","Analysis of Phase Transition Pathways in X3H(SO4)2 (X = Rb, NH4, K, Na): Variable Temperature Single-Crystal X-ray Diffraction Studies#","Inorganic Chemistry","2007","46","","4411","4421","10.1021/ic061901x","","x-ray","0.71073","MoKα","","0.0246","0.024","","","0.0728","0.0732","","","","","","1.176","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307404","8.667","0.0017","9.668","0.0019","9.2333","0.0019","90","","108.763","0.003","90","","732.6","0.3","500","2","500","2","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","","","","- H Na3 O8 S2 -","- H Na3 O8 S2 -","- H4 Na12 O32 S8 -","4","1","","Diptikanta Swain; Tayur N. Guru Row","Analysis of Phase Transition Pathways in X3H(SO4)2 (X = Rb, NH4, K, Na): Variable Temperature Single-Crystal X-ray Diffraction Studies#","Inorganic Chemistry","2007","46","","4411","4421","10.1021/ic061901x","","x-ray","0.71073","MoKα","","0.0286","0.0271","","","0.0835","0.0846","","","","","","1.077","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307405","15.041","0.008","5.857","0.003","10.095","0.005","90","","102.502","0.009","90","","868.2","0.8","100","2","100","2","","","","","","","see text","4","C 1 2/c 1","-C 2yc","15","","Trirubidium Hydrogen bisulfate","","- H O8 Rb3 S2 -","- H O8 Rb3 S2 -","- H4 O32 Rb12 S8 -","4","0.5","","Diptikanta Swain; Tayur N. Guru Row","Analysis of Phase Transition Pathways in X3H(SO4)2 (X = Rb, NH4, K, Na): Variable Temperature Single-Crystal X-ray Diffraction Studies#","Inorganic Chemistry","2007","46","","4411","4421","10.1021/ic061901x","","x-ray","0.71073","MoKα","","0.0279","0.0251","","","0.0695","0.0704","","","","","","1.347","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307406","15.146","0.005","5.8914","0.0019","10.159","0.003","90","","102.54","0.006","90","","884.9","0.5","294","2","294","2","","","","","","","see text","4","C 1 2/c 1","-C 2yc","15","","","","- H O8 Rb3 S2 -","- H O8 Rb3 S2 -","- H4 O32 Rb12 S8 -","4","0.5","","Diptikanta Swain; Tayur N. Guru Row","Analysis of Phase Transition Pathways in X3H(SO4)2 (X = Rb, NH4, K, Na): Variable Temperature Single-Crystal X-ray Diffraction Studies#","Inorganic Chemistry","2007","46","","4411","4421","10.1021/ic061901x","","x-ray","0.71073","MoKα","","0.0293","0.0273","","","0.0685","0.0694","","","","","","1.225","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307407","20.149","0.005","11.78","0.005","8.162","0.005","90","","112.838","0.005","90","","1785.4","1.4","350","2","100","2","","","","","","","see text","4","C 1 2/m 1","-C 2y","12","","","","- H O8 Rb3 S2 -","- H O8 Rb3 S2 -","- H8 O64 Rb24 S16 -","8","1","","Diptikanta Swain; Tayur N. Guru Row","Analysis of Phase Transition Pathways in X3H(SO4)2 (X = Rb, NH4, K, Na): Variable Temperature Single-Crystal X-ray Diffraction Studies#","Inorganic Chemistry","2007","46","","4411","4421","10.1021/ic061901x","","x-ray","0.71073","MoKα","","0.1203","0.0818","","","0.2862","0.3008","","","","","","1.224","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307408","20.48","0.01","11.815","0.006","16.387","0.008","90","","114.577","0.007","90","","3606","3","425","2","425","2","","","","","","","see text","4","C 1 2/c 1","-C 2yc","15","","Trirubidium Hydrogen bisulfate","","- H O8 Rb3 S2 -","- O8 Rb3 S2 -","- O128 Rb48 S32 -","16","2","","Diptikanta Swain; Tayur N. Guru Row","Analysis of Phase Transition Pathways in X3H(SO4)2 (X = Rb, NH4, K, Na): Variable Temperature Single-Crystal X-ray Diffraction Studies#","Inorganic Chemistry","2007","46","","4411","4421","10.1021/ic061901x","","x-ray","0.71073","MoKα","","0.1807","0.1169","","","0.4349","0.4728","","","","","","1.321","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307409","16.5906","0.0006","9.3692","0.0003","17.1718","0.0005","90","","110.166","0.002","90","","2505.57","0.14","123","2","123","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H32 Cl2 Fe N4 O9 Zn -","- C19 H32 Cl2 Fe N4 O9 Zn -","- C76 H128 Cl8 Fe4 N16 O36 Zn4 -","4","1","","Gilles Gasser; Matthew J. Belousoff; Alan M. Bond; Zuzanna Kosowski; Leone Spiccia","Recognition of Thymine and Related Nucleosides by a ZnII-Cyclen Complex Bearing a Ferrocenyl Pendant","Inorganic Chemistry","2007","46","","1665","1674","10.1021/ic061902p","","","0.71073","MoKα","","0.0607","0.0468","","","0.0906","0.0957","","","","","","1.116","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307410","11.3576","0.0007","9.2364","0.0005","24.7717","0.0014","90","","90","","90","","2598.6","0.3","123","2","123","2","","","","","","","","7","P n m a","-P 2ac 2n","62","C3","C3","","- C42 H68 Cl4 Fe2 N14 O8 Zn2 -","- C42 H66 Cl4 Fe2 N10.024 O8 Zn2 -","- C84 H132 Cl8 Fe4 N20.048 O16 Zn4 -","2","0.25","","Gilles Gasser; Matthew J. Belousoff; Alan M. Bond; Zuzanna Kosowski; Leone Spiccia","Recognition of Thymine and Related Nucleosides by a ZnII-Cyclen Complex Bearing a Ferrocenyl Pendant","Inorganic Chemistry","2007","46","","1665","1674","10.1021/ic061902p","","","0.71073","MoKα","","0.0963","0.0801","","","0.1917","0.1996","","","","","","1.216","","","","has coordinates,has disorder","179112","2020-10-21","18:00:00",""
"4307411","11.691","0.002","14.152","0.003","35.978","0.007","90","","90.08","0.03","90","","5953","2","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","C4","C4","","- C24 H34 Cl Fe N6 O8 Zn -","- C24 H34 Cl Fe N6 O8 Zn -","- C192 H272 Cl8 Fe8 N48 O64 Zn8 -","8","2","","Gilles Gasser; Matthew J. Belousoff; Alan M. Bond; Zuzanna Kosowski; Leone Spiccia","Recognition of Thymine and Related Nucleosides by a ZnII-Cyclen Complex Bearing a Ferrocenyl Pendant","Inorganic Chemistry","2007","46","","1665","1674","10.1021/ic061902p","","","0.71073","MoKα","","0.1298","0.0821","","","0.2008","0.218","","","","","","1.097","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307412","20.253","0.002","12.093","0.0013","35.505","0.004","90","","91.396","0.002","90","","8693.3","1.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H44 Br8 Fe3 N4 O6 -","- C20 H44 Br8 Fe3 N4 O6 -","- C160 H352 Br64 Fe24 N32 O48 -","8","1","","Fabio Marchetti; Fabio Marchetti; Bernardo Melai; Guido Pampaloni; Stefano Zacchini","Synthesis and Reactivity of Haloacetato Derivatives of Iron(II) Including the Crystal and the Molecular Structure of [Fe(CF3COOH)2(μ-CF3COO)2]n","Inorganic Chemistry","2007","46","","3378","3384","10.1021/ic061903h","","","0.71073","MoKα","","0.2111","0.0988","","","0.2675","0.351","","","","","","1.029","","","","has coordinates,has disorder","179112","2020-10-21","18:00:00",""
"4307413","18.3606","0.0005","18.3606","0.0005","26.0896","0.0009","90","","90","","120","","7616.8","0.4","293","2","293","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","Tris(N,N-tetrahydrofurane)(μ~3~-oxo) hexakis(μ~2~-trichloroacetate)diiron(iii)iron(ii)","","- C24 H24 Cl18 Fe3 O16 -","- C24 H24 Cl18 Fe3 O16 -","- C144 H144 Cl108 Fe18 O96 -","6","0.166667","","Fabio Marchetti; Fabio Marchetti; Bernardo Melai; Guido Pampaloni; Stefano Zacchini","Synthesis and Reactivity of Haloacetato Derivatives of Iron(II) Including the Crystal and the Molecular Structure of [Fe(CF3COOH)2(μ-CF3COO)2]n","Inorganic Chemistry","2007","46","","3378","3384","10.1021/ic061903h","","","0.71073","MoKα","","0.1186","0.0614","","","0.1825","0.2343","","","","","","1.013","","","","has coordinates,has disorder","179112","2020-10-21","18:00:00",""
"4307414","18.1844","0.0018","18.1844","0.0018","22.747","0.002","90","","90","","120","","6514.1","1.1","293","2","293","2","","","","","","","","6","R 3 2 :H","R 3 2""","155","","Tris(N,N-dimethylformamide)(μ~3~-oxo) hexakis(μ~2~-trifluoroacetate)diiron(iii)iron(ii)","","- C21 H21 F18 Fe3 N3 O16 -","- C21 H21 F18 Fe3 N3 O16 -","- C126 H126 F108 Fe18 N18 O96 -","6","0.333333","","Fabio Marchetti; Fabio Marchetti; Bernardo Melai; Guido Pampaloni; Stefano Zacchini","Synthesis and Reactivity of Haloacetato Derivatives of Iron(II) Including the Crystal and the Molecular Structure of [Fe(CF3COOH)2(μ-CF3COO)2]n","Inorganic Chemistry","2007","46","","3378","3384","10.1021/ic061903h","","","0.71073","MoKα","","0.0975","0.0757","","","0.2065","0.2325","","","","","","1.041","","","","has coordinates,has disorder","179112","2020-10-21","18:00:00",""
"4307415","16.09","0.001","16.09","0.001","48.867","0.004","90","","90","","90","","12651.1","1.5","293","2","293","2","","","","","","","","6","I -4 2 d","I -4 2bw","122","","Tetrakis(N,N-dimethylformamide)bis(μ~3~-oxo) hexakis(μ~2~-trifluoroacetate)bis(O-acetate)tetrairon(iii)","","- C28 H28 F24 Fe4 N4 O22 -","- C28 H28 F24 Fe4 N4 O22 -","- C224 H224 F192 Fe32 N32 O176 -","8","0.5","","Fabio Marchetti; Fabio Marchetti; Bernardo Melai; Guido Pampaloni; Stefano Zacchini","Synthesis and Reactivity of Haloacetato Derivatives of Iron(II) Including the Crystal and the Molecular Structure of [Fe(CF3COOH)2(μ-CF3COO)2]n","Inorganic Chemistry","2007","46","","3378","3384","10.1021/ic061903h","","","0.71073","MoKα","","0.0668","0.0617","","","0.158","0.1644","","","","","","1.067","","","","has coordinates,has disorder","179112","2020-10-21","18:00:00",""
"4307417","8.5335","0.0017","9.829","0.002","11.004","0.002","114.74","0.03","98.09","0.03","90.31","0.03","827.8","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H2 F12 Fe O8 -","- C8 H2 F12 Fe O8 -","- C16 H4 F24 Fe2 O16 -","2","1","","Fabio Marchetti; Fabio Marchetti; Bernardo Melai; Guido Pampaloni; Stefano Zacchini","Synthesis and Reactivity of Haloacetato Derivatives of Iron(II) Including the Crystal and the Molecular Structure of [Fe(CF3COOH)2(μ-CF3COO)2]n","Inorganic Chemistry","2007","46","","3378","3384","10.1021/ic061903h","","","0.71073","MoKα","","0.1511","0.1123","","","0.2997","0.3236","","","","","","1.051","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307418","9.548","0.005","9.548","0.005","6.077","0.005","90","","90","","120","","479.8","0.5","153","2","153","2","","","","","","","","5","P 3 1 m","P 3 -2","157","","","","- C15 H12 Co2 N6 O8 -","- C15 H9 Co2 N6 O8 -","- C15 H9 Co2 N6 O8 -","1","0.166667","","Antonio Rodríguez-Diéguez; Joan Cano; Raikko Kivekäs; Abderrahmane Debdoubi; Enrique Colacio","Self-Assembled Cationic Heterochiral Honeycomb-Layered Metal Complexes with the in Situ Generated Pyrimidine-2-carboxylato Bisdidentate Ligand. Hydrothermal Synthesis, Crystal Structures, Magnetic Properties, and Theoretical Study of [M2(μ-pymca)3]OH.H2O (M = FeII, CoII)","Inorganic Chemistry","2007","46","","2503","2510","10.1021/ic061908e","","","0.71073","MoKα","","0.0825","0.0704","","","0.1878","0.2005","","","","","","1.144","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307419","9.6956","0.0008","9.6956","0.0008","6.053","0.001","90","","90","","120","","492.78","0.1","100","2","100","2","","","","","","","","5","P 3 1 m","P 3 -2","157","","","","- C15 H12 Fe2 N6 O8 -","- C15 H9 Fe2 N6 O8 -","- C15 H9 Fe2 N6 O8 -","1","0.166667","","Antonio Rodríguez-Diéguez; Joan Cano; Raikko Kivekäs; Abderrahmane Debdoubi; Enrique Colacio","Self-Assembled Cationic Heterochiral Honeycomb-Layered Metal Complexes with the in Situ Generated Pyrimidine-2-carboxylato Bisdidentate Ligand. Hydrothermal Synthesis, Crystal Structures, Magnetic Properties, and Theoretical Study of [M2(μ-pymca)3]OH.H2O (M = FeII, CoII)","Inorganic Chemistry","2007","46","","2503","2510","10.1021/ic061908e","","","0.71073","MoKα","","0.0793","0.0744","","","0.2052","0.2114","","","","","","1.194","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307420","15.961","0.004","13.884","0.004","27.976","0.006","90","","90","","90","","6200","3","120","2","120","2","","","","","","","","6","C m c m","-C 2c 2","63","","","","- C32 H65 Cl4 Cu7 N36 O24 -","- C32 H37 Cl4 Cu7 N36 O24 -","- C128 H148 Cl16 Cu28 N144 O96 -","4","0.25","","Sacramento Ferrer; Elena Aznar; Francesc Lloret; Alfonso Castiñeiras; Malva Liu-González; Joaquín Borrás","One-Dimensional Metal-Organic Framework with Unprecedented Heptanuclear Copper Units","Inorganic Chemistry","2007","46","","372","374","10.1021/ic0619106","","","1.54184","CuKα","","0.0556","0.055","","","0.1709","0.1714","","","","","","1.022","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307421","13.5338","0.0003","7.7333","0.0002","21.7974","0.0006","90","","90","","90","","2281.34","0.1","150","2","150","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C19 H21 Au Cl5 N3 -","- C20 H21 Au Cl5 N3 -","- C80 H84 Au4 Cl20 N12 -","4","0.5","","Lingyun Cao; Michael C. Jennings; Richard J. Puddephatt","Amine-Amide Equilibrium in Gold(III) Complexes and a Gold(III)-Gold(I) Aurophilic Bond","Inorganic Chemistry","2007","46","","1361","1368","10.1021/ic061911y","","","0.71073","MoKα","","0.0583","0.0421","","","0.0909","0.0962","","","","","","1.076","","","","has coordinates,has disorder","179112","2020-10-21","18:00:00",""
"4307422","7.1396","0.0004","12.0281","0.0009","14.1127","0.001","69.675","0.004","85.958","0.003","82.756","0.003","1126.95","0.14","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H23 Au Cl3 N3 -","- C20 H23 Au Cl3 N3 -","- C40 H46 Au2 Cl6 N6 -","2","1","","Lingyun Cao; Michael C. Jennings; Richard J. Puddephatt","Amine-Amide Equilibrium in Gold(III) Complexes and a Gold(III)-Gold(I) Aurophilic Bond","Inorganic Chemistry","2007","46","","1361","1368","10.1021/ic061911y","","","0.71073","MoKα","","0.1001","0.0434","","","0.0823","0.0986","","","","","","0.995","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307423","5.0844","0.0004","11.8297","0.0007","12.0383","0.0011","93.929","0.005","98.807","0.003","94.546","0.004","710.88","0.1","299","2","299","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H16 Cl2 N2 -","- C13 H16 Cl2 N2 -","- C26 H32 Cl4 N4 -","2","1","","Lingyun Cao; Michael C. Jennings; Richard J. Puddephatt","Amine-Amide Equilibrium in Gold(III) Complexes and a Gold(III)-Gold(I) Aurophilic Bond","Inorganic Chemistry","2007","46","","1361","1368","10.1021/ic061911y","","","0.71073","MoKα","","0.1165","0.0621","","","0.1682","0.1942","","","","","","1.054","","","","has coordinates,has disorder","179112","2020-10-21","18:00:00",""
"4307424","14.3491","0.0008","7.6628","0.0003","14.2562","0.0008","90","","112.434","0.002","90","","1448.9","0.13","150","2","150","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C12 H12 Au B Cl F4 N3 -","- C12 H12 Au B Cl F4 N3 -","- C48 H48 Au4 B4 Cl4 F16 N12 -","4","1","","Lingyun Cao; Michael C. Jennings; Richard J. Puddephatt","Amine-Amide Equilibrium in Gold(III) Complexes and a Gold(III)-Gold(I) Aurophilic Bond","Inorganic Chemistry","2007","46","","1361","1368","10.1021/ic061911y","","","0.71073","MoKα","","0.056","0.0348","","","0.0822","0.0903","","","","","","0.983","","","","has coordinates,has disorder","179112","2020-10-21","18:00:00",""
"4307425","7.1133","0.0008","9.2737","0.0013","13.218","0.002","108.123","0.005","97.509","0.007","102.762","0.007","789.3","0.19","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C12 H12 Au Cl F6 N3 P -","- C12 H12 Au Cl F6 N3 P -","- C24 H24 Au2 Cl2 F12 N6 P2 -","2","1","","Lingyun Cao; Michael C. Jennings; Richard J. Puddephatt","Amine-Amide Equilibrium in Gold(III) Complexes and a Gold(III)-Gold(I) Aurophilic Bond","Inorganic Chemistry","2007","46","","1361","1368","10.1021/ic061911y","","","0.71073","MoKα","","0.0816","0.0515","","","0.1047","0.1143","","","","","","1.044","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307426","7.4839","0.0003","19.8209","0.0007","10.7631","0.0004","90","","95.441","0.002","90","","1589.38","0.1","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 Au2 Cl3 N3 -","- C12 H12 Au2 Cl3 N3 -","- C48 H48 Au8 Cl12 N12 -","4","1","","Lingyun Cao; Michael C. Jennings; Richard J. Puddephatt","Amine-Amide Equilibrium in Gold(III) Complexes and a Gold(III)-Gold(I) Aurophilic Bond","Inorganic Chemistry","2007","46","","1361","1368","10.1021/ic061911y","","","0.71073","MoKα","","0.0631","0.0385","","","0.0875","0.0964","","","","","","0.964","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307427","8.4086","0.0004","13.809","0.0007","22.1926","0.001","90","","97.336","0.003","90","","2555.8","0.2","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C17 H19 Au Cl F6 N3 O7 S2 -","- C17 H19 Au Cl F6 N3 O7 S2 -","- C68 H76 Au4 Cl4 F24 N12 O28 S8 -","4","1","","Lingyun Cao; Michael C. Jennings; Richard J. Puddephatt","Amine-Amide Equilibrium in Gold(III) Complexes and a Gold(III)-Gold(I) Aurophilic Bond","Inorganic Chemistry","2007","46","","1361","1368","10.1021/ic061911y","","","0.71073","MoKα","","0.1034","0.0538","","","0.0909","0.1019","","","","","","1.048","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307428","7.87","0.0004","9.4406","0.0004","14.5086","0.0005","92.775","0.002","104.76","0.002","91.309","0.003","1040.47","0.08","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C31 H42 La N5 Ni2 O22 -","- C31 H42 La N5 Ni2 O22 -","- C31 H42 La N5 Ni2 O22 -","1","0.5","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0281","","","","0.0969","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307429","7.8217","0.0002","9.4165","0.0003","14.5053","0.0005","92.707","0.002","104.827","0.002","91.333","0.001","1030.94","0.06","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C31 H41.5 Ce N5 Ni2 O22 -","- C31 H41.5 Ce N5 Ni2 O22 -","- C31 H41.5 Ce N5 Ni2 O22 -","1","0.5","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0286","","","","0.0863","","","","","","0.997","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307430","7.8083","0.0007","9.3987","0.0006","14.481","0.001","92.794","0.002","104.708","0.004","91.285","0.003","1026.02","0.13","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C31 H43 N5 Ni2 O22 Pr -","- C31 H43 N5 Ni2 O22 Pr -","- C31 H43 N5 Ni2 O22 Pr -","1","0.5","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0284","","","","0.0869","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307431","7.8223","0.0006","9.3897","0.0008","14.454","0.001","92.48","0.003","104.616","0.003","91.396","0.004","1025.63","0.14","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C31 H42 N5 Nd Ni2 O22 -","- C31 H42 N5 Nd Ni2 O22 -","- C31 H42 N5 Nd Ni2 O22 -","1","0.5","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0319","","","","0.0903","","","","","","0.999","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307432","7.8113","0.0003","9.3785","0.0005","14.4618","0.0007","92.432","0.003","104.463","0.003","91.265","0.002","1024.36","0.08","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C31 H44 N5 Ni2 O22 Sm -","- C31 H44 N5 Ni2 O22 Sm -","- C31 H44 N5 Ni2 O22 Sm -","1","0.5","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0274","","","","0.091","","","","","","0.998","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307433","7.792","0.0006","9.3695","0.0008","14.451","0.001","92.424","0.002","104.477","0.004","91.207","0.003","1020.07","0.14","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C31 H42 Eu N5 Ni2 O22 -","- C31 H42 Eu N5 Ni2 O22 -","- C31 H42 Eu N5 Ni2 O22 -","1","0.5","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.026","","","","0.0751","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307434","7.822","0.0004","9.3686","0.0005","14.4871","0.0009","92.321","0.003","104.321","0.003","91.211","0.002","1027.27","0.1","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C31 H38 Gd N5 Ni2 O22 -","- C31 H38 Gd N5 Ni2 O22 -","- C31 H38 Gd N5 Ni2 O22 -","1","0.5","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0338","","","","0.0912","","","","","","0.997","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307435","7.8897","0.0008","16.801","0.001","16.981","0.002","68.735","0.002","77.85","0.002","78.293","0.005","2030.8","0.3","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C29 H42 N5 Ni2 O24 Sm -","- C29 H42 N5 Ni2 O24 Sm -","- C58 H84 N10 Ni4 O48 Sm2 -","2","1","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0524","","","","0.1696","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307436","10.8349","0.0007","14.809","0.002","16.448","0.002","109.124","0.003","100.14","0.003","110.188","0.005","2212.4","0.4","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H50 Lu N5 Ni2 O23 -","- C34 H50 Lu N5 Ni2 O23 -","- C68 H100 Lu2 N10 Ni4 O46 -","2","1","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0299","","","","0.0939","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307437","7.833","0.0007","16.713","0.001","16.9108","0.0009","68.641","0.002","78.02","0.004","78.468","0.002","1998","0.2","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C29 H42 Eu N5 Ni2 O24 -","- C29 H42 Eu N5 Ni2 O24 -","- C58 H84 Eu2 N10 Ni4 O48 -","2","1","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.045","","","","0.1313","","","","","","0.998","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307438","7.9047","0.0008","16.786","0.002","17.04","0.002","68.804","0.006","78.224","0.004","78.643","0.004","2044.8","0.4","213.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C29 H42 Gd N5 Ni2 O24 -","- C29 H42 Gd N5 Ni2 O24 -","- C58 H84 Gd2 N10 Ni4 O48 -","2","1","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0378","","","","0.1349","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307439","14.103","0.001","17.2153","0.0009","16.3096","0.0008","90","","99.328","0.003","90","","3907.4","0.4","183.2","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H38 Gd N5 Ni2 O21 -","- C30 H38 Gd N5 Ni2 O21 -","- C120 H152 Gd4 N20 Ni8 O84 -","4","0.5","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0465","","","","0.0659","","","","","","0.996","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307440","14.1121","0.0005","17.2313","0.0006","16.3004","0.0006","90","","99.2495","0.0009","90","","3912.2","0.2","183.2","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H38 N5 Ni2 O21 Tb -","- C30 H38 N5 Ni2 O21 Tb -","- C120 H152 N20 Ni8 O84 Tb4 -","4","0.5","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0333","","","","0.0947","","","","","","0.999","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307441","14.0708","0.0006","17.2309","0.0009","16.2927","0.0009","90","","99.187","0.001","90","","3899.5","0.3","183.2","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H36 Dy N5 Ni2 O21 -","- C30 H36 Dy N5 Ni2 O21 -","- C120 H144 Dy4 N20 Ni8 O84 -","4","0.5","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0298","","","","0.104","","","","","","0.998","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307442","10.862","0.002","14.851","0.003","16.521","0.003","109.156","0.004","100.149","0.006","110.336","0.007","2230.2","0.8","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H50 Ho N5 Ni2 O23 -","- C34 H50 Ho N5 Ni2 O23 -","- C68 H100 Ho2 N10 Ni4 O46 -","2","1","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0627","","","","0.2017","","","","","","0.996","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307443","10.8507","0.0006","14.87","0.0006","16.502","0.0008","109.139","0.002","100.197","0.002","110.294","0.002","2228.7","0.2","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H50 Er N5 Ni2 O23 -","- C34 H50 Er N5 Ni2 O23 -","- C68 H100 Er2 N10 Ni4 O46 -","2","1","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0379","","","","0.1306","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307444","10.8582","0.0001","14.8577","","16.5084","0.0002","109.178","0.0007","100.118","0.0007","110.285","0.0008","2229.86","0.04","296.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H50 N5 Ni2 O23 Tm -","- C34 H50 N5 Ni2 O23 Tm -","- C68 H100 N10 Ni4 O46 Tm2 -","2","1","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.033","","","","0.1098","","","","","","0.999","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307445","10.8743","0.0005","14.8551","0.0006","16.5024","0.0009","108.984","0.002","100.109","0.001","110.412","0.003","2233.4","0.2","183.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H50 N5 Ni2 O23 Yb -","- C34 H50 N5 Ni2 O23 Yb -","- C68 H100 N10 Ni4 O46 Yb2 -","2","1","","Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba","Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism","Inorganic Chemistry","2007","46","","3492","3501","10.1021/ic0619153","","","0.7107","MoKα","","","0.0495","","","","0.148","","","","","","1.001","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307446","17.5455","0.0003","17.5455","0.0003","17.5455","0.0003","90","","90","","90","","5401.29","0.16","293","2","293","2","","","","","","","","8","P m -3 m","-P 4 2 3","221","","","","- C144 H214 B8 Cl4 Co6 Fe8 N72 O47 -","- C144 H213.98 B8 Cl4.02 Co6 Fe8 N72 O46.9 -","- C144 H213.98 B8 Cl4.02 Co6 Fe8 N72 O46.9 -","1","0.0208333","","Long Jiang; Hye Jin Choi; Xiao-Long Feng; Tong-Bu Lu; Jeffrey R. Long","Syntheses, Structures, and Magnetic Properties of the Face-Centered Cubic Clusters [Tp8(H2O)12M6Fe8(CN)24]4+ (M = Co, Ni)","Inorganic Chemistry","2007","46","","2181","2186","10.1021/ic061924b","","","0.71073","MoKα","","0.1045","0.0803","","","0.2073","0.2431","","","","","","1.053","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307447","17.548","0.0012","17.548","0.0012","17.548","0.0012","90","","90","","90","","5403.6","0.6","293","2","293","2","","","","","","","","8","P m -3 m","-P 4 2 3","221","","","","- C144 H214 B8 Cl4 Fe8 N72 Ni6 O47 -","- C144 H214 B8 Cl4.02 Fe8 N72 Ni6 O46.9 -","- C144 H214 B8 Cl4.02 Fe8 N72 Ni6 O46.9 -","1","0.0208333","","Long Jiang; Hye Jin Choi; Xiao-Long Feng; Tong-Bu Lu; Jeffrey R. Long","Syntheses, Structures, and Magnetic Properties of the Face-Centered Cubic Clusters [Tp8(H2O)12M6Fe8(CN)24]4+ (M = Co, Ni)","Inorganic Chemistry","2007","46","","2181","2186","10.1021/ic061924b","","","0.71073","MoKα","","0.1097","0.097","","","0.2352","0.2498","","","","","","1.092","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307448","10.1222","0.0009","3.608","0.0003","8.1884","0.0008","90","","120.23","0.002","90","","258.38","0.04","298","2","298","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Mo1.21 Sb4 Ti0.79 -","- Mo1.206 Sb4 Ti0.794 -","- Mo2.412 Sb8 Ti1.588 -","2","0.25","","Shahab Derakhshan; Abdeljalil Assoud; Katja M. Kleinke; Holger Kleinke","Crystal Structure, Electronic Structure, and Physical Properties of Ti1-δMo1+δAs4 and Ti1-δMo1+δSb4","Inorganic Chemistry","2007","46","","1459","1463","10.1021/ic0619254","","","0.71073","MoKα","","0.0221","0.0209","","","0.0497","0.0503","","","","","","1.281","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307449","13.535","0.003","14.232","0.003","10.638","0.002","90","","90","","90","","2049.2","0.7","293","2","293","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C38 H22 Cu6 N14 Ni S2 -","- C38 H22 Cu6 N14 Ni S2 -","- C76 H44 Cu12 N28 Ni2 S4 -","2","0.5","","Xiao-Ping Zhou; Wen-Xiu Ni; Shun-Ze Zhan; Jia Ni; Dan Li; Ye-Gao Yin","From Encapsulation to Polypseudorotaxane: Unusual Anion Networks Driven by Predesigned Metal Bis(terpyridine) Complex Cations","Inorganic Chemistry","2007","46","","2345","2347","10.1021/ic061927o","","","0.71073","MoKα","","0.0936","0.0721","","","0.1785","0.1927","","","","","","1.039","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307450","13.582","0.002","13.9512","0.0019","10.6531","0.0016","90","","90","","90","","2018.6","0.5","293","2","293","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C38 H22 Co Cu6 N14 S2 -","- C38 H22 Co Cu6 N14 S2 -","- C76 H44 Co2 Cu12 N28 S4 -","2","0.5","","Xiao-Ping Zhou; Wen-Xiu Ni; Shun-Ze Zhan; Jia Ni; Dan Li; Ye-Gao Yin","From Encapsulation to Polypseudorotaxane: Unusual Anion Networks Driven by Predesigned Metal Bis(terpyridine) Complex Cations","Inorganic Chemistry","2007","46","","2345","2347","10.1021/ic061927o","","","0.71073","MoKα","","0.1147","0.077","","","0.1898","0.2152","","","","","","1.052","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307451","35.514","0.005","18.574","0.003","16.238","0.003","90","","103.746","0.002","90","","10404","3","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H34 Cu6 Mn N14 -","- C52 H34 Cu6 Mn N14 -","- C416 H272 Cu48 Mn8 N112 -","8","1","","Xiao-Ping Zhou; Wen-Xiu Ni; Shun-Ze Zhan; Jia Ni; Dan Li; Ye-Gao Yin","From Encapsulation to Polypseudorotaxane: Unusual Anion Networks Driven by Predesigned Metal Bis(terpyridine) Complex Cations","Inorganic Chemistry","2007","46","","2345","2347","10.1021/ic061927o","","","0.71073","MoKα","","0.0841","0.0581","","","0.1641","0.1846","","","","","","1.041","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307452","35.495","0.006","18.29","0.003","16.306","0.003","90","","103.554","0.002","90","","10291","3","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H34 Cu6 Fe N14 -","- C52 H34 Cu6 Fe N14 -","- C416 H272 Cu48 Fe8 N112 -","8","1","","Xiao-Ping Zhou; Wen-Xiu Ni; Shun-Ze Zhan; Jia Ni; Dan Li; Ye-Gao Yin","From Encapsulation to Polypseudorotaxane: Unusual Anion Networks Driven by Predesigned Metal Bis(terpyridine) Complex Cations","Inorganic Chemistry","2007","46","","2345","2347","10.1021/ic061927o","","","0.71073","MoKα","","0.0976","0.0539","","","0.1405","0.1776","","","","","","1.046","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307453","35.528","0.002","18.4842","0.0011","16.2804","0.001","90","","103.575","0.001","90","","10392.8","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H34 Co Cu6 N14 -","- C52 H34 Co Cu6 N14 -","- C416 H272 Co8 Cu48 N112 -","8","1","","Xiao-Ping Zhou; Wen-Xiu Ni; Shun-Ze Zhan; Jia Ni; Dan Li; Ye-Gao Yin","From Encapsulation to Polypseudorotaxane: Unusual Anion Networks Driven by Predesigned Metal Bis(terpyridine) Complex Cations","Inorganic Chemistry","2007","46","","2345","2347","10.1021/ic061927o","","","0.71073","MoKα","","0.0806","0.0534","","","0.1147","0.128","","","","","","1.029","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307454","35.514","0.003","18.5884","0.0015","16.2731","0.0013","90","","103.66","0.002","90","","10438.8","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H34 Cu6 N14 Ni -","- C52 H34 Cu6 N14 Ni -","- C416 H272 Cu48 N112 Ni8 -","8","1","","Xiao-Ping Zhou; Wen-Xiu Ni; Shun-Ze Zhan; Jia Ni; Dan Li; Ye-Gao Yin","From Encapsulation to Polypseudorotaxane: Unusual Anion Networks Driven by Predesigned Metal Bis(terpyridine) Complex Cations","Inorganic Chemistry","2007","46","","2345","2347","10.1021/ic061927o","","","0.71073","MoKα","","0.0783","0.0496","","","0.1157","0.1311","","","","","","1.035","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307455","35.529","0.004","18.5537","0.0018","16.2503","0.0016","90","","103.733","0.001","90","","10405.9","1.9","200","2","200","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C52 H34 Cu7 N14 -","- C52 H34 Cu7 N14 -","- C416 H272 Cu56 N112 -","8","1","","Xiao-Ping Zhou; Wen-Xiu Ni; Shun-Ze Zhan; Jia Ni; Dan Li; Ye-Gao Yin","From Encapsulation to Polypseudorotaxane: Unusual Anion Networks Driven by Predesigned Metal Bis(terpyridine) Complex Cations","Inorganic Chemistry","2007","46","","2345","2347","10.1021/ic061927o","","","0.71073","MoKα","","0.0558","0.0412","","","0.1049","0.1162","","","","","","1.029","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307456","7.542","0.003","8.536","0.003","15.912","0.006","102.563","0.006","99.46","0.006","97.057","0.006","972.8","0.6","150","2","150","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H25 Cl2 Ir N4 O -","- C17 H25 Cl2 Ir N4 O -","- C34 H50 Cl4 Ir2 N8 O2 -","2","1","","Claudio Pettinari; Riccardo Pettinari; Fabio Marchetti; Alceo Macchioni; Daniele Zuccaccia; Brian W. Skelton; Allan H. White","Synthesis, Reactivity, Spectroscopic Characterization, X-ray Structures, PGSE, and NOE NMR Studies of (η5-C5Me5)-Rhodium and -Iridium Derivatives Containing Bis(pyrazolyl)alkane Ligands","Inorganic Chemistry","2007","46","","896","906","10.1021/ic061928g","","","0.71073","MoKα","","0.053","0.039","","0.121","","0.121","","","1.138","","","1.138","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307457","9.623","0.003","14.176","0.004","13.315","0.004","90","","99.136","0.005","90","","1793.3","0.9","150","2","150","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C31 H46 Cl4 N4 O0 Rh2 -","- C31 H47 Cl4 N4 Rh2 -","- C62 H94 Cl8 N8 Rh4 -","2","0.5","","Claudio Pettinari; Riccardo Pettinari; Fabio Marchetti; Alceo Macchioni; Daniele Zuccaccia; Brian W. Skelton; Allan H. White","Synthesis, Reactivity, Spectroscopic Characterization, X-ray Structures, PGSE, and NOE NMR Studies of (η5-C5Me5)-Rhodium and -Iridium Derivatives Containing Bis(pyrazolyl)alkane Ligands","Inorganic Chemistry","2007","46","","896","906","10.1021/ic061928g","","","0.71073","MoKα","","0.1449","0.108","","","0.279","0.299","","","","","","1.09","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4307458","15.765","0.002","8.305","0.001","18.554","0.002","90","","90.261","0.009","90","","2429.2","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H35 Cl2 N4 O2 Rh -","- C21 H31 Cl2 N4 O2 Rh -","- C84 H124 Cl8 N16 O8 Rh4 -","4","1","","Claudio Pettinari; Riccardo Pettinari; Fabio Marchetti; Alceo Macchioni; Daniele Zuccaccia; Brian W. Skelton; Allan H. White","Synthesis, Reactivity, Spectroscopic Characterization, X-ray Structures, PGSE, and NOE NMR Studies of (η5-C5Me5)-Rhodium and -Iridium Derivatives Containing Bis(pyrazolyl)alkane Ligands","Inorganic Chemistry","2007","46","","896","906","10.1021/ic061928g","","","0.71073","MoKα","","0.0502","0.0374","","","0.0995","0.1027","","","","","","1.098","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307459","12.602","0.004","13.993","0.005","17.467","0.006","74.662","0.005","82.048","0.005","63.242","0.005","2651.7","1.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C21.5 H32 Cl3 N4 Rh -","- C21.5 H32 Cl3 N4 Rh -","- C86 H128 Cl12 N16 Rh4 -","4","2","","Claudio Pettinari; Riccardo Pettinari; Fabio Marchetti; Alceo Macchioni; Daniele Zuccaccia; Brian W. Skelton; Allan H. White","Synthesis, Reactivity, Spectroscopic Characterization, X-ray Structures, PGSE, and NOE NMR Studies of (η5-C5Me5)-Rhodium and -Iridium Derivatives Containing Bis(pyrazolyl)alkane Ligands","Inorganic Chemistry","2007","46","","896","906","10.1021/ic061928g","","","0.71073","MoKα","","0.1778","0.1042","","","0.2699","0.2955","","","","","","1.068","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4307460","9.6379","0.0008","14.1369","0.0009","14.047","0.002","90","","110.073","0.008","90","","1797.6","0.3","100","2","100","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C31 H46 Cl4 Ir2 N4 -","- C31 H46 Cl4 Ir2 N4 -","- C62 H92 Cl8 Ir4 N8 -","2","0.5","","Claudio Pettinari; Riccardo Pettinari; Fabio Marchetti; Alceo Macchioni; Daniele Zuccaccia; Brian W. Skelton; Allan H. White","Synthesis, Reactivity, Spectroscopic Characterization, X-ray Structures, PGSE, and NOE NMR Studies of (η5-C5Me5)-Rhodium and -Iridium Derivatives Containing Bis(pyrazolyl)alkane Ligands","Inorganic Chemistry","2007","46","","896","906","10.1021/ic061928g","","","0.71073","MoKα","","0.1024","0.0843","","","0.21","0.2202","","","","","","1.089","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307461","22.569","0.005","8.57","0.002","23.91","0.005","90","","91.232","0.004","90","","4623.5","1.8","150","","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C20 H27 Cl F3 Ir N4 O3 S -","- C20 H27 Cl F3 Ir N4 O3 S -","- C160 H216 Cl8 F24 Ir8 N32 O24 S8 -","8","1","","Claudio Pettinari; Riccardo Pettinari; Fabio Marchetti; Alceo Macchioni; Daniele Zuccaccia; Brian W. Skelton; Allan H. White","Synthesis, Reactivity, Spectroscopic Characterization, X-ray Structures, PGSE, and NOE NMR Studies of (η5-C5Me5)-Rhodium and -Iridium Derivatives Containing Bis(pyrazolyl)alkane Ligands","Inorganic Chemistry","2007","46","","896","906","10.1021/ic061928g","","","0.71073","MoKα","","0.06","0.06","","0.093","","0.093","","","1.142","","","1.142","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307462","11.184","0.003","23.044","0.006","13.132","0.003","90","","113.902","0.004","90","","3094.2","1.4","150","","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C21 H35 F6 N4 O10 Rh S2 -","- C21 H33 F6 N4 O10 Rh S2 -","- C84 H132 F24 N16 O40 Rh4 S8 -","4","1","","Claudio Pettinari; Riccardo Pettinari; Fabio Marchetti; Alceo Macchioni; Daniele Zuccaccia; Brian W. Skelton; Allan H. White","Synthesis, Reactivity, Spectroscopic Characterization, X-ray Structures, PGSE, and NOE NMR Studies of (η5-C5Me5)-Rhodium and -Iridium Derivatives Containing Bis(pyrazolyl)alkane Ligands","Inorganic Chemistry","2007","46","","896","906","10.1021/ic061928g","","","0.71073","MoKα","","0.063","0.043","","0.119","","0.119","","","1.09","","","1.09","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307463","18.292","0.003","10.294","0.001","14.626","0.004","90","","105.891","0.017","90","","2648.8","0.9","100","2","100","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C19 H25 F6 N4 O7 Rh S2 -","- C19 H25 F6 N4 O7 Rh S2 -","- C76 H100 F24 N16 O28 Rh4 S8 -","4","1","","Claudio Pettinari; Riccardo Pettinari; Fabio Marchetti; Alceo Macchioni; Daniele Zuccaccia; Brian W. Skelton; Allan H. White","Synthesis, Reactivity, Spectroscopic Characterization, X-ray Structures, PGSE, and NOE NMR Studies of (η5-C5Me5)-Rhodium and -Iridium Derivatives Containing Bis(pyrazolyl)alkane Ligands","Inorganic Chemistry","2007","46","","896","906","10.1021/ic061928g","","","0.71073","MoKα","","0.0337","0.0274","","","0.0579","0.0598","","","","","","1.009","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307464","10.8361","0.0009","11.5484","0.001","13.0041","0.0011","111.002","0.002","97.221","0.002","91.78","0.002","1502.1","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C9 H12 Cl N2 O7.25 Re S -","- C9 H12 Cl N2 O7.25 Re S -","- C36 H48 Cl4 N8 O29 Re4 S4 -","4","2","","Haiyang He; Malgorzata Lipowska; Xiaolong Xu; Andrew T. Taylor; Luigi G. Marzilli","Rhenium Analogues of Promising Renal Imaging Agents with a {99mTc(CO)3}+ Core Bound to Cysteine-Derived Dipeptides, Including Lanthionine","Inorganic Chemistry","2007","46","","3385","3394","10.1021/ic0619299","","","0.71073","MoKα","","0.0567","0.0446","","","0.0967","0.1014","","","","","","1.085","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307465","8.0524","0.0003","8.5267","0.0003","10.97","0.0004","77.872","0.002","78.388","0.002","73.174","0.002","696.88","0.04","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H13 N2 O8 Re S -","- C9 H13 N2 O8 Re S -","- C18 H26 N4 O16 Re2 S2 -","2","1","","Haiyang He; Malgorzata Lipowska; Xiaolong Xu; Andrew T. Taylor; Luigi G. Marzilli","Rhenium Analogues of Promising Renal Imaging Agents with a {99mTc(CO)3}+ Core Bound to Cysteine-Derived Dipeptides, Including Lanthionine","Inorganic Chemistry","2007","46","","3385","3394","10.1021/ic0619299","","","1.54178","CuKα","","0.0329","0.0304","","","0.0878","0.0894","","","","","","1.057","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307466","8.6594","0.0008","19.563","0.0018","8.9757","0.0008","90","","104.032","0.002","90","","1475.1","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H15 N2 O9 Re S -","- C9 H15 N2 O9 Re S -","- C36 H60 N8 O36 Re4 S4 -","4","1","","Haiyang He; Malgorzata Lipowska; Xiaolong Xu; Andrew T. Taylor; Luigi G. Marzilli","Rhenium Analogues of Promising Renal Imaging Agents with a {99mTc(CO)3}+ Core Bound to Cysteine-Derived Dipeptides, Including Lanthionine","Inorganic Chemistry","2007","46","","3385","3394","10.1021/ic0619299","","","0.71073","MoKα","","0.039","0.0349","","","0.0829","0.0847","","","","","","1.13","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307467","9.2513","0.0005","11.0612","0.0006","16.2289","0.0009","90","","90","","90","","1660.71","0.16","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C10 H19 N2 O10 Re S -","- C10 H19 N2 O10 Re S -","- C40 H76 N8 O40 Re4 S4 -","4","1","","Haiyang He; Malgorzata Lipowska; Xiaolong Xu; Andrew T. Taylor; Luigi G. Marzilli","Rhenium Analogues of Promising Renal Imaging Agents with a {99mTc(CO)3}+ Core Bound to Cysteine-Derived Dipeptides, Including Lanthionine","Inorganic Chemistry","2007","46","","3385","3394","10.1021/ic0619299","","","0.71073","MoKα","","0.0261","0.0254","","","0.0646","0.0651","","","","","","1.029","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307468","9.017","0.003","10.374","0.004","13.917","0.005","81.215","0.009","72.996","0.009","84.007","0.01","1227.9","0.8","204.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C19 H32 Cu N6 O6 -","- C19 H32 Cu N6 O6 -","- C38 H64 Cu2 N12 O12 -","2","1","","Nicolai Lehnert; Ursula Cornelissen; Frank Neese; Tetsuya Ono; Yuki Noguchi; Ken-ichi Okamoto; Kiyoshi Fujisawa","Synthesis and Spectroscopic Characterization of Copper(II)-Nitrito Complexes with Hydrotris(pyrazolyl)borate and Related Coligands","Inorganic Chemistry","2007","46","","3916","3933","10.1021/ic0619355","","","0.7107","MoKα","","","0.038","","","","0.038","","","","","","2.255","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307469","10.008","0.004","19.188","0.007","16.541","0.007","90","","106.065","0.005","90","","3052","2","207.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H46 B Cu N7 O2 -","- C27 H46 B Cu N7 O2 -","- C108 H184 B4 Cu4 N28 O8 -","4","1","","Nicolai Lehnert; Ursula Cornelissen; Frank Neese; Tetsuya Ono; Yuki Noguchi; Ken-ichi Okamoto; Kiyoshi Fujisawa","Synthesis and Spectroscopic Characterization of Copper(II)-Nitrito Complexes with Hydrotris(pyrazolyl)borate and Related Coligands","Inorganic Chemistry","2007","46","","3916","3933","10.1021/ic0619355","","","0.71069","MoKα","","","0.07","","","","0.069","","","","","","2.775","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307470","9.494","0.003","17.488","0.005","20.792","0.006","90","","107.125","0.003","90","","3299.1","1.7","207.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H52 B Cu N7 O2 -","- C30 H52 B Cu N7 O2 -","- C120 H208 B4 Cu4 N28 O8 -","4","1","","Nicolai Lehnert; Ursula Cornelissen; Frank Neese; Tetsuya Ono; Yuki Noguchi; Ken-ichi Okamoto; Kiyoshi Fujisawa","Synthesis and Spectroscopic Characterization of Copper(II)-Nitrito Complexes with Hydrotris(pyrazolyl)borate and Related Coligands","Inorganic Chemistry","2007","46","","3916","3933","10.1021/ic0619355","","","0.71069","MoKα","","","0.046","","","","0.042","","","","","","2.384","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307471","8.2462","0.0005","9.7908","0.0005","18.359","0.0009","90.679","0.002","98.948","0.002","114.061","0.002","1332.32","0.13","183.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H34 Cl2 Cu N6 O4 -","- C20 H34 Cl2 Cu N6 O4 -","- C40 H68 Cl4 Cu2 N12 O8 -","2","1","","Nicolai Lehnert; Ursula Cornelissen; Frank Neese; Tetsuya Ono; Yuki Noguchi; Ken-ichi Okamoto; Kiyoshi Fujisawa","Synthesis and Spectroscopic Characterization of Copper(II)-Nitrito Complexes with Hydrotris(pyrazolyl)borate and Related Coligands","Inorganic Chemistry","2007","46","","3916","3933","10.1021/ic0619355","","","0.7107","MoKα","","","0.061","","","","0.094","","","","","","4.962","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307472","12.2294","0.0005","12.2294","0.0005","5.9852","0.0005","90","","90","","90","","895.14","0.09","273","2","273","2","","","","","","","","2","P 42/n :2","-P 4bc","86","","","","- Sb Tm3 -","- Sb Tm3 -","- Sb8 Tm24 -","8","1","","Shalabh Gupta; Ling Chen; Ashok K. Ganguli; John D. Corbett","Rare-Earth Metal-Rich Antimonides: Syntheses, Structures, and Properties of Tm3Sb and Lu7Sb3","Inorganic Chemistry","2007","46","","2187","2192","10.1021/ic0619409","","","0.71073","MoKα","","0.0323","0.0274","","","0.0506","0.0518","","","","","","1.182","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307474","18.057","0.004","18.204","0.004","19.226","0.004","112.441","0.003","98.555","0.004","112.615","0.004","5058.2","1.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C130 H270 Co8 N52 Ni7 O93 -","- C65 H90 Co4 N26 Ni3.5 O46.5 -","- C130 H180 Co8 N52 Ni7 O93 -","2","1","","Ai-Ling Cheng; Na Liu; Jian-Yong Zhang; En-Qing Gao","Assembling the Cage-Based Metal-Organic Network from a Cubic Metalloligand","Inorganic Chemistry","2007","46","","1034","1035","10.1021/ic061943l","","","0.71073","MoKα","","0.1384","0.069","","","0.1467","0.1715","","","","","","1.019","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307475","9.3999","0.0019","30.749","0.006","15.537","0.003","90","","97.975","0.004","90","","4447.3","1.5","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","[4-(2-pyridyl)-1,2,4,5-dithiadiazolyl]-bis(hexafluoroacetylacetonate) copper(II)","","- C16 H6 Cu F12 N3 O4 S2 -","- C16 H6 Cu F12 N3 O4 S2 -","- C128 H48 Cu8 F96 N24 O32 S16 -","8","2","","James Britten; Nigel G. R. Hearns; Kathryn E. Preuss; John F. Richardson; Sofi Bin-Salamon","Mn(II) and Cu(II) Complexes of a Dithiadiazolyl Radical Ligand: Monomer/Dimer Equilibria in Solution","Inorganic Chemistry","2007","46","","3934","3945","10.1021/ic0619456","","","0.71073","MoKα","","0.1625","0.0785","","","0.1863","0.2201","","","","","","1.039","","","","has coordinates,has disorder","179112","2020-10-21","18:00:00",""
"4307476","16.663","0.016","17.815","0.017","17.467","0.017","90","","116.19","0.015","90","","4653","8","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[4-(2-pyridyl)-1,2,4,5-dithiadiazolyl]-bis(hexafluoroacetylacetonate) manganese(II)","","- C16 H6 F12 Mn N3 O4 S2 -","- C16 H6 F12 Mn N3 O4 S2 -","- C128 H48 F96 Mn8 N24 O32 S16 -","8","2","","James Britten; Nigel G. R. Hearns; Kathryn E. Preuss; John F. Richardson; Sofi Bin-Salamon","Mn(II) and Cu(II) Complexes of a Dithiadiazolyl Radical Ligand: Monomer/Dimer Equilibria in Solution","Inorganic Chemistry","2007","46","","3934","3945","10.1021/ic0619456","","","0.71073","MoKα","","0.1868","0.0835","","","0.1556","0.1901","","","","","","1.025","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307477","15.0752","0.0013","16.0141","0.0014","17.8295","0.0015","80.9","0.002","72.585","0.002","66.351","0.002","3758.5","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C132 H128 Mn10 N12 O70 Th6 -","- C112 H80 Mn10 N2 O70 Th6 -","- C112 H80 Mn10 N2 O70 Th6 -","1","0.5","","Abhudaya Mishra; Anastasios J. Tasiopoulos; Wolfgang Wernsdorfer; Khalil A. Abboud; George Christou","High-Nuclearity Ce/Mn and Th/Mn Cluster Chemistry: Preparation of Complexes with [Ce4Mn10O10(OMe)6]18+ and [Th6Mn10O22(OH)2]18+ Cores","Inorganic Chemistry","2007","46","","3105","3115","10.1021/ic061946y","","","0.71073","MoKα","","0.1373","0.0707","","","0.1647","0.1848","","","","","","0.86","","","","has coordinates,has disorder","179112","2020-10-21","18:00:00",""
"4307478","32.408","0.002","16.9687","0.0011","27.6545","0.0017","90","","95.942","0.002","90","","15126.1","1.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C136 H146 Ce4 Mn10 N8 O63 -","- C120 H104 Ce4 Mn10 N2 O59 -","- C480 H416 Ce16 Mn40 N8 O236 -","4","0.5","","Abhudaya Mishra; Anastasios J. Tasiopoulos; Wolfgang Wernsdorfer; Khalil A. Abboud; George Christou","High-Nuclearity Ce/Mn and Th/Mn Cluster Chemistry: Preparation of Complexes with [Ce4Mn10O10(OMe)6]18+ and [Th6Mn10O22(OH)2]18+ Cores","Inorganic Chemistry","2007","46","","3105","3115","10.1021/ic061946y","","","0.71073","MoKα","","0.1572","0.0805","","","0.1866","0.2168","","","","","","0.973","","","","has coordinates,has disorder","179112","2020-10-21","18:00:00",""
"4307479","9.861","0.005","10.501","0.005","16.856","0.005","89.522","0.005","78.766","0.005","80.179","0.005","1686.4","1.3","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H36 I3 N2 P -","- C26 H36 I3 N2 P -","- C52 H72 I6 N4 P2 -","2","1","","Gregor Reeske; Alan H. Cowley","One-Step Redox Route to N-Heterocyclic Phosphenium Ions","Inorganic Chemistry","2007","46","","1426","1430","10.1021/ic061956z","","","0.71069","MoKα","","0.082","0.045","","","0.1163","0.1267","","","","","","1.107","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307480","20.593","0.005","17.637","0.005","23.597","0.005","90","","91.069","0.005","90","","8569","4","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H56 B N2 P -","- C50 H56 B N2 P -","- C400 H448 B8 N16 P8 -","8","2","","Gregor Reeske; Alan H. Cowley","One-Step Redox Route to N-Heterocyclic Phosphenium Ions","Inorganic Chemistry","2007","46","","1426","1430","10.1021/ic061956z","","","0.71069","MoKα","","0.1124","0.0553","","","0.1102","0.1314","","","","","","1.014","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4307481","21.647","0.004","7.5469","0.0015","16.488","0.003","90","","112.69","0.03","90","","2485.1","1","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H24 I3 N2 P -","- C20 H24 I3 N2 P -","- C80 H96 I12 N8 P4 -","4","0.5","","Gregor Reeske; Alan H. Cowley","One-Step Redox Route to N-Heterocyclic Phosphenium Ions","Inorganic Chemistry","2007","46","","1426","1430","10.1021/ic061956z","","","0.71073","MoKα","","0.0609","0.0446","","","0.1129","0.1244","","","","","","1.065","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307482","12.993","0.005","15.126","0.005","12.254","0.005","90","","110.922","0.005","90","","2249.5","1.5","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H28 I3 N2 O P -","- C14 H28 I3 N2 O P -","- C56 H112 I12 N8 O4 P4 -","4","1","","Gregor Reeske; Alan H. Cowley","One-Step Redox Route to N-Heterocyclic Phosphenium Ions","Inorganic Chemistry","2007","46","","1426","1430","10.1021/ic061956z","","x-ray","0.71069","MoKα","","0.0635","0.0341","","","0.0738","0.0845","","","","","","1.078","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4307483","13.817","0.005","17.943","0.005","18.382","0.005","82.75","0.005","68.21","0.005","70.13","0.005","3980","2","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H24 I3 N2 P -","- C14 H24 I3 N2 P -","- C112 H192 I24 N16 P8 -","8","4","","Gregor Reeske; Alan H. Cowley","One-Step Redox Route to N-Heterocyclic Phosphenium Ions","Inorganic Chemistry","2007","46","","1426","1430","10.1021/ic061956z","","","0.71069","MoKα","","0.1169","0.0641","","","0.1462","0.1651","","","","","","1.103","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307484","9.7482","0.0019","17.553","0.004","34.013","0.007","90","","90","","90","","5820","2","153","2","153","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C34 H38 B N2 P -","- C34 H38 B N2 P -","- C272 H304 B8 N16 P8 -","8","1","","Gregor Reeske; Alan H. Cowley","One-Step Redox Route to N-Heterocyclic Phosphenium Ions","Inorganic Chemistry","2007","46","","1426","1430","10.1021/ic061956z","","","0.71073","MoKα","","0.113","0.0672","","","0.1755","0.2051","","","","","","1.023","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4307485","17.47","0.002","17.392","0.002","17.208","0.002","90","","93.253","0.002","90","","5220","1","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Bi18 Ca21 Mn4 -","- Bi18 Ca21 Mn4 -","- Bi72 Ca84 Mn16 -","4","0.5","","Sheng-qing Xia; Svilen Bobev","Diverse Polyanions Based on MnBi4 and MnSb4 Tetrahedra: Polymorphism, Structure, and Bonding in Ca21Mn4Bi18 and Ca21Mn4Sb18","Inorganic Chemistry","2007","46","","874","883","10.1021/ic061958j","","","0.71073","MoKα","","0.0556","0.0405","","","0.084","0.0894","","","","","","1.033","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307486","17.415","0.006","16.567","0.006","17.047","0.006","90","","92.068","0.004","90","","4915","3","120","2","120","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Ca21 Mn4 Sb18 -","- Ca21 Mn4 Sb18 -","- Ca84 Mn16 Sb72 -","4","0.5","","Sheng-qing Xia; Svilen Bobev","Diverse Polyanions Based on MnBi4 and MnSb4 Tetrahedra: Polymorphism, Structure, and Bonding in Ca21Mn4Bi18 and Ca21Mn4Sb18","Inorganic Chemistry","2007","46","","874","883","10.1021/ic061958j","","","0.71073","MoKα","","0.0598","0.0432","","","0.0788","0.0853","","","","","","1.036","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307487","19.563","0.007","12.713","0.005","16.837","0.008","90","","121.099","0.015","90","","3586","3","150.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C31 H28.5 Cl2 Fe N9.5 O8 -","- C30 H24 Cl2 Fe N9 O8 -","- C120 H96 Cl8 Fe4 N36 O32 -","4","0.5","","Hiroaki Hagiwara; Shingo Hashimoto; Naohide Matsumoto; Seiichiro Iijima","Two-Dimensional Iron(II) Spin Crossover Complex Constructed of Bifurcated NH...O-Hydrogen Bonds and π-π Interactions: [FeII(HLH,Me)2](ClO4)2.1.5MeCN (HLH,Me= Imidazol-4-yl-methylidene-8-amino-2-methylquinoline)","Inorganic Chemistry","2007","46","","3136","3143","10.1021/ic061960a","","","0.71075","MoKα","","","0.0585","","","","0.1749","","","","","","1.003","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307488","19.733","0.008","12.901","0.005","17.025","0.006","90","","121.261","0.015","90","","3705","3","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C31 H28.5 Cl2 Fe N9.5 O8 -","- C30 H24 Cl2 Fe N9 O8 -","- C120 H96 Cl8 Fe4 N36 O32 -","4","0.5","","Hiroaki Hagiwara; Shingo Hashimoto; Naohide Matsumoto; Seiichiro Iijima","Two-Dimensional Iron(II) Spin Crossover Complex Constructed of Bifurcated NH...O-Hydrogen Bonds and π-π Interactions: [FeII(HLH,Me)2](ClO4)2.1.5MeCN (HLH,Me= Imidazol-4-yl-methylidene-8-amino-2-methylquinoline)","Inorganic Chemistry","2007","46","","3136","3143","10.1021/ic061960a","","","0.71075","MoKα","","","0.0596","","","","0.1677","","","","","","1.008","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307489","6.07557","0.00016","6.16629","0.00016","6.5729","0.00021","90","","114.192","0.0014","90","","224.619","0.011","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","silver azide","","","- Ag N3 -","- Ag N3 -","- Ag4 N12 -","4","1","","Carsten L. Schmidt; Robert Dinnebier; Ulrich Wedig; Martin Jansen","Crystal Structure and Chemical Bonding of the High-Temperature Phase of AgN3","Inorganic Chemistry","2007","46","","907","916","10.1021/ic061963n","powder diffraction","","","","","","","","","","","","","1.05","","","","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307490","10.3807","0.0011","22.029","0.003","15.8319","0.0017","90","","100.694","0.009","90","","3557.5","0.7","296","1","296","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H18 F11 O Os P S3 -","- C36 H18 F11 O Os P S3 -","- C144 H72 F44 O4 Os4 P4 S12 -","4","1","","Maribel Arroyo; Sylvain Bernès; Margarita Cerón; Verónica Cortina; Consuelo Mendoza; Hugo Torrens","Carbon-Fluorine Bond Cleavage in the Preparation of Osmium(III) and Osmium(IV) Fluorothiolate Complexes. Fluorine by Fluorine NMR-Assignment and Fluxional Processes","Inorganic Chemistry","2007","46","","4857","4867","10.1021/ic0619660","","x-ray","0.71073","MoKα","","0.0594","0.0337","","","0.06","0.0674","","","","","","1.011","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307491","14.8936","0.0015","16.227","0.002","15.9492","0.0014","90","","95.561","0.006","90","","3836.4","0.7","298","1","298","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H F24 O0.5 Os S5 -","- C30 H F24 O0.5 Os S5 -","- C120 H4 F96 O2 Os4 S20 -","4","1","","Maribel Arroyo; Sylvain Bernès; Margarita Cerón; Verónica Cortina; Consuelo Mendoza; Hugo Torrens","Carbon-Fluorine Bond Cleavage in the Preparation of Osmium(III) and Osmium(IV) Fluorothiolate Complexes. Fluorine by Fluorine NMR-Assignment and Fluxional Processes","Inorganic Chemistry","2007","46","","4857","4867","10.1021/ic0619660","","x-ray","0.71073","MoKα","","0.0619","0.0423","","","0.1039","0.1151","","","","","","1.05","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307492","18.3106","0.0017","9.2362","0.0011","20.0791","0.0019","90","","97.707","0.008","90","","3365.1","0.6","296","1","296","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H5 F19 Os S5 -","- C30 H5 F19 Os S5 -","- C120 H20 F76 Os4 S20 -","4","1","","Maribel Arroyo; Sylvain Bernès; Margarita Cerón; Verónica Cortina; Consuelo Mendoza; Hugo Torrens","Carbon-Fluorine Bond Cleavage in the Preparation of Osmium(III) and Osmium(IV) Fluorothiolate Complexes. Fluorine by Fluorine NMR-Assignment and Fluxional Processes","Inorganic Chemistry","2007","46","","4857","4867","10.1021/ic0619660","","x-ray","0.71073","MoKα","","0.092","0.0566","","","0.1328","0.151","","","","","","1.029","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307493","8.416","0.002","19.096","0.004","22.572","0.004","90","","96.036","0.015","90","","3607.5","1.3","294","1","294","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C34 H22 F13 O Os P2 S3 -","- C34 H22 F13 O Os P2 S3 -","- C136 H88 F52 O4 Os4 P8 S12 -","4","1","","Maribel Arroyo; Sylvain Bernès; Margarita Cerón; Verónica Cortina; Consuelo Mendoza; Hugo Torrens","Carbon-Fluorine Bond Cleavage in the Preparation of Osmium(III) and Osmium(IV) Fluorothiolate Complexes. Fluorine by Fluorine NMR-Assignment and Fluxional Processes","Inorganic Chemistry","2007","46","","4857","4867","10.1021/ic0619660","","x-ray","0.71073","MoKα","","0.0687","0.037","","","0.0663","0.0752","","","","","","1.019","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307494","7.5737","0.0005","10.3969","0.0006","10.3986","0.0006","64.172","0.001","69.395","0.001","79.333","0.001","689.38","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H12 N2 O5 S Zn -","- C12 H12 N2 O5 S Zn -","- C24 H24 N4 O10 S2 Zn2 -","2","1","","K. Prabhakara Rao; C. N. R. Rao","Coordination Polymers and Hybrid Networks of Different Dimensionalities Formed by Metal Sulfites","Inorganic Chemistry","2007","46","","2511","2518","10.1021/ic061988m","","","0.71073","MoKα","","0.0417","0.0387","","","0.0978","0.0993","","","","","","0.999","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307495","8.0247","0.0003","9.4962","0.0003","10.274","0.0002","81.07","0.001","80.438","0.001","75.66","","742.64","0.04","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H10 N2 O7 S2 Zn2 -","- C12 H10 N2 O7 S2 Zn2 -","- C24 H20 N4 O14 S4 Zn4 -","2","1","","K. Prabhakara Rao; C. N. R. Rao","Coordination Polymers and Hybrid Networks of Different Dimensionalities Formed by Metal Sulfites","Inorganic Chemistry","2007","46","","2511","2518","10.1021/ic061988m","","","0.71073","MoKα","","0.0399","0.0369","","","0.0946","0.0957","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307496","16.6062","0.0001","4.7935","0.0001","19.2721","0.0005","90","","100.674","0.002","90","","1507.55","0.05","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 N2 O7 S2 Zn2 -","- C10 H10 N2 O7 S2 Zn2 -","- C40 H40 N8 O28 S8 Zn8 -","4","0.5","","K. Prabhakara Rao; C. N. R. Rao","Coordination Polymers and Hybrid Networks of Different Dimensionalities Formed by Metal Sulfites","Inorganic Chemistry","2007","46","","2511","2518","10.1021/ic061988m","","","0.71073","MoKα","","0.0267","0.0248","","","0.0642","0.065","","","","","","1.073","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307497","11.0793","0.0003","11.0793","0.0003","8.8246","0.0003","90","","90","","90","","1083.23","0.06","293","2","293","2","","","","","","","","6","P 42 n m","P 4n -2n","102","","","","- C6 H20 N2 O16 S4 Zn4 -","- C6 H20 N2 O16 S4 Zn4 -","- C12 H40 N4 O32 S8 Zn8 -","2","0.25","","K. Prabhakara Rao; C. N. R. Rao","Coordination Polymers and Hybrid Networks of Different Dimensionalities Formed by Metal Sulfites","Inorganic Chemistry","2007","46","","2511","2518","10.1021/ic061988m","","","0.71073","MoKα","","0.0293","0.0272","","","0.0706","0.0726","","","","","","1.077","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307498","9.088","0.0003","6.9429","0.0002","13.0805","0.0005","90","","91.551","0.002","90","","825.04","0.05","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C2 H14 N2 Nd2 O16 S4 -","- C2 H14 N2 Nd2 O16 S4 -","- C4 H28 N4 Nd4 O32 S8 -","2","0.5","","K. Prabhakara Rao; C. N. R. Rao","Coordination Polymers and Hybrid Networks of Different Dimensionalities Formed by Metal Sulfites","Inorganic Chemistry","2007","46","","2511","2518","10.1021/ic061988m","","","0.71073","MoKα","","0.0176","0.0175","","","0.0472","0.0473","","","","","","1.217","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307499","6.3754","0.0013","8.046","0.0016","10.918","0.002","90.13","0.03","102.04","0.03","102.75","0.03","533.5","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H10 F10 Hg -","- C24 H10 F10 Hg -","- C24 H10 F10 Hg -","1","0.5","","Charlotte N. Burress; Martha I. Bodine; Oussama Elbjeirami; Joseph H. Reibenspies; Mohammad A. Omary; François P. Gabbaï","Enhancement of External Spin-Orbit Coupling Effects Caused by Metal-Metal Cooperativity","Inorganic Chemistry","2007","46","","1388","1395","10.1021/ic061998n","","","0.71073","MoKα","","0.0354","0.0323","","","0.061","0.0625","","","","","","1","","","","has coordinates","179112","2020-10-21","18:00:00",""
"4307500","7.0988","0.0014","8.1504","0.0016","10.74","0.002","91.37","0.03","107.29","0.03","108.9","0.03","556.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H10 F10 Hg -","- C25 H9 F10 Hg -","- C25 H9 F10 Hg -","1","0.5","","Charlotte N. Burress; Martha I. Bodine; Oussama Elbjeirami; Joseph H. Reibenspies; Mohammad A. Omary; François P. Gabbaï","Enhancement of External Spin-Orbit Coupling Effects Caused by Metal-Metal Cooperativity","Inorganic Chemistry","2007","46","","1388","1395","10.1021/ic061998n","","","0.71073","MoKα","","0.0749","0.0457","","","0.0951","0.1038","","","","","","1","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307501","7.0469","0.0014","44.805","0.009","17.337","0.004","90","","91.36","0.03","90","","5472","2","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H10 F12 Hg3 -","- C31 H10 F12 Hg3 -","- C248 H80 F96 Hg24 -","8","2","","Charlotte N. Burress; Martha I. Bodine; Oussama Elbjeirami; Joseph H. Reibenspies; Mohammad A. Omary; François P. Gabbaï","Enhancement of External Spin-Orbit Coupling Effects Caused by Metal-Metal Cooperativity","Inorganic Chemistry","2007","46","","1388","1395","10.1021/ic061998n","","","0.71073","MoKα","","0.0505","0.0442","","","0.1005","0.1072","","","","","","1.011","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307502","9.948","0.002","6.8142","0.0014","14.627","0.003","90","","105.33","0.03","90","","956.3","0.4","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H8 F10 Hg -","- C22 H8 F10 Hg -","- C44 H16 F20 Hg2 -","2","0.5","","Charlotte N. Burress; Martha I. Bodine; Oussama Elbjeirami; Joseph H. Reibenspies; Mohammad A. Omary; François P. Gabbaï","Enhancement of External Spin-Orbit Coupling Effects Caused by Metal-Metal Cooperativity","Inorganic Chemistry","2007","46","","1388","1395","10.1021/ic061998n","","","0.71073","MoKα","","0.0354","0.028","","","0.0745","0.0827","","","","","","1.008","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307503","12.2611","0.0006","15.8967","0.0008","16.5101","0.0009","90","","90","","90","","3218","0.3","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C13 H23 Fe N6 O4 -","- C13 H23 Fe N6 O4 -","- C104 H184 Fe8 N48 O32 -","8","1","","Yu-Fei Song; John F. Berry; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Iron Complexes of New Pentadentate Ligands Containing the 1,4,7-Triazacyclononane-1,4-diacetate Motif. Spectroscopic, Electro-, and Photochemical Studies","Inorganic Chemistry","2007","46","","2208","2219","10.1021/ic062001j","","","0.71073","MoKα","","0.0738","0.0444","","","0.0902","0.1022","","","","","","1.064","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307504","16.4915","0.0006","16.5318","0.0006","36.239","0.002","90","","97.229","0.005","90","","9801.5","0.7","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C71 H122 F6 Fe4 N12 Na O35 P -","- C71 H100 F6 Fe4 N12 Na O35 P -","- C284 H400 F24 Fe16 N48 Na4 O140 P4 -","4","1","","Yu-Fei Song; John F. Berry; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Iron Complexes of New Pentadentate Ligands Containing the 1,4,7-Triazacyclononane-1,4-diacetate Motif. Spectroscopic, Electro-, and Photochemical Studies","Inorganic Chemistry","2007","46","","2208","2219","10.1021/ic062001j","","","0.71073","MoKα","","0.1123","0.098","","","0.2135","0.2203","","","","","","1.22","","","","has coordinates,has disorder","286259","2023-09-07","06:04:45",""
"4307505","8.3266","0.0006","13.0757","0.0009","19.1902","0.0012","73.25","0.01","89.24","0.01","88.9","0.01","2000.3","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H27 Cl Fe N3 O5 -","- C18 H27 Cl Fe N3 O5 -","- C72 H108 Cl4 Fe4 N12 O20 -","4","2","","Yu-Fei Song; John F. Berry; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Iron Complexes of New Pentadentate Ligands Containing the 1,4,7-Triazacyclononane-1,4-diacetate Motif. Spectroscopic, Electro-, and Photochemical Studies","Inorganic Chemistry","2007","46","","2208","2219","10.1021/ic062001j","","","0.71073","MoKα","","0.0503","0.0412","","","0.0927","0.097","","","","","","1.08","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307506","7.4733","0.0002","12.9538","0.0004","18.9587","0.0004","90","","90","","90","","1835.35","0.08","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H23 Fe N6 O4 -","- C17 H23 Fe N6 O4 -","- C68 H92 Fe4 N24 O16 -","4","1","","Yu-Fei Song; John F. Berry; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Iron Complexes of New Pentadentate Ligands Containing the 1,4,7-Triazacyclononane-1,4-diacetate Motif. Spectroscopic, Electro-, and Photochemical Studies","Inorganic Chemistry","2007","46","","2208","2219","10.1021/ic062001j","","","0.71073","MoKα","","0.0287","0.0251","","","0.055","0.0565","","","","","","1.039","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307507","15.6291","0.0006","6.9003","0.0002","15.8036","0.0006","90","","103.783","0.005","90","","1655.27","0.11","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13.5 H25 Cl Fe N3 O4.5 -","- C13.5 H25 Cl Fe N3 O4.5 -","- C54 H100 Cl4 Fe4 N12 O18 -","4","1","","Yu-Fei Song; John F. Berry; Eckhard Bill; Eberhard Bothe; Thomas Weyhermüller; Karl Wieghardt","Iron Complexes of New Pentadentate Ligands Containing the 1,4,7-Triazacyclononane-1,4-diacetate Motif. Spectroscopic, Electro-, and Photochemical Studies","Inorganic Chemistry","2007","46","","2208","2219","10.1021/ic062001j","","","0.71073","MoKα","","0.0331","0.0262","","","0.0611","0.064","","","","","","1.047","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307508","10.5956","0.0009","11.6384","0.001","12.4709","0.001","110.484","0.001","95.676","0.001","102.899","0.001","1377.6","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H38 Co I N3 -","- C28 H38 Co I N3 -","- C56 H76 Co2 I2 N6 -","2","1","","Martin Bröring; Serguei Prikhodovski; Carsten D. Brandt; Esther Cónsul Tejero; Silke Köhler; Clemens Pietzonka","Cyanide-Promoted Demetalation of TrpyNiNCO: A Route to Sensitive Metallotripyrrins of CoII, FeII, and MnII","Inorganic Chemistry","2007","46","","917","925","10.1021/ic062009t","","","0.71073","MoKα","","0.0287","0.0271","","","0.0639","0.0647","","","","","","1.08","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307509","11.067","0.0006","10.6803","0.0006","20.8687","0.0012","90","","97.148","0.001","90","","2447.5","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H34 Co N4 O -","- C27 H34 Co N4 O -","- C108 H136 Co4 N16 O4 -","4","1","","Martin Bröring; Serguei Prikhodovski; Carsten D. Brandt; Esther Cónsul Tejero; Silke Köhler; Clemens Pietzonka","Cyanide-Promoted Demetalation of TrpyNiNCO: A Route to Sensitive Metallotripyrrins of CoII, FeII, and MnII","Inorganic Chemistry","2007","46","","917","925","10.1021/ic062009t","","","0.71073","MoKα","","0.0459","0.0401","","","0.1003","0.1037","","","","","","1.033","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307510","10.972","0.003","11.257","0.002","20.908","0.008","90","","98.24","0.04","90","","2555.7","1.3","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H34 Co N4 S -","- C27 H34 Co N4 S -","- C108 H136 Co4 N16 S4 -","4","1","","Martin Bröring; Serguei Prikhodovski; Carsten D. Brandt; Esther Cónsul Tejero; Silke Köhler; Clemens Pietzonka","Cyanide-Promoted Demetalation of TrpyNiNCO: A Route to Sensitive Metallotripyrrins of CoII, FeII, and MnII","Inorganic Chemistry","2007","46","","917","925","10.1021/ic062009t","","","0.71073","MoKα","","0.1153","0.0457","","","0.0748","0.0883","","","","","","0.771","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307511","10.926","0.002","11.574","0.002","11.876","0.002","82.3","0.03","67.94","0.03","88.86","0.03","1378.6","0.5","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H38 Co N4 O3 -","- C28 H38 Co N4 O3 -","- C56 H76 Co2 N8 O6 -","2","1","","Martin Bröring; Serguei Prikhodovski; Carsten D. Brandt; Esther Cónsul Tejero; Silke Köhler; Clemens Pietzonka","Cyanide-Promoted Demetalation of TrpyNiNCO: A Route to Sensitive Metallotripyrrins of CoII, FeII, and MnII","Inorganic Chemistry","2007","46","","917","925","10.1021/ic062009t","","","0.71073","MoKα","","0.04","0.0338","","","0.088","0.0902","","","","","","1.048","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307512","18.9641","0.0014","14.0552","0.0016","19.4466","0.0014","90","","95.337","0.009","90","","5160.9","0.8","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H68 Fe2 N8 O3 -","- C54 H68 Fe2 N8 O3 -","- C216 H272 Fe8 N32 O12 -","4","1","","Martin Bröring; Serguei Prikhodovski; Carsten D. Brandt; Esther Cónsul Tejero; Silke Köhler; Clemens Pietzonka","Cyanide-Promoted Demetalation of TrpyNiNCO: A Route to Sensitive Metallotripyrrins of CoII, FeII, and MnII","Inorganic Chemistry","2007","46","","917","925","10.1021/ic062009t","","","0.71073","MoKα","","0.1495","0.0402","","","0.052","0.0655","","","","","","0.583","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307513","13.1292","0.0003","24.9288","0.0005","11.6353","0.0002","90","","91.483","0.001","90","","3806.9","0.13","126","","126","","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","(salen)Zn(EtOH)EtOH","","","- C40 H58 N2 O4 Zn -","- C40 H58 N2 O4 Zn -","- C160 H232 N8 O16 Zn4 -","4","1","","Meaghan E. Germain; Thomas R. Vargo; Peter G. Khalifah; Michael J. Knapp","Fluorescent Detection of Nitroaromatics and 2,3-Dimethyl- 2,3-dinitrobutane (DMNB) by a Zinc Complex: (salophen)Zn","Inorganic Chemistry","2007","46","","4422","4429","10.1021/ic062012c","","x-ray","0.71069","MoKα","","0.1014","0.0477","","","0.1018","0.1168","","","","","","1.02","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307514","10.96","0.0004","13.067","0.0005","13.154","0.0005","91.943","0.002","104.094","0.002","92.054","0.002","1824.19","0.12","120","","120","","","","","","","","synthesis as described","5","P -1","-P 1","2","(salen)Zn(THF)","","","- C40 H54 N2 O3 Zn -","- C40 H54 N2 O3 Zn -","- C80 H108 N4 O6 Zn2 -","2","1","","Meaghan E. Germain; Thomas R. Vargo; Peter G. Khalifah; Michael J. Knapp","Fluorescent Detection of Nitroaromatics and 2,3-Dimethyl- 2,3-dinitrobutane (DMNB) by a Zinc Complex: (salophen)Zn","Inorganic Chemistry","2007","46","","4422","4429","10.1021/ic062012c","","x-ray","0.71073","MoKα","","0.0575","0.0425","","","0.096","0.1067","","","","","","1.054","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307515","15.4018","0.0002","10.4556","0.0001","23.1113","0.0003","90","","90","","90","","3721.73","0.08","120","","120","","","","","","","","synthesis as described","5","P b c m","-P 2c 2b","57","(salen)Zn(py)","","","- C41 H51 N3 O2 Zn -","- C41 H51 N3 O2 Zn -","- C164 H204 N12 O8 Zn4 -","4","0.5","","Meaghan E. Germain; Thomas R. Vargo; Peter G. Khalifah; Michael J. Knapp","Fluorescent Detection of Nitroaromatics and 2,3-Dimethyl- 2,3-dinitrobutane (DMNB) by a Zinc Complex: (salophen)Zn","Inorganic Chemistry","2007","46","","4422","4429","10.1021/ic062012c","","x-ray","0.71073","MoKα","","0.0429","0.0327","","","0.0799","0.0859","","","","","","1.046","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307516","18.0875","0.0008","18.3897","0.0008","19.77","0.0008","90","","90","","90","","6576","0.5","293","2","273","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C52 H56 I8 N8 Zn4 -","- C52 H56 I8 N8 Zn4 -","- C208 H224 I32 N32 Zn16 -","4","1","","Lei Han; Henry Valle; Xianhui Bu","Homochiral Coordination Polymer with Infinite Double-Stranded Helices","Inorganic Chemistry","2007","46","","1511","1513","10.1021/ic062015p","","","0.71073","MoKα","","0.0711","0.0339","","","0.0568","0.0696","","","","","","1.006","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307517","8.805","0.002","12.308","0.002","13.052","0.003","78.04","0.03","86.39","0.03","76.43","0.03","1345","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C60 H46 N22 Ni -","- C60 H46 N22 Ni -","- C60 H46 N22 Ni -","1","0.5","","Loreto Ballester; Angel Gutiérrez; M. Felisa Perpiñán; Ana E. Sánchez; Marina Fonari; Maria Gdaniec","Hexaazamacrocyclic Nickel and Copper Complexes and their Reactivity with Tetracyanoquinodimethane","Inorganic Chemistry","2007","46","","3946","3955","10.1021/ic062016h","","","0.71073","MoKα","","0.0665","0.0578","","","0.1704","0.1787","","","","","","1.124","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307518","12.455","0.0014","15.6884","0.0017","6.2507","0.0007","90","","90.806","0.002","90","","1221.3","0.2","296","2","296","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C12 H38 Cl4 Cu2 N6 O4 -","- C12 H38 Cl4 Cu2 N6 O4 -","- C24 H76 Cl8 Cu4 N12 O8 -","2","0.25","","Loreto Ballester; Angel Gutiérrez; M. Felisa Perpiñán; Ana E. Sánchez; Marina Fonari; Maria Gdaniec","Hexaazamacrocyclic Nickel and Copper Complexes and their Reactivity with Tetracyanoquinodimethane","Inorganic Chemistry","2007","46","","3946","3955","10.1021/ic062016h","","","0.71073","MoKα","","0.0269","0.0239","","","0.0656","0.0667","","","","","","1.066","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307519","13.169","0.0012","9.3466","0.0009","15.2323","0.0014","90","","97.627","0.002","90","","1858.3","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H32 Cl2 Cu N6 O -","- C12 H32 Cl2 Cu N6 O -","- C48 H128 Cl8 Cu4 N24 O4 -","4","1","","Loreto Ballester; Angel Gutiérrez; M. Felisa Perpiñán; Ana E. Sánchez; Marina Fonari; Maria Gdaniec","Hexaazamacrocyclic Nickel and Copper Complexes and their Reactivity with Tetracyanoquinodimethane","Inorganic Chemistry","2007","46","","3946","3955","10.1021/ic062016h","","","0.71073","MoKα","","0.1228","0.0432","","","0.0766","0.096","","","","","","0.838","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307520","15.349","0.003","15.598","0.003","16.174","0.003","75.769","0.004","75.452","0.005","85.635","0.004","3632.7","1.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H38 N14 Ni -","- C36 H38 N14 Ni -","- C144 H152 N56 Ni4 -","4","2","","Loreto Ballester; Angel Gutiérrez; M. Felisa Perpiñán; Ana E. Sánchez; Marina Fonari; Maria Gdaniec","Hexaazamacrocyclic Nickel and Copper Complexes and their Reactivity with Tetracyanoquinodimethane","Inorganic Chemistry","2007","46","","3946","3955","10.1021/ic062016h","","","0.71073","MoKα","","0.5685","0.0506","","","0.0622","0.1598","","","","","","0.524","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307521","31.6901","0.001","9.4983","0.0003","15.7308","0.0005","90","","112.735","0.001","90","","4367.1","0.2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Fe(TOCH3PP)","","","- C52.5 H42 Cl2 Fe N4 O4 -","- C52.5 H42 Cl2 Fe N4 O4 -","- C210 H168 Cl8 Fe4 N16 O16 -","4","0.5","","Chuanjiang Hu; Bruce C. Noll; Charles E. Schulz; W. Robert Scheidt","Four-Coordinate Iron(II) Porphyrinates: Electronic Configuration Change by Intermolecular Interaction","Inorganic Chemistry","2007","46","","619","621","10.1021/ic0620182","","","0.71073","MoKα","","0.0753","0.0536","","","0.1511","0.1684","","","","","","1.062","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307522","9.151","0.0001","13.29","0.0001","14.826","0.0002","80.328","0.001","88.146","0.001","72.101","0.001","1691.07","0.03","100","2","100","2","","","","","","","","4","P -1","-P 1","2","Fe(TPP)","","","- C47.5 H32 Fe N4 -","- C47.5 H32 Fe N4 -","- C95 H64 Fe2 N8 -","2","1","","Chuanjiang Hu; Bruce C. Noll; Charles E. Schulz; W. Robert Scheidt","Four-Coordinate Iron(II) Porphyrinates: Electronic Configuration Change by Intermolecular Interaction","Inorganic Chemistry","2007","46","","619","621","10.1021/ic0620182","","","0.71073","MoKα","","0.0464","0.035","","","0.0897","0.0968","","","","","","1.031","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307523","14.309","0.003","8.5795","0.0017","15.619","0.003","90","","95.32","0.03","90","","1909.2","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Fe(TTP)","","","- C50 H42 Fe N4 S -","- C50 H41 Fe N4 S -","- C100 H82 Fe2 N8 S2 -","2","0.5","","Chuanjiang Hu; Bruce C. Noll; Charles E. Schulz; W. Robert Scheidt","Four-Coordinate Iron(II) Porphyrinates: Electronic Configuration Change by Intermolecular Interaction","Inorganic Chemistry","2007","46","","619","621","10.1021/ic0620182","","","0.71073","MoKα","","0.0541","0.0431","","","0.1195","0.1267","","","","","","1.053","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307524","21.866","0.003","7.6101","0.001","19.646","0.003","90","","90","","90","","3269.1","0.8","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","Tb GWMOF-6","","","- C14 H18 N O7 Tb -","- C14 H14 N O7 Tb -","- C112 H112 N8 O56 Tb8 -","8","1","","Daniel T. de Lill; Ana de Bettencourt-Dias; Christopher L. Cahill","Exploring Lanthanide Luminescence in Metal-Organic Frameworks: Synthesis, Structure, and Guest-Sensitized Luminescence of a Mixed Europium/Terbium-Adipate Framework and a Terbium-Adipate Framework","Inorganic Chemistry","2007","46","","3960","3965","10.1021/ic062019u","","","0.71073","MoKα","","0.0781","0.0365","","","0.0619","0.0722","","","","","","1.007","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4307525","21.925","0.002","7.6493","0.0007","19.6691","0.0015","90","","90","","90","","3298.7","0.5","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C28 H36 Eu N2 O14 Tb -","- C28 H36 Eu N2 O14 Tb -","- C112 H144 Eu4 N8 O56 Tb4 -","4","0.5","","Daniel T. de Lill; Ana de Bettencourt-Dias; Christopher L. Cahill","Exploring Lanthanide Luminescence in Metal-Organic Frameworks: Synthesis, Structure, and Guest-Sensitized Luminescence of a Mixed Europium/Terbium-Adipate Framework and a Terbium-Adipate Framework","Inorganic Chemistry","2007","46","","3960","3965","10.1021/ic062019u","","","0.71073","MoKα","","0.1364","0.0474","","","0.0554","0.0715","","","","","","0.765","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4307526","9.108","0.0002","11.5504","0.0002","14.2834","0.0004","88.594","0.0014","72.1198","0.001","83.028","0.0013","1419.35","0.06","150","1","150","1","","","","","","","","6","P -1","-P 1","2","[(dpppa)Zn](ClO4)2","","","- C23 H35 Cl2 N5 O9 Zn -","- C23 H35 Cl2 N5 O9 Zn -","- C46 H70 Cl4 N10 O18 Zn2 -","2","1","","Gajendrasingh K. Ingle; Magdalena M. Makowska-Grzyska; Ewa Szajna-Fuller; Indranil Sen; John C. Price; Atta M. Arif; Lisa M. Berreau","Influence of the Chelate Ligand Structure on the Amide Methanolysis Reactivity of Mononuclear Zinc Complexes","Inorganic Chemistry","2007","46","","1471","1480","10.1021/ic062020t","","","0.71073","MoKα","","0.0417","0.0326","","","0.0754","0.0803","","","","","","1.033","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307527","9.4708","0.0009","12.1353","0.0008","12.129","0.0011","90","","100.544","0.003","90","","1370.5","0.2","150","1","150","1","","","","","","","","7","P 1 21 1","P 2yb","4","[(epppa)Zn](ClO4)2","","","- C21 H30 Cl2 N4 O9 S Zn -","- C21 H30 Cl2 N4 O9 S Zn -","- C42 H60 Cl4 N8 O18 S2 Zn2 -","2","1","","Gajendrasingh K. Ingle; Magdalena M. Makowska-Grzyska; Ewa Szajna-Fuller; Indranil Sen; John C. Price; Atta M. Arif; Lisa M. Berreau","Influence of the Chelate Ligand Structure on the Amide Methanolysis Reactivity of Mononuclear Zinc Complexes","Inorganic Chemistry","2007","46","","1471","1480","10.1021/ic062020t","","","0.71073","MoKα","","0.1277","0.0767","","","0.1661","0.1949","","","","","","1.04","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307528","14.3737","0.0009","16.2349","0.001","19.1426","0.0012","88.632","0.001","81.764","0.001","75.257","0.001","4275","0.5","293","2","130","1","","","","","","","","6","P -1","-P 1","2","","","","- C32 H60 N8 O62 S2 W18 -","- C30.84 N8 O62 S2 W18 -","- C61.68 N16 O124 S4 W36 -","2","1","","Andrew W. A. Mariotti; Jingli Xie; Brendan F. Abrahams; Alan M. Bond; Anthony G. Wedd","Synthesis and Voltammetry of [bmim]4[α-S2W18O62] and Related Compounds: Rapid Precipitation and Dissolution of Reduced Surface Films","Inorganic Chemistry","2007","46","","2530","2540","10.1021/ic062022d","","","0.71073","MoKα","","0.1206","0.1037","","","0.2583","0.2735","","","","","","1.041","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307529","6.229","0.003","14.553","0.008","15.613","0.008","90","","94.481","0.015","90","","1411","1.3","118","2","118","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C17 H14 B F2 Fe N O -","- C17 H14 B F2 Fe N O -","- C68 H56 B4 F8 Fe4 N4 O4 -","4","1","","Young-Kwan Lim; Scott Wallace; John C. Bollinger; Xufang Chen; Dongwhan Lee","Triferrocenes Built on a C3-Symmetric Ligand Platform: Entry to Redox-Activepseudo-Triphenylenes via Chelation-Driven Stereoselection of Triple Schiff Bases","Inorganic Chemistry","2007","46","","1694","1703","10.1021/ic062029v","","","0.71073","MoKα","","0.0397","0.031","","","0.0775","0.0861","","","","","","1.049","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307530","10.447","0.003","10.885","0.002","18.647","0.004","93.915","0.013","99.125","0.011","106.223","0.016","1996","0.8","129","2","129","2","","","","","","","","8","P -1","-P 1","2","","","","- C41 H35.75 B3 Cl0.5 F6 Fe3 N4.75 O6.5 -","- C41 H35.74 B3 Cl0.52 F6 Fe3 N4.74 O6.48 -","- C82 H71.48 B6 Cl1.04 F12 Fe6 N9.48 O12.96 -","2","1","","Young-Kwan Lim; Scott Wallace; John C. Bollinger; Xufang Chen; Dongwhan Lee","Triferrocenes Built on a C3-Symmetric Ligand Platform: Entry to Redox-Activepseudo-Triphenylenes via Chelation-Driven Stereoselection of Triple Schiff Bases","Inorganic Chemistry","2007","46","","1694","1703","10.1021/ic062029v","","","0.71073","MoKα","","0.0545","0.036","","","0.0845","0.0983","","","","","","1.068","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307531","11.575","0.002","12.113","0.002","16.6","0.003","90","","90.736","0.003","90","","2327.3","0.7","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C38 H72 Cl6 N2 O2 P2 U -","- C38 H72 Cl6 N2 O2 P2 U -","- C76 H144 Cl12 N4 O4 P4 U2 -","2","0.5","","L. Jonas L Häller; Nikolas Kaltsoyannis; Mark J. Sarsfield; Iain May; Stéphanie M. Cornet; Michael P. Redmond; Madeleine Helliwell","A Structural and Theoretical Investigation of Equatorial cis and trans Uranyl Phosphinimine and Uranyl Phosphine Oxide Complexes UO2Cl2(Cy3PNH)2 and UO2Cl2(Cy3PO)2","Inorganic Chemistry","2007","46","","4868","4875","10.1021/ic062031m","","","0.71073","MoKα","","0.0637","0.0447","","","0.1032","0.111","","","","","","1.015","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307532","27.453","0.003","8.8971","0.0009","20.764","0.002","90","","113.601","0.001","90","","4647.4","0.8","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C38 H72 Cl6 N2 O2 P2 U -","- C38 H72 Cl6 N2 O2 P2 U -","- C152 H288 Cl24 N8 O8 P8 U4 -","4","0.5","","L. Jonas L Häller; Nikolas Kaltsoyannis; Mark J. Sarsfield; Iain May; Stéphanie M. Cornet; Michael P. Redmond; Madeleine Helliwell","A Structural and Theoretical Investigation of Equatorial cis and trans Uranyl Phosphinimine and Uranyl Phosphine Oxide Complexes UO2Cl2(Cy3PNH)2 and UO2Cl2(Cy3PO)2","Inorganic Chemistry","2007","46","","4868","4875","10.1021/ic062031m","","","0.71073","MoKα","","0.0309","0.0276","","","0.0669","0.0685","","","","","","1.054","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307533","43.387","0.007","8.8391","0.0014","25.714","0.004","90","","104.301","0.003","90","","9556","3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H68 Cl8 O4 P2 U -","- C30.4 H52.8 Cl6.4 O3.2 P1.6 U0.8 -","- C304 H528 Cl64 O32 P16 U8 -","10","1.25","","L. Jonas L Häller; Nikolas Kaltsoyannis; Mark J. Sarsfield; Iain May; Stéphanie M. Cornet; Michael P. Redmond; Madeleine Helliwell","A Structural and Theoretical Investigation of Equatorial cis and trans Uranyl Phosphinimine and Uranyl Phosphine Oxide Complexes UO2Cl2(Cy3PNH)2 and UO2Cl2(Cy3PO)2","Inorganic Chemistry","2007","46","","4868","4875","10.1021/ic062031m","","","0.71073","MoKα","","0.1263","0.0516","","","0.0899","0.105","","","","","","0.827","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307535","9.099","0.002","14.423","0.003","18.446","0.004","90","","92.03","0.03","90","","2419.2","0.9","293","2","293","2","","","","","","","synthesis","6","P 1 21/c 1","-P 2ybc","14","","[8-(2'-oxy-5'-phenylazo-phenyl)-3-methyl-1-phenyl-6-thiomethyl-1-one-4,5,7- triazaocta-1,3,5,7-tetraenato(-)-2'-olato(-)O,O',N4N7]oxovanadium(IV)","","- C25 H21 N5 O3 S V -","- C25 H21 N5 O3 S V -","- C100 H84 N20 O12 S4 V4 -","4","1","","Julieta Gradinaru; Alessandra Forni; Vadim Druta; Francesca Tessore; Sandro Zecchin; Silvio Quici; Nicolae Garbalau","Structural, Spectral, Electric-Field-Induced Second Harmonic, and Theoretical Study of Ni(II), Cu(II), Zn(II), and VO(II) Complexes with [N2O2] Unsymmetrical Schiff Bases of S-Methylisothiosemicarbazide Derivatives","Inorganic Chemistry","2007","46","","884","895","10.1021/ic062035r","","","0.71073","MoKα","","0.1061","0.0523","","","0.1123","0.1346","","","","","","0.995","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307536","9.312","0.003","18.545","0.017","20.892","0.012","90","","90","","90","","3608","4","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","[8-(2'-oxyphenyl)-3-methyl-1-phenyl-6-thiomethyl-1-one-4,5,7- triazaocta-1,3,5,7-tetraenato(-)-2'-olato(-)O,O',N4N7]copper(II)","","- C19 H17 Cu N3 O2 S -","- C19 H17 Cu N3 O2 S -","- C152 H136 Cu8 N24 O16 S8 -","8","1","","Julieta Gradinaru; Alessandra Forni; Vadim Druta; Francesca Tessore; Sandro Zecchin; Silvio Quici; Nicolae Garbalau","Structural, Spectral, Electric-Field-Induced Second Harmonic, and Theoretical Study of Ni(II), Cu(II), Zn(II), and VO(II) Complexes with [N2O2] Unsymmetrical Schiff Bases of S-Methylisothiosemicarbazide Derivatives","Inorganic Chemistry","2007","46","","884","895","10.1021/ic062035r","","","0.8","synchrotron","","0.0376","0.0306","","","0.0831","0.089","","","","","","1.092","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307537","5.041","0.001","8.841","0.002","23.718","0.005","87.17","0.03","86.79","0.03","79.57","0.03","1037.1","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[8-(2'-oxyphenyl)-3-methyl-1-phenyl-6-thiomethyl-1-one-4,5,7- triazaocta-1,3,5,7-tetraenato(-)-2'-olato(-)O,O',N4N7]zinc(II)","","- C20 H21 N3 O3 S Zn -","- C20 H21 N3 O3 S Zn -","- C40 H42 N6 O6 S2 Zn2 -","2","1","","Julieta Gradinaru; Alessandra Forni; Vadim Druta; Francesca Tessore; Sandro Zecchin; Silvio Quici; Nicolae Garbalau","Structural, Spectral, Electric-Field-Induced Second Harmonic, and Theoretical Study of Ni(II), Cu(II), Zn(II), and VO(II) Complexes with [N2O2] Unsymmetrical Schiff Bases of S-Methylisothiosemicarbazide Derivatives","Inorganic Chemistry","2007","46","","884","895","10.1021/ic062035r","","","0.71073","MoKα","","0.1257","0.0594","","","0.131","0.1612","","","","","","0.913","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307538","10.165","0.018","16.575","0.007","11.1","0.02","90","","94.35","0.02","90","","1865","5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[8-(2'-oxyphenyl)-3-methyl-1-phenyl-6-thiomethyl-1-one-4,5,7- triazaocta-1,3,5,7-tetraenato(-)-2'-olato(-)O,O',N4N7]oxovanadium(IV)","","- C19 H17 N3 O3 S V -","- C19 H17 N3 O3 S V -","- C76 H68 N12 O12 S4 V4 -","4","1","","Julieta Gradinaru; Alessandra Forni; Vadim Druta; Francesca Tessore; Sandro Zecchin; Silvio Quici; Nicolae Garbalau","Structural, Spectral, Electric-Field-Induced Second Harmonic, and Theoretical Study of Ni(II), Cu(II), Zn(II), and VO(II) Complexes with [N2O2] Unsymmetrical Schiff Bases of S-Methylisothiosemicarbazide Derivatives","Inorganic Chemistry","2007","46","","884","895","10.1021/ic062035r","","","0.7","synchrotron","","0.0436","0.039","","","0.1088","0.1134","","","","","","1.064","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307539","24.95","0.03","7.615","0.003","26.77","0.03","90","","90","","90","","5086","9","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","[8-(2'-oxy-5'-phenylazo-phenyl)-3-methyl-1-phenyl-6-thiomethyl-1-one-4,5,7- triazaocta-1,3,5,7-tetraenato(-)-2'-olato(-)O,O',N4N7]zinc(II)","","- C26 H25 N5 O3 S Zn -","- C26 H25 N5 O3 S Zn -","- C208 H200 N40 O24 S8 Zn8 -","8","1","","Julieta Gradinaru; Alessandra Forni; Vadim Druta; Francesca Tessore; Sandro Zecchin; Silvio Quici; Nicolae Garbalau","Structural, Spectral, Electric-Field-Induced Second Harmonic, and Theoretical Study of Ni(II), Cu(II), Zn(II), and VO(II) Complexes with [N2O2] Unsymmetrical Schiff Bases of S-Methylisothiosemicarbazide Derivatives","Inorganic Chemistry","2007","46","","884","895","10.1021/ic062035r","","","0.7","synchrotron","","0.0793","0.0672","","","0.1737","0.1795","","","","","","1.212","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307540","26.6572","0.0003","13.7512","0.0002","31.9934","0.0004","90","","102.663","0.001","90","","11442.5","0.3","150","1","150","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C57 H79 K N2 O6 P3 Re -","- C57 H79 K N2 O6 P3 Re -","- C456 H632 K8 N16 O48 P24 Re8 -","8","2","","Justin G. Hinman; Alan J. Lough; Robert H. Morris","Properties of the Polyhydride Anions [WH5(PMe2Ph)3]- and [ReH4(PMePh2)3]- and Periodic Trends in the Acidity of Polyhydride Complexes","Inorganic Chemistry","2007","46","","4392","4401","10.1021/ic062037b","","","0.71073","MoKα","","0.0951","0.0523","","","0.0871","0.098","","","","","","1.03","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307541","16.363","0.0002","16.432","0.0002","23.339","0.0003","71.361","0.0007","74.09","0.0008","69.965","0.0007","5489.98","0.12","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C104 H141 Cl7 Cu N4 O18 P -","- C103 H127 Cl7 Cu N4 O18 P -","- C206 H254 Cl14 Cu2 N8 O36 P2 -","2","1","","G. Izzet; X. Zeng; D. Over; B. Douziech; J. Zeitouny; M. Giorgi; I. Jabin; Y. Le Mest; O. Reinaud","First Insights into the Electronic Properties of a Cu(II) Center Embedded in the PN3 Cap of a Calix[6]arene-Based Ligand","Inorganic Chemistry","2007","46","","375","377","10.1021/ic0620384","","","0.71073","MoKα","","0.1023","0.0846","","","0.2284","0.2521","","","","","","1.032","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307542","9.5604","0.0006","23.3208","0.0014","11.4639","0.0007","90","","112.57","0.001","90","","2360.2","0.3","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H30 Ge4 O10 Ru4 -","- C46 H30 Ge4 O10 Ru4 -","- C92 H60 Ge8 O20 Ru8 -","2","0.5","","Richard D. Adams; Erin M. Boswell; Burjor Captain; Mitul A. Patel","Multiple Additions of Phenylgermanium Ligands to Tetraruthenium and Tetraosmium Carbonyl Cluster Complexes","Inorganic Chemistry","2007","46","","533","540","10.1021/ic062039w","","","0.71073","MoKα","","0.0804","0.0367","","","0.0808","0.1021","","","","","","1.031","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307543","12.8681","0.0005","21.9498","0.0009","23.1456","0.001","90","","90","","90","","6537.5","0.5","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C57 H40 Ge5 O9 Ru4 -","- C57 H40 Ge5 O9 Ru4 -","- C228 H160 Ge20 O36 Ru16 -","4","1","","Richard D. Adams; Erin M. Boswell; Burjor Captain; Mitul A. Patel","Multiple Additions of Phenylgermanium Ligands to Tetraruthenium and Tetraosmium Carbonyl Cluster Complexes","Inorganic Chemistry","2007","46","","533","540","10.1021/ic062039w","","","0.71073","MoKα","","0.0468","0.0352","","","0.1002","0.1075","","","","","","1.106","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307544","11.7557","0.0007","25.424","0.0016","24.7493","0.0016","90","","90","","90","","7397","0.8","100","2","100","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C76 H70 Ge6 O10 Ru4 -","- C76 H70 Ge6 O10 Ru4 -","- C304 H280 Ge24 O40 Ru16 -","4","0.5","","Richard D. Adams; Erin M. Boswell; Burjor Captain; Mitul A. Patel","Multiple Additions of Phenylgermanium Ligands to Tetraruthenium and Tetraosmium Carbonyl Cluster Complexes","Inorganic Chemistry","2007","46","","533","540","10.1021/ic062039w","","","0.71073","MoKα","","0.0298","0.0258","","","0.0579","0.0597","","","","","","1.025","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307545","14.1902","0.0006","17.1633","0.0007","18.0443","0.0007","104.846","0.001","106.665","0.001","112.665","0.001","3534.9","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H48 Ge5 O9 Os4 -","- C64 H48 Ge5 O9 Os4 -","- C128 H96 Ge10 O18 Os8 -","2","1","","Richard D. Adams; Erin M. Boswell; Burjor Captain; Mitul A. Patel","Multiple Additions of Phenylgermanium Ligands to Tetraruthenium and Tetraosmium Carbonyl Cluster Complexes","Inorganic Chemistry","2007","46","","533","540","10.1021/ic062039w","","","0.71073","MoKα","","0.034","0.0288","","","0.0939","0.0968","","","","","","1.059","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307546","15.79","0.0006","17.9143","0.0007","25.2968","0.001","90","","91.869","0.001","90","","7151.8","0.5","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C69 H52.5 Ge6 O8.25 Os4 -","- C69 H52.5 Ge6 O8.25 Os4 -","- C276 H210 Ge24 O33 Os16 -","4","1","","Richard D. Adams; Erin M. Boswell; Burjor Captain; Mitul A. Patel","Multiple Additions of Phenylgermanium Ligands to Tetraruthenium and Tetraosmium Carbonyl Cluster Complexes","Inorganic Chemistry","2007","46","","533","540","10.1021/ic062039w","","","0.71073","MoKα","","0.0474","0.0309","","","0.0855","0.0981","","","","","","1.114","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307547","21.398","0.003","8.057","0.004","13.33","0.004","90","","90","","90","","2298.1","1.4","173","2","173","2","","","","","","","","6","P m m a","-P 2a 2a","51","","","","- C12.5 H18 Cl7 Mo1.5 N2.5 O3 -","- C12.5 H18 Cl7 Mo1.5 N2.5 O3 -","- C50 H72 Cl28 Mo6 N10 O12 -","4","0.5","","Farideh Jalilehvand; Vicky Mah; Bonnie O. Leung; Daniel Ross; Masood Parvez; Ricardo F. Aroca","Structural Characterization of Molybdenum(V) Species in Aqueous HCl Solutions","Inorganic Chemistry","2007","46","","4430","4445","10.1021/ic062047c","","","0.71073","MoKα","","0.056","0.036","","","0.086","0.098","","","","","","0.99","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307548","3.2129","0.0004","3.2129","0.0004","9.3901","0.0016","90","","90","","120","","83.95","0.02","293","2","293","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- C Co N2 -","- C Co N2 -","- C2 Co2 N4 -","2","0.0833333","","Manuel Krott; Xiaohui Liu; Boniface P. T. Fokwa; Manfred Speldrich; Heiko Lueken; Richard Dronskowski","Synthesis, Crystal-Structure Determination and Magnetic Properties of Two New Transition-Metal Carbodiimides: CoNCN and NiNCN","Inorganic Chemistry","2007","46","","2204","2207","10.1021/ic062051o","","","0.71073","MoKα","","0.0214","0.0158","","","0.0374","0.0389","","","","","","1.231","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307549","3.1533","0.0008","3.1533","0.0008","9.272","0.003","90","","90","","120","","79.84","0.04","293","2","293","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- C N2 Ni -","- C N2 Ni -","- C2 N4 Ni2 -","2","0.0833333","","Manuel Krott; Xiaohui Liu; Boniface P. T. Fokwa; Manfred Speldrich; Heiko Lueken; Richard Dronskowski","Synthesis, Crystal-Structure Determination and Magnetic Properties of Two New Transition-Metal Carbodiimides: CoNCN and NiNCN","Inorganic Chemistry","2007","46","","2204","2207","10.1021/ic062051o","","","0.71073","MoKα","","0.1397","0.1045","","","0.1543","0.1638","","","","","","1.441","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307550","10.6093","0.001","16.035","0.0014","16.561","0.0017","90.382","0.011","92.563","0.012","96.208","0.011","2797.8","0.5","123","","123","1","","","","","","","see text","7","P 1","P 1","1","","","","- C80 H120 As8 Cl8 Cu8 Mo8 S12 -","- C80 H120 As8 Cl8 Cu8 Mo8 S12 -","- C80 H120 As8 Cl8 Cu8 Mo8 S12 -","1","1","","Michael Pronold; Manfred Scheer; Joachim Wachter; Manfred Zabel","Investigation into the Formation of Supramolecular Compounds from Mixed As/S-Ligand Complexes [(Cp*Mo)2As2S3] (Cp* = C5Me5) and Copper Halides","Inorganic Chemistry","2007","46","","1396","1400","10.1021/ic062052g","","","0.71073","MoKα","","0.0568","0.0361","","","0.0758","0.0792","","","","","","0.815","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307551","10.5935","0.0012","16.3714","0.0018","16.6376","0.0018","91.103","0.013","92.323","0.014","97.429","0.013","2858","0.6","293","","123","1","","","","","","","see text","7","P 1","P 1","1","","","","- C80 H120 As8 Br8 Cu8 Mo8 S12 -","- C80 H120 As8 Br8 Cu8 Mo8 S12 -","- C80 H120 As8 Br8 Cu8 Mo8 S12 -","1","1","","Michael Pronold; Manfred Scheer; Joachim Wachter; Manfred Zabel","Investigation into the Formation of Supramolecular Compounds from Mixed As/S-Ligand Complexes [(Cp*Mo)2As2S3] (Cp* = C5Me5) and Copper Halides","Inorganic Chemistry","2007","46","","1396","1400","10.1021/ic062052g","","","0.71073","MoKα","","0.0545","0.0369","","","0.0815","0.0847","","","","","","0.848","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307552","15.6076","0.0013","16.0505","0.0013","21.119","0.002","100.382","0.011","93.589","0.011","118.951","0.009","4484.1","0.9","123","","123","1","","","","","","","see text","7","P -1","-P 1","2","","","","- C60 H90 As6 Cu7 I7 Mo6 S9 -","- C60 H90 As6 Cu7 I7 Mo6 S9 -","- C120 H180 As12 Cu14 I14 Mo12 S18 -","2","1","","Michael Pronold; Manfred Scheer; Joachim Wachter; Manfred Zabel","Investigation into the Formation of Supramolecular Compounds from Mixed As/S-Ligand Complexes [(Cp*Mo)2As2S3] (Cp* = C5Me5) and Copper Halides","Inorganic Chemistry","2007","46","","1396","1400","10.1021/ic062052g","","","0.71073","MoKα","","0.0826","0.07","","","0.1923","0.2008","","","","","","1.051","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307553","11.0951","0.0013","12.6629","0.0017","15.319","0.002","94.714","0.005","92.826","0.005","106.954","0.004","2045.7","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H62 N2 Si2 Zr2 -","- C40 H62 N2 Si2 Zr2 -","- C80 H124 N4 Si4 Zr4 -","2","1","","Tamara E. Hanna; Ivan Keresztes; Emil Lobkovsky; Paul J. Chirik","Diazene Dehydrogenation Follows H2 Addition to Coordinated Dinitrogen in anansa-Zirconocene Complex","Inorganic Chemistry","2007","46","","1675","1683","10.1021/ic0620539","","","0.71073","MoKα","","0.0421","0.0272","","","0.0632","0.0676","","","","","","1.04","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307554","11.2903","0.0006","26.3223","0.0015","13.6173","0.0008","90","","96.767","0.001","90","","4018.7","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H60 N2 Si2 Zr2 -","- C40 H60 N2 Si2 Zr2 -","- C160 H240 N8 Si8 Zr8 -","4","1","","Tamara E. Hanna; Ivan Keresztes; Emil Lobkovsky; Paul J. Chirik","Diazene Dehydrogenation Follows H2 Addition to Coordinated Dinitrogen in anansa-Zirconocene Complex","Inorganic Chemistry","2007","46","","1675","1683","10.1021/ic0620539","","","0.71073","MoKα","","0.0712","0.0478","","","0.1194","0.1273","","","","","","1.087","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307555","14.8185","0.0005","12.8243","0.0005","19.6422","0.0008","90","","96.251","0.001","90","","3710.5","0.2","143","1","143","1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C32 H44 Cl3 N3 O4 Pt S Si2 -","- C32 H44 Cl3 N3 O4 Pt S Si2 -","- C128 H176 Cl12 N12 O16 Pt4 S4 Si8 -","4","1","","Douglas S. Williams; Patrick J. Carroll; Eric Meggers","Platinum Complex as a Nanomolar Protein Kinase Inhibitor","Inorganic Chemistry","2007","46","","2944","2946","10.1021/ic062055t","","","0.71069","MoKα","","0.0346","0.0274","","","0.0667","0.0693","","","","","","1.022","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307556","17.1297","0.0005","43.1511","0.0011","14.8137","0.0004","90","","112.676","0.001","90","","10103.4","0.5","143","1","143","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C98 H111 Cl3 N12 O14 Pt3 Si4 -","- C93 H101 Cl3 N12 O12 Pt3 Si4 -","- C372 H404 Cl12 N48 O48 Pt12 Si16 -","4","1","","Douglas S. Williams; Patrick J. Carroll; Eric Meggers","Platinum Complex as a Nanomolar Protein Kinase Inhibitor","Inorganic Chemistry","2007","46","","2944","2946","10.1021/ic062055t","","","0.71073","MoKα","","0.0759","0.0642","","","0.1418","0.1469","","","","","","1.161","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307557","14.907","0.006","13.736","0.006","21.759","0.009","90","","92.844","0.009","90","","4450","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","([Bis-(3,5-di-tert-butyl-2-hydroxy-benzyl)-amino]-acetato) (dipyrido[3,2-d:2',3'-f]quinoxaline)iron(III) acetonitrile solvate","","- C48 H57 Fe N6 O4 -","- C48 H54 Fe N6 O4 -","- C192 H216 Fe4 N24 O16 -","4","1","","Mithun Roy; Sounik Saha; Ashis K. Patra; Munirathinam Nethaji; Akhil R. Chakravarty","Ternary Iron(III) Complex Showing Photocleavage of DNA in the Photodynamic Therapy Window","Inorganic Chemistry","2007","46","","4368","4370","10.1021/ic062056l","","","0.71073","MoKα","","0.1635","0.0927","","","0.1989","0.2337","","","","","","1.042","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307558","13.496","0.003","18.139","0.004","18.576","0.004","80.05","0.03","81.38","0.03","82.52","0.03","4403","1.8","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C94 H148 Ga2 N6 Ni O3 -","- C94 H148 Ga2 N6 Ni O3 -","- C188 H296 Ga4 N12 Ni2 O6 -","2","1","","Shaun P. Green; Cameron Jones; Andreas Stasch","Homo- and Heteroleptic Complexes of Four-Membered Group 13 Metal(I) N-Heterocyclic Carbene Analogues with Group 10 Metal(0) Fragments","Inorganic Chemistry","2007","46","","11","13","10.1021/ic062057d","","","0.71073","MoKα","","0.0904","0.0663","","","0.1629","0.1769","","","","","","1.035","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307559","14.172","0.003","17.635","0.004","22.36","0.005","80.33","0.03","88.13","0.03","68.81","0.03","5134","2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C106 H150 Ga2 N6 P2 Pt -","- C106 H150 Ga2 N6 P2 Pt -","- C212 H300 Ga4 N12 P4 Pt2 -","2","1","","Shaun P. Green; Cameron Jones; Andreas Stasch","Homo- and Heteroleptic Complexes of Four-Membered Group 13 Metal(I) N-Heterocyclic Carbene Analogues with Group 10 Metal(0) Fragments","Inorganic Chemistry","2007","46","","11","13","10.1021/ic062057d","","","0.71073","MoKα","","0.1359","0.0721","","","0.1451","0.1684","","","","","","1.018","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307560","15.69","0.003","18.532","0.004","19.397","0.004","102.36","0.03","98.51","0.03","106.69","0.03","5143","2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C103 H143 In2 N6 P2 Pt -","- C103 H143 In2 N6 P2 Pt -","- C206 H286 In4 N12 P4 Pt2 -","2","1","","Shaun P. Green; Cameron Jones; Andreas Stasch","Homo- and Heteroleptic Complexes of Four-Membered Group 13 Metal(I) N-Heterocyclic Carbene Analogues with Group 10 Metal(0) Fragments","Inorganic Chemistry","2007","46","","11","13","10.1021/ic062057d","","","0.71073","MoKα","","0.086","0.0569","","","0.1307","0.1447","","","","","","1.058","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307561","19.329","0.004","33.357","0.007","19.333","0.004","90","","96.36","0.03","90","","12388","5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C132 H192 Ga3 N9 Pt -","- C132 H192 Ga3 N9 Pt -","- C528 H768 Ga12 N36 Pt4 -","4","1","","Shaun P. Green; Cameron Jones; Andreas Stasch","Homo- and Heteroleptic Complexes of Four-Membered Group 13 Metal(I) N-Heterocyclic Carbene Analogues with Group 10 Metal(0) Fragments","Inorganic Chemistry","2007","46","","11","13","10.1021/ic062057d","","","0.71073","MoKα","","0.0437","0.0345","","","0.0761","0.0795","","","","","","1.057","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307562","3.797","0.004","10.769","0.007","11.312","0.006","90","","90","","90","","462.5","0.6","150","2","150","2","","","","","","","","5","I 2 2 2","I 2 2","23","","","","- C10 H8 F3 N2 V -","- C10 H8 F3 N2 V -","- C20 H16 F6 N4 V2 -","2","0.25","","David W. Aldous; Nicholas F. Stephens; Philip Lightfoot","Hydrothermal Vanadium Fluoride Chemistry: Four New V3+ Chain Structures","Inorganic Chemistry","2007","46","","3996","4001","10.1021/ic062061p","","","0.6709","synchrotron","","0.0498","0.0379","","","0.0848","0.0907","","","","","","0.922","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307563","6.315","0.002","7.636","0.002","10.921","0.004","90","","90","","90","","526.6","0.3","93","2","93","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- F5 H8 N2 V -","- F5 H8 N2 V -","- F20 H32 N8 V4 -","4","0.5","","David W. Aldous; Nicholas F. Stephens; Philip Lightfoot","Hydrothermal Vanadium Fluoride Chemistry: Four New V3+ Chain Structures","Inorganic Chemistry","2007","46","","3996","4001","10.1021/ic062061p","","","0.7107","MoKα","","0.0533","0.0505","","","0.1384","0.1398","","","","","","1.277","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307564","12.837","0.002","12.837","0.002","7.9502","0.0017","90","","90","","90","","1310.1","0.4","93","2","93","2","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- C2 H10 F5 N2 V -","- C2 H10 F5 N2 V -","- C16 H80 F40 N16 V8 -","8","0.5","","David W. Aldous; Nicholas F. Stephens; Philip Lightfoot","Hydrothermal Vanadium Fluoride Chemistry: Four New V3+ Chain Structures","Inorganic Chemistry","2007","46","","3996","4001","10.1021/ic062061p","","","0.71073","MoKα","","0.0289","0.0286","","","0.0805","0.0807","","","","","","1.189","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307565","11.447","0.003","5.91","0.002","13.58","0.006","90","","91.54","0.02","90","","918.4","0.6","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H14 F5 N2 O V -","- C4 H12 F5 N2 O V -","- C16 H48 F20 N8 O4 V4 -","4","1","","David W. Aldous; Nicholas F. Stephens; Philip Lightfoot","Hydrothermal Vanadium Fluoride Chemistry: Four New V3+ Chain Structures","Inorganic Chemistry","2007","46","","3996","4001","10.1021/ic062061p","","","0.8462","Synchrotron","","0.0673","0.0562","","","0.1305","0.1393","","","","","","1.005","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307566","14.0448","0.0004","9.2259","0.0003","17.0103","0.0007","90","","90","","90","","2204.13","0.13","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C26 H14 Fe N12 -","- C26 H14 Fe N12 -","- C104 H56 Fe4 N48 -","4","0.5","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.1039","0.0373","","","0.0768","0.0905","","","","","","0.919","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307567","13.8675","0.0003","9.3721","0.0002","16.4788","0.0005","90","","90","","90","","2141.71","0.09","180","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C26 H14 Fe N12 -","- C26 H14 Fe N12 -","- C104 H56 Fe4 N48 -","4","0.5","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.0512","0.0315","","","0.0858","0.0914","","","","","","1.063","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307568","16.9214","0.0005","18.1578","0.0004","8.0538","0.0002","90","","102.672","0.0008","90","","2414.3","0.11","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H18 Fe N12 O -","- C27 H14 Fe N12 O -","- C108 H56 Fe4 N48 O4 -","4","1","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.1102","0.049","","","0.1257","0.1418","","","","","","0.965","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307569","19.7302","0.0004","10.949","0.0002","17.1696","0.0003","90","","113.856","0.0009","90","","3392.18","0.11","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C29 H24 Cl2 Fe N12 O9 -","- C29 H20 Cl2 Fe N12 O9 -","- C116 H80 Cl8 Fe4 N48 O36 -","4","1","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.1395","0.0603","","","0.1539","0.1796","","","","","","1.01","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307570","10.9217","0.0003","12.2206","0.0003","14.9706","0.0007","80.399","0.001","75.572","0.001","67.995","0.001","1788.13","0.11","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H27 B2 F8 Fe N13 O -","- C31 H20 B2 F8 Fe N13 O -","- C62 H40 B4 F16 Fe2 N26 O2 -","2","1","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.2291","0.0739","","","0.1597","0.1983","","","","","","0.9","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307571","10.7509","0.0003","10.8452","0.0003","15.0267","0.0005","75.648","0.002","84.107","0.002","83.302","0.001","1680.82","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H26 Cl2 Fe N12 O9 -","- C30 H24 Cl2 Fe N12 O9 -","- C60 H48 Cl4 Fe2 N24 O18 -","2","1","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.1151","0.0541","","","0.1362","0.155","","","","","","0.958","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307572","10.7053","0.0003","10.9912","0.0003","14.9959","0.0005","76.15","0.001","84.2","0.002","83.298","0.002","1696.57","0.09","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H26 B2 F8 Fe N12 O -","- C30 H24 B1.348 F8 Fe N12 O -","- C60 H48 B2.696 F16 Fe2 N24 O2 -","2","1","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.1713","0.0588","","","0.129","0.1563","","","","","","0.905","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307573","23.7949","0.0006","12.3765","0.0004","18.5437","0.0006","90","","125.894","0.002","90","","4424","0.3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35 H36 B2 F8 Fe N12 O -","- C35 H32 B2 F8 Fe N12 O -","- C140 H128 B8 F32 Fe4 N48 O4 -","4","0.5","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.1242","0.0843","","","0.2611","0.2851","","","","","","1.05","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307574","17.5989","0.0004","15.009","0.0003","17.5184","0.0004","90","","117.255","0.001","90","","4113.6","0.16","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H38 Cl2 Fe N12 O9 -","- C36 H36 Cl2 Fe N12 O9 -","- C144 H144 Cl8 Fe4 N48 O36 -","4","1","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.1443","0.0518","","","0.1303","0.1585","","","","","","0.939","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307575","17.7559","0.0006","14.8845","0.0004","17.4731","0.0005","90","","117.69","0.001","90","","4089.1","0.2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H38 B2 F8 Fe N12 O -","- C36 H36 B2 F8 Fe N12 O -","- C144 H144 B8 F32 Fe4 N48 O4 -","4","1","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.293","0.0797","","","0.1308","0.1746","","","","","","0.88","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307576","23.5373","0.0006","12.1628","0.0005","18.6877","0.0006","90","","126.857","0.002","90","","4280.6","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H40 Cl2 Fe N12 O8 -","- C38 H40 Cl2 Fe N12 O8 -","- C152 H160 Cl8 Fe4 N48 O32 -","4","0.5","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.1293","0.0499","","","0.1158","0.1376","","","","","","0.918","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307577","23.2983","0.0006","12.0762","0.0004","18.6481","0.0006","90","","126.759","0.002","90","","4203.5","0.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H40 B2 F8 Fe N12 -","- C38 H40 B2 F8 Fe N12 -","- C152 H160 B8 F32 Fe4 N48 -","4","0.5","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.1174","0.0511","","","0.1046","0.1217","","","","","","0.913","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307578","23.7115","0.0004","12.4063","0.0003","18.596","0.0006","90","","125.8","0.001","90","","4436.9","0.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H44 Cl2 Fe N12 O8 -","- C40 H44 Cl2 Fe N12 O8 -","- C160 H176 Cl8 Fe4 N48 O32 -","4","0.5","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.1718","0.0722","","","0.1882","0.2233","","","","","","0.943","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307579","23.4991","0.0004","12.3063","0.0003","18.5483","0.0007","90","","125.621","0.002","90","","4360.3","0.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H44 B2 F8 Fe N12 -","- C40 H44 B2 F8 Fe N12 -","- C160 H176 B8 F32 Fe4 N48 -","4","0.5","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.1849","0.0802","","","0.205","0.2409","","","","","","0.952","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307580","12.6873","0.0003","10.3056","0.0002","27.0758","0.0009","102.199","0.001","89.681","0.001","110.412","0.001","3233.98","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H80 Cl2 Fe N12 O8 -","- C58 H80 Cl2 Fe N12 O8 -","- C116 H160 Cl4 Fe2 N24 O16 -","2","1","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.2555","0.0813","","","0.1843","0.2367","","","","","","0.898","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307581","12.5561","0.0004","19.7989","0.0009","27.6441","0.0014","105.5","0.001","94.077","0.002","106.07","0.001","6284.9","0.5","205","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H80 Cl2 Fe N12 O8 -","- C58 H80 Cl2 Fe N12 O8 -","- C232 H320 Cl8 Fe4 N48 O32 -","4","2","","Wen Zhang; Fei Zhao; Tao Liu; Mei Yuan; Zhe-Ming Wang; Song Gao","Spin Crossover in a Series of Iron(II) Complexes of 2-(2-Alkyl-2H-tetrazol-5-yl)-1,10-phenanthroline: Effects of Alkyl Side Chain, Solvent, and Anion","Inorganic Chemistry","2007","46","","2541","2555","10.1021/ic062062h","","","0.71073","MoKα","","0.2825","0.0668","","","0.1173","0.1618","","","","","","0.871","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307582","13.0582","0.0005","3.9198","0.0002","7.3298","0.0003","90","","104.562","0.001","90","","363.13","0.03","294","2","294","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Eu K O3 Pd -","- Eu K O3 Pd -","- Eu4 K4 O12 Pd4 -","4","0.5","","Samuel J. Mugavero; Mark D. Smith; Hans-Conrad zur Loye","Crystal Growth and Structural Characterization of the New Ordered Palladates LnKPdO3 (Ln = La, Pr, Nd, Sm-Gd) and the Isostructural, Partially Cu-Substituted Palladate PrK(Cu0.14Pd0.86)O3","Inorganic Chemistry","2007","46","","3116","3122","10.1021/ic062066m","","","0.71073","MoKα","","0.0248","0.0239","","","0.0602","0.0607","","","","","","1.148","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307583","13.0212","0.0007","3.9096","0.0002","7.3209","0.0004","90","","104.427","0.002","90","","360.94","0.03","294","2","294","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Gd K O3 Pd -","- Gd K O3 Pd -","- Gd4 K4 O12 Pd4 -","4","0.5","","Samuel J. Mugavero; Mark D. Smith; Hans-Conrad zur Loye","Crystal Growth and Structural Characterization of the New Ordered Palladates LnKPdO3 (Ln = La, Pr, Nd, Sm-Gd) and the Isostructural, Partially Cu-Substituted Palladate PrK(Cu0.14Pd0.86)O3","Inorganic Chemistry","2007","46","","3116","3122","10.1021/ic062066m","","","0.71073","MoKα","","0.024","0.022","","","0.0492","0.0501","","","","","","1.052","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307584","13.4232","0.0008","3.984","0.0002","7.4424","0.0004","90","","105.644","0.002","90","","383.26","0.04","294","2","294","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- K La O3 Pd -","- K La O3 Pd -","- K4 La4 O12 Pd4 -","4","0.5","","Samuel J. Mugavero; Mark D. Smith; Hans-Conrad zur Loye","Crystal Growth and Structural Characterization of the New Ordered Palladates LnKPdO3 (Ln = La, Pr, Nd, Sm-Gd) and the Isostructural, Partially Cu-Substituted Palladate PrK(Cu0.14Pd0.86)O3","Inorganic Chemistry","2007","46","","3116","3122","10.1021/ic062066m","","","0.71073","MoKα","","0.0324","0.0288","","","0.0677","0.0697","","","","","","1.1","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307585","13.2053","0.0006","3.9444","0.0002","7.3711","0.0004","90","","104.97","0.002","90","","370.91","0.03","294","2","294","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- K Nd O3 Pd -","- K Nd O3 Pd -","- K4 Nd4 O12 Pd4 -","4","0.5","","Samuel J. Mugavero; Mark D. Smith; Hans-Conrad zur Loye","Crystal Growth and Structural Characterization of the New Ordered Palladates LnKPdO3 (Ln = La, Pr, Nd, Sm-Gd) and the Isostructural, Partially Cu-Substituted Palladate PrK(Cu0.14Pd0.86)O3","Inorganic Chemistry","2007","46","","3116","3122","10.1021/ic062066m","","","0.71073","MoKα","","0.0291","0.0246","","","0.0549","0.0566","","","","","","1.076","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307586","13.2512","0.0007","3.9488","0.0002","7.3773","0.0004","90","","105.122","0.002","90","","372.66","0.03","294","2","294","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- Cu0.14 K O3 Pd0.86 Pr -","- Cu0.137 K O3 Pd0.863 Pr -","- Cu0.548 K4 O12 Pd3.452 Pr4 -","4","0.5","","Samuel J. Mugavero; Mark D. Smith; Hans-Conrad zur Loye","Crystal Growth and Structural Characterization of the New Ordered Palladates LnKPdO3 (Ln = La, Pr, Nd, Sm-Gd) and the Isostructural, Partially Cu-Substituted Palladate PrK(Cu0.14Pd0.86)O3","Inorganic Chemistry","2007","46","","3116","3122","10.1021/ic062066m","","","0.71073","MoKα","","0.0306","0.0261","","","0.0656","0.0682","","","","","","1.083","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307587","13.262","0.0005","3.9576","0.0002","7.3865","0.0003","90","","105.158","0.001","90","","374.2","0.03","294","2","294","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- K O3 Pd Pr -","- K O3 Pd Pr -","- K4 O12 Pd4 Pr4 -","4","0.5","","Samuel J. Mugavero; Mark D. Smith; Hans-Conrad zur Loye","Crystal Growth and Structural Characterization of the New Ordered Palladates LnKPdO3 (Ln = La, Pr, Nd, Sm-Gd) and the Isostructural, Partially Cu-Substituted Palladate PrK(Cu0.14Pd0.86)O3","Inorganic Chemistry","2007","46","","3116","3122","10.1021/ic062066m","","","0.71073","MoKα","","0.0165","0.0156","","","0.0377","0.0383","","","","","","1.086","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307588","13.1015","0.0007","3.9281","0.0002","7.34","0.0004","90","","104.684","0.002","90","","365.41","0.03","294","2","294","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- K O3 Pd Sm -","- K O3 Pd Sm -","- K4 O12 Pd4 Sm4 -","4","0.5","","Samuel J. Mugavero; Mark D. Smith; Hans-Conrad zur Loye","Crystal Growth and Structural Characterization of the New Ordered Palladates LnKPdO3 (Ln = La, Pr, Nd, Sm-Gd) and the Isostructural, Partially Cu-Substituted Palladate PrK(Cu0.14Pd0.86)O3","Inorganic Chemistry","2007","46","","3116","3122","10.1021/ic062066m","","","0.71073","MoKα","","0.0428","0.0335","","","0.0664","0.0697","","","","","","1.02","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307589","25.2744","0.0009","18.0781","0.0007","25.9777","0.0009","90","","109.794","0.002","90","","11168.3","0.7","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Comound DL151","","","- C52 H118 N6 O60 S2 W18 -","- C52 H112 N6 O60 S2 W18 -","- C208 H448 N24 O240 S8 W72 -","4","1","","Nigel Fay; Alan M. Bond; Carole Baffert; John F. Boas; John R. Pilbrow; De-Liang Long; Leroy Cronin","Structural, Electrochemical, and Spectroscopic Characterization of a Redox Pair of Sulfite-Based Polyoxotungstates: α-[W18O54(SO3)2]4- and α-[W18O54(SO3)2]5-","Inorganic Chemistry","2007","46","","3502","3510","10.1021/ic062067e","","","0.71073","MoKα","","0.0986","0.0479","","","0.0875","0.1067","","","","","","1.028","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307590","16.4863","0.0012","22.0781","0.0015","33.587","0.002","90","","98.137","0.004","90","","12102.1","1.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Compound DL152","","","- C64 H146 N7 O60 S2 W18 -","- C58.2 H103.9 N5.6 O60 S2 W18 -","- C232.8 H415.6 N22.4 O240 S8 W72 -","4","1","","Nigel Fay; Alan M. Bond; Carole Baffert; John F. Boas; John R. Pilbrow; De-Liang Long; Leroy Cronin","Structural, Electrochemical, and Spectroscopic Characterization of a Redox Pair of Sulfite-Based Polyoxotungstates: α-[W18O54(SO3)2]4- and α-[W18O54(SO3)2]5-","Inorganic Chemistry","2007","46","","3502","3510","10.1021/ic062067e","","","0.71073","MoKα","","0.1012","0.0716","","","0.1428","0.1594","","","","","","1.164","","","","has coordinates,has disorder","179113","2020-10-21","18:00:00",""
"4307591","8.548","0.002","10.067","0.002","33.777","0.008","90","","90.1","0.02","90","","2906.6","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H36 N2 O2 S2 -","- C33 H36 N2 O2 S2 -","- C132 H144 N8 O8 S8 -","4","1","","Beatriz García-Acosta; Ramón Martínez-Máñez; Félix Sancenón; Juan Soto; Knut Rurack; Monika Spieles; Eduardo García-Breijo; Luis Gil","Ditopic N-Crowned 4-(p-Aminophenyl)-2,6-diphenylpyridines: Implications of Macrocycle Topology on the Spectroscopic Properties, Cation Complexation, and Differential Anion Responses","Inorganic Chemistry","2007","46","","3123","3135","10.1021/ic062069z","","","0.71073","MoKα","","0.068","0.0429","","0.227","0.1026","","","","0.954","0.907","0.907","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307592","8.3347","0.0007","7.6594","0.0006","20.8988","0.0017","90","","90","","90","","1334.15","0.19","193","2","193","2","","","","","","","","3","P b c n","-P 2n 2ab","60","uranyl iodate hydrate Iodic acid","","","- I4 O15 U -","- I4 O15 U -","- I16 O60 U4 -","4","0.5","","Jie Ling; Thomas E. Albrecht-Schmitt","Intercalation of Iodic Acid into the Layered Uranyl Iodate, UO2(IO3)2(H2O)","Inorganic Chemistry","2007","46","","346","347","10.1021/ic062072i","","","0.71073","MoKα","","0.0265","0.0245","","","0.062","0.0627","","","","","","1.216","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307593","20.2713","0.0013","4.8809","0.0003","14.0473","0.0009","90","","132.807","0.001","90","","1019.67","0.11","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Potassium Selenate Diiodic acid","","","- H2 I2 K2 O10 Se -","- H2 I2 K2 O10 Se -","- H8 I8 K8 O40 Se4 -","4","0.5","","Jie Ling; Thomas E. Albrecht-Schmitt","Intercalation of Iodic Acid into the Layered Uranyl Iodate, UO2(IO3)2(H2O)","Inorganic Chemistry","2007","46","","346","347","10.1021/ic062072i","","","0.71073","MoKα","","0.0224","0.0217","","","0.0534","0.0539","","","","","","1.166","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307594","10.502","0.0003","17.7237","0.0005","19.9453","0.0005","98.608","0.002","94.671","0.002","91.647","0.002","3655.34","0.17","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C85.5 H66 Mn3 N7.5 O14.25 -","- C85.5 H65.5 Mn3 N7.5 O14.25 -","- C171 H131 Mn6 N15 O28.5 -","2","1","","Guillem Aromí; Patrick Gamez; J. Krzystek; Huub Kooijman; Anthony L. Spek; Elizabeth J. MacLean; Simon J. Teat; Harriott Nowell","Novel Linear Transition Metal Clusters of a Heptadentate Bis-β-diketone Ligand","Inorganic Chemistry","2007","46","","2519","2529","10.1021/ic062075v","","","0.6894","synchrotron","","0.0751","0.0554","","","0.146","0.1583","","","","","","1.036","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307595","13.9229","0.0015","8.5263","0.0012","32.19","0.005","90","","90","","90","","3821.3","0.9","150","","150","","","","","","","","see text","3","P b c n","-P 2n 2ab","60","","","","- C24 H18 O7 -","- C24 H18 O7 -","- C192 H144 O56 -","8","1","","Guillem Aromí; Patrick Gamez; J. Krzystek; Huub Kooijman; Anthony L. Spek; Elizabeth J. MacLean; Simon J. Teat; Harriott Nowell","Novel Linear Transition Metal Clusters of a Heptadentate Bis-β-diketone Ligand","Inorganic Chemistry","2007","46","","2519","2529","10.1021/ic062075v","","x-ray","0.71073","MoKα","","0.0826","0.0468","","","0.1087","0.1254","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307596","8.929","0.002","11.205","0.002","17.579","0.006","103.625","0.015","90.17","0.015","106.18","0.02","1637.1","0.8","150","","150","","","","","","","","see text","5","P -1","-P 1","2","","","","- C78 H62 N6 Ni2 O14 -","- C78 H62 N6 Ni2 O14 -","- C78 H62 N6 Ni2 O14 -","1","0.5","","Guillem Aromí; Patrick Gamez; J. Krzystek; Huub Kooijman; Anthony L. Spek; Elizabeth J. MacLean; Simon J. Teat; Harriott Nowell","Novel Linear Transition Metal Clusters of a Heptadentate Bis-β-diketone Ligand","Inorganic Chemistry","2007","46","","2519","2529","10.1021/ic062075v","","x-ray","0.71073","MoKα","","0.0619","0.0383","","","0.08","0.0877","","","","","","1.025","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307597","12.932","0.002","9.0376","0.0017","28.463","0.005","90","","92.615","0.002","90","","3323.1","1","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H28 Co N3 O7 -","- C39 H28 Co N3 O7 -","- C156 H112 Co4 N12 O28 -","4","1","","Guillem Aromí; Patrick Gamez; J. Krzystek; Huub Kooijman; Anthony L. Spek; Elizabeth J. MacLean; Simon J. Teat; Harriott Nowell","Novel Linear Transition Metal Clusters of a Heptadentate Bis-β-diketone Ligand","Inorganic Chemistry","2007","46","","2519","2529","10.1021/ic062075v","","","0.8464","synchrotron","","0.0656","0.0486","","","0.114","0.1246","","","","","","1.04","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307598","10.8441","0.001","18.591","0.002","20.904","0.003","85.172","0.015","77.893","0.015","87.872","0.015","4105.1","0.9","150","","150","","","","","","","","see text","5","P -1","-P 1","2","","","","- C76 H61 Mn4 N5 O18 -","- C77 H61 Mn4 N5 O18 -","- C154 H122 Mn8 N10 O36 -","2","1","","Guillem Aromí; Patrick Gamez; J. Krzystek; Huub Kooijman; Anthony L. Spek; Elizabeth J. MacLean; Simon J. Teat; Harriott Nowell","Novel Linear Transition Metal Clusters of a Heptadentate Bis-β-diketone Ligand","Inorganic Chemistry","2007","46","","2519","2529","10.1021/ic062075v","","x-ray","0.71073","MoKα","","0.0525","0.0407","","","0.1154","0.1203","","","","","","1.074","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307599","15.8846","0.0011","15.8321","0.0011","14.0294","0.001","90","","113.446","0.002","90","","3236.9","0.4","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C64 H64.56 Mn4 N4 O22.28 -","- C64 H64 Mn4 N4 O22.284 -","- C128 H128 Mn8 N8 O44.568 -","2","0.5","","Guillem Aromí; Patrick Gamez; J. Krzystek; Huub Kooijman; Anthony L. Spek; Elizabeth J. MacLean; Simon J. Teat; Harriott Nowell","Novel Linear Transition Metal Clusters of a Heptadentate Bis-β-diketone Ligand","Inorganic Chemistry","2007","46","","2519","2529","10.1021/ic062075v","","x-ray","0.6711","synchrotron","","0.0564","0.0384","","","0.0901","0.0988","","","","","","1.018","","","","has coordinates","179113","2020-10-21","18:00:00",""
"4307600","14.2149","0.0011","12.1924","0.0009","16.3375","0.0012","90","","90.031","0.001","90","","2831.5","0.4","90","2","90","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","compound 7","","","- C33 H43 B N2 -","- C33 H43 B N2 -","- C132 H172 B4 N8 -","4","1","","Eric Rivard; W. Alexander Merrill; James C. Fettinger; Robert Wolf; Geoffrey H. Spikes; Philip P. Power","Boron-Pnictogen Multiple Bonds: Donor-Stabilized PB and AsB Bonds and a Hindered Iminoborane with a B-N Triple Bond","Inorganic Chemistry","2007","46","","2971","2978","10.1021/ic062076n","","","0.71073","MoKα","","0.0729","0.0576","","","0.1675","0.1744","","","","","","1.052","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307601","16.0804","0.0007","16.9371","0.0008","17.56","0.0008","79.336","0.001","84.333","0.001","83.061","0.001","4651.2","0.4","90","2","90","2","","","","","","","","6","P -1","-P 1","2","compound 1","","","- C96 H150 B2 Br2 N2 P2 -","- C96 H150 B2 Br2 N2 P2 -","- C192 H300 B4 Br4 N4 P4 -","2","1","","Eric Rivard; W. Alexander Merrill; James C. Fettinger; Robert Wolf; Geoffrey H. Spikes; Philip P. Power","Boron-Pnictogen Multiple Bonds: Donor-Stabilized PB and AsB Bonds and a Hindered Iminoborane with a B-N Triple Bond","Inorganic Chemistry","2007","46","","2971","2978","10.1021/ic062076n","","","0.71073","MoKα","","0.072","0.0407","","","0.0983","0.1061","","","","","","1.061","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307602","10.9159","0.0005","11.529","0.0006","11.784","0.0006","89.214","0.001","89.268","0.001","83.565","0.001","1473.43","0.13","90","2","90","2","","","","","","","","5","P -1","-P 1","2","compound 6","","","- C33 H44 B Br N2 -","- C33 H44 B Br N2 -","- C66 H88 B2 Br2 N4 -","2","1","","Eric Rivard; W. Alexander Merrill; James C. Fettinger; Robert Wolf; Geoffrey H. Spikes; Philip P. Power","Boron-Pnictogen Multiple Bonds: Donor-Stabilized PB and AsB Bonds and a Hindered Iminoborane with a B-N Triple Bond","Inorganic Chemistry","2007","46","","2971","2978","10.1021/ic062076n","","","0.71073","MoKα","","0.0579","0.0461","","","0.1358","0.1411","","","","","","1.079","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307603","12.368","0.005","18.983","0.008","27.134","0.01","106.011","0.004","90.942","0.002","108.792","0.005","5758","4","103","2","103","2","","","","","","","","6","P -1","-P 1","2","","","","- C98 H178 Cl2 N6 Si12 Ti2 -","- C98 H178 Cl2 N6 Si12 Ti2 -","- C196 H356 Cl4 N12 Si24 Ti4 -","2","1","","Hirofumi Hamaki; Nobuhiro Takeda; Norihiro Tokitoh","Nucleophilic Attack toward Group 4 Metal Complexes Bearing Reactive 1-Aza-1,3-butadienyl and Imido Moieties","Inorganic Chemistry","2007","46","","1795","1802","10.1021/ic0620844","","","0.7107","MoKα","","0.119","0.0832","","","0.1951","0.2168","","","","","","1.12","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307604","11.8582","0.0013","16.745","0.002","18.135","0.004","98.209","0.017","101.84","0.015","107.231","0.005","3285.4","1","103","2","103","2","","","","","","","","7","P -1","-P 1","2","","","","- C54 H101 Cl N2 P2 Si6 Ti -","- C54 H101 Cl N2 P2 Si6 Ti -","- C108 H202 Cl2 N4 P4 Si12 Ti2 -","2","1","","Hirofumi Hamaki; Nobuhiro Takeda; Norihiro Tokitoh","Nucleophilic Attack toward Group 4 Metal Complexes Bearing Reactive 1-Aza-1,3-butadienyl and Imido Moieties","Inorganic Chemistry","2007","46","","1795","1802","10.1021/ic0620844","","","0.71069","MoKα","","0.1948","0.0818","","","0.1468","0.1938","","","","","","1.03","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307605","7.694","0.0004","26.1454","0.0013","14.5059","0.0007","90","","94.895","0.002","90","","2907.4","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H40 B N3 Si3 -","- C28 H40 B N3 Si3 -","- C112 H160 B4 N12 Si12 -","4","1","","Hongping Zhu; Eugene Y.-X. Chen","Tripodal Amido Boron and Aluminum Complexes","Inorganic Chemistry","2007","46","","1481","1487","10.1021/ic0620889","","","0.71073","MoKα","","0.0596","0.0398","","","0.0972","0.1094","","","","","","1.073","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307606","10.5785","0.0003","21.6592","0.0007","17.0059","0.0005","90","","91.549","0.002","90","","3895","0.2","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C56 H131 B0 Cl2 Li6 N6 O2 Si6 -","- C56.04 H131.08 Cl2 Li6 N6 O2 Si6 -","- C112.08 H262.16 Cl4 Li12 N12 O4 Si12 -","2","0.5","","Hongping Zhu; Eugene Y.-X. Chen","Tripodal Amido Boron and Aluminum Complexes","Inorganic Chemistry","2007","46","","1481","1487","10.1021/ic0620889","","","0.71073","MoKα","","0.0858","0.0535","","","0.1422","0.1663","","","","","","1.033","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307607","28.8457","0.0011","13.0329","0.0006","23.92","0.0009","90","","126.888","0.001","90","","7192.3","0.5","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C62 H94 Al2 Cl2 Li2 N6 Si6 -","- C62 H80 Al2 Cl2 Li2 N6 Si6 -","- C248 H320 Al8 Cl8 Li8 N24 Si24 -","4","0.5","","Hongping Zhu; Eugene Y.-X. Chen","Tripodal Amido Boron and Aluminum Complexes","Inorganic Chemistry","2007","46","","1481","1487","10.1021/ic0620889","","","0.71073","MoKα","","0.0558","0.0466","","","0.13","0.1386","","","","","","1.066","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307608","14.7157","0.0006","14.7551","0.0006","18.0703","0.0008","90.799","0.002","101.923","0.002","118.783","0.002","3335.1","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H48 Al N3 O Si3 -","- C32 H48 Al N3 O Si3 -","- C128 H192 Al4 N12 O4 Si12 -","4","2","","Hongping Zhu; Eugene Y.-X. Chen","Tripodal Amido Boron and Aluminum Complexes","Inorganic Chemistry","2007","46","","1481","1487","10.1021/ic0620889","","","0.71073","MoKα","","0.0631","0.0421","","","0.1083","0.1216","","","","","","1.002","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307609","11.9203","0.0007","26.6477","0.0014","13.5389","0.0007","90","","99.636","0.003","90","","4239.9","0.4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C38 H59 Al Li N3 O3 Si3 -","- C38 H59 Al Li N3 O3 Si3 -","- C152 H236 Al4 Li4 N12 O12 Si12 -","4","1","","Hongping Zhu; Eugene Y.-X. Chen","Tripodal Amido Boron and Aluminum Complexes","Inorganic Chemistry","2007","46","","1481","1487","10.1021/ic0620889","","","0.71073","MoKα","","0.0921","0.0568","","","0.1462","0.1683","","","","","","1.018","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307610","17.2591","0.0007","20.7769","0.0009","20.954","0.0009","90","","90","","90","","7513.9","0.6","233","2","233","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","BisRhssCab","","","- C54 H82 B20 N2 Rh2 S4 -","- C54 H82 B20 N2 Rh2 S4 -","- C216 H328 B80 N8 Rh8 S16 -","4","0.5","","Jong Hyub Paek; Kyu Ho Song; Il Jung; Sang Ook Kang; Jaejung Ko","Organometallic Fragments Coordinated to a Multiisocyanide Ligand and Their Physical Properties","Inorganic Chemistry","2007","46","","2787","2796","10.1021/ic0620900","","","0.71073","MoKα","","0.0544","0.0408","","","0.1207","0.1285","","","","","","1.144","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307611","14.9119","0.0011","14.9973","0.0011","18.7576","0.0014","73.255","0.001","69.383","0.002","69.659","0.002","3615.2","0.5","203","2","203","2","","","","","","","","5","P -1","-P 1","2","TrisCrCO5","","","- C66 H51 Cr3 N3 O15 -","- C66 H51 Cr3 N3 O15 -","- C132 H102 Cr6 N6 O30 -","2","1","","Jong Hyub Paek; Kyu Ho Song; Il Jung; Sang Ook Kang; Jaejung Ko","Organometallic Fragments Coordinated to a Multiisocyanide Ligand and Their Physical Properties","Inorganic Chemistry","2007","46","","2787","2796","10.1021/ic0620900","","","0.71073","MoKα","","0.1135","0.0584","","","0.1557","0.176","","","","","","0.884","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307612","22.5803","0.0013","18.6604","0.0012","30.452","0.002","90","","105.37","0.002","90","","12372.3","1.3","230.5","","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","TrisAuCl","","","- C51 H51 Au3 Cl3 N3 -","- C51 H51 Au3 Cl3 N3 -","- C408 H408 Au24 Cl24 N24 -","8","1","","Jong Hyub Paek; Kyu Ho Song; Il Jung; Sang Ook Kang; Jaejung Ko","Organometallic Fragments Coordinated to a Multiisocyanide Ligand and Their Physical Properties","Inorganic Chemistry","2007","46","","2787","2796","10.1021/ic0620900","","","0.71073","MoKα","","0.1555","0.0606","","","0.1473","0.1792","","","","","","0.713","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307613","8.823","0.004","10.669","0.005","11.477","0.005","92.93","0.004","99.701","0.007","97.116","0.006","1053.8","0.8","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H20 Ag Bi I5 N -","- C8 H20 Ag Bi I5 N -","- C16 H40 Ag2 Bi2 I10 N2 -","2","1","","Wen-Xiang Chai; Li-Ming Wu; Jun-Qian Li; Ling Chen","Silver Iodobismuthates: Syntheses, Structures, Properties, and Theoretical Studies of [Bi2Ag2I102-]n and [Bi4Ag2I162-]n","Inorganic Chemistry","2007","46","","1042","1044","10.1021/ic062091s","","","0.71073","MoKα","","0.0452","0.0356","","","0.0768","0.0822","","","","","","1.079","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307614","15.46","0.005","14.058","0.004","13.2","0.004","90","","108.872","0.003","90","","2714.6","1.4","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H20 Ag Bi2 I8 N -","- C8 H20 Ag Bi2 I8 N -","- C32 H80 Ag4 Bi8 I32 N4 -","4","1","","Wen-Xiang Chai; Li-Ming Wu; Jun-Qian Li; Ling Chen","Silver Iodobismuthates: Syntheses, Structures, Properties, and Theoretical Studies of [Bi2Ag2I102-]n and [Bi4Ag2I162-]n","Inorganic Chemistry","2007","46","","1042","1044","10.1021/ic062091s","","","0.71073","MoKα","","0.0457","0.0375","","","0.0827","0.0871","","","","","","1.071","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307615","6.154","0.002","7.282","0.001","9.396","0.003","90","","104.29","0.01","90","","408","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 N4 Ni Tl2 -","- C4 N4 Ni Tl2 -","- C8 N8 Ni2 Tl4 -","2","0.5","","Mikhail Maliarik; Jeffrey K. Nagle; Andrey Ilyukhin; Elena Murashova; János Mink; Mikhail Skripkin; Julius Glaser; Margit Kovacs; Attila Horváth","Metal-Metal Bonding in Tetracyanometalates (M = PtII, PdII, NiII) of Monovalent Thallium. Crystallographic and Spectroscopic Characterization of the New Compounds Tl2Ni(CN)4 and Tl2Pd(CN)4","Inorganic Chemistry","2007","46","","4642","4653","10.1021/ic062092k","","","0.71073","MoKα","","0.0376","0.0374","","","0.0982","0.0983","","","","","","1.074","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307616","6.277","0.002","7.437","0.002","9.591","0.003","90","","104.67","","90","","433.1","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 N4 Pd Tl2 -","- C4 N4 Pd Tl2 -","- C8 N8 Pd2 Tl4 -","2","0.5","","Mikhail Maliarik; Jeffrey K. Nagle; Andrey Ilyukhin; Elena Murashova; János Mink; Mikhail Skripkin; Julius Glaser; Margit Kovacs; Attila Horváth","Metal-Metal Bonding in Tetracyanometalates (M = PtII, PdII, NiII) of Monovalent Thallium. Crystallographic and Spectroscopic Characterization of the New Compounds Tl2Ni(CN)4 and Tl2Pd(CN)4","Inorganic Chemistry","2007","46","","4642","4653","10.1021/ic062092k","","","0.71073","MoKα","","0.044","0.0285","","","0.0428","0.0446","","","","","","1.266","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307617","8.97","0.0012","9.6283","0.0012","10.6464","0.0014","91.898","0.003","99.04","0.003","117.182","0.002","802","0.18","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H24 N6 O -","- C14 H24 N6 O -","- C28 H48 N12 O2 -","2","1","","Antonio Otero; Juan Fernández-Baeza; Antonio Antiñolo; Juan Tejeda; Agustín Lara-Sánchez; Luis F. Sánchez-Barba; Isabel López-Solera; Ana M. Rodríguez","Lithium, Titanium, and Zirconium Complexes with Novel Amidinate Scorpionate Ligands","Inorganic Chemistry","2007","46","","1760","1770","10.1021/ic062093c","","","0.71073","MoKα","","0.0993","0.0633","","","0.1511","0.173","","","","","","1.019","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307618","10.386","0.005","10.996","0.005","13.197","0.006","65.725","0.009","85.059","0.008","63.99","0.008","1226.6","1","250","2","250","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H37 Li N6 O -","- C22 H37 Li N6 O -","- C44 H74 Li2 N12 O2 -","2","1","","Antonio Otero; Juan Fernández-Baeza; Antonio Antiñolo; Juan Tejeda; Agustín Lara-Sánchez; Luis F. Sánchez-Barba; Isabel López-Solera; Ana M. Rodríguez","Lithium, Titanium, and Zirconium Complexes with Novel Amidinate Scorpionate Ligands","Inorganic Chemistry","2007","46","","1760","1770","10.1021/ic062093c","","","0.71073","MoKα","","0.1206","0.0754","","","0.1975","0.2365","","","","","","1.054","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307619","10.073","0.004","10.445","0.004","13.078","0.006","79.548","0.009","68.95","0.008","68.878","0.008","1195.7","0.9","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H37 Li N6 O -","- C22 H37.6 Li N6 O -","- C44 H75.2 Li2 N12 O2 -","2","1","","Antonio Otero; Juan Fernández-Baeza; Antonio Antiñolo; Juan Tejeda; Agustín Lara-Sánchez; Luis F. Sánchez-Barba; Isabel López-Solera; Ana M. Rodríguez","Lithium, Titanium, and Zirconium Complexes with Novel Amidinate Scorpionate Ligands","Inorganic Chemistry","2007","46","","1760","1770","10.1021/ic062093c","","","0.71073","MoKα","","0.3475","0.0981","","","0.1883","0.3009","","","","","","0.874","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307620","22.883","0.006","11.983","0.003","21.052","0.005","90","","102.064","0.007","90","","5645","2","160","2","160","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H84 Li2 N16 O4 -","- C50 H84 Li2 N16 O4 -","- C200 H336 Li8 N64 O16 -","4","0.5","","Antonio Otero; Juan Fernández-Baeza; Antonio Antiñolo; Juan Tejeda; Agustín Lara-Sánchez; Luis F. Sánchez-Barba; Isabel López-Solera; Ana M. Rodríguez","Lithium, Titanium, and Zirconium Complexes with Novel Amidinate Scorpionate Ligands","Inorganic Chemistry","2007","46","","1760","1770","10.1021/ic062093c","","","0.71073","MoKα","","0.155","0.071","","","0.1775","0.2225","","","","","","0.946","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307621","13.739","0.003","18.195","0.008","22.337","0.009","90","","95.14","0.03","90","","5561","4","250","2","250","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C78 H118 Li10 N26 O8 -","- C78 H118 Li10 N26 O8 -","- C156 H236 Li20 N52 O16 -","2","0.5","","Antonio Otero; Juan Fernández-Baeza; Antonio Antiñolo; Juan Tejeda; Agustín Lara-Sánchez; Luis F. Sánchez-Barba; Isabel López-Solera; Ana M. Rodríguez","Lithium, Titanium, and Zirconium Complexes with Novel Amidinate Scorpionate Ligands","Inorganic Chemistry","2007","46","","1760","1770","10.1021/ic062093c","","","0.71073","MoKα","","0.4733","0.1401","","","0.3053","0.37","","","","","","0.739","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307622","21.468","0.005","9.254","0.002","27.056","0.007","90","","99.517","0.004","90","","5301","2","90","2","90","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[Ru(SBPy3)(NO)](BF4)3","","","- C20 H21 B3 F12 N6 O Ru -","- C20 H21 B3 F12 N6 O Ru -","- C160 H168 B24 F96 N48 O8 Ru8 -","8","1","","Michael J. Rose; Apurba K. Patra; Eric A. Alcid; Marylin M. Olmstead; Pradip K. Mascharak","Ruthenium Nitrosyls Derived from Polypyridine Ligands with Carboxamide or Imine Nitrogen Donor(s): Isoelectronic Complexes with Different NO Photolability","Inorganic Chemistry","2007","46","","2328","2338","10.1021/ic0620945","","","0.71073","MoKα","","0.0939","0.0779","","","0.2058","0.2183","","","","","","1.163","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307623","10.1081","0.0012","16.5739","0.0018","17.3238","0.0019","75.761","0.004","86.966","0.004","84.073","0.007","2796.9","0.5","90","2","90","2","","","","","","","","7","P -1","-P 1","2","[(PaPy3)Ru(NO)](BF4)2.CH3CN.0.25Et2O","","","- C23 H25.5 B2 F8 N7 O2.25 Ru -","- C23 H25.5 B2 F8 N7 O2.25 Ru -","- C92 H102 B8 F32 N28 O9 Ru4 -","4","2","","Michael J. Rose; Apurba K. Patra; Eric A. Alcid; Marylin M. Olmstead; Pradip K. Mascharak","Ruthenium Nitrosyls Derived from Polypyridine Ligands with Carboxamide or Imine Nitrogen Donor(s): Isoelectronic Complexes with Different NO Photolability","Inorganic Chemistry","2007","46","","2328","2338","10.1021/ic0620945","","","0.71073","MoKα","","0.0692","0.047","","","0.1029","0.1116","","","","","","1.038","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307624","13.7575","0.0009","13.7599","0.0009","14.8939","0.0009","62.793","0.005","62.81","0.005","83.886","0.005","2211.6","0.3","90","2","90","2","","","","","","","","7","P -1","-P 1","2","[Ru(Py3P)(NO)]BF4","","","- C21 H19 B F4 N6 O3 Ru -","- C21 H19 B F4 N6 O3 Ru -","- C84 H76 B4 F16 N24 O12 Ru4 -","4","2","","Michael J. Rose; Apurba K. Patra; Eric A. Alcid; Marylin M. Olmstead; Pradip K. Mascharak","Ruthenium Nitrosyls Derived from Polypyridine Ligands with Carboxamide or Imine Nitrogen Donor(s): Isoelectronic Complexes with Different NO Photolability","Inorganic Chemistry","2007","46","","2328","2338","10.1021/ic0620945","","","0.71073","MoKα","","0.0428","0.0348","","","0.0651","0.0676","","","","","","0.905","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307625","14.6611","0.0005","10.4632","0.0004","13.3745","0.0005","90","","90","","90","","2051.68","0.13","90","2","90","2","","","","","","","","6","P c a 21","P 2c -2ac","29","(Py3P)Ru(NO)(Cl)","","","- C21 H19 Cl N6 O3 Ru -","- C21 H19 Cl N6 O3 Ru -","- C84 H76 Cl4 N24 O12 Ru4 -","4","1","","Michael J. Rose; Apurba K. Patra; Eric A. Alcid; Marylin M. Olmstead; Pradip K. Mascharak","Ruthenium Nitrosyls Derived from Polypyridine Ligands with Carboxamide or Imine Nitrogen Donor(s): Isoelectronic Complexes with Different NO Photolability","Inorganic Chemistry","2007","46","","2328","2338","10.1021/ic0620945","","","0.71073","MoKα","","0.0177","0.0174","","","0.046","0.0462","","","","","","1.024","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307626","10.1334","0.0012","12.7761","0.0015","17.245","0.002","90","","94.899","0.005","90","","2224.5","0.5","90","2","90","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(Py3P)Ru(Cl).CH3CN","","","- C23 H22 Cl N6 O2 Ru -","- C23 H22 Cl N6 O2 Ru -","- C92 H88 Cl4 N24 O8 Ru4 -","4","1","","Michael J. Rose; Apurba K. Patra; Eric A. Alcid; Marylin M. Olmstead; Pradip K. Mascharak","Ruthenium Nitrosyls Derived from Polypyridine Ligands with Carboxamide or Imine Nitrogen Donor(s): Isoelectronic Complexes with Different NO Photolability","Inorganic Chemistry","2007","46","","2328","2338","10.1021/ic0620945","","","0.71073","MoKα","","0.0375","0.0279","","","0.0687","0.0759","","","","","","1.081","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307627","8.5012","0.0011","18.408","0.002","14.3838","0.0017","90","","95.476","0.006","90","","2240.6","0.5","90","2","90","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","[(PaPy3)Ru(Cl)](BF4).H2O","","","- C20 H22 B Cl F4 N5 O2 Ru -","- C20 H22 B Cl F4 N5 O2 Ru -","- C80 H88 B4 Cl4 F16 N20 O8 Ru4 -","4","1","","Michael J. Rose; Apurba K. Patra; Eric A. Alcid; Marylin M. Olmstead; Pradip K. Mascharak","Ruthenium Nitrosyls Derived from Polypyridine Ligands with Carboxamide or Imine Nitrogen Donor(s): Isoelectronic Complexes with Different NO Photolability","Inorganic Chemistry","2007","46","","2328","2338","10.1021/ic0620945","","","0.71073","MoKα","","0.0283","0.0251","","","0.0579","0.0597","","","","","","1.093","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4307628","6.5423","","11.4132","","6.5317","","90","","108.788","","90","","461.726","","","","","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- Cu2 S3 Si0.37 Sn0.63 -","- Cu2 S3 Si0.373 Sn0.627 -","- Cu8 S12 Si1.492 Sn2.508 -","4","1","","Alain Lafond; Jason A. Cody; Marc Souilah; Catherine Guillot-Deudon; Ragnar Kiebach; Wolfgang Bensch","Syntheses and X-ray Diffraction, Photochemical, and Optical Characterization of Cu2SixSn1-xS3 (0.4 <=x<= 0.6) for Photovoltaic Applications","Inorganic Chemistry","2007","46","","1502","1506","10.1021/ic0621087","","","0.71069","MoKα","","0.0671","0.0404","","","0.0479","0.0498","","","","","","1.29","","","","has coordinates,has Fobs","179114","2020-10-21","18:00:00",""
"4307629","11.423","0.01","14.241","0.012","18.88","0.02","109.06","0.03","103.68","0.05","98.82","0.04","2730","5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H32 N6 O11 Zn2 -","- C52 H32 N6 O11 Zn2 -","- C104 H64 N12 O22 Zn4 -","2","1","","Alok Ranjan Paital; A-Qing Wu; Guo-Cong Guo; Guillem Aromí; Jordi Ribas-Ariño; Debashis Ray","Two Cu2 and Zn2 Metallamacrocycles Featuring a Novel Extended π-Conjugated Carbazole Bridge","Inorganic Chemistry","2007","46","","2947","2949","10.1021/ic062109z","","","0.71073","MoKα","","0.258","0.1617","","","0.2986","0.3619","","","","","","1.158","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307630","10.5504","0.0005","11.837","","11.9253","0.0001","78.153","0.019","68.288","0.014","65.79","0.015","1259.42","0.19","3273","2","3273","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H20 Cl3 Cu N3 O3 -","- C27 H18 Cl3 Cu N3 O3 -","- C54 H36 Cl6 Cu2 N6 O6 -","2","1","","Alok Ranjan Paital; A-Qing Wu; Guo-Cong Guo; Guillem Aromí; Jordi Ribas-Ariño; Debashis Ray","Two Cu2 and Zn2 Metallamacrocycles Featuring a Novel Extended π-Conjugated Carbazole Bridge","Inorganic Chemistry","2007","46","","2947","2949","10.1021/ic062109z","","","0.71073","MoKα","","0.0836","0.0713","","","0.1992","0.2152","","","","","","1.054","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307631","12.1038","0.0008","16.8908","0.0011","18.8556","0.0012","90","","101.196","0.001","90","","3781.5","0.4","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C33 H34 Cl2 F12 N4 O P2 Ru2 -","- C33 H34 Cl2 F12 N4 O P2 Ru2 -","- C132 H136 Cl8 F48 N16 O4 P8 Ru8 -","4","1","","Steven W. Magennis; Abraha Habtemariam; Olga Novakova; John B. Henry; Samuel Meier; Simon Parsons; Iain D. H. Oswald; Viktor Brabec; Peter J. Sadler","Dual Triggering of DNA Binding and Fluorescence via Photoactivation of a Dinuclear Ruthenium(II) Arene Complex","Inorganic Chemistry","2007","46","","5059","5068","10.1021/ic062111q","","","0.71073","MoKα","","0.0472","0.0381","","","0.0782","0.081","","","","","","1.158","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307632","10.6306","0.0012","10.6306","0.0012","10.6306","0.0012","90","","90","","90","","1201.4","0.2","90","2","90","2","","","","","","","","4","P m -3 n","-P 4n 2 3","223","Al14.10 Ba7.72 Eu0.28 Si30.64","Al14.10 Ba7.72 Eu0.28 Si30.64","","- Al14.1 Ba7.72 Eu0.28 Si30.64 -","- Al14.1 Ba7.72 Eu0.28 Si30.64 -","- Al14.1 Ba7.72 Eu0.28 Si30.64 -","1","0.0208333","","Cathie L. Condron; Susan M. Kauzlarich; G. S. Nolas","Structure and Thermoelectric Characterization of AxBa8-xAl14Si31 (A = Sr, Eu) Single Crystals","Inorganic Chemistry","2007","46","","2556","2562","10.1021/ic062115v","","","0.71073","MoKα","","0.0152","0.0142","","","0.0339","0.0343","","","","","","1.323","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307633","10.5962","0.0012","10.5962","0.0012","10.5962","0.0012","90","","90","","90","","1189.7","0.2","90","2","90","2","","","","","","","","4","P m -3 n","-P 4n 2 3","223","","Al14 Ba7.3 Si31 Sr0.70","","- Al14.1 Ba7.33 Si30.64 Sr0.67 -","- Al14.1 Ba7.326 Si30.64 Sr0.67 -","- Al14.1 Ba7.326 Si30.64 Sr0.67 -","1","0.0208333","","Cathie L. Condron; Susan M. Kauzlarich; G. S. Nolas","Structure and Thermoelectric Characterization of AxBa8-xAl14Si31 (A = Sr, Eu) Single Crystals","Inorganic Chemistry","2007","46","","2556","2562","10.1021/ic062115v","","","0.71073","MoKα","","0.0346","0.0213","","","0.0432","0.0503","","","","","","1.259","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4307634","8.4051","0.0002","10.4775","0.0002","14.7541","0.0003","76.3517","0.0009","77.1357","0.0008","80.214","0.0009","1221.44","0.05","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H8 Au Cl10 Tl -","- C19 H8 Au Cl10 Tl -","- C38 H16 Au2 Cl20 Tl2 -","2","1","","Eduardo J. Fernández; Antonio Laguna; José M. López-de-Luzuriaga; Miguel Monge; Manuel Montiel; M. Elena Olmos","Photophysical Studies and Excited-State Structure of a Blue Phosphorescent Gold-Thallium Complex","Inorganic Chemistry","2007","46","","2953","2955","10.1021/ic062127g","","","0.71073","MoKα","","0.0424","0.0299","","","0.0644","0.069","","","","","","1.027","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307635","6.8621","0.0004","7.9851","0.0004","10.0983","0.0005","90","","99.36","0.001","90","","545.96","0.05","240","","240","","","","","","","","","4","P 1 21 1","P 2yb","4","hydrazinium copper sulfide","? hydrazinium copper sulfide","","- Cu7 H9 N4 S4 -","- Cu7 H10 N4 S4 -","- Cu14 H20 N8 S8 -","2","1","","David B. Mitzi","N4H9Cu7S4: A Hydrazinium-Based Salt with a Layered Cu7S4-Framework","Inorganic Chemistry","2007","46","","926","931","10.1021/ic0621291","","","0.7093","MolybdenumKα","","0.038","0.038","","0.046","0.046","","","","","1.79","1.79","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307636","4.3898","0.0018","5.694","0.002","9.023","0.004","105.192","0.006","93.81","0.006","111.102","0.006","199.79","0.14","193","2","193","2","","","","","","","","3","P -1","-P 1","2","Cr(B3H8)2","","","- B6 Cr H16 -","- B6 Cr H16 -","- B6 Cr H16 -","1","0.5","","Dean M. Goedde; G. Kenneth Windler; Gregory S. Girolami","Synthesis and Characterization of the Homoleptic Octahydrotriborate Complex Cr(B3H8)2 and Its Lewis Base Adducts","Inorganic Chemistry","2007","46","","2814","2823","10.1021/ic0621300","","","0.71073","MoKα","","0.0638","0.0514","","","0.1139","0.1198","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307637","7.0764","0.0017","16.985","0.004","7.985","0.002","90","","110.589","0.004","90","","898.4","0.4","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Cr(B3H8)2(Et2O)2","","","- C8 H36 B6 Cr O2 -","- C8 H36 B6 Cr O2 -","- C16 H72 B12 Cr2 O4 -","2","0.5","","Dean M. Goedde; G. Kenneth Windler; Gregory S. Girolami","Synthesis and Characterization of the Homoleptic Octahydrotriborate Complex Cr(B3H8)2 and Its Lewis Base Adducts","Inorganic Chemistry","2007","46","","2814","2823","10.1021/ic0621300","","","0.71073","MoKα","","0.0871","0.0401","","","0.0733","0.0841","","","","","","0.924","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307638","9.2238","0.0016","8.7248","0.0015","11.0292","0.0019","90","","102.597","0.003","90","","866.2","0.3","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Cr(B3H8)2(thf)2","","","- C8 H32 B6 Cr O2 -","- C8 H32 B6 Cr O2 -","- C16 H64 B12 Cr2 O4 -","2","0.5","","Dean M. Goedde; G. Kenneth Windler; Gregory S. Girolami","Synthesis and Characterization of the Homoleptic Octahydrotriborate Complex Cr(B3H8)2 and Its Lewis Base Adducts","Inorganic Chemistry","2007","46","","2814","2823","10.1021/ic0621300","","","0.71073","MoKα","","0.0588","0.0421","","","0.1163","0.1254","","","","","","1.072","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307639","16.404","0.003","13.744","0.003","16.728","0.003","90","","90","","90","","3771.4","1.3","198","2","198","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Cr(B3H8)2(PMe3)2","","","- C6 H34 B6 Cr P2 -","- C6 H34 B6 Cr P2 -","- C48 H272 B48 Cr8 P16 -","8","1","","Dean M. Goedde; G. Kenneth Windler; Gregory S. Girolami","Synthesis and Characterization of the Homoleptic Octahydrotriborate Complex Cr(B3H8)2 and Its Lewis Base Adducts","Inorganic Chemistry","2007","46","","2814","2823","10.1021/ic0621300","","","0.71073","MoKα","","0.0735","0.0349","","","0.074","0.0842","","","","","","0.936","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307640","25.1232","0.0011","25.1232","0.0011","25.1232","0.0011","90","","90","","90","","15857.1","1.2","180","2","180","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","","","","- C135 H156 Cl6 Co6 N18 O45 -","- C135 H156 Cl6 Co6 N18 O45 -","- C540 H624 Cl24 Co24 N72 O180 -","4","0.333333","","Frank B. Johansson; Andrew D. Bond; Christine J. McKenzie","Functional Tetrametallic Linker Modules for Coordination Polymers and Metal-Organic Frameworks","Inorganic Chemistry","2007","46","","2224","2236","10.1021/ic062131s","","","0.71073","MoKα","","0.1153","0.0878","","","0.24","0.2701","","","","","","1.045","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307641","11.7529","0.0009","27.09","0.002","12.0596","0.0009","90","","106.345","0.002","90","","3684.4","0.5","150","2","150","2","","","","","","","","6","I 1 2/m 1","-I 2y","12","","","","- C64 H60 Cl10 N12 O2 Zn4 -","- C64 H60 Cl4 N12 O2 Zn4 -","- C128 H120 Cl8 N24 O4 Zn8 -","2","0.25","","Frank B. Johansson; Andrew D. Bond; Christine J. McKenzie","Functional Tetrametallic Linker Modules for Coordination Polymers and Metal-Organic Frameworks","Inorganic Chemistry","2007","46","","2224","2236","10.1021/ic062131s","","","0.71073","MoKα","","0.0957","0.0581","","","0.151","0.1622","","","","","","0.944","","","","has coordinates","270074","2021-10-24","17:53:43",""
"4307642","10.8272","0.0007","11.1926","0.0007","18.8464","0.0011","99.661","0.001","100.107","0.001","102.15","0.001","2147.8","0.2","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H77 Cl6 N17 O27 Zn4 -","- C74 H77 Cl6 N17 O27 Zn4 -","- C74 H77 Cl6 N17 O27 Zn4 -","1","0.5","","Frank B. Johansson; Andrew D. Bond; Christine J. McKenzie","Functional Tetrametallic Linker Modules for Coordination Polymers and Metal-Organic Frameworks","Inorganic Chemistry","2007","46","","2224","2236","10.1021/ic062131s","","","0.71073","MoKα","","0.1014","0.0658","","","0.1692","0.1895","","","","","","1.032","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307643","11.869","0.003","27.292","0.005","12.241","0.004","90","","105.34","0.03","90","","3823.9","1.8","150","2","150","2","","","","","","","","7","I 1 2/m 1","-I 2y","12","","","","- C66 H63 Cl10 Cu4 N13 O2 Zn2 -","- C66 H63 Cl10 Cu4 N13 O2 Zn2 -","- C132 H126 Cl20 Cu8 N26 O4 Zn4 -","2","0.25","","Frank B. Johansson; Andrew D. Bond; Christine J. McKenzie","Functional Tetrametallic Linker Modules for Coordination Polymers and Metal-Organic Frameworks","Inorganic Chemistry","2007","46","","2224","2236","10.1021/ic062131s","","","0.897","synchrotron","","0.1438","0.0954","","","0.2736","0.304","","","","","","1.07","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307644","11.869","0.003","27.292","0.005","12.241","0.004","90","","105.34","0.03","90","","3823.9","1.8","150","2","150","2","","","","","","","","6","I 1 2/m 1","-I 2y","12","","","","- C64 H60 Cl4 Cu4 N12 O2 -","- C64 H60 Cl4 Cu4 N12 O2 -","- C128 H120 Cl8 Cu8 N24 O4 -","2","0.25","","Frank B. Johansson; Andrew D. Bond; Christine J. McKenzie","Functional Tetrametallic Linker Modules for Coordination Polymers and Metal-Organic Frameworks","Inorganic Chemistry","2007","46","","2224","2236","10.1021/ic062131s","","","0.897","synchrotron","","0.1078","0.0689","","","0.181","0.1948","","","","","","0.951","","","","has coordinates","270074","2021-10-24","17:53:43",""
"4307645","11.0806","0.0007","12.5195","0.0008","19.8843","0.0013","97.482","0.003","96.817","0.003","98.501","0.003","2678","0.3","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C110 H96 Cl4 Cu2 N14 O14 Zn4 -","- C110 H96 Cl4 Cu2 N14 O14 Zn4 -","- C110 H96 Cl4 Cu2 N14 O14 Zn4 -","1","0.5","","Frank B. Johansson; Andrew D. Bond; Christine J. McKenzie","Functional Tetrametallic Linker Modules for Coordination Polymers and Metal-Organic Frameworks","Inorganic Chemistry","2007","46","","2224","2236","10.1021/ic062131s","","","0.71073","MoKα","","0.1144","0.0565","","","0.1307","0.1489","","","","","","1.038","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307646","20.834","0.003","26.036","0.003","15.4807","0.0018","90","","108.322","0.004","90","","7971.6","1.7","180","2","180","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C159.2 H136 B2.8 Fe0.8 N12 O10 Zn3.2 -","- C159.2 H136 B2.8 Fe0.8 N12 O10 Zn3.2 -","- C318.4 H272 B5.6 Fe1.6 N24 O20 Zn6.4 -","2","0.5","","Frank B. Johansson; Andrew D. Bond; Christine J. McKenzie","Functional Tetrametallic Linker Modules for Coordination Polymers and Metal-Organic Frameworks","Inorganic Chemistry","2007","46","","2224","2236","10.1021/ic062131s","","","0.71073","MoKα","","0.1861","0.1142","","","0.3237","0.3723","","","","","","1.045","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307647","19.191","0.009","19.763","0.006","20.328","0.009","83.299","0.009","66.759","0.006","81.316","0.008","6989","5","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C140 H120 B2 Co4 N12 O10 -","- C140 H120 B2 Co4 N12 O10 -","- C280 H240 B4 Co8 N24 O20 -","2","1","","Frank B. Johansson; Andrew D. Bond; Christine J. McKenzie","Functional Tetrametallic Linker Modules for Coordination Polymers and Metal-Organic Frameworks","Inorganic Chemistry","2007","46","","2224","2236","10.1021/ic062131s","","","0.71073","MoKα","","0.1304","0.0675","","","0.153","0.1729","","","","","","0.862","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307648","18.9268","0.0008","12.7196","0.0005","21.7486","0.0009","90","","92.96","0.002","90","","5228.8","0.4","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C92 H122 Cl4 Co4 N12 O38 -","- C92 H122 Cl4 Co4 N12 O38 -","- C184 H244 Cl8 Co8 N24 O76 -","2","0.5","","Frank B. Johansson; Andrew D. Bond; Christine J. McKenzie","Functional Tetrametallic Linker Modules for Coordination Polymers and Metal-Organic Frameworks","Inorganic Chemistry","2007","46","","2224","2236","10.1021/ic062131s","","","0.71073","MoKα","","0.115","0.0767","","","0.2176","0.2445","","","","","","1.05","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307649","15.873","0.0001","16.9061","0.0001","22.8297","0.0002","90","","90","","90","","6126.36","0.08","293","2","293","2","","","","","","","synthesis as described","7","P 21 21 21","P 2ac 2ab","19","","","","- C30 H80 Ag3 Cu3 N9 O31 S6 -","- C30 H80 Ag3 Cu3 N9 O31 S6 -","- C120 H320 Ag12 Cu12 N36 O124 S24 -","4","1","","Tzuoo-Tsair Luo; Liang-Yu Hsu; Chan-Cheng Su; Chuen-Her Ueng; Tseng-Chang Tsai; Kuang-Lieh Lu","Deliberate Design of a 3D Homochiral CuII/l-met/AgI Coordination Network Based on the Distinct Soft-Hard Recognition Principle","Inorganic Chemistry","2007","46","","1532","1534","10.1021/ic062132k","","x-ray","0.71073","MoKα","","0.0498","0.0363","","","0.0786","0.0831","","","","","","1.053","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307650","9.8553","0.0001","10.5419","0.0002","13.0706","0.0003","84.685","0.0007","72.933","0.0008","70.871","0.001","1226.46","0.04","295","","295","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H27 Cl2 N3 P2 Pt -","- C24 H27 Cl2 N3 P2 Pt -","- C48 H54 Cl4 N6 P4 Pt2 -","2","1","","P. Bergamini; V. Bertolasi; L. Marvelli; A. Canella; R. Gavioli; N. Mantovani; S. Mañas; A. Romerosa","Phosphinic Platinum Complexes with 8-Thiotheophylline Derivatives: Synthesis, Characterization, and Antiproliferative Activity","Inorganic Chemistry","2007","46","","4267","4276","10.1021/ic062133c","","","0.7107","MoKα","","0.0394","0.033","","","0.0786","0.0825","","","","","","1.051","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307651","14.045","0.005","9.759","0.003","9.8","0.003","90","","96.491","0.004","90","","1334.6","0.7","163","2","163","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 Cl2 Cu D8 N4 O8 -","- C8 Cl2 Cu D8 N4 O8 -","- C32 Cl8 Cu4 D32 N16 O32 -","4","0.5","","F. Matthew Woodward; Pamela J. Gibson; Geoffrey B. Jameson; Christopher P. Landee; Mark M. Turnbull; Roger D. Willett","Two-Dimensional Heisenberg Antiferromagnets: Syntheses, X-ray Structures, and Magnetic Behavior of [Cu(pz)2](ClO4)2, [Cu(pz)2](BF4)2, and [Cu(pz)2(NO3)](PF6)","Inorganic Chemistry","2007","46","","4256","4266","10.1021/ic0621392","","","0.71073","MoKα","","0.0351","0.0347","","","0.0974","0.0976","","","","","","1.191","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307652","9.7093","0.0011","9.7093","0.0011","14.005","0.002","90","","90","","90","","1320.3","0.3","293","2","293","2","","","","","","","","8","I 4/m c m","-I 4 2c","140","","Bis(pyrazine)nitratocopper(II) hexafluorophosphate","","- C8 H8 Cl0.25 Cu F6 N5 O3 P -","- C8 H8 Cu F5.968 N4.99 O2.984 P -","- C32 H32 Cu4 F23.872 N19.96 O11.936 P4 -","4","0.125","","F. Matthew Woodward; Pamela J. Gibson; Geoffrey B. Jameson; Christopher P. Landee; Mark M. Turnbull; Roger D. Willett","Two-Dimensional Heisenberg Antiferromagnets: Syntheses, X-ray Structures, and Magnetic Behavior of [Cu(pz)2](ClO4)2, [Cu(pz)2](BF4)2, and [Cu(pz)2(NO3)](PF6)","Inorganic Chemistry","2007","46","","4256","4266","10.1021/ic0621392","","","0.71073","MoKa","","0.0525","0.0437","","0.1134","0.1089","","","","1.153","1.264","1.264","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307653","9.692","0.002","9.736","0.002","7.916","0.002","90","","120.92","0.01","90","","640.8","0.3","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","Bis(pyrazine)copper(II) tetrafluoroborate","","- C8 H8 B2 Cu F8 N4 -","- C8 H8 B2.04 Cu F8.08 N4 -","- C16 H16 B4.08 Cu2 F16.16 N8 -","2","0.25","","F. Matthew Woodward; Pamela J. Gibson; Geoffrey B. Jameson; Christopher P. Landee; Mark M. Turnbull; Roger D. Willett","Two-Dimensional Heisenberg Antiferromagnets: Syntheses, X-ray Structures, and Magnetic Behavior of [Cu(pz)2](ClO4)2, [Cu(pz)2](BF4)2, and [Cu(pz)2(NO3)](PF6)","Inorganic Chemistry","2007","46","","4256","4266","10.1021/ic0621392","","","0.71073","MoKα","","0.0396","0.037","","0.0967","0.0952","","","","1.229","1.268","1.268","","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307654","20.9596","0.0004","18.275","0.0004","7.5787","0.0002","90","","90","","90","","2902.92","0.11","150","2","150","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C12 H8 Cl2 N2 O2 P2 -","- C12 H8 Cl2 N2 O2 P2 -","- C96 H64 Cl16 N16 O16 P16 -","8","1","","Eric W. Ainscough; Andrew M. Brodie; Adrian B. Chaplin; Andreas Derwahl; John A. Harrison; Carl A. Otter","Conformational Flexibility in 2,2'-Dioxybiphenyl-chloro-cyclotetraphosphazenes and its Relevance to Polyphosphazene Analogues","Inorganic Chemistry","2007","46","","2575","2583","10.1021/ic062141t","","","0.71073","MoKα","","0.0546","0.0485","","","0.1262","0.1303","","","","","","1.108","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307655","9.8389","0.0005","7.4607","0.0003","19.2015","0.0009","90","","99.749","0.001","90","","1389.13","0.11","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H16 Cl4 N4 O4 P4 -","- C24 H16 Cl4 N4 O4 P4 -","- C48 H32 Cl8 N8 O8 P8 -","2","0.5","","Eric W. Ainscough; Andrew M. Brodie; Adrian B. Chaplin; Andreas Derwahl; John A. Harrison; Carl A. Otter","Conformational Flexibility in 2,2'-Dioxybiphenyl-chloro-cyclotetraphosphazenes and its Relevance to Polyphosphazene Analogues","Inorganic Chemistry","2007","46","","2575","2583","10.1021/ic062141t","","","0.71073","MoKα","","0.0595","0.0495","","","0.1007","0.1066","","","","","","1.06","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307656","11.9325","0.0002","12.3467","0.0002","15.4345","0.0003","69.354","0.001","67.676","0.001","68.037","0.001","1891.18","0.06","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H26 Cl4 N4 O6 P4 -","- C36.9758 H25.9516 Cl3.9516 N4 O6 P4 -","- C73.9516 H51.9032 Cl7.9032 N8 O12 P8 -","2","1","","Eric W. Ainscough; Andrew M. Brodie; Adrian B. Chaplin; Andreas Derwahl; John A. Harrison; Carl A. Otter","Conformational Flexibility in 2,2'-Dioxybiphenyl-chloro-cyclotetraphosphazenes and its Relevance to Polyphosphazene Analogues","Inorganic Chemistry","2007","46","","2575","2583","10.1021/ic062141t","","","0.71073","MoKα","","0.0505","0.0385","","","0.0861","0.0936","","","","","","1.034","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307657","12.343","0.0001","15.4971","0.0001","20.7351","0.0003","105.069","0.001","97.033","0.001","93.288","0.001","3784.53","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H50 Cl8 N8 O12 P8 -","- C74 H50 Cl8 N8 O12 P8 -","- C148 H100 Cl16 N16 O24 P16 -","2","1","","Eric W. Ainscough; Andrew M. Brodie; Adrian B. Chaplin; Andreas Derwahl; John A. Harrison; Carl A. Otter","Conformational Flexibility in 2,2'-Dioxybiphenyl-chloro-cyclotetraphosphazenes and its Relevance to Polyphosphazene Analogues","Inorganic Chemistry","2007","46","","2575","2583","10.1021/ic062141t","","","0.71073","MoKα","","0.0835","0.0565","","","0.1179","0.1328","","","","","","1.055","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307658","14.2015","0.0002","12.0582","0.0001","20.7909","0.0003","90","","95.88","0.001","90","","3541.6","0.08","186","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H24 Cl2 N4 O6 P4 -","- C36 H24 Cl2 N4 O6 P4 -","- C144 H96 Cl8 N16 O24 P16 -","4","1","","Eric W. Ainscough; Andrew M. Brodie; Adrian B. Chaplin; Andreas Derwahl; John A. Harrison; Carl A. Otter","Conformational Flexibility in 2,2'-Dioxybiphenyl-chloro-cyclotetraphosphazenes and its Relevance to Polyphosphazene Analogues","Inorganic Chemistry","2007","46","","2575","2583","10.1021/ic062141t","","","0.71073","MoKα","","0.099","0.0581","","","0.1116","0.1268","","","","","","1.037","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307659","8.3504","0.0006","10.5157","0.0008","11.871","0.0009","99.509","0.001","100.833","0.001","107.008","0.001","951.76","0.12","130","","130","","","","","","","","","6","P -1","-P 1","2","","","","- C16 H14 Co0.5 N8 O3 W -","- C16 H14 Co0.5 N8 O3 W -","- C32 H28 Co N16 O6 W2 -","2","1","","Jung Hee Yoon; Jeong Hak Lim; Seok Woo Choi; Hyoung Chan Kim; Chang Seop Hong","Cyanide-Bridged WV-CoII Double-Zigzag Chain Based on an Octacoordinated W Precursor: Metamagnetism and Spin Canting","Inorganic Chemistry","2007","46","","1529","1531","10.1021/ic062143d","","","0.71073","MoKα","","0.0146","0.014","","","0.0315","0.0317","","","","","","1.086","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307660","17.064","0.004","15.3018","0.0003","15.3674","0.0004","90","","93.085","0.0011","90","","4006.8","0.9","120","","120","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C18 H50 Mo7 N6 O28 -","- C18 H42 Mo7 N6 O28 -","- C72 H168 Mo28 N24 O112 -","4","1","","Violaine Coué; Rémi Dessapt; Martine Bujoli-Doeuff; Michel Evain; Stéphane Jobic","Synthesis, Characterization, and Photochromic Properties of Hybrid Organic-Inorganic Materials Based on Molybdate, DABCO, and Piperazine","Inorganic Chemistry","2007","46","","2824","2835","10.1021/ic0621502","","","0.71069","MoKα","","0.0599","0.0471","","","0.1444","0.1604","","","","2.41","2.41","2.5","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307661","7.6028","0.0005","10.3658","0.0009","17.8759","0.0012","90","","90","","90","","1408.78","0.18","","","293","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C6 H16 Mo3 N2 O11 -","- C6 H14 Mo3 N2 O11 -","- C24 H56 Mo12 N8 O44 -","4","0.5","","Violaine Coué; Rémi Dessapt; Martine Bujoli-Doeuff; Michel Evain; Stéphane Jobic","Synthesis, Characterization, and Photochromic Properties of Hybrid Organic-Inorganic Materials Based on Molybdate, DABCO, and Piperazine","Inorganic Chemistry","2007","46","","2824","2835","10.1021/ic0621502","","","0.71069","MoKα","","0.057","0.0439","","","0.1244","0.1292","","","","2.03","2.03","1.94","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307662","9.5331","0.0006","9.7314","0.0005","10.8372","0.0006","104.867","0.004","98.326","0.004","108.391","0.004","893.72","0.1","","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H40 Mo8 N6 O27 -","- C16 H40 Mo8 N6 O27 -","- C16 H40 Mo8 N6 O27 -","1","0.5","","Violaine Coué; Rémi Dessapt; Martine Bujoli-Doeuff; Michel Evain; Stéphane Jobic","Synthesis, Characterization, and Photochromic Properties of Hybrid Organic-Inorganic Materials Based on Molybdate, DABCO, and Piperazine","Inorganic Chemistry","2007","46","","2824","2835","10.1021/ic0621502","","","0.71069","MoKα","","0.0414","0.027","","","0.0658","0.0723","","","","1.09","1.09","1.08","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307663","42.4125","0.0005","11.21","0.0003","20.4336","0.0003","90","","114.893","0.001","90","","8812.5","0.3","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C65 H50 Fe O20 S40 -","- C65 H40 Fe O20 S40 -","- C260 H160 Fe4 O80 S160 -","4","0.5","","Eugenio Coronado; Simona Curreli; Carlos Giménez-Saiz; Carlos J. Gómez-García; Paola Deplano; Maria Laura Mercuri; Angela Serpe; Luca Pilia; Christophe Faulmann; Enric Canadell","New BEDT-TTF/[Fe(C5O5)3]3-Hybrid System: Synthesis, Crystal Structure, and Physical Properties of a Chirality-Induced α Phase and a Novel Magnetic Molecular Metal","Inorganic Chemistry","2007","46","","4446","4457","10.1021/ic062152m","","","0.71073","MoKα","","0.1036","0.0466","","","0.1104","0.1327","","","","","","1.014","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307664","19.591","0.002","19.395","0.002","12.9581","0.0012","103.194","0.011","102.859","0.011","73.68","0.01","4533.9","0.8","170","2","170","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H45 Fe N O15 S40 -","- C72 H45 Fe N O15 S40 -","- C144 H90 Fe2 N2 O30 S80 -","2","1","","Eugenio Coronado; Simona Curreli; Carlos Giménez-Saiz; Carlos J. Gómez-García; Paola Deplano; Maria Laura Mercuri; Angela Serpe; Luca Pilia; Christophe Faulmann; Enric Canadell","New BEDT-TTF/[Fe(C5O5)3]3-Hybrid System: Synthesis, Crystal Structure, and Physical Properties of a Chirality-Induced α Phase and a Novel Magnetic Molecular Metal","Inorganic Chemistry","2007","46","","4446","4457","10.1021/ic062152m","","","0.71073","MoKα","","0.2029","0.0528","","","0.0745","0.1119","","","","","","0.682","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307665","19.821","0.0002","34.3667","0.0005","27.5484","0.0004","90","","89.942","0.001","90","","18765.5","0.4","153","2","","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C110 H186 N36 O43 Pd6 S7 -","- C110 H144 N36 O43 Pd6 S7 -","- C440 H576 N144 O172 Pd24 S28 -","4","1","","Kazuhiro Uehara; Ko Kasai; Noritaka Mizuno","Syntheses and Characterizations of Palladium-Based Molecular Triangle/Square Compounds and Hybrid Composites with Polyoxometalates","Inorganic Chemistry","2007","46","","2563","2570","10.1021/ic062156r","","x-ray","0.71073","MoKα","","","0.0676","","","","0.2033","","","","","","0.993","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307666","45.6921","0.0016","8.7721","0.0008","36.719","0.003","90","","126.509","0.002","90","","11829.4","1.5","153","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C64 H96 N24 O24 Pd4 -","- C64 H96 N24 O24 Pd4 -","- C256 H384 N96 O96 Pd16 -","4","0.5","","Kazuhiro Uehara; Ko Kasai; Noritaka Mizuno","Syntheses and Characterizations of Palladium-Based Molecular Triangle/Square Compounds and Hybrid Composites with Polyoxometalates","Inorganic Chemistry","2007","46","","2563","2570","10.1021/ic062156r","","x-ray","0.71069","MoKα","","","0.087","","","","0.2531","","","","","","0.676","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307667","11.5984","0.0004","20.4269","0.0007","21.098","0.001","90.908","0.002","103.321","0.002","99.633","0.002","4787.7","0.3","153","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C53 N15 O45 Pd2 W12 -","- C53 N15 O45 Pd2 W12 -","- C106 N30 O90 Pd4 W24 -","2","1","","Kazuhiro Uehara; Ko Kasai; Noritaka Mizuno","Syntheses and Characterizations of Palladium-Based Molecular Triangle/Square Compounds and Hybrid Composites with Polyoxometalates","Inorganic Chemistry","2007","46","","2563","2570","10.1021/ic062156r","","x-ray","0.71069","MoKα","","","0.0709","","","","0.2664","","","","","","1.033","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307668","34.4639","0.0008","29.939","0.0006","15.0871","0.0004","90","","90","","90","","15567.1","0.6","153","2","","","","","","","","","","6","C m c a","-C 2ac 2","64","","","","- C44 N11 O24.5 Pd2 S6 W3 -","- C44.02 N11 O24.5 Pd2 S6 W3 -","- C352.16 N88 O196 Pd16 S48 W24 -","8","","","Kazuhiro Uehara; Ko Kasai; Noritaka Mizuno","Syntheses and Characterizations of Palladium-Based Molecular Triangle/Square Compounds and Hybrid Composites with Polyoxometalates","Inorganic Chemistry","2007","46","","2563","2570","10.1021/ic062156r","","x-ray","0.71069","MoKα","","","0.0864","","","","0.32","","","","","","0.955","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307669","18.79","0.002","20.633","0.003","22.388","0.004","91.012","0.007","92.822","0.01","90.383","0.008","8668","2","153","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C64 N16 O64 Pd4 W20 -","- C64 N16 O64 Pd4 W20 -","- C128 N32 O128 Pd8 W40 -","2","1","","Kazuhiro Uehara; Ko Kasai; Noritaka Mizuno","Syntheses and Characterizations of Palladium-Based Molecular Triangle/Square Compounds and Hybrid Composites with Polyoxometalates","Inorganic Chemistry","2007","46","","2563","2570","10.1021/ic062156r","","","0.71069","MoKα","","","0.0975","","","","0.2935","","","","","","0.687","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307670","14.3773","0.0008","16.9891","0.001","23.6467","0.0017","73.883","0.003","89.413","0.002","72.568","0.004","5277.2","0.6","153","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C32 N8 O32 Pd2 W10 -","- C32 N8 O32 Pd2 W10 -","- C64 N16 O64 Pd4 W20 -","2","1","","Kazuhiro Uehara; Ko Kasai; Noritaka Mizuno","Syntheses and Characterizations of Palladium-Based Molecular Triangle/Square Compounds and Hybrid Composites with Polyoxometalates","Inorganic Chemistry","2007","46","","2563","2570","10.1021/ic062156r","","x-ray","0.71069","MoKα","","","0.0978","","","","0.2733","","","","","","0.963","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307671","20.4824","0.0003","49.3372","0.0008","27.4","0.0006","90","","109.029","0.001","90","","26175.8","0.8","153","2","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C79 N16 O87.5 Pd4 S7.5 Si2 W24 -","- C79 N16 O87.5 Pd4 S7.513 Si2 W24 -","- C316 N64 O350 Pd16 S30.052 Si8 W96 -","4","1","","Kazuhiro Uehara; Ko Kasai; Noritaka Mizuno","Syntheses and Characterizations of Palladium-Based Molecular Triangle/Square Compounds and Hybrid Composites with Polyoxometalates","Inorganic Chemistry","2007","46","","2563","2570","10.1021/ic062156r","","x-ray","0.71069","MoKα","","","0.0784","","","","0.23","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307672","8.1712","0.0006","12.1173","0.0013","16.383","0.0011","90","","100.369","0.002","90","","1595.6","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 Cl N3 O2 Re -","- C14 H11 Cl N3 O2 Re -","- C56 H44 Cl4 N12 O8 Re4 -","4","1","","Shunsuke Sato; Akiko Sekine; Yuji Ohashi; Osamu Ishitani; Ana Maria Blanco-Rodríguez; Vlček, Jr., Antonín; Taiju Unno; Kazuhide Koike","Photochemical Ligand Substitution Reactions of fac-[Re(bpy)(CO)3Cl] and Derivatives","Inorganic Chemistry","2007","46","","3531","3540","10.1021/ic0621603","","","0.71073","MoKα","","0.0372","0.0315","","","0.0727","0.0759","","","","","","1.086","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307673","13.881","0.015","13.202","0.017","8.397","0.009","108.65","0.04","72.22","0.03","103.68","0.04","1372","3","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H26 F6 N3 O5.35 P2 Re -","- C20 H26 F6 N3 O5.35 P2 Re -","- C40 H52 F12 N6 O10.7 P4 Re2 -","2","1","","Shunsuke Sato; Akiko Sekine; Yuji Ohashi; Osamu Ishitani; Ana Maria Blanco-Rodríguez; Vlček, Jr., Antonín; Taiju Unno; Kazuhide Koike","Photochemical Ligand Substitution Reactions of fac-[Re(bpy)(CO)3Cl] and Derivatives","Inorganic Chemistry","2007","46","","3531","3540","10.1021/ic0621603","","","0.71073","MoKα","","0.0534","0.0488","","","0.1603","0.1628","","","","","","1.087","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307674","9.3103","0.0019","18.45","0.004","20.787","0.004","90","","98.55","0.03","90","","3531","1.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37 H56 Cl2 N3 P -","- C37 H56 Cl2 N3 P -","- C148 H224 Cl8 N12 P4 -","4","1","","Shaun P. Green; Cameron Jones; Guoxia Jin; Andreas Stasch","Base-Stabilized Amidodiarsenes: Synthesis, Structure, and Theoretical Studies","Inorganic Chemistry","2007","46","","8","10","10.1021/ic062163f","","","0.71073","MoKα","","0.082","0.056","","","0.143","0.1583","","","","","","1.045","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307675","12.634","0.003","10.535","0.002","36.397","0.007","90","","99.99","0.03","90","","4771","1.8","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C51 H72 As Cl2 N3 -","- C51 H72 As Cl2 N3 -","- C204 H288 As4 Cl8 N12 -","4","1","","Shaun P. Green; Cameron Jones; Guoxia Jin; Andreas Stasch","Base-Stabilized Amidodiarsenes: Synthesis, Structure, and Theoretical Studies","Inorganic Chemistry","2007","46","","8","10","10.1021/ic062163f","","","0.71073","MoKα","","0.0537","0.046","","","0.1142","0.1192","","","","","","1.035","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307676","19.856","0.004","18.17","0.004","20.189","0.004","90","","90","","90","","7284","3","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C37 H56 Cl2 N3 Sb -","- C37 H56 Cl2 N3 Sb -","- C296 H448 Cl16 N24 Sb8 -","8","1","","Shaun P. Green; Cameron Jones; Guoxia Jin; Andreas Stasch","Base-Stabilized Amidodiarsenes: Synthesis, Structure, and Theoretical Studies","Inorganic Chemistry","2007","46","","8","10","10.1021/ic062163f","","","0.71073","MoKα","","0.0417","0.0299","","","0.064","0.0688","","","","","","1.014","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307677","19.643","0.004","18.352","0.004","21.162","0.004","90","","90","","90","","7629","3","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C37 H56 I2 N3 Sb -","- C37 H56 I2 N3 Sb -","- C296 H448 I16 N24 Sb8 -","8","1","","Shaun P. Green; Cameron Jones; Guoxia Jin; Andreas Stasch","Base-Stabilized Amidodiarsenes: Synthesis, Structure, and Theoretical Studies","Inorganic Chemistry","2007","46","","8","10","10.1021/ic062163f","","","0.71073","MoKα","","0.0475","0.0324","","","0.0623","0.0668","","","","","","1.035","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307678","28.31","0.006","23.938","0.005","13.435","0.003","90","","90","","90","","9105","3","150","2","150","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C102 H144 As2 N6 -","- C102 H144 As2 N6 -","- C408 H576 As8 N24 -","4","1","","Shaun P. Green; Cameron Jones; Guoxia Jin; Andreas Stasch","Base-Stabilized Amidodiarsenes: Synthesis, Structure, and Theoretical Studies","Inorganic Chemistry","2007","46","","8","10","10.1021/ic062163f","","","0.71073","MoKα","","0.0552","0.0412","","","0.0896","0.0958","","","","","","1.041","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307679","14.0149","0.0019","14.421","0.002","28.304","0.004","90","","92.402","0.006","90","","5715.5","1.4","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C91 H112 Ho4 Mn6 N8 O54 -","- C91 H110 Ho4 Mn6 N8 O54 -","- C182 H220 Ho8 Mn12 N16 O108 -","2","0.5","","Curtis M. Zaleski; Jeff W. Kampf; Talal Mallah; Martin L. Kirk; Vincent L. Pecoraro","Assessing the Slow Magnetic Relaxation Behavior of LnIII4MnIII6 Metallacrowns","Inorganic Chemistry","2007","46","","1954","1956","10.1021/ic0621648","","","0.71073","MoKα","","0.0609","0.039","","","0.0795","0.0862","","","","","","1.077","","","","has coordinates,has disorder","179114","2020-10-21","18:00:00",""
"4307680","37.006","0.005","39.403","0.005","10.1814","0.0014","90","","90","","90","","14846","3","296","2","296","2","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C28.25 H49.5 Br Cl1.5 Mo N5 O2 -","- C28.25 H49.5 Br Cl1.5 Mo N5 O2 -","- C452 H792 Br16 Cl24 Mo16 N80 O32 -","16","1","","Laura Ion; Dolores Morales; Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Richard A. Kowenicki; Mary McPartlin","Biimidazole and Bis(amide)bipyridine Molybdenum Carbonyl Complexes as Anions Receptors","Inorganic Chemistry","2007","46","","2846","2853","10.1021/ic0621650","","","0.71073","MoKα","","0.1163","0.0602","","","0.1443","0.1582","","","","","","1.033","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307681","14.431","0.017","15.904","0.019","21.68","0.03","90","","90","","90","","4976","11","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C48 H60 Cl2 Mo N5 O4 -","- C48 H60 Cl2 Mo N5 O4 -","- C192 H240 Cl8 Mo4 N20 O16 -","4","1","","Laura Ion; Dolores Morales; Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Richard A. Kowenicki; Mary McPartlin","Biimidazole and Bis(amide)bipyridine Molybdenum Carbonyl Complexes as Anions Receptors","Inorganic Chemistry","2007","46","","2846","2853","10.1021/ic0621650","","","0.71073","MoKα","","0.0755","0.0497","","","0.1067","0.1245","","","","","","1.076","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307682","9.179","0.002","26.858","0.006","16.629","0.004","90","","102.285","0.004","90","","4005.7","1.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H39 Mo N5 O8 S -","- C37 H39 Mo N5 O8 S -","- C148 H156 Mo4 N20 O32 S4 -","4","1","","Laura Ion; Dolores Morales; Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Richard A. Kowenicki; Mary McPartlin","Biimidazole and Bis(amide)bipyridine Molybdenum Carbonyl Complexes as Anions Receptors","Inorganic Chemistry","2007","46","","2846","2853","10.1021/ic0621650","","","0.71073","MoKα","","0.0935","0.0452","","","0.0787","0.0858","","","","","","1.025","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307683","29.194","0.006","12.039","0.002","12.783","0.003","90","","90","","90","","4492.8","1.6","180","2","180","2","","","","","","","","6","I b a m","-I 2 2c","72","","","","- C17 H22 Br Mo N5 O2 -","- C16.97 H23.94 Br Mo N5 O2 -","- C135.76 H191.52 Br8 Mo8 N40 O16 -","8","0.5","","Laura Ion; Dolores Morales; Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Richard A. Kowenicki; Mary McPartlin","Biimidazole and Bis(amide)bipyridine Molybdenum Carbonyl Complexes as Anions Receptors","Inorganic Chemistry","2007","46","","2846","2853","10.1021/ic0621650","","","0.71073","MoKα","","0.068","0.049","","","0.0944","0.1011","","","","","","1.105","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307684","16.411","0.003","10.172","0.002","14.171","0.003","90","","90","","90","","2365.6","0.8","180","2","180","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C17 H22 Mo N5 O6 Re -","- C16.97 H21.94 Mo N5 O6 Re -","- C67.88 H87.76 Mo4 N20 O24 Re4 -","4","0.5","","Laura Ion; Dolores Morales; Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Richard A. Kowenicki; Mary McPartlin","Biimidazole and Bis(amide)bipyridine Molybdenum Carbonyl Complexes as Anions Receptors","Inorganic Chemistry","2007","46","","2846","2853","10.1021/ic0621650","","","0.71073","MoKα","","0.0797","0.0502","","","0.0966","0.1067","","","","","","1.142","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307685","6.665","0.002","14.74","0.005","8.779","0.003","90","","91.498","0.006","90","","862.2","0.5","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H14 N3 O4 Re -","- C16 H14 N3 O4 Re -","- C32 H28 N6 O8 Re2 -","2","1","","Luciano Cuesta; Miguel A. Huertos; Dolores Morales; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Amador Menéndez-Velázquez; Santiago García-Granda","Synthesis, Structure, and Reactivity of Mononuclear Re(I) Oximato Complexes","Inorganic Chemistry","2007","46","","2836","2845","10.1021/ic062168c","","","0.71073","MoKα","","0.0182","0.0171","","","0.0415","0.042","","","","","","1.016","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307686","20.177","0.005","13.77","0.003","20.177","0.005","90","","111.696","0.003","90","","5209","2","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C50 H27 B F24 N3 O4 Re -","- C50 H27 B F24 N3 O4 Re -","- C200 H108 B4 F96 N12 O16 Re4 -","4","1","","Luciano Cuesta; Miguel A. Huertos; Dolores Morales; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Amador Menéndez-Velázquez; Santiago García-Granda","Synthesis, Structure, and Reactivity of Mononuclear Re(I) Oximato Complexes","Inorganic Chemistry","2007","46","","2836","2845","10.1021/ic062168c","","","0.71073","MoKα","","0.0653","0.0431","","","0.1107","0.1238","","","","","","1.012","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307687","6.559","0.005","18.448","0.014","22.006","0.017","90","","90.758","0.014","90","","2663","4","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 N4 O4 Re S -","- C24 H21 N4 O4 Re S -","- C96 H84 N16 O16 Re4 S4 -","4","1","","Luciano Cuesta; Miguel A. Huertos; Dolores Morales; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Amador Menéndez-Velázquez; Santiago García-Granda","Synthesis, Structure, and Reactivity of Mononuclear Re(I) Oximato Complexes","Inorganic Chemistry","2007","46","","2836","2845","10.1021/ic062168c","","","0.71073","MoKα","","0.0937","0.0724","","","0.1706","0.1791","","","","","","1.163","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307688","9.984","0.003","11.569","0.004","13.526","0.005","103.207","0.006","111.49","0.005","95.13","0.006","1389.2","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26.25 H21.5 Cl0.5 N4 O5 Re -","- C26.25 H21.5 Cl0.5 N4 O5 Re -","- C52.5 H43 Cl N8 O10 Re2 -","2","1","","Luciano Cuesta; Miguel A. Huertos; Dolores Morales; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Amador Menéndez-Velázquez; Santiago García-Granda","Synthesis, Structure, and Reactivity of Mononuclear Re(I) Oximato Complexes","Inorganic Chemistry","2007","46","","2836","2845","10.1021/ic062168c","","","0.71073","MoKα","","0.03","0.0288","","","0.0847","0.0861","","","","","","1.023","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307689","28.471","0.014","10.101","0.005","20.223","0.01","90","","129.629","0.007","90","","4479","4","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H16 N3 O7 Re -","- C22 H16 N3 O7 Re -","- C176 H128 N24 O56 Re8 -","8","1","","Luciano Cuesta; Miguel A. Huertos; Dolores Morales; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Amador Menéndez-Velázquez; Santiago García-Granda","Synthesis, Structure, and Reactivity of Mononuclear Re(I) Oximato Complexes","Inorganic Chemistry","2007","46","","2836","2845","10.1021/ic062168c","","","0.71073","MoKα","","0.0329","0.024","","","0.052","0.0542","","","","","","1.02","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307690","7.7302","0.0015","11.292","0.002","16.019","0.003","88.46","0.03","77.65","0.03","76.79","0.03","1329.4","0.5","293","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H16 Cl2 N7 O4 Re -","- C25 H16 Cl2 N7 O4 Re -","- C50 H32 Cl4 N14 O8 Re2 -","2","1","","Luciano Cuesta; Miguel A. Huertos; Dolores Morales; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Amador Menéndez-Velázquez; Santiago García-Granda","Synthesis, Structure, and Reactivity of Mononuclear Re(I) Oximato Complexes","Inorganic Chemistry","2007","46","","2836","2845","10.1021/ic062168c","","","","CuK-alpha","","0.047","0.0408","","","0.1012","0.1057","","","","","","1.089","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307691","9.2206","0.0003","20.4832","0.0008","13.3466","0.0006","90","","94.792","0.002","90","","2511.93","0.17","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H20 N3 O10 Re -","- C21 H20 N3 O10 Re -","- C84 H80 N12 O40 Re4 -","4","1","","Luciano Cuesta; Miguel A. Huertos; Dolores Morales; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Amador Menéndez-Velázquez; Santiago García-Granda","Synthesis, Structure, and Reactivity of Mononuclear Re(I) Oximato Complexes","Inorganic Chemistry","2007","46","","2836","2845","10.1021/ic062168c","","","1.54184","CuKα","","0.0898","0.0544","","","0.1356","0.1638","","","","","","1.11","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307692","8.374","0.003","10.639","0.004","13.446","0.005","103.459","0.007","106.804","0.007","105.346","0.007","1042","0.7","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H16 N3 O8 Re -","- C19 H16 N3 O8 Re -","- C38 H32 N6 O16 Re2 -","2","1","","Luciano Cuesta; Miguel A. Huertos; Dolores Morales; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; Amador Menéndez-Velázquez; Santiago García-Granda","Synthesis, Structure, and Reactivity of Mononuclear Re(I) Oximato Complexes","Inorganic Chemistry","2007","46","","2836","2845","10.1021/ic062168c","","","0.71073","MoKα","","0.0496","0.0361","","","0.0526","0.0546","","","","","","1.021","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307693","9.039","0.001","15.0319","0.0017","9.987","0.0009","90","","95.586","0.008","90","","1350.5","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H18 Cu N4 O3 -","- C13 H18 Cu N4 O3 -","- C52 H72 Cu4 N16 O12 -","4","1","","Patricia Antunes; Rita Delgado; Michael G. B. Drew; Vitor Félix; Helmut Maecke","Copper Complexes of New Benzodioxotetraaza Macrocycles with Potential Applications in Nuclear Medicine","Inorganic Chemistry","2007","46","","3144","3153","10.1021/ic062172o","","","0.71073","MoKα","","0.0647","0.034","","","0.0699","0.0727","","","","","","0.858","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307694","9.1455","0.0013","8.4625","0.0012","15.81","0.002","90","","103.57","0.013","90","","1189.4","0.3","150","2","150","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C12 H16 N4 O2 -","- C12 H16 N4 O2 -","- C48 H64 N16 O8 -","4","1","","Patricia Antunes; Rita Delgado; Michael G. B. Drew; Vitor Félix; Helmut Maecke","Copper Complexes of New Benzodioxotetraaza Macrocycles with Potential Applications in Nuclear Medicine","Inorganic Chemistry","2007","46","","3144","3153","10.1021/ic062172o","","","0.71073","MoKα","","0.1367","0.106","","","0.315","0.3254","","","","","","1.18","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307695","6.771","0.0018","10.205","0.0015","10.2277","0.0014","90","","103.509","0.017","90","","687.2","0.2","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H18 Cu N4 O4 -","- C12 H18 Cu N4 O4 -","- C24 H36 Cu2 N8 O8 -","2","1","","Patricia Antunes; Rita Delgado; Michael G. B. Drew; Vitor Félix; Helmut Maecke","Copper Complexes of New Benzodioxotetraaza Macrocycles with Potential Applications in Nuclear Medicine","Inorganic Chemistry","2007","46","","3144","3153","10.1021/ic062172o","","","0.71073","MoKα","","0.0864","0.057","","","0.114","0.1207","","","","","","0.961","","","","has coordinates","179114","2020-10-21","18:00:00",""
"4307696","18.504","0.006","8.09","0.003","9.49","0.003","90","","119.058","0.004","90","","1241.8","0.7","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","lead lanthanum oxide chloride","","","- Cl0.5 La0.5 O3.5 Pb3 -","- Cl La O7 Pb6 -","- Cl4 La4 O28 Pb24 -","4","0.5","","Oleg I. Siidra; Sergey V. Krivovichev; Thomas Armbruster; Wulf Depmeier","Lead Rare-Earth Oxyhalides: Syntheses and Characterization of Pb6LaO7X (X = Cl, Br)","Inorganic Chemistry","2007","46","","1523","1525","10.1021/ic062191y","","","0.71073","MoKα","","0.1037","0.0663","","","0.1585","0.1717","","","","","","0.941","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307697","9.5896","0.0017","16.146","0.003","8.1459","0.0015","90","","90","","90","","1261.3","0.4","293","2","293","2","","","","","","","","4","C m c m","-C 2c 2","63","lead lanthanum oxide bromide","","","- Br0.4 La0.4 O2.8 Pb2.4 -","- Br La O7 Pb6 -","- Br4 La4 O28 Pb24 -","4","0.25","","Oleg I. Siidra; Sergey V. Krivovichev; Thomas Armbruster; Wulf Depmeier","Lead Rare-Earth Oxyhalides: Syntheses and Characterization of Pb6LaO7X (X = Cl, Br)","Inorganic Chemistry","2007","46","","1523","1525","10.1021/ic062191y","","","0.71073","MoKα","","0.067","0.0403","","","0.0713","0.0769","","","","","","0.983","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307698","3.3164","0.0005","10.484","0.003","4.3793","0.0005","90","","90","","90","","152.26","0.05","","","293","","","","","","","","","1","C m c a","-C 2ac 2","64","","","","- P -","- P -","- P8 -","8","","","Stefan Lange; Peer Schmidt; Tom Nilges","Au3SnP7@Black Phosphorus: An Easy Access to Black Phosphorus","Inorganic Chemistry","2007","46","","4028","4035","10.1021/ic062192q","","","0.71073","MoKα","","0.0187","0.0177","","","0.0454","0.0464","","","","1.16","1.16","1.16","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307699","17.927","0.007","30.512","0.011","17.102","0.006","90","","108.139","0.0016","90","","8890","6","293.1","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C66 H102 F12 Mo6 O2 P2 Ru2 S12 -","- C66 H60 F12 Mo6 O2 P2 Ru2 S12 -","- C264 H240 F48 Mo24 O8 P8 Ru8 S48 -","4","1","","Izuru Takei; Koji Kobayashi; Keita Dohki; Masanobu Hidai","Synthesis and Reactivity of a Bis(disulfide)-Bridged RuMo3S4 Double-Cubane Cluster: A New Family of Nona- or Decanuclear Mixed-Metal Sulfide Clusters with Two RuMo3S4 Units","Inorganic Chemistry","2007","46","","1045","1047","10.1021/ic0621953","","","0.7107","MoKα","","","0.0568","","","","0.1956","","","","","","1.025","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307700","11.4628","0.0007","18.196","0.0009","26.855","0.002","95.954","0.002","100.126","0.003","97.109","0.002","5426.4","0.6","293.1","","","","","","","","","","","9","P -1","-P 1","2","","","","- C82 H116 Cl8 F12 Mo6 P3 Pd Ru2 S11 -","- C82 H90 Cl8 F12 Mo6 P3 Pd Ru2 S11 -","- C164 H180 Cl16 F24 Mo12 P6 Pd2 Ru4 S22 -","2","1","","Izuru Takei; Koji Kobayashi; Keita Dohki; Masanobu Hidai","Synthesis and Reactivity of a Bis(disulfide)-Bridged RuMo3S4 Double-Cubane Cluster: A New Family of Nona- or Decanuclear Mixed-Metal Sulfide Clusters with Two RuMo3S4 Units","Inorganic Chemistry","2007","46","","1045","1047","10.1021/ic0621953","","","0.7107","MoKa","","","0.068","","","","0.084","","","","","","1.047","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307701","18.241","0.003","18.61","0.003","22.053","0.004","72.338","0.007","87.748","0.008","69.835","0.006","6678","2","293.1","","","","","","","","","","","9","P -1","-P 1","2","","","","- C103.7 H136 Cl11.8 F12 Mo6 P4 Pd2 Ru2 S11 -","- C103.7 H105 Cl11.8 F12 Mo6 P4 Pd2 Ru2 S11 -","- C207.4 H210 Cl23.6 F24 Mo12 P8 Pd4 Ru4 S22 -","2","1","","Izuru Takei; Koji Kobayashi; Keita Dohki; Masanobu Hidai","Synthesis and Reactivity of a Bis(disulfide)-Bridged RuMo3S4 Double-Cubane Cluster: A New Family of Nona- or Decanuclear Mixed-Metal Sulfide Clusters with Two RuMo3S4 Units","Inorganic Chemistry","2007","46","","1045","1047","10.1021/ic0621953","","","0.7107","MoKa","","","0.067","","","","0.202","","","","","","1.027","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307702","17.4712","0.0009","30.631","0.002","23.555","0.002","90","","100.623","0.0008","90","","12389.7","1.5","293.1","","","","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C101 H130 Cl10 F12 Mo6 P4 Pt Ru2 S10 -","- C100.5 H105 Cl10 F12 Mo6 P4 Pt Ru2 S10 -","- C402 H420 Cl40 F48 Mo24 P16 Pt4 Ru8 S40 -","4","1","","Izuru Takei; Koji Kobayashi; Keita Dohki; Masanobu Hidai","Synthesis and Reactivity of a Bis(disulfide)-Bridged RuMo3S4 Double-Cubane Cluster: A New Family of Nona- or Decanuclear Mixed-Metal Sulfide Clusters with Two RuMo3S4 Units","Inorganic Chemistry","2007","46","","1045","1047","10.1021/ic0621953","","","0.7107","MoKa","","","0.064","","","","0.188","","","","","","1.05","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307703","16.111","0.003","20.119","0.003","17.299","0.003","90","","92.803","0.003","90","","5600.5","1.7","100","2","100","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C28 H40 Au2 Cl5 F24 N4 O8 P4 Rh -","- C28 H40 Au2 Cl5 F24 N4 O8 P4 Rh -","- C112 H160 Au8 Cl20 F96 N16 O32 P16 Rh4 -","4","1","","Arthur J. Esswein; Jillian L. Dempsey; Daniel G. Nocera","A RhII-AuII Bimetallic Core with a Direct Metal-Metal Bond","Inorganic Chemistry","2007","46","","2362","2364","10.1021/ic062203f","","","0.71073","MoKα","","0.0347","0.0299","","","0.0751","0.0773","","","","","","1.018","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307704","23.5341","0.0013","10.8576","0.0006","22.769","0.0012","90","","116.454","0.001","90","","5208.8","0.5","100","2","100","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C28 H40 Au Cl2 F24 N4 O8 P4 Rh -","- C28 H40 Au Cl2 F24 N4 O8 P4 Rh -","- C112 H160 Au4 Cl8 F96 N16 O32 P16 Rh4 -","4","1","","Arthur J. Esswein; Jillian L. Dempsey; Daniel G. Nocera","A RhII-AuII Bimetallic Core with a Direct Metal-Metal Bond","Inorganic Chemistry","2007","46","","2362","2364","10.1021/ic062203f","","","0.71073","MoKα","","0.0445","0.0334","","","0.0757","0.0827","","","","","","1.031","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307705","12.9108","0.0014","24.157","0.003","16.0473","0.0017","90","","103.708","0.004","90","","4862.4","1","100","2","100","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C23 H31 Au Cl4 F24 N3 O8 P4 Rh -","- C23 H31 Au Cl4 F24 N3 O8 P4 Rh -","- C92 H124 Au4 Cl16 F96 N12 O32 P16 Rh4 -","4","1","","Arthur J. Esswein; Jillian L. Dempsey; Daniel G. Nocera","A RhII-AuII Bimetallic Core with a Direct Metal-Metal Bond","Inorganic Chemistry","2007","46","","2362","2364","10.1021/ic062203f","","","0.71073","MoKα","","0.0607","0.0434","","","0.109","0.1274","","","","","","1.094","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307706","10.5097","0.0011","13.8322","0.0013","15.731","0.002","90","","108.772","0.005","90","","2165.2","0.4","173.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H30 Cu F6 N4 Sb -","- C14 H30 Cu F6 N4 Sb -","- C56 H120 Cu4 F24 N16 Sb4 -","4","1","","Kajita, Yuji; Arii, Hidekazu; Saito, Takahiro; Saito, Yamato; Nagatomo, Shigenori; Kitagawa, Teizo; Funahashi, Yasuhiro; Ozawa, Tomohiro; Masuda, Hideki","Syntheses, Characterization, and Dioxygen Reactivities of Cu(I) Complexes with cis,cis-1,3,5-Triaminocyclohexane Derivatives: A Cu(III)2O2Intermediate Exhibiting Higher C‒H Activation","Inorganic Chemistry","2007","46","8","3322","3335","10.1021/ic062206s","","","0.7107","MoKα","","","0.031","","","","0.022","","","","","","1.008","","","","has coordinates","210308","2020-10-21","18:00:00",""
"4307707","10.264","0.006","16.788","0.01","15.995","0.008","90","","106.584","0.005","90","","2641","3","173.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H42 Cu F6 N4 Sb -","- C20 H42 Cu F6 N4 Sb -","- C80 H168 Cu4 F24 N16 Sb4 -","4","1","","Kajita, Yuji; Arii, Hidekazu; Saito, Takahiro; Saito, Yamato; Nagatomo, Shigenori; Kitagawa, Teizo; Funahashi, Yasuhiro; Ozawa, Tomohiro; Masuda, Hideki","Syntheses, Characterization, and Dioxygen Reactivities of Cu(I) Complexes with cis,cis-1,3,5-Triaminocyclohexane Derivatives: A Cu(III)2O2Intermediate Exhibiting Higher C‒H Activation","Inorganic Chemistry","2007","46","8","3322","3335","10.1021/ic062206s","","","0.7107","MoKα","","","0.0465","","","","0.1698","","","","","","1.158","","","","has coordinates","210308","2020-10-21","18:00:00",""
"4307708","10.515","0.002","28.9","0.009","10.762","0.005","90","","113.402","0.004","90","","3001.4","1.8","173.1","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C29 H33 Cu F6 N4 Sb -","- C29 H33 Cu F6 N4 Sb -","- C116 H132 Cu4 F24 N16 Sb4 -","4","1","","Kajita, Yuji; Arii, Hidekazu; Saito, Takahiro; Saito, Yamato; Nagatomo, Shigenori; Kitagawa, Teizo; Funahashi, Yasuhiro; Ozawa, Tomohiro; Masuda, Hideki","Syntheses, Characterization, and Dioxygen Reactivities of Cu(I) Complexes with cis,cis-1,3,5-Triaminocyclohexane Derivatives: A Cu(III)2O2Intermediate Exhibiting Higher C‒H Activation","Inorganic Chemistry","2007","46","8","3322","3335","10.1021/ic062206s","","","0.7107","MoKα","","","0.0391","","","","0.1368","","","","","","1.022","","","","has coordinates","210308","2020-10-21","18:00:00",""
"4307709","16.97","0.03","19.83","0.02","19.62","0.04","90","0.015","107.925","0.017","90","0.015","6282","18","103.1","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C28 H33 Cu F6 N3 O2 Sb -","- C28 H33 Cu F6 N3 O2 Sb -","- C224 H264 Cu8 F48 N24 O16 Sb8 -","8","2","","Kajita, Yuji; Arii, Hidekazu; Saito, Takahiro; Saito, Yamato; Nagatomo, Shigenori; Kitagawa, Teizo; Funahashi, Yasuhiro; Ozawa, Tomohiro; Masuda, Hideki","Syntheses, Characterization, and Dioxygen Reactivities of Cu(I) Complexes with cis,cis-1,3,5-Triaminocyclohexane Derivatives: A Cu(III)2O2Intermediate Exhibiting Higher C‒H Activation","Inorganic Chemistry","2007","46","8","3322","3335","10.1021/ic062206s","","","0.7107","MoKα","","","0.0701","","","","0.2128","","","","","","1.04","","","","has coordinates","210308","2020-10-21","18:00:00",""
"4307710","9.595","0.002","9.768","0.002","12.384","0.003","97.665","0.0013","109.349","0.0015","113.483","0.0015","956","0.4","173.1","","","","","","","","","","","7","P -1","-P 1","2","","","","- C13 H28 Cu F3 N3 O4 S -","- C13 H28 Cu F3 N3 O4 S -","- C26 H56 Cu2 F6 N6 O8 S2 -","2","1","","Kajita, Yuji; Arii, Hidekazu; Saito, Takahiro; Saito, Yamato; Nagatomo, Shigenori; Kitagawa, Teizo; Funahashi, Yasuhiro; Ozawa, Tomohiro; Masuda, Hideki","Syntheses, Characterization, and Dioxygen Reactivities of Cu(I) Complexes with cis,cis-1,3,5-Triaminocyclohexane Derivatives: A Cu(III)2O2Intermediate Exhibiting Higher C‒H Activation","Inorganic Chemistry","2007","46","8","3322","3335","10.1021/ic062206s","","","0.7107","MoKα","","","0.0311","","","","0.0827","","","","","","1.024","","","","has coordinates","210308","2020-10-21","18:00:00",""
"4307711","10.183","0.006","12.297","0.006","20.33","0.05","90","","98.29","0.03","90","","2519","6","173.1","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H40 Cu F3 N3 O5 S -","- C19 H40 Cu F3 N3 O5 S -","- C76 H160 Cu4 F12 N12 O20 S4 -","4","1","","Kajita, Yuji; Arii, Hidekazu; Saito, Takahiro; Saito, Yamato; Nagatomo, Shigenori; Kitagawa, Teizo; Funahashi, Yasuhiro; Ozawa, Tomohiro; Masuda, Hideki","Syntheses, Characterization, and Dioxygen Reactivities of Cu(I) Complexes with cis,cis-1,3,5-Triaminocyclohexane Derivatives: A Cu(III)2O2Intermediate Exhibiting Higher C‒H Activation","Inorganic Chemistry","2007","46","8","3322","3335","10.1021/ic062206s","","","0.7107","MoKα","","","0.0762","","","","0.1826","","","","","","1.512","","","","has coordinates","210308","2020-10-21","18:00:00",""
"4307712","14.411","0.007","10.865","0.007","17.783","0.009","90","0.006","91.904","0.006","90","0.006","2783","3","173.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H34 Cl Cu N3 O6 -","- C28 H34 Cl Cu N3 O6 -","- C112 H136 Cl4 Cu4 N12 O24 -","4","1","","Kajita, Yuji; Arii, Hidekazu; Saito, Takahiro; Saito, Yamato; Nagatomo, Shigenori; Kitagawa, Teizo; Funahashi, Yasuhiro; Ozawa, Tomohiro; Masuda, Hideki","Syntheses, Characterization, and Dioxygen Reactivities of Cu(I) Complexes with cis,cis-1,3,5-Triaminocyclohexane Derivatives: A Cu(III)2O2Intermediate Exhibiting Higher C‒H Activation","Inorganic Chemistry","2007","46","8","3322","3335","10.1021/ic062206s","","","0.7107","MoKα","","","0.0652","","","","0.2163","","","","","","1","","","","has coordinates","210308","2020-10-21","18:00:00",""
"4307713","9.0475","0.0011","18.228","0.002","11.7273","0.0014","90","","100.534","0.0009","90","","1901.4","0.4","173.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C12 H22 Cu F6 N3 O Sb -","- C12 H22 Cu F6 N3 O Sb -","- C48 H88 Cu4 F24 N12 O4 Sb4 -","4","1","","Kajita, Yuji; Arii, Hidekazu; Saito, Takahiro; Saito, Yamato; Nagatomo, Shigenori; Kitagawa, Teizo; Funahashi, Yasuhiro; Ozawa, Tomohiro; Masuda, Hideki","Syntheses, Characterization, and Dioxygen Reactivities of Cu(I) Complexes with cis,cis-1,3,5-Triaminocyclohexane Derivatives: A Cu(III)2O2Intermediate Exhibiting Higher C‒H Activation","Inorganic Chemistry","2007","46","8","3322","3335","10.1021/ic062206s","","","0.7107","MoKα","","","0.0504","","","","0.1391","","","","","","1.023","","","","has coordinates","210308","2020-10-21","18:00:00",""
"4307714","22.6727","0.0018","14.8307","0.0008","23.3878","0.0019","90","","99.387","0.01","90","","7758.9","1","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C50 H95 F24 Fe4 N17 O10 P4 -","- C50 H95 F24 Fe4 N17 O10 P4 -","- C200 H380 F96 Fe16 N68 O40 P16 -","4","1","","Vladimir B. Romakh; Bruno Therrien; Georg Süss-Fink; Georgiy B. Shul'pin","Synthesis, Molecular Structure, and Catalytic Potential of the Tetrairon Complex [Fe4(N3O2-L)4(μ-O)2]4+ (L = 1-Carboxymethyl-4,7-dimethyl-1,4,7-triazacyclononane)","Inorganic Chemistry","2007","46","","3166","3175","10.1021/ic062207k","","","0.71073","MoKα","","0.2013","0.0701","","","0.1667","0.2037","","","","","","0.745","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307715","14.2385","0.0007","26.3312","0.0013","10.2825","0.0005","90","","90","","90","","3855.1","0.3","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C22 H23 Cr Cu2 Mo6 N4 O28 -","- C22 H23 Cr Cu2 Mo6 N4 O28 -","- C88 H92 Cr4 Cu8 Mo24 N16 O112 -","4","1","","Ruige Cao; Shuxia Liu; Linhua Xie; Yibing Pan; Jianfang Cao; Yuanhang Ren; Lin Xu","Organic-Inorganic Hybrids Constructed of Anderson-Type Polyoxoanions and Oxalato-Bridged Dinuclear Copper Complexes","Inorganic Chemistry","2007","46","","3541","3547","10.1021/ic062208c","","","0.71073","MoKα","","0.0559","0.0416","","","0.0782","0.0831","","","","","","1.025","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307716","14.2454","0.0008","26.2933","0.0014","10.2411","0.0005","90","","90","","90","","3835.9","0.4","273","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C22 H23 Al Cu2 Mo6 N4 O28 -","- C22 H23 Al Cu2 Mo6 N4 O28 -","- C88 H92 Al4 Cu8 Mo24 N16 O112 -","4","1","","Ruige Cao; Shuxia Liu; Linhua Xie; Yibing Pan; Jianfang Cao; Yuanhang Ren; Lin Xu","Organic-Inorganic Hybrids Constructed of Anderson-Type Polyoxoanions and Oxalato-Bridged Dinuclear Copper Complexes","Inorganic Chemistry","2007","46","","3541","3547","10.1021/ic062208c","","","0.71073","MoKα","","0.0461","0.0346","","","0.0644","0.0686","","","","","","1.033","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307717","11.1004","0.0009","14.6062","0.0012","17.249","0.0013","63.667","0.006","70.728","0.006","77.087","0.006","2356.2","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H66 Cl4 Mn2 N6 O16.5 -","- C30 H44 Cl4 Mn2 N6 O6 -","- C60 H88 Cl8 Mn4 N12 O12 -","2","1","","Jian Wang; Brianna Slater; Antonio Alberola; Helen Stoeckli-Evans; Fereidoon S. Razavi; Melanie Pilkington","Rational Design of a Covalently Tethered Dinuclear [MnII(N3O2)Cl(OH2)]22+ Macrocyclic Building Block: Synthesis, Structure, and Magnetic Properties","Inorganic Chemistry","2007","46","","4763","4765","10.1021/ic062212o","","x-ray","0.71073","MoKα","","0.104","0.0799","","","0.1988","0.2106","","","","","","0.966","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307718","11.9344","0.0005","14.3433","0.0005","24.3896","0.0009","79.808","0.001","77.329","0.001","72.55","0.001","3858","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H42 B22 Cl22 N4 -","- C50 H42 B22 Cl22 N4 -","- C100 H84 B44 Cl44 N8 -","2","1","","J. Luis Gárate-Morales; Fook S. Tham; Christopher A. Reed","Do Sitting-Atop Metalloporphyrin Complexes Exist? Observation of N-H—π Bonding in Arene Solvates of a Diprotonated Porphyrin Dication","Inorganic Chemistry","2007","46","","1514","1516","10.1021/ic062213g","","","0.71073","MoKα","","0.0604","0.0361","","","0.0782","0.0887","","","","","","1.017","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307719","14.5131","0.0012","15.6384","0.0013","19.6042","0.0016","86.342","0.001","83.359","0.001","88.183","0.001","4409.2","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H60 B22 Cl22 N4 Zn0.08 -","- C68 H60 B22 Cl22 N4 Zn0.074 -","- C136 H120 B44 Cl44 N8 Zn0.148 -","2","1","","J. Luis Gárate-Morales; Fook S. Tham; Christopher A. Reed","Do Sitting-Atop Metalloporphyrin Complexes Exist? Observation of N-H—π Bonding in Arene Solvates of a Diprotonated Porphyrin Dication","Inorganic Chemistry","2007","46","","1514","1516","10.1021/ic062213g","","","0.71073","MoKα","","0.1118","0.0547","","","0.1196","0.143","","","","","","1.042","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307720","14.512","0.0015","15.8141","0.0017","19.71","0.002","87.025","0.002","82.28","0.002","87.631","0.002","4473.6","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C71 H66 B22 Cl22 N4 Zn0.05 -","- C71 H66 B22 Cl22 N4 Zn0.046 -","- C142 H132 B44 Cl44 N8 Zn0.092 -","2","1","","J. Luis Gárate-Morales; Fook S. Tham; Christopher A. Reed","Do Sitting-Atop Metalloporphyrin Complexes Exist? Observation of N-H—π Bonding in Arene Solvates of a Diprotonated Porphyrin Dication","Inorganic Chemistry","2007","46","","1514","1516","10.1021/ic062213g","","","0.71073","MoKα","","0.1106","0.0513","","","0.1109","0.134","","","","","","1.045","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307721","10.627","0.002","11.392","0.002","14.167","0.003","88.76","0.03","78.53","0.03","62.85","0.03","1490.9","0.7","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H28 Na4 O32 V4 -","- C8 H28 Na4 O32 V4 -","- C16 H56 Na8 O64 V8 -","2","1","","Peter Schwendt; Alan S. Tracey; Jozef Tatiersky; Jana Gáliková; Zdirad Žák","Vanadium(V) Tartrato Complexes: Speciation in the H3O+(OH-)/H2VO4-/(2R,3R)-Tartrate System and X-ray Crystal Structures of Na4[V4O8(rac-tart)2].12H2O and (NEt4)4[V4O8((R,R)-tart)2].6H2O (tart = C4H2O64-)","Inorganic Chemistry","2007","46","","3971","3983","10.1021/ic062223h","","","0.71073","MoKα","","0.0219","0.0193","","","0.053","0.0541","","","","","","1.084","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307722","12.225","0.002","14.029","0.003","18.298","0.004","90","","108.75","0.03","90","","2971.6","1.2","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C40 H96 N4 O26 V4 -","- C40 H96 N4 O26 V4 -","- C80 H192 N8 O52 V8 -","2","1","","Peter Schwendt; Alan S. Tracey; Jozef Tatiersky; Jana Gáliková; Zdirad Žák","Vanadium(V) Tartrato Complexes: Speciation in the H3O+(OH-)/H2VO4-/(2R,3R)-Tartrate System and X-ray Crystal Structures of Na4[V4O8(rac-tart)2].12H2O and (NEt4)4[V4O8((R,R)-tart)2].6H2O (tart = C4H2O64-)","Inorganic Chemistry","2007","46","","3971","3983","10.1021/ic062223h","","","0.71073","MoKα","","0.0703","0.0499","","","0.1173","0.1241","","","","","","0.966","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307723","14.2863","0.0007","15.7924","0.0008","52.946","0.003","90","","93.432","0.002","90","","11924","1.1","213","2","213","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","a-[Mo2(DAniF)3]2(p-anisyloxamidate)PF6","","","- C110 H112 Cl8 F6 Mo4 N14 O16 P -","- C110 H112 Cl8 F6 Mo4 N14 O16 P -","- C440 H448 Cl32 F24 Mo16 N56 O64 P4 -","4","1","","F. Albert Cotton; Chun Y. Liu; Carlos A. Murillo; Qinliang Zhao","Electronic Localization versus Delocalization Determined by the Binding of the Linker in an Isomer Pair","Inorganic Chemistry","2007","46","","2604","2611","10.1021/ic0622252","","","0.71073","MoKα","","0.077","0.0566","","","0.1239","0.1333","","","","","","1.066","","","","has coordinates,has disorder","179115","2020-10-21","18:00:00",""
"4307724","16.186","0.003","18.231","0.003","21.99","0.004","93.145","0.003","110.568","0.003","108.078","0.003","5676.7","1.8","213","2","213","2","","","","","","","","8","P -1","-P 1","2","Beta-[Mo2(DAniF)3]2(p-anisyloxamidate)PF6","","","- C109.5 H111 Cl7 F6 Mo4 N14 O16 P -","- C109.5 H111 Cl7 F6 Mo4 N14 O16 P -","- C219 H222 Cl14 F12 Mo8 N28 O32 P2 -","2","1","","F. Albert Cotton; Chun Y. Liu; Carlos A. Murillo; Qinliang Zhao","Electronic Localization versus Delocalization Determined by the Binding of the Linker in an Isomer Pair","Inorganic Chemistry","2007","46","","2604","2611","10.1021/ic0622252","","","0.71073","MoKα","","0.0642","0.051","","","0.1253","0.1384","","","","","","1.085","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307725","15.905","0.004","19.349","0.005","21.638","0.005","72.397","0.005","79.21","0.005","69.398","0.004","5917","3","213","2","213","2","","","","","","","","8","P -1","-P 1","2","a-Mo2(DAniF)3]2(p-anisyloxamidate)(PF6)2","","","- C109 H110 Cl6 F12 Mo4 N14 O16 P2 -","- C109 H110 Cl6 F12 Mo4 N14 O16 P2 -","- C218 H220 Cl12 F24 Mo8 N28 O32 P4 -","2","1","","F. Albert Cotton; Chun Y. Liu; Carlos A. Murillo; Qinliang Zhao","Electronic Localization versus Delocalization Determined by the Binding of the Linker in an Isomer Pair","Inorganic Chemistry","2007","46","","2604","2611","10.1021/ic0622252","","","0.71073","MoKα","","0.0857","0.0573","","","0.1438","0.1657","","","","","","1.066","","","","has coordinates,has disorder","179115","2020-10-21","18:00:00",""
"4307726","16.489","0.005","17.873","0.005","20.498","0.006","74.728","0.005","75.07","0.005","80.877","0.006","5604","3","213","2","213","2","","","","","","","","8","P -1","-P 1","2","Beta-[Mo(DAniF)3]2(p-anisyloxamidate)(PF6)2","","","- C108 H108 Cl4 F12 Mo4 N14 O16 P2 -","- C108 H108 Cl4 F12 Mo4 N14 O16 P2 -","- C216 H216 Cl8 F24 Mo8 N28 O32 P4 -","2","1","","F. Albert Cotton; Chun Y. Liu; Carlos A. Murillo; Qinliang Zhao","Electronic Localization versus Delocalization Determined by the Binding of the Linker in an Isomer Pair","Inorganic Chemistry","2007","46","","2604","2611","10.1021/ic0622252","","","0.71073","MoKα","","0.0897","0.0573","","","0.1393","0.165","","","","","","1.068","","","","has coordinates,has disorder","179115","2020-10-21","18:00:00",""
"4307727","10.1408","0.0003","10.8961","0.0003","16.3592","0.0004","90","","105.946","0.001","90","","1738.06","0.08","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H22 N4 O2 -","- C18 H22 N4 O2 -","- C72 H88 N16 O8 -","4","1","","Guillermo A. Santillan; Carl J. Carrano","Synthesis and Characterization of Copper(II) Complexes of Nonfacially Coordinating Heteroscorpionate Ligands (4-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane and (3-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane","Inorganic Chemistry","2007","46","","1751","1759","10.1021/ic062226u","","","0.71073","MoKα","","0.0848","0.0572","","","0.1709","0.1912","","","","","","1.031","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307728","9.2908","0.0005","22.779","0.0012","10.0016","0.0005","90","","102.1","0.002","90","","2069.66","0.19","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H21 Cl Cu N4 O7 -","- C18 H21 Cl Cu N4 O7 -","- C72 H84 Cl4 Cu4 N16 O28 -","4","1","","Guillermo A. Santillan; Carl J. Carrano","Synthesis and Characterization of Copper(II) Complexes of Nonfacially Coordinating Heteroscorpionate Ligands (4-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane and (3-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane","Inorganic Chemistry","2007","46","","1751","1759","10.1021/ic062226u","","","0.71073","MoKα","","0.08","0.0476","","","0.1259","0.1406","","","","","","1.003","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307729","9.3","0.003","15.852","0.005","13.942","0.006","90","","107.607","0.01","90","","1959.1","1.2","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18.5 H19 Cl Cu N4 O2.5 -","- C18.5 H19 Cl Cu N4 O2.5 -","- C74 H76 Cl4 Cu4 N16 O10 -","4","1","","Guillermo A. Santillan; Carl J. Carrano","Synthesis and Characterization of Copper(II) Complexes of Nonfacially Coordinating Heteroscorpionate Ligands (4-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane and (3-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane","Inorganic Chemistry","2007","46","","1751","1759","10.1021/ic062226u","","","0.71073","MoKα","","0.1781","0.0873","","","0.2288","0.2832","","","","","","0.985","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307730","12.7148","0.0008","9.6352","0.0007","13.8772","0.001","90","","90.574","0.003","90","","1700","0.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H19 N4 O2 -","- C18 H19 N4 O2 -","- C72 H76 N16 O8 -","4","1","","Guillermo A. Santillan; Carl J. Carrano","Synthesis and Characterization of Copper(II) Complexes of Nonfacially Coordinating Heteroscorpionate Ligands (4-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane and (3-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane","Inorganic Chemistry","2007","46","","1751","1759","10.1021/ic062226u","","","0.71073","MoKα","","0.0684","0.0534","","","0.1688","0.1827","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307731","16.8155","0.0008","15.5036","0.0007","18.9048","0.0008","90","","100.917","0.002","90","","4839.3","0.4","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H46 Cl2 Cu2 N8 O20 -","- C37 H46 Cl2 Cu2 N8 O20 -","- C148 H184 Cl8 Cu8 N32 O80 -","4","1","","Guillermo A. Santillan; Carl J. Carrano","Synthesis and Characterization of Copper(II) Complexes of Nonfacially Coordinating Heteroscorpionate Ligands (4-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane and (3-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane","Inorganic Chemistry","2007","46","","1751","1759","10.1021/ic062226u","","","0.71073","MoKα","","0.0818","0.0586","","","0.1746","0.1932","","","","","","1.076","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307732","11.635","0.003","14.149","0.003","12.908","0.003","90","","93.928","0.01","90","","2120","0.9","240","2","240","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H20 Cl2 Cu N4 O3 -","- C19 H20 Cl2 Cu N4 O3 -","- C76 H80 Cl8 Cu4 N16 O12 -","4","1","","Guillermo A. Santillan; Carl J. Carrano","Synthesis and Characterization of Copper(II) Complexes of Nonfacially Coordinating Heteroscorpionate Ligands (4-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane and (3-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane","Inorganic Chemistry","2007","46","","1751","1759","10.1021/ic062226u","","","0.71073","MoKα","","0.0659","0.0392","","","0.0929","0.1058","","","","","","1.016","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307733","24.4844","0.0007","10.9463","0.0003","19.7862","0.0005","90","","103.899","0.002","90","","5147.7","0.2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C23 H28 Cu N4 O8 -","- C23 H28 Cu N4 O8 -","- C184 H224 Cu8 N32 O64 -","8","1","","Guillermo A. Santillan; Carl J. Carrano","Synthesis and Characterization of Copper(II) Complexes of Nonfacially Coordinating Heteroscorpionate Ligands (4-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane and (3-Carboxyphenyl)bis(3,5-dimethylpyrazolyl)methane","Inorganic Chemistry","2007","46","","1751","1759","10.1021/ic062226u","","","0.71073","MoKα","","0.0748","0.0548","","","0.1606","0.1824","","","","","","1.033","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307734","17.888","0.002","14.947","0.001","14.418","0.001","90","","116.38","0.002","90","","3453.5","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H15 Cl2 N3 O Zn -","- C12 H15 Cl2 N3 O Zn -","- C96 H120 Cl16 N24 O8 Zn8 -","8","1","","Marcello Gennari; Matteo Tegoni; Maurizio Lanfranchi; Maria Angela Pellinghelli; Luciano Marchiò","A New Chiral N,N',O-Donor Heteroscorpionate Ligand. Structures of Ni2+, Cu2+, Zn2+ Complexes and Study of Solution Equilibria by Means of 1H NMR/UV-Vis Titrations and EXSY NMR Spectroscopy","Inorganic Chemistry","2007","46","","3367","3377","10.1021/ic062228e","","","0.71073","MoKα","","0.0501","0.0318","","","0.0781","0.0817","","","","","","1.005","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307735","8.515","0.001","10.54","0.002","10.582","0.002","63.298","0.002","86.374","0.002","69.046","0.002","786.9","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H21 N3 O2 -","- C15 H21 N3 O2 -","- C30 H42 N6 O4 -","2","1","","Marcello Gennari; Matteo Tegoni; Maurizio Lanfranchi; Maria Angela Pellinghelli; Luciano Marchiò","A New Chiral N,N',O-Donor Heteroscorpionate Ligand. Structures of Ni2+, Cu2+, Zn2+ Complexes and Study of Solution Equilibria by Means of 1H NMR/UV-Vis Titrations and EXSY NMR Spectroscopy","Inorganic Chemistry","2007","46","","3367","3377","10.1021/ic062228e","","","0.71073","MoKα","","0.0595","0.0429","","","0.1297","0.1407","","","","","","1.01","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307736","11.378","0.001","15.37","0.001","11.496","0.001","90","","102.49","0.01","90","","1962.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H54 Cl2 N6 Ni O7 -","- C33 H54 Cl2 N6 Ni O7 -","- C66 H108 Cl4 N12 Ni2 O14 -","2","0.5","","Marcello Gennari; Matteo Tegoni; Maurizio Lanfranchi; Maria Angela Pellinghelli; Luciano Marchiò","A New Chiral N,N',O-Donor Heteroscorpionate Ligand. Structures of Ni2+, Cu2+, Zn2+ Complexes and Study of Solution Equilibria by Means of 1H NMR/UV-Vis Titrations and EXSY NMR Spectroscopy","Inorganic Chemistry","2007","46","","3367","3377","10.1021/ic062228e","","","0.71073","MoKα","","0.061","0.0372","","","0.092","0.0987","","","","","","1.008","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307737","25.631","0.002","8.455","0.001","21.883","0.002","90","","121.86","0.002","90","","4027.8","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H48 Cl4 Cu2 N6 O6 -","- C31.98 H47.94 Cl4 Cu2 N6 O5.98 -","- C127.92 H191.76 Cl16 Cu8 N24 O23.92 -","4","0.5","","Marcello Gennari; Matteo Tegoni; Maurizio Lanfranchi; Maria Angela Pellinghelli; Luciano Marchiò","A New Chiral N,N',O-Donor Heteroscorpionate Ligand. Structures of Ni2+, Cu2+, Zn2+ Complexes and Study of Solution Equilibria by Means of 1H NMR/UV-Vis Titrations and EXSY NMR Spectroscopy","Inorganic Chemistry","2007","46","","3367","3377","10.1021/ic062228e","","","0.71073","MoKα","","0.0578","0.0345","","","0.0857","0.0918","","","","","","1.01","","","","has coordinates,has disorder","179115","2020-10-21","18:00:00",""
"4307738","14.037","0.008","18.297","0.006","13.928","0.008","90","","90","","90","","3577","3","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C30 H46 Cl2 Cu N6 O6 -","- C30 H46 Cl2 Cu N6 O6 -","- C120 H184 Cl8 Cu4 N24 O24 -","4","0.5","","Marcello Gennari; Matteo Tegoni; Maurizio Lanfranchi; Maria Angela Pellinghelli; Luciano Marchiò","A New Chiral N,N',O-Donor Heteroscorpionate Ligand. Structures of Ni2+, Cu2+, Zn2+ Complexes and Study of Solution Equilibria by Means of 1H NMR/UV-Vis Titrations and EXSY NMR Spectroscopy","Inorganic Chemistry","2007","46","","3367","3377","10.1021/ic062228e","","","0.71073","MoKα","","0.1291","0.0419","","","0.065","0.0783","","","","","","1.004","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307739","26.383","0.003","9.016","0.002","22.609","0.002","90","","125.33","0.02","90","","4387.5","1.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H48 Cl4 N8 O4 Zn2 -","- C34 H48 Cl4 N8 O4 Zn2 -","- C136 H192 Cl16 N32 O16 Zn8 -","4","0.5","","Marcello Gennari; Matteo Tegoni; Maurizio Lanfranchi; Maria Angela Pellinghelli; Luciano Marchiò","A New Chiral N,N',O-Donor Heteroscorpionate Ligand. Structures of Ni2+, Cu2+, Zn2+ Complexes and Study of Solution Equilibria by Means of 1H NMR/UV-Vis Titrations and EXSY NMR Spectroscopy","Inorganic Chemistry","2007","46","","3367","3377","10.1021/ic062228e","","","0.71073","MoKα","","0.1418","0.0424","","","0.0431","0.0501","","","","","","0.861","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307740","10.642","0.003","16.477","0.005","29.817","0.008","90","","90","","90","","5228","3","99","2","99","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","[Co(C5H5N)2(N3)2(H2O)]n","","","- C10 H12 Co N8 O -","- C10 H12 Co N8 O -","- C160 H192 Co16 N128 O16 -","16","0.5","","Morsy A. M. Abu-Youssef; Franz A. Mautner; Ramon Vicente","1D and 2D End-to-End Azide-Bridged Cobalt(II) Complexes: Syntheses, Crystal Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","4654","4659","10.1021/ic0622297","","","0.71069","MoKα","","0.0525","0.0376","","0.105","","0.091","","","1.056","","","1.042","","","","has coordinates,has disorder","179115","2020-10-21","18:00:00",""
"4307741","8.045","0.003","8.335","0.003","11.588","0.004","90","","93.22","0.03","90","","775.8","0.5","99","2","99","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","[Co(4-acpy)2(N3)2]n","","","- C14 H14 Co N8 O2 -","- C14 H14 Co N8 O2 -","- C28 H28 Co2 N16 O4 -","2","0.5","","Morsy A. M. Abu-Youssef; Franz A. Mautner; Ramon Vicente","1D and 2D End-to-End Azide-Bridged Cobalt(II) Complexes: Syntheses, Crystal Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","4654","4659","10.1021/ic0622297","","","0.71069","MoKα","","0.0558","0.0408","","0.095","","0.0848","","","1.088","","","1.086","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307742","37.1295","0.0008","11.0515","0.0002","24.1369","0.0004","90","","109.212","0.003","90","","9352.7","0.3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H42 Fe2 N2 O2 S6 -","- C48 H42 Fe2 N2 O2 S6 -","- C384 H336 Fe16 N16 O16 S48 -","8","1","","Prasanta Ghosh; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt","The Molecular and Electronic Structure of the Electron Transfer Series [Fe2(NO)2(S2C2R2)3]z (z= 0, -1, -2; R = phenyl, p-tolyl, p-tert-butylphenyl)","Inorganic Chemistry","2007","46","","2612","2618","10.1021/ic0622306","","","0.71073","MoKα","","0.0462","0.032","","","0.0672","0.0736","","","","","","1.088","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307743","19.0256","0.0006","29.5816","0.0009","12.0932","0.0003","90","","101.446","0.004","90","","6670.8","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C66 H78 Fe2 N2 O2 S6 -","- C66 H78 Fe2 N2 O2 S6 -","- C264 H312 Fe8 N8 O8 S24 -","4","1","","Prasanta Ghosh; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt","The Molecular and Electronic Structure of the Electron Transfer Series [Fe2(NO)2(S2C2R2)3]z (z= 0, -1, -2; R = phenyl, p-tolyl, p-tert-butylphenyl)","Inorganic Chemistry","2007","46","","2612","2618","10.1021/ic0622306","","","0.71073","MoKα","","0.0853","0.0627","","","0.1059","0.1126","","","","","","1.184","","","","has coordinates,has disorder","179115","2020-10-21","18:00:00",""
"4307744","3.0899","0.0002","3.0899","0.0002","19.135","0.003","90","","90","","120","","158.22","0.03","293","2","293","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- C2 Al Ta3 -","- C2 Al Ta3 -","- C4 Al2 Ta6 -","2","0.0833333","","Johannes Etzkorn; Martin Ade; Harald Hillebrecht","Ta3AlC2 and Ta4AlC3- Single-Crystal Investigations of Two New Ternary Carbides of Tantalum Synthesized by the Molten Metal Technique","Inorganic Chemistry","2007","46","","1410","1418","10.1021/ic062231y","","","0.71073","MoKα","","0.0406","0.0296","","","0.0541","0.0567","","","","","","1.11","","","","has coordinates","190297","2020-10-21","18:00:00",""
"4307745","3.1004","0.0004","3.1004","0.0004","19.2","0.004","90","","90","","120","","159.83","0.04","293","2","293","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- C2 Al Ta3 -","- C2 Al Ta3 -","- C4 Al2 Ta6 -","2","0.0833333","","Johannes Etzkorn; Martin Ade; Harald Hillebrecht","Ta3AlC2 and Ta4AlC3- Single-Crystal Investigations of Two New Ternary Carbides of Tantalum Synthesized by the Molten Metal Technique","Inorganic Chemistry","2007","46","","1410","1418","10.1021/ic062231y","","","0.71073","MoKα","","0.0603","0.0338","","","0.0383","0.0407","","","","","","1.025","","","","has coordinates","190297","2020-10-21","18:00:00",""
"4307746","3.1123","0.0005","3.1123","0.0005","24.111","0.005","90","","90","","120","","202.26","0.06","293","2","293","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- C3 Al Ta4 -","- C3 Al Ta4 -","- C6 Al2 Ta8 -","2","0.0833333","","Johannes Etzkorn; Martin Ade; Harald Hillebrecht","Ta3AlC2 and Ta4AlC3- Single-Crystal Investigations of Two New Ternary Carbides of Tantalum Synthesized by the Molten Metal Technique","Inorganic Chemistry","2007","46","","1410","1418","10.1021/ic062231y","","","0.71073","MoKα","","0.0491","0.0341","","","0.0535","0.0578","","","","","","1.05","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307747","13.2763","0.0002","20.7631","0.0004","15.7275","0.0003","90","","109.47","","90","","4087.48","0.13","200","2","200","2","","","","","","","Synthesized by the authors. See text","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H33 Ag6 F9 O6 S9 -","- C18 H33 Ag6 F9.015 O6 S9 -","- C72 H132 Ag24 F36.06 O24 S36 -","4","1","","Mohamed Osman Awaleh; Antonella Badia; François Brisse","One-Dimensional Coordination Polymers Incorporating Silver(I) Perfluorocarboxylate Cuboctahedral Clusters and the Bis(methylthio)methane Ligand","Inorganic Chemistry","2007","46","","3185","3191","10.1021/ic062232q","","","1.54178","CuKα","","0.0398","0.0374","","","0.098","0.0998","","","","","","1.046","","","","has coordinates,has disorder","179115","2020-10-21","18:00:00",""
"4307748","13.0172","0.0008","13.2443","0.0008","14.9673","0.0009","87.154","0.003","64.591","0.003","63.443","0.003","2052.3","0.2","153","2","153","2","","","","","","","Synthesized by the authors. See text","6","P -1","-P 1","2","","","","- C18 H27 Ag6 F15 O7 S7 -","- C18 H27 Ag6 F15 O7 S7 -","- C36 H54 Ag12 F30 O14 S14 -","2","1","","Mohamed Osman Awaleh; Antonella Badia; François Brisse","One-Dimensional Coordination Polymers Incorporating Silver(I) Perfluorocarboxylate Cuboctahedral Clusters and the Bis(methylthio)methane Ligand","Inorganic Chemistry","2007","46","","3185","3191","10.1021/ic062232q","","","1.54178","CuKα","","0.0911","0.0549","","","0.137","0.1574","","","","","","1.022","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307749","12.814","0.004","12.814","0.004","9.338","0.004","90","","90","","120","","1327.9","0.8","294","2","294","2","","","","","","","","6","P -3 1 c","-P 3 2c","163","","","","- C18 H22.5 Cu La1.5 N6 O20 -","- C18 H6 Cu La1.48 N6 O19.98 -","- C36 H12 Cu2 La2.96 N12 O39.96 -","2","0.166667","","Feng-Qin Wang; Xiang-Jun Zheng; Yong-Hong Wan; Chang-Yan Sun; Zhe-Ming Wang; Ke-Zhi Wang; Lin-Pei Jin","Novel 3D LnIII-CuI Supramolecular Architecture Based on 2D MOFs with (6,3) Topology","Inorganic Chemistry","2007","46","","2956","2958","10.1021/ic062236v","","","0.71073","MoKα","","0.0606","0.0462","","","0.1028","0.1087","","","","","","1.221","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307750","12.659","0.008","12.659","0.008","9.492","0.006","90","","90","","120","","1317.3","1.4","294","2","294","2","","","","","","","","6","P -3 1 c","-P 3 2c","163","","","","- C18 H22.5 Cu Eu1.5 N6 O20 -","- C18 H6 Cu Eu1.52 N6 O19.98 -","- C36 H12 Cu2 Eu3.04 N12 O39.96 -","2","0.166667","","Feng-Qin Wang; Xiang-Jun Zheng; Yong-Hong Wan; Chang-Yan Sun; Zhe-Ming Wang; Ke-Zhi Wang; Lin-Pei Jin","Novel 3D LnIII-CuI Supramolecular Architecture Based on 2D MOFs with (6,3) Topology","Inorganic Chemistry","2007","46","","2956","2958","10.1021/ic062236v","","","0.71073","MoKα","","0.0385","0.0284","","","0.0779","0.0841","","","","","","1.065","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307751","12.6203","0.0011","12.6203","0.0011","9.4547","0.0017","90","","90","","120","","1304.1","0.3","294","2","294","2","","","","","","","","6","P -3 1 c","-P 3 2c","163","","","","- C18 H22.5 Cu Gd1.5 N6 O20 -","- C18 H6 Cu Gd1.5 N6 O19.98 -","- C36 H12 Cu2 Gd3 N12 O39.96 -","2","0.166667","","Feng-Qin Wang; Xiang-Jun Zheng; Yong-Hong Wan; Chang-Yan Sun; Zhe-Ming Wang; Ke-Zhi Wang; Lin-Pei Jin","Novel 3D LnIII-CuI Supramolecular Architecture Based on 2D MOFs with (6,3) Topology","Inorganic Chemistry","2007","46","","2956","2958","10.1021/ic062236v","","","0.71073","MoKα","","0.0488","0.0303","","","0.0688","0.0755","","","","","","1.099","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307752","11.437","0.012","11.438","0.012","18.72","0.019","90","","90","","90","","2449","4","293","2","293","2","","","","","","","","5","P -4 n 2","P -4 -2n","118","","","","- C56 H44 N12 O4 V -","- C56 H44 N12 O4 V -","- C112 H88 N24 O8 V2 -","2","0.25","","Manas Sutradhar; Gurunath Mukherjee; Michael G. B. Drew; Saktiprosad Ghosh","Simple General Method of Generating Non-oxo, Non-amavadine Model Octacoordinated Vanadium(IV) Complexes of Some Tetradentate ONNO Chelating Ligands from Various Oxovanadium(IV/V) Compounds and Structural Characterization of One of Them","Inorganic Chemistry","2007","46","","5069","5075","10.1021/ic062242r","","","0.71073","MoKα","","0.0404","0.0383","","","0.093","0.0942","","","","","","1.062","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307753","17.498","0.009","13.694","0.007","11.349","0.006","90","","90","","90","","2719","2","173","1","173","1","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C18 H39 F3 O3 P4 S -","- C18 H39 F3 O3 P4 S -","- C72 H156 F12 O12 P16 S4 -","4","1","","C. Adam Dyker; Neil Burford; Gabriel Menard; Michael D. Lumsden; Andreas Decken","Monocyclic Di- and Triphosphinophosphonium Cations: New Foundational Frameworks for catena-Phosphorus Chemistry","Inorganic Chemistry","2007","46","","4277","4285","10.1021/ic0622499","","x-ray","0.71073","MoKα","","0.1024","0.0446","","","0.0843","0.0966","","","","","","1.016","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307754","13.773","0.01","12.781","0.009","15.071","0.01","90","","98.354","0.012","90","","2625","3","208","1","208","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H37 F3 O3 P4 S -","- C17 H37 F3 O3 P4 S -","- C68 H148 F12 O12 P16 S4 -","4","1","","C. Adam Dyker; Neil Burford; Gabriel Menard; Michael D. Lumsden; Andreas Decken","Monocyclic Di- and Triphosphinophosphonium Cations: New Foundational Frameworks for catena-Phosphorus Chemistry","Inorganic Chemistry","2007","46","","4277","4285","10.1021/ic0622499","","x-ray","0.71073","MoKα","","0.076","0.0406","","","0.0889","0.0962","","","","","","1.013","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307755","11.0069","0.0005","23.6983","0.0015","10.9874","0.0005","90","","91.538","0.004","90","","2865","0.3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H10 Cu F12 N2 O4 S4 -","- C22 H10 Cu F12 N2 O4 S4 -","- C88 H40 Cu4 F48 N8 O16 S16 -","4","1","","M'hamed Chahma; Nasser Hassan; Antonio Alberola; Helen Stoeckli-Evans; Melanie Pilkington","Preparation and Coordination Complex of the First Imine-Bridged Tetrathiafulvalene-Pyridine Donor Ligand","Inorganic Chemistry","2007","46","","3807","3809","10.1021/ic062257p","","","0.71073","MoKα","","0.0744","0.0427","","","0.0829","0.0912","","","","","","1.008","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307756","14.208","0.003","14.344","0.003","15.912","0.003","77.549","0.003","64.388","0.003","75.093","0.004","2805.5","1","200","","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H88 Cu10 Mn6 N10 O58 -","- C68 H88 Cu10 Mn6 N10 O58 -","- C68 H88 Cu10 Mn6 N10 O58 -","1","0.5","","Satoshi Yamashita; Takuya Shiga; Masashi Kurashina; Masayuki Nihei; Hiroyuki Nojiri; Hiroshi Sawa; Toru Kakiuchi; Hiroki Oshio","Manganese(III,IV) and Manganese(III) Oxide Clusters Trapped by Copper(II) Complexes","Inorganic Chemistry","2007","46","","3810","3812","10.1021/ic062258h","","","0.71073","MoKα","","0.074","0.057","","","0.1697","0.1839","","","","","","1.08","","","","has coordinates,has disorder","179115","2020-10-21","18:00:00",""
"4307757","24.702","0.002","24.702","0.002","20.365","0.003","90","","90","","90","","12426","2","100","","","","","","","","","","","6","I 41/a m d :2","-I 4bd 2","141","","","","- C64 H84 Cu8 Mn12 N12 O70 -","- C64 H84 Cu8 Mn12 N12 O70 -","- C256 H336 Cu32 Mn48 N48 O280 -","4","0.125","","Satoshi Yamashita; Takuya Shiga; Masashi Kurashina; Masayuki Nihei; Hiroyuki Nojiri; Hiroshi Sawa; Toru Kakiuchi; Hiroki Oshio","Manganese(III,IV) and Manganese(III) Oxide Clusters Trapped by Copper(II) Complexes","Inorganic Chemistry","2007","46","","3810","3812","10.1021/ic062258h","","","1","SrKα","","0.0848","0.069","","","0.2169","0.2321","","","","","","0.985","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307758","6.1596","0.0003","19.6271","0.001","16.2744","0.0009","90","","96.674","0.001","90","","1954.16","0.18","180","1","180","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H17 N5 -","- C25 H17 N5 -","- C100 H68 N20 -","4","1","","Yuan-Qing Fang; Nicholas J. Taylor; François Laverdière; Garry S. Hanan; Frédérique Loiseau; Francesco Nastasi; Sebastiano Campagna; Hélène Nierengarten; Emmanuelle Leize-Wagner; Alain Van Dorsselaer","Ruthenium(II) Complexes with Improved Photophysical Properties Based on Planar 4'-(2-Pyrimidinyl)-2,2':6',2''-terpyridine Ligands","Inorganic Chemistry","2007","46","","2854","2863","10.1021/ic0622609","","","0.71073","MoKα","","0.0855","0.057","","","0.0796","0.0848","","","","","","1.246","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307759","13.267","0.002","25.158","0.004","14.348","0.002","90","","109.739","0.002","90","","4507.6","1.2","447","2","173","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C42 H26 F17 N10 O3 P2 Ru -","- C46 H32 F5 N13 O6.25 Ru -","- C184 H128 F20 N52 O25 Ru4 -","4","1","","Yuan-Qing Fang; Nicholas J. Taylor; François Laverdière; Garry S. Hanan; Frédérique Loiseau; Francesco Nastasi; Sebastiano Campagna; Hélène Nierengarten; Emmanuelle Leize-Wagner; Alain Van Dorsselaer","Ruthenium(II) Complexes with Improved Photophysical Properties Based on Planar 4'-(2-Pyrimidinyl)-2,2':6',2''-terpyridine Ligands","Inorganic Chemistry","2007","46","","2854","2863","10.1021/ic0622609","","","0.71073","MoKα","","0.0652","0.0506","","","0.1235","0.1304","","","","","","1.007","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307760","8.6796","0.0011","12.275","0.0016","19.378","0.003","81.824","0.002","85.027","0.002","75.882","0.002","1979","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H33.17 N11.5 O6.34 Ru -","- C43 H28 N11.5 O6.34 Ru -","- C86 H56 N23 O12.68 Ru2 -","2","1","","Yuan-Qing Fang; Nicholas J. Taylor; François Laverdière; Garry S. Hanan; Frédérique Loiseau; Francesco Nastasi; Sebastiano Campagna; Hélène Nierengarten; Emmanuelle Leize-Wagner; Alain Van Dorsselaer","Ruthenium(II) Complexes with Improved Photophysical Properties Based on Planar 4'-(2-Pyrimidinyl)-2,2':6',2''-terpyridine Ligands","Inorganic Chemistry","2007","46","","2854","2863","10.1021/ic0622609","","","0.71073","MoKα","","0.1003","0.0838","","","0.1481","0.151","","","","","","1.921","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307761","16.39","0.013","15.295","0.011","14.013","0.01","73.92","0.02","69.26","0.03","66.57","0.03","2976","4","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C51.2 H51.2 N13 Ni4 O12.9 S -","- C51.2 H38 N13 Ni4 O12.9 S -","- C102.4 H76 N26 Ni8 O25.8 S2 -","2","1","","Theocharis C. Stamatatos; Eleanna Diamantopoulou; Catherine P. Raptopoulou; Vassilis Psycharis; Albert Escuer; Spyros P. Perlepes","Acetate/Di-2-pyridyl Ketone Oximate ""Blend"" as a Source of High-Nuclearity Nickel(II) Clusters: Dependence of the Nuclearity on the Nature of the Inorganic Anion Present","Inorganic Chemistry","2007","46","","2350","2352","10.1021/ic062262t","","","0.71073","MoKα","","0.0828","0.0604","","","0.16","0.1752","","","","","","1.076","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307762","16.8789","0.0015","25.14","0.002","18.2298","0.0016","90","","113.63","0.003","90","","7086.9","1.1","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48.5 H56.4 N9 Ni5 O21.7 -","- C48.5 H47 N9 Ni5 O21.7 -","- C194 H188 N36 Ni20 O86.8 -","4","1","","Theocharis C. Stamatatos; Eleanna Diamantopoulou; Catherine P. Raptopoulou; Vassilis Psycharis; Albert Escuer; Spyros P. Perlepes","Acetate/Di-2-pyridyl Ketone Oximate ""Blend"" as a Source of High-Nuclearity Nickel(II) Clusters: Dependence of the Nuclearity on the Nature of the Inorganic Anion Present","Inorganic Chemistry","2007","46","","2350","2352","10.1021/ic062262t","","","1.5418","CuKα","","0.104","0.0764","","","0.2058","0.2438","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307763","21.475","0.009","21.955","0.009","11.352","0.005","90","","96.393","0.012","90","","5319","4","298","","298","","","","","","","","","5","P 1 2/a 1","-P 2ya","13","","","","- C82 H100.4 N26 Ni7 O32.2 -","- C82 H76 N26 Ni7 O32.2 -","- C164 H152 N52 Ni14 O64.4 -","2","0.5","","Theocharis C. Stamatatos; Eleanna Diamantopoulou; Catherine P. Raptopoulou; Vassilis Psycharis; Albert Escuer; Spyros P. Perlepes","Acetate/Di-2-pyridyl Ketone Oximate ""Blend"" as a Source of High-Nuclearity Nickel(II) Clusters: Dependence of the Nuclearity on the Nature of the Inorganic Anion Present","Inorganic Chemistry","2007","46","","2350","2352","10.1021/ic062262t","","","0.71073","MoKα","","0.0723","0.0453","","","0.115","0.1307","","","","","","1.099","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307764","12.003","0.003","13.907","0.003","16.065","0.004","95.431","0.005","109.997","0.004","106.291","0.004","2364.2","1","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H60 B Fe N12 O -","- C44 H60 B Fe N12 O -","- C88 H120 B2 Fe2 N24 O2 -","2","1","","Zhi-Guo Gu; Wei Liu; Qiao-Fang Yang; Xin-Hui Zhou; Jing-Lin Zuo; Xiao-Zeng You","Cyano-Bridged FeIII2CuII3 and FeIII4NiII4 Complexes: Syntheses, Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","3236","3244","10.1021/ic062267q","","","0.71073","MoKα","","0.0958","0.0586","","","0.113","0.1199","","","","","","1.047","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307765","14.7644","0.0002","18.0753","0.0002","26.8753","0.0003","90","","90","","90","","7172.24","0.15","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C31 H48 B Fe N12 -","- C31 H48 B Fe N12 -","- C248 H384 B8 Fe8 N96 -","8","1","","Zhi-Guo Gu; Wei Liu; Qiao-Fang Yang; Xin-Hui Zhou; Jing-Lin Zuo; Xiao-Zeng You","Cyano-Bridged FeIII2CuII3 and FeIII4NiII4 Complexes: Syntheses, Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","3236","3244","10.1021/ic062267q","","","0.71073","MoKα","","0.0782","0.044","","","0.1111","0.1267","","","","","","1.057","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307766","25.437","0.006","25.437","0.006","16.538","0.005","90","","90","","90","","10701","5","298","2","298","2","","","","","","","","8","P 42/m n m","-P 4n 2n","136","","","","- C168 H260 B4 Cl8 Cu6 Fe4 N60 O40 -","- C168 H260 B4 Cl8 Cu6 Fe4 N60 O40 -","- C336 H520 B8 Cl16 Cu12 Fe8 N120 O80 -","2","0.125","","Zhi-Guo Gu; Wei Liu; Qiao-Fang Yang; Xin-Hui Zhou; Jing-Lin Zuo; Xiao-Zeng You","Cyano-Bridged FeIII2CuII3 and FeIII4NiII4 Complexes: Syntheses, Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","3236","3244","10.1021/ic062267q","","","0.71073","MoKα","","0.1049","0.0607","","","0.1199","0.1293","","","","","","1.031","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307767","20.375","0.011","16.234","0.009","31.17","0.013","90","","119.17","0.03","90","","9002","8","291","2","291","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C114 H180 B4 Cl8 Cu6 Fe4 N62 O35 -","- C114 H180 B4 Cl8 Cu6 Fe4 N62 O35 -","- C228 H360 B8 Cl16 Cu12 Fe8 N124 O70 -","2","0.5","","Zhi-Guo Gu; Wei Liu; Qiao-Fang Yang; Xin-Hui Zhou; Jing-Lin Zuo; Xiao-Zeng You","Cyano-Bridged FeIII2CuII3 and FeIII4NiII4 Complexes: Syntheses, Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","3236","3244","10.1021/ic062267q","","","0.71073","MoKα","","0.0899","0.0559","","","0.0831","0.0888","","","","","","1.152","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307768","18.6771","0.0016","30.5524","0.0016","52.567","0.003","90","","90","","90","","29996","3","293","2","293","2","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","","","","- C112 H108 B4 Cl4 Fe4 N52 Ni4 O28 -","- C112 H108 B4 Cl4 Fe4 N52 Ni4 O28 -","- C896 H864 B32 Cl32 Fe32 N416 Ni32 O224 -","8","0.25","","Zhi-Guo Gu; Wei Liu; Qiao-Fang Yang; Xin-Hui Zhou; Jing-Lin Zuo; Xiao-Zeng You","Cyano-Bridged FeIII2CuII3 and FeIII4NiII4 Complexes: Syntheses, Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","3236","3244","10.1021/ic062267q","","","0.71073","MoKα","","0.1136","0.0667","","","0.1366","0.1459","","","","","","1.014","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307769","11.5235","0.0002","12.4295","0.0002","15.7847","0.0002","90","","95.442","0.001","90","","2250.67","0.06","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H15 B Fe N11 O3 Zn -","- C17 H15 B Fe N11 O3 Zn -","- C68 H60 B4 Fe4 N44 O12 Zn4 -","4","1","","Zhi-Guo Gu; Wei Liu; Qiao-Fang Yang; Xin-Hui Zhou; Jing-Lin Zuo; Xiao-Zeng You","Cyano-Bridged FeIII2CuII3 and FeIII4NiII4 Complexes: Syntheses, Structures, and Magnetic Properties","Inorganic Chemistry","2007","46","","3236","3244","10.1021/ic062267q","","","0.71073","MoKα","","0.0401","0.0296","","","0.0798","0.0836","","","","","","1.036","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307770","9.9639","0.0008","9.7061","0.0008","14.1313","0.0009","90","","90","","90","","1366.65","0.18","90","2","90","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C4 H6 N6 Zn -","- C4 H6 N6 Zn -","- C32 H48 N48 Zn8 -","8","1","","Wayne Ouellette; Bruce S. Hudson; Jon Zubieta","Hydrothermal and Structural Chemistry of the Zinc(II)- and Cadmium(II)-1,2,4-Triazolate Systems","Inorganic Chemistry","2007","46","","4887","4904","10.1021/ic062269a","","x-ray","0.71073","MoKα","","0.0618","0.046","","","0.108","0.1161","","","","","","1.06","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307771","6.3341","0.0006","9.6687","0.0009","9.0805","0.0008","90","","102.888","0.002","90","","542.1","0.09","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C2 H2 Br N3 Zn -","- C2 H2 Br N3 Zn -","- C8 H8 Br4 N12 Zn4 -","4","1","","Wayne Ouellette; Bruce S. Hudson; Jon Zubieta","Hydrothermal and Structural Chemistry of the Zinc(II)- and Cadmium(II)-1,2,4-Triazolate Systems","Inorganic Chemistry","2007","46","","4887","4904","10.1021/ic062269a","","x-ray","0.71073","MoKα","","0.0196","0.0185","","","0.0476","0.0481","","","","","","1.167","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307772","7.5978","0.0004","9.9695","0.0005","17.5058","0.0009","90","","90","","90","","1326","0.12","90","2","90","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C3 H6.5 N4.5 O2 Zn -","- C3 H3 N4.5 O2 Zn -","- C24 H24 N36 O16 Zn8 -","8","1","","Wayne Ouellette; Bruce S. Hudson; Jon Zubieta","Hydrothermal and Structural Chemistry of the Zinc(II)- and Cadmium(II)-1,2,4-Triazolate Systems","Inorganic Chemistry","2007","46","","4887","4904","10.1021/ic062269a","","x-ray","0.71073","MoKα","","0.0303","0.0283","","","0.0694","0.0704","","","","","","1.098","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307773","7.3183","0.0004","6.8119","0.0004","13.7846","0.0007","90","","90","","90","","687.18","0.07","90","2","90","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C H1.5 N1.5 O2.5 S0.5 Zn -","- C H1.5 N1.5 O2.5 S0.5 Zn -","- C8 H12 N12 O20 S4 Zn8 -","8","1","","Wayne Ouellette; Bruce S. Hudson; Jon Zubieta","Hydrothermal and Structural Chemistry of the Zinc(II)- and Cadmium(II)-1,2,4-Triazolate Systems","Inorganic Chemistry","2007","46","","4887","4904","10.1021/ic062269a","","x-ray","0.71073","MoKα","","0.0254","0.025","","","0.0624","0.0627","","","","","","1.263","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307774","18.07","0.0006","18.0766","0.0006","17.9952","0.0006","90","","90","","90","","5878","0.3","90","2","90","2","","","","","","","","6","C c c a :2","-C 2a 2ac","68","","","","- C6 H12.88 Cd3 F2 N9 O4.13 -","- C6 H7.378 Cd3 F2 N9 O4.128 -","- C96 H118.048 Cd48 F32 N144 O66.048 -","16","1","","Wayne Ouellette; Bruce S. Hudson; Jon Zubieta","Hydrothermal and Structural Chemistry of the Zinc(II)- and Cadmium(II)-1,2,4-Triazolate Systems","Inorganic Chemistry","2007","46","","4887","4904","10.1021/ic062269a","","x-ray","0.71073","MoKα","","0.0393","0.0374","","","0.0911","0.0921","","","","","","1.215","","","","has coordinates,has disorder","179115","2020-10-21","18:00:00",""
"4307775","7.5186","0.0004","11.7796","0.0006","12.3158","0.0006","90","","90","","90","","1090.76","0.1","90","2","90","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C2 H3 Cd Cl N3 O0.5 -","- C2 H3 Cd Cl N3 O0.5 -","- C16 H24 Cd8 Cl8 N24 O4 -","8","1","","Wayne Ouellette; Bruce S. Hudson; Jon Zubieta","Hydrothermal and Structural Chemistry of the Zinc(II)- and Cadmium(II)-1,2,4-Triazolate Systems","Inorganic Chemistry","2007","46","","4887","4904","10.1021/ic062269a","","x-ray","0.71073","MoKα","","0.0188","0.0186","","","0.0426","0.0427","","","","","","1.368","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307776","15.6858","0.0011","12.5013","0.0009","8.4003","0.0006","90","","103.091","0.001","90","","1604.4","0.2","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H6 Br3 Cd3 N9 -","- C6 H6 Br3 Cd3 N9 -","- C24 H24 Br12 Cd12 N36 -","4","1","","Wayne Ouellette; Bruce S. Hudson; Jon Zubieta","Hydrothermal and Structural Chemistry of the Zinc(II)- and Cadmium(II)-1,2,4-Triazolate Systems","Inorganic Chemistry","2007","46","","4887","4904","10.1021/ic062269a","","x-ray","0.71073","MoKα","","0.0557","0.0533","","","0.1399","0.1411","","","","","","1.15","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307777","7.8569","0.0005","10.3906","0.0006","18.578","0.0011","90","","90","","90","","1516.67","0.16","90","2","90","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C3 H3 Cd I0.5 N4.5 -","- C3 H3 Cd I0.5 N4.5 -","- C24 H24 Cd8 I4 N36 -","8","1","","Wayne Ouellette; Bruce S. Hudson; Jon Zubieta","Hydrothermal and Structural Chemistry of the Zinc(II)- and Cadmium(II)-1,2,4-Triazolate Systems","Inorganic Chemistry","2007","46","","4887","4904","10.1021/ic062269a","","x-ray","0.71073","MoKα","","0.0352","0.0295","","","0.0589","0.0611","","","","","","1.1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307778","19.6945","0.0009","17.3497","0.0008","13.879","0.0007","90","","91.047","0.002","90","","4741.6","0.4","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cd3 N16 O5 -","- C10 H10 Cd3 N16 O5 -","- C80 H80 Cd24 N128 O40 -","8","1","","Wayne Ouellette; Bruce S. Hudson; Jon Zubieta","Hydrothermal and Structural Chemistry of the Zinc(II)- and Cadmium(II)-1,2,4-Triazolate Systems","Inorganic Chemistry","2007","46","","4887","4904","10.1021/ic062269a","","x-ray","0.71073","MoKα","","0.0453","0.0421","","","0.1067","0.1079","","","","","","1.149","","","","has coordinates,has disorder","179115","2020-10-21","18:00:00",""
"4307779","9.1409","0.0004","13.5467","0.0007","13.5525","0.0007","90","","108.487","0.001","90","","1591.59","0.14","90","2","90","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C8 H12 Cd8 N12 O23 S5 -","- C8 H12 Cd8 N12 O23 S5 -","- C16 H24 Cd16 N24 O46 S10 -","2","1","","Wayne Ouellette; Bruce S. Hudson; Jon Zubieta","Hydrothermal and Structural Chemistry of the Zinc(II)- and Cadmium(II)-1,2,4-Triazolate Systems","Inorganic Chemistry","2007","46","","4887","4904","10.1021/ic062269a","","x-ray","0.71073","MoKα","","0.0166","0.0164","","","0.037","0.0371","","","","","","1.103","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307780","10.052","0.003","10.184","0.003","27.379","0.009","90","","98.371","0.009","90","","2772.9","1.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H42 N8 Ni2 O3 -","- C20 H42 N8 Ni2 O3 -","- C80 H168 N32 Ni8 O12 -","4","1","","Long Jiang; Xiao-Long Feng; Cheng-Yong Su; Xiao-Ming Chen; Tong-Bu Lu","Interchain-Solvent-Induced Chirality Change of 1D Helical Chains: From Achiral to Chiral Crystallization","Inorganic Chemistry","2007","46","","2637","2644","10.1021/ic062272u","","","0.71073","MoKα","","0.1316","0.0628","","","0.1296","0.1611","","","","","","1.032","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307781","10.026","0.002","15.02","0.004","18.179","0.005","90","","90","","90","","2737.6","1.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H39 N9 Ni2 -","- C22 H39 N9 Ni2 -","- C88 H156 N36 Ni8 -","4","1","","Long Jiang; Xiao-Long Feng; Cheng-Yong Su; Xiao-Ming Chen; Tong-Bu Lu","Interchain-Solvent-Induced Chirality Change of 1D Helical Chains: From Achiral to Chiral Crystallization","Inorganic Chemistry","2007","46","","2637","2644","10.1021/ic062272u","","","0.71073","MoKα","","0.1413","0.0748","","","0.1689","0.199","","","","","","1.046","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307782","10.066","0.003","13.747","0.004","17.948","0.006","90","","90","","90","","2483.6","1.3","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H36 N8 Ni2 -","- C20 H36 N8 Ni2 -","- C80 H144 N32 Ni8 -","4","1","","Long Jiang; Xiao-Long Feng; Cheng-Yong Su; Xiao-Ming Chen; Tong-Bu Lu","Interchain-Solvent-Induced Chirality Change of 1D Helical Chains: From Achiral to Chiral Crystallization","Inorganic Chemistry","2007","46","","2637","2644","10.1021/ic062272u","","","0.71073","MoKα","","0.0861","0.0636","","","0.1484","0.1603","","","","","","1.096","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307783","16.0165","0.0005","16.0165","0.0005","18.6084","0.0011","90","","90","","120","","4134","0.3","173","2","173","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C20 H38.5 N8 Ni2 O1.25 -","- C20 H38.505 N8 Ni2 O1.25 -","- C120 H231.03 N48 Ni12 O7.5 -","6","1","","Long Jiang; Xiao-Long Feng; Cheng-Yong Su; Xiao-Ming Chen; Tong-Bu Lu","Interchain-Solvent-Induced Chirality Change of 1D Helical Chains: From Achiral to Chiral Crystallization","Inorganic Chemistry","2007","46","","2637","2644","10.1021/ic062272u","","","0.71073","MoKα","","0.029","0.0287","","","0.0773","0.0775","","","","","","1.077","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307784","8.8632","0.0012","14.814","0.002","10.0634","0.0014","90","","95.152","0.002","90","","1316","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H40 N8 Ni2 O2 -","- C20 H40 N8 Ni2 O2 -","- C40 H80 N16 Ni4 O4 -","2","1","","Long Jiang; Xiao-Long Feng; Cheng-Yong Su; Xiao-Ming Chen; Tong-Bu Lu","Interchain-Solvent-Induced Chirality Change of 1D Helical Chains: From Achiral to Chiral Crystallization","Inorganic Chemistry","2007","46","","2637","2644","10.1021/ic062272u","","","0.71073","MoKα","","0.0399","0.0315","","","0.0696","0.0741","","","","","","1.046","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307785","8.8452","0.0014","14.816","0.003","10.0445","0.0016","90","","95.136","0.003","90","","1311.1","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H40 N8 Ni2 O2 -","- C20 H40 N8 Ni2 O2 -","- C40 H80 N16 Ni4 O4 -","2","1","","Long Jiang; Xiao-Long Feng; Cheng-Yong Su; Xiao-Ming Chen; Tong-Bu Lu","Interchain-Solvent-Induced Chirality Change of 1D Helical Chains: From Achiral to Chiral Crystallization","Inorganic Chemistry","2007","46","","2637","2644","10.1021/ic062272u","","","0.71073","MoKα","","0.1287","0.0563","","","0.083","0.1024","","","","","","0.966","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307786","8.846","0.002","14.828","0.004","10.067","0.002","90","","95.138","0.005","90","","1315.2","0.5","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H40 N8 Ni2 O2 -","- C20 H40 N8 Ni2 O2 -","- C40 H80 N16 Ni4 O4 -","2","1","","Long Jiang; Xiao-Long Feng; Cheng-Yong Su; Xiao-Ming Chen; Tong-Bu Lu","Interchain-Solvent-Induced Chirality Change of 1D Helical Chains: From Achiral to Chiral Crystallization","Inorganic Chemistry","2007","46","","2637","2644","10.1021/ic062272u","","","0.71073","MoKα","","0.0475","0.0355","","","0.0696","0.0746","","","","","","1.049","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307787","8.8514","0.0018","14.824","0.003","10.049","0.002","90","","95.148","0.004","90","","1313.2","0.5","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H40 N8 Ni2 O2 -","- C20 H40 N8 Ni2 O2 -","- C40 H80 N16 Ni4 O4 -","2","1","","Long Jiang; Xiao-Long Feng; Cheng-Yong Su; Xiao-Ming Chen; Tong-Bu Lu","Interchain-Solvent-Induced Chirality Change of 1D Helical Chains: From Achiral to Chiral Crystallization","Inorganic Chemistry","2007","46","","2637","2644","10.1021/ic062272u","","","0.71073","MoKα","","0.1077","0.0603","","","0.1191","0.1391","","","","","","1.004","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307788","15.057","0.006","15.887","0.006","18.534","0.007","74.932","0.005","70.676","0.006","71.248","0.005","3903","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H64 Hg N16 O19 -","- C68 H64 Hg N16 O19 -","- C136 H128 Hg2 N32 O38 -","2","1","","Dayu Wu; Wei Huang; Chunying Duan; Zhihua Lin; Qingjin Meng","Highly Sensitive Fluorescent Probe for Selective Detection of Hg2+ in DMF Aqueous Media","Inorganic Chemistry","2007","46","","1538","1540","10.1021/ic062274e","","","0.71073","MoKα","","0.1692","0.0768","","","0.167","0.189","","","","","","0.818","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307789","6.0002","0.0012","10.653","0.002","13.411","0.003","94.16","0.03","96.76","0.03","99.49","0.03","835.9","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H23 As B Cl N2 -","- C14 H23 As B Cl N2 -","- C28 H46 As2 B2 Cl2 N4 -","2","1","","Jari Konu; Maravanji S. Balakrishna; Tristram Chivers; Thomas W. Swaddle","New Bonding Modes for Boraamidinate Ligands in Heavy Group 15 Complexes: Fluxional Behavior of the 1:2 Complexes, LiM[PhB(NtBu)2]2 (M = As, Sb, Bi)","Inorganic Chemistry","2007","46","","2627","2636","10.1021/ic0622757","","","0.71073","MoKα","","0.0646","0.0555","","","0.1502","0.1544","","","","","","1.14","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307790","9.1398","0.0018","11.328","0.002","17.09","0.003","91.53","0.03","102.55","0.03","90.16","0.03","1726.5","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H23 B Cl N2 Sb -","- C14 H23 B Cl N2 Sb -","- C56 H92 B4 Cl4 N8 Sb4 -","4","2","","Jari Konu; Maravanji S. Balakrishna; Tristram Chivers; Thomas W. Swaddle","New Bonding Modes for Boraamidinate Ligands in Heavy Group 15 Complexes: Fluxional Behavior of the 1:2 Complexes, LiM[PhB(NtBu)2]2 (M = As, Sb, Bi)","Inorganic Chemistry","2007","46","","2627","2636","10.1021/ic0622757","","","0.71073","MoKα","","0.0383","0.0333","","","0.0831","0.0862","","","","","","1.139","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307791","33.164","0.007","9.3408","0.0019","5.5395","0.0011","90","","92.13","0.03","90","","1714.8","0.6","173","2","173","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C14 H23 B Bi Cl N2 -","- C14 H23 B Bi Cl N2 -","- C56 H92 B4 Bi4 Cl4 N8 -","4","0.5","","Jari Konu; Maravanji S. Balakrishna; Tristram Chivers; Thomas W. Swaddle","New Bonding Modes for Boraamidinate Ligands in Heavy Group 15 Complexes: Fluxional Behavior of the 1:2 Complexes, LiM[PhB(NtBu)2]2 (M = As, Sb, Bi)","Inorganic Chemistry","2007","46","","2627","2636","10.1021/ic0622757","","","0.71073","MoKα","","0.0565","0.0441","","","0.0973","0.101","","","","","","1.215","","","","has coordinates,has disorder","179115","2020-10-21","18:00:00",""
"4307792","20.053","0.004","17.372","0.004","15.402","0.003","90","","119.15","0.03","90","","4686","2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H69 B3 N6 Sb2 -","- C42 H69 B3 N6 Sb2 -","- C168 H276 B12 N24 Sb8 -","4","0.5","","Jari Konu; Maravanji S. Balakrishna; Tristram Chivers; Thomas W. Swaddle","New Bonding Modes for Boraamidinate Ligands in Heavy Group 15 Complexes: Fluxional Behavior of the 1:2 Complexes, LiM[PhB(NtBu)2]2 (M = As, Sb, Bi)","Inorganic Chemistry","2007","46","","2627","2636","10.1021/ic0622757","","","0.71073","MoKα","","0.0369","0.0268","","","0.061","0.065","","","","","","1.071","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307793","20.239","0.004","17.659","0.004","15.205","0.003","90","","120.23","0.03","90","","4695","2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H69 B3 Bi2 N6 -","- C42 H69 B3 Bi2 N6 -","- C168 H276 B12 Bi8 N24 -","4","0.5","","Jari Konu; Maravanji S. Balakrishna; Tristram Chivers; Thomas W. Swaddle","New Bonding Modes for Boraamidinate Ligands in Heavy Group 15 Complexes: Fluxional Behavior of the 1:2 Complexes, LiM[PhB(NtBu)2]2 (M = As, Sb, Bi)","Inorganic Chemistry","2007","46","","2627","2636","10.1021/ic0622757","","","0.71073","MoKα","","0.0533","0.0312","","","0.0574","0.0637","","","","","","1.015","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307794","25.99","0.005","8.6722","0.0017","18.403","0.004","90","","134.22","0.03","90","","2972.6","1.8","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H46 As B2 Li N4 -","- C28 H46 As B2 Li N4 -","- C112 H184 As4 B8 Li4 N16 -","4","0.5","","Jari Konu; Maravanji S. Balakrishna; Tristram Chivers; Thomas W. Swaddle","New Bonding Modes for Boraamidinate Ligands in Heavy Group 15 Complexes: Fluxional Behavior of the 1:2 Complexes, LiM[PhB(NtBu)2]2 (M = As, Sb, Bi)","Inorganic Chemistry","2007","46","","2627","2636","10.1021/ic0622757","","","0.71073","MoKα","","0.059","0.0533","","","0.1317","0.1342","","","","","","1.157","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307795","10.05","0.002","10.148","0.002","18.845","0.004","82.92","0.03","84.57","0.03","66.12","0.03","1741.9","0.7","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H56 As B2 Li N4 O -","- C32 H56 As B2 Li N4 O -","- C64 H112 As2 B4 Li2 N8 O2 -","2","1","","Jari Konu; Maravanji S. Balakrishna; Tristram Chivers; Thomas W. Swaddle","New Bonding Modes for Boraamidinate Ligands in Heavy Group 15 Complexes: Fluxional Behavior of the 1:2 Complexes, LiM[PhB(NtBu)2]2 (M = As, Sb, Bi)","Inorganic Chemistry","2007","46","","2627","2636","10.1021/ic0622757","","","0.71073","MoKα","","0.0329","0.0287","","","0.0704","0.0724","","","","","","1.025","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307796","25.878","0.005","8.7115","0.0017","18.521","0.004","90","","133.85","0.03","90","","3011","1.8","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H46 B2 Li N4 Sb -","- C28 H46 B2 Li N4 Sb -","- C112 H184 B8 Li4 N16 Sb4 -","4","0.5","","Jari Konu; Maravanji S. Balakrishna; Tristram Chivers; Thomas W. Swaddle","New Bonding Modes for Boraamidinate Ligands in Heavy Group 15 Complexes: Fluxional Behavior of the 1:2 Complexes, LiM[PhB(NtBu)2]2 (M = As, Sb, Bi)","Inorganic Chemistry","2007","46","","2627","2636","10.1021/ic0622757","","","0.71073","MoKα","","0.116","0.0662","","","0.126","0.1419","","","","","","1.061","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307797","12.067","0.002","20.28","0.004","14.304","0.003","90","","94.44","0.03","90","","3490","1.2","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H56 B2 Bi Li N4 O -","- C32 H56 B2 Bi Li N4 O -","- C128 H224 B8 Bi4 Li4 N16 O4 -","4","1","","Jari Konu; Maravanji S. Balakrishna; Tristram Chivers; Thomas W. Swaddle","New Bonding Modes for Boraamidinate Ligands in Heavy Group 15 Complexes: Fluxional Behavior of the 1:2 Complexes, LiM[PhB(NtBu)2]2 (M = As, Sb, Bi)","Inorganic Chemistry","2007","46","","2627","2636","10.1021/ic0622757","","","0.71073","MoKα","","0.033","0.0274","","","0.0703","0.0737","","","","","","1.048","","","","has coordinates","179115","2020-10-21","18:00:00",""
"4307798","5.5156","0.0006","5.5156","0.0006","7.6259","0.0009","90","","90","","120","","200.91","0.04","295","2","295","2","","","","","","","","3","P 64 2 2","P 64 2 (0 0 2)","181","Zirconium tin antimony (1/1.2/0.8)","Zirconium tin antimony (1/1.2/0.8)","","- Sb0.8 Sn1.2 Zr -","- Sb0.8 Sn1.2 Zr -","- Sb2.4 Sn3.6 Zr3 -","3","0.25","","Andriy V. Tkachuk; Davin G. Piercey; Arthur Mar","Ternary Zirconium Tin Antimonide ZrSn2-xSbx (0.2 < x < 0.8), Different from the Parent Binaries ZrSn2 and ZrSb2","Inorganic Chemistry","2007","46","","2877","2882","10.1021/ic062277r","","","0.71073","MoKα","","0.0266","0.0261","","","0.0934","0.0938","","","","","","1.737","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307799","5.5142","0.0004","5.5142","0.0004","7.6287","0.0006","90","","90","","120","","200.88","0.03","295","2","295","2","","","","","","","","3","P 64 2 2","P 64 2 (0 0 2)","181","Zirconium tin antimony (1/1.3/0.7)","Zirconium tin antimony (1/1.3/0.7)","","- Sb0.7 Sn1.3 Zr -","- Sb0.7 Sn1.3 Zr -","- Sb2.1 Sn3.9 Zr3 -","3","0.25","","Andriy V. Tkachuk; Davin G. Piercey; Arthur Mar","Ternary Zirconium Tin Antimonide ZrSn2-xSbx (0.2 < x < 0.8), Different from the Parent Binaries ZrSn2 and ZrSb2","Inorganic Chemistry","2007","46","","2877","2882","10.1021/ic062277r","","","0.71073","MoKα","","0.0355","0.0335","","","0.085","0.0861","","","","","","1.471","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307800","26.2799","0.0006","14.0668","0.0002","28.5669","0.0005","90","","102.282","0.0008","90","","10318.7","0.3","150","1","150","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H57 Cl2 N10 O12.5 Zn2 -","- C46 H57 Cl2 N10 O12.5 Zn2 -","- C368 H456 Cl16 N80 O100 Zn16 -","8","1","","Ewa Szajna-Fuller; Gajendrasingh K. Ingle; Rex W. Watkins; Atta M. Arif; Lisa M. Berreau","Amide Hydrolysis Reactivity of a N4O-Ligated Zinc Complex: Comparison of Kinetic and Themodynamic Parameters with Those of the Corresponding Amide Methanolysis Reaction","Inorganic Chemistry","2007","46","","2353","2355","10.1021/ic0622813","","","0.71073","MoKα","","0.0811","0.0504","","","0.113","0.1313","","","","","","1.028","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307801","10.2058","0.0008","11.5017","0.0011","19.2119","0.0017","78.689","0.007","76.26","0.007","72.3","0.007","2068.1","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H71 B11 I2 N2 Sn -","- C26 H71 B11 I2 N2 Sn -","- C52 H142 B22 I4 N4 Sn2 -","2","1","","Torben Gädt; Falko M. Schappacher; Rainer Pöttgen; Lars Wesemann","Iodination of Stanna-closo-dodecaborate","Inorganic Chemistry","2007","46","","2864","2869","10.1021/ic0622858","","","0.71073","MoKα","","0.0954","0.0727","","","0.1826","0.1983","","","","","","1.102","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307802","11.5022","0.0009","12.102","0.0009","19.9242","0.0014","87.162","0.006","86.792","0.006","81.35","0.006","2735.2","0.4","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C45 H56 B11 Fe I2 N2 P3 Sn -","- C45 H56 B11 Fe I2 N2 P3 Sn -","- C90 H112 B22 Fe2 I4 N4 P6 Sn2 -","2","1","","Torben Gädt; Falko M. Schappacher; Rainer Pöttgen; Lars Wesemann","Iodination of Stanna-closo-dodecaborate","Inorganic Chemistry","2007","46","","2864","2869","10.1021/ic0622858","","","0.71073","MoKα","","0.0515","0.0437","","","0.1036","0.107","","","","","","1.105","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307803","15.1042","0.001","8.3461","0.0006","21.8796","0.0014","90","","90.758","0.002","90","","2757.9","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25.5 H25 B N4 O3.63 Re -","- C23 H20 B N6 O4 Re -","- C92 H80 B4 N24 O16 Re4 -","4","1","","Michael Middleditch; James C. Anderson; Alexander J. Blake; Clare Wilson","A Series of [3 + 2] Cycloaddition Products from the Reaction of Rhenium Oxo Complexes with Diphenyl Ketene","Inorganic Chemistry","2007","46","","2797","2804","10.1021/ic062290b","","","0.71073","MoKα","","0.0393","0.0302","","","0.0683","0.0704","","","","","","1.07","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307804","8.4662","0.0007","11.2918","0.001","17.789","0.002","72.523","0.001","78.082","0.001","72.196","0.001","1532.1","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H32 B N2 O5 Re -","- C33 H32 B N6 O5 Re -","- C66 H64 B2 N12 O10 Re2 -","2","1","","Michael Middleditch; James C. Anderson; Alexander J. Blake; Clare Wilson","A Series of [3 + 2] Cycloaddition Products from the Reaction of Rhenium Oxo Complexes with Diphenyl Ketene","Inorganic Chemistry","2007","46","","2797","2804","10.1021/ic062290b","","","0.71073","MoKα","","0.0359","0.0337","","","0.0779","0.079","","","","","","1.101","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307805","8.5255","0.0004","31.2728","0.0014","12.1317","0.0006","90","","104.291","0.002","90","","3134.4","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25.25 H22 Cl2 N6 O8.25 Re2 -","- C25 H21 Cl2 N6 O8 Re2 -","- C100 H84 Cl8 N24 O32 Re8 -","4","1","","Michael Middleditch; James C. Anderson; Alexander J. Blake; Clare Wilson","A Series of [3 + 2] Cycloaddition Products from the Reaction of Rhenium Oxo Complexes with Diphenyl Ketene","Inorganic Chemistry","2007","46","","2797","2804","10.1021/ic062290b","","","0.71073","MoKα","","0.0351","0.0312","","","0.0803","0.082","","","","","","1.01","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307806","13.1274","0.0008","19.7989","0.0012","13.8541","0.0008","90","","99.55","0.002","90","","3550.9","0.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H34 Br N2 O2 Re -","- C42 H34 Br N2 O5 Re -","- C168 H136 Br4 N8 O20 Re4 -","4","1","","Michael Middleditch; James C. Anderson; Alexander J. Blake; Clare Wilson","A Series of [3 + 2] Cycloaddition Products from the Reaction of Rhenium Oxo Complexes with Diphenyl Ketene","Inorganic Chemistry","2007","46","","2797","2804","10.1021/ic062290b","","","0.71073","MoKα","","0.0316","0.0273","","","0.067","0.0683","","","","","","0.98","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307807","14.402","0.002","16.83","0.003","21.932","0.003","90","","108.14","0.003","90","","5051.8","1.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H22 Cl3 N O4 Re -","- C25 H22 Cl3 N2 O4 Re -","- C200 H176 Cl24 N16 O32 Re8 -","8","2","","Michael Middleditch; James C. Anderson; Alexander J. Blake; Clare Wilson","A Series of [3 + 2] Cycloaddition Products from the Reaction of Rhenium Oxo Complexes with Diphenyl Ketene","Inorganic Chemistry","2007","46","","2797","2804","10.1021/ic062290b","","","0.71073","MoKα","","0.0544","0.0351","","","0.0555","0.0598","","","","","","0.81","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307808","19.1456","0.0009","19.1456","0.0009","11.0901","0.0011","90","","90","","120","","3520.5","0.4","100","2","100","2","","","","","","","","6","P 65","P 65","170","[PhB(3-(CF3)Pz)3]Ag","","","- C18 H11 Ag B F9 N6 -","- C18 H11 Ag B F9 N6 -","- C108 H66 Ag6 B6 F54 N36 -","6","1","","H. V. Rasika Dias; Jiang Wu; Xiaoyu Wang; Krishnan Rangan","Structural Variations of Silver Ethylene Complexes Supported by Boron-Protected Fluorinated Scorpionates and the Isolation of a Ligand-Directed Silver Helix","Inorganic Chemistry","2007","46","","1960","1962","10.1021/ic062293o","","","0.71073","MoKα","","0.0733","0.0691","","","0.1879","0.1945","","","","","","1.022","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307809","13.0803","0.0005","13.0803","0.0005","11.8765","0.0004","90","","90","","90","","2032","0.13","100","2","100","2","","","","","","","","6","P 43","P 4cw","78","[MeB(3-(CF3)Pz)3]AgC2H4","","","- C15 H13 Ag B F9 N6 -","- C15 H13 Ag B F9 N6 -","- C60 H52 Ag4 B4 F36 N24 -","4","1","","H. V. Rasika Dias; Jiang Wu; Xiaoyu Wang; Krishnan Rangan","Structural Variations of Silver Ethylene Complexes Supported by Boron-Protected Fluorinated Scorpionates and the Isolation of a Ligand-Directed Silver Helix","Inorganic Chemistry","2007","46","","1960","1962","10.1021/ic062293o","","","0.71073","MoKα","","0.017","0.0168","","","0.0425","0.0426","","","","","","1.043","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307810","12.0283","0.0006","18.2095","0.0009","12.3905","0.0006","90","","117.8","0.001","90","","2400.6","0.2","163","2","163","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[PhB(3-(CF3)Pz)3]AgC2H4","","","- C20 H15 Ag B F9 N6 -","- C20 H15 Ag B F9 N6 -","- C80 H60 Ag4 B4 F36 N24 -","4","1","","H. V. Rasika Dias; Jiang Wu; Xiaoyu Wang; Krishnan Rangan","Structural Variations of Silver Ethylene Complexes Supported by Boron-Protected Fluorinated Scorpionates and the Isolation of a Ligand-Directed Silver Helix","Inorganic Chemistry","2007","46","","1960","1962","10.1021/ic062293o","","","0.71073","MoKα","","0.0442","0.0358","","","0.0857","0.0926","","","","","","1.084","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307811","15.6725","0.0011","20.2095","0.0011","27.9054","0.0017","90","","94.61","0.001","90","","8810","0.9","","","","","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","?","- C544 H360 Au4 Cl4 Cu48 F288 N104 O48 P16 -","- C544 H360 Au4 Cl4 Cu48 F288 N104 O48 P16 -","","","","Ahmed A. Mohamed; Alfredo Burini; Rossana Galassi; Daniele Paglialunga; José-Ramón Galán-Mascarós; Kim R. Dunbar; John P. Fackler","Self-assembly of a High-Nuclearity Chloride-Centered Copper(II) Cluster. Structure and Magnetic Properties of [Au(PPh3)2][trans-Cu6(μ-OH)6{μ-(3,5-CF3)2pz}6Cl]","Inorganic Chemistry","2007","46","","2348","2349","10.1021/ic062299d","","","","","","","","","","","","","","","","","","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307812","33.327","0.005","19.145","0.003","29.603","0.005","90","","106.309","0.002","90","","18128","5","91","2","91","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","{Cp2Fe[ZnTPP(THF)]2}{Cp2Fe[ZnTPP(THF)ZnTPP(MeOH)]}.3MeOH.6THF","","","- C232 H211 Fe2 N16 O13 Zn4 -","- C232 H203 Fe2 N16 O13 Zn4 -","- C928 H812 Fe8 N64 O52 Zn16 -","4","1","","Hong J. H. Wang; Laurent Jaquinod; Marilyn M. Olmstead; M. Graça H. Vicente; Karl M. Kadish; Zhongping Ou; Kevin M. Smith","Synthesis, Characterization, and Electrochemical Studies of β,β'-Fused Metallocenoporphyrins","Inorganic Chemistry","2007","46","","2898","2913","10.1021/ic062303l","","","0.71073","MoKα","","0.1639","0.0906","","","0.2147","0.247","","","","","","1.001","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307813","23","0.006","24.256","0.006","63.56","0.016","90","","95.462","0.005","90","","35298","15","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C246 H267 Dy30 I N50 O180 -","- C246 Dy30 I N50 O180 -","- C984 Dy120 I4 N200 O720 -","4","1","","Xiaojun Gu; Dongfeng Xue","Surface Modification of High-Nuclearity Lanthanide Clusters: Two Tetramers Constructed by Cage-Shaped {Dy26} Clusters and Isonicotinate Linkers","Inorganic Chemistry","2007","46","","3212","3216","10.1021/ic0623056","","","0.71073","MoKα","","0.0899","0.0504","","","0.1117","0.132","","","","","","1.012","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307814","37.962","0.002","39.63","0.003","42.08","0.003","90.189","0.001","93.505","0.001","109.604","0.001","59506","7","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C750 H933 Dy104 I4 N161 O648 -","- C750 Dy104 I4 N161 O648 -","- C1500 Dy208 I8 N322 O1296 -","2","1","","Xiaojun Gu; Dongfeng Xue","Surface Modification of High-Nuclearity Lanthanide Clusters: Two Tetramers Constructed by Cage-Shaped {Dy26} Clusters and Isonicotinate Linkers","Inorganic Chemistry","2007","46","","3212","3216","10.1021/ic0623056","","","0.71073","MoKα","","0.1703","0.0713","","","0.1326","0.1544","","","","","","0.962","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307815","8.4292","0.0006","11.9941","0.0009","15.952","0.001","90","","115.337","0.005","90","","1457.62","0.19","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H19 Cu N3 O4 -","- C12 H19 Cu N3 O4 -","- C48 H76 Cu4 N12 O16 -","4","1","","József Kaizer; Zoltán Zsigmond; Ildikó Ganszky; Gábor Speier; Michel Giorgi; Marius Réglier","New Functional Model Complexes of Intradiol-Cleaving Catechol Dioxygenases: Properties and Reactivity of CuII(L)(O2Ncat)","Inorganic Chemistry","2007","46","","4660","4666","10.1021/ic062309a","","","0.71073","MoKα","","0.0764","0.065","","","0.1892","0.2101","","","","","","1.23","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307816","35.118","0.004","10.999","0.002","18.437","0.003","90","","114.89","0.01","90","","6460.1","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H36 Cu N3 O4.5 -","- C36 H35 Cu N3 O4.5 -","- C288 H280 Cu8 N24 O36 -","8","1","","József Kaizer; Zoltán Zsigmond; Ildikó Ganszky; Gábor Speier; Michel Giorgi; Marius Réglier","New Functional Model Complexes of Intradiol-Cleaving Catechol Dioxygenases: Properties and Reactivity of CuII(L)(O2Ncat)","Inorganic Chemistry","2007","46","","4660","4666","10.1021/ic062309a","","","0.71073","MoKα","","0.1921","0.1022","","","0.2096","0.259","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307817","4.8845","0.0003","8.507","0.0006","29.6073","0.0017","90","","90","","90","","1230.26","0.14","","","","","","","","","","","","3","P m c n","-P 2n 2a","62","","","","- Ce2 D4 Ni7 -","- Ce2 D4.11 Ni7 -","- Ce16 D32.88 Ni56 -","8","1","","Yaroslav E. Filinchuk; Klaus Yvon; Herman Emerich","Tetrahedral D Atom Coordination of Nickel and Evidence for Anti-isostructural Phase Transition in Orthorhombic Ce2Ni7D~4","Inorganic Chemistry","2007","46","","2914","2920","10.1021/ic062312u","powder diffraction","neutron","1.49381","ConstantWavelengthNeutronDiffraction","","","","","","","","","2.7706","","","","","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307818","4.8748","","8.559","","21.59","","90","","90","","90","","900.808","","","","","","","","","","","","","3","P m c n","-P 2n 2a","62","","","","- Ce D2.8 Ni3 -","- Ce D2.76667 Ni3 -","- Ce12 D33.2 Ni36 -","12","1.5","","Yaroslav E. Filinchuk; Klaus Yvon; Herman Emerich","Tetrahedral D Atom Coordination of Nickel and Evidence for Anti-isostructural Phase Transition in Orthorhombic Ce2Ni7D~4","Inorganic Chemistry","2007","46","","2914","2920","10.1021/ic062312u","powder diffraction","neutron","1.49381","ConstantWavelengthNeutronDiffraction","","","","","","","","","4.4731","","","","","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307819","4.87726","0.00012","8.5291","0.0002","29.6257","0.0007","90","","90","","90","","1232.39","0.05","","","","","","","","","","","","3","P m c n","-P 2n 2a","62","","","","- Ce2 D4 Ni7 -","- Ce2 Ni7 -","- Ce16 Ni56 -","8","1","","Yaroslav E. Filinchuk; Klaus Yvon; Herman Emerich","Tetrahedral D Atom Coordination of Nickel and Evidence for Anti-isostructural Phase Transition in Orthorhombic Ce2Ni7D~4","Inorganic Chemistry","2007","46","","2914","2920","10.1021/ic062312u","powder diffraction","","","X-ray","","","","","","","","","9.7318","","","","","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307820","4.8703","0.0011","8.5493","0.0019","21.607","0.003","90","","90","","90","","899.7","0.3","","","","","","","","","","","","3","P m c n","-P 2n 2a","62","","","","- Ce D2.8 Ni3 -","- Ce D2.76667 Ni3 -","- Ce12 D33.2 Ni36 -","12","1.5","","Yaroslav E. Filinchuk; Klaus Yvon; Herman Emerich","Tetrahedral D Atom Coordination of Nickel and Evidence for Anti-isostructural Phase Transition in Orthorhombic Ce2Ni7D~4","Inorganic Chemistry","2007","46","","2914","2920","10.1021/ic062312u","powder diffraction","","","X-ray","","","","","","","","","20.9714","","","","","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307821","4.934573","0.000007","4.934573","0.000007","24.5716457","0.0000003","90","","90","","120","","518.16","0.001","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","","","- Ce2 Ni7 -","- Ce2 Ni7 -","- Ce8 Ni28 -","4","0.166667","","Yaroslav E. Filinchuk; Klaus Yvon; Herman Emerich","Tetrahedral D Atom Coordination of Nickel and Evidence for Anti-isostructural Phase Transition in Orthorhombic Ce2Ni7D~4","Inorganic Chemistry","2007","46","","2914","2920","10.1021/ic062312u","powder diffraction","","","X-ray","","","","","","","","","14.0599","","","","","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307822","4.93841","0.000002","4.93841","0.000002","24.49565","","90","","90","","120","","517.361","0.0003","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","","","- Ce2 Ni7 -","- Ce2 Ni7 -","- Ce8 Ni28 -","4","0.166667","","Yaroslav E. Filinchuk; Klaus Yvon; Herman Emerich","Tetrahedral D Atom Coordination of Nickel and Evidence for Anti-isostructural Phase Transition in Orthorhombic Ce2Ni7D~4","Inorganic Chemistry","2007","46","","2914","2920","10.1021/ic062312u","powder diffraction","","","X-ray","","","","","","","","","6.1456","","","","","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307823","4.96135","","4.96135","","16.52157","","90","","90","","120","","352.194","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","","","- Ce Ni3 -","- Ce Ni3 -","- Ce6 Ni18 -","6","0.25","","Yaroslav E. Filinchuk; Klaus Yvon; Herman Emerich","Tetrahedral D Atom Coordination of Nickel and Evidence for Anti-isostructural Phase Transition in Orthorhombic Ce2Ni7D~4","Inorganic Chemistry","2007","46","","2914","2920","10.1021/ic062312u","powder diffraction","","","X-ray","","","","","","","","","9.2787","","","","","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307824","15.7888","0.0003","19.1122","0.0004","25.302","0.0006","90","","98.396","0.001","90","","7553.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C76 H110 O6 P2 Ti -","- C76 H89 O6 P2 Ti -","- C304 H356 O24 P8 Ti4 -","4","1","","Lan-Chang Liang; Yu-Ning Chang; Hon Man Lee","Biphenolate Phosphine Complexes of Group 4 Metals","Inorganic Chemistry","2007","46","","2666","2673","10.1021/ic062314e","","","0.71073","MoKα","","0.1639","0.08","","","0.2165","0.2613","","","","","","1.037","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307825","13.0543","0.0009","15.8","0.0011","19.508","0.002","108.855","0.007","104.769","0.007","97.517","0.005","3580.6","0.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H102 O6 P2 Zr -","- C72 H102 O6 P2 Zr -","- C144 H204 O12 P4 Zr2 -","2","1","","Lan-Chang Liang; Yu-Ning Chang; Hon Man Lee","Biphenolate Phosphine Complexes of Group 4 Metals","Inorganic Chemistry","2007","46","","2666","2673","10.1021/ic062314e","","x-ray","0.71073","MoKα","","0.185","0.0896","","","0.2157","0.2679","","","","","","0.932","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307826","13.328","0.005","15.052","0.006","18.924","0.007","67.765","0.006","75.82","0.007","81.975","0.008","3402","2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H92 Hf O5 P2 -","- C68 H92 Hf O5 P2 -","- C136 H184 Hf2 O10 P4 -","2","1","","Lan-Chang Liang; Yu-Ning Chang; Hon Man Lee","Biphenolate Phosphine Complexes of Group 4 Metals","Inorganic Chemistry","2007","46","","2666","2673","10.1021/ic062314e","","x-ray","0.71073","MoKα","","0.2569","0.0829","","","0.183","0.2352","","","","","","0.836","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307827","11.234","0.0008","13.2667","0.0011","16.5354","0.0012","78.436","0.006","76.747","0.005","75.31","0.003","2293.7","0.3","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C94 H124 Cl4 O6 P2 Ti2 -","- C94 H124 Cl4 O6 P2 Ti2 -","- C94 H124 Cl4 O6 P2 Ti2 -","1","0.5","","Lan-Chang Liang; Yu-Ning Chang; Hon Man Lee","Biphenolate Phosphine Complexes of Group 4 Metals","Inorganic Chemistry","2007","46","","2666","2673","10.1021/ic062314e","","","0.71073","MoKα","","0.276","0.1313","","","0.297","0.3855","","","","","","1.068","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307828","9.4765","0.001","10.9764","0.0011","13.3235","0.0014","80.14","0.002","82.215","0.002","86.197","0.002","1351.5","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H70 Co N4 Ni2 O18 -","- C46 H70 Co N4 Ni2 O18 -","- C46 H70 Co N4 Ni2 O18 -","1","0.5","","Anuj Kumar Sharma; Francesc Lloret; Rabindranath Mukherjee","Phenolate- and Acetate (Both μ2-1,1 and μ2-1,3 Mode)-Bridged Face-Shared Trioctahedral Linear NiII3, NiII2MII (M = Mn, Co) Complexes: Ferro- and Antiferromagnetic Coupling","Inorganic Chemistry","2007","46","","5128","5130","10.1021/ic0623157","","","0.71073","MoKα","","0.1016","0.0735","","","0.1471","0.1946","","","","","","1.105","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307829","9.468","0.005","10.98","0.005","13.28","0.005","80.237","0.005","82.486","0.005","86.234","0.005","1347.6","1.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H68 N4 Ni3 O18 -","- C46 H68 N4 Ni3 O18 -","- C46 H68 N4 Ni3 O18 -","1","0.5","","Anuj Kumar Sharma; Francesc Lloret; Rabindranath Mukherjee","Phenolate- and Acetate (Both μ2-1,1 and μ2-1,3 Mode)-Bridged Face-Shared Trioctahedral Linear NiII3, NiII2MII (M = Mn, Co) Complexes: Ferro- and Antiferromagnetic Coupling","Inorganic Chemistry","2007","46","","5128","5130","10.1021/ic0623157","","","0.71069","MoKα","","0.0822","0.0573","","","0.1407","0.1511","","","","","","0.975","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307830","10.3362","0.0009","18.2471","0.0016","12.2056","0.0011","90","","113.853","0.002","90","","2105.4","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H46 Mn N4 Ni2 O12 -","- C38 H46 Mn N4 Ni2 O12 -","- C76 H92 Mn2 N8 Ni4 O24 -","2","0.5","","Anuj Kumar Sharma; Francesc Lloret; Rabindranath Mukherjee","Phenolate- and Acetate (Both μ2-1,1 and μ2-1,3 Mode)-Bridged Face-Shared Trioctahedral Linear NiII3, NiII2MII (M = Mn, Co) Complexes: Ferro- and Antiferromagnetic Coupling","Inorganic Chemistry","2007","46","","5128","5130","10.1021/ic0623157","","","0.71073","MoKα","","0.1477","0.0829","","","0.1687","0.2034","","","","","","1.058","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307831","13.036","0.002","14.613","0.003","25.751","0.004","87.617","0.014","88.199","0.013","76.658","0.013","4767.7","1.5","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C92 H72 B2 F48.75 N12 Re2 -","- C92 H72 B2 F48.7458 N12 Re2 -","- C184 H144 B4 F97.4916 N24 Re4 -","2","1","","F. Albert Cotton; Naresh S. Dalal; Penglin Huang; Sergey A. Ibragimov; Carlos A. Murillo; Paula M. B. Piccoli; Chris M. Ramsey; Arthur J. Schultz; Xiaoping Wang; Qinliang Zhao","Better Understanding of the Species with the Shortest Re26+ Bonds and Related Re27+ Species with Tetraguanidinate Paddlewheel Structures","Inorganic Chemistry","2007","46","","1718","1726","10.1021/ic062319b","powder diffraction","","","","","","","","","","","","","1.18","","","","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307832","9.3539","0.0017","15.419","0.003","13.652","0.003","90","","94.44","0.003","90","","1963.1","0.7","213","2","213","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Re2(hpp)4(CF3SO3)2","","","- C30 H48 F6 N12 O6 Re2 S2 -","- C30 H48 F6 N12 O6 Re2 S2 -","- C60 H96 F12 N24 O12 Re4 S4 -","2","0.5","","F. Albert Cotton; Naresh S. Dalal; Penglin Huang; Sergey A. Ibragimov; Carlos A. Murillo; Paula M. B. Piccoli; Chris M. Ramsey; Arthur J. Schultz; Xiaoping Wang; Qinliang Zhao","Better Understanding of the Species with the Shortest Re26+ Bonds and Related Re27+ Species with Tetraguanidinate Paddlewheel Structures","Inorganic Chemistry","2007","46","","1718","1726","10.1021/ic062319b","","","0.71073","MoKα","","0.0548","0.0392","","","0.0976","0.1109","","","","","","1.051","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307833","9.459","0.003","10.728","0.004","11.194","0.004","93.392","0.006","103.51","0.005","95.5","0.006","1095.5","0.7","213","2","213","2","","","","","","","","7","P -1","-P 1","2","Re2(hpp)4(CF3CO2)2,4CH2Cl2","","","- C34 H52 Cl4 F6 N12 O4 Re2 -","- C34.002 H52.004 Cl4.004 F6 N12 O4 Re2 -","- C34.002 H52.004 Cl4.004 F6 N12 O4 Re2 -","1","0.5","","F. Albert Cotton; Naresh S. Dalal; Penglin Huang; Sergey A. Ibragimov; Carlos A. Murillo; Paula M. B. Piccoli; Chris M. Ramsey; Arthur J. Schultz; Xiaoping Wang; Qinliang Zhao","Better Understanding of the Species with the Shortest Re26+ Bonds and Related Re27+ Species with Tetraguanidinate Paddlewheel Structures","Inorganic Chemistry","2007","46","","1718","1726","10.1021/ic062319b","","","0.71073","MoKα","","0.0223","0.021","","","0.0528","0.0536","","","","","","1.036","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307834","12.76","0.002","15.583","0.003","20.773","0.004","90","","92.453","0.003","90","","4126.7","1.3","213","2","213","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Re2(hpp)4F2,3CH2Cl2","","","- C31 H54 Cl6 F2 N12 Re2 -","- C31 H54 Cl6 F2 N12 Re2 -","- C124 H216 Cl24 F8 N48 Re8 -","4","0.5","","F. Albert Cotton; Naresh S. Dalal; Penglin Huang; Sergey A. Ibragimov; Carlos A. Murillo; Paula M. B. Piccoli; Chris M. Ramsey; Arthur J. Schultz; Xiaoping Wang; Qinliang Zhao","Better Understanding of the Species with the Shortest Re26+ Bonds and Related Re27+ Species with Tetraguanidinate Paddlewheel Structures","Inorganic Chemistry","2007","46","","1718","1726","10.1021/ic062319b","","","0.71073","MoKα","","0.0304","0.0287","","","0.0699","0.0709","","","","","","1.045","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307835","13.1621","0.0006","14.8033","0.0007","26.0223","0.0012","87.37","0.001","88.908","0.001","76.862","0.001","4932.1","0.4","213","2","213","2","","","","","","","","6","P -1","-P 1","2","[Re2(hpp)4F](TFPB)2","","","- C92 H72 B2 F48.96 N12 Re2 -","- C92 H72 B2 F48.96 N12 Re2 -","- C184 H144 B4 F97.92 N24 Re4 -","2","1","","F. Albert Cotton; Naresh S. Dalal; Penglin Huang; Sergey A. Ibragimov; Carlos A. Murillo; Paula M. B. Piccoli; Chris M. Ramsey; Arthur J. Schultz; Xiaoping Wang; Qinliang Zhao","Better Understanding of the Species with the Shortest Re26+ Bonds and Related Re27+ Species with Tetraguanidinate Paddlewheel Structures","Inorganic Chemistry","2007","46","","1718","1726","10.1021/ic062319b","","","0.71073","MoKα","","0.0568","0.041","","","0.0919","0.1026","","","","","","1.029","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307836","14.503","0.005","18.608","0.005","21.841","0.006","101.521","0.01","99.117","0.012","96.2","0.01","5643","3","120","","120","","","","","","","","","5","P -1","-P 1","2","[(C30H24N6O12Zn6)(CH3CO2)5(OH)](MeOH)3(H2O)1.5","","","- C43 H55 N6 O27.5 Zn6 -","- C43 H55 N6 O27.5 Zn6 -","- C172 H220 N24 O110 Zn24 -","4","2","","Shigehisa Akine; Shuichi Sunaga; Takanori Taniguchi; Hayato Miyazaki; Tatsuya Nabeshima","Core/Shell Oligometallic Template Synthesis of Macrocyclic Hexaoxime","Inorganic Chemistry","2007","46","","2959","2961","10.1021/ic062327s","","","0.71069","MoKα","","0.1252","0.0804","","","0.1976","0.2244","","","","","","1.032","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307837","7.574","0.001","30.384","0.001","15.263","0.001","90","","93.05","0.002","90","","3507.5","0.5","120","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","cyclic oxime trimer","","","- C32 H36 N6 O13 -","- C32 H36 N6 O13 -","- C128 H144 N24 O52 -","4","1","","Shigehisa Akine; Shuichi Sunaga; Takanori Taniguchi; Hayato Miyazaki; Tatsuya Nabeshima","Core/Shell Oligometallic Template Synthesis of Macrocyclic Hexaoxime","Inorganic Chemistry","2007","46","","2959","2961","10.1021/ic062327s","","","0.71069","MoKα","","0.0566","0.0513","","","0.1311","0.1455","","","","","","1.109","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307838","10.322","0.004","14.213","0.006","14.728","0.007","94.079","0.018","92.159","0.016","95.342","0.015","2143.7","1.6","120","","120","","","","","","","","","6","P -1","-P 1","2","(C8H4O4)3LaZn3(NO3)3(MeOH)7","","","- C31 H40 La N3 O28 Zn3 -","- C31 H40 La N3 O28 Zn3 -","- C62 H80 La2 N6 O56 Zn6 -","2","1","","Shigehisa Akine; Shuichi Sunaga; Takanori Taniguchi; Hayato Miyazaki; Tatsuya Nabeshima","Core/Shell Oligometallic Template Synthesis of Macrocyclic Hexaoxime","Inorganic Chemistry","2007","46","","2959","2961","10.1021/ic062327s","","","0.71069","MoKα","","0.0576","0.0445","","","0.0974","0.1027","","","","","","1.013","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307839","16.617","0.004","11.409","0.002","21.955","0.003","90","","90","","90","","4162.3","1.4","120","","120","","","","","","","","","6","P c a 21","P 2c -2ac","29","[LZn3La(NO3)3(MeOH)2]","","","- C32 H32 La N9 O23 Zn3 -","- C32 H32 La N9 O23 Zn3 -","- C128 H128 La4 N36 O92 Zn12 -","4","1","","Shigehisa Akine; Shuichi Sunaga; Takanori Taniguchi; Hayato Miyazaki; Tatsuya Nabeshima","Core/Shell Oligometallic Template Synthesis of Macrocyclic Hexaoxime","Inorganic Chemistry","2007","46","","2959","2961","10.1021/ic062327s","","","0.71069","MoKα","","0.0245","0.0232","","","0.0506","0.0511","","","","","","1.02","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307840","35.0914","0.001","24.8161","0.0006","16.8782","0.0005","90","","94.0136","0.0017","90","","14662","0.7","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(K-crypt)4[tBu-Ge9-Ge9-tBu]*7en","","- C94 H182 Ge18 K4 N22 O24 -","- C93.56 H162 Ge18 K4 N21.56 O24 -","- C374.24 H648 Ge72 K16 N86.24 O96 -","4","0.5","","Michael W. Hull; Angel Ugrinov; Ivaylo Petrov; Slavi C. Sevov","Alkylation of Deltahedral Zintl Clusters: Synthesis of [R-Ge9-Ge9-R]4- (R = tBu, sBu, nBu, tAm) and Structure of [tBu-Ge9-Ge9-tBu]4-","Inorganic Chemistry","2007","46","","2704","2708","10.1021/ic0623314","","","0.71073","MoKα","","0.0867","0.0625","","","0.1644","0.1779","","","","","","1.06","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307841","16.42","0.003","18.624","0.004","26.339","0.005","90","","100.08","0.03","90","","7930","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22 H54 As8 N10 O41 V12 Zn4 -","- C22 H40.8 As8 N10 O41 V12 Zn4 -","- C88 H163.2 As32 N40 O164 V48 Zn16 -","4","0.5","","Yanfei Qi; Yangguang Li; Chao Qin; Enbo Wang; Hua Jin; Dongrong Xiao; Xinglong Wang; Song Chang","From Chain to Network: Design and Analysis of Novel Organic-Inorganic Assemblies from Organically Functionalized Zinc-Substituted Polyoxovanadates and Zinc Organoamine Subunits","Inorganic Chemistry","2007","46","","3217","3230","10.1021/ic062338l","","","0.71073","MoKα","","0.1168","0.0788","","","0.2193","0.2416","","","","","","1.24","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307842","15.037","0.003","15.974","0.003","31.224","0.006","90","","101.16","0.03","90","","7358","3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H50 As8 N10 O45 V12 Zn4 -","- C18 H40 As8 N10 O45 V12 Zn4 -","- C72 H160 As32 N40 O180 V48 Zn16 -","4","1","","Yanfei Qi; Yangguang Li; Chao Qin; Enbo Wang; Hua Jin; Dongrong Xiao; Xinglong Wang; Song Chang","From Chain to Network: Design and Analysis of Novel Organic-Inorganic Assemblies from Organically Functionalized Zinc-Substituted Polyoxovanadates and Zinc Organoamine Subunits","Inorganic Chemistry","2007","46","","3217","3230","10.1021/ic062338l","","","0.71073","MoKα","","0.1126","0.0733","","","0.1964","0.2232","","","","","","1.029","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307843","19.665","0.004","28.701","0.006","27.002","0.005","90","","93.87","0.03","90","","15205","5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C29 H120 As16 N25 O90 V24 Zn8 -","- C29 H98 As16 N25 O91 V24 Zn8 -","- C116 H392 As64 N100 O364 V96 Zn32 -","4","1","","Yanfei Qi; Yangguang Li; Chao Qin; Enbo Wang; Hua Jin; Dongrong Xiao; Xinglong Wang; Song Chang","From Chain to Network: Design and Analysis of Novel Organic-Inorganic Assemblies from Organically Functionalized Zinc-Substituted Polyoxovanadates and Zinc Organoamine Subunits","Inorganic Chemistry","2007","46","","3217","3230","10.1021/ic062338l","","","0.71073","MoKα","","0.1311","0.0714","","","0.1637","0.1906","","","","","","1.048","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307844","12.901","0.003","22.591","0.005","25.299","0.005","90","","103.56","0.03","90","","7168","3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C76 H200 As32 N36 O178 V48 Zn14 -","- C84 H160 As32 N36 O178 V48 Zn14 -","- C84 H160 As32 N36 O178 V48 Zn14 -","1","0.25","","Yanfei Qi; Yangguang Li; Chao Qin; Enbo Wang; Hua Jin; Dongrong Xiao; Xinglong Wang; Song Chang","From Chain to Network: Design and Analysis of Novel Organic-Inorganic Assemblies from Organically Functionalized Zinc-Substituted Polyoxovanadates and Zinc Organoamine Subunits","Inorganic Chemistry","2007","46","","3217","3230","10.1021/ic062338l","","","0.71073","MoKα","","0.061","0.0475","","","0.161","0.1726","","","","","","1.06","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307845","19.5853","0.0008","9.03","0.0004","23.2542","0.0008","90","","112.608","0.002","90","","3796.6","0.3","150","","150","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 Cl F6 N2 Os P -","- C14 H18 Cl F6 N2 Os P -","- C112 H144 Cl8 F48 N16 Os8 P8 -","8","2","","Anna F. A. Peacock; Abraha Habtemariam; Stephen A. Moggach; Alessandro Prescimone; Simon Parsons; Peter J. Sadler","Chloro Half-Sandwich Osmium(II) Complexes: Influence of Chelated N,N-Ligands on Hydrolysis, Guanine Binding, and Cytotoxicity","Inorganic Chemistry","2007","46","","4049","4059","10.1021/ic062350d","","","0.71073","MoKα","","0.0913","0.042","","0.0972","0.0888","0.0972","","","","","","0.6814","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307846","10.002","0.0015","7.009","0.001","19.717","0.003","90","","102.447","0.002","90","","1349.8","0.3","293","","150","","","","","","","","?","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H13 Cl2 N Os -","- C14 H13 Cl2 N Os -","- C56 H52 Cl8 N4 Os4 -","4","1","","Anna F. A. Peacock; Abraha Habtemariam; Stephen A. Moggach; Alessandro Prescimone; Simon Parsons; Peter J. Sadler","Chloro Half-Sandwich Osmium(II) Complexes: Influence of Chelated N,N-Ligands on Hydrolysis, Guanine Binding, and Cytotoxicity","Inorganic Chemistry","2007","46","","4049","4059","10.1021/ic062350d","","","0.71073","MoKα","","0.0306","0.0285","","0.0802","0.0786","0.0802","","","","","","1.0434","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307847","8.2549","0.0003","12.2787","0.0004","12.8556","0.0005","84.792","0.002","82.98","0.002","80.68","0.002","1272.84","0.08","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C23 H28 Cl F6 N4 Os P -","- C23 H28 Cl F6 N4 Os P -","- C46 H56 Cl2 F12 N8 Os2 P2 -","2","1","","Anna F. A. Peacock; Abraha Habtemariam; Stephen A. Moggach; Alessandro Prescimone; Simon Parsons; Peter J. Sadler","Chloro Half-Sandwich Osmium(II) Complexes: Influence of Chelated N,N-Ligands on Hydrolysis, Guanine Binding, and Cytotoxicity","Inorganic Chemistry","2007","46","","4049","4059","10.1021/ic062350d","","","0.71073","MoKα","","0.0309","0.0285","","0.065","0.0644","0.065","","","","","","0.6645","","","","has coordinates","258736","2020-11-05","08:57:04",""
"4307848","8.1226","0.0003","10.0165","0.0004","17.3516","0.0006","101.105","0.002","96.365","0.002","109.271","0.002","1284.28","0.09","150","","150","","","","","","","","?","7","P -1","-P 1","2","","","","- C25 H24 Cl F6 N4 Os P -","- C25 H24 Cl F6 N4 Os P -","- C50 H48 Cl2 F12 N8 Os2 P2 -","2","1","","Anna F. A. Peacock; Abraha Habtemariam; Stephen A. Moggach; Alessandro Prescimone; Simon Parsons; Peter J. Sadler","Chloro Half-Sandwich Osmium(II) Complexes: Influence of Chelated N,N-Ligands on Hydrolysis, Guanine Binding, and Cytotoxicity","Inorganic Chemistry","2007","46","","4049","4059","10.1021/ic062350d","","","0.71073","MoKα","","0.0389","0.034","","0.0769","0.0749","0.0769","","","","","","0.9409","","","","has coordinates","258736","2020-11-05","08:57:04",""
"4307849","11.8153","0.0012","8.7125","0.0009","26.175","0.003","90","","102.952","0.004","90","","2625.9","0.5","150","","150","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H20 Cl F6 N4 Os P -","- C30 H20 Cl F6 N4 Os P -","- C120 H80 Cl4 F24 N16 Os4 P4 -","4","1","","Anna F. A. Peacock; Abraha Habtemariam; Stephen A. Moggach; Alessandro Prescimone; Simon Parsons; Peter J. Sadler","Chloro Half-Sandwich Osmium(II) Complexes: Influence of Chelated N,N-Ligands on Hydrolysis, Guanine Binding, and Cytotoxicity","Inorganic Chemistry","2007","46","","4049","4059","10.1021/ic062350d","","","0.71073","MoKα","","0.0428","0.04","","0.0452","0.0452","0.0452","","","","","","1.0562","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307850","12.7769","0.0003","13.3958","0.0002","26.6395","0.0006","90","","90","","90","","4559.53","0.16","293","","293","","","","","","","","?","7","P b c a","-P 2ac 2ab","61","","","","- C22 H22 Cl F6 N2 Os P -","- C22 H22 Cl F6 N2 Os P -","- C176 H176 Cl8 F48 N16 Os8 P8 -","8","1","","Anna F. A. Peacock; Abraha Habtemariam; Stephen A. Moggach; Alessandro Prescimone; Simon Parsons; Peter J. Sadler","Chloro Half-Sandwich Osmium(II) Complexes: Influence of Chelated N,N-Ligands on Hydrolysis, Guanine Binding, and Cytotoxicity","Inorganic Chemistry","2007","46","","4049","4059","10.1021/ic062350d","","","0.71073","MoKα","","0.048","0.0255","","0.0655","0.0597","0.0655","","","","","","0.599","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307851","12.722","0.003","7.9298","0.0016","18.142","0.004","90","","105.28","0.03","90","","1765.5","0.7","150","","150","","","","","","","","A. Peacock","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H22 B Cl F4 N2 Os -","- C16 H22 B Cl F4 N2 Os -","- C64 H88 B4 Cl4 F16 N8 Os4 -","4","1","","Anna F. A. Peacock; Abraha Habtemariam; Stephen A. Moggach; Alessandro Prescimone; Simon Parsons; Peter J. Sadler","Chloro Half-Sandwich Osmium(II) Complexes: Influence of Chelated N,N-Ligands on Hydrolysis, Guanine Binding, and Cytotoxicity","Inorganic Chemistry","2007","46","","4049","4059","10.1021/ic062350d","","","0.71073","MoKα","","0.044","0.0307","","0.0907","0.0802","0.0907","","","","","","0.9498","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307852","19.149","0.003","14.28","0.002","34.059","0.004","90","","92.287","0.003","90","","9306","2","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C81 H122 Fe3 N3 Ni O2 S16 -","- C81 H122 Fe3 N3 Ni O2 S16 -","- C324 H488 Fe12 N12 Ni4 O8 S64 -","4","1","","Jibin Sun; Christian Tessier; R. H. Holm","Sulfur Ligand Substitution at the Nickel(II) Sites of Cubane-Type and Cubanoid NiFe3S4 Clusters Relevant to the C-Clusters of Carbon Monoxide Dehydrogenase","Inorganic Chemistry","2007","46","","2691","2699","10.1021/ic062362z","","","0.71073","MoKα","","0.0845","0.0485","","","0.0918","0.098","","","","","","0.78","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307853","14.6496","0.0011","18.66","0.0015","34.069","0.003","90","","90","","90","","9313.2","1.3","193","2","193","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C77 H111 Fe3 N3 Ni O S15 -","- C77 H111 Fe3 N3 Ni O S15 -","- C308 H444 Fe12 N12 Ni4 O4 S60 -","4","1","","Jibin Sun; Christian Tessier; R. H. Holm","Sulfur Ligand Substitution at the Nickel(II) Sites of Cubane-Type and Cubanoid NiFe3S4 Clusters Relevant to the C-Clusters of Carbon Monoxide Dehydrogenase","Inorganic Chemistry","2007","46","","2691","2699","10.1021/ic062362z","","","0.71073","MoKα","","0.1625","0.0545","","","0.1217","0.1453","","","","","","0.78","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307854","14.5174","0.0011","19.5281","0.0015","33.269","0.002","89.047","0.004","86.254","0.004","87.217","0.004","9399.6","1.2","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C334 H462 Fe12 N12 Ni4 O3 S63 -","- C334 H462 Fe12 N12 Ni4 O3 S63 -","- C334 H462 Fe12 N12 Ni4 O3 S63 -","1","0.5","","Jibin Sun; Christian Tessier; R. H. Holm","Sulfur Ligand Substitution at the Nickel(II) Sites of Cubane-Type and Cubanoid NiFe3S4 Clusters Relevant to the C-Clusters of Carbon Monoxide Dehydrogenase","Inorganic Chemistry","2007","46","","2691","2699","10.1021/ic062362z","","","0.71073","MoKα","","0.2178","0.0903","","","0.2097","0.2578","","","","","","0.88","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307855","19.167","0.002","14.2035","0.0019","34.125","0.004","90","","92.319","0.003","90","","9282.5","1.9","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C81 H122 Cu Fe3 N3 O2 S16 -","- C81 H122 Cu Fe3 N3 O2 S16 -","- C324 H488 Cu4 Fe12 N12 O8 S64 -","4","1","","Jibin Sun; Christian Tessier; R. H. Holm","Sulfur Ligand Substitution at the Nickel(II) Sites of Cubane-Type and Cubanoid NiFe3S4 Clusters Relevant to the C-Clusters of Carbon Monoxide Dehydrogenase","Inorganic Chemistry","2007","46","","2691","2699","10.1021/ic062362z","","","0.71073","MoKα","","0.1259","0.0575","","","0.1087","0.1254","","","","","","0.818","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307856","14.127","0.002","35.084","0.006","19.619","0.003","90","","99.803","0.004","90","","9582","3","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C86 H123 Fe4 N3 O2 S17 -","- C86 H123 Fe4 N3 O2 S17 -","- C344 H492 Fe16 N12 O8 S68 -","4","1","","Jibin Sun; Christian Tessier; R. H. Holm","Sulfur Ligand Substitution at the Nickel(II) Sites of Cubane-Type and Cubanoid NiFe3S4 Clusters Relevant to the C-Clusters of Carbon Monoxide Dehydrogenase","Inorganic Chemistry","2007","46","","2691","2699","10.1021/ic062362z","","","0.71073","MoKα","","0.1294","0.0708","","","0.1657","0.1967","","","","","","1.021","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307857","13.1529","0.0003","16.9438","0.0003","23.02","0.0005","71.256","0.002","86.863","0.002","71.429","0.002","4598.7","0.19","295","2","295","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C104 H148 Cu10 N20 O128 Si2 W22 -","- C104 H64 Cu10 N20 O128 Si2 W22 -","- C104 H64 Cu10 N20 O128 Si2 W22 -","1","0.5","","Santiago Reinoso; Pablo Vitoria; Juan M. Gutiérrez-Zorrilla; Luis Lezama; Juan M. Madariaga; Leire San Felices; Amaia Iturrospe","Coexistence of Five Different Copper(II)-Phenanthroline Species in the Crystal Packing of Inorganic-Metalorganic Hybrids Based on Keggin Polyoxometalates and Copper(II)-Phenanthroline-Oxalate Complexes","Inorganic Chemistry","2007","46","","4010","4021","10.1021/ic062367w","","","0.71073","MoKα","","0.0933","0.042","","","0.0828","0.0877","","","","","","1.043","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307858","13.1674","0.0002","16.9263","0.0004","22.9728","0.0006","71.073","0.002","86.908","0.002","71.451","0.002","4584.72","0.19","295","2","295","2","","","","","","","synthesis as described","8","P -1","-P 1","2","","","","- C104 H132 Cu10 N16 O128 Rb4 Si2 W22 -","- C104 H64 Cu10 N16 O128 Rb4 Si2 W22 -","- C104 H64 Cu10 N16 O128 Rb4 Si2 W22 -","1","0.5","","Santiago Reinoso; Pablo Vitoria; Juan M. Gutiérrez-Zorrilla; Luis Lezama; Juan M. Madariaga; Leire San Felices; Amaia Iturrospe","Coexistence of Five Different Copper(II)-Phenanthroline Species in the Crystal Packing of Inorganic-Metalorganic Hybrids Based on Keggin Polyoxometalates and Copper(II)-Phenanthroline-Oxalate Complexes","Inorganic Chemistry","2007","46","","4010","4021","10.1021/ic062367w","","x-ray","0.71073","MoKα","","0.0797","0.0513","","","0.1469","0.1541","","","","","","1.017","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307859","11.554","0.002","11.94","0.002","18.039","0.003","108.352","0.003","98.82","0.003","90.829","0.004","2328.8","0.7","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","Di[1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]tricarbonylcobalt(1+) Tetracarbonylcobaltate(1-) cyclohexane solvate","","- C50.5 H51 Co2 N4 O7 -","- C50.5 H51 Co2 N4 O7 -","- C101 H102 Co4 N8 O14 -","2","1","","Hendrik van Rensburg; Robert P. Tooze; Douglas F. Foster; Stefanus Otto","Synthesis and Characterization of a Novel Cobalt Carbonyl N-Heterocyclic Carbene Salt. Crystal Structure of [Co(CO)3(IMes)2]+[Co(CO)4]-","Inorganic Chemistry","2007","46","","1963","1965","10.1021/ic062368o","","","0.71073","MoKα","","0.1081","0.0623","","","0.1396","0.1624","","","","","","1.016","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307860","9.504","0.0006","16.3094","0.001","17.1537","0.0006","90","","94.378","0.003","90","","2651.1","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","yttrium(tris(3,5-dimethylpyrazolyl)methane trichloride","","","- C20 H28 Cl3 N8 Y -","- C20 H28 Cl3 N8 Y -","- C80 H112 Cl12 N32 Y4 -","4","1","","Andrea Sella; Sarah E. Brown; Jonathan W. Steed; Derek A. Tocher","Synthesis and Solid-State Structures of Pyrazolylmethane Complexes of the Rare Earths","Inorganic Chemistry","2007","46","","1856","1864","10.1021/ic062370f","","","0.71073","MoKα","","0.0807","0.0631","","","0.1481","0.1572","","","","","","1.067","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307861","10.5541","0.0016","13.335","0.002","21.004","0.003","90","","90","","90","","2956.1","0.8","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","samarium(tris(3,5-dimethylpyrazolyl)methanetrichloride tetrahydrofuranate","","","- C24 H38 Cl3 N6 O2 Sm -","- C24 H38 Cl3 N6 O2 Sm -","- C96 H152 Cl12 N24 O8 Sm4 -","4","1","","Andrea Sella; Sarah E. Brown; Jonathan W. Steed; Derek A. Tocher","Synthesis and Solid-State Structures of Pyrazolylmethane Complexes of the Rare Earths","Inorganic Chemistry","2007","46","","1856","1864","10.1021/ic062370f","","","0.71073","MoKα","","0.0316","0.0308","","","0.076","0.0765","","","","","","0.978","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307862","28.698","0.003","19.426","0.002","19.807","0.002","90","","97.185","0.002","90","","10955","2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","yttrium(tris(3,5-dimethylpyrazolyl)methane tris-(trifluoromethanesulfonate)","","","- C35 H54 F9 N6 O13 S3 Y -","- C35 H54 F9 N6 O13 S3 Y -","- C280 H432 F72 N48 O104 S24 Y8 -","8","1","","Andrea Sella; Sarah E. Brown; Jonathan W. Steed; Derek A. Tocher","Synthesis and Solid-State Structures of Pyrazolylmethane Complexes of the Rare Earths","Inorganic Chemistry","2007","46","","1856","1864","10.1021/ic062370f","","","0.71073","MoKα","","0.156","0.0881","","","0.2502","0.3028","","","","","","1.007","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307863","29.275","0.0002","19.657","0.001","19.8299","0.0015","90","","95.481","0.003","90","","11359.1","1","120","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","holmium(tris(3,5-dimethylpyrazolyl)methane) tris-(trifluoromethanesulfonate)","","","- C31 H46 F9 Ho N6 O12 S3 -","- C31 H30 F9 Ho N6 O12 S3 -","- C248 H240 F72 Ho8 N48 O96 S24 -","8","1","","Andrea Sella; Sarah E. Brown; Jonathan W. Steed; Derek A. Tocher","Synthesis and Solid-State Structures of Pyrazolylmethane Complexes of the Rare Earths","Inorganic Chemistry","2007","46","","1856","1864","10.1021/ic062370f","","","0.71073","MoKα","","0.1088","0.0733","","","0.1798","0.2027","","","","","","1.055","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307864","12.5317","0.0011","16.2143","0.0014","16.3503","0.0014","60.779","0.001","77.205","0.001","82.508","0.001","2826.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","neodymium(tris(3,5-dimethylpyrazolyl)methane tris-(2,6-dimethylphenoxide)","","","- C52 H73 N6 Nd O6 -","- C52 H73 N6 Nd O6 -","- C104 H146 N12 Nd2 O12 -","2","1","","Andrea Sella; Sarah E. Brown; Jonathan W. Steed; Derek A. Tocher","Synthesis and Solid-State Structures of Pyrazolylmethane Complexes of the Rare Earths","Inorganic Chemistry","2007","46","","1856","1864","10.1021/ic062370f","","","0.71073","MoKα","","0.0528","0.0502","","","0.1447","0.1471","","","","","","1.202","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307865","12.4975","0.0008","16.2324","0.001","16.3598","0.001","60.69","0.001","77.296","0.001","82.493","0.001","2822.1","0.3","150","2","293","2","","","","","","","","5","P -1","-P 1","2","samarium(tris(3,5-dimethylpyrazolyl)methane tris-(2,6-dimethylphenoxide)","","","- C52 H73 N6 O6 Sm -","- C52 H73 N6 O6 Sm -","- C104 H146 N12 O12 Sm2 -","2","1","","Andrea Sella; Sarah E. Brown; Jonathan W. Steed; Derek A. Tocher","Synthesis and Solid-State Structures of Pyrazolylmethane Complexes of the Rare Earths","Inorganic Chemistry","2007","46","","1856","1864","10.1021/ic062370f","","","0.71073","MoKα","","0.0439","0.0414","","","0.1266","0.129","","","","","","1.104","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307866","13.1022","0.0005","22.6659","0.0008","23.6928","0.0009","77.841","0.001","75.896","0.001","89.568","0.001","6663.8","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","{[3,5-(CF3)2Pz]Ag}3-0.5tol","","","- C92.5 H35 Ag15 F90 N30 -","- C92.5 H35 Ag15 F90 N30 -","- C185 H70 Ag30 F180 N60 -","2","1","","H. V. Rasika Dias; Chammi S. Palehepitiya Gamage; Jeremy Keltner; Himashinie V. K. Diyabalanage; Ivan Omari; Yvonne Eyobo; Nadeeka R. Dias; Nathan Roehr; Lesly McKinney; Theresa Poth","Trinuclear Silver(I) Complexes of Fluorinated Pyrazolates","Inorganic Chemistry","2007","46","","2979","2987","10.1021/ic062374k","","","0.71073","MoKα","","0.034","0.0298","","","0.0727","0.0752","","","","","","1.02","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307867","8.4759","0.0009","11.0492","0.0012","12.1947","0.0013","68.974","0.001","77.129","0.001","83.36","0.001","1038.43","0.19","100","2","100","2","","","","","","","","5","P -1","-P 1","2","{[3-CF3,5-MePz]Ag}3","","","- C15 H12 Ag3 F9 N6 -","- C15 H12 Ag3 F9 N6 -","- C30 H24 Ag6 F18 N12 -","2","1","","H. V. Rasika Dias; Chammi S. Palehepitiya Gamage; Jeremy Keltner; Himashinie V. K. Diyabalanage; Ivan Omari; Yvonne Eyobo; Nadeeka R. Dias; Nathan Roehr; Lesly McKinney; Theresa Poth","Trinuclear Silver(I) Complexes of Fluorinated Pyrazolates","Inorganic Chemistry","2007","46","","2979","2987","10.1021/ic062374k","","","0.71073","MoKα","","0.025","0.0231","","","0.0587","0.06","","","","","","1.042","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307868","14.452","0.002","10.0648","0.0017","21.35","0.004","90","","93.223","0.011","90","","3100.6","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","{[3-CF3,5-tBuPz]Ag}3","","","- C24 H30 Ag3 F9 N6 -","- C24 H30 Ag3 F9 N6 -","- C96 H120 Ag12 F36 N24 -","4","1","","H. V. Rasika Dias; Chammi S. Palehepitiya Gamage; Jeremy Keltner; Himashinie V. K. Diyabalanage; Ivan Omari; Yvonne Eyobo; Nadeeka R. Dias; Nathan Roehr; Lesly McKinney; Theresa Poth","Trinuclear Silver(I) Complexes of Fluorinated Pyrazolates","Inorganic Chemistry","2007","46","","2979","2987","10.1021/ic062374k","","","0.71073","MoKα","","0.0358","0.0275","","","0.0634","0.0668","","","","","","1.093","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307869","12.2012","0.0014","30.843","0.004","11.477","0.002","90","","103.525","0.012","90","","4199.3","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","{[3-C3F7,5-tBuPz]Ag}3","","","- C30 H30 Ag3 F21 N6 -","- C30 H30 Ag3 F21 N6 -","- C120 H120 Ag12 F84 N24 -","4","1","","H. V. Rasika Dias; Chammi S. Palehepitiya Gamage; Jeremy Keltner; Himashinie V. K. Diyabalanage; Ivan Omari; Yvonne Eyobo; Nadeeka R. Dias; Nathan Roehr; Lesly McKinney; Theresa Poth","Trinuclear Silver(I) Complexes of Fluorinated Pyrazolates","Inorganic Chemistry","2007","46","","2979","2987","10.1021/ic062374k","","","0.71073","MoKα","","0.0829","0.059","","","0.1541","0.1653","","","","","","1.038","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307870","15.4624","0.0008","25.0706","0.0013","12.3999","0.0006","90","","107.197","0.001","90","","4591.9","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","{[3-CF3,5-tBuPz]Ag}3-tol","","","- C37 H38 Ag3 F21 N6 -","- C37 H38 Ag3 F21 N6 -","- C148 H152 Ag12 F84 N24 -","4","1","","H. V. Rasika Dias; Chammi S. Palehepitiya Gamage; Jeremy Keltner; Himashinie V. K. Diyabalanage; Ivan Omari; Yvonne Eyobo; Nadeeka R. Dias; Nathan Roehr; Lesly McKinney; Theresa Poth","Trinuclear Silver(I) Complexes of Fluorinated Pyrazolates","Inorganic Chemistry","2007","46","","2979","2987","10.1021/ic062374k","","","0.71073","MoKα","","0.0248","0.0214","","","0.0517","0.0537","","","","","","1.044","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307871","12.4379","0.0017","14.1005","0.0019","18.57","0.002","90","","95.824","0.004","90","","3240","0.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H24 Cl3 F15 N4 -","- C27 H24 Cl3 F15 N4 -","- C108 H96 Cl12 F60 N16 -","4","1","","P. S. Lakshminarayanan; I. Ravikumar; E. Suresh; Pradyut Ghosh","Encapsulation of Halides within the Cavity of a Pentafluorophenyl-Substituted Tripodal Amine Receptor","Inorganic Chemistry","2007","46","","4769","4771","10.1021/ic062380g","","","0.71073","MoKα","","0.1574","0.0693","","","0.1349","0.171","","","","","","0.986","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307872","12.4791","0.0018","14.561","0.002","18.996","0.003","90","","93.989","0.003","90","","3443.4","0.9","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H24 Br3 F15 N4 -","- C27 H24 Br3 F15 N4 -","- C108 H96 Br12 F60 N16 -","4","1","","P. S. Lakshminarayanan; I. Ravikumar; E. Suresh; Pradyut Ghosh","Encapsulation of Halides within the Cavity of a Pentafluorophenyl-Substituted Tripodal Amine Receptor","Inorganic Chemistry","2007","46","","4769","4771","10.1021/ic062380g","","","0.71073","MoKα","","0.1444","0.0621","","","0.1503","0.1865","","","","","","0.964","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307873","9.0109","0.0018","15.951","0.003","13.459","0.003","90","","96.33","0.03","90","","1922.7","0.7","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 Br2 Mn N4 -","- C18 H18 Br2 Mn N4 -","- C72 H72 Br8 Mn4 N16 -","4","1","","Carole Duboc; Thida Phoeung; Samir Zein; Jacques Pécaut; Marie-Noëlle Collomb; Frank Neese","Origin of the Zero-Field Splitting in Mononuclear Octahedral Dihalide MnII Complexes: An Investigation by Multifrequency High-Field Electron Paramagnetic Resonance and Density Functional Theory","Inorganic Chemistry","2007","46","","4905","4916","10.1021/ic062384l","","","0.71073","MoKα","","0.0464","0.0352","","","0.0844","0.0898","","","","","","1.026","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307874","9.026","0.0018","15.876","0.003","13.278","0.003","90","","98.84","0.03","90","","1880.1","0.7","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 Cl2 Mn N4 -","- C18 H18 Cl2 Mn N4 -","- C72 H72 Cl8 Mn4 N16 -","4","1","","Carole Duboc; Thida Phoeung; Samir Zein; Jacques Pécaut; Marie-Noëlle Collomb; Frank Neese","Origin of the Zero-Field Splitting in Mononuclear Octahedral Dihalide MnII Complexes: An Investigation by Multifrequency High-Field Electron Paramagnetic Resonance and Density Functional Theory","Inorganic Chemistry","2007","46","","4905","4916","10.1021/ic062384l","","","0.71073","MoKα","","0.0597","0.0386","","","0.0772","0.0835","","","","","","1.085","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307875","9.1075","0.0018","16.228","0.003","14.137","0.003","90","","91.86","0.03","90","","2088.3","0.7","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 I2 Mn N4 -","- C18 H18 I2 Mn N4 -","- C72 H72 I8 Mn4 N16 -","4","1","","Carole Duboc; Thida Phoeung; Samir Zein; Jacques Pécaut; Marie-Noëlle Collomb; Frank Neese","Origin of the Zero-Field Splitting in Mononuclear Octahedral Dihalide MnII Complexes: An Investigation by Multifrequency High-Field Electron Paramagnetic Resonance and Density Functional Theory","Inorganic Chemistry","2007","46","","4905","4916","10.1021/ic062384l","","","0.71073","MoKα","","0.0404","0.0298","","","0.0511","0.0533","","","","","","1.092","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307876","6.2772","0.0007","13.8384","0.0009","17.4663","0.0009","90","","90","","90","","1517.2","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Li2Ce5Sn7","","","- Ce5 Li2 Sn7 -","- Ce5 Li2 Sn7 -","- Ce20 Li8 Sn28 -","4","1","","Iliya Todorov; Slavi C. Sevov","In Search of Cyclohexane-like Sn612-: Synthesis of Li2Ln5Sn7 (Ln = Ce, Pr, Sm, Eu) with an Open-Chain Heptane-like Sn716- Instead","Inorganic Chemistry","2007","46","","4044","4048","10.1021/ic062390h","","","0.71073","MoKα","","0.0289","0.0276","","","0.0671","0.0676","","","","","","1.229","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307877","20.6837","0.0012","13.6138","0.0008","22.0265","0.0013","90","","92.989","0.001","90","","6193.9","0.6","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H40 Eu3 F30 O14 -","- C52 H40 Eu3 F30 O14 -","- C208 H160 Eu12 F120 O56 -","4","0.5","","Kieran Norton; Thomas J. Emge; John G. Brennan","Lanthanide Compounds with Fluorinated OC6F5 Ligands: Homo- and Heterovalent Complexes of Eu(II) and Eu(III)","Inorganic Chemistry","2007","46","","4060","4066","10.1021/ic062395e","","","0.71073","MoKα","","0.036","0.032","","","0.0797","0.0821","","","","","","1.002","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307878","10.4086","0.0005","12.8244","0.0006","23.4796","0.0011","90","","96.058","0.001","90","","3116.6","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 Eu F15 O7 -","- C26 H20 Eu F15 O7 -","- C104 H80 Eu4 F60 O28 -","4","1","","Kieran Norton; Thomas J. Emge; John G. Brennan","Lanthanide Compounds with Fluorinated OC6F5 Ligands: Homo- and Heterovalent Complexes of Eu(II) and Eu(III)","Inorganic Chemistry","2007","46","","4060","4066","10.1021/ic062395e","","","0.71073","MoKα","","0.0237","0.0212","","","0.0512","0.0524","","","","","","1.001","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307879","11.9347","0.0006","20.9972","0.001","20.6604","0.001","90","","104.768","0.001","90","","5006.4","0.4","110","5","110","5","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C42 H27 Eu2 F25 O11 -","- C42 H27 Eu2 F25 O11 -","- C168 H108 Eu8 F100 O44 -","4","1","","Kieran Norton; Thomas J. Emge; John G. Brennan","Lanthanide Compounds with Fluorinated OC6F5 Ligands: Homo- and Heterovalent Complexes of Eu(II) and Eu(III)","Inorganic Chemistry","2007","46","","4060","4066","10.1021/ic062395e","","","0.71073","MoKα","","0.0532","0.0424","","","0.076","0.0796","","","","","","0.963","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307880","15.245","0.002","18.481","0.003","19.241","0.003","90","","107.588","0.002","90","","5167.6","1.3","208","2","208","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","KS-129-03","","","- C50 H54 B2 F8 Fe2 N8 O4 -","- C50 H54 B2 F8 Fe2 N8 O4 -","- C200 H216 B8 F32 Fe8 N32 O16 -","4","1","","Kil Sik Min; Antonio DiPasquale; Arnold L. Rheingold; Joel S. Miller","Room-Temperature Spin Crossover Observed for [(TPyA)FeII(DBQ2-)FeII(TPyA)]2+ [TPyA = Tris(2-pyridylmethyl)amine; DBQ2-= 2,5-Di-tert-butyl-3,6-dihydroxy-1,4-benzoquinonate]","Inorganic Chemistry","2007","46","","1048","1050","10.1021/ic062400e","","","0.71073","MoKα","","0.1183","0.0864","","","0.2438","0.2738","","","","","","1.033","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307881","15.3981","0.0016","18.5528","0.0019","19.548","0.002","90","","107.824","0.002","90","","5316.4","0.9","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","KS-129-03","","","- C50 H54 B2 F8 Fe2 N8 O4 -","- C50 H54 Fe2 N8 O4 -","- C200 H216 Fe8 N32 O16 -","4","1","","Kil Sik Min; Antonio DiPasquale; Arnold L. Rheingold; Joel S. Miller","Room-Temperature Spin Crossover Observed for [(TPyA)FeII(DBQ2-)FeII(TPyA)]2+ [TPyA = Tris(2-pyridylmethyl)amine; DBQ2-= 2,5-Di-tert-butyl-3,6-dihydroxy-1,4-benzoquinonate]","Inorganic Chemistry","2007","46","","1048","1050","10.1021/ic062400e","","","0.71073","MoKα","","0.073","0.0598","","","0.1782","0.1883","","","","","","1.097","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4307882","8.936","0.002","11.823","0.002","14.563","0.003","73.17","0.02","79.54","0.02","86.84","0.02","1448.2","0.5","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H32 B2 F8 Fe N6 O2 -","- C24 H32 B2 F8 Fe N6 O2 -","- C48 H64 B4 F16 Fe2 N12 O4 -","2","1","","José Sánchez Costa; Kristian Lappalainen; Graham de Ruiter; Manuel Quesada; Jinkui Tang; Ilpo Mutikainen; Urho Turpeinen; C. Matthias Grunert; Philipp Gütlich; Hanane Zhor Lazar; Jean-François Létard; Patrick Gamez; Jan Reedijk","Remarkable Steric Effects and Influence of Monodentate Axial Ligands L on the Spin-Crossover Properties of trans-[FeII(N4ligand)L] Complexes","Inorganic Chemistry","2007","46","","4079","4089","10.1021/ic0624017","","","0.71073","MoKα","","0.0676","0.046","","","0.118","0.1285","","","","","","1.025","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307883","14.477","0.003","10.635","0.002","15.577","0.003","90","","118.13","0.03","90","","2115","0.9","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 Fe N8 S2 -","- C18.2 H14.4 Fe N7.4 S2 -","- C72.8 H57.6 Fe4 N29.6 S8 -","4","1","","José Sánchez Costa; Kristian Lappalainen; Graham de Ruiter; Manuel Quesada; Jinkui Tang; Ilpo Mutikainen; Urho Turpeinen; C. Matthias Grunert; Philipp Gütlich; Hanane Zhor Lazar; Jean-François Létard; Patrick Gamez; Jan Reedijk","Remarkable Steric Effects and Influence of Monodentate Axial Ligands L on the Spin-Crossover Properties of trans-[FeII(N4ligand)L] Complexes","Inorganic Chemistry","2007","46","","4079","4089","10.1021/ic0624017","","","0.71073","MoKα","","0.1403","0.0668","","","0.1609","0.1961","","","","","","1.025","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307884","8.112","0.0016","10.671","0.002","16.026","0.003","106.21","0.03","95.15","0.03","96.88","0.03","1311.4","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C24.5 H26 Fe N8 O0.5 S2 -","- C24.5 H26 Fe N8 O0.5 S2 -","- C49 H52 Fe2 N16 O S4 -","2","1","","José Sánchez Costa; Kristian Lappalainen; Graham de Ruiter; Manuel Quesada; Jinkui Tang; Ilpo Mutikainen; Urho Turpeinen; C. Matthias Grunert; Philipp Gütlich; Hanane Zhor Lazar; Jean-François Létard; Patrick Gamez; Jan Reedijk","Remarkable Steric Effects and Influence of Monodentate Axial Ligands L on the Spin-Crossover Properties of trans-[FeII(N4ligand)L] Complexes","Inorganic Chemistry","2007","46","","4079","4089","10.1021/ic0624017","","","0.71073","MoKα","","0.0629","0.0398","","","0.0949","0.107","","","","","","1.026","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307885","20.522","0.004","14.136","0.003","9.213","0.0018","90","","106.87","0.03","90","","2557.7","1","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H24 Fe N12 -","- C26 H24 Fe N12 -","- C104 H96 Fe4 N48 -","4","0.5","","José Sánchez Costa; Kristian Lappalainen; Graham de Ruiter; Manuel Quesada; Jinkui Tang; Ilpo Mutikainen; Urho Turpeinen; C. Matthias Grunert; Philipp Gütlich; Hanane Zhor Lazar; Jean-François Létard; Patrick Gamez; Jan Reedijk","Remarkable Steric Effects and Influence of Monodentate Axial Ligands L on the Spin-Crossover Properties of trans-[FeII(N4ligand)L] Complexes","Inorganic Chemistry","2007","46","","4079","4089","10.1021/ic0624017","","","0.71073","MoKα","","0.0467","0.035","","","0.092","0.1025","","","","","","0.742","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307886","12.495","0.002","14.37","0.003","13.809","0.002","90","","92.58","0.02","90","","2476.9","0.7","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 F6 Fe N6 O6 S2 -","- C20 H16 F6 Fe N6 O6 S2 -","- C80 H64 F24 Fe4 N24 O24 S8 -","4","1","","José Sánchez Costa; Kristian Lappalainen; Graham de Ruiter; Manuel Quesada; Jinkui Tang; Ilpo Mutikainen; Urho Turpeinen; C. Matthias Grunert; Philipp Gütlich; Hanane Zhor Lazar; Jean-François Létard; Patrick Gamez; Jan Reedijk","Remarkable Steric Effects and Influence of Monodentate Axial Ligands L on the Spin-Crossover Properties of trans-[FeII(N4ligand)L] Complexes","Inorganic Chemistry","2007","46","","4079","4089","10.1021/ic0624017","","","0.71073","MoKα","","0.0904","0.0723","","","0.186","0.205","","","","","","1.011","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307887","9.574","0.002","10.757","0.002","14.712","0.002","105.89","0.03","95.66","0.03","90.45","0.03","1449.2","0.5","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H24 F6 Fe N6 O6 S2 -","- C24 H24 F6 Fe N6 O6 S2 -","- C48 H48 F12 Fe2 N12 O12 S4 -","2","1","","José Sánchez Costa; Kristian Lappalainen; Graham de Ruiter; Manuel Quesada; Jinkui Tang; Ilpo Mutikainen; Urho Turpeinen; C. Matthias Grunert; Philipp Gütlich; Hanane Zhor Lazar; Jean-François Létard; Patrick Gamez; Jan Reedijk","Remarkable Steric Effects and Influence of Monodentate Axial Ligands L on the Spin-Crossover Properties of trans-[FeII(N4ligand)L] Complexes","Inorganic Chemistry","2007","46","","4079","4089","10.1021/ic0624017","","","0.7107","MoKα","","0.0562","0.0388","","","0.0968","0.1046","","","","","","1.016","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307888","12.5326","0.0013","13.7091","0.0015","13.9894","0.0015","90","","90","","90","","2403.5","0.4","153","2","153","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C8 H23 Mn N5 Se7 Sn3 -","- C8 H23 Mn N5 Se7 Sn3 -","- C32 H92 Mn4 N20 Se28 Sn12 -","4","1","","Jian Zhou; Guo-Qing Bian; Jie Dai; Yong Zhang; Ai-bin Tang; Qin-Yu Zhu","Synthesis of a Selenidostannate(IV), [Mn(tepa).Sn3Se7]n, Demonstrating the Transformation from Achiral to Chiral and Dimeric to Polymeric Structure","Inorganic Chemistry","2007","46","","1541","1543","10.1021/ic062403r","","","0.7107","MoKα","","0.0265","0.0249","","","0.0432","0.0437","","","","","","1.064","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307889","26.483","0.002","26.483","0.002","10.1423","0.0009","90","","90","","90","","7113.3","1","153","2","153","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H46 Mn2 N10 Se6 Sn2 -","- C16 H46 Mn2 N10 Se6 Sn2 -","- C128 H368 Mn16 N80 Se48 Sn16 -","8","0.5","","Jian Zhou; Guo-Qing Bian; Jie Dai; Yong Zhang; Ai-bin Tang; Qin-Yu Zhu","Synthesis of a Selenidostannate(IV), [Mn(tepa).Sn3Se7]n, Demonstrating the Transformation from Achiral to Chiral and Dimeric to Polymeric Structure","Inorganic Chemistry","2007","46","","1541","1543","10.1021/ic062403r","","","0.7107","MoKα","","0.0395","0.0356","","","0.0848","0.0868","","","","","","1.089","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307890","25.832","0.002","25.832","0.002","10.0295","0.0009","90","","90","","90","","6692.6","0.9","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C16 H46 Mn2 N10 S6 Sn2 -","- C16 H46 Mn2 N10 S6 Sn2 -","- C128 H368 Mn16 N80 S48 Sn16 -","8","0.5","","Jian Zhou; Guo-Qing Bian; Jie Dai; Yong Zhang; Ai-bin Tang; Qin-Yu Zhu","Synthesis of a Selenidostannate(IV), [Mn(tepa).Sn3Se7]n, Demonstrating the Transformation from Achiral to Chiral and Dimeric to Polymeric Structure","Inorganic Chemistry","2007","46","","1541","1543","10.1021/ic062403r","","","0.7107","MoKα","","0.0467","0.0414","","","0.11","0.1135","","","","","","1.01","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4307891","15.306","0.003","15.806","0.003","16.916","0.003","98.44","0.03","96.79","0.03","98.97","0.03","3956.7","1.4","180","","180","","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C30 H30 Cl4 N6 O V2 -","- C30 H30 Cl4 N6 O V2 -","- C120 H120 Cl16 N24 O4 V8 -","4","2","","Christian Lorber; Robert Choukroun; Laure Vendier","Reaction of p-Toluenesulfonylamide and M(NMe2)4 (M = Ti, V): Generation of Electron-Deficient Imido Complexes of Early Transition Metals","Inorganic Chemistry","2007","46","","3192","3202","10.1021/ic062404j","","","0.71073","MoKα","","0.3463","0.1096","","","0.1953","0.2596","","","","","","0.679","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307892","8.0903","0.001","21.086","0.002","9.5039","0.0012","90","","114.395","0.013","90","","1476.5","0.3","180","","180","","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H38 N6 O4 S2 Ti2 -","- C22 H38 N6 O4 S2 Ti2 -","- C44 H76 N12 O8 S4 Ti4 -","2","0.5","","Christian Lorber; Robert Choukroun; Laure Vendier","Reaction of p-Toluenesulfonylamide and M(NMe2)4 (M = Ti, V): Generation of Electron-Deficient Imido Complexes of Early Transition Metals","Inorganic Chemistry","2007","46","","3192","3202","10.1021/ic062404j","","","0.71073","MoKα","","0.1627","0.0549","","","0.0758","0.1001","","","","","","0.859","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307893","8.0142","0.0005","8.8093","0.0008","20.0954","0.0014","90","","94.02","0.008","90","","1415.23","0.19","180","","180","","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H38 N6 O4 S2 V2 -","- C22 H38 N6 O4 S2 V2 -","- C44 H76 N12 O8 S4 V4 -","2","0.5","","Christian Lorber; Robert Choukroun; Laure Vendier","Reaction of p-Toluenesulfonylamide and M(NMe2)4 (M = Ti, V): Generation of Electron-Deficient Imido Complexes of Early Transition Metals","Inorganic Chemistry","2007","46","","3192","3202","10.1021/ic062404j","","","0.71073","MoKα","","0.0335","0.0272","","","0.0738","0.0759","","","","","","1.036","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307894","9.6076","0.0007","12.2159","0.0009","15.8021","0.0012","90","","97.555","0.006","90","","1838.5","0.2","180","","180","","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C26 H54 Cl2 N8 O4 S2 Ti2 -","- C26 H54 Cl2 N8 O4 S2 Ti2 -","- C52 H108 Cl4 N16 O8 S4 Ti4 -","2","0.5","","Christian Lorber; Robert Choukroun; Laure Vendier","Reaction of p-Toluenesulfonylamide and M(NMe2)4 (M = Ti, V): Generation of Electron-Deficient Imido Complexes of Early Transition Metals","Inorganic Chemistry","2007","46","","3192","3202","10.1021/ic062404j","","","","MoKα","","0.0599","0.0359","","","0.0948","0.1143","","","","","","1.022","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307895","35.005","0.002","12.4083","0.0008","25.2366","0.0017","90","","128.269","0.008","90","","8606.1","1.3","180","","180","","","","","","","","synthesis as described","7","C 1 2/c 1","-C 2yc","15","","","","- C110 H210 Cl20 N31 O19 S10 Ti10 -","- C110 H210 Cl20 N31 O19 S10 Ti10 -","- C220 H420 Cl40 N62 O38 S20 Ti20 -","2","0.25","","Christian Lorber; Robert Choukroun; Laure Vendier","Reaction of p-Toluenesulfonylamide and M(NMe2)4 (M = Ti, V): Generation of Electron-Deficient Imido Complexes of Early Transition Metals","Inorganic Chemistry","2007","46","","3192","3202","10.1021/ic062404j","","","0.71073","MoKα","","0.0938","0.07","","","0.1522","0.1625","","","","","","1.074","","","","has coordinates,has disorder","179116","2020-10-21","18:00:00",""
"4307896","9.9919","0.0008","18.2905","0.0013","19.6658","0.0016","90","","101.128","0.007","90","","3526.5","0.5","180","","180","","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C11 H21 Cl2 N3 O2 S V -","- C11 H21 Cl2 N3 O2 S V -","- C88 H168 Cl16 N24 O16 S8 V8 -","8","2","","Christian Lorber; Robert Choukroun; Laure Vendier","Reaction of p-Toluenesulfonylamide and M(NMe2)4 (M = Ti, V): Generation of Electron-Deficient Imido Complexes of Early Transition Metals","Inorganic Chemistry","2007","46","","3192","3202","10.1021/ic062404j","","","0.71073","MoKα","","0.1073","0.0411","","","0.0852","0.1026","","","","","","0.883","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307897","22.6523","0.0017","11.4504","0.0008","15.3571","0.0011","90","","128.659","0.005","90","","3110.5","0.4","180","","180","","","","","","","","?","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H35 Cl4 N5 O4 S2 Ti2 -","- C20 H35 Cl4 N5 O4 S2 Ti2 -","- C80 H140 Cl16 N20 O16 S8 Ti8 -","4","0.5","","Christian Lorber; Robert Choukroun; Laure Vendier","Reaction of p-Toluenesulfonylamide and M(NMe2)4 (M = Ti, V): Generation of Electron-Deficient Imido Complexes of Early Transition Metals","Inorganic Chemistry","2007","46","","3192","3202","10.1021/ic062404j","","","0.71073","MoKα","","0.0597","0.0317","","0.0455","0.038","0.038","","","","","","1.0804","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307898","13.2975","0.001","8.5345","0.0008","15.5771","0.0014","90","","98.878","0.01","90","","1746.6","0.3","180","","180","","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 Cl3 N3 V -","- C15 H15 Cl3 N3 V -","- C60 H60 Cl12 N12 V4 -","4","1","","Christian Lorber; Robert Choukroun; Laure Vendier","Reaction of p-Toluenesulfonylamide and M(NMe2)4 (M = Ti, V): Generation of Electron-Deficient Imido Complexes of Early Transition Metals","Inorganic Chemistry","2007","46","","3192","3202","10.1021/ic062404j","","","0.71073","MoKα","","0.0315","0.0271","","","0.0728","0.0754","","","","","","1.023","","","","has coordinates","179116","2020-10-21","18:00:00",""
"4307899","8.7252","0.0013","11.5021","0.0017","13.944","0.002","90","","90","","90","","1399.4","0.4","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","06123","","","- C17 H15 N O3 -","- C17 H15 N O3 -","- C68 H60 N4 O12 -","4","1","","Aramice Y. S. Malkhasian; Maila E. Finch; Borislava Nikolovski; Adarsh Menon; Benjamin E. Kucera; Ferman A. Chavez","N,N'-Dimethylformamide-Derived Products from Catalytic Oxidation of 3-Hydroxyflavone","Inorganic Chemistry","2007","46","","2950","2952","10.1021/ic062408o","","","0.71073","MoKα","","0.0575","0.0482","","","0.1138","0.1185","","","","","","1.005","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307900","6.9123","0.0006","9.3536","0.0008","11.0002","0.0009","82.589","0.001","72.43","0.001","69.268","0.001","633.94","0.09","173","2","173","2","","","","","","","","4","P -1","-P 1","2","06110","","","- C16 H15 N O2 -","- C16 H15 N O2 -","- C32 H30 N2 O4 -","2","1","","Aramice Y. S. Malkhasian; Maila E. Finch; Borislava Nikolovski; Adarsh Menon; Benjamin E. Kucera; Ferman A. Chavez","N,N'-Dimethylformamide-Derived Products from Catalytic Oxidation of 3-Hydroxyflavone","Inorganic Chemistry","2007","46","","2950","2952","10.1021/ic062408o","","","0.71073","MoKα","","0.0459","0.0345","","","0.082","0.0881","","","","","","1.046","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307901","11.9708","0.0013","12.3451","0.0013","17.4481","0.0019","88.917","0.001","89.445","0.001","61.601","0.001","2267.8","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","rubidium copper niobate","","","- C4 H26.5 Cu N4 Nb3 O17 Rb -","- C4 H26.5 Cu N4 Nb3 O17 Rb -","- C16 H106 Cu4 N16 Nb12 O68 Rb4 -","4","2","","Ranko P. Bontchev; Eugene L. Venturini; May Nyman","Copper-Linked Hexaniobate Lindqvist Clusters Variations on a Theme","Inorganic Chemistry","2007","46","","4483","4491","10.1021/ic0624118","","","0.71073","MoKα","","0.0305","0.0273","","","0.0671","0.0687","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307902","12.6242","0.001","12.6577","0.001","16.4412","0.0013","74.622","0.001","88.541","0.001","81.502","0.001","2505.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","COPPER-ETYLENEDIAMINE POLUOXONIOBATE","","","- C4.8 H29.6 Cu1.2 N4.8 Nb2.4 O13.24 -","- C4.8 H29.6 Cu1.2 N4.8 Nb2.4 O13.24 -","- C24 H148 Cu6 N24 Nb12 O66.2 -","5","2.5","","Ranko P. Bontchev; Eugene L. Venturini; May Nyman","Copper-Linked Hexaniobate Lindqvist Clusters Variations on a Theme","Inorganic Chemistry","2007","46","","4483","4491","10.1021/ic0624118","","","0.71073","MoKα","","0.0264","0.0245","","","0.0657","0.0743","","","","","","1.142","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307903","8.752","0.0007","13.0771","0.001","15.928","0.0013","86.619","0.001","83.649","0.001","88.044","0.001","1807.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Copper-ammonia hexaniobate","","","- Cu1.75 N3.5 Nb3 O15.5 Rb0.5 -","- Cu1.75 N3.5 Nb3 O15.495 Rb0.5 -","- Cu7 N14 Nb12 O61.98 Rb2 -","4","2","","Ranko P. Bontchev; Eugene L. Venturini; May Nyman","Copper-Linked Hexaniobate Lindqvist Clusters Variations on a Theme","Inorganic Chemistry","2007","46","","4483","4491","10.1021/ic0624118","","","0.71073","MoKα","","0.0288","0.0265","","","0.0719","0.0739","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307904","13.6592","0.0011","8.8725","0.0007","13.8676","0.001","90","","96.446","0.003","90","","1670","0.2","293","2","293","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","Copper-ammonia hexaniobate","","","- Cu2.67 N2.67 Nb4 O22.67 -","- Cu2.66667 N2.66667 Nb4 O22.6667 -","- Cu8 N8 Nb12 O68 -","3","0.75","","Ranko P. Bontchev; Eugene L. Venturini; May Nyman","Copper-Linked Hexaniobate Lindqvist Clusters Variations on a Theme","Inorganic Chemistry","2007","46","","4483","4491","10.1021/ic0624118","","","0.71073","","","0.0983","0.0904","","","0.1777","0.1795","","","","","","1.13","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307905","18.266","0.005","8.913","0.005","13.591","0.005","90","0.005","130.84","0.005","90","0.005","1674","1.2","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","Copper-ammonia hexaniobate","","","- Cu2 N2 Nb3 O16 -","- Cu2 N2 Nb3 O16 -","- Cu8 N8 Nb12 O64 -","4","0.5","","Ranko P. Bontchev; Eugene L. Venturini; May Nyman","Copper-Linked Hexaniobate Lindqvist Clusters Variations on a Theme","Inorganic Chemistry","2007","46","","4483","4491","10.1021/ic0624118","","","0.71069","MoKα","","0.0908","0.0877","","","0.1236","0.1643","","","","","","1.025","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307906","9.5099","0.0019","9.6798","0.0019","14.006","0.003","70.557","0.018","83.699","0.018","67.909","0.012","1126.4","0.4","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H22 Cl2 N2 Pt -","- C26 H22 Cl2 N2 Pt -","- C52 H44 Cl4 N4 Pt2 -","2","1","","Yulia Yu. Scaffidi-Domianello; Alexey A. Nazarov; Matti Haukka; Markus Galanski; Bernhard K. Keppler; Jacob Schneider; Pingwu Du; Richard Eisenberg; Vadim Yu. Kukushkin","First Example of the Solid-State Thermal Cyclometalation of Ligated Benzophenone Imine Giving Novel Luminescent Platinum(II) Species","Inorganic Chemistry","2007","46","","4469","4482","10.1021/ic062414k","","","0.71073","MoKα","","0.0453","0.0351","","","0.0806","0.0897","","","","","","1.105","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307907","5.5695","0.0005","16.5381","0.0013","17.9682","0.0015","90","","98.032","0.007","90","","1638.8","0.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 Cl2 N O Pt S -","- C15 H17 Cl2 N O Pt S -","- C60 H68 Cl8 N4 O4 Pt4 S4 -","4","1","","Yulia Yu. Scaffidi-Domianello; Alexey A. Nazarov; Matti Haukka; Markus Galanski; Bernhard K. Keppler; Jacob Schneider; Pingwu Du; Richard Eisenberg; Vadim Yu. Kukushkin","First Example of the Solid-State Thermal Cyclometalation of Ligated Benzophenone Imine Giving Novel Luminescent Platinum(II) Species","Inorganic Chemistry","2007","46","","4469","4482","10.1021/ic062414k","","","0.71073","MoKα","","0.0294","0.0201","","","0.0411","0.0439","","","","","","1.071","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307908","19.869","0.002","18.081","0.003","23.197","0.002","90","","99.181","0.011","90","","8226.8","1.8","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17.5 H19.5 Cl3.5 N O Pt S -","- C17.5 H19.5 Cl3.5 N O Pt S -","- C280 H312 Cl56 N16 O16 Pt16 S16 -","16","4","","Yulia Yu. Scaffidi-Domianello; Alexey A. Nazarov; Matti Haukka; Markus Galanski; Bernhard K. Keppler; Jacob Schneider; Pingwu Du; Richard Eisenberg; Vadim Yu. Kukushkin","First Example of the Solid-State Thermal Cyclometalation of Ligated Benzophenone Imine Giving Novel Luminescent Platinum(II) Species","Inorganic Chemistry","2007","46","","4469","4482","10.1021/ic062414k","","","0.71073","MoKα","","0.1282","0.0631","","","0.1462","0.1939","","","","","","1.105","","","","has coordinates","256620","2020-10-21","18:00:00",""
"4307909","10.0666","0.0003","10.5808","0.0003","14.757","0.0003","107.833","0.002","95.223","0.002","92.213","0.001","1486.4","0.07","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C15 H16 Cl N O Pt S -","- C15 H16 Cl N O Pt S -","- C60 H64 Cl4 N4 O4 Pt4 S4 -","4","2","","Yulia Yu. Scaffidi-Domianello; Alexey A. Nazarov; Matti Haukka; Markus Galanski; Bernhard K. Keppler; Jacob Schneider; Pingwu Du; Richard Eisenberg; Vadim Yu. Kukushkin","First Example of the Solid-State Thermal Cyclometalation of Ligated Benzophenone Imine Giving Novel Luminescent Platinum(II) Species","Inorganic Chemistry","2007","46","","4469","4482","10.1021/ic062414k","","","0.71073","MoKα","","0.0462","0.032","","","0.0719","0.0773","","","","","","1.108","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307910","10.3839","0.0001","24.3071","0.0004","13.4799","0.0002","90","","99.749","0.009","90","","3353.23","0.12","120","2","120","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C17 H18 Cl N O Pt S -","- C17 H18 Cl N O Pt S -","- C136 H144 Cl8 N8 O8 Pt8 S8 -","8","4","","Yulia Yu. Scaffidi-Domianello; Alexey A. Nazarov; Matti Haukka; Markus Galanski; Bernhard K. Keppler; Jacob Schneider; Pingwu Du; Richard Eisenberg; Vadim Yu. Kukushkin","First Example of the Solid-State Thermal Cyclometalation of Ligated Benzophenone Imine Giving Novel Luminescent Platinum(II) Species","Inorganic Chemistry","2007","46","","4469","4482","10.1021/ic062414k","","","0.71073","MoKα","","0.0266","0.0231","","","0.0474","0.0484","","","","","","1.029","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4307911","11.921","0.002","12.162","0.002","20.104","0.004","75.28","0.03","73.23","0.03","81.22","0.03","2689.3","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H84 B10 K2 O13 -","- C38 H84 B10 K2 O13 -","- C76 H168 B20 K4 O26 -","2","1","","Liang Deng; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, Reactivity, and Thermal Isomerization of Boron-Substituted 13-Vertex Cobaltacarboranes (η5-Cp)Co(η6-R2C2B10Me8H2) (R = H, Et)","Inorganic Chemistry","2007","46","","2716","2724","10.1021/ic062423t","","","0.71073","MoKα","","0.0945","0.0674","","","0.1777","0.1956","","","","","","1.081","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307912","13.6259","0.0007","9.918","0.0005","16.0642","0.0008","90","","99.944","0.001","90","","2138.33","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H33 B10 Co -","- C15 H33 B10 Co -","- C60 H132 B40 Co4 -","4","1","","Liang Deng; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, Reactivity, and Thermal Isomerization of Boron-Substituted 13-Vertex Cobaltacarboranes (η5-Cp)Co(η6-R2C2B10Me8H2) (R = H, Et)","Inorganic Chemistry","2007","46","","2716","2724","10.1021/ic062423t","","","0.71073","MoKα","","0.0453","0.0408","","","0.1172","0.1204","","","","","","1.057","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307913","10.063","0.003","16.035","0.005","13.155","0.004","90","","97.662","0.007","90","","2103.7","1.1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H33 B10 Co -","- C15 H33 B10 Co -","- C60 H132 B40 Co4 -","4","1","","Liang Deng; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, Reactivity, and Thermal Isomerization of Boron-Substituted 13-Vertex Cobaltacarboranes (η5-Cp)Co(η6-R2C2B10Me8H2) (R = H, Et)","Inorganic Chemistry","2007","46","","2716","2724","10.1021/ic062423t","","","0.71073","MoKα","","0.1072","0.0496","","","0.1226","0.1547","","","","","","1.003","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307914","14.547","0.003","15.511","0.003","18.591","0.004","90","","90","","90","","4194.8","1.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C15 H33 B10 Co -","- C15 H33 B10 Co -","- C120 H264 B80 Co8 -","8","1","","Liang Deng; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, Reactivity, and Thermal Isomerization of Boron-Substituted 13-Vertex Cobaltacarboranes (η5-Cp)Co(η6-R2C2B10Me8H2) (R = H, Et)","Inorganic Chemistry","2007","46","","2716","2724","10.1021/ic062423t","","","0.71073","MoKα","","0.1976","0.0582","","","0.1348","0.1823","","","","","","0.975","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307915","14.15","0.003","13.758","0.003","10.681","0.002","90","","90","","90","","2079.3","0.7","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C15 H33 B10 Co -","- C16 H33 B9 Co -","- C64 H132 B36 Co4 -","4","0.5","","Liang Deng; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, Reactivity, and Thermal Isomerization of Boron-Substituted 13-Vertex Cobaltacarboranes (η5-Cp)Co(η6-R2C2B10Me8H2) (R = H, Et)","Inorganic Chemistry","2007","46","","2716","2724","10.1021/ic062423t","","","0.71073","MoKα","","0.0997","0.0838","","","0.1583","0.1648","","","","","","1.264","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307916","9.0144","0.0018","10.273","0.002","27.164","0.005","90","","94.87","0.03","90","","2506.4","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H41 B10 Co -","- C19 H41 B10 Co -","- C76 H164 B40 Co4 -","4","1","","Liang Deng; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, Reactivity, and Thermal Isomerization of Boron-Substituted 13-Vertex Cobaltacarboranes (η5-Cp)Co(η6-R2C2B10Me8H2) (R = H, Et)","Inorganic Chemistry","2007","46","","2716","2724","10.1021/ic062423t","","","0.71073","MoKα","","0.176","0.0792","","","0.2056","0.2636","","","","","","0.98","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307917","13.314","0.003","10.011","0.002","19.776","0.004","90","","106.67","0.03","90","","2525.1","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H41 B10 Co -","- C19 H41 B10 Co -","- C76 H164 B40 Co4 -","4","1","","Liang Deng; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, Reactivity, and Thermal Isomerization of Boron-Substituted 13-Vertex Cobaltacarboranes (η5-Cp)Co(η6-R2C2B10Me8H2) (R = H, Et)","Inorganic Chemistry","2007","46","","2716","2724","10.1021/ic062423t","","","0.71073","MoKα","","0.0534","0.0436","","","0.1181","0.1263","","","","","","1.048","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307918","17.5088","0.001","12.5157","0.0007","10.0731","0.0005","90","","90","","90","","2207.4","0.2","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C16 H35 B10 Co -","- C16 H35 B10 Co -","- C64 H140 B40 Co4 -","4","0.5","","Liang Deng; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, Reactivity, and Thermal Isomerization of Boron-Substituted 13-Vertex Cobaltacarboranes (η5-Cp)Co(η6-R2C2B10Me8H2) (R = H, Et)","Inorganic Chemistry","2007","46","","2716","2724","10.1021/ic062423t","","","0.71073","MoKα","","0.0495","0.0462","","","0.1344","0.1382","","","","","","1.134","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307919","16.2735","0.0016","9.9673","0.001","15.8338","0.0016","90","","110.631","0.002","90","","2403.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H41 B10 Co -","- C19 H41 B10 Co -","- C76 H164 B40 Co4 -","4","1","","Liang Deng; Hoi-Shan Chan; Zuowei Xie","Synthesis, Structure, Reactivity, and Thermal Isomerization of Boron-Substituted 13-Vertex Cobaltacarboranes (η5-Cp)Co(η6-R2C2B10Me8H2) (R = H, Et)","Inorganic Chemistry","2007","46","","2716","2724","10.1021/ic062423t","","","0.71073","MoKα","","0.1888","0.0689","","","0.1621","0.2194","","","","","","0.922","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307920","4.166777","0.000007","4.166777","0.000007","9.8172579","0.0000012","90","","90","","120","","147.612","0.0004","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","","","?","- Br2 Gd2 Ge0.99994 -","- Br2 Gd2 Ge0.99994 -","","","","Mar'yana Lukachuk; Reinhard K. Kremer; Hansjürgen Mattausch; Arndt Simon","New Layered Germanide Halides RE2GeX2 (RE = Y, Gd; X = Br, I)","Inorganic Chemistry","2007","46","","3231","3235","10.1021/ic062425d","powder diffraction","","","X-ray","","","","","","","","","7.2936","","","","","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307921","4.252741","0.000004","4.252741","0.000004","31.65699","","90","","90","","120","","495.836","0.0007","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","?","- Gd6 Ge2.99928 I6 -","- Gd6 Ge2.99928 I6 -","","","","Mar'yana Lukachuk; Reinhard K. Kremer; Hansjürgen Mattausch; Arndt Simon","New Layered Germanide Halides RE2GeX2 (RE = Y, Gd; X = Br, I)","Inorganic Chemistry","2007","46","","3231","3235","10.1021/ic062425d","powder diffraction","","","X-ray","","","","","","","","","6.0728","","","","","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307922","4.213504","0.000009","4.213504","0.000009","31.479641","0.00000015","90","","90","","120","","484.002","0.0015","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","?","- Ge2.99928 I6 Y6 -","- Ge2.99928 I6 Y6 -","","","","Mar'yana Lukachuk; Reinhard K. Kremer; Hansjürgen Mattausch; Arndt Simon","New Layered Germanide Halides RE2GeX2 (RE = Y, Gd; X = Br, I)","Inorganic Chemistry","2007","46","","3231","3235","10.1021/ic062425d","powder diffraction","","","X-ray","","","","","","","","","10.6406","","","","","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307923","5.01313","0.00006","8.8007","0.0001","5.52831","0.00007","90","","99.6962","0.0006","90","","240.42","0.005","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","sodium magnesium orthoborate","","- B Mg Na O3 -","- B Mg Na O3 -","- B4 Mg4 Na4 O12 -","4","0.5","","Li Wu; Yi Zhang; Yong Fa Kong; Tong Qing Sun; Jing Jun Xu; Xiao Long Chen","Structure Determination of Novel Orthoborate NaMgBO3: A Promising Birefringent Crystal","Inorganic Chemistry","2007","46","","5207","5211","10.1021/ic062429i","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","","2.7","","","","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307924","18.1999","0.0008","17.0313","0.0005","26.7503","0.0009","90","","90","","90","","8291.7","0.5","133","2","133","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C25 H42 Cl4 Cu2 N12 O20 -","- C25 H42 Cl4 Cu2 N12 O20 -","- C200 H336 Cl32 Cu16 N96 O160 -","8","1","","Angelina Prokofieva; Alexander I. Prikhod'ko; Eva Anna Enyedy; Etelka Farkas; Walter Maringgele; Serhiy Demeshko; Sebastian Dechert; Franc Meyer","Oligonuclear Copper Complexes of a Bioinspired Pyrazolate-Bridging Ligand: Synthesis, Structures, and Equilibria in Solution","Inorganic Chemistry","2007","46","","4298","4307","10.1021/ic062434m","","","0.71073","MoKα","","0.0806","0.0481","","","0.11","0.1211","","","","","","1.005","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307925","18.1991","0.0009","16.9395","0.0006","13.6063","0.0008","90","","112.35","0.004","90","","3879.5","0.3","133","2","133","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C29 H43 Cl2 Cu2 N13 O10 -","- C29 H43 Cl2 Cu2 N13 O10 -","- C116 H172 Cl8 Cu8 N52 O40 -","4","1","","Angelina Prokofieva; Alexander I. Prikhod'ko; Eva Anna Enyedy; Etelka Farkas; Walter Maringgele; Serhiy Demeshko; Sebastian Dechert; Franc Meyer","Oligonuclear Copper Complexes of a Bioinspired Pyrazolate-Bridging Ligand: Synthesis, Structures, and Equilibria in Solution","Inorganic Chemistry","2007","46","","4298","4307","10.1021/ic062434m","","","0.71073","MoKα","","0.0314","0.0287","","","0.0674","0.0682","","","","","","1.001","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307926","11.1984","0.0004","14.9118","0.0006","24.3582","0.0009","101.663","0.003","99.134","0.003","100.299","0.003","3838.4","0.3","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H48 Cu2 N14 O10 -","- C29 H48 Cu2 N14 O10 -","- C116 H192 Cu8 N56 O40 -","4","2","","Angelina Prokofieva; Alexander I. Prikhod'ko; Eva Anna Enyedy; Etelka Farkas; Walter Maringgele; Serhiy Demeshko; Sebastian Dechert; Franc Meyer","Oligonuclear Copper Complexes of a Bioinspired Pyrazolate-Bridging Ligand: Synthesis, Structures, and Equilibria in Solution","Inorganic Chemistry","2007","46","","4298","4307","10.1021/ic062434m","","","0.71073","MoKα","","0.0743","0.052","","","0.1262","0.1367","","","","","","1.017","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307927","9.5728","0.0006","13.1348","0.0008","14.566","0.0009","94.003","0.005","106.635","0.005","93.85","0.005","1743.26","0.19","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H80 Cu4 N30 O25 -","- C50 H80 Cu4 N30 O25 -","- C50 H80 Cu4 N30 O25 -","1","0.5","","Angelina Prokofieva; Alexander I. Prikhod'ko; Eva Anna Enyedy; Etelka Farkas; Walter Maringgele; Serhiy Demeshko; Sebastian Dechert; Franc Meyer","Oligonuclear Copper Complexes of a Bioinspired Pyrazolate-Bridging Ligand: Synthesis, Structures, and Equilibria in Solution","Inorganic Chemistry","2007","46","","4298","4307","10.1021/ic062434m","","","0.71073","MoKα","","0.0364","0.0312","","","0.0836","0.086","","","","","","1.04","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307928","15.1346","0.0011","10.8111","0.0008","17.5583","0.0013","90","","93.065","0.001","90","","2868.8","0.4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H25 Cl N3 O4 P Pt -","- C32 H25 Cl N3 O4 P Pt -","- C128 H100 Cl4 N12 O16 P4 Pt4 -","4","1","","Chi-Kin Koo; Yu-Man Ho; Cheuk-Fai Chow; Michael Hon-Wah Lam; Tai-Chu Lau; Wai-Yeung Wong","Synthesis and Spectroscopic Studies of Cyclometalated Pt(II) Complexes Containing a Functionalized Cyclometalating Ligand, 2-Phenyl-6-(1H-pyrazol-3-yl)-pyridine","Inorganic Chemistry","2007","46","","3603","3612","10.1021/ic062439j","","","0.71073","MoKα","","0.043","0.0297","","","0.0675","0.0726","","","","","","1.064","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307929","8.1722","0.0005","11.9826","0.0007","13.6523","0.0008","101.173","0.001","98.678","0.001","100.959","0.001","1262.94","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 Cl N3 Pt -","- C14 H10 Cl N3 Pt -","- C56 H40 Cl4 N12 Pt4 -","4","2","","Chi-Kin Koo; Yu-Man Ho; Cheuk-Fai Chow; Michael Hon-Wah Lam; Tai-Chu Lau; Wai-Yeung Wong","Synthesis and Spectroscopic Studies of Cyclometalated Pt(II) Complexes Containing a Functionalized Cyclometalating Ligand, 2-Phenyl-6-(1H-pyrazol-3-yl)-pyridine","Inorganic Chemistry","2007","46","","3603","3612","10.1021/ic062439j","","","0.71073","MoKα","","0.0241","0.0207","","","0.0545","0.0561","","","","","","1.036","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307930","10.5571","0.0008","16.6276","0.0012","19.5283","0.0014","90","","103.964","0.001","90","","3326.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H18 N6 Pt2 -","- C28 H18 N6 Pt2 -","- C168 H108 N36 Pt12 -","6","1.5","","Chi-Kin Koo; Yu-Man Ho; Cheuk-Fai Chow; Michael Hon-Wah Lam; Tai-Chu Lau; Wai-Yeung Wong","Synthesis and Spectroscopic Studies of Cyclometalated Pt(II) Complexes Containing a Functionalized Cyclometalating Ligand, 2-Phenyl-6-(1H-pyrazol-3-yl)-pyridine","Inorganic Chemistry","2007","46","","3603","3612","10.1021/ic062439j","","","0.71073","MoKα","","0.0382","0.0243","","","0.0547","0.0601","","","","","","1.05","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307931","10.546","0.0018","14.131","0.002","14.663","0.003","96.49","0.004","94.872","0.003","102.656","0.003","2104.8","0.6","193","2","193","2","","","","","","","","4","P -1","-P 1","2","20","","","- C38 H58 S6 W -","- C38 H58 S6 W -","- C76 H116 S12 W2 -","2","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.0908","0.0592","","","0.1432","0.1663","","","","","","1.014","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4307932","10.8879","0.001","21.931","0.002","11.3105","0.001","90","","97.963","0.001","90","","2674.7","0.4","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(Et4N)[3]","","","- C20 H41 N S5 W -","- C20 H41 N S5 W -","- C80 H164 N4 S20 W4 -","4","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.0688","0.0463","","","0.1034","0.1107","","","","","","1.113","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307933","36.315","0.003","36.315","0.003","9.736","0.0018","90","","90","","90","","12840","3","193","2","193","2","","","","","","","","6","I 41/a :2","-I 4ad","88","(Et4N)[7]","","","- C26 H47 N S4 Se W -","- C26 H47 N S4 Se W -","- C416 H752 N16 S64 Se16 W16 -","16","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.0606","0.0399","","","0.1025","0.1117","","","","","","1.025","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307934","9.5035","0.0014","16.525","0.002","17.415","0.003","90","","103.404","0.003","90","","2660.4","0.7","353","2","353","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(Et4N)[10]","","","- C20 H41 N O S5 W -","- C20 H41 N O S5 W -","- C80 H164 N4 O4 S20 W4 -","4","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.1128","0.0595","","","0.0922","0.1067","","","","","","0.994","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307935","10.895","0.003","22.103","0.006","11.33","0.003","90","","98.595","0.006","90","","2697.8","1.3","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(Et4N)[5]","","","- C20 H41 N S4 Se W -","- C20 H41 N S4 Se W -","- C80 H164 N4 S16 Se4 W4 -","4","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.1533","0.0782","","","0.1411","0.1684","","","","","","0.992","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307936","10.0347","0.0018","16.524","0.003","20.663","0.004","90","","95.856","0.004","90","","3408.3","1.1","353","2","353","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(Et4N)[24]","","","- C24 H44 N S8 Se W2 -","- C24 H44 N S8 Se W2 -","- C96 H176 N4 S32 Se4 W8 -","4","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.0559","0.0399","","","0.0714","0.0766","","","","","","1.018","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307937","9.5206","0.0009","16.522","0.0017","17.5703","0.0018","90","","103.435","0.002","90","","2688.2","0.5","193","2","193","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","(Et4N)[12]","","","- C20 H41 N O S4 Se W -","- C20 H41 N O S4 Se W -","- C80 H164 N4 O4 S16 Se4 W4 -","4","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.1006","0.0529","","","0.0997","0.1155","","","","","","0.978","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307938","10.9708","0.0015","11.675","0.0013","13.7319","0.0015","69.463","0.002","68.356","0.002","70.839","0.002","1490.5","0.3","193","2","193","2","","","","","","","","6","P 1","P 1","1","(Et4N)2[23]","","","- C44 H82 N8 S8 Se2 W2 -","- C44 H82 N8 S8 Se2 W2 -","- C44 H82 N8 S8 Se2 W2 -","1","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.0285","0.0265","","","0.07","0.0717","","","","","","1.038","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307939","10.8938","0.0006","24.8017","0.0014","11.4759","0.0006","90","","96.536","0.001","90","","3080.5","0.3","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(Et4N)[4]","","","- C26 H47 N S5 W -","- C26 H47 N S5 W -","- C104 H188 N4 S20 W4 -","4","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.0537","0.0379","","","0.0749","0.0806","","","","","","1.055","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307940","36.01","0.02","36.01","0.02","9.885","0.008","90","","90","","90","","12818","14","193","2","193","2","","","","","","","","6","I 41/a :2","-I 4ad","88","(Et4N)[6]","","","- C26 H47 N S4 Se W -","- C26 H47 N S4 Se W -","- C416 H752 N16 S64 Se16 W16 -","16","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.0667","0.0464","","","0.1141","0.1223","","","","","","1.118","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307941","11.3005","0.0013","15.3472","0.0017","14.9299","0.0016","90","","107.755","0.002","90","","2466","0.5","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(Et4N)2[22]*6CH3CN","","","- C36 H70 N4 S10 W2 -","- C36 H70 N4 S10 W2 -","- C72 H140 N8 S20 W4 -","2","0.5","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.0675","0.0549","","","0.1023","0.1056","","","","","","1.298","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307942","11.0113","0.0006","11.8192","0.0006","14.844","0.0008","74.006","0.001","88.728","0.001","70.253","0.001","1742.5","0.16","193","2","193","2","","","","","","","","6","P -1","-P 1","2","(Et4N)[11]*CH3CN","","","- C29 H50 N2.5 O S5 W -","- C29 H50 N2.5 O S5 W -","- C58 H100 N5 O2 S10 W2 -","2","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.0427","0.0379","","","0.0841","0.0865","","","","","","1.119","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307943","10.9448","0.0016","12.9035","0.0018","25.552","0.004","90","","91.022","0.003","90","","3608","0.9","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","20","","","- C36 H42 O S5 Si W -","- C36 H42 O S5 Si W -","- C144 H168 O4 S20 Si4 W4 -","4","1","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.0504","0.0393","","","0.0937","0.0993","","","","","","1.041","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307944","13.2009","0.0009","13.7465","0.0009","19.2673","0.0013","95.866","0.001","94.09","0.001","90.356","0.001","3468.9","0.4","193","2","193","2","","","","","","","","5","P -1","-P 1","2","(Et4N)2[21]*CH3CN","","","- C26 H55 Mo N3 S5 -","- C26 H55 Mo N3 S5 -","- C104 H220 Mo4 N12 S20 -","4","2","","Stanislav Groysman; R. H. Holm","Synthesis and Structures of Bis(dithiolene)tungsten(IV,VI) Thiolate and Selenolate Complexes: Approaches to the Active Sites of Molybdenum and Tungsten Formate Dehydrogenases","Inorganic Chemistry","2007","46","","4090","4102","10.1021/ic062441a","","","0.71073","MoKα","","0.1568","0.063","","","0.1163","0.1486","","","","","","0.954","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307945","14.8348","0.0017","17.3985","0.0019","17.809","0.002","92.055","0.002","88.116","0.002","93.027","0.002","4585","0.9","213","2","213","2","","","","","","","","6","P -1","-P 1","2","[Mo2(DAniF)3]2(OH)2,1.5CH2Cl2","","","- C91.5 H93 Cl3 Mo4 N12 O14 -","- C91.5 H93 Cl3 Mo4 N12 O14 -","- C183 H186 Cl6 Mo8 N24 O28 -","2","1","","F. Albert Cotton; Zhong Li; Carlos A. Murillo; Xiaoping Wang; Rongmin Yu; Qinliang Zhao","Crystal-to-Crystal Oxidative Deprotonation of a Di(μ-hydroxo) to a Di(μ-oxo) Dimer of Dimolybdenum Units","Inorganic Chemistry","2007","46","","3245","3250","10.1021/ic062443v","","","0.71073","MoKα","","0.0707","0.0489","","","0.135","0.1588","","","","","","1.056","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307946","14.758","0.003","17.262","0.004","17.517","0.004","92.301","0.004","91.046","0.004","95.794","0.003","4435","1.7","213","2","213","2","","","","","","","","6","P -1","-P 1","2","[Mo2(DAniF)3]2(OH?)2,0.46CH2Cl2","","","- C90.46 H90.92 Cl0.92 Mo4 N12 O14 -","- C90.457 H90.914 Cl0.914 Mo4 N12 O14 -","- C180.914 H181.828 Cl1.828 Mo8 N24 O28 -","2","1","","F. Albert Cotton; Zhong Li; Carlos A. Murillo; Xiaoping Wang; Rongmin Yu; Qinliang Zhao","Crystal-to-Crystal Oxidative Deprotonation of a Di(μ-hydroxo) to a Di(μ-oxo) Dimer of Dimolybdenum Units","Inorganic Chemistry","2007","46","","3245","3250","10.1021/ic062443v","","","0.71073","MoKα","","0.0697","0.0487","","","0.1241","0.1465","","","","","","1.034","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307947","14.723","0.003","17.246","0.004","17.459","0.004","92.129","0.003","90.993","0.003","95.741","0.003","4406.8","1.7","213","2","213","2","","","","","","","","6","P -1","-P 1","2","[Mo2(DAniF)3]2(OH?)2,0.253CH2Cl2","","","- C90.25 H90.5 Cl0.5 Mo4 N12 O14 -","- C90.253 H90.506 Cl0.506 Mo4 N12 O14 -","- C180.506 H181.012 Cl1.012 Mo8 N24 O28 -","2","1","","F. Albert Cotton; Zhong Li; Carlos A. Murillo; Xiaoping Wang; Rongmin Yu; Qinliang Zhao","Crystal-to-Crystal Oxidative Deprotonation of a Di(μ-hydroxo) to a Di(μ-oxo) Dimer of Dimolybdenum Units","Inorganic Chemistry","2007","46","","3245","3250","10.1021/ic062443v","","","0.71073","MoKα","","0.0983","0.0481","","","0.1079","0.1445","","","","","","1.071","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307948","14.702","0.003","17.244","0.004","17.449","0.004","91.797","0.003","90.969","0.003","95.943","0.003","4396.8","1.7","213","2","213","2","","","","","","","","6","P -1","-P 1","2","[Mo2(DAniF)3]2(OH?)2,0.18CH2Cl2","","","- C90.18 H90.36 Cl0.36 Mo4 N12 O14 -","- C90.184 H90.368 Cl0.368 Mo4 N12 O14 -","- C180.368 H180.736 Cl0.736 Mo8 N24 O28 -","2","1","","F. Albert Cotton; Zhong Li; Carlos A. Murillo; Xiaoping Wang; Rongmin Yu; Qinliang Zhao","Crystal-to-Crystal Oxidative Deprotonation of a Di(μ-hydroxo) to a Di(μ-oxo) Dimer of Dimolybdenum Units","Inorganic Chemistry","2007","46","","3245","3250","10.1021/ic062443v","","","0.71073","MoKα","","0.1007","0.0504","","","0.1126","0.1616","","","","","","1.045","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307949","14.68","0.003","17.221","0.003","17.462","0.003","91.619","0.002","91.094","0.002","96.315","0.002","4384.8","1.4","213","2","213","2","","","","","","","","5","P -1","-P 1","2","[Mo2(DAniF)3]2O2","","","- C90 H90 Mo4 N12 O14 -","- C90 H90 Mo4 N12 O14 -","- C180 H180 Mo8 N24 O28 -","2","1","","F. Albert Cotton; Zhong Li; Carlos A. Murillo; Xiaoping Wang; Rongmin Yu; Qinliang Zhao","Crystal-to-Crystal Oxidative Deprotonation of a Di(μ-hydroxo) to a Di(μ-oxo) Dimer of Dimolybdenum Units","Inorganic Chemistry","2007","46","","3245","3250","10.1021/ic062443v","","","0.71073","MoKα","","0.1135","0.0556","","","0.1322","0.1967","","","","","","1.092","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307950","14.674","0.002","17.232","0.003","17.483","0.003","91.549","0.002","91.144","0.002","96.256","0.002","4391.7","1.2","213","2","213","2","","","","","","","","5","P -1","-P 1","2","[Mo2(DANiF)3]2O2","","","- C90 H90 Mo4 N12 O14 -","- C90 H90 Mo4 N12 O14 -","- C180 H180 Mo8 N24 O28 -","2","1","","F. Albert Cotton; Zhong Li; Carlos A. Murillo; Xiaoping Wang; Rongmin Yu; Qinliang Zhao","Crystal-to-Crystal Oxidative Deprotonation of a Di(μ-hydroxo) to a Di(μ-oxo) Dimer of Dimolybdenum Units","Inorganic Chemistry","2007","46","","3245","3250","10.1021/ic062443v","","","0.71073","MoKα","","0.135","0.0613","","","0.1458","0.2167","","","","","","1.089","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307951","14.661","0.003","17.247","0.003","17.539","0.003","91.456","0.003","91.093","0.003","95.972","0.003","4408.3","1.4","213","2","213","2","","","","","","","","5","P -1","-P 1","2","[Mo2(DAniF)3]2O2","","","- C90 H90 Mo4 N12 O14 -","- C90 H90 Mo4 N12 O14 -","- C180 H180 Mo8 N24 O28 -","2","1","","F. Albert Cotton; Zhong Li; Carlos A. Murillo; Xiaoping Wang; Rongmin Yu; Qinliang Zhao","Crystal-to-Crystal Oxidative Deprotonation of a Di(μ-hydroxo) to a Di(μ-oxo) Dimer of Dimolybdenum Units","Inorganic Chemistry","2007","46","","3245","3250","10.1021/ic062443v","","","0.71073","MoKα","","0.1424","0.0656","","","0.1662","0.2343","","","","","","1.083","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307952","14.736","0.003","17.278","0.004","17.59","0.004","91.605","0.004","90.926","0.004","96.177","0.004","4450","1.7","213","2","213","2","","","","","","","","5","P -1","-P 1","2","[Mo2(DAniF)3]2O2","","","- C90 H90 Mo4 N12 O14 -","- C90 H90 Mo4 N12 O14 -","- C180 H180 Mo8 N24 O28 -","2","1","","F. Albert Cotton; Zhong Li; Carlos A. Murillo; Xiaoping Wang; Rongmin Yu; Qinliang Zhao","Crystal-to-Crystal Oxidative Deprotonation of a Di(μ-hydroxo) to a Di(μ-oxo) Dimer of Dimolybdenum Units","Inorganic Chemistry","2007","46","","3245","3250","10.1021/ic062443v","","","0.71073","MoKα","","0.162","0.0758","","","0.194","0.2614","","","","","","1.073","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307953","12.973","0.005","14.045","0.005","14.046","0.005","71.25","0.006","73.612","0.006","87.71","0.006","2321.4","1.5","213","2","213","2","","","","","","","","6","P -1","-P 1","2","[Mo2(DAniF)3]2O2,2CH2Cl2","","","- C92 H94 Cl4 Mo4 N12 O14 -","- C91.998 H93.996 Cl3.996 Mo4 N12 O14 -","- C91.998 H93.996 Cl3.996 Mo4 N12 O14 -","1","0.5","","F. Albert Cotton; Zhong Li; Carlos A. Murillo; Xiaoping Wang; Rongmin Yu; Qinliang Zhao","Crystal-to-Crystal Oxidative Deprotonation of a Di(μ-hydroxo) to a Di(μ-oxo) Dimer of Dimolybdenum Units","Inorganic Chemistry","2007","46","","3245","3250","10.1021/ic062443v","","","0.71073","MoKα","","0.0353","0.0275","","","0.066","0.0715","","","","","","1.036","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307954","24.683","0.003","14.1381","0.0018","26.693","0.003","90","","109.503","0.002","90","","8780.6","1.8","213","2","213","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[Mo2(DAniF)3]2(OH)(O),BF4","","","- C90 H91 B F4 Mo4 N12 O14 -","- C90 H91 B F4 Mo4 N12 O14 -","- C360 H364 B4 F16 Mo16 N48 O56 -","4","0.5","","F. Albert Cotton; Zhong Li; Carlos A. Murillo; Xiaoping Wang; Rongmin Yu; Qinliang Zhao","Crystal-to-Crystal Oxidative Deprotonation of a Di(μ-hydroxo) to a Di(μ-oxo) Dimer of Dimolybdenum Units","Inorganic Chemistry","2007","46","","3245","3250","10.1021/ic062443v","","","0.71073","MoKα","","0.0694","0.0432","","","0.1","0.1161","","","","","","1.023","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307955","12.348","0.0016","13.8837","0.0018","24.831","0.003","74.618","0.002","84.485","0.002","72.854","0.002","3921.3","0.9","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C52.5 H101 Cu6 N6 O32 Ti4 -","- C52.5 H101 Cu6 N6 O32 Ti4 -","- C105 H202 Cu12 N12 O64 Ti8 -","2","1","","Mazhar Hamid; Asif A. Tahir; Muhammad Mazhar; Matthias Zeller; Allen D. Hunter","Heterobimetallic Molecular Cages for the Deposition of Cu/Ti and Cu/Zn Mixed-Metal Oxides","Inorganic Chemistry","2007","46","","4120","4127","10.1021/ic0624470","","","0.71073","MoKα","","0.0769","0.0661","","","0.1573","0.1618","","","","","","1.226","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307956","15.2973","0.0008","17.8935","0.0009","15.398","0.0008","90","","113.728","0.001","90","","3858.5","0.3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C50 H92 Cl4 Cu4.94 N4 O30 Zn7.06 -","- C50 H92 Cl4 Cu4.94 N4 O30 Zn7.06 -","- C100 H184 Cl8 Cu9.88 N8 O60 Zn14.12 -","2","0.5","","Mazhar Hamid; Asif A. Tahir; Muhammad Mazhar; Matthias Zeller; Allen D. Hunter","Heterobimetallic Molecular Cages for the Deposition of Cu/Ti and Cu/Zn Mixed-Metal Oxides","Inorganic Chemistry","2007","46","","4120","4127","10.1021/ic0624470","","","0.71073","MoKα","","0.0277","0.025","","","0.0632","0.0645","","","","","","1.051","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307957","8.96","0.005","10.104","0.005","11.403","0.004","103.96","0.04","103.68","0.04","104.94","0.05","917.6","0.9","293","2","293","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","adeninium aquabis(oxalato)cuprate(II)","","- C14 H14 Cu N10 O9 -","- C14 H14 Cu N10 O9 -","- C28 H28 Cu2 N20 O18 -","2","1","","Juan P. García-Terán; Oscar Castillo; Antonio Luque; Urko García-Couceiro; Garikoitz Beobide; Pascual Román","Molecular Recognition of Adeninium Cations on Anionic Metal-Oxalato Frameworks: An Experimental and Theoretical Analysis","Inorganic Chemistry","2007","46","","3593","3602","10.1021/ic062448s","","","0.71073","MoKα","","0.2686","0.0495","","","0.0624","0.0784","","","","","","0.91","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307958","24.549","0.005","7.631","0.001","12.752","0.003","90","","114.91","0.02","90","","2166.6","0.8","293","2","293","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","adeninium diaquabis(oxalato)cobaltate(II)","","- C14 H20 Co N10 O12 -","- C14 H20 Co N10 O12 -","- C56 H80 Co4 N40 O48 -","4","0.5","","Juan P. García-Terán; Oscar Castillo; Antonio Luque; Urko García-Couceiro; Garikoitz Beobide; Pascual Román","Molecular Recognition of Adeninium Cations on Anionic Metal-Oxalato Frameworks: An Experimental and Theoretical Analysis","Inorganic Chemistry","2007","46","","3593","3602","10.1021/ic062448s","","","0.71073","MoKα","","0.0941","0.0681","","","0.1693","0.1778","","","","","","1.184","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307959","24.653","0.004","7.626","0.001","12.782","0.003","90","","115.44","0.02","90","","2170.1","0.8","293","2","293","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","adeninium diaquabis(oxalato)zincate(II)","","- C14 H20 N10 O12 Zn -","- C14 H20 N10 O12 Zn -","- C56 H80 N40 O48 Zn4 -","4","0.5","","Juan P. García-Terán; Oscar Castillo; Antonio Luque; Urko García-Couceiro; Garikoitz Beobide; Pascual Román","Molecular Recognition of Adeninium Cations on Anionic Metal-Oxalato Frameworks: An Experimental and Theoretical Analysis","Inorganic Chemistry","2007","46","","3593","3602","10.1021/ic062448s","","","0.71073","MoKα","","0.1133","0.0747","","","0.1869","0.1971","","","","","","1.04","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307960","16.8431","0.0017","17.2353","0.0019","31.392","0.004","90","","90","","90","","9113","1.8","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C60 H116 Cl4 Cu2 N20 Ni4 O34 -","- C60 H88 Cl4 Cu2 N20 Ni4 O34 -","- C240 H352 Cl16 Cu8 N80 Ni16 O136 -","4","1","","Emilio Pardo; Rafael Ruiz-García; Francesc Lloret; Miguel Julve; Joan Cano; Jorge Pasán; Catalina Ruiz-Pérez; Yasmine Filali; Lise-Marie Chamoreau; Yves Journaux","Molecular-Programmed Self-Assembly of Homo- and Heterometallic Penta- and Hexanuclear Coordination Compounds: Synthesis, Crystal Structures, and Magnetic Properties of Ladder-Type CuII2MIIx (M = Cu, Ni;x= 3, 4) Oxamato Complexes with CuII2 Metallacyclophane Cores","Inorganic Chemistry","2007","46","","4504","4514","10.1021/ic062453w","","x-ray","0.71073","Mokα","","0.1743","0.0752","","","0.1413","0.1772","","","","","","0.986","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307961","14.821","0.003","17.246","0.007","19.253","0.009","88.69","0.04","78.06","0.03","77.72","0.02","4703","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H112 Cu6 F19 N16 O18 P3 -","- C56 H100 Cu6 F19 N16 O18 P3 -","- C112 H200 Cu12 F38 N32 O36 P6 -","2","1","","Emilio Pardo; Rafael Ruiz-García; Francesc Lloret; Miguel Julve; Joan Cano; Jorge Pasán; Catalina Ruiz-Pérez; Yasmine Filali; Lise-Marie Chamoreau; Yves Journaux","Molecular-Programmed Self-Assembly of Homo- and Heterometallic Penta- and Hexanuclear Coordination Compounds: Synthesis, Crystal Structures, and Magnetic Properties of Ladder-Type CuII2MIIx (M = Cu, Ni;x= 3, 4) Oxamato Complexes with CuII2 Metallacyclophane Cores","Inorganic Chemistry","2007","46","","4504","4514","10.1021/ic062453w","","x-ray","0.71073","MoKα","","0.1991","0.0968","","","0.1864","0.3229","","","","","","0.983","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307962","20.58","0.005","16.392","0.002","31.014","0.004","90","","105.013","0.009","90","","10105","3","250","2","250","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H140 Cl4 Cu6 N16 O42 -","- C62 H120 Cl4 Cu6 N16 O42 -","- C248 H480 Cl16 Cu24 N64 O168 -","4","1","","Emilio Pardo; Rafael Ruiz-García; Francesc Lloret; Miguel Julve; Joan Cano; Jorge Pasán; Catalina Ruiz-Pérez; Yasmine Filali; Lise-Marie Chamoreau; Yves Journaux","Molecular-Programmed Self-Assembly of Homo- and Heterometallic Penta- and Hexanuclear Coordination Compounds: Synthesis, Crystal Structures, and Magnetic Properties of Ladder-Type CuII2MIIx (M = Cu, Ni;x= 3, 4) Oxamato Complexes with CuII2 Metallacyclophane Cores","Inorganic Chemistry","2007","46","","4504","4514","10.1021/ic062453w","","","0.71073","MoKα","","0.1994","0.0864","","","0.2287","0.2718","","","","","","1.028","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307963","21.47","0.004","21.508","0.005","20.3051","0.0017","93.678","0.01","93.388","0.011","85.662","0.013","9316","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H100 Cl4 Cu6 N16 O28 -","- C56 H100 Cl4 Cu6 N16 O28 -","- C224 H400 Cl16 Cu24 N64 O112 -","4","2","","Emilio Pardo; Rafael Ruiz-García; Francesc Lloret; Miguel Julve; Joan Cano; Jorge Pasán; Catalina Ruiz-Pérez; Yasmine Filali; Lise-Marie Chamoreau; Yves Journaux","Molecular-Programmed Self-Assembly of Homo- and Heterometallic Penta- and Hexanuclear Coordination Compounds: Synthesis, Crystal Structures, and Magnetic Properties of Ladder-Type CuII2MIIx (M = Cu, Ni;x= 3, 4) Oxamato Complexes with CuII2 Metallacyclophane Cores","Inorganic Chemistry","2007","46","","4504","4514","10.1021/ic062453w","","","0.71073","MoKα","","0.2649","0.0836","","","0.1995","0.4371","","","","","","1.043","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307964","25.0996","0.0005","25.0996","0.0005","70.9292","0.0016","90","","90","","90","","44684.7","1.6","100","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C216 H359.2 Mn40 N8 Na4 O169.6 -","- C216 H340 Mn40 N8 Na4 O169.6 -","- C864 H1360 Mn160 N32 Na16 O678.4 -","4","0.25","","Eleni E. Moushi; Christos Lampropoulos; Wolfgang Wernsdorfer; Vassilios Nastopoulos; George Christou; Anastasios J. Tasiopoulos","A Large [Mn10Na]4 Loop of Four Linked Mn10 Loops","Inorganic Chemistry","2007","46","","3795","3797","10.1021/ic062454o","","","0.71073","MoKα","","0.114","0.0545","","","0.1537","0.1723","","","","","","0.906","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307965","28.006","0.004","9.3751","0.0015","27.169","0.004","90","","100.938","0.002","90","","7003.9","1.8","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C74 H80 Fe2 O10 S8 -","- C74 H80 Fe2 O10 S8 -","- C296 H320 Fe8 O40 S32 -","4","0.5","","Rongmin Yu; Kuppuswamy Arumugam; Ashok Manepalli; Yvon Tran; Russell Schmehl; Heiko Jacobsen; James P. Donahue","Reversible, Electrochemically Controlled Binding of Phosphine to Iron and Cobalt Bis(dithiolene) Complexes","Inorganic Chemistry","2007","46","","5131","5133","10.1021/ic0624569","","","0.71073","MoKα","","0.0801","0.0488","","","0.1129","0.1283","","","","","","1.011","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307966","30.9619","0.0018","11.4244","0.0007","23.0118","0.0014","90","","108.746","0.001","90","","7708","0.8","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C80.5 H93 Cl Fe2 N O8 S8 -","- C80.5 H93 Cl Fe2 N O8 S8 -","- C322 H372 Cl4 Fe8 N4 O32 S32 -","4","1","","Rongmin Yu; Kuppuswamy Arumugam; Ashok Manepalli; Yvon Tran; Russell Schmehl; Heiko Jacobsen; James P. Donahue","Reversible, Electrochemically Controlled Binding of Phosphine to Iron and Cobalt Bis(dithiolene) Complexes","Inorganic Chemistry","2007","46","","5131","5133","10.1021/ic0624569","","","0.71073","MoKα","","0.053","0.0411","","","0.0972","0.1039","","","","","","1.05","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307967","17.0266","0.0011","15.1377","0.001","18.1196","0.0012","90","","102.853","0.001","90","","4553.2","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C96 H128 Fe2 N2 O8 S8 -","- C96 H128 Fe2 N2 O8 S8 -","- C192 H256 Fe4 N4 O16 S16 -","2","0.5","","Rongmin Yu; Kuppuswamy Arumugam; Ashok Manepalli; Yvon Tran; Russell Schmehl; Heiko Jacobsen; James P. Donahue","Reversible, Electrochemically Controlled Binding of Phosphine to Iron and Cobalt Bis(dithiolene) Complexes","Inorganic Chemistry","2007","46","","5131","5133","10.1021/ic0624569","","","0.71073","MoKα","","0.0592","0.0473","","","0.1155","0.1223","","","","","","1.035","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307968","17.424","0.004","17.872","0.005","18.977","0.006","90","","108.96","0.005","90","","5589","3","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C122 H110 Co2 Fe3 O12 S12 -","- C122 H110 Co2 Fe3 O12 S12 -","- C244 H220 Co4 Fe6 O24 S24 -","2","0.5","","Rongmin Yu; Kuppuswamy Arumugam; Ashok Manepalli; Yvon Tran; Russell Schmehl; Heiko Jacobsen; James P. Donahue","Reversible, Electrochemically Controlled Binding of Phosphine to Iron and Cobalt Bis(dithiolene) Complexes","Inorganic Chemistry","2007","46","","5131","5133","10.1021/ic0624569","","","0.71073","MoKα","","0.1278","0.0562","","","0.1223","0.1535","","","","","","1.001","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307969","12.233","0.004","14.75","0.005","14.989","0.005","84.722","0.006","69.274","0.005","66.092","0.005","2308.3","1.3","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H48 Fe O4.5 P S4 -","- C52 H43 Fe O4.5 P S4 -","- C104 H86 Fe2 O9 P2 S8 -","2","1","","Rongmin Yu; Kuppuswamy Arumugam; Ashok Manepalli; Yvon Tran; Russell Schmehl; Heiko Jacobsen; James P. Donahue","Reversible, Electrochemically Controlled Binding of Phosphine to Iron and Cobalt Bis(dithiolene) Complexes","Inorganic Chemistry","2007","46","","5131","5133","10.1021/ic0624569","","","0.71073","MoKα","","0.0423","0.0345","","","0.0927","0.0986","","","","","","1.051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307970","9.6052","0.001","11.7254","0.0012","15.3302","0.0016","100.556","0.001","90.322","0.001","90.189","0.002","1697.3","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H64 Cl4 Co2 O8 S8 -","- C68 H64 Cl4 Co2 O8 S8 -","- C68 H64 Cl4 Co2 O8 S8 -","1","0.5","","Rongmin Yu; Kuppuswamy Arumugam; Ashok Manepalli; Yvon Tran; Russell Schmehl; Heiko Jacobsen; James P. Donahue","Reversible, Electrochemically Controlled Binding of Phosphine to Iron and Cobalt Bis(dithiolene) Complexes","Inorganic Chemistry","2007","46","","5131","5133","10.1021/ic0624569","","","0.71073","MoKα","","0.0716","0.0554","","","0.1163","0.124","","","","","","1.074","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307971","30.86","0.003","11.4501","0.0007","22.8507","0.0016","90","","108.453","0.005","90","","7659.1","1.1","100","2","100","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C80.5 H93 Cl Co2 N O8 S8 -","- C80.5 H93 Cl Co2 N O8 S8 -","- C322 H372 Cl4 Co8 N4 O32 S32 -","4","1","","Rongmin Yu; Kuppuswamy Arumugam; Ashok Manepalli; Yvon Tran; Russell Schmehl; Heiko Jacobsen; James P. Donahue","Reversible, Electrochemically Controlled Binding of Phosphine to Iron and Cobalt Bis(dithiolene) Complexes","Inorganic Chemistry","2007","46","","5131","5133","10.1021/ic0624569","","","0.71073","MoKα","","0.0777","0.0494","","","0.1043","0.1157","","","","","","1.03","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4307972","18.102","0.006","14.679","0.005","17.638","0.006","90","","105.69","0.007","90","","4512","3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C84 H104 Cl8 Co2 N2 O8 S8 -","- C84 H104 Cl8 Co2 N2 O8 S8 -","- C168 H208 Cl16 Co4 N4 O16 S16 -","2","0.5","","Rongmin Yu; Kuppuswamy Arumugam; Ashok Manepalli; Yvon Tran; Russell Schmehl; Heiko Jacobsen; James P. Donahue","Reversible, Electrochemically Controlled Binding of Phosphine to Iron and Cobalt Bis(dithiolene) Complexes","Inorganic Chemistry","2007","46","","5131","5133","10.1021/ic0624569","","","0.71073","MoKα","","0.0605","0.0441","","","0.1006","0.1082","","","","","","1.03","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307973","33.495","0.002","9.3299","0.0006","16.7071","0.0009","90","","103.291","0.006","90","","5081.2","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H70 Co N O4 S4 -","- C54 H70 Co N O4 S4 -","- C216 H280 Co4 N4 O16 S16 -","4","1","","Rongmin Yu; Kuppuswamy Arumugam; Ashok Manepalli; Yvon Tran; Russell Schmehl; Heiko Jacobsen; James P. Donahue","Reversible, Electrochemically Controlled Binding of Phosphine to Iron and Cobalt Bis(dithiolene) Complexes","Inorganic Chemistry","2007","46","","5131","5133","10.1021/ic0624569","","","0.71073","MoKα","","0.0388","0.0328","","","0.0834","0.0877","","","","","","1.039","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4307974","12.6495","0.0019","14.127","0.002","14.823","0.002","96.201","0.003","94.674","0.003","112.256","0.002","2415.5","0.6","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H47 Cl2 Co O4 P S4 -","- C52 H47 Cl2 Co O4 P S4 -","- C104 H94 Cl4 Co2 O8 P2 S8 -","2","1","","Rongmin Yu; Kuppuswamy Arumugam; Ashok Manepalli; Yvon Tran; Russell Schmehl; Heiko Jacobsen; James P. Donahue","Reversible, Electrochemically Controlled Binding of Phosphine to Iron and Cobalt Bis(dithiolene) Complexes","Inorganic Chemistry","2007","46","","5131","5133","10.1021/ic0624569","","","0.71073","MoKα","","0.0648","0.0543","","","0.134","0.1406","","","","","","1.059","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307975","15.8","0.002","8.9292","0.0013","44.332","0.007","90","","96.972","0.002","90","","6208.2","1.5","150","2","150","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C18 H54 B2 Mg P2 Si4 -","- C18 H54 B2 Mg P2 Si4 -","- C144 H432 B16 Mg8 P16 Si32 -","8","2","","Keith Izod; Corinne Wills; William Clegg; Ross W. Harrington","Alkaline Earth Metal Complexes of a Phosphine-Borane-Stabilized Carbanion: Synthesis, Structures, and Stabilities","Inorganic Chemistry","2007","46","","4320","4325","10.1021/ic062459l","","","0.71073","MoKα","","0.0589","0.056","","","0.1198","0.1209","","","","","","1.204","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307976","10.837","0.002","13.824","0.003","17.219","0.004","90","","105.666","0.002","90","","2483.8","0.9","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H86 B2 Ca O4 P2 Si4 -","- C34 H86 B2 Ca O4 P2 Si4 -","- C68 H172 B4 Ca2 O8 P4 Si8 -","2","0.5","","Keith Izod; Corinne Wills; William Clegg; Ross W. Harrington","Alkaline Earth Metal Complexes of a Phosphine-Borane-Stabilized Carbanion: Synthesis, Structures, and Stabilities","Inorganic Chemistry","2007","46","","4320","4325","10.1021/ic062459l","","","0.71073","MoKα","","0.0577","0.0427","","","0.1121","0.1219","","","","","","1.03","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307977","17.455","0.003","13.611","0.002","22.757","0.003","90","","90","","90","","5406.6","1.4","150","2","150","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C38 H94 B2 O5 P2 Si4 Sr -","- C38 H94 B2 O5 P2 Si4 Sr -","- C152 H376 B8 O20 P8 Si16 Sr4 -","4","1","","Keith Izod; Corinne Wills; William Clegg; Ross W. Harrington","Alkaline Earth Metal Complexes of a Phosphine-Borane-Stabilized Carbanion: Synthesis, Structures, and Stabilities","Inorganic Chemistry","2007","46","","4320","4325","10.1021/ic062459l","","","0.71073","MoKα","","0.0694","0.0388","","","0.0797","0.0905","","","","","","1.014","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307978","17.541","0.004","13.8433","0.0007","22.928","0.011","90","","90","","90","","5567","3","150","2","150","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C38 H94 B2 Ba O5 P2 Si4 -","- C38 H94 B2 Ba O5 P2 Si4 -","- C152 H376 B8 Ba4 O20 P8 Si16 -","4","1","","Keith Izod; Corinne Wills; William Clegg; Ross W. Harrington","Alkaline Earth Metal Complexes of a Phosphine-Borane-Stabilized Carbanion: Synthesis, Structures, and Stabilities","Inorganic Chemistry","2007","46","","4320","4325","10.1021/ic062459l","","","0.71073","MoKα","","0.0661","0.0491","","","0.1139","0.1281","","","","","","1.056","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307979","12.856","0.007","14.168","0.008","14.389","0.008","105.01","0.01","93.85","0.01","103.128","0.01","2443","2","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C24 H44 Cl2 F6 N2 O18 P4 Ru2 S4 -","- C24 H44 Cl2 F6 N2 O18 P4 Ru2 S4 -","- C48 H88 Cl4 F12 N4 O36 P8 Ru4 S8 -","2","1","","Sumito Ishizu; Hiroyasu Sugiyama; Brian K. Breedlove; Kazuko Matsumoto","C-H Cleavage and Double Alkyl Additions to the Disulfido Ligand in Dicyanido-Bridged Ru2S2 Complexes","Inorganic Chemistry","2007","46","","3726","3735","10.1021/ic062460k","","","0.71073","MoKα","","0.2047","0.0867","","","0.1989","0.2556","","","","","","1.025","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307980","12.96","0.002","13.624","0.002","14.275","0.002","104.22","0.003","94.368","0.003","101.795","0.003","2370.4","0.6","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C24 H44 Br2 F6 N2 O18 P4 Ru2 S4 -","- C24 H44 Br2 F6 N2 O18 P4 Ru2 S4 -","- C48 H88 Br4 F12 N4 O36 P8 Ru4 S8 -","2","1","","Sumito Ishizu; Hiroyasu Sugiyama; Brian K. Breedlove; Kazuko Matsumoto","C-H Cleavage and Double Alkyl Additions to the Disulfido Ligand in Dicyanido-Bridged Ru2S2 Complexes","Inorganic Chemistry","2007","46","","3726","3735","10.1021/ic062460k","","","0.71073","MoKα","","0.0721","0.0635","","","0.1795","0.1883","","","","","","1.078","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307981","18.818","0.012","13.172","0.008","17.09","0.01","90","","90","","90","","4236","4","293","2","293","2","","","","","","","","9","P c a 21","P 2c -2ac","29","","","","- C23 H44 Cl2 F3 N2 O15 P4 Ru2 S3 -","- C23 H44 Cl2 F3 N2 O15 P4 Ru2 S3 -","- C92 H176 Cl8 F12 N8 O60 P16 Ru8 S12 -","4","1","","Sumito Ishizu; Hiroyasu Sugiyama; Brian K. Breedlove; Kazuko Matsumoto","C-H Cleavage and Double Alkyl Additions to the Disulfido Ligand in Dicyanido-Bridged Ru2S2 Complexes","Inorganic Chemistry","2007","46","","3726","3735","10.1021/ic062460k","","","0.71073","MoKα","","0.0755","0.0541","","","0.1342","0.1539","","","","","","1.017","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307982","12.2984","0.0015","13.0334","0.0015","13.5373","0.0016","82.017","0.002","78.268","0.002","89.181","0.002","2103.8","0.4","123","2","123","2","","","","","","","","9","P -1","-P 1","2","","","","- C23 H44 Br2 F3 N2 O15 P4 Ru2 S3 -","- C23 H44 Br2 F3 N2 O15 P4 Ru2 S3 -","- C46 H88 Br4 F6 N4 O30 P8 Ru4 S6 -","2","1","","Sumito Ishizu; Hiroyasu Sugiyama; Brian K. Breedlove; Kazuko Matsumoto","C-H Cleavage and Double Alkyl Additions to the Disulfido Ligand in Dicyanido-Bridged Ru2S2 Complexes","Inorganic Chemistry","2007","46","","3726","3735","10.1021/ic062460k","","","0.71073","MoKα","","0.0588","0.0437","","","0.1086","0.1199","","","","","","1.024","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307983","8.982","0.006","13.158","0.008","23.18","0.014","104.245","0.012","97.383","0.011","96.312","0.012","2605","3","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C30 H54 Cl2 F6 N2 O18 P4 Ru2 S4 -","- C30 H54 Cl2 F6 N2 O18 P4 Ru2 S4 -","- C60 H108 Cl4 F12 N4 O36 P8 Ru4 S8 -","2","1","","Sumito Ishizu; Hiroyasu Sugiyama; Brian K. Breedlove; Kazuko Matsumoto","C-H Cleavage and Double Alkyl Additions to the Disulfido Ligand in Dicyanido-Bridged Ru2S2 Complexes","Inorganic Chemistry","2007","46","","3726","3735","10.1021/ic062460k","","","0.71073","MoKα","","0.1177","0.0704","","","0.1839","0.2198","","","","","","1.067","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307984","9.367","0.004","11.691","0.005","23.899","0.011","102.601","0.008","99.426","0.009","94.774","0.009","2500.3","1.9","123","2","123","2","","","","","","","","9","P -1","-P 1","2","","","","- C30 H54 Br2 F6 N2 O18 P4 Ru2 S4 -","- C30 H54 Br2 F6 N2 O18 P4 Ru2 S4 -","- C60 H108 Br4 F12 N4 O36 P8 Ru4 S8 -","2","1","","Sumito Ishizu; Hiroyasu Sugiyama; Brian K. Breedlove; Kazuko Matsumoto","C-H Cleavage and Double Alkyl Additions to the Disulfido Ligand in Dicyanido-Bridged Ru2S2 Complexes","Inorganic Chemistry","2007","46","","3726","3735","10.1021/ic062460k","","","0.71073","MoKα","","0.0994","0.0754","","","0.1897","0.2009","","","","","","1.07","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307985","11.906","0.005","13.125","0.006","15.181","0.006","80.023","0.007","86.096","0.008","85.906","0.008","2326.7","1.7","120","2","120","2","","","","","","","","9","P -1","-P 1","2","","","","- C28 H53 Cl2 F3 N2 O15 P4 Ru2 S3 -","- C28 H53 Cl2 F3 N2 O15 P4 Ru2 S3 -","- C56 H106 Cl4 F6 N4 O30 P8 Ru4 S6 -","2","1","","Sumito Ishizu; Hiroyasu Sugiyama; Brian K. Breedlove; Kazuko Matsumoto","C-H Cleavage and Double Alkyl Additions to the Disulfido Ligand in Dicyanido-Bridged Ru2S2 Complexes","Inorganic Chemistry","2007","46","","3726","3735","10.1021/ic062460k","","","0.71073","MoKα","","0.1035","0.0727","","","0.1987","0.224","","","","","","1.047","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307986","8.853","0.007","12.38","0.009","24.678","0.018","103.258","0.012","94.601","0.012","95.267","0.014","2607","3","120","2","120","2","","","","","","","","9","P -1","-P 1","2","","","","- C30 H56 Cl2 F6 N2 O18 P4 Ru2 S4 -","- C30 H56 Cl2 F6 N2 O18 P4 Ru2 S4 -","- C60 H112 Cl4 F12 N4 O36 P8 Ru4 S8 -","2","1","","Sumito Ishizu; Hiroyasu Sugiyama; Brian K. Breedlove; Kazuko Matsumoto","C-H Cleavage and Double Alkyl Additions to the Disulfido Ligand in Dicyanido-Bridged Ru2S2 Complexes","Inorganic Chemistry","2007","46","","3726","3735","10.1021/ic062460k","","","0.71073","MoKα","","0.0842","0.0626","","","0.157","0.174","","","","","","1.046","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307987","12.2103","0.0018","13.232","0.002","16.283","0.002","66.21","0.002","88.096","0.003","88.014","0.003","2405.3","0.6","120","2","120","2","","","","","","","","9","P -1","-P 1","2","","","","- C29 H55 Cl2 F3 N2 O15 P4 Ru2 S3 -","- C29 H55 Cl2 F3 N2 O15 P4 Ru2 S3 -","- C58 H110 Cl4 F6 N4 O30 P8 Ru4 S6 -","2","1","","Sumito Ishizu; Hiroyasu Sugiyama; Brian K. Breedlove; Kazuko Matsumoto","C-H Cleavage and Double Alkyl Additions to the Disulfido Ligand in Dicyanido-Bridged Ru2S2 Complexes","Inorganic Chemistry","2007","46","","3726","3735","10.1021/ic062460k","","","0.71073","MoKα","","0.1186","0.0955","","","0.2467","0.275","","","","","","1.011","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307988","8.915","0.009","12.413","0.012","24.95","0.02","103.957","0.018","91.684","0.018","95.768","0.016","2662","4","120","2","426","2","","","","","","","","9","P -1","-P 1","2","","","","- C31 H57 Cl2 F6 N2 O18 P4 Ru2 S4 -","- C31 H53 Cl2 F6 N2 O18 P4 Ru2 S4 -","- C62 H106 Cl4 F12 N4 O36 P8 Ru4 S8 -","2","1","","Sumito Ishizu; Hiroyasu Sugiyama; Brian K. Breedlove; Kazuko Matsumoto","C-H Cleavage and Double Alkyl Additions to the Disulfido Ligand in Dicyanido-Bridged Ru2S2 Complexes","Inorganic Chemistry","2007","46","","3726","3735","10.1021/ic062460k","","","0.71073","MoKα","","0.143","0.0753","","","0.186","0.228","","","","","","1.028","","","","has coordinates,has disorder","179117","2020-10-21","18:00:00",""
"4307989","8.8148","0.0012","12.4503","0.0017","23.23","0.003","102.872","0.003","98.455","0.002","94.801","0.002","2440.4","0.6","120","2","120","2","","","","","","","","9","P -1","-P 1","2","","","","- C28 H50 Cl2 F6 N2 O18 P4 Ru2 S4 -","- C28 H50 Cl2 F6 N2 O18 P4 Ru2 S4 -","- C56 H100 Cl4 F12 N4 O36 P8 Ru4 S8 -","2","1","","Sumito Ishizu; Hiroyasu Sugiyama; Brian K. Breedlove; Kazuko Matsumoto","C-H Cleavage and Double Alkyl Additions to the Disulfido Ligand in Dicyanido-Bridged Ru2S2 Complexes","Inorganic Chemistry","2007","46","","3726","3735","10.1021/ic062460k","","","0.71073","MoKα","","0.0539","0.0448","","","0.1122","0.1186","","","","","","1.047","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307990","11.7128","0.0015","13.0959","0.0017","15.2169","0.0019","80.371","0.003","85.484","0.003","85.406","0.002","2288.8","0.5","120","2","120","2","","","","","","","","9","P -1","-P 1","2","","","","- C27 H51 Cl2 F3 N2 O16 P4 Ru2 S3 -","- C27 H51 Cl2 F3 N2 O16 P4 Ru2 S3 -","- C54 H102 Cl4 F6 N4 O32 P8 Ru4 S6 -","2","1","","Sumito Ishizu; Hiroyasu Sugiyama; Brian K. Breedlove; Kazuko Matsumoto","C-H Cleavage and Double Alkyl Additions to the Disulfido Ligand in Dicyanido-Bridged Ru2S2 Complexes","Inorganic Chemistry","2007","46","","3726","3735","10.1021/ic062460k","","","0.71073","MoKα","","0.1468","0.0825","","","0.2167","0.2641","","","","","","1.029","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307991","12.539","0.003","7.499","0.0018","12.248","0.003","90","","113.731","0.004","90","","1054.3","0.4","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Bi P2 Se6 Tl -","- Bi P2 Se6 Tl -","- Bi4 P8 Se24 Tl4 -","4","1","","Matthew A. Gave; Christos D. Malliakas; David P. Weliky; Mercouri G. Kanatzidis","Wide Compositional and Structural Diversity in the System Tl/Bi/P/Q (Q = S, Se) and Observation of Vicinal P-Tl J Coupling in the Solid State","Inorganic Chemistry","2007","46","","3632","3644","10.1021/ic062465h","","","0.71073","MoKα","","0.0537","0.0399","","","0.0984","0.1037","","","","","","1.083","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307992","9.5028","0.0017","12.29","0.002","9.0771","0.0016","90","","90.561","0.003","90","","1060.1","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Bi P2 S7 Tl -","- Bi P2 S7 Tl -","- Bi4 P8 S28 Tl4 -","4","1","","Matthew A. Gave; Christos D. Malliakas; David P. Weliky; Mercouri G. Kanatzidis","Wide Compositional and Structural Diversity in the System Tl/Bi/P/Q (Q = S, Se) and Observation of Vicinal P-Tl J Coupling in the Solid State","Inorganic Chemistry","2007","46","","3632","3644","10.1021/ic062465h","","","0.71073","MoKα","","0.0256","0.0197","","","0.04","0.0417","","","","","","1.02","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307993","6.5967","0.0012","7.3749","0.0014","9.7911","0.0018","90","","91.27","0.003","90","","476.22","0.15","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- Bi P2 S6 Tl -","- Bi P2 S6 Tl -","- Bi2 P4 S12 Tl2 -","2","1","","Matthew A. Gave; Christos D. Malliakas; David P. Weliky; Mercouri G. Kanatzidis","Wide Compositional and Structural Diversity in the System Tl/Bi/P/Q (Q = S, Se) and Observation of Vicinal P-Tl J Coupling in the Solid State","Inorganic Chemistry","2007","46","","3632","3644","10.1021/ic062465h","","","0.71073","MoKα","","0.024","0.0229","","","0.0508","0.0513","","","","","","1.099","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307994","12.25","0.002","7.5518","0.0015","22.834","0.005","90","","97.65","0.03","90","","2093.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Bi P2 Se6 Tl -","- Bi P2 Se6 Tl -","- Bi8 P16 Se48 Tl8 -","8","2","","Matthew A. Gave; Christos D. Malliakas; David P. Weliky; Mercouri G. Kanatzidis","Wide Compositional and Structural Diversity in the System Tl/Bi/P/Q (Q = S, Se) and Observation of Vicinal P-Tl J Coupling in the Solid State","Inorganic Chemistry","2007","46","","3632","3644","10.1021/ic062465h","","","0.71073","MoKα","","0.0703","0.0412","","","0.0711","0.0777","","","","","","0.993","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307995","20.8189","0.0007","13.2281","0.0003","22.2029","0.0007","90","","117.896","0.002","90","","5404","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Bi3 P4 S16 Tl3 -","- Bi3 P4 S16 Tl3 -","- Bi24 P32 S128 Tl24 -","8","2","","Matthew A. Gave; Christos D. Malliakas; David P. Weliky; Mercouri G. Kanatzidis","Wide Compositional and Structural Diversity in the System Tl/Bi/P/Q (Q = S, Se) and Observation of Vicinal P-Tl J Coupling in the Solid State","Inorganic Chemistry","2007","46","","3632","3644","10.1021/ic062465h","","","0.71073","MoKα","","0.0521","0.0464","","","0.0992","0.1027","","","","","","1.048","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307996","6.9998","0.0004","7.5808","0.0004","8.3361","0.0004","64.618","0.001","68.721","0.001","69.637","0.001","362.55","0.03","100","2","100","2","","","","","","","","2","P -1","-P 1","2","compound 8, (C5Me4H)2","","","- C18 H26 -","- C18 H26 -","- C18 H26 -","1","0.5","","Abdessamad Grirrane; Irene Resa; Diego del Río; Amor Rodríguez; Eleuterio Álvarez; Kurt Mereiter; Ernesto Carmona","Solid-State Structures and Solution Studies of Novel Cyclopentadienyl Mercury Compounds","Inorganic Chemistry","2007","46","","4667","4676","10.1021/ic0624672","","","0.71073","MoKα","","0.0411","0.0388","","","0.108","0.1106","","","","","","1.077","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307997","4.1704","0.0006","8.7597","0.0013","13.318","0.002","92.219","0.006","91.385","0.005","97.15","0.005","482.17","0.12","100","2","100","2","","","","","","","","4","P -1","-P 1","2","compound 1, HgCl(C5Me4H)","","","- C9 H13 Cl Hg -","- C9 H13 Cl Hg -","- C18 H26 Cl2 Hg2 -","2","1","","Abdessamad Grirrane; Irene Resa; Diego del Río; Amor Rodríguez; Eleuterio Álvarez; Kurt Mereiter; Ernesto Carmona","Solid-State Structures and Solution Studies of Novel Cyclopentadienyl Mercury Compounds","Inorganic Chemistry","2007","46","","4667","4676","10.1021/ic0624672","","","0.71073","MoKα","","0.0802","0.0669","","","0.1603","0.1621","","","","","","1.077","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4307998","25.236","0.0014","9.0785","0.0004","26.7146","0.0015","90","","114.163","0.001","90","","5584.2","0.5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","compound 2, HgCl(C5Me4-tBu)","","","- C13 H21 Cl Hg -","- C13 H21 Cl Hg -","- C208 H336 Cl16 Hg16 -","16","2","","Abdessamad Grirrane; Irene Resa; Diego del Río; Amor Rodríguez; Eleuterio Álvarez; Kurt Mereiter; Ernesto Carmona","Solid-State Structures and Solution Studies of Novel Cyclopentadienyl Mercury Compounds","Inorganic Chemistry","2007","46","","4667","4676","10.1021/ic0624672","","","0.71073","MoKα","","0.0392","0.0325","","","0.0825","0.0859","","","","","","1.006","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4307999","13.352","0.003","14.702","0.004","18.093","0.003","68.94","0.02","81.23","0.02","63.21","0.02","2958.5","1.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","compound 3, HgCl(C5Me4SiMe3)","","","- C12 H21 Cl Hg Si -","- C12 H21 Cl Hg Si -","- C96 H168 Cl8 Hg8 Si8 -","8","4","","Abdessamad Grirrane; Irene Resa; Diego del Río; Amor Rodríguez; Eleuterio Álvarez; Kurt Mereiter; Ernesto Carmona","Solid-State Structures and Solution Studies of Novel Cyclopentadienyl Mercury Compounds","Inorganic Chemistry","2007","46","","4667","4676","10.1021/ic0624672","","","0.71073","MoKα","","0.0453","0.0261","","","0.0489","0.0535","","","","","","1.002","","","","has coordinates","179117","2020-10-21","18:00:00",""
"4308000","6.6159","0.0005","22.6512","0.0016","15.1872","0.0011","90","","91.469","0.002","90","","2275.2","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","compound 4, HgCl(C5H4SiMe3)","","","- C8 H13 Cl Hg Si -","- C8 H13 Cl Hg Si -","- C64 H104 Cl8 Hg8 Si8 -","8","2","","Abdessamad Grirrane; Irene Resa; Diego del Río; Amor Rodríguez; Eleuterio Álvarez; Kurt Mereiter; Ernesto Carmona","Solid-State Structures and Solution Studies of Novel Cyclopentadienyl Mercury Compounds","Inorganic Chemistry","2007","46","","4667","4676","10.1021/ic0624672","","","0.71073","MoKα","","0.0689","0.0457","","","0.0922","0.1009","","","","","","1.061","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308001","8.7264","0.0013","11.3098","0.0016","22.744","0.003","93.496","0.002","99.672","0.002","111.419","0.002","2041.6","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","compound 5, Hg(C5Me4SiMe3)2","","","- C24 H42 Hg Si2 -","- C24 H42 Hg Si2 -","- C72 H126 Hg3 Si6 -","3","1.5","","Abdessamad Grirrane; Irene Resa; Diego del Río; Amor Rodríguez; Eleuterio Álvarez; Kurt Mereiter; Ernesto Carmona","Solid-State Structures and Solution Studies of Novel Cyclopentadienyl Mercury Compounds","Inorganic Chemistry","2007","46","","4667","4676","10.1021/ic0624672","","","0.71073","MoKα","","0.0348","0.024","","","0.0468","0.0493","","","","","","1.027","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308002","7.9219","0.0003","9.2815","0.0003","12.4204","0.0005","90","","91.824","0.001","90","","912.77","0.06","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","compound 6, Hg(C5H4SiMe3)2","","","- C16 H26 Hg Si2 -","- C16 H26 Hg Si2 -","- C32 H52 Hg2 Si4 -","2","0.5","","Abdessamad Grirrane; Irene Resa; Diego del Río; Amor Rodríguez; Eleuterio Álvarez; Kurt Mereiter; Ernesto Carmona","Solid-State Structures and Solution Studies of Novel Cyclopentadienyl Mercury Compounds","Inorganic Chemistry","2007","46","","4667","4676","10.1021/ic0624672","","","0.71073","MoKα","","0.0208","0.0157","","","0.0394","0.044","","","","","","1.047","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308003","13.603","0.002","13.808","0.002","14.618","0.002","91.692","0.004","116.356","0.004","118.452","0.004","2059.4","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","compound 7, HgCl(C5Me4SiMe3).Hg(C5Me4SiMe3)2","","","- C36 H63 Cl Hg2 Si3 -","- C36 H63 Cl Hg2 Si3 -","- C72 H126 Cl2 Hg4 Si6 -","2","1","","Abdessamad Grirrane; Irene Resa; Diego del Río; Amor Rodríguez; Eleuterio Álvarez; Kurt Mereiter; Ernesto Carmona","Solid-State Structures and Solution Studies of Novel Cyclopentadienyl Mercury Compounds","Inorganic Chemistry","2007","46","","4667","4676","10.1021/ic0624672","","","0.71073","MoKα","","0.0379","0.0222","","","0.0463","0.0514","","","","","","1.029","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308004","4.1704","0.0006","8.7597","0.0013","13.318","0.002","92.219","0.006","91.385","0.005","97.15","0.005","482.17","0.12","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C9 H13 Cl Hg -","- C9 H13 Cl Hg -","- C18 H26 Cl2 Hg2 -","2","1","","Abdessamad Grirrane; Irene Resa; Diego del Río; Amor Rodríguez; Eleuterio Álvarez; Kurt Mereiter; Ernesto Carmona","Solid-State Structures and Solution Studies of Novel Cyclopentadienyl Mercury Compounds","Inorganic Chemistry","2007","46","","4667","4676","10.1021/ic0624672","","","0.71073","MoKα","","0.0802","0.0669","","","0.1603","0.1621","","","","","","1.077","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308012","12.265","0.0013","23.736","0.003","21.737","0.003","90","","114.251","0.007","90","","5769.7","1.3","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Os2O6(tbupy)4","","","- C42 H64 Cl12 N4 O6 Os2 -","- C42 H64 Cl12 N4 O6 Os2 -","- C168 H256 Cl48 N16 O24 Os8 -","4","1","","Karine Valliant-Saunders; Erica Gunn; G. Robert Shelton; David A. Hrovat; Weston Thatcher Borden; James M. Mayer","Oxidation of Tertiary Silanes by Osmium Tetroxide","Inorganic Chemistry","2007","46","","5212","5219","10.1021/ic062468u","","","0.71073","MoKα","","0.2753","0.0874","","","0.1569","0.2159","","","","","","0.994","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308013","10.1127","0.0019","10.224","0.002","11.903","0.002","105.14","0.005","108.065","0.004","107.293","0.004","1029","0.3","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H29 Cl3 Te -","- C18 H29 Cl3 Te -","- C36 H58 Cl6 Te2 -","2","1","","Jens Beckmann; Stephan Heitz; Malte Hesse","Four Distinctively Different Decomposition Pathways of Metastable Supermesityltellurium(IV) Trichloride","Inorganic Chemistry","2007","46","","3275","3282","10.1021/ic062469m","","","0.71073","MoKα","","0.0484","0.0422","","","0.105","0.11","","","","","","1.015","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308014","10.536","0.002","18.065","0.004","11.779","0.003","90","","114.308","0.005","90","","2043.2","0.8","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H56 Cl4 O Te2 -","- C38 H56 Cl4 O Te2 -","- C76 H112 Cl8 O2 Te4 -","2","0.5","","Jens Beckmann; Stephan Heitz; Malte Hesse","Four Distinctively Different Decomposition Pathways of Metastable Supermesityltellurium(IV) Trichloride","Inorganic Chemistry","2007","46","","3275","3282","10.1021/ic062469m","","","0.71073","MoKα","","0.0279","0.0224","","","0.0582","0.0621","","","","","","1.048","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4308015","22.573","0.004","10.0611","0.0017","19.194","0.003","90","","111.869","0.003","90","","4045.4","1.2","133","","133","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H30 Cl2 O Te -","- C18 H30 Cl2 O Te -","- C144 H240 Cl16 O8 Te8 -","8","1","","Jens Beckmann; Stephan Heitz; Malte Hesse","Four Distinctively Different Decomposition Pathways of Metastable Supermesityltellurium(IV) Trichloride","Inorganic Chemistry","2007","46","","3275","3282","10.1021/ic062469m","","","0.71073","MoKα","","0.0284","0.0216","","","0.0529","0.0565","","","","","","1.05","","","","has coordinates,has disorder","179118","2020-10-21","18:00:00",""
"4308016","5.9188","0.0012","15.599","0.003","20.123","0.004","90","","90","","90","","1857.9","0.6","173","","173","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H29 Cl Te -","- C18 H29 Cl Te -","- C72 H116 Cl4 Te4 -","4","1","","Jens Beckmann; Stephan Heitz; Malte Hesse","Four Distinctively Different Decomposition Pathways of Metastable Supermesityltellurium(IV) Trichloride","Inorganic Chemistry","2007","46","","3275","3282","10.1021/ic062469m","","","0.71073","MoKα","","0.05","0.0324","","","0.0724","0.0778","","","","","","1.081","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308017","8.763","0.005","25.607","0.005","31.505","0.005","90","0.005","90","0.005","90","0.005","7070","4","173","","173","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C16 H42 Cl10 O4 Te2 -","- C8 H21 Cl5 O2 Te -","- C128 H336 Cl80 O32 Te16 -","16","0.5","","Jens Beckmann; Stephan Heitz; Malte Hesse","Four Distinctively Different Decomposition Pathways of Metastable Supermesityltellurium(IV) Trichloride","Inorganic Chemistry","2007","46","","3275","3282","10.1021/ic062469m","","","0.71069","MoKα","","0.0629","0.0542","","","0.0965","0.0993","","","","","","1.393","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308018","12.1103","0.0012","14.0116","0.0014","18.9519","0.0019","90","","107.876","0.002","90","","3060.6","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H24 Cl3 I N2 Pd -","- C33 H24 Cl3 I N2 Pd -","- C132 H96 Cl12 I4 N8 Pd4 -","4","1","","Liqing Ma; Philip M. Imbesi; James B. Updegraff; Allen D. Hunter; John D. Protasiewicz","Synthesis and Structural Studies of NCN Diimine Palladium Pincer Complexes Bearingm-Terphenyl Scaffolds","Inorganic Chemistry","2007","46","","5220","5228","10.1021/ic062476a","","","0.71073","MoKα","","0.0276","0.0266","","","0.0615","0.062","","","","","","1.117","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308019","9.7013","0.0002","10.4575","0.0002","14.4524","0.0003","88.357","0.001","85.11","0.001","73.893","0.001","1403.51","0.05","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H35 I N2 Pd -","- C32 H35 I N2 Pd -","- C64 H70 I2 N4 Pd2 -","2","1","","Liqing Ma; Philip M. Imbesi; James B. Updegraff; Allen D. Hunter; John D. Protasiewicz","Synthesis and Structural Studies of NCN Diimine Palladium Pincer Complexes Bearingm-Terphenyl Scaffolds","Inorganic Chemistry","2007","46","","5220","5228","10.1021/ic062476a","","","0.71073","MoKα","","0.0251","0.0237","","","0.06","0.0607","","","","","","1.169","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308020","17.3546","0.0004","14.2975","0.0004","12.2046","0.0003","90","","99.881","0.001","90","","2983.37","0.13","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H31 I N2 Pd -","- C36 H31 I N2 Pd -","- C144 H124 I4 N8 Pd4 -","4","1","","Liqing Ma; Philip M. Imbesi; James B. Updegraff; Allen D. Hunter; John D. Protasiewicz","Synthesis and Structural Studies of NCN Diimine Palladium Pincer Complexes Bearingm-Terphenyl Scaffolds","Inorganic Chemistry","2007","46","","5220","5228","10.1021/ic062476a","","","0.71073","MoKα","","0.0251","0.0213","","","0.054","0.0563","","","","","","1.062","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308021","27.466","0.0008","13.746","0.0004","19.5017","0.0006","90","","121.316","0.001","90","","6290.2","0.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H35 I N2 Pd -","- C38 H35 I N2 Pd -","- C304 H280 I8 N16 Pd8 -","8","1","","Liqing Ma; Philip M. Imbesi; James B. Updegraff; Allen D. Hunter; John D. Protasiewicz","Synthesis and Structural Studies of NCN Diimine Palladium Pincer Complexes Bearingm-Terphenyl Scaffolds","Inorganic Chemistry","2007","46","","5220","5228","10.1021/ic062476a","","","0.71073","MoKα","","0.018","0.0165","","","0.0459","0.0469","","","","","","1.09","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308022","15.7499","0.0002","15.7499","0.0002","10.5822","0.0002","90","","90","","120","","2273.33","0.06","100","2","100","2","","","","","","","","5","P 31","P 31","144","","","","- C36 H31 I N2 Pd -","- C36 H31 I N2 Pd -","- C108 H93 I3 N6 Pd3 -","3","1","","Liqing Ma; Philip M. Imbesi; James B. Updegraff; Allen D. Hunter; John D. Protasiewicz","Synthesis and Structural Studies of NCN Diimine Palladium Pincer Complexes Bearingm-Terphenyl Scaffolds","Inorganic Chemistry","2007","46","","5220","5228","10.1021/ic062476a","","","0.71073","MoKα","","0.0143","0.0139","","","0.0335","0.0336","","","","","","1.019","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308023","10.0764","0.0003","14.6621","0.0004","33.0584","0.001","90","","97.881","0.002","90","","4838","0.2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C38 H33 I N2 Pd -","- C38 H33 I N2 Pd -","- C228 H198 I6 N12 Pd6 -","6","3","","Liqing Ma; Philip M. Imbesi; James B. Updegraff; Allen D. Hunter; John D. Protasiewicz","Synthesis and Structural Studies of NCN Diimine Palladium Pincer Complexes Bearingm-Terphenyl Scaffolds","Inorganic Chemistry","2007","46","","5220","5228","10.1021/ic062476a","","","0.71073","MoKα","","0.1324","0.0669","","","0.1141","0.1385","","","","","","0.978","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308024","25.6349","0.0002","25.6349","0.0002","25.6349","0.0002","90","","90","","90","","16845.9","0.2","293","2","293","2","","","","","","","","5","P 43 3 2","P 4acd 2ab 3","212","MOF2a","","","- C48 H28 N6 O14 Zn3 -","- C48 H24 N6 O14 Zn3 -","- C192 H96 N24 O56 Zn12 -","4","0.166667","","Daofeng Sun; Yanxiong Ke; David J. Collins; Gary A. Lorigan; Hong-Cai Zhou","Construction of Robust Open Metal-Organic Frameworks with Chiral Channels and Permanent Porosity","Inorganic Chemistry","2007","46","","2725","2734","10.1021/ic0624773","","","0.71073","MoKα","","0.0508","0.028","","","0.0492","0.0518","","","","","","0.787","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308025","25.6415","0.0006","25.6415","0.0006","25.6415","0.0006","90","","90","","90","","16858.9","0.7","213","2","213","2","","","","","","","","5","P 41 3 2","P 4bd 2ab 3","213","MOF2b","","","- C48 H28 N6 O14 Zn3 -","- C48 H24 N6 O14 Zn3 -","- C192 H96 N24 O56 Zn12 -","4","0.166667","","Daofeng Sun; Yanxiong Ke; David J. Collins; Gary A. Lorigan; Hong-Cai Zhou","Construction of Robust Open Metal-Organic Frameworks with Chiral Channels and Permanent Porosity","Inorganic Chemistry","2007","46","","2725","2734","10.1021/ic0624773","","","0.71073","MoKα","","0.0546","0.0256","","","0.0467","0.0497","","","","","","0.765","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308026","26.001","0.003","26.001","0.003","26.001","0.003","90","","90","","90","","17578","4","293","2","293","2","","","","","","","","5","P 43 3 2","P 4acd 2ab 3","212","MOF3","","","- C48 H28 Cd3 N6 O14 -","- C48 H24 Cd3 N6 O14 -","- C192 H96 Cd12 N24 O56 -","4","0.166667","","Daofeng Sun; Yanxiong Ke; David J. Collins; Gary A. Lorigan; Hong-Cai Zhou","Construction of Robust Open Metal-Organic Frameworks with Chiral Channels and Permanent Porosity","Inorganic Chemistry","2007","46","","2725","2734","10.1021/ic0624773","","x-ray","0.71073","MoKα","","0.1929","0.1046","","","0.2709","0.3575","","","","","","1.112","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308027","17.8737","0.0003","17.8737","0.0003","26.2972","0.0007","90","","90","","90","","8401.1","0.3","213","2","213","2","","","","","","","","5","P 43 2 2","P 4cw 2c","95","none","","","- C52 H36.5 N7.5 O14 Zn3 -","- C52 H35.5 N7.5 O14 Zn3 -","- C208 H142 N30 O56 Zn12 -","4","0.5","","Daofeng Sun; Yanxiong Ke; David J. Collins; Gary A. Lorigan; Hong-Cai Zhou","Construction of Robust Open Metal-Organic Frameworks with Chiral Channels and Permanent Porosity","Inorganic Chemistry","2007","46","","2725","2734","10.1021/ic0624773","","","0.71073","MoKα","","0.0646","0.053","","","0.1874","0.1922","","","","","","1.107","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308028","17.998","0.0003","17.998","0.0003","25.9577","0.0009","90","","90","","90","","8408.4","0.4","183","2","183","2","","","","","","","","5","P 41 2 2","P 4w 2c","91","none","","","- C49 H28 N6 O15.5 Zn3 -","- C49 H24 N6 O15.5 Zn3 -","- C196 H96 N24 O62 Zn12 -","4","0.5","","Daofeng Sun; Yanxiong Ke; David J. Collins; Gary A. Lorigan; Hong-Cai Zhou","Construction of Robust Open Metal-Organic Frameworks with Chiral Channels and Permanent Porosity","Inorganic Chemistry","2007","46","","2725","2734","10.1021/ic0624773","","","0.71073","MoKα","","0.0521","0.0453","","","0.16","0.1631","","","","","","1.113","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308029","18.0373","0.0004","18.0373","0.0004","27.2604","0.0014","90","","90","","90","","8869","0.5","213","2","213","2","","","","","","","","5","P 43 2 2","P 4cw 2c","95","none","","","- C50 H27 Cd3 N6 O14 -","- C50 H24 Cd3 N6 O14 -","- C200 H96 Cd12 N24 O56 -","4","0.5","","Daofeng Sun; Yanxiong Ke; David J. Collins; Gary A. Lorigan; Hong-Cai Zhou","Construction of Robust Open Metal-Organic Frameworks with Chiral Channels and Permanent Porosity","Inorganic Chemistry","2007","46","","2725","2734","10.1021/ic0624773","","","0.71073","MoKα","","0.0731","0.0602","","","0.197","0.2172","","","","","","1.181","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308030","18.0494","0.0004","18.0494","0.0004","27.17","0.0013","90","","90","","90","","8851.5","0.5","213","2","213","2","","","","","","","","5","P 41 2 2","P 4w 2c","91","none","","","- C50 H27 Cd3 N6 O14 -","- C50 H24 Cd3 N6 O14 -","- C200 H96 Cd12 N24 O56 -","4","0.5","","Daofeng Sun; Yanxiong Ke; David J. Collins; Gary A. Lorigan; Hong-Cai Zhou","Construction of Robust Open Metal-Organic Frameworks with Chiral Channels and Permanent Porosity","Inorganic Chemistry","2007","46","","2725","2734","10.1021/ic0624773","","","0.71073","MoKα","","0.0749","0.0631","","","0.1837","0.2007","","","","","","1.185","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308031","16.19","0.002","11.345","0.001","21.092","0.002","90","","109.83","0.01","90","","3644.4","0.7","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H59 N5 Ni O4 S2 -","- C32 H59 N5 Ni O4 S2 -","- C128 H236 N20 Ni4 O16 S8 -","4","1","","Erwan Galardon; Emilie Bourles; Isabelle Artaud; Jean-Claude Daran; Pascal Roussel; Alain Tomas","Metalation of Cyclic Pseudopeptidic Thiosulfinates with Ni(II) and Zn(II) after Ring Opening: A Mechanistic Investigation","Inorganic Chemistry","2007","46","","4515","4522","10.1021/ic062480m","","","0.71073","MoKα","","0.0754","0.0548","","","0.1479","0.1601","","","","","","1.111","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308032","16.833","0.004","11.8","0.002","19.114","0.004","90","","112.602","0.003","90","","3505","1.3","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H60 N4 Ni O4 S2 -","- C32 H60 N4 Ni O4 S2 -","- C128 H240 N16 Ni4 O16 S8 -","4","1","","Erwan Galardon; Emilie Bourles; Isabelle Artaud; Jean-Claude Daran; Pascal Roussel; Alain Tomas","Metalation of Cyclic Pseudopeptidic Thiosulfinates with Ni(II) and Zn(II) after Ring Opening: A Mechanistic Investigation","Inorganic Chemistry","2007","46","","4515","4522","10.1021/ic062480m","","","0.71073","MoKα","","0.0652","0.0454","","","0.1168","0.1267","","","","","","1.102","","","","has coordinates,has disorder","179118","2020-10-21","18:00:00",""
"4308033","9.907","0.01","14.555","0.014","16.175","0.016","79.44","0.02","75.718","0.016","72.794","0.019","2144","4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H21 Mo N4 O6 Re -","- C15 H21 Mo N4 O6 Re -","- C60 H84 Mo4 N16 O24 Re4 -","4","2","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; James A. Golen; Arnold L. Rheingold","Pyrazole Complexes as Anion Receptors: Effects of Changing the Metal, the Pyrazole Substitution Pattern, and the Number of Pyrazole Ligands","Inorganic Chemistry","2007","46","","3407","3418","10.1021/ic0700046","","","0.71073","MoKα","","0.1342","0.0925","","","0.2303","0.2672","","","","","","1.056","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308034","14.775","0.003","26.092","0.006","15.489","0.003","90","","105.468","0.004","90","","5755","2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C50 H36 B F24 Mn N6 O3 -","- C50 H36 B F24 Mn N6 O3 -","- C200 H144 B4 F96 Mn4 N24 O12 -","4","1","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; James A. Golen; Arnold L. Rheingold","Pyrazole Complexes as Anion Receptors: Effects of Changing the Metal, the Pyrazole Substitution Pattern, and the Number of Pyrazole Ligands","Inorganic Chemistry","2007","46","","3407","3418","10.1021/ic0700046","","","0.71073","MoKα","","0.1482","0.087","","","0.2381","0.2888","","","","","","1.043","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308035","10.814","0.007","15.8","0.007","19.85","0.009","74.826","0.014","76.374","0.015","83.188","0.014","3175","3","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H48 B F24 Mn N6 O3 -","- C56 H48 B F24 Mn N6 O3 -","- C112 H96 B2 F48 Mn2 N12 O6 -","2","1","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; James A. Golen; Arnold L. Rheingold","Pyrazole Complexes as Anion Receptors: Effects of Changing the Metal, the Pyrazole Substitution Pattern, and the Number of Pyrazole Ligands","Inorganic Chemistry","2007","46","","3407","3418","10.1021/ic0700046","","","0.71073","MoKα","","0.1011","0.0771","","","0.2172","0.2442","","","","","","1.061","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308036","11.865","0.003","14.837","0.004","14.004","0.004","90","","110.941","0.005","90","","2302.4","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 Mn N7 O6 -","- C18 H24 Mn N7 O6 -","- C72 H96 Mn4 N28 O24 -","4","1","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; James A. Golen; Arnold L. Rheingold","Pyrazole Complexes as Anion Receptors: Effects of Changing the Metal, the Pyrazole Substitution Pattern, and the Number of Pyrazole Ligands","Inorganic Chemistry","2007","46","","3407","3418","10.1021/ic0700046","","","0.71073","MoKα","","0.0612","0.0405","","","0.0998","0.1118","","","","","","1.001","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308037","13.887","0.006","15.524","0.006","23.611","0.01","90","","102.224","0.008","90","","4975","4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 Mn N6 O7 Re -","- C18 H24 Mn N6 O7 Re -","- C144 H192 Mn8 N48 O56 Re8 -","8","2","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; James A. Golen; Arnold L. Rheingold","Pyrazole Complexes as Anion Receptors: Effects of Changing the Metal, the Pyrazole Substitution Pattern, and the Number of Pyrazole Ligands","Inorganic Chemistry","2007","46","","3407","3418","10.1021/ic0700046","","","0.71073","MoKα","","0.0819","0.0562","","","0.1209","0.1436","","","","","","1.027","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308038","18.566","0.003","28.554","0.005","18.475","0.003","90","","119.043","0.003","90","","8563","2","296","2","296","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C72 H84 B F24 Mn N7 O7 Re -","- C72 H84 B F24 Mn N7 O7 Re -","- C288 H336 B4 F96 Mn4 N28 O28 Re4 -","4","1","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; James A. Golen; Arnold L. Rheingold","Pyrazole Complexes as Anion Receptors: Effects of Changing the Metal, the Pyrazole Substitution Pattern, and the Number of Pyrazole Ligands","Inorganic Chemistry","2007","46","","3407","3418","10.1021/ic0700046","","","0.71073","MoKα","","0.1649","0.089","","","0.2087","0.2639","","","","","","1.011","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308039","13.926","0.003","15.559","0.003","23.677","0.005","90","","102.265","0.004","90","","5013.1","1.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 N6 O7 Re2 -","- C18 H24 N6 O7 Re2 -","- C144 H192 N48 O56 Re16 -","8","2","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; James A. Golen; Arnold L. Rheingold","Pyrazole Complexes as Anion Receptors: Effects of Changing the Metal, the Pyrazole Substitution Pattern, and the Number of Pyrazole Ligands","Inorganic Chemistry","2007","46","","3407","3418","10.1021/ic0700046","","","0.71073","MoKα","","0.0787","0.0591","","","0.1381","0.1572","","","","","","1.044","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308040","9.407","0.005","18.291","0.01","10.21","0.006","90","","92.686","0.011","90","","1754.8","1.7","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C11 H8 F3 N2 O8 Re S -","- C11 H8 F3 N2 O8 Re S -","- C44 H32 F12 N8 O32 Re4 S4 -","4","1","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; James A. Golen; Arnold L. Rheingold","Pyrazole Complexes as Anion Receptors: Effects of Changing the Metal, the Pyrazole Substitution Pattern, and the Number of Pyrazole Ligands","Inorganic Chemistry","2007","46","","3407","3418","10.1021/ic0700046","","","0.71073","MoKα","","0.0367","0.0282","","","0.0763","0.0806","","","","","","1.053","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308041","10.6683","0.0017","12.405","0.002","19.975","0.003","95.593","0.004","95.245","0.003","99.65","0.003","2578","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H28 B F24 N4 O4 Re -","- C46 H28 B F24 N4 O4 Re -","- C92 H56 B2 F48 N8 O8 Re2 -","2","1","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; James A. Golen; Arnold L. Rheingold","Pyrazole Complexes as Anion Receptors: Effects of Changing the Metal, the Pyrazole Substitution Pattern, and the Number of Pyrazole Ligands","Inorganic Chemistry","2007","46","","3407","3418","10.1021/ic0700046","","","0.71073","MoKα","","0.0528","0.0433","","","0.1125","0.12","","","","","","1.03","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308042","14.532","0.004","23.467","0.006","17.381","0.004","90","","103.523","0.005","90","","5763","3","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C50 H37 B F24 N5 O3 Re -","- C50 H37 B F24 N5 O3 Re -","- C200 H148 B4 F96 N20 O12 Re4 -","4","1","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; James A. Golen; Arnold L. Rheingold","Pyrazole Complexes as Anion Receptors: Effects of Changing the Metal, the Pyrazole Substitution Pattern, and the Number of Pyrazole Ligands","Inorganic Chemistry","2007","46","","3407","3418","10.1021/ic0700046","","","0.71073","MoKα","","0.0627","0.0464","","","0.1129","0.1267","","","","","","1.011","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308043","11.79","0.007","20.368","0.012","17.485","0.01","90","","93.392","0.012","90","","4191","4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H42 N6 O10 Re2 -","- C36 H42 N6 O10 Re2 -","- C144 H168 N24 O40 Re8 -","4","1","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; James A. Golen; Arnold L. Rheingold","Pyrazole Complexes as Anion Receptors: Effects of Changing the Metal, the Pyrazole Substitution Pattern, and the Number of Pyrazole Ligands","Inorganic Chemistry","2007","46","","3407","3418","10.1021/ic0700046","","","0.71073","MoKα","","0.0573","0.0326","","","0.0687","0.0763","","","","","","1","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308044","10.7796","0.0008","12.6297","0.001","19.6399","0.0015","90","","90","","90","","2673.8","0.4","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H18 Cl N6 O7 Re -","- C24 H18 Cl N6 O7 Re -","- C96 H72 Cl4 N24 O28 Re4 -","4","1","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel; James A. Golen; Arnold L. Rheingold","Pyrazole Complexes as Anion Receptors: Effects of Changing the Metal, the Pyrazole Substitution Pattern, and the Number of Pyrazole Ligands","Inorganic Chemistry","2007","46","","3407","3418","10.1021/ic0700046","","","0.71073","MoKα","","0.0244","0.0232","","","0.0611","0.0615","","","","","","1.062","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308045","13.6041","0.0017","9.6219","0.0012","25.158","0.003","90","","96.093","0.002","90","","3274.5","0.7","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C68 H84 B2 Cl2 Ga2 N8 O6 -","- C68 H84 B2 Cl2 Ga2 N8 O6 -","- C136 H168 B4 Cl4 Ga4 N16 O12 -","2","0.5","","Dong Guo; James K. McCusker","Spin Exchange Effects on the Physicochemical Properties of Tetraoxolene-Bridged Bimetallic Complexes","Inorganic Chemistry","2007","46","","3257","3274","10.1021/ic070005y","","","0.71073","MoKα","","0.096","0.0465","","","0.088","0.098","","","","","","0.913","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308046","13.646","0.006","9.668","0.004","25.117","0.01","90","","96.149","0.007","90","","3295","2","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C68 H84 B2 Cl2 Cr Ga N8 O6 -","- C68 H84 B2 Cl2 Cr Ga N8 O6 -","- C136 H168 B4 Cl4 Cr2 Ga2 N16 O12 -","2","0.5","","Dong Guo; James K. McCusker","Spin Exchange Effects on the Physicochemical Properties of Tetraoxolene-Bridged Bimetallic Complexes","Inorganic Chemistry","2007","46","","3257","3274","10.1021/ic070005y","","","0.71073","MoKα","","0.0767","0.0426","","","0.0844","0.0906","","","","","","0.97","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308047","13.6357","0.0013","9.6821","0.0009","24.999","0.002","90","","96.219","0.003","90","","3281","0.5","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C68 H84 B2 Cl2 Cr2 N8 O6 -","- C68 H84 B2 Cl2 Cr2 N8 O6 -","- C136 H168 B4 Cl4 Cr4 N16 O12 -","2","0.5","","Dong Guo; James K. McCusker","Spin Exchange Effects on the Physicochemical Properties of Tetraoxolene-Bridged Bimetallic Complexes","Inorganic Chemistry","2007","46","","3257","3274","10.1021/ic070005y","","","0.71073","MoKα","","0.1598","0.0674","","","0.0888","0.1085","","","","","","1.002","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308048","28.961","0.001","15.597","0.001","26.911","0.001","90","","113.4","0.01","90","","11156.1","1.2","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","(PhTe)16 Ag4 Hg6","(PhTe)16 Ag4 Hg6","","- C96 H80 Ag4 Hg6 Te16 -","- C96 H80 Ag4 Hg6 Te16 -","- C384 H320 Ag16 Hg24 Te64 -","4","1","","Davi F. Back; Gelson N. M. de Oliveira; Robert A. Burrow; Ernesto E. Castellano; Ulrich Abram; Ernesto S. Lang","Mercury Bis(phenyltellurolate) as a Precursor for the Synthesis of Binary and Ternary Nanoclusters","Inorganic Chemistry","2007","46","","2356","2358","10.1021/ic070006q","","x-ray","0.71073","MoKα","","0.0689","0.06","","","0.1651","0.1764","","","","","","1.034","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308049","17.571","0.005","18.633","0.005","20.902","0.005","95.805","0.015","113.791","0.014","90.738","0.016","6219","3","295","2","295","2","","","","","","","","7","P -1","-P 1","2","Cluster Hg-Ag-TePh","[(PhTe)14Hg6Ag4Te]","","- C87 H77 Ag4 Hg6 N O Te15 -","- C87 H77 Ag4 Hg6 N O Te15 -","- C174 H154 Ag8 Hg12 N2 O2 Te30 -","2","1","","Davi F. Back; Gelson N. M. de Oliveira; Robert A. Burrow; Ernesto E. Castellano; Ulrich Abram; Ernesto S. Lang","Mercury Bis(phenyltellurolate) as a Precursor for the Synthesis of Binary and Ternary Nanoclusters","Inorganic Chemistry","2007","46","","2356","2358","10.1021/ic070006q","","","0.71073","MoKα","","0.1767","0.075","","","0.2074","0.2407","","","","","","0.951","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308050","28.6613","0.0009","28.6613","0.0009","28.6613","0.0009","90","","90","","90","","23544.4","1.3","293","2","293","2","","","","","","","","8","F -4 3 c","F -4a 2 3","219","CLUSTER-2","Cluster Co-Hg-Te","","- C108 H60 Cl4 Co Hg8 N6 O6 Te13 -","- C108 H60 Cl4 Co Hg8 N6 O6 Te13 -","- C864 H480 Cl32 Co8 Hg64 N48 O48 Te104 -","8","0.0833333","","Davi F. Back; Gelson N. M. de Oliveira; Robert A. Burrow; Ernesto E. Castellano; Ulrich Abram; Ernesto S. Lang","Mercury Bis(phenyltellurolate) as a Precursor for the Synthesis of Binary and Ternary Nanoclusters","Inorganic Chemistry","2007","46","","2356","2358","10.1021/ic070006q","","","0.71073","MoKα","","0.0597","0.0343","","","0.0954","0.1633","","","","","","1.32","","","","has coordinates","268283","2021-08-30","06:31:22",""
"4308051","28.6613","0.0009","28.6613","0.0009","28.6613","0.0009","90","","90","","90","","23544.4","1.3","296","2","296","2","","","","","","","","8","F -4 3 c","F -4a 2 3","219","","[(PhTe)12Hg8TeCl4][NiDMF6]","","- C90 H60 Cl4 Hg8 N6 Ni O6 Te13 -","- C90 H60 Cl4 Hg8 N6 Ni O6 Te13 -","- C720 H480 Cl32 Hg64 N48 Ni8 O48 Te104 -","8","0.0833333","","Davi F. Back; Gelson N. M. de Oliveira; Robert A. Burrow; Ernesto E. Castellano; Ulrich Abram; Ernesto S. Lang","Mercury Bis(phenyltellurolate) as a Precursor for the Synthesis of Binary and Ternary Nanoclusters","Inorganic Chemistry","2007","46","","2356","2358","10.1021/ic070006q","","","0.71073","MoKα","","0.0754","0.038","","","0.1089","0.1523","","","","","","1.344","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308052","36.9313","0.001","5.513","0.0002","17.4561","0.0006","90","","94.2051","0.001","90","","3544.5","0.2","293","2","293","2","","","","","","","synthesis as described","6","C 1 2 1","C 2y","5","","","","- C26 H42 Cl2 N2 O16 Pt -","- C26 H42 Cl2 N2 O16 Pt -","- C104 H168 Cl8 N8 O64 Pt4 -","4","1","","Sine A. Johannesen; Bent O. Petersen; Jens Ø. Duus; Troels Skrydstrup","Studies Directed to Understanding the Structure of Chitosan-Metal Complexes: Investigations of Mono- and Disaccharide Models with Platinum(II) Group Metals","Inorganic Chemistry","2007","46","","4326","4335","10.1021/ic070016r","","x-ray","0.71073","MoKα","","0.0375","0.0292","","","0.0488","0.0507","","","","","","1.019","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308053","36.298","0.003","5.4644","0.0004","17.3189","0.001","90","","94.004","0.002","90","","3426.8","0.4","100","2","100","2","","","","","","","synthesis as described","6","C 1 2 1","C 2y","5","","","","- C26 H42 Cl2 N2 O16 Pd -","- C26 H42 Cl2 N2 O16 Pd -","- C104 H168 Cl8 N8 O64 Pd4 -","4","1","","Sine A. Johannesen; Bent O. Petersen; Jens Ø. Duus; Troels Skrydstrup","Studies Directed to Understanding the Structure of Chitosan-Metal Complexes: Investigations of Mono- and Disaccharide Models with Platinum(II) Group Metals","Inorganic Chemistry","2007","46","","4326","4335","10.1021/ic070016r","","x-ray","0.71073","MoKα","","0.0599","0.0434","","","0.0668","0.0718","","","","","","0.987","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308054","9.7966","0.0012","12.2052","0.0015","14.1207","0.0017","105.856","0.002","104.118","0.002","107.017","0.002","1453.6","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H28 Ni O4 S4 -","- C32 H28 Ni O4 S4 -","- C64 H56 Ni2 O8 S8 -","2","1","","Kuppuswamy Arumugam; James E. Bollinger; Mark Fink; James P. Donahue","Preparation and Isolation of Dithiolene Thiophosphoryl Molecules as Stable, Protected Forms of Dithiolene Ligands","Inorganic Chemistry","2007","46","","3283","3288","10.1021/ic0700203","","","0.71073","MoKα","","0.0423","0.0342","","","0.0852","0.0908","","","","","","1.03","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308055","5.8333","0.0008","16.246","0.002","19.129","0.003","90","","92.991","0.002","90","","1810.3","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H17 O2 P S4 -","- C17 H17 O2 P S4 -","- C68 H68 O8 P4 S16 -","4","1","","Kuppuswamy Arumugam; James E. Bollinger; Mark Fink; James P. Donahue","Preparation and Isolation of Dithiolene Thiophosphoryl Molecules as Stable, Protected Forms of Dithiolene Ligands","Inorganic Chemistry","2007","46","","3283","3288","10.1021/ic0700203","","","0.71073","MoKα","","0.0695","0.0534","","","0.1143","0.1212","","","","","","1.077","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308056","7.1334","0.0007","14.442","0.0014","11.2896","0.0011","90","","103.833","0.001","90","","1129.33","0.19","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H21 O2 P S4 -","- C23 H21 O2 P S4 -","- C46 H42 O4 P2 S8 -","2","1","","Kuppuswamy Arumugam; James E. Bollinger; Mark Fink; James P. Donahue","Preparation and Isolation of Dithiolene Thiophosphoryl Molecules as Stable, Protected Forms of Dithiolene Ligands","Inorganic Chemistry","2007","46","","3283","3288","10.1021/ic0700203","","","0.71073","MoKα","","0.0311","0.0305","","","0.0779","0.0785","","","","","","1.064","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308057","9.476","0.003","10.329","0.003","25.685","0.007","90","","90","","90","","2514","1.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","tetra(p-anisyl)thiophene","","","- C32 H28 O4 S -","- C32 H28 O4 S -","- C128 H112 O16 S4 -","4","1","","Kuppuswamy Arumugam; James E. Bollinger; Mark Fink; James P. Donahue","Preparation and Isolation of Dithiolene Thiophosphoryl Molecules as Stable, Protected Forms of Dithiolene Ligands","Inorganic Chemistry","2007","46","","3283","3288","10.1021/ic0700203","","","0.71073","MoKα","","0.0803","0.0703","","","0.1752","0.1817","","","","","","1.079","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308058","6.374","0.003","23.815","0.01","10.636","0.004","90","","95.981","0.006","90","","1605.7","1.2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H13 P S4 -","- C15 H13 P S4 -","- C60 H52 P4 S16 -","4","1","","Kuppuswamy Arumugam; James E. Bollinger; Mark Fink; James P. Donahue","Preparation and Isolation of Dithiolene Thiophosphoryl Molecules as Stable, Protected Forms of Dithiolene Ligands","Inorganic Chemistry","2007","46","","3283","3288","10.1021/ic0700203","","","0.71073","MoKα","","0.0375","0.035","","","0.0973","0.0998","","","","","","1.087","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308059","7.5963","0.0017","5.8631","0.0014","19.351","0.005","90","","100.079","0.004","90","","848.6","0.4","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H18 S2 -","- C22 H18 S2 -","- C44 H36 S4 -","2","1","","Kuppuswamy Arumugam; James E. Bollinger; Mark Fink; James P. Donahue","Preparation and Isolation of Dithiolene Thiophosphoryl Molecules as Stable, Protected Forms of Dithiolene Ligands","Inorganic Chemistry","2007","46","","3283","3288","10.1021/ic0700203","","","0.71073","MoKα","","0.0834","0.0621","","","0.1277","0.137","","","","","","1.023","","","","has coordinates,has disorder","179118","2020-10-21","18:00:00",""
"4308060","15.549","0.004","10.768","0.003","7.659","0.002","90","","93.119","0.005","90","","1280.5","0.6","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","deoxyanisoin","","","- C16 H16 O3 -","- C16 H16 O3 -","- C64 H64 O12 -","4","1","","Kuppuswamy Arumugam; James E. Bollinger; Mark Fink; James P. Donahue","Preparation and Isolation of Dithiolene Thiophosphoryl Molecules as Stable, Protected Forms of Dithiolene Ligands","Inorganic Chemistry","2007","46","","3283","3288","10.1021/ic0700203","","","0.71073","MoKα","","0.0664","0.0528","","","0.1394","0.1463","","","","","","1.005","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308061","7.185","0.0002","5.7981","0.0002","18.1675","0.0006","90","","92.248","0.002","90","","756.26","0.04","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- Eu2 F K5 O13 Si4 -","- Eu2 F K5 O13 Si4 -","- Eu4 F2 K10 O26 Si8 -","2","0.5","","Pei-Yun Chiang; Tsai-Wei Lin; Jian-Hung Dai; Bor-Chen Chang; Kwang-Hwa Lii","Flux Synthesis, Crystal Structure, and Luminescence Properties of a New Europium Fluoride-Silicate: K5Eu2FSi4O13","Inorganic Chemistry","2007","46","","3619","3622","10.1021/ic0700304","","","0.71073","MoKα","","0.0318","0.0256","","","0.0593","0.0662","","","","","","1.057","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308062","12.4914","0.0003","16.8849","0.0003","10.2275","0.0002","90","","90","","90","","2157.14","0.08","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- In3 K5 O21 Si7 -","- In3 K5 O21 Si7 -","- In12 K20 O84 Si28 -","4","1","","Ling-I Hung; Sue-Lein Wang; Hsien-Ming Kao; Kwang-Hwa Lii","Flux Synthesis, Crystal Structures, and Solid-State NMR Spectroscopy of Two Indium Silicates Containing Varied In-O Coordination Geometries","Inorganic Chemistry","2007","46","","3301","3305","10.1021/ic0700349","","","0.71073","MoKα","","0.0195","0.0188","","","0.0481","0.0484","","","","","","0.702","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308063","8.4041","0.0003","11.4919","0.0004","10.4841","0.0003","90","","90.478","0.002","90","","1012.51","0.06","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- In2 K4 O21 Si8 -","- In2 K4 O21 Si8 -","- In4 K8 O42 Si16 -","2","0.5","","Ling-I Hung; Sue-Lein Wang; Hsien-Ming Kao; Kwang-Hwa Lii","Flux Synthesis, Crystal Structures, and Solid-State NMR Spectroscopy of Two Indium Silicates Containing Varied In-O Coordination Geometries","Inorganic Chemistry","2007","46","","3301","3305","10.1021/ic0700349","","","0.71073","MoKα","","0.0222","0.0191","","","0.0498","0.0503","","","","","","1.024","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308064","12.331","0.014","18.87","0.02","12.398","0.014","90","","98.32","0.016","90","","2854","5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H22 B F15 N P -","- C27 H22 B F15 N P -","- C108 H88 B4 F60 N4 P4 -","4","1","","Silke Courtenay; Denise Walsh; Sarah Hawkeswood; Pingrong Wei; Anjan Kumar Das; Douglas W. Stephan","Boron and Aluminum Complexes of Sterically Demanding Phosphinimines and Phosphinimides","Inorganic Chemistry","2007","46","","3623","3631","10.1021/ic0700351","","","0.71073","MoKα","","0.1473","0.0635","","","0.1378","0.1854","","","","","","1.082","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308065","11.384","0.018","12.84","0.02","21.46","0.04","90","","91.77","0.04","90","","3135","9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 B F15 N P -","- C30 H28 B F15 N P -","- C120 H112 B4 F60 N4 P4 -","4","1","","Silke Courtenay; Denise Walsh; Sarah Hawkeswood; Pingrong Wei; Anjan Kumar Das; Douglas W. Stephan","Boron and Aluminum Complexes of Sterically Demanding Phosphinimines and Phosphinimides","Inorganic Chemistry","2007","46","","3623","3631","10.1021/ic0700351","","","0.71073","MoKα","","0.0671","0.0499","","","0.1234","0.1344","","","","","","0.979","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308066","8.212","0.005","8.397","0.005","11.678","0.006","84.132","0.012","85.683","0.01","85.338","0.01","796.6","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H31 B N P -","- C12 H31 B N P -","- C24 H62 B2 N2 P2 -","2","1","","Silke Courtenay; Denise Walsh; Sarah Hawkeswood; Pingrong Wei; Anjan Kumar Das; Douglas W. Stephan","Boron and Aluminum Complexes of Sterically Demanding Phosphinimines and Phosphinimides","Inorganic Chemistry","2007","46","","3623","3631","10.1021/ic0700351","","","0.71073","MoKα","","0.0733","0.0551","","","0.1516","0.1623","","","","","","1.013","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308067","14.486","0.004","14.486","0.004","14.486","0.004","90","","90","","90","","3039.8","1.5","293","2","293","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","","","- C24 H58 Al2 N2 P2 -","- C24 H58.02 Al1.98 N2 P2 -","- C96 H232.08 Al7.92 N8 P8 -","4","0.166667","","Silke Courtenay; Denise Walsh; Sarah Hawkeswood; Pingrong Wei; Anjan Kumar Das; Douglas W. Stephan","Boron and Aluminum Complexes of Sterically Demanding Phosphinimines and Phosphinimides","Inorganic Chemistry","2007","46","","3623","3631","10.1021/ic0700351","","","0.71073","MoKα","","0.0633","0.0482","","","0.1423","0.1527","","","","","","1.058","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308068","13.64","0.008","17.599","0.01","19.094","0.011","112.843","0.011","108.234","0.012","90.847","0.012","3963","4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C26 H56 Al2 F6 N2 O6 P2 S2 -","- C26 H56 Al2 F6 N2 O6 P2 S2 -","- C104 H224 Al8 F24 N8 O24 P8 S8 -","4","2","","Silke Courtenay; Denise Walsh; Sarah Hawkeswood; Pingrong Wei; Anjan Kumar Das; Douglas W. Stephan","Boron and Aluminum Complexes of Sterically Demanding Phosphinimines and Phosphinimides","Inorganic Chemistry","2007","46","","3623","3631","10.1021/ic0700351","","","0.71073","MoKα","","0.1631","0.0695","","","0.1662","0.195","","","","","","0.855","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308069","14.298","0.004","14.298","0.004","14.298","0.004","90","","90","","90","","2923","1.4","293","2","293","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","","","- C24 H54 B2 F4 N2 P2 -","- C24 H54 B1.98 F4.02 N2 P2 -","- C96 H216 B7.92 F16.08 N8 P8 -","4","0.166667","","Silke Courtenay; Denise Walsh; Sarah Hawkeswood; Pingrong Wei; Anjan Kumar Das; Douglas W. Stephan","Boron and Aluminum Complexes of Sterically Demanding Phosphinimines and Phosphinimides","Inorganic Chemistry","2007","46","","3623","3631","10.1021/ic0700351","","","0.71073","MoKα","","0.0802","0.0588","","","0.1571","0.1757","","","","","","1.047","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308070","21.6195","0.0013","21.6195","0.0013","9.6282","0.0008","90","","90","","120","","3897.3","0.5","173","2","173","2","","","","","","","","5","P -3 m 1","-P 3 2""","164","","","","- C22 H20 N2 O8 Zn2 -","- C22 H8 N2 O8 Zn2 -","- C66 H24 N6 O24 Zn6 -","3","0.25","","Hyungphil Chun; Jumi Moon","Discovery, Synthesis, and Characterization of an Isomeric Coordination Polymer with Pillared Kagome Net Topology","Inorganic Chemistry","2007","46","","4371","4373","10.1021/ic070036t","","","0.71073","MoKα","","0.07","0.052","","","0.179","0.197","","","","","","1.159","","","","has coordinates,has disorder","179118","2020-10-21","18:00:00",""
"4308071","15.912","0.003","9.4974","0.0019","17.184","0.003","90","","90","","90","","2596.9","0.8","293","2","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Ba2 Ca2 Sn6 -","- Ba2 Ca2 Sn6 -","- Ba16 Ca16 Sn48 -","8","","","Ming-Hui Ge; John D. Corbett","M2Ba2Sn6 (M =Yb, Ca): Metallic Zintl Phases with a Novel Tin Chain Substructure","Inorganic Chemistry","2007","46","","4138","4144","10.1021/ic070042p","","","0.71073","MoKα","","0.0384","0.0285","","","0.0525","0.0549","","","","","","1.027","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308072","15.871","0.003","9.387","0.0019","17.212","0.003","90","","90","","90","","2564.3","0.8","293","2","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Ba2 Sn6 Yb2 -","- Ba2 Sn6 Yb2 -","- Ba16 Sn48 Yb16 -","8","","","Ming-Hui Ge; John D. Corbett","M2Ba2Sn6 (M =Yb, Ca): Metallic Zintl Phases with a Novel Tin Chain Substructure","Inorganic Chemistry","2007","46","","4138","4144","10.1021/ic070042p","","","0.71073","MoKα","","0.0332","0.0307","","","0.077","0.0784","","","","","","1.095","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308073","19.828","0.0005","7.513","0.0002","10.73","0.0003","90","","103.44","0.002","90","","1554.65","0.07","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H5 Co O5.5 S -","- C6 H5 Co O5.5 S -","- C48 H40 Co8 O44 S8 -","8","1","","Aude Demessence; Guillaume Rogez; Richard Welter; Pierre Rabu","Structure and Magnetic Properties of a New Cobalt(II) Thiophenedicarboxylate Coordination Polymer Showing Unprecedented Coordination","Inorganic Chemistry","2007","46","","3423","3425","10.1021/ic070046u","","","0.7107","MoKα","","0.0313","0.0258","","","0.0625","0.0649","","","","","","1.086","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308074","11.986813","0.000005","11.986813","","11.986813","","90","","90","","90","","1722.31","0.0007","","","","","","","","","","","","3","I -4 3 d","I -4bd 2c 3","220","","","","- Al7 Ca6 O16.52 -","- Al7 Ca6 O16.5208 -","- Al28 Ca24 O66.0832 -","4","0.0833333","","Luis Palacios; Ángeles G. De La Torre; Sebastián Bruque; Jose L. García-Muñoz; Santiago García-Granda; Denis Sheptyakov; Miguel A. G. Aranda","Crystal Structures and in-Situ Formation Study of Mayenite Electrides","Inorganic Chemistry","2007","46","","4167","4176","10.1021/ic0700497","powder diffraction","","","","","","","","","","","","","0.58","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308075","8.69417","0.0002","8.09299","0.00019","15.20965","0.00032","90","","90.1665","0.0019","90","","1070.17","0.04","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- Al2 Ca O4 -","- Al2 Ca O4 -","- Al24 Ca12 O48 -","12","3","","Luis Palacios; Ángeles G. De La Torre; Sebastián Bruque; Jose L. García-Muñoz; Santiago García-Granda; Denis Sheptyakov; Miguel A. G. Aranda","Crystal Structures and in-Situ Formation Study of Mayenite Electrides","Inorganic Chemistry","2007","46","","4167","4176","10.1021/ic0700497","powder diffraction","","","","","","","","","","","","","0.58","","","","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308076","11.992147","0.000004","11.992147","","11.992147","","90","","90","","90","","1724.61","0.0006","","","","","","","","","","","","3","I -4 3 d","I -4bd 2c 3","220","","","","- Al7 Ca6 O16.27 -","- Al7 Ca6 O16.2676 -","- Al28 Ca24 O65.0704 -","4","0.0833333","","Luis Palacios; Ángeles G. De La Torre; Sebastián Bruque; Jose L. García-Muñoz; Santiago García-Granda; Denis Sheptyakov; Miguel A. G. Aranda","Crystal Structures and in-Situ Formation Study of Mayenite Electrides","Inorganic Chemistry","2007","46","","4167","4176","10.1021/ic0700497","powder diffraction","","","","","","","","","","","","","0.78","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308077","11.9904","0.0003","11.9904","0.0003","11.9904","0.0003","90","","90","","90","","1723.86","0.07","293","2","293","2","","","","","","","","3","I -4 3 d","I -4bd 2c 3","220","Mayenite","","","- Al14 Ca12 O33 -","- Al14 Ca12 O32.912 -","- Al28 Ca24 O65.824 -","2","0.0416667","","Luis Palacios; Ángeles G. De La Torre; Sebastián Bruque; Jose L. García-Muñoz; Santiago García-Granda; Denis Sheptyakov; Miguel A. G. Aranda","Crystal Structures and in-Situ Formation Study of Mayenite Electrides","Inorganic Chemistry","2007","46","","4167","4176","10.1021/ic0700497","","","0.71073","MoKα","","0.037","0.0313","","","0.0786","0.0813","","","","","","1.118","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308078","11.9824","0.0005","11.9824","0.0005","11.9824","0.0005","90","","90","","90","","1720.41","0.12","293","2","293","2","","","","","","","","3","I -4 3 d","I -4bd 2c 3","220","Mayenite","","","- Al14 Ca12 O33 -","- Al14 Ca12 O32.888 -","- Al28 Ca24 O65.776 -","2","0.0416667","","Luis Palacios; Ángeles G. De La Torre; Sebastián Bruque; Jose L. García-Muñoz; Santiago García-Granda; Denis Sheptyakov; Miguel A. G. Aranda","Crystal Structures and in-Situ Formation Study of Mayenite Electrides","Inorganic Chemistry","2007","46","","4167","4176","10.1021/ic0700497","","","0.71073","MoKα","","0.0423","0.042","","","0.1175","0.118","","","","","","1.019","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308079","18.786","0.004","16.768","0.003","12.803","0.003","90","","100.02","0.03","90","","3971.5","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C79 H55 N9 O22 Zn4 -","- C79 H47 N9 O22 Zn4 -","- C158 H94 N18 O44 Zn8 -","2","0.25","","Dong-Rong Xiao; Yang-Guang Li; En-Bo Wang; Lin-Lin Fan; Hai-Yan An; Zhong-Min Su; Lin Xu","Exceptional Self-Penetrating Networks Containing Unprecedented Quintuple-Stranded Molecular Braid, 9-Fold Meso Helices, and 17-Fold Interwoven Helices","Inorganic Chemistry","2007","46","","4158","4166","10.1021/ic070054a","","","0.71073","MoKα","","0.1567","0.0767","","","0.1413","0.1697","","","","","","1.144","","","","has coordinates,has disorder","179118","2020-10-21","18:00:00",""
"4308080","19.144","0.004","9.934","0.002","21.129","0.004","90","","100.9","0.03","90","","3945.7","1.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H32 Cd2 N2 O16 S2 -","- C38 H32 Cd2 N2 O16 S2 -","- C152 H128 Cd8 N8 O64 S8 -","4","0.5","","Dong-Rong Xiao; Yang-Guang Li; En-Bo Wang; Lin-Lin Fan; Hai-Yan An; Zhong-Min Su; Lin Xu","Exceptional Self-Penetrating Networks Containing Unprecedented Quintuple-Stranded Molecular Braid, 9-Fold Meso Helices, and 17-Fold Interwoven Helices","Inorganic Chemistry","2007","46","","4158","4166","10.1021/ic070054a","","","0.71073","MoKα","","0.028","0.0239","","","0.0688","0.0709","","","","","","1.077","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308081","10.1638","0.0004","11.0421","0.0004","12.52","0.0004","85.461","0.002","85.529","0.002","76.41","0.002","1358.93","0.09","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- Br20 Mo6 Se14 Te4 -","- Br20 Mo6 Se14 Te4 -","- Br20 Mo6 Se14 Te4 -","1","0.5","","Maxim N. Sokolov; Artem L. Gushchin; Pavel A. Abramov; Alexander V. Virovets; Eugenia V. Peresypkina; Vladimir P. Fedin","Synthesis and Structures of Mo3Se7Te2Br10, Mo3Se7TeI6, and Mo6Te21I22 Containing TeX3- (X = Br, I) Ligands Coordinated to a Triangular Cluster Core","Inorganic Chemistry","2007","46","","4677","4682","10.1021/ic0700553","","","0.71073","MoKα","","0.0732","0.042","","","0.1022","0.1176","","","","","","1.023","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308082","10.4969","0.0017","13.029","0.002","16.567","0.002","90","","102.921","0.005","90","","2208.4","0.6","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- I6 Mo3 Se7 Te -","- I6 Mo3 Se7 Te -","- I24 Mo12 Se28 Te4 -","4","1","","Maxim N. Sokolov; Artem L. Gushchin; Pavel A. Abramov; Alexander V. Virovets; Eugenia V. Peresypkina; Vladimir P. Fedin","Synthesis and Structures of Mo3Se7Te2Br10, Mo3Se7TeI6, and Mo6Te21I22 Containing TeX3- (X = Br, I) Ligands Coordinated to a Triangular Cluster Core","Inorganic Chemistry","2007","46","","4677","4682","10.1021/ic0700553","","","0.71073","MoKα","","0.1419","0.0643","","","0.1445","0.1804","","","","","","1.015","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308083","11.2148","0.0006","11.655","0.0006","16.6798","0.0013","92.124","0.003","102.223","0.002","117.427","0.002","1868.4","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- I22 Mo6 Te21 -","- I22 Mo6 Te21 -","- I22 Mo6 Te21 -","1","0.5","","Maxim N. Sokolov; Artem L. Gushchin; Pavel A. Abramov; Alexander V. Virovets; Eugenia V. Peresypkina; Vladimir P. Fedin","Synthesis and Structures of Mo3Se7Te2Br10, Mo3Se7TeI6, and Mo6Te21I22 Containing TeX3- (X = Br, I) Ligands Coordinated to a Triangular Cluster Core","Inorganic Chemistry","2007","46","","4677","4682","10.1021/ic0700553","","","0.71073","MoKα","","0.096","0.0463","","","0.0954","0.1144","","","","","","1.012","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308084","10.3798","0.0007","9.3934","0.0007","13.8051","0.001","90","","90","","90","","1346.02","0.17","291","2","291","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","hydrated dipotassium gallium pentaborate","","- B5 Ga H8 K2 O14 -","- B5 Ga H8 K2 O14 -","- B20 Ga4 H32 K8 O56 -","4","0.5","","Zhi-Hong Liu; Ping Yang; Ping Li","K2[Ga(B5O10)].4H2O: The First Chiral Zeolite-like Galloborate with Large Odd 11-Ring Channels","Inorganic Chemistry","2007","46","","2965","2967","10.1021/ic070056v","","","0.71073","MoKα","","0.0211","0.021","","","0.0555","0.0556","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308085","11.992","0.002","17.992","0.003","11.908","0.002","90","","114.19","0.03","90","","2343.7","0.9","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H52 Cl2 Cu3 N8 O6 -","- C42 H52 Cl2 Cu3 N8 O6 -","- C84 H104 Cl4 Cu6 N16 O12 -","2","0.5","","Yu-Fei Song; Gerard A. van Albada; Jinkui Tang; Ilpo Mutikainen; Urho Turpeinen; Chiara Massera; Olivier Roubeau; José Sanchez Costa; Patrick Gamez; Jan Reedijk","Controlled Copper-Mediated Chlorination of Phenol Rings under Mild Conditions","Inorganic Chemistry","2007","46","","4944","4950","10.1021/ic070057n","","","0.71073","MoKα","","0.0696","0.0384","","","0.0817","0.0906","","","","","","1.041","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308086","20.824","0.001","12.187","0.001","18.739","0.001","90","0.005","118.415","0.001","90","0.005","4182.7","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H39 Cl8 Cu4 N5 O6 -","- C36 H37 Cl8 Cu4 N5 O6 -","- C144 H148 Cl32 Cu16 N20 O24 -","4","0.5","","Yu-Fei Song; Gerard A. van Albada; Jinkui Tang; Ilpo Mutikainen; Urho Turpeinen; Chiara Massera; Olivier Roubeau; José Sanchez Costa; Patrick Gamez; Jan Reedijk","Controlled Copper-Mediated Chlorination of Phenol Rings under Mild Conditions","Inorganic Chemistry","2007","46","","4944","4950","10.1021/ic070057n","","","0.71069","MoKα","","0.0992","0.0589","","","0.1631","0.182","","","","","","1.004","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308087","10.89","0.0005","15.6607","0.0006","19.397","0.001","90","","98.309","0.004","90","","3273.3","0.3","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C27 H28 Cl2 F6 Fe N4 O6 S2 -","- C26.999 H27.998 Cl1.998 F6 Fe N4 O6 S2 -","- C107.996 H111.992 Cl7.992 F24 Fe4 N16 O24 S8 -","4","1","","Jason England; George J. P. Britovsek; Nitin Rabadia; Andrew J. P. White","Ligand Topology Variations and the Importance of Ligand Field Strength in Non-Heme Iron Catalyzed Oxidations of Alkanes","Inorganic Chemistry","2007","46","","3752","3767","10.1021/ic070062r","","","0.71073","MoKα","","0.0893","0.0853","","","0.2176","0.2217","","","","","","1.152","","","","has coordinates,has disorder","179118","2020-10-21","18:00:00",""
"4308088","9.5484","0.0003","13.5201","0.0004","21.4401","0.0007","90","","90","","90","","2767.82","0.15","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C24 H22 F6 Fe N4 O6 S2 -","- C24 H22 F6 Fe N4 O6 S2 -","- C96 H88 F24 Fe4 N16 O24 S8 -","4","1","","Jason England; George J. P. Britovsek; Nitin Rabadia; Andrew J. P. White","Ligand Topology Variations and the Importance of Ligand Field Strength in Non-Heme Iron Catalyzed Oxidations of Alkanes","Inorganic Chemistry","2007","46","","3752","3767","10.1021/ic070062r","","","0.71073","MoKα","","0.0399","0.0386","","","0.084","0.0849","","","","","","1.087","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308089","9.614","0.0004","16.817","0.0007","19.3532","0.0007","73.806","0.003","78.501","0.003","80.9","0.003","2927","0.2","203","2","203","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H24 F6 Fe N4 O6 S2 -","- C25 H24 F6 Fe N4 O6 S2 -","- C100 H96 F24 Fe4 N16 O24 S8 -","4","2","","Jason England; George J. P. Britovsek; Nitin Rabadia; Andrew J. P. White","Ligand Topology Variations and the Importance of Ligand Field Strength in Non-Heme Iron Catalyzed Oxidations of Alkanes","Inorganic Chemistry","2007","46","","3752","3767","10.1021/ic070062r","","","0.71073","MoKα","","0.0774","0.0463","","","0.1153","0.1297","","","","","","0.953","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308090","13.005","0.003","22.68","0.005","19.89","0.004","90","","104.57","0.03","90","","5678","2","288","2","288","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C43 H81 Mo6 N3 O18 -","- C43 H81 Mo6 N3 O18 -","- C172 H324 Mo24 N12 O72 -","4","1","","Jian Hao; Laurent Ruhlmann; Yulin Zhu; Qiang Li; Yongge Wei","Naphthylimido-Substituted Hexamolybdate: Preparation, Crystal Structures, Solvent Effects, and Optical Properties of Three Polymorphs","Inorganic Chemistry","2007","46","","4960","4967","10.1021/ic070064b","","","0.71073","MoKα","","0.0641","0.0403","","","0.0698","0.0774","","","","","","0.852","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308091","12.957","0.003","20.993","0.004","20.87","0.004","90","","95.27","0.03","90","","5653","2","288","2","288","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H81 Mo6 N3 O18 -","- C42.996 H81 Mo6 N3 O18 -","- C171.984 H324 Mo24 N12 O72 -","4","1","","Jian Hao; Laurent Ruhlmann; Yulin Zhu; Qiang Li; Yongge Wei","Naphthylimido-Substituted Hexamolybdate: Preparation, Crystal Structures, Solvent Effects, and Optical Properties of Three Polymorphs","Inorganic Chemistry","2007","46","","4960","4967","10.1021/ic070064b","","","0.71073","MoKα","","0.0463","0.0309","","","0.072","0.0781","","","","","","1.037","","","","has coordinates,has disorder","179118","2020-10-21","18:00:00",""
"4308092","11.48","0.002","12.391","0.003","21.288","0.004","76.6","0.03","77.37","0.03","89.91","0.03","2870.6","1.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H81 Mo6 N3 O18 -","- C43 H81 Mo6 N3 O18 -","- C86 H162 Mo12 N6 O36 -","2","1","","Jian Hao; Laurent Ruhlmann; Yulin Zhu; Qiang Li; Yongge Wei","Naphthylimido-Substituted Hexamolybdate: Preparation, Crystal Structures, Solvent Effects, and Optical Properties of Three Polymorphs","Inorganic Chemistry","2007","46","","4960","4967","10.1021/ic070064b","","","0.71073","MoKα","","0.037","0.0317","","","0.0751","0.077","","","","","","1.053","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308093","7.4832","0.0015","10.528","0.002","8.8525","0.0018","90","","90","","90","","697.4","0.2","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Al2 B3 H O8 -","- Al2 B3 H O8 -","- Al8 B12 H4 O32 -","4","0.5","","Tao Yang; Jing Ju; Guobao Li; Fuhui Liao; Xiaodong Zou; Feng Deng; Lei Chen; Yingxia Wang; Jianhua Lin","Square-Pyramidal/Triangular Framework Oxide: Synthesis and Structure of PKU-6","Inorganic Chemistry","2007","46","","4772","4774","10.1021/ic070073k","","","0.71073","MoKα","","0.0348","0.0311","","","0.1342","0.1373","","","","","","1.227","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308094","4.2419","0.0003","4.2419","0.0003","6.8559","0.0005","90","","90","","90","","123.363","0.015","","","293","","","","","","","","","3","P 4/m m m","-P 4 2","123","","","","- Co Ga5 Sm -","- Co0.024 Ga0.248 Sm0.027 -","- Co0.024 Ga0.248 Sm0.027 -","1","0.0625","","YongZhong Jia; Claude Belin; Monique Tillard; Laurence Lacroix-Orio; David Zitoun; GuoHua Feng","Three Novel Phases in the Sm-Co-Ga System. Syntheses, Crystal and Electronic Structures, and Electrical and Magnetic Properties","Inorganic Chemistry","2007","46","","4177","4186","10.1021/ic0700755","powder diffraction","x-ray","","CuKα","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308095","4.1246","0.0006","15.608","0.002","6.4556","0.0009","90","","90","","90","","415.59","0.1","293","2","293","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Co Ga4 Sm -","- Co Ga4 Sm -","- Co4 Ga16 Sm4 -","4","0.25","","YongZhong Jia; Claude Belin; Monique Tillard; Laurence Lacroix-Orio; David Zitoun; GuoHua Feng","Three Novel Phases in the Sm-Co-Ga System. Syntheses, Crystal and Electronic Structures, and Electrical and Magnetic Properties","Inorganic Chemistry","2007","46","","4177","4186","10.1021/ic0700755","","","0.71073","MoKα","","0.0352","0.0269","","","0.0562","0.058","","","","","","1.203","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308096","6.062","0.0005","6.062","0.0005","11.1495","0.0009","90","","90","","90","","409.72","0.06","293","2","293","2","","","","","","","","3","P 4/m m m","-P 4 2","123","","","","- Co3 Ga16 Sm4 -","- Co3 Ga16 Sm4 -","- Co3 Ga16 Sm4 -","1","0.0625","","YongZhong Jia; Claude Belin; Monique Tillard; Laurence Lacroix-Orio; David Zitoun; GuoHua Feng","Three Novel Phases in the Sm-Co-Ga System. Syntheses, Crystal and Electronic Structures, and Electrical and Magnetic Properties","Inorganic Chemistry","2007","46","","4177","4186","10.1021/ic0700755","","","0.71073","MoKα","","0.0273","0.0262","","","0.0626","0.063","","","","","","1.328","","","","has coordinates","179118","2020-10-21","18:00:00",""
"4308097","10.07","0.003","4.234","0.001","10.866","0.003","90","","90","","90","","463.3","0.2","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Ba Al2 Si2","","","- Al2 Ba Si2 -","- Al2 Ba Si2 -","- Al8 Ba4 Si8 -","4","0.5","","Cathie L. Condron; Håkon Hope; Paula M. B. Piccoli; Arthur J. Schultz; Susan M. Kauzlarich","Synthesis, Structure, and Properties of BaAl2Si2","Inorganic Chemistry","2007","46","","4523","4529","10.1021/ic070078h","","neutron","","neutronwhite-beam","","0.0597","0.0529","","","0.112","0.1155","","","","","","1.033","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4308098","10.0807","0.0005","4.2274","0.0002","10.8742","0.0005","90","","90","","90","","463.41","0.04","90","2","90","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Ba Al2 Si2","","","- Al2 Ba Si2 -","- Al2 Ba Si2 -","- Al8 Ba4 Si8 -","4","0.5","","Cathie L. Condron; Håkon Hope; Paula M. B. Piccoli; Arthur J. Schultz; Susan M. Kauzlarich","Synthesis, Structure, and Properties of BaAl2Si2","Inorganic Chemistry","2007","46","","4523","4529","10.1021/ic070078h","","","0.71073","MoKα","","0.0143","0.0137","","","0.0373","0.0382","","","","","","1.055","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4308099","10.0736","0.0009","4.2255","0.0004","10.8653","0.0009","90","","90","","90","","462.49","0.07","","","10","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Ba Al2 Si2","","","- Al2 Ba Si2 -","- Al2 Ba Si2 -","- Al8 Ba4 Si8 -","4","0.5","","Cathie L. Condron; Håkon Hope; Paula M. B. Piccoli; Arthur J. Schultz; Susan M. Kauzlarich","Synthesis, Structure, and Properties of BaAl2Si2","Inorganic Chemistry","2007","46","","4523","4529","10.1021/ic070078h","","","0.71073","MoKα","","0.0145","0.0126","","","0.0255","0.0267","","","","","","1.169","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4308100","13.1711","0.0003","14.7432","0.0007","17.24","0.0007","90","","93.042","0.002","90","","3343","0.2","183","2","183","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C28 H33 Cl Cu N8 O8 S Zn -","- C28 H33 Cl Cu N8 O8 S Zn -","- C112 H132 Cl4 Cu4 N32 O32 S4 Zn4 -","4","1","","Arne Roth; Eike T. Spielberg; Winfried Plass","Kit for Unsymmetric Dinucleating Double-Schiff-Base Ligands: Facile Access to a Versatile New Ligand System and Its First Heterobimetallic Copper-Zinc Complex","Inorganic Chemistry","2007","46","","4362","4364","10.1021/ic070088i","","","0.71073","MoKα","","0.0874","0.0549","","","0.1316","0.1452","","","","","","1.045","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308101","10.397","0.0008","12.4925","0.0012","13.2344","0.001","81.333","0.002","70.966","0.001","65.525","0.001","1478.7","0.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H32 F6 Fe N6 O6 S2 -","- C21 H32 F6 Fe N6 O6 S2 -","- C42 H64 F12 Fe2 N12 O12 S4 -","2","1","","Sonia Taktak; Wanhua Ye; Aida M. Herrera; Elena V. Rybak-Akimova","Synthesis and Catalytic Properties in Olefin Epoxidation of Novel Iron(II) Complexes with Pyridine-Containing Macrocycles Bearing an Aminopropyl Pendant Arm","Inorganic Chemistry","2007","46","","2929","2942","10.1021/ic070094e","","","0.71073","MoKα","","0.0723","0.0566","","","0.1577","0.1735","","","","","","1.15","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308102","8.7638","0.0013","8.9187","0.0013","19.95","0.003","93.991","0.003","96.393","0.003","115.802","0.002","1382.9","0.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H33 F6 Fe N5 O6 S2 -","- C20 H33 F6 Fe N5 O6 S2 -","- C40 H66 F12 Fe2 N10 O12 S4 -","2","1","","Sonia Taktak; Wanhua Ye; Aida M. Herrera; Elena V. Rybak-Akimova","Synthesis and Catalytic Properties in Olefin Epoxidation of Novel Iron(II) Complexes with Pyridine-Containing Macrocycles Bearing an Aminopropyl Pendant Arm","Inorganic Chemistry","2007","46","","2929","2942","10.1021/ic070094e","","","0.71073","MoKα","","0.0815","0.0489","","","0.1186","0.1384","","","","","","0.983","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308103","16.485","0.002","8.8459","0.0011","17.364","0.003","90","","98.145","0.003","90","","2506.6","0.6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H33 Cl2 Fe N5 O8 -","- C18 H33 Cl2 Fe N5 O8 -","- C72 H132 Cl8 Fe4 N20 O32 -","4","1","","Sonia Taktak; Wanhua Ye; Aida M. Herrera; Elena V. Rybak-Akimova","Synthesis and Catalytic Properties in Olefin Epoxidation of Novel Iron(II) Complexes with Pyridine-Containing Macrocycles Bearing an Aminopropyl Pendant Arm","Inorganic Chemistry","2007","46","","2929","2942","10.1021/ic070094e","","","0.71073","MoKα","","0.2191","0.0912","","","0.2302","0.2784","","","","","","0.731","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308104","25.9723","0.0006","25.9723","0.0006","25.9723","0.0006","90","","90","","90","","17519.9","0.7","293","2","293","2","","","","","","","","5","F d -3 c :2","-F 4ud 2vw 3","228","","","","- C12 H21 Co1.5 O19.5 Sm -","- C12 H18 Co1.5 O19.5 Sm -","- C384 H576 Co48 O624 Sm32 -","32","0.166667","","Ying Wang; Peng Cheng; Jun Chen; Dai-Zheng Liao; Shi-Ping Yan","A Heterometallic Porous Material for Hydrogen Adsorption","Inorganic Chemistry","2007","46","","4530","4534","10.1021/ic070097r","","","0.71073","MoKα","","0.0573","0.0316","","","0.0741","0.0982","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308105","14.8127","0.0014","14.8127","0.0014","15.613","0.003","90","","90","","120","","2966.8","0.7","294","2","294","2","","","","","","","","5","P 6/m c c","-P 6 2c","192","","","","- C12 H19.5 O18.75 Sm Zn1.5 -","- C12 H18 O18.72 Sm Zn1.5 -","- C48 H72 O74.88 Sm4 Zn6 -","4","0.166667","","Ying Wang; Peng Cheng; Jun Chen; Dai-Zheng Liao; Shi-Ping Yan","A Heterometallic Porous Material for Hydrogen Adsorption","Inorganic Chemistry","2007","46","","4530","4534","10.1021/ic070097r","","","0.71073","MoKα","","0.0581","0.0408","","","0.1273","0.1476","","","","","","1.149","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4308106","8.919","0.002","19.849","0.004","20.229","0.004","90","","90","","90","","3581.2","1.3","120","2","120","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","6-(alpha-picolylamino)-7,12-dihydroindolo[3,2-d][1]benzazepine","","- C22 H18 N4 -","- C22 H18 N4 -","- C176 H144 N32 -","8","1","","Wolfgang F. Schmid; Stefanie Zorbas-Seifried; Roland O. John; Vladimir B. Arion; Michael A. Jakupec; Alexander Roller; Markus Galanski; Ion Chiorescu; Haralabos Zorbas; Bernhard K. Keppler","The First Ruthenium-Based Paullones: Syntheses, X-ray Diffraction Structures, and Spectroscopic and Antiproliferative Properties in Vitro","Inorganic Chemistry","2007","46","","3645","3656","10.1021/ic070098j","","","0.71073","MoKα","","0.0603","0.0419","","","0.1027","0.1118","","","","","","1.015","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308107","12.4094","0.0003","12.8933","0.0003","18.5633","0.0005","106.807","0.002","92.525","0.002","108.003","0.002","2674.83","0.13","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","(OC-6-43)-Bis(9-bromo-6-(E)-[(alpha-picolyl-kappaN)imino-kappaN]- 7,12-dihydroindolo[3,2-d][1]benzazepine)chloro(dimethyl sulfoxide) ruthenium(II) chloride 2.8ethanol 0.2water","","- C51.6 H55.2 Br2 Cl2 N8 O4 Ru S -","- C51.6 H54.8 Br2 Cl2 N8 O4 Ru S -","- C103.2 H109.6 Br4 Cl4 N16 O8 Ru2 S2 -","2","1","","Wolfgang F. Schmid; Stefanie Zorbas-Seifried; Roland O. John; Vladimir B. Arion; Michael A. Jakupec; Alexander Roller; Markus Galanski; Ion Chiorescu; Haralabos Zorbas; Bernhard K. Keppler","The First Ruthenium-Based Paullones: Syntheses, X-ray Diffraction Structures, and Spectroscopic and Antiproliferative Properties in Vitro","Inorganic Chemistry","2007","46","","3645","3656","10.1021/ic070098j","","","0.71073","MoKα","","0.0644","0.0454","","","0.131","0.1389","","","","","","1.112","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4308108","11.0629","0.0005","19.584","0.0009","8.693","0.0005","90","","94.466","0.003","90","","1877.67","0.16","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-Bromo-6-(alpha-picolylamino)-7,12-dihydroindolo[3,2-d][1]benzazepine","","- C22 H17 Br N4 -","- C22 H17 Br N4 -","- C88 H68 Br4 N16 -","4","1","","Wolfgang F. Schmid; Stefanie Zorbas-Seifried; Roland O. John; Vladimir B. Arion; Michael A. Jakupec; Alexander Roller; Markus Galanski; Ion Chiorescu; Haralabos Zorbas; Bernhard K. Keppler","The First Ruthenium-Based Paullones: Syntheses, X-ray Diffraction Structures, and Spectroscopic and Antiproliferative Properties in Vitro","Inorganic Chemistry","2007","46","","3645","3656","10.1021/ic070098j","","","0.71073","MoKα","","0.058","0.0318","","","0.0711","0.0807","","","","","","1.011","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308109","15.366","0.003","7.5306","0.0015","29.65","0.006","90","","104.11","0.03","90","","3327.4","1.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(OC-6-14)-Dichlorobis(dimethyl sulfoxide)(6-(E)-[alpha-picolyl- kappaN]-7,12-dihydroindolo[3,2-d][1]benzazepine]ruthenium(II) diethanol solvate","","- C30 H42 Cl2 N4 O4 Ru S2 -","- C30 H42 Cl2 N4 O4 Ru S2 -","- C120 H168 Cl8 N16 O16 Ru4 S8 -","4","1","","Wolfgang F. Schmid; Stefanie Zorbas-Seifried; Roland O. John; Vladimir B. Arion; Michael A. Jakupec; Alexander Roller; Markus Galanski; Ion Chiorescu; Haralabos Zorbas; Bernhard K. Keppler","The First Ruthenium-Based Paullones: Syntheses, X-ray Diffraction Structures, and Spectroscopic and Antiproliferative Properties in Vitro","Inorganic Chemistry","2007","46","","3645","3656","10.1021/ic070098j","","","0.71073","MoKα","","0.0567","0.0347","","","0.0715","0.0795","","","","","","1.022","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308110","10.4123","0.0018","15.53","0.0018","15.9655","0.0019","66.699","0.011","85.856","0.016","78.656","0.015","2324.7","0.6","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C90 H148 N4 Na4 O10 -","- C90 H148 N4 Na4 O10 -","- C90 H148 N4 Na4 O10 -","1","0.5","","Xiaoping Xu; Yingming Yao; Yong Zhang; Qi Shen","Synthesis, Reactivity, and Structural Characterization of Sodium and Ytterbium Complexes Containing New Imidazolidine-Bridged Bis(phenolato) Ligands","Inorganic Chemistry","2007","46","","3743","3751","10.1021/ic0701054","","","0.7107","MoKα","","0.1172","0.0817","","","0.2042","0.2279","","","","","","1.103","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308111","15.9447","0.0017","24.683","0.003","18.6684","0.0019","90","","94.481","0.003","90","","7324.7","1.4","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C62.5 H106 Cl4 N8 O4 P2 Yb2 -","- C62.5 H94 Cl4 N8 O4 P2 Yb2 -","- C250 H376 Cl16 N32 O16 P8 Yb8 -","4","1","","Xiaoping Xu; Yingming Yao; Yong Zhang; Qi Shen","Synthesis, Reactivity, and Structural Characterization of Sodium and Ytterbium Complexes Containing New Imidazolidine-Bridged Bis(phenolato) Ligands","Inorganic Chemistry","2007","46","","3743","3751","10.1021/ic0701054","","","0.7107","MoKα","","0.0891","0.0723","","","0.1732","0.184","","","","","","1.178","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308112","17.4291","0.0011","17.106","0.0011","23.4174","0.0016","90","","91.022","0.002","90","","6980.6","0.8","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C55 H108 Cl2 N8 O7 P2 Yb2 -","- C55 H73 Cl2 N8 O7 P2 Yb2 -","- C220 H292 Cl8 N32 O28 P8 Yb8 -","4","1","","Xiaoping Xu; Yingming Yao; Yong Zhang; Qi Shen","Synthesis, Reactivity, and Structural Characterization of Sodium and Ytterbium Complexes Containing New Imidazolidine-Bridged Bis(phenolato) Ligands","Inorganic Chemistry","2007","46","","3743","3751","10.1021/ic0701054","","","0.7107","MoKα","","0.065","0.0596","","","0.1382","0.1412","","","","","","1.135","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308113","32.547","0.002","18.155","0.0008","16.7632","0.001","90","","90","","90","","9905.2","1","193","2","193","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C42 H82 Cl N6 O4 P2 Yb -","- C42 H82 Cl N6 O4 P2 Yb -","- C336 H656 Cl8 N48 O32 P16 Yb8 -","8","1","","Xiaoping Xu; Yingming Yao; Yong Zhang; Qi Shen","Synthesis, Reactivity, and Structural Characterization of Sodium and Ytterbium Complexes Containing New Imidazolidine-Bridged Bis(phenolato) Ligands","Inorganic Chemistry","2007","46","","3743","3751","10.1021/ic0701054","","","0.7107","MoKα","","0.0506","0.0424","","","0.0792","0.0822","","","","","","1.225","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308114","14.1","0.0005","27.5165","0.0011","54.844","0.002","90","","90","","90","","21278.5","1.4","153","2","153","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C51 H78 N6 O3 P Yb -","- C51 H78 N6 O3 P Yb -","- C816 H1248 N96 O48 P16 Yb16 -","16","2","","Xiaoping Xu; Yingming Yao; Yong Zhang; Qi Shen","Synthesis, Reactivity, and Structural Characterization of Sodium and Ytterbium Complexes Containing New Imidazolidine-Bridged Bis(phenolato) Ligands","Inorganic Chemistry","2007","46","","3743","3751","10.1021/ic0701054","","","0.7107","MoKα","","0.0797","0.0621","","","0.1226","0.1295","","","","","","1.141","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308115","16.5515","0.0013","16.2383","0.0012","20.9858","0.0017","90","","102.783","0.002","90","","5500.5","0.7","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C55 H74 N9 O2 P2 Yb -","- C55 H74 N9 O2 P2 Yb -","- C220 H296 N36 O8 P8 Yb4 -","4","1","","Xiaoping Xu; Yingming Yao; Yong Zhang; Qi Shen","Synthesis, Reactivity, and Structural Characterization of Sodium and Ytterbium Complexes Containing New Imidazolidine-Bridged Bis(phenolato) Ligands","Inorganic Chemistry","2007","46","","3743","3751","10.1021/ic0701054","","","0.7107","MoKα","","0.0368","0.0296","","","0.0664","0.0706","","","","","","1.08","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308116","18.6028","0.0014","26.8523","0.0014","20.8083","0.0013","90","","103.879","0.002","90","","10090.9","1.1","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C99 H101 Fe7 N8 O28 -","- C99 H101 Fe7 N8 O28 -","- C396 H404 Fe28 N32 O112 -","4","0.5","","Rashmi Bagai; Saiti Datta; Amalia Betancur-Rodriguez; Khalil A. Abboud; Stephen Hill; George Christou","Diversity of New Structural Types in Polynuclear Iron Chemistry with a Tridentate N,N,O Ligand","Inorganic Chemistry","2007","46","","4535","4547","10.1021/ic070106w","","","0.71073","MoKα","","0.0704","0.0457","","","0.0899","0.0998","","","","","","1.045","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308117","12.4586","0.0008","13.5495","0.0009","18.69","0.012","70.636","0.002","79.731","0.002","73.099","0.002","2836.2","1.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H70 Fe7 N5 O28 -","- C38 H70 Fe7 N5 O28 -","- C76 H140 Fe14 N10 O56 -","2","1","","Rashmi Bagai; Saiti Datta; Amalia Betancur-Rodriguez; Khalil A. Abboud; Stephen Hill; George Christou","Diversity of New Structural Types in Polynuclear Iron Chemistry with a Tridentate N,N,O Ligand","Inorganic Chemistry","2007","46","","4535","4547","10.1021/ic070106w","","","0.71073","MoKα","","0.0463","0.0353","","","0.0864","0.0927","","","","","","1.015","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308118","12.9769","0.001","14.4142","0.0011","23.9082","0.0018","87.624","0.001","88.562","0.001","66.092","0.001","4084.7","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H112 Fe6 N6 O24 -","- C58 H112 Fe6 N6 O24 -","- C116 H224 Fe12 N12 O48 -","2","1","","Rashmi Bagai; Saiti Datta; Amalia Betancur-Rodriguez; Khalil A. Abboud; Stephen Hill; George Christou","Diversity of New Structural Types in Polynuclear Iron Chemistry with a Tridentate N,N,O Ligand","Inorganic Chemistry","2007","46","","4535","4547","10.1021/ic070106w","","","0.71073","MoKα","","0.0591","0.0415","","","0.1009","0.1102","","","","","","1.026","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308119","12.326","0.0008","25.3961","0.0017","13.14","0.0009","90","","99.149","0.001","90","","4060.9","0.5","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H54 Cl2 Fe3 N13 O7 -","- C25 H54 Cl2 Fe3 N13 O7 -","- C100 H216 Cl8 Fe12 N52 O28 -","4","1","","Rashmi Bagai; Saiti Datta; Amalia Betancur-Rodriguez; Khalil A. Abboud; Stephen Hill; George Christou","Diversity of New Structural Types in Polynuclear Iron Chemistry with a Tridentate N,N,O Ligand","Inorganic Chemistry","2007","46","","4535","4547","10.1021/ic070106w","","","0.71073","MoKα","","0.0546","0.0497","","","0.1023","0.1043","","","","","","1.211","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308120","9.5895","0.0003","13.2032","0.0005","15.7764","0.0006","106.467","0.001","98.786","0.001","94.551","0.001","1877.16","0.12","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H50 Cl2 Cu2 N8 O8 -","- C28 H50 Cl2 Cu2 N8 O8 -","- C56 H100 Cl4 Cu4 N16 O16 -","2","1","","Anna Company; Laura Gómez; Rubén Mas-Ballesté; Ivan V. Korendovych; Xavi Ribas; Albert Poater; Teodor Parella; Xavier Fontrodona; Jordi Benet-Buchholz; Miquel Solà; Que, Jr., Lawrence; Elena V. Rybak-Akimova; Miquel Costas","Fast O2 Binding at Dicopper Complexes Containing Schiff-Base Dinucleating Ligands","Inorganic Chemistry","2007","46","","4997","5012","10.1021/ic0701108","","","0.71073","MoKα","","0.0582","0.04","","","0.0982","0.1048","","","","","","0.949","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308121","16.0444","0.0016","14.7659","0.0014","17.428","0.0017","90","","110.071","0.002","90","","3878.1","0.7","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H51 Cu2 F6 N6 O6 S2 -","- C30 H51 Cu2 F6 N6 O6 S2 -","- C120 H204 Cu8 F24 N24 O24 S8 -","4","1","","Anna Company; Laura Gómez; Rubén Mas-Ballesté; Ivan V. Korendovych; Xavi Ribas; Albert Poater; Teodor Parella; Xavier Fontrodona; Jordi Benet-Buchholz; Miquel Solà; Que, Jr., Lawrence; Elena V. Rybak-Akimova; Miquel Costas","Fast O2 Binding at Dicopper Complexes Containing Schiff-Base Dinucleating Ligands","Inorganic Chemistry","2007","46","","4997","5012","10.1021/ic0701108","","","0.71073","MoKα","","0.0423","0.0328","","","0.0853","0.0887","","","","","","1.062","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308122","14.687","0.006","14.645","0.006","17.054","0.007","90","","102.048","0.006","90","","3587","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H52 Cl2 Cu2 N6 O8 -","- C28 H52 Cl2 Cu2 N6 O8 -","- C112 H208 Cl8 Cu8 N24 O32 -","4","1","","Anna Company; Laura Gómez; Rubén Mas-Ballesté; Ivan V. Korendovych; Xavi Ribas; Albert Poater; Teodor Parella; Xavier Fontrodona; Jordi Benet-Buchholz; Miquel Solà; Que, Jr., Lawrence; Elena V. Rybak-Akimova; Miquel Costas","Fast O2 Binding at Dicopper Complexes Containing Schiff-Base Dinucleating Ligands","Inorganic Chemistry","2007","46","","4997","5012","10.1021/ic0701108","","","0.71073","MoKα","","0.0658","0.0493","","","0.1275","0.1474","","","","","","1.051","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308123","18.108","0.003","18.952","0.003","55.483","0.01","90","","90","","90","","19041","6","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C90 H71 B2 Cu2 F48 N8 O2 -","- C90 H71 B2 Cu2 F48 N8 O2 -","- C720 H568 B16 Cu16 F384 N64 O16 -","8","1","","Anna Company; Laura Gómez; Rubén Mas-Ballesté; Ivan V. Korendovych; Xavi Ribas; Albert Poater; Teodor Parella; Xavier Fontrodona; Jordi Benet-Buchholz; Miquel Solà; Que, Jr., Lawrence; Elena V. Rybak-Akimova; Miquel Costas","Fast O2 Binding at Dicopper Complexes Containing Schiff-Base Dinucleating Ligands","Inorganic Chemistry","2007","46","","4997","5012","10.1021/ic0701108","","","0.71073","MoKα","","0.2574","0.1199","","","0.2909","0.3706","","","","","","1.038","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308124","12.56","0.006","9.927","0.005","26.238","0.007","90","","115.121","0.002","90","","2962","2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C52 H62 Cu4 N8 O15 V4 -","- C52 H62 Cu4 N8 O15 V4 -","- C104 H124 Cu8 N16 O30 V8 -","2","0.5","","Xiaoshu Qu; Lin Xu; Guanggang Gao; Fengyan Li; Yanyan Yang","Unprecedented Eight-Connected Self-catenated Network Based on Heterometallic {Cu4V4O12} Clusters as Nodes","Inorganic Chemistry","2007","46","","4775","4777","10.1021/ic070114c","","","0.71069","MoKα","","0.1057","0.0479","","","0.0963","0.121","","","","","","0.927","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308125","12.56","0.005","9.927","0.005","26.238","0.005","90","","115.121","0.012","90","","2962","2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C52 H62 Cu4 N8 O15 V4 -","- C104 H124 Cu8 N16 O30 V8 -","- C104 H124 Cu8 N16 O30 V8 -","1","0.25","","Xiaoshu Qu; Lin Xu; Guanggang Gao; Fengyan Li; Yanyan Yang","Unprecedented Eight-Connected Self-catenated Network Based on Heterometallic {Cu4V4O12} Clusters as Nodes","Inorganic Chemistry","2007","46","","4775","4777","10.1021/ic070114c","","","0.71069","MoKα","","0.1476","0.0675","","","0.1445","0.1797","","","","","","1.034","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308126","9.576","0.003","12.172","0.003","12.314","0.002","90","","90","","90","","1435.3","0.6","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- Ca2 H18 O17 U -","- Ca2 O17 U -","- Ca8 O68 U4 -","4","0.5","","Karrie-Ann Kubatko; Tori Z. Forbes; Amanda L. Klingensmith; Peter C. Burns","Expanding the Crystal Chemistry of Uranyl Peroxides: Synthesis and Structures of Di- and Triperoxodioxouranium(VI) Complexes","Inorganic Chemistry","2007","46","","3657","3662","10.1021/ic070118h","","","0.71073","MoKα","","0.167","0.0397","","","0.0671","0.0959","","","","","","0.46","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308127","15.078","0.008","6.669","0.004","23.526","0.013","90","","90","","90","","2366","2","293","2","293","2","","","","","","","","4","P c c a","-P 2a 2ac","54","","","","- H16 K6 O21 U2 -","- K6 O21 U2 -","- K24 O84 U8 -","4","0.5","","Karrie-Ann Kubatko; Tori Z. Forbes; Amanda L. Klingensmith; Peter C. Burns","Expanding the Crystal Chemistry of Uranyl Peroxides: Synthesis and Structures of Di- and Triperoxodioxouranium(VI) Complexes","Inorganic Chemistry","2007","46","","3657","3662","10.1021/ic070118h","","","0.71073","MoKα","","0.1975","0.0589","","","0.1283","0.1733","","","","","","0.852","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308128","6.7883","0.0006","16.0005","0.0015","16.5624","0.0016","90","","91.917","0.002","90","","1797.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","sodium uranyl triperoxo hydrate","sodium uranyl triperoxo hydrate","","- H24 Na4 O20 U -","- Na4 O20 U -","- Na16 O80 U4 -","4","1","","Karrie-Ann Kubatko; Tori Z. Forbes; Amanda L. Klingensmith; Peter C. Burns","Expanding the Crystal Chemistry of Uranyl Peroxides: Synthesis and Structures of Di- and Triperoxodioxouranium(VI) Complexes","Inorganic Chemistry","2007","46","","3657","3662","10.1021/ic070118h","","","0.71073","MoKα","","0.0392","0.0281","","","0.0666","0.0708","","","","","","1.127","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308129","6.808","0.002","16.888","0.006","23.286","0.008","90","","90","","90","","2677.3","1.5","293","2","293","2","","","","","","","","5","P b c m","-P 2c 2b","57","","","","- H28 Na2 O28 Rb4 U2 -","- Na2 O27 Rb4 U2 -","- Na8 O108 Rb16 U8 -","4","0.5","","Karrie-Ann Kubatko; Tori Z. Forbes; Amanda L. Klingensmith; Peter C. Burns","Expanding the Crystal Chemistry of Uranyl Peroxides: Synthesis and Structures of Di- and Triperoxodioxouranium(VI) Complexes","Inorganic Chemistry","2007","46","","3657","3662","10.1021/ic070118h","","","0.71073","MoKα","","0.0712","0.0376","","","0.082","0.1065","","","","","","0.854","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308130","9.895","0.003","14.405","0.004","16.275","0.004","90","","104.088","0.005","90","","2250","1.1","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C34 H56 Cl2 Fe2 N10 O9 S4 -","- C34 H56 Cl2 Fe2 N10 O9 S4 -","- C68 H112 Cl4 Fe4 N20 O18 S8 -","2","0.5","","Ivan V. Korendovych; Olga P. Kryatova; William M. Reiff; Elena V. Rybak-Akimova","Iron(II) Complexes with Amide-Containing Macrocycles as Non-Heme Porphyrin Analogues","Inorganic Chemistry","2007","46","","4197","4211","10.1021/ic0701209","","","0.71073","MoKα","","0.1432","0.0657","","","0.1595","0.1903","","","","","","1.026","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308131","10.396","0.003","15.702","0.004","12.084","0.003","90","","106.979","0.005","90","","1886.6","0.9","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H29 Fe N5 O5 -","- C16 H29 Fe N5 O5 -","- C64 H116 Fe4 N20 O20 -","4","1","","Ivan V. Korendovych; Olga P. Kryatova; William M. Reiff; Elena V. Rybak-Akimova","Iron(II) Complexes with Amide-Containing Macrocycles as Non-Heme Porphyrin Analogues","Inorganic Chemistry","2007","46","","4197","4211","10.1021/ic0701209","","","0.71073","MoKα","","0.095","0.0461","","","0.0923","0.1015","","","","","","0.882","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308132","8.3892","0.0005","18.6742","0.001","10.7301","0.0006","90","","90","","90","","1680.99","0.16","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C14 H20 Cl Fe N5 O3 -","- C14 H20 Cl Fe N5 O3 -","- C56 H80 Cl4 Fe4 N20 O12 -","4","1","","Ivan V. Korendovych; Olga P. Kryatova; William M. Reiff; Elena V. Rybak-Akimova","Iron(II) Complexes with Amide-Containing Macrocycles as Non-Heme Porphyrin Analogues","Inorganic Chemistry","2007","46","","4197","4211","10.1021/ic0701209","","","0.71073","MoKα","","0.0266","0.0257","","","0.0704","0.0716","","","","","","0.961","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308133","10.492","0.003","16.55","0.004","24.814","0.006","90","","94.536","0.006","90","","4295.3","1.9","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H28 Cl Fe N5 O5 -","- C16 H28 Cl Fe N5 O5 -","- C128 H224 Cl8 Fe8 N40 O40 -","8","2","","Ivan V. Korendovych; Olga P. Kryatova; William M. Reiff; Elena V. Rybak-Akimova","Iron(II) Complexes with Amide-Containing Macrocycles as Non-Heme Porphyrin Analogues","Inorganic Chemistry","2007","46","","4197","4211","10.1021/ic0701209","","","0.71073","MoKα","","0.1527","0.0991","","","0.2288","0.2498","","","","","","1.083","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308134","8.6336","0.0009","13.7092","0.0015","14.7841","0.0015","90","","100.904","0.002","90","","1718.2","0.3","213","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H22 Cl Fe N5 O3 -","- C14 H22 Cl Fe N5 O3 -","- C56 H88 Cl4 Fe4 N20 O12 -","4","1","","Ivan V. Korendovych; Olga P. Kryatova; William M. Reiff; Elena V. Rybak-Akimova","Iron(II) Complexes with Amide-Containing Macrocycles as Non-Heme Porphyrin Analogues","Inorganic Chemistry","2007","46","","4197","4211","10.1021/ic0701209","","","0.71073","MoKα","","0.0329","0.029","","","0.0792","0.0812","","","","","","1.025","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308135","11.73","0.002","13.834","0.003","25.885","0.005","90","","95.722","0.005","90","","4179.5","1.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H52 Fe2 N16 O5 -","- C38 H52 Fe2 N16 O5 -","- C152 H208 Fe8 N64 O20 -","4","1","","Ivan V. Korendovych; Olga P. Kryatova; William M. Reiff; Elena V. Rybak-Akimova","Iron(II) Complexes with Amide-Containing Macrocycles as Non-Heme Porphyrin Analogues","Inorganic Chemistry","2007","46","","4197","4211","10.1021/ic0701209","","","0.71073","MoKα","","0.1855","0.0893","","","0.2241","0.2809","","","","","","0.893","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308136","34.5727","0.0003","14.2882","0.0002","30.4695","0.0004","90","","121.656","0.001","90","","12811.9","0.3","153","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C48 N3 O18 W3 -","- C48.06 N3 O18.015 W2.9991 -","- C384.48 N24 O144.12 W23.9928 -","8","1","","Keigo Kamata; Shinjiro Kuzuya; Kazuhiro Uehara; Syuhei Yamaguchi; Noritaka Mizuno","μ-η1:η1-Peroxo-Bridged Dinuclear Peroxotungstate Catalytically Active for Epoxidation of Olefins","Inorganic Chemistry","2007","46","","3768","3774","10.1021/ic0701211","","x-ray","0.71073","MoKα","","","0.062","","","","0.211","","","","","","1.063","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308137","10.5187","0.0001","32.8781","0.0004","11.7385","0.0001","90","","92.7546","0.0007","90","","4054.89","0.07","296.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H72 N2 O11 W2 -","- C32 H72 N2 O11 W2 -","- C128 H288 N8 O44 W8 -","4","1","","Keigo Kamata; Shinjiro Kuzuya; Kazuhiro Uehara; Syuhei Yamaguchi; Noritaka Mizuno","μ-η1:η1-Peroxo-Bridged Dinuclear Peroxotungstate Catalytically Active for Epoxidation of Olefins","Inorganic Chemistry","2007","46","","3768","3774","10.1021/ic0701211","","","0.7107","MoKα","","","0.041","","","","0.164","","","","","","1.069","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308138","16.2968","0.0012","16.4126","0.0012","23.0668","0.0017","78.848","0.002","70.724","0.002","74.988","0.003","5585.6","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H40 Cl13 N6 O2 Ru2 -","- C49 H40 Cl13 N6 O2 Ru2 -","- C196 H160 Cl52 N24 O8 Ru8 -","4","2","","Wei-Zhong Chen; John D. Protasiewicz; Stephen A. Davis; James B. Updegraff; Li-Qing Ma; Phillip E. Fanwick; Tong Ren","Olefin Metathesis as an Inorganic Synthetic Tool: Cross and Ring Closing Metathesis Reactions of Diruthenium-Bound ω-Alkene-α-carboxylates","Inorganic Chemistry","2007","46","","3775","3782","10.1021/ic070123l","","","0.71073","MoKα","","0.1363","0.0557","","","0.1395","0.2139","","","","","","1.018","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308139","11.5633","0.0005","14.8987","0.0006","15.702","0.0007","104.82","0.002","99.83","0.002","94.748","0.002","2553.93","0.19","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H32 Cl13 N6 O2 Ru2 -","- C44 Cl13 N6 O2 Ru2 -","- C88 Cl26 N12 O4 Ru4 -","2","1","","Wei-Zhong Chen; John D. Protasiewicz; Stephen A. Davis; James B. Updegraff; Li-Qing Ma; Phillip E. Fanwick; Tong Ren","Olefin Metathesis as an Inorganic Synthetic Tool: Cross and Ring Closing Metathesis Reactions of Diruthenium-Bound ω-Alkene-α-carboxylates","Inorganic Chemistry","2007","46","","3775","3782","10.1021/ic070123l","","","0.71073","MoKα","","0.0605","0.0418","","","0.1102","0.1143","","","","","","1.369","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308140","11.8156","0.0003","17.4357","0.0005","24.9434","0.0007","101.488","0.002","92.864","0.002","92.053","0.002","5023.9","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C86 H60 Cl26 N12 O4 Ru4 -","- C86 H49 Cl26 N12 O4 Ru4 -","- C172 H98 Cl52 N24 O8 Ru8 -","2","1","","Wei-Zhong Chen; John D. Protasiewicz; Stephen A. Davis; James B. Updegraff; Li-Qing Ma; Phillip E. Fanwick; Tong Ren","Olefin Metathesis as an Inorganic Synthetic Tool: Cross and Ring Closing Metathesis Reactions of Diruthenium-Bound ω-Alkene-α-carboxylates","Inorganic Chemistry","2007","46","","3775","3782","10.1021/ic070123l","","","0.71073","MoKα","","0.1429","0.0794","","","0.1622","0.1938","","","","","","1.224","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308141","11.1616","0.0007","12.8807","0.0008","17.4883","0.0011","108.298","0.001","97.328","0.001","109.898","0.001","2165.9","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H32.5 Cl9 N4 O5 Ru2 -","- C38 H33.5 Cl9 N4 O5 Ru2 -","- C76 H67 Cl18 N8 O10 Ru4 -","2","1","","Wei-Zhong Chen; John D. Protasiewicz; Stephen A. Davis; James B. Updegraff; Li-Qing Ma; Phillip E. Fanwick; Tong Ren","Olefin Metathesis as an Inorganic Synthetic Tool: Cross and Ring Closing Metathesis Reactions of Diruthenium-Bound ω-Alkene-α-carboxylates","Inorganic Chemistry","2007","46","","3775","3782","10.1021/ic070123l","","","0.71073","MoKα","","0.0245","0.023","","","0.0615","0.0634","","","","","","1.047","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308142","11.3739","0.0004","12.6997","0.0004","17.7184","0.0008","108.329","0.002","96.638","0.002","106.74","0.001","2265.91","0.15","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H36 Cl9 N4 O5 Ru2 -","- C40 H36 Cl9 N4 O5 Ru2 -","- C80 H72 Cl18 N8 O10 Ru4 -","2","1","","Wei-Zhong Chen; John D. Protasiewicz; Stephen A. Davis; James B. Updegraff; Li-Qing Ma; Phillip E. Fanwick; Tong Ren","Olefin Metathesis as an Inorganic Synthetic Tool: Cross and Ring Closing Metathesis Reactions of Diruthenium-Bound ω-Alkene-α-carboxylates","Inorganic Chemistry","2007","46","","3775","3782","10.1021/ic070123l","","","0.71073","MoKα","","0.031","0.0261","","","0.0648","0.0675","","","","","","1.027","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308143","10.903","0.0003","25.1518","0.0009","17.9937","0.0006","90","","107.625","0.002","90","","4702.8","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H40 Cl9 N4 O6 Ru2 -","- C42 H34 Cl9 N4 O6 Ru2 -","- C168 H136 Cl36 N16 O24 Ru8 -","4","1","","Wei-Zhong Chen; John D. Protasiewicz; Stephen A. Davis; James B. Updegraff; Li-Qing Ma; Phillip E. Fanwick; Tong Ren","Olefin Metathesis as an Inorganic Synthetic Tool: Cross and Ring Closing Metathesis Reactions of Diruthenium-Bound ω-Alkene-α-carboxylates","Inorganic Chemistry","2007","46","","3775","3782","10.1021/ic070123l","","","0.71073","MoKα","","0.063","0.0385","","","0.0767","0.0848","","","","","","1.021","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308144","23.768","0.005","13.363","0.003","20.343","0.004","90","","114.666","0.01","90","","5872","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","? bis[bis(2-pyridylmethyl)amine-N,N')-silver(I)] diperchlorate","","- C24 H26 Ag2 Cl2 N6 O8 -","- C24 H26 Ag2 Cl2 N6 O8 -","- C192 H208 Ag16 Cl16 N48 O64 -","8","1","","Silvia Del Piero; Rosalisa Fedele; Andrea Melchior; Roberto Portanova; Marilena Tolazzi; Ennio Zangrando","Solvation Effects on the Stability of Silver(I) Complexes with Pyridine-Containing Ligands Studied by Thermodynamic and DFT Methods","Inorganic Chemistry","2007","46","","4683","4691","10.1021/ic070124d","","","0.71073","Mokα","","0.0968","0.0603","","","0.1971","0.2199","","","","","","0.984","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308145","37.43","0.002","37.43","0.002","19.6822","0.0014","90","","90","","90","","27575","3","173","2","173","2","","","","","","","","8","I 4/m","-I 4","87","","","","- C24 H112 Fe4 K4 N8 O100 Si2 W20 -","- C18 H44 Fe4 K4 N5 O98 Si2 W20 -","- C144 H352 Fe32 K32 N40 O784 Si16 W160 -","8","0.5","","Bogdan Botar; Paul Kögerler; Craig L. Hill","Tetrairon and Hexairon Hydroxo/Acetato Clusters Stabilized by Multiple Polyoxometalate Scaffolds. Structures, Magnetic Properties, and Chemistry of a Dimer and a Trimer","Inorganic Chemistry","2007","46","","5398","5403","10.1021/ic070126y","","","0.71073","MoKα","","0.0936","0.062","","","0.1766","0.1898","","","","","","1.03","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308146","20.3314","0.0009","20.3314","0.0009","33.39","0.003","90","","90","","120","","11953.1","1.3","173","2","173","2","","","","","","","","8","P 31 2 1","P 31 2""","152","","","","- C20 H161 Fe6 K9 N8 O162 Si3 W30 -","- C16 H44 Fe6 K9 N6 O162 Si3 W30 -","- C48 H132 Fe18 K27 N18 O486 Si9 W90 -","3","0.5","","Bogdan Botar; Paul Kögerler; Craig L. Hill","Tetrairon and Hexairon Hydroxo/Acetato Clusters Stabilized by Multiple Polyoxometalate Scaffolds. Structures, Magnetic Properties, and Chemistry of a Dimer and a Trimer","Inorganic Chemistry","2007","46","","5398","5403","10.1021/ic070126y","","","0.71073","MoKα","","0.0575","0.0557","","","0.1317","0.1323","","","","","","1.293","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308147","7.4564","0.0015","9.1845","0.0019","11.582","0.002","100.842","0.003","104.303","0.003","94.774","0.003","747.8","0.3","110","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H36 Cu4 N4 O22 P4 -","- C20 H16 Cu4 N4 O17.22 P4 -","- C20 H16 Cu4 N4 O17.22 P4 -","1","0.5","","Sanjit Konar; Jerzy Zoń; Andrey V. Prosvirin; Kim R. Dunbar; Abraham Clearfield","Synthesis and Characterization of Four Metal-Organophosphonates with One-, Two-, and Three-Dimensional Structures","Inorganic Chemistry","2007","46","","5229","5236","10.1021/ic070132u","","","0.71073","MoKα","","0.0698","0.0635","","","0.1675","0.1716","","","","","","1.095","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308148","7.6871","0.0014","10.576","0.002","14.47","0.003","81.34","0.004","81.561","0.003","68.757","0.003","1078.5","0.4","110","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H32 Cl2 Mn3 N4 O26 P4 -","- C10 H11 Cl2 Mn1.5 N2 O17 P2 -","- C20 H22 Cl4 Mn3 N4 O34 P4 -","2","1","","Sanjit Konar; Jerzy Zoń; Andrey V. Prosvirin; Kim R. Dunbar; Abraham Clearfield","Synthesis and Characterization of Four Metal-Organophosphonates with One-, Two-, and Three-Dimensional Structures","Inorganic Chemistry","2007","46","","5229","5236","10.1021/ic070132u","","","0.71073","MoKα","","0.104","0.0977","","","0.2818","0.2844","","","","","","1.138","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308149","8.497","0.005","9.391","0.005","12.378","0.006","90","","90.86","0.011","90","","987.6","0.9","110","2","273","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C5 H6 Cl2 N O3 P Zn -","- C5 H6 Cl2 N O3 P Zn -","- C20 H24 Cl8 N4 O12 P4 Zn4 -","4","1","","Sanjit Konar; Jerzy Zoń; Andrey V. Prosvirin; Kim R. Dunbar; Abraham Clearfield","Synthesis and Characterization of Four Metal-Organophosphonates with One-, Two-, and Three-Dimensional Structures","Inorganic Chemistry","2007","46","","5229","5236","10.1021/ic070132u","","","0.71073","MoKα","","0.0834","0.0727","","","0.2028","0.2135","","","","","","1.128","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308150","21.744","0.004","5.6744","0.001","4.7927","0.0009","90","","90","","90","","591.34","0.19","110","2","273","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C8 H12 Co2 O8 P2 -","- C6 H4 Co O4 P -","- C24 H16 Co4 O16 P4 -","4","0.5","","Sanjit Konar; Jerzy Zoń; Andrey V. Prosvirin; Kim R. Dunbar; Abraham Clearfield","Synthesis and Characterization of Four Metal-Organophosphonates with One-, Two-, and Three-Dimensional Structures","Inorganic Chemistry","2007","46","","5229","5236","10.1021/ic070132u","","","0.71073","MoKα","","0.0816","0.0712","","","0.1909","0.2107","","","","","","1.253","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308151","8.755","0.0018","4.712","0.0009","12.368","0.003","90","","90","","90","","510.22","0.19","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Au2 Ba In2 -","- Au2 Ba In2 -","- Au8 Ba4 In8 -","4","0.5","","Jing-Cao Dai; John D. Corbett","Transformation of AeIn4 Indides (Ae = Ba, Sr) into an AeAu2In2 Structure Type Through Gold Substitution","Inorganic Chemistry","2007","46","","4592","4598","10.1021/ic070142v","","","0.71073","MoKα","","0.048","0.0442","","","0.1157","0.118","","","","","","1.001","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308152","8.532","0.0001","4.5996","0.0001","12.2821","0.0002","90","","90","","90","","481.996","0.014","273","2","273","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Au2 In2 Sr -","- Au2 In2 Sr -","- Au8 In8 Sr4 -","4","0.5","","Jing-Cao Dai; John D. Corbett","Transformation of AeIn4 Indides (Ae = Ba, Sr) into an AeAu2In2 Structure Type Through Gold Substitution","Inorganic Chemistry","2007","46","","4592","4598","10.1021/ic070142v","","","0.71073","MoKα","","0.0447","0.0387","","","0.0942","0.0966","","","","","","1.001","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308153","19.4261","0.0009","9.7061","0.0004","22.1846","0.001","90","","106.477","0.002","90","","4011.2","0.3","298","2","298","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C41.5 H43 As Cl2 N O4 P Pd -","- C41.5 H43 As Cl2 N O4 P Pd -","- C166 H172 As4 Cl8 N4 O16 P4 Pd4 -","4","2","","Maricar L. Bungabong; Kien Wee Tan; Yongxin Li; Selvasothi V. Selvaratnam; Krishna G. Dongol; Pak-Hing Leung","A Novel Asymmetric Hydroarsination Reaction Promoted by a Chiral Organopalladium Complex","Inorganic Chemistry","2007","46","","4733","4736","10.1021/ic0701561","","","0.71073","MoKα","","0.1228","0.0537","","","0.1003","0.1239","","","","","","0.967","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308154","12.5105","0.0002","14.371","0.0002","17.2687","0.0002","98.834","0.001","110.744","0.001","104.711","0.001","2704.58","0.07","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H112 Cu10 N20 O74 Si2 W18 -","- C30 H70 Cu10 N20 O74 Si2 W18 -","- C30 H70 Cu10 N20 O74 Si2 W18 -","1","0.5","","Shou-Tian Zheng; Da-Qiang Yuan; Jie Zhang; Guo-Yu Yang","Combination of Lacunary Polyoxometalates and High-Nuclear Transition Metal Clusters under Hydrothermal Conditions. 3. Structure and Characterization of [Cu(enMe)2]2{[Cu(enMe)2(H2O)]2[Cu6(enMe)2(B-a-SiW9O34)2]}.4H2O","Inorganic Chemistry","2007","46","","4569","4574","10.1021/ic070160c","","","0.71073","MoKα","","0.0605","0.0469","","","0.1131","0.125","","","","","","1.064","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308155","11.393","0.0011","17.702","0.002","19.709","0.002","90","","97.997","0.005","90","","3936.2","0.7","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H50 Cl2 N2 Pd S2 -","- C41 H50 Cl2 N2 Pd S2 -","- C164 H200 Cl8 N8 Pd4 S8 -","4","1","","José Vicente; Pablo González-Herrero; María Pérez-Cadenas; Peter G. Jones; Delia Bautista","Synthesis, Structure, and Luminescence of Di- and Trinuclear Palladium/Gold and Platinum/Gold Complexes with (2,7-Di-tert-butylfluoren-9-ylidene)methanedithiolate,1","Inorganic Chemistry","2007","46","","4718","4732","10.1021/ic070164h","","","0.71073","MoKα","","0.0654","0.0389","","","0.0981","0.1138","","","","","","1.023","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308156","9.5339","0.0004","15.1567","0.0007","26.6961","0.0012","90","","92.012","0.002","90","","3855.3","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C80 H114 Au2 P2 Pd S4 -","- C80 H114 Au2 P2 Pd S4 -","- C160 H228 Au4 P4 Pd2 S8 -","2","0.5","","José Vicente; Pablo González-Herrero; María Pérez-Cadenas; Peter G. Jones; Delia Bautista","Synthesis, Structure, and Luminescence of Di- and Trinuclear Palladium/Gold and Platinum/Gold Complexes with (2,7-Di-tert-butylfluoren-9-ylidene)methanedithiolate,1","Inorganic Chemistry","2007","46","","4718","4732","10.1021/ic070164h","","","0.71073","MoKα","","0.0267","0.0227","","","0.0503","0.0518","","","","","","1.036","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308157","9.5454","0.0004","15.1537","0.0007","26.6997","0.0011","90","","91.988","0.002","90","","3859.7","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C80 H114 Au2 P2 Pt S4 -","- C80 H114 Au2 P2 Pt S4 -","- C160 H228 Au4 P4 Pt2 S8 -","2","0.5","","José Vicente; Pablo González-Herrero; María Pérez-Cadenas; Peter G. Jones; Delia Bautista","Synthesis, Structure, and Luminescence of Di- and Trinuclear Palladium/Gold and Platinum/Gold Complexes with (2,7-Di-tert-butylfluoren-9-ylidene)methanedithiolate,1","Inorganic Chemistry","2007","46","","4718","4732","10.1021/ic070164h","","","0.71073","MoKα","","0.0483","0.0429","","","0.0759","0.0776","","","","","","1.249","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308158","20.3656","0.0009","17.0378","0.0007","35.8373","0.0016","90","","90","","90","","12435","0.9","100","2","100","2","","","","","","","","9","P b c a","-P 2ac 2ab","61","","","","- C61 H87 Au Cl N2 O5 P Pt S2 -","- C61 H87 Au Cl N2 O5 P Pt S2 -","- C488 H696 Au8 Cl8 N16 O40 P8 Pt8 S16 -","8","1","","José Vicente; Pablo González-Herrero; María Pérez-Cadenas; Peter G. Jones; Delia Bautista","Synthesis, Structure, and Luminescence of Di- and Trinuclear Palladium/Gold and Platinum/Gold Complexes with (2,7-Di-tert-butylfluoren-9-ylidene)methanedithiolate,1","Inorganic Chemistry","2007","46","","4718","4732","10.1021/ic070164h","","","0.71073","MoKα","","0.0253","0.0207","","","0.0462","0.0477","","","","","","1.06","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308159","22.6833","0.0009","14.445","0.0006","28.7838","0.0012","90","","112.831","0.002","90","","8692.4","0.6","100","2","100","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C83 H129 Au2 Cl2 N2 O9 P2 Pd S2 -","- C83 H129 Au2 Cl2 N2 O9 P2 Pd S2 -","- C332 H516 Au8 Cl8 N8 O36 P8 Pd4 S8 -","4","1","","José Vicente; Pablo González-Herrero; María Pérez-Cadenas; Peter G. Jones; Delia Bautista","Synthesis, Structure, and Luminescence of Di- and Trinuclear Palladium/Gold and Platinum/Gold Complexes with (2,7-Di-tert-butylfluoren-9-ylidene)methanedithiolate,1","Inorganic Chemistry","2007","46","","4718","4732","10.1021/ic070164h","","","0.71073","MoKα","","0.0449","0.0313","","","0.0682","0.0731","","","","","","1.024","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308160","14.3624","0.0007","10.3495","0.0004","19.4897","0.0009","90","","106.771","0.004","90","","2773.8","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H34 Au N2 P -","- C31 H34 Au N2 P -","- C124 H136 Au4 N8 P4 -","4","1","","Jenni Meiners; Jost-Steffen Herrmann; Peter W. Roesky","Three-Coordinated Aminotroponiminate and Aminotroponate Complexes of Gold(I)","Inorganic Chemistry","2007","46","","4599","4604","10.1021/ic0701662","","","0.71073","MoKα","","0.0491","0.0329","","","0.0733","0.078","","","","","","1.023","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308161","11.1572","0.0008","13.0802","0.001","13.3","0.001","109.54","0.006","110.119","0.006","101.708","0.006","1602.9","0.3","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H42 Au N2 P -","- C37 H42 Au N2 P -","- C74 H84 Au2 N4 P2 -","2","1","","Jenni Meiners; Jost-Steffen Herrmann; Peter W. Roesky","Three-Coordinated Aminotroponiminate and Aminotroponate Complexes of Gold(I)","Inorganic Chemistry","2007","46","","4599","4604","10.1021/ic0701662","","","0.71073","MoKα","","0.0618","0.0422","","","0.0779","0.0831","","","","","","1.032","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308162","12.297","0.003","17.199","0.004","17.234","0.004","116.069","0.004","104.143","0.004","91.725","0.004","3135.1","1.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C51 H62 Cl6 Cu3 N7 O22.5 S4 -","- C51 H47 Cl6 Cu3 N7 O15 S4 -","- C102 H94 Cl12 Cu6 N14 O30 S8 -","2","1","","M. Carla Aragoni; Massimiliano Arca; Andrea Bencini; Alexander J. Blake; Claudia Caltagirone; Greta De Filippo; Francesco A. Devillanova; Alessandra Garau; Thomas Gelbrich; Michael B. Hursthouse; Francesco Isaia; Vito Lippolis; Marta Mameli; Palma Mariani; Barbara Valtancoli; Claire Wilson","Tuning the Selectivity/Specificity of Fluorescent Metal Ion Sensors Based on N2S2 Pyridine-Containing Macrocyclic Ligands by Changing the Fluorogenic Subunit: Spectrofluorimetric and Metal Ion Binding Studies","Inorganic Chemistry","2007","46","","4548","4559","10.1021/ic070169e","","","0.71073","MoKα","","0.139","0.0675","","","0.156","0.175","","","","","","0.84","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4308163","11.8164","0.0012","14.494","0.002","15.89","0.002","90","","108.924","0.002","90","","2574.3","0.5","150","2","150","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C22 H24.5 Cl2 Cu N3.5 O8 S2 -","- C22 H24.5 Cl2 Cu N3.5 O8 S2 -","- C88 H98 Cl8 Cu4 N14 O32 S8 -","4","2","","M. Carla Aragoni; Massimiliano Arca; Andrea Bencini; Alexander J. Blake; Claudia Caltagirone; Greta De Filippo; Francesco A. Devillanova; Alessandra Garau; Thomas Gelbrich; Michael B. Hursthouse; Francesco Isaia; Vito Lippolis; Marta Mameli; Palma Mariani; Barbara Valtancoli; Claire Wilson","Tuning the Selectivity/Specificity of Fluorescent Metal Ion Sensors Based on N2S2 Pyridine-Containing Macrocyclic Ligands by Changing the Fluorogenic Subunit: Spectrofluorimetric and Metal Ion Binding Studies","Inorganic Chemistry","2007","46","","4548","4559","10.1021/ic070169e","","","0.71073","MoKα","","0.0458","0.0412","","","0.094","0.096","","","","","","1.11","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308164","22.199","0.002","8.7307","0.0005","28.982","0.002","90","","98.407","0.002","90","","5556.7","0.7","150","2","150","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C23 H26 Cl2 Hg N4 O8 S2 -","- C23 H26 Cl2 Hg N4 O8 S2 -","- C184 H208 Cl16 Hg8 N32 O64 S16 -","8","1","","M. Carla Aragoni; Massimiliano Arca; Andrea Bencini; Alexander J. Blake; Claudia Caltagirone; Greta De Filippo; Francesco A. Devillanova; Alessandra Garau; Thomas Gelbrich; Michael B. Hursthouse; Francesco Isaia; Vito Lippolis; Marta Mameli; Palma Mariani; Barbara Valtancoli; Claire Wilson","Tuning the Selectivity/Specificity of Fluorescent Metal Ion Sensors Based on N2S2 Pyridine-Containing Macrocyclic Ligands by Changing the Fluorogenic Subunit: Spectrofluorimetric and Metal Ion Binding Studies","Inorganic Chemistry","2007","46","","4548","4559","10.1021/ic070169e","","","0.71073","MoKα","","0.0352","0.0329","","","0.0864","0.0876","","","","","","0.99","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308165","9.4031","0.0008","20.719","0.002","12.8426","0.0011","90","","90.956","0.002","90","","2501.7","0.4","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C21 H23 Cl2 N3 O8 Pb S2 -","- C21 H23 Cl2 N3 O8 Pb S2 -","- C84 H92 Cl8 N12 O32 Pb4 S8 -","4","1","","M. Carla Aragoni; Massimiliano Arca; Andrea Bencini; Alexander J. Blake; Claudia Caltagirone; Greta De Filippo; Francesco A. Devillanova; Alessandra Garau; Thomas Gelbrich; Michael B. Hursthouse; Francesco Isaia; Vito Lippolis; Marta Mameli; Palma Mariani; Barbara Valtancoli; Claire Wilson","Tuning the Selectivity/Specificity of Fluorescent Metal Ion Sensors Based on N2S2 Pyridine-Containing Macrocyclic Ligands by Changing the Fluorogenic Subunit: Spectrofluorimetric and Metal Ion Binding Studies","Inorganic Chemistry","2007","46","","4548","4559","10.1021/ic070169e","","","0.71073","MoKα","","0.032","0.0231","","","0.0499","0.0529","","","","","","1.04","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308166","6.757","0.0017","25.205","0.006","15.048","0.004","90","","100.38","0.02","90","","2520.9","1.1","120","2","120","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C44 H50 B2 Cl2 Cu F8 N8 O6 S4 -","- C44 H50 B2 Cl2 Cu F8 N8 O6 S4 -","- C88 H100 B4 Cl4 Cu2 F16 N16 O12 S8 -","2","0.5","","M. Carla Aragoni; Massimiliano Arca; Andrea Bencini; Alexander J. Blake; Claudia Caltagirone; Greta De Filippo; Francesco A. Devillanova; Alessandra Garau; Thomas Gelbrich; Michael B. Hursthouse; Francesco Isaia; Vito Lippolis; Marta Mameli; Palma Mariani; Barbara Valtancoli; Claire Wilson","Tuning the Selectivity/Specificity of Fluorescent Metal Ion Sensors Based on N2S2 Pyridine-Containing Macrocyclic Ligands by Changing the Fluorogenic Subunit: Spectrofluorimetric and Metal Ion Binding Studies","Inorganic Chemistry","2007","46","","4548","4559","10.1021/ic070169e","","","0.71073","MoKα","","0.1234","0.0664","","","0.1397","0.1609","","","","","","0.995","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308167","12.3734","0.001","14.1375","0.0012","14.9149","0.0012","90","","96.326","0.001","90","","2593.2","0.4","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C21 H25 Cl2 N3 O9 S2 Zn -","- C21 H25 Cl2 N3 O9 S2 Zn -","- C84 H100 Cl8 N12 O36 S8 Zn4 -","4","1","","M. Carla Aragoni; Massimiliano Arca; Andrea Bencini; Alexander J. Blake; Claudia Caltagirone; Greta De Filippo; Francesco A. Devillanova; Alessandra Garau; Thomas Gelbrich; Michael B. Hursthouse; Francesco Isaia; Vito Lippolis; Marta Mameli; Palma Mariani; Barbara Valtancoli; Claire Wilson","Tuning the Selectivity/Specificity of Fluorescent Metal Ion Sensors Based on N2S2 Pyridine-Containing Macrocyclic Ligands by Changing the Fluorogenic Subunit: Spectrofluorimetric and Metal Ion Binding Studies","Inorganic Chemistry","2007","46","","4548","4559","10.1021/ic070169e","","","0.71073","MoKα","","0.0419","0.04","","","0.0931","0.0941","","","","","","1.167","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308168","9.879","0.0005","9.879","0.0005","5.3063","0.0004","90","","90","","90","","517.87","0.05","193","2","193","2","","","","","","","","3","P 42/n :2","-P 4bc","86","Neptunium(IV) iodate","","","- I4 Np O12 -","- I4 Np O12 -","- I8 Np2 O24 -","2","0.25","","Travis H. Bray; Jie Ling; Eun Sang Choi; James S. Brooks; James V. Beitz; Richard E. Sykora; Richard G. Haire; David M. Stanbury; Thomas E. Albrecht-Schmitt","Critical Role of Water Content in the Formation and Reactivity of Uranium, Neptunium, and Plutonium Iodates under Hydrothermal Conditions: Implications for the Oxidative Dissolution of Spent Nuclear Fuel","Inorganic Chemistry","2007","46","","3663","3668","10.1021/ic070170d","","","0.71073","MoKα","","0.0252","0.025","","","0.0653","0.0654","","","","","","1.328","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308169","21.8675","0.001","21.8675","0.001","12.9705","0.0008","90","","90","","120","","5371.4","0.5","193","2","193","2","","","","","","","","3","R 3 c :H","R 3 -2""c","161","neptunium(IV) iodate hydrate","","","- I4.03 Np O13 -","- I4.03 Np O13 -","- I72.54 Np18 O234 -","18","1","","Travis H. Bray; Jie Ling; Eun Sang Choi; James S. Brooks; James V. Beitz; Richard E. Sykora; Richard G. Haire; David M. Stanbury; Thomas E. Albrecht-Schmitt","Critical Role of Water Content in the Formation and Reactivity of Uranium, Neptunium, and Plutonium Iodates under Hydrothermal Conditions: Implications for the Oxidative Dissolution of Spent Nuclear Fuel","Inorganic Chemistry","2007","46","","3663","3668","10.1021/ic070170d","","","0.71073","MoKα","","0.044","0.0403","","","0.087","0.088","","","","","","1.04","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308170","9.8687","0.001","9.8687","0.001","5.2861","0.0007","90","","90","","90","","514.82","0.1","193","2","193","2","","","","","","","","3","P 42/n :2","-P 4bc","86","Plutonium(IV) Iodate","","","- I4 O12 Pu -","- I4 O12 Pu -","- I8 O24 Pu2 -","2","0.25","","Travis H. Bray; Jie Ling; Eun Sang Choi; James S. Brooks; James V. Beitz; Richard E. Sykora; Richard G. Haire; David M. Stanbury; Thomas E. Albrecht-Schmitt","Critical Role of Water Content in the Formation and Reactivity of Uranium, Neptunium, and Plutonium Iodates under Hydrothermal Conditions: Implications for the Oxidative Dissolution of Spent Nuclear Fuel","Inorganic Chemistry","2007","46","","3663","3668","10.1021/ic070170d","","","0.71073","MoKα","","0.0338","0.0266","","","0.0453","0.0467","","","","","","1.137","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308171","10.9686","0.0003","10.9686","0.0003","8.6941","0.0005","90","","90","","120","","905.85","0.06","100","2","100","2","","","","","","","","7","P -3","-P 3","147","Fe(4ditz)3(PF6)2.0.75(CH3OH) xx2","[mue-tris(1,4-bis(tetrazol-1-yl)butane-N4,N4')iron(II)] bis(hexafluorophosphate solvate (methanol)","","- C18.75 H33 F12 Fe N24 O0.75 P2 -","- C18.786 H30 F12 Fe N24 O0.786 P2 -","- C18.786 H30 F12 Fe N24 O0.786 P2 -","1","0.166667","","Matthias Bartel; Alina Absmeier; Guy N. L. Jameson; Franz Werner; Kenichi Kato; Masaki Takata; Roman Boca; Miki Hasegawa; Kurt Mereiter; Andrea Caneschi; Wolfgang Linert","Modification of Spin Crossover Behavior through Solvent Assisted Formation and Solvent Inclusion in a Triply Interpenetrating Three-Dimensional Network","Inorganic Chemistry","2007","46","","4220","4229","10.1021/ic070173q","","","0.71073","MoKα","","0.0216","0.0215","","","0.0552","0.0553","","","","","","1.059","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308172","10.963","0.002","10.963","0.002","8.6978","0.0016","90","","90","","120","","905.3","0.3","100","2","100","2","","","","","","","","7","P -3","-P 3","147","Fe(4ditz)3(PF6)2.0.75(CH3OH) xx1","[mue-tris(1,4-bis(tetrazol-1-yl)butane-N4,N4')iron(II)] bis(hexafluorophosphate solvate (methanol)","","- C18.75 H33 F12 Fe N24 O0.75 P2 -","- C18.766 H30 F12 Fe N24 O0.768 P2 -","- C18.766 H30 F12 Fe N24 O0.768 P2 -","1","0.166667","","Matthias Bartel; Alina Absmeier; Guy N. L. Jameson; Franz Werner; Kenichi Kato; Masaki Takata; Roman Boca; Miki Hasegawa; Kurt Mereiter; Andrea Caneschi; Wolfgang Linert","Modification of Spin Crossover Behavior through Solvent Assisted Formation and Solvent Inclusion in a Triply Interpenetrating Three-Dimensional Network","Inorganic Chemistry","2007","46","","4220","4229","10.1021/ic070173q","","","0.71073","MoKα","","0.0332","0.0307","","","0.0783","0.0798","","","","","","1.056","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308173","10.9726","0.0004","10.9726","0.0004","8.6916","0.0007","90","","90","","120","","906.25","0.09","100","2","100","2","","","","","","","","7","P -3","-P 3","147","Fe(4ditz)3(PF6)2.0.25(C2H5OH) xx2","[mue-tris(1,4-bis(tetrazol-1-yl)butane-N4,N4')iron(II)] bis(hexafluorophosphate solvate (ethanol)","","- C18.5 H31.5 F12 Fe N24 O0.25 P2 -","- C18.51 H30 F12 Fe N24 O0.258 P2 -","- C18.51 H30 F12 Fe N24 O0.258 P2 -","1","0.166667","","Matthias Bartel; Alina Absmeier; Guy N. L. Jameson; Franz Werner; Kenichi Kato; Masaki Takata; Roman Boca; Miki Hasegawa; Kurt Mereiter; Andrea Caneschi; Wolfgang Linert","Modification of Spin Crossover Behavior through Solvent Assisted Formation and Solvent Inclusion in a Triply Interpenetrating Three-Dimensional Network","Inorganic Chemistry","2007","46","","4220","4229","10.1021/ic070173q","","","0.71073","MoKα","","0.0334","0.0293","","","0.0729","0.0766","","","","","","1.054","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308174","10.9697","0.0005","10.9697","0.0005","8.6824","0.0008","90","","90","","120","","904.82","0.1","100","2","100","2","","","","","","","","7","P -3","-P 3","147","Fe(4ditz)3(PF6)2.0.25(C2H5OH) xx1","[mue-tris(1,4-bis(tetrazol-1-yl)butane-N4,N4')iron(II)] bis(hexafluorophosphate solvate (ethanol)","","- C18.5 H31.5 F12 Fe N24 O0.25 P2 -","- C18.504 H30 F12 Fe N24 O0.252 P2 -","- C18.504 H30 F12 Fe N24 O0.252 P2 -","1","0.166667","","Matthias Bartel; Alina Absmeier; Guy N. L. Jameson; Franz Werner; Kenichi Kato; Masaki Takata; Roman Boca; Miki Hasegawa; Kurt Mereiter; Andrea Caneschi; Wolfgang Linert","Modification of Spin Crossover Behavior through Solvent Assisted Formation and Solvent Inclusion in a Triply Interpenetrating Three-Dimensional Network","Inorganic Chemistry","2007","46","","4220","4229","10.1021/ic070173q","","","0.71073","MoKα","","0.0372","0.0333","","","0.078","0.0803","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308175","19.002","0.0005","8.6125","0.0001","20.0582","0.0005","90","","112.882","0.001","90","","3024.3","0.12","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H44 I In N2 -","- C29.9135 H43.7405 I1.0865 In N2 -","- C119.654 H174.962 I4.346 In4 N8 -","4","1","","Michael S. Hill; Peter B. Hitchcock; Ruti Pongtavornpinyo","Oxidative Addition Reactions of Alkyl Halides with the Group 13 Carbene Analogue [In{N(Dipp)C(Me)}2CH] (Dipp = 2,6-iPr2C6H3)","Inorganic Chemistry","2007","46","","3783","3788","10.1021/ic070183r","","x-ray","0.71073","MoKα","","0.0371","0.0333","","","0.0817","0.0834","","","","","","1.169","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4308176","15.7887","0.0002","21.4997","0.0004","9.5541","0.0002","90","","90","","90","","3243.16","0.1","173","2","173","2","","","","","","","synthesis as described","5","P n m a","-P 2ac 2n","62","","","","- C32 H48 I In N2 -","- C32 H48 I In N2 -","- C128 H192 I4 In4 N8 -","4","0.5","","Michael S. Hill; Peter B. Hitchcock; Ruti Pongtavornpinyo","Oxidative Addition Reactions of Alkyl Halides with the Group 13 Carbene Analogue [In{N(Dipp)C(Me)}2CH] (Dipp = 2,6-iPr2C6H3)","Inorganic Chemistry","2007","46","","3783","3788","10.1021/ic070183r","","x-ray","0.71073","MoKα","","0.0264","0.022","","","0.0501","0.052","","","","","","1.065","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308177","9.1089","0.0003","20.3097","0.0004","10.0983","0.0003","90","","116.04","0.001","90","","1678.53","0.08","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/m 1","-P 2yb","11","","","","- C33 H50 I In N2 -","- C33 H50 I In N2 -","- C66 H100 I2 In2 N4 -","2","0.5","","Michael S. Hill; Peter B. Hitchcock; Ruti Pongtavornpinyo","Oxidative Addition Reactions of Alkyl Halides with the Group 13 Carbene Analogue [In{N(Dipp)C(Me)}2CH] (Dipp = 2,6-iPr2C6H3)","Inorganic Chemistry","2007","46","","3783","3788","10.1021/ic070183r","","x-ray","0.71073","MoKα","","0.0452","0.0341","","","0.0975","0.1234","","","","","","1.139","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308178","15.6859","0.0003","21.4625","0.0003","9.545","0.0002","90","","90","","90","","3213.41","0.1","173","2","173","2","","","","","","","synthesis as described","5","P n m a","-P 2ac 2n","62","","","","- C32 H48 Br In N2 -","- C32 H48 Br In N2 -","- C128 H192 Br4 In4 N8 -","4","0.5","","Michael S. Hill; Peter B. Hitchcock; Ruti Pongtavornpinyo","Oxidative Addition Reactions of Alkyl Halides with the Group 13 Carbene Analogue [In{N(Dipp)C(Me)}2CH] (Dipp = 2,6-iPr2C6H3)","Inorganic Chemistry","2007","46","","3783","3788","10.1021/ic070183r","","x-ray","0.71073","MoKα","","0.036","0.0251","","","0.0527","0.0566","","","","","","1.032","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308179","10.2964","0.0002","27.2575","0.0004","12.2832","0.0003","90","","106.063","0.001","90","","3312.74","0.12","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H50 Br In N2 -","- C33 H50 Br In N2 -","- C132 H200 Br4 In4 N8 -","4","1","","Michael S. Hill; Peter B. Hitchcock; Ruti Pongtavornpinyo","Oxidative Addition Reactions of Alkyl Halides with the Group 13 Carbene Analogue [In{N(Dipp)C(Me)}2CH] (Dipp = 2,6-iPr2C6H3)","Inorganic Chemistry","2007","46","","3783","3788","10.1021/ic070183r","","x-ray","0.71073","MoKα","","0.0818","0.0573","","","0.1431","0.1582","","","","","","0.86","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308180","17.493","0.006","10.969","0.004","18.647","0.005","90","","114.08","0.03","90","","3267","2","298","","298","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C22 H34 Cl4 Cu2 N8 O12 -","- C22 H34 Cl4 Cu2 N8 O12 -","- C88 H136 Cl16 Cu8 N32 O48 -","4","1","","Gianluca Ambrosi; Mauro Formica; Vieri Fusi; Luca Giorgi; Annalisa Guerri; Mauro Micheloni; Paola Paoli; Roberto Pontellini; Patrizia Rossi","A New Branched Phenanthroline Derivative Ligand: Synthesis, Solution Chemistry, and Crystal Structures of Copper(II) and Zinc(II) Complexes","Inorganic Chemistry","2007","46","","4737","4748","10.1021/ic070184j","","","0.71069","MoKα","","0.1397","0.0971","","","0.2161","0.2483","","","","","","1.076","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308181","10.225","0.006","15.88","0.001","24.179","0.002","102.033","0.007","100.026","0.006","105.365","0.007","3591","2","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H39 Cl4 N8 O17.5 Zn -","- C22 H32.5 Cl4 N8 O17.5 Zn -","- C88 H130 Cl16 N32 O70 Zn4 -","4","2","","Gianluca Ambrosi; Mauro Formica; Vieri Fusi; Luca Giorgi; Annalisa Guerri; Mauro Micheloni; Paola Paoli; Roberto Pontellini; Patrizia Rossi","A New Branched Phenanthroline Derivative Ligand: Synthesis, Solution Chemistry, and Crystal Structures of Copper(II) and Zinc(II) Complexes","Inorganic Chemistry","2007","46","","4737","4748","10.1021/ic070184j","","","0.71069","MoKα","","0.2131","0.08","","","0.184","0.2263","","","","","","0.849","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308182","9.4067","0.0007","9.694","0.0006","20.412","0.001","77.837","0.005","80.571","0.006","85.084","0.005","1792.4","0.2","120","","120","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H42 Cl4 Cu N8 O19 -","- C22 H42 Cl4 Cu N8 O19 -","- C44 H84 Cl8 Cu2 N16 O38 -","2","1","","Gianluca Ambrosi; Mauro Formica; Vieri Fusi; Luca Giorgi; Annalisa Guerri; Mauro Micheloni; Paola Paoli; Roberto Pontellini; Patrizia Rossi","A New Branched Phenanthroline Derivative Ligand: Synthesis, Solution Chemistry, and Crystal Structures of Copper(II) and Zinc(II) Complexes","Inorganic Chemistry","2007","46","","4737","4748","10.1021/ic070184j","","","0.71069","MoKα","","0.073","0.0434","","","0.0966","0.1062","","","","","","0.904","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308183","12.8947","0.0005","13.5128","0.0005","13.9914","0.0005","90","","90","0.004","64.28","0.002","2196.38","0.15","293","2","293","2","","","","","","","","8","P 1 1 21/b","-P 2bc","14","","Bis(phenyltris(1-methyl-imidazol-2-ylidene)borato)maganese(iv) triflate","","- C8.44 H8.89 B0.44 F1.33 Mn0.22 N2.67 O1.33 S0.44 -","- C8.44444 H8.88889 B0.444444 F1.33333 Mn0.222222 N2.66667 O1.33333 S0.444444 -","- C76 H80 B4 F12 Mn2 N24 O12 S4 -","9","2.25","","Adam P. Forshaw; Ranko P. Bontchev; Jeremy M. Smith","Oxidation of the Tris(carbene)borate Complex PhB(MeIm)3MnI(CO)3 to MnIV[PhB(MeIm)3]2(OTf)2","Inorganic Chemistry","2007","46","","3792","3794","10.1021/ic070187w","","","0.71073","mokα","","0.0438","0.0404","","","0.1132","0.1232","","","","","","1.092","","","","has coordinates","189832","2020-10-21","18:00:00",""
"4308184","9.5832","0.0005","11.4151","0.0005","10.5034","0.0005","90","","95.603","0.002","90","","1143.51","0.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","mu-dibromobis(tert-butylnitrile)hexacarbonyldimanganese(0)","","- C8 H9 Br Mn N O3 -","- C8 H9 Br Mn N O3 -","- C32 H36 Br4 Mn4 N4 O12 -","4","1","","Adam P. Forshaw; Ranko P. Bontchev; Jeremy M. Smith","Oxidation of the Tris(carbene)borate Complex PhB(MeIm)3MnI(CO)3 to MnIV[PhB(MeIm)3]2(OTf)2","Inorganic Chemistry","2007","46","","3792","3794","10.1021/ic070187w","","","0.71073","MoKα","","0.0856","0.031","","","0.0616","0.0782","","","","","","0.982","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308185","7.429","0.005","30.728","0.005","8.143","0.005","90","0.005","116.802","0.005","90","0.005","1659.2","1.5","85","2","85","2","","","","","","","","6","C 1 c 1","C -2yc","9","Compound 5 cbab","","","- C12 H14 Cd N4 O7 S -","- C12 H14 Cd N4 O7 S -","- C48 H56 Cd4 N16 O28 S4 -","4","1","","Cory A. Black; Lyall R. Hanton; Mark D. Spicer","Probing Anion-π Interactions in 1-D Co(II), Ni(II), and Cd(II) Coordination Polymers Containing Flexible Pyrazine Ligands","Inorganic Chemistry","2007","46","","3669","3679","10.1021/ic070194k","","","0.71069","MoKα","","0.0184","0.0168","","","0.0357","0.0362","","","","","","1.051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308186","11.672","0.005","12.952","0.005","14.072","0.005","90","0.005","97.084","0.005","90","0.005","2111.1","1.4","113","2","113","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Compound 1 cbh","","","- C14 H16 Cl2 Co N6 O8 S -","- C14 H16 Cl2 Co N6 O8 S -","- C56 H64 Cl8 Co4 N24 O32 S4 -","4","1","","Cory A. Black; Lyall R. Hanton; Mark D. Spicer","Probing Anion-π Interactions in 1-D Co(II), Ni(II), and Cd(II) Coordination Polymers Containing Flexible Pyrazine Ligands","Inorganic Chemistry","2007","46","","3669","3679","10.1021/ic070194k","","","0.71069","MoKα","","0.0702","0.0438","","","0.1012","0.112","","","","","","1.045","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308187","8.8097","0.0004","14.2323","0.001","11.2912","0.0007","90","","92.835","0.004","90","","1413.98","0.15","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Compound 2 cbd","","","- C10 H10 N6 Ni O6 S -","- C10 H10 N6 Ni O6 S -","- C40 H40 N24 Ni4 O24 S4 -","4","1","","Cory A. Black; Lyall R. Hanton; Mark D. Spicer","Probing Anion-π Interactions in 1-D Co(II), Ni(II), and Cd(II) Coordination Polymers Containing Flexible Pyrazine Ligands","Inorganic Chemistry","2007","46","","3669","3679","10.1021/ic070194k","","x-ray","0.71073","MoKα","","0.0556","0.0397","","","0.0886","0.0942","","","","","","1.087","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308188","7.4224","0.0001","26.3251","0.0005","13.7056","0.0002","90","","116.653","0.001","90","","2393.45","0.07","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Compound 3.H2O cbe","","","- C12 H17 Cd2 N9 O14 S -","- C12 H17 Cd2 N9 O14 S -","- C48 H68 Cd8 N36 O56 S4 -","4","1","","Cory A. Black; Lyall R. Hanton; Mark D. Spicer","Probing Anion-π Interactions in 1-D Co(II), Ni(II), and Cd(II) Coordination Polymers Containing Flexible Pyrazine Ligands","Inorganic Chemistry","2007","46","","3669","3679","10.1021/ic070194k","","","0.71073","MoKα","","0.069","0.0565","","","0.132","0.1381","","","","","","1.214","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308189","7.018","0.005","7.443","0.005","19.42","0.005","87.17","0.005","88.412","0.005","85.967","0.005","1010.4","1","85","2","85","2","","","","","","","","7","P -1","-P 1","2","Compound 4.H2O cbt","","","- C12 H20 Cl2 Co N2 O12 S -","- C12 H20 Cl2 Co N2 O12 S -","- C24 H40 Cl4 Co2 N4 O24 S2 -","2","1","","Cory A. Black; Lyall R. Hanton; Mark D. Spicer","Probing Anion-π Interactions in 1-D Co(II), Ni(II), and Cd(II) Coordination Polymers Containing Flexible Pyrazine Ligands","Inorganic Chemistry","2007","46","","3669","3679","10.1021/ic070194k","","","0.71069","MoKα","","0.0582","0.043","","","0.1122","0.1209","","","","","","1.122","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308190","15.286","0.005","13.357","0.004","15.847","0.005","90","","100.134","0.004","90","","3185.1","1.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H41 N3 O2 Yb2 -","- C33 H41 N3 O2 Yb2 -","- C132 H164 N12 O8 Yb8 -","4","1","","Chengfu Pi; Ruiting Liu; Pengzhi Zheng; Zhenxia Chen; Xigeng Zhou","Selective Reaction Based on the Linked Diamido Ligands of Dinuclear Lanthanide Complexes","Inorganic Chemistry","2007","46","","5252","5259","10.1021/ic070203p","","","0.71073","MoKα","","0.0599","0.0374","","","0.0732","0.0797","","","","","","0.889","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308191","39.077","0.01","9.963","0.003","27.155","0.007","90","","90","","90","","10572","5","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C55 H77 N7 O Yb2 -","- C55 H74 N7 O Yb2 -","- C440 H592 N56 O8 Yb16 -","8","1","","Chengfu Pi; Ruiting Liu; Pengzhi Zheng; Zhenxia Chen; Xigeng Zhou","Selective Reaction Based on the Linked Diamido Ligands of Dinuclear Lanthanide Complexes","Inorganic Chemistry","2007","46","","5252","5259","10.1021/ic070203p","","","0.71073","MoKα","","0.1377","0.062","","","0.1086","0.1248","","","","","","1.034","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308192","28.357","0.008","28.357","0.008","14.586","0.006","90","","90","","90","","11729","7","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C60 H86 N6 O2 Yb2 -","- C60 H86 N6 O2 Yb2 -","- C480 H688 N48 O16 Yb16 -","8","0.5","","Chengfu Pi; Ruiting Liu; Pengzhi Zheng; Zhenxia Chen; Xigeng Zhou","Selective Reaction Based on the Linked Diamido Ligands of Dinuclear Lanthanide Complexes","Inorganic Chemistry","2007","46","","5252","5259","10.1021/ic070203p","","","0.71073","MoKα","","0.1041","0.0708","","","0.1451","0.1544","","","","","","1.262","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308193","13.573","0.004","13.804","0.005","16.113","0.005","104.092","0.004","113.479","0.004","103.867","0.005","2485.9","1.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C52 H70 N6 Yb2 -","- C52 H70 N6 Yb2 -","- C104 H140 N12 Yb4 -","2","1","","Chengfu Pi; Ruiting Liu; Pengzhi Zheng; Zhenxia Chen; Xigeng Zhou","Selective Reaction Based on the Linked Diamido Ligands of Dinuclear Lanthanide Complexes","Inorganic Chemistry","2007","46","","5252","5259","10.1021/ic070203p","","","0.71073","MoKα","","0.0536","0.0356","","","0.082","0.0892","","","","","","0.958","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308194","9.453","0.003","35.987","0.01","8.267","0.002","90","","103.094","0.004","90","","2739.2","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C59 H74 N6 Yb2 -","- C59 H66 N6 Yb2 -","- C118 H132 N12 Yb4 -","2","0.5","","Chengfu Pi; Ruiting Liu; Pengzhi Zheng; Zhenxia Chen; Xigeng Zhou","Selective Reaction Based on the Linked Diamido Ligands of Dinuclear Lanthanide Complexes","Inorganic Chemistry","2007","46","","5252","5259","10.1021/ic070203p","","","0.71073","MoKα","","0.0744","0.0532","","","0.1272","0.1404","","","","","","1.193","","","","has coordinates,has disorder","179119","2020-10-21","18:00:00",""
"4308195","16.6087","0.0002","17.4331","0.0001","18.413","0.0002","90","","102.542","0.001","90","","5204.1","0.09","297","2","297","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52 H32 Ag4 F12 O12 S4 -","- C52 H32 Ag4 F12 O12 S4 -","- C208 H128 Ag16 F48 O48 S16 -","4","0.5","","Adolf Gogoll; Prasad Polavarapu; Helena Grennberg","Enhanced Silver Ion Binding to a Rigid Bisarene Molecular Cleft with Formation of Nonpolar Pleated Sheets through Non-Ionic Intermolecular Forces","Inorganic Chemistry","2007","46","","5271","5275","10.1021/ic070222z","","","0.71073","MoKα","","0.0787","0.0465","","","0.1282","0.1504","","","","","","0.991","","","","has coordinates","270822","2021-11-23","08:36:47",""
"4308196","9.9659","0.0015","15.391","0.002","16.128","0.002","90","","90","","90","","2473.8","0.6","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H35 O2 P Pd -","- C26 H35 O2 P Pd -","- C104 H140 O8 P4 Pd4 -","4","1","","Joseph Kok-Peng Ng; Shuli Chen; Yongxin Li; Geok-Kheng Tan; Lip-Lin Koh; Pak-Hing Leung","Cyclopalladation of the Prochiral (Di-tert-butyl)(diphenylmethyl)phosphine: Kinetic Lability of the Corresponding (+)-Phosphapalladacyclic Pd-C Bond and the Reluctance of the Phosphine to Bind in a Monodentate Fashion","Inorganic Chemistry","2007","46","","5100","5109","10.1021/ic0702320","","","0.71073","MoKα","","0.0528","0.0434","","","0.0801","0.0838","","","","","","1.009","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308197","13.01","0.03","11.437","0.004","18.487","0.007","90","","104.374","0.009","90","","2665","6","200","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- F58 P6 Pb3 Xe11 -","- F58 P6 Pb3 Xe11 -","- F116 P12 Pb6 Xe22 -","2","0.25","","Tina Bunič; Melita Tramšek; Evgeny Goreshnik; Gašper Tavčar; Boris Žemva","Metal(II) Hexafluorophosphates(V) (M = Sr, Pb) Containing XeF2-Coordinated Metal Ions [M(XeF2)3](PF6)2, [Pb3(XeF2)11](PF6)6, and [Sr3(XeF2)10](PF6)6","Inorganic Chemistry","2007","46","","5276","5282","10.1021/ic0702365","","","0.71069","MoKα","","","0.0764","","","","0.1446","","","","","","1.052","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308198","12.232","0.006","11.947","0.006","10.898","0.005","90","","98.801","0.006","90","","1573.8","1.3","200","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- F18 P2 Sr Xe3 -","- F18 P2 Sr Xe3 -","- F72 P8 Sr4 Xe12 -","4","0.5","","Tina Bunič; Melita Tramšek; Evgeny Goreshnik; Gašper Tavčar; Boris Žemva","Metal(II) Hexafluorophosphates(V) (M = Sr, Pb) Containing XeF2-Coordinated Metal Ions [M(XeF2)3](PF6)2, [Pb3(XeF2)11](PF6)6, and [Sr3(XeF2)10](PF6)6","Inorganic Chemistry","2007","46","","5276","5282","10.1021/ic0702365","","","0.71069","MoKα","","","0.0332","","","","0.0613","","","","","","0.89","","","","has coordinates","273129","2022-02-23","10:11:34",""
"4308199","11.778","0.006","12.497","0.006","34.599","0.016","90","","95.574","0.004","90","","5069","4","200","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- F56 P6 Sr3 Xe10 -","- F56 P6 Sr3 Xe10 -","- F224 P24 Sr12 Xe40 -","4","0.5","","Tina Bunič; Melita Tramšek; Evgeny Goreshnik; Gašper Tavčar; Boris Žemva","Metal(II) Hexafluorophosphates(V) (M = Sr, Pb) Containing XeF2-Coordinated Metal Ions [M(XeF2)3](PF6)2, [Pb3(XeF2)11](PF6)6, and [Sr3(XeF2)10](PF6)6","Inorganic Chemistry","2007","46","","5276","5282","10.1021/ic0702365","","","0.71069","MoKα","","","0.0726","","","","0.1958","","","","","","1.074","","","","has coordinates","179119","2020-10-21","18:00:00",""
"4308200","12.2415","0.0011","12.0533","0.0008","10.9607","0.0009","90","","98.999","0.004","90","","1597.3","0.2","200","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- F18 P2 Pb Xe3 -","- F18 P2 Pb Xe3 -","- F72 P8 Pb4 Xe12 -","4","0.5","","Tina Bunič; Melita Tramšek; Evgeny Goreshnik; Gašper Tavčar; Boris Žemva","Metal(II) Hexafluorophosphates(V) (M = Sr, Pb) Containing XeF2-Coordinated Metal Ions [M(XeF2)3](PF6)2, [Pb3(XeF2)11](PF6)6, and [Sr3(XeF2)10](PF6)6","Inorganic Chemistry","2007","46","","5276","5282","10.1021/ic0702365","","","0.71069","MoKα","","","0.0639","","","","0.1616","","","","","","1.117","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308201","11.6777","0.0009","12.9078","0.0015","13.519","0.002","79.63","0.02","77.03","0.02","67.96","0.02","1830.3","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H50 Cu2 N3 O4.5 -","- C40 H49 Cu2 N3 O4.5 -","- C80 H98 Cu4 N6 O9 -","2","1","","Phalguni Chaudhuri; Rita Wagner; Thomas Weyhermüller","Ferromagnetic vs Antiferromagnetic Coupling in Bis(μ-phenoxo)dicopper(II) Complexes. Tuning of the Nature of Exchange Coupling by Remote Ligand Substituents","Inorganic Chemistry","2007","46","","5134","5136","10.1021/ic070238p","","","0.71073","MoKα","","0.0855","0.0523","","0.2619","0.1113","","","","1.026","1.069","1.069","","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308202","10.0842","0.0006","10.7271","0.0006","27.6144","0.0014","93.97","0.01","94.92","0.01","90","0.01","2969","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H94 Cu2 N2 O4 -","- C62 H94 Cu2 N2 O4 -","- C124 H188 Cu4 N4 O8 -","2","1","","Phalguni Chaudhuri; Rita Wagner; Thomas Weyhermüller","Ferromagnetic vs Antiferromagnetic Coupling in Bis(μ-phenoxo)dicopper(II) Complexes. Tuning of the Nature of Exchange Coupling by Remote Ligand Substituents","Inorganic Chemistry","2007","46","","5134","5136","10.1021/ic070238p","","","0.71073","MoKα","","0.0417","0.0351","","0.0932","0.0896","","","","1.067","1.095","1.095","","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308203","16.3911","0.0005","16.3911","0.0005","32.712","0.001","90","","90","","90","","8788.7","0.5","293","2","293","2","","","","","","","","2","I -4 2 d","I -4 2bw","122","","","","- Ba19 Li44 -","- Ba19 Li44 -","- Ba76 Li176 -","4","0.25","","Volodymyr Smetana; Volodymyr Babizhetskyy; Grigori V. Vajenine; Constantin Hoch; Arndt Simon","Double-Icosahedral Li Clusters in a New Binary Compound Ba19Li44: A Reinvestigation of the Ba-Li Phase Diagram","Inorganic Chemistry","2007","46","","5425","5428","10.1021/ic070249i","","","0.71073","MoKα","","0.096","0.049","","","0.0439","0.0484","","","","","","0.952","","","","has coordinates","273129","2022-02-23","10:11:34",""
"4308204","14.6465","0.0006","14.6465","0.0006","41.974","0.003","90","","90","","120","","7797.9","0.7","294","2","294","2","","","","","","","","5","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C26 H14 Cu4 N10 Zn -","- C26 H14 Cu4 N10 Zn -","- C312 H168 Cu48 N120 Zn12 -","12","1","","Shi-Shen Zhang; Shun-Ze Zhan; Mian Li; Rong Peng; Dan Li","A Rare Chiral Self-Catenated Network Formed by Two Cationic and One Anionic Frameworks","Inorganic Chemistry","2007","46","","4365","4367","10.1021/ic070250h","","","0.71073","MoKα","","0.0539","0.0439","","","0.0972","0.1018","","","","","","1.122","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308205","20.17","0.002","20.17","0.002","11.844","0.003","90","","90","","90","","4818.5","1.4","233","2","233","2","","","","","","","","4","P -4 21 c","P -4 2n","114","(1) [Sc(mu-ONep)2(ONep)]4","","","- C60 H132 O12 Sc4 -","- C60 H132 O12 Sc4 -","- C120 H264 O24 Sc8 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.0505","0.0452","","","0.1298","0.1328","","","","","","1.105","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308206","18.035","0.002","18.035","0.002","11.773","0.003","90","","90","","90","","3829.3","1.1","178","2","178","2","","","","","","","","4","P -4 21 c","P -4 2n","114","[Y(ONep)3]4","","","- C60 H132 O12 Y4 -","- C60 H132 O12 Y4 -","- C120 H264 O24 Y8 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.0705","0.0494","","","0.1089","0.1192","","","","","","1.027","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308207","20.704","0.0013","20.704","0.0013","11.9418","0.0015","90","","90","","90","","5118.9","0.8","203","2","203","2","","","","","","","","4","P -4 21 c","P -4 2n","114","(5) [Pr(mu-ONep)2(ONep)]4 *TOl","","","- C60 H132 O12 Pr4 -","- C60 H132 O12 Pr4 -","- C120 H264 O24 Pr8 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.0433","0.0395","","","0.1088","0.1107","","","","","","1.167","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308208","18.2051","0.0018","18.2051","0.0018","11.749","0.002","90","","90","","90","","3893.9","0.9","203","2","203","2","","","","","","","","4","P -4 21 c","P -4 2n","114","(7) [Sm(m-ONep)2(ONep)]4","","","- C60 H132 O12 Sm4 -","- C60 H132 O12 Sm4 -","- C120 H264 O24 Sm8 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.0782","0.0621","","","0.1152","0.1206","","","","","","1.15","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308209","20.4403","0.0008","20.4403","0.0008","12.0304","0.0009","90","","90","","90","","5026.4","0.5","203","2","203","2","","","","","","","","4","P -4 21 c","P -4 2n","114","(8) [Eu(m-ONep)2(ONep)]4","","","- C60 H132 Eu4 O12 -","- C60 H132 Eu4 O12 -","- C120 H264 Eu8 O24 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.0282","0.027","","","0.0763","0.077","","","","","","1.125","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308210","18.367","0.003","18.367","0.003","11.927","0.004","90","","90","","90","","4023.5","1.6","203","2","203","2","","","","","","","","4","P -4 21 c","P -4 2n","114","(9) [Gd(m-ONep)(ONep)]4","","","- C60 H132 Gd4 O12 -","- C60 H132 Gd4 O12 -","- C120 H264 Gd8 O24 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.0601","0.0454","","","0.1222","0.1363","","","","","","1.14","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308211","18.106","0.0006","18.106","0.0006","11.7612","0.0007","90","","90","","90","","3855.6","0.3","203","2","203","2","","","","","","","","4","P -4 21 c","P -4 2n","114","(10) [Tb(m-ONep)(ONep)]4","","","- C60 H132 O12 Tb4 -","- C60 H132 O12 Tb4 -","- C120 H264 O24 Tb8 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.0271","0.0257","","","0.0629","0.0639","","","","","","1.064","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308212","18.0322","0.0006","18.0322","0.0006","11.7258","0.0007","90","","90","","90","","3812.8","0.3","168","2","168","2","","","","","","","","4","P -4 21 c","P -4 2n","114","DyOnep","","","- C60 H132 Dy4 O12 -","- C60 H100 Dy4 O12 -","- C120 H200 Dy8 O24 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.0481","0.0385","","","0.0763","0.079","","","","","","1.187","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308213","18.04","0.0012","18.04","0.0012","11.7617","0.0015","90","","90","","90","","3827.7","0.6","203","2","203","2","","","","","","","","4","P -4 21 c","P -4 2n","114","(12) [Ho(m-ONep)2(ONep)]4","","","- C60 H132 Ho4 O12 -","- C60 H132 Ho4 O12 -","- C120 H264 Ho8 O24 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.066","0.0615","","","0.0976","0.0989","","","","","","1.285","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308214","20.1985","0.0014","20.1985","0.0014","12.0226","0.0016","90","","90","","90","","4905","0.8","168","2","168","2","","","","","","","","4","P -4 21 c","P -4 2n","114","(13) [Er(ONep)3]4","","","- C66 H146 Er4 O12 -","- C60 H132 Er4 O12 -","- C120 H264 Er8 O24 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.0477","0.041","","","0.146","0.1526","","","","","","1.102","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308215","20.2106","0.0017","20.2106","0.0017","12.045","0.002","90","","90","","90","","4920","1","203","2","203","2","","","","","","","","4","P -4 21 c","P -4 2n","114","(14)TmOnep","","","- C60 H132 O12 Tm4 -","- C60 H132 O12 Tm4 -","- C120 H264 O24 Tm8 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.0417","0.0359","","","0.1449","0.1535","","","","","","1.203","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308216","20.296","0.0009","20.296","0.0009","11.7989","0.001","90","","90","","90","","4860.3","0.5","168","2","168","2","","","","","","","","4","P -4 21 c","P -4 2n","114","(15) [Yb(ONep)(mu-ONep)2]4*(Hexane)","","","- C60 H132 O12 Yb4 -","- C60 H132 O12 Yb4 -","- C120 H264 O24 Yb8 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.0332","0.0303","","","0.0805","0.0818","","","","","","1.08","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308217","20.304","0.003","20.304","0.003","11.772","0.002","90","","90","","90","","4853","1.3","168","2","168","2","","","","","","","","4","P -4 21 c","P -4 2n","114","(16) [Lu(ONep)(mu-ONep)2]4*(Hexane)","","","- C66 H146 Lu4 O12 -","- C60 H132 Lu4 O12 -","- C120 H264 Lu8 O24 -","2","0.25","","Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey","Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles","Inorganic Chemistry","2007","46","","3705","3713","10.1021/ic070253u","","","0.71073","MoKα","","0.0354","0.0305","","","0.0753","0.077","","","","","","1.102","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308218","15.6698","0.0007","10.7097","0.0005","17.2643","0.0008","90","","90","","90","","2897.3","0.2","150","2","150","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C25 H33 Fe N3 Na O9 S -","- C25 H33 Fe N3 Na O9 S -","- C100 H132 Fe4 N12 Na4 O36 S4 -","4","1","","Ming-Li Tsai; Chung-Hung Hsieh; Wen-Feng Liaw","Dinitrosyl Iron Complexes (DNICs) Containing S/N/O Ligation: Transformation of Roussin's Red Ester into the Neutral {Fe(NO)2}10DNICs","Inorganic Chemistry","2007","46","","5110","5117","10.1021/ic0702567","","","0.71073","MoKα","","0.0555","0.0491","","","0.1186","0.1227","","","","","","1.057","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308219","9.2711","0.0005","21.5461","0.001","19.6333","0.001","90","","101.753","0.001","90","","3839.6","0.3","150","1","150","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C43 H34 Fe N3 O4 P2 S -","- C43 H34 Fe N3 O4 P2 S -","- C172 H136 Fe4 N12 O16 P8 S4 -","4","1","","Ming-Li Tsai; Chung-Hung Hsieh; Wen-Feng Liaw","Dinitrosyl Iron Complexes (DNICs) Containing S/N/O Ligation: Transformation of Roussin's Red Ester into the Neutral {Fe(NO)2}10DNICs","Inorganic Chemistry","2007","46","","5110","5117","10.1021/ic0702567","","","0.71073","MoKα","","0.0692","0.0551","","","0.1189","0.1253","","","","","","1.134","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308220","7.3947","0.0015","8.2739","0.0016","9.1533","0.0018","69.3","0.002","68.851","0.002","78.218","0.003","486.7","0.17","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C7 H4 Fe N3 O2 S2 -","- C7 H4 Fe N3 O2 S2 -","- C14 H8 Fe2 N6 O4 S4 -","2","1","","Ming-Li Tsai; Chung-Hung Hsieh; Wen-Feng Liaw","Dinitrosyl Iron Complexes (DNICs) Containing S/N/O Ligation: Transformation of Roussin's Red Ester into the Neutral {Fe(NO)2}10DNICs","Inorganic Chemistry","2007","46","","5110","5117","10.1021/ic0702567","","","0.71073","MoKα","","0.0338","0.0291","","","0.0732","0.0748","","","","","","1.014","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4308221","16.3003","0.001","15.7942","0.0009","15.9975","0.001","90","","120.085","0.001","90","","3563.7","0.4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H30 Fe N9 O2 P2 -","- C36 H30 Fe N9 O2 P2 -","- C144 H120 Fe4 N36 O8 P8 -","4","0.5","","Ming-Li Tsai; Chung-Hung Hsieh; Wen-Feng Liaw","Dinitrosyl Iron Complexes (DNICs) Containing S/N/O Ligation: Transformation of Roussin's Red Ester into the Neutral {Fe(NO)2}10DNICs","Inorganic Chemistry","2007","46","","5110","5117","10.1021/ic0702567","","","0.71073","MoKα","","0.0609","0.0484","","","0.1075","0.1133","","","","","","1.103","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308222","17.3194","0.0004","17.4086","0.0005","17.6044","0.0005","61.782","0.001","70.331","0.001","69.419","0.001","4284.1","0.2","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H37 O12 Os3 P Pt Sn -","- C36 H37 O12 Os3 P Pt Sn -","- C144 H148 O48 Os12 P4 Pt4 Sn4 -","4","2","","Richard D. Adams; Burjor Captain; Lei Zhu","Addition of Pt(PBut3) to Osmium-Tin Cluster Complexes","Inorganic Chemistry","2007","46","","4605","4611","10.1021/ic070261a","","","0.71073","MoKα","","0.047","0.0309","","","0.0754","0.0896","","","","","","1.002","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308223","9.2366","0.0012","14.6004","0.0018","46.617","0.006","90","","95.151","0.002","90","","6261.3","1.4","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C54 H70 O12 Os3 P2 Pt2 Sn -","- C54 H70 O12 Os3.08 P2 Pt2 Sn -","- C216 H280 O48 Os12.32 P8 Pt8 Sn4 -","4","1","","Richard D. Adams; Burjor Captain; Lei Zhu","Addition of Pt(PBut3) to Osmium-Tin Cluster Complexes","Inorganic Chemistry","2007","46","","4605","4611","10.1021/ic070261a","","","0.71073","MoKα","","0.0837","0.0579","","","0.1226","0.1344","","","","","","1.053","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308224","17.6264","0.0005","21.7527","0.0007","16.0451","0.0005","90","","98.01","0.001","90","","6092","0.3","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C53 H78 O11 Os3 P2 Pt Sn -","- C53 H78 O11 Os3 P2 Pt Sn -","- C212 H312 O44 Os12 P8 Pt4 Sn4 -","4","1","","Richard D. Adams; Burjor Captain; Lei Zhu","Addition of Pt(PBut3) to Osmium-Tin Cluster Complexes","Inorganic Chemistry","2007","46","","4605","4611","10.1021/ic070261a","","","0.71073","MoKα","","0.0584","0.0382","","","0.0989","0.1115","","","","","","1.044","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308225","12.0543","0.0003","26.575","0.0006","8.9479","0.0002","90","","90","","90","","2866.4","0.12","294","2","294","2","","","","","","","","8","P n n 2","P 2 -2n","34","","","","- C41 H54 Cl O16 Os4 P2 Pt2 Sn -","- C41 H54 Cl O16 Os4 P2 Pt2 Sn -","- C82 H108 Cl2 O32 Os8 P4 Pt4 Sn2 -","2","0.5","","Richard D. Adams; Burjor Captain; Lei Zhu","Addition of Pt(PBut3) to Osmium-Tin Cluster Complexes","Inorganic Chemistry","2007","46","","4605","4611","10.1021/ic070261a","","","0.71073","MoKα","","0.0241","0.0222","","","0.0575","0.0589","","","","","","1.042","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308226","29.1361","0.0013","29.1361","0.0013","55.364","0.003","90","","90","","120","","40702","3","150","","150","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C71 H51 Cl13 N11 O2 Ru2 -","- C71 H51 Cl13 N11 O2 Ru2 -","- C1278 H918 Cl234 N198 O36 Ru36 -","18","1","","Wei-Zhong Chen; Phillip E. Fanwick; Tong Ren","Dendronized Diruthenium Compounds via the Copper(I)-Catalyzed Click Reaction","Inorganic Chemistry","2007","46","","3429","3431","10.1021/ic0702623","","","0.71073","MO-Kα","","0.088","0.058","","","0.13","0.141","","","","","","1.019","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308227","13.026","0.002","14.733","0.002","21.529","0.004","90","","90","","90","","4131.7","1.1","296","2","296","2","","","","","","","","8","C 2 2 21","C 2c 2","20","","","","- C14 H52 Cl6 Co2 N10 O20 Pt S2 -","- C14 H44 Cl6 Co2 N10 O20 Pt S2 -","- C56 H176 Cl24 Co8 N40 O80 Pt4 S8 -","4","0.5","","Zentaro Matsumoto; Takashi Aridomi; Asako Igashira-Kamiyama; Tatsuya Kawamoto; Takumi Konno","Proton-Induced Cis-Trans Conversion of a Platinum(II) Center Coordinated by l-Cysteinatocobalt(III) Metalloligands","Inorganic Chemistry","2007","46","","2968","2970","10.1021/ic070265f","","","0.71069","MoKα","","0.0367","0.0332","","","0.0896","0.0917","","","","","","1.068","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308228","12.55","0.016","12.544","0.015","14.634","0.017","95.28","0.11","108.02","0.1","115.35","0.09","1911","5","200","1","200","1","","","","","","","","8","P 1","P 1","1","","","","- C28 H110 Cl8 Co4 N20 O33 Pt2 S4 -","- C28 H84 Cl8 Co4 N20 O33 Pt2 S4 -","- C28 H84 Cl8 Co4 N20 O33 Pt2 S4 -","1","1","","Zentaro Matsumoto; Takashi Aridomi; Asako Igashira-Kamiyama; Tatsuya Kawamoto; Takumi Konno","Proton-Induced Cis-Trans Conversion of a Platinum(II) Center Coordinated by l-Cysteinatocobalt(III) Metalloligands","Inorganic Chemistry","2007","46","","2968","2970","10.1021/ic070265f","","","0.71075","MoKα","","0.0419","0.0348","","","0.0943","0.1164","","","","","","0.998","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308229","27.215","0.01","27.215","0.01","14.548","0.008","90","","90","","120","","9331","7","200","2","200","2","","","","","","","","8","P 31 2 1","P 31 2""","152","","","","- C36 H160 Cl2 Co4 N20 O56 Pt2 S6 -","- C36 H88 Cl2 Co4 N20 O56 Pt2 S6 -","- C108 H264 Cl6 Co12 N60 O168 Pt6 S18 -","3","0.5","","Zentaro Matsumoto; Takashi Aridomi; Asako Igashira-Kamiyama; Tatsuya Kawamoto; Takumi Konno","Proton-Induced Cis-Trans Conversion of a Platinum(II) Center Coordinated by l-Cysteinatocobalt(III) Metalloligands","Inorganic Chemistry","2007","46","","2968","2970","10.1021/ic070265f","","","0.71075","MoKα","","0.0575","0.0421","","","0.1071","0.1089","","","","","","0.964","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308230","11.502","0.0009","13.5067","0.0011","15.4858","0.0014","90","","98.838","0.004","90","","2377.2","0.3","110","","110","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H29 Cu N2 S -","- C27 H29 Cu N2 S -","- C108 H116 Cu4 N8 S4 -","4","1","","Samuel A. Delp; Colleen Munro-Leighton; Laurel A. Goj; Magaly A. Ramírez; T. Brent Gunnoe; Jeffrey L. Petersen; Paul D. Boyle","Addition of S-H Bonds across Electron-Deficient Olefins Catalyzed by Well-Defined Copper(I) Thiolate Complexes","Inorganic Chemistry","2007","46","","2365","2367","10.1021/ic070268s","","","0.71073","MolybdenumKα","","0.042","0.036","","0.051","","0.05","","","","","","1.78","","","","has coordinates","192276","2020-10-21","18:00:00",""
"4308231","9.8888","0.0005","17.0894","0.001","20.8855","0.0012","82.285","0.001","83.321","0.001","89.663","0.001","3473.7","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","(IPr)Cu(SPh)","","","- C36.5 H45 Cu N2 S -","- C33 H41 Cu N2 S -","- C132 H164 Cu4 N8 S4 -","4","2","","Samuel A. Delp; Colleen Munro-Leighton; Laurel A. Goj; Magaly A. Ramírez; T. Brent Gunnoe; Jeffrey L. Petersen; Paul D. Boyle","Addition of S-H Bonds across Electron-Deficient Olefins Catalyzed by Well-Defined Copper(I) Thiolate Complexes","Inorganic Chemistry","2007","46","","2365","2367","10.1021/ic070268s","","","0.71073","MoKα","","0.0998","0.0509","","","0.1247","0.1398","","","","","","0.89","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308232","9.6738","0.0005","10.5848","0.0006","16.6355","0.0009","88.089","0.001","89.426","0.001","72.312","0.001","1621.97","0.15","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H43 Cu N2 S -","- C34 H43 Cu N2 S -","- C68 H86 Cu2 N4 S2 -","2","1","","Samuel A. Delp; Colleen Munro-Leighton; Laurel A. Goj; Magaly A. Ramírez; T. Brent Gunnoe; Jeffrey L. Petersen; Paul D. Boyle","Addition of S-H Bonds across Electron-Deficient Olefins Catalyzed by Well-Defined Copper(I) Thiolate Complexes","Inorganic Chemistry","2007","46","","2365","2367","10.1021/ic070268s","","","0.71073","MoKα","","0.0656","0.0498","","","0.1331","0.1447","","","","","","1.023","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308233","16.7295","0.0014","12.5227","0.0011","14.9627","0.0012","90","","90","","90","","3134.7","0.5","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C33 H43 Cu N2 S -","- C33 H43 Cu N2 S -","- C132 H172 Cu4 N8 S4 -","4","1","","Samuel A. Delp; Colleen Munro-Leighton; Laurel A. Goj; Magaly A. Ramírez; T. Brent Gunnoe; Jeffrey L. Petersen; Paul D. Boyle","Addition of S-H Bonds across Electron-Deficient Olefins Catalyzed by Well-Defined Copper(I) Thiolate Complexes","Inorganic Chemistry","2007","46","","2365","2367","10.1021/ic070268s","","","0.71073","MoKα","","0.0435","0.0341","","","0.085","0.0919","","","","","","1.023","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308234","10.7453","0.0007","19.7533","0.0013","16.1033","0.001","90","","106.24","0.001","90","","3281.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H45 Cu N2 S -","- C34 H45 Cu N2 S -","- C136 H180 Cu4 N8 S4 -","4","1","","Samuel A. Delp; Colleen Munro-Leighton; Laurel A. Goj; Magaly A. Ramírez; T. Brent Gunnoe; Jeffrey L. Petersen; Paul D. Boyle","Addition of S-H Bonds across Electron-Deficient Olefins Catalyzed by Well-Defined Copper(I) Thiolate Complexes","Inorganic Chemistry","2007","46","","2365","2367","10.1021/ic070268s","","","0.71073","MoKα","","0.1265","0.0551","","","0.1297","0.1578","","","","","","0.99","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308240","17.8638","0.001","11.0914","0.0006","16.4562","0.0009","90","","117.328","0.001","90","","2896.6","0.3","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H52 F N P2 Ru Si2 -","- C22 H52 F N P2 Ru Si2 -","- C88 H208 F4 N4 P8 Ru4 Si8 -","4","1","","Xiaofan Yang; Amy Walstrom; Nikolay Tsvetkov; Maren Pink; Kenneth G. Caulton","Influence of Chelate Substituents on the Structure and Spin State of Unsaturated [N(SiMe2CH2PtBu2)2]Ru-X","Inorganic Chemistry","2007","46","","4612","4616","10.1021/ic070283x","","","0.71073","MoKα","","0.0348","0.0282","","","0.0635","0.0678","","","","","","1.13","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308241","15.2508","0.0017","16.4829","0.0019","17.4","0.002","70.861","0.001","85.484","0.001","70.859","0.001","3901.7","0.8","141","2","141","2","","","","","","","","5","P -1","-P 1","2","","","","- C85 H102 N6 O2 Yb2 -","- C77 H56 N6 Yb2 -","- C154 H112 N12 Yb4 -","2","1","","Christin N. Carlson; Brian L. Scott; Richard L. Martin; Joe D. Thompson; David E. Morris; Kevin D. John","Control of Electronic and Magnetic Coupling via Bridging Ligand Geometry in a Bimetallic Ytterbocene Complex","Inorganic Chemistry","2007","46","","5013","5022","10.1021/ic0702973","","","0.71073","MoKα","","0.0904","0.0667","","","0.1821","0.1947","","","","","","1.134","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308242","10.0642","0.001","14.7923","0.0015","19.532","0.002","85.012","0.004","82.825","0.004","70.49","0.004","2716.2","0.5","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C54 H38 F9 Fe3 N2 Nd O6 -","- C54 H38 F9 Fe3 N2 Nd O6 -","- C108 H76 F18 Fe6 N4 Nd2 O12 -","2","1","","Yao-Feng Yuan; Thomas Cardinaels; Kyra Lunstroot; Kristof Van Hecke; Luc Van Meervelt; Christiane Görller-Walrand; Koen Binnemans; Peter Nockemann","Rare-Earth Complexes of Ferrocene-Containing Ligands: Visible-Light Excitable Luminescent Materials","Inorganic Chemistry","2007","46","","5302","5309","10.1021/ic070303v","","","1.54178","CuKα","","0.0991","0.0658","","","0.1526","0.1641","","","","","","0.943","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308243","14.5049","0.0002","15.6998","0.0002","15.9769","0.0003","119.147","0.001","114.041","0.001","90.289","0.001","2805.96","0.09","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C60 H36 F9 Fe2 N2 Nd O6 S3 -","- C60 H36 F9 Fe2 N2 Nd O6 S3 -","- C120 H72 F18 Fe4 N4 Nd2 O12 S6 -","2","1","","Yao-Feng Yuan; Thomas Cardinaels; Kyra Lunstroot; Kristof Van Hecke; Luc Van Meervelt; Christiane Görller-Walrand; Koen Binnemans; Peter Nockemann","Rare-Earth Complexes of Ferrocene-Containing Ligands: Visible-Light Excitable Luminescent Materials","Inorganic Chemistry","2007","46","","5302","5309","10.1021/ic070303v","","","1.54178","CuKα","","0.065","0.0547","","","0.1086","0.1147","","","","","","1.038","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308244","14.5049","0.0002","15.6998","0.0002","15.9769","0.0003","119.147","0.001","114.041","0.001","90.289","0.001","2805.96","0.09","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C60 H36 F9 Fe2 N2 Nd O6 S3 -","- C60 H36 F9 Fe2 N2 Nd O6 S3 -","- C120 H72 F18 Fe4 N4 Nd2 O12 S6 -","2","1","","Yao-Feng Yuan; Thomas Cardinaels; Kyra Lunstroot; Kristof Van Hecke; Luc Van Meervelt; Christiane Görller-Walrand; Koen Binnemans; Peter Nockemann","Rare-Earth Complexes of Ferrocene-Containing Ligands: Visible-Light Excitable Luminescent Materials","Inorganic Chemistry","2007","46","","5302","5309","10.1021/ic070303v","","","1.54178","CuKα","","0.0543","0.048","","","0.1178","0.1268","","","","","","1.088","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308245","9.446","0.0019","11.592","0.002","12.042","0.002","87.87","0.03","85.77","0.03","83.79","0.03","1306.7","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H36 Ag2 F6 N12 O6 S2 -","- C56 H36 Ag2 F6 N12 O6 S2 -","- C56 H36 Ag2 F6 N12 O6 S2 -","1","0.5","","Xiang-Ping Li; Jian-Yong Zhang; Mei Pan; Sheng-Run Zheng; Yu Liu; Cheng-Yong Su","Zero to Three Dimensional Increase of Silver(I) Coordination Assemblies Controlled by Deprotonation of 1,3,5-Tri(2-benzimidazolyl)benzene and Aggregation of Multinuclear Building Units","Inorganic Chemistry","2007","46","","4617","4625","10.1021/ic070309k","","","0.71073","MoKα","","0.0657","0.0489","","","0.1258","0.1364","","","","","","1.016","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308246","30.35","0.004","34.864","0.007","8.8405","0.0011","90","","90","","90","","9354","3","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C27 H16 Ag2 N6 -","- C27 H16 Ag2 N6 -","- C432 H256 Ag32 N96 -","16","1","","Xiang-Ping Li; Jian-Yong Zhang; Mei Pan; Sheng-Run Zheng; Yu Liu; Cheng-Yong Su","Zero to Three Dimensional Increase of Silver(I) Coordination Assemblies Controlled by Deprotonation of 1,3,5-Tri(2-benzimidazolyl)benzene and Aggregation of Multinuclear Building Units","Inorganic Chemistry","2007","46","","4617","4625","10.1021/ic070309k","","","0.71073","MoKα","","0.0543","0.0357","","","0.0684","0.0743","","","","","","1.086","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308247","15.153","0.009","25.681","0.014","24.53","0.014","90","","90","","90","","9546","9","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C110 H66 Ag9 N27 -","- C110 H66 Ag9 N27 -","- C440 H264 Ag36 N108 -","4","0.5","","Xiang-Ping Li; Jian-Yong Zhang; Mei Pan; Sheng-Run Zheng; Yu Liu; Cheng-Yong Su","Zero to Three Dimensional Increase of Silver(I) Coordination Assemblies Controlled by Deprotonation of 1,3,5-Tri(2-benzimidazolyl)benzene and Aggregation of Multinuclear Building Units","Inorganic Chemistry","2007","46","","4617","4625","10.1021/ic070309k","","","0.71073","MoKα","","0.1758","0.0864","","","0.1355","0.1614","","","","","","1.005","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308248","13.8011","0.0008","25.0364","0.0016","22.604","0.0015","90","","93.485","0.004","90","","7795.9","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C324 H206 Ag34 N72 O12 -","- C324 H182 Ag34 N72 O12 -","- C324 H182 Ag34 N72 O12 -","1","0.25","","Xiang-Ping Li; Jian-Yong Zhang; Mei Pan; Sheng-Run Zheng; Yu Liu; Cheng-Yong Su","Zero to Three Dimensional Increase of Silver(I) Coordination Assemblies Controlled by Deprotonation of 1,3,5-Tri(2-benzimidazolyl)benzene and Aggregation of Multinuclear Building Units","Inorganic Chemistry","2007","46","","4617","4625","10.1021/ic070309k","","","0.71073","MoKα","","0.174","0.0689","","","0.1331","0.1565","","","","","","1.006","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308249","11.9437","0.0004","9.6134","0.0003","31.1947","0.001","90","0.003","95.608","0.003","90","0.003","3564.6","0.2","170","2","170","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C33.5 H32 B Cl F4 Fe2 O4 P2 S2 -","- C33.5 H32 B Cl F4 Fe2 O4 P2 S2 -","- C134 H128 B4 Cl4 F16 Fe8 O16 P8 S8 -","4","1","","Salah Ezzaher; Jean-François Capon; Frédéric Gloaguen; François Y. Pétillon; Philippe Schollhammer; Jean Talarmin; Roger Pichon; Nelly Kervarec","Evidence for the Formation of Terminal Hydrides by Protonation of an Asymmetric Iron Hydrogenase Active Site Mimic","Inorganic Chemistry","2007","46","","3426","3428","10.1021/ic0703124","","","0.71073","MoKα","","0.0534","0.0386","","","0.0881","0.094","","","","","","1.058","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4308250","13.1745","0.0009","18.5992","0.0012","22.5851","0.0013","90","","92.244","0.003","90","","5529.9","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- Cu6 N12 Na14 O105 Si2 W18 -","- Cu6 N12 Na14 O105 Si2 W18 -","- Cu12 N24 Na28 O210 Si4 W36 -","2","0.5","","Céline Pichon; Pierre Mialane; Anne Dolbecq; Jérôme Marrot; Eric Rivière; Bineta Keita; Louis Nadjo; Francis Sécheresse","Characterization and Electrochemical Properties of Molecular Icosanuclear and Bidimensional Hexanuclear Cu(II) Azido Polyoxometalates","Inorganic Chemistry","2007","46","","5292","5301","10.1021/ic070313w","","","0.71073","MoKα","","0.0484","0.0418","","","0.1203","0.1372","","","","","","1.23","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308251","25.7938","0.0003","25.7938","0.0003","22.0081","0.0005","90","","90","","90","","14642.4","0.4","293","2","293","2","","","","","","","","7","I 4/m","-I 4","87","","","","- Cu20 K12 N18 Na8 O237.25 P8 W48 -","- Cu20 K12 N18 Na8 O237.25 P8 W48 -","- Cu40 K24 N36 Na16 O474.5 P16 W96 -","2","0.125","","Céline Pichon; Pierre Mialane; Anne Dolbecq; Jérôme Marrot; Eric Rivière; Bineta Keita; Louis Nadjo; Francis Sécheresse","Characterization and Electrochemical Properties of Molecular Icosanuclear and Bidimensional Hexanuclear Cu(II) Azido Polyoxometalates","Inorganic Chemistry","2007","46","","5292","5301","10.1021/ic070313w","","","0.71073","MoKα","","0.0663","0.0413","","","0.1191","0.1609","","","","","","1.274","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308252","18.0588","0.0005","19.8587","0.0006","25.4792","0.0008","90","","90","","90","","9137.5","0.5","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C120 H188 Cl20 Cr28 N36 O56 -","- C120 H188 Cl20 Cr28 N36 O56 -","- C240 H376 Cl40 Cr56 N72 O112 -","2","0.25","","Rachel Shaw; Rebecca H. Laye; Leigh F. Jones; David M. Low; Caytie Talbot-Eeckelaers; Qiang Wei; Constantinos J. Milios; Simon Teat; Madeleine Helliwell; James Raftery; Marco Evangelisti; Marco Affronte; David Collison; Euan K. Brechin; Eric J. L. McInnes","1,2,3-Triazolate-Bridged Tetradecametallic Transition Metal Clusters [M14(L)6O6(OMe)18X6] (M = FeIII, CrIII and VIII/IV) and Related Compounds: Ground-State Spins Ranging from S=0 to S=25 and Spin-Enhanced Magnetocaloric Effect","Inorganic Chemistry","2007","46","","4968","4978","10.1021/ic070320k","","","0.71073","MoKα","","0.0903","0.0542","","","0.1456","0.1693","","","","","","1.063","","","","has coordinates,has disorder","194037","2020-10-21","18:00:00",""
"4308253","13.049","0.002","17.069","0.003","16.566","0.003","90","","108.139","0.002","90","","3506.4","1","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H83 Cl6 Fe14 N18 O28.5 -","- C34 H66 Cl6 Fe14 N18 O28.5 -","- C68 H132 Cl12 Fe28 N36 O57 -","2","0.5","","Rachel Shaw; Rebecca H. Laye; Leigh F. Jones; David M. Low; Caytie Talbot-Eeckelaers; Qiang Wei; Constantinos J. Milios; Simon Teat; Madeleine Helliwell; James Raftery; Marco Evangelisti; Marco Affronte; David Collison; Euan K. Brechin; Eric J. L. McInnes","1,2,3-Triazolate-Bridged Tetradecametallic Transition Metal Clusters [M14(L)6O6(OMe)18X6] (M = FeIII, CrIII and VIII/IV) and Related Compounds: Ground-State Spins Ranging from S=0 to S=25 and Spin-Enhanced Magnetocaloric Effect","Inorganic Chemistry","2007","46","","4968","4978","10.1021/ic070320k","","","0.6893","synchrotron","","0.0755","0.0492","","","0.1188","0.1335","","","","","","1.027","","","","has coordinates,has disorder","194037","2020-10-21","18:00:00",""
"4308254","21.848","0.002","24.513","0.002","17.335","0.001","90","","90","","90","","9283.9","1.3","293","2","100","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C56 H58 Cl8 Fe14 N21 Na0 O25 -","- C56 H58 Cl8 Fe14 N21 O25 -","- C224 H232 Cl32 Fe56 N84 O100 -","4","0.5","","Rachel Shaw; Rebecca H. Laye; Leigh F. Jones; David M. Low; Caytie Talbot-Eeckelaers; Qiang Wei; Constantinos J. Milios; Simon Teat; Madeleine Helliwell; James Raftery; Marco Evangelisti; Marco Affronte; David Collison; Euan K. Brechin; Eric J. L. McInnes","1,2,3-Triazolate-Bridged Tetradecametallic Transition Metal Clusters [M14(L)6O6(OMe)18X6] (M = FeIII, CrIII and VIII/IV) and Related Compounds: Ground-State Spins Ranging from S=0 to S=25 and Spin-Enhanced Magnetocaloric Effect","Inorganic Chemistry","2007","46","","4968","4978","10.1021/ic070320k","","","0.71073","MoKα","","0.1658","0.073","","","0.2084","0.2426","","","","","","0.949","","","","has coordinates","194037","2020-10-21","18:00:00",""
"4308255","13.3","0.0019","14.938","0.002","15.264","0.002","66.155","0.002","75.976","0.002","76.399","0.002","2658.7","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C67.3 H107.2 Cl2.1 N18 O29.2 V14 -","- C67.3 H48 Cl2.1 N18 O29.2 V14 -","- C67.3 H48 Cl2.1 N18 O29.2 V14 -","1","0.5","","Rachel Shaw; Rebecca H. Laye; Leigh F. Jones; David M. Low; Caytie Talbot-Eeckelaers; Qiang Wei; Constantinos J. Milios; Simon Teat; Madeleine Helliwell; James Raftery; Marco Evangelisti; Marco Affronte; David Collison; Euan K. Brechin; Eric J. L. McInnes","1,2,3-Triazolate-Bridged Tetradecametallic Transition Metal Clusters [M14(L)6O6(OMe)18X6] (M = FeIII, CrIII and VIII/IV) and Related Compounds: Ground-State Spins Ranging from S=0 to S=25 and Spin-Enhanced Magnetocaloric Effect","Inorganic Chemistry","2007","46","","4968","4978","10.1021/ic070320k","","","0.6888","synchrotron","","0.0713","0.0579","","","0.1945","0.2099","","","","","","1.071","","","","has coordinates,has disorder","194037","2020-10-21","18:00:00",""
"4308256","11.493","0.003","12.151","0.004","15.795","0.004","83.39","0.006","72.027","0.005","61.945","0.004","1850.4","0.9","223","2","223","2","","","","","","","","9","P -1","-P 1","2","","","","- C56 H62 Cl6 Co2 Gd N13 O15 P2 S2 -","- C56 H62 Cl6 Co2 Gd N13 O15 P2 S2 -","- C56 H62 Cl6 Co2 Gd N13 O15 P2 S2 -","1","0.5","","Vadapalli Chandrasekhar; Balasubramanian Murugesa Pandian; Ramachandran Azhakar; Jagadese J. Vittal; Rodolphe Clérac","Linear Trinuclear Mixed-Metal CoII-GdIII-CoII Single-Molecule Magnet: [L2Co2Gd][NO3].2CHCl3 (LH3= (S)P[N(Me)NCH-C6H3-2-OH-3-OMe]3)","Inorganic Chemistry","2007","46","","5140","5142","10.1021/ic070321c","","","0.71073","MoKα","","0.0812","0.0641","","","0.1825","0.1933","","","","","","1.085","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308257","19.7272","0.001","18.8114","0.001","18.5113","0.001","90","","117.852","0.01","90","","6073.7","0.8","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[ReOCl(PhCONCSNPhMe)2]","Chlorooxobis(N-benzoyl-N'-phenyl-N'-methylthioureato-O,S)rhenium(V)","","- C30 H26 Cl N4 O3 Re S2 -","- C30 H26 Cl N4 O3 Re S2 -","- C240 H208 Cl8 N32 O24 Re8 S16 -","8","2","","Nguyen Hung Huy; Ulrich Abram","Rhenium and Technetium Complexes with N,N-Dialkyl-N'-benzoylthioureas","Inorganic Chemistry","2007","46","","5310","5319","10.1021/ic070323x","","","0.71073","MoKα","","0.1072","0.0489","","","0.0975","0.1263","","","","","","0.946","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4308258","10.763","0.001","11.207","0.001","16.926","0.001","92.48","0.01","99.99","0.01","114.8","0.01","1809.8","0.3","200","2","200","2","","","","","","","","7","P -1","-P 1","2","TcOCl(PhCONCSPh2)2","chlorooxobis(N-benzoyl-N',N'-diphenylthioureato-O,S)technetium(V)","","- C40 H30 Cl N4 O3 S2 Tc -","- C40 H30 Cl N4 O3 S2 Tc -","- C80 H60 Cl2 N8 O6 S4 Tc2 -","2","1","","Nguyen Hung Huy; Ulrich Abram","Rhenium and Technetium Complexes with N,N-Dialkyl-N'-benzoylthioureas","Inorganic Chemistry","2007","46","","5310","5319","10.1021/ic070323x","","","0.71069","MoKα","","0.1387","0.0639","","","0.1104","0.1474","","","","","","0.929","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4308259","11.73","0.001","19.891","0.001","16.864","0.002","90","","130.8","0.01","90","","2978.6","0.6","200","2","200","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","ReOCl2PPh3(PhCONCSMor)","TriphenylphosphineOxodichloro(N-benzoyl-N'-morpholinylthioreato-O,S)rhenium(V)","","- C30 H28 Cl2 N2 O3 P Re S -","- C30 H28 Cl2 N2 O3 P Re S -","- C120 H112 Cl8 N8 O12 P4 Re4 S4 -","4","1","","Nguyen Hung Huy; Ulrich Abram","Rhenium and Technetium Complexes with N,N-Dialkyl-N'-benzoylthioureas","Inorganic Chemistry","2007","46","","5310","5319","10.1021/ic070323x","","","0.71073","MoKα","","0.0366","0.0284","","","0.0644","0.0667","","","","","","1.042","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308260","12.689","0.001","13.334","0.001","15.004","0.001","77.87","0.01","85.38","0.01","74.62","0.01","2392.2","0.3","200","2","200","2","","","","","","","","8","P -1","-P 1","2","ReCl2(PPh3)2(L-Ph2)","Dichloro(N-benzoyl-N',N'-diphenylthioureato-O,S)bis(triphenylphosphine)rhenium(III)","","- C56 H45 Cl2 N2 O P2 Re S -","- C56 H45 Cl2 N2 O P2 Re S -","- C112 H90 Cl4 N4 O2 P4 Re2 S2 -","2","1","","Nguyen Hung Huy; Ulrich Abram","Rhenium and Technetium Complexes with N,N-Dialkyl-N'-benzoylthioureas","Inorganic Chemistry","2007","46","","5310","5319","10.1021/ic070323x","","","0.71073","MoKα","","0.0471","0.0353","","","0.0851","0.1004","","","","","","0.978","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4308261","31.573","0.002","11.338","0.001","16.041","0.001","90","","109.85","0.01","90","","5401.1","0.8","200","2","200","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","ReO(OMe)(PhCONCSNEt2)2","Bis(N-benzoyl-N',N'-diethylthioureato-O,S)methoxooxorhenium(V)","","- C25 H33 Cl0 N4 O4 P0 Re S2 -","- C25 H33 N4 O4 Re S2 -","- C200 H264 N32 O32 Re8 S16 -","8","1","","Nguyen Hung Huy; Ulrich Abram","Rhenium and Technetium Complexes with N,N-Dialkyl-N'-benzoylthioureas","Inorganic Chemistry","2007","46","","5310","5319","10.1021/ic070323x","","","0.71073","MoKα","","0.0654","0.0387","","","0.073","0.0786","","","","","","0.95","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4308262","20.955","0.009","15.933","0.009","16.66","0.01","90","","108.5","0.05","90","","5275","5","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Re2O3(PhCONCSCEt2)4","mu-oxo{bis(N-benzoyl-N'N'-diethylthioureato)oxorhenium(V)}","","- C48 H60 N8 O7 Re2 S4 -","- C48 H60 N8 O7 Re2 S4 -","- C192 H240 N32 O28 Re8 S16 -","4","1","","Nguyen Hung Huy; Ulrich Abram","Rhenium and Technetium Complexes with N,N-Dialkyl-N'-benzoylthioureas","Inorganic Chemistry","2007","46","","5310","5319","10.1021/ic070323x","","","0.71073","MoKα","","0.1237","0.0782","","","0.1123","0.1225","","","","","","1.032","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4308263","12.729","0.005","13.286","0.005","17.181","0.005","73.34","0.01","80.07","0.01","89.27","0.01","2739.9","1.7","200","2","200","2","","","","","","","","8","P -1","-P 1","2","TcClPPh3(PhCONCSNPh2)","Bis(N-benzoyl-N',N-diphenylthioureato)chloro(triphenylphosphine)technetium(III) x MeOH","","- C59 H49 Cl N4 O3 P S2 Tc -","- C59 H49 Cl N4 O3 P S2 Tc -","- C118 H98 Cl2 N8 O6 P2 S4 Tc2 -","2","1","","Nguyen Hung Huy; Ulrich Abram","Rhenium and Technetium Complexes with N,N-Dialkyl-N'-benzoylthioureas","Inorganic Chemistry","2007","46","","5310","5319","10.1021/ic070323x","","","0.71069","MoKα","","0.1619","0.0695","","","0.0947","0.1185","","","","","","0.839","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4308264","12.999","0.001","13.635","0.001","16.615","0.002","93.08","0.01","106.8","0.01","95.57","0.01","2795.5","0.5","200","2","200","2","","","","","","","","7","P -1","-P 1","2","Tc(PhCONCSNPh2)3","Tris(N-benzoyl-N',N'-diphenylthioureato_O,S)technetium(III) x MeOH","","- C61 H49 Cl0 N6 O4 S3 Tc -","- C61 H49 N6 O4 S3 Tc -","- C122 H98 N12 O8 S6 Tc2 -","2","1","","Nguyen Hung Huy; Ulrich Abram","Rhenium and Technetium Complexes with N,N-Dialkyl-N'-benzoylthioureas","Inorganic Chemistry","2007","46","","5310","5319","10.1021/ic070323x","","","0.71073","MoKα","","0.1291","0.0588","","","0.1335","0.1697","","","","","","0.888","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4308265","18.4773","0.0006","7.941","0.0003","22.4534","0.0007","90","","98.494","0.002","90","","3258.41","0.19","100","2","100","2","","","","","","","","6","P 1 n 1","P -2yac","7","CoHA-BPDS-DMSO","","","- C40 H82 Co2 N12 O25 S8 -","- C40 H72 Co2 N12 O25 S8 -","- C80 H144 Co4 N24 O50 S16 -","2","1","","Xin-Yi Wang; Rachelle Justice; Slavi C. Sevov","Hydrogen-Bonded Metal-Complex Sulfonate (MCS) Inclusion Compounds: Effect of the Guest Molecule on the Host Framework","Inorganic Chemistry","2007","46","","4626","4631","10.1021/ic070324p","","","0.71073","MoKα","","0.048","0.046","","","0.1362","0.1415","","","","","","1.158","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308266","30.0959","0.0008","15.3393","0.0005","12.8545","0.0004","90","","101.28","0.002","90","","5819.6","0.3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","CoHA-BPDS-DMF","","","- C39 H71 Co2 N13 O21 S6 -","- C39 H36 Co2 N13 O21 S6 -","- C156 H144 Co8 N52 O84 S24 -","4","0.5","","Xin-Yi Wang; Rachelle Justice; Slavi C. Sevov","Hydrogen-Bonded Metal-Complex Sulfonate (MCS) Inclusion Compounds: Effect of the Guest Molecule on the Host Framework","Inorganic Chemistry","2007","46","","4626","4631","10.1021/ic070324p","","","0.71073","MoKα","","0.0686","0.0522","","","0.143","0.1524","","","","","","1.042","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308267","30.2942","0.0011","15.0722","0.0006","13.1166","0.0005","90","","97.896","0.002","90","","5932.3","0.4","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","CoHA-BPDS-piperadine","","","- C41 H75 Co2 N13 O20 S6 -","- C41 H52 Co2 N13 O20 S6 -","- C164 H208 Co8 N52 O80 S24 -","4","1","","Xin-Yi Wang; Rachelle Justice; Slavi C. Sevov","Hydrogen-Bonded Metal-Complex Sulfonate (MCS) Inclusion Compounds: Effect of the Guest Molecule on the Host Framework","Inorganic Chemistry","2007","46","","4626","4631","10.1021/ic070324p","","","0.71073","MoKα","","0.0499","0.042","","","0.1133","0.1205","","","","","","1.081","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308268","7.8111","0.0001","13.1879","0.0002","15.6203","0.0003","101.135","0.001","93.187","0.001","96.474","0.001","1563.77","0.04","100","2","100","2","","","","","","","","6","P -1","-P 1","2","CoHA-BPDS-Acetone","","","- C42 H80 Co2 N12 O24 S6 -","- C42 H80 Co2 N12 O24 S6 -","- C42 H80 Co2 N12 O24 S6 -","1","0.5","","Xin-Yi Wang; Rachelle Justice; Slavi C. Sevov","Hydrogen-Bonded Metal-Complex Sulfonate (MCS) Inclusion Compounds: Effect of the Guest Molecule on the Host Framework","Inorganic Chemistry","2007","46","","4626","4631","10.1021/ic070324p","","","0.71073","MoKα","","0.044","0.0371","","","0.1008","0.1044","","","","","","1.075","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308269","7.7896","0.0003","13.1339","0.0005","15.6698","0.0005","100.318","0.002","93.647","0.002","96.525","0.002","1561.21","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","CoHA-BPDS-MeCN","","","- C40 H74 Co2 N14 O22 S6 -","- C40 H64 Co2 N14 O22 S6 -","- C40 H64 Co2 N14 O22 S6 -","1","0.5","","Xin-Yi Wang; Rachelle Justice; Slavi C. Sevov","Hydrogen-Bonded Metal-Complex Sulfonate (MCS) Inclusion Compounds: Effect of the Guest Molecule on the Host Framework","Inorganic Chemistry","2007","46","","4626","4631","10.1021/ic070324p","","","0.71073","MoKα","","0.0851","0.0715","","","0.1862","0.1902","","","","","","1.124","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308270","7.8222","0.0004","13.1884","0.0006","15.5464","0.0007","101.091","0.002","93.105","0.002","96.714","0.002","1558.21","0.13","100","2","100","2","","","","","","","","6","P -1","-P 1","2","CoHA-BPDS-THF","","","- C44 H84 Co2 N12 O24 S6 -","- C44 H68 Co2 N12 O24 S6 -","- C44 H68 Co2 N12 O24 S6 -","1","0.5","","Xin-Yi Wang; Rachelle Justice; Slavi C. Sevov","Hydrogen-Bonded Metal-Complex Sulfonate (MCS) Inclusion Compounds: Effect of the Guest Molecule on the Host Framework","Inorganic Chemistry","2007","46","","4626","4631","10.1021/ic070324p","","","0.71073","MoKα","","0.0835","0.0639","","","0.1581","0.1636","","","","","","1.123","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308271","30.175","0.003","21.108","0.003","16.762","0.002","90","","123.188","0.002","90","","8934.8","1.9","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","PCN-5","","","- C48 H30 N6 Ni3 O16 -","- C48 H24 N6 Ni3 O16 -","- C192 H96 N24 Ni12 O64 -","4","0.5","","Shengqian Ma; Xi-Sen Wang; Erika S. Manis; Christopher D. Collier; Hong-Cai Zhou","Metal-Organic Framework Based on a Trinickel Secondary Building Unit Exhibiting Gas-Sorption Hysteresis","Inorganic Chemistry","2007","46","","3432","3434","10.1021/ic070338v","","","0.71073","MoKα","","0.0622","0.0476","","","0.1256","0.1304","","","","","","0.949","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308272","9.9176","0.0004","17.9965","0.0006","20.9666","0.0008","90","","92.445","0.002","90","","3738.8","0.2","243","2","243","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C F20 O4 Te4 -","- C0.99925 F20 O4 Te3.997 -","- C7.994 F160 O32 Te31.976 -","8","4","","Matthew D. Moran; Hélène P. A. Mercier; Gary J. Schrobilgen","Synthesis and Structural Characterization of C(OTeF5)4 and a Comparative Structural Study of the Isoelectronic B(OTeF5)4- Anion","Inorganic Chemistry","2007","46","","5034","5045","10.1021/ic700362g","","","0.71073","MoKα","","0.0852","0.053","","","0.0879","0.0944","","","","","","1.28","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308273","17.9521","0.001","7.7195","0.0004","16.6623","0.001","90","","94.963","0.002","90","","2300.4","0.2","273","2","273","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C4 H12 B F20 N O4 Te4 -","- C4 H12 B F20 N O4 Te4 -","- C16 H48 B4 F80 N4 O16 Te16 -","4","1","","Matthew D. Moran; Hélène P. A. Mercier; Gary J. Schrobilgen","Synthesis and Structural Characterization of C(OTeF5)4 and a Comparative Structural Study of the Isoelectronic B(OTeF5)4- Anion","Inorganic Chemistry","2007","46","","5034","5045","10.1021/ic700362g","","","0.71073","MoKα","","0.0341","0.0259","","","0.04","0.0419","","","","","","1.012","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308274","14.8324","0.0007","14.613","0.0007","23.0893","0.0011","90","","90","","90","","5004.5","0.4","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C6 H24 B2 Mg N2 -","- C6 H24 B2 Mg N2 -","- C96 H384 B32 Mg16 N32 -","16","2","","Grigorii L. Soloveichik; Matthew Andrus; Emil B. Lobkovsky","Magnesium Borohydride Complexed by Tetramethylethylenediamine","Inorganic Chemistry","2007","46","","3790","3791","10.1021/ic700376n","","","0.71073","MoKα","","0.0648","0.0386","","","0.1026","0.1129","","","","","","1.051","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308275","13.2493","0.0005","14.5646","0.0005","18.9955","0.0007","90","","93.654","0.002","90","","3658.1","0.2","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(DIPP-nacnac)YbH.THF dimer","","","- C22 H33.33 N1.33 O0.67 Yb0.67 -","- C22 H33.3333 N1.33333 O0.666667 Yb0.666667 -","- C132 H200 N8 O4 Yb4 -","6","1.5","","Christian Ruspic; Jan Spielmann; Sjoerd Harder","Syntheses and Structures of Ytterbium(II) Hydride and Hydroxide Complexes: Similarities and Differences with Their Calcium Analogues","Inorganic Chemistry","2007","46","","5320","5326","10.1021/ic700403d","","","0.71073","MoKα","","0.0384","0.0282","","","0.0671","0.0705","","","","","","1.077","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308276","12.6955","0.0015","12.7651","0.0015","13.3877","0.0014","97.95","0.007","114.063","0.007","111.239","0.007","1739.1","0.4","183","2","183","2","","","","","","","","5","P -1","-P 1","2","DIPP-nacnac-Yb(OH)THF-dimer (toluene)0.5","","","- C36.5 H54 N2 O2 Yb -","- C36.5 H54 N2 O2 Yb -","- C73 H108 N4 O4 Yb2 -","2","1","","Christian Ruspic; Jan Spielmann; Sjoerd Harder","Syntheses and Structures of Ytterbium(II) Hydride and Hydroxide Complexes: Similarities and Differences with Their Calcium Analogues","Inorganic Chemistry","2007","46","","5320","5326","10.1021/ic700403d","","","0.71073","MoKα","","0.0525","0.0475","","","0.1354","0.1455","","","","","","1.106","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308277","4.725","0.0016","4.725","0.0016","4.725","0.0016","90","","90","","90","","105.49","0.06","293","2","293","2","","","","","","","","2","P m -3 m","-P 4 2 3","221","trinatrium nitride","","","- N Na3 -","- N Na3 -","- N Na3 -","1","0.0208333","","Grigori V. Vajenine","Plasma-Assisted Synthesis and Properties of Na3N","Inorganic Chemistry","2007","46","","5146","5148","10.1021/ic700406q","","","0.56086","AgKα","","0.0451","0.0378","","","0.0837","0.0886","","","","","","1.205","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308278","10.119","0.0004","9.9954","0.0003","26.599","0.0008","91.161","0.005","90.02","0.005","99.519","0.005","2652.71","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H40 N4 Ni -","- C28 H40 N4 Ni -","- C112 H160 N16 Ni4 -","4","2","","Nicoleta Muresan; Krzysztof Chlopek; Thomas Weyhermüller; Frank Neese; Karl Wieghardt","Bis(α-diimine)nickel Complexes: Molecular and Electronic Structure of Three Members of the Electron-Transfer Series [Ni(L)2]z (z= 0, 1+, 2+) (L = 2-Phenyl-1,4-bis(isopropyl)-1,4-diazabutadiene). A Combined Experimental and Theoretical Study","Inorganic Chemistry","2007","46","","5327","5337","10.1021/ic700407m","","","0.71073","MoKα","","0.0805","0.0504","","","0.0861","0.0969","","","","","","1.058","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308279","9.1845","0.0003","9.1845","0.0003","30.6806","0.0012","90","","90","","120","","2241.33","0.14","100","2","100","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C28 H40 F6 N4 Ni P -","- C28 H40 F6 N4 Ni P -","- C84 H120 F18 N12 Ni3 P3 -","3","0.5","","Nicoleta Muresan; Krzysztof Chlopek; Thomas Weyhermüller; Frank Neese; Karl Wieghardt","Bis(α-diimine)nickel Complexes: Molecular and Electronic Structure of Three Members of the Electron-Transfer Series [Ni(L)2]z (z= 0, 1+, 2+) (L = 2-Phenyl-1,4-bis(isopropyl)-1,4-diazabutadiene). A Combined Experimental and Theoretical Study","Inorganic Chemistry","2007","46","","5327","5337","10.1021/ic700407m","","","0.71073","MoKα","","0.0632","0.0536","","","0.1197","0.125","","","","","","1.081","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308280","18.8774","0.0005","9.7865","0.0002","18.6485","0.0005","90","","106.408","0.003","90","","3304.89","0.15","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H40 F12 N4 Ni P2 -","- C28 H40 F12 N4 Ni P2 -","- C112 H160 F48 N16 Ni4 P8 -","4","1","","Nicoleta Muresan; Krzysztof Chlopek; Thomas Weyhermüller; Frank Neese; Karl Wieghardt","Bis(α-diimine)nickel Complexes: Molecular and Electronic Structure of Three Members of the Electron-Transfer Series [Ni(L)2]z (z= 0, 1+, 2+) (L = 2-Phenyl-1,4-bis(isopropyl)-1,4-diazabutadiene). A Combined Experimental and Theoretical Study","Inorganic Chemistry","2007","46","","5327","5337","10.1021/ic700407m","","","0.71073","MoKα","","0.069","0.0418","","","0.0845","0.0948","","","","","","1.018","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308281","12.5937","0.0004","19.4208","0.0006","18.12","0.0006","90","","109.208","0.005","90","","4185.1","0.3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C36 H56 F12 N4 Ni O2 P2 -","- C36.004 H56.008 F12 N4 Ni O2.001 P2 -","- C144.016 H224.032 F48 N16 Ni4 O8.004 P8 -","4","1","","Nicoleta Muresan; Krzysztof Chlopek; Thomas Weyhermüller; Frank Neese; Karl Wieghardt","Bis(α-diimine)nickel Complexes: Molecular and Electronic Structure of Three Members of the Electron-Transfer Series [Ni(L)2]z (z= 0, 1+, 2+) (L = 2-Phenyl-1,4-bis(isopropyl)-1,4-diazabutadiene). A Combined Experimental and Theoretical Study","Inorganic Chemistry","2007","46","","5327","5337","10.1021/ic700407m","","","0.71073","MoKα","","0.0821","0.064","","","0.154","0.1648","","","","","","1.073","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308282","22.381","0.002","11.269","0.0007","19.0866","0.0018","90","","119.119","0.004","90","","4205.4","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H28 Ag4 Mo8 N12 O26 -","- C16 H28 Ag4 Mo8 N12 O26 -","- C64 H112 Ag16 Mo32 N48 O104 -","4","0.5","","Quan-Guo Zhai; Xiao-Yuan Wu; Shu-Mei Chen; Zhen-Guo Zhao; Can-Zhong Lu","Construction of Ag/1,2,4-Triazole/Polyoxometalates Hybrid Family Varying from Diverse Supramolecular Assemblies to 3-D Rod-Packing Framework","Inorganic Chemistry","2007","46","","5046","5058","10.1021/ic700415w","","","0.71073","MoKα","","0.0539","0.0422","","","0.0993","0.1075","","","","","","1.05","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308283","17.6706","0.0006","17.6706","0.0006","23.5201","0.0011","90","","90","","120","","6360.2","0.4","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C12 H26 Ag6 Mo24 N24 O81 P2 -","- C12 H24 Ag6 Mo24 N24 O81 P2 -","- C36 H72 Ag18 Mo72 N72 O243 P6 -","3","0.166667","","Quan-Guo Zhai; Xiao-Yuan Wu; Shu-Mei Chen; Zhen-Guo Zhao; Can-Zhong Lu","Construction of Ag/1,2,4-Triazole/Polyoxometalates Hybrid Family Varying from Diverse Supramolecular Assemblies to 3-D Rod-Packing Framework","Inorganic Chemistry","2007","46","","5046","5058","10.1021/ic700415w","","","0.71073","MoKα","","0.0446","0.0402","","","0.0881","0.0907","","","","","","1.106","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308284","12.1848","0.0007","14.4015","0.0008","13.5158","0.0009","90","","91.926","0.003","90","","2370.4","0.2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C8 H13 Ag4 Mo12 N16 O40 P -","- C8 H12 Ag4 Mo12 N16 O40 P -","- C16 H24 Ag8 Mo24 N32 O80 P2 -","2","0.5","","Quan-Guo Zhai; Xiao-Yuan Wu; Shu-Mei Chen; Zhen-Guo Zhao; Can-Zhong Lu","Construction of Ag/1,2,4-Triazole/Polyoxometalates Hybrid Family Varying from Diverse Supramolecular Assemblies to 3-D Rod-Packing Framework","Inorganic Chemistry","2007","46","","5046","5058","10.1021/ic700415w","","","0.71073","MoKα","","0.0651","0.0522","","","0.104","0.1125","","","","","","1.057","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308285","13.755","0.002","13.589","0.002","14.229","0.002","90","","90.925","0.002","90","","2659.3","0.7","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H29 Ag4 Mo12 N12 O40 P -","- C16 H28 Ag4 Mo12 N12 O40 P -","- C32 H56 Ag8 Mo24 N24 O80 P2 -","2","0.5","","Quan-Guo Zhai; Xiao-Yuan Wu; Shu-Mei Chen; Zhen-Guo Zhao; Can-Zhong Lu","Construction of Ag/1,2,4-Triazole/Polyoxometalates Hybrid Family Varying from Diverse Supramolecular Assemblies to 3-D Rod-Packing Framework","Inorganic Chemistry","2007","46","","5046","5058","10.1021/ic700415w","","","0.71073","MoKα","","0.0436","0.0367","","","0.0889","0.094","","","","","","1.055","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308286","7.8389","0.0006","9.9999","0.0007","11.6357","0.0009","106.616","0.001","102.63","0.002","100.051","0.003","825","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H12 Ag4 Mo8 N12 O26 -","- C8 H12 Ag4 Mo8 N12 O26 -","- C8 H12 Ag4 Mo8 N12 O26 -","1","0.5","","Quan-Guo Zhai; Xiao-Yuan Wu; Shu-Mei Chen; Zhen-Guo Zhao; Can-Zhong Lu","Construction of Ag/1,2,4-Triazole/Polyoxometalates Hybrid Family Varying from Diverse Supramolecular Assemblies to 3-D Rod-Packing Framework","Inorganic Chemistry","2007","46","","5046","5058","10.1021/ic700415w","","","0.71073","MoKα","","0.0307","0.0261","","","0.0622","0.0652","","","","","","1.024","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308287","8.2465","0.0004","10.8172","0.0005","10.9336","0.0002","71.101","0.007","82.03","0.01","87.775","0.01","913.81","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H16 Ag4 Mo8 N16 O26 -","- C8 H16 Ag4 Mo8 N16 O26 -","- C8 H16 Ag4 Mo8 N16 O26 -","1","0.5","","Quan-Guo Zhai; Xiao-Yuan Wu; Shu-Mei Chen; Zhen-Guo Zhao; Can-Zhong Lu","Construction of Ag/1,2,4-Triazole/Polyoxometalates Hybrid Family Varying from Diverse Supramolecular Assemblies to 3-D Rod-Packing Framework","Inorganic Chemistry","2007","46","","5046","5058","10.1021/ic700415w","","","0.71073","MoKα","","0.0382","0.0316","","","0.0782","0.0837","","","","","","1.024","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308288","14.0585","0.0011","14.8261","0.0011","14.4347","0.0011","90","","99.582","0.003","90","","2966.7","0.4","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C4 H8 Ag5 Cl Mo8 N8 O26 -","- C4 H8 Ag5 Cl Mo8 N8 O26 -","- C16 H32 Ag20 Cl4 Mo32 N32 O104 -","4","0.5","","Quan-Guo Zhai; Xiao-Yuan Wu; Shu-Mei Chen; Zhen-Guo Zhao; Can-Zhong Lu","Construction of Ag/1,2,4-Triazole/Polyoxometalates Hybrid Family Varying from Diverse Supramolecular Assemblies to 3-D Rod-Packing Framework","Inorganic Chemistry","2007","46","","5046","5058","10.1021/ic700415w","","","0.71073","MoKα","","0.0518","0.0455","","","0.1006","0.105","","","","","","1.165","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308289","9.7391","0.0006","11.0838","0.0006","13.737","0.0008","72.323","0.001","84.384","0.001","73.71","","1355.99","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H16 Ag12 Mo8 N24 O30 -","- C16 H16 Ag12 Mo8 N24 O30 -","- C16 H16 Ag12 Mo8 N24 O30 -","1","0.5","","Quan-Guo Zhai; Xiao-Yuan Wu; Shu-Mei Chen; Zhen-Guo Zhao; Can-Zhong Lu","Construction of Ag/1,2,4-Triazole/Polyoxometalates Hybrid Family Varying from Diverse Supramolecular Assemblies to 3-D Rod-Packing Framework","Inorganic Chemistry","2007","46","","5046","5058","10.1021/ic700415w","","","0.71073","MoKα","","0.0702","0.0599","","","0.1328","0.1418","","","","","","1.061","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4308290","12.159","0.003","14.35","0.003","22.245","0.005","97.11","0.004","97.185","0.004","110.593","0.003","3545.5","1.4","90","2","90","2","","","","","","","","7","P -1","-P 1","2","","","","- C74 H25 Cl F30 N10 O3 Zn2 -","- C74 H25 Cl F30 N10 O3 Zn2 -","- C148 H50 Cl2 F60 N20 O6 Zn4 -","2","1","","Shigeki Mori; Soji Shimizu; Ji-Young Shin; Atsuhiro Osuka","Group 12 Metal Complexes of [26]Hexaphyrin(1.1.1.1.1.1)","Inorganic Chemistry","2007","46","","4374","4376","10.1021/ic7004216","","","0.71073","MoKα","","0.0688","0.0543","","","0.1554","0.1686","","","","","","1.037","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308291","18.217","0.0018","32.707","0.003","12.5752","0.0013","90","","101.453","0.002","90","","7343.4","1.2","90","2","90","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C67 H14 Cd2 Cl4 F30 N6 O -","- C67 H14 Cd2 Cl4 F30 N6 O -","- C268 H56 Cd8 Cl16 F120 N24 O4 -","4","1","","Shigeki Mori; Soji Shimizu; Ji-Young Shin; Atsuhiro Osuka","Group 12 Metal Complexes of [26]Hexaphyrin(1.1.1.1.1.1)","Inorganic Chemistry","2007","46","","4374","4376","10.1021/ic7004216","","","0.71073","MoKα","","0.1221","0.0929","","","0.2123","0.2245","","","","","","1.104","","","","has coordinates,has disorder","179120","2020-10-21","18:00:00",""
"4308292","9.8513","0.0005","16.2689","0.0006","16.0216","0.0008","90","","107.749","0.002","90","","2445.6","0.2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H31 B5 N2 O10 -","- C18 H31 B5 N2 O10 -","- C72 H124 B20 N8 O40 -","4","1","","Michael A. Beckett; Catherine C. Bland; Peter N. Horton; Michael B. Hursthouse; K. Sukumar Varma","An Unprecedented Polyborate Ester Anion: X-ray Diffraction Studies on [1,8-C10H6(NMe2)2H][B5O6(OMe)4]","Inorganic Chemistry","2007","46","","3801","3803","10.1021/ic700433e","","","0.71073","MoKα","","0.1493","0.0676","","","0.1155","0.1404","","","","","","1.024","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4308293","22.51","0.002","33.749","0.003","46.872","0.005","90","","90.654","0.002","90","","35606","6","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C296 H253 Au18 Cl4 N3 O56 P16 V20 -","- C296 H253 Au18 Cl4 N3 O56 P16 V20 -","- C1184 H1012 Au72 Cl16 N12 O224 P64 V80 -","4","1","","Martin Schulz-Dobrick; Martin Jansen","Structure-Directing Effects in the Supramolecular Intercluster Compound [Au9(PPh3)8]2[V10O28H3]2: Long-Range versus Short-Range Bonding Interactions","Inorganic Chemistry","2007","46","","4380","4382","10.1021/ic700434x","","","0.71073","MoKα","","0.0652","0.0444","","","0.1055","0.1138","","","","","","0.993","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308294","12.2644","0.0008","13.0387","0.0012","23.392","0.002","91.952","0.005","96.536","0.005","111.559","0.004","3444.7","0.5","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C12 H106 B2 K12 O128 Sn6 W26 -","- C12 H36 B2 K12 O128 Sn6 W26 -","- C12 H36 B2 K12 O128 Sn6 W26 -","1","0.5","","Santiago Reinoso; Michael H. Dickman; Marius F. Matei; Ulrich Kortz","13-Tungstoborate Stabilized by an Organostannoxane Hexamer","Inorganic Chemistry","2007","46","","4383","4385","10.1021/ic7004437","","","0.71073","MoKα","","0.138","0.065","","","0.1414","0.1801","","","","","","1.008","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308295","11.5579","0.0005","18.6002","0.0006","6.7094","0.0003","90","","90","","90","","1442.38","0.1","183","2","183","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C16 H18 Mg O2 -","- C16 H18 Mg O2 -","- C64 H72 Mg4 O8 -","4","0.5","","Martin Gärtner; Reinald Fischer; Jens Langer; Helmar Görls; Dirk Walther; Matthias Westerhausen","Syntheses and Structures of Alkaline Earth Metal Bis(diphenylamides)","Inorganic Chemistry","2007","46","","5118","5124","10.1021/ic700459d","","","0.71073","MoKα","","0.0603","0.0382","","","0.0919","0.1015","","","","","","1.024","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308296","13.1143","0.0004","14.4644","0.0005","19.869","0.0004","90","","106.111","0.002","90","","3620.94","0.19","183","2","183","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C36 H44 Mg N2 O3 -","- C36 H44 Mg N2 O3 -","- C144 H176 Mg4 N8 O12 -","4","1","","Martin Gärtner; Reinald Fischer; Jens Langer; Helmar Görls; Dirk Walther; Matthias Westerhausen","Syntheses and Structures of Alkaline Earth Metal Bis(diphenylamides)","Inorganic Chemistry","2007","46","","5118","5124","10.1021/ic700459d","","","0.71073","MoKα","","0.139","0.0952","","","0.2771","0.3199","","","","","","1.03","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308297","24.9375","0.0008","17.2162","0.0005","18.4757","0.0006","90","","129.216","0.002","90","","6145.6","0.4","183","2","183","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H40 Ca N2 O4 -","- C32 H40 Ca N2 O4 -","- C256 H320 Ca8 N16 O32 -","8","1","","Martin Gärtner; Reinald Fischer; Jens Langer; Helmar Görls; Dirk Walther; Matthias Westerhausen","Syntheses and Structures of Alkaline Earth Metal Bis(diphenylamides)","Inorganic Chemistry","2007","46","","5118","5124","10.1021/ic700459d","","","0.71073","MoKα","","0.0792","0.0441","","","0.099","0.1144","","","","","","1.012","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308298","19.0176","0.0008","11.9452","0.0006","9.2214","0.0004","90","","93.354","0.003","90","","2091.23","0.16","183","2","183","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C44 H60 N2 O5 Sr -","- C44 H60 N2 O5 Sr -","- C88 H120 N4 O10 Sr2 -","2","0.5","","Martin Gärtner; Reinald Fischer; Jens Langer; Helmar Görls; Dirk Walther; Matthias Westerhausen","Syntheses and Structures of Alkaline Earth Metal Bis(diphenylamides)","Inorganic Chemistry","2007","46","","5118","5124","10.1021/ic700459d","","","0.71073","MoKα","","0.0462","0.041","","","0.0831","0.0864","","","","","","1.034","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308299","19.5613","0.0011","11.9298","0.0004","9.1896","0.0005","90","","93.622","0.002","90","","2140.22","0.18","183","2","183","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C44 H60 Ba N2 O5 -","- C44 H60 Ba N2 O5 -","- C88 H120 Ba2 N4 O10 -","2","0.5","","Martin Gärtner; Reinald Fischer; Jens Langer; Helmar Görls; Dirk Walther; Matthias Westerhausen","Syntheses and Structures of Alkaline Earth Metal Bis(diphenylamides)","Inorganic Chemistry","2007","46","","5118","5124","10.1021/ic700459d","","","0.71073","MoKα","","0.0452","0.0426","","","0.0902","0.0922","","","","","","1.032","","","","has coordinates","179120","2020-10-21","18:00:00",""
"4308300","18.0567","0.0009","18.3122","0.0009","21.687","0.0011","90","","96.233","0.003","90","","7128.6","0.6","273","2","273","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C54 H43 Cu6 I5 N8 Nd4 O24 -","- C54 H41 Cu6 I5 N8 Nd4 O24 -","- C216 H164 Cu24 I20 N32 Nd16 O96 -","4","1","","Xiaojun Gu; Dongfeng Xue","3D Coordination Framework [Ln4(μ3-OH)2Cu6I5(IN)8(OAc)3] (IN = Isonicotinate): Employing 2D Layers of Lanthanide Wheel Clusters and 1D Chains of Copper Halide Clusters","Inorganic Chemistry","2007","46","","5349","5353","10.1021/ic7004826","","","0.71073","MoKα","","0.0602","0.0384","","","0.0804","0.0896","","","","","","1.018","","","","has coordinates,has disorder","179121","2020-10-21","18:00:00",""
"4308301","18.0965","0.0011","18.3267","0.0012","21.7131","0.0012","90","","96.159","0.004","90","","7159.6","0.8","273","2","273","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C54 H43 Cu6 I5 N8 O24 Pr4 -","- C54 H41 Cu6 I5 N8 O24 Pr4 -","- C216 H164 Cu24 I20 N32 O96 Pr16 -","4","1","","Xiaojun Gu; Dongfeng Xue","3D Coordination Framework [Ln4(μ3-OH)2Cu6I5(IN)8(OAc)3] (IN = Isonicotinate): Employing 2D Layers of Lanthanide Wheel Clusters and 1D Chains of Copper Halide Clusters","Inorganic Chemistry","2007","46","","5349","5353","10.1021/ic7004826","","","0.71073","MoKα","","0.1147","0.0509","","","0.0683","0.0829","","","","","","1.014","","","","has coordinates","179121","2020-10-21","18:00:00",""
"4308302","10.1506","0.0009","10.8733","0.0009","18.2157","0.0014","101.369","0.007","102.863","0.0017","100.601","0.007","1866.2","0.3","110","","110","","","","","","","","?","5","P -1","-P 1","2","","","","- C18 H40 Mo8 N6 O26 -","- C18 H40 Mo8 N6 O26 -","- C36 H80 Mo16 N12 O52 -","2","1","","Adam K. Stover; Jesse R. Gutnick; Amy Narducci Sarjeant; Alexander J. Norquist","[Mo16O53F2]12-: a New Polyoxofluoromolybdate Anion","Inorganic Chemistry","2007","46","","4389","4391","10.1021/ic7004997","","","0.7107","MoKα","","0.056","0.0365","","0.1016","0.0927","0.0927","","","","","","0.9357","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308303","9.6315","0.001","33.417","0.003","12.5367","0.0011","90","","103.167","0.008","90","","3928.9","0.7","110","","110","","","","","","","","?","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H92 F2 Mo16 N12 O57 -","- C36 H92 F2 Mo16 N12 O57 -","- C72 H184 F4 Mo32 N24 O114 -","2","0.5","","Adam K. Stover; Jesse R. Gutnick; Amy Narducci Sarjeant; Alexander J. Norquist","[Mo16O53F2]12-: a New Polyoxofluoromolybdate Anion","Inorganic Chemistry","2007","46","","4389","4391","10.1021/ic7004997","","","0.71073","MoKα","","0.0765","0.0256","","0.0773","0.0587","0.0587","","","","","","0.9236","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308304","14.7451","0.0008","10.6645","0.0008","12.2089","0.0008","90","","93.575","0.005","90","","1916.1","0.2","220","2","220","2","","","","","","","","8","C 1 c 1","C -2yc","9","","","","- C12 H16 B Cl Mo N6 O2 S3 -","- C12 H16 B Cl Mo N6 O2 S3 -","- C48 H64 B4 Cl4 Mo4 N24 O8 S12 -","4","1","","Ba L. Tran; Carl J. Carrano","Oxo-Molybdenum(VI,V,IV) Complexes of the Facially Coordinating Tris(mercaptoimidazolyl)borate Ligand: Synthesis, Characterization, and Oxygen Atom Transfer Reactivity","Inorganic Chemistry","2007","46","","5429","5438","10.1021/ic7005259","","","0.71073","MoKα","","0.0484","0.0378","","","0.0849","0.0881","","","","","","0.96","","","","has coordinates","179121","2020-10-21","18:00:00",""
"4308305","11.5639","0.0015","25.181","0.003","12.0206","0.0014","90","","99.227","0.007","90","","3455","0.7","240","2","240","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C22 H34 B F6 Mo N8 O P S3 -","- C22 H34 B F6 Mo N8 O P S3 -","- C88 H136 B4 F24 Mo4 N32 O4 P4 S12 -","4","1","","Ba L. Tran; Carl J. Carrano","Oxo-Molybdenum(VI,V,IV) Complexes of the Facially Coordinating Tris(mercaptoimidazolyl)borate Ligand: Synthesis, Characterization, and Oxygen Atom Transfer Reactivity","Inorganic Chemistry","2007","46","","5429","5438","10.1021/ic7005259","","","0.71073","MoKα","","0.0581","0.0355","","","0.0819","0.0936","","","","","","1.037","","","","has coordinates","179121","2020-10-21","18:00:00",""
"4308306","9.433","0.004","14.547","0.005","21.325","0.008","106.45","0.02","98.33","0.02","94.53","0.02","2754.6","1.9","200","2","200","2","","","","","","","","8","P -1","-P 1","2","","","","- C26 H36 B2 Cl8 Mo2 N12 O5 S6 -","- C26 H36 B2 Cl8 Mo2 N12 O5 S6 -","- C52 H72 B4 Cl16 Mo4 N24 O10 S12 -","2","1","","Ba L. Tran; Carl J. Carrano","Oxo-Molybdenum(VI,V,IV) Complexes of the Facially Coordinating Tris(mercaptoimidazolyl)borate Ligand: Synthesis, Characterization, and Oxygen Atom Transfer Reactivity","Inorganic Chemistry","2007","46","","5429","5438","10.1021/ic7005259","","","0.71073","MoKα","","0.142","0.092","","","0.2622","0.2929","","","","","","1.062","","","","has coordinates","179121","2020-10-21","18:00:00",""
"4308307","9.461","0.002","22.51","0.005","13.38","0.003","90","","107.334","0.008","90","","2720.1","1","240","2","240","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 B Cl Mo N9 O1.5 S3 -","- C18 H16 B Cl Mo N9 O1.5 S3 -","- C72 H64 B4 Cl4 Mo4 N36 O6 S12 -","4","1","","Ba L. Tran; Carl J. Carrano","Oxo-Molybdenum(VI,V,IV) Complexes of the Facially Coordinating Tris(mercaptoimidazolyl)borate Ligand: Synthesis, Characterization, and Oxygen Atom Transfer Reactivity","Inorganic Chemistry","2007","46","","5429","5438","10.1021/ic7005259","","","0.71073","MoKα","","0.0718","0.0422","","","0.0957","0.1089","","","","","","1.068","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308308","13.736","0.0002","14.466","0.0002","15.578","0.0002","108.306","0.0008","101.794","0.0008","104.771","0.0007","2701.78","0.07","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C126 H106 Br2 N2 O4 P4 Pd2 -","- C126 H106 Br2 N2 O4 P4 Pd2 -","- C126 H106 Br2 N2 O4 P4 Pd2 -","1","0.5","","Haim Weissman; Elijah Shirman; Tal Ben-Moshe; Revital Cohen; Gregory Leitus; Linda J. W. Shimon; Boris Rybtchinski","Palladium Complexes of Perylene Diimides: Strong Fluorescence Despite Direct Attachment of Late Transition Metals to Organic Dyes","Inorganic Chemistry","2007","46","","4790","4792","10.1021/ic700539b","","","0.71073","MoKα","","0.0534","0.0392","","","0.1119","0.1187","","","","","","1.066","","","","has coordinates,has disorder","179121","2020-10-21","18:00:00",""
"4308309","13.843","0.003","18.538","0.004","18.911","0.004","90","","96.61","0.03","90","","4820.7","1.8","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C118 H104 Br2 N2 O4 P4 Pd2 -","- C118 H104 Br2 N2 O4 P4 Pd2 -","- C236 H208 Br4 N4 O8 P8 Pd4 -","2","0.5","","Haim Weissman; Elijah Shirman; Tal Ben-Moshe; Revital Cohen; Gregory Leitus; Linda J. W. Shimon; Boris Rybtchinski","Palladium Complexes of Perylene Diimides: Strong Fluorescence Despite Direct Attachment of Late Transition Metals to Organic Dyes","Inorganic Chemistry","2007","46","","4790","4792","10.1021/ic700539b","","","0.71073","MoKα","","0.0756","0.0454","","","0.1001","0.1088","","","","","","1.031","","","","has coordinates,has disorder","179121","2020-10-21","18:00:00",""
"4308310","9.962","0.005","16.841","0.005","13.62","0.005","90","0.005","91.447","0.005","90","0.005","2284.3","1.6","200","2","200","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H24 Cl4 N4 Pd -","- C19 H24 Cl4 N4 Pd -","- C76 H96 Cl16 N16 Pd4 -","4","1","","Alberto Sánchez-Méndez; Ernesto de Jesús; Juan C. Flores; Pilar Gómez-Sal","Crystal Structures of Poly(aryl ether) Dendrons with Palladium Scorpionate Complexes at Their Focal Point","Inorganic Chemistry","2007","46","","4793","4795","10.1021/ic7005748","","x-ray","0.71069","MoKα","","0.094","0.0666","","","0.1817","0.2011","","","","","","1.034","","","","has coordinates","179121","2020-10-21","18:00:00",""
"4308311","12.8582","0.001","14.4619","0.0013","19.635","0.003","97.459","0.011","90.026","0.009","116.091","0.011","3244.6","0.7","200","2","200","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C65 H70 Cl6 N8 O4 Pd2 -","- C65 H70 Cl6 N8 O4 Pd2 -","- C130 H140 Cl12 N16 O8 Pd4 -","2","1","","Alberto Sánchez-Méndez; Ernesto de Jesús; Juan C. Flores; Pilar Gómez-Sal","Crystal Structures of Poly(aryl ether) Dendrons with Palladium Scorpionate Complexes at Their Focal Point","Inorganic Chemistry","2007","46","","4793","4795","10.1021/ic7005748","","x-ray","0.71073","MoKα","","0.1202","0.0715","","","0.1794","0.2167","","","","","","1.027","","","","has coordinates","179121","2020-10-21","18:00:00",""
"4308312","9.73","0.004","15.841","0.004","19.084","0.003","98.93","0.018","97.935","0.016","106.14","0.02","2739.9","1.4","200","2","200","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C61.5 H61.5 Cl2 N4 O6 Pd -","- C61.5 H61.5 Cl2 N4 O6 Pd -","- C123 H123 Cl4 N8 O12 Pd2 -","2","1","","Alberto Sánchez-Méndez; Ernesto de Jesús; Juan C. Flores; Pilar Gómez-Sal","Crystal Structures of Poly(aryl ether) Dendrons with Palladium Scorpionate Complexes at Their Focal Point","Inorganic Chemistry","2007","46","","4793","4795","10.1021/ic7005748","","x-ray","0.71073","MoKα","","0.0931","0.0633","","","0.1618","0.1868","","","","","","1.079","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308313","13.0826","0.0002","12.1616","0.0002","18.1906","0.0004","90","","94.7891","0.0008","90","","2884.12","0.09","150","","150","","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H44 Al6 Li2 N4 O2 -","- C12 H44 Al6 Li2 N4 O2 -","- C48 H176 Al24 Li8 N16 O8 -","4","1","","Christina Y. Tang; Andrew R. Cowley; Anthony J. Downs; Simon Parsons","Preparation and Characterization of Lithium Imidoalanate Complexes Li2[(RN)4(AlH2)6] (R = Me or tBu): First Examples of Aluminum-Rich Imidoalanes with an Adamantoid Structure","Inorganic Chemistry","2007","46","","5439","5446","10.1021/ic7006827","","","0.71073","MoKα","","","0.0494","","","","0.0584","","","","","","1.063","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4308314","18.3521","0.0009","18.3521","0.0009","18.3521","0.0009","90","","90","","90","","6181","0.5","150","","150","","","","","","","","Tony Downs, Oxford","5","F d -3 m :2","-F 4vw 2vw 3","227","","","","- C16 H48 Al6 Li2 N4 -","- C16 H48 Al6 Li2 N4 -","- C128 H384 Al48 Li16 N32 -","8","0.0416667","","Christina Y. Tang; Andrew R. Cowley; Anthony J. Downs; Simon Parsons","Preparation and Characterization of Lithium Imidoalanate Complexes Li2[(RN)4(AlH2)6] (R = Me or tBu): First Examples of Aluminum-Rich Imidoalanes with an Adamantoid Structure","Inorganic Chemistry","2007","46","","5439","5446","10.1021/ic7006827","","","0.71073","MoKα","","0.1168","0.0878","","0.0843","0.0802","0.0802","","","","","","2.631","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4308315","10.5708","0.0002","16.547","0.0004","17.0406","0.0004","92.1463","0.0009","93.8153","0.0009","91.387","0.0011","2970.9","0.11","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","4","P -1","-P 1","2","","","","- C18 H48 Al6 N6 -","- C18 H48 Al6 N6 -","- C72 H192 Al24 N24 -","4","2","","Christina Y. Tang; Andrew R. Cowley; Anthony J. Downs; Simon Parsons","Preparation and Characterization of Lithium Imidoalanate Complexes Li2[(RN)4(AlH2)6] (R = Me or tBu): First Examples of Aluminum-Rich Imidoalanes with an Adamantoid Structure","Inorganic Chemistry","2007","46","","5439","5446","10.1021/ic7006827","","","","","","0.1078","0.0405","","0.097","0.0449","0.0449","","","","","","1.0872","","","","has coordinates","179121","2020-10-21","18:00:00",""
"4308316","35.136","0.0002","16.798","0.0002","20.627","0.0002","90","0.01","109.004","0.01","90","0.01","11510.8","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C116 H164 Cl2 N0 O14 Sm2 -","- C116 H164 Cl2 O14 Sm2 -","- C464 H656 Cl8 O56 Sm8 -","4","0.5","","Geoffroy Guillemot; Barbara Castellano; Thierry Prangé; Euro Solari; Carlo Floriani","Use of Calix[4]arenes in the Redox Chemistry of Lanthanides: the Reduction of Dinitrogen by a Calix[4]arene-Samarium Complex","Inorganic Chemistry","2007","46","","5152","5154","10.1021/ic700787d","","","0.7107","MoKα","","0.0921","0.0759","","","0.2084","0.2159","","","","","","1.129","","","","has coordinates","179121","2020-10-21","18:00:00",""
"4308317","19.471","0.0002","20.34","0.0004","25.884","0.0004","103.26","0.1","103.37","0.1","114.44","0.1","8446","13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C174 H238 N2 Na O21 Sm3 -","- C174 H238 N2 Na O21 Sm3 -","- C348 H476 N4 Na2 O42 Sm6 -","2","1","","Geoffroy Guillemot; Barbara Castellano; Thierry Prangé; Euro Solari; Carlo Floriani","Use of Calix[4]arenes in the Redox Chemistry of Lanthanides: the Reduction of Dinitrogen by a Calix[4]arene-Samarium Complex","Inorganic Chemistry","2007","46","","5152","5154","10.1021/ic700787d","","","0.7107","MoKα","","0.1251","0.0719","","","0.1953","0.2235","","","","","","0.977","","","","has coordinates","179121","2020-10-21","18:00:00",""
"4327203","10.784","0.002","8.84","0.002","17.492","0.004","90","","93.63","0.03","90","","1664.2","0.6","200","2","200","2","","","","","","","Chemical synthesis, S.C. Lee lab","6","P 1 21/n 1","-P 2yn","14","Fe2(mu-NPh)2Cl2(NH2tBu)2.2THF","","","- C28 H48 Cl2 Fe2 N4 O2 -","- C14 H24 Cl Fe N2 O -","- C56 H96 Cl4 Fe4 N8 O4 -","4","1","","Jeremiah S. Duncan; Michael J. Zdilla; Sonny C. Lee","Synthesis and Elaboration of the Dinuclear Iron-Imide Cluster Core [Fe2(μ-NR)2]2+","Inorganic Chemistry","2007","46","","1071","1080","10.1021/ic061133+","","","0.71073","MoKα","","0.0758","0.0467","","0.1319","0.1163","","","","1.02","1.085","1.085","","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327204","16.379","0.003","11.612","0.002","22.422","0.005","90","","108.22","0.03","90","","4050.7","1.5","200","2","200","2","","","","","","","Chemical Synthesis, S.C. Lee Lab","6","P 1 21/n 1","-P 2yn","14","(NEt4){FeCl2[N(SiMe3)2]2}","tetraethylammonium dichlorobis(bis(trimethylsilyl)amido)ferrate(II)","","- C27 H64 Cl2 Fe N3 Si4 -","- C20 H56 Cl2 Fe N3 Si4 -","- C80 H224 Cl8 Fe4 N12 Si16 -","4","1","","Jeremiah S. Duncan; Michael J. Zdilla; Sonny C. Lee","Synthesis and Elaboration of the Dinuclear Iron-Imide Cluster Core [Fe2(μ-NR)2]2+","Inorganic Chemistry","2007","46","","1071","1080","10.1021/ic061133+","","","0.71073","MoKα","","0.0946","0.0574","","0.1579","0.1441","","","","1.043","1.197","1.197","","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327205","14.2101","0.001","13.4726","0.0011","9.2165","0.0005","90","","107.954","0.004","90","","1678.5","0.2","200","2","200","2","","","","","","","Chemical synthesis, S.C. Lee lab","5","C 1 2/m 1","-C 2y","12","(NEt4)2[Fe2(mu-NPh)2Cl4]","","","- C28 H50 Cl4 Fe2 N4 -","- C28 H50 Cl4 Fe2 N4 -","- C56 H100 Cl8 Fe4 N8 -","2","0.25","","Jeremiah S. Duncan; Michael J. Zdilla; Sonny C. Lee","Synthesis and Elaboration of the Dinuclear Iron-Imide Cluster Core [Fe2(μ-NR)2]2+","Inorganic Chemistry","2007","46","","1071","1080","10.1021/ic061133+","","","0.71073","MoKα","","0.0557","0.0377","","0.0983","0.0889","","","","1.07","1.101","1.101","","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327206","11.2513","0.0004","11.266","0.0005","14.3038","0.0006","90","","92.351","0.002","90","","1811.58","0.13","200","2","200","2","","","","","","","Chemical synthesis, S.C. Lee lab","5","P 1 21/n 1","-P 2yn","14","(NEt4)2[Fe2(mu-NpTol)2Cl4]","","","- C30 H54 Cl4 Fe2 N4 -","- C30 H54 Cl4 Fe2 N4 -","- C60 H108 Cl8 Fe4 N8 -","2","0.5","","Jeremiah S. Duncan; Michael J. Zdilla; Sonny C. Lee","Synthesis and Elaboration of the Dinuclear Iron-Imide Cluster Core [Fe2(μ-NR)2]2+","Inorganic Chemistry","2007","46","","1071","1080","10.1021/ic061133+","","","0.71073","MoKα","","0.0651","0.0448","","0.1246","0.1111","","","","1.04","1.068","1.068","","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327207","23.374","0.0009","21.029","0.0009","16.3194","0.0006","90","","122.271","0.0015","90","","6782.4","0.5","200","2","200","2","","","","","","","Chemical synthesis, S.C. Lee lab","5","C 1 2/c 1","-C 2yc","15","(NBu4)2[Fe2(mu-NMes)2Cl4].4MeCN","","","- C58 H106 Cl4 Fe2 N8 -","- C58 H106 Cl4 Fe2 N8 -","- C232 H424 Cl16 Fe8 N32 -","4","0.5","","Jeremiah S. Duncan; Michael J. Zdilla; Sonny C. Lee","Synthesis and Elaboration of the Dinuclear Iron-Imide Cluster Core [Fe2(μ-NR)2]2+","Inorganic Chemistry","2007","46","","1071","1080","10.1021/ic061133+","","","0.71073","MoKα","","0.0822","0.0489","","0.1426","0.1225","","","","1.031","1.091","1.091","","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327208","21.2691","0.001","27.751","0.002","19.323","0.0012","90","","119.177","0.003","90","","9958.1","1.1","200","2","200","2","","","","","","","Chemical synthesis, S.C. Lee lab","6","C 1 c 1","C -2yc","9","[Fe3Cl4(DME)5][Fe4(mu3-NtBu)4Cl4]2.DME","","","- C56 H132 Cl12 Fe11 N8 O12 -","- C56 H132 Cl12 Fe11 N8 O12 -","- C224 H528 Cl48 Fe44 N32 O48 -","4","1","","Jeremiah S. Duncan; Michael J. Zdilla; Sonny C. Lee","Synthesis and Elaboration of the Dinuclear Iron-Imide Cluster Core [Fe2(μ-NR)2]2+","Inorganic Chemistry","2007","46","","1071","1080","10.1021/ic061133+","","","0.71073","MoKα","","0.0892","0.0658","","0.1566","0.1444","","","","1.034","1.096","1.096","","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327209","12.002","0.0009","11.5142","0.0006","12.5742","0.001","90","","94.769","0.002","90","","1731.7","0.2","200","2","200","2","","","","","","","Chemical synthesis, S.C. Lee lab","5","P 1 21/n 1","-P 2yn","14","(NEt4)2[Fe2(mu-NtBu)2Cl4]","","","- C24 H58 Cl4 Fe2 N4 -","- C24 H58 Cl4 Fe2 N4 -","- C48 H116 Cl8 Fe4 N8 -","2","0.5","","Jeremiah S. Duncan; Michael J. Zdilla; Sonny C. Lee","Synthesis and Elaboration of the Dinuclear Iron-Imide Cluster Core [Fe2(μ-NR)2]2+","Inorganic Chemistry","2007","46","","1071","1080","10.1021/ic061133+","","","0.71073","MoKα","","0.1285","0.0564","","0.1671","0.1311","","","","0.991","1.06","1.06","","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327210","19.0192","0.0004","19.0192","0.0004","12.8131","0.0002","90","","90","","120","","4013.93","0.13","200","2","200","2","","","","","","","Chemical synthesis, S.C. Lee lab","5","P 61","P 61","169","Fe2(mu-NtBu)2Cl2(tBuNH2)2.(1/3)(C5H12)","","","- C17.67 H44 Cl2 Fe2 N4 -","- C16 H40 Cl2 Fe2 N4 -","- C96 H240 Cl12 Fe12 N24 -","6","1","","Jeremiah S. Duncan; Michael J. Zdilla; Sonny C. Lee","Synthesis and Elaboration of the Dinuclear Iron-Imide Cluster Core [Fe2(μ-NR)2]2+","Inorganic Chemistry","2007","46","","1071","1080","10.1021/ic061133+","","","0.71073","MoKα","","0.0546","0.0418","","0.076","0.0726","","","","1.03","1.073","1.073","","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327211","9.5058","0.0009","10.6657","0.0006","11.7335","0.0011","70.684","0.005","68.911","0.004","65.967","0.005","989.74","0.15","200","2","200","2","","","","","","","Chemical synthesis, S.C. Lee lab","5","P -1","-P 1","2","Fe2(mu-NtBu)2Cl2(DMAP)2.2PhMe","","","- C36 H54 Cl2 Fe2 N6 -","- C36 H54 Cl2 Fe2 N6 -","- C36 H54 Cl2 Fe2 N6 -","1","0.5","","Jeremiah S. Duncan; Michael J. Zdilla; Sonny C. Lee","Synthesis and Elaboration of the Dinuclear Iron-Imide Cluster Core [Fe2(μ-NR)2]2+","Inorganic Chemistry","2007","46","","1071","1080","10.1021/ic061133+","","","0.71073","MoKα","","0.0729","0.05","","0.1433","0.1308","","","","1.097","1.154","1.154","","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327212","8.6982","0.0003","18.3233","0.0009","18.1204","0.0008","90","","92.203","0.002","90","","2885.9","0.2","200","2","200","2","","","","","","","Chemical synthesis, S.C. Lee lab","6","P 1 21/n 1","-P 2yn","14","Fe2(mu-NtBu)2Cl2(PEt3)2","","","- C20 H48 Cl2 Fe2 N2 P2 -","- C20 H48 Cl2 Fe2 N2 P2 -","- C80 H192 Cl8 Fe8 N8 P8 -","4","1","","Jeremiah S. Duncan; Michael J. Zdilla; Sonny C. Lee","Synthesis and Elaboration of the Dinuclear Iron-Imide Cluster Core [Fe2(μ-NR)2]2+","Inorganic Chemistry","2007","46","","1071","1080","10.1021/ic061133+","","","0.71073","MoKα","","0.0776","0.043","","0.1203","0.1048","","","","1.021","1.097","1.097","","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327213","18.645","0.003","5.6257","0.0005","12.014","0.002","90","","117.547","0.006","90","","1117.3","0.3","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Gd5 Li O13 P2 -","- Gd5 Li O13 P2 -","- Gd20 Li4 O52 P8 -","4","0.5","","Jing Zhu; Wen-Dan Cheng; Dong-Sheng Wu; Hao Zhang; Ya-Jing Gong; Hua-Nan Tong; Dan Zhao","Synthesis, Crystal Structure, and Optical Properties of LiGd5P2O13, a Layered Lithium Gadolinium Phosphate Containing One-Dimensional Li Chains","Inorganic Chemistry","2007","46","","208","212","10.1021/ic061536+","","","0.71073","MoKα","","0.046","0.0382","","","0.0932","0.0984","","","","","","1.007","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327214","16.6366","0.0011","9.9935","0.0007","13.6266","0.0009","90","","90","","90","","2265.5","0.3","123","2","123","2","","","","","","","","6","P n m a","-P 2ac 2n","62","C1","","","- C19 H30 Cu Fe N6 O6 -","- C19 H30 Cu Fe N6 O6 -","- C76 H120 Cu4 Fe4 N24 O24 -","4","0.5","","Gilles Gasser; Matthew J. Belousoff; Alan M. Bond; Leone Spiccia","Binding of Nitrate to a CuII-Cyclen Complex Bearing a Ferrocenyl Pendant: Synthesis, Solid-State X-ray Structure, and Solution-Phase Electrochemical and Spectrophotometric Studies","Inorganic Chemistry","2007","46","","3876","3888","10.1021/ic061622+","","","0.71073","MoKα","","0.0633","0.0555","","","0.1286","0.1331","","","","","","1.16","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327215","8.7844","0.0003","12.3857","0.0004","16.255","0.0005","90","","90","","90","","1768.56","0.1","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- As F10 N S Xe -","- As F10 N S Xe -","- As8 F80 N8 S8 Xe8 -","8","1","","Gregory L. Smith; Hélène P. A. Mercier; Gary J. Schrobilgen","Synthesis of [F3S\τbNXeF][AsF6] and Structural Study by Multi-NMR and Raman Spectroscopy, Electronic Structure Calculations, and X-ray Crystallography","Inorganic Chemistry","2007","46","","1369","1378","10.1021/ic061899+","","","0.71073","MoKα","","0.0569","0.0438","","","0.0655","0.0679","","","","","","1.226","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327216","15.6403","0.0017","16.6383","0.0015","20.448","0.003","90","","90","","90","","5321.1","1.1","173","","173","1","","","","","","","see text","6","P n m a","-P 2ac 2n","62","","","","- C37 H30 Co11 Nb O17 Te5 -","- C37 H30 Co11 Nb O17 Te5 -","- C148 H120 Co44 Nb4 O68 Te20 -","4","0.5","","Olivier Cador; Hélène Cattey; Jean-François Halet; Walter Meier; Yves Mugnier; Joachim Wachter; Jean-Yves Saillard; Bachir Zouchoune; Manfred Zabel","Electron-Sponge Behavior and Electronic Structures in Cobalt-Centered Pentagonal Prismatic Co11Te7(CO)10 and Co11Te5(CO)15 Cluster Anions","Inorganic Chemistry","2007","46","","501","509","10.1021/ic061904+","","","0.71073","MoKα","","0.0858","0.0322","","","0.0779","0.1072","","","","","","0.553","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327217","18.8838","0.001","18.8838","0.001","12.5586","0.0006","90","","90","","90","","4478.4","0.4","173","2","173","2","","","","","","","","7","P 4","P 4","75","","","","- C22 H50 F18 Mn2 N6 O4 P3 -","- C22 H50 Mn2 N6 O4 -","- C88 H200 Mn8 N24 O16 -","4","1","","Vladimir B. Romakh; Bruno Therrien; Georg Süss-Fink; Georgiy B. Shul'pin","Dinuclear Manganese Complexes Containing Chiral 1,4,7-Triazacyclononane-Derived Ligands and Their Catalytic Potential for the Oxidation of Olefins, Alkanes, and Alcohols","Inorganic Chemistry","2007","46","","1315","1331","10.1021/ic061950+","","","0.71073","MoKα","","0.1644","0.1185","","","0.2865","0.3169","","","","","","0.92","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327218","18.68","0.003","18.68","0.003","24.73","0.005","90","","90","","90","","8629","3","173","2","173","2","","","","","","","","7","I 4","I 4","79","","","","- C22 H50 F18 Mn2 N6 O4 P3 -","- C22 H50 F13 Mn2 N6 O4 P2.25 -","- C176 H400 F104 Mn16 N48 O32 P18 -","8","1","","Vladimir B. Romakh; Bruno Therrien; Georg Süss-Fink; Georgiy B. Shul'pin","Dinuclear Manganese Complexes Containing Chiral 1,4,7-Triazacyclononane-Derived Ligands and Their Catalytic Potential for the Oxidation of Olefins, Alkanes, and Alcohols","Inorganic Chemistry","2007","46","","1315","1331","10.1021/ic061950+","","","0.71073","MoKα","","0.1371","0.0669","","","0.1497","0.1698","","","","","","0.799","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327219","24.282","0.003","15.256","0.002","29.836","0.004","90","","100.84","0.006","90","","10855","2","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C112 H116 Cu2 F12 N16 O6 P2 -","- C100 H84 Cu2 F12 N12 O2 P2 -","- C400 H336 Cu8 F48 N48 O8 P8 -","4","0.5","","Lei Zhou; Douglas Powell; Kenneth M. Nicholas","Copper(I) Complexes of Tripodal Tris(imidazolyl) Ligands: Potential Mimics of the Cu(A) Site of Hydroxylase Enzymes","Inorganic Chemistry","2007","46","","2316","2321","10.1021/ic061985+","","","0.71073","MoKα","","0.0526","0.0436","","","0.1248","0.1308","","","","","","1.014","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327220","14.2688","0.0018","14.304","0.0018","14.8469","0.0019","65.39","0.002","65.275","0.002","74.127","0.002","2484.3","0.5","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C108 H104 Cl4 Cu2 F12 N12 O2 P2 -","- C108 H104 Cl4 Cu2 N12 O2 -","- C108 H104 Cl4 Cu2 N12 O2 -","1","0.5","","Lei Zhou; Douglas Powell; Kenneth M. Nicholas","Copper(I) Complexes of Tripodal Tris(imidazolyl) Ligands: Potential Mimics of the Cu(A) Site of Hydroxylase Enzymes","Inorganic Chemistry","2007","46","","2316","2321","10.1021/ic061985+","","","0.71073","MoKα","","0.1042","0.0823","","","0.2438","0.2652","","","","","","1.046","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327221","13.42","0.002","15.024","0.002","16.47","0.003","89.324","0.005","69.714","0.005","68.746","0.005","2878.1","0.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C63 H71 Cu F6 N7 O3 P -","- C55 H51 Cu F6 N7 O P -","- C110 H102 Cu2 F12 N14 O2 P2 -","2","1","","Lei Zhou; Douglas Powell; Kenneth M. Nicholas","Copper(I) Complexes of Tripodal Tris(imidazolyl) Ligands: Potential Mimics of the Cu(A) Site of Hydroxylase Enzymes","Inorganic Chemistry","2007","46","","2316","2321","10.1021/ic061985+","","","0.71073","MoKα","","0.0534","0.0437","","","0.121","0.1261","","","","","","1.035","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327222","15.141","0.005","19.367","0.007","40.82","0.015","90","","92.987","0.015","90","","11954","7","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C60 H64 Cu F6 N7 O1.5 P -","- C58 H59 Cu F6 N7 O P -","- C464 H472 Cu8 F48 N56 O8 P8 -","8","2","","Lei Zhou; Douglas Powell; Kenneth M. Nicholas","Copper(I) Complexes of Tripodal Tris(imidazolyl) Ligands: Potential Mimics of the Cu(A) Site of Hydroxylase Enzymes","Inorganic Chemistry","2007","46","","2316","2321","10.1021/ic061985+","","","0.71073","MoKα","","0.1291","0.1005","","","0.2495","0.2648","","","","","","1.047","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4327223","18.605","0.004","23.695","0.006","29.271","0.007","73.48","0.008","81.182","0.008","89.827","0.008","12214","5","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C118 H123 Cl4 Cu3 F18 N14 O4.5 P3 -","- C116 H119 Cu3 F17.997 N14 O4.5 P2.9995 -","- C464 H476 Cu12 F71.988 N56 O18 P11.998 -","4","2","","Lei Zhou; Douglas Powell; Kenneth M. Nicholas","Copper(I) Complexes of Tripodal Tris(imidazolyl) Ligands: Potential Mimics of the Cu(A) Site of Hydroxylase Enzymes","Inorganic Chemistry","2007","46","","2316","2321","10.1021/ic061985+","","","0.71073","MoKα","","0.0935","0.0813","","","0.2356","0.2452","","","","","","1.024","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327224","15.328","0.004","24.336","0.005","15.89","0.004","90","","100.667","0.008","90","","5825","2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H58 Cu F12 N6 O3 P2 -","- C52 H48 Cu F12 N6 O2 P2 -","- C208 H192 Cu4 F48 N24 O8 P8 -","4","1","","Lei Zhou; Douglas Powell; Kenneth M. Nicholas","Copper(I) Complexes of Tripodal Tris(imidazolyl) Ligands: Potential Mimics of the Cu(A) Site of Hydroxylase Enzymes","Inorganic Chemistry","2007","46","","2316","2321","10.1021/ic061985+","","","0.71073","MoKα","","0.0818","0.0612","","","0.1784","0.1917","","","","","","1.005","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327225","14.842","0.009","8.535","0.005","16.104","0.01","90","","101.345","0.009","90","","2000","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 Co N6 O6 -","- C20 H18 Co N6 O6 -","- C80 H72 Co4 N24 O24 -","4","1","","Miao Du; Xiu-Juan Jiang; Xiao-Jun Zhao","Molecular Tectonics of Mixed-Ligand Metal-Organic Frameworks: Positional Isomeric Effect, Metal-Directed Assembly, and Structural Diversification","Inorganic Chemistry","2007","46","","3984","3995","10.1021/ic062098+","","","0.71073","MoKα","","0.081","0.0483","","","0.1078","0.1218","","","","","","1.057","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327226","15.1489","0.0011","8.7777","0.0006","15.9117","0.0011","90","","102.533","0.001","90","","2065.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 Cd N6 O6 -","- C20 H18 Cd N6 O6 -","- C80 H72 Cd4 N24 O24 -","4","1","","Miao Du; Xiu-Juan Jiang; Xiao-Jun Zhao","Molecular Tectonics of Mixed-Ligand Metal-Organic Frameworks: Positional Isomeric Effect, Metal-Directed Assembly, and Structural Diversification","Inorganic Chemistry","2007","46","","3984","3995","10.1021/ic062098+","","","0.71073","MoKα","","0.0428","0.0362","","","0.0891","0.0912","","","","","","1.084","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327227","8.5894","0.0016","10.0957","0.0018","13.979","0.003","81.271","0.002","78.165","0.002","78.788","0.002","1155.9","0.4","293","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H20 Co N6 O7 -","- C20 H18 Co N6 O7 -","- C40 H36 Co2 N12 O14 -","2","1","","Miao Du; Xiu-Juan Jiang; Xiao-Jun Zhao","Molecular Tectonics of Mixed-Ligand Metal-Organic Frameworks: Positional Isomeric Effect, Metal-Directed Assembly, and Structural Diversification","Inorganic Chemistry","2007","46","","3984","3995","10.1021/ic062098+","","","0.71073","MoKα","","0.0536","0.0414","","","0.1301","0.1351","","","","","","1.075","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327228","10.105","0.004","28.745","0.012","13.072","0.005","90","","111.813","0.006","90","","3525","2","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H41 N9 Ni O10 -","- C29 H41 N9 Ni O10 -","- C116 H164 N36 Ni4 O40 -","4","1","","Miao Du; Xiu-Juan Jiang; Xiao-Jun Zhao","Molecular Tectonics of Mixed-Ligand Metal-Organic Frameworks: Positional Isomeric Effect, Metal-Directed Assembly, and Structural Diversification","Inorganic Chemistry","2007","46","","3984","3995","10.1021/ic062098+","","","0.71073","MoKα","","0.0878","0.0584","","","0.1216","0.1851","","","","","","1.024","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327229","19.813","0.006","10.013","0.003","23.062","0.007","90","","92.469","0.004","90","","4571","2","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H42 N14 O10 Zn2 -","- C46 H42 N14 O10 Zn2 -","- C184 H168 N56 O40 Zn8 -","4","1","","Miao Du; Xiu-Juan Jiang; Xiao-Jun Zhao","Molecular Tectonics of Mixed-Ligand Metal-Organic Frameworks: Positional Isomeric Effect, Metal-Directed Assembly, and Structural Diversification","Inorganic Chemistry","2007","46","","3984","3995","10.1021/ic062098+","","","0.71073","MoKα","","0.0604","0.038","","","0.0928","0.1055","","","","","","1.015","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327230","15.764","0.0009","12.8408","0.0007","37.833","0.002","90","","93.358","0.001","90","","7645.1","0.7","273","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H38 Cd2 N6 O18 -","- C28 H18 Cd2 N6 O18 -","- C224 H144 Cd16 N48 O144 -","8","1","","Miao Du; Xiu-Juan Jiang; Xiao-Jun Zhao","Molecular Tectonics of Mixed-Ligand Metal-Organic Frameworks: Positional Isomeric Effect, Metal-Directed Assembly, and Structural Diversification","Inorganic Chemistry","2007","46","","3984","3995","10.1021/ic062098+","","","0.71073","MoKα","","0.0483","0.0393","","","0.1093","0.1145","","","","","","1.087","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327231","10.9814","0.001","11.5837","0.0011","22.24","0.002","81.63","0.001","84.578","0.001","72.513","0.001","2665.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C49 H51 Cd2 N15 O12 -","- C49 H51 Cd2 N15 O12 -","- C98 H102 Cd4 N30 O24 -","2","1","","Miao Du; Xiu-Juan Jiang; Xiao-Jun Zhao","Molecular Tectonics of Mixed-Ligand Metal-Organic Frameworks: Positional Isomeric Effect, Metal-Directed Assembly, and Structural Diversification","Inorganic Chemistry","2007","46","","3984","3995","10.1021/ic062098+","","","0.71073","MoKα","","0.0534","0.0338","","","0.0753","0.0802","","","","","","1.002","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327232","30.989","0.006","8.96","0.0018","16.326","0.003","90","","100.1","0.03","90","","4462.9","1.5","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C12 H54 Cl8 Co2 N12 O16 P4 Zn4 -","- C12 H6 Cl8 Co2 N12 O16 P4 Zn4 -","- C48 H24 Cl32 Co8 N48 O64 P16 Zn16 -","4","0.5","","Peng Chen; Jiyang Li; Fangzheng Duan; Jihong Yu; Ruren Xu; Raj Pal Sharma","Syntheses and Characterizations of Three Low-Dimensional Chloride-Rich Zincophosphates Assembled about [d-Co(en)3]3+ and [dl-Co(en)3]3+ Complex Cations","Inorganic Chemistry","2007","46","","6683","6687","10.1021/ic062103+","","","0.71073","MoKα","","0.1045","0.0726","","","0.145","0.156","","","","","","1.072","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327233","31.103","0.006","9.0456","0.0018","16.499","0.003","90","","100.43","0.03","90","","4565.2","1.6","293","2","293","2","","","","","","","","8","C 1 2 1","C 2y","5","","","","- C24 H108 Cl16 Co4 N24 O32 P8 Zn8 -","- C24 H106 Cl16 Co4 N24 O32 P8 Zn8 -","- C48 H212 Cl32 Co8 N48 O64 P16 Zn16 -","2","0.5","","Peng Chen; Jiyang Li; Fangzheng Duan; Jihong Yu; Ruren Xu; Raj Pal Sharma","Syntheses and Characterizations of Three Low-Dimensional Chloride-Rich Zincophosphates Assembled about [d-Co(en)3]3+ and [dl-Co(en)3]3+ Complex Cations","Inorganic Chemistry","2007","46","","6683","6687","10.1021/ic062103+","","","0.71073","MoKα","","0.1685","0.086","","","0.1732","0.2434","","","","","","0.81","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327234","12.778","0.003","12.136","0.002","15.527","0.003","90","","112.12","0.03","90","","2230.6","0.9","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C6 H28 Cl2 Co N6 O12 P3 Zn2 -","- C6 H28 Cl2 Co N6 O12 P3 Zn2 -","- C24 H112 Cl8 Co4 N24 O48 P12 Zn8 -","4","1","","Peng Chen; Jiyang Li; Fangzheng Duan; Jihong Yu; Ruren Xu; Raj Pal Sharma","Syntheses and Characterizations of Three Low-Dimensional Chloride-Rich Zincophosphates Assembled about [d-Co(en)3]3+ and [dl-Co(en)3]3+ Complex Cations","Inorganic Chemistry","2007","46","","6683","6687","10.1021/ic062103+","","","0.71073","MoKα","","0.0945","0.0557","","","0.1188","0.1367","","","","","","1.085","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327235","10.1885","0.0016","4.9751","0.0008","10.2014","0.0017","90","","115.754","0.003","90","","465.73","0.13","153","2","153","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Ag6 O8 V2 -","- Ag6 O8 V2 -","- Ag12 O16 V4 -","2","0.25","","Thomas A. Albrecht; Charlotte L. Stern; Kenneth R. Poeppelmeier","The Ag2O-V2O5-HF(aq) System and Crystal Structure of α-Ag3VO4","Inorganic Chemistry","2007","46","","1704","1708","10.1021/ic062138+","","","0.71073","MoKα","","0.0317","0.0295","","","0.0771","0.0785","","","","","","1.12","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327236","10.775","0.0015","10.775","0.0015","27.882","0.006","90","","90","","120","","2803.4","0.8","293","2","293","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C22 H46 N11 O17 Yb -","- C22 H46 N11 O17 Yb -","- C66 H138 N33 O51 Yb3 -","3","0.5","","Jeff Vipond; Mark Woods; Piyu Zhao; Gyula Tircsó; Jimin Ren; Simon G. Bott; Doug Ogrin; Garry E. Kiefer; Zoltan Kovacs; A. Dean Sherry","A Bridge to Coordination Isomer Selection in Lanthanide(III) DOTA-tetraamide Complexes","Inorganic Chemistry","2007","46","","2584","2595","10.1021/ic062184+","","","0.71073","MoKα","","0.0263","0.0235","","0.0519","0.0496","","","","1.125","1.101","1.101","","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327237","7.5518","0.0002","8.871","0.0002","9.9838","0.0003","99.097","0.001","91.782","0.001","108.516","0.001","623.87","0.03","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H20 B2 F6 Mn N12 Sb -","- C18 H20 B2 F6 Mn N12 Sb -","- C18 H20 B2 F6 Mn N12 Sb -","1","0.5","","Ferdaus Hossain; Matthew A. Rigsby; Cole T. Duncan; Paul L. Milligan; Richard L. Lord; Mu-Hyun Baik; Franklin A. Schultz","Synthesis, Structure, and Properties of Low-Spin Manganese(III)-Poly(pyrazolyl)borate Complexes","Inorganic Chemistry","2007","46","","2596","2603","10.1021/ic062224+","","","0.71073","MoKα","","0.023","0.021","","","0.0546","0.0562","","","","","","1.041","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327238","10.4142","0.0004","14.1854","0.0006","12.4063","0.0005","90","","94.27","0.001","90","","1827.69","0.13","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H44 B2 F6 Mn N12 Sb -","- C30 H44 B2 F6 Mn N12 Sb -","- C60 H88 B4 F12 Mn2 N24 Sb2 -","2","0.5","","Ferdaus Hossain; Matthew A. Rigsby; Cole T. Duncan; Paul L. Milligan; Richard L. Lord; Mu-Hyun Baik; Franklin A. Schultz","Synthesis, Structure, and Properties of Low-Spin Manganese(III)-Poly(pyrazolyl)borate Complexes","Inorganic Chemistry","2007","46","","2596","2603","10.1021/ic062224+","","","0.71073","MoKα","","0.0476","0.0334","","","0.0923","0.1017","","","","","","1.07","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327239","17.4593","0.0016","20.0737","0.0018","10.2596","0.0009","90","","118.728","0.002","90","","3153.1","0.5","130","2","130","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H24 B2 F6 Mn N16 Sb -","- C24 H24 B2 F6 Mn N16 Sb -","- C96 H96 B8 F24 Mn4 N64 Sb4 -","4","0.5","","Ferdaus Hossain; Matthew A. Rigsby; Cole T. Duncan; Paul L. Milligan; Richard L. Lord; Mu-Hyun Baik; Franklin A. Schultz","Synthesis, Structure, and Properties of Low-Spin Manganese(III)-Poly(pyrazolyl)borate Complexes","Inorganic Chemistry","2007","46","","2596","2603","10.1021/ic062224+","","","0.71073","MoKα","","0.0426","0.035","","","0.0823","0.0878","","","","","","1.05","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327240","12.32","0.004","14.443","0.004","19.498","0.005","100.76","0.02","91.57","0.02","108.96","0.03","3209","1.7","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H43 Cl11 Cu N8 O16 -","- C51 H43 Cl11 Cu N8 O16 -","- C102 H86 Cl22 Cu2 N16 O32 -","2","1","","Zhi-Min Liu; Yu Liu; Sheng-Run Zheng; Zhi-Quan Yu; Mei Pan; Cheng-Yong Su","Assembly of Trigonal and Tetragonal Prismatic Cages from Octahedral Metal Ions and a Flexible Molecular Clip","Inorganic Chemistry","2007","46","","5814","5816","10.1021/ic062270+","","","0.71073","MoKα","","0.1522","0.0854","","","0.1689","0.1922","","","","","","1","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327241","12.361","0.003","14.5562","0.0018","18.766","0.003","97.043","0.011","93.595","0.014","111.148","0.015","3104.5","1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C104 H97 Cl15 Cu2 N20 O31 -","- C104 H97 Cl15 Cu2 N20 O31 -","- C104 H97 Cl15 Cu2 N20 O31 -","1","0.5","","Zhi-Min Liu; Yu Liu; Sheng-Run Zheng; Zhi-Quan Yu; Mei Pan; Cheng-Yong Su","Assembly of Trigonal and Tetragonal Prismatic Cages from Octahedral Metal Ions and a Flexible Molecular Clip","Inorganic Chemistry","2007","46","","5814","5816","10.1021/ic062270+","","","0.71073","MoKα","","0.1426","0.0894","","","0.1992","0.2173","","","","","","1.016","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327242","12.8802","0.0014","13.937","0.0016","19.775","0.002","105.353","0.002","91.982","0.002","107.158","0.002","3246.2","0.6","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C106 H88 Cl24 Cu2 F6 N18 O28 S2 -","- C106 H88 Cl24 Cu2 F6 N18 O28 S2 -","- C106 H88 Cl24 Cu2 F6 N18 O28 S2 -","1","0.5","","Zhi-Min Liu; Yu Liu; Sheng-Run Zheng; Zhi-Quan Yu; Mei Pan; Cheng-Yong Su","Assembly of Trigonal and Tetragonal Prismatic Cages from Octahedral Metal Ions and a Flexible Molecular Clip","Inorganic Chemistry","2007","46","","5814","5816","10.1021/ic062270+","","","0.71073","MoKα","","0.1133","0.0524","","","0.1075","0.1294","","","","","","1.023","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327243","16.5876","0.0007","16.5876","0.0007","19.004","0.0007","90","","90","","120","","4528.4","0.3","293","2","293","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C154 H146 Cl6 F24 N24 O60 S8 Zn4 -","- C154 H144 Cl6 F24 N24 O60 S8 Zn4 -","- C154 H144 Cl6 F24 N24 O60 S8 Zn4 -","1","0.0833333","","Zhi-Min Liu; Yu Liu; Sheng-Run Zheng; Zhi-Quan Yu; Mei Pan; Cheng-Yong Su","Assembly of Trigonal and Tetragonal Prismatic Cages from Octahedral Metal Ions and a Flexible Molecular Clip","Inorganic Chemistry","2007","46","","5814","5816","10.1021/ic062270+","","","0.71073","MoKα","","0.0809","0.0569","","","0.1345","0.148","","","","","","1.013","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327244","8.9805","0.0014","13.021","0.002","13.71","0.002","90.878","0.004","108.591","0.003","102.259","0.004","1478.9","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H30 N10 O9 -","- C27 H30 N10 O9 -","- C54 H60 N20 O18 -","2","1","","D. Amilan Jose; D. Krishna Kumar; Bishwajit Ganguly; Amitava Das","Rugby-Ball-Shaped Sulfate-Water-Sulfate Adduct Encapsulated in a Neutral Molecular Receptor Capsule","Inorganic Chemistry","2007","46","","5817","5819","10.1021/ic062466+","","","0.71073","MoKα","","0.1793","0.0861","","","0.1526","0.1918","","","","","","1.128","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327245","8","0.002","14.482","0.004","14.837","0.004","99.56","0.004","91.818","0.004","93.915","0.005","1689.5","0.8","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H37 N11 O10 -","- C30 H37 N11 O10 -","- C60 H74 N22 O20 -","2","1","","D. Amilan Jose; D. Krishna Kumar; Bishwajit Ganguly; Amitava Das","Rugby-Ball-Shaped Sulfate-Water-Sulfate Adduct Encapsulated in a Neutral Molecular Receptor Capsule","Inorganic Chemistry","2007","46","","5817","5819","10.1021/ic062466+","","","0.71073","MoKα","","0.0959","0.0569","","","0.153","0.1995","","","","","","0.983","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327246","17.23","0.01","17.23","0.01","39.99","0.05","90","","90","","120","","10281","15","100","2","100","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C118 H240 N24 O44 S2 -","- C102 H162.12 N23 O29 S2 -","- C306 H486.36 N69 O87 S6 -","3","0.166667","","D. Amilan Jose; D. Krishna Kumar; Bishwajit Ganguly; Amitava Das","Rugby-Ball-Shaped Sulfate-Water-Sulfate Adduct Encapsulated in a Neutral Molecular Receptor Capsule","Inorganic Chemistry","2007","46","","5817","5819","10.1021/ic062466+","","","0.71073","MoKα","","0.0878","0.0624","","","0.1633","0.177","","","","","","0.923","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327248","15.2157","0.0004","11.137","0.0004","19.9789","0.0006","90","","106.995","0.003","90","","3237.72","0.18","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H44 N2 Pt S2 Si2 -","- C30 H44 N2 Pt S2 Si2 -","- C120 H176 N8 Pt4 S8 Si8 -","4","1","","József Sándor Pap; Flávio Luiz Benedito; Eberhard Bothe; Eckhard Bill; Serena DeBeer George; Thomas Weyhermüller; Karl Wieghardt","Dimerization Processes of Square Planar [PtII(tbpy)(dithiolato.)]+ Radicals","Inorganic Chemistry","2007","46","","4187","4196","10.1021/ic070130+","","","0.71073","MoKα","","0.0347","0.0275","","","0.0527","0.0549","","","","","","1.105","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327249","10.8207","0.0003","21.3485","0.0006","20.2643","0.0006","90","","97.13","0.003","90","","4645","0.2","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C83 H106 Cl6 F12 N4 P2 Pt2 S4 -","- C83 H106 Cl6 F12 N4 P2 Pt2 S4 -","- C166 H212 Cl12 F24 N8 P4 Pt4 S8 -","2","0.5","","József Sándor Pap; Flávio Luiz Benedito; Eberhard Bothe; Eckhard Bill; Serena DeBeer George; Thomas Weyhermüller; Karl Wieghardt","Dimerization Processes of Square Planar [PtII(tbpy)(dithiolato.)]+ Radicals","Inorganic Chemistry","2007","46","","4187","4196","10.1021/ic070130+","","","0.71073","MoKα","","0.0396","0.0298","","","0.0602","0.0641","","","","","","1.035","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327250","11.731","0.0006","13.7027","0.0007","20.5167","0.0012","103.082","0.004","105.661","0.004","96.134","0.004","3043.1","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C61 H59 Cl9 P2 Pt S2 -","- C61 H59 Cl9 P2 Pt S2 -","- C122 H118 Cl18 P4 Pt2 S4 -","2","1","","József Sándor Pap; Flávio Luiz Benedito; Eberhard Bothe; Eckhard Bill; Serena DeBeer George; Thomas Weyhermüller; Karl Wieghardt","Dimerization Processes of Square Planar [PtII(tbpy)(dithiolato.)]+ Radicals","Inorganic Chemistry","2007","46","","4187","4196","10.1021/ic070130+","","","0.71073","MoKα","","0.0591","0.0512","","","0.1269","0.1321","","","","","","1.102","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327251","11.992","0.0008","35.632","0.002","11.1812","0.0006","90","","90","","90","","4777.7","0.5","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C51 H60 Pt S4 -","- C50 H52 Pt S4 -","- C200 H208 Pt4 S16 -","4","1","","József Sándor Pap; Flávio Luiz Benedito; Eberhard Bothe; Eckhard Bill; Serena DeBeer George; Thomas Weyhermüller; Karl Wieghardt","Dimerization Processes of Square Planar [PtII(tbpy)(dithiolato.)]+ Radicals","Inorganic Chemistry","2007","46","","4187","4196","10.1021/ic070130+","","","0.71073","MoKα","","0.0786","0.0525","","","0.1198","0.132","","","","","","1.011","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327252","8.2593","0.0004","15.3005","0.0007","17.838","0.0009","90","","100.998","0.001","90","","2212.81","0.19","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H38 O2 Ti -","- C24 H38 O2 Ti -","- C96 H152 O8 Ti4 -","4","1","","Tamara E. Hanna; Emil Lobkovsky; Paul J. Chirik","Dihydrogen and Silane Addition to Base-Free, Monomeric Bis(cyclopentadienyl)titanium Oxides","Inorganic Chemistry","2007","46","","2359","2361","10.1021/ic070205+","","","0.71073","MoKα","","0.0815","0.0531","","","0.1285","0.1427","","","","","","1.02","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327253","13.0247","0.0009","20.0354","0.0013","21.3948","0.0013","90","","95.895","0.003","90","","5553.6","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H84 O6 Si4 Ti4 -","- C48 H84 O6 Si4 Ti4 -","- C192 H336 O24 Si16 Ti16 -","4","1","","Tamara E. Hanna; Emil Lobkovsky; Paul J. Chirik","Dihydrogen and Silane Addition to Base-Free, Monomeric Bis(cyclopentadienyl)titanium Oxides","Inorganic Chemistry","2007","46","","2359","2361","10.1021/ic070205+","","","0.71073","MoKα","","0.0529","0.0405","","","0.1112","0.1172","","","","","","1.111","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327254","17.1305","0.0013","8.6746","0.0009","21.761","0.002","90","","104.178","0.003","90","","3135.2","0.5","173","2","173","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C34 H46 O Si2 Ti -","- C34 H46 O Si2 Ti -","- C136 H184 O4 Si8 Ti4 -","4","1","","Tamara E. Hanna; Emil Lobkovsky; Paul J. Chirik","Dihydrogen and Silane Addition to Base-Free, Monomeric Bis(cyclopentadienyl)titanium Oxides","Inorganic Chemistry","2007","46","","2359","2361","10.1021/ic070205+","","","0.71073","MoKα","","0.0658","0.038","","","0.0918","0.1015","","","","","","1.028","","","","has coordinates","179375","2020-10-21","18:00:00",""
"4327255","17.9821","0.0011","9.7449","0.0006","22.7374","0.0015","90","","90","","90","","3984.4","0.4","295","2","295","2","","","","","","","","5","P b c n","-P 2n 2ab","60","Co(DH)2(4-t-BuPy)","","","- C17 H27 Co N5 O4 -","- C17 H27 Co N5 O4 -","- C136 H216 Co8 N40 O32 -","8","1","","Alan M. Stolzenberg; Sarah R. Workman; Jessica E. Gutshall; Jeffrey L. Petersen; Novruz Akhmedov","Syntheses and Characterization of Organo-Group 14 Cobaloxime Compounds","Inorganic Chemistry","2007","46","","6744","6754","10.1021/ic070251+","","x-ray","0.71073","MoKα","","0.0579","0.043","","","0.1099","0.123","","","","","","1.035","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327256","11.6443","0.0006","15.6085","0.0008","22.6354","0.0012","90","","96.634","0.001","90","","4086.4","0.4","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(4-t-BuPy)Co(DH)2(SnPh3)","","","- C39 H52 Co N5 O5 Sn -","- C39 H52 Co N5 O5 Sn -","- C156 H208 Co4 N20 O20 Sn4 -","4","1","","Alan M. Stolzenberg; Sarah R. Workman; Jessica E. Gutshall; Jeffrey L. Petersen; Novruz Akhmedov","Syntheses and Characterization of Organo-Group 14 Cobaloxime Compounds","Inorganic Chemistry","2007","46","","6744","6754","10.1021/ic070251+","","x-ray","0.71073","MoKα","","0.042","0.0305","","","0.0725","0.0772","","","","","","1.026","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327257","15.0104","0.0007","15.7693","0.0008","16.623","0.0008","90","","114.348","0.001","90","","3584.8","0.3","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(4-t-BuPy)Co(DH)2(PbPh3)","","","- C35 H42 Co N5 O4 Pb -","- C35 H42 Co N5 O4 Pb -","- C140 H168 Co4 N20 O16 Pb4 -","4","1","","Alan M. Stolzenberg; Sarah R. Workman; Jessica E. Gutshall; Jeffrey L. Petersen; Novruz Akhmedov","Syntheses and Characterization of Organo-Group 14 Cobaloxime Compounds","Inorganic Chemistry","2007","46","","6744","6754","10.1021/ic070251+","","x-ray","0.71073","MoKα","","0.0358","0.0251","","","0.0549","0.0582","","","","","","1.014","","","","has coordinates,has disorder","179375","2020-10-21","18:00:00",""
"4327258","12.339","0.004","12.339","0.004","9.339","0.003","90","","90","","120","","1231.4","0.7","293.1","","","","","","","","","","","6","P 3","P 3","143","","","","- C18 H30.5 Br1.5 Co N10 O4 -","- C18 H22.5 Br1.5 Co N10 O3.995 -","- C36 H45 Br3 Co2 N20 O7.99 -","2","0.666667","","Hirofumi Nakamura; Yukinari Sunatsuki; Masaaki Kojima; Naohide Matsumoto","Chiral Recognition and Conglomerate Crystallization Induced by Self-Organization of Cobalt(III) Complexes of a Tripodal Ligand Containing Three Imidazole Groups","Inorganic Chemistry","2007","46","","8170","8181","10.1021/ic070286+","","","0.71075","MoKα","","","0.0832","","","","0.2454","","","","","","1.086","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327259","12.388","0.003","12.388","0.003","9.389","0.003","90","","90","","120","","1247.8","0.6","296.1","","","","","","","","","","","6","P 3","P 3","143","","","","- C18 H26.5 Co I1.5 N10 O2 -","- C18 H22.5 Co I1.5 N10 O1.995 -","- C36 H45 Co2 I3 N20 O3.99 -","2","0.666667","","Hirofumi Nakamura; Yukinari Sunatsuki; Masaaki Kojima; Naohide Matsumoto","Chiral Recognition and Conglomerate Crystallization Induced by Self-Organization of Cobalt(III) Complexes of a Tripodal Ligand Containing Three Imidazole Groups","Inorganic Chemistry","2007","46","","8170","8181","10.1021/ic070286+","","","0.71075","MoKα","","","0.0889","","","","0.2648","","","","","","1.141","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327260","12.254","0.004","12.254","0.004","9.299","0.002","90","","90","","120","","1209.3","0.6","296.1","","","","","","","","","","","7","P 3","P 3","143","","","","- C18 H27.5 B1.5 Co F6 N10 O2.5 -","- C18 H22.5 B1.505 Co F6.02 N10 O2.48 -","- C36 H45 B3.01 Co2 F12.04 N20 O4.96 -","2","0.666667","","Hirofumi Nakamura; Yukinari Sunatsuki; Masaaki Kojima; Naohide Matsumoto","Chiral Recognition and Conglomerate Crystallization Induced by Self-Organization of Cobalt(III) Complexes of a Tripodal Ligand Containing Three Imidazole Groups","Inorganic Chemistry","2007","46","","8170","8181","10.1021/ic070286+","","","0.71075","MoKα","","","0.0564","","","","0.1591","","","","","","1.116","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327261","12.304","0.003","12.304","0.003","9.315","0.003","90","","90","","120","","1221.3","0.6","296.1","","","","","","","","","","","6","P 3","P 3","143","","","","- C18 H24.5 Cl1.5 Co N10 O7 -","- C18 H22.5 Cl1.505 Co N10 O7.015 -","- C36 H45 Cl3.01 Co2 N20 O14.03 -","2","0.666667","","Hirofumi Nakamura; Yukinari Sunatsuki; Masaaki Kojima; Naohide Matsumoto","Chiral Recognition and Conglomerate Crystallization Induced by Self-Organization of Cobalt(III) Complexes of a Tripodal Ligand Containing Three Imidazole Groups","Inorganic Chemistry","2007","46","","8170","8181","10.1021/ic070286+","","","0.71075","MoKα","","","0.0506","","","","0.1425","","","","","","1.118","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327262","25.096","0.006","13.469","0.004","17.884","0.004","90","","91.545","0.008","90","","6043","3","296.1","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C18 H29.5 Co F9 N10 O3.5 P1.5 -","- C18 H22.5 Co F9 N10 O3.5 P1.5 -","- C144 H180 Co8 F72 N80 O28 P12 -","8","1","","Hirofumi Nakamura; Yukinari Sunatsuki; Masaaki Kojima; Naohide Matsumoto","Chiral Recognition and Conglomerate Crystallization Induced by Self-Organization of Cobalt(III) Complexes of a Tripodal Ligand Containing Three Imidazole Groups","Inorganic Chemistry","2007","46","","8170","8181","10.1021/ic070286+","","","0.71075","MoKα","","","0.0662","","","","0.1852","","","","","","1.078","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327263","11.919","0.004","11.919","0.004","57.12","0.03","90","","90","","120","","7027","5","293.1","","","","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C18 H29.5 Co I0.5 N10 O4 -","- C18 H29.5 Co I0.5 N10 O4 -","- C216 H354 Co12 I6 N120 O48 -","12","0.333333","","Hirofumi Nakamura; Yukinari Sunatsuki; Masaaki Kojima; Naohide Matsumoto","Chiral Recognition and Conglomerate Crystallization Induced by Self-Organization of Cobalt(III) Complexes of a Tripodal Ligand Containing Three Imidazole Groups","Inorganic Chemistry","2007","46","","8170","8181","10.1021/ic070286+","","","0.71075","MoKα","","","0.0263","","","","0.0674","","","","","","1.106","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333173","10.574","0.002","22.681","0.004","13.041","0.002","90","","111.31","0.02","90","","2913.8","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis-1-ethyl-3-methyl-imidazolium dodecakis-μ-bromo- hexa bromo-beryillido-hexa-zirconium","","- C24 H44 Be Br18 N8 Zr6 -","- C24 H44 Be Br18 N8 Zr6 -","- C48 H88 Be2 Br36 N16 Zr12 -","2","0.5","","Willems, Johannes B.; Rohm, Henning W.; Geers, Christine; Köckerling, Martin","Reversible bromide-chloride exchange in zirconium cluster compounds: synthesis by means of ionic liquids, structures, and some spectral data of (EMIm)(4)[(Zr(6)Z)Br(18)] cluster phases (Z = Be, Fe).","Inorganic chemistry","2007","46","15","6197","6203","10.1021/ic061624u","","","0.71073","MoKα","","0.1005","0.0411","","","0.0768","0.0855","","","","","","0.721","","","","has coordinates","179434","2020-10-21","18:00:00",""
"4333174","10.5746","0.0004","22.6567","0.0009","13.026","0.0005","90","","111.279","0.002","90","","2908.1","0.2","566","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis-1-ethyl-3-methyl-imidazolium dodecakis-μ-bromo- hexa bromo-ferro-hexa-zirconium","","- C24 H44 Br18 Fe N8 Zr6 -","- C24 H44 Br18 Fe N8 Zr6 -","- C48 H88 Br36 Fe2 N16 Zr12 -","2","0.5","","Willems, Johannes B.; Rohm, Henning W.; Geers, Christine; Köckerling, Martin","Reversible bromide-chloride exchange in zirconium cluster compounds: synthesis by means of ionic liquids, structures, and some spectral data of (EMIm)(4)[(Zr(6)Z)Br(18)] cluster phases (Z = Be, Fe).","Inorganic chemistry","2007","46","15","6197","6203","10.1021/ic061624u","","","0.71073","Mokα","","0.0843","0.045","","","0.1067","0.1261","","","","","","1.036","","","","has coordinates","179434","2020-10-21","18:00:00",""
"4333176","14.206","0.0005","15.278","0.0005","21.881","0.0007","90.668","0.002","108.425","0.002","94.286","0.002","4489.9","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C264 H136 Cl10 Mn2 N14 S2 -","- C264 H136 Cl10 Mn2 N14 S2 -","- C264 H136 Cl10 Mn2 N14 S2 -","1","0.5","","Konarev, Dmitri V.; Khasanov, Salavat S.; Saito, Gunzi; Otsuka, Akihiro; Lyubovskaya, Rimma N.","Ionic and neutral C60 complexes with coordination assemblies of metal tetraphenylporphyrins, MIITPP2.DMP (M=Mn, Zn). Coexistence of (C60-)2 dimers bonded by one and two single bonds in the same compound.","Inorganic chemistry","2007","46","18","7601","7609","10.1021/ic061628z","","","0.71073","MoKα","","0.0647","0.0588","","","0.1592","0.1632","","","","","","1.019","","","","has coordinates,has disorder","179434","2020-10-21","18:00:00",""
"4333177","14.042","0.001","30.708","0.002","18.186","0.001","90","","105.794","0.002","90","","7545.8","0.8","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C238 H90 Cl4 N10 Zn2 -","- C238 H90 Cl4 N10 Zn2 -","- C476 H180 Cl8 N20 Zn4 -","2","0.5","","Konarev, Dmitri V.; Khasanov, Salavat S.; Saito, Gunzi; Otsuka, Akihiro; Lyubovskaya, Rimma N.","Ionic and neutral C60 complexes with coordination assemblies of metal tetraphenylporphyrins, MIITPP2.DMP (M=Mn, Zn). Coexistence of (C60-)2 dimers bonded by one and two single bonds in the same compound.","Inorganic chemistry","2007","46","18","7601","7609","10.1021/ic061628z","","","0.71073","MoKα","","0.0949","0.0597","","","0.1686","0.1871","","","","","","1.087","","","","has coordinates,has disorder","179434","2020-10-21","18:00:00",""
"4333210","20.6186","0.0011","10.3248","0.0005","20.6359","0.0013","90","","106.432","0.004","90","","4213.6","0.4","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H30 Cl3 N4 Si2 Ta -","- C10 H30 Cl3 N4 Si2 Ta -","- C80 H240 Cl24 N32 Si16 Ta8 -","8","2","","Gaess, Daniel; Harms, Klaus; Pokoj, Michael; Stolz, Wolfgang; Sundermeyer, Jörg","Volatile Imido−Hydrazido Compounds of the Refractory Metals Niobium, Tantalum, Molybdenum, and Tungsten","Inorganic Chemistry","2007","46","16","6688","6701","10.1021/ic062435e","","","0.71073","MoKα","","0.0385","0.0286","","","0.0571","0.0595","","","","","","0.986","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333211","15.8391","0.0012","7.9386","0.0004","20.9423","0.0016","90","","93.747","0.006","90","","2627.7","0.3","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H30 Cl F5 N5 Si2 Ta -","- C16 H30 Cl F5 N5 Si2 Ta -","- C64 H120 Cl4 F20 N20 Si8 Ta4 -","4","1","","Gaess, Daniel; Harms, Klaus; Pokoj, Michael; Stolz, Wolfgang; Sundermeyer, Jörg","Volatile Imido−Hydrazido Compounds of the Refractory Metals Niobium, Tantalum, Molybdenum, and Tungsten","Inorganic Chemistry","2007","46","16","6688","6701","10.1021/ic062435e","","","0.71073","MoKα","","0.0327","0.0229","","","0.0496","0.0515","","","","","","0.921","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333212","17.5882","0.0012","10.3497","0.0004","15.9474","0.001","90","","94.528","0.005","90","","2893.9","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H46 N5 Si2 Ta -","- C21 H46 N5 Si2 Ta -","- C84 H184 N20 Si8 Ta4 -","4","1","","Gaess, Daniel; Harms, Klaus; Pokoj, Michael; Stolz, Wolfgang; Sundermeyer, Jörg","Volatile Imido−Hydrazido Compounds of the Refractory Metals Niobium, Tantalum, Molybdenum, and Tungsten","Inorganic Chemistry","2007","46","16","6688","6701","10.1021/ic062435e","","","0.71073","MoKα","","0.0291","0.0222","","","0.0521","0.0534","","","","","","0.961","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333213","10.2499","0.0017","16.1415","0.0018","16.683","0.003","90","","103.302","0.019","90","","2686.1","0.8","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H45 N6 Si2 Ta -","- C16 H45 N6 Si2 Ta -","- C64 H180 N24 Si8 Ta4 -","4","1","","Gaess, Daniel; Harms, Klaus; Pokoj, Michael; Stolz, Wolfgang; Sundermeyer, Jörg","Volatile Imido−Hydrazido Compounds of the Refractory Metals Niobium, Tantalum, Molybdenum, and Tungsten","Inorganic Chemistry","2007","46","16","6688","6701","10.1021/ic062435e","","","0.71073","MoKα","","0.056","0.0375","","","0.0813","0.0858","","","","","","0.921","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333214","8.9516","0.0012","30.228","0.003","10.9993","0.0015","90","","105.645","0.015","90","","2866","0.7","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H49 N6 Nb Si2 -","- C18 H49 N6 Nb Si2 -","- C72 H196 N24 Nb4 Si8 -","4","1","","Gaess, Daniel; Harms, Klaus; Pokoj, Michael; Stolz, Wolfgang; Sundermeyer, Jörg","Volatile Imido−Hydrazido Compounds of the Refractory Metals Niobium, Tantalum, Molybdenum, and Tungsten","Inorganic Chemistry","2007","46","16","6688","6701","10.1021/ic062435e","","","0.71073","MoKα","","0.0332","0.0239","","","0.0571","0.0586","","","","","","0.91","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333215","14.8943","0.0012","10.2528","0.0005","14.6359","0.0012","90","","100.874","0.007","90","","2194.9","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H33 Br N4 Si W -","- C13 H33 Br N4 Si W -","- C52 H132 Br4 N16 Si4 W4 -","4","1","","Gaess, Daniel; Harms, Klaus; Pokoj, Michael; Stolz, Wolfgang; Sundermeyer, Jörg","Volatile Imido−Hydrazido Compounds of the Refractory Metals Niobium, Tantalum, Molybdenum, and Tungsten","Inorganic Chemistry","2007","46","16","6688","6701","10.1021/ic062435e","","","0.71073","MoKα","","0.0282","0.0208","","","0.0458","0.0472","","","","","","0.963","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333217","6.5314","0.0007","7.5658","0.0009","9.6048","0.0011","100.962","0.002","96.885","0.002","107.436","0.002","436.56","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C4 As2 F16 N2 S6 -","- C4 As2 F16 N2 S6 -","- C4 As2 F16 N2 S6 -","1","0.5","","Decken, Andreas; Ebdah, Mohammad; Kowalczyk, Radoslaw M.; Landee, Christopher P.; McInnes, Eric J. L.; Passmore, Jack; Shuvaev, Konstantin V.; Thompson, Laurence K.","Tuning intermolecular magnetic exchange interactions in the solids C(x)F(2)(x)(CNSSS)(2)(AsF(6))(2): structural, EPR, and magnetic characterization of dimeric (x = 2, 4) diradicals.","Inorganic chemistry","2007","46","19","7756","7766","10.1021/ic062475i","","","0.71073","MoKα","","0.0429","0.0412","","","0.1146","0.1172","","","","","","1.062","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333218","10.6398","0.0016","7.968","0.0011","12.7468","0.0019","90","","99.758","0.002","90","","1065","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 As2 F20 N2 S6 -","- C6 As2 F20 N2 S6 -","- C12 As4 F40 N4 S12 -","2","0.5","","Decken, Andreas; Ebdah, Mohammad; Kowalczyk, Radoslaw M.; Landee, Christopher P.; McInnes, Eric J. L.; Passmore, Jack; Shuvaev, Konstantin V.; Thompson, Laurence K.","Tuning intermolecular magnetic exchange interactions in the solids C(x)F(2)(x)(CNSSS)(2)(AsF(6))(2): structural, EPR, and magnetic characterization of dimeric (x = 2, 4) diradicals.","Inorganic chemistry","2007","46","19","7756","7766","10.1021/ic062475i","","","0.71073","MoKα","","0.0717","0.0389","","","0.0874","0.0962","","","","","","1.044","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333219","27.054","0.003","12.1104","0.0015","15.1194","0.0019","90","","98.159","0.002","90","","4903.5","1","141","2","141","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H27 K N5 O -","- C18 H24 K N4 O6 -","- C144 H192 K8 N32 O48 -","8","1","","Schelter, Eric J.; Morris, David E.; Scott, Brian L.; Thompson, Joe D.; Kiplinger, Jaqueline L.","Toward actinide molecular magnetic materials: coordination polymers of U(IV) and the organic acceptors TCNQ and TCNE.","Inorganic chemistry","2007","46","14","5528","5536","10.1021/ic0700295","","","0.71073","MoKα","","0.0975","0.0537","","","0.1333","0.159","","","","","","0.829","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333220","9.6186","0.0008","15.4228","0.0013","12.8644","0.0011","90","","107.589","0.002","90","","1819.2","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H56 Cl2 N2 Os P4 S4 -","- C24 H56 Cl2 N2 Os P4 S4 -","- C48 H112 Cl4 N4 Os2 P8 S8 -","2","0.5","","Cheung, Wai-Man; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Synthesis, crystal structures, and reactivity of osmium(II) and -(IV) complexes containing a dithioimidodiphosphinate ligand.","Inorganic chemistry","2007","46","14","5754","5762","10.1021/ic070048e","","","0.71073","MoKα","","0.0485","0.0355","","","0.0652","0.0691","","","","","","1.033","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333221","9.6387","0.0006","23.5292","0.0014","21.6939","0.0013","90","","95.514","0.001","90","","4897.2","0.5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H70 N4 Os P4 S4 -","- C40 H70 N4 Os P4 S4 -","- C160 H280 N16 Os4 P16 S16 -","4","1","","Cheung, Wai-Man; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Synthesis, crystal structures, and reactivity of osmium(II) and -(IV) complexes containing a dithioimidodiphosphinate ligand.","Inorganic chemistry","2007","46","14","5754","5762","10.1021/ic070048e","","","0.71073","MoKα","","0.0947","0.0597","","","0.0881","0.0952","","","","","","1.003","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333222","12.5973","0.0012","12.7653","0.0012","17.1029","0.0017","102.619","0.002","98.489","0.002","100.346","0.002","2589.7","0.4","250","2","250","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H74 N4 Os P4 S4 -","- C42 H57 N4 Os P4 S4 -","- C84 H114 N8 Os2 P8 S8 -","2","1","","Cheung, Wai-Man; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Synthesis, crystal structures, and reactivity of osmium(II) and -(IV) complexes containing a dithioimidodiphosphinate ligand.","Inorganic chemistry","2007","46","14","5754","5762","10.1021/ic070048e","","","0.71073","MoKα","","0.0433","0.0338","","","0.0814","0.0852","","","","","","0.994","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333223","9.922","0.006","14.963","0.009","26.216","0.015","90","","94.05","0.014","90","","3882","4","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H58 N2 O3 Os P4 S5 -","- C24 H58 N2 O3 Os P4 S5 -","- C96 H232 N8 O12 Os4 P16 S20 -","4","1","","Cheung, Wai-Man; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Synthesis, crystal structures, and reactivity of osmium(II) and -(IV) complexes containing a dithioimidodiphosphinate ligand.","Inorganic chemistry","2007","46","14","5754","5762","10.1021/ic070048e","","","0.71073","MoKα","","0.0824","0.0532","","","0.0906","0.1037","","","","","","0.983","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333224","9.4626","0.0015","10.1442","0.0016","19.756","0.003","90","","90.433","0.003","90","","1896.3","0.5","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C26 H62 N2 O2 Os P4 S4 -","- C26 H62 N2 O2 Os P4 S4 -","- C52 H124 N4 O4 Os2 P8 S8 -","2","0.5","","Cheung, Wai-Man; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Synthesis, crystal structures, and reactivity of osmium(II) and -(IV) complexes containing a dithioimidodiphosphinate ligand.","Inorganic chemistry","2007","46","14","5754","5762","10.1021/ic070048e","","","0.71073","MoKα","","0.0406","0.0338","","","0.0756","0.0786","","","","","","1.026","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333225","8.8731","0.0001","11.4664","0.0002","21.2205","0.0003","90","","90","","90","","2159.03","0.05","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C18 H26 N5 O6 S Tc -","- C18 H26 N5 O6 S Tc -","- C72 H104 N20 O24 S4 Tc4 -","4","1","","Cantorias, Melchor V.; Howell, Robertha C.; Todaro, Louis; Cyr, John E.; Berndorff, Dietmar; Rogers, Robin D.; Francesconi, Lynn C.","MO tripeptide diastereomers (M=99/99mTc, Re): models to identify the structure of 99mTc peptide targeted radiopharmaceuticals.","Inorganic chemistry","2007","46","18","7326","7340","10.1021/ic070077p","","","0.71073","MoKα","","0.0668","0.0507","","0.0905","0.0829","","","","1.193","1.19","1.19","","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333226","6.634","0.0013","14.722","0.003","18.159","0.004","90","","90","","90","","1773.5","0.6","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 N4 O5 Re S -","- C14 H19 N4 O5 Re S -","- C56 H76 N16 O20 Re4 S4 -","4","1","","Cantorias, Melchor V.; Howell, Robertha C.; Todaro, Louis; Cyr, John E.; Berndorff, Dietmar; Rogers, Robin D.; Francesconi, Lynn C.","MO tripeptide diastereomers (M=99/99mTc, Re): models to identify the structure of 99mTc peptide targeted radiopharmaceuticals.","Inorganic chemistry","2007","46","18","7326","7340","10.1021/ic070077p","","","0.71073","MoKα","","0.0542","0.0495","","","0.1105","0.1134","","","","","","1.037","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333227","10.52","0.002","6.802","0.0014","11.335","0.002","90","","97.84","0.03","90","","803.5","0.3","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C14 H17 N4 O4 Re S -","- C14 H17 N4 O4 Re S -","- C28 H34 N8 O8 Re2 S2 -","2","1","","Cantorias, Melchor V.; Howell, Robertha C.; Todaro, Louis; Cyr, John E.; Berndorff, Dietmar; Rogers, Robin D.; Francesconi, Lynn C.","MO tripeptide diastereomers (M=99/99mTc, Re): models to identify the structure of 99mTc peptide targeted radiopharmaceuticals.","Inorganic chemistry","2007","46","18","7326","7340","10.1021/ic070077p","","","0.71073","MoKα","","0.0271","0.0252","","","0.0564","0.0574","","","","","","1.034","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333228","9.648","0.0019","10.186","0.002","12.272","0.003","90","","106.36","0.03","90","","1157.2","0.5","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C18 H30 N5 O6 Re S -","- C18 H30 N5 O6 Re S -","- C36 H60 N10 O12 Re2 S2 -","2","1","","Cantorias, Melchor V.; Howell, Robertha C.; Todaro, Louis; Cyr, John E.; Berndorff, Dietmar; Rogers, Robin D.; Francesconi, Lynn C.","MO tripeptide diastereomers (M=99/99mTc, Re): models to identify the structure of 99mTc peptide targeted radiopharmaceuticals.","Inorganic chemistry","2007","46","18","7326","7340","10.1021/ic070077p","","","0.71073","MoKα","","0.0492","0.0416","","","0.093","0.0965","","","","","","1.043","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333229","17.5","0.004","10.578","0.002","13.384","0.003","90","","90","","90","","2477.6","0.9","100","2","100","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C20 H32 N5 O5 Re S -","- C20 H26 N5 O5 Re S -","- C80 H104 N20 O20 Re4 S4 -","4","1","","Cantorias, Melchor V.; Howell, Robertha C.; Todaro, Louis; Cyr, John E.; Berndorff, Dietmar; Rogers, Robin D.; Francesconi, Lynn C.","MO tripeptide diastereomers (M=99/99mTc, Re): models to identify the structure of 99mTc peptide targeted radiopharmaceuticals.","Inorganic chemistry","2007","46","18","7326","7340","10.1021/ic070077p","","","0.71073","MoKα","","0.0345","0.0272","","","0.0492","0.0512","","","","","","1.054","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333230","6.634","0.0013","14.613","0.003","18.22","0.004","90","","90","","90","","1766.3","0.6","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 N4 O5 S Tc -","- C14 H19 N4 O5 S Tc -","- C56 H76 N16 O20 S4 Tc4 -","4","1","","Cantorias, Melchor V.; Howell, Robertha C.; Todaro, Louis; Cyr, John E.; Berndorff, Dietmar; Rogers, Robin D.; Francesconi, Lynn C.","MO tripeptide diastereomers (M=99/99mTc, Re): models to identify the structure of 99mTc peptide targeted radiopharmaceuticals.","Inorganic chemistry","2007","46","18","7326","7340","10.1021/ic070077p","","","0.71073","MoKα","","0.0431","0.0343","","","0.0659","0.0693","","","","","","1.027","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333231","10.704","0.002","20.966","0.004","30.939","0.006","90","","90","","90","","6943","2","295","2","295","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C54 H88 N15 O20 S3 Tc3 -","- C54 H78 N15 O20 S3 Tc3 -","- C216 H312 N60 O80 S12 Tc12 -","4","1","","Cantorias, Melchor V.; Howell, Robertha C.; Todaro, Louis; Cyr, John E.; Berndorff, Dietmar; Rogers, Robin D.; Francesconi, Lynn C.","MO tripeptide diastereomers (M=99/99mTc, Re): models to identify the structure of 99mTc peptide targeted radiopharmaceuticals.","Inorganic chemistry","2007","46","18","7326","7340","10.1021/ic070077p","","","0.71073","MoKα","","0.0703","0.0445","","","0.0971","0.105","","","","","","1.011","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333232","9.0754","0.0004","14.5477","0.0005","17.2021","0.0008","73.8877","0.0018","85.6121","0.0018","81.146","0.003","2154.55","0.16","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H41.4 Co2 N6 O8.7 -","- C52 H41.4 Co2 N6 O8.7 -","- C104 H82.8 Co4 N12 O17.4 -","2","1","","Muniappan, Sankar; Lipstman, Sophia; George, Sumod; Goldberg, Israel","Porphyrin framework solids. Synthesis and structure of hybrid coordination polymers of tetra(carboxyphenyl)porphyrins and lanthanide-bridging ions.","Inorganic chemistry","2007","46","14","5544","5554","10.1021/ic0701099","","","0.71073","MoKα","","0.1052","0.066","","","0.1257","0.1434","","","","","","1.08","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333233","9.6872","0.0006","9.6872","0.0006","6.5998","0.0007","90","","90","","90","","619.34","0.09","200","2","200","2","","","","","","","","6","P 4/n b m :2","-P 4a 2b","125","Bis(pyrazine) copper(II) bifloride tetrafluoroborate","","","- C8 H9 B Cu F6 N4 -","- C8 H9 B Cu F6 N4 -","- C16 H18 B2 Cu2 F12 N8 -","2","0.125","","Brown, S.; Cao, J.; Musfeldt, J. L.; Conner, M. M.; McConnell, A. C.; Southerland, H. I.; Manson, J. L.; Schlueter, J. A.; Phillips, M. D.; Turnbull, M. M.; Landee, C. P.","Hydrogen Bonding and Multiphonon Structure in Copper Pyrazine Coordination Polymers","Inorganic Chemistry","2007","46","21","8577","8583","10.1021/ic070122t","","","0.71073","MoKα","","0.0609","0.0533","","","0.1377","0.1492","","","","","","1.097","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333234","17.4566","0.0006","17.4566","0.0006","9.0567","0.0003","90","","90","","90","","2759.87","0.16","100","2","100","2","","","","","","","","6","I -4","I -4","82","","","","- C10 H10 Cl2 N4 O2 Pt -","- C10 H10 Cl2 N4 O2 Pt -","- C80 H80 Cl16 N32 O16 Pt8 -","8","1","","Bulak, Ece; Leboschka, Markus; Schwederski, Brigitte; Sarper, Orkan; Varnali, Tereza; Fiedler, Jan; Lissner, Falk; Schleid, Thomas; Kaim, Wolfgang","Reversibly reducible cis-dichloroplatinum(II) and cis-dichloropalladium(II) complexes of bis(1-methylimidazol-2-yl)glyoxal.","Inorganic chemistry","2007","46","14","5562","5566","10.1021/ic070185b","","","0.71069","MoKα","","0.0348","0.0312","","","0.0601","0.0617","","","","","","1.059","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333235","43.846","0.009","15.669","0.003","16.258","0.003","90","","97.38","0.03","90","","11077","4","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C98 H72 Mn4 N32 O8 W2 -","- C98 H72 Mn4 N32 O8 W2 -","- C392 H288 Mn16 N128 O32 W8 -","4","0.5","","Wang, Zhao-Xi; Li,; Wang, Tian-Wei; Li, Yi-Zhi; Ohkoshi, Shin-ichi; Hashimoto, Kazuhito; Song, You; You, Xiao-Zeng","Octacyanotungstate(V)-Based Magnetic Complex Consisting of Dimeric Mn2and Tetrameric Mn2W2","Inorganic Chemistry","2007","46","26","10990","10995","10.1021/ic070195c","","","0.71073","MoKα","","0.0851","0.0565","","","0.115","0.1226","","","","","","1.075","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333236","7.0698","0.0001","8.3572","0.0002","17.2918","0.0004","91.228","0.0011","91.613","0.0013","107.051","0.0011","975.9","0.04","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H21 Ag I N3 -","- C19 H21 Ag I N3 -","- C38 H42 Ag2 I2 N6 -","2","1","","Wang, Chao-Yu; Fu, Ching-Feng; Liu, Yi-Hong; Peng, Shei-Ming; Liu, Shiuh-Tzung","Synthesis of iridium pyridinyl N-heterocyclic carbene complexes and their catalytic activities on reduction of nitroarenes.","Inorganic chemistry","2007","46","14","5779","5786","10.1021/ic070330l","","","0.71073","MoKα","","0.0496","0.0357","","","0.1138","0.1314","","","","","","0.974","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333237","9.8802","0.0001","12.2907","0.0001","26.4927","0.0003","90","","93.446","0.001","90","","3211.31","0.06","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H41 Cl Ir N3 -","- C35 H41 Cl Ir N3 -","- C140 H164 Cl4 Ir4 N12 -","4","1","","Wang, Chao-Yu; Fu, Ching-Feng; Liu, Yi-Hong; Peng, Shei-Ming; Liu, Shiuh-Tzung","Synthesis of iridium pyridinyl N-heterocyclic carbene complexes and their catalytic activities on reduction of nitroarenes.","Inorganic chemistry","2007","46","14","5779","5786","10.1021/ic070330l","","","0.71073","MoKα","","0.054","0.0352","","","0.0894","0.1096","","","","","","1.162","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333238","7.744","0.0001","20.63","0.0002","21.144","0.0002","89.83","0.0008","86.053","0.0008","87.231","0.0008","3365.99","0.06","295","2","295","2","","","","","","","","8","P -1","-P 1","2","","","","- C30 H30 B Cl3 F4 Ir N3 O2 -","- C30 H30 B Cl3 F4 Ir N3 O2 -","- C120 H120 B4 Cl12 F16 Ir4 N12 O8 -","4","2","","Wang, Chao-Yu; Fu, Ching-Feng; Liu, Yi-Hong; Peng, Shei-Ming; Liu, Shiuh-Tzung","Synthesis of iridium pyridinyl N-heterocyclic carbene complexes and their catalytic activities on reduction of nitroarenes.","Inorganic chemistry","2007","46","14","5779","5786","10.1021/ic070330l","","","0.71073","MoKα","","0.0836","0.0727","","","0.2077","0.2165","","","","","","1.181","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333239","7.6816","0.0018","11.482","0.003","11.716","0.003","98.347","0.005","102.806","0.004","100.994","0.004","970","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C8 H9 N7 -","- C8 H9 N7 -","- C32 H36 N28 -","4","2","","Zheng, Ling-Ling; Zhang, Wei-Xiong; Qin, Lian-Jing; Leng, Ji-Dong; Lu, Jun-Xian; Tong, Ming-Liang","Isolation of a Pentadentate Ligand and Stepwise Synthesis, Structures, and Magnetic Properties of a New Family of Homo- and Heterotrinuclear Complexes","Inorganic Chemistry","2007","46","23","9548","9557","10.1021/ic070343z","","","0.71073","MoKα","","0.0672","0.0545","","","0.1487","0.1591","","","","","","1.04","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333240","5.6286","0.0007","13.1374","0.0016","17.198","0.002","90","","90","","90","","1271.7","0.3","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C8 H10 Cl N7 O4 -","- C8 H10 Cl N7 O4 -","- C32 H40 Cl4 N28 O16 -","4","0.5","","Zheng, Ling-Ling; Zhang, Wei-Xiong; Qin, Lian-Jing; Leng, Ji-Dong; Lu, Jun-Xian; Tong, Ming-Liang","Isolation of a Pentadentate Ligand and Stepwise Synthesis, Structures, and Magnetic Properties of a New Family of Homo- and Heterotrinuclear Complexes","Inorganic Chemistry","2007","46","23","9548","9557","10.1021/ic070343z","","","0.71073","MoKα","","0.0775","0.0683","","","0.1732","0.1805","","","","","","1.067","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333241","22.285","0.008","22.285","0.008","3.8905","0.0015","90","","90","","90","","1932.1","1.2","293","2","293","2","","","","","","","","4","P 42/n :2","-P 4bc","86","","","","- C16 H16 Cu N14 -","- C16 H16 Cu N14 -","- C64 H64 Cu4 N56 -","4","0.5","","Zheng, Ling-Ling; Zhang, Wei-Xiong; Qin, Lian-Jing; Leng, Ji-Dong; Lu, Jun-Xian; Tong, Ming-Liang","Isolation of a Pentadentate Ligand and Stepwise Synthesis, Structures, and Magnetic Properties of a New Family of Homo- and Heterotrinuclear Complexes","Inorganic Chemistry","2007","46","23","9548","9557","10.1021/ic070343z","","","0.71073","MoKα","","0.1191","0.065","","","0.0999","0.1132","","","","","","1.181","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333242","11.2713","0.0016","16.454","0.002","17.633","0.003","90","","90.632","0.003","90","","3270","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H31 N22 Ni1.5 O -","- C27 H31 N22 Ni1.5 O -","- C108 H124 N88 Ni6 O4 -","4","1","","Zheng, Ling-Ling; Zhang, Wei-Xiong; Qin, Lian-Jing; Leng, Ji-Dong; Lu, Jun-Xian; Tong, Ming-Liang","Isolation of a Pentadentate Ligand and Stepwise Synthesis, Structures, and Magnetic Properties of a New Family of Homo- and Heterotrinuclear Complexes","Inorganic Chemistry","2007","46","23","9548","9557","10.1021/ic070343z","","","0.71073","MoKα","","0.1046","0.0638","","","0.1394","0.1591","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333243","7.4824","0.0006","8.4117","0.0007","17.005","0.0014","86.338","0.002","86.662","0.002","68.646","0.002","994.07","0.14","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H34 Co2 Cu N20 O16 -","- C30 H34 Co2 Cu N20 O16 -","- C30 H34 Co2 Cu N20 O16 -","1","0.5","","Zheng, Ling-Ling; Zhang, Wei-Xiong; Qin, Lian-Jing; Leng, Ji-Dong; Lu, Jun-Xian; Tong, Ming-Liang","Isolation of a Pentadentate Ligand and Stepwise Synthesis, Structures, and Magnetic Properties of a New Family of Homo- and Heterotrinuclear Complexes","Inorganic Chemistry","2007","46","23","9548","9557","10.1021/ic070343z","","","0.71073","MoKα","","0.0392","0.0366","","","0.1","0.1023","","","","","","1.105","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333244","7.7313","0.0012","8.5788","0.0014","16.549","0.003","85.636","0.002","84.976","0.003","71.365","0.003","1034.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H34 Cu N20 Ni2 O16 -","- C30 H34 Cu N20 Ni2 O16 -","- C30 H34 Cu N20 Ni2 O16 -","1","0.5","","Zheng, Ling-Ling; Zhang, Wei-Xiong; Qin, Lian-Jing; Leng, Ji-Dong; Lu, Jun-Xian; Tong, Ming-Liang","Isolation of a Pentadentate Ligand and Stepwise Synthesis, Structures, and Magnetic Properties of a New Family of Homo- and Heterotrinuclear Complexes","Inorganic Chemistry","2007","46","23","9548","9557","10.1021/ic070343z","","","0.71073","MoKα","","0.0628","0.0542","","","0.1218","0.1266","","","","","","1.136","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333245","7.959","0.001","9.275","0.004","13.231","0.004","79.18","0.03","72.88","0.02","70.78","0.02","876.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H32 N18 Ni3 O18 -","- C18 H32 N18 Ni3 O18 -","- C18 H32 N18 Ni3 O18 -","1","0.5","","Zheng, Ling-Ling; Zhang, Wei-Xiong; Qin, Lian-Jing; Leng, Ji-Dong; Lu, Jun-Xian; Tong, Ming-Liang","Isolation of a Pentadentate Ligand and Stepwise Synthesis, Structures, and Magnetic Properties of a New Family of Homo- and Heterotrinuclear Complexes","Inorganic Chemistry","2007","46","23","9548","9557","10.1021/ic070343z","","","0.71073","MoKα","","0.0671","0.0366","","","0.0806","0.0951","","","","","","1.025","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333252","19.493","0.004","11.612","0.002","18.319","0.004","90","","108.325","0.003","90","","3936.3","1.4","109","2","109","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Eu-bis-5LINMe-1,2-HOPO","","","- C34 H38 Eu K N10 O14 -","- C34 H38 Eu K N10 O14 -","- C136 H152 Eu4 K4 N40 O56 -","4","1","","Moore, Evan G.; Jocher, Christoph J.; Xu, Jide; Werner, Eric J.; Raymond, Kenneth N.","An Octadentate Luminescent Eu(III) 1,2-HOPO Chelate with Potent Aqueous Stability","Inorganic Chemistry","2007","46","14","5468","5470","10.1021/ic700364t","","","0.71073","MoKα","","0.0954","0.0484","","","0.106","0.1172","","","","","","1.074","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333253","9.048","0.003","21.65","0.003","15.583","0.003","90","","91.75","0.03","90","","3051.1","1.2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C33 H35 Cl2 N O3 P Re -","- C33 H35 Cl2 N O3 P Re -","- C132 H140 Cl8 N4 O12 P4 Re4 -","4","1","","Sachse, Anna; Mösch-Zanetti, Nadia C; Lyashenko, Ganna; Wielandt, J. Wolfram; Most, Kerstin; Magull, Jörg; Dall'Antonia, Fabio; Pal, Aritra; Herbst-Irmer, Regine","Rhenium(V) oxo complexes with acetylacetone derived Schiff bases: structure and catalytic epoxidation.","Inorganic chemistry","2007","46","17","7129","7135","10.1021/ic700381n","","","1.54178","CuKα","","0.0197","0.0175","","","0.0424","0.0433","","","","","","1.046","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333254","7.828","0.002","8.018","0.002","10.21","0.002","112.79","0.03","106.59","0.03","92.62","0.03","557.3","0.3","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H15 N O S -","- C12 H15 N O S -","- C24 H30 N2 O2 S2 -","2","1","","Sachse, Anna; Mösch-Zanetti, Nadia C; Lyashenko, Ganna; Wielandt, J. Wolfram; Most, Kerstin; Magull, Jörg; Dall'Antonia, Fabio; Pal, Aritra; Herbst-Irmer, Regine","Rhenium(V) oxo complexes with acetylacetone derived Schiff bases: structure and catalytic epoxidation.","Inorganic chemistry","2007","46","17","7129","7135","10.1021/ic700381n","","","0.71073","MoKα","","0.0608","0.056","","","0.1583","0.1642","","","","","","1.087","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333255","9.6116","0.0001","9.6116","0.0001","25.2776","0.0006","90","","90","","120","","2022.36","0.06","150","2","150","2","","","","","","","","6","P 32 2 1","P 32 2""","154","","","","- C22 H18 Cl4 N10 O Zn2 -","- C22 H18 Cl4 N10 O Zn2 -","- C66 H54 Cl12 N30 O3 Zn6 -","3","0.5","","Chen, Chih-Yuan; Cheng, Pi-Yun; Wu, Hsin-Hsuan; Lee, Hon Man","Conformational Effect of 2,6-Bis(imidazol-1-yl)pyridine on the Self-Assembly of 1D Coordination Chains: Spontaneous Resolution, Supramolecular Isomerism, and Structural Transformation","Inorganic Chemistry","2007","46","14","5691","5699","10.1021/ic700428e","","x-ray","0.71073","MoKα","","0.0307","0.0267","","","0.0703","0.0714","","","","","","1.007","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333256","9.6165","0.0001","9.6165","0.0001","25.2979","0.0004","90","","90","","120","","2026.05","0.04","150","2","150","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C22 H18 Cl4 N10 O Zn2 -","- C22 H18 Cl4 N10 O Zn2 -","- C66 H54 Cl12 N30 O3 Zn6 -","3","0.5","","Chen, Chih-Yuan; Cheng, Pi-Yun; Wu, Hsin-Hsuan; Lee, Hon Man","Conformational Effect of 2,6-Bis(imidazol-1-yl)pyridine on the Self-Assembly of 1D Coordination Chains: Spontaneous Resolution, Supramolecular Isomerism, and Structural Transformation","Inorganic Chemistry","2007","46","14","5691","5699","10.1021/ic700428e","","x-ray","0.71073","MoKα","","0.0245","0.0229","","","0.0627","0.0631","","","","","","1.025","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333257","9.724","0.0005","9.724","0.0005","25.71","0.003","90","","90","","120","","2105.3","0.3","150","2","150","2","","","","","","","","6","P 32 2 1","P 32 2""","154","","","","- C11 H9 Br2 N5 O0.25 Zn -","- C11 H9 Br2 N5 O0.25 Zn -","- C66 H54 Br12 N30 O1.5 Zn6 -","6","1","","Chen, Chih-Yuan; Cheng, Pi-Yun; Wu, Hsin-Hsuan; Lee, Hon Man","Conformational Effect of 2,6-Bis(imidazol-1-yl)pyridine on the Self-Assembly of 1D Coordination Chains: Spontaneous Resolution, Supramolecular Isomerism, and Structural Transformation","Inorganic Chemistry","2007","46","14","5691","5699","10.1021/ic700428e","","x-ray","0.71073","MoKα","","0.0214","0.0197","","","0.0471","0.0475","","","","","","1.051","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333258","9.7276","0.0001","9.7276","0.0001","25.7448","0.0005","90","","90","","120","","2109.75","0.05","150","2","150","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C11 H9 Br2 N5 O0.25 Zn -","- C11 H9 Br2 N5 O0.25 Zn -","- C66 H54 Br12 N30 O1.5 Zn6 -","6","1","","Chen, Chih-Yuan; Cheng, Pi-Yun; Wu, Hsin-Hsuan; Lee, Hon Man","Conformational Effect of 2,6-Bis(imidazol-1-yl)pyridine on the Self-Assembly of 1D Coordination Chains: Spontaneous Resolution, Supramolecular Isomerism, and Structural Transformation","Inorganic Chemistry","2007","46","14","5691","5699","10.1021/ic700428e","","x-ray","0.71073","MoKα","","0.0321","0.025","","","0.0483","0.0494","","","","","","0.999","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333259","9.0895","0.0009","9.9518","0.001","15.1892","0.0015","90","","98.945","0.002","90","","1357.3","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H9 Cl2 N5 Zn -","- C11 H9 Cl2 N5 Zn -","- C44 H36 Cl8 N20 Zn4 -","4","1","","Chen, Chih-Yuan; Cheng, Pi-Yun; Wu, Hsin-Hsuan; Lee, Hon Man","Conformational Effect of 2,6-Bis(imidazol-1-yl)pyridine on the Self-Assembly of 1D Coordination Chains: Spontaneous Resolution, Supramolecular Isomerism, and Structural Transformation","Inorganic Chemistry","2007","46","14","5691","5699","10.1021/ic700428e","","x-ray","0.71073","MoKα","","0.025","0.0203","","","0.053","0.0542","","","","","","1.074","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333260","9.4515","0.0005","14.2276","0.0008","20.1329","0.0011","90","","90","","90","","2707.3","0.3","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C11 H9 Cl2 N5 Zn -","- C11 H9 Cl2 N5 Zn -","- C88 H72 Cl16 N40 Zn8 -","8","1","","Chen, Chih-Yuan; Cheng, Pi-Yun; Wu, Hsin-Hsuan; Lee, Hon Man","Conformational Effect of 2,6-Bis(imidazol-1-yl)pyridine on the Self-Assembly of 1D Coordination Chains: Spontaneous Resolution, Supramolecular Isomerism, and Structural Transformation","Inorganic Chemistry","2007","46","14","5691","5699","10.1021/ic700428e","","x-ray","0.71073","MoKα","","0.0268","0.0222","","","0.0593","0.0611","","","","","","1.036","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333261","3.7728","0.0006","15.486","0.003","18.834","0.003","90","","95.665","0.005","90","","1095","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H11 N5 O -","- C11 H11 N5 O -","- C44 H44 N20 O4 -","4","1","","Chen, Chih-Yuan; Cheng, Pi-Yun; Wu, Hsin-Hsuan; Lee, Hon Man","Conformational Effect of 2,6-Bis(imidazol-1-yl)pyridine on the Self-Assembly of 1D Coordination Chains: Spontaneous Resolution, Supramolecular Isomerism, and Structural Transformation","Inorganic Chemistry","2007","46","14","5691","5699","10.1021/ic700428e","","x-ray","0.71073","MoKα","","0.0655","0.0488","","","0.1292","0.1375","","","","","","1.119","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333262","15.837","0.003","14.029","0.003","20.124","0.004","90","","109.93","0.03","90","","4203.3","1.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H14 Br2 Cu N2 O4 -","- C24 H14 Br2 Cu N2 O4 -","- C192 H112 Br16 Cu8 N16 O32 -","8","2","","Han, Zhangang; Zhao, Yulong; Peng, Jun; Gómez-García, Carlos J.","Unusual Oxidation of an N-Heterocycle Ligand in a Metal−Organic Framework","Inorganic Chemistry","2007","46","14","5453","5455","10.1021/ic700432p","","","0.71073","MoKα","","0.1216","0.0475","","","0.0854","0.104","","","","","","0.947","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333263","10.0173","0.0005","17.6957","0.0009","18.322","0.001","90","","90","","90","","3247.8","0.3","141","2","141","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C36 H44 F2 N2 U -","- C36 H44 F2 N2 U -","- C144 H176 F8 N8 U4 -","4","1","","Schelter, Eric J.; Yang, Ping; Scott, Brian L.; Thompson, J. D.; Martin, Richard L.; Hay, P. Jeffrey; Morris, David E.; Kiplinger, Jaqueline L.","Systematic Studies of Early Actinide Complexes: Uranium(IV) Fluoroketimides","Inorganic Chemistry","2007","46","18","7477","7488","10.1021/ic700455b","","","0.71073","MoKα","","0.0346","0.0321","","","0.0823","0.0826","","","","","","1.775","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333264","17.979","0.0019","18.0889","0.0019","9.9044","0.0011","90","","90","","90","","3221.1","0.6","141","2","141","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C36 H44 F2 N2 U -","- C36 H44 F2 N2 U -","- C144 H176 F8 N8 U4 -","4","0.5","","Schelter, Eric J.; Yang, Ping; Scott, Brian L.; Thompson, J. D.; Martin, Richard L.; Hay, P. Jeffrey; Morris, David E.; Kiplinger, Jaqueline L.","Systematic Studies of Early Actinide Complexes: Uranium(IV) Fluoroketimides","Inorganic Chemistry","2007","46","18","7477","7488","10.1021/ic700455b","","","0.71073","MoKα","","0.0781","0.0712","","","0.1908","0.1915","","","","","","3.486","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333265","10.6877","0.0006","17.5713","0.0009","19.3511","0.001","108.793","0.001","90.476","0.001","102.7","0.001","3343.8","0.3","141","2","141","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H42 F4 N2 U -","- C36 H42 F4 N2 U -","- C144 H168 F16 N8 U4 -","4","2","","Schelter, Eric J.; Yang, Ping; Scott, Brian L.; Thompson, J. D.; Martin, Richard L.; Hay, P. Jeffrey; Morris, David E.; Kiplinger, Jaqueline L.","Systematic Studies of Early Actinide Complexes: Uranium(IV) Fluoroketimides","Inorganic Chemistry","2007","46","18","7477","7488","10.1021/ic700455b","","","0.71073","MoKα","","0.0427","0.0318","","","0.0857","0.0889","","","","","","1.214","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333266","13.5252","0.0005","14.5744","0.0005","17.1466","0.0006","90","","96.434","0.001","90","","3358.7","0.2","141","2","141","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H40 F6 N2 U -","- C36 H40 F6 N2 U -","- C144 H160 F24 N8 U4 -","4","0.5","","Schelter, Eric J.; Yang, Ping; Scott, Brian L.; Thompson, J. D.; Martin, Richard L.; Hay, P. Jeffrey; Morris, David E.; Kiplinger, Jaqueline L.","Systematic Studies of Early Actinide Complexes: Uranium(IV) Fluoroketimides","Inorganic Chemistry","2007","46","18","7477","7488","10.1021/ic700455b","","","0.71073","MoKα","","0.0223","0.0197","","","0.0492","0.0501","","","","","","1.118","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333267","12.9529","0.0006","13.8105","0.0006","18.5471","0.0008","90","","99.781","0.001","90","","3269.6","0.3","141","2","141","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H40 F6 N2 U -","- C36 H40 F6 N2 U -","- C144 H160 F24 N8 U4 -","4","0.5","","Schelter, Eric J.; Yang, Ping; Scott, Brian L.; Thompson, J. D.; Martin, Richard L.; Hay, P. Jeffrey; Morris, David E.; Kiplinger, Jaqueline L.","Systematic Studies of Early Actinide Complexes: Uranium(IV) Fluoroketimides","Inorganic Chemistry","2007","46","18","7477","7488","10.1021/ic700455b","","","0.71073","MoKα","","0.0159","0.0149","","","0.0373","0.0378","","","","","","0.873","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333268","15.9821","0.0004","16.3139","0.0004","26.9285","0.0006","90","","90","","90","","7021.1","0.3","141","2","141","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C36 H36 F10 N2 U -","- C36 H36 F10 N2 U -","- C288 H288 F80 N16 U8 -","8","1","","Schelter, Eric J.; Yang, Ping; Scott, Brian L.; Thompson, J. D.; Martin, Richard L.; Hay, P. Jeffrey; Morris, David E.; Kiplinger, Jaqueline L.","Systematic Studies of Early Actinide Complexes: Uranium(IV) Fluoroketimides","Inorganic Chemistry","2007","46","18","7477","7488","10.1021/ic700455b","","","0.71073","MoKα","","0.0544","0.0318","","","0.0931","0.1002","","","","","","1.559","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333269","21.2148","0.0019","22.494","0.002","29.539","0.003","91.468","0.002","97.911","0.002","109.603","0.001","13114","2","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C197.5 H227 Mn30 O120 -","- C197.48 H226.94 Mn30 O120 -","- C394.96 H453.88 Mn60 O240 -","2","1","","Zheng, Yan-Zhen; Xue, Wei; Zhang, Wei-Xiong; Tong, Ming-Liang; Chen, Xiao-Ming","From Pseudo to TrueC3Symmetry: Magnetic Anisotropy Enhanced by Site-Specific Ligand Substitution in Two Mn15-Carboxylate Clusters","Inorganic Chemistry","2007","46","16","6437","6443","10.1021/ic7004584","","","0.71073","MoKα","","0.1558","0.0783","","","0.2047","0.258","","","","","","1.012","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333270","23.6136","0.0012","23.6136","0.0012","13.4921","0.0015","90","","90","","120","","6515.3","0.9","100","2","100","2","","","","","","","","4","P -3","-P 3","147","","","","- C92.5 H178 Mn15 O58 -","- C92.51 H178.02 Mn15 O57.98 -","- C185.02 H356.04 Mn30 O115.96 -","2","0.333333","","Zheng, Yan-Zhen; Xue, Wei; Zhang, Wei-Xiong; Tong, Ming-Liang; Chen, Xiao-Ming","From Pseudo to TrueC3Symmetry: Magnetic Anisotropy Enhanced by Site-Specific Ligand Substitution in Two Mn15-Carboxylate Clusters","Inorganic Chemistry","2007","46","16","6437","6443","10.1021/ic7004584","","","0.71073","MoKα","","0.0824","0.0589","","","0.1517","0.172","","","","","","1.031","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333271","17.9477","0.0008","18.5844","0.0008","23.6049","0.0009","91.685","0.003","100.181","0.003","97.343","0.004","7674.9","0.6","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C78 H247 Ag4 B66 N15 Sn6 -","- C78 H247 Ag4 B66 N15 Sn6 -","- C156 H494 Ag8 B132 N30 Sn12 -","2","1","","Hagen, Siegbert; Schubert, Hartmut; Maichle-Mössmer, Cäcilia; Pantenburg, Ingo; Weigend, Florian; Wesemann, Lars","Silver aggregation caused by Stanna-closo-dodecaborate coordination: syntheses, solid-state structures and theoretical studies.","Inorganic chemistry","2007","46","16","6775","6784","10.1021/ic700464d","","","0.71073","MoKα","","0.0932","0.0514","","","0.0958","0.1141","","","","","","1.036","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4333272","15.7176","0.0017","16.8227","0.0015","21.692","0.002","99.861","0.008","97.8","0.008","116.129","0.007","4926.8","0.9","173","","173","","","","","","","","","8","P -1","-P 1","2","","","","- C54.5 H162 Ag3 B33 Cl N3 P3 Sn3 -","- C54.5 H162 Ag3 B33 Cl N3 P3 Sn3 -","- C109 H324 Ag6 B66 Cl2 N6 P6 Sn6 -","2","1","","Hagen, Siegbert; Schubert, Hartmut; Maichle-Mössmer, Cäcilia; Pantenburg, Ingo; Weigend, Florian; Wesemann, Lars","Silver aggregation caused by Stanna-closo-dodecaborate coordination: syntheses, solid-state structures and theoretical studies.","Inorganic chemistry","2007","46","16","6775","6784","10.1021/ic700464d","","","0.71073","MoKα","","0.159","0.0884","","","0.1161","0.1345","","","","","","1.113","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333273","23.678","0.002","40.503","0.003","16.6818","0.0017","90","","135.054","0.006","90","","11302","2","170","2","170","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C60 H192 Ag4 B44 N4 P4 Sn4 -","- C60 H80 Ag4 B44 N4 P4 Sn4 -","- C240 H320 Ag16 B176 N16 P16 Sn16 -","4","0.5","","Hagen, Siegbert; Schubert, Hartmut; Maichle-Mössmer, Cäcilia; Pantenburg, Ingo; Weigend, Florian; Wesemann, Lars","Silver aggregation caused by Stanna-closo-dodecaborate coordination: syntheses, solid-state structures and theoretical studies.","Inorganic chemistry","2007","46","16","6775","6784","10.1021/ic700464d","","","0.71073","MoKα","","0.12","0.0614","","","0.1303","0.1463","","","","","","0.898","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333274","11.6074","0.001","12.8553","0.0011","14.7336","0.0013","68.158","0.006","75.747","0.007","71.529","0.006","1914.9","0.3","130","2","130","2","","","","","","","","7","P -1","-P 1","2","","","","- C62 H112 Ag2 B22 N2 P2 Sn2 -","- C62 H112 Ag2 B22 N2 P2 Sn2 -","- C62 H112 Ag2 B22 N2 P2 Sn2 -","1","0.5","","Hagen, Siegbert; Schubert, Hartmut; Maichle-Mössmer, Cäcilia; Pantenburg, Ingo; Weigend, Florian; Wesemann, Lars","Silver aggregation caused by Stanna-closo-dodecaborate coordination: syntheses, solid-state structures and theoretical studies.","Inorganic chemistry","2007","46","16","6775","6784","10.1021/ic700464d","","","0.71073","MoKα","","0.0292","0.0265","","","0.0673","0.0684","","","","","","1.064","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333275","12.699","0.004","20.24","0.006","15.276","0.005","90","","96.06","0.003","90","","3904","2","173.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H42 Cl3 O4 P3 Ru -","- C41 H42 Cl3 O4 P3 Ru -","- C164 H168 Cl12 O16 P12 Ru4 -","4","1","","Kayaki, Yoshihito; Shimokawatoko, Yoshiki; Ikariya, Takao","Synthesis of ruthenium(II) complexes containing hydroxymethylphosphines and their catalytic activities for hydrogenation of supercritical carbon dioxide.","Inorganic chemistry","2007","46","14","5791","5797","10.1021/ic700470n","","","0.7107","MoKα","","","0.039","","","","0.108","","","","","","0.991","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333276","11.901","0.006","17.515","0.009","17.487","0.008","90","","94.339","0.007","90","","3635","3","193.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H43 Cl3 O2 P2 Ru -","- C37 H43 Cl3 O2 P2 Ru -","- C148 H172 Cl12 O8 P8 Ru4 -","4","1","","Kayaki, Yoshihito; Shimokawatoko, Yoshiki; Ikariya, Takao","Synthesis of ruthenium(II) complexes containing hydroxymethylphosphines and their catalytic activities for hydrogenation of supercritical carbon dioxide.","Inorganic chemistry","2007","46","14","5791","5797","10.1021/ic700470n","","","0.7107","MoKα","","","0.076","","","","0.219","","","","","","1.003","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333277","20.689","0.009","13.894","0.006","20.617","0.01","90","","102.489","0.006","90","","5786","5","193.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H49 Cl O4 P2 Ru -","- C26 H49 Cl O4 P2 Ru -","- C208 H392 Cl8 O32 P16 Ru8 -","8","2","","Kayaki, Yoshihito; Shimokawatoko, Yoshiki; Ikariya, Takao","Synthesis of ruthenium(II) complexes containing hydroxymethylphosphines and their catalytic activities for hydrogenation of supercritical carbon dioxide.","Inorganic chemistry","2007","46","14","5791","5797","10.1021/ic700470n","","","0.7107","MoKα","","","0.049","","","","0.149","","","","","","0.885","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333278","12.847","0.003","13.472","0.003","16.384","0.003","91.9","0.03","103.11","0.03","96.52","0.03","2738.8","1.1","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C56 H78 Al3 N5 -","- C56 H78 Al3 N5 -","- C112 H156 Al6 N10 -","2","1","","Löbl, Jiri; Timoshkin, Alexey Y.; Cong, Trinh; Necas, Marek; Roesky, Herbert W.; Pinkas, Jiri","Alumazene Adducts with Pyridines: Synthesis, Structure, and Stability Studies","Inorganic Chemistry","2007","46","14","5678","5685","10.1021/ic700488p","","","0.71073","MoKα","","0.0956","0.0628","","","0.1624","0.1809","","","","","","1.049","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333279","13.8982","0.0011","14.1768","0.0011","15.0948","0.0011","94.089","0.002","101.607","0.002","112.116","0.002","2663.3","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C57 H55 Co N9 O7 -","- C56.94 H36.98 Co N8.98 O6.98 -","- C113.88 H73.96 Co2 N17.96 O13.96 -","2","1","","Barrios, Leoní A.; Ribas, Joan; Aromí, Guillem; Ribas-Ariño, Jordi; Gamez, Patrick; Roubeau, Olivier; Teat, Simon J.","Preparation and Structure of Three Solvatomorphs of the Polymer [Co(dbm)2(4ptz)]n: Spin Canting Depending on the Supramolecular Organization","Inorganic Chemistry","2007","46","17","7154","7162","10.1021/ic7004979","","","0.7848","synchrotron","","0.0822","0.0659","","","0.1824","0.1967","","","","","","1.038","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333280","8.3921","0.0003","8.5622","0.0003","14.5139","0.0006","90.727","0.002","104.25","0.002","95.379","0.002","1005.66","0.07","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H11 F6 N5 O3.5 P Re -","- C16 H11 F6 N5 O3.5 P Re -","- C32 H22 F12 N10 O7 P2 Re2 -","2","1","","Kirgan, Robert; Simpson, Megan; Moore, Curtis; Day, Jeff; Bui, Loan; Tanner, Clayton; Rillema, D. Paul","Synthesis, characterization, photophysical, and computational studies of rhenium(I) tricarbonyl complexes containing the derivatives of bipyrazine.","Inorganic chemistry","2007","46","16","6464","6472","10.1021/ic700512j","","","0.71073","MoKα","","0.0171","0.0161","","","0.0383","0.0386","","","","","","1.093","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333281","27.105","0.0005","27.105","0.0005","11.2195","0.0004","90","","90","","120","","7138.4","0.3","273","2","273","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C13 H10 Cl N4 O3 Re -","- C13 H10 Cl N4 O3 Re -","- C234 H180 Cl18 N72 O54 Re18 -","18","1","","Kirgan, Robert; Simpson, Megan; Moore, Curtis; Day, Jeff; Bui, Loan; Tanner, Clayton; Rillema, D. Paul","Synthesis, characterization, photophysical, and computational studies of rhenium(I) tricarbonyl complexes containing the derivatives of bipyrazine.","Inorganic chemistry","2007","46","16","6464","6472","10.1021/ic700512j","","","0.71073","MoKα","","0.029","0.0238","","","0.0394","0.0401","","","","","","1.121","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333282","33.2103","0.0003","33.2103","0.0003","10.6556","0.0002","90","","90","","120","","10177.8","0.2","273","2","273","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C18.28 H15 F6 N5.22 O3 P Re -","- C18.3 H15 F6 N5.2 O3 P Re -","- C329.4 H270 F108 N93.6 O54 P18 Re18 -","18","1","","Kirgan, Robert; Simpson, Megan; Moore, Curtis; Day, Jeff; Bui, Loan; Tanner, Clayton; Rillema, D. Paul","Synthesis, characterization, photophysical, and computational studies of rhenium(I) tricarbonyl complexes containing the derivatives of bipyrazine.","Inorganic chemistry","2007","46","16","6464","6472","10.1021/ic700512j","","","0.71073","MoKα","","0.0344","0.0233","","","0.0503","0.0534","","","","","","1.054","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333283","3.8884","0.0005","6.417","0.0008","6.1051","0.0007","90","","96.413","0.002","90","","151.38","0.03","193","2","193","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","Palladium Selenite","","","- O3 Pd Se -","- O3 Pd Se -","- O6 Pd2 Se2 -","2","0.5","","Ling, Jie; Albrecht-Schmitt, Thomas E","Selenium oxoanion compounds of palladium(II).","Inorganic chemistry","2007","46","14","5686","5690","10.1021/ic700524c","","","0.71073","MoKα","","0.0195","0.019","","","0.0473","0.0476","","","","","","1.146","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333284","12.1976","0.0017","5.55","0.0008","7.1997","0.001","90","","107.9","0.002","90","","463.8","0.11","193","2","193","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Palladium Diselenite","","","- O5 Pd Se2 -","- O5 Pd Se2 -","- O20 Pd4 Se8 -","4","0.5","","Ling, Jie; Albrecht-Schmitt, Thomas E","Selenium oxoanion compounds of palladium(II).","Inorganic chemistry","2007","46","14","5686","5690","10.1021/ic700524c","","","0.71073","MoKα","","0.0242","0.0234","","","0.0591","0.0596","","","","","","1.161","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333285","4.9349","0.0011","5.9981","0.0013","7.1512","0.0015","73.894","0.004","86.124","0.004","70.837","0.004","192.03","0.07","193","2","193","2","","","","","","","","4","P -1","-P 1","2","Sodium Palladium Diselenate","","","- Na2 O8 Pd Se2 -","- Na2 O8 Pd Se2 -","- Na2 O8 Pd Se2 -","1","0.5","","Ling, Jie; Albrecht-Schmitt, Thomas E","Selenium oxoanion compounds of palladium(II).","Inorganic chemistry","2007","46","14","5686","5690","10.1021/ic700524c","","","0.71073","MoKα","","0.0246","0.0241","","","0.065","0.0656","","","","","","1.047","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333286","8.7234","0.0006","14.5024","0.0011","20.6747","0.0016","90","","90","","90","","2615.6","0.3","90","","90","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C18 H28 Ag F6 N2 O P S3 -","- C18 H28 Ag F6 N2 O P S3 -","- C72 H112 Ag4 F24 N8 O4 P4 S12 -","4","1","","Habata, Yoichi; Noto, Kanae; Osaka, Futoshi","Substituent Effects on the Structures of Silver Complexes with Monoazatrithia-12-Crown-4 Ethers Bearing Substituted Aromatic Rings","Inorganic Chemistry","2007","46","16","6529","6534","10.1021/ic700538f","","","0.71073","MoKα","","0.0361","0.0332","","","0.0882","0.0896","","","","","","1.185","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333287","13.891","0.0008","9.0832","0.0005","23.7127","0.001","90","","122.378","0.002","90","","2526.8","0.2","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H28 Ag F3 N2 O3 S4 -","- C19 H28 Ag F3 N2 O3 S4 -","- C76 H112 Ag4 F12 N8 O12 S16 -","4","1","","Habata, Yoichi; Noto, Kanae; Osaka, Futoshi","Substituent Effects on the Structures of Silver Complexes with Monoazatrithia-12-Crown-4 Ethers Bearing Substituted Aromatic Rings","Inorganic Chemistry","2007","46","16","6529","6534","10.1021/ic700538f","","","0.71073","MoKα","","0.0688","0.0438","","","0.0875","0.0947","","","","","","0.877","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333288","24.854","0.002","8.9828","0.0009","23.438","0.002","90","","109.941","0.002","90","","4919","0.8","298","","298","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H52 Ag2 F6 N4 O6 S8 -","- C36 H52 Ag2 F6 N4 O6 S8 -","- C144 H208 Ag8 F24 N16 O24 S32 -","4","1","","Habata, Yoichi; Noto, Kanae; Osaka, Futoshi","Substituent Effects on the Structures of Silver Complexes with Monoazatrithia-12-Crown-4 Ethers Bearing Substituted Aromatic Rings","Inorganic Chemistry","2007","46","16","6529","6534","10.1021/ic700538f","","","0.71073","MoKα","","0.0915","0.0442","","","0.0838","0.0966","","","","","","0.848","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333289","9.5868","0.0006","11.6802","0.0007","22.3982","0.0014","90","","90","","90","","2508.1","0.3","90","","90","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C19 H27 Ag F5 N O4 S4 -","- C19 H27 Ag F5 N O4 S4 -","- C76 H108 Ag4 F20 N4 O16 S16 -","4","1","","Habata, Yoichi; Noto, Kanae; Osaka, Futoshi","Substituent Effects on the Structures of Silver Complexes with Monoazatrithia-12-Crown-4 Ethers Bearing Substituted Aromatic Rings","Inorganic Chemistry","2007","46","16","6529","6534","10.1021/ic700538f","","","0.71073","MoKα","","0.0322","0.0312","","","0.0737","0.0744","","","","","","1.042","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333290","8.7183","0.0004","21.1087","0.001","22.244","0.001","72.106","0.001","82.984","0.001","83.089","0.001","3851.5","0.3","100","","100","","","","","","","","","8","P -1","-P 1","2","","","","- C50 H73 Ag3 Cl6 F9 N3 O12 S12 -","- C50 H69 Ag3 Cl6 F9 N3 O12 S12 -","- C100 H138 Ag6 Cl12 F18 N6 O24 S24 -","2","1","","Habata, Yoichi; Noto, Kanae; Osaka, Futoshi","Substituent Effects on the Structures of Silver Complexes with Monoazatrithia-12-Crown-4 Ethers Bearing Substituted Aromatic Rings","Inorganic Chemistry","2007","46","16","6529","6534","10.1021/ic700538f","","","0.71073","MoKα","","0.0752","0.0567","","","0.1494","0.1619","","","","","","1.064","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333291","20.7184","0.0007","20.7184","0.0007","32.921","0.002","90","","90","","120","","12238.2","0.9","298","","","","","","","","","","","7","R -3 :H","-R 3","148","","","","- C56 H72 Ag3 F9 N10 O15 S12 -","- C56 H66 Ag3 F9 N10 O15 S12 -","- C336 H396 Ag18 F54 N60 O90 S72 -","6","0.333333","","Habata, Yoichi; Noto, Kanae; Osaka, Futoshi","Substituent Effects on the Structures of Silver Complexes with Monoazatrithia-12-Crown-4 Ethers Bearing Substituted Aromatic Rings","Inorganic Chemistry","2007","46","16","6529","6534","10.1021/ic700538f","","","0.71073","MoKα","","0.0949","0.0758","","","0.2228","0.2461","","","","","","1.069","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333292","23.268","0.003","23.268","0.003","46.969","0.009","90","","90","","120","","22022","6","120","2","120","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C16 H36 N O14.33 P0.33 Sn0.33 W3.67 -","- C16 H36 N O14.3333 P0.333333 Sn0.34 W3.66 -","- C288 H648 N18 O258 P6 Sn6.12 W65.88 -","18","0.5","","Bar-Nahum, Itsik; Ettedgui, Jessica; Konstantinovski, Leonid; Kogan, Vladimir; Neumann, Ronny","A New Method for the Synthesis of Organopolyoxometalate Hybrid Compounds","Inorganic Chemistry","2007","46","14","5798","5804","10.1021/ic700540g","","","0.71073","MoKα","","0.1144","0.0806","","","0.2184","0.2407","","","","","","1.113","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333293","15.742","0.0016","12.0853","0.0012","15.7064","0.0015","90","","116.208","0.002","90","","2680.9","0.5","298","2","298","2","","","","","","","","9","P 1 2/c 1","-P 2yc","13","","","","- C84 H88 Cl4 Cu6 F24 N12 O6 P4 S4 -","- C84 H88 Cl4 Cu6 F24 N12 O6 P4 S4 -","- C84 H88 Cl4 Cu6 F24 N12 O6 P4 S4 -","1","0.25","","Manzur, Jorge; Mora, Hector; Vega, Andrés; Spodine, Evgenia; Venegas-Yazigi, Diego; Garland, María Teresa; El Fallah, M. Salah; Escuer, Albert","Copper(II) Complexes with New Polypodal Ligands Presenting Axial−Equatorial Phenoxo Bridges {2-[(Bis(2-pyridylmethyl)amino)methyl]-4-methylphenol, 2-[(Bis(2-pyridylmethyl)amino)methyl]-4-methyl-6-(methylthio)phenol}: Examples of Ferromagnetically Coupled Bi- and Trinuclear Copper(II) Complexes","Inorganic Chemistry","2007","46","17","6924","6932","10.1021/ic700544b","","","0.71073","MoKα","","0.1051","0.0617","","","0.1655","0.1894","","","","","","0.991","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333294","15.0794","0.0019","24.078","0.003","14.8697","0.0019","90","","116.272","0.002","90","","4841.2","1.1","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C42 H44 Cu2 F12 N6 O2 P2 S2 -","- C42 H44 Cu2 F12 N6 O2 P2 S2 -","- C168 H176 Cu8 F48 N24 O8 P8 S8 -","4","0.5","","Manzur, Jorge; Mora, Hector; Vega, Andrés; Spodine, Evgenia; Venegas-Yazigi, Diego; Garland, María Teresa; El Fallah, M. Salah; Escuer, Albert","Copper(II) Complexes with New Polypodal Ligands Presenting Axial−Equatorial Phenoxo Bridges {2-[(Bis(2-pyridylmethyl)amino)methyl]-4-methylphenol, 2-[(Bis(2-pyridylmethyl)amino)methyl]-4-methyl-6-(methylthio)phenol}: Examples of Ferromagnetically Coupled Bi- and Trinuclear Copper(II) Complexes","Inorganic Chemistry","2007","46","17","6924","6932","10.1021/ic700544b","","","0.71073","MoKα","","0.1039","0.0689","","","0.1946","0.2126","","","","","","0.965","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333295","11.2421","0.0013","16.7619","0.0019","11.9655","0.0014","90","","107.422","0.002","90","","2151.3","0.4","299","2","299","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C40 H40 Cu2 F12 N6 O2 P2 -","- C40 H40 Cu2 F12 N6 O2 P2 -","- C80 H80 Cu4 F24 N12 O4 P4 -","2","0.5","","Manzur, Jorge; Mora, Hector; Vega, Andrés; Spodine, Evgenia; Venegas-Yazigi, Diego; Garland, María Teresa; El Fallah, M. Salah; Escuer, Albert","Copper(II) Complexes with New Polypodal Ligands Presenting Axial−Equatorial Phenoxo Bridges {2-[(Bis(2-pyridylmethyl)amino)methyl]-4-methylphenol, 2-[(Bis(2-pyridylmethyl)amino)methyl]-4-methyl-6-(methylthio)phenol}: Examples of Ferromagnetically Coupled Bi- and Trinuclear Copper(II) Complexes","Inorganic Chemistry","2007","46","17","6924","6932","10.1021/ic700544b","","","0.71073","MoKα","","0.0628","0.0467","","","0.12","0.1301","","","","","","1.042","","","","has coordinates","179435","2020-10-21","18:00:00",""
"4333296","6.0283","0.0012","9.938","0.002","20.078","0.004","90","","90","","90","","1202.9","0.4","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H10 Fe I N -","- C13 H10 Fe I N -","- C52 H40 Fe4 I4 N4 -","4","1","","Nemykin, Victor N.; Makarova, Elena A.; Grosland, Jeffrey O.; Hadt, Ryan G.; Koposov, Alexey Y.","Preparation, characterization, molecular and electronic structures, TDDFT, and TDDFT/PCM study of the solvatochromism in cyanovinylferrocenes.","Inorganic chemistry","2007","46","23","9591","9601","10.1021/ic700558v","","","0.71073","MoKα","","0.0432","0.0329","","0.0767","0.0714","0.0714","","","","","","0.9984","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333297","7.7228","0.0013","11.8209","0.0017","13.2023","0.0019","90","","90","","90","","1205.2","0.3","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H10 Fe I N -","- C13 H10 Fe I N -","- C52 H40 Fe4 I4 N4 -","4","1","","Nemykin, Victor N.; Makarova, Elena A.; Grosland, Jeffrey O.; Hadt, Ryan G.; Koposov, Alexey Y.","Preparation, characterization, molecular and electronic structures, TDDFT, and TDDFT/PCM study of the solvatochromism in cyanovinylferrocenes.","Inorganic chemistry","2007","46","23","9591","9601","10.1021/ic700558v","","","0.71073","MoKα","","0.0541","0.0439","","0.1147","0.1048","0.1048","","","","","","0.988","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333298","7.6334","0.0015","13.929","0.003","10.926","0.002","90","","90","","90","","1161.7","0.4","293","","293","","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- C14 H10 Fe N2 -","- C14 H10 Fe N2 -","- C56 H40 Fe4 N8 -","4","0.5","","Nemykin, Victor N.; Makarova, Elena A.; Grosland, Jeffrey O.; Hadt, Ryan G.; Koposov, Alexey Y.","Preparation, characterization, molecular and electronic structures, TDDFT, and TDDFT/PCM study of the solvatochromism in cyanovinylferrocenes.","Inorganic chemistry","2007","46","23","9591","9601","10.1021/ic700558v","","","0.71073","MoKα","","0.1279","0.0975","","0.2482","0.2283","0.2283","","","","","","1.0154","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333299","11.1389","0.0007","11.2652","0.0007","11.4139","0.0007","76.38","0.001","66.369","0.001","78.964","0.001","1267.65","0.14","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H20 Co3 N2 O16 -","- C14 H6 Co3 N2 O16 -","- C28 H12 Co6 N4 O32 -","2","1","","Huang, You-Gui; Yuan, Da-Qiang; Pan, Long; Jiang, Fei-Long; Wu, Ming-Yan; Zhang, Xu-Dong; Wei, Wei; Gao, Qiang; Lee, Jeong Yong; Li, Jing; Hong, Mao-Chun","A 3D porous cobalt-organic framework exhibiting spin-canted antiferromagnetism and field-induced spin-flop transition.","Inorganic chemistry","2007","46","23","9609","9615","10.1021/ic700559z","","","0.71073","MoKα","","","0.0762","","","0.193","0.2066","","","","","","1.044","","","","has coordinates,has disorder","179435","2020-10-21","18:00:00",""
"4333300","28.3414","0.0014","27.9995","0.0016","41.5819","0.0016","90","","90","","90","","32997","3","293","2","293","2","","","","","","","","7","A b a 2","A 2 -2ab","41","","","","- C156 H206 As32 N46 O170 V54 Zn10 -","- C156 H198 As32 N46 O170 V54 Zn10 -","- C624 H792 As128 N184 O680 V216 Zn40 -","4","","","Zheng, Shou-Tian; Wang, Ming-Hui; Yang, Guo-Yu","In situ ligand reactions under hydrothermal conditions afford a novel zinc-substituted polyoxovanadate dimer.","Inorganic chemistry","2007","46","22","9503","9508","10.1021/ic700562m","","","0.71073","MoKα","","0.075","0.0644","","","0.1575","0.1692","","","","","","1.035","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333301","15.5635","0.0003","19.6903","0.0004","24.8067","0.0004","85.215","0.005","89.402","0.004","82.088","0.003","7503.4","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H118 As16 N24 O87 V24 Zn8 -","- C32 H100 As16 N24 O87 V24 Zn8 -","- C64 H200 As32 N48 O174 V48 Zn16 -","2","1","","Zheng, Shou-Tian; Wang, Ming-Hui; Yang, Guo-Yu","In situ ligand reactions under hydrothermal conditions afford a novel zinc-substituted polyoxovanadate dimer.","Inorganic chemistry","2007","46","22","9503","9508","10.1021/ic700562m","","","0.71073","MoKα","","0.1333","0.0893","","","0.2164","0.2504","","","","","","1.055","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333302","19.1679","0.0013","13.9594","0.001","19.529","0.0014","90","","90.785","0.001","90","","5224.9","0.6","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C45 H58 Ag2 Cl2 F12 O6 P2 S4 -","- C45 H58 Ag2 Cl2 F12 O6 P2 S4 -","- C180 H232 Ag8 Cl8 F48 O24 P8 S16 -","4","1","","Lee, Jai Young; Lee, So Young; Seo, Joobeom; Park, Chul Soon; Go, Jung Nam; Sim, Wonbo; Lee, Shim Sung","Calix[4]bis(thiacrown): assembly of an endocyclic disilver(I) complex and exocyclic 3D copper(I) coordination polymers.","Inorganic chemistry","2007","46","16","6221","6223","10.1021/ic7005875","","","0.71073","MoKα","","0.1135","0.0846","","","0.168","0.18","","","","","","1.155","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333303","11.1221","0.0012","16.871","0.0017","24.762","0.003","90","","99.944","0.002","90","","4576.6","0.9","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H26 Cu I O3 S2 -","- C22 H26 Cu I O3 S2 -","- C176 H208 Cu8 I8 O24 S16 -","8","1","","Lee, Jai Young; Lee, So Young; Seo, Joobeom; Park, Chul Soon; Go, Jung Nam; Sim, Wonbo; Lee, Shim Sung","Calix[4]bis(thiacrown): assembly of an endocyclic disilver(I) complex and exocyclic 3D copper(I) coordination polymers.","Inorganic chemistry","2007","46","16","6221","6223","10.1021/ic7005875","","","0.71073","MoKα","","0.1377","0.0577","","","0.0857","0.101","","","","","","0.95","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333304","20.2463","0.0011","19.9394","0.0011","24.988","0.0013","90","","90","","90","","10087.6","0.9","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C44 H52 Cu4 I4 O6 S4 -","- C44 H52 Cu4 I4 O6 S4 -","- C352 H416 Cu32 I32 O48 S32 -","8","1","","Lee, Jai Young; Lee, So Young; Seo, Joobeom; Park, Chul Soon; Go, Jung Nam; Sim, Wonbo; Lee, Shim Sung","Calix[4]bis(thiacrown): assembly of an endocyclic disilver(I) complex and exocyclic 3D copper(I) coordination polymers.","Inorganic chemistry","2007","46","16","6221","6223","10.1021/ic7005875","","","0.71073","MoKα","","0.1007","0.0545","","","0.0959","0.113","","","","","","1.133","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333305","13.8156","0.0007","20.8414","0.0009","16.5381","0.0008","90","","92.154","0.004","90","","4758.6","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H73 Mo N3 O S3 -","- C46 H72.853 Mo N3 O S3 -","- C184 H291.412 Mo4 N12 O4 S12 -","4","1","","Kapre, Ruta R.; Bothe, Eberhard; Weyhermüller, Thomas; DeBeer George, Serena; Wieghardt, Karl","Electronic Structure of Neutral and Monoanionic Tris(benzene-1,2-dithiolato)metal Complexes of Molybdenum and Tungsten","Inorganic Chemistry","2007","46","14","5642","5650","10.1021/ic700600r","","","0.71073","MoKα","","0.0686","0.0546","","","0.1115","0.1177","","","","","","1.155","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333306","13.3491","0.0006","18.5592","0.0008","19.3158","0.0008","90","","99.663","0.005","90","","4717.6","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H60 Mo S6 -","- C42 H60 Mo S6 -","- C168 H240 Mo4 S24 -","4","1","","Kapre, Ruta R.; Bothe, Eberhard; Weyhermüller, Thomas; DeBeer George, Serena; Wieghardt, Karl","Electronic Structure of Neutral and Monoanionic Tris(benzene-1,2-dithiolato)metal Complexes of Molybdenum and Tungsten","Inorganic Chemistry","2007","46","14","5642","5650","10.1021/ic700600r","","","0.71073","MoKα","","0.0648","0.0389","","","0.0756","0.0855","","","","","","1.027","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333307","10.7227","0.0002","18.7101","0.0004","23.7213","0.0005","90","","94.045","0.005","90","","4747.18","0.17","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H61.5 N0.5 S6 W -","- C43 H60 N0.5 S6 W -","- C172 H240 N2 S24 W4 -","4","1","","Kapre, Ruta R.; Bothe, Eberhard; Weyhermüller, Thomas; DeBeer George, Serena; Wieghardt, Karl","Electronic Structure of Neutral and Monoanionic Tris(benzene-1,2-dithiolato)metal Complexes of Molybdenum and Tungsten","Inorganic Chemistry","2007","46","14","5642","5650","10.1021/ic700600r","","","0.71073","MoKα","","0.0358","0.034","","","0.0774","0.0786","","","","","","1.133","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333308","14.5012","0.0006","21.7374","0.0009","20.2212","0.0009","90","","90.563","0.005","90","","6373.8","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C60 H99 Mo N2 S6 -","- C60 H99 Mo N2 S6 -","- C240 H396 Mo4 N8 S24 -","4","1","","Kapre, Ruta R.; Bothe, Eberhard; Weyhermüller, Thomas; DeBeer George, Serena; Wieghardt, Karl","Electronic Structure of Neutral and Monoanionic Tris(benzene-1,2-dithiolato)metal Complexes of Molybdenum and Tungsten","Inorganic Chemistry","2007","46","14","5642","5650","10.1021/ic700600r","","","0.71073","MoKα","","0.0762","0.0546","","","0.1004","0.1074","","","","","","1.111","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333309","14.5159","0.0008","21.949","0.002","20.174","0.002","90","","91.68","0.01","90","","6424.9","0.9","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58.19 H96.38 Cl0.38 N S6 W -","- C58.187 H96.374 Cl0.374 N S6 W -","- C232.748 H385.496 Cl1.496 N4 S24 W4 -","4","1","","Kapre, Ruta R.; Bothe, Eberhard; Weyhermüller, Thomas; DeBeer George, Serena; Wieghardt, Karl","Electronic Structure of Neutral and Monoanionic Tris(benzene-1,2-dithiolato)metal Complexes of Molybdenum and Tungsten","Inorganic Chemistry","2007","46","14","5642","5650","10.1021/ic700600r","","","0.71073","MoKα","","0.086","0.051","","","0.0881","0.0995","","","","","","1.089","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333310","12.19","0.003","12.19","0.003","30.035","0.003","90","0.013","90","0.013","120","0.017","3865.1","1.5","293","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C18 H18 Mn3 N6 O18 -","- C18 H18 Mn3 N6 O18 -","- C108 H108 Mn18 N36 O108 -","6","0.166667","","Sun, Wei-Wei; Cheng, Ai-Ling; Jia, Qin-Xiang; Gao, En-Qing","Metal-coordination-directed assembly of binuclear trigonal prisms and three-dimensional hydrogen-bonded networks.","Inorganic chemistry","2007","46","14","5471","5473","10.1021/ic700610p","","","0.71073","MoKα","","0.0562","0.0302","","","0.0612","0.0672","","","","","","0.852","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333311","13.267","0.003","8.7549","0.0018","14.685","0.003","90","","90","","90","","1705.7","0.6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H12 Co2 N4 O12 -","- C12 H12 Co2 N4 O12 -","- C48 H48 Co8 N16 O48 -","4","0.5","","Sun, Wei-Wei; Cheng, Ai-Ling; Jia, Qin-Xiang; Gao, En-Qing","Metal-coordination-directed assembly of binuclear trigonal prisms and three-dimensional hydrogen-bonded networks.","Inorganic chemistry","2007","46","14","5471","5473","10.1021/ic700610p","","","0.71073","MoKα","","0.0576","0.0327","","","0.0476","0.0502","","","","","","0.843","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333312","10.0888","0.0005","10.3628","0.0005","10.7442","0.0006","88.834","0.001","88.418","0.001","67.372","0.001","1036.37","0.09","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H16 N3 O6 Pb S -","- C22 H16 N3 O6 Pb S -","- C44 H32 N6 O12 Pb2 S2 -","2","1","","Fan, Sai-Rong; Zhu, Long-Guan","Syntheses, structures, and characterizations of four new lead(II) 5-sulfosalicylate complexes with both chelating and bridging neutral ligands.","Inorganic chemistry","2007","46","16","6785","6793","10.1021/ic700611e","","","0.71073","MoKα","","0.0341","0.0319","","","0.0692","0.07","","","","","","1.111","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333313","14.1956","0.0008","10.9841","0.0007","15.5903","0.0009","90","","116.482","0.002","90","","2175.9","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H36 N6 O14 Pb2 S2 -","- C44 H36 N6 O14 Pb2 S2 -","- C88 H72 N12 O28 Pb4 S4 -","2","0.5","","Fan, Sai-Rong; Zhu, Long-Guan","Syntheses, structures, and characterizations of four new lead(II) 5-sulfosalicylate complexes with both chelating and bridging neutral ligands.","Inorganic chemistry","2007","46","16","6785","6793","10.1021/ic700611e","","","0.71073","MoKα","","0.0281","0.0237","","","0.0615","0.0642","","","","","","1.081","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333314","11.3325","0.0011","15.0546","0.0015","12.6712","0.0013","90","","91.369","0.001","90","","2161.2","0.4","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H17 N3 O6 Pb S -","- C24 H12 N3 O6 Pb S -","- C96 H48 N12 O24 Pb4 S4 -","4","1","","Fan, Sai-Rong; Zhu, Long-Guan","Syntheses, structures, and characterizations of four new lead(II) 5-sulfosalicylate complexes with both chelating and bridging neutral ligands.","Inorganic chemistry","2007","46","16","6785","6793","10.1021/ic700611e","","","0.71073","MoKα","","0.064","0.0419","","","0.1296","0.1546","","","","","","0.997","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333315","11.6713","0.0007","15.5691","0.001","11.8091","0.0008","90","","96.122","0.001","90","","2133.6","0.2","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H17 N3 O6 Pb S -","- C23 H17 N3 O6 Pb S -","- C92 H68 N12 O24 Pb4 S4 -","4","1","","Fan, Sai-Rong; Zhu, Long-Guan","Syntheses, structures, and characterizations of four new lead(II) 5-sulfosalicylate complexes with both chelating and bridging neutral ligands.","Inorganic chemistry","2007","46","16","6785","6793","10.1021/ic700611e","","","0.71073","MoKα","","0.0376","0.0309","","","0.064","0.0667","","","","","","1.021","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333316","18.506","0.002","4.6865","0.0006","7.3414","0.0009","90","","90","","90","","636.71","0.13","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","LaAu2In4","","- Au2 In4 La -","- Au2 In4 La -","- Au8 In16 La4 -","4","0.5","","Salvador, James R.; Hoang, Khang; Mahanti, S. D.; Kanatzidis, Mercouri G.","REAu2In4(RE = La, Ce, Pr, Nd): Polyindides from Liquid Indium","Inorganic Chemistry","2007","46","17","6933","6941","10.1021/ic700633b","","","0.71073","MoK\α","","0.0349","0.0316","","","0.0845","0.0859","","","","","","1.196","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333317","18.514","0.003","4.6624","0.0008","7.3888","0.0012","90","","90","","90","","637.8","0.18","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","CeAu2In4","","- Au2 Ce In4 -","- Au2 Ce In4 -","- Au8 Ce4 In16 -","4","0.5","","Salvador, James R.; Hoang, Khang; Mahanti, S. D.; Kanatzidis, Mercouri G.","REAu2In4(RE = La, Ce, Pr, Nd): Polyindides from Liquid Indium","Inorganic Chemistry","2007","46","17","6933","6941","10.1021/ic700633b","","","0.71073","MoK\α","","0.043","0.0382","","","0.095","0.0968","","","","","","1.084","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333318","18.42","0.004","4.6202","0.0009","7.376","0.0015","90","","90","","90","","627.7","0.2","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","PrAu2In4","","- Au2 In4 Pr -","- Au2 In4 Pr -","- Au8 In16 Pr4 -","4","0.5","","Salvador, James R.; Hoang, Khang; Mahanti, S. D.; Kanatzidis, Mercouri G.","REAu2In4(RE = La, Ce, Pr, Nd): Polyindides from Liquid Indium","Inorganic Chemistry","2007","46","17","6933","6941","10.1021/ic700633b","","","0.71073","MoK\α","","0.0382","0.033","","","0.0755","0.0778","","","","","","1.129","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333319","18.4059","0.0018","4.6114","0.0005","7.4073","0.0007","90","","90","","90","","628.71","0.11","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","NdAu2In4","","- Au2 In4 Nd -","- Au2 In4 Nd -","- Au8 In16 Nd4 -","4","0.5","","Salvador, James R.; Hoang, Khang; Mahanti, S. D.; Kanatzidis, Mercouri G.","REAu2In4(RE = La, Ce, Pr, Nd): Polyindides from Liquid Indium","Inorganic Chemistry","2007","46","17","6933","6941","10.1021/ic700633b","","","0.71073","MoK\α","","0.0375","0.0363","","","0.0891","0.0898","","","","","","1.14","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333320","13.807","0.005","12.319","0.005","22.65","0.005","90","","96.768","0.005","90","","3826","2","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H32 Cu4 F12 N4 O8 -","- C28 H32 Cu4 F12 N4 O8 -","- C112 H128 Cu16 F48 N16 O32 -","4","1","","Aronica, Christophe; Chastanet, Guillaume; Pilet, Guillaume; Le Guennic, Boris; Robert, Vincent; Wernsdorfer, Wolfgang; Luneau, Dominique","Cubane variations: syntheses, structures, and magnetic property analyses of lanthanide(III)-copper(II) architectures with controlled nuclearities.","Inorganic chemistry","2007","46","15","6108","6119","10.1021/ic700645q","","","0.71069","MoKα","","0.1363","0.0449","","0.124","0.0563","0.0563","","","","","","1.0021","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333321","13.0969","0.0002","15.3158","0.0003","15.6664","0.0003","77.997","0.001","89.331","0.001","82.752","0.001","3048.9","0.1","293","","293","","","","","","","","","8","P -1","-P 1","2","","","","- C42 H43 Cl Cu3 F27 Gd N4 O12 -","- C42 H43 Cl Cu3 F27 Gd N4 O12 -","- C84 H86 Cl2 Cu6 F54 Gd2 N8 O24 -","2","1","","Aronica, Christophe; Chastanet, Guillaume; Pilet, Guillaume; Le Guennic, Boris; Robert, Vincent; Wernsdorfer, Wolfgang; Luneau, Dominique","Cubane variations: syntheses, structures, and magnetic property analyses of lanthanide(III)-copper(II) architectures with controlled nuclearities.","Inorganic chemistry","2007","46","15","6108","6119","10.1021/ic700645q","","","0.71073","MoKα","","0.0502","0.0377","","0.0539","0.0452","0.0452","","","","","","1.0759","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333322","29","0.002","15.1494","0.0008","25.742","0.002","90","","122.558","0.002","90","","9532","1.1","150","","150","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C44 H88 Cl3 Cu6 F18 N6 O33 Y3 -","- C44 H88 Cl3 Cu6 F18 N6 O33 Y3 -","- C176 H352 Cl12 Cu24 F72 N24 O132 Y12 -","4","0.5","","Aronica, Christophe; Chastanet, Guillaume; Pilet, Guillaume; Le Guennic, Boris; Robert, Vincent; Wernsdorfer, Wolfgang; Luneau, Dominique","Cubane variations: syntheses, structures, and magnetic property analyses of lanthanide(III)-copper(II) architectures with controlled nuclearities.","Inorganic chemistry","2007","46","15","6108","6119","10.1021/ic700645q","","","0.71073","MoKα","","0.1415","0.0641","","0.1192","0.0704","0.0704","","","","","","1.1016","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333323","13.0941","0.0002","15.2755","0.0002","15.6275","0.0002","78.095","0.001","89.215","0.001","82.666","0.001","3033.28","0.07","293","","293","","","","","","","","","8","P -1","-P 1","2","","","","- C42 H43 Cl Cu3 F27 N4 O12 Y -","- C42 H43 Cl Cu3 F27 N4 O12 Y -","- C84 H86 Cl2 Cu6 F54 N8 O24 Y2 -","2","1","","Aronica, Christophe; Chastanet, Guillaume; Pilet, Guillaume; Le Guennic, Boris; Robert, Vincent; Wernsdorfer, Wolfgang; Luneau, Dominique","Cubane variations: syntheses, structures, and magnetic property analyses of lanthanide(III)-copper(II) architectures with controlled nuclearities.","Inorganic chemistry","2007","46","15","6108","6119","10.1021/ic700645q","","","0.71073","MoKα","","0.0824","0.0452","","0.0775","0.0524","0.0524","","","","","","1.1014","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333324","13.259","0.003","13.256","0.003","17.905","0.004","90","","92.74","0.03","90","","3143.4","1.2","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","[Ru(η^5^-C~5~Me~5~){P^i^Pr~2~NC~6~H~10~NP^i^Pr~2~-κ^3^-P,P',N}] [B{C~8~H~3~F~6~}~4~]'","pentahapto-pentamethylcyclopentadienyl-{(R,R)-bis((diisopropylphosphino)amino) cyclohexane-κ^3^-P,P',N}ruthenium(II) tetrakis{3,5-bis(trifluoromethyl)phenyl} borate","","- C60 H67 B F24 N2 P2 Ru -","- C60 H67 B F24 N2 P2 Ru -","- C120 H134 B2 F48 N4 P4 Ru2 -","2","1","","Palacios, M. Dolores; Puerta, M. Carmen; Valerga, Pedro; Lledós, Agustí; Veilly, Edouard","Coordinatively Unsaturated Semisandwich Complexes of Ruthenium with Phosphinoamine Ligands and Related Species: A Complex Containing (R,R)-1,2-Bis((diisopropylphosphino)amino)cyclohexane in a New Coordination Form κ3P,P‘,N-η2-P,N","Inorganic Chemistry","2007","46","17","6958","6967","10.1021/ic700674c","","x-ray","0.71073","MoKα","","0.0408","0.0401","","","0.0869","0.0874","","","","","","1.047","","","","has coordinates,has disorder","194597","2020-10-21","18:00:00",""
"4333325","13.079","0.003","17.54","0.004","26.037","0.005","90","","93.51","0.03","90","","5962","2","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","[Ru(η^5^C~5~H~5~)(N~2~){(Κ^2^-P,P')-^i^Pr~2~PNH(C~6~H~10~)NHP^i^Pr~2~}] [B{(C~6~H~3~(CF~3~)~2~}~4~]","","","- C55 H57 B F24 N4 P2 Ru -","- C55 H57 B F24 N4 P2 Ru -","- C220 H228 B4 F96 N16 P8 Ru4 -","4","2","","Palacios, M. Dolores; Puerta, M. Carmen; Valerga, Pedro; Lledós, Agustí; Veilly, Edouard","Coordinatively Unsaturated Semisandwich Complexes of Ruthenium with Phosphinoamine Ligands and Related Species: A Complex Containing (R,R)-1,2-Bis((diisopropylphosphino)amino)cyclohexane in a New Coordination Form κ3P,P‘,N-η2-P,N","Inorganic Chemistry","2007","46","17","6958","6967","10.1021/ic700674c","","x-ray","0.71073","MoKα","","0.0613","0.06","","","0.1373","0.1382","","","","","","1.034","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333326","14.176","0.003","14.483","0.003","15.648","0.003","98.52","0.03","102.84","0.03","100.43","0.03","3020.6","1.3","100","2","100","2","","","","","","","","8","P -1","-P 1","2","[Ru(η^5^-C~5~Me~5~){P^i^Pr~2~NHCH~2~CH~2~NHP^i^Pr~2~-κ^2^-P,P'}(η^2^-O~2~)] [B{C~8~H~3~F~6~}~4~]","pentahapto-pentamethylcyclopentadienyl-{bis((diisopropylphosphino)amino) ethane-κ^2^-P,P'}-dihapto-dioxygen-ruthenium (II) tetrakis{3,5-bis(trifluoromethyl)phenyl}borate","","- C56 H61 B F24 N2 O2 P2 Ru -","- C56 H61 B F24 N2 O2 P2 Ru -","- C112 H122 B2 F48 N4 O4 P4 Ru2 -","2","1","","Palacios, M. Dolores; Puerta, M. Carmen; Valerga, Pedro; Lledós, Agustí; Veilly, Edouard","Coordinatively Unsaturated Semisandwich Complexes of Ruthenium with Phosphinoamine Ligands and Related Species: A Complex Containing (R,R)-1,2-Bis((diisopropylphosphino)amino)cyclohexane in a New Coordination Form κ3P,P‘,N-η2-P,N","Inorganic Chemistry","2007","46","17","6958","6967","10.1021/ic700674c","","x-ray","0.71073","MoKα","","0.0693","0.0594","","","0.112","0.1172","","","","","","1.076","","","","has coordinates,has disorder","194597","2020-10-21","18:00:00",""
"4333327","12.943","0.003","13.232","0.003","14.614","0.003","92.57","0.03","90.22","0.03","118.7","0.03","2192.2","1.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","[Ru(η^5^-C~5~H~5~)(η^6^-C~6~H~5~F)][B{C~6~H~3~(CF~3~)~2~}~4~]","pentahapto-cyclopentadienil-hexahapto-fluorbencene-ruthenium(II) tetrakis{3,5-bis(trifluoromethyl)phenyl}borate","","- C43 H22 B F25 Ru -","- C43 H22 B F25 Ru -","- C86 H44 B2 F50 Ru2 -","2","1","","Palacios, M. Dolores; Puerta, M. Carmen; Valerga, Pedro; Lledós, Agustí; Veilly, Edouard","Coordinatively Unsaturated Semisandwich Complexes of Ruthenium with Phosphinoamine Ligands and Related Species: A Complex Containing (R,R)-1,2-Bis((diisopropylphosphino)amino)cyclohexane in a New Coordination Form κ3P,P‘,N-η2-P,N","Inorganic Chemistry","2007","46","17","6958","6967","10.1021/ic700674c","","x-ray","0.71073","MoKα","","0.0656","0.0594","","","0.1263","0.1307","","","","","","0.947","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333328","8.4451","0.0002","10.8058","0.0004","13.5406","0.0005","90","","90","","90","","1235.66","0.07","293","2","293","2","","","","","","","hydrothermal synthesis","5","P b c a","-P 2ac 2ab","61","","Potassium uranyl sulfate hydroxide","","- H K O7 S U -","- H K O7 S U -","- H8 K8 O56 S8 U8 -","8","1","","Forbes, Tori Z.; Goss, Valerie; Jain, Meha; Burns, Peter C.","Structure determination and infrared spectroscopy of K(UO2)(SO4)(OH)(H2O) and K(UO2)(SO4)(OH).","Inorganic chemistry","2007","46","17","7163","7168","10.1021/ic700691k","","x-ray","0.71073","MoKα","","0.0236","0.0206","","","0.0479","0.0489","","","","","","1.148","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333329","8.0521","0.0004","7.9354","0.0004","11.3177","0.0006","90","","107.678","0.001","90","","689.01","0.06","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Potassium uranyl sulfate hydroxide hydrate","","- H3 K O8 S U -","- H3 K O8 S U -","- H12 K4 O32 S4 U4 -","4","1","","Forbes, Tori Z.; Goss, Valerie; Jain, Meha; Burns, Peter C.","Structure determination and infrared spectroscopy of K(UO2)(SO4)(OH)(H2O) and K(UO2)(SO4)(OH).","Inorganic chemistry","2007","46","17","7163","7168","10.1021/ic700691k","","","0.71073","MoKα","","0.0269","0.0251","","","0.0601","0.0607","","","","","","1.184","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333330","24.1931","0.0009","11.7696","0.0005","18.488","0.0006","90","","90","","90","","5264.3","0.3","298","2","298","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","","","- C36 H62 Cl4 Cu2 N10 O18 -","- C36 H58 Cl4 Cu2 N10 O18 -","- C144 H232 Cl16 Cu8 N40 O72 -","4","0.5","","Company, Anna; Jee, Joo-Eun; Ribas, Xavi; Lopez-Valbuena, Josep Maria; Gómez, Laura; Corbella, Montserrat; Llobet, Antoni; Mahía, José; Benet-Buchholz, Jordi; Costas, Miquel; van Eldik, Rudi","Structural and Kinetic Study of Reversible CO2Fixation by Dicopper Macrocyclic Complexes. From Intramolecular Binding to Self-Assembly of Molecular Boxes","Inorganic Chemistry","2007","46","22","9098","9110","10.1021/ic700692t","","","0.71073","MoKα","","0.1561","0.0696","","0.187","0.144","","","","1.044","1.179","1.179","","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333331","26.0381","0.0007","13.132","0.0005","31.2787","0.0012","90","","106.586","0.002","90","","10250.2","0.6","153","2","153","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C79.5 H118 Cu4 F12 N19 O18 S4 -","- C79.5 H118 Cu4 F12 N19 O18 S4 -","- C318 H472 Cu16 F48 N76 O72 S16 -","4","0.5","","Company, Anna; Jee, Joo-Eun; Ribas, Xavi; Lopez-Valbuena, Josep Maria; Gómez, Laura; Corbella, Montserrat; Llobet, Antoni; Mahía, José; Benet-Buchholz, Jordi; Costas, Miquel; van Eldik, Rudi","Structural and Kinetic Study of Reversible CO2Fixation by Dicopper Macrocyclic Complexes. From Intramolecular Binding to Self-Assembly of Molecular Boxes","Inorganic Chemistry","2007","46","22","9098","9110","10.1021/ic700692t","","","0.71073","MoKα","","0.1529","0.0812","","","0.1977","0.2328","","","","","","0.926","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333332","15.8738","0.0007","15.7332","0.0006","36.4668","0.0016","90","","94.387","0.002","90","","9080.7","0.7","153","2","153","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C67 H102 Cl2 Cu4 F12 N12 O21 S4 -","- C67 H102 Cl2 Cu4 F12 N12 O21 S4 -","- C268 H408 Cl8 Cu16 F48 N48 O84 S16 -","4","1","","Company, Anna; Jee, Joo-Eun; Ribas, Xavi; Lopez-Valbuena, Josep Maria; Gómez, Laura; Corbella, Montserrat; Llobet, Antoni; Mahía, José; Benet-Buchholz, Jordi; Costas, Miquel; van Eldik, Rudi","Structural and Kinetic Study of Reversible CO2Fixation by Dicopper Macrocyclic Complexes. From Intramolecular Binding to Self-Assembly of Molecular Boxes","Inorganic Chemistry","2007","46","22","9098","9110","10.1021/ic700692t","","","0.71073","MoKα","","0.2292","0.0888","","","0.2131","0.2652","","","","","","0.908","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333333","15.2221","0.0006","17.3423","0.0006","18.8869","0.0007","91.036","0.002","113.422","0.002","103.114","0.002","4422.9","0.3","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H112 Cu4 F12 N14 O21 S4 -","- C70 H112 Cu4 F12 N14 O21 S4 -","- C140 H224 Cu8 F24 N28 O42 S8 -","2","1","","Company, Anna; Jee, Joo-Eun; Ribas, Xavi; Lopez-Valbuena, Josep Maria; Gómez, Laura; Corbella, Montserrat; Llobet, Antoni; Mahía, José; Benet-Buchholz, Jordi; Costas, Miquel; van Eldik, Rudi","Structural and Kinetic Study of Reversible CO2Fixation by Dicopper Macrocyclic Complexes. From Intramolecular Binding to Self-Assembly of Molecular Boxes","Inorganic Chemistry","2007","46","22","9098","9110","10.1021/ic700692t","","","0.71073","MoKα","","0.119","0.0546","","","0.1192","0.1362","","","","","","0.858","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333334","17.797","0.004","13.879","0.002","19.063","0.003","90","","112.867","0.014","90","","4338.6","1.4","173","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C64 H112 Cl4 Cu4 N12 O28 -","- C64 H92 Cl4 Cu4 N12 O28 -","- C128 H184 Cl8 Cu8 N24 O56 -","2","0.5","","Company, Anna; Jee, Joo-Eun; Ribas, Xavi; Lopez-Valbuena, Josep Maria; Gómez, Laura; Corbella, Montserrat; Llobet, Antoni; Mahía, José; Benet-Buchholz, Jordi; Costas, Miquel; van Eldik, Rudi","Structural and Kinetic Study of Reversible CO2Fixation by Dicopper Macrocyclic Complexes. From Intramolecular Binding to Self-Assembly of Molecular Boxes","Inorganic Chemistry","2007","46","22","9098","9110","10.1021/ic700692t","","","0.71073","MoKα","","0.1172","0.0857","","0.2337","0.2143","","","","1.048","1.157","1.157","","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333335","11.8935","0.0009","12.3996","0.001","17.1234","0.0014","101.549","0.002","102.531","0.002","96.167","0.002","2385","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C76 H48 Mn4 N26 O6 Pt4 S16 -","- C76 H48 Mn4 N26 O6 Pt4 S16 -","- C76 H48 Mn4 N26 O6 Pt4 S16 -","1","0.5","","Hiraga, Hiroki; Miyasaka, Hitoshi; Nakata, Kazuya; Kajiwara, Takashi; Takaishi, Shinya; Oshima, Yugo; Nojiri, Hiroyuki; Yamashita, Masahiro","Hybrid Molecular Material Exhibiting Single-Molecule Magnet Behavior and Molecular Conductivity","Inorganic Chemistry","2007","46","23","9661","9671","10.1021/ic700727n","","","0.71073","MoKα","","0.0565","0.0418","","","0.0808","0.0841","","","","","","0.996","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333336","10.7098","0.0009","13.175","0.0011","21.1269","0.0018","100.777","0.002","103.169","0.002","104.008","0.002","2722.3","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C88 H42 Mn4 N32 O6 Pt6 S24 -","- C88 H42 Mn4 N32 O6 Pt6 S24 -","- C88 H42 Mn4 N32 O6 Pt6 S24 -","1","0.5","","Hiraga, Hiroki; Miyasaka, Hitoshi; Nakata, Kazuya; Kajiwara, Takashi; Takaishi, Shinya; Oshima, Yugo; Nojiri, Hiroyuki; Yamashita, Masahiro","Hybrid Molecular Material Exhibiting Single-Molecule Magnet Behavior and Molecular Conductivity","Inorganic Chemistry","2007","46","23","9661","9671","10.1021/ic700727n","","","0.71073","MoKα","","0.0858","0.0363","","","0.0604","0.114","","","","","","0.972","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333337","3.5731","0.0004","10.4293","0.0011","21.196","0.002","89.031","0.005","89.322","0.005","85.546","0.005","787.33","0.14","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H8 Ag N2 O10 V4 -","- C10 H8 Ag N2 O10 V4 -","- C20 H16 Ag2 N4 O20 V8 -","2","1","","Yan, Bangbo; Maggard, Paul A.","M(bipyridine)V4O10(M = Cu, Ag): Hybrid Analogues of Low-Dimensional Reduced Vanadates","Inorganic Chemistry","2007","46","16","6640","6646","10.1021/ic700729q","","","0.71073","MoKα","","0.1002","0.0787","","","0.2111","0.2236","","","","","","1.027","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333338","25.9568","0.0002","25.9568","0.0002","37.3385","0.0005","90","","90","","90","","25157","0.4","173","","173","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C61 H50 F12 N6 O2 P2 Ru -","- C61 H50 F12 N6 O2 P2 Ru -","- C976 H800 F192 N96 O32 P32 Ru16 -","16","1","","Bonnet, Sylvestre; Collin, Jean-Paul; Sauvage, Jean-Pierre","Light-Induced Geometrical Changes in Acyclic Ruthenium(II) Complexes and Their Ruthena−Macrocyclic Analogues","Inorganic Chemistry","2007","46","25","10520","10533","10.1021/ic700734q","","","0.71073","Mo-Kα","","0.109","0.065","","0.151","","0.087","","","1.366","","","1.209","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333339","10.81","0.002","14.866","0.002","15.253","0.003","104.99","0.01","100.25","0.01","95.15","0.01","2306.1","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H70 Cl2 O9 P2 -","- C40 H70 Cl2 O9 P2 -","- C80 H140 Cl4 O18 P4 -","2","1","","Moiseev, Dmitry V.; Patrick, Brian O.; James, Brian R.; Hu, Thomas Q.","Interaction of tertiary phosphines with lignin-type, alpha,beta-unsaturated aldehydes in water.","Inorganic chemistry","2007","46","22","9389","9399","10.1021/ic7007478","","","0.71073","MoKα","","0.1263","0.0852","","","0.2086","0.2298","","","","","","1.056","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333340","10.186","0.001","31.887","0.003","11.314","0.001","90","","102.084","0.004","90","","3593.4","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H50 Cl2 O9 P2 -","- C30 H50 Cl2 O9 P2 -","- C120 H200 Cl8 O36 P8 -","4","1","","Moiseev, Dmitry V.; Patrick, Brian O.; James, Brian R.; Hu, Thomas Q.","Interaction of tertiary phosphines with lignin-type, alpha,beta-unsaturated aldehydes in water.","Inorganic chemistry","2007","46","22","9389","9399","10.1021/ic7007478","","","0.71073","MoKα","","0.0734","0.0464","","","0.0947","0.106","","","","","","1.019","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333341","7.91","0.007","17.789","0.014","14.957","0.012","90","","100.004","0.013","90","","2073","3","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H11 N6 Ni S4 -","- C16 H11 N6 Ni S4 -","- C64 H44 N24 Ni4 S16 -","4","1","","Tian, Zhengfang; Ren, Xiaoming; Li, Yizhi; Song, You; Meng, Qingjin","A new quasi-1D spin system with spin transition exhibiting novel CN...pi interactions.","Inorganic chemistry","2007","46","20","8102","8104","10.1021/ic700758c","","","0.71073","MoKα","","0.0755","0.0587","","","0.1295","0.1345","","","","","","1.104","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333342","7.8826","0.0014","17.777","0.003","14.967","0.003","90","","99.931","0.004","90","","2065.9","0.7","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H11 N6 Ni S4 -","- C16 H11 N6 Ni S4 -","- C64 H44 N24 Ni4 S16 -","4","1","","Tian, Zhengfang; Ren, Xiaoming; Li, Yizhi; Song, You; Meng, Qingjin","A new quasi-1D spin system with spin transition exhibiting novel CN...pi interactions.","Inorganic chemistry","2007","46","20","8102","8104","10.1021/ic700758c","","","0.71073","MoKα","","0.0753","0.0578","","","0.1363","0.1425","","","","","","1.081","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333343","8.2309","0.001","10.8644","0.0012","14.0116","0.0016","90","","90","","90","","1253","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","05336m","","","- C10 H22 Cl Cu N2 -","- C10 H22 Cl Cu N2 -","- C40 H88 Cl4 Cu4 N8 -","4","1","","York, John T.; Bar-Nahum, Itsik; Tolman, William B.","Structural Diversity in Copper−Sulfur Chemistry: Synthesis of Novel Cu/S Clusters through Metathesis Reactions","Inorganic Chemistry","2007","46","20","8105","8107","10.1021/ic700760p","","","0.71073","MoKα","","0.0565","0.0323","","","0.0562","0.0608","","","","","","1.005","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333344","15.028","0.004","15.526","0.004","16.968","0.004","90","","114.692","0.004","90","","3597.1","1.6","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","05260m","","","- C44 H96 Cl12 Cu6 N8 S8 -","- C44 H96 Cl12 Cu6 N8 S8 -","- C88 H192 Cl24 Cu12 N16 S16 -","2","1","","York, John T.; Bar-Nahum, Itsik; Tolman, William B.","Structural Diversity in Copper−Sulfur Chemistry: Synthesis of Novel Cu/S Clusters through Metathesis Reactions","Inorganic Chemistry","2007","46","20","8105","8107","10.1021/ic700760p","","","0.71073","MoKα","","0.0358","0.0282","","","0.0522","0.0544","","","","","","1.001","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333345","15.6678","0.001","14.2575","0.0009","26.5917","0.0016","90","","99.427","0.001","90","","5859.9","0.6","173","2","173","2","","","","","","","","8","P 1 21 1","P 2yb","4","05288m","","","- C35 H70 Cl4 Cu3 F9 N6 O9 S5 -","- C35 H70 Cl4 Cu3 F9 N6 O9 S5 -","- C140 H280 Cl16 Cu12 F36 N24 O36 S20 -","4","2","","York, John T.; Bar-Nahum, Itsik; Tolman, William B.","Structural Diversity in Copper−Sulfur Chemistry: Synthesis of Novel Cu/S Clusters through Metathesis Reactions","Inorganic Chemistry","2007","46","20","8105","8107","10.1021/ic700760p","","","0.71073","MoKα","","0.064","0.0496","","","0.1122","0.1188","","","","","","1.027","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333346","8.7073","0.0013","21.205","0.003","19.464","0.003","90","","92.307","0.003","90","","3590.9","0.9","173","2","173","2","","","","","","","","8","P 1 21 1","P 2yb","4","06193m","","","- C43 H94 Cl8 Cu4 F12 N8 S4 Sb2 -","- C43 H94 Cl8 Cu4 F12 N8 S4 Sb2 -","- C86 H188 Cl16 Cu8 F24 N16 S8 Sb4 -","2","1","","York, John T.; Bar-Nahum, Itsik; Tolman, William B.","Structural Diversity in Copper−Sulfur Chemistry: Synthesis of Novel Cu/S Clusters through Metathesis Reactions","Inorganic Chemistry","2007","46","20","8105","8107","10.1021/ic700760p","","","0.71073","MoKα","","0.0842","0.0613","","","0.1294","0.1382","","","","","","1.075","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333347","12.503","0.005","12.391","0.005","13.242","0.008","90","","118","0.006","90","","1811.4","1.5","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","06214","","","- C22 H48 Cl6 Cu2 N4 S4 -","- C22 H48 Cl6 Cu2 N4 S4 -","- C44 H96 Cl12 Cu4 N8 S8 -","2","1","","York, John T.; Bar-Nahum, Itsik; Tolman, William B.","Structural Diversity in Copper−Sulfur Chemistry: Synthesis of Novel Cu/S Clusters through Metathesis Reactions","Inorganic Chemistry","2007","46","20","8105","8107","10.1021/ic700760p","","","0.71073","MoKα","","0.0404","0.0299","","","0.0667","0.0708","","","","","","1.013","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333348","14.924","0.003","31.721","0.006","9.4866","0.0019","90","","94.31","0.03","90","","4478.3","1.5","193","2","193","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C80 H84 Cu6 Mo2 N8 O2 P2 S12 -","- C80 H84 Cu6 Mo2 N8 O2 P2 S12 -","- C160 H168 Cu12 Mo4 N16 O4 P4 S24 -","2","0.5","","Zhang, Wen-Hua; Song, Ying-Lin; Ren, Zhi-Gang; Li, Hong-Xi; Li, Ling-Ling; Zhang, Yong; Lang, Jian-Ping","Construction of [(eta5-C5Me5)MoS3Cu3]-based supramolecular assemblies from the [(eta5-C5Me5)MoS3(CuNCS)3]- cluster anion and multitopic ligands with different symmetries.","Inorganic chemistry","2007","46","16","6647","6660","10.1021/ic700762x","","","0.71073","MoKα","","0.0932","0.0689","","","0.1153","0.124","","","","","","1.184","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333349","9.3447","0.0011","14.7948","0.0018","16.563","0.002","90","","90","","90","","2289.9","0.5","153","2","153","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C16 H19 Cu3 Mo N4 S5 -","- C16 H19 Cu3 Mo N4 S5 -","- C64 H76 Cu12 Mo4 N16 S20 -","4","0.5","","Zhang, Wen-Hua; Song, Ying-Lin; Ren, Zhi-Gang; Li, Hong-Xi; Li, Ling-Ling; Zhang, Yong; Lang, Jian-Ping","Construction of [(eta5-C5Me5)MoS3Cu3]-based supramolecular assemblies from the [(eta5-C5Me5)MoS3(CuNCS)3]- cluster anion and multitopic ligands with different symmetries.","Inorganic chemistry","2007","46","16","6647","6660","10.1021/ic700762x","","","0.7107","MoKα","","0.0437","0.0397","","","0.069","0.0703","","","","","","1.276","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333350","10.472","0.002","16.396","0.003","16.563","0.003","60.45","0.03","89.52","0.03","78.05","0.03","2405.6","1.1","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C40.5 H38 Cu3 Mo N9.75 O0.5 S5 -","- C40.5 H38 Cu3 Mo N9.75 O0.5 S5 -","- C81 H76 Cu6 Mo2 N19.5 O S10 -","2","1","","Zhang, Wen-Hua; Song, Ying-Lin; Ren, Zhi-Gang; Li, Hong-Xi; Li, Ling-Ling; Zhang, Yong; Lang, Jian-Ping","Construction of [(eta5-C5Me5)MoS3Cu3]-based supramolecular assemblies from the [(eta5-C5Me5)MoS3(CuNCS)3]- cluster anion and multitopic ligands with different symmetries.","Inorganic chemistry","2007","46","16","6647","6660","10.1021/ic700762x","","","0.71073","MoKα","","0.0625","0.0568","","","0.1562","0.1597","","","","","","1.2","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333351","14.961","0.003","15.335","0.003","16.021","0.003","99.33","0.03","116.22","0.03","108.91","0.03","2910.6","1.9","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C59 H56 Cu3.1 Mo N8 S5 -","- C59 H56 Cu3.1 Mo N8 S5 -","- C118 H112 Cu6.2 Mo2 N16 S10 -","2","1","","Zhang, Wen-Hua; Song, Ying-Lin; Ren, Zhi-Gang; Li, Hong-Xi; Li, Ling-Ling; Zhang, Yong; Lang, Jian-Ping","Construction of [(eta5-C5Me5)MoS3Cu3]-based supramolecular assemblies from the [(eta5-C5Me5)MoS3(CuNCS)3]- cluster anion and multitopic ligands with different symmetries.","Inorganic chemistry","2007","46","16","6647","6660","10.1021/ic700762x","","","0.71073","MoKα","","0.0839","0.0698","","","0.1741","0.1841","","","","","","1.115","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333352","7.1997","0.0008","10.6039","0.001","7.2604","0.0008","90","","98.537","0.006","90","","548.15","0.1","260","2","260","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C H8 B4 N2 O12 -","- B4 H12 N2 O10.41 -","- B8 H24 N4 O20.82 -","2","1","","Ramachandran, P. Veeraraghavan; Gagare, Pravin D.","Preparation of Ammonia Borane in High Yield and Purity, Methanolysis, and Regeneration","Inorganic Chemistry","2007","46","19","7810","7817","10.1021/ic700772a","","","0.71073","MoKα","","0.0748","0.0637","","","0.1691","0.1797","","","","","","1.06","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333353","22.4122","0.0009","12.0086","0.0003","18.885","0.0005","90","","90","","90","","5082.7","0.3","150","2","150","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C40 H160 B10 N10 O0.25 -","- C22 H88 B5 N5 O22 -","- C88 H352 B20 N20 O88 -","4","1","","Ramachandran, P. Veeraraghavan; Gagare, Pravin D.","Preparation of Ammonia Borane in High Yield and Purity, Methanolysis, and Regeneration","Inorganic Chemistry","2007","46","19","7810","7817","10.1021/ic700772a","","","0.71073","MoKα","","0.0706","0.0509","","","0.1016","0.113","","","","","","1.062","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333354","12.2778","0.0008","12.9304","0.0008","23.6398","0.0015","90","","92.554","0.001","90","","3749.3","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H37 Cu N3 P -","- C50 H37 Cu N3 P -","- C200 H148 Cu4 N12 P4 -","4","1","","Teets, Thomas S.; Partyka, David V.; Esswein, Arthur J.; Updegraff, James B.; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.","Luminescent, Three-Coordinate Azadipyrromethene Complexes of d10Copper, Silver, and Gold","Inorganic Chemistry","2007","46","16","6218","6220","10.1021/ic700776t","","","0.71073","MoKα","","0.0497","0.0374","","","0.0936","0.1009","","","","","","1.023","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333355","15.0342","0.0002","17.0484","0.0003","26.9464","0.0004","89.408","0.001","77.777","0.001","70.741","0.001","6359.02","0.18","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H37 Ag N3 P -","- C50 H37 Ag N3 P -","- C300 H222 Ag6 N18 P6 -","6","3","","Teets, Thomas S.; Partyka, David V.; Esswein, Arthur J.; Updegraff, James B.; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.","Luminescent, Three-Coordinate Azadipyrromethene Complexes of d10Copper, Silver, and Gold","Inorganic Chemistry","2007","46","16","6218","6220","10.1021/ic700776t","","","0.71073","MoKα","","0.0462","0.0335","","","0.0817","0.0863","","","","","","1.059","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333356","12.3616","0.0002","12.9923","0.0002","23.7047","0.0005","90","","90.678","0.001","90","","3806.84","0.12","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H37 Au N3 P -","- C50 H37 Au N3 P -","- C200 H148 Au4 N12 P4 -","4","1","","Teets, Thomas S.; Partyka, David V.; Esswein, Arthur J.; Updegraff, James B.; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G.","Luminescent, Three-Coordinate Azadipyrromethene Complexes of d10Copper, Silver, and Gold","Inorganic Chemistry","2007","46","16","6218","6220","10.1021/ic700776t","","","0.71073","MoKα","","0.018","0.0157","","","0.0401","0.0413","","","","","","1.009","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333357","7.272","0.002","7.272","0.002","26.563","0.003","90","","90","","120","","1216.5","0.5","213","2","213","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C2 Ag0.56 Au0.44 K N2 -","- C2 Ag0.556 Au0.444 K N2 -","- C18 Ag5.004 Au3.996 K9 N18 -","9","0.5","","Hettiarachchi, Samanthika R.; Schaefer, Brian K.; Yson, Renante L.; Staples, Richard J.; Herbst-Irmer, Regine; Patterson, Howard H.","Observation of a Mixed-Metal Transition in Heterobimetallic Au/Ag Dicyanide Systems","Inorganic Chemistry","2007","46","17","6997","7004","10.1021/ic700780k","","","0.71073","MoKα","","0.0198","0.0193","","","0.0486","0.0488","","","","","","1.079","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333358","12.6158","0.001","13.5543","0.0011","15.9732","0.0012","84.293","0.001","73.259","0.001","64.411","0.001","2358.1","0.3","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C21.2 H22.8 Cl0.8 Cr0.8 N3.2 -","- C21.2 H22.8 Cl0.8 Cr0.8 N3.2 -","- C106 H114 Cl4 Cr4 N16 -","5","2.5","","Darensbourg, Donald J.; Fitch, Shawn B.","(Tetramethyltetraazaannulene)chromium Chloride: A Highly Active Catalyst for the Alternating Copolymerization of Epoxides and Carbon Dioxide","Inorganic Chemistry","2007","46","14","5474","5476","10.1021/ic7007842","","","0.71073","MoKα","","0.0623","0.0419","","","0.1046","0.1161","","","","","","1.011","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333359","17.927","0.004","24.839","0.005","16.881","0.003","90","","103.615","0.003","90","","7306","3","298","2","298","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C40 H46 Cu6 I3 N9 O7 S6 W2 -","- C40 H46 Cu6 I3 N9 O7 S6 W2 -","- C160 H184 Cu24 I12 N36 O28 S24 W8 -","4","0.5","","Huang, Kexuan; Song, Yinglin; Pan, Zhaorui; Li, Yizhi; Zhuo, Xin; Zheng, Hegen","Porous Nonlinear-Optical Material Based on a Twin-Nest-Shaped Heterothiometallic Cluster: {[NH4][W2O2S6Cu6I3(4,4‘-bipy)4]·5H2O}n","Inorganic Chemistry","2007","46","16","6233","6235","10.1021/ic700794y","","","0.71073","MoKα","","0.0774","0.0479","","","0.0973","0.1035","","","","","","1.041","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333360","14.598","0.0002","23.753","0.0003","14.835","0.0002","90","","90.398","0.001","90","","5143.86","0.12","100","1","100","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H57 Ce N15 O11 W -","- C37 H42.62 Ce N15 O11 W -","- C148 H170.48 Ce4 N60 O44 W4 -","4","1","","Przychodzeń, Paweł; Pełka, Robert; Lewiński, Krzysztof; Supel, Justyna; Rams, Michał; Tomala, Krzysztof; Sieklucka, Barbara","Tuning of Magnetic Properties of Polynuclear Lanthanide(III)−Octacyanotungstate(V) Systems: Determination of Ligand-Field Parameters and Exchange Interaction","Inorganic Chemistry","2007","46","21","8924","8938","10.1021/ic700795q","","","0.7107","MoKα","","0.0555","0.0364","","","0.0795","0.0878","","","","","","1.027","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4333361","14.384","0.0002","23.437","0.0002","14.735","0.0002","90","","90.288","0.0006","90","","4967.37","0.11","100","1","100","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H57 N15 O11 Pr W -","- C37 H51.243 N15 O11 Pr W -","- C148 H204.972 N60 O44 Pr4 W4 -","4","1","","Przychodzeń, Paweł; Pełka, Robert; Lewiński, Krzysztof; Supel, Justyna; Rams, Michał; Tomala, Krzysztof; Sieklucka, Barbara","Tuning of Magnetic Properties of Polynuclear Lanthanide(III)−Octacyanotungstate(V) Systems: Determination of Ligand-Field Parameters and Exchange Interaction","Inorganic Chemistry","2007","46","21","8924","8938","10.1021/ic700795q","","","0.7107","MoKα","","0.0398","0.034","","","0.0789","0.0815","","","","","","1.158","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333362","14.336","0.0002","23.418","0.0003","14.713","0.0002","90","","90.462","0.001","90","","4939.29","0.12","100","1","100","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H57 N15 Nd O11 W -","- C37 H40.681 N15 Nd O10.671 W -","- C148 H162.724 N60 Nd4 O42.684 W4 -","4","1","","Przychodzeń, Paweł; Pełka, Robert; Lewiński, Krzysztof; Supel, Justyna; Rams, Michał; Tomala, Krzysztof; Sieklucka, Barbara","Tuning of Magnetic Properties of Polynuclear Lanthanide(III)−Octacyanotungstate(V) Systems: Determination of Ligand-Field Parameters and Exchange Interaction","Inorganic Chemistry","2007","46","21","8924","8938","10.1021/ic700795q","","","0.7107","MoKα","","0.0441","0.0374","","","0.0843","0.0866","","","","","","1.253","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333363","14.509","0.0001","23.678","0.0003","14.747","0.0001","90","","90.876","0.0007","90","","5065.65","0.08","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H57 N15 O11 Sm W -","- C37 H38 N15 O11 Sm W -","- C148 H152 N60 O44 Sm4 W4 -","4","1","","Przychodzeń, Paweł; Pełka, Robert; Lewiński, Krzysztof; Supel, Justyna; Rams, Michał; Tomala, Krzysztof; Sieklucka, Barbara","Tuning of Magnetic Properties of Polynuclear Lanthanide(III)−Octacyanotungstate(V) Systems: Determination of Ligand-Field Parameters and Exchange Interaction","Inorganic Chemistry","2007","46","21","8924","8938","10.1021/ic700795q","","","0.7107","MoKα","","0.0477","0.0327","","","0.0764","0.0842","","","","","","1.031","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4333364","14.237","0.0002","23.417","0.0003","14.669","0.0002","90","","90.919","0.001","90","","4889.84","0.11","100","1","100","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H57 Eu N15 O11 W -","- C37 H42.116 Eu N15 O10.412 W -","- C148 H168.464 Eu4 N60 O41.648 W4 -","4","1","","Przychodzeń, Paweł; Pełka, Robert; Lewiński, Krzysztof; Supel, Justyna; Rams, Michał; Tomala, Krzysztof; Sieklucka, Barbara","Tuning of Magnetic Properties of Polynuclear Lanthanide(III)−Octacyanotungstate(V) Systems: Determination of Ligand-Field Parameters and Exchange Interaction","Inorganic Chemistry","2007","46","21","8924","8938","10.1021/ic700795q","","","0.7107","MoKα","","0.0401","0.0352","","","0.0817","0.0835","","","","","","1.2","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333365","14.482","0.0001","23.688","0.0003","14.713","0.0001","90","","91.191","0.001","90","","5046.2","0.08","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H57 Gd N15 O11 W -","- C37 H38 Gd N15 O11 W -","- C148 H152 Gd4 N60 O44 W4 -","4","1","","Przychodzeń, Paweł; Pełka, Robert; Lewiński, Krzysztof; Supel, Justyna; Rams, Michał; Tomala, Krzysztof; Sieklucka, Barbara","Tuning of Magnetic Properties of Polynuclear Lanthanide(III)−Octacyanotungstate(V) Systems: Determination of Ligand-Field Parameters and Exchange Interaction","Inorganic Chemistry","2007","46","21","8924","8938","10.1021/ic700795q","","","0.7107","MoKα","","0.0451","0.0319","","","0.0706","0.0771","","","","","","1.039","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333366","14.207","0.0002","23.434","0.0004","14.628","0.0002","90","","91.279","0.001","90","","4868.84","0.13","100","1","100","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H57 N15 O11 Tb W -","- C37 H42.648 N15 O10.336 Tb W -","- C148 H170.592 N60 O41.344 Tb4 W4 -","4","1","","Przychodzeń, Paweł; Pełka, Robert; Lewiński, Krzysztof; Supel, Justyna; Rams, Michał; Tomala, Krzysztof; Sieklucka, Barbara","Tuning of Magnetic Properties of Polynuclear Lanthanide(III)−Octacyanotungstate(V) Systems: Determination of Ligand-Field Parameters and Exchange Interaction","Inorganic Chemistry","2007","46","21","8924","8938","10.1021/ic700795q","","","0.7107","MoKα","","0.0468","0.0345","","","0.0725","0.077","","","","","","1.041","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333367","14.408","0.0002","23.71","0.0003","14.667","0.0002","90","","91.538","0.001","90","","5008.64","0.12","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H57 Dy N15 O11 W -","- C37 H39 Dy N15 O10.296 W -","- C148 H156 Dy4 N60 O41.184 W4 -","4","1","","Przychodzeń, Paweł; Pełka, Robert; Lewiński, Krzysztof; Supel, Justyna; Rams, Michał; Tomala, Krzysztof; Sieklucka, Barbara","Tuning of Magnetic Properties of Polynuclear Lanthanide(III)−Octacyanotungstate(V) Systems: Determination of Ligand-Field Parameters and Exchange Interaction","Inorganic Chemistry","2007","46","21","8924","8938","10.1021/ic700795q","","","0.7107","MoKα","","0.0337","0.0291","","","0.0659","0.0678","","","","","","1.076","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333368","9.711","0.0002","12.275","0.0003","15.639","0.0004","90","","94.782","0.001","90","","1857.72","0.08","100","1","100","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C29 H35 Ho N13 O7 W -","- C29 H35 Ho N13 O7 W -","- C58 H70 Ho2 N26 O14 W2 -","2","1","","Przychodzeń, Paweł; Pełka, Robert; Lewiński, Krzysztof; Supel, Justyna; Rams, Michał; Tomala, Krzysztof; Sieklucka, Barbara","Tuning of Magnetic Properties of Polynuclear Lanthanide(III)−Octacyanotungstate(V) Systems: Determination of Ligand-Field Parameters and Exchange Interaction","Inorganic Chemistry","2007","46","21","8924","8938","10.1021/ic700795q","","","0.7107","MoKα","","0.0271","0.0253","","","0.0561","0.057","","","","","","1.066","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333369","9.716","0.0002","12.248","0.0002","15.627","0.0002","90","","94.814","0.001","90","","1853.08","0.05","100","1","100","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C29 H35 Er N13 O7 W -","- C29 H35 Er N13 O7 W -","- C58 H70 Er2 N26 O14 W2 -","2","1","","Przychodzeń, Paweł; Pełka, Robert; Lewiński, Krzysztof; Supel, Justyna; Rams, Michał; Tomala, Krzysztof; Sieklucka, Barbara","Tuning of Magnetic Properties of Polynuclear Lanthanide(III)−Octacyanotungstate(V) Systems: Determination of Ligand-Field Parameters and Exchange Interaction","Inorganic Chemistry","2007","46","21","8924","8938","10.1021/ic700795q","","","0.7107","MoKα","","0.0224","0.0214","","","0.0478","0.0482","","","","","","1.064","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333370","9.718","0.0001","12.211","0.0002","15.636","0.0002","90","","94.763","0.001","90","","1849.06","0.04","100","1","100","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C29 H35 N13 O7 W Yb -","- C29 H33.383 N13 O7 W Yb -","- C58 H66.766 N26 O14 W2 Yb2 -","2","1","","Przychodzeń, Paweł; Pełka, Robert; Lewiński, Krzysztof; Supel, Justyna; Rams, Michał; Tomala, Krzysztof; Sieklucka, Barbara","Tuning of Magnetic Properties of Polynuclear Lanthanide(III)−Octacyanotungstate(V) Systems: Determination of Ligand-Field Parameters and Exchange Interaction","Inorganic Chemistry","2007","46","21","8924","8938","10.1021/ic700795q","","","0.7107","MoKα","","0.025","0.0243","","","0.0593","0.0597","","","","","","1.063","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333371","32.981","0.0002","20.236","0.0001","26.151","0.0002","90","","96.48","","90","","17341.8","0.19","100","1","100","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H46 N14 O10 Tm W -","- C32 H46 N14 O10 Tm W -","- C512 H736 N224 O160 Tm16 W16 -","16","2","","Przychodzeń, Paweł; Pełka, Robert; Lewiński, Krzysztof; Supel, Justyna; Rams, Michał; Tomala, Krzysztof; Sieklucka, Barbara","Tuning of Magnetic Properties of Polynuclear Lanthanide(III)−Octacyanotungstate(V) Systems: Determination of Ligand-Field Parameters and Exchange Interaction","Inorganic Chemistry","2007","46","21","8924","8938","10.1021/ic700795q","","","0.7107","MoKα","","0.0403","0.0287","","","0.0584","0.0621","","","","","","1.035","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4333372","10.8601","0.0013","11.1179","0.0013","16.4084","0.0018","85.038","0.003","81.826","0.003","63.096","0.002","1748.2","0.4","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C33 H36 B N7 O2 Ru S2 W -","- C33 H36 B N7 O2 Ru S2 W -","- C66 H72 B2 N14 O4 Ru2 S4 W2 -","2","1","","Seidel, Wolfram W.; Meel, Matthias J.; Radius, Udo; Schaffrath, Markus; Pape, Tania","On the Prospects of Polynuclear Complexes with Acetylenedithiolate Bridging Units","Inorganic Chemistry","2007","46","23","9616","9629","10.1021/ic7008286","","","0.71073","MoKα","","0.0767","0.0494","","","0.0928","0.1012","","","","","","0.962","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333373","11.2667","0.0017","13.802","0.002","14.509","0.002","98.51","0.003","99.285","0.003","108.812","0.003","2058.8","0.5","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C82 H94 B2 Mo2 N14 O2 Pd S4 -","- C82 H78 B2 Mo2 N14 O2 Pd S4 -","- C82 H78 B2 Mo2 N14 O2 Pd S4 -","1","0.5","","Seidel, Wolfram W.; Meel, Matthias J.; Radius, Udo; Schaffrath, Markus; Pape, Tania","On the Prospects of Polynuclear Complexes with Acetylenedithiolate Bridging Units","Inorganic Chemistry","2007","46","23","9616","9629","10.1021/ic7008286","","","0.71073","MoKα","","0.0644","0.0432","","","0.1007","0.1107","","","","","","1.018","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333374","28.938","0.0005","28.938","0.0005","8.2392","0.0002","90","","90","","90","","6899.6","0.2","100","2","100","2","","","","","","","","8","I -4","I -4","82","","","","- C27 H39 B K Mo N7 O2 S2 -","- C27 H39 B K Mo N7 O2 S2 -","- C216 H312 B8 K8 Mo8 N56 O16 S16 -","8","1","","Seidel, Wolfram W.; Meel, Matthias J.; Radius, Udo; Schaffrath, Markus; Pape, Tania","On the Prospects of Polynuclear Complexes with Acetylenedithiolate Bridging Units","Inorganic Chemistry","2007","46","23","9616","9629","10.1021/ic7008286","","","1.54178","CuKα","","0.0631","0.0499","","","0.1188","0.1223","","","","","","0.965","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333375","10.308","0.0004","18.2252","0.0007","38.2076","0.0014","90","","90","","90","","7177.9","0.5","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C34 H43 F10 N3 O2 Pd -","- C34 H38 F10 N3 O2 Pd -","- C272 H304 F80 N24 O16 Pd8 -","8","1","","Ruiz, José; Villa, María Dolores; Rodríguez, Venancio; Cutillas, Natalia; Vicente, Consuelo; López, Gregorio; Bautista, Delia","A Novel Metal-Binding Mode of Thymine Nucleobases: N(3) and O(4) Chelation†","Inorganic Chemistry","2007","46","14","5448","5449","10.1021/ic700843s","","","0.71073","MoKα","","0.1504","0.1241","","","0.3089","0.328","","","","","","1.068","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333376","10.1862","0.0005","17.8341","0.0009","38.0036","0.0019","90","","90","","90","","6903.8","0.6","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C34 H47 F6 N3 O2 Pd -","- C34 H47 F6 N3 O2 Pd -","- C272 H376 F48 N24 O16 Pd8 -","8","1","","Ruiz, José; Villa, María Dolores; Rodríguez, Venancio; Cutillas, Natalia; Vicente, Consuelo; López, Gregorio; Bautista, Delia","A Novel Metal-Binding Mode of Thymine Nucleobases: N(3) and O(4) Chelation†","Inorganic Chemistry","2007","46","14","5448","5449","10.1021/ic700843s","","","0.71073","MoKα","","0.0889","0.0752","","","0.1871","0.1954","","","","","","1.008","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333377","13.373","0.002","13.387","0.002","13.988","0.002","73.133","0.002","86.758","0.003","68.991","0.002","2234","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H58 Cl2 N4 O V -","- C51 H58 Cl2 N4 O V -","- C102 H116 Cl4 N8 O2 V2 -","2","1","","Bröring, Martin; Hell, Christian; Brégier, Frédérique; Burghaus, Olaf; Tejero, Esther Cónsul","New porphyrinoids: vanadyl(IV) complexes of meso-aryl-substituted corrphycene and 10-oxocorrole ligands.","Inorganic chemistry","2007","46","14","5477","5479","10.1021/ic700844p","","","0.71073","MoKα","","0.0694","0.0631","","","0.1713","0.1761","","","","","","1.081","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333378","11.295","0.002","14.043","0.002","14.495","0.002","88.934","0.002","68.563","0.002","71.998","0.002","2023.7","0.5","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C49 H54 N4 O2 V -","- C49 H54 N4 O2 V -","- C98 H108 N8 O4 V2 -","2","1","","Bröring, Martin; Hell, Christian; Brégier, Frédérique; Burghaus, Olaf; Tejero, Esther Cónsul","New porphyrinoids: vanadyl(IV) complexes of meso-aryl-substituted corrphycene and 10-oxocorrole ligands.","Inorganic chemistry","2007","46","14","5477","5479","10.1021/ic700844p","","","0.71073","MoKα","","0.0971","0.0607","","","0.153","0.1688","","","","","","0.939","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333379","11.258","0.0003","15.9262","0.0005","12.393","0.0004","90","","116.246","0.001","90","","1992.95","0.11","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Fe(TPP)(TMSO)2","","","- C52 H44 Fe N4 O2 S2 -","- C52 H44 Fe N4 O2 S2 -","- C104 H88 Fe2 N8 O4 S4 -","2","0.5","","Hu, Chuanjiang; Noll, Bruce C.; Scheidt, W. Robert","Sulfoxide as a Ligand in Iron(II) Porphyrinates: S- or O-Bound?","Inorganic Chemistry","2007","46","20","8258","8263","10.1021/ic7008495","","","0.71073","MoKα","","0.0293","0.0275","","","0.0783","0.0799","","","","","","1.012","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333380","22.1182","0.0009","19.1114","0.0009","10.0921","0.0003","90","","95.184","0.005","90","","4248.6","0.3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C42 H60 Cr O6 -","- C42 H60 Cr O6 -","- C168 H240 Cr4 O24 -","4","0.5","","Kapre, Ruta R.; Bothe, Eberhard; Weyhermüller, Thomas; DeBeer George, Serena; Muresan, Nicoleta; Wieghardt, Karl","Electronic Structures of Tris(dioxolene)chromium and Tris(dithiolene)chromium Complexes of the Electron-Transfer Series [Cr(dioxolene)3]zand [Cr(dithiolene)3]z(z= 0, 1−, 2−, 3−). A Combined Experimental and Density Functional Theoretical Study","Inorganic Chemistry","2007","46","19","7827","7839","10.1021/ic7008607","","","0.71073","MoKα","","0.1112","0.0578","","","0.102","0.1252","","","","","","1.058","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333381","14.4072","0.0008","21.579","0.002","20.1333","0.0012","90","","90.703","0.005","90","","6258.8","0.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C58 H96 Cr N S6 -","- C58 H96 Cr N S6 -","- C232 H384 Cr4 N4 S24 -","4","1","","Kapre, Ruta R.; Bothe, Eberhard; Weyhermüller, Thomas; DeBeer George, Serena; Muresan, Nicoleta; Wieghardt, Karl","Electronic Structures of Tris(dioxolene)chromium and Tris(dithiolene)chromium Complexes of the Electron-Transfer Series [Cr(dioxolene)3]zand [Cr(dithiolene)3]z(z= 0, 1−, 2−, 3−). A Combined Experimental and Density Functional Theoretical Study","Inorganic Chemistry","2007","46","19","7827","7839","10.1021/ic7008607","","","0.71073","MoKα","","0.1212","0.0685","","","0.1358","0.1605","","","","","","1.059","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333382","6.1929","0.0018","7.225","0.002","7.999","0.002","92.453","0.004","102.094","0.004","108.916","0.004","328.68","0.16","293","2","293","2","","","","","","","","7","P -1","-P 1","2","Uranium Phosphite","","","- C H6 F3 N O3 P U -","- C H6 F3 N O3 P U -","- C2 H12 F6 N2 O6 P2 U2 -","2","1","","Mandal, Sukhendu; Chandra, Manabendra; Natarajan, Srinivasan","Synthesis, Structure, and Upconversion Studies on Organically Templated Uranium Phosphites","Inorganic Chemistry","2007","46","19","7935","7943","10.1021/ic700866f","","","0.71073","MoKα","","0.0322","0.0318","","","0.0821","0.0824","","","","","","1.084","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333383","7.338","0.002","10.669","0.003","9.383","0.003","90","","102.581","0.004","90","","716.9","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Uranium Phosphite","","","- C2 H7 F3 N O3 P U -","- C2 H7 F3 N O3 P U -","- C8 H28 F12 N4 O12 P4 U4 -","4","1","","Mandal, Sukhendu; Chandra, Manabendra; Natarajan, Srinivasan","Synthesis, Structure, and Upconversion Studies on Organically Templated Uranium Phosphites","Inorganic Chemistry","2007","46","19","7935","7943","10.1021/ic700866f","","","0.71073","MoKα","","0.0407","0.0376","","","0.0983","0.1013","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333384","6.725","0.002","6.901","0.002","9.272","0.003","103.186","0.004","111.028","0.004","97.386","0.004","380.4","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","Uranium Phosphite","","","- C2 H7 F N O5 P U -","- C2 H7 F N O5 P U -","- C4 H14 F2 N2 O10 P2 U2 -","2","1","","Mandal, Sukhendu; Chandra, Manabendra; Natarajan, Srinivasan","Synthesis, Structure, and Upconversion Studies on Organically Templated Uranium Phosphites","Inorganic Chemistry","2007","46","19","7935","7943","10.1021/ic700866f","","","0.71073","MoKα","","0.0356","0.0349","","","0.0976","0.0981","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333385","7.6282","0.0001","12.5037","0.0001","8.6307","0.0001","90","","98.02","0.001","90","","815.151","0.016","95","","95","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 Co N2 O10 S2 -","- C10 H16 Co N2 O10 S2 -","- C20 H32 Co2 N4 O20 S4 -","2","0.5","","Legrand, Yves-Marie; van der Lee, Arie; Masquelez, Nathalie; Rabu, Pierre; Barboiu, Mihail","Temperature induced single-crystal-to-single-crystal transformations and structure directed effects on magnetic properties.","Inorganic chemistry","2007","46","22","9083","9089","10.1021/ic700867b","","","0.71073","MoKα","","0.0278","0.0202","","0.0237","0.0223","0.0223","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333386","7.6095","0.0001","12.5603","0.0001","8.6699","0.0001","90","","97.893","0.001","90","","820.798","0.016","175","","175","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 Co N2 O10 S2 -","- C10 H16 Co N2 O10 S2 -","- C20 H32 Co2 N4 O20 S4 -","2","0.5","","Legrand, Yves-Marie; van der Lee, Arie; Masquelez, Nathalie; Rabu, Pierre; Barboiu, Mihail","Temperature induced single-crystal-to-single-crystal transformations and structure directed effects on magnetic properties.","Inorganic chemistry","2007","46","22","9083","9089","10.1021/ic700867b","","","0.71073","MoKα","","0.0294","0.0221","","0.0249","0.0239","0.0239","","","","","","1.0934","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333387","7.581","0.0001","12.6627","0.0002","8.7203","0.0001","90","","97.456","0.002","90","","830.04","0.02","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 Co N2 O10 S2 -","- C10 H16 Co N2 O10 S2 -","- C20 H32 Co2 N4 O20 S4 -","2","0.5","","Legrand, Yves-Marie; van der Lee, Arie; Masquelez, Nathalie; Rabu, Pierre; Barboiu, Mihail","Temperature induced single-crystal-to-single-crystal transformations and structure directed effects on magnetic properties.","Inorganic chemistry","2007","46","22","9083","9089","10.1021/ic700867b","","","0.71073","MoKα","","0.0407","0.0247","","0.0314","0.0293","0.0293","","","","","","1.0996","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333388","7.50596","0.0001","12.56344","0.00015","8.6664","0.00011","90","","97.9756","0.0013","90","","809.342","0.018","95","","95","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 N2 Ni O10 S2 -","- C10 H16 N2 Ni O10 S2 -","- C20 H32 N4 Ni2 O20 S4 -","2","0.5","","Legrand, Yves-Marie; van der Lee, Arie; Masquelez, Nathalie; Rabu, Pierre; Barboiu, Mihail","Temperature induced single-crystal-to-single-crystal transformations and structure directed effects on magnetic properties.","Inorganic chemistry","2007","46","22","9083","9089","10.1021/ic700867b","","","0.71073","MoKα","","0.0304","0.0231","","0.0263","0.0254","0.0254","","","","","","1.0931","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333389","7.4831","0.00016","12.6173","0.0003","8.71068","0.00018","90","","97.752","0.002","90","","814.92","0.03","175","","175","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 N2 Ni O10 S2 -","- C10 H16 N2 Ni O10 S2 -","- C20 H32 N4 Ni2 O20 S4 -","2","0.5","","Legrand, Yves-Marie; van der Lee, Arie; Masquelez, Nathalie; Rabu, Pierre; Barboiu, Mihail","Temperature induced single-crystal-to-single-crystal transformations and structure directed effects on magnetic properties.","Inorganic chemistry","2007","46","22","9083","9089","10.1021/ic700867b","","","0.71073","MoKα","","0.0618","0.0277","","0.0345","0.0297","0.0297","","","","","","1.0812","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333390","7.5035","0.0001","12.6593","0.0002","8.7351","0.0002","90","","97.352","0.002","90","","822.92","0.03","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 N2 Ni O10 S2 -","- C10 H16 N2 Ni O10 S2 -","- C20 H32 N4 Ni2 O20 S4 -","2","0.5","","Legrand, Yves-Marie; van der Lee, Arie; Masquelez, Nathalie; Rabu, Pierre; Barboiu, Mihail","Temperature induced single-crystal-to-single-crystal transformations and structure directed effects on magnetic properties.","Inorganic chemistry","2007","46","22","9083","9089","10.1021/ic700867b","","","0.71073","MoKα","","0.06","0.0249","","0.0195","0.0165","0.0165","","","","","","1.0757","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333391","9.0036","0.0002","8.8584","0.00015","9.5756","0.0002","90","","114.931","0.003","90","","692.56","0.03","95","","95","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H12 Cu N2 O8 S2 -","- C10 H12 Cu N2 O8 S2 -","- C20 H24 Cu2 N4 O16 S4 -","2","0.5","","Legrand, Yves-Marie; van der Lee, Arie; Masquelez, Nathalie; Rabu, Pierre; Barboiu, Mihail","Temperature induced single-crystal-to-single-crystal transformations and structure directed effects on magnetic properties.","Inorganic chemistry","2007","46","22","9083","9089","10.1021/ic700867b","","","0.71073","MoKα","","0.0238","0.0201","","0.0207","0.0203","0.0203","","","","","","1.0845","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333392","9.0249","0.0004","8.9181","0.0003","9.5654","0.0005","90","","115.017","0.006","90","","697.64","0.06","175","","175","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H12 Cu N2 O8 S2 -","- C10 H12 Cu N2 O8 S2 -","- C20 H24 Cu2 N4 O16 S4 -","2","0.5","","Legrand, Yves-Marie; van der Lee, Arie; Masquelez, Nathalie; Rabu, Pierre; Barboiu, Mihail","Temperature induced single-crystal-to-single-crystal transformations and structure directed effects on magnetic properties.","Inorganic chemistry","2007","46","22","9083","9089","10.1021/ic700867b","","","0.71073","MoKα","","0.0335","0.0241","","0.0303","0.0284","0.0284","","","","","","1.0616","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333393","9.0443","0.0015","9.0093","0.0011","9.5518","0.0015","90","","115.093","0.011","90","","704.85","0.19","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H12 Cu N2 O8 S2 -","- C10 H12 Cu N2 O8 S2 -","- C20 H24 Cu2 N4 O16 S4 -","2","0.5","","Legrand, Yves-Marie; van der Lee, Arie; Masquelez, Nathalie; Rabu, Pierre; Barboiu, Mihail","Temperature induced single-crystal-to-single-crystal transformations and structure directed effects on magnetic properties.","Inorganic chemistry","2007","46","22","9083","9089","10.1021/ic700867b","","","0.71073","MoKα","","0.0314","0.0247","","0.0242","0.0236","0.0236","","","","","","1.0394","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333394","5.3385","0.0005","8.4547","0.0008","9.1418","0.0008","89.654","0.001","89.672","0.001","77.045","0.001","402.1","0.06","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","tetrakis(mu2-trifluoroacetateo-O,O')-molybdenium(II)-rhodium(II)","","- C8 F12 Mo O8 Rh -","- C8 F11.94 Mo0.98 O8 Rh1.02 -","- C8 F11.94 Mo0.98 O8 Rh1.02 -","1","0.5","","Li, Bo; Zhang, Haitao; Huynh, Lan; Shatruk, Mikhael; Dikarev, Evgeny V.","Mo/Rh Carboxylate: Heterometallic Compound Built of Homometallic Paddlewheel Units","Inorganic Chemistry","2007","46","22","9155","9159","10.1021/ic7009012","","","0.71073","MoKα","","0.0305","0.0301","","","0.0766","0.0769","","","","","","1.081","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333395","5.4305","0.0004","8.3276","0.0006","8.9954","0.0007","88.565","0.001","87.239","0.001","80.179","0.001","400.31","0.05","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","tetrakis(mu2-trifluoroacetateo-O,O')-molybdenium(II)-rhodium(II)","","- C8 F12 Mo1.4 O8 Rh0.6 -","- C8 F12 Mo1.404 O8 Rh0.596 -","- C8 F12 Mo1.404 O8 Rh0.596 -","1","0.5","","Li, Bo; Zhang, Haitao; Huynh, Lan; Shatruk, Mikhael; Dikarev, Evgeny V.","Mo/Rh Carboxylate: Heterometallic Compound Built of Homometallic Paddlewheel Units","Inorganic Chemistry","2007","46","22","9155","9159","10.1021/ic7009012","","","0.71073","MoKα","","0.0218","0.0209","","","0.0532","0.0538","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333396","8.622","0.0009","9.2046","0.0009","9.3268","0.001","64.197","0.001","77.887","0.002","77.401","0.002","644.76","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","tetrakis(mu2-trifluoroacetateo-O,O')-bis(tetrahydrofuran) -molybdenium(II)-rhodium(II)","","- C16 H16 F12 Mo O10 Rh -","- C16 H16 F11.88 Mo1.04 O10 Rh0.96 -","- C16 H16 F11.88 Mo1.04 O10 Rh0.96 -","1","0.5","","Li, Bo; Zhang, Haitao; Huynh, Lan; Shatruk, Mikhael; Dikarev, Evgeny V.","Mo/Rh Carboxylate: Heterometallic Compound Built of Homometallic Paddlewheel Units","Inorganic Chemistry","2007","46","22","9155","9159","10.1021/ic7009012","","","0.71073","MoKα","","0.0617","0.0448","","","0.1039","0.1126","","","","","","1.025","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333397","5.5662","0.0008","8.2207","0.0012","8.9579","0.0013","87.515","0.002","85.862","0.002","80.617","0.002","403.15","0.1","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","tetrakis(mu2-trifluoroacetateo-O,O')-di-molybdenium(II)","","- C8 F12 Mo2 O8 -","- C8 F12 Mo2 O8 -","- C8 F12 Mo2 O8 -","1","0.5","","Li, Bo; Zhang, Haitao; Huynh, Lan; Shatruk, Mikhael; Dikarev, Evgeny V.","Mo/Rh Carboxylate: Heterometallic Compound Built of Homometallic Paddlewheel Units","Inorganic Chemistry","2007","46","22","9155","9159","10.1021/ic7009012","","","0.71073","MoKα","","0.0222","0.022","","","0.0574","0.0576","","","","","","1.05","","","","has coordinates","179436","2020-10-21","18:00:00",""
"4333398","8.7817","0.0007","9.0928","0.0007","9.4597","0.0007","62.735","0.001","78.275","0.001","77.451","0.001","650.7","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","tetrakis(mu2-trifluoroacetateo-O,O')-bis((tetrahydrofuran)-molybdenium(II))","","- C16 H16 F12 Mo2 O10 -","- C16 H16 F11.88 Mo2 O10 -","- C16 H16 F11.88 Mo2 O10 -","1","0.5","","Li, Bo; Zhang, Haitao; Huynh, Lan; Shatruk, Mikhael; Dikarev, Evgeny V.","Mo/Rh Carboxylate: Heterometallic Compound Built of Homometallic Paddlewheel Units","Inorganic Chemistry","2007","46","22","9155","9159","10.1021/ic7009012","","","0.71073","MoKα","","0.038","0.0373","","","0.0984","0.0994","","","","","","1.047","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333399","8.5503","0.0008","9.1936","0.0009","9.4802","0.0009","63.59","0.001","77.035","0.001","76.583","0.001","642.92","0.11","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","tetrakis(mu2-trifluoroacetateo-O,O')-bis((tetrahydrofuran)-rhodium(II))","","- C16 H16 F12 O10 Rh2 -","- C16 H16 F11.88 O10 Rh2 -","- C16 H16 F11.88 O10 Rh2 -","1","0.5","","Li, Bo; Zhang, Haitao; Huynh, Lan; Shatruk, Mikhael; Dikarev, Evgeny V.","Mo/Rh Carboxylate: Heterometallic Compound Built of Homometallic Paddlewheel Units","Inorganic Chemistry","2007","46","22","9155","9159","10.1021/ic7009012","","","0.71073","MoKα","","0.0597","0.0467","","","0.1165","0.1244","","","","","","1.014","","","","has coordinates,has disorder","179436","2020-10-21","18:00:00",""
"4333400","13.0529","0.0015","18.3403","0.0017","10.3838","0.0012","90","","90","","90","","2485.8","0.5","295","","295","","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- B16 Cs8 H24 O112 P24 Sc8 -","- B2 Cs H3 O14 P3 Sc -","- B16 Cs8 H24 O112 P24 Sc8 -","8","1","","Menezes, Prashanth W.; Hoffmann, Stefan; Prots, Yurii; Kniep, Rüdiger","CsSc[B2P3O11(OH)3]: A New Borophosphate Oligomer Containing Boron in Three- and Fourfold Coordination†","Inorganic Chemistry","2007","46","18","7503","7508","10.1021/ic700914v","","","0.71073","MoKα","","","0.0444","","","","0.1211","","","","","","1.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333401","20.047","0.004","11.296","0.002","16.169","0.003","90","","90","","90","","3661.5","1.2","243","2","243","2","","","","","","","","5","P n a 21","P 2c -2n","33","","bis(4-(3,3-dimethylbutanoyl-3-methyl-1-phenyl)pyrazolon- 5-ato-O,O')-diethoxy-titanium(iv)","","- C36 H48 N4 O6 Ti -","- C36 H48 N4 O6 Ti -","- C144 H192 N16 O24 Ti4 -","4","1","","Caruso, Francesco; Pettinari, Claudio; Marchetti, Fabio; Natanti, Paolo; Phillips, Christine; Tanski, Joseph; Rossi, Miriam","Synthesis, molecular structure (X-ray and DFT), and solution behavior of titanium 4-Acyl-5-pyrazolonates. Correlations with related antitumor beta-diketonato derivatives.","Inorganic chemistry","2007","46","18","7553","7560","10.1021/ic700935x","","","0.71073","MoKα","","0.0977","0.0441","","","0.0904","0.1042","","","","","","1.002","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333402","25.298","0.003","13.1985","0.0014","22.0359","0.0019","90","","108.744","0.002","90","","6967.5","1.3","243","2","243","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","di-mu-Oxo-bis(4-(3,3-dimethylbutanoyl-3-methyl-1-phenyl)pyrazolon- 5-ato-O,O')-ethoxy-titanium(iv)","","- C68 H86 N8 O11 Ti2 -","- C68 H86 N8 O11 Ti2 -","- C272 H344 N32 O44 Ti8 -","4","0.5","","Caruso, Francesco; Pettinari, Claudio; Marchetti, Fabio; Natanti, Paolo; Phillips, Christine; Tanski, Joseph; Rossi, Miriam","Synthesis, molecular structure (X-ray and DFT), and solution behavior of titanium 4-Acyl-5-pyrazolonates. Correlations with related antitumor beta-diketonato derivatives.","Inorganic chemistry","2007","46","18","7553","7560","10.1021/ic700935x","","","0.71073","MoKα","","0.1461","0.0641","","","0.1597","0.1911","","","","","","1.014","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333403","7.9426","0.0004","19.9895","0.0009","10.0796","0.0005","90","","90.575","0.002","90","","1600.24","0.13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","lithium uranyl molybdate","","","- Li4 Mo2 O38 U10 -","- Li4 Mo2 O38 U10 -","- Li8 Mo4 O76 U20 -","2","0.5","","Alekseev, Evgeny V.; Krivovichev, Sergey V.; Malcherek, Thomas; Depmeier, Wulf","One-Dimensional Array of Two- and Three-Center Cation−Cation Bonds in the Structure of Li4[(UO2)10O10(Mo2O8)]","Inorganic Chemistry","2007","46","21","8442","8444","10.1021/ic7009385","","","0.71073","MoKα","","0.0494","0.0429","","","0.1166","0.121","","","","","","0.936","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333404","10.686","0.002","13.399","0.003","14.177","0.003","84.473","0.003","68.2","0.003","73.74","0.003","1809.3","0.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H39 Cu2 I2 N3 S3 -","- C31 H39 Cu2 I2 N3 S3 -","- C62 H78 Cu4 I4 N6 S6 -","2","1","","Huerta, Raúl; Flores-Figueroa, Aarón; Ugalde-Saldívar, Víctor M.; Castillo, Ivan","Electrochemical Behavior of an Aminotrithioether Ligand: Copper(II)-Mediated Oxidative C−C Bond Formation","Inorganic Chemistry","2007","46","23","9510","9512","10.1021/ic7009429","","","0.71073","MoKα","","0.0245","0.0221","","","0.0553","0.0566","","","","","","1.026","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333405","8.887","0.003","14.107","0.004","16.121","0.005","90","","98.751","0.005","90","","1997.5","1.1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3-(2,4-Dimethyl-phenylsulfanylmethyl)-6,8-dimethyl-2H-benzo[e][1,3] thiazin-3-ium perchlorate","","- C19 H22 Cl N O4 S2 -","- C19 H22 Cl N O4.004 S2 -","- C76 H88 Cl4 N4 O16.016 S8 -","4","1","","Huerta, Raúl; Flores-Figueroa, Aarón; Ugalde-Saldívar, Víctor M.; Castillo, Ivan","Electrochemical Behavior of an Aminotrithioether Ligand: Copper(II)-Mediated Oxidative C−C Bond Formation","Inorganic Chemistry","2007","46","23","9510","9512","10.1021/ic7009429","","","0.71073","MoKα","","0.1273","0.0605","","","0.0958","0.1119","","","","","","0.858","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333406","12.991","0.003","12.2","0.002","25.812","0.005","90","","101.63","0.03","90","","4007","1.4","173","2","173","2","","","","","","","","8","C 1 c 1","C -2yc","9","","","","- C36.5 H28 Cl Co Cr Mn N6 O14.5 -","- C36.5 H22 Cl Co Cr Mn N6 O14.5 -","- C146 H88 Cl4 Co4 Cr4 Mn4 N24 O58 -","4","1","","Kou, Hui-Zhong; Sato, Osamu","New Oxalate-Bridged CrIII−MnIIPolymeric Network Incorporating a Spin-Crossover [Co(terpy)2]2+Cation","Inorganic Chemistry","2007","46","23","9513","9515","10.1021/ic701043f","","","0.71073","MoKα","","0.1104","0.0695","","","0.1045","0.1131","","","","","","1.045","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333407","14.693","0.003","17.947","0.004","20.005","0.005","90","","98.2571","0.0013","90","","5221","2","113","2","113","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C42.5 H38 Co Cr2 Mn2 N6 O31.5 -","- C42.5 H22 Co Cr2 Mn2 N6 O31.5 -","- C170 H88 Co4 Cr8 Mn8 N24 O126 -","4","1","","Kou, Hui-Zhong; Sato, Osamu","New Oxalate-Bridged CrIII−MnIIPolymeric Network Incorporating a Spin-Crossover [Co(terpy)2]2+Cation","Inorganic Chemistry","2007","46","23","9513","9515","10.1021/ic701043f","","","0.71073","MoKα","","0.1293","0.1125","","","0.2189","0.2286","","","","","","1.084","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333408","16.275","0.002","16.275","0.002","19.222","0.004","90","","90","","120","","4409.3","1.2","120","2","120","2","","","","","","","","6","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C23 H43 Cl N P2 Rh -","- C23 H43 Cl N P2 Rh -","- C138 H258 Cl6 N6 P12 Rh6 -","6","0.5","","Feller, Moran; Ben-Ari, Eyal; Gupta, Tarkeshwar; Shimon, Linda J. W.; Leitus, Gregory; Diskin-Posner, Yael; Weiner, Lev; Milstein, David","Mononuclear Rh(II) PNP-type complexes. Structure and reactivity.","Inorganic chemistry","2007","46","25","10479","10490","10.1021/ic701044b","","","0.71073","MoKα","","0.0347","0.0288","","","0.0725","0.0761","","","","","","1.006","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333409","14.643","0.003","12.744","0.003","15.667","0.003","90","","105.67","0.03","90","","2815","1.1","120","2","120","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C23 H43 B Cl F4 N P2 Rh -","- C23 H43 B Cl F4 N P2 Rh -","- C92 H172 B4 Cl4 F16 N4 P8 Rh4 -","4","1","","Feller, Moran; Ben-Ari, Eyal; Gupta, Tarkeshwar; Shimon, Linda J. W.; Leitus, Gregory; Diskin-Posner, Yael; Weiner, Lev; Milstein, David","Mononuclear Rh(II) PNP-type complexes. Structure and reactivity.","Inorganic chemistry","2007","46","25","10479","10490","10.1021/ic701044b","","","0.71073","MoKα","","0.0843","0.0493","","","0.1113","0.1237","","","","","","1.006","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333410","29.248","0.006","14.051","0.003","19.768","0.004","90","","125.59","0.03","90","","6606","3","120","2","120","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C26 H49 B2 F8 N O P2 Rh -","- C26 H49 B2 F8 N O P2 Rh -","- C208 H392 B16 F64 N8 O8 P16 Rh8 -","8","1","","Feller, Moran; Ben-Ari, Eyal; Gupta, Tarkeshwar; Shimon, Linda J. W.; Leitus, Gregory; Diskin-Posner, Yael; Weiner, Lev; Milstein, David","Mononuclear Rh(II) PNP-type complexes. Structure and reactivity.","Inorganic chemistry","2007","46","25","10479","10490","10.1021/ic701044b","","","0.71073","MoKα","","0.0706","0.0462","","","0.1189","0.128","","","","","","0.986","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333411","12.526","0.003","7.893","0.0016","28.603","0.006","90","","93.36","0.03","90","","2823.1","1.1","120","2","120","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C23 H43 B Cl F4 N2 O P2 Rh -","- C23 H43 B Cl F4 N2 O P2 Rh -","- C92 H172 B4 Cl4 F16 N8 O4 P8 Rh4 -","4","1","","Feller, Moran; Ben-Ari, Eyal; Gupta, Tarkeshwar; Shimon, Linda J. W.; Leitus, Gregory; Diskin-Posner, Yael; Weiner, Lev; Milstein, David","Mononuclear Rh(II) PNP-type complexes. Structure and reactivity.","Inorganic chemistry","2007","46","25","10479","10490","10.1021/ic701044b","","","0.71073","MoKα","","0.0571","0.0401","","","0.0989","0.1062","","","","","","1.017","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333412","18.5015","0.0003","10.99","0.0004","15.218","0.0007","90","","111.949","0.002","90","","2870.01","0.18","120","2","120","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C23 H44 B Cl F4 N P2 Rh -","- C23 H44 B Cl F4 N P2 Rh -","- C92 H176 B4 Cl4 F16 N4 P8 Rh4 -","4","1","","Feller, Moran; Ben-Ari, Eyal; Gupta, Tarkeshwar; Shimon, Linda J. W.; Leitus, Gregory; Diskin-Posner, Yael; Weiner, Lev; Milstein, David","Mononuclear Rh(II) PNP-type complexes. Structure and reactivity.","Inorganic chemistry","2007","46","25","10479","10490","10.1021/ic701044b","","","0.71073","MoKα","","0.0559","0.0342","","","0.0733","0.0792","","","","","","1.019","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333413","8.099","0.0002","12.387","0.0002","15.564","0.0003","107.84","0.001","102.825","0.001","91.456","0.001","1441.9","0.05","290","2","290","2","","","","","","","","8","P -1","-P 1","2","","","","- C48 H86 B2 F8 N2 O2 P4 Rh2 -","- C48 H86 B2 F8 N2 O2 P4 Rh2 -","- C48 H86 B2 F8 N2 O2 P4 Rh2 -","1","0.5","","Feller, Moran; Ben-Ari, Eyal; Gupta, Tarkeshwar; Shimon, Linda J. W.; Leitus, Gregory; Diskin-Posner, Yael; Weiner, Lev; Milstein, David","Mononuclear Rh(II) PNP-type complexes. Structure and reactivity.","Inorganic chemistry","2007","46","25","10479","10490","10.1021/ic701044b","","","0.71073","MoKα","","0.0653","0.0582","","","0.1668","0.1734","","","","","","1.069","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333414","13.835","0.002","13.835","0.002","21.163","0.004","90","","90","","120","","3508.1","1","100","2","100","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C36 H30 Cl Fe N12 Ni2 O10 -","- C36 H30 Cl1.02 Fe N12 Ni2 O10.08 -","- C108 H90 Cl3.06 Fe3 N36 Ni6 O30.24 -","3","0.166667","","Chaudhuri, Phalguni; Weyhermüller, Thomas; Wagner, Rita; Khanra, Sumit; Biswas, Biplab; Bothe, Eberhard; Bill, Eckhard","Tridentate Facial Ligation of Tris(pyridine-2-aldoximato)nickel(II) and Tris(imidazole-2-aldoximato)nickel(II) To Generate NiIIFeIIINiII, MnIIINiII, NiIINiII, and ZnIINiIIand the Electrooxidized MnIVNiII, NiIINiIII, and ZnIINiIIISpecies: A Magnetostructural, Electrochemical, and EPR Spectroscopic Study","Inorganic Chemistry","2007","46","21","9003","9016","10.1021/ic701073j","","","0.71073","MoKα","","0.092","0.0626","","","0.1785","0.2041","","","","","","1.122","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333415","19.9574","0.0007","24.6226","0.0009","14.9959","0.0006","90","","90.73","0.01","90","","7368.4","0.5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C29 H39 Cl2 Mn N10 Ni O11 -","- C29 H39 Cl2 Mn N10 Ni O11 -","- C232 H312 Cl16 Mn8 N80 Ni8 O88 -","8","1","","Chaudhuri, Phalguni; Weyhermüller, Thomas; Wagner, Rita; Khanra, Sumit; Biswas, Biplab; Bothe, Eberhard; Bill, Eckhard","Tridentate Facial Ligation of Tris(pyridine-2-aldoximato)nickel(II) and Tris(imidazole-2-aldoximato)nickel(II) To Generate NiIIFeIIINiII, MnIIINiII, NiIINiII, and ZnIINiIIand the Electrooxidized MnIVNiII, NiIINiIII, and ZnIINiIIISpecies: A Magnetostructural, Electrochemical, and EPR Spectroscopic Study","Inorganic Chemistry","2007","46","21","9003","9016","10.1021/ic701073j","","","0.71073","MoKα","","0.086","0.05","","","0.0983","0.113","","","","","","1.025","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333416","9.2784","0.0003","16.5598","0.0009","11.3633","0.0006","90","","112.61","0.01","90","","1611.76","0.18","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C27 H38 Cl N9 Ni2 O8 -","- C27 H38 Cl N9 Ni2 O8 -","- C54 H76 Cl2 N18 Ni4 O16 -","2","1","","Chaudhuri, Phalguni; Weyhermüller, Thomas; Wagner, Rita; Khanra, Sumit; Biswas, Biplab; Bothe, Eberhard; Bill, Eckhard","Tridentate Facial Ligation of Tris(pyridine-2-aldoximato)nickel(II) and Tris(imidazole-2-aldoximato)nickel(II) To Generate NiIIFeIIINiII, MnIIINiII, NiIINiII, and ZnIINiIIand the Electrooxidized MnIVNiII, NiIINiIII, and ZnIINiIIISpecies: A Magnetostructural, Electrochemical, and EPR Spectroscopic Study","Inorganic Chemistry","2007","46","21","9003","9016","10.1021/ic701073j","","","0.71073","MoKα","","0.0673","0.0484","","","0.0761","0.082","","","","","","1.053","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333417","11.6289","0.0004","13.823","0.0005","13.8607","0.0005","119.548","0.003","101.498","0.003","102.176","0.003","1770.03","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C30.5 H44 Cl N9 Ni2 O7.5 -","- C30.5 H44 Cl N9 Ni2 O7.5 -","- C61 H88 Cl2 N18 Ni4 O15 -","2","1","","Chaudhuri, Phalguni; Weyhermüller, Thomas; Wagner, Rita; Khanra, Sumit; Biswas, Biplab; Bothe, Eberhard; Bill, Eckhard","Tridentate Facial Ligation of Tris(pyridine-2-aldoximato)nickel(II) and Tris(imidazole-2-aldoximato)nickel(II) To Generate NiIIFeIIINiII, MnIIINiII, NiIINiII, and ZnIINiIIand the Electrooxidized MnIVNiII, NiIINiIII, and ZnIINiIIISpecies: A Magnetostructural, Electrochemical, and EPR Spectroscopic Study","Inorganic Chemistry","2007","46","21","9003","9016","10.1021/ic701073j","","","0.71073","MoKα","","0.0314","0.0289","","0.0722","0.0708","","","","1.044","1.061","1.061","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333418","20.9553","0.0003","20.9553","0.0003","20.9553","0.0003","90","","90","","90","","9202","0.2","100","2","100","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","","","- C45 H48 Cl N9 Ni2 O7 -","- C45 H48 Cl N9 Ni2 O7 -","- C360 H384 Cl8 N72 Ni16 O56 -","8","0.333333","","Chaudhuri, Phalguni; Weyhermüller, Thomas; Wagner, Rita; Khanra, Sumit; Biswas, Biplab; Bothe, Eberhard; Bill, Eckhard","Tridentate Facial Ligation of Tris(pyridine-2-aldoximato)nickel(II) and Tris(imidazole-2-aldoximato)nickel(II) To Generate NiIIFeIIINiII, MnIIINiII, NiIINiII, and ZnIINiIIand the Electrooxidized MnIVNiII, NiIINiIII, and ZnIINiIIISpecies: A Magnetostructural, Electrochemical, and EPR Spectroscopic Study","Inorganic Chemistry","2007","46","21","9003","9016","10.1021/ic701073j","","","0.71073","MoKα","","0.0521","0.0464","","","0.1186","0.1218","","","","","","1.166","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333419","17.8083","0.0004","15.7015","0.0004","24.5793","0.0006","90","","104.911","0.004","90","","6641.4","0.3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H42 Cl N12 Ni2 O8.5 -","- C24 H42 Cl N12 Ni2 O8.5 -","- C192 H336 Cl8 N96 Ni16 O68 -","8","1","","Chaudhuri, Phalguni; Weyhermüller, Thomas; Wagner, Rita; Khanra, Sumit; Biswas, Biplab; Bothe, Eberhard; Bill, Eckhard","Tridentate Facial Ligation of Tris(pyridine-2-aldoximato)nickel(II) and Tris(imidazole-2-aldoximato)nickel(II) To Generate NiIIFeIIINiII, MnIIINiII, NiIINiII, and ZnIINiIIand the Electrooxidized MnIVNiII, NiIINiIII, and ZnIINiIIISpecies: A Magnetostructural, Electrochemical, and EPR Spectroscopic Study","Inorganic Chemistry","2007","46","21","9003","9016","10.1021/ic701073j","","","0.71073","MoKα","","0.0468","0.0414","","","0.0991","0.1018","","","","","","1.112","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333420","9.3049","0.0003","16.6595","0.0006","11.3975","0.0004","90","","112.472","0.005","90","","1632.63","0.11","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C27 H38 Cl N9 Ni O8 Zn -","- C27 H38 Cl N9 Ni O8 Zn -","- C54 H76 Cl2 N18 Ni2 O16 Zn2 -","2","1","","Chaudhuri, Phalguni; Weyhermüller, Thomas; Wagner, Rita; Khanra, Sumit; Biswas, Biplab; Bothe, Eberhard; Bill, Eckhard","Tridentate Facial Ligation of Tris(pyridine-2-aldoximato)nickel(II) and Tris(imidazole-2-aldoximato)nickel(II) To Generate NiIIFeIIINiII, MnIIINiII, NiIINiII, and ZnIINiIIand the Electrooxidized MnIVNiII, NiIINiIII, and ZnIINiIIISpecies: A Magnetostructural, Electrochemical, and EPR Spectroscopic Study","Inorganic Chemistry","2007","46","21","9003","9016","10.1021/ic701073j","","","0.71073","MoKα","","0.0287","0.0254","","","0.0567","0.0581","","","","","","1.022","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333421","11.982","0.0004","11.982","0.0004","47.0659","0.0013","90","","90","","120","","5851.9","0.3","100","2","100","2","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","","","- C30 H54 Cl N9 O13 Zn2 -","- C30 H54 Cl N9 O13 Zn2 -","- C180 H324 Cl6 N54 O78 Zn12 -","6","0.333333","","Chaudhuri, Phalguni; Weyhermüller, Thomas; Wagner, Rita; Khanra, Sumit; Biswas, Biplab; Bothe, Eberhard; Bill, Eckhard","Tridentate Facial Ligation of Tris(pyridine-2-aldoximato)nickel(II) and Tris(imidazole-2-aldoximato)nickel(II) To Generate NiIIFeIIINiII, MnIIINiII, NiIINiII, and ZnIINiIIand the Electrooxidized MnIVNiII, NiIINiIII, and ZnIINiIIISpecies: A Magnetostructural, Electrochemical, and EPR Spectroscopic Study","Inorganic Chemistry","2007","46","21","9003","9016","10.1021/ic701073j","","","1.54178","CuKα","","0.0526","0.0523","","","0.1401","0.1406","","","","","","1.076","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333422","7.417","0.002","8.433","0.003","9.756","0.003","105.358","0.006","111.757","0.006","97.075","0.006","529.6","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H22 Co N4 O16 P4 -","- C10 H22 Co N4 O16 P4 -","- C10 H22 Co N4 O16 P4 -","1","0.5","","Cao, Deng-Ke; Li, Yi-Zhi; Zheng, Li-Min","Layered cobalt(II) and nickel(II) diphosphonates showing canted antiferromagnetism and slow relaxation behavior.","Inorganic chemistry","2007","46","18","7571","7578","10.1021/ic701098t","","","0.71073","MoKα","","0.068","0.0541","","","0.1454","0.1863","","","","","","1.083","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333423","7.387","0.002","8.339","0.002","9.777","0.003","69.33","0.006","67.84","0.005","83.022","0.006","521.8","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H22 N4 Ni O16 P4 -","- C10 H22 N4 Ni O16 P4 -","- C10 H22 N4 Ni O16 P4 -","1","0.5","","Cao, Deng-Ke; Li, Yi-Zhi; Zheng, Li-Min","Layered cobalt(II) and nickel(II) diphosphonates showing canted antiferromagnetism and slow relaxation behavior.","Inorganic chemistry","2007","46","18","7571","7578","10.1021/ic701098t","","","0.71073","MoKα","","0.0695","0.0553","","","0.142","0.1481","","","","","","1.039","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333424","28.1794","0.0014","28.1794","0.0014","17.0456","0.0012","90","","90","","90","","13535.5","1.3","373","2","100","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C72.5 H67 Cl2 N O16.5 V4 -","- C72.5 H66.5 Cl2 N O16.5 V4 -","- C580 H532 Cl16 N8 O132 V32 -","8","0.5","","Tidmarsh, Ian S.; Scales, Emma; Brearley, Paul R.; Wolowska, Joanna; Sorace, Lorenzo; Caneschi, Andrea; Laye, Rebecca H.; McInnes, Eric J. L.","Synthesis, structural, and magnetic studies on a redox family of tetrametallic vanadium clusters: {VIV4}, {VIII2VIV2}, and {VIII4} butterfly complexes.","Inorganic chemistry","2007","46","23","9743","9753","10.1021/ic7011183","","","0.71073","MoKα","","0.0569","0.0374","","","0.0991","0.1048","","","","","","0.943","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333425","23.992","0.003","11.0699","0.0006","16.632","0.002","90","","117.814","0.003","90","","3906.9","0.7","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H49 N O16 V4 -","- C32 H49 N O16 V4 -","- C128 H196 N4 O64 V16 -","4","0.5","","Tidmarsh, Ian S.; Scales, Emma; Brearley, Paul R.; Wolowska, Joanna; Sorace, Lorenzo; Caneschi, Andrea; Laye, Rebecca H.; McInnes, Eric J. L.","Synthesis, structural, and magnetic studies on a redox family of tetrametallic vanadium clusters: {VIV4}, {VIII2VIV2}, and {VIII4} butterfly complexes.","Inorganic chemistry","2007","46","23","9743","9753","10.1021/ic7011183","","","0.7107","MoKα","","0.0627","0.0446","","","0.109","0.1127","","","","","","0.944","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333426","9.2831","0.0003","11.1266","0.0004","19.4966","0.0007","90","","102.773","0.003","90","","1963.96","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H46 O16 V4 -","- C36 H46 O16 V4 -","- C72 H92 O32 V8 -","2","0.5","","Tidmarsh, Ian S.; Scales, Emma; Brearley, Paul R.; Wolowska, Joanna; Sorace, Lorenzo; Caneschi, Andrea; Laye, Rebecca H.; McInnes, Eric J. L.","Synthesis, structural, and magnetic studies on a redox family of tetrametallic vanadium clusters: {VIV4}, {VIII2VIV2}, and {VIII4} butterfly complexes.","Inorganic chemistry","2007","46","23","9743","9753","10.1021/ic7011183","","","0.7107","MoKα","","0.039","0.0356","","","0.0976","0.1004","","","","","","1.058","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333427","11.067","0.008","12.034","0.009","17.256","0.013","102.367","0.014","94.48","0.013","114.203","0.012","2012","3","100","2","373","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H52 O22 V4 -","- C30 H50 O22 V4 -","- C60 H100 O44 V8 -","2","1","","Tidmarsh, Ian S.; Scales, Emma; Brearley, Paul R.; Wolowska, Joanna; Sorace, Lorenzo; Caneschi, Andrea; Laye, Rebecca H.; McInnes, Eric J. L.","Synthesis, structural, and magnetic studies on a redox family of tetrametallic vanadium clusters: {VIV4}, {VIII2VIV2}, and {VIII4} butterfly complexes.","Inorganic chemistry","2007","46","23","9743","9753","10.1021/ic7011183","","","0.71073","MoKα","","0.0788","0.0618","","","0.1681","0.1778","","","","","","1.037","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333428","24.473","0.006","11.0449","0.0015","25.027","0.003","90","","104.667","0.013","90","","6544","2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C74 H70 Cl2 O15 V4 -","- C74 H70 Cl2 O15 V4 -","- C296 H280 Cl8 O60 V16 -","4","0.5","","Tidmarsh, Ian S.; Scales, Emma; Brearley, Paul R.; Wolowska, Joanna; Sorace, Lorenzo; Caneschi, Andrea; Laye, Rebecca H.; McInnes, Eric J. L.","Synthesis, structural, and magnetic studies on a redox family of tetrametallic vanadium clusters: {VIV4}, {VIII2VIV2}, and {VIII4} butterfly complexes.","Inorganic chemistry","2007","46","23","9743","9753","10.1021/ic7011183","","","0.7107","MoKα","","0.1053","0.0834","","","0.1741","0.1826","","","","","","1.119","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333429","11.1495","0.0004","13.4573","0.0004","22.8482","0.0008","78.97","0.003","89.538","0.003","68.743","0.003","3128.9","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H66 Cl2 O14 V4 -","- C72 H66 Cl2 O14 V4 -","- C144 H132 Cl4 O28 V8 -","2","1","","Tidmarsh, Ian S.; Scales, Emma; Brearley, Paul R.; Wolowska, Joanna; Sorace, Lorenzo; Caneschi, Andrea; Laye, Rebecca H.; McInnes, Eric J. L.","Synthesis, structural, and magnetic studies on a redox family of tetrametallic vanadium clusters: {VIV4}, {VIII2VIV2}, and {VIII4} butterfly complexes.","Inorganic chemistry","2007","46","23","9743","9753","10.1021/ic7011183","","","0.7107","MoKα","","0.0549","0.0427","","","0.1172","0.1247","","","","","","1.052","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333430","10.7183","0.0016","25.3971","0.0018","11.8682","0.0011","90","","108.142","0.011","90","","3070.1","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C66 H62 Cl2 O14 V4 -","- C66 H62 Cl2 O14 V4 -","- C132 H124 Cl4 O28 V8 -","2","0.5","","Tidmarsh, Ian S.; Scales, Emma; Brearley, Paul R.; Wolowska, Joanna; Sorace, Lorenzo; Caneschi, Andrea; Laye, Rebecca H.; McInnes, Eric J. L.","Synthesis, structural, and magnetic studies on a redox family of tetrametallic vanadium clusters: {VIV4}, {VIII2VIV2}, and {VIII4} butterfly complexes.","Inorganic chemistry","2007","46","23","9743","9753","10.1021/ic7011183","","","0.7107","MoKα","","0.054","0.0326","","","0.0795","0.0832","","","","","","0.948","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333431","14.2348","0.0012","14.6217","0.0011","15.3715","0.0013","106.773","0.007","95.178","0.007","113.363","0.007","2734.8","0.5","175","","175","","","","","","","","","7","P -1","-P 1","2","","","","- C60 H44 F6 N8 O6 S2 Zn -","- C60 H44 F6 N8 O6 S2 Zn -","- C120 H88 F12 N16 O12 S4 Zn2 -","2","1","","Legrand, Yves-Marie; van der Lee, Arie; Barboiu, Mihail","Self-Optimizing Charge-Transfer Energy Phenomena in Metallosupramolecular Complexes by Dynamic Constitutional Self-Sorting","Inorganic Chemistry","2007","46","23","9540","9547","10.1021/ic701122a","","","0.71073","MoKα","","0.0913","0.0354","","0.0377","0.0377","0.0377","","","","","","1.1299","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333432","10.6288","0.0007","12.8757","0.0008","14.5384","0.0009","71.882","0.001","74.571","0.001","71.725","0.001","1764.02","0.19","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H25 F12 N11 P2 Ru -","- C28 H25 F12 N11 P2 Ru -","- C56 H50 F24 N22 P4 Ru2 -","2","1","","Stagni, Stefano; Orselli, Enrico; Palazzi, Antonio; De Cola, Luisa; Zacchini, Stefano; Femoni, Cristina; Marcaccio, Massimo; Paolucci, Francesco; Zanarini, Simone","Polypyridyl ruthenium(II) complexes with tetrazolate-based chelating ligands. Synthesis, reactivity, and electrochemical and photophysical properties.","Inorganic chemistry","2007","46","22","9126","9138","10.1021/ic7011556","","","0.71073","MoKα","","0.0433","0.0404","","","0.114","0.1169","","","","","","1.059","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333433","9.701","0.0008","13.6667","0.0011","14.0902","0.0011","81.451","0.001","71.487","0.001","89.522","0.001","1750.2","0.2","298","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H26 F12 N10 P2 Ru -","- C29 H26 F12 N10 P2 Ru -","- C58 H52 F24 N20 P4 Ru2 -","2","1","","Stagni, Stefano; Orselli, Enrico; Palazzi, Antonio; De Cola, Luisa; Zacchini, Stefano; Femoni, Cristina; Marcaccio, Massimo; Paolucci, Francesco; Zanarini, Simone","Polypyridyl ruthenium(II) complexes with tetrazolate-based chelating ligands. Synthesis, reactivity, and electrochemical and photophysical properties.","Inorganic chemistry","2007","46","22","9126","9138","10.1021/ic7011556","","","0.71073","MoKα","","0.0492","0.0426","","","0.1158","0.1234","","","","","","1.064","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333434","10","0.003","15.541","0.004","15.83","0.004","90","","90","","90","","2460.1","1.2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H25 N3 O6 S V -","- C24 H21 N3 O6 S V -","- C96 H84 N12 O24 S4 V4 -","4","1","","Sasmal, Pijus K.; Patra, Ashis K.; Nethaji, Munirathinam; Chakravarty, Akhil R.","DNA Cleavage by New Oxovanadium(IV) Complexes ofN-Salicylidene α-Amino Acids and Phenanthroline Bases in the Photodynamic Therapy Window","Inorganic Chemistry","2007","46","26","11112","11121","10.1021/ic7011793","","","0.71073","MoKα","","0.1503","0.078","","","0.1176","0.1375","","","","","","1.028","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333435","9.429","0.008","14.957","0.012","17.702","0.016","90","","90","","90","","2497","4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H21 N5 O4 S V -","- C26 H21 N5 O4 S V -","- C104 H84 N20 O16 S4 V4 -","4","1","","Sasmal, Pijus K.; Patra, Ashis K.; Nethaji, Munirathinam; Chakravarty, Akhil R.","DNA Cleavage by New Oxovanadium(IV) Complexes ofN-Salicylidene α-Amino Acids and Phenanthroline Bases in the Photodynamic Therapy Window","Inorganic Chemistry","2007","46","26","11112","11121","10.1021/ic7011793","","","0.71073","MoKα","","0.1235","0.0759","","","0.1042","0.1175","","","","","","1.05","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333436","10.42","0.007","16.214","0.01","31.66","0.02","90","","90","","90","","5349","6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C30.5 H24 N4 O4.5 V -","- C30.5 H22 N4 O4.5 V -","- C244 H176 N32 O36 V8 -","8","2","","Sasmal, Pijus K.; Patra, Ashis K.; Nethaji, Munirathinam; Chakravarty, Akhil R.","DNA Cleavage by New Oxovanadium(IV) Complexes ofN-Salicylidene α-Amino Acids and Phenanthroline Bases in the Photodynamic Therapy Window","Inorganic Chemistry","2007","46","26","11112","11121","10.1021/ic7011793","","","0.71073","MoKα","","0.2031","0.0959","","","0.1444","0.1819","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333437","8.244","0.002","10.408","0.003","13.512","0.004","83.63","0.03","86.59","0.03","65.35","0.03","1047.1","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H18 Cd I2 N5 O -","- C14 H18 Cd I2 N5 O -","- C28 H36 Cd2 I4 N10 O2 -","2","1","","Sarker, K. K.; Sardar, D.; Suwa, K.; Otsuki, J.; Sinha, C.","Cadmium(II) Complexes of (Arylazo)imidazoles: Synthesis, Structure, Photochromism, and Density Functional Theory Calculation","Inorganic Chemistry","2007","46","20","8291","8301","10.1021/ic7012073","","","0.71073","MoKα","","0.0593","0.0367","","","0.0897","0.0957","","","","","","1.038","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333438","12.9142","0.0013","8.8002","0.0009","14.5441","0.0015","90","","91.931","0.001","90","","1652","0.3","125","2","125","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 N4 S2 -","- C18 H14 N4 S2 -","- C72 H56 N16 S8 -","4","1","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.0383","0.0322","","","0.1165","0.1268","","","","","","1.066","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333439","9.2589","0.0008","9.9669","0.0009","10.8822","0.0009","85.774","0.002","89.877","0.002","70.033","0.001","941.02","0.14","243","2","243","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Cu I N4 S2 -","- C14 H22 Cu I N4 S2 -","- C28 H44 Cu2 I2 N8 S4 -","2","1","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.1452","0.0785","","","0.2216","0.3153","","","","","","1.035","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333440","13.3552","0.0013","14.3521","0.0015","13.9868","0.0014","90","","93.275","0.002","90","","2676.5","0.5","243","2","243","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H26 Cl6 Co N4 S2 -","- C16 H26 Cl6 Co N4 S2 -","- C64 H104 Cl24 Co4 N16 S8 -","4","1","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.0693","0.0458","","","0.1154","0.1283","","","","","","1.013","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333441","8.6315","0.0008","14.288","0.0014","25.144","0.003","90","","98.144","0.002","90","","3069.7","0.6","243","2","243","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H28 Cl4 Fe N4 Se2 -","- C25 H28 Cl4 Fe N4 Se2 -","- C100 H112 Cl16 Fe4 N16 Se8 -","4","1","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.0836","0.0392","","","0.0828","0.0981","","","","","","1.02","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333442","7.3358","0.0014","9.3361","0.0019","13.886","0.004","74.588","0.008","84.137","0.014","68.513","0.005","853.1","0.3","243","2","243","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H48 N4 Ni P2 S2 -","- C27 H48 N4 Ni P2 S2 -","- C27 H48 N4 Ni P2 S2 -","1","0.5","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.0554","0.0425","","","0.1102","0.1181","","","","","","1.051","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333443","20.146","0.002","10.6201","0.0013","20.869","0.003","90","","90","","90","","4465","1","125","2","125","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C15 H24 Cl4 N4 Ni S2 -","- C15 H24 Cl4 N4 Ni S2 -","- C120 H192 Cl32 N32 Ni8 S16 -","8","1","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.0808","0.0378","","","0.0759","0.092","","","","","","1.022","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333444","6.7689","0.001","23.862","0.003","14.198","0.002","90","","100.066","0.002","90","","2258","0.5","125","2","125","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 Cl4 Co N4 S2 -","- C19 H16 Cl4 Co N4 S2 -","- C76 H64 Cl16 Co4 N16 S8 -","4","1","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.0936","0.0814","","","0.2265","0.2325","","","","","","1.023","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333445","16.0506","0.0015","4.4308","0.0004","9.148","0.0009","90","","123.909","0.002","90","","539.93","0.09","298","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ag2.22 Ba2 Cu1.77 Se5 -","- Ag2.224 Ba2 Cu1.776 Se5 -","- Ag4.448 Ba4 Cu3.552 Se10 -","2","0.25","","Assoud, Abdeljalil; Xu, Jianxiao; Kleinke, Holger","Structures and physical properties of new semiconducting polyselenides Ba2CudeltaAg4-deltaSe5 with unprecedented linear Se(3)4- units.","Inorganic chemistry","2007","46","23","9906","9911","10.1021/ic701278b","","","0.71073","MoKα","","0.0432","0.0405","","","0.0933","0.0952","","","","","","1.058","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333446","8.4161","0.0004","17.3262","0.0009","19.9065","0.0011","84.976","0.001","88.813","0.001","89.799","0.001","2891","0.3","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H45 N O3 S2 Si W -","- C23 H45 N O3 S2 Si W -","- C92 H180 N4 O12 S8 Si4 W4 -","4","2","","Wang, Jun-Jieh; Holm, R. H.","Silylation, Sulfidation, and Benzene-1,2-dithiolate Complexation Reactions of Oxo- and Oxosulfidomolybdates(VI) and -Tungstates(VI)","Inorganic Chemistry","2007","46","26","11156","11164","10.1021/ic701294y","","","0.71073","MoKα","","0.0657","0.0471","","","0.0954","0.1021","","","","","","1.089","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333447","19.94","0.004","7.83","0.0016","34.29","0.007","90","","92.17","0.03","90","","5349.9","1.9","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H39 N O3 S2 Si W -","- C20 H39 N O3 S2 Si W -","- C160 H312 N8 O24 S16 Si8 W8 -","8","2","","Wang, Jun-Jieh; Holm, R. H.","Silylation, Sulfidation, and Benzene-1,2-dithiolate Complexation Reactions of Oxo- and Oxosulfidomolybdates(VI) and -Tungstates(VI)","Inorganic Chemistry","2007","46","26","11156","11164","10.1021/ic701294y","","","0.71073","MoKα","","0.0918","0.0593","","","0.1329","0.1457","","","","","","1.076","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333448","8.35","0.0017","16.477","0.003","13.535","0.003","90","","104","0.03","90","","1806.9","0.7","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H48 Cl2 Mo2 N2 O3 S4 -","- C28 H48 Cl2 Mo2 N2 O3 S4 -","- C56 H96 Cl4 Mo4 N4 O6 S8 -","2","0.5","","Wang, Jun-Jieh; Holm, R. H.","Silylation, Sulfidation, and Benzene-1,2-dithiolate Complexation Reactions of Oxo- and Oxosulfidomolybdates(VI) and -Tungstates(VI)","Inorganic Chemistry","2007","46","26","11156","11164","10.1021/ic701294y","","","0.71073","MoKα","","0.0684","0.0515","","","0.1195","0.129","","","","","","1.046","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333449","9.83","0.002","10.66","0.002","15.92","0.003","107.21","0.03","103.2","0.03","93.31","0.03","1537.3","0.6","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H41 Cl2 Mo N O4 Si -","- C25 H41 Cl2 Mo N O4 Si -","- C50 H82 Cl4 Mo2 N2 O8 Si2 -","2","1","","Wang, Jun-Jieh; Holm, R. H.","Silylation, Sulfidation, and Benzene-1,2-dithiolate Complexation Reactions of Oxo- and Oxosulfidomolybdates(VI) and -Tungstates(VI)","Inorganic Chemistry","2007","46","26","11156","11164","10.1021/ic701294y","","","0.71073","MoKα","","0.0349","0.031","","","0.0833","0.0856","","","","","","1.042","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333450","8.5965","0.0008","9.2168","0.0009","19.4188","0.0018","100.911","0.002","92.755","0.002","113.094","0.002","1376.9","0.2","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H35 Mo N O3 S Si -","- C26 H35 Mo N O3 S Si -","- C52 H70 Mo2 N2 O6 S2 Si2 -","2","1","","Wang, Jun-Jieh; Holm, R. H.","Silylation, Sulfidation, and Benzene-1,2-dithiolate Complexation Reactions of Oxo- and Oxosulfidomolybdates(VI) and -Tungstates(VI)","Inorganic Chemistry","2007","46","26","11156","11164","10.1021/ic701294y","","","0.71073","MoKα","","0.0532","0.049","","","0.1347","0.1383","","","","","","1.08","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333451","17.7637","0.0014","8.4492","0.0007","16.5049","0.0014","90","","90.732","0.002","90","","2477","0.4","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H41 Mo N O2 S2 Si -","- C17 H40.935 Mo N O2 S2 Si -","- C68 H163.74 Mo4 N4 O8 S8 Si4 -","4","1","","Wang, Jun-Jieh; Holm, R. H.","Silylation, Sulfidation, and Benzene-1,2-dithiolate Complexation Reactions of Oxo- and Oxosulfidomolybdates(VI) and -Tungstates(VI)","Inorganic Chemistry","2007","46","26","11156","11164","10.1021/ic701294y","","","0.71073","MoKα","","0.0699","0.0479","","","0.1031","0.1117","","","","","","1.089","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333452","17.99","0.004","8.49","0.0017","16.67","0.003","90","","90.79","0.03","90","","2545.9","0.9","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H41 Mo N O S3 Si -","- C17 H41 Mo N O S3 Si -","- C68 H164 Mo4 N4 O4 S12 Si4 -","4","1","","Wang, Jun-Jieh; Holm, R. H.","Silylation, Sulfidation, and Benzene-1,2-dithiolate Complexation Reactions of Oxo- and Oxosulfidomolybdates(VI) and -Tungstates(VI)","Inorganic Chemistry","2007","46","26","11156","11164","10.1021/ic701294y","","","0.71073","MoKα","","0.1304","0.103","","","0.2617","0.28","","","","","","1.248","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333453","20.6752","0.0016","10.3777","0.0008","14.4721","0.0011","90","","110.422","0.001","90","","2910","0.4","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H39 Mo N O S3 Si -","- C24 H39 Mo N O S3 Si -","- C96 H156 Mo4 N4 O4 S12 Si4 -","4","1","","Wang, Jun-Jieh; Holm, R. H.","Silylation, Sulfidation, and Benzene-1,2-dithiolate Complexation Reactions of Oxo- and Oxosulfidomolybdates(VI) and -Tungstates(VI)","Inorganic Chemistry","2007","46","26","11156","11164","10.1021/ic701294y","","","0.71073","MoKα","","0.0451","0.035","","","0.0895","0.0993","","","","","","1.107","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333454","18.061","0.002","8.5225","0.001","16.6623","0.0019","90","","91.032","0.002","90","","2564.3","0.5","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H41 N O S3 Si W -","- C17 H41 N O S3 Si W -","- C68 H164 N4 O4 S12 Si4 W4 -","4","1","","Wang, Jun-Jieh; Holm, R. H.","Silylation, Sulfidation, and Benzene-1,2-dithiolate Complexation Reactions of Oxo- and Oxosulfidomolybdates(VI) and -Tungstates(VI)","Inorganic Chemistry","2007","46","26","11156","11164","10.1021/ic701294y","","","0.71073","MoKα","","0.0744","0.0559","","","0.1242","0.1318","","","","","","1.147","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333455","18.678","0.004","8.1799","0.0016","16.724","0.003","90","","110.59","0.03","90","","2391.9","0.9","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H35 N O S3 Si W -","- C14 H35 N O S3 Si W -","- C56 H140 N4 O4 S12 Si4 W4 -","4","1","","Wang, Jun-Jieh; Holm, R. H.","Silylation, Sulfidation, and Benzene-1,2-dithiolate Complexation Reactions of Oxo- and Oxosulfidomolybdates(VI) and -Tungstates(VI)","Inorganic Chemistry","2007","46","26","11156","11164","10.1021/ic701294y","","","0.71073","MoKα","","0.0429","0.0322","","","0.0836","0.0942","","","","","","1.176","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333456","8.4","0.0017","17.3","0.004","19.86","0.004","85.08","0.03","88.78","0.03","89.7","0.03","2874.8","1.1","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H45 Mo N O3 S2 Si -","- C23 H45 Mo N O3 S2 Si -","- C92 H180 Mo4 N4 O12 S8 Si4 -","4","2","","Wang, Jun-Jieh; Holm, R. H.","Silylation, Sulfidation, and Benzene-1,2-dithiolate Complexation Reactions of Oxo- and Oxosulfidomolybdates(VI) and -Tungstates(VI)","Inorganic Chemistry","2007","46","26","11156","11164","10.1021/ic701294y","","","0.71073","MoKα","","0.077","0.0495","","","0.1057","0.1177","","","","","","1.026","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333457","23.374","0.006","8.965","0.002","15.057","0.003","90","","90","","90","","3155.2","1.2","273","2","273","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C30 H43 Mo N O3 S2 Si -","- C30 H43 Mo N O3 S2 Si -","- C120 H172 Mo4 N4 O12 S8 Si4 -","4","1","","Wang, Jun-Jieh; Holm, R. H.","Silylation, Sulfidation, and Benzene-1,2-dithiolate Complexation Reactions of Oxo- and Oxosulfidomolybdates(VI) and -Tungstates(VI)","Inorganic Chemistry","2007","46","26","11156","11164","10.1021/ic701294y","","","0.71073","MoKα","","0.0364","0.0301","","","0.0638","0.066","","","","","","0.993","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333458","11.3051","0.001","7.5236","0.0007","13.3767","0.0012","90","","104.849","0.002","90","","1099.76","0.17","170","2","170","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 S2 V -","- C12 H12 S2 V -","- C48 H48 S8 V4 -","4","1","","Cranswick, Matthew A.; Dawson, Alice; Cooney, J. Jon A.; Gruhn, Nadine E.; Lichtenberger, Dennis L.; Enemark, John H.","Photoelectron Spectroscopy and Electronic Structure Calculations of d1Vanadocene Compounds with Chelated Dithiolate Ligands: Implications for Pyranopterin Mo/W Enzymes","Inorganic Chemistry","2007","46","25","10639","10646","10.1021/ic701338s","","","0.71073","MoKα","","0.0644","0.0389","","","0.0855","0.0986","","","","","","1.04","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333459","9.1202","0.0003","13.2285","0.0005","16.8642","0.0004","90","","100.292","0.0019","90","","2001.87","0.11","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H56 O10 Ti2 -","- C38 H56 O10 Ti2 -","- C76 H112 O20 Ti4 -","2","0.5","","Wallace, Warren A.; Potvin, Pierre G.","Structurally Diverse Aggregating Condensations of Ti(IV) Catecholates","Inorganic Chemistry","2007","46","22","9463","9472","10.1021/ic7013495","","","0.71073","MoKα","","0.0799","0.0453","","","0.1085","0.1277","","","","","","1.03","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333460","12.6267","0.0006","13.4917","0.0006","15.6335","0.0009","95.798","0.003","97.372","0.003","104.835","0.003","2528.2","0.2","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C88 H100 Cl12 O24 Ti6 -","- C88 H100 Cl12 O24 Ti6 -","- C88 H100 Cl12 O24 Ti6 -","1","0.5","","Wallace, Warren A.; Potvin, Pierre G.","Structurally Diverse Aggregating Condensations of Ti(IV) Catecholates","Inorganic Chemistry","2007","46","22","9463","9472","10.1021/ic7013495","","","0.71073","MoKα","","0.117","0.0725","","","0.1882","0.2215","","","","","","1.023","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333461","6.8346","0.0012","12.817","0.002","15.437","0.003","97.647","0.009","102.055","0.008","103.035","0.009","1265.1","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H46 N2 Ni P2 S8 -","- C56 H46 N2 Ni P2 S8 -","- C56 H46 N2 Ni P2 S8 -","1","0.5","","Eid, Samar; Fourmigué, Marc; Roisnel, Thierry; Lorcy, Dominique","Influence of the Thiazole Backbone on the Structural, Redox, and Optical Properties of Dithiolene and Diselenolene Complexes","Inorganic Chemistry","2007","46","25","10647","10654","10.1021/ic7013682","","","0.71073","MoKα","","0.0392","0.0299","","","0.0696","0.0744","","","","","","1.031","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333462","9.0355","0.0005","9.4837","0.0005","20.1155","0.0011","90","","90.886","0.003","90","","1723.49","0.16","100","2","100","2","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C24 H46 N4 S4 Se4 Zn -","- C24 H46 N4 S4 Se4 Zn -","- C48 H92 N8 S8 Se8 Zn2 -","2","1","","Eid, Samar; Fourmigué, Marc; Roisnel, Thierry; Lorcy, Dominique","Influence of the Thiazole Backbone on the Structural, Redox, and Optical Properties of Dithiolene and Diselenolene Complexes","Inorganic Chemistry","2007","46","25","10647","10654","10.1021/ic7013682","","x-ray","0.71073","MoKα","","0.0941","0.0511","","","0.1224","0.1435","","","","","","1.026","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333463","21.7845","0.0019","6.3878","0.0006","18.8278","0.0016","90","","110.857","0.003","90","","2448.3","0.4","100","2","100","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H26 N3 Ni S8 -","- C16 H26 N3 Ni S8 -","- C64 H104 N12 Ni4 S32 -","4","0.5","","Eid, Samar; Fourmigué, Marc; Roisnel, Thierry; Lorcy, Dominique","Influence of the Thiazole Backbone on the Structural, Redox, and Optical Properties of Dithiolene and Diselenolene Complexes","Inorganic Chemistry","2007","46","25","10647","10654","10.1021/ic7013682","","x-ray","0.71073","MoKα","","0.0422","0.034","","","0.0791","0.0829","","","","","","1.098","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333464","11.0748","0.0004","14.1195","0.0005","16.2086","0.0006","77.589","0.002","86.946","0.002","75.875","0.002","2400.48","0.15","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H26 N3 Pd S8 -","- C16 H26 N3 Pd S8 -","- C64 H104 N12 Pd4 S32 -","4","2","","Eid, Samar; Fourmigué, Marc; Roisnel, Thierry; Lorcy, Dominique","Influence of the Thiazole Backbone on the Structural, Redox, and Optical Properties of Dithiolene and Diselenolene Complexes","Inorganic Chemistry","2007","46","25","10647","10654","10.1021/ic7013682","","","0.71073","MoKα","","0.0844","0.0568","","","0.1169","0.1279","","","","","","1.11","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333465","10.6112","0.0004","15.3656","0.0005","16.6603","0.0012","67.156","0.002","81.1619","0.0006","83.4457","0.0008","2469.2","0.2","293.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C58 H50 Fe O7 P2 S2 -","- C58 H50 Fe O7 P2 S2 -","- C116 H100 Fe2 O14 P4 S4 -","2","1","","Akutsu, Hiroki; Ohnishi, Ryo; Yamada, Jun-ich; Nakatsuji, Shin'ichi; Turner, Scott S.","Novel bis(ethylenedithio)tetrathiafulvalene-based organic conductor with 1,1'-ferrocenedisulfonate.","Inorganic chemistry","2007","46","21","8472","8474","10.1021/ic701392z","","","0.71069","MoKα","","","0.0628","","","","0.0611","","","","","","1.073","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333466","16.7469","0.001","17.4917","0.0016","19.7235","0.0017","100.183","0.0018","99.3893","0.0006","94.1645","0.0008","5579.7","0.8","295.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C50 H52 Fe O12 S34 -","- C50 H52 Fe O12 S34 -","- C150 H156 Fe3 O36 S102 -","3","1.5","","Akutsu, Hiroki; Ohnishi, Ryo; Yamada, Jun-ich; Nakatsuji, Shin'ichi; Turner, Scott S.","Novel bis(ethylenedithio)tetrathiafulvalene-based organic conductor with 1,1'-ferrocenedisulfonate.","Inorganic chemistry","2007","46","21","8472","8474","10.1021/ic701392z","","","0.71069","MoKα","","","0.0784","","","","0.0663","","","","","","1.189","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333467","13.8849","0.0006","21.6767","0.0009","25.4158","0.0011","90","","99.281","0.001","90","","7549.5","0.6","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C50 H40 As Cu5 Mo12 N10 O42 V2 -","- C50 H40 As Cu5 Mo12 N10 O44 V2 -","- C200 H160 As4 Cu20 Mo48 N40 O176 V8 -","4","1","","Sha, Jing-quan; Peng, Jun; Liu, Hong-sheng; Chen, Jing; Tian, Ai-xiang; Zhang, Peng-peng","Asymmetrical Polar Modification of a Bivanadium-Capped Keggin POM by Multiple Cu−N Coordination Polymeric Chains","Inorganic Chemistry","2007","46","26","11183","11189","10.1021/ic7014308","","","0.71073","MoKα","","0.0746","0.0534","","","0.1464","0.1559","","","","","","1.025","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333468","12.274","0.004","12.872","0.004","13.108","0.004","93.971","0.005","104.876","0.004","110.758","0.005","1842","1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C48 H38 As Cu3 Mo12 N8 O43 V2 -","- C48 H40 As Cu3 Mo12 N8 O44 V2 -","- C48 H40 As Cu3 Mo12 N8 O44 V2 -","1","0.5","","Sha, Jing-quan; Peng, Jun; Liu, Hong-sheng; Chen, Jing; Tian, Ai-xiang; Zhang, Peng-peng","Asymmetrical Polar Modification of a Bivanadium-Capped Keggin POM by Multiple Cu−N Coordination Polymeric Chains","Inorganic Chemistry","2007","46","26","11183","11189","10.1021/ic7014308","","","0.71073","MoKα","","0.1287","0.0781","","","0.1733","0.1998","","","","","","1.082","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333469","5.4503","0.0009","12.88","0.002","16.417","0.003","67.841","0.006","80.633","0.006","87.688","0.008","1052.8","0.3","250","2","250","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H22 Cd3 N2 O30 P4 -","- C20 H22 Cd3 N2 O30 P4 -","- C20 H22 Cd3 N2 O30 P4 -","1","0.5","","Bauer, Sebastian; Marrot, Jérôme; Devic, Thomas; Férey, Gérard; Stock, Norbert","[Cd3(H2O)3((O3PCH2)2NH−CH2C6H4−COOH)2]·11H2O: A Layered Cadmium Phosphonate with Reversible Dehydration/Hydration Properties","Inorganic Chemistry","2007","46","23","9998","10002","10.1021/ic7014918","","","0.71073","MoKα","","0.1143","0.0705","","","0.1823","0.2108","","","","","","1.202","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333470","9.9557","0.0001","12.0647","0.0002","15.7194","0.0003","85.4865","0.001","74.0517","0.0011","71.1197","0.0011","1717.64","0.05","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C14 H5 F6 N3 O5 Os -","- C14 H5 F6 N3 O5 Os -","- C56 H20 F24 N12 O20 Os4 -","4","2","","Cheng, Yi-Ming; Li, Elise Y.; Lee, Gene-Hsiang; Chou, Pi-Tai; Lin, Sue-Yi; Shu, Ching-Fong; Hwang, Kwun-Chi; Chen, Yao-Lun; Song, Yi-Hwa; Chi, Yun","Strategic Design and Synthesis of Osmium(II) Complexes Bearing a Single Pyridyl Azolate π-Chromophore: Achieving High-Efficiency Blue Phosphorescence by Localized Excitation","Inorganic Chemistry","2007","46","24","10276","10286","10.1021/ic7015269","","","0.71073","MoKα","","0.0413","0.0326","","","0.0779","0.0844","","","","","","1.015","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333471","10.2656","0.0007","12.4189","0.0008","14.7477","0.0009","92.357","0.001","92.615","0.001","109.768","0.001","1764.3","0.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H31 F6 N3 O3 Os P2 -","- C38 H31 F6 N3 O3 Os P2 -","- C76 H62 F12 N6 O6 Os2 P4 -","2","1","","Cheng, Yi-Ming; Li, Elise Y.; Lee, Gene-Hsiang; Chou, Pi-Tai; Lin, Sue-Yi; Shu, Ching-Fong; Hwang, Kwun-Chi; Chen, Yao-Lun; Song, Yi-Hwa; Chi, Yun","Strategic Design and Synthesis of Osmium(II) Complexes Bearing a Single Pyridyl Azolate π-Chromophore: Achieving High-Efficiency Blue Phosphorescence by Localized Excitation","Inorganic Chemistry","2007","46","24","10276","10286","10.1021/ic7015269","","","0.71073","MoKα","","0.0858","0.0716","","","0.1208","0.125","","","","","","1.23","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333472","9.4227","0.0007","11.281","0.0008","17.8178","0.0013","77.385","0.002","84.591","0.002","75.979","0.002","1791.5","0.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H31 F6 N3 O3 Os P2 -","- C38 H31 F6 N3 O3 Os P2 -","- C76 H62 F12 N6 O6 Os2 P4 -","2","1","","Cheng, Yi-Ming; Li, Elise Y.; Lee, Gene-Hsiang; Chou, Pi-Tai; Lin, Sue-Yi; Shu, Ching-Fong; Hwang, Kwun-Chi; Chen, Yao-Lun; Song, Yi-Hwa; Chi, Yun","Strategic Design and Synthesis of Osmium(II) Complexes Bearing a Single Pyridyl Azolate π-Chromophore: Achieving High-Efficiency Blue Phosphorescence by Localized Excitation","Inorganic Chemistry","2007","46","24","10276","10286","10.1021/ic7015269","","","0.71073","MoKα","","0.0277","0.0248","","","0.0557","0.0637","","","","","","1.091","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333473","12.5949","0.0008","18.2927","0.0011","16.1595","0.001","90","","101.664","0.002","90","","3646.2","0.4","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C38 H31 F6 N3 O3 Os P2 -","- C38 H31 F6 N3 O3 Os P2 -","- C152 H124 F24 N12 O12 Os4 P8 -","4","1","","Cheng, Yi-Ming; Li, Elise Y.; Lee, Gene-Hsiang; Chou, Pi-Tai; Lin, Sue-Yi; Shu, Ching-Fong; Hwang, Kwun-Chi; Chen, Yao-Lun; Song, Yi-Hwa; Chi, Yun","Strategic Design and Synthesis of Osmium(II) Complexes Bearing a Single Pyridyl Azolate π-Chromophore: Achieving High-Efficiency Blue Phosphorescence by Localized Excitation","Inorganic Chemistry","2007","46","24","10276","10286","10.1021/ic7015269","","","0.71073","MoKα","","0.1128","0.093","","","0.1654","0.173","","","","","","1.249","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333474","11.356","0.001","12.034","0.001","19.243","0.002","86.241","0.001","77.666","0.001","74.859","0.001","2479.7","0.4","100","2","100","2","","","","","","","","9","P -1","-P 1","2","","","","- C53 H35 Cu2 Fe I2 N1.5 O6 P2 S2 -","- C53 H35 Cu2 Fe I2 N1.5 O6 P2 S2 -","- C106 H70 Cu4 Fe2 I4 N3 O12 P4 S4 -","2","1","","Punji, Benudhar; Mague, Joel T.; Balakrishna, Maravanji S.","Thioether-Functionalized Ferrocenyl-bis(phosphonite), Fe{(C5H4)P(−OC10H6(μ-S)C10H6O−)}2: Synthesis, Coordination Behavior, and Application in Suzuki-Miyaura Cross-Coupling Reactions","Inorganic Chemistry","2007","46","24","10268","10275","10.1021/ic701537k","","","0.71073","MoKα","","0.063","0.045","","","0.0956","0.1024","","","","","","1.041","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333475","18.585","0.001","9.6828","0.0006","24.923","0.002","90","","103.52","0.001","90","","4360.7","0.5","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C50 H32 Au2 Cl2 Fe O4 P2 S2 -","- C50 H32 Au2 Cl2 Fe O4 P2 S2 -","- C200 H128 Au8 Cl8 Fe4 O16 P8 S8 -","4","0.5","","Punji, Benudhar; Mague, Joel T.; Balakrishna, Maravanji S.","Thioether-Functionalized Ferrocenyl-bis(phosphonite), Fe{(C5H4)P(−OC10H6(μ-S)C10H6O−)}2: Synthesis, Coordination Behavior, and Application in Suzuki-Miyaura Cross-Coupling Reactions","Inorganic Chemistry","2007","46","24","10268","10275","10.1021/ic701537k","","","0.71073","MoKα","","0.0432","0.033","","","0.0719","0.0756","","","","","","1.079","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333476","13.35","0.006","14.073","0.004","14.187","0.004","83.293","0.012","68.602","0.015","70.833","0.014","2344.1","1.4","120","","120","","","","","","","","","6","P -1","-P 1","2","[LZn3(OAc)2(MeOH)2]CHCl3","","","- C39 H45 Cl3 N4 O16 Zn3 -","- C39 H45 Cl3 N4 O16 Zn3 -","- C78 H90 Cl6 N8 O32 Zn6 -","2","1","","Akine, Shigehisa; Kagiyama, Satoko; Nabeshima, Tatsuya","Oligometallic Template Strategy for Ring-Closing Olefin Metathesis: Highly Cis- and Trans-Selective Synthesis of a 32-Membered Macrocyclic Tetraoxime","Inorganic Chemistry","2007","46","23","9525","9527","10.1021/ic701585x","","","0.71069","MoKα","","0.0577","0.0523","","","0.1626","0.1666","","","","","","1.05","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333477","13.791","0.003","15.788","0.004","20.439","0.004","84.018","0.01","81.632","0.01","73.877","0.011","4220.1","1.7","120","","120","","","","","","","","","7","P -1","-P 1","2","[LZn2Ca(OAc)2](CHCl3)0.5(H2O)0.75","","","- C36.5 H38 Ca Cl1.5 N4 O14.75 Zn2 -","- C36.5 H36.5 Ca Cl1.5 N4 O14.75 Zn2 -","- C146 H146 Ca4 Cl6 N16 O59 Zn8 -","4","2","","Akine, Shigehisa; Kagiyama, Satoko; Nabeshima, Tatsuya","Oligometallic Template Strategy for Ring-Closing Olefin Metathesis: Highly Cis- and Trans-Selective Synthesis of a 32-Membered Macrocyclic Tetraoxime","Inorganic Chemistry","2007","46","23","9525","9527","10.1021/ic701585x","","","0.71069","MoKα","","0.0981","0.0632","","","0.1567","0.1809","","","","","","1.03","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333478","12.836","0.005","13.302","0.005","14.564","0.005","115.026","0.014","94.16","0.017","93.458","0.017","2235.9","1.5","120","","120","","","","","","","","","7","P -1","-P 1","2","LZn2La(OAc)3(CHCl3)","","","- C39 H40 Cl3 La N4 O16 Zn2 -","- C39 H40 Cl3 La N4 O16 Zn2 -","- C78 H80 Cl6 La2 N8 O32 Zn4 -","2","1","","Akine, Shigehisa; Kagiyama, Satoko; Nabeshima, Tatsuya","Oligometallic Template Strategy for Ring-Closing Olefin Metathesis: Highly Cis- and Trans-Selective Synthesis of a 32-Membered Macrocyclic Tetraoxime","Inorganic Chemistry","2007","46","23","9525","9527","10.1021/ic701585x","","","0.71069","MoKα","","0.0535","0.0472","","","0.1402","0.1431","","","","","","1.085","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333479","9.234","0.005","12.938","0.007","17.913","0.009","82.101","0.009","83.023","0.009","74.558","0.009","2035.1","1.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","In(4-pyrdpm)~3~^.^1.5CHCl~3~","","","- C43.5 H31 Cl4.5 In N9 -","- C43.5 H31 Cl4.5 In N9 -","- C87 H62 Cl9 In2 N18 -","2","1","","Stork, Jay R.; Thoi, Van S.; Cohen, Seth M.","Rare Examples of Transition-Metal−Main-Group Metal Heterometallic Metal−Organic Frameworks from Gallium and Indium Dipyrrinato Complexes and Silver Salts: Synthesis and Framework Variability","Inorganic Chemistry","2007","46","26","11213","11223","10.1021/ic7016159","","","0.71073","MoKα","","0.0415","0.0364","","","0.0893","0.0922","","","","","","1.057","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333480","8.597","0.003","28.61","0.009","14.372","0.005","90","","107.716","0.005","90","","3367","2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ga(4-pyrdpm)~3~","","","- C42 H30 Ga N9 -","- C42 H30 Ga N9 -","- C168 H120 Ga4 N36 -","4","1","","Stork, Jay R.; Thoi, Van S.; Cohen, Seth M.","Rare Examples of Transition-Metal−Main-Group Metal Heterometallic Metal−Organic Frameworks from Gallium and Indium Dipyrrinato Complexes and Silver Salts: Synthesis and Framework Variability","Inorganic Chemistry","2007","46","26","11213","11223","10.1021/ic7016159","","","0.71073","MoKα","","0.0741","0.0493","","","0.0943","0.1021","","","","","","1.057","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333481","30.55","0.02","13.082","0.009","33.62","0.02","90","","114.739","0.008","90","","12203","14","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","MOF-Ga/AgOTf-1b","","","- C43 H30 Ag F3 Ga N9 O3 S -","- C43 H30 Ag F3 Ga N9 O3 S -","- C344 H240 Ag8 F24 Ga8 N72 O24 S8 -","8","1","","Stork, Jay R.; Thoi, Van S.; Cohen, Seth M.","Rare Examples of Transition-Metal−Main-Group Metal Heterometallic Metal−Organic Frameworks from Gallium and Indium Dipyrrinato Complexes and Silver Salts: Synthesis and Framework Variability","Inorganic Chemistry","2007","46","26","11213","11223","10.1021/ic7016159","","","0.71073","MoKα","","0.1111","0.0787","","","0.2338","0.2489","","","","","","1.063","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333482","31.16","0.015","13.208","0.007","34.044","0.017","90","","114.487","0.008","90","","12751","11","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","MOF-In/AgOTf-1b","","","- C43 H30 Ag F3 In N9 O3 S -","- C43 H30 Ag F3 In N9 O3 S -","- C344 H240 Ag8 F24 In8 N72 O24 S8 -","8","1","","Stork, Jay R.; Thoi, Van S.; Cohen, Seth M.","Rare Examples of Transition-Metal−Main-Group Metal Heterometallic Metal−Organic Frameworks from Gallium and Indium Dipyrrinato Complexes and Silver Salts: Synthesis and Framework Variability","Inorganic Chemistry","2007","46","26","11213","11223","10.1021/ic7016159","","","0.71073","MoKα","","0.1156","0.0828","","","0.1978","0.21","","","","","","0.996","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333483","27.172","0.018","12.563","0.008","33.7","0.02","90","","90","","90","","11504","13","100","2","100","2","","","","","","","","7","P b c n","-P 2n 2ab","60","MOF-Ga/AgPF~6~-1d","","","- C42 H30 Ag F6 Ga N9 P -","- C42 H30 Ag F6 Ga N9 P -","- C336 H240 Ag8 F48 Ga8 N72 P8 -","8","1","","Stork, Jay R.; Thoi, Van S.; Cohen, Seth M.","Rare Examples of Transition-Metal−Main-Group Metal Heterometallic Metal−Organic Frameworks from Gallium and Indium Dipyrrinato Complexes and Silver Salts: Synthesis and Framework Variability","Inorganic Chemistry","2007","46","26","11213","11223","10.1021/ic7016159","","","0.71073","MoKα","","0.1084","0.0713","","","0.1875","0.2013","","","","","","0.977","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333484","9.3464","0.0007","7.1262","0.0005","16.112","0.0011","90","","92.993","0.003","90","","1071.66","0.13","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","meso-(4-pyridyl)dipyrrin","","","- C14 H11 N3 -","- C14 H11 N3 -","- C56 H44 N12 -","4","1","","Stork, Jay R.; Thoi, Van S.; Cohen, Seth M.","Rare Examples of Transition-Metal−Main-Group Metal Heterometallic Metal−Organic Frameworks from Gallium and Indium Dipyrrinato Complexes and Silver Salts: Synthesis and Framework Variability","Inorganic Chemistry","2007","46","26","11213","11223","10.1021/ic7016159","","","1.54178","CuKα","","0.0342","0.0329","","","0.0901","0.0912","","","","","","1.03","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333485","13.285","0.004","16.707","0.005","27.366","0.008","84.264","0.006","85.449","0.007","80.949","0.009","5956","3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","MOF-In/AgPF~6~-1","","","- C85 H60 Ag2 F12 In2 N18.75 P2 -","- C85 H60 Ag2 F12 In2 N18.75 P2 -","- C170 H120 Ag4 F24 In4 N37.5 P4 -","2","1","","Stork, Jay R.; Thoi, Van S.; Cohen, Seth M.","Rare Examples of Transition-Metal−Main-Group Metal Heterometallic Metal−Organic Frameworks from Gallium and Indium Dipyrrinato Complexes and Silver Salts: Synthesis and Framework Variability","Inorganic Chemistry","2007","46","26","11213","11223","10.1021/ic7016159","","","0.71073","MoKα","","0.0813","0.0532","","","0.145","0.1562","","","","","","1.018","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333486","27.062","0.007","13.006","0.003","33.486","0.008","90","","90","","90","","11786","5","208","2","208","2","","","","","","","","7","P b c n","-P 2n 2ab","60","MOF-Co/AgPF~6~-1b","","","- C42 H30 Ag Co F6 N9 P -","- C42 H30 Ag Co F6 N9 P -","- C336 H240 Ag8 Co8 F48 N72 P8 -","8","1","","Stork, Jay R.; Thoi, Van S.; Cohen, Seth M.","Rare Examples of Transition-Metal−Main-Group Metal Heterometallic Metal−Organic Frameworks from Gallium and Indium Dipyrrinato Complexes and Silver Salts: Synthesis and Framework Variability","Inorganic Chemistry","2007","46","26","11213","11223","10.1021/ic7016159","","","0.71073","MoKα","","0.1259","0.0801","","","0.2163","0.2387","","","","","","0.894","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333487","30.705","0.006","12.857","0.003","33.146","0.007","90","","116.457","0.003","90","","11715","4","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","MOF-Ga/AgPF~6~-1b","","","- C42 H30 Ag F4 Ga N9 P -","- C42 H30 Ag F4 Ga N9 P -","- C336 H240 Ag8 F32 Ga8 N72 P8 -","8","1","","Stork, Jay R.; Thoi, Van S.; Cohen, Seth M.","Rare Examples of Transition-Metal−Main-Group Metal Heterometallic Metal−Organic Frameworks from Gallium and Indium Dipyrrinato Complexes and Silver Salts: Synthesis and Framework Variability","Inorganic Chemistry","2007","46","26","11213","11223","10.1021/ic7016159","","","0.71073","MoKα","","0.085","0.0505","","","0.1173","0.128","","","","","","0.893","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333488","13.339","0.003","16.06","0.004","16.38","0.004","108.941","0.004","98.464","0.004","111.852","0.004","2933.5","1.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","MOF-Ga/AgSbF~6~-1","","","- C43.85 H30 Ag F6 Ga N9.7 Sb -","- C43.85 H30 Ag F6 Ga N9.7 Sb -","- C87.7 H60 Ag2 F12 Ga2 N19.4 Sb2 -","2","1","","Stork, Jay R.; Thoi, Van S.; Cohen, Seth M.","Rare Examples of Transition-Metal−Main-Group Metal Heterometallic Metal−Organic Frameworks from Gallium and Indium Dipyrrinato Complexes and Silver Salts: Synthesis and Framework Variability","Inorganic Chemistry","2007","46","26","11213","11223","10.1021/ic7016159","","","0.71073","MoKα","","0.0854","0.0642","","","0.1795","0.1905","","","","","","1.071","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333489","33.3744","0.0017","66.686","0.003","14.9678","0.0008","90","","110.058","0.001","90","","31292","3","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","MOF-Ga/AgOTf-1b prime","","","- C43.19 H30 Ag F3 Ga N9.1 O3 S -","- C43.1933 H30 Ag F3 Ga N9.09667 O3 S -","- C1036.64 H720 Ag24 F72 Ga24 N218.32 O72 S24 -","24","3","","Stork, Jay R.; Thoi, Van S.; Cohen, Seth M.","Rare Examples of Transition-Metal−Main-Group Metal Heterometallic Metal−Organic Frameworks from Gallium and Indium Dipyrrinato Complexes and Silver Salts: Synthesis and Framework Variability","Inorganic Chemistry","2007","46","26","11213","11223","10.1021/ic7016159","","","0.71073","MoKα","","0.0881","0.0496","","","0.1096","0.1202","","","","","","0.87","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4333490","31.835","0.003","12.8637","0.0012","33.715","0.003","90","","115.343","0.001","90","","12478","2","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","MOF-In/AgPF~6~-1b","","","- C42 H30 Ag F6 In N9 P -","- C42 H30 Ag F6 In N9 P -","- C336 H240 Ag8 F48 In8 N72 P8 -","8","1","","Stork, Jay R.; Thoi, Van S.; Cohen, Seth M.","Rare Examples of Transition-Metal−Main-Group Metal Heterometallic Metal−Organic Frameworks from Gallium and Indium Dipyrrinato Complexes and Silver Salts: Synthesis and Framework Variability","Inorganic Chemistry","2007","46","26","11213","11223","10.1021/ic7016159","","","0.71073","MoKα","","0.0864","0.0621","","","0.1775","0.1917","","","","","","0.947","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333491","10.105","0.0006","20.162","0.001","20.186","0.001","90","","102.732","0.001","90","","4011.5","0.4","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C47 H31 Cl2 N O4 P2 S2 -","- C47 H31 Cl2 N O4 P2 S2 -","- C188 H124 Cl8 N4 O16 P8 S8 -","4","1","","Punji, Benudhar; Mague, Joel T.; Balakrishna, Maravanji S.","Highly Air-Stable Anionic Mononuclear and Neutral Binuclear Palladium(II) Complexes for C−C and C−N Bond-Forming Reactions","Inorganic Chemistry","2007","46","26","11316","11327","10.1021/ic701674x","","","0.71073","MoKα","","0.0755","0.0563","","","0.1336","0.1451","","","","","","1.027","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333492","13.854","0.002","17.168","0.002","21.344","0.003","80.24","0.01","72.42","0.01","74.73","0.01","4646.2","1.1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C87 H55 Cl4 N O11 P4 Pd2 S4 -","- C87 H55 Cl4 N O11 P4 Pd2 S4 -","- C174 H110 Cl8 N2 O22 P8 Pd4 S8 -","2","1","","Punji, Benudhar; Mague, Joel T.; Balakrishna, Maravanji S.","Highly Air-Stable Anionic Mononuclear and Neutral Binuclear Palladium(II) Complexes for C−C and C−N Bond-Forming Reactions","Inorganic Chemistry","2007","46","26","11316","11327","10.1021/ic701674x","","","0.71073","MoKα","","0.1589","0.0747","","","0.1842","0.2097","","","","","","0.889","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333493","8.2069","0.0007","12.61","0.001","15.004","0.001","101.169","0.001","101.788","0.001","97.862","0.001","1465.9","0.2","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C27 H30 Cl4 N O3 P Pd S -","- C27 H30 Cl4 N O3 P Pd S -","- C54 H60 Cl8 N2 O6 P2 Pd2 S2 -","2","1","","Punji, Benudhar; Mague, Joel T.; Balakrishna, Maravanji S.","Highly Air-Stable Anionic Mononuclear and Neutral Binuclear Palladium(II) Complexes for C−C and C−N Bond-Forming Reactions","Inorganic Chemistry","2007","46","26","11316","11327","10.1021/ic701674x","","","0.71073","MoKα","","0.0298","0.0278","","","0.0681","0.0694","","","","","","1.038","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333494","18.068","0.002","11.882","0.001","23.402","0.002","90","","111.127","0.001","90","","4686.3","0.8","100","2","100","2","","","","","","","","8","P 1 2/n 1","-P 2yac","13","","","","- C47 H29 I2 N O4.25 P2 Pt S2 -","- C47 H29 I2 N O4.25 P2 Pt S2 -","- C188 H116 I8 N4 O17 P8 Pt4 S8 -","4","1","","Punji, Benudhar; Mague, Joel T.; Balakrishna, Maravanji S.","Highly Air-Stable Anionic Mononuclear and Neutral Binuclear Palladium(II) Complexes for C−C and C−N Bond-Forming Reactions","Inorganic Chemistry","2007","46","26","11316","11327","10.1021/ic701674x","","","0.71073","MoKα","","0.0503","0.0414","","","0.0925","0.0957","","","","","","1.141","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333495","5.8854","0.0012","11.014","0.002","10.227","0.002","90","","105.99","0.03","90","","637.3","0.2","298","2","298","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- F9 H2.8 K3.3 N0.7 O4 P Ti2 -","- F9 H2.8 K3.3 N0.7 O4 P Ti2 -","- F18 H5.6 K6.6 N1.4 O8 P2 Ti4 -","2","0.5","","Yang, Sihai; Li, Guobao; Li, Lei; Tian, Shujian; Liao, Fuhui; Xiong, Ming; Lin, Jianhua","Syntheses and Structural Characterization of a Series of One-Dimensional Fluorotitanophosphates (NH4)xK4 - x[Ti2PO4F9] (x= 0, 0.70, 1.00, 1.25)","Inorganic Chemistry","2007","46","26","11431","11436","10.1021/ic701715k","","","0.71073","MoKα","","0.0502","0.0474","","","0.1245","0.1261","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4333496","5.8777","0.0012","10.991","0.002","10.219","0.002","90","","106.04","0.03","90","","634.5","0.2","298","2","298","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- F9 H4 K3 N O4 P Ti2 -","- F9 H4 K3 N O4 P Ti2 -","- F18 H8 K6 N2 O8 P2 Ti4 -","2","0.5","","Yang, Sihai; Li, Guobao; Li, Lei; Tian, Shujian; Liao, Fuhui; Xiong, Ming; Lin, Jianhua","Syntheses and Structural Characterization of a Series of One-Dimensional Fluorotitanophosphates (NH4)xK4 - x[Ti2PO4F9] (x= 0, 0.70, 1.00, 1.25)","Inorganic Chemistry","2007","46","26","11431","11436","10.1021/ic701715k","","","0.71073","MoKα","","0.0403","0.036","","","0.0881","0.0905","","","","","","1","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333497","5.8962","0.0012","11.011","0.002","10.252","0.002","90","","106.1","0.03","90","","639.5","0.2","298","2","298","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- F9 H5 K2.75 N1.25 O4 P Ti2 -","- F9 H5 K2.754 N1.246 O4 P Ti2 -","- F18 H10 K5.508 N2.492 O8 P2 Ti4 -","2","0.5","","Yang, Sihai; Li, Guobao; Li, Lei; Tian, Shujian; Liao, Fuhui; Xiong, Ming; Lin, Jianhua","Syntheses and Structural Characterization of a Series of One-Dimensional Fluorotitanophosphates (NH4)xK4 - x[Ti2PO4F9] (x= 0, 0.70, 1.00, 1.25)","Inorganic Chemistry","2007","46","26","11431","11436","10.1021/ic701715k","","","0.71073","MoKα","","0.0344","0.0308","","","0.0802","0.0824","","","","","","1","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4333498","13.033","0.003","20.015","0.004","13.697","0.003","90","","91.55","0.03","90","","3571.6","1.3","150","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 K2 N8 O17 Pt -","- C20 H19 K2 N8 O17 Pt -","- C80 H76 K8 N32 O68 Pt4 -","4","1","","Holland, Lars; Shen, Wei-Zheng; Micklitz, Wolfgang; Lippert, Bernhard","Tetrakis- and Tris(1-Methyluracil) Complexes of PtII: Formation and Properties of a Carbon-Bonded Nucleobase Species as Well as of Heternonuclear Derivatives","Inorganic Chemistry","2007","46","26","11356","11365","10.1021/ic701768a","","","0.71073","MoKα","","","0.0454","","","","0.1038","","","","","","0.838","","","","has coordinates,has disorder","179437","2020-10-21","18:00:00",""
"4333499","7.874","0.0016","14.403","0.003","24.386","0.005","90","","90.67","0.03","90","","2765.4","1","150","2","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H15 Cl Cu N6 O8 Pt -","- C15 H15 Cl Cu N6 O8 Pt -","- C60 H60 Cl4 Cu4 N24 O32 Pt4 -","4","1","","Holland, Lars; Shen, Wei-Zheng; Micklitz, Wolfgang; Lippert, Bernhard","Tetrakis- and Tris(1-Methyluracil) Complexes of PtII: Formation and Properties of a Carbon-Bonded Nucleobase Species as Well as of Heternonuclear Derivatives","Inorganic Chemistry","2007","46","26","11356","11365","10.1021/ic701768a","","","0.71073","MoKα","","","0.0476","","","","0.0889","","","","","","0.801","","","","has coordinates","179437","2020-10-21","18:00:00",""
"4338840","9.8489","0.0001","9.8489","0.0001","11.0567","0.0002","90","","90","","120","","928.82","0.02","573","","573","","","","","","","","","3","R -3","-R 3","148","Chevrel phase","zinc dihydroxide divanadate dihydrate","","- Mg3 Mo18 Se24 -","- Mg3.00006 Mo18 Se24 -","- Mg3.00006 Mo18 Se24 -","1","","","Levi, E.; Mitelman, A.; Aurbach, D.; Isnard, O.","On the mechanism of triclinic distortion in Chevrel Phase as probed by in-situ neutron diffraction.","Inorganic chemistry","2007","46","18","7528","7535","10.1021/ic7008573","powder diffraction","","1.9106","neutron","","","","","","","","","3.905","3.0527","","","","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338841","8.535","0.008","13.3","0.012","13.522","0.013","90","","90.588","0.016","90","","1535","2","115","2","115","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- H20 Mn2 N10 S4 Sn -","- H20 Mn2 N10 S4 Sn -","- H80 Mn8 N40 S16 Sn4 -","4","1","","Yuan, Min; Dirmyer, Matthew; Badding, John; Sen, Ayusman; Dahlberg, Maria; Schiffer, Peter","Controlled assembly of zero-, one-, two-, and three-dimensional metal chalcogenide structures.","Inorganic chemistry","2007","46","18","7238","7240","10.1021/ic7007107","","","0.71073","MoKα","","0.0852","0.0844","","","0.2068","0.2071","","","","","","1.315","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338842","10.304","0.004","13.182","0.005","18.27","0.007","90","","97.657","0.007","90","","2459.4","1.6","115","2","115","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- H40 Mn2 N20 Se4 Sn -","- H40 Mn2 N20 Se4 Sn -","- H160 Mn8 N80 Se16 Sn4 -","4","1","","Yuan, Min; Dirmyer, Matthew; Badding, John; Sen, Ayusman; Dahlberg, Maria; Schiffer, Peter","Controlled assembly of zero-, one-, two-, and three-dimensional metal chalcogenide structures.","Inorganic chemistry","2007","46","18","7238","7240","10.1021/ic7007107","","","0.71073","MoKα","","0.0397","0.0334","","","0.0745","0.0765","","","","","","1.111","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338843","12.919","0.003","8.9345","0.0019","15.23","0.003","90","","106.992","0.004","90","","1681.2","0.6","115","2","115","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- H24 Mn2 N12 S4 Sn -","- H24 Mn2 N12 S4 Sn -","- H96 Mn8 N48 S16 Sn4 -","4","0.5","","Yuan, Min; Dirmyer, Matthew; Badding, John; Sen, Ayusman; Dahlberg, Maria; Schiffer, Peter","Controlled assembly of zero-, one-, two-, and three-dimensional metal chalcogenide structures.","Inorganic chemistry","2007","46","18","7238","7240","10.1021/ic7007107","","","0.71073","MoKα","","0.015","0.0145","","","0.0364","0.0366","","","","","","1.124","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338844","8.1029","0.0019","9.879","0.002","13.021","0.003","95.008","0.004","94.423","0.004","113.425","0.004","945.6","0.4","115","2","115","2","","","","","","","","5","P -1","-P 1","2","","","","- H28 Mn2 N14 Se4 Sn -","- H28 Mn2 N14 Se4 Sn -","- H56 Mn4 N28 Se8 Sn2 -","2","1","","Yuan, Min; Dirmyer, Matthew; Badding, John; Sen, Ayusman; Dahlberg, Maria; Schiffer, Peter","Controlled assembly of zero-, one-, two-, and three-dimensional metal chalcogenide structures.","Inorganic chemistry","2007","46","18","7238","7240","10.1021/ic7007107","","","0.71073","MoKα","","0.0513","0.0493","","","0.1343","0.1356","","","","","","1.049","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338845","22.6139","0.0009","17.1826","0.0008","17.2375","0.0006","90","","102.419","0.003","90","","6541.2","0.5","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C64 H100 Al2 N6 O2 Zr -","- C64 H100 Al2 N6 O2 Zr -","- C256 H400 Al8 N24 O8 Zr4 -","4","1","","Mandal, Swadhin K.; Gurubasavaraj, Prabhuodeyara M.; Roesky, Herbert W.; Oswald, Rainer B.; Magull, Jörg; Ringe, Arne","Synthesis, structural characterization, and theoretical investigation of compounds containing an Al-O-M-O-Al (M=Ti, Zr) core.","Inorganic chemistry","2007","46","18","7594","7600","10.1021/ic701063v","","","0.71073","MoKα","","0.0647","0.0373","","","0.0744","0.081","","","","","","0.967","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338846","22.6235","0.0009","17.1285","0.0004","17.1933","0.0005","90","","103.433","0.003","90","","6480.2","0.4","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C64 H100 Al2 N6 O2 Ti -","- C64 H100 Al2 N6 O2 Ti -","- C256 H400 Al8 N24 O8 Ti4 -","4","1","","Mandal, Swadhin K.; Gurubasavaraj, Prabhuodeyara M.; Roesky, Herbert W.; Oswald, Rainer B.; Magull, Jörg; Ringe, Arne","Synthesis, structural characterization, and theoretical investigation of compounds containing an Al-O-M-O-Al (M=Ti, Zr) core.","Inorganic chemistry","2007","46","18","7594","7600","10.1021/ic701063v","","","0.71073","MoKα","","0.062","0.0395","","","0.091","0.0977","","","","","","0.966","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338847","16.054","0.005","8.947","0.003","15.282","0.005","90","","90","","90","","2195","1.2","110","","110","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C9 H14 N2 Ni O2 S2 -","- C9 H14 N2 Ni O2 S2 -","- C72 H112 N16 Ni8 O16 S16 -","8","1","","Green, Kayla N.; Brothers, Scott M.; Jenkins, Roxanne M.; Carson, Cody E.; Grapperhaus, Craig A.; Darensbourg, Marcetta Y.","An experimental and computational study of sulfur-modified nucleophilicity in a dianionic NiN2S2 complex.","Inorganic chemistry","2007","46","18","7536","7544","10.1021/ic700878y","","","0.71073","MoKα","","0.0301","0.0246","","","0.0601","0.0619","","","","","","0.97","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338848","10.1135","0.0006","10.1135","0.0006","52.752","0.005","90","","90","","90","","5395.6","0.7","110","2","110","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C22 H48 N4 Ni O4 S2 -","- C22 H48 N4 Ni O4 S2 -","- C176 H384 N32 Ni8 O32 S16 -","8","1","","Green, Kayla N.; Brothers, Scott M.; Jenkins, Roxanne M.; Carson, Cody E.; Grapperhaus, Craig A.; Darensbourg, Marcetta Y.","An experimental and computational study of sulfur-modified nucleophilicity in a dianionic NiN2S2 complex.","Inorganic chemistry","2007","46","18","7536","7544","10.1021/ic700878y","","","0.71073","MoKα","","0.0642","0.0597","","","0.1571","0.1619","","","","","","1.04","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338849","10.764","0.002","18.894","0.004","22.199","0.004","90","","98.135","0.013","90","","4469.3","1.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","PNCu(PPh3)2","","","- C54 H53 Cu N P3 -","- C54 H53 Cu N P3 -","- C216 H212 Cu4 N4 P12 -","4","1","","Miller, Alexander J. M.; Dempsey, Jillian L.; Peters, Jonas C.","Long-lived and efficient emission from mononuclear amidophosphine complexes of copper.","Inorganic chemistry","2007","46","18","7244","7246","10.1021/ic7009513","","","0.71073","MoKα","","0.0878","0.0469","","","0.0704","0.0757","","","","","","1.309","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338850","9.9195","0.0004","16.3588","0.0007","16.5646","0.0007","90","","90","","90","","2687.96","0.19","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","PNCu(PMe3)2","","","- C24 H41 Cu N P3 -","- C24 H41 Cu N P3 -","- C96 H164 Cu4 N4 P12 -","4","1","","Miller, Alexander J. M.; Dempsey, Jillian L.; Peters, Jonas C.","Long-lived and efficient emission from mononuclear amidophosphine complexes of copper.","Inorganic chemistry","2007","46","18","7244","7246","10.1021/ic7009513","","","0.71073","MoKα","","0.0734","0.0424","","","0.0615","0.066","","","","","","1.07","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338851","11.099","0.004","21.513","0.007","21.933","0.006","90","","103.72","0.03","90","","5088","3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[MePN]Cu(PPh3)2","","","- C59 H65 Cu N O P3 -","- C59 H65 Cu N O P3 -","- C236 H260 Cu4 N4 O4 P12 -","4","1","","Miller, Alexander J. M.; Dempsey, Jillian L.; Peters, Jonas C.","Long-lived and efficient emission from mononuclear amidophosphine complexes of copper.","Inorganic chemistry","2007","46","18","7244","7246","10.1021/ic7009513","","","0.71073","MoKα","","0.0732","0.0497","","","0.0938","0.0974","","","","","","1.589","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338852","11.101","0.016","21.7","0.05","22.3","0.04","90","","103.11","0.07","90","","5232","17","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","[CF3PN]Cu(PPh3)2","","","- C59 H62 Cu F3 N O P3 -","- C59 H62 Cu F3 N O P3 -","- C236 H248 Cu4 F12 N4 O4 P12 -","4","1","","Miller, Alexander J. M.; Dempsey, Jillian L.; Peters, Jonas C.","Long-lived and efficient emission from mononuclear amidophosphine complexes of copper.","Inorganic chemistry","2007","46","18","7244","7246","10.1021/ic7009513","","","0.71073","MoKα","","0.1176","0.0617","","","0.1007","0.1078","","","","","","1.32","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338853","10.8189","0.0005","19.1162","0.0008","22.2135","0.0009","90","","97.254","0.001","90","","4557.3","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","PNAg(PPh3)2","","","- C54 H53 Ag N P3 -","- C54 H53 Ag N P3 -","- C216 H212 Ag4 N4 P12 -","4","1","","Miller, Alexander J. M.; Dempsey, Jillian L.; Peters, Jonas C.","Long-lived and efficient emission from mononuclear amidophosphine complexes of copper.","Inorganic chemistry","2007","46","18","7244","7246","10.1021/ic7009513","","","0.71073","MoKα","","0.0585","0.0378","","","0.0629","0.0662","","","","","","1.446","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338854","21.074","0.014","8.729","0.006","19.086","0.013","90","","110.905","0.014","90","","3280","4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","PN2Zn","","","- C36 H46 N2 P2 Zn -","- C36 H46 N2 P2 Zn -","- C144 H184 N8 P8 Zn4 -","4","0.5","","Miller, Alexander J. M.; Dempsey, Jillian L.; Peters, Jonas C.","Long-lived and efficient emission from mononuclear amidophosphine complexes of copper.","Inorganic chemistry","2007","46","18","7244","7246","10.1021/ic7009513","","","0.71073","MoKα","","0.0791","0.0451","","","0.0713","0.0752","","","","","","1.39","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338855","10.0983","0.0004","12.338","0.0005","13.4727","0.0006","91.152","0.001","103.777","0.001","100.701","0.001","1598.31","0.12","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H66 N6 O10 Sn4 -","- C62 H66 N6 O10 Sn4 -","- C62 H66 N6 O10 Sn4 -","1","0.5","","Gerasimchuk, Nikolay; Maher, Tiffany; Durham, Paul; Domasevitch, Konstantin V.; Wilking, Janet; Mokhir, Andrew","Tin(IV) cyanoximates: synthesis, characterization, and cytotoxicity.","Inorganic chemistry","2007","46","18","7268","7284","10.1021/ic061354f","","","0.71073","MoKα","","0.0398","0.0322","","","0.0777","0.0821","","","","","","1.139","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338856","24.7571","0.0015","22.4751","0.0014","9.7846","0.0006","90","","100.217","0.001","90","","5358","0.6","220","2","220","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H78 N6 O8 Sn4 -","- C14 H6 N6 O8 Sn4 -","- C56 H24 N24 O32 Sn16 -","4","0.5","","Gerasimchuk, Nikolay; Maher, Tiffany; Durham, Paul; Domasevitch, Konstantin V.; Wilking, Janet; Mokhir, Andrew","Tin(IV) cyanoximates: synthesis, characterization, and cytotoxicity.","Inorganic chemistry","2007","46","18","7268","7284","10.1021/ic061354f","","","0.71073","MoKα","","0.0706","0.0531","","","0.1607","0.173","","","","","","1.074","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338857","8.295","0.002","7.332","0.001","11.095","0.002","90","","100.12","0.03","90","","664.3","0.2","223","2","223","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C9 H13 N3 O S Sn -","- C9 H13 N3 O S Sn -","- C18 H26 N6 O2 S2 Sn2 -","2","1","","Gerasimchuk, Nikolay; Maher, Tiffany; Durham, Paul; Domasevitch, Konstantin V.; Wilking, Janet; Mokhir, Andrew","Tin(IV) cyanoximates: synthesis, characterization, and cytotoxicity.","Inorganic chemistry","2007","46","18","7268","7284","10.1021/ic061354f","","","0.71073","MoKα","","0.0302","0.0263","","","0.0724","0.0745","","","","","","1.08","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338858","12.3052","0.0004","21.7989","0.0005","14.8634","0.0006","90","","92.15","0.002","90","","3984.1","0.2","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C80 H112 Ca4 N8 O8 -","- C80 H112 Ca4 N8 O8 -","- C160 H224 Ca8 N16 O16 -","2","0.5","","Gärtner, Martin; Görls, Helmar; Westerhausen, Matthias","Synthesis and molecular structures of phenylamides of magnesium, calcium, strontium, and barium‒from molecular to polymeric structures.","Inorganic chemistry","2007","46","18","7678","7683","10.1021/ic7010524","","","0.71073","MoKα","","0.0943","0.0545","","","0.127","0.1481","","","","","","1.01","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338859","10.935","0.002","23.084","0.005","25.096","0.005","90","","93.46","0.03","90","","6323","2","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H28 N2 O2 Sr -","- C20 H28 N2 O2 Sr -","- C240 H336 N24 O24 Sr12 -","12","3","","Gärtner, Martin; Görls, Helmar; Westerhausen, Matthias","Synthesis and molecular structures of phenylamides of magnesium, calcium, strontium, and barium‒from molecular to polymeric structures.","Inorganic chemistry","2007","46","18","7678","7683","10.1021/ic7010524","","","0.71073","MoKα","","0.0897","0.0518","","","0.1257","0.1435","","","","","","1.03","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338860","12.0064","0.0007","14.4655","0.0007","14.7707","0.0009","99.935","0.003","103.939","0.003","98.784","0.003","2401.3","0.2","183","2","183","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H58 Ba2 N4 O4.25 -","- C41 H58 Ba2 N4 O4.25 -","- C82 H116 Ba4 N8 O8.5 -","2","1","","Gärtner, Martin; Görls, Helmar; Westerhausen, Matthias","Synthesis and molecular structures of phenylamides of magnesium, calcium, strontium, and barium‒from molecular to polymeric structures.","Inorganic chemistry","2007","46","18","7678","7683","10.1021/ic7010524","","","0.71073","MoKα","","0.0936","0.0559","","","0.1407","0.1643","","","","","","1.039","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338861","22.438","0.005","24.895","0.005","39.019","0.008","90","","90","","90","","21796","8","120","2","210","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C183 H164 Au18 Cl9 P19 -","- C183 H164 Au18 Cl9 P19 -","- C732 H656 Au72 Cl36 P76 -","4","0.5","","Sevillano, Paloma; Fuhr, Olaf; Hampe, Oliver; Lebedkin, Sergej; Matern, Eberhard; Fenske, Dieter; Kappes, Manfred M.","Synthesis, characterization, and X-ray structure determination of [Au18(P)2(PPh)4(PHPh)(dppm)6]Cl3.","Inorganic chemistry","2007","46","18","7294","7298","10.1021/ic062107e","","","0.71073","MoKα","","0.0558","0.0534","","","0.1467","0.1491","","","","","","1.128","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338862","12.5043","0.001","13.0229","0.0012","15.5065","0.0015","69.468","0.002","75.945","0.002","69.019","0.002","2188","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H4 B2 Br18 Cl2 Cu N12 -","- C19 H4 B2 Br18 Cl2 Cu N12 -","- C38 H8 B4 Br36 Cl4 Cu2 N24 -","2","1","","Mairena, Miguel A.; Urbano, Juan; Carbajo, José; Maraver, J Joaquín; Alvarez, Eleuterio; Díaz-Requejo, M Mar; Pérez, Pedro J","Effects of the substituents in the TpxCu activation of dioxygen: an experimental study.","Inorganic chemistry","2007","46","18","7428","7435","10.1021/ic7007073","","","0.71073","MoKα","","0.0831","0.0588","","","0.1494","0.1642","","","","","","1.07","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338863","12.31","0.004","24.837","0.007","16.479","0.005","90","","103.257","0.009","90","","4904","3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C49 H68 B2 Cu2 N12 O3 -","- C49 H68 B2 Cu2 N12 O3 -","- C196 H272 B8 Cu8 N48 O12 -","4","1","","Mairena, Miguel A.; Urbano, Juan; Carbajo, José; Maraver, J Joaquín; Alvarez, Eleuterio; Díaz-Requejo, M Mar; Pérez, Pedro J","Effects of the substituents in the TpxCu activation of dioxygen: an experimental study.","Inorganic chemistry","2007","46","18","7428","7435","10.1021/ic7007073","","","0.71073","MoKα","","0.0962","0.0735","","","0.1933","0.2128","","","","","","1.044","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338864","13.306","0.0009","14.513","0.0011","24.3521","0.0018","90","","103.797","0.002","90","","4566.9","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H59 B2 Cu2 N13 O3 -","- C45 H59 B2 Cu2 N13 O3 -","- C180 H236 B8 Cu8 N52 O12 -","4","1","","Mairena, Miguel A.; Urbano, Juan; Carbajo, José; Maraver, J Joaquín; Alvarez, Eleuterio; Díaz-Requejo, M Mar; Pérez, Pedro J","Effects of the substituents in the TpxCu activation of dioxygen: an experimental study.","Inorganic chemistry","2007","46","18","7428","7435","10.1021/ic7007073","","","0.71073","MoKα","","0.0678","0.043","","","0.1091","0.1196","","","","","","1.051","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338865","10.0429","0.0008","21.886","0.0018","17.025","0.0014","90","","90.843","0.001","90","","3741.7","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H52 Fe2 N4 Si4 U -","- C32 H52 Fe2 N4 Si4 U -","- C128 H208 Fe8 N16 Si16 U4 -","4","1","","Monreal, Marisa J.; Carver, Colin T.; Diaconescu, Paula L.","Redox processes in a uranium bis(1,1'-diamidoferrocene) complex.","Inorganic chemistry","2007","46","18","7226","7228","10.1021/ic700457h","","","0.71073","MoKα","","0.0574","0.0319","","","0.0589","0.065","","","","","","1.007","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338866","31.1991","0.0013","32.9655","0.0013","28.3521","0.0011","90","","90","","90","","29160","2","100","2","100","2","","","","","","","","8","P c c n","-P 2ab 2ac","56","","","","- C138 H192 B2 Cl4 Fe4 N8 Si8 U2 -","- C138 H192 B2 Cl4 Fe4 N8 Si8 U2 -","- C1104 H1536 B16 Cl32 Fe32 N64 Si64 U16 -","8","1","","Monreal, Marisa J.; Carver, Colin T.; Diaconescu, Paula L.","Redox processes in a uranium bis(1,1'-diamidoferrocene) complex.","Inorganic chemistry","2007","46","18","7226","7228","10.1021/ic700457h","","","0.71073","MoKα","","0.0599","0.0346","","","0.0865","0.0927","","","","","","1.163","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338867","13.271","0.003","14.427","0.003","14.477","0.003","90","","90","","90","","2771.8","1","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C11 H14 Ag N3 O4 S -","- C11 H14 Ag N3 O4 S -","- C88 H112 Ag8 N24 O32 S8 -","8","1","","Liu, Hai-Yan; Wu, Hua; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min","Structural study of silver(I) sulfonate complexes with pyrazine derivatives.","Inorganic chemistry","2007","46","18","7299","7311","10.1021/ic070147s","","","0.71073","MoKα","","0.0566","0.0381","","","0.0974","0.1035","","","","","","1.055","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338868","7.0778","0.0014","14.533","0.003","12.958","0.003","90","","93.24","0.03","90","","1330.8","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 Ag N3 O3 S -","- C12 H14 Ag N3 O3 S -","- C48 H56 Ag4 N12 O12 S4 -","4","1","","Liu, Hai-Yan; Wu, Hua; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min","Structural study of silver(I) sulfonate complexes with pyrazine derivatives.","Inorganic chemistry","2007","46","18","7299","7311","10.1021/ic070147s","","","0.71073","MoKα","","0.0311","0.0279","","","0.0694","0.0706","","","","","","1.13","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4338869","13.518","0.003","14.308","0.003","7.7796","0.0016","90","","90","","90","","1504.7","0.6","293","2","293","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C26 H34 Ag2 N6 O7 S2 -","- C26 H32 Ag2 N6 O7 S2 -","- C52 H64 Ag4 N12 O14 S4 -","2","0.5","","Liu, Hai-Yan; Wu, Hua; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min","Structural study of silver(I) sulfonate complexes with pyrazine derivatives.","Inorganic chemistry","2007","46","18","7299","7311","10.1021/ic070147s","","","0.71073","MoKα","","0.0472","0.0417","","","0.0975","0.0996","","","","","","1.075","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338870","13.482","0.003","14.254","0.003","16.552","0.003","90","","107.99","0.03","90","","3025.3","1.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H17 Ag N3 O4.5 S -","- C12 H17 Ag N3 O4.5 S -","- C96 H136 Ag8 N24 O36 S8 -","8","1","","Liu, Hai-Yan; Wu, Hua; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min","Structural study of silver(I) sulfonate complexes with pyrazine derivatives.","Inorganic chemistry","2007","46","18","7299","7311","10.1021/ic070147s","","","0.71073","MoKα","","0.04","0.034","","","0.0924","0.0949","","","","","","1.126","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4338871","8.6401","0.0017","7.4461","0.0015","10.576","0.002","90","","95.9","0.03","90","","676.8","0.2","293","2","293","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C12 H14 Ag N3 O3 S -","- C12 H14 Ag N3 O3 S -","- C24 H28 Ag2 N6 O6 S2 -","2","1","","Liu, Hai-Yan; Wu, Hua; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min","Structural study of silver(I) sulfonate complexes with pyrazine derivatives.","Inorganic chemistry","2007","46","18","7299","7311","10.1021/ic070147s","","","0.71073","MoKα","","0.0214","0.0209","","","0.0516","0.0518","","","","","","1.111","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338872","8.878","0.0011","9.014","0.0011","9.558","0.0012","90","0.0019","116.99","0.0016","90","0.0019","681.58","0.15","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C10 H14 Ag N O6 S -","- C10 H14 Ag N O6 S -","- C20 H28 Ag2 N2 O12 S2 -","2","1","","Liu, Hai-Yan; Wu, Hua; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min","Structural study of silver(I) sulfonate complexes with pyrazine derivatives.","Inorganic chemistry","2007","46","18","7299","7311","10.1021/ic070147s","","","0.71073","MoKα","","0.0445","0.033","","","0.0893","0.1411","","","","","","1.002","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338873","9.1193","0.0018","6.8496","0.0014","24.826","0.005","90","","90.4","0.03","90","","1550.7","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 Ag N3 O3 S -","- C15 H14 Ag N3 O3 S -","- C60 H56 Ag4 N12 O12 S4 -","4","1","","Liu, Hai-Yan; Wu, Hua; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min","Structural study of silver(I) sulfonate complexes with pyrazine derivatives.","Inorganic chemistry","2007","46","18","7299","7311","10.1021/ic070147s","","","0.71073","MoKα","","0.0441","0.0284","","","0.076","0.0896","","","","","","1.069","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338874","21.949","0.007","21.949","0.007","20.22","0.005","90","","90","","120","","8436","4","293","2","293","2","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","","","- C16 H19 Ag N3 O4.5 S -","- C16 H16 Ag N3 O4.5 S -","- C288 H288 Ag18 N54 O81 S18 -","18","1","","Liu, Hai-Yan; Wu, Hua; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min","Structural study of silver(I) sulfonate complexes with pyrazine derivatives.","Inorganic chemistry","2007","46","18","7299","7311","10.1021/ic070147s","","","0.71069","MoKα","","0.0342","0.0312","","","0.0869","0.0888","","","","","","1.082","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4338875","21.902","0.003","21.902","0.003","20.776","0.004","90","","90","","120","","8631","2","293","2","293","2","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","","","- C17 H22 Ag N3 O5 S -","- C17 H22 Ag N3 O5 S -","- C306 H396 Ag18 N54 O90 S18 -","18","1","","Liu, Hai-Yan; Wu, Hua; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min","Structural study of silver(I) sulfonate complexes with pyrazine derivatives.","Inorganic chemistry","2007","46","18","7299","7311","10.1021/ic070147s","","","0.71073","MoKα","","0.0464","0.0371","","","0.0768","0.0796","","","","","","1.079","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338876","11.931","0.003","18.766","0.004","13.323","0.003","90","","90","","90","","2983","1.2","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C26 H30 Ag2 N4 O9 S2 -","- C26 H30 Ag2 N4 O9 S2 -","- C104 H120 Ag8 N16 O36 S8 -","4","1","","Liu, Hai-Yan; Wu, Hua; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min","Structural study of silver(I) sulfonate complexes with pyrazine derivatives.","Inorganic chemistry","2007","46","18","7299","7311","10.1021/ic070147s","","","0.71069","MoKα","","0.0547","0.0424","","","0.0744","0.0788","","","","","","0.911","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338877","10.018","0.002","17.175","0.003","10.438","0.002","90","","91.28","0.03","90","","1795.5","0.6","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C16 H18 Ag N3 O4 S -","- C16 H18 Ag N3 O4 S -","- C64 H72 Ag4 N12 O16 S4 -","4","1","","Liu, Hai-Yan; Wu, Hua; Ma, Jian-Fang; Song, Shu-Yan; Yang, Jin; Liu, Ying-Ying; Su, Zhong-Min","Structural study of silver(I) sulfonate complexes with pyrazine derivatives.","Inorganic chemistry","2007","46","18","7299","7311","10.1021/ic070147s","","","0.71073","MoKα","","0.0368","0.0341","","","0.0869","0.0909","","","","","","1.105","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338878","12.6863","0.0012","12.6863","0.0012","43.813","0.008","90","","90","","120","","6106.7","1.4","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C18 H48 Cl4 Mo3 O12 P6 S4 -","- C18 Cl4 Mo3 O12 P6 S4 -","- C108 Cl24 Mo18 O72 P36 S24 -","6","0.333333","","Algarra, Andrés G; Basallote, Manuel G.; Fernández-Trujillo, M Jesús; Guillamón, Eva; Llusar, Rosa; Segarra, M. Dolores; Vicent, Cristian","Synthesis, crystal structure, aqueous speciation, and kinetics of substitution reactions in a water-soluble Mo3S4 cluster bearing hydroxymethyl diphosphine ligands.","Inorganic chemistry","2007","46","18","7668","7677","10.1021/ic701082p","","","0.71073","MoKα","","0.077","0.0472","","","0.1181","0.13","","","","","","1.072","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4338879","10.936","0.0007","19.421","0.0013","19.174","0.0014","90","","94.957","0.004","90","","4057.1","0.5","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H62 O2 P Sn -","- C42 H62 O2 P Sn -","- C168 H248 O8 P4 Sn4 -","4","1","","Liang, Lan-Chang; Chang, Yu-Ning; Chen, Han-Sheng; Lee, Hon Man","Biphenolate phosphine complexes of tin(IV).","Inorganic chemistry","2007","46","18","7587","7593","10.1021/ic701006r","","x-ray","0.71073","MoKα","","0.1321","0.0765","","","0.1725","0.2007","","","","","","1.033","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338880","13.2078","0.0005","20.1362","0.0008","15.8305","0.0007","90","","105.598","0.002","90","","4055.1","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H63 O2 P Sn -","- C41 H63 O2 P Sn -","- C164 H252 O8 P4 Sn4 -","4","1","","Liang, Lan-Chang; Chang, Yu-Ning; Chen, Han-Sheng; Lee, Hon Man","Biphenolate phosphine complexes of tin(IV).","Inorganic chemistry","2007","46","18","7587","7593","10.1021/ic701006r","","x-ray","0.71073","MoKα","","0.0634","0.0413","","","0.1139","0.124","","","","","","1.05","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338881","11.2833","0.0002","13.178","0.0003","16.6922","0.0005","77.866","0.001","75.926","0.001","73.479","0.001","2281.39","0.1","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H61 Cl2 O3 P Sn -","- C45 H61 Cl2 O3 P Sn -","- C90 H122 Cl4 O6 P2 Sn2 -","2","1","","Liang, Lan-Chang; Chang, Yu-Ning; Chen, Han-Sheng; Lee, Hon Man","Biphenolate phosphine complexes of tin(IV).","Inorganic chemistry","2007","46","18","7587","7593","10.1021/ic701006r","","","0.71073","MoKα","","0.0744","0.0504","","","0.1249","0.1454","","","","","","1.09","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338882","13.3818","0.0009","13.3818","0.0009","13.3818","0.0009","90.93","","90.93","","90.93","","2395.4","0.3","293","2","293","2","","","","","","","","4","R -3 c :R","-P 3* 2n","167","","","","- Cd Hg6 I6 Sb4 -","- Cd0.99 Hg6 I6 Sb4 -","- Cd3.96 Hg24 I24 Sb16 -","4","0.333333","","Zou, Jian-Ping; Li, Yan; Zhang, Zhang-Jing; Guo, Guo-Cong; Liu, Xi; Wang, Ming-Sheng; Cai, Li-Zhen; Lu, Ying-Bing; Huang, Jin-Shun","Synthesis, crystal and band structures, and properties of a new mixed three-dimensional framework metal pnictidehalide semiconductor, (Hg6Sb4)(CdI6).","Inorganic chemistry","2007","46","18","7321","7325","10.1021/ic0624165","","","0.71073","MoKα","","0.1081","0.0655","","","0.1247","0.1329","","","","","","0.997","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338883","17.131","0.003","18.134","0.003","18.725","0.003","108.97","0.05","108.77","0.05","107.19","0.05","4659","5","177","2","177","2","","","","","","","chemical synthesis","6","P -1","-P 1","2","Ru(II) complex, toluene solvate","","","- C123 H78 F12 N6 P2 Ru -","- C123 H78 F12 N6 P2 Ru -","- C246 H156 F24 N12 P4 Ru2 -","2","1","","Goze, Christine; Sabatini, Cristiana; Barbieri, Andrea; Barigelletti, Francesco; Ziessel, Raymond","Ruthenium-terpyridine complexes with multiple ethynylpyrenyl or ethynyltoluyl subunits: X-ray structure, redox, and spectroscopic properties.","Inorganic chemistry","2007","46","18","7341","7350","10.1021/ic070149c","","","0.972","synchrotronDCI","","0.1338","0.0871","","0.2792","","0.2337","","","1.008","","","1.07","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338884","12.9146","0.0017","15.739","0.002","17.626","0.002","92.632","0.002","110.355","0.002","105.793","0.002","3192.7","0.7","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H53 Cl4 Mn N12 O2 -","- C74 H53 Cl4 Mn N12 O2 -","- C148 H106 Cl8 Mn2 N24 O4 -","2","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Metalloporphyrin-based inclusion materials: exploiting ligating topologies and hydrogen-bonding backbones in generating new supramolecular architectures.","Inorganic chemistry","2007","46","18","7351","7361","10.1021/ic0702163","","","0.71073","MoKα","","0.1273","0.0686","","","0.1637","0.1887","","","","","","1.022","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338885","12.92","0.0012","13.9061","0.0012","16.0531","0.0014","93.852","0.002","94.519","0.002","96.53","0.002","2848.1","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C67 H48 Cl Mn N10 O6 -","- C67 H48 Cl Mn N10 O6 -","- C134 H96 Cl2 Mn2 N20 O12 -","2","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Metalloporphyrin-based inclusion materials: exploiting ligating topologies and hydrogen-bonding backbones in generating new supramolecular architectures.","Inorganic chemistry","2007","46","18","7351","7361","10.1021/ic0702163","","","0.71073","MoKα","","0.1468","0.0964","","","0.2091","0.2323","","","","","","1.042","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338886","18.5409","0.0017","11.9085","0.0011","23.836","0.002","90","","110.051","0.002","90","","4943.9","0.8","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C61.5 H44 Br2 N6 O Zn -","- C61.5 H44 Br2 N6 O Zn -","- C246 H176 Br8 N24 O4 Zn4 -","4","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Metalloporphyrin-based inclusion materials: exploiting ligating topologies and hydrogen-bonding backbones in generating new supramolecular architectures.","Inorganic chemistry","2007","46","18","7351","7361","10.1021/ic0702163","","","0.71073","MoKα","","0.044","0.0378","","","0.0893","0.0924","","","","","","1.012","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4338887","11.17","0.003","11.284","0.003","22.556","0.006","80.641","0.004","86.847","0.006","73.517","0.005","2689.8","1.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C56.5 H40 N5.5 O0.5 Zn -","- C56.5 H40 N5.5 O0.5 Zn -","- C113 H80 N11 O Zn2 -","2","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Metalloporphyrin-based inclusion materials: exploiting ligating topologies and hydrogen-bonding backbones in generating new supramolecular architectures.","Inorganic chemistry","2007","46","18","7351","7361","10.1021/ic0702163","","","0.71073","MoKα","","0.1723","0.0819","","","0.2005","0.2361","","","","","","0.872","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4338888","18.5279","0.0011","11.8843","0.0007","23.8153","0.0015","90","","109.562","0.001","90","","4941.2","0.5","100","2","100","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C63.5 H50 N6 O Zn -","- C63.5 H50 N6 O Zn -","- C254 H200 N24 O4 Zn4 -","4","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Metalloporphyrin-based inclusion materials: exploiting ligating topologies and hydrogen-bonding backbones in generating new supramolecular architectures.","Inorganic chemistry","2007","46","18","7351","7361","10.1021/ic0702163","","","0.71073","MoKα","","0.0395","0.0351","","","0.0798","0.0817","","","","","","1.017","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4338889","39.6465","0.0013","39.6465","0.0013","17.0551","0.0012","90","","90","","120","","23216","2","100","2","100","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C62.33 H46.33 Cl N8 O Zn -","- C62.3333 H46.3333 Cl N8 O Zn -","- C1122 H834 Cl18 N144 O18 Zn18 -","18","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Metalloporphyrin-based inclusion materials: exploiting ligating topologies and hydrogen-bonding backbones in generating new supramolecular architectures.","Inorganic chemistry","2007","46","18","7351","7361","10.1021/ic0702163","","","0.71073","MoKα","","0.0787","0.0692","","","0.2063","0.2149","","","","","","0.965","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338890","12.8727","0.0011","13.0713","0.0011","20.0292","0.0016","82.514","0.001","84.051","0.001","78.267","0.001","3261.3","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C78 H63 Cl Mn N12 O3 -","- C78 H63 Cl Mn N12 O3 -","- C156 H126 Cl2 Mn2 N24 O6 -","2","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Metalloporphyrin-based inclusion materials: exploiting ligating topologies and hydrogen-bonding backbones in generating new supramolecular architectures.","Inorganic chemistry","2007","46","18","7351","7361","10.1021/ic0702163","","","0.71073","MoKα","","0.0955","0.0575","","","0.1462","0.1659","","","","","","1.042","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338891","13.3651","0.0008","17.5105","0.001","28.9961","0.0017","92.68","0.001","91.197","0.001","93.493","0.001","6764","0.7","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C158 H122 N21 O6 Zn3 -","- C158 H122 N21 O6 Zn3 -","- C316 H244 N42 O12 Zn6 -","2","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Metalloporphyrin-based inclusion materials: exploiting ligating topologies and hydrogen-bonding backbones in generating new supramolecular architectures.","Inorganic chemistry","2007","46","18","7351","7361","10.1021/ic0702163","","","0.71073","MoKα","","0.0939","0.0655","","","0.1604","0.173","","","","","","1.043","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338892","11.682","0.002","23.694","0.005","22.016","0.004","90","","104.749","0.003","90","","5893.1","1.9","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C72 H57 N7 O2 Zn -","- C72 H57 N7 O2 Zn -","- C288 H228 N28 O8 Zn4 -","4","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Metalloporphyrin-based inclusion materials: exploiting ligating topologies and hydrogen-bonding backbones in generating new supramolecular architectures.","Inorganic chemistry","2007","46","18","7351","7361","10.1021/ic0702163","","","0.71073","MoKα","","0.1308","0.0579","","","0.1506","0.191","","","","","","0.939","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338893","11.5116","0.0012","16.2337","0.0017","14.5075","0.0011","90","","111.105","0.01","90","","2529.2","0.5","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 F6 N4 P Ti -","- C28 H24 F6 N4 P Ti -","- C112 H96 F24 N16 P4 Ti4 -","4","1","","Piglosiewicz, Ingmar M.; Beckhaus, Rüdiger; Wittstock, Gunther; Saak, Wolfgang; Haase, Detlef","Selective oxidation and reduction of trinuclear titanium(II) hexaazatrinaphthylene complexes-synthesis, structure, and electrochemical investigations.","Inorganic chemistry","2007","46","18","7610","7620","10.1021/ic701009u","","","0.71073","MoKα","","0.2246","0.0508","","","0.0742","0.1253","","","","","","0.568","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338894","17.5975","0.0007","16.278","0.0007","7.7007","0.0002","90","","93.677","0.004","90","","2201.34","0.14","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 N2 Ti -","- C30 H26 N2 Ti -","- C120 H104 N8 Ti4 -","4","1","","Piglosiewicz, Ingmar M.; Beckhaus, Rüdiger; Wittstock, Gunther; Saak, Wolfgang; Haase, Detlef","Selective oxidation and reduction of trinuclear titanium(II) hexaazatrinaphthylene complexes-synthesis, structure, and electrochemical investigations.","Inorganic chemistry","2007","46","18","7610","7620","10.1021/ic701009u","","","0.71073","MoKα","","0.0453","0.0291","","","0.0651","0.0693","","","","","","0.923","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338895","15.145","0.0005","19.569","0.0012","16.5042","0.0006","90","","90","","90","","4891.4","0.4","153","2","153","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C28 H22 F6 N2 P Ti -","- C28 H22 F6 N2 P Ti -","- C224 H176 F48 N16 P8 Ti8 -","8","1","","Piglosiewicz, Ingmar M.; Beckhaus, Rüdiger; Wittstock, Gunther; Saak, Wolfgang; Haase, Detlef","Selective oxidation and reduction of trinuclear titanium(II) hexaazatrinaphthylene complexes-synthesis, structure, and electrochemical investigations.","Inorganic chemistry","2007","46","18","7610","7620","10.1021/ic701009u","","","0.71073","MoKα","","0.1012","0.044","","","0.0836","0.0969","","","","","","0.817","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338896","16.3898","0.0007","14.8294","0.0009","28.2782","0.0011","90","","90.054","0.005","90","","6873","0.6","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C69 H72 F12 N6 O3 P2 Ti3 -","- C69 H72 F12 N6 O3 P2 Ti3 -","- C276 H288 F48 N24 O12 P8 Ti12 -","4","1","","Piglosiewicz, Ingmar M.; Beckhaus, Rüdiger; Wittstock, Gunther; Saak, Wolfgang; Haase, Detlef","Selective oxidation and reduction of trinuclear titanium(II) hexaazatrinaphthylene complexes-synthesis, structure, and electrochemical investigations.","Inorganic chemistry","2007","46","18","7610","7620","10.1021/ic701009u","","","0.71073","MoKα","","0.2606","0.1205","","","0.2881","0.3355","","","","","","0.922","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338897","8.1348","0.0002","16.9495","0.0005","19.2166","0.0009","90","","90","","90","","2649.6","0.16","153","2","153","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C28 H22 I3 N2 Ti -","- C28 H22 I3 N2 Ti -","- C112 H88 I12 N8 Ti4 -","4","0.5","","Piglosiewicz, Ingmar M.; Beckhaus, Rüdiger; Wittstock, Gunther; Saak, Wolfgang; Haase, Detlef","Selective oxidation and reduction of trinuclear titanium(II) hexaazatrinaphthylene complexes-synthesis, structure, and electrochemical investigations.","Inorganic chemistry","2007","46","18","7610","7620","10.1021/ic701009u","","","0.71073","MoKα","","0.0298","0.0179","","","0.0373","0.0391","","","","","","0.897","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338898","22.3769","0.0006","28.1718","0.001","30.5731","0.0013","90","","90","","90","","19273.2","1.2","153","2","153","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C112 H130 B N6 O7 Ti3 -","- C112 H130 B N6 O7 Ti3 -","- C896 H1040 B8 N48 O56 Ti24 -","8","1","","Piglosiewicz, Ingmar M.; Beckhaus, Rüdiger; Wittstock, Gunther; Saak, Wolfgang; Haase, Detlef","Selective oxidation and reduction of trinuclear titanium(II) hexaazatrinaphthylene complexes-synthesis, structure, and electrochemical investigations.","Inorganic chemistry","2007","46","18","7610","7620","10.1021/ic701009u","","","0.71073","MoKα","","0.1837","0.0819","","","0.1931","0.2354","","","","","","0.828","","","","has coordinates,has disorder","179491","2020-10-21","18:00:00",""
"4338899","12.2222","0.0007","8.5034","0.0003","25.812","0.0017","90","","101.172","0.007","90","","2631.8","0.3","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H32 N4 O Ti -","- C32 H32 N4 O Ti -","- C128 H128 N16 O4 Ti4 -","4","1","","Piglosiewicz, Ingmar M.; Beckhaus, Rüdiger; Wittstock, Gunther; Saak, Wolfgang; Haase, Detlef","Selective oxidation and reduction of trinuclear titanium(II) hexaazatrinaphthylene complexes-synthesis, structure, and electrochemical investigations.","Inorganic chemistry","2007","46","18","7610","7620","10.1021/ic701009u","","","0.71073","MoKα","","0.0876","0.0602","","","0.1439","0.1551","","","","","","1.054","","","","has coordinates","179491","2020-10-21","18:00:00",""
"4338900","15.4273","0.0007","30.339","0.002","14.7438","0.0005","90","","99.948","0.005","90","","6797.1","0.6","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C72 H78 B3 F12 N6 O4 Ti3 -","- C72 H78 B3 F12 N6 O4 Ti3 -","- C288 H312 B12 F48 N24 O16 Ti12 -","4","1","","Piglosiewicz, Ingmar M.; Beckhaus, Rüdiger; Wittstock, Gunther; Saak, Wolfgang; Haase, Detlef","Selective oxidation and reduction of trinuclear titanium(II) hexaazatrinaphthylene complexes-synthesis, structure, and electrochemical investigations.","Inorganic chemistry","2007","46","18","7610","7620","10.1021/ic701009u","","","0.71073","MoKα","","0.0836","0.0516","","","0.1376","0.1544","","","","","","1.009","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338901","10.8817","0.0006","17.8329","0.0005","14.3651","0.0006","90","","111.953","0.005","90","","2585.5","0.2","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 F6 N2 P Ti -","- C30 H26 F6 N2 P Ti -","- C120 H104 F24 N8 P4 Ti4 -","4","1","","Piglosiewicz, Ingmar M.; Beckhaus, Rüdiger; Wittstock, Gunther; Saak, Wolfgang; Haase, Detlef","Selective oxidation and reduction of trinuclear titanium(II) hexaazatrinaphthylene complexes-synthesis, structure, and electrochemical investigations.","Inorganic chemistry","2007","46","18","7610","7620","10.1021/ic701009u","","","0.71073","MoKα","","0.0565","0.0431","","","0.1098","0.1151","","","","","","1.032","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338902","12.8067","0.0006","29.0762","0.0011","19.537","0.0016","90","","92.708","0.008","90","","7266.9","0.7","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C69 H72 B4 F16 N6 O3 Ti3 -","- C69 H72 B4 F16 N6 O3 Ti3 -","- C276 H288 B16 F64 N24 O12 Ti12 -","4","1","","Piglosiewicz, Ingmar M.; Beckhaus, Rüdiger; Wittstock, Gunther; Saak, Wolfgang; Haase, Detlef","Selective oxidation and reduction of trinuclear titanium(II) hexaazatrinaphthylene complexes-synthesis, structure, and electrochemical investigations.","Inorganic chemistry","2007","46","18","7610","7620","10.1021/ic701009u","","","0.71073","MoKα","","0.3414","0.213","","","0.4325","0.4656","","","","","","1.602","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338903","13.922","0.003","15.111","0.003","17.506","0.004","67.57","0.03","81.47","0.03","73.71","0.03","3264","1.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H64 Cl12 Mg4 N4 O14 -","- C52 H64 Cl12 Mg4 N4 O14 -","- C104 H128 Cl24 Mg8 N8 O28 -","2","1","","Rood, Jeffrey A.; Noll, Bruce C.; Henderson, Kenneth W.","Synthesis, structure, and computational studies of the tetrameric magnesium imides [2,4,6-Cl3C6H2NMg.S]4 (S=1,4-dioxane and tetrahydrofuran).","Inorganic chemistry","2007","46","18","7259","7261","10.1021/ic701104s","","x-ray","0.71073","MoKα","","0.0515","0.0482","","","0.1418","0.1473","","","","","","1.025","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338904","16.3452","0.0002","12.8441","0.0002","25.5481","0.0004","90","","94.438","0.001","90","","5347.47","0.14","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C47 H48 Cl12 Mg4 N4 O4 -","- C47 H48 Cl12 Mg4 N4 O4 -","- C188 H192 Cl48 Mg16 N16 O16 -","4","1","","Rood, Jeffrey A.; Noll, Bruce C.; Henderson, Kenneth W.","Synthesis, structure, and computational studies of the tetrameric magnesium imides [2,4,6-Cl3C6H2NMg.S]4 (S=1,4-dioxane and tetrahydrofuran).","Inorganic chemistry","2007","46","18","7259","7261","10.1021/ic701104s","","","1.54178","CuKα","","0.0474","0.0357","","","0.0862","0.0921","","","","","","1.017","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338905","11.6809","0.001","12.5918","0.001","15.1061","0.0013","104.569","0.007","99.987","0.007","112.359","0.006","1896.7","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H88 Br2.22 Cu5 Gd2 N7.78 O46.34 -","- C48 H74 Br2.22 Cu5 Gd2 N7.78 O46.34 -","- C48 H74 Br2.22 Cu5 Gd2 N7.78 O46.34 -","1","0.5","","Wu, Gang; Hewitt, Ian J.; Mameri, Samir; Lan, Yanhua; Clérac, Rodolphe; Anson, Christopher E.; Qiu, Shilun; Powell, Annie K.","Bifunctional ligand approach for constructing 3d-4f heterometallic clusters.","Inorganic chemistry","2007","46","18","7229","7231","10.1021/ic070296a","","","0.71073","MoKα","","0.061","0.0535","","","0.1386","0.145","","","","","","1.048","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338906","16.5935","0.0018","9.9693","0.0011","19.166","0.002","90","","95.781","0.002","90","","3154.4","0.6","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H17 Co N3 O4 -","- C16 H17 Co N3 O4 -","- C128 H136 Co8 N24 O32 -","8","1","","Montney, Matthew R.; Krishnan, Subhashree Mallika; Supkowski, Ronald M.; LaDuca, Robert L.","Diverse entangled metal-organic framework materials incorporating kinked organodiimine and flexible aliphatic dicarboxylate ligands: synthesis, structure, physical properties, and reversible structural reorganization.","Inorganic chemistry","2007","46","18","7362","7370","10.1021/ic070291d","","","0.71073","MoKα","","0.0771","0.0417","","","0.0734","0.0862","","","","","","1.05","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338907","23.157","0.003","9.3556","0.0013","17.074","0.002","90","","119.455","0.002","90","","3220.9","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H19 N3 Ni O5 -","- C16 H19 N3 Ni O5 -","- C128 H152 N24 Ni8 O40 -","8","1","","Montney, Matthew R.; Krishnan, Subhashree Mallika; Supkowski, Ronald M.; LaDuca, Robert L.","Diverse entangled metal-organic framework materials incorporating kinked organodiimine and flexible aliphatic dicarboxylate ligands: synthesis, structure, physical properties, and reversible structural reorganization.","Inorganic chemistry","2007","46","18","7362","7370","10.1021/ic070291d","","","0.71073","MoKα","","0.0542","0.032","","","0.0656","0.0744","","","","","","1.065","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338908","21.472","0.005","8.542","0.002","18.807","0.005","90","","90","","90","","3449.5","1.5","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C16 H19 N3 O5 Zn -","- C16 H19 N3 O5 Zn -","- C128 H152 N24 O40 Zn8 -","8","1","","Montney, Matthew R.; Krishnan, Subhashree Mallika; Supkowski, Ronald M.; LaDuca, Robert L.","Diverse entangled metal-organic framework materials incorporating kinked organodiimine and flexible aliphatic dicarboxylate ligands: synthesis, structure, physical properties, and reversible structural reorganization.","Inorganic chemistry","2007","46","18","7362","7370","10.1021/ic070291d","","","0.71073","MoKα","","0.0792","0.0406","","","0.0883","0.1034","","","","","","1.018","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338909","7.3337","0.0002","10.8421","0.0002","22.8755","0.0007","100.664","0.002","96.051","0.002","104.07","0.001","1712.14","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H39 N5 O2 Zn -","- C39 H39 N5 O2 Zn -","- C78 H78 N10 O4 Zn2 -","2","1","","Escudero-Adán, Eduardo C; Benet-Buchholz, Jordi; Kleij, Arjan W.","Expedient method for the transmetalation of Zn(II)-centered salphen complexes.","Inorganic chemistry","2007","46","18","7265","7267","10.1021/ic701245r","","","0.71073","MoKα","","0.0684","0.0482","","","0.1267","0.1342","","","","","","0.968","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338910","6.9022","0.0019","9.625","0.003","9.699","0.003","77.193","0.007","78.779","0.005","87.223","0.008","616.3","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H26 N4 Ni3 O20 P4 -","- C10 H26 N4 Ni3 O20 P4 -","- C10 H26 N4 Ni3 O20 P4 -","1","0.5","","Cao, Deng-Ke; Li, Yi-Zhi; Zheng, Li-Min","Layered cobalt(II) and nickel(II) diphosphonates showing canted antiferromagnetism and slow relaxation behavior.","Inorganic chemistry","2007","46","18","7571","7578","10.1021/ic701098t","","","0.71073","MoKα","","0.0817","0.0634","","","0.1541","0.1596","","","","","","1.085","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338911","6.945","0.0013","9.5734","0.0018","9.7882","0.0019","77.284","0.003","78.623","0.004","87.507","0.004","622.4","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H26 Co3 N4 O20 P4 -","- C10 H26 Co3 N4 O20 P4 -","- C10 H26 Co3 N4 O20 P4 -","1","0.5","","Cao, Deng-Ke; Li, Yi-Zhi; Zheng, Li-Min","Layered cobalt(II) and nickel(II) diphosphonates showing canted antiferromagnetism and slow relaxation behavior.","Inorganic chemistry","2007","46","18","7571","7578","10.1021/ic701098t","","","0.71073","MoKα","","0.0571","0.0476","","","0.1185","0.1245","","","","","","1.055","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338912","18.1028","0.0007","20.7179","0.0008","16.985","0.0007","90","","98.788","0.001","90","","6295.5","0.4","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","[(Et2O)3Na][(CO)5WPNb(N[Np]Ar)3]","","","- C56 H90 N3 Na Nb O8 P W -","- C56 H90 N3 Na Nb O8 P W -","- C224 H360 N12 Na4 Nb4 O32 P4 W4 -","4","1","","Piro, Nicholas A.; Cummins, Christopher C.","Ethylenebis(triphenylphosphine)platinum as a probe for niobium-mediated diphosphorus chemistry.","Inorganic chemistry","2007","46","18","7387","7393","10.1021/ic700514u","","","0.71073","MoKα","","0.0771","0.0445","","","0.0903","0.1033","","","","","","1.035","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338913","13.2971","0.0003","19.6681","0.0007","25.3876","0.0008","90","","90","","90","","6639.6","0.3","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","[Na(12c4)][(Ar[Np]N)3Nb=P-W(CO)5]","","","- C60 H92 N3 Na Nb O13 P W -","- C60 H92 N3 Na Nb O13 P W -","- C240 H368 N12 Na4 Nb4 O52 P4 W4 -","4","1","","Piro, Nicholas A.; Cummins, Christopher C.","Ethylenebis(triphenylphosphine)platinum as a probe for niobium-mediated diphosphorus chemistry.","Inorganic chemistry","2007","46","18","7387","7393","10.1021/ic700514u","","","0.71073","MoKα","","0.0304","0.0283","","","0.0668","0.0676","","","","","","1.048","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338914","12.404","0.006","21.068","0.01","22.997","0.011","109.101","0.008","93.589","0.009","96.043","0.008","5617","5","100","2","100","2","","","","","","","","8","P -1","-P 1","2","Mes*NP[Pt(PPh3)]2PNb(N[Np]Ar)3","","","- C104.5 H140.5 N4 Nb O0.75 P4 Pt2 Si1.5 -","- C104.5 H140.5 N4 Nb O0.75 P4 Pt2 Si1.5 -","- C209 H281 N8 Nb2 O1.5 P8 Pt4 Si3 -","2","1","","Piro, Nicholas A.; Cummins, Christopher C.","Ethylenebis(triphenylphosphine)platinum as a probe for niobium-mediated diphosphorus chemistry.","Inorganic chemistry","2007","46","18","7387","7393","10.1021/ic700514u","","","0.71073","MoKα","","0.0994","0.0503","","","0.1118","0.1315","","","","","","1.042","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4338915","14.4491","0.0007","23.0682","0.0011","25.2132","0.0012","90","","100.593","0.001","90","","8260.7","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","W(CO)5P2[Pt(PPh3)2]2 (C7H8)2.5","","","- C94.5 H80 O5 P6 Pt2 W -","- C94.5 H80 O5 P6 Pt2 W -","- C378 H320 O20 P24 Pt8 W4 -","4","1","","Piro, Nicholas A.; Cummins, Christopher C.","Ethylenebis(triphenylphosphine)platinum as a probe for niobium-mediated diphosphorus chemistry.","Inorganic chemistry","2007","46","18","7387","7393","10.1021/ic700514u","","","0.71073","MoKα","","0.0309","0.0257","","","0.0538","0.0555","","","","","","1.211","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4338916","9.485","0.005","10.877","0.005","16.57","0.005","73.26","0.005","81.56","0.005","76.04","0.005","1583.2","1.2","298","2","298","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","(N-benzyl-N,N?,N?-tris(2-pyridylmethyl)ethylenediamine)(cyano) iron(II) hexafluorophosphate","","- C29 H35 F6 Fe N6 O2 P -","- C29 H35 F6 Fe N6 O2 P -","- C58 H70 F12 Fe2 N12 O4 P2 -","2","1","","Ortega-Villar, Norma; Ugalde-Saldívar, Víctor M; Muñoz, M Carmen; Ortiz-Frade, Luis A; Alvarado-Rodríguez, José G; Real, José A; Moreno-Esparza, Rafael","Synthesis and relative stability of a series of compounds of type [Fe(II)(bztpen)X]+, where bztpen=pentadentate ligand, N5, and X-=monodentate anion.","Inorganic chemistry","2007","46","18","7285","7293","10.1021/ic0620743","","x-ray","0.71069","MoKα","","0.0991","0.0582","","","0.1465","0.1662","","","","","","1.009","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338917","17.921","0.0003","18.913","0.0003","19.744","0.0004","90","","90","","90","","6692","0.2","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","acetonitryle)(N-benzyl-N,N?,N?-tris(2-pyridylmethyl)ethylenediamine) iron(II) hexafluorophosphate","","- C29 H32 F12 Fe N6 P2 -","- C29 H32 F12 Fe N6 P2 -","- C232 H256 F96 Fe8 N48 P16 -","8","1","","Ortega-Villar, Norma; Ugalde-Saldívar, Víctor M; Muñoz, M Carmen; Ortiz-Frade, Luis A; Alvarado-Rodríguez, José G; Real, José A; Moreno-Esparza, Rafael","Synthesis and relative stability of a series of compounds of type [Fe(II)(bztpen)X]+, where bztpen=pentadentate ligand, N5, and X-=monodentate anion.","Inorganic chemistry","2007","46","18","7285","7293","10.1021/ic0620743","","x-ray","0.71073","MoKα","","0.1256","0.0782","","","0.2134","0.2561","","","","","","1.019","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338918","18.452","0.003","16.9375","0.0019","18.471","0.002","90","","90","","90","","5772.8","1.3","298","2","298","2","","","","","","","synthesis as described","7","P b c a","-P 2ac 2ab","61","","(N-benzyl-N,N?,N?-tris(2-pyridylmethyl)ethylenediamine) (bromo)iron(II) hexafluorophosphate","","- C27 H29 Br F6 Fe N5 P -","- C27 H29 Br F6 Fe N5 P -","- C216 H232 Br8 F48 Fe8 N40 P8 -","8","1","","Ortega-Villar, Norma; Ugalde-Saldívar, Víctor M; Muñoz, M Carmen; Ortiz-Frade, Luis A; Alvarado-Rodríguez, José G; Real, José A; Moreno-Esparza, Rafael","Synthesis and relative stability of a series of compounds of type [Fe(II)(bztpen)X]+, where bztpen=pentadentate ligand, N5, and X-=monodentate anion.","Inorganic chemistry","2007","46","18","7285","7293","10.1021/ic0620743","","x-ray","0.71073","MoKα","","0.1795","0.0733","","","0.1306","0.1571","","","","","","0.9","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338919","8.814","0.0008","18.842","0.0017","19.003","0.0019","91.116","0.003","95.699","0.003","92.736","0.003","3135.8","0.5","298","2","298","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","(N-benzyl-N,N?,N?-tris(2-pyridylmethyl)ethylenediamine)(tiocyanato) iron(II) hexafluorophosphate","","- C28 H29 F6 Fe N6 P S -","- C28 H29 F6 Fe N6 P S -","- C112 H116 F24 Fe4 N24 P4 S4 -","4","2","","Ortega-Villar, Norma; Ugalde-Saldívar, Víctor M; Muñoz, M Carmen; Ortiz-Frade, Luis A; Alvarado-Rodríguez, José G; Real, José A; Moreno-Esparza, Rafael","Synthesis and relative stability of a series of compounds of type [Fe(II)(bztpen)X]+, where bztpen=pentadentate ligand, N5, and X-=monodentate anion.","Inorganic chemistry","2007","46","18","7285","7293","10.1021/ic0620743","","x-ray","0.71069","MoKα","","0.1573","0.0544","","","0.0807","0.0985","","","","","","0.742","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338920","17.445","0.0008","18.465","0.0008","18.465","0.0007","90","","90","","90","","5948","0.4","298","2","298","2","","","","","","","synthesis as described","7","P b c a","-P 2ac 2ab","61","","N-benzyl-N,N?,N?-tris(2-pyridylmethyl)ethylenediamine)(iodo)iron(II) hexafluorophosphate","","- C27 H29 F6 Fe I N5 P -","- C27 H29 F6 Fe I N5 P -","- C216 H232 F48 Fe8 I8 N40 P8 -","8","1","","Ortega-Villar, Norma; Ugalde-Saldívar, Víctor M; Muñoz, M Carmen; Ortiz-Frade, Luis A; Alvarado-Rodríguez, José G; Real, José A; Moreno-Esparza, Rafael","Synthesis and relative stability of a series of compounds of type [Fe(II)(bztpen)X]+, where bztpen=pentadentate ligand, N5, and X-=monodentate anion.","Inorganic chemistry","2007","46","18","7285","7293","10.1021/ic0620743","","x-ray","0.71073","MoKα","","0.0741","0.0473","","","0.1275","0.137","","","","","","1.018","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338921","18.227","0.0003","17.703","0.0003","18.25","0.0004","90","","90","","90","","5888.77","0.19","298","2","298","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","N-benzyl-N,N?,N?-tris(2-pyridylmethyl)ethylenediamine)(cyanato) iron(II) hexafluorophosphate","","- C28 H29 F6 Fe N6 O P -","- C28 H29 F6 Fe N6 O P -","- C224 H232 F48 Fe8 N48 O8 P8 -","8","1","","Ortega-Villar, Norma; Ugalde-Saldívar, Víctor M; Muñoz, M Carmen; Ortiz-Frade, Luis A; Alvarado-Rodríguez, José G; Real, José A; Moreno-Esparza, Rafael","Synthesis and relative stability of a series of compounds of type [Fe(II)(bztpen)X]+, where bztpen=pentadentate ligand, N5, and X-=monodentate anion.","Inorganic chemistry","2007","46","18","7285","7293","10.1021/ic0620743","","x-ray","0.71073","MoKα","","0.1389","0.0688","","","0.2117","0.2745","","","","","","0.898","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4338922","7.9567","0.0019","8.79","0.002","9.186","0.002","78.827","0.004","64.727","0.004","67.085","0.004","534.8","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- H12 K2 O8 Re6 S8 -","- K2 O8 Re6 S8 -","- K2 O8 Re6 S8 -","1","0.5","","Brylev, Konstantin A.; Mironov, Yuri V.; Yarovoi, Spartak S.; Naumov, Nikolai G.; Fedorov, Vladimir E.; Kim, Sung-Jin; Kitamura, Noboru; Kuwahara, Yusuke; Yamada, Konatsu; Ishizaka, Shoji; Sasaki, Yoichi","A family of octahedral rhenium cluster complexes [Re6Q8(H2O)n(OH)6-n]n-4 (Q=S, Se; n=0-6): structural and pH-dependent spectroscopic studies.","Inorganic chemistry","2007","46","18","7414","7422","10.1021/ic7005265","","","0.71073","MoKα","","0.034","0.0286","","","0.0776","0.0796","","","","","","1.036","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338923","14.9959","0.0013","14.9959","0.0013","10.9403","0.0019","90","","90","","120","","2130.6","0.5","173","2","173","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- H34 O18 Re6 S8 -","- O18 Re6 S8 -","- O54 Re18 S24 -","3","0.0833333","","Brylev, Konstantin A.; Mironov, Yuri V.; Yarovoi, Spartak S.; Naumov, Nikolai G.; Fedorov, Vladimir E.; Kim, Sung-Jin; Kitamura, Noboru; Kuwahara, Yusuke; Yamada, Konatsu; Ishizaka, Shoji; Sasaki, Yoichi","A family of octahedral rhenium cluster complexes [Re6Q8(H2O)n(OH)6-n]n-4 (Q=S, Se; n=0-6): structural and pH-dependent spectroscopic studies.","Inorganic chemistry","2007","46","18","7414","7422","10.1021/ic7005265","","","0.71073","MoKα","","0.0236","0.0204","","","0.0547","0.0554","","","","","","1.285","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338924","9.1109","0.0008","9.2467","0.0008","15.8877","0.0015","99.966","0.002","90.343","0.003","115.183","0.002","1188.21","0.19","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- Br8 H32 O16 Re12 S14 -","- Br7.994 O16 Re12 S14.006 -","- Br7.994 O16 Re12 S14.006 -","1","0.5","","Brylev, Konstantin A.; Mironov, Yuri V.; Yarovoi, Spartak S.; Naumov, Nikolai G.; Fedorov, Vladimir E.; Kim, Sung-Jin; Kitamura, Noboru; Kuwahara, Yusuke; Yamada, Konatsu; Ishizaka, Shoji; Sasaki, Yoichi","A family of octahedral rhenium cluster complexes [Re6Q8(H2O)n(OH)6-n]n-4 (Q=S, Se; n=0-6): structural and pH-dependent spectroscopic studies.","Inorganic chemistry","2007","46","18","7414","7422","10.1021/ic7005265","","","0.71073","MoKα","","0.0669","0.0463","","","0.1254","0.1346","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4338925","12.084","0.004","12.084","0.004","12.084","0.004","90","","90","","90","","1764.5","1","173","2","173","2","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","","","- H10 O6 Re6 Se8 -","- O6 Re6 Se8 -","- O24 Re24 Se32 -","4","0.166667","","Brylev, Konstantin A.; Mironov, Yuri V.; Yarovoi, Spartak S.; Naumov, Nikolai G.; Fedorov, Vladimir E.; Kim, Sung-Jin; Kitamura, Noboru; Kuwahara, Yusuke; Yamada, Konatsu; Ishizaka, Shoji; Sasaki, Yoichi","A family of octahedral rhenium cluster complexes [Re6Q8(H2O)n(OH)6-n]n-4 (Q=S, Se; n=0-6): structural and pH-dependent spectroscopic studies.","Inorganic chemistry","2007","46","18","7414","7422","10.1021/ic7005265","","","0.71073","MoKα","","0.0689","0.0389","","","0.078","0.082","","","","","","0.878","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338926","14.4563","0.0002","14.4726","0.0002","24.0551","0.0004","90","","90","","90","","5032.81","0.13","273","2","300","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H58 Mn4 N14 Sn2 Te8 -","- C20 H58 Mn4 N14 Sn2 Te8 -","- C80 H232 Mn16 N56 Sn8 Te32 -","4","1","","Zhang, Qichun; Bu, Xianhui; Lin, Zhien; Biasini, Maurizio; Beyermann, W. P.; Feng, Pingyun","Metal-complex-decorated homochiral heterobimetallic telluride single-stranded helix.","Inorganic chemistry","2007","46","18","7262","7264","10.1021/ic701135h","","","0.71073","MoKα","","0.039","0.0305","","","0.068","0.0712","","","","","","0.95","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338927","6.983","0.002","11.526","0.004","14.207","0.005","113.055","0.006","98.801","0.006","90.363","0.006","1037","0.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H36.31 Cu F12 N6 O6.31 -","- C36 H36.3 Cu F12 N6 O6.3 -","- C36 H36.3 Cu F12 N6 O6.3 -","1","0.5","","Hirel, Catherine; Li, Licun; Brough, Peter; Vostrikova, Kira; Pécaut, Jacques; Mehdaoui, Boubker; Bernard, Maxime; Turek, Philippe; Rey, Paul","New spin-transition-like copper(II)-nitroxide species.","Inorganic chemistry","2007","46","18","7545","7552","10.1021/ic700851x","","","0.71073","MoKα","","0.0897","0.0823","","","0.2089","0.2133","","","","","","1.177","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338928","12.021","0.003","24.238","0.006","16.376","0.004","90","","100.821","0.005","90","","4687","2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H24 Cu2 F24 N3 O10 -","- C34 H24 Cu2 F24 N3 O10 -","- C136 H96 Cu8 F96 N12 O40 -","4","1","","Hirel, Catherine; Li, Licun; Brough, Peter; Vostrikova, Kira; Pécaut, Jacques; Mehdaoui, Boubker; Bernard, Maxime; Turek, Philippe; Rey, Paul","New spin-transition-like copper(II)-nitroxide species.","Inorganic chemistry","2007","46","18","7545","7552","10.1021/ic700851x","","","0.71073","MoKα","","0.2372","0.0656","","","0.1445","0.2138","","","","","","0.841","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338929","12.1128","0.0012","24.104","0.003","16.304","0.002","90","","102.694","0.003","90","","4643.9","0.9","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H24 Cu2 F24 N3 O10 -","- C34 H24 Cu2 F24 N3 O10 -","- C136 H96 Cu8 F96 N12 O40 -","4","1","","Hirel, Catherine; Li, Licun; Brough, Peter; Vostrikova, Kira; Pécaut, Jacques; Mehdaoui, Boubker; Bernard, Maxime; Turek, Philippe; Rey, Paul","New spin-transition-like copper(II)-nitroxide species.","Inorganic chemistry","2007","46","18","7545","7552","10.1021/ic700851x","","","0.71073","MoKα","","0.158","0.0627","","","0.1583","0.1877","","","","","","0.914","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338930","11.8235","0.0008","14.298","0.001","15.2209","0.001","67.321","0.001","74.831","0.001","81.525","0.001","2288.3","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H24 Cu2 F24 N3 O10 -","- C34 H24 Cu2 F24 N3 O10 -","- C68 H48 Cu4 F48 N6 O20 -","2","1","","Hirel, Catherine; Li, Licun; Brough, Peter; Vostrikova, Kira; Pécaut, Jacques; Mehdaoui, Boubker; Bernard, Maxime; Turek, Philippe; Rey, Paul","New spin-transition-like copper(II)-nitroxide species.","Inorganic chemistry","2007","46","18","7545","7552","10.1021/ic700851x","","","0.71073","MoKα","","0.0971","0.0487","","","0.127","0.1451","","","","","","0.926","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338931","11.607","0.003","12.788","0.003","16.149","0.004","72.035","0.004","82.396","0.004","83.896","0.004","2254.6","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H22 Cu2 F24 N3 O10 -","- C33 H22 Cu2 F24 N3 O10 -","- C66 H44 Cu4 F48 N6 O20 -","2","1","","Hirel, Catherine; Li, Licun; Brough, Peter; Vostrikova, Kira; Pécaut, Jacques; Mehdaoui, Boubker; Bernard, Maxime; Turek, Philippe; Rey, Paul","New spin-transition-like copper(II)-nitroxide species.","Inorganic chemistry","2007","46","18","7545","7552","10.1021/ic700851x","","","0.71073","MoKα","","0.0737","0.0435","","","0.1091","0.1275","","","","","","1.025","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338933","15.405","0.003","21.21","0.004","15.444","0.003","90","","112.63","0.03","90","","4657.7","1.9","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H22 Cu2 F24 N3 O10 -","- C33 H22 Cu2 F24 N3 O10 -","- C132 H88 Cu8 F96 N12 O40 -","4","1","","Hirel, Catherine; Li, Licun; Brough, Peter; Vostrikova, Kira; Pécaut, Jacques; Mehdaoui, Boubker; Bernard, Maxime; Turek, Philippe; Rey, Paul","New spin-transition-like copper(II)-nitroxide species.","Inorganic chemistry","2007","46","18","7545","7552","10.1021/ic700851x","","","0.71073","MoKα","","0.1442","0.0761","","","0.21","0.2681","","","","","","0.878","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338934","15.797","0.002","12.5865","0.0019","15.829","0.002","90","","105.516","0.003","90","","3032.6","0.7","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22 Cu F12 N3 O6 -","- C24 H22 Cu F12 N3 O6 -","- C96 H88 Cu4 F48 N12 O24 -","4","1","","Hirel, Catherine; Li, Licun; Brough, Peter; Vostrikova, Kira; Pécaut, Jacques; Mehdaoui, Boubker; Bernard, Maxime; Turek, Philippe; Rey, Paul","New spin-transition-like copper(II)-nitroxide species.","Inorganic chemistry","2007","46","18","7545","7552","10.1021/ic700851x","","","0.71073","MoKα","","0.1601","0.0511","","","0.1119","0.1538","","","","","","0.879","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338935","12.5519","0.0005","16.0139","0.0007","30.1852","0.0013","90","","90","","90","","6067.4","0.4","298","2","298","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C48 H44 Cu2 F24 N6 O12 -","- C48 H44 Cu2 F24 N6 O12 -","- C192 H176 Cu8 F96 N24 O48 -","4","1","","Hirel, Catherine; Li, Licun; Brough, Peter; Vostrikova, Kira; Pécaut, Jacques; Mehdaoui, Boubker; Bernard, Maxime; Turek, Philippe; Rey, Paul","New spin-transition-like copper(II)-nitroxide species.","Inorganic chemistry","2007","46","18","7545","7552","10.1021/ic700851x","","","0.71073","MoKα","","0.1025","0.0475","","","0.1097","0.1217","","","","","","0.913","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338936","10.359","0.006","12.437","0.007","18.888","0.011","94.599","0.009","104.701","0.009","101.002","0.009","2289","2","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C18 H27 Cl2 Cu N6 O4.5 -","- C18 H22 Cl2 Cu N6 O4.5 -","- C72 H88 Cl8 Cu4 N24 O18 -","4","4","","Patra, Ashis K.; Bhowmick, Tuhin; Ramakumar, Suryanarayanarao; Chakravarty, Akhil R.","Metal-based netropsin mimics showing AT-selective DNA binding and DNA cleavage activity at red light.","Inorganic chemistry","2007","46","22","9030","9032","10.1021/ic701326z","","","0.71073","MoKα","","0.0588","0.0454","","","0.1226","0.1326","","","","","","1.025","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4338937","14.6195","0.001","17.5736","0.0012","4.1542","0.0003","90","","90","","90","","1067.29","0.13","193","2","193","2","","","","","","","","3","P n n m","-P 2 2n","58","lanthanum lutetium selenide","","","- La3 Lu Se6 -","- La3 Lu Se6 -","- La12 Lu4 Se24 -","4","0.5","","Jin, Geng Bang; Choi, Eun Sang; Guertin, Robert P.; Brooks, James S.; Booth, Corwin H.; Albrecht-Schmitt, Thomas E","Syntheses, structures, magnetism, and optical properties of lutetium-based interlanthanide selenides.","Inorganic chemistry","2007","46","22","9213","9220","10.1021/ic701012j","","","0.71073","MoKα","","0.03","0.0273","","","0.0636","0.0645","","","","","","1.082","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338938","14.502","0.0009","17.4954","0.0011","4.1129","0.0003","90","","90","","90","","1043.52","0.12","193","2","193","2","","","","","","","","3","P n n m","-P 2 2n","58","cerium lutetium selenide","","","- Ce3 Lu Se6 -","- Ce3 Lu Se6 -","- Ce12 Lu4 Se24 -","4","0.5","","Jin, Geng Bang; Choi, Eun Sang; Guertin, Robert P.; Brooks, James S.; Booth, Corwin H.; Albrecht-Schmitt, Thomas E","Syntheses, structures, magnetism, and optical properties of lutetium-based interlanthanide selenides.","Inorganic chemistry","2007","46","22","9213","9220","10.1021/ic701012j","","","0.71073","MoKα","","0.0234","0.0212","","","0.0477","0.0485","","","","","","1.086","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338939","4.0052","0.001","12.996","0.003","9.865","0.003","90","","90","","90","","513.5","0.2","193","2","193","2","","","","","","","","3","C m c m","-C 2c 2","63","praseodymium lutetium selenide","","","- Lu Pr Se3 -","- Lu Pr Se3 -","- Lu4 Pr4 Se12 -","4","0.25","","Jin, Geng Bang; Choi, Eun Sang; Guertin, Robert P.; Brooks, James S.; Booth, Corwin H.; Albrecht-Schmitt, Thomas E","Syntheses, structures, magnetism, and optical properties of lutetium-based interlanthanide selenides.","Inorganic chemistry","2007","46","22","9213","9220","10.1021/ic701012j","","","0.71073","MoKα","","0.0444","0.0429","","","0.1042","0.1049","","","","","","1.163","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338940","3.9946","0.0005","13.0015","0.0017","9.8583","0.0013","90","","90","","90","","512","0.11","193","2","193","2","","","","","","","","3","C m c m","-C 2c 2","63","neodymium lutetium selenide","","","- Lu Nd Se3 -","- Lu Nd Se3 -","- Lu4 Nd4 Se12 -","4","0.25","","Jin, Geng Bang; Choi, Eun Sang; Guertin, Robert P.; Brooks, James S.; Booth, Corwin H.; Albrecht-Schmitt, Thomas E","Syntheses, structures, magnetism, and optical properties of lutetium-based interlanthanide selenides.","Inorganic chemistry","2007","46","22","9213","9220","10.1021/ic701012j","","","0.71073","MoKα","","0.0228","0.0226","","","0.0599","0.0601","","","","","","1.331","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338941","11.3925","0.0013","4.0483","0.0005","11.6844","0.0014","90","","108.915","0.002","90","","509.79","0.11","193","2","193","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","samarium lutetium selenide","","","- Lu2.18 Se6 Sm1.82 -","- Lu2.17 Se6 Sm1.83 -","- Lu4.34 Se12 Sm3.66 -","2","0.5","","Jin, Geng Bang; Choi, Eun Sang; Guertin, Robert P.; Brooks, James S.; Booth, Corwin H.; Albrecht-Schmitt, Thomas E","Syntheses, structures, magnetism, and optical properties of lutetium-based interlanthanide selenides.","Inorganic chemistry","2007","46","22","9213","9220","10.1021/ic701012j","","","0.71073","MoKα","","0.0325","0.03","","","0.081","0.0822","","","","","","1.116","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338942","11.4274","0.0012","4.0542","0.0004","11.716","0.0012","90","","109.005","0.002","90","","513.2","0.09","193","2","193","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","gadolinium lutetium selenide","","","- Gd1.87 Lu2.13 Se6 -","- Gd1.86 Lu2.14 Se6 -","- Gd3.72 Lu4.28 Se12 -","2","0.5","","Jin, Geng Bang; Choi, Eun Sang; Guertin, Robert P.; Brooks, James S.; Booth, Corwin H.; Albrecht-Schmitt, Thomas E","Syntheses, structures, magnetism, and optical properties of lutetium-based interlanthanide selenides.","Inorganic chemistry","2007","46","22","9213","9220","10.1021/ic701012j","","","0.71073","MoKα","","0.0332","0.0308","","","0.0804","0.0817","","","","","","1.074","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338943","12.74","0.004","12.859","0.004","20.917","0.006","94.484","0.005","91.957","0.006","95.536","0.005","3397.3","1.8","213","2","213","2","","","","","","","","5","P -1","-P 1","2","[Mo2(DAniF)2]2(OH)4,(C4H8O)2","","","- C136 H160 Mo8 N16 O28 -","- C136 H160 Mo8 N16 O28 -","- C136 H160 Mo8 N16 O28 -","1","0.5","","Cotton, F. Albert; Li, Zhong; Liu, Chun Y.; Murillo, Carlos A.","Enhancement in electronic communication upon replacement of Mo-O by Mo-S bonds in tetranuclear clusters of the type [Mo2]2(mu-E-E)2 (E = O or S).","Inorganic chemistry","2007","46","22","9294","9302","10.1021/ic701303k","","","0.71073","MoKα","","0.1044","0.0515","","","0.0945","0.1124","","","","","","1.039","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338944","10.59","0.003","14.603","0.004","14.675","0.004","104.881","0.005","108.272","0.004","106.46","0.005","1912","0.9","213","2","213","2","","","","","","","","6","P -1","-P 1","2","[Mo2(DAniF)2]2(C6H4O2)2, 0.5(CH2Cl2)","","","- C73 H70 Cl2 Mo4 N8 O12 -","- C73 H70 Cl2 Mo4 N8 O12 -","- C73 H70 Cl2 Mo4 N8 O12 -","1","0.5","","Cotton, F. Albert; Li, Zhong; Liu, Chun Y.; Murillo, Carlos A.","Enhancement in electronic communication upon replacement of Mo-O by Mo-S bonds in tetranuclear clusters of the type [Mo2]2(mu-E-E)2 (E = O or S).","Inorganic chemistry","2007","46","22","9294","9302","10.1021/ic701303k","","","0.71073","MoKα","","0.0664","0.0581","","","0.1568","0.1649","","","","","","1.065","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338945","10.48","0.006","14.735","0.008","14.792","0.008","104.701","0.009","105.451","0.009","109.507","0.008","1922","1.9","213","2","213","2","","","","","","","","6","P -1","-P 1","2","[Mo2(DAniF)2]2(O2C10H6)2(CH2Cl2)","","","- C81 H74 Cl2 Mo4 N8 O12 -","- C81 H74 Cl2 Mo4 N8 O12 -","- C81 H74 Cl2 Mo4 N8 O12 -","1","0.5","","Cotton, F. Albert; Li, Zhong; Liu, Chun Y.; Murillo, Carlos A.","Enhancement in electronic communication upon replacement of Mo-O by Mo-S bonds in tetranuclear clusters of the type [Mo2]2(mu-E-E)2 (E = O or S).","Inorganic chemistry","2007","46","22","9294","9302","10.1021/ic701303k","","","0.71073","MoKα","","0.0786","0.0645","","","0.1705","0.1845","","","","","","1.08","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338946","10.365","0.004","15.036","0.005","15.21","0.005","118.909","0.006","94.175","0.006","103.173","0.006","1973.4","1.2","213","2","213","2","","","","","","","","7","P -1","-P 1","2","[Mo2(DAniF)2]2(C6H4S2)2,(CH2Cl2)","","","- C74 H72 Cl4 Mo4 N8 O8 S4 -","- C74 H72 Cl4 Mo4 N8 O8 S4 -","- C74 H72 Cl4 Mo4 N8 O8 S4 -","1","0.5","","Cotton, F. Albert; Li, Zhong; Liu, Chun Y.; Murillo, Carlos A.","Enhancement in electronic communication upon replacement of Mo-O by Mo-S bonds in tetranuclear clusters of the type [Mo2]2(mu-E-E)2 (E = O or S).","Inorganic chemistry","2007","46","22","9294","9302","10.1021/ic701303k","","","0.71073","MoKα","","0.1449","0.0762","","","0.1635","0.1943","","","","","","1.085","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338947","12.398","0.004","12.398","0.004","53.97","0.02","90","","90","","90","","8296","5","293","2","293","2","","","","","","","","7","I -4 2 d","I -4 2bw","122","","tetrakis(m\3-oxo)tetrakis(μ-acetato)tetrakispyridine tetracobalt(III) NaClO~4~ 3.5H~2~O","","- C28 H32 Cl Co4 N4 Na O19.5 -","- C28 H26 Cl Co4 N4 Na O19.5 -","- C224 H208 Cl8 Co32 N32 Na8 O156 -","8","0.5","","Chakrabarty, Rajesh; Bora, Sanchay J.; Das, Birinchi K.","Synthesis, structure, spectral and electrochemical properties, and catalytic use of cobalt(III)-oxo cubane clusters.","Inorganic chemistry","2007","46","22","9450","9462","10.1021/ic7011759","","","0.71073","MoKα","","0.0394","0.0384","","","0.1225","0.1238","","","","","","1.183","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4338948","10.122","0.001","11.177","0.001","36.62","0.004","92.187","0.002","91.111","0.002","103.145","0.002","4029.8","0.7","293","2","100","2","","","","","","","","6","P -1","-P 1","2","tetraoxotetracobalt(III)acetate tetrapyridine adduct","tetrakis[(mu3-oxo)(mu-acetato)(pyridine)]tetracobalt(III)","","- C28 H36 Co4 N4.5 Na0.5 O21.5 -","- C28 H32 Co4 N4.5 Na0.5 O21.5 -","- C112 H128 Co16 N18 Na2 O86 -","4","2","","Chakrabarty, Rajesh; Bora, Sanchay J.; Das, Birinchi K.","Synthesis, structure, spectral and electrochemical properties, and catalytic use of cobalt(III)-oxo cubane clusters.","Inorganic chemistry","2007","46","22","9450","9462","10.1021/ic7011759","","","0.71073","MoKα","","0.1361","0.1072","","","0.2063","0.2162","","","","","","1.24","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4338949","16.733","0.002","17.51","0.002","13.1904","0.0018","90","","90","","90","","3864.7","0.8","293","2","293","2","","","","","","","","5","P n n m","-P 2 2n","58","","tetrakis(m\-oxo)tetrakis(m\-acetato)tetrakis(4-methylpyridine) tetracobalt(III) 3H~2~O","","- C32 H34 Co4 N4 O15 -","- C32 H34 Co4 N4 O15 -","- C128 H136 Co16 N16 O60 -","4","0.5","","Chakrabarty, Rajesh; Bora, Sanchay J.; Das, Birinchi K.","Synthesis, structure, spectral and electrochemical properties, and catalytic use of cobalt(III)-oxo cubane clusters.","Inorganic chemistry","2007","46","22","9450","9462","10.1021/ic7011759","","","0.71073","MoKα","","0.1548","0.0824","","","0.1986","0.2504","","","","","","1.069","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338950","15.412","0.005","10.972","0.003","25.15","0.008","90","","102.19","0.005","90","","4157","2","149","2","149","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","EuTR12HOPO","","","- C30.5 H39.5 Eu N8.5 O11 -","- C30.5 H39.5 Eu N8.5 O11 -","- C122 H158 Eu4 N34 O44 -","4","1","","Jocher, Christoph J.; Moore, Evan G.; Xu, Jide; Avedano, Stefano; Botta, Mauro; Aime, Silvio; Raymond, Kenneth N.","1,2-hydroxypyridonates as contrast agents for magnetic resonance imaging: TREN-1,2-HOPO.","Inorganic chemistry","2007","46","22","9182","9191","10.1021/ic700985j","","","0.71073","MoKα","","0.0989","0.0524","","","0.1099","0.1243","","","","","","0.984","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4338951","10.6865","0.0011","15.0442","0.0019","12.5046","0.0017","90","","91.703","0.016","90","","2009.5","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H46 Al2 N4 O8 -","- C44 H46 Al2 N4 O8 -","- C88 H92 Al4 N8 O16 -","2","0.5","","Cametti, Massimo; Dalla Cort, Antonella; Colapietro, Marcello; Portalone, Gustavo; Russo, Luca; Rissanen, Kari","Evidence of the facile hydride and enolate addition to the imine bond of an aluminum-salophen complex.","Inorganic chemistry","2007","46","22","9057","9059","10.1021/ic701521s","","","0.710689","MoKα","","0.0712","0.0581","","","0.1642","0.1772","","","","","","1.132","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338952","9.1356","0.0005","11.4023","0.0008","11.64","0.0008","86.1385","0.0034","69.3368","0.0034","78.0562","0.0037","1109.92","0.13","173","0.1","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 Al N2 O5 -","- C24 H22 Al N2 O5 -","- C48 H44 Al2 N4 O10 -","2","1","","Cametti, Massimo; Dalla Cort, Antonella; Colapietro, Marcello; Portalone, Gustavo; Russo, Luca; Rissanen, Kari","Evidence of the facile hydride and enolate addition to the imine bond of an aluminum-salophen complex.","Inorganic chemistry","2007","46","22","9057","9059","10.1021/ic701521s","","","0.71069","MoKα","","0.1277","0.0753","","","0.1662","0.2053","","","","","","1.048","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338953","16.4817","0.0007","7.8604","0.0002","21.8412","0.0009","90","","90","","90","","2829.59","0.18","150","2","150","2","","","","","","","","7","P c a 21","P 2c -2ac","29","Compound jf459a","","","- C15 H32 Ag2 F6 N4 O9 S2 -","- C15 H32 Ag2 F6 N4 O9 S2 -","- C60 H128 Ag8 F24 N16 O36 S8 -","4","1","","Fielden, John; Long, De-liang; Slawin, Alexandra M. Z.; Kögerler, Paul; Cronin, Leroy","Ligand and counterion control of Ag(I) architectures: assembly of a {Ag8} ring cluster mediated by hydrophobic and Ag...Ag interactions.","Inorganic chemistry","2007","46","22","9090","9097","10.1021/ic700872b","","","0.71073","MoKα","","0.079","0.062","","","0.151","0.16","","","","","","1.056","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338954","10.6679","0.0004","12.3778","0.0006","12.6385","0.0003","101.404","0.002","113.443","0.002","94.57","0.002","1477.43","0.1","150","2","150","2","","","","","","","","7","P -1","-P 1","2","Compound JS134","","","- C17 H36 Ag2 F6 N4 O9 S2 -","- C17 H36 Ag2 F6 N4 O9 S2 -","- C34 H72 Ag4 F12 N8 O18 S4 -","2","1","","Fielden, John; Long, De-liang; Slawin, Alexandra M. Z.; Kögerler, Paul; Cronin, Leroy","Ligand and counterion control of Ag(I) architectures: assembly of a {Ag8} ring cluster mediated by hydrophobic and Ag...Ag interactions.","Inorganic chemistry","2007","46","22","9090","9097","10.1021/ic700872b","","","0.71073","MoKα","","0.0604","0.0374","","","0.0712","0.078","","","","","","1.028","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338955","14.3141","0.0003","14.3913","0.0003","37.9501","0.0009","90.172","0.002","100.697","0.002","95.281","0.002","7647.6","0.3","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C84 H212 Ag8 N24 O40 Si6 -","- C74.7 H163.4 Ag8 N23.5 O34.4 Si6.4 -","- C149.4 H326.8 Ag16 N47 O68.8 Si12.8 -","2","1","","Fielden, John; Long, De-liang; Slawin, Alexandra M. Z.; Kögerler, Paul; Cronin, Leroy","Ligand and counterion control of Ag(I) architectures: assembly of a {Ag8} ring cluster mediated by hydrophobic and Ag...Ag interactions.","Inorganic chemistry","2007","46","22","9090","9097","10.1021/ic700872b","","","0.71073","MoKα","","0.1493","0.1284","","","0.31","0.3305","","","","","","1.13","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338956","7.0267","0.0003","9.6235","0.0007","13.8161","0.0009","90","","91.824","0.004","90","","933.79","0.1","150","2","150","2","","","","","","","","7","P 1 21 1","P 2yb","4","Compound JF477B","","","- C12 H28 Ag Cl N2 O5 Si -","- C12 H28 Ag Cl N2 O5 Si -","- C24 H56 Ag2 Cl2 N4 O10 Si2 -","2","1","","Fielden, John; Long, De-liang; Slawin, Alexandra M. Z.; Kögerler, Paul; Cronin, Leroy","Ligand and counterion control of Ag(I) architectures: assembly of a {Ag8} ring cluster mediated by hydrophobic and Ag...Ag interactions.","Inorganic chemistry","2007","46","22","9090","9097","10.1021/ic700872b","","","0.71073","MoKα","","0.047","0.036","","","0.068","0.072","","","","","","1.032","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338957","7.3623","0.0003","8.7919","0.0006","8.8932","0.0006","111.832","0.003","99.411","0.003","91.128","0.004","525.13","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H16 Ag N3 O4 -","- C7 H16 Ag N3 O4 -","- C14 H32 Ag2 N6 O8 -","2","1","","Fielden, John; Long, De-liang; Slawin, Alexandra M. Z.; Kögerler, Paul; Cronin, Leroy","Ligand and counterion control of Ag(I) architectures: assembly of a {Ag8} ring cluster mediated by hydrophobic and Ag...Ag interactions.","Inorganic chemistry","2007","46","22","9090","9097","10.1021/ic700872b","","","0.71073","MoKα","","0.0942","0.0822","","","0.2272","0.2337","","","","","","1.184","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338958","10.532","0.002","12.828","0.003","23.516","0.005","90","","94.148","0.013","90","","3168.8","1.2","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H20 F12 N8 P2 Ru -","- C25 H20 F12 N8 P2 Ru -","- C100 H80 F48 N32 P8 Ru4 -","4","1","","Singh, Priti; Fiedler, Jan; Zális, Stanislav; Duboc, Carole; Niemeyer, Mark; Lissner, Falk; Schleid, Thomas; Kaim, Wolfgang","Spectroelectrochemistry and DFT analysis of a new {RuNO}n redox system with multifrequency EPR suggesting conformational isomerism in the {RuNO}7 state.","Inorganic chemistry","2007","46","22","9254","9261","10.1021/ic701206a","","","0.71073","MoKα","","0.1737","0.0763","","","0.1759","0.2232","","","","","","1.003","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338959","8.9165","0.0017","15.8829","0.0019","19.321","0.003","90","","95.216","0.015","90","","2724.9","0.7","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H17 F6 N8 O2 P Ru -","- C23 H17 F6 N8 O2 P Ru -","- C92 H68 F24 N32 O8 P4 Ru4 -","4","1","","Singh, Priti; Fiedler, Jan; Zális, Stanislav; Duboc, Carole; Niemeyer, Mark; Lissner, Falk; Schleid, Thomas; Kaim, Wolfgang","Spectroelectrochemistry and DFT analysis of a new {RuNO}n redox system with multifrequency EPR suggesting conformational isomerism in the {RuNO}7 state.","Inorganic chemistry","2007","46","22","9254","9261","10.1021/ic701206a","","","0.71073","MoKα","","0.1053","0.0534","","","0.1201","0.1316","","","","","","0.827","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338960","14.7169","0.0002","17.8342","0.0002","23.8615","0.0002","90","","90","","90","","6262.79","0.12","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C23 H17 F18 N8 O P3 Ru -","- C23 H17 F18 N8 O P3 Ru -","- C184 H136 F144 N64 O8 P24 Ru8 -","8","1","","Singh, Priti; Fiedler, Jan; Zális, Stanislav; Duboc, Carole; Niemeyer, Mark; Lissner, Falk; Schleid, Thomas; Kaim, Wolfgang","Spectroelectrochemistry and DFT analysis of a new {RuNO}n redox system with multifrequency EPR suggesting conformational isomerism in the {RuNO}7 state.","Inorganic chemistry","2007","46","22","9254","9261","10.1021/ic701206a","","","0.71073","MoKα","","0.1383","0.0868","","","0.1241","0.1367","","","","","","1.189","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338961","11.729","0.003","13.314","0.003","19.666","0.004","90","","98.902","0.003","90","","3034","1.2","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H25 Co2 N3 O7 -","- C36 H24 Co2 N3 O7 -","- C144 H96 Co8 N12 O28 -","4","1","","Luo, Junhua; Zhao, Yusheng; Xu, Hongwu; Kinnibrugh, Tiffany L.; Yang, Dali; Timofeeva, Tatiana V.; Daemen, Luke L.; Zhang, Jianzhong; Bao, Wei; Thompson, Joe D.; Currier, Robert P.","A novel helical double-layered cobalt(II)-organic framework with tetranuclear [Co4(mu3-OH)2] clusters linked by an unsymmetrical pyridylbenzoate ligand.","Inorganic chemistry","2007","46","22","9021","9023","10.1021/ic701003z","","","0.71073","MoKα","","0.0311","0.0265","","","0.0697","0.071","","","","","","1.053","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338962","14.158","0.005","9.341","0.004","13.755","0.005","90","","117.75","0.03","90","","1609.9","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H29 Cl N2 Ru -","- C14 H29 Cl N2 Ru -","- C56 H116 Cl4 N8 Ru4 -","4","1","","Morilla, M. Esther; Rodríguez, Pilar; Belderrain, Tomas R.; Graiff, Claudia; Tiripicchio, Antonio; Nicasio, M. Carmen; Pérez, Pedro J","Synthesis, characterization, and reactivity of ruthenium diene/diamine complexes including catalytic hydrogenation of ketones.","Inorganic chemistry","2007","46","22","9405","9414","10.1021/ic701363g","","","0.71073","MoKα","","0.0675","0.0428","","","0.1114","0.1224","","","","","","0.914","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338963","7.302","0.005","18.162","0.005","13.562","0.005","90","","103.89","0.05","90","","1746","1.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H28 Cl2 N2 Ru -","- C15 H28 Cl2 N2 Ru -","- C60 H112 Cl8 N8 Ru4 -","4","1","","Morilla, M. Esther; Rodríguez, Pilar; Belderrain, Tomas R.; Graiff, Claudia; Tiripicchio, Antonio; Nicasio, M. Carmen; Pérez, Pedro J","Synthesis, characterization, and reactivity of ruthenium diene/diamine complexes including catalytic hydrogenation of ketones.","Inorganic chemistry","2007","46","22","9405","9414","10.1021/ic701363g","","","0.71073","MoKα","","0.043","0.0283","","","0.0688","0.0745","","","","","","1.004","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338964","19.894","0.003","11.39","0.003","15.798","0.004","90","","101.91","0.03","90","","3502.7","1.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H49 Cl3 Mn3 O12 Ti -","- C21 H49 Cl3 Mn3 O12 Ti -","- C84 H196 Cl12 Mn12 O48 Ti4 -","4","1","","Jerzykiewicz, Lucjan B.; Utko, Józef; John, Lukasz; Duczmal, Marek; Sobota, Piotr","Titanium-manganese compound with a chiral Mn3Ti center.","Inorganic chemistry","2007","46","22","9024","9026","10.1021/ic7013094","","","0.71073","MoKα","","0.0557","0.0371","","","0.0853","0.0904","","","","","","1.072","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338965","10.1936","0.0003","10.1936","0.0003","22.6287","0.0008","90","","90","","120","","2036.32","0.11","296","2","296","2","","","","","","","","6","P 31","P 31","144","","","","- C23 H28 As Cl4 N Pd -","- C23 H28 As Cl4 N Pd -","- C69 H84 As3 Cl12 N3 Pd3 -","3","1","","Ma, Mengtao; Pullarkat, Sumod A.; Li, Yongxin; Leung, Pak-Hing","Novel stereochemistry, reactivity, and stability of an arsenic heterocycle in a metal-promoted asymmetric cycloaddition reaction.","Inorganic chemistry","2007","46","22","9488","9494","10.1021/ic701419j","","","0.71073","MoKα","","0.0396","0.0321","","","0.0857","0.0896","","","","","","1.039","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338966","9.3153","0.0003","17.0471","0.0007","17.1125","0.0007","90","","90","","90","","2717.45","0.18","273","2","273","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H26 As I2 P Pd -","- C26 H26 As I2 P Pd -","- C104 H104 As4 I8 P4 Pd4 -","4","1","","Ma, Mengtao; Pullarkat, Sumod A.; Li, Yongxin; Leung, Pak-Hing","Novel stereochemistry, reactivity, and stability of an arsenic heterocycle in a metal-promoted asymmetric cycloaddition reaction.","Inorganic chemistry","2007","46","22","9488","9494","10.1021/ic701419j","","","0.71073","MoKα","","0.031","0.0261","","","0.0714","0.0846","","","","","","1.159","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338967","7.6291","0.0003","14.2545","0.0005","17.146","0.0006","90","","90","","90","","1864.61","0.12","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H21 Cl2 P Pd -","- C20 H21 Cl2 P Pd -","- C80 H84 Cl8 P4 Pd4 -","4","1","","Ma, Mengtao; Pullarkat, Sumod A.; Li, Yongxin; Leung, Pak-Hing","Novel stereochemistry, reactivity, and stability of an arsenic heterocycle in a metal-promoted asymmetric cycloaddition reaction.","Inorganic chemistry","2007","46","22","9488","9494","10.1021/ic701419j","","","0.71073","MoKα","","0.0333","0.0279","","","0.0511","0.0536","","","","","","1.054","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338968","8.6453","0.0003","14.7344","0.0006","22.8349","0.0009","90","","90","","90","","2908.79","0.19","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C27 H27 As Cl5 P Pd -","- C27 H27 As Cl5 P Pd -","- C108 H108 As4 Cl20 P4 Pd4 -","4","1","","Ma, Mengtao; Pullarkat, Sumod A.; Li, Yongxin; Leung, Pak-Hing","Novel stereochemistry, reactivity, and stability of an arsenic heterocycle in a metal-promoted asymmetric cycloaddition reaction.","Inorganic chemistry","2007","46","22","9488","9494","10.1021/ic701419j","","","0.71073","MoKα","","0.041","0.0296","","","0.0613","0.0805","","","","","","1.087","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338969","9.9874","0.0003","10.4103","0.0003","18.6414","0.0007","93.513","0.002","103.462","0.002","100.661","0.001","1841.32","0.11","173","2","173","2","","","","","","","","8","P 1","P 1","1","","","","- C36.5 H40.5 As Cl2.5 N O4 P Pd -","- C36.5 H40.5 As Cl2.5 N O4 P Pd -","- C73 H81 As2 Cl5 N2 O8 P2 Pd2 -","2","2","","Ma, Mengtao; Pullarkat, Sumod A.; Li, Yongxin; Leung, Pak-Hing","Novel stereochemistry, reactivity, and stability of an arsenic heterocycle in a metal-promoted asymmetric cycloaddition reaction.","Inorganic chemistry","2007","46","22","9488","9494","10.1021/ic701419j","","","0.71073","MoKα","","0.0275","0.0253","","","0.0623","0.0656","","","","","","1.037","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4338970","11.108","0.002","13.532","0.0019","17.788","0.001","73.05","0.011","86.62","0.01","67.92","0.01","2366.2","0.6","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","Bis(hydrido(tris-(3,5-dimethylpyrazolyl)borato)- samarium(III)benzophenone ketyl","","- C93 H116 B4 N24 O2 Sm2 -","- C93 H108 B4 N24 O2 Sm2 -","- C93 H108 B4 N24 O2 Sm2 -","1","0.5","","Domingos, Angela; Lopes, Irene; Waerenborgh, João C; Marques, Noémia; Lin, G. Y.; Zhang, X. W.; Takats, Josef; McDonald, Robert; Hillier, Anna C.; Sella, Andrea; Elsegood, Mark R. J.; Day, Victor W.","Trapping of anionic organic radicals by (TpMe2)2Ln (Ln = Sm, Eu).","Inorganic chemistry","2007","46","22","9415","9424","10.1021/ic701364k","","","0.71073","MoKα","","0.0501","0.0374","","","0.0822","0.0877","","","","","","1.117","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338971","17.784","0.0011","12.648","0.0012","22.108","0.001","90","0.001","92.542","0.005","90","0.001","4967.9","0.6","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(hydrido(tris-(3,5-dimethylpyrazolyl)borato)samarium(III)fluorenone ketyl","","- C50 H60 B2 N12 O Sm -","- C50 H60 B2 N12 O Sm -","- C200 H240 B8 N48 O4 Sm4 -","4","1","","Domingos, Angela; Lopes, Irene; Waerenborgh, João C; Marques, Noémia; Lin, G. Y.; Zhang, X. W.; Takats, Josef; McDonald, Robert; Hillier, Anna C.; Sella, Andrea; Elsegood, Mark R. J.; Day, Victor W.","Trapping of anionic organic radicals by (TpMe2)2Ln (Ln = Sm, Eu).","Inorganic chemistry","2007","46","22","9415","9424","10.1021/ic701364k","","","0.71073","MoKα","","0.0793","0.0442","","","0.0849","0.0984","","","","","","1.1","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338972","10.924","0.002","15.044","0.003","18.785","0.004","89.96","0.03","74.29","0.03","71.14","0.03","2799.5","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(hydrido(tris-(3,5-dimethylpyrazolyl)borato)samarium(III) para- (3,5-di-t-Butyl)benzohemiquinone","","- C51 H72 B2 N12 O2 Sm -","- C50 H64 B2 N12 O2 Sm -","- C100 H128 B4 N24 O4 Sm2 -","2","1","","Domingos, Angela; Lopes, Irene; Waerenborgh, João C; Marques, Noémia; Lin, G. Y.; Zhang, X. W.; Takats, Josef; McDonald, Robert; Hillier, Anna C.; Sella, Andrea; Elsegood, Mark R. J.; Day, Victor W.","Trapping of anionic organic radicals by (TpMe2)2Ln (Ln = Sm, Eu).","Inorganic chemistry","2007","46","22","9415","9424","10.1021/ic701364k","","","0.71073","MoKα","","0.0858","0.0573","","","0.1238","0.1368","","","","","","1.012","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338973","14.863","0.001","17.717","0.002","17.932","0.002","87.51","0.011","70.61","0.01","69.94","0.012","4170.7","0.8","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","Bis[Bis(hydrido(tris-(3,5-dimethylpyrazolyl)borato)samarium(III)]- (mu-benzoquinone)","","- C72 H97 B4 N24 O2 Sm2 -","- C72 H97 B4 N24 O2 Sm2 -","- C144 H194 B8 N48 O4 Sm4 -","2","1","","Domingos, Angela; Lopes, Irene; Waerenborgh, João C; Marques, Noémia; Lin, G. Y.; Zhang, X. W.; Takats, Josef; McDonald, Robert; Hillier, Anna C.; Sella, Andrea; Elsegood, Mark R. J.; Day, Victor W.","Trapping of anionic organic radicals by (TpMe2)2Ln (Ln = Sm, Eu).","Inorganic chemistry","2007","46","22","9415","9424","10.1021/ic701364k","","","0.71073","MoKα","","0.1442","0.0683","","","0.1214","0.1484","","","","","","1.048","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338974","10.8129","0.0016","14.0111","0.0019","14.493","0.002","102.135","0.004","93.804","0.004","91.768","0.004","2139.6","0.5","160","2","160","2","","","","","","","","7","P -1","-P 1","2","","Bis[Bis(hydrido(tris-(3,5-dimethylpyrazolyl)borato)samarium(III)]- (mu-anthraquinone)","","- C76 H100 B4 Cl4 N24 O2 Sm2 -","- C76 H100 B4 Cl4 N24 O2 Sm2 -","- C76 H100 B4 Cl4 N24 O2 Sm2 -","1","0.5","","Domingos, Angela; Lopes, Irene; Waerenborgh, João C; Marques, Noémia; Lin, G. Y.; Zhang, X. W.; Takats, Josef; McDonald, Robert; Hillier, Anna C.; Sella, Andrea; Elsegood, Mark R. J.; Day, Victor W.","Trapping of anionic organic radicals by (TpMe2)2Ln (Ln = Sm, Eu).","Inorganic chemistry","2007","46","22","9415","9424","10.1021/ic701364k","","","0.71073","MoKα","","0.1488","0.0905","","","0.1918","0.2225","","","","","","0.995","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338975","13.1716","0.0001","13.794","0.0002","14.7429","0.0002","92.399","0.001","102.571","0.001","104.603","0.001","2516.65","0.06","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","Bis(hydrido(tris-(3,5-dimethylpyrazolyl)borato)samarium(III)- ortho-(3,5-di-t-Butyl)benzohemiquinone","","- C47.5 H68 B2 N12 O2 Sm -","- C47.5 H68 B2 N12 O2 Sm -","- C95 H136 B4 N24 O4 Sm2 -","2","1","","Domingos, Angela; Lopes, Irene; Waerenborgh, João C; Marques, Noémia; Lin, G. Y.; Zhang, X. W.; Takats, Josef; McDonald, Robert; Hillier, Anna C.; Sella, Andrea; Elsegood, Mark R. J.; Day, Victor W.","Trapping of anionic organic radicals by (TpMe2)2Ln (Ln = Sm, Eu).","Inorganic chemistry","2007","46","22","9415","9424","10.1021/ic701364k","","","0.71073","MoKα","","0.054","0.039","","","0.0882","0.0954","","","","","","1.053","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338976","11.29","0.002","17.51","0.003","29.728","0.005","90","","96.638","0.015","90","","5837.5","1.8","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C60 H88 Ga2 N4 Zn -","- C60 H88 Ga2 N4 Zn -","- C240 H352 Ga8 N16 Zn4 -","4","1","","Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.","Synthesis and structure of new compounds with Zn-Ga bonds: insertion of the gallium(I) bisimidinate Ga(DDP) into Zn-X (X = CH3, Cl) and the homoleptic complex cation [Zn(GaCp*)4]2+.","Inorganic chemistry","2007","46","22","9481","9487","10.1021/ic7013804","","","0.71073","MoKα","","0.1064","0.0507","","","0.0908","0.1048","","","","","","0.954","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338977","10.2208","0.0004","19.127","0.0014","10.7564","0.0007","90","","90.242","0.004","90","","2102.8","0.2","105","2","105","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C74 H106 Cl4 Ga2 N4 O4 Zn2 -","- C74 H106 Cl4 Ga2 N4 O4 Zn2 -","- C74 H106 Cl4 Ga2 N4 O4 Zn2 -","1","0.25","","Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.","Synthesis and structure of new compounds with Zn-Ga bonds: insertion of the gallium(I) bisimidinate Ga(DDP) into Zn-X (X = CH3, Cl) and the homoleptic complex cation [Zn(GaCp*)4]2+.","Inorganic chemistry","2007","46","22","9481","9487","10.1021/ic7013804","","","0.71073","MoKα","","0.1269","0.0596","","","0.1382","0.1462","","","","","","0.817","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338978","14.9889","0.0015","15.3966","0.0015","17.283","0.002","97.492","0.009","96.7","0.009","95.653","0.008","3901.2","0.7","113","2","113","2","","","","","","","","9","P -1","-P 1","2","","","","- C156 H154 B2 Cl2 F50 Ga2 N4 O4 Zn2 -","- C156 H156 B2 Cl2 F50 Ga2 N4 O4 Zn2 -","- C156 H156 B2 Cl2 F50 Ga2 N4 O4 Zn2 -","1","0.5","","Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.","Synthesis and structure of new compounds with Zn-Ga bonds: insertion of the gallium(I) bisimidinate Ga(DDP) into Zn-X (X = CH3, Cl) and the homoleptic complex cation [Zn(GaCp*)4]2+.","Inorganic chemistry","2007","46","22","9481","9487","10.1021/ic7013804","","","0.71073","MoKα","","0.2158","0.0532","","","0.0692","0.0836","","","","","","0.568","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338979","26.3741","0.001","14.1628","0.0006","28.8814","0.0017","90","","97.821","0.004","90","","10687.8","0.9","105","2","105","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Zn(GaCp*)4][BArF]2","","","- C416 H336 B8 F192 Ga16 Zn4 -","- C416 H336 B8 F192.072 Ga16 Zn4 -","- C416 H336 B8 F192.072 Ga16 Zn4 -","1","0.125","","Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.","Synthesis and structure of new compounds with Zn-Ga bonds: insertion of the gallium(I) bisimidinate Ga(DDP) into Zn-X (X = CH3, Cl) and the homoleptic complex cation [Zn(GaCp*)4]2+.","Inorganic chemistry","2007","46","22","9481","9487","10.1021/ic7013804","","","0.71073","MoKα","","0.0891","0.046","","","0.0843","0.0898","","","","","","0.902","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338980","30.935","0.006","14.33","0.003","25.247","0.005","90","","97.716","0.002","90","","11091","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C85.4 H84 Cl10.2 Mn8 N4 O42 -","- C85.4 H84 Cl10.2 Mn8 N4 O42 -","- C341.6 H336 Cl40.8 Mn32 N16 O168 -","4","0.5","","Sañudo, E Carolina; Cauchy, Thomas; Ruiz, Eliseo; Laye, Rebecca H.; Roubeau, Olivier; Teat, Simon J.; Aromí, Guillem","Molecules composed of two weakly magnetically coupled [MnIII4] clusters.","Inorganic chemistry","2007","46","22","9045","9047","10.1021/ic701467y","","","0.7848","synchrotron","","0.0923","0.0645","","","0.1714","0.1949","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4338981","7.2156","0.0006","15.7051","0.0014","18.6098","0.0016","71.677","0.002","85.469","0.002","85.651","0.002","1992.8","0.3","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","","","- C25 H20 O7 -","- C25 H20 O7 -","- C100 H80 O28 -","4","2","","Sañudo, E Carolina; Cauchy, Thomas; Ruiz, Eliseo; Laye, Rebecca H.; Roubeau, Olivier; Teat, Simon J.; Aromí, Guillem","Molecules composed of two weakly magnetically coupled [MnIII4] clusters.","Inorganic chemistry","2007","46","22","9045","9047","10.1021/ic701467y","","","0.7749","synchrotron","","0.0652","0.0575","","","0.1649","0.174","","","","","","1.033","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338982","16.0152","0.0008","16.5984","0.0008","18.2588","0.0009","90","","92.0129","0.001","90","","4850.7","0.4","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C46 H42 Au2 Cl2 Mo N6 O4 P4 -","- C46 H42 Au2 Cl2 Mo N6 O4 P4 -","- C184 H168 Au8 Cl8 Mo4 N24 O16 P16 -","4","1","","Thirupathi, Natesan; Stricklen, Phillip M.; Liu, Xiaodong; Oshel, Reed; Guzei, Ilia; Ellern, Arkady; Verkade, John G.","Comparisons of phosphorus ligation properties in P(CH2NR)3P.","Inorganic chemistry","2007","46","22","9351","9363","10.1021/ic0703070","","","0.71073","MoKα","","0.0522","0.0304","","","0.0556","0.0594","","","","","","1.007","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338983","8.389","0.002","5.7804","0.0015","6.4204","0.0016","90","","90","","90","","311.34","0.13","173","2","173","2","","","","","","","","4","P m n 21","P 2ac -2","31","","","","- C3 H6 O3 P2 -","- C3 H6 O3 P2 -","- C6 H12 O6 P4 -","2","0.5","","Thirupathi, Natesan; Stricklen, Phillip M.; Liu, Xiaodong; Oshel, Reed; Guzei, Ilia; Ellern, Arkady; Verkade, John G.","Comparisons of phosphorus ligation properties in P(CH2NR)3P.","Inorganic chemistry","2007","46","22","9351","9363","10.1021/ic0703070","","","0.71073","MoKα","","0.0332","0.0307","","","0.0702","0.0711","","","","","","1.084","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338984","10.243","0.0004","18.6675","0.0008","10.5701","0.0004","90","","109.56","0.001","90","","1904.49","0.13","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H21 N3 P2 -","- C21 H21 N3 P2 -","- C84 H84 N12 P8 -","4","1","","Thirupathi, Natesan; Stricklen, Phillip M.; Liu, Xiaodong; Oshel, Reed; Guzei, Ilia; Ellern, Arkady; Verkade, John G.","Comparisons of phosphorus ligation properties in P(CH2NR)3P.","Inorganic chemistry","2007","46","22","9351","9363","10.1021/ic0703070","","","0.71073","MoKα","","0.0409","0.0326","","","0.0993","0.1045","","","","","","1.039","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338985","13.7683","0.0007","16.2735","0.0008","16.87","0.0008","78.9063","0.001","89.324","0.001","87.458","0.001","3705.6","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H63 Mo N9 O3 P6 -","- C66 H63 Mo N9 O3 P6 -","- C132 H126 Mo2 N18 O6 P12 -","2","1","","Thirupathi, Natesan; Stricklen, Phillip M.; Liu, Xiaodong; Oshel, Reed; Guzei, Ilia; Ellern, Arkady; Verkade, John G.","Comparisons of phosphorus ligation properties in P(CH2NR)3P.","Inorganic chemistry","2007","46","22","9351","9363","10.1021/ic0703070","","","0.71073","MoKα","","0.0538","0.0393","","","0.0925","0.0965","","","","","","1.017","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338986","7.2702","0.0011","7.2702","0.0011","10.952","0.002","90","","90","","120","","501.32","0.14","173","2","173","2","","","","","","","","5","P -3","-P 3","147","","","","- C6 H15 N3 O P2 -","- C6 H15 N3 O P2 -","- C12 H30 N6 O2 P4 -","2","0.333333","","Thirupathi, Natesan; Stricklen, Phillip M.; Liu, Xiaodong; Oshel, Reed; Guzei, Ilia; Ellern, Arkady; Verkade, John G.","Comparisons of phosphorus ligation properties in P(CH2NR)3P.","Inorganic chemistry","2007","46","22","9351","9363","10.1021/ic0703070","","","0.71073","MoKα","","0.0467","0.0401","","","0.1072","0.1116","","","","","","1.108","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338987","14.4369","0.0008","12.5461","0.0007","13.4794","0.0007","90","","90","","90","","2441.5","0.2","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C16 H15 N3 O10 P2 W2 -","- C16 H15 N3 O10 P2 W2 -","- C64 H60 N12 O40 P8 W8 -","4","1","","Thirupathi, Natesan; Stricklen, Phillip M.; Liu, Xiaodong; Oshel, Reed; Guzei, Ilia; Ellern, Arkady; Verkade, John G.","Comparisons of phosphorus ligation properties in P(CH2NR)3P.","Inorganic chemistry","2007","46","22","9351","9363","10.1021/ic0703070","","","0.71073","MoKα","","0.0253","0.0226","","","0.056","0.0569","","","","","","1.053","","","","has coordinates,has disorder","179492","2020-10-21","18:00:00",""
"4338988","13.0587","0.0008","13.283","0.0008","14.2394","0.0008","90","","90","","90","","2469.9","0.3","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C6 H21 B2 N3 P2 -","- C6 H21 B2 N3 P2 -","- C48 H168 B16 N24 P16 -","8","1","","Thirupathi, Natesan; Stricklen, Phillip M.; Liu, Xiaodong; Oshel, Reed; Guzei, Ilia; Ellern, Arkady; Verkade, John G.","Comparisons of phosphorus ligation properties in P(CH2NR)3P.","Inorganic chemistry","2007","46","22","9351","9363","10.1021/ic0703070","","","0.71073","Mo-Kα","","0.042","0.0362","","","0.1052","0.1092","","","","","","1.084","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4338989","21.617","0.003","12.1196","0.0017","25.563","0.004","90","","109.264","0.002","90","","6322.2","1.6","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C64 H69 Cl N6 O3 P4 Ru -","- C64 H69 Cl N6 O3 P4 Ru -","- C256 H276 Cl4 N24 O12 P16 Ru4 -","4","1","","Thirupathi, Natesan; Stricklen, Phillip M.; Liu, Xiaodong; Oshel, Reed; Guzei, Ilia; Ellern, Arkady; Verkade, John G.","Comparisons of phosphorus ligation properties in P(CH2NR)3P.","Inorganic chemistry","2007","46","22","9351","9363","10.1021/ic0703070","","","0.71073","MoKα","","0.0701","0.0411","","","0.1148","0.1341","","","","","","0.771","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338990","10.132","0.0006","11.0295","0.0007","23.3101","0.0013","90","","95.294","0.003","90","","2593.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H32 Co N10 O2 -","- C22 H32 Co N10 O2 -","- C88 H128 Co4 N40 O8 -","4","1","","Yoo, Houng Sik; Kim, Jae Il; Yang, Namgeun; Koh, Eui Kwan; Park, Je-Geun; Hong, Chang Seop","Uncommon ferromagnetic interactions in a homometallic Co(II) chain bridged by a single end-to-end azide.","Inorganic chemistry","2007","46","22","9054","9056","10.1021/ic7014995","","","0.71073","MoKα","","0.051","0.0347","","","0.0815","0.091","","","","","","1.041","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338991","13.3729","0.0003","14.8031","0.0003","29.4844","0.0007","90","","95.08","0.001","90","","5813.8","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H33 Co N12 O2 -","- C22 H33 Co N12 O2 -","- C176 H264 Co8 N96 O16 -","8","2","","Yoo, Houng Sik; Kim, Jae Il; Yang, Namgeun; Koh, Eui Kwan; Park, Je-Geun; Hong, Chang Seop","Uncommon ferromagnetic interactions in a homometallic Co(II) chain bridged by a single end-to-end azide.","Inorganic chemistry","2007","46","22","9054","9056","10.1021/ic7014995","","","0.71073","MoKα","","0.1226","0.0625","","","0.163","0.1801","","","","","","1.068","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338992","12.4579","0.0003","15.1725","0.0003","13.0991","0.0003","90","","116.425","0.001","90","","2217.27","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 Co N12 O0 -","- C18 H25 Co N12 -","- C72 H100 Co4 N48 -","4","1","","Yoo, Houng Sik; Kim, Jae Il; Yang, Namgeun; Koh, Eui Kwan; Park, Je-Geun; Hong, Chang Seop","Uncommon ferromagnetic interactions in a homometallic Co(II) chain bridged by a single end-to-end azide.","Inorganic chemistry","2007","46","22","9054","9056","10.1021/ic7014995","","","0.71073","MoKα","","0.0595","0.0386","","","0.0947","0.1083","","","","","","1.038","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338993","18.1943","0.0003","9.3573","0.0001","10.0465","0.0001","90","","90","","90","","1710.41","0.04","300","","300","","","","","","","","","9","P c c n","-P 2ab 2ac","56","","Nickel diruthenium(II,III) tetracarbonate","","- C4 H8 Ni O16 Ru2 en lv so t -","- C4 Ni O22.6384 Ru2 -","- C16 Ni4 O90.5536 Ru8 -","4","0.5","","Kennon, Bretni S.; Her, Jae-Hyuk; Stephens, Peter W.; Shum, William W.; Miller, Joel S.","Structure and magnetic ordering of KxH1-xNi(OH2)4[Ru2(CO3)4].zH2O.","Inorganic chemistry","2007","46","22","9033","9035","10.1021/ic701318q","powder diffraction","","0.696677","synchrotron","","","","","","","","","0.026","2.017","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4338994","23.968","0.003","8.1797","0.001","16.2729","0.0019","90","","124.719","0.002","90","","2622.3","0.6","243","2","243","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H26 Cl2 Co N4 Se2 -","- C24 H26 Cl2 Co N4 Se2 -","- C96 H104 Cl8 Co4 N16 Se8 -","4","0.5","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.04","0.0287","","","0.0681","0.0731","","","","","","1.039","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338995","8.6691","0.0008","14.2662","0.0015","25.323","0.003","90","","96.84","0.002","90","","3109.5","0.6","243","2","243","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H27 Cl5 N4 Ni Se2 -","- C25 H27 Cl5 N4 Ni Se2 -","- C100 H108 Cl20 N16 Ni4 Se8 -","4","1","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.1223","0.0484","","","0.0786","0.0946","","","","","","1.012","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338996","9.625","0.0017","9.6646","0.0018","11.838","0.002","100.645","0.003","100.726","0.003","91.95","0.003","1060.7","0.3","243","2","243","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H24 Cl3 Cu N4 S2 -","- C15 H24 Cl3 Cu N4 S2 -","- C30 H48 Cl6 Cu2 N8 S4 -","2","1","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.0392","0.0348","","","0.1476","0.1561","","","","","","1.043","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338997","13.1296","0.001","14.2593","0.0011","13.9286","0.0011","90","","93.042","0.001","90","","2604","0.3","125","2","125","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H26 Cl6 N4 S2 Zn -","- C16 H26 Cl6 N4 S2 Zn -","- C64 H104 Cl24 N16 S8 Zn4 -","4","1","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.083","0.0436","","","0.0976","0.1122","","","","","","1.066","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338998","12.415","0.005","20.52","0.008","10.938","0.005","90","","94.253","0.007","90","","2779","2","243","2","243","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(SIm)2FeCl2","","","- C23 H31 Cl2 Fe N4 S2 -","- C23 H31 Cl2 Fe N4 S2 -","- C92 H124 Cl8 Fe4 N16 S8 -","4","1","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.131","0.0512","","","0.1107","0.139","","","","","","1.006","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4338999","13.0132","0.0011","11.9125","0.001","21.4092","0.0019","90","","90","","90","","3318.8","0.5","243","2","243","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H22 N4 S2 -","- C14 H22 N4 S2 -","- C112 H176 N32 S16 -","8","1","","Figueroa, Joshua S.; Yurkerwich, Kevin; Melnick, Jonathan; Buccella, Daniela; Parkin, Gerard","Applications of bis(1-R-imidazol-2-yl)disulfides and diselenides as ligands for main-group and transition metals: kappa2-(N,N) coordination, S-S bond cleavage, and S-S/E-E (E = S, Se) bond metathesis reactions.","Inorganic chemistry","2007","46","22","9234","9244","10.1021/ic701228y","","","0.71073","MoKα","","0.0859","0.0435","","","0.0915","0.1061","","","","","","1.007","","","","has coordinates","179492","2020-10-21","18:00:00",""
"4339000","19.919","0.006","13.482","0.004","22.577","0.007","90","","92.851","0.007","90","","6056","3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H30 F6 N Ni P3 S -","- C28 H30 F6 N Ni P3 S -","- C224 H240 F48 N8 Ni8 P24 S8 -","8","2","","Desrochers, Patrick J.; Duong, Davis S.; Marshall, Ariel S.; Lelievre, Stacey A.; Hong, Bonnie; Brown, Josh R.; Tarkka, Richard M.; Manion, Jerald M.; Holman, Garen; Merkert, Jon W.; Vicic, David A.","Nickel-cysteine binding supported by phosphine chelates.","Inorganic chemistry","2007","46","22","9221","9233","10.1021/ic701150q","","","0.7107","MoKα","","0.1063","0.0756","","","0.1744","0.1994","","","","","","1.101","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339001","29.426","0.006","13.159","0.003","16.647","0.003","90","","111.1","0.03","90","","6014","2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C27 H25 F8 N10 O P Ru -","- C27 H25 F6 N10 O P Ru -","- C216 H200 F48 N80 O8 P8 Ru8 -","8","1","","Stagni, Stefano; Orselli, Enrico; Palazzi, Antonio; De Cola, Luisa; Zacchini, Stefano; Femoni, Cristina; Marcaccio, Massimo; Paolucci, Francesco; Zanarini, Simone","Polypyridyl ruthenium(II) complexes with tetrazolate-based chelating ligands. Synthesis, reactivity, and electrochemical and photophysical properties.","Inorganic chemistry","2007","46","22","9126","9138","10.1021/ic7011556","","","0.71073","MoKα","","0.068","0.0513","","","0.1455","0.1588","","","","","","1.075","","","","has coordinates","264242","2021-04-16","08:52:18",""
"4339002","5.2366","0.0005","12.6144","0.0019","21.364","0.002","90","","96.086","0.008","90","","1403.3","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H17 N O3 -","- C16 H17 N O3 -","- C64 H68 N4 O12 -","4","1","","Ang, Wee Han; Daldini, Elisa; Juillerat-Jeanneret, Lucienne; Dyson, Paul J.","Strategy to tether organometallic ruthenium-arene anticancer compounds to recombinant human serum albumin.","Inorganic chemistry","2007","46","22","9048","9050","10.1021/ic701474m","","","0.71073","MoKα","","0.0811","0.0511","","","0.0903","0.1018","","","","","","1.128","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339003","20.93","0.02","17.304","0.008","6.992","0.003","90","","90.2","0.06","90","","2532","3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23.5 H30.5 Cl2 N4.5 O3.5 P Ru -","- C23.5 H30.5 Cl2 N4.5 O3.5 P Ru -","- C94 H122 Cl8 N18 O14 P4 Ru4 -","4","1","","Ang, Wee Han; Daldini, Elisa; Juillerat-Jeanneret, Lucienne; Dyson, Paul J.","Strategy to tether organometallic ruthenium-arene anticancer compounds to recombinant human serum albumin.","Inorganic chemistry","2007","46","22","9048","9050","10.1021/ic701474m","","","0.71073","MoKα","","0.1146","0.0886","","","0.212","0.2299","","","","","","1.122","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339004","15.1","0.003","16.311","0.003","23.866","0.004","101.992","0.002","106.52","0.002","94.217","0.002","5457.1","1.7","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C128 H188 Cl4 Mn22 N6 O88 P8 -","- C113.8 H145.18 Mn22 O88 P8 -","- C113.8 H145.18 Mn22 O88 P8 -","1","0.5","","Brockman, Jonathan T.; Stamatatos, Theocharis C.; Wernsdorfer, Wolfgang; Abboud, Khalil A.; Christou, George","Synthesis and characterization of a Mn22 single-molecule magnet and a [Mn22]n single-chain magnet.","Inorganic chemistry","2007","46","22","9160","9171","10.1021/ic7011292","","","0.71073","MoKα","","0.065","0.0485","","","0.1366","0.1492","","","","","","1.105","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339005","15.49","0.0006","24.4301","0.001","19.927","0.0008","90","","93.187","0.002","90","","7529.2","0.5","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H26 N6 O4 S2 -","- C32 H26 N6 O4 S2 -","- C256 H208 N48 O32 S16 -","8","2","","Lin, Tzu-Pin; Chen, Chan-Yu; Wen, Yuh-Sheng; Sun, Shih-Sheng","Synthesis, photophysical, and anion-sensing properties of quinoxalinebis(sulfonamide) functionalized receptors and their metal complexes.","Inorganic chemistry","2007","46","22","9201","9212","10.1021/ic701300a","","","0.71073","MoKα","","0.0929","0.051","","","0.1236","0.1321","","","","","","0.952","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339006","10.431","0.0002","11.9439","0.0003","14.7268","0.0003","100.209","0.001","98.885","0.001","108.095","0.001","1672.82","0.06","295","0.2","295","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H26 N4 O4 S2 -","- C34 H26 N4 O4 S2 -","- C68 H52 N8 O8 S4 -","2","1","","Lin, Tzu-Pin; Chen, Chan-Yu; Wen, Yuh-Sheng; Sun, Shih-Sheng","Synthesis, photophysical, and anion-sensing properties of quinoxalinebis(sulfonamide) functionalized receptors and their metal complexes.","Inorganic chemistry","2007","46","22","9201","9212","10.1021/ic701300a","","","0.71073","MoKα","","0.0629","0.0409","","","0.0957","0.0988","","","","","","0.938","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339007","9.6292","0.0004","12.7526","0.0005","21.3799","0.0008","79.08","0.001","89.946","0.001","75.018","0.001","2487.03","0.17","150","0.1","150","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C46 H42 Br2 N6 O12 Re2 S2 -","- C46 H34 Br2 N6 O12 Re2 S2 -","- C92 H68 Br4 N12 O24 Re4 S4 -","2","1","","Lin, Tzu-Pin; Chen, Chan-Yu; Wen, Yuh-Sheng; Sun, Shih-Sheng","Synthesis, photophysical, and anion-sensing properties of quinoxalinebis(sulfonamide) functionalized receptors and their metal complexes.","Inorganic chemistry","2007","46","22","9201","9212","10.1021/ic701300a","","","0.71073","MoKα","","0.0498","0.0356","","","0.0997","0.1061","","","","","","1.084","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339008","16.9178","0.0008","21.2629","0.0008","25.8518","0.0009","90","","98.706","0.004","90","","9192.3","0.6","100","1","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C105.5 H108 Fe2 Mo N2 O4 P4 -","- C106 H104 Fe2 Mo N2 O4 P4 -","- C424 H416 Fe8 Mo4 N8 O16 P16 -","4","1","","Paul, Frédéric; Goeb, Sébastien; Justaud, Frédéric; Argouarch, Gilles; Toupet, Loic; Ziessel, Raymond F.; Lapinte, Claude","New polypyridine ligands functionalized with redox-active Fe(II) organometallic fragments.","Inorganic chemistry","2007","46","22","9036","9038","10.1021/ic7014379","","","0.71073","MoKα","","0.1932","0.0563","","","0.1119","0.1324","","","","","","0.737","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339009","13.4551","0.0002","15.7071","0.0002","27.9066","0.0004","89.142","0.001","78.813","0.001","79.659","0.001","5690.55","0.14","120","1","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C136.5 H133.5 Fe3 N3 P6 -","- C136.5 H132 Fe3 N3 P6 -","- C273 H264 Fe6 N6 P12 -","2","1","","Paul, Frédéric; Goeb, Sébastien; Justaud, Frédéric; Argouarch, Gilles; Toupet, Loic; Ziessel, Raymond F.; Lapinte, Claude","New polypyridine ligands functionalized with redox-active Fe(II) organometallic fragments.","Inorganic chemistry","2007","46","22","9036","9038","10.1021/ic7014379","","","0.71069","MoKα","","0.115","0.0746","","","0.1979","0.2238","","","","","","1.038","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339010","14.6625","0.0003","17.6927","0.0003","19.0511","0.0004","113.054","0.001","103.303","0.001","99.354","0.001","4245.7","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C92 H89.5 Fe2 N3 O0.25 P4 -","- C92 H89.5 Fe2 N3 O0.25 P4 -","- C184 H179 Fe4 N6 O0.5 P8 -","2","1","","Paul, Frédéric; Goeb, Sébastien; Justaud, Frédéric; Argouarch, Gilles; Toupet, Loic; Ziessel, Raymond F.; Lapinte, Claude","New polypyridine ligands functionalized with redox-active Fe(II) organometallic fragments.","Inorganic chemistry","2007","46","22","9036","9038","10.1021/ic7014379","","","0.71069","MoKα","","0.1222","0.0748","","","0.2206","0.2704","","","","","","1.043","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339011","6.813","0.004","19.085","0.012","10.277","0.006","90","","107.788","0.01","90","","1272.4","1.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 As2 Cl2 S4 -","- C24 H20 As2 Cl2 S4 -","- C48 H40 As4 Cl4 S8 -","2","0.5","","Cangelosi, Virginia M.; Sather, Aaron C.; Zakharov, Lev N.; Berryman, Orion B.; Johnson, Darren W.","Diastereoselectivity in the self-assembly of As2L2Cl2 macrocycles is directed by the As-pi interaction.","Inorganic chemistry","2007","46","22","9278","9284","10.1021/ic701290h","","","0.71073","MoKα","","0.1402","0.0797","","","0.1767","0.2126","","","","","","1.044","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339012","19.313","0.004","19.923","0.004","24.508","0.005","78.11","0.004","78.86","0.005","89.183","0.005","9051","3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H21 As2 Cl5 S4 -","- C25 H21 As2 Cl5 S4 -","- C300 H252 As24 Cl60 S48 -","12","6","","Cangelosi, Virginia M.; Sather, Aaron C.; Zakharov, Lev N.; Berryman, Orion B.; Johnson, Darren W.","Diastereoselectivity in the self-assembly of As2L2Cl2 macrocycles is directed by the As-pi interaction.","Inorganic chemistry","2007","46","22","9278","9284","10.1021/ic701290h","","","0.71073","MoKα","","0.1577","0.0687","","","0.1278","0.1646","","","","","","0.981","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339013","6.3949","0.0013","19.675","0.004","10.967","0.002","90","","106.817","0.003","90","","1320.9","0.5","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 As2 Cl2 S4 -","- C24 H20 As2 Cl2 S4 -","- C48 H40 As4 Cl4 S8 -","2","0.5","","Cangelosi, Virginia M.; Sather, Aaron C.; Zakharov, Lev N.; Berryman, Orion B.; Johnson, Darren W.","Diastereoselectivity in the self-assembly of As2L2Cl2 macrocycles is directed by the As-pi interaction.","Inorganic chemistry","2007","46","22","9278","9284","10.1021/ic701290h","","","0.71073","MoKα","","0.0603","0.0486","","","0.1226","0.1314","","","","","","1.053","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339014","10.3332","0.0007","34.375","0.002","17.8593","0.0012","90","","98.965","0.001","90","","6266.2","0.7","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H26 As2 Cl2 S4 -","- C30 H26 As2 Cl2 S4 -","- C240 H208 As16 Cl16 S32 -","8","2","","Cangelosi, Virginia M.; Sather, Aaron C.; Zakharov, Lev N.; Berryman, Orion B.; Johnson, Darren W.","Diastereoselectivity in the self-assembly of As2L2Cl2 macrocycles is directed by the As-pi interaction.","Inorganic chemistry","2007","46","22","9278","9284","10.1021/ic701290h","","","0.71073","MoKα","","0.0657","0.0577","","","0.1155","0.1185","","","","","","1.26","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339015","11.7994","0.0002","13.6595","0.0002","15.0346","0.0003","88.266","0.001","86.454","0.001","88.827","0.001","2417.02","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H62 Cl Fe N4 O6 -","- C46.5 H55 Cl Fe N4 O6 -","- C93 H110 Cl2 Fe2 N8 O12 -","2","1","","Matoga, Dariusz; Szklarzewicz, Janusz; Stadnicka, Katarzyna; Shongwe, Musa S.","Iron(III) complexes with a biologically relevant aroylhydrazone: crystallographic evidence for coordination versatility.","Inorganic chemistry","2007","46","22","9042","9044","10.1021/ic701435x","","","0.71073","MoKα","","0.0923","0.062","","","0.1602","0.1811","","","","","","1.053","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339016","13.376","0.0003","31.0562","0.0006","11.8253","0.0002","90","","91.458","0.001","90","","4910.73","0.17","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H61 Fe N4 O6 -","- C46 H61 Fe N4 O6 -","- C184 H244 Fe4 N16 O24 -","4","1","","Matoga, Dariusz; Szklarzewicz, Janusz; Stadnicka, Katarzyna; Shongwe, Musa S.","Iron(III) complexes with a biologically relevant aroylhydrazone: crystallographic evidence for coordination versatility.","Inorganic chemistry","2007","46","22","9042","9044","10.1021/ic701435x","","","0.71073","MoKα","","0.1355","0.0932","","","0.2534","0.2832","","","","","","1.062","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339017","13.9644","0.0019","6.9088","0.001","16.034","0.002","90","","90","","90","","1546.9","0.4","193","2","193","2","","","","","","","","5","P c a 21","P 2c -2ac","29","Bis(octahydrotriborato)bis(dimethylether)magnesium(II)","","","- C4 H28 B6 Mg O2 -","- C4 H28 B6 Mg O2 -","- C16 H112 B24 Mg4 O8 -","4","1","","Kim, Do Young; Yang, Yu; Abelson, John R.; Girolami, Gregory S.","Volatile magnesium octahydrotriborate complexes as potential CVD precursors to MgB2. Synthesis and characterization of Mg(B3H8)2 and its etherates.","Inorganic chemistry","2007","46","22","9060","9066","10.1021/ic701037t","","","0.71073","MoKα","","0.0652","0.0347","","","0.0725","0.0796","","","","","","0.908","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339018","12.414","0.016","9.855","0.012","11.556","0.014","90","","116.721","0.019","90","","1263","3","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","bis(cyclopentadienyl)(tetrahydrofuran)magnesium","","","- C14 H18 Mg O -","- C14 H18 Mg O -","- C56 H72 Mg4 O4 -","4","0.5","","Kim, Do Young; Yang, Yu; Abelson, John R.; Girolami, Gregory S.","Volatile magnesium octahydrotriborate complexes as potential CVD precursors to MgB2. Synthesis and characterization of Mg(B3H8)2 and its etherates.","Inorganic chemistry","2007","46","22","9060","9066","10.1021/ic701037t","","","0.71073","MoKα","","0.1944","0.0824","","","0.1637","0.2045","","","","","","0.894","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339019","7.337","0.004","15.586","0.008","8.332","0.004","90","","90","","90","","952.8","0.8","193","2","193","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","Mg(B3H8)2(Et2O)2","f79u","","- C8 H36 B6 Mg O2 -","- C8 H36 B6 Mg O2 -","- C16 H72 B12 Mg2 O4 -","2","0.5","","Kim, Do Young; Yang, Yu; Abelson, John R.; Girolami, Gregory S.","Volatile magnesium octahydrotriborate complexes as potential CVD precursors to MgB2. Synthesis and characterization of Mg(B3H8)2 and its etherates.","Inorganic chemistry","2007","46","22","9060","9066","10.1021/ic701037t","","x-ray","0.71073","MoKα","","0.0776","0.0726","","","0.1557","0.1579","","","","","","1.225","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339020","13.464","0.002","10.0183","0.0015","11.247","0.0017","90","","100.283","0.003","90","","1492.7","0.4","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","lithium 3,5-diphenyl-1-methyl-4-methylamino-1,2,4,3,5-triazaborol-2-ide","","- C14 H17 B2 Li N4 -","- C14 H17 B2 Li N4 -","- C56 H68 B8 Li4 N16 -","4","1","","Ly, Hanh V.; Chow, Joanna H.; Parvez, Masood; McDonald, Robert; Roesler, Roland","Revisiting the 1,2,4-triaza-3,5-diborolyl ligand: sigma and pi coordination modes in the alkali metal and rhodium complexes of a planar, 6-pi-electron B2N3- ring.","Inorganic chemistry","2007","46","22","9303","9311","10.1021/ic7013286","","","0.71073","MoKα","","0.1298","0.0621","","","0.1589","0.2012","","","","","","1.039","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339021","9.111","0.004","17.582","0.004","18.059","0.006","90","","91.344","0.014","90","","2892.1","1.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H32 B3 K N4 -","- C32 H32 B3 K N4 -","- C128 H128 B12 K4 N16 -","4","1","","Ly, Hanh V.; Chow, Joanna H.; Parvez, Masood; McDonald, Robert; Roesler, Roland","Revisiting the 1,2,4-triaza-3,5-diborolyl ligand: sigma and pi coordination modes in the alkali metal and rhodium complexes of a planar, 6-pi-electron B2N3- ring.","Inorganic chemistry","2007","46","22","9303","9311","10.1021/ic7013286","","","0.71073","MoKα","","0.0781","0.0456","","","0.1075","0.1258","","","","","","1.001","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339022","32.087","0.012","11.022","0.005","23.883","0.007","90","","118.1","0.02","90","","7451","5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H41 B3 Li N7 -","- C38 H41 B3 Li N7 -","- C304 H328 B24 Li8 N56 -","8","1","","Ly, Hanh V.; Chow, Joanna H.; Parvez, Masood; McDonald, Robert; Roesler, Roland","Revisiting the 1,2,4-triaza-3,5-diborolyl ligand: sigma and pi coordination modes in the alkali metal and rhodium complexes of a planar, 6-pi-electron B2N3- ring.","Inorganic chemistry","2007","46","22","9303","9311","10.1021/ic7013286","","","0.71073","MoKα","","0.1085","0.0624","","","0.1475","0.1768","","","","","","1.019","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339023","9.818","0.002","10.13","0.003","13.284","0.003","77.906","0.013","77.701","0.013","87.761","0.015","1262.2","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H37 B2 N4 O Rh -","- C26 H37 B2 N4 O Rh -","- C52 H74 B4 N8 O2 Rh2 -","2","1","","Ly, Hanh V.; Chow, Joanna H.; Parvez, Masood; McDonald, Robert; Roesler, Roland","Revisiting the 1,2,4-triaza-3,5-diborolyl ligand: sigma and pi coordination modes in the alkali metal and rhodium complexes of a planar, 6-pi-electron B2N3- ring.","Inorganic chemistry","2007","46","22","9303","9311","10.1021/ic7013286","","","0.71073","MoKα","","0.0515","0.0383","","","0.0921","0.098","","","","","","1.029","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339024","7.746","0.004","11.973","0.004","16.742","0.009","90","","90","","90","","1552.7","1.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H17 B2 K N4 -","- C14 H17 B2 K N4 -","- C56 H68 B8 K4 N16 -","4","1","","Ly, Hanh V.; Chow, Joanna H.; Parvez, Masood; McDonald, Robert; Roesler, Roland","Revisiting the 1,2,4-triaza-3,5-diborolyl ligand: sigma and pi coordination modes in the alkali metal and rhodium complexes of a planar, 6-pi-electron B2N3- ring.","Inorganic chemistry","2007","46","22","9303","9311","10.1021/ic7013286","","","0.71073","MoKα","","0.0466","0.0379","","","0.0952","0.1014","","","","","","1.056","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339025","13.419","0.007","10.143","0.005","11.526","0.008","90","","99.82","0.03","90","","1545.8","1.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H17 B2 N4 Na -","- C14 H17 B2 N4 Na -","- C56 H68 B8 N16 Na4 -","4","1","","Ly, Hanh V.; Chow, Joanna H.; Parvez, Masood; McDonald, Robert; Roesler, Roland","Revisiting the 1,2,4-triaza-3,5-diborolyl ligand: sigma and pi coordination modes in the alkali metal and rhodium complexes of a planar, 6-pi-electron B2N3- ring.","Inorganic chemistry","2007","46","22","9303","9311","10.1021/ic7013286","","","0.71073","MoKα","","0.1458","0.0539","","","0.1131","0.1486","","","","","","1","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339026","11.6733","0.0014","15.6152","0.0018","10.306","0.0012","90","","90","","90","","1878.6","0.4","150","2","150","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","{Me2In[OCH2CH2N(Me)2]}2","compound 1 ?","","- C12 H32 In2 N2 O2 -","- C12 H32 In2 N2 O2 -","- C48 H128 In8 N8 O8 -","4","0.5","","Basharat, Siama; Carmalt, Claire J.; Barnett, Sarah A.; Tocher, Derek A.; Davies, Hywel O.","Aerosol assisted chemical vapor deposition of In2O3 films from Me3In and donor functionalized alcohols.","Inorganic chemistry","2007","46","22","9473","9480","10.1021/ic701372b","","","0.71073","MoKα","","0.0232","0.0201","","","0.0453","0.0466","","","","","","1.112","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4339027","15.5563","0.0012","8.1075","0.0006","16.7231","0.0013","90","","96.95","0.001","90","","2093.7","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","{Me2In[N(Me)2CH2CH(Me)O]}2","compound 2 ?","","- C14 H36 In2 N2 O2 -","- C14 H36 In2 N2 O2 -","- C56 H144 In8 N8 O8 -","4","1","","Basharat, Siama; Carmalt, Claire J.; Barnett, Sarah A.; Tocher, Derek A.; Davies, Hywel O.","Aerosol assisted chemical vapor deposition of In2O3 films from Me3In and donor functionalized alcohols.","Inorganic chemistry","2007","46","22","9473","9480","10.1021/ic701372b","","","0.71073","MoKα","","0.0197","0.0177","","","0.0416","0.0423","","","","","","1.086","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4339028","8.3096","0.0009","15.0739","0.0016","8.7685","0.0009","90","","112.743","0.002","90","","1012.93","0.19","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","{Me2In[OC(Me)2CH2OMe]}2","compound 3 ?","","- C14 H34 In2 O4 -","- C14 H34 In2 O4 -","- C28 H68 In4 O8 -","2","0.5","","Basharat, Siama; Carmalt, Claire J.; Barnett, Sarah A.; Tocher, Derek A.; Davies, Hywel O.","Aerosol assisted chemical vapor deposition of In2O3 films from Me3In and donor functionalized alcohols.","Inorganic chemistry","2007","46","22","9473","9480","10.1021/ic701372b","","","0.71073","MoKα","","0.0197","0.018","","","0.0419","0.0427","","","","","","1.078","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4339029","8.382","0.0008","8.4014","0.0008","10.1223","0.001","66.184","0.001","85.316","0.002","82.575","0.002","646.31","0.11","150","2","150","2","","","","","","","","5","P -1","-P 1","2","{Me2In[N(Me)2CH2CHOCH2N(Me)2]}2","compound 4 ?","","- C18 H46 In2 N4 O2 -","- C18 H46 In2 N4 O2 -","- C18 H46 In2 N4 O2 -","1","0.5","","Basharat, Siama; Carmalt, Claire J.; Barnett, Sarah A.; Tocher, Derek A.; Davies, Hywel O.","Aerosol assisted chemical vapor deposition of In2O3 films from Me3In and donor functionalized alcohols.","Inorganic chemistry","2007","46","22","9473","9480","10.1021/ic701372b","","","0.71073","MoKα","","0.0248","0.023","","","0.0567","0.0576","","","","","","1.108","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4339030","7.269","0.004","7.307","0.004","11.469","0.005","98.283","0.01","100.122","0.009","118.767","0.007","506.9","0.5","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H20 Fe N6 O6 S2 -","- C12 H20 Fe N6 O6 S2 -","- C12 H20 Fe N6 O6 S2 -","1","0.5","","Xie, Jingli; Ma, Michelle T.; Abrahams, Brendan F.; Wedd, Anthony G.","A pillared discrete bilayer formed from guanidinium and ferrocenedisulfonate ions: synthesis, crystal structure, and initial electrochemical properties.","Inorganic chemistry","2007","46","22","9027","9029","10.1021/ic7011974","","","0.71073","MoKα","","0.3909","0.2832","","","0.5609","0.6197","","","","","","1.013","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339031","14.4605","0.001","21.1321","0.0014","14.7606","0.001","90","","108.773","0.001","90","","4270.6","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H44 Cl2 N4 P2 Ru -","- C50 H44 Cl2 N4 P2 Ru -","- C200 H176 Cl8 N16 P8 Ru4 -","4","1","","Roy, Amit Saha; Tuononen, Heikki M.; Rath, Sankar P.; Ghosh, Prasanta","First ruthenium complex of glyoxalbis(N-phenyl)osazone (L(NHPh)H(2)): synthesis, x-ray structure, spectra, and density functional theory calculations of (L(NHPh)H(2))Ru(PPh(3))(2)Cl(2).","Inorganic chemistry","2007","46","15","5942","5948","10.1021/ic070294q","","","0.71073","MoKα","","0.0655","0.0444","","","0.0893","0.0959","","","","","","0.929","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339032","14.9945","0.0008","23.5994","0.0013","14.2714","0.0008","90","","112.112","0.001","90","","4678.7","0.4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H25 Cl2 Cu N3 O9 S -","- C17 H25 Cl2 Cu N3 O9 S -","- C136 H200 Cl16 Cu8 N24 O72 S8 -","8","2","","Lee, Dong-Heon; Hatcher, Lanying Q.; Vance, Michael A.; Sarangi, Ritimukta; Milligan, Ashley E.; Sarjeant, Amy A Narducci; Incarvito, Christopher D.; Rheingold, Arnold L.; Hodgson, Keith O.; Hedman, Britt; Solomon, Edward I.; Karlin, Kenneth D.","Copper(I) complex O(2)-reactivity with a N(3)S thioether ligand: a copper-dioxygen adduct including sulfur ligation, ligand oxygenation, and comparisons with all nitrogen ligand analogues.","Inorganic chemistry","2007","46","15","6056","6068","10.1021/ic700541k","","","0.71073","MoKα","","0.0561","0.0463","","","0.1269","0.1355","","","","","","1.029","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339033","11.69","0.003","17.998","0.004","14.173","0.003","90","","111.013","0.005","90","","2783.6","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H54 N12 O31 Zn6 -","- C28 H40 N12 O31 Zn6 -","- C56 H80 N24 O62 Zn12 -","2","0.5","","Gu, Jin-Zhong; Lu, Wen-Guan; Jiang, Long; Zhou, Hong-Cai; Lu, Tong-Bu","3D porous metal-organic framework exhibiting selective adsorption of water over organic solvents.","Inorganic chemistry","2007","46","15","5835","5837","10.1021/ic7004908","","","0.71073","MoKα","","0.11","0.054","","","0.1328","0.1597","","","","","","1.005","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339034","3.5183","0.0001","10.6365","0.0001","11.3204","0.0001","81.368","0.001","86.303","0.001","83.541","0.001","415.691","0.013","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C6 H6 Ag N3 O5 -","- C6 H6 Ag N3 O5 -","- C12 H12 Ag2 N6 O10 -","2","1","","Abu-Youssef, Morsy A M; Dey, Raja; Gohar, Yousry; Massoud, Alshima'a A.; Ohrström, Lars; Langer, Vratislav","Synthesis and structure of silver complexes with nicotinate-type ligands having antibacterial activities against clinically isolated antibiotic resistant pathogens.","Inorganic chemistry","2007","46","15","5893","5903","10.1021/ic0621594","","","0.71073","MoKα","","0.0406","0.0289","","","0.0584","0.0632","","","","","","0.986","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339035","7.3026","0.0001","8.9139","0.0002","11.1363","0.0002","95.966","0.001","99.428","0.001","100.698","0.001","695.91","0.02","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H12 Ag N5 O5 -","- C12 H12 Ag N5 O5 -","- C24 H24 Ag2 N10 O10 -","2","1","","Abu-Youssef, Morsy A M; Dey, Raja; Gohar, Yousry; Massoud, Alshima'a A.; Ohrström, Lars; Langer, Vratislav","Synthesis and structure of silver complexes with nicotinate-type ligands having antibacterial activities against clinically isolated antibiotic resistant pathogens.","Inorganic chemistry","2007","46","15","5893","5903","10.1021/ic0621594","","","0.71073","MoKα","","0.0352","0.0271","","","0.0624","0.0664","","","","","","1.008","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339036","7.2836","0.0002","7.8177","0.0002","16.28","0.0004","77.062","0.001","86.046","0.001","81.727","0.001","893.42","0.04","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H18 Ag N3 O7 -","- C16 H18 Ag N3 O7 -","- C32 H36 Ag2 N6 O14 -","2","1","","Abu-Youssef, Morsy A M; Dey, Raja; Gohar, Yousry; Massoud, Alshima'a A.; Ohrström, Lars; Langer, Vratislav","Synthesis and structure of silver complexes with nicotinate-type ligands having antibacterial activities against clinically isolated antibiotic resistant pathogens.","Inorganic chemistry","2007","46","15","5893","5903","10.1021/ic0621594","","","0.71073","MoKα","","0.0439","0.0304","","","0.0711","0.0777","","","","","","0.98","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339037","6.945","0.0001","12.09","0.0003","12.469","0.0002","64.437","0.001","76.351","0.001","74.229","0.001","900.39","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H18 Ag N3 O7 -","- C16 H18 Ag N3 O7 -","- C32 H36 Ag2 N6 O14 -","2","1","","Abu-Youssef, Morsy A M; Dey, Raja; Gohar, Yousry; Massoud, Alshima'a A.; Ohrström, Lars; Langer, Vratislav","Synthesis and structure of silver complexes with nicotinate-type ligands having antibacterial activities against clinically isolated antibiotic resistant pathogens.","Inorganic chemistry","2007","46","15","5893","5903","10.1021/ic0621594","","","0.71073","MoKα","","0.0773","0.0447","","","0.0917","0.1042","","","","","","1.001","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339038","7.3257","0.0001","10.0792","0.0002","12.4069","0.0001","69.001","0.001","76.142","0.001","81.098","0.001","827.95","0.02","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H16 Ag N3 O8 -","- C14 H16 Ag N3 O8 -","- C28 H32 Ag2 N6 O16 -","2","1","","Abu-Youssef, Morsy A M; Dey, Raja; Gohar, Yousry; Massoud, Alshima'a A.; Ohrström, Lars; Langer, Vratislav","Synthesis and structure of silver complexes with nicotinate-type ligands having antibacterial activities against clinically isolated antibiotic resistant pathogens.","Inorganic chemistry","2007","46","15","5893","5903","10.1021/ic0621594","","","0.71073","MoKα","","0.0798","0.0425","","","0.0726","0.0839","","","","","","1.039","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339039","14.37","0.003","14.595","0.004","15.995","0.004","102.835","0.002","92.41","0.002","103.181","0.003","3169.4","1.4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C33 H34 Cl17 F6 N8 O11 P Ru3 -","- C33 H33 Cl17 F6 N8 O11 P Ru3 -","- C66 H66 Cl34 F12 N16 O22 P2 Ru6 -","2","1","","Ye, Heng-Yun; Dai, Feng-Rong; Zhang, Li-Yi; Chen, Zhong-Ning","Low-valence triruthenium compounds via substitution of a bridging acetate in the parent Ru(3)O(OAc)(6) cluster core by 2,2'-azobispyridine (abpy) or 2,2'-azobis(5-chloropyrimidine) (abcp).","Inorganic chemistry","2007","46","15","6129","6135","10.1021/ic0702771","","","0.71073","MoKα","","0.0612","0.0527","","","0.1609","0.1704","","","","","","1.312","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339040","17.443","0.003","10.229","0.002","19.207","0.004","90","","110.09","0.008","90","","3218.5","1.1","133.2","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C32 H41 Cl Co N3 O7 -","- C32 H41 Cl Co N3 O7 -","- C128 H164 Cl4 Co4 N12 O28 -","4","1","","Shimazaki, Yuichi; Kabe, Ryota; Huth, Stefan; Tani, Fumito; Naruta, Yoshinori; Yamauchi, Osamu","Formation and characterization of Co(III)-semiquinonate phenoxyl radical species.","Inorganic chemistry","2007","46","15","6083","6090","10.1021/ic700596g","","","0.7107","MoKα","","","0.0648","","","","0.1747","","","","","","0.808","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339041","11.382","0.001","11.971","0.002","21.791","0.003","90","","104.223","0.005","90","","2878.1","0.7","133.2","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C29 H37 Cl Co N4 O -","- C29 H37 Cl Co N4 O -","- C116 H148 Cl4 Co4 N16 O4 -","4","1","","Shimazaki, Yuichi; Kabe, Ryota; Huth, Stefan; Tani, Fumito; Naruta, Yoshinori; Yamauchi, Osamu","Formation and characterization of Co(III)-semiquinonate phenoxyl radical species.","Inorganic chemistry","2007","46","15","6083","6090","10.1021/ic700596g","","","0.7107","MoKα","","","0.0325","","","","0.0764","","","","","","0.842","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339042","10.508","0.001","14.823","0.001","35.388","0.003","90","","90","","90","","5512","0.8","133.2","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C29 H38 Cl Co N3 O -","- C29 H38 Cl Co N3 O -","- C232 H304 Cl8 Co8 N24 O8 -","8","1","","Shimazaki, Yuichi; Kabe, Ryota; Huth, Stefan; Tani, Fumito; Naruta, Yoshinori; Yamauchi, Osamu","Formation and characterization of Co(III)-semiquinonate phenoxyl radical species.","Inorganic chemistry","2007","46","15","6083","6090","10.1021/ic700596g","","","0.7107","MoKα","","","0.0338","","","","0.089","","","","","","0.81","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339043","9.248","0.003","12.351","0.004","19.719","0.006","95.78","0.03","90.25","0.02","95.51","0.03","2230.3","1.2","296.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C45 H55 Cl3 Co N3 O7 -","- C44 H60 Cl3 Co N3 O7 -","- C88 H120 Cl6 Co2 N6 O14 -","2","1","","Shimazaki, Yuichi; Kabe, Ryota; Huth, Stefan; Tani, Fumito; Naruta, Yoshinori; Yamauchi, Osamu","Formation and characterization of Co(III)-semiquinonate phenoxyl radical species.","Inorganic chemistry","2007","46","15","6083","6090","10.1021/ic700596g","","","0.7107","MoKα","","","0.0661","","","","0.2267","","","","","","1.981","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339044","32.425","0.003","25.599","0.003","10.507","0.001","90","","90","","90","","8721.3","1.5","133.2","","","","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C43 H57 Co N4 O3 -","- C43 H57 Co N4 O3 -","- C344 H456 Co8 N32 O24 -","8","1","","Shimazaki, Yuichi; Kabe, Ryota; Huth, Stefan; Tani, Fumito; Naruta, Yoshinori; Yamauchi, Osamu","Formation and characterization of Co(III)-semiquinonate phenoxyl radical species.","Inorganic chemistry","2007","46","15","6083","6090","10.1021/ic700596g","","","0.7107","MoKα","","","0.0719","","","","0.213","","","","","","1.023","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339045","15.212","0.001","15.212","0.001","15.451","0.002","90","","90","","120","","3096.4","0.5","294","2","294","2","","","","","","","","6","P 6/m c c","-P 6 2c","192","","","","- C42 H36.5 Co3 Gd2 N6 O33.25 -","- C42 H36.48 Co3 Gd2 N6 O33.25 -","- C84 H72.96 Co6 Gd4 N12 O66.5 -","2","0.0833333","","Zhao, Xiao-Qing; Zhao, Bin; Ma, Yue; Shi, Wei; Cheng, Peng; Jiang, Zong-Hui; Liao, Dai-Zheng; Yan, Shi-Ping","Lanthanide(III)-cobalt(II) heterometallic coordination polymers with radical adsorption properties.","Inorganic chemistry","2007","46","15","5832","5834","10.1021/ic7007446","","","0.71073","MoKα","","0.0398","0.0299","","","0.1214","0.1326","","","","","","1.038","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339046","15.4318","0.0008","15.4318","0.0008","15.2764","0.0017","90","","90","","120","","3150.5","0.4","294","2","294","2","","","","","","","","6","P 6/m c c","-P 6 2c","192","","","","- C42 H44 Co3 N6 Nd2 O37 -","- C42 H30 Co3 N6 Nd2 O36.97 -","- C84 H60 Co6 N12 Nd4 O73.94 -","2","0.0833333","","Zhao, Xiao-Qing; Zhao, Bin; Ma, Yue; Shi, Wei; Cheng, Peng; Jiang, Zong-Hui; Liao, Dai-Zheng; Yan, Shi-Ping","Lanthanide(III)-cobalt(II) heterometallic coordination polymers with radical adsorption properties.","Inorganic chemistry","2007","46","15","5832","5834","10.1021/ic7007446","","","0.71073","MoKα","","0.0391","0.0291","","","0.1205","0.131","","","","","","1.034","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339047","18.2475","0.0009","18.2475","0.0009","6.8687","0.0003","90","","90","","120","","1980.67","0.16","180","2","180","2","","","","","","","","4","P 63","P 6c","173","","","","- P7 Rb3 S25 Ti3 -","- P7 Rb3.0002 S25 Ti3 -","- P14 Rb6.0004 S50 Ti6 -","2","0.333333","","Wu, Yuandong; Bensch, Wolfgang","Rb(3)Ti(3)(P(4)S(13))(PS(4))(3) and Cs(2)Ti(2)(P(2)S(8))(PS(4))(2): two polar titanium thiophosphates with complex one-dimensional tunnels.","Inorganic chemistry","2007","46","15","6170","6177","10.1021/ic700478r","","","0.71073","MoKα","","0.039","0.0318","","","0.0723","0.0754","","","","","","1.022","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339048","21.9709","0.0014","6.9093","0.0003","17.1489","0.001","90","","98.785","0.007","90","","2572.7","0.3","220","2","220","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- Cs2 P4 S16 Ti2 -","- Cs2 P4 S16 Ti2 -","- Cs8 P16 S64 Ti8 -","4","1","","Wu, Yuandong; Bensch, Wolfgang","Rb(3)Ti(3)(P(4)S(13))(PS(4))(3) and Cs(2)Ti(2)(P(2)S(8))(PS(4))(2): two polar titanium thiophosphates with complex one-dimensional tunnels.","Inorganic chemistry","2007","46","15","6170","6177","10.1021/ic700478r","","","0.71073","MoKα","","0.0414","0.0337","","","0.0771","0.0801","","","","","","0.973","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339049","9.9344","0.0011","19.756","0.002","22.601","0.003","90","","95.708","0.002","90","","4413.8","0.9","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H57 Cl7 Li2 O10 Pr -","- C27 H57 Cl7 Li2 O10 Pr -","- C108 H228 Cl28 Li8 O40 Pr4 -","4","1","","Aspinall, Helen C.; Bickley, Jamie F.; Gaskell, Jeffrey M.; Jones, Anthony C.; Labat, Gael; Chalker, Paul R.; Williams, Paul A.","Precursors for MOCVD and ALD of rare earth oxides-complexes of the early lanthanides with a donor-functionalized alkoxide ligand.","Inorganic chemistry","2007","46","15","5852","5860","10.1021/ic061382y","","","0.71073","MoKα","","0.1159","0.051","","","0.0986","0.1101","","","","","","0.761","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339050","39.443","0.004","14.7341","0.0015","20.618","0.002","90","","100.036","0.002","90","","11799","2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C45 H99 La3 O18 -","- C45 H99 La3 O18 -","- C360 H792 La24 O144 -","8","1","","Aspinall, Helen C.; Bickley, Jamie F.; Gaskell, Jeffrey M.; Jones, Anthony C.; Labat, Gael; Chalker, Paul R.; Williams, Paul A.","Precursors for MOCVD and ALD of rare earth oxides-complexes of the early lanthanides with a donor-functionalized alkoxide ligand.","Inorganic chemistry","2007","46","15","5852","5860","10.1021/ic061382y","","","0.71073","MoKα","","0.0514","0.046","","","0.1196","0.1222","","","","","","1.078","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339051","11.514","0.0007","13.5134","0.0008","22.3467","0.0013","74.749","0.001","78.496","0.001","71.226","0.001","3150.9","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H100 La3 Na O19 -","- C45 H100 La3 Na O19 -","- C90 H200 La6 Na2 O38 -","2","1","","Aspinall, Helen C.; Bickley, Jamie F.; Gaskell, Jeffrey M.; Jones, Anthony C.; Labat, Gael; Chalker, Paul R.; Williams, Paul A.","Precursors for MOCVD and ALD of rare earth oxides-complexes of the early lanthanides with a donor-functionalized alkoxide ligand.","Inorganic chemistry","2007","46","15","5852","5860","10.1021/ic061382y","","","0.71073","MoKα","","0.0335","0.0299","","","0.0785","0.0802","","","","","","1.074","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339052","11.6604","0.0014","13.658","0.002","13.7802","0.0017","90","","90","","90","","2194.6","0.5","200","","","","","","","","","","","4","F m m m","-F 2 2","69","","","","- As2 Ba F22 Xe5 -","- As2 Ba F22 Xe5 -","- As8 Ba4 F88 Xe20 -","4","0.125","","Gerken, Michael; Hazendonk, Paul; Iuga, Adriana; Nieboer, Jared; Tramsek, Melita; Goreshnik, Evgeny; Zemva, Boris; Zheng, Shaohui; Autschbach, Jochen","Solid-state NMR spectroscopic study of coordination compounds of XeF(2) with metal cations and the crystal structure of [Ba(XeF(2))(5)][AsF(6)](2).","Inorganic chemistry","2007","46","15","6069","6077","10.1021/ic700557m","","","0.71069","MoKα","","0.0614","0.035","","","0.0828","0.1011","","","","","","0.922","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339053","12.0985","0.0009","13.9437","0.001","13.6072","0.0011","90","","90","","90","","2295.5","0.3","200","","","","","","","","","","","4","F m m m","-F 2 2","69","","","","- Ba F22 Sb2 Xe5 -","- Ba F22 Sb2 Xe5 -","- Ba4 F88 Sb8 Xe20 -","4","0.125","","Gerken, Michael; Hazendonk, Paul; Iuga, Adriana; Nieboer, Jared; Tramsek, Melita; Goreshnik, Evgeny; Zemva, Boris; Zheng, Shaohui; Autschbach, Jochen","Solid-state NMR spectroscopic study of coordination compounds of XeF(2) with metal cations and the crystal structure of [Ba(XeF(2))(5)][AsF(6)](2).","Inorganic chemistry","2007","46","15","6069","6077","10.1021/ic700557m","","","0.71069","MoKα","","0.069","0.0506","","","0.1391","0.1531","","","","","","1.103","","","","has coordinates","273129","2022-02-23","10:11:35",""
"4339054","14.7407","0.0008","9.1414","0.0005","23.4181","0.0013","90","","98.232","0.001","90","","3123.1","0.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H26 Br Cl2 N4 O3 Re -","- C32 H26 Br Cl2 N4 O3 Re -","- C128 H104 Br4 Cl8 N16 O12 Re4 -","4","1","","Si, Zhenjun; Li, Jiang; Li, Bin; Zhao, Feifei; Liu, Shiyong; Li, Wenlian","Synthesis, structural characterization, and electrophosphorescent properties of rhenium(I) complexes containing carrier-transporting groups.","Inorganic chemistry","2007","46","15","6155","6163","10.1021/ic061645o","","","0.71073","MoKα","","0.1166","0.0636","","","0.1483","0.1713","","","","","","1.067","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339055","8.607","0.001","14.322","0.001","12.731","0.001","90","","100.295","0.001","90","","1544.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(1,3-bis(2-carboxymethyl)benzene-triazenide-N,O)-palladium)","","- C32 H28 N6 O8 Pd2 -","- C32 H28 N6 O8 Pd2 -","- C64 H56 N12 O16 Pd4 -","2","0.5","","Nuricumbo-Escobar, Juan José; Campos-Alvarado, Carlos; Ríos-Moreno, Gustavo; Morales-Morales, David; Walsh, Patrick J.; Parra-Hake, Miguel","Binuclear palladium(I) and palladium(II) complexes of ortho-functionalized 1,3-bis(aryl)triazenido ligands.","Inorganic chemistry","2007","46","15","6182","6189","10.1021/ic700516p","","","0.71073","MoKα","","0.0448","0.0352","","","0.0731","0.0765","","","","","","1.072","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339056","10.4058","0.0005","16.2488","0.0008","9.95","0.0005","90","","90","","90","","1682.36","0.14","143","1","143","1","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C29 H30 Cl4 N6 Pd2 S2 -","- C29 H30 Cl4 N6 Pd2 S2 -","- C58 H60 Cl8 N12 Pd4 S4 -","2","0.5","","Nuricumbo-Escobar, Juan José; Campos-Alvarado, Carlos; Ríos-Moreno, Gustavo; Morales-Morales, David; Walsh, Patrick J.; Parra-Hake, Miguel","Binuclear palladium(I) and palladium(II) complexes of ortho-functionalized 1,3-bis(aryl)triazenido ligands.","Inorganic chemistry","2007","46","15","6182","6189","10.1021/ic700516p","","","0.71069","MoKα","","0.0462","0.0424","","","0.1083","0.1129","","","","","","1.129","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4339057","6.6288","0.0005","10.2631","0.001","11.0246","0.0011","85.579","0.006","80.885","0.006","74.607","0.006","713.51","0.12","143","1","143","1","","","","","","","","5","P -1","-P 1","2","","","","- C30 H28 N6 O4 Pd2 -","- C30 H28 N6 O4 Pd2 -","- C30 H28 N6 O4 Pd2 -","1","0.5","","Nuricumbo-Escobar, Juan José; Campos-Alvarado, Carlos; Ríos-Moreno, Gustavo; Morales-Morales, David; Walsh, Patrick J.; Parra-Hake, Miguel","Binuclear palladium(I) and palladium(II) complexes of ortho-functionalized 1,3-bis(aryl)triazenido ligands.","Inorganic chemistry","2007","46","15","6182","6189","10.1021/ic700516p","","","0.71069","MoKα","","0.0196","0.019","","","0.0464","0.047","","","","","","1.097","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4339058","20.866","0.003","20.866","0.003","13.156","0.002","90","","90","","90","","5728","1.5","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","Bis(1,3-bis(2-methoxy)benzene-triazenide-N,O)-palladium)","","- C28 H28 N6 O4 Pd2 -","- C28 H28 N6 O4 Pd2 -","- C224 H224 N48 O32 Pd16 -","8","0.5","","Nuricumbo-Escobar, Juan José; Campos-Alvarado, Carlos; Ríos-Moreno, Gustavo; Morales-Morales, David; Walsh, Patrick J.; Parra-Hake, Miguel","Binuclear palladium(I) and palladium(II) complexes of ortho-functionalized 1,3-bis(aryl)triazenido ligands.","Inorganic chemistry","2007","46","15","6182","6189","10.1021/ic700516p","","","0.71073","MoKα","","0.054","0.0318","","","0.0445","0.0466","","","","","","1.013","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339059","3.872","0.003","16.647","0.01","7.377","0.005","90","","99.074","0.008","90","","469.5","0.6","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C3 H6 Br2 Cu2 N6 -","- C3 H6 Br2 Cu2 N6 -","- C6 H12 Br4 Cu4 N12 -","2","0.5","","Zhang, Lei; Zhang, Jian; Li, Zhao-Ji; Cheng, Jian-Kai; Yin, Pei-Xiu; Yao, Yuan-Gen","New coordination motifs of melamine directed by N-H—X (X = Cl or Br) hydrogen bonds.","Inorganic chemistry","2007","46","15","5838","5840","10.1021/ic7005138","","","0.71073","MoKα","","0.0333","0.0284","","","0.0661","0.0683","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339060","17.8255","0.0018","3.6689","0.0004","15.9805","0.0018","90","","90","","90","","1045.12","0.19","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C3 H6 Cl3 Cu3 N6 -","- C3 H6 Cl3 Cu3 N6 -","- C12 H24 Cl12 Cu12 N24 -","4","1","","Zhang, Lei; Zhang, Jian; Li, Zhao-Ji; Cheng, Jian-Kai; Yin, Pei-Xiu; Yao, Yuan-Gen","New coordination motifs of melamine directed by N-H—X (X = Cl or Br) hydrogen bonds.","Inorganic chemistry","2007","46","15","5838","5840","10.1021/ic7005138","","","0.71073","MoKα","","0.0349","0.0285","","","0.0544","0.0569","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339061","10.9596","0.0002","14.6367","0.0004","18.5586","0.0006","78.498","0.001","81.692","0.001","77.416","0.001","2831.23","0.13","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C65 H57 Cl N2 O3 P4 Ru S -","- C65 H57 Cl N2 O3 P4 Ru S -","- C130 H114 Cl2 N4 O6 P8 Ru2 S2 -","2","1","","Fillaut, Jean-Luc; Andriès, Julien; Perruchon, Johann; Desvergne, Jean-Pierre; Toupet, Loïc; Fadel, Lotfi; Zouchoune, Bachir; Saillard, Jean-Yves","Alkynyl ruthenium colorimetric sensors: optimizing the selectivity toward fluoride anion.","Inorganic chemistry","2007","46","15","5922","5932","10.1021/ic062389i","","","0.71069","MoKα","","0.0664","0.0401","","","0.1011","0.1245","","","","","","1.047","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339062","21.0082","0.0009","21.0082","0.0009","40.4","0.003","90","","90","","90","","17830.3","1.7","273","2","273","2","","","","","","","","7","I 41/a c d :2","-I 4bd 2c","142","","","","- C40 H58 As8 Co2 N16 O43 V14 -","- C40 H56 As8 Co2 N16 O43 V14 -","- C320 H448 As64 Co16 N128 O344 V112 -","8","0.25","","Dong, Bao-xia; Peng, Jun; Gómez-García, Carlos J; Benmansour, Samia; Jia, Heng-qing; Hu, Ning-hai","High-dimensional assembly depending on polyoxoanion templates, metal ion coordination geometries, and a flexible bis(imidazole) ligand.","Inorganic chemistry","2007","46","15","5933","5941","10.1021/ic070007i","","","0.71073","MoKα","","0.0732","0.0476","","","0.134","0.1436","","","","","","1.043","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339063","20.9245","0.0004","20.9245","0.0004","40.6114","0.0016","90","","90","","90","","17781.1","0.8","293","2","293","2","","","","","","","","7","I 41/a c d :2","-I 4bd 2c","142","","","","- C40 H58 As8 N16 Ni2 O43 V14 -","- C40 H56 As8 N16 Ni2 O43 V14 -","- C320 H448 As64 N128 Ni16 O344 V112 -","8","0.25","","Dong, Bao-xia; Peng, Jun; Gómez-García, Carlos J; Benmansour, Samia; Jia, Heng-qing; Hu, Ning-hai","High-dimensional assembly depending on polyoxoanion templates, metal ion coordination geometries, and a flexible bis(imidazole) ligand.","Inorganic chemistry","2007","46","15","5933","5941","10.1021/ic070007i","","","0.71073","MoKα","","0.0904","0.0527","","","0.1461","0.168","","","","","","1.028","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339064","56.305","0.01","14.621","0.003","22.372","0.004","90","","110.706","0.004","90","","17228","6","273","2","273","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C40 H58 As8 Cu4 N16 O43 V14 -","- C40 H56 As8 Cu4 N16 O43 V14 -","- C320 H448 As64 Cu32 N128 O344 V112 -","8","1","","Dong, Bao-xia; Peng, Jun; Gómez-García, Carlos J; Benmansour, Samia; Jia, Heng-qing; Hu, Ning-hai","High-dimensional assembly depending on polyoxoanion templates, metal ion coordination geometries, and a flexible bis(imidazole) ligand.","Inorganic chemistry","2007","46","15","5933","5941","10.1021/ic070007i","","","0.71073","MoKα","","0.2536","0.079","","","0.1575","0.1971","","","","","","0.696","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339065","14.164","0.003","16.024","0.003","24.529","0.005","91.41","0.03","105.26","0.03","114.04","0.03","4850","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H84 Cl Cu6 N24 O38 V16 -","- C60 H84 Cl Cu6 N24 O38 V16 -","- C120 H168 Cl2 Cu12 N48 O76 V32 -","2","1","","Dong, Bao-xia; Peng, Jun; Gómez-García, Carlos J; Benmansour, Samia; Jia, Heng-qing; Hu, Ning-hai","High-dimensional assembly depending on polyoxoanion templates, metal ion coordination geometries, and a flexible bis(imidazole) ligand.","Inorganic chemistry","2007","46","15","5933","5941","10.1021/ic070007i","","","0.71073","MoKα","","0.0658","0.0475","","","0.1351","0.1506","","","","","","1.039","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339066","11.43","0.003","12.242","0.003","14.279","0.003","106.196","0.004","94.316","0.004","98.294","0.003","1884.6","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H50 Mo12 N10 Ni2 O54 Si -","- C44 H50 Mo12 N10 Ni2 O54 Si -","- C44 H50 Mo12 N10 Ni2 O54 Si -","1","0.5","","Wei, Meilin; He, Cheng; Sun, Qiaozhen; Meng, Qingjin; Duan, Chunying","Zeolite ionic crystals assembled through direct incorporation of polyoxometalate clusters within 3D metal-organic frameworks.","Inorganic chemistry","2007","46","15","5957","5966","10.1021/ic070274o","","","0.71073","MoKα","","0.1069","0.0745","","","0.1576","0.1711","","","","","","0.998","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339067","11.736","0.004","17.472","0.007","18.857","0.007","92.186","0.006","97.799","0.006","98.882","0.007","3778","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H45 Gd Mo12 N9 O53 P -","- C42 H41 Gd Mo12 N9 O53 P -","- C84 H82 Gd2 Mo24 N18 O106 P2 -","2","1","","Wei, Meilin; He, Cheng; Sun, Qiaozhen; Meng, Qingjin; Duan, Chunying","Zeolite ionic crystals assembled through direct incorporation of polyoxometalate clusters within 3D metal-organic frameworks.","Inorganic chemistry","2007","46","15","5957","5966","10.1021/ic070274o","","","0.71073","MoKα","","0.0882","0.0613","","","0.1441","0.1543","","","","","","1.029","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339068","23.133","0.0011","23.133","0.0011","23.133","0.0011","90","","90","","90","","12379.3","1","293","2","293","2","","","","","","","","7","I m -3","-I 2 2 3","204","","","","- C144 H187 N36 Ni4 O171 P3 W36 -","- C144 H120 N36 Ni4 O171 P3 W36 -","- C288 H240 N72 Ni8 O342 P6 W72 -","2","0.0416667","","Wei, Meilin; He, Cheng; Sun, Qiaozhen; Meng, Qingjin; Duan, Chunying","Zeolite ionic crystals assembled through direct incorporation of polyoxometalate clusters within 3D metal-organic frameworks.","Inorganic chemistry","2007","46","15","5957","5966","10.1021/ic070274o","","","0.71073","MoKα","","0.094","0.0743","","","0.2362","0.2498","","","","","","1.02","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339069","13.21","0.003","16.532","0.003","18.518","0.004","88.736","0.004","81.983","0.004","83.31","0.004","3977.2","1.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H52.5 Ho Mo12 N9.5 O56 Si -","- C46 H42 Ho Mo12 N9.5 O56 Si -","- C92 H84 Ho2 Mo24 N19 O112 Si2 -","2","1","","Wei, Meilin; He, Cheng; Sun, Qiaozhen; Meng, Qingjin; Duan, Chunying","Zeolite ionic crystals assembled through direct incorporation of polyoxometalate clusters within 3D metal-organic frameworks.","Inorganic chemistry","2007","46","15","5957","5966","10.1021/ic070274o","","","0.71073","MoKα","","0.0868","0.0574","","","0.1212","0.1301","","","","","","1.032","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339070","11.6989","0.0011","17.4755","0.0017","18.8466","0.0018","92.071","0.002","97.642","0.002","98.84","0.002","3767.2","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H45 Dy Mo12 N9 O53 P -","- C42 H41 Dy Mo12 N9 O53 P -","- C84 H82 Dy2 Mo24 N18 O106 P2 -","2","1","","Wei, Meilin; He, Cheng; Sun, Qiaozhen; Meng, Qingjin; Duan, Chunying","Zeolite ionic crystals assembled through direct incorporation of polyoxometalate clusters within 3D metal-organic frameworks.","Inorganic chemistry","2007","46","15","5957","5966","10.1021/ic070274o","","","0.71073","MoKα","","0.0828","0.0555","","","0.1446","0.1561","","","","","","1.057","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339071","13.222","0.003","16.498","0.004","18.489","0.005","88.827","0.004","82.058","0.005","83.139","0.005","3965.8","1.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H52.5 Gd Mo12 N9.5 O56 Si -","- C46 H42 Gd Mo12 N9.5 O56 Si -","- C92 H84 Gd2 Mo24 N19 O112 Si2 -","2","1","","Wei, Meilin; He, Cheng; Sun, Qiaozhen; Meng, Qingjin; Duan, Chunying","Zeolite ionic crystals assembled through direct incorporation of polyoxometalate clusters within 3D metal-organic frameworks.","Inorganic chemistry","2007","46","15","5957","5966","10.1021/ic070274o","","","0.71073","MoKα","","0.0892","0.0639","","","0.1535","0.1646","","","","","","1.008","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339072","18.833","0.004","8.9106","0.0018","11.965","0.002","90","","90","","90","","2007.9","0.7","293","2","293","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C40 H72 F24 N12 O32 P4 S8 -","- C40 H72 F24 N12 O32 P4 S8 -","- C40 H72 F24 N12 O32 P4 S8 -","1","0.125","","Mena-Cruz, Adrian; Lorenzo-Luis, Pablo; Romerosa, Antonio; Saoud, Mustapha; Serrano-Ruiz, Manuel","Synthesis of the water soluble ligands dmPTA and dmoPTA and the complex [RuClCp(HdmoPTA)(PPh(3))](OSO(2)CF(3)) (dmPTA = N,N'-Dimethyl-1,3,5-triaza-7-phosphaadamantane, dmoPTA = 3,7-Dimethyl-1,3,7-triaza-5-phosphabicyclo[3.3.1]nonane, HdmoPTA = 3,7-H-3,7-Dimethyl-1,3,7-triaza-5-phosphabicyclo[3.3.1]nonane).","Inorganic chemistry","2007","46","15","6120","6128","10.1021/ic070168m","","","0.71073","MoKα","","0.0864","0.0604","","","0.1537","0.1809","","","","","","1.248","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339073","9.162","0.005","14.336","0.005","15.123","0.005","77.226","0.005","74.345","0.005","77.086","0.005","1836.7","1.3","100","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C32.5 H43 Cl F3 N3 O4.5 P2 Ru S -","- C32.5 H43 Cl F3 N3 O4.5 P2 Ru S -","- C65 H86 Cl2 F6 N6 O9 P4 Ru2 S2 -","2","1","","Mena-Cruz, Adrian; Lorenzo-Luis, Pablo; Romerosa, Antonio; Saoud, Mustapha; Serrano-Ruiz, Manuel","Synthesis of the water soluble ligands dmPTA and dmoPTA and the complex [RuClCp(HdmoPTA)(PPh(3))](OSO(2)CF(3)) (dmPTA = N,N'-Dimethyl-1,3,5-triaza-7-phosphaadamantane, dmoPTA = 3,7-Dimethyl-1,3,7-triaza-5-phosphabicyclo[3.3.1]nonane, HdmoPTA = 3,7-H-3,7-Dimethyl-1,3,7-triaza-5-phosphabicyclo[3.3.1]nonane).","Inorganic chemistry","2007","46","15","6120","6128","10.1021/ic070168m","","","0.71069","MoKα","","0.0911","0.0517","","","0.1163","0.1737","","","","","","0.94","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339074","17.078","0.007","11.888","0.004","21.335","0.009","90","","113.117","0.0011","90","","3984","3","103.1","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C76 H94 Cu2 F6 Mn2 N10 O20 S2 -","- C76 H90 Cu2 F6 Mn2 N10 O20 S2 -","- C152 H180 Cu4 F12 Mn4 N20 O40 S4 -","2","0.5","","Kachi-Terajima, Chihiro; Miyasaka, Hitoshi; Saitoh, Ayumi; Shirakawa, Naoki; Yamashita, Masahiro; Clérac, Rodolphe","Single-molecule magnet behavior in heterometallic M(II)-Mn(III)(2)-M(II) tetramers (M(II) = Cu, Ni) containing Mn(III) salen-type dinuclear core.","Inorganic chemistry","2007","46","15","5861","5872","10.1021/ic0620891","","","0.7107","MoKα","","","0.0698","","","","0.2016","","","","","","1.179","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339075","16.853","0.006","11.904","0.004","21.36","0.007","90","","113.131","0.0011","90","","3941","2","103.1","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C76 H94 F6 Mn2 N10 Ni2 O20 S2 -","- C76 H90 F6 Mn2 N10 Ni2 O20 S2 -","- C152 H180 F12 Mn4 N20 Ni4 O40 S4 -","2","0.5","","Kachi-Terajima, Chihiro; Miyasaka, Hitoshi; Saitoh, Ayumi; Shirakawa, Naoki; Yamashita, Masahiro; Clérac, Rodolphe","Single-molecule magnet behavior in heterometallic M(II)-Mn(III)(2)-M(II) tetramers (M(II) = Cu, Ni) containing Mn(III) salen-type dinuclear core.","Inorganic chemistry","2007","46","15","5861","5872","10.1021/ic0620891","","","0.7107","MoKα","","","0.0443","","","","0.1367","","","","","","1.09","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339076","16.839","0.007","12.12","0.005","20.886","0.009","90","","113.493","0.0015","90","","3909","3","103.1","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C76 H90 Cu2 F6 Mn2 N10 O18 S2 -","- C76 H90 Cu2 F6 Mn2 N10 O18 S2 -","- C152 H180 Cu4 F12 Mn4 N20 O36 S4 -","2","0.5","","Kachi-Terajima, Chihiro; Miyasaka, Hitoshi; Saitoh, Ayumi; Shirakawa, Naoki; Yamashita, Masahiro; Clérac, Rodolphe","Single-molecule magnet behavior in heterometallic M(II)-Mn(III)(2)-M(II) tetramers (M(II) = Cu, Ni) containing Mn(III) salen-type dinuclear core.","Inorganic chemistry","2007","46","15","5861","5872","10.1021/ic0620891","","","0.7107","MoKα","","","0.0652","","","","0.1865","","","","","","1.06","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339077","16.645","0.009","12.098","0.006","20.738","0.011","90","","112.669","0.0014","90","","3853","3","103.1","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C76 H90 F6 Mn2 N10 Ni2 O18 S2 -","- C76 H90 F6 Mn2 N10 Ni2 O18 S2 -","- C152 H180 F12 Mn4 N20 Ni4 O36 S4 -","2","0.5","","Kachi-Terajima, Chihiro; Miyasaka, Hitoshi; Saitoh, Ayumi; Shirakawa, Naoki; Yamashita, Masahiro; Clérac, Rodolphe","Single-molecule magnet behavior in heterometallic M(II)-Mn(III)(2)-M(II) tetramers (M(II) = Cu, Ni) containing Mn(III) salen-type dinuclear core.","Inorganic chemistry","2007","46","15","5861","5872","10.1021/ic0620891","","","0.7107","MoKα","","","0.0537","","","","0.1421","","","","","","1.014","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339078","19.545","0.005","14.274","0.005","19.548","0.005","90","0.005","113.289","0.005","90","0.005","5009","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraethylammonium tetrakis(1,2-dicyanoethylenedithiolato)bis(2-hydroxyethanethiolato)ditungstate","","- C36 H50 N10 O2 S10 W2 -","- C36 H50 N10 O2 S10 W2 -","- C144 H200 N40 O8 S40 W8 -","4","1","","Majumdar, Amit; Pal, Kuntal; Nagarajan, Kowliki; Sarkar, Sabyasachi","Desoxo molybdenum(IV) and tungsten(IV) bis(dithiolene) complexes: monomer-dimer interconversion involving reversible thiol bridge formation.","Inorganic chemistry","2007","46","15","6136","6147","10.1021/ic7006777","","","0.71069","MoKα","","0.0457","0.0357","","","0.0827","0.087","","","","","","1.013","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339079","11.332","0.005","15.089","0.005","18.625","0.005","101.109","0.005","98.54","0.005","97.958","0.005","3044.2","1.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Tetraethylammonium tetrakis(1,2-dicyanoethylenedithiolato)bis(benzylthiolato)ditungstate","","- C46 H54 N10 S10 W2 -","- C46 H54 N10 S10 W2 -","- C92 H108 N20 S20 W4 -","2","1","","Majumdar, Amit; Pal, Kuntal; Nagarajan, Kowliki; Sarkar, Sabyasachi","Desoxo molybdenum(IV) and tungsten(IV) bis(dithiolene) complexes: monomer-dimer interconversion involving reversible thiol bridge formation.","Inorganic chemistry","2007","46","15","6136","6147","10.1021/ic7006777","","","0.71069","MoKα","","0.0446","0.0362","","","0.0885","0.0913","","","","","","1.036","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339080","28.897","0.005","11.481","0.005","33.556","0.005","90","0.005","94.246","0.005","90","0.005","11102","5","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Tetraethylammonium tetrakis(1,2-dicyanoethylenedithiolato)bis(thiophenolato)ditungstate","","- C44 H50 N10 S10 W2 -","- C44 H50 N10 S10 W2 -","- C352 H400 N80 S80 W16 -","8","1","","Majumdar, Amit; Pal, Kuntal; Nagarajan, Kowliki; Sarkar, Sabyasachi","Desoxo molybdenum(IV) and tungsten(IV) bis(dithiolene) complexes: monomer-dimer interconversion involving reversible thiol bridge formation.","Inorganic chemistry","2007","46","15","6136","6147","10.1021/ic7006777","","","0.71069","MoKα","","0.0729","0.0516","","","0.1074","0.1157","","","","","","1.039","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339081","20.596","0.005","18.049","0.005","46.838","0.005","90","","94.498","0.005","90","","17358","7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraethylammonium tetrakis(1,2-dicyanoethylenedithiolato)bis(benzyalthiolato)dimolybdate","","- C142 H168 Mo6 N32 S30 -","- C142 H168 Mo6 N32 S30 -","- C568 H672 Mo24 N128 S120 -","4","1","","Majumdar, Amit; Pal, Kuntal; Nagarajan, Kowliki; Sarkar, Sabyasachi","Desoxo molybdenum(IV) and tungsten(IV) bis(dithiolene) complexes: monomer-dimer interconversion involving reversible thiol bridge formation.","Inorganic chemistry","2007","46","15","6136","6147","10.1021/ic7006777","","x-ray","0.71069","MoKα","","0.0827","0.0558","","","0.1218","0.1332","","","","","","1.045","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339082","19.542","0.005","14.284","0.005","19.587","0.005","90","","113.128","0.005","90","","5028","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraethylammonium tetrakis(1,2-dicyanoethylenedithiolato)bis(2-hydroxyethanethiolato)dimolybdate","","- C36 H50 Mo2 N10 O2 S10 -","- C36 H50 Mo2 N10 O2 S10 -","- C144 H200 Mo8 N40 O8 S40 -","4","1","","Majumdar, Amit; Pal, Kuntal; Nagarajan, Kowliki; Sarkar, Sabyasachi","Desoxo molybdenum(IV) and tungsten(IV) bis(dithiolene) complexes: monomer-dimer interconversion involving reversible thiol bridge formation.","Inorganic chemistry","2007","46","15","6136","6147","10.1021/ic7006777","","x-ray","0.71069","MoKα","","0.0948","0.0678","","","0.1344","0.1433","","","","","","1.18","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339083","11.824","0.005","14.496","0.005","16.5","0.005","98.803","0.005","109.364","0.005","92.968","0.005","2620.7","1.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","Tetraethylammonium tetrakis(1,2-dicyanoethylenedithiolato)bis(thiophenolato)dimolybdate","","- C44 H50 Mo2 N10 S10 -","- C44 H50 Mo2 N10 S10 -","- C88 H100 Mo4 N20 S20 -","2","1","","Majumdar, Amit; Pal, Kuntal; Nagarajan, Kowliki; Sarkar, Sabyasachi","Desoxo molybdenum(IV) and tungsten(IV) bis(dithiolene) complexes: monomer-dimer interconversion involving reversible thiol bridge formation.","Inorganic chemistry","2007","46","15","6136","6147","10.1021/ic7006777","","x-ray","0.71069","MoKα","","0.039","0.034","","","0.0824","0.0851","","","","","","1.016","","","","has coordinates,has disorder","179493","2020-10-21","18:00:00",""
"4339084","13.467","0.005","32.375","0.005","16.133","0.005","90","0.005","111.143","0.005","90","0.005","6560","3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Tetraphenylphosphonium bis(1,2-dicyanoethylenedithiolato)-bis(phenylthiolato)-tungsten(IV)","","- C69.5 H54 N4 O0.5 P2 S6 W -","- C69.5 H54 N4 O0.5 P2 S6 W -","- C278 H216 N16 O2 P8 S24 W4 -","4","1","","Majumdar, Amit; Pal, Kuntal; Nagarajan, Kowliki; Sarkar, Sabyasachi","Desoxo molybdenum(IV) and tungsten(IV) bis(dithiolene) complexes: monomer-dimer interconversion involving reversible thiol bridge formation.","Inorganic chemistry","2007","46","15","6136","6147","10.1021/ic7006777","","","0.71069","MoKα","","0.0993","0.0532","","","0.096","0.1195","","","","","","1.04","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339085","19.419","0.005","14.377","0.005","19.308","0.005","90","","114.375","0.005","90","","4910","2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraethylammonium tetrakis(1,2-dicyanoethylenedithiolato)bis(ethanethiolato)dimolybdate","","- C36 H50 Mo2 N10 S10 -","- C36 H50 Mo2 N10 S10 -","- C144 H200 Mo8 N40 S40 -","4","1","","Majumdar, Amit; Pal, Kuntal; Nagarajan, Kowliki; Sarkar, Sabyasachi","Desoxo molybdenum(IV) and tungsten(IV) bis(dithiolene) complexes: monomer-dimer interconversion involving reversible thiol bridge formation.","Inorganic chemistry","2007","46","15","6136","6147","10.1021/ic7006777","","x-ray","0.71069","MoKα","","0.0553","0.0414","","","0.092","0.0979","","","","","","1.03","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339086","19.57","0.005","14.516","0.005","19.563","0.005","90","","113.941","0.005","90","","5079","3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraethylammonium tetrakis(1,2-dicyanoethylenedithiolato)bis(ethanethiolato)ditungstate","","- C36 H50 N10 S10 W2 -","- C36 H50 N10 S10 W2 -","- C144 H200 N40 S40 W8 -","4","1","","Majumdar, Amit; Pal, Kuntal; Nagarajan, Kowliki; Sarkar, Sabyasachi","Desoxo molybdenum(IV) and tungsten(IV) bis(dithiolene) complexes: monomer-dimer interconversion involving reversible thiol bridge formation.","Inorganic chemistry","2007","46","15","6136","6147","10.1021/ic7006777","","","0.71069","MoKα","","0.1132","0.0632","","","0.1361","0.1722","","","","","","1.047","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339087","16.115","0.002","16.115","0.002","16.115","0.002","90","","90","","90","","4185","0.9","273","2","273","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","","","","- C42 H24 Fe2 N6 Na O12 -","- C42 H24 Fe2 N6 Na O12 -","- C168 H96 Fe8 N24 Na4 O48 -","4","0.333333","","Li, Pei-zhou; Lu, Xiao-ming; Liu, Bo; Wang, Shuo; Wang, Xiao-jun","Self-Assembly of Two Chiral Supramolecules with Three-Dimensional Porous Host Frameworks: (Delta){[Fe(II)(phen)(3)][Fe(III)Na(C(2)O(4))(3)]}(n)() and Its Enantiomer.","Inorganic chemistry","2007","46","15","5823","5825","10.1021/ic070214i","","","0.71073","MoKα","","0.1203","0.0699","","","0.1813","0.2143","","","","","","1.011","","","","has coordinates","271475","2021-12-16","11:44:44",""
"4339088","16.1281","0.0014","16.1281","0.0014","16.1281","0.0014","90","","90","","90","","4195.2","0.6","273","2","273","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","","","","- C42 H24 Fe2 N6 Na O12 -","- C42 H24 Fe2 N6 Na O12 -","- C168 H96 Fe8 N24 Na4 O48 -","4","0.333333","","Li, Pei-zhou; Lu, Xiao-ming; Liu, Bo; Wang, Shuo; Wang, Xiao-jun","Self-Assembly of Two Chiral Supramolecules with Three-Dimensional Porous Host Frameworks: (Delta){[Fe(II)(phen)(3)][Fe(III)Na(C(2)O(4))(3)]}(n)() and Its Enantiomer.","Inorganic chemistry","2007","46","15","5823","5825","10.1021/ic070214i","","","0.71073","MoKα","","0.1497","0.0715","","","0.1689","0.2109","","","","","","0.992","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339089","8.0581","0.0011","8.0581","0.0011","4.4411","0.0009","90","","90","","120","","249.74","0.07","293","2","293","2","","","","","","","","3","P -6 m 2","P -6 2","187","","","","- Au4 In6 K -","- Au4 In6 K -","- Au4 In6 K -","1","0.0833333","","Li, Bin; Corbett, John D.","Different cation arrangements in Au-In networks. Syntheses and structures of six intermetallic compounds in alkali-metal-Au-In systems.","Inorganic chemistry","2007","46","15","6022","6028","10.1021/ic700519c","","","0.71073","MoKα","","0.0277","0.0263","","","0.0583","0.0586","","","","","","1.164","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339090","8.0788","0.0011","8.0788","0.0011","4.4857","0.0009","90","","90","","120","","253.54","0.07","293","2","293","2","","","","","","","","3","P -6 m 2","P -6 2","187","","","","- Au4 In6 Rb -","- Au4 In6 Rb -","- Au4 In6 Rb -","1","0.0833333","","Li, Bin; Corbett, John D.","Different cation arrangements in Au-In networks. Syntheses and structures of six intermetallic compounds in alkali-metal-Au-In systems.","Inorganic chemistry","2007","46","15","6022","6028","10.1021/ic700519c","","","0.71073","MoKα","","0.0389","0.0382","","","0.1044","0.1048","","","","","","1.128","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339091","8.665","0.0012","8.665","0.0012","14.19","0.003","90","","90","","90","","1065.4","0.3","293","2","293","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","","","","- Au6 In4 K1.76 -","- Au6 In4 K1.76 -","- Au24 In16 K7.04 -","4","0.125","","Li, Bin; Corbett, John D.","Different cation arrangements in Au-In networks. Syntheses and structures of six intermetallic compounds in alkali-metal-Au-In systems.","Inorganic chemistry","2007","46","15","6022","6028","10.1021/ic700519c","","","0.71073","MoKα","","0.048","0.0375","","","0.0959","0.0998","","","","","","0.833","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339092","13.1105","0.0019","13.1105","0.0019","5.4401","0.0011","90","","90","","90","","935.1","0.3","293","2","293","2","","","","","","","","3","P 42/n m c :2","-P 4ac 2a","137","","","","- Au2 In2 K0.73 -","- Au2 In2 K0.73 -","- Au16 In16 K5.84 -","8","0.5","","Li, Bin; Corbett, John D.","Different cation arrangements in Au-In networks. Syntheses and structures of six intermetallic compounds in alkali-metal-Au-In systems.","Inorganic chemistry","2007","46","15","6022","6028","10.1021/ic700519c","","","0.71073","MoKα","","0.0941","0.0494","","","0.0904","0.1046","","","","","","0.989","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339093","13.3051","0.0019","13.3051","0.0019","5.4597","0.0011","90","","90","","90","","966.5","0.3","293","2","293","2","","","","","","","","3","P 42/n m c :2","-P 4ac 2a","137","","","","- Au2 In2 Rb0.66 -","- Au2 In2 Rb0.66 -","- Au16 In16 Rb5.28 -","8","0.5","","Li, Bin; Corbett, John D.","Different cation arrangements in Au-In networks. Syntheses and structures of six intermetallic compounds in alkali-metal-Au-In systems.","Inorganic chemistry","2007","46","15","6022","6028","10.1021/ic700519c","","","0.71073","MoKα","","0.1403","0.0484","","","0.093","0.1122","","","","","","0.855","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339094","13.4104","0.0019","13.4104","0.0019","5.367","0.0011","90","","90","","90","","965.2","0.3","293","2","293","2","","","","","","","","3","P 42/n m c :2","-P 4ac 2a","137","","","","- Au2 Cs0.65 In2 -","- Au2 Cs0.656 In2 -","- Au16 Cs5.248 In16 -","8","0.5","","Li, Bin; Corbett, John D.","Different cation arrangements in Au-In networks. Syntheses and structures of six intermetallic compounds in alkali-metal-Au-In systems.","Inorganic chemistry","2007","46","15","6022","6028","10.1021/ic700519c","","","0.71073","MoKα","","0.0696","0.0363","","","0.0794","0.0833","","","","","","1.211","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339095","17.165","0.002","6.732","0.0009","14.886","0.002","90","","109.339","0.002","90","","1623.1","0.4","110","2","110","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C14 H24 Mn N2 O5.5 -","- C14 H24 Mn N2 O5.5 -","- C56 H96 Mn4 N8 O22 -","4","1","","Darensbourg, Donald J.; Frantz, Eric B.","Manganese(III) Schiff base complexes: chemistry relevant to the copolymerization of epoxides and carbon dioxide.","Inorganic chemistry","2007","46","15","5967","5978","10.1021/ic7003968","","","0.71073","MoKα","","0.0728","0.0557","","","0.1361","0.1511","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339096","10.2639","0.0011","13.5749","0.0015","11.3173","0.0011","90","","112.173","0.006","90","","1460.2","0.3","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H18 Mn N5 O2 -","- C12 H18 Mn N5 O2 -","- C48 H72 Mn4 N20 O8 -","4","1","","Darensbourg, Donald J.; Frantz, Eric B.","Manganese(III) Schiff base complexes: chemistry relevant to the copolymerization of epoxides and carbon dioxide.","Inorganic chemistry","2007","46","15","5967","5978","10.1021/ic7003968","","","1.54178","CuKα","","0.0721","0.0488","","","0.1013","0.1057","","","","","","1.004","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339097","8.7824","0.0009","13.9008","0.0014","28.352","0.003","90","","90.793","0.002","90","","3460.9","0.6","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H48 Mn2 N12 O4 -","- C31 H46 Mn2 N12 O4 -","- C124 H184 Mn8 N48 O16 -","4","1","","Darensbourg, Donald J.; Frantz, Eric B.","Manganese(III) Schiff base complexes: chemistry relevant to the copolymerization of epoxides and carbon dioxide.","Inorganic chemistry","2007","46","15","5967","5978","10.1021/ic7003968","","","0.71073","MoKα","","0.0673","0.0497","","","0.1231","0.1405","","","","","","1","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339098","13.778","0.01","19.679","0.015","20.056","0.015","90","","90","","90","","5438","7","110","2","110","2","","","","","","","","5","P c a n","-P 2n 2c","60","","","","- C24 H36 Mn2 N10 O4 -","- C24 H36 Mn2 N10 O4 -","- C192 H288 Mn16 N80 O32 -","8","1","","Darensbourg, Donald J.; Frantz, Eric B.","Manganese(III) Schiff base complexes: chemistry relevant to the copolymerization of epoxides and carbon dioxide.","Inorganic chemistry","2007","46","15","5967","5978","10.1021/ic7003968","","","0.71073","MoKα","","0.1151","0.0793","","","0.1902","0.2286","","","","","","1.022","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339099","6.5564","0.0005","14.1006","0.0011","10.0027","0.0008","90","","93.029","0.004","90","","923.45","0.12","110","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H23 Mn N6 O2 -","- C17 H23 Mn N6 O2 -","- C34 H46 Mn2 N12 O4 -","2","1","","Darensbourg, Donald J.; Frantz, Eric B.","Manganese(III) Schiff base complexes: chemistry relevant to the copolymerization of epoxides and carbon dioxide.","Inorganic chemistry","2007","46","15","5967","5978","10.1021/ic7003968","","","1.54178","CuKα","","0.0612","0.0471","","","0.095","0.1045","","","","","","1.005","","","","has coordinates","179493","2020-10-21","18:00:00",""
"4339100","8.1727","0.0005","17.1898","0.0011","12.3854","0.0008","90","","94.768","0.001","90","","1733.97","0.19","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","EtOH/NO3","","","- C14 H24 Mn N3 O6 -","- C14 H24 Mn N3 O6 -","- C56 H96 Mn4 N12 O24 -","4","1","","Darensbourg, Donald J.; Frantz, Eric B.","Manganese(III) Schiff base complexes: chemistry relevant to the copolymerization of epoxides and carbon dioxide.","Inorganic chemistry","2007","46","15","5967","5978","10.1021/ic7003968","","","0.71073","MoKα","","0.088","0.0689","","","0.1622","0.1786","","","","","","0.989","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339101","13.712","0.003","20.604","0.006","20.674","0.005","81.703","0.01","76.112","0.009","86.273","0.01","5608","2","113","2","113","2","","","","","","","","7","P -1","-P 1","2","","","","- C218 H162 Cl6 Fe6 Mn6 N48 O30 -","- C218 H146 Cl6 Fe6 Mn6 N48 O30 -","- C218 H146 Cl6 Fe6 Mn6 N48 O30 -","1","0.5","","Ni, Zhong-Hai; Zhang, Li-Fang; Tangoulis, Vassilis; Wernsdorfer, Wolfgang; Cui, Ai-Li; Sato, Osamu; Kou, Hui-Zhong","Substituent effect on formation of heterometallic molecular wheels: synthesis, crystal structure, and magnetic properties.","Inorganic chemistry","2007","46","15","6029","6037","10.1021/ic700528a","","","0.7107","MoKα","","0.102","0.0878","","","0.2288","0.2422","","","","","","1.1","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339102","13.718","0.003","21.098","0.004","21.117","0.004","78.69","0.03","77.61","0.03","87.18","0.03","5853","2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C233 H220 Fe6 Mn6 N48 O39 -","- C233 H180 Fe6 Mn6 N48 O39 -","- C233 H180 Fe6 Mn6 N48 O39 -","1","0.5","","Ni, Zhong-Hai; Zhang, Li-Fang; Tangoulis, Vassilis; Wernsdorfer, Wolfgang; Cui, Ai-Li; Sato, Osamu; Kou, Hui-Zhong","Substituent effect on formation of heterometallic molecular wheels: synthesis, crystal structure, and magnetic properties.","Inorganic chemistry","2007","46","15","6029","6037","10.1021/ic700528a","","","0.71073","MoKα","","0.1232","0.0924","","","0.2522","0.2729","","","","","","1.049","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339103","25.073","0.004","25.073","0.004","12.7482","0.0018","90","","90","","120","","6940.5","1.8","123","2","123","2","","","","","","","","7","P -3","-P 3","147","","","","- C244 H234 Br12 Fe6 Mn6 N56 O48 -","- C244 H180 Br12 Fe6 Mn6 N56 O48 -","- C244 H180 Br12 Fe6 Mn6 N56 O48 -","1","0.166667","","Ni, Zhong-Hai; Zhang, Li-Fang; Tangoulis, Vassilis; Wernsdorfer, Wolfgang; Cui, Ai-Li; Sato, Osamu; Kou, Hui-Zhong","Substituent effect on formation of heterometallic molecular wheels: synthesis, crystal structure, and magnetic properties.","Inorganic chemistry","2007","46","15","6029","6037","10.1021/ic700528a","","","0.71073","MoKα","","0.0969","0.0936","","","0.2306","0.2323","","","","","","0.879","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339104","25.009","0.005","25.009","0.005","12.512","0.002","90","","90","","120","","6777","2","113","2","113","2","","","","","","","","7","P -3","-P 3","147","","","","- C238 H227 Cl12 Fe6 Mn6 N53 O49 -","- C238 H162 Cl12 Fe6 Mn6 N53 O49 -","- C238 H162 Cl12 Fe6 Mn6 N53 O49 -","1","0.166667","","Ni, Zhong-Hai; Zhang, Li-Fang; Tangoulis, Vassilis; Wernsdorfer, Wolfgang; Cui, Ai-Li; Sato, Osamu; Kou, Hui-Zhong","Substituent effect on formation of heterometallic molecular wheels: synthesis, crystal structure, and magnetic properties.","Inorganic chemistry","2007","46","15","6029","6037","10.1021/ic700528a","","","0.71075","MoKα","","0.082","0.0761","","","0.1867","0.191","","","","","","1.057","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339105","13.248","0.013","18.659","0.018","19.04","0.02","115.82","0.05","106.82","0.05","91.45","0.04","3992","7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C78 H66 Cl4 Fe2 Mn2 N17 O11 -","- C78 H58 Cl4 Fe2 Mn2 N17 O11 -","- C156 H116 Cl8 Fe4 Mn4 N34 O22 -","2","1","","Ni, Zhong-Hai; Zhang, Li-Fang; Tangoulis, Vassilis; Wernsdorfer, Wolfgang; Cui, Ai-Li; Sato, Osamu; Kou, Hui-Zhong","Substituent effect on formation of heterometallic molecular wheels: synthesis, crystal structure, and magnetic properties.","Inorganic chemistry","2007","46","15","6029","6037","10.1021/ic700528a","","","0.71075","MoKα","","0.0599","0.0532","","","0.1373","0.1415","","","","","","1.033","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339106","24.8433","0.0008","12.9735","0.0004","12.593","0.0004","90","","114.14","","90","","3703.8","0.2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H18 Cl Cu N4 -","- C18 H18 Cl Cu N4 -","- C144 H144 Cl8 Cu8 N32 -","8","1","","Eckenhoff, William T.; Pintauer, Tomislav","Atom transfer radical addition in the presence of catalytic amounts of copper(I/II) complexes with tris(2-pyridylmethyl)amine.","Inorganic chemistry","2007","46","15","5844","5846","10.1021/ic700908m","","","0.71073","MoKα","","0.0431","0.0311","","","0.0813","0.0843","","","","","","0.969","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339107","12.4157","0.0001","12.4157","0.0001","12.4157","0.0001","90","","90","","90","","1913.88","0.03","150","2","150","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- C18 H18 Cl2 Cu N4 -","- C18 H18 Cl2 Cu N4 -","- C72 H72 Cl8 Cu4 N16 -","4","0.333333","","Eckenhoff, William T.; Pintauer, Tomislav","Atom transfer radical addition in the presence of catalytic amounts of copper(I/II) complexes with tris(2-pyridylmethyl)amine.","Inorganic chemistry","2007","46","15","5844","5846","10.1021/ic700908m","","","0.71073","MoKα","","0.0184","0.017","","","0.0455","0.046","","","","","","1.054","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339108","13.839","0.0004","12.2627","0.0004","22.6302","0.0005","90","","96.785","0.002","90","","3813.53","0.19","290","","290","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H32 Cu4 F12 N4 O8 -","- C28 H32 Cu4 F12 N4 O8 -","- C112 H128 Cu16 F48 N16 O32 -","4","1","","Aronica, Christophe; Chastanet, Guillaume; Pilet, Guillaume; Le Guennic, Boris; Robert, Vincent; Wernsdorfer, Wolfgang; Luneau, Dominique","Cubane variations: syntheses, structures, and magnetic property analyses of lanthanide(III)-copper(II) architectures with controlled nuclearities.","Inorganic chemistry","2007","46","15","6108","6119","10.1021/ic700645q","","","0.71073","MoKα","","0.1223","0.0523","","0.1087","0.0614","0.0614","","","","","","1.0957","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339109","12.1149","0.0011","8.8183","0.0008","17.3298","0.0016","90","","107.997","0.002","90","","1760.8","0.3","273","2","273","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C4 H23 Co0.5 N3 O15 P0.5 Si2 Zr2 -","- C4 H8 Co0.5 N3 O15 P0.5 Si2 Zr2 -","- C16 H32 Co2 N12 O60 P2 Si8 Zr8 -","4","1","","Du, Yu; Pan, Qinhe; Li, Jiyang; Yu, Jihong; Xu, Ruren","Synthesis, structure, and photoluminescence property of a new layered zirconium phosphate |Co(dien)(2)|[Zr(4)H(8)P(5)O(26)] x 3H(2)O.","Inorganic chemistry","2007","46","15","5847","5851","10.1021/ic061873i","","","0.71073","MoKα","","0.0875","0.0556","","","0.1138","0.1253","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339110","12.1149","0.0011","8.8183","0.0008","17.3298","0.0016","90","","107.997","0.002","90","","1760.8","0.3","273","2","273","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C4 H20 Co0.5 N3 O14.5 P2.5 Zr2 -","- C4 H12.5 Co0.5 N3 O14.5 P2.5 Zr2 -","- C16 H50 Co2 N12 O58 P10 Zr8 -","4","1","","Du, Yu; Pan, Qinhe; Li, Jiyang; Yu, Jihong; Xu, Ruren","Synthesis, structure, and photoluminescence property of a new layered zirconium phosphate |Co(dien)(2)|[Zr(4)H(8)P(5)O(26)] x 3H(2)O.","Inorganic chemistry","2007","46","15","5847","5851","10.1021/ic061873i","","","0.71073","MoKα","","0.0838","0.0514","","","0.0991","0.1097","","","","","","0.992","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339111","10.9474","0.0004","14.3863","0.0005","16.2272","0.0006","85.946","0.002","71.136","0.002","89.264","0.002","2412.21","0.15","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(K-crown)2[CH2=CH-Ge9-CHCH2] en","","- C30 H62 Ge9 K2 N2 O12 -","- C30 H62 Ge9 K2 N2 O12 -","- C60 H124 Ge18 K4 N4 O24 -","2","1","","Hull, Michael W.; Sevov, Slavi C.","Organo-Zintl clusters soluble in conventional organic solvents: setting the stage for organo-Zintl cluster chemistry.","Inorganic chemistry","2007","46","26","10953","10955","10.1021/ic702151q","","","0.71073","MoKα","","0.0354","0.0236","","","0.054","0.0591","","","","","","1.015","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339112","30.2772","0.0015","13.3218","0.0007","15.4229","0.0008","90","","118.552","0.003","90","","5464.2","0.5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(Me4N)2[CH2=CH-Ge9-CHCH2] 0.5en","","- C13 H34 Ge9 N3 -","- C13 H34 Ge9 N3 -","- C104 H272 Ge72 N24 -","8","1","","Hull, Michael W.; Sevov, Slavi C.","Organo-Zintl clusters soluble in conventional organic solvents: setting the stage for organo-Zintl cluster chemistry.","Inorganic chemistry","2007","46","26","10953","10955","10.1021/ic702151q","","","0.71073","MoKα","","0.0462","0.0296","","","0.0729","0.0764","","","","","","1.158","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339113","10.9239","0.0004","16.8461","0.0006","22.4274","0.0007","90","","92.006","0.002","90","","4124.7","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Pr4N)2[CH2=CH-Ge9-CHCH2]","","- C28 H62 Ge9 N2 -","- C28 H62 Ge9 N2 -","- C112 H248 Ge36 N8 -","4","1","","Hull, Michael W.; Sevov, Slavi C.","Organo-Zintl clusters soluble in conventional organic solvents: setting the stage for organo-Zintl cluster chemistry.","Inorganic chemistry","2007","46","26","10953","10955","10.1021/ic702151q","","","0.71073","MoKα","","0.0611","0.0426","","","0.1164","0.127","","","","","","1.083","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339114","15.548","0.0005","20.52","0.0008","21.476","0.0007","90","","98.127","0.003","90","","6783","0.4","180","2","180","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C56.5 H34 Cr2 Fe N14 O24 -","- C56.5 H34 Cr2 Fe N14 O24 -","- C226 H136 Cr8 Fe4 N56 O96 -","4","1","","Clemente-León, Miguel; Coronado, Eugenio; Giménez-López, M Carmen; Romero, Francisco M.","Structural, thermal, and magnetic study of solvation processes in spin-crossover [Fe(bpp)(2)][Cr(L)(ox)(2)](2).nH(2)O complexes.","Inorganic chemistry","2007","46","26","11266","11276","10.1021/ic700910n","","","0.71073","MoKα","","0.1333","0.0815","","","0.241","0.2994","","","","","","1.151","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339115","15.39","0.0002","17.6","0.0002","21.522","0.0003","102.413","0.001","101.339","0.001","101.813","0.001","5393.26","0.13","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H34 Cr2 Fe N14 O16 -","- C54.5 H35 Cr2 Fe N14 O17 -","- C218 H140 Cr8 Fe4 N56 O68 -","4","2","","Clemente-León, Miguel; Coronado, Eugenio; Giménez-López, M Carmen; Romero, Francisco M.","Structural, thermal, and magnetic study of solvation processes in spin-crossover [Fe(bpp)(2)][Cr(L)(ox)(2)](2).nH(2)O complexes.","Inorganic chemistry","2007","46","26","11266","11276","10.1021/ic700910n","","","0.71073","MoKα","","0.0827","0.0445","","","0.1061","0.1229","","","","","","1.077","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339116","8.695","0.0002","15.377","0.0004","21.415","0.0006","73.433","0.001","78.994","0.001","78.288","0.0012","2660.12","0.12","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H47 Cr Fe2 N22 O9 -","- C54 H34 Cr2 Fe N14 O16.5 -","- C108 H68 Cr4 Fe2 N28 O33 -","2","1","","Clemente-León, Miguel; Coronado, Eugenio; Giménez-López, M Carmen; Romero, Francisco M.","Structural, thermal, and magnetic study of solvation processes in spin-crossover [Fe(bpp)(2)][Cr(L)(ox)(2)](2).nH(2)O complexes.","Inorganic chemistry","2007","46","26","11266","11276","10.1021/ic700910n","","","0.71073","MoKα","","0.1925","0.0759","","","0.1907","0.2873","","","","","","1.015","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339117","19.832","0.004","12.054","0.002","26.508","0.005","90","","103.29","0.03","90","","6167","2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C56 H64 In3 O8 Si4 Y -","- C56 H64 In3 O8 Si4 Y -","- C224 H256 In12 O32 Si16 Y4 -","4","0.5","","Giessmann, Stephan; Blaurock, Steffen; Lorenz, Volker; Edelmann, Frank T.","Unusual inorganic ring systems of scandium and yttrium containing group 13 Metals: coordination of monomeric Me(2)InOMe to yttrium.","Inorganic chemistry","2007","46","26","10956","10958","10.1021/ic701909m","","","0.71073","MoKα","","0.072","0.0465","","","0.1107","0.1175","","","","","","0.908","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339118","28.68","0.006","22.212","0.004","25.817","0.005","90","","117.09","0.03","90","","14642","6","180","2","180","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C70 H86 Al Cl Li O11 Sc Si4 -","- C70 H86 Al Cl Li O11 Sc Si4 -","- C560 H688 Al8 Cl8 Li8 O88 Sc8 Si32 -","8","1","","Giessmann, Stephan; Blaurock, Steffen; Lorenz, Volker; Edelmann, Frank T.","Unusual inorganic ring systems of scandium and yttrium containing group 13 Metals: coordination of monomeric Me(2)InOMe to yttrium.","Inorganic chemistry","2007","46","26","10956","10958","10.1021/ic701909m","","","0.71073","MoKα","","0.1652","0.0597","","","0.146","0.1719","","","","","","0.725","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339119","12.1149","0.0009","17.6649","0.0011","17.7492","0.001","90","","99.113","0.004","90","","3750.5","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H110 Br4 O38 U3 -","- C48 H110 Br4 O38 U3 -","- C96 H220 Br8 O76 U6 -","2","0.5","","Nockemann, Peter; Servaes, Kelly; Van Deun, Rik; Van Hecke, Kristof; Van Meervelt, Luc; Binnemans, Koen; Görller-Walrand, Christiane","Speciation of uranyl complexes in ionic liquids by optical spectroscopy.","Inorganic chemistry","2007","46","26","11335","11344","10.1021/ic701752j","","","1.54178","CuKα","","0.0773","0.0516","","","0.1058","0.1166","","","","","","1.003","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339120","33.297","0.005","33.297","0.005","7.1671","0.0014","90","","90","","120","","6882","2","100","2","100","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C20 H38 Br4 N4 O2 U -","- C20 H38 Br4 N4 O2 U -","- C180 H342 Br36 N36 O18 U9 -","9","0.5","","Nockemann, Peter; Servaes, Kelly; Van Deun, Rik; Van Hecke, Kristof; Van Meervelt, Luc; Binnemans, Koen; Görller-Walrand, Christiane","Speciation of uranyl complexes in ionic liquids by optical spectroscopy.","Inorganic chemistry","2007","46","26","11335","11344","10.1021/ic701752j","","","1.54178","CuKα","","0.0449","0.0357","","","0.078","0.0822","","","","","","1.05","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339121","10.804","0.002","13.453","0.003","11.166","0.002","90","","90","","90","","1622.9","0.6","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C16 H12 F2 Mn N5 O2 -","- C16 H12 F2 Mn N5 O2 -","- C64 H48 F8 Mn4 N20 O8 -","4","1","","Yuan, Mei; Zhao, Fei; Zhang, Wen; Wang, Zhe-Ming; Gao, Song","Azide-bridged one-dimensional Mn(III) polymers: effects of side group of Schiff base ligands on structure and magnetism.","Inorganic chemistry","2007","46","26","11235","11242","10.1021/ic701655w","","","0.71073","MoKα","","0.0799","0.0352","","","0.0626","0.0703","","","","","","1.012","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339122","10.862","0.002","11.184","0.002","29.688","0.006","90","","90","","90","","3606.5","1.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H18 Mn N5 O4 -","- C18 H18 Mn N5 O4 -","- C144 H144 Mn8 N40 O32 -","8","1","","Yuan, Mei; Zhao, Fei; Zhang, Wen; Wang, Zhe-Ming; Gao, Song","Azide-bridged one-dimensional Mn(III) polymers: effects of side group of Schiff base ligands on structure and magnetism.","Inorganic chemistry","2007","46","26","11235","11242","10.1021/ic701655w","","","0.71073","MoKα","","0.1885","0.0455","","","0.0616","0.0744","","","","","","1.013","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339123","7.9707","0.0016","10.064","0.002","12.057","0.002","97.65","0.03","91.31","0.03","91.85","0.03","957.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H18 Mn N5 O3 -","- C21 H17 Mn N5 O3 -","- C42 H34 Mn2 N10 O6 -","2","1","","Yuan, Mei; Zhao, Fei; Zhang, Wen; Wang, Zhe-Ming; Gao, Song","Azide-bridged one-dimensional Mn(III) polymers: effects of side group of Schiff base ligands on structure and magnetism.","Inorganic chemistry","2007","46","26","11235","11242","10.1021/ic701655w","","","0.71073","MoKα","","0.0884","0.0417","","","0.0808","0.0888","","","","","","0.99","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339124","36.666","0.007","25.887","0.005","21.682","0.004","90","","94.891","0.003","90","","20505","7","293","2","293","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C7 H134 Fe13 N7 O200 P8 W36 -","- C7 H35 Fe13 N7 O200 P8 W36 -","- C28 H140 Fe52 N28 O800 P32 W144 -","4","0.5","","Zhao, Jun-Wei; Zhang, Jie; Zheng, Shou-Tian; Yang, Guo-Yu","Combination of lacunary polyoxometalates and high-nuclear transition-metal clusters under hydrothermal conditions. 5. A novel tetrameric cluster of [{Fe(II)Fe(III)(12)(mu(3)-OH)(12)(mu(4)-PO(4))(4)}(B-alpha-PW(9)O(34))(4)](22)(-).","Inorganic chemistry","2007","46","26","10944","10946","10.1021/ic701810t","","","0.71073","MoKα","","0.0598","0.0526","","","0.1327","0.1378","","","","","","1.088","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339125","33.8468","0.0003","33.8468","0.0003","24.395","0.0004","90","","90","","120","","24202.9","0.5","123.1","","","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C51 H69 Cl3 N6 Zn3 -","- C51 H69 Cl3 N6 Zn3 -","- C918 H1242 Cl54 N108 Zn54 -","18","1","","Cipot-Wechsler, Judy; Ali, Adeeb Al-Sheikh; Chapman, Erin E.; Cameron, T. Stanley; Thompson, Alison","Synthesis and reactivity of a dipyrrinatolithium complex.","Inorganic chemistry","2007","46","26","10947","10949","10.1021/ic701369h","","","0.7107","MoKα","","","0.0335","","","","0.0363","","","","","","1.072","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339126","12.8334","0.0005","13.9647","0.0005","8.3343","0.0003","90","","90","","90","","1493.63","0.1","293.1","","","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C17 H23 Li N2 -","- C17 H23 Li N2 -","- C68 H92 Li4 N8 -","4","1","","Cipot-Wechsler, Judy; Ali, Adeeb Al-Sheikh; Chapman, Erin E.; Cameron, T. Stanley; Thompson, Alison","Synthesis and reactivity of a dipyrrinatolithium complex.","Inorganic chemistry","2007","46","26","10947","10949","10.1021/ic701369h","","","0.7107","MoKα","","","0.0496","","","","0.0766","","","","","","1.085","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339127","9.0304","0.0006","11.7223","0.0008","22.488","0.002","90","","90","","90","","2380.5","0.3","293.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H39 Li N2 O2 -","- C25 H39 Li N2 O2 -","- C100 H156 Li4 N8 O8 -","4","1","","Cipot-Wechsler, Judy; Ali, Adeeb Al-Sheikh; Chapman, Erin E.; Cameron, T. Stanley; Thompson, Alison","Synthesis and reactivity of a dipyrrinatolithium complex.","Inorganic chemistry","2007","46","26","10947","10949","10.1021/ic701369h","","","0.7107","MoKα","","","0.0689","","","","0.0708","","","","","","1.155","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339128","29.552","0.006","9.5122","0.0019","24.428","0.005","90","","121.48","0.03","90","","5856","3","208","2","208","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H21 Cu F12 N4 O6 -","- C22 H21 Cu F12 N4 O6 -","- C176 H168 Cu8 F96 N32 O48 -","8","1","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0483","0.0407","","","0.1075","0.1157","","","","","","1.05","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339129","29.567","0.006","9.491","0.0019","24.46","0.005","90","","121.62","0.03","90","","5845","3","215","2","215","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H21 Cu F12 N4 O6 -","- C22 H21 Cu F12 N4 O6 -","- C176 H168 Cu8 F96 N32 O48 -","8","1","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0504","0.042","","","0.1082","0.1144","","","","","","1.031","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339130","29.66","0.006","9.4899","0.0019","24.52","0.005","90","","121.91","0.03","90","","5859","3","218","2","218","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H21 Cu F12 N4 O6 -","- C22 H21 Cu F12 N4 O6 -","- C176 H168 Cu8 F96 N32 O48 -","8","1","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0542","0.0448","","","0.1129","0.1232","","","","","","1.026","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339131","29.811","0.008","9.407","0.002","24.659","0.007","90","","123.169","0.009","90","","5788","3","221","2","221","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H21 Cu F12 N4 O6 -","- C22 H21 Cu F12 N4 O6 -","- C176 H168 Cu8 F96 N32 O48 -","8","1","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.1324","0.1088","","","0.2663","0.2806","","","","","","1.399","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339132","30.098","0.006","9.4572","0.0019","24.923","0.005","90","","123.75","0.03","90","","5899","3","229","2","229","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H21 Cu F12 N4 O6 -","- C22 H21 Cu F12 N4 O6 -","- C176 H168 Cu8 F96 N32 O48 -","8","1","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0533","0.0425","","","0.1055","0.1155","","","","","","1.006","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339133","30.189","0.006","9.4707","0.0019","24.991","0.005","90","","123.9","0.03","90","","5931","3","241","2","241","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H21 Cu F12 N4 O6 -","- C22 H21 Cu F12 N4 O6 -","- C176 H168 Cu8 F96 N32 O48 -","8","1","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0556","0.0445","","","0.1163","0.1264","","","","","","1.097","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339134","30.032","0.006","9.6811","0.0019","25.641","0.005","90","","127.23","0.03","90","","5936","3","115","2","115","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H23 Cu F12 N4 O6 -","- C184 H184 Cu8 F96 N32 O48 -","8","2","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0424","0.0365","","","0.095","0.0999","","","","","","0.966","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339135","30.024","0.0018","9.6599","0.0005","25.5727","0.0013","90","","127.055","0.001","90","","5919","0.6","145","2","145","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H23 Cu F12 N4 O6 -","- C184 H184 Cu8 F96 N32 O48 -","8","2","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0542","0.0446","","","0.1201","0.1269","","","","","","1.031","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339136","30.114","0.006","9.6665","0.0019","25.594","0.005","90","","126.81","0.03","90","","5965","3","175","2","175","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H23 Cu F12 N4 O6 -","- C184 H184 Cu8 F96 N32 O48 -","8","2","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0634","0.0505","","","0.1414","0.1536","","","","","","1.031","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339137","30.091","0.002","9.6322","0.0007","25.5389","0.0018","90","","126.637","0.001","90","","5939.8","0.7","195","2","195","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H23 Cu F12 N4 O6 -","- C184 H184 Cu8 F96 N32 O48 -","8","2","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.08","0.0581","","","0.1505","0.1651","","","","","","1.013","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339138","30.263","0.002","9.6656","0.0006","25.6609","0.0015","90","","126.519","0.001","90","","6032.3","0.7","205","2","205","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H23 Cu F12 N4 O6 -","- C184 H184 Cu8 F96 N32 O48 -","8","2","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0607","0.0431","","","0.1124","0.1255","","","","","","0.813","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339139","30.306","0.002","9.6673","0.0006","25.6901","0.0015","90","","126.469","0.001","90","","6052.7","0.7","210","2","210","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H23 Cu F12 N4 O6 -","- C184 H184 Cu8 F96 N32 O48 -","8","2","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0607","0.0415","","","0.1039","0.1161","","","","","","0.854","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339140","30.321","0.002","9.6572","0.0006","25.6994","0.0016","90","","126.402","0.001","90","","6056.8","0.7","215","2","215","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H23 Cu F12 N4 O6 -","- C184 H184 Cu8 F96 N32 O48 -","8","2","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0682","0.0474","","","0.1217","0.1419","","","","","","0.926","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339141","30.401","0.002","9.6628","0.0006","25.7577","0.0015","90","","126.323","0.001","90","","6096.3","0.7","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H23 Cu F12 N4 O6 -","- C184 H184 Cu8 F96 N32 O48 -","8","2","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0727","0.0511","","","0.1319","0.1481","","","","","","0.94","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339142","30.44","0.002","9.6463","0.0007","25.7769","0.0017","90","","126.19","","90","","6108.6","0.7","225","2","225","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H23 Cu F12 N4 O6 -","- C184 H184 Cu8 F96 N32 O48 -","8","1","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0514","0.0443","","","0.1148","0.1269","","","","","","0.677","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339143","30.503","0.002","9.6056","0.0007","25.8351","0.0019","90","","126.003","0.001","90","","6123.8","0.8","229","2","229","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H21 Cu F12 N4 O6 -","- C184 H168 Cu8 F96 N32 O48 -","8","1","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0573","0.0489","","","0.1264","0.1372","","","","","","0.941","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339144","30.55","0.002","9.5949","0.0007","25.8807","0.0019","90","","125.892","0.001","90","","6145.8","0.8","232","2","232","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H23 Cu F12 N4 O6 -","- C184 H184 Cu8 F96 N32 O48 -","8","1","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0672","0.0584","","","0.1637","0.1727","","","","","","1.019","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339145","30.613","0.003","9.5703","0.0007","25.945","0.002","90","","125.676","0.003","90","","6174.7","0.9","240","2","240","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H23 Cu F12 N4 O6 -","- C23 H23 Cu F12 N4 O6 -","- C184 H184 Cu8 F96 N32 O48 -","8","1","","Fedin, Matvey; Veber, Sergey; Gromov, Igor; Maryunina, Ksenia; Fokin, Sergey; Romanenko, Galina; Sagdeev, Renad; Ovcharenko, Victor; Bagryanskaya, Elena","Thermally induced spin transitions in nitroxide-copper(II)-nitroxide spin triads studied by EPR.","Inorganic chemistry","2007","46","26","11405","11415","10.1021/ic7014385","","","0.71073","MoKα","","0.0629","0.0536","","","0.1434","0.1514","","","","","","1.049","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339146","14.7439","0.0006","21.8538","0.0009","21.9153","0.0009","90","","90","","90","","7061.3","0.5","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C36 H42 Cl2 O4 P2 Pd -","- C36 H42 Cl2 O4 P2 Pd -","- C288 H336 Cl16 O32 P16 Pd8 -","8","1","","Moiseev, Dmitry V.; Patrick, Brian O.; James, Brian R.","New tertiary phosphines from cinnamaldehydes and diphenylphosphine.","Inorganic chemistry","2007","46","26","11467","11474","10.1021/ic701597g","","","0.71073","MoKα","","0.0889","0.0546","","","0.1023","0.1129","","","","","","1.118","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339147","9.0715","0.0004","13.5523","0.0006","14.9505","0.0006","84.728","0.001","88.297","0.001","83.173","0.001","1816.93","0.14","150","1","150","1","","","","","","","","7","P -1","-P 1","2","","","","- C30 H38 Ag F6 N8 O4 P -","- C30 H38 Ag F6 N8 O4 P -","- C60 H76 Ag2 F12 N16 O8 P2 -","2","1","","Reger, Daniel L.; Foley, Elizabeth A.; Semeniuc, Radu F.; Smith, Mark D.","Structural comparisons of silver(I) complexes of third-generation ligands built from tridentate (o-C(6)H(4)[CH(2)OCH(2)C(pz)(3)](2)) versus bidentate poly(1-pyrazolyl)methane units (o-C(6)H(4)[CH(2)OCH(2)CH(pz)(2)](2)) (pz = pyrazolyl ring).","Inorganic chemistry","2007","46","26","11345","11355","10.1021/ic7017743","","","0.71073","MoKα","","0.0475","0.0428","","","0.1151","0.1184","","","","","","1.038","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339148","9.0339","0.0003","26.9953","0.001","15.3334","0.0006","90","","92.521","0.001","90","","3735.8","0.2","150","1","150","1","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C29.5 H35 Ag F3 N8 O6.5 S -","- C29.5 H35 Ag F3 N8 O6.5 S -","- C118 H140 Ag4 F12 N32 O26 S4 -","4","1","","Reger, Daniel L.; Foley, Elizabeth A.; Semeniuc, Radu F.; Smith, Mark D.","Structural comparisons of silver(I) complexes of third-generation ligands built from tridentate (o-C(6)H(4)[CH(2)OCH(2)C(pz)(3)](2)) versus bidentate poly(1-pyrazolyl)methane units (o-C(6)H(4)[CH(2)OCH(2)CH(pz)(2)](2)) (pz = pyrazolyl ring).","Inorganic chemistry","2007","46","26","11345","11355","10.1021/ic7017743","","","0.71073","MoKα","","0.0611","0.0481","","","0.1451","0.1526","","","","","","1.076","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339149","8.2566","0.0005","10.396","0.0006","10.4792","0.0006","95.528","0.001","91.541","0.001","106.084","0.001","858.91","0.09","150","1","150","1","","","","","","","","7","P 1","P 1","1","","","","- C31 H30 Ag F3 N12 O5 S -","- C31 H30 Ag F3 N12 O5 S -","- C31 H30 Ag F3 N12 O5 S -","1","1","","Reger, Daniel L.; Foley, Elizabeth A.; Semeniuc, Radu F.; Smith, Mark D.","Structural comparisons of silver(I) complexes of third-generation ligands built from tridentate (o-C(6)H(4)[CH(2)OCH(2)C(pz)(3)](2)) versus bidentate poly(1-pyrazolyl)methane units (o-C(6)H(4)[CH(2)OCH(2)CH(pz)(2)](2)) (pz = pyrazolyl ring).","Inorganic chemistry","2007","46","26","11345","11355","10.1021/ic7017743","","","0.71073","MoKα","","0.0524","0.0494","","","0.1198","0.1219","","","","","","0.996","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339150","13.5708","0.0006","28.5556","0.0012","25.5868","0.0011","90","","101.854","0.001","90","","9704","0.7","150","1","150","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C72 H81 Ag4 F9 N24 O15.5 S3 -","- C72 H81 Ag4 F9 N24 O15.5 S3 -","- C288 H324 Ag16 F36 N96 O62 S12 -","4","1","","Reger, Daniel L.; Foley, Elizabeth A.; Semeniuc, Radu F.; Smith, Mark D.","Structural comparisons of silver(I) complexes of third-generation ligands built from tridentate (o-C(6)H(4)[CH(2)OCH(2)C(pz)(3)](2)) versus bidentate poly(1-pyrazolyl)methane units (o-C(6)H(4)[CH(2)OCH(2)CH(pz)(2)](2)) (pz = pyrazolyl ring).","Inorganic chemistry","2007","46","26","11345","11355","10.1021/ic7017743","","","0.71073","MoKα","","0.0985","0.0818","","","0.2071","0.2175","","","","","","1.087","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339151","10.37","0.001","13.399","0.001","48.885","0.001","90","","90","","90","","6792.5","0.8","198","2","198","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H18 Cl2 F9 Ir N6 -","- C36 H18 Cl2 F9 Ir N6 -","- C288 H144 Cl16 F72 Ir8 N48 -","8","2","","Orselli, Enrico; Kottas, Gregg S.; Konradsson, Asgeir E.; Coppo, Paolo; Fröhlich, Roland; de Cola, Luisa; van Dijken, Addy; Büchel, Michael; Börner, Herbert","Blue-emitting iridium complexes with substituted 1,2,4-triazole ligands: synthesis, photophysics, and devices.","Inorganic chemistry","2007","46","26","11082","11093","10.1021/ic701110p","","","0.71073","MoKα","","0.0857","0.0581","","","0.1283","0.145","","","","","","1.042","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339152","9.424","0.001","20.573","0.001","18.276","0.001","90","","90.89","0.01","90","","3542.9","0.5","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H27 F6 Ir N6 -","- C42 H27 F6 Ir N6 -","- C168 H108 F24 Ir4 N24 -","4","1","","Orselli, Enrico; Kottas, Gregg S.; Konradsson, Asgeir E.; Coppo, Paolo; Fröhlich, Roland; de Cola, Luisa; van Dijken, Addy; Büchel, Michael; Börner, Herbert","Blue-emitting iridium complexes with substituted 1,2,4-triazole ligands: synthesis, photophysics, and devices.","Inorganic chemistry","2007","46","26","11082","11093","10.1021/ic701110p","","","0.71073","MoKα","","0.0627","0.0423","","","0.1014","0.1089","","","","","","1.075","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339153","18.775","0.0003","14.468","0.0002","10.8932","0.0002","90","","90","","90","","2958.99","0.08","198","2","198","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C35 H19 F6 Ir N6 -","- C35 H19 F6 Ir N6 -","- C140 H76 F24 Ir4 N24 -","4","1","","Orselli, Enrico; Kottas, Gregg S.; Konradsson, Asgeir E.; Coppo, Paolo; Fröhlich, Roland; de Cola, Luisa; van Dijken, Addy; Büchel, Michael; Börner, Herbert","Blue-emitting iridium complexes with substituted 1,2,4-triazole ligands: synthesis, photophysics, and devices.","Inorganic chemistry","2007","46","26","11082","11093","10.1021/ic701110p","","","0.71073","MoKα","","0.0392","0.0288","","","0.0556","0.0582","","","","","","1.046","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339154","9.5584","0.0001","14.4182","0.0002","21.1791","0.0003","90","","97.485","0.001","90","","2893.92","0.07","198","2","198","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H20 F5 Ir N6 -","- C35 H20 F5 Ir N6 -","- C140 H80 F20 Ir4 N24 -","4","1","","Orselli, Enrico; Kottas, Gregg S.; Konradsson, Asgeir E.; Coppo, Paolo; Fröhlich, Roland; de Cola, Luisa; van Dijken, Addy; Büchel, Michael; Börner, Herbert","Blue-emitting iridium complexes with substituted 1,2,4-triazole ligands: synthesis, photophysics, and devices.","Inorganic chemistry","2007","46","26","11082","11093","10.1021/ic701110p","","","0.71073","MoKα","","0.0303","0.0242","","","0.058","0.0603","","","","","","1.039","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339155","24.854","0.001","15.37","0.001","17.733","0.001","90","","90","","90","","6774.1","0.6","223","2","223","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C36 H23 F4 Ir N6 -","- C36 H23 F4 Ir N6 -","- C288 H184 F32 Ir8 N48 -","8","1","","Orselli, Enrico; Kottas, Gregg S.; Konradsson, Asgeir E.; Coppo, Paolo; Fröhlich, Roland; de Cola, Luisa; van Dijken, Addy; Büchel, Michael; Börner, Herbert","Blue-emitting iridium complexes with substituted 1,2,4-triazole ligands: synthesis, photophysics, and devices.","Inorganic chemistry","2007","46","26","11082","11093","10.1021/ic701110p","","","0.71073","MoKα","","0.0838","0.049","","","0.1534","0.1711","","","","","","1.057","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339156","17.8018","0.0002","9.6752","0.0001","17.7056","0.0002","90","","101.247","0.001","90","","2990.98","0.06","198","2","198","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H19 F6 Ir N6 -","- C35 H19 F6 Ir N6 -","- C140 H76 F24 Ir4 N24 -","4","1","","Orselli, Enrico; Kottas, Gregg S.; Konradsson, Asgeir E.; Coppo, Paolo; Fröhlich, Roland; de Cola, Luisa; van Dijken, Addy; Büchel, Michael; Börner, Herbert","Blue-emitting iridium complexes with substituted 1,2,4-triazole ligands: synthesis, photophysics, and devices.","Inorganic chemistry","2007","46","26","11082","11093","10.1021/ic701110p","","","0.71073","MoKα","","0.04","0.0283","","","0.065","0.0694","","","","","","1.027","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339157","15.616","0.003","14.575","0.003","26.312","0.005","90","","95.85","0.03","90","","5958","2","253","2","253","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C65 H52 Cl6 N4 Os P2 -","- C65 H52 Cl6 N4 Os P2 -","- C260 H208 Cl24 N16 Os4 P8 -","4","1","","Lai, Siu-Wai; Chan, Queenie K.-W.; Zhu, Nianyong; Che, Chi-Ming","cis-Dicyanoosmium(II) diimine complexes bearing phosphine or sulfoxide ligands: spectroscopic and luminescent studies.","Inorganic chemistry","2007","46","26","11003","11016","10.1021/ic070290l","","","0.71073","MoKα","","0.0517","0.0427","","","0.1255","0.1293","","","","","","1.083","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339158","20.479","0.004","10.639","0.002","23.738","0.005","90","","113.88","0.03","90","","4729","2","253","2","253","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52 H42 Cl4 N4 Os P2 -","- C52 H42 Cl4 N4 Os P2 -","- C208 H168 Cl16 N16 Os4 P8 -","4","0.5","","Lai, Siu-Wai; Chan, Queenie K.-W.; Zhu, Nianyong; Che, Chi-Ming","cis-Dicyanoosmium(II) diimine complexes bearing phosphine or sulfoxide ligands: spectroscopic and luminescent studies.","Inorganic chemistry","2007","46","26","11003","11016","10.1021/ic070290l","","","0.71073","MoKα","","0.0353","0.0303","","","0.0811","0.0825","","","","","","1.146","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339159","25.929","0.005","14.953","0.003","11.856","0.002","90","","90","","90","","4596.8","1.5","301","2","301","2","","","","","","","","7","P n n a","-P 2a 2bc","52","","","","- C50 H38 N6 O6 Os P2 Zn -","- C50 H38 N6 O6 Os P2 Zn -","- C200 H152 N24 O24 Os4 P8 Zn4 -","4","0.5","","Lai, Siu-Wai; Chan, Queenie K.-W.; Zhu, Nianyong; Che, Chi-Ming","cis-Dicyanoosmium(II) diimine complexes bearing phosphine or sulfoxide ligands: spectroscopic and luminescent studies.","Inorganic chemistry","2007","46","26","11003","11016","10.1021/ic070290l","","","0.71069","MoKα","","0.0523","0.0342","","","0.1049","0.1176","","","","","","1.059","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339160","12.015","0.002","13.223","0.003","17.861","0.004","83.28","0.03","87.84","0.03","75.57","0.03","2729.1","1.1","301","2","301","2","","","","","","","","6","P -1","-P 1","2","","","","- C63 H51 Cl2 N5 Os P2 -","- C63 H51 Cl2 N5 Os P2 -","- C126 H102 Cl4 N10 Os2 P4 -","2","1","","Lai, Siu-Wai; Chan, Queenie K.-W.; Zhu, Nianyong; Che, Chi-Ming","cis-Dicyanoosmium(II) diimine complexes bearing phosphine or sulfoxide ligands: spectroscopic and luminescent studies.","Inorganic chemistry","2007","46","26","11003","11016","10.1021/ic070290l","","","0.71073","MoKα","","0.0355","0.0315","","","0.0856","0.0866","","","","","","1.041","","","","has coordinates,has disorder","211151","2020-10-21","18:00:00",""
"4339161","12.034","0.002","28.425","0.006","15.404","0.003","90","","101.71","0.03","90","","5159.5","1.8","253","2","253","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C57 H58 Cl2 N4 O Os P2 -","- C57 H58 Cl2 N4 O Os P2 -","- C228 H232 Cl8 N16 O4 Os4 P8 -","4","1","","Lai, Siu-Wai; Chan, Queenie K.-W.; Zhu, Nianyong; Che, Chi-Ming","cis-Dicyanoosmium(II) diimine complexes bearing phosphine or sulfoxide ligands: spectroscopic and luminescent studies.","Inorganic chemistry","2007","46","26","11003","11016","10.1021/ic070290l","","","0.71073","MoKα","","0.039","0.0261","","","0.0613","0.0632","","","","","","0.941","","","","has coordinates","211151","2020-10-21","18:00:00",""
"4339162","7.671","0.0015","9.465","0.002","15.651","0.003","102.86","0.03","98.04","0.03","104.78","0.03","1047.6","0.5","301","2","301","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H24 N4 O3 Os S2 -","- C17 H24 N4 O3 Os S2 -","- C34 H48 N8 O6 Os2 S4 -","2","1","","Lai, Siu-Wai; Chan, Queenie K.-W.; Zhu, Nianyong; Che, Chi-Ming","cis-Dicyanoosmium(II) diimine complexes bearing phosphine or sulfoxide ligands: spectroscopic and luminescent studies.","Inorganic chemistry","2007","46","26","11003","11016","10.1021/ic070290l","","","0.71073","MoKα","","0.0381","0.0344","","","0.0857","0.0863","","","","","","1.014","","","","has coordinates","211151","2020-10-21","18:00:00",""
"4339163","25.414","0.005","10.516","0.002","24.557","0.005","90","","117.73","0.03","90","","5809","3","301","2","301","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28.5 H29 Cl N4 O2 Os S2 -","- C28.5 H29 Cl1.005 N4 O2 Os S2 -","- C228 H232 Cl8.04 N32 O16 Os8 S16 -","8","1","","Lai, Siu-Wai; Chan, Queenie K.-W.; Zhu, Nianyong; Che, Chi-Ming","cis-Dicyanoosmium(II) diimine complexes bearing phosphine or sulfoxide ligands: spectroscopic and luminescent studies.","Inorganic chemistry","2007","46","26","11003","11016","10.1021/ic070290l","","","0.71073","MoKα","","0.049","0.0379","","","0.0953","0.0981","","","","","","0.959","","","","has coordinates","211151","2020-10-21","18:00:00",""
"4339164","19.018","0.004","22.018","0.004","18.594","0.004","90","","109.34","0.03","90","","7347","3","301","2","301","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26.5 H42 Cl N4 O2.5 Os S2 -","- C26.5 H42 Cl N4 O2.5 Os S2 -","- C212 H336 Cl8 N32 O20 Os8 S16 -","8","2","","Lai, Siu-Wai; Chan, Queenie K.-W.; Zhu, Nianyong; Che, Chi-Ming","cis-Dicyanoosmium(II) diimine complexes bearing phosphine or sulfoxide ligands: spectroscopic and luminescent studies.","Inorganic chemistry","2007","46","26","11003","11016","10.1021/ic070290l","","","0.71073","MoKα","","0.0975","0.0441","","","0.1074","0.1168","","","","","","0.828","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339165","10.882","0.003","10.392","0.003","12.466","0.004","90","","100.07","0.02","90","","1388","0.7","301","2","301","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C21 H32 Cl2 N4 O2 Os P2 -","- C21 H32 Cl2 N4 O2 Os P2 -","- C42 H64 Cl4 N8 O4 Os2 P4 -","2","0.5","","Lai, Siu-Wai; Chan, Queenie K.-W.; Zhu, Nianyong; Che, Chi-Ming","cis-Dicyanoosmium(II) diimine complexes bearing phosphine or sulfoxide ligands: spectroscopic and luminescent studies.","Inorganic chemistry","2007","46","26","11003","11016","10.1021/ic070290l","","","0.71073","MoKα","","0.0319","0.0241","","","0.0647","0.0729","","","","","","1.194","","","","has coordinates","211151","2020-10-21","18:00:00",""
"4339166","9.7133","0.0006","11.2111","0.0007","13.3168","0.0008","99.75","0.004","97.639","0.004","100.634","0.004","1384.34","0.15","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H34 N3 O7 P -","- C28 H34 N3 O7 P -","- C56 H68 N6 O14 P2 -","2","1","","Huang, Rongcai; Frost, Brian J.","Development of a series of P(CH(2)N=CHR)(3) and trisubstituted 1,3,5-Triaza-7-phosphaadamantane ligands.","Inorganic chemistry","2007","46","26","10962","10964","10.1021/ic701864g","","","0.71073","MoKα","","0.0923","0.0506","","","0.1204","0.1337","","","","","","1.059","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339167","14.727","0.0003","22.0291","0.0004","8.7533","0.0001","90","","98.813","0.001","90","","2806.24","0.08","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C56 H64 Cl6 N6 O6 P2 Pd -","- C56 H64 Cl6 N6 O6 P2 Pd -","- C112 H128 Cl12 N12 O12 P4 Pd2 -","2","0.5","","Huang, Rongcai; Frost, Brian J.","Development of a series of P(CH(2)N=CHR)(3) and trisubstituted 1,3,5-Triaza-7-phosphaadamantane ligands.","Inorganic chemistry","2007","46","26","10962","10964","10.1021/ic701864g","","","0.71073","MoKα","","0.0902","0.0479","","","0.1126","0.1248","","","","","","1.034","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339168","7.0594","0.0003","10.9914","0.0005","17.0315","0.0007","76.065","0.001","86.217","0.001","74.073","0.001","1233.39","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C27.5 H30 Cl N3 O3 P -","- C27.5 H30 Cl N3 O3 P -","- C55 H60 Cl2 N6 O6 P2 -","2","1","","Huang, Rongcai; Frost, Brian J.","Development of a series of P(CH(2)N=CHR)(3) and trisubstituted 1,3,5-Triaza-7-phosphaadamantane ligands.","Inorganic chemistry","2007","46","26","10962","10964","10.1021/ic701864g","","","0.71073","MoKα","","0.0701","0.045","","","0.1024","0.1218","","","","","","1.054","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339169","15.7012","0.0007","12.9389","0.0006","6.8971","0.0003","90","","97.005","0.001","90","","1390.73","0.11","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H9 Cl F3 N5 Pt -","- C12 H9 Cl F3 N5 Pt -","- C48 H36 Cl4 F12 N20 Pt4 -","4","1","","Chang, Sheng-Yuan; Chen, Jing-Lin; Chi, Yun; Cheng, Yi-Ming; Lee, Gene-Hsiang; Jiang, Chang-Ming; Chou, Pi-Tai","Blue-emitting platinum(II) complexes bearing both pyridylpyrazolate chelate and bridging pyrazolate ligands: synthesis, structures, and photophysical properties.","Inorganic chemistry","2007","46","26","11202","11212","10.1021/ic701586c","","","0.71073","MoKα","","0.0289","0.0234","","","0.053","0.073","","","","","","1.175","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339170","10.9312","0.001","20.0897","0.0019","9.9253","0.001","90","","98.352","0.002","90","","2156.5","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H21 Cl F3 N7 Pt -","- C19 H21 Cl F3 N7 Pt -","- C76 H84 Cl4 F12 N28 Pt4 -","4","1","","Chang, Sheng-Yuan; Chen, Jing-Lin; Chi, Yun; Cheng, Yi-Ming; Lee, Gene-Hsiang; Jiang, Chang-Ming; Chou, Pi-Tai","Blue-emitting platinum(II) complexes bearing both pyridylpyrazolate chelate and bridging pyrazolate ligands: synthesis, structures, and photophysical properties.","Inorganic chemistry","2007","46","26","11202","11212","10.1021/ic701586c","","","0.71073","MoKα","","0.0404","0.0344","","","0.0771","0.08","","","","","","1.06","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339171","10.855","0.0007","18.6229","0.0012","14.4743","0.0009","90","","91.67","0.001","90","","2924.8","0.3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C26 H37 Cl F3 N5 O1.5 Pt -","- C26 H37 Cl F3 N5 O1.5 Pt -","- C104 H148 Cl4 F12 N20 O6 Pt4 -","4","1","","Chang, Sheng-Yuan; Chen, Jing-Lin; Chi, Yun; Cheng, Yi-Ming; Lee, Gene-Hsiang; Jiang, Chang-Ming; Chou, Pi-Tai","Blue-emitting platinum(II) complexes bearing both pyridylpyrazolate chelate and bridging pyrazolate ligands: synthesis, structures, and photophysical properties.","Inorganic chemistry","2007","46","26","11202","11212","10.1021/ic701586c","","","0.71073","MoKα","","0.0622","0.0456","","","0.1034","0.1105","","","","","","1.04","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339172","21.9896","0.0009","9.5191","0.0004","25.6962","0.001","90","","110.516","0.001","90","","5037.6","0.4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H27 Cl3 F3 N5 Pt -","- C21 H27 Cl3 F3 N5 Pt -","- C168 H216 Cl24 F24 N40 Pt8 -","8","1","","Chang, Sheng-Yuan; Chen, Jing-Lin; Chi, Yun; Cheng, Yi-Ming; Lee, Gene-Hsiang; Jiang, Chang-Ming; Chou, Pi-Tai","Blue-emitting platinum(II) complexes bearing both pyridylpyrazolate chelate and bridging pyrazolate ligands: synthesis, structures, and photophysical properties.","Inorganic chemistry","2007","46","26","11202","11212","10.1021/ic701586c","","","0.71073","MoKα","","0.0458","0.0376","","","0.0743","0.0772","","","","","","1.094","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339173","11.1587","0.0006","21.3575","0.0012","13.2677","0.0007","90","","108.591","0.001","90","","2997","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H18 Cl2 F6 N10 Pt2 -","- C25 H18 Cl2 F6 N10 Pt2 -","- C100 H72 Cl8 F24 N40 Pt8 -","4","1","","Chang, Sheng-Yuan; Chen, Jing-Lin; Chi, Yun; Cheng, Yi-Ming; Lee, Gene-Hsiang; Jiang, Chang-Ming; Chou, Pi-Tai","Blue-emitting platinum(II) complexes bearing both pyridylpyrazolate chelate and bridging pyrazolate ligands: synthesis, structures, and photophysical properties.","Inorganic chemistry","2007","46","26","11202","11212","10.1021/ic701586c","","","0.71073","MoKα","","0.0557","0.0417","","","0.0762","0.0809","","","","","","1.064","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339174","17.4642","0.001","8.6594","0.0005","19.8926","0.0011","90","","103.644","0.001","90","","2923.5","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H22 F6 N10 O Pt2 -","- C27 H22 F6 N10 O Pt2 -","- C108 H88 F24 N40 O4 Pt8 -","4","1","","Chang, Sheng-Yuan; Chen, Jing-Lin; Chi, Yun; Cheng, Yi-Ming; Lee, Gene-Hsiang; Jiang, Chang-Ming; Chou, Pi-Tai","Blue-emitting platinum(II) complexes bearing both pyridylpyrazolate chelate and bridging pyrazolate ligands: synthesis, structures, and photophysical properties.","Inorganic chemistry","2007","46","26","11202","11212","10.1021/ic701586c","","","0.71073","MoKα","","0.0457","0.0347","","","0.0758","0.0895","","","","","","1.126","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339175","19.625","0.007","43.089","0.017","21.573","0.008","90","","96.97","0.008","90","","18108","12","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C43 H28.5 F12 Fe N12.5 O P2 -","- C43 H24 F12 Fe N12.5 O P2 -","- C688 H384 F192 Fe16 N200 O16 P32 -","16","2","","Roy, Mithun; Pathak, Biswarup; Patra, Ashis K.; Jemmis, Eluvathingal D.; Nethaji, Munirathinam; Chakravarty, Akhil R.","New insights into the visible-light-induced DNA cleavage activity of dipyridoquinoxaline complexes of bivalent 3d-metal ions.","Inorganic chemistry","2007","46","26","11122","11132","10.1021/ic701450a","","","0.71073","MoKα","","0.2102","0.0907","","","0.2101","0.2731","","","","","","0.951","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339176","13.6228","0.0019","13.612","0.0019","40.764","0.006","90","","98.331","0.002","90","","7479.2","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 Cl2 N10 O11 Zn -","- C34 H29 Cl2 N10 O11 Zn -","- C272 H232 Cl16 N80 O88 Zn8 -","8","2","","Roy, Mithun; Pathak, Biswarup; Patra, Ashis K.; Jemmis, Eluvathingal D.; Nethaji, Munirathinam; Chakravarty, Akhil R.","New insights into the visible-light-induced DNA cleavage activity of dipyridoquinoxaline complexes of bivalent 3d-metal ions.","Inorganic chemistry","2007","46","26","11122","11132","10.1021/ic701450a","","","0.71073","MoKα","","0.2185","0.1113","","","0.2181","0.2662","","","","","","1.046","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339177","21.0116","0.0008","21.0116","0.0008","13.3454","0.001","90","","90","","90","","5891.8","0.5","273","2","273","2","","","","","","","","4","P 4/n c c :2","-P 4a 2ac","130","","","","- Bi3 K3 P4 S16 -","- Bi3 K3 P4 S16 -","- Bi24 K24 P32 S128 -","8","0.5","","Gave, Matthew A.; Weliky, David P.; Kanatzidis, Mercouri G.","New potassium bismuth thiophosphates including the modulated K(1.5)Bi(2.5)(PS4)(3).","Inorganic chemistry","2007","46","26","11063","11074","10.1021/ic701211a","","","0.71073","MoKα","","0.122","0.0674","","","0.1771","0.2092","","","","","","1.049","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339178","18.306","0.004","8.926","0.002","9.71","0.002","90","","90","","90","","1586.6","0.6","273","2","273","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- Bi K9 P4 S16 -","- Bi K9 P4 S16 -","- Bi2 K18 P8 S32 -","2","0.5","","Gave, Matthew A.; Weliky, David P.; Kanatzidis, Mercouri G.","New potassium bismuth thiophosphates including the modulated K(1.5)Bi(2.5)(PS4)(3).","Inorganic chemistry","2007","46","26","11063","11074","10.1021/ic701211a","","","0.71073","MoKα","","0.106","0.0578","","","0.089","0.1018","","","","","","1.021","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339179","16.204","0.002","11.087","0.0013","17.977","0.003","90","","90.868","0.012","90","","3229.3","0.8","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H19 Al F24 N2 O4 -","- C20 H19 Al F24 N2 O4 -","- C80 H76 Al4 F96 N8 O16 -","4","1","","Timofte, Tudor; Pitula, Slawomir; Mudring, Anja-Verena","Ionic liquids with perfluorinated alkoxyaluminates.","Inorganic chemistry","2007","46","26","10938","10940","10.1021/ic7009995","","","0.71073","MoKα","","0.0901","0.0451","","0.1073","0.0957","","","","0.886","1.134","1.134","","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339180","24.344","0.004","10.6717","0.0016","25.978","0.004","90","","90","","90","","6748.9","1.8","298","2","298","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C42 H76 Cl5 Fe3 N22 O13 -","- C42 H76 Cl5 Fe3 N22 O13 -","- C168 H304 Cl20 Fe12 N88 O52 -","4","0.5","","Piñero, Dalice; Baran, Peter; Boca, Roman; Herchel, Radovan; Klein, Michael; Raptis, Raphael G.; Renz, Franz; Sanakis, Yiannis","A pyrazolate-supported Fe(3)(mu(3)-O) core: structural, spectroscopic, electrochemical, and magnetic study.","Inorganic chemistry","2007","46","26","10981","10989","10.1021/ic0701460","","","0.71073","MoKα","","0.0927","0.0497","","","0.1183","0.1382","","","","","","1.003","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339181","17.532","0.003","18.109","0.003","24.15","0.004","90","","106.755","0.003","90","","7342","2","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C66 H52 Cl3 Fe3 N18 O13 P2 -","- C66 H52 Cl3 Fe3 N18 O13 P2 -","- C264 H208 Cl12 Fe12 N72 O52 P8 -","4","1","","Piñero, Dalice; Baran, Peter; Boca, Roman; Herchel, Radovan; Klein, Michael; Raptis, Raphael G.; Renz, Franz; Sanakis, Yiannis","A pyrazolate-supported Fe(3)(mu(3)-O) core: structural, spectroscopic, electrochemical, and magnetic study.","Inorganic chemistry","2007","46","26","10981","10989","10.1021/ic0701460","","","0.71073","MoKα","","0.1219","0.0472","","","0.0846","0.1026","","","","","","0.902","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339182","17.811","0.003","15.399","0.002","26.573","0.004","90","","101.809","0.003","90","","7134","1.9","299","2","299","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50.5 H88 Cl3 Fe3 N20 O14.5 -","- C50.5 H84 Cl3 Fe3 N20 O14.5 -","- C202 H336 Cl12 Fe12 N80 O58 -","4","1","","Piñero, Dalice; Baran, Peter; Boca, Roman; Herchel, Radovan; Klein, Michael; Raptis, Raphael G.; Renz, Franz; Sanakis, Yiannis","A pyrazolate-supported Fe(3)(mu(3)-O) core: structural, spectroscopic, electrochemical, and magnetic study.","Inorganic chemistry","2007","46","26","10981","10989","10.1021/ic0701460","","","0.71073","MoKα","","0.131","0.0677","","","0.1451","0.1763","","","","","","1.044","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339183","10.9792","0.0003","12.377","0.0004","12.699","0.0005","89.131","0.001","80.044","0.002","65.729","0.002","1546.44","0.09","130","2","130","2","","","","","","","","6","P -1","-P 1","2","AW16","AW16","","- C27 H25 F12 N5 O4 Ru -","- C27 H25 F11.99 N5 O4 Ru -","- C54 H50 F23.98 N10 O8 Ru2 -","2","1","","Wu, Adam; Masland, Joshua; Swartz, Rodney D.; Kaminsky, Werner; Mayer, James M.","Synthesis and characterization of ruthenium bis(beta-diketonato) pyridine-imidazole complexes for hydrogen atom transfer.","Inorganic chemistry","2007","46","26","11190","11201","10.1021/ic7015726","","","0.71073","MoKα","","0.1037","0.0631","","","0.1355","0.1535","","","","","","1.059","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339184","10.2674","0.0005","11.4128","0.0006","15.8465","0.001","90","","90.087","0.003","90","","1856.89","0.18","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","AW14","AW14","","- C18 H20 N3 O4 Ru -","- C18 H20 N3 O4 Ru -","- C72 H80 N12 O16 Ru4 -","4","1","","Wu, Adam; Masland, Joshua; Swartz, Rodney D.; Kaminsky, Werner; Mayer, James M.","Synthesis and characterization of ruthenium bis(beta-diketonato) pyridine-imidazole complexes for hydrogen atom transfer.","Inorganic chemistry","2007","46","26","11190","11201","10.1021/ic7015726","","","0.71073","MoKα","","0.0931","0.0653","","","0.1704","0.1939","","","","","","1.021","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339185","7.624","0.0006","11.73","0.0007","14.936","0.0011","112.531","0.003","95.165","0.003","94.249","0.003","1220.17","0.15","130","2","130","2","","","","","","","","8","P -1","-P 1","2","AW08","AW08","","- C39 H44 Cl2 F6 N6 O14 Ru2 S2 -","- C39 H44 Cl2 F6 N6 O14 Ru2 S2 -","- C39 H44 Cl2 F6 N6 O14 Ru2 S2 -","1","0.5","","Wu, Adam; Masland, Joshua; Swartz, Rodney D.; Kaminsky, Werner; Mayer, James M.","Synthesis and characterization of ruthenium bis(beta-diketonato) pyridine-imidazole complexes for hydrogen atom transfer.","Inorganic chemistry","2007","46","26","11190","11201","10.1021/ic7015726","","","0.71073","MoKα","","0.0825","0.058","","","0.1485","0.1669","","","","","","1.051","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339186","7.5358","0.0006","15.9357","0.0014","17.595","0.002","90","","106.26","0.003","90","","2028.4","0.3","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","AW15","","","- C21 H24 N3 O4 Ru -","- C21 H24 N3 O4 Ru -","- C84 H96 N12 O16 Ru4 -","4","1","","Wu, Adam; Masland, Joshua; Swartz, Rodney D.; Kaminsky, Werner; Mayer, James M.","Synthesis and characterization of ruthenium bis(beta-diketonato) pyridine-imidazole complexes for hydrogen atom transfer.","Inorganic chemistry","2007","46","26","11190","11201","10.1021/ic7015726","","","0.71073","MoKα","","0.1439","0.0649","","","0.1309","0.1649","","","","","","0.984","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339187","9.8715","0.0001","19.7664","0.0003","23.8995","0.0004","90","","90.4656","0.0005","90","","4663.21","0.12","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","AW06","AW06","","- C18 H11 F12 N3 O4 Ru -","- C18 H11 F12 N3 O4 Ru -","- C144 H88 F96 N24 O32 Ru8 -","8","2","","Wu, Adam; Masland, Joshua; Swartz, Rodney D.; Kaminsky, Werner; Mayer, James M.","Synthesis and characterization of ruthenium bis(beta-diketonato) pyridine-imidazole complexes for hydrogen atom transfer.","Inorganic chemistry","2007","46","26","11190","11201","10.1021/ic7015726","","","0.71073","MoKα","","0.1102","0.0601","","","0.1535","0.1736","","","","","","1.01","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339188","9.859","0.0004","19.459","0.001","23.84","0.0013","90","","90.39","0.002","90","","4573.5","0.4","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","AW11","AW11","","- C18 H9 F12 N3 O4 Ru -","- C18 H9 F12 N3 O4 Ru -","- C144 H72 F96 N24 O32 Ru8 -","8","2","","Wu, Adam; Masland, Joshua; Swartz, Rodney D.; Kaminsky, Werner; Mayer, James M.","Synthesis and characterization of ruthenium bis(beta-diketonato) pyridine-imidazole complexes for hydrogen atom transfer.","Inorganic chemistry","2007","46","26","11190","11201","10.1021/ic7015726","","","0.71073","MoKα","","0.2302","0.0768","","","0.1409","0.1993","","","","","","0.917","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339189","11.6752","0.0004","12.0201","0.0004","12.4185","0.0004","94.827","0.001","114.882","0.001","96.952","0.001","1551.63","0.09","90","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C66 H90 Cr2 Si2 -","- C66 H90 Cr2 Si2 -","- C66 H90 Cr2 Si2 -","1","0.5","","Wolf, Robert; Ni, Chengbao; Nguyen, Tailuan; Brynda, Marcin; Long, Gary J.; Sutton, Andrew D.; Fischer, Roland C.; Fettinger, J. C.; Hellman, Matthew; Pu, Lihung; Power, Philip P.","Substituent effects in formally quintuple-bonded ArCrCrAr compounds (Ar = terphenyl) and related species.","Inorganic chemistry","2007","46","26","11277","11290","10.1021/ic702112e","","","0.71073","MoKα","","0.0591","0.0382","","","0.0813","0.0895","","","","","","1.005","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339190","10.2466","0.0008","11.1972","0.0009","15.207","0.0012","109.655","0.002","92.661","0.002","105.614","0.002","1564.3","0.2","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C76 H94 Cr2 O2 -","- C76 H94 Cr2 O2 -","- C76 H94 Cr2 O2 -","1","0.5","","Wolf, Robert; Ni, Chengbao; Nguyen, Tailuan; Brynda, Marcin; Long, Gary J.; Sutton, Andrew D.; Fischer, Roland C.; Fettinger, J. C.; Hellman, Matthew; Pu, Lihung; Power, Philip P.","Substituent effects in formally quintuple-bonded ArCrCrAr compounds (Ar = terphenyl) and related species.","Inorganic chemistry","2007","46","26","11277","11290","10.1021/ic702112e","","","0.71073","MoKα","","0.0635","0.042","","","0.1027","0.1162","","","","","","0.951","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339191","9.8219","0.0019","13.937","0.003","20.835","0.004","106.625","0.004","93.504","0.004","94.576","0.004","2713.6","0.9","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C67 H80 Cr2 F2 -","- C67 H80 Cr2 F2 -","- C134 H160 Cr4 F4 -","2","1","","Wolf, Robert; Ni, Chengbao; Nguyen, Tailuan; Brynda, Marcin; Long, Gary J.; Sutton, Andrew D.; Fischer, Roland C.; Fettinger, J. C.; Hellman, Matthew; Pu, Lihung; Power, Philip P.","Substituent effects in formally quintuple-bonded ArCrCrAr compounds (Ar = terphenyl) and related species.","Inorganic chemistry","2007","46","26","11277","11290","10.1021/ic702112e","","","0.71073","MoKα","","0.0866","0.066","","","0.1844","0.1933","","","","","","0.894","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339192","10.0088","0.0009","10.9009","0.001","14.4175","0.0013","88.771","0.002","82.146","0.002","76.107","0.002","1512.6","0.2","90","2","90","2","","","","","","","","3","P -1","-P 1","2","","","","- C74 H90 Cr2 -","- C74 H90 Cr2 -","- C74 H90 Cr2 -","1","0.5","","Wolf, Robert; Ni, Chengbao; Nguyen, Tailuan; Brynda, Marcin; Long, Gary J.; Sutton, Andrew D.; Fischer, Roland C.; Fettinger, J. C.; Hellman, Matthew; Pu, Lihung; Power, Philip P.","Substituent effects in formally quintuple-bonded ArCrCrAr compounds (Ar = terphenyl) and related species.","Inorganic chemistry","2007","46","26","11277","11290","10.1021/ic702112e","","","0.71073","MoKα","","0.0519","0.0428","","","0.1111","0.1207","","","","","","0.952","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339193","9.8711","0.0002","30.1788","0.0007","18.739","0.0004","90","","96.83","","90","","5542.7","0.2","90","2","90","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C66 H88 Cr2 -","- C66 H88 Cr2 -","- C264 H352 Cr8 -","4","1","","Wolf, Robert; Ni, Chengbao; Nguyen, Tailuan; Brynda, Marcin; Long, Gary J.; Sutton, Andrew D.; Fischer, Roland C.; Fettinger, J. C.; Hellman, Matthew; Pu, Lihung; Power, Philip P.","Substituent effects in formally quintuple-bonded ArCrCrAr compounds (Ar = terphenyl) and related species.","Inorganic chemistry","2007","46","26","11277","11290","10.1021/ic702112e","","","0.71073","MoKα","","0.0434","0.0348","","","0.0927","0.1001","","","","","","0.869","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339194","19.0106","0.0012","19.0748","0.0012","26.7964","0.0017","90.915","0.001","93.208","0.001","90.861","0.001","9699.3","1.1","90","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C106 H165 Cr2 -","- C106 H165 Cr2 -","- C424 H660 Cr8 -","4","2","","Wolf, Robert; Ni, Chengbao; Nguyen, Tailuan; Brynda, Marcin; Long, Gary J.; Sutton, Andrew D.; Fischer, Roland C.; Fettinger, J. C.; Hellman, Matthew; Pu, Lihung; Power, Philip P.","Substituent effects in formally quintuple-bonded ArCrCrAr compounds (Ar = terphenyl) and related species.","Inorganic chemistry","2007","46","26","11277","11290","10.1021/ic702112e","","","0.71073","MoKα","","0.1035","0.0758","","","0.1808","0.1966","","","","","","1.021","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339195","9.8443","0.0005","13.8545","0.0007","14.2731","0.0008","101.999","0.001","98.78","0.001","93.103","0.001","1874.39","0.17","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H104 Cr2 F8 O2 -","- C84 H104 Cr2 F8 O2 -","- C84 H104 Cr2 F8 O2 -","1","0.5","","Wolf, Robert; Ni, Chengbao; Nguyen, Tailuan; Brynda, Marcin; Long, Gary J.; Sutton, Andrew D.; Fischer, Roland C.; Fettinger, J. C.; Hellman, Matthew; Pu, Lihung; Power, Philip P.","Substituent effects in formally quintuple-bonded ArCrCrAr compounds (Ar = terphenyl) and related species.","Inorganic chemistry","2007","46","26","11277","11290","10.1021/ic702112e","","","0.71073","MoKα","","0.0616","0.0476","","","0.1233","0.1311","","","","","","0.842","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339196","10.4069","0.0016","18.823","0.003","17.893","0.003","90","","93.876","0.005","90","","3497","1","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H56 B2 Cu8 N22 S12 W2 -","- C44 H56 B2 Cu8 N22 S12 W2 -","- C88 H112 B4 Cu16 N44 S24 W4 -","2","0.5","","Wang, Jing; Sun, Zhen-Rong; Deng, Li; Wei, Zheng-Hong; Zhang, Wen-Hua; Zhang, Yong; Lang, Jian-Ping","Reactions of a tungsten trisulfido complex of hydridotris(3,5-dimethylpyrazol-1-yl)borate (Tp*) [Et(4)N][Tp*WS(3)] with CuX (X = Cl, NCS, or CN): isolation, structures, and third-order NLO properties.","Inorganic chemistry","2007","46","26","11381","11389","10.1021/ic701641h","","","0.7107","MoKα","","0.0946","0.0828","","","0.1868","0.1942","","","","","","1.202","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339197","10.355","0.002","10.39","0.002","21.624","0.004","83.93","0.03","85.13","0.03","75.46","0.03","2235.2","0.8","223","2","223","2","","","","","","","","8","P -1","-P 1","2","","","","- C25 H44 B Cl9 Cu3 N7 S3 W -","- C25 H44 B Cl9 Cu3 N7 S3 W -","- C50 H88 B2 Cl18 Cu6 N14 S6 W2 -","2","1","","Wang, Jing; Sun, Zhen-Rong; Deng, Li; Wei, Zheng-Hong; Zhang, Wen-Hua; Zhang, Yong; Lang, Jian-Ping","Reactions of a tungsten trisulfido complex of hydridotris(3,5-dimethylpyrazol-1-yl)borate (Tp*) [Et(4)N][Tp*WS(3)] with CuX (X = Cl, NCS, or CN): isolation, structures, and third-order NLO properties.","Inorganic chemistry","2007","46","26","11381","11389","10.1021/ic701641h","","","0.71073","MoKα","","0.0895","0.0789","","","0.205","0.2128","","","","","","1.043","","","","has coordinates,has disorder","179494","2020-10-21","18:00:00",""
"4339198","9.863","0.002","12.442","0.003","20.895","0.005","90","","90","","90","","2564.1","1","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C18 H25 B Cu2 N8 S3 W -","- C18 H25 B Cu2 N8 S3 W -","- C72 H100 B4 Cu8 N32 S12 W4 -","4","1","","Wang, Jing; Sun, Zhen-Rong; Deng, Li; Wei, Zheng-Hong; Zhang, Wen-Hua; Zhang, Yong; Lang, Jian-Ping","Reactions of a tungsten trisulfido complex of hydridotris(3,5-dimethylpyrazol-1-yl)borate (Tp*) [Et(4)N][Tp*WS(3)] with CuX (X = Cl, NCS, or CN): isolation, structures, and third-order NLO properties.","Inorganic chemistry","2007","46","26","11381","11389","10.1021/ic701641h","","","0.71073","MoKα","","0.0423","0.0326","","","0.0541","0.0559","","","","","","0.918","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339199","17.254","0.004","18.011","0.004","20.956","0.004","90","","90","","90","","6512","2","223","2","223","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C24 H42 B Cu N8 O S3 W -","- C24 H42 B Cu N8 O S3 W -","- C192 H336 B8 Cu8 N64 O8 S24 W8 -","8","1","","Wang, Jing; Sun, Zhen-Rong; Deng, Li; Wei, Zheng-Hong; Zhang, Wen-Hua; Zhang, Yong; Lang, Jian-Ping","Reactions of a tungsten trisulfido complex of hydridotris(3,5-dimethylpyrazol-1-yl)borate (Tp*) [Et(4)N][Tp*WS(3)] with CuX (X = Cl, NCS, or CN): isolation, structures, and third-order NLO properties.","Inorganic chemistry","2007","46","26","11381","11389","10.1021/ic701641h","","","0.71073","MoKα","","0.0907","0.0856","","","0.1943","0.197","","","","","","1.343","","","","has coordinates","179494","2020-10-21","18:00:00",""
"4339200","6.2978","0.001","6.6804","0.001","7.0836","0.0011","90.614","0.003","99.335","0.003","96.5","0.003","292.05","0.08","193","2","193","2","","","","","","","","5","P -1","-P 1","2","neptunium(VI) methylphosphonate","","","- C H3 Np O5 P -","- C H3 Np O5 P -","- C2 H6 Np2 O10 P2 -","2","1","","Bray, Travis H.; Nelson, Anna-Gay D; Jin, Geng Bang; Haire, Richard G.; Albrecht-Schmitt, Thomas E","In situ hydrothermal reduction of neptunium(VI) as a route to neptunium(IV) phosphonates.","Inorganic chemistry","2007","46","26","10959","10961","10.1021/ic702136h","","","0.71073","MoKα","","0.0469","0.0372","","","0.0668","0.0683","","","","","","1.046","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339201","10.607","0.003","9.438","0.003","11.346","0.004","90","","90","","90","","1135.8","0.6","193","2","193","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C2 H9 N Np O11 P2 -","- C2 H9 N Np O11 P2 -","- C8 H36 N4 Np4 O44 P8 -","4","1","","Bray, Travis H.; Nelson, Anna-Gay D; Jin, Geng Bang; Haire, Richard G.; Albrecht-Schmitt, Thomas E","In situ hydrothermal reduction of neptunium(VI) as a route to neptunium(IV) phosphonates.","Inorganic chemistry","2007","46","26","10959","10961","10.1021/ic702136h","","","0.71073","MoKα","","0.0193","0.0182","","","0.0429","0.0432","","","","","","0.938","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339202","5.8402","0.0012","11","0.002","19.436","0.004","90","","90.87","0.03","90","","1248.5","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- F9 K4 O4 P Ti2 -","- F9 K4 O4 P Ti2 -","- F36 K16 O16 P4 Ti8 -","4","1","","Yang, Sihai; Li, Guobao; Li, Lei; Tian, Shujian; Liao, Fuhui; Xiong, Ming; Lin, Jianhua","Syntheses and structural characterization of a series of one-dimensional fluorotitanophosphates (NH4)(x)K(4-x)[Ti(2)PO(4)F(9)] (x = 0, 0.70, 1.00, 1.25).","Inorganic chemistry","2007","46","26","11431","11436","10.1021/ic701715k","","","0.71073","MoKα","","0.0459","0.0311","","","0.0747","0.0858","","","","","","1","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339203","11.3137","0.0005","12.0536","0.0005","16.0827","0.0011","109.059","0.004","94.664","0.004","111.536","0.003","1877.1","0.19","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H24.4 Fe Ge N6 O12.2 -","- C42 H24 Fe Ge N6 O12.2 -","- C84 H48 Fe2 Ge2 N12 O24.4 -","2","1","","Shi, Fa-Nian; Cunha-Silva, Luís; Hardie, Michaele J.; Trindade, Tito; Paz, Filipe A Almeida; Rocha, João","Heterodimetallic germanium(IV) complex structures with transition metals.","Inorganic chemistry","2007","46","16","6502","6515","10.1021/ic700507j","","","0.71073","MoKα","","0.086","0.0418","","","0.0826","0.0981","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339204","15.25","0.003","12.032","0.002","13.582","0.003","90","","90","","90","","2492.1","0.8","100","2","100","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C28 H18 Cu Ge N4 O10 -","- C28 H18 Cu Ge N4 O10 -","- C112 H72 Cu4 Ge4 N16 O40 -","4","0.5","","Shi, Fa-Nian; Cunha-Silva, Luís; Hardie, Michaele J.; Trindade, Tito; Paz, Filipe A Almeida; Rocha, João","Heterodimetallic germanium(IV) complex structures with transition metals.","Inorganic chemistry","2007","46","16","6502","6515","10.1021/ic700507j","","","0.71073","MoKα","","0.1387","0.105","","","0.2622","0.2798","","","","","","1.117","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339205","12.7304","0.0002","17.0619","0.0003","12.1242","0.0002","90","","100.729","0.001","90","","2587.4","0.07","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H18 Cd Ge N4 O10 -","- C28 H18 Cd Ge N4 O10 -","- C112 H72 Cd4 Ge4 N16 O40 -","4","0.5","","Shi, Fa-Nian; Cunha-Silva, Luís; Hardie, Michaele J.; Trindade, Tito; Paz, Filipe A Almeida; Rocha, João","Heterodimetallic germanium(IV) complex structures with transition metals.","Inorganic chemistry","2007","46","16","6502","6515","10.1021/ic700507j","","","0.71073","MoKα","","0.0176","0.0153","","","0.0392","0.0402","","","","","","1.048","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339206","9.3425","0.0005","20.6117","0.0009","19.1881","0.0009","90","","95.41","0.002","90","","3678.5","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H24 Fe Ge N6 O12 -","- C42 H24 Fe Ge N6 O12 -","- C168 H96 Fe4 Ge4 N24 O48 -","4","1","","Shi, Fa-Nian; Cunha-Silva, Luís; Hardie, Michaele J.; Trindade, Tito; Paz, Filipe A Almeida; Rocha, João","Heterodimetallic germanium(IV) complex structures with transition metals.","Inorganic chemistry","2007","46","16","6502","6515","10.1021/ic700507j","","","0.71073","MoKα","","0.0546","0.0335","","","0.0793","0.0896","","","","","","1.064","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339207","14.1076","0.0009","12.914","0.0008","20.8073","0.0013","90","","97.982","0.003","90","","3754.1","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H24 Cu Ge N6 O12 -","- C42 H24 Cu Ge N6 O12 -","- C168 H96 Cu4 Ge4 N24 O48 -","4","1","","Shi, Fa-Nian; Cunha-Silva, Luís; Hardie, Michaele J.; Trindade, Tito; Paz, Filipe A Almeida; Rocha, João","Heterodimetallic germanium(IV) complex structures with transition metals.","Inorganic chemistry","2007","46","16","6502","6515","10.1021/ic700507j","","","0.71073","MoKα","","0.0458","0.0309","","","0.0672","0.0744","","","","","","1.027","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339208","9.473","0.0019","20.528","0.004","19.029","0.004","90","","96.19","0.03","90","","3678.8","1.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H24 Cu Ge N6 O12 -","- C42 H24 Cu Ge N6 O12 -","- C168 H96 Cu4 Ge4 N24 O48 -","4","1","","Shi, Fa-Nian; Cunha-Silva, Luís; Hardie, Michaele J.; Trindade, Tito; Paz, Filipe A Almeida; Rocha, João","Heterodimetallic germanium(IV) complex structures with transition metals.","Inorganic chemistry","2007","46","16","6502","6515","10.1021/ic700507j","","","0.71073","MoKα","","0.0755","0.0386","","","0.0721","0.085","","","","","","1.042","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339209","9.406","0.0019","20.647","0.004","19.022","0.004","90","","95.09","0.03","90","","3679.6","1.3","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H24 Ge N6 Ni O12 -","- C42 H24 Ge N6 Ni O12 -","- C168 H96 Ge4 N24 Ni4 O48 -","4","1","","Shi, Fa-Nian; Cunha-Silva, Luís; Hardie, Michaele J.; Trindade, Tito; Paz, Filipe A Almeida; Rocha, João","Heterodimetallic germanium(IV) complex structures with transition metals.","Inorganic chemistry","2007","46","16","6502","6515","10.1021/ic700507j","","","1.5418","CuKα","","0.0531","0.0522","","","0.1382","0.1397","","","","","","1.051","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339210","16.4993","0.0015","12.4912","0.0011","17.8396","0.0016","90","","110.685","0.002","90","","3439.7","0.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C43 H31 Mn N9 -","- C43 H31 Mn N9 -","- C172 H124 Mn4 N36 -","4","1","","Cetin, Anil; Durfee, William S.; Ziegler, Christopher J.","Low-coordinate transition-metal complexes of a carbon-substituted hemiporphyrazine.","Inorganic chemistry","2007","46","16","6239","6241","10.1021/ic7011099","","","0.71073","MoKα","","0.0852","0.0633","","","0.1665","0.1806","","","","","","1.032","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339211","16.6549","0.0016","12.5612","0.0012","17.5184","0.0017","90","","111.49","0.002","90","","3410.2","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C40.5 H28.5 Co N8.5 -","- C33 H21 Co N7 -","- C132 H84 Co4 N28 -","4","1","","Cetin, Anil; Durfee, William S.; Ziegler, Christopher J.","Low-coordinate transition-metal complexes of a carbon-substituted hemiporphyrazine.","Inorganic chemistry","2007","46","16","6239","6241","10.1021/ic7011099","","","0.71073","MoKα","","0.0873","0.0522","","","0.1219","0.1331","","","","","","0.944","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339212","31.61","0.005","11.9896","0.0018","18.876","0.003","90","","107.095","0.003","90","","6837.8","1.8","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C40.5 H28.5 Fe N8.5 -","- C33 H23 Fe N7 -","- C264 H184 Fe8 N56 -","8","1","","Cetin, Anil; Durfee, William S.; Ziegler, Christopher J.","Low-coordinate transition-metal complexes of a carbon-substituted hemiporphyrazine.","Inorganic chemistry","2007","46","16","6239","6241","10.1021/ic7011099","","","0.71073","MoKα","","0.0753","0.0485","","","0.1162","0.1244","","","","","","0.966","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339213","20.187","0.005","24.542","0.005","24.756","0.004","90","","90","","90","","12265","4","293","2","293","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C72 H56 B Cu F4 O3 P4 -","- C72 H56 B Cu F4 O3 P4 -","- C576 H448 B8 Cu8 F32 O24 P32 -","8","1","","Venkateswaran, Ramalingam; Balakrishna, Maravanji S.; Mobin, Shaikh M.; Tuononen, Heikki M.","Copper(I) complexes of bis(2-(diphenylphosphino)phenyl) ether: synthesis, reactivity, and theoretical calculations.","Inorganic chemistry","2007","46","16","6535","6541","10.1021/ic7005474","","","0.71073","MoKα","","0.1621","0.058","","","0.1245","0.1508","","","","","","0.776","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339214","13.803","0.002","19.089","0.004","20.051","0.005","69.255","0.019","77.065","0.016","72.71","0.015","4675.6","1.8","150","2","150","2","","","","","","","","9","P -1","-P 1","2","","","","- C97 H78 B2 Cl7.5 Cu2 F8 N4 O2 P4 -","- C97 H78 B2 Cl7.5 Cu2 F8 N4 O2 P4 -","- C194 H156 B4 Cl15 Cu4 F16 N8 O4 P8 -","2","1","","Venkateswaran, Ramalingam; Balakrishna, Maravanji S.; Mobin, Shaikh M.; Tuononen, Heikki M.","Copper(I) complexes of bis(2-(diphenylphosphino)phenyl) ether: synthesis, reactivity, and theoretical calculations.","Inorganic chemistry","2007","46","16","6535","6541","10.1021/ic7005474","","","0.71073","MoKα","","0.1253","0.0736","","","0.1869","0.2066","","","","","","1.03","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339215","20.1286","0.0016","24.5174","0.0017","24.833","0.003","90","","90","","90","","12255","2","150","2","150","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C72 H56 B Cu F4 O2 P4 -","- C72 H56 B Cu F4 O2 P4 -","- C576 H448 B8 Cu8 F32 O16 P32 -","8","1","","Venkateswaran, Ramalingam; Balakrishna, Maravanji S.; Mobin, Shaikh M.; Tuononen, Heikki M.","Copper(I) complexes of bis(2-(diphenylphosphino)phenyl) ether: synthesis, reactivity, and theoretical calculations.","Inorganic chemistry","2007","46","16","6535","6541","10.1021/ic7005474","","","0.71073","MoKα","","0.0666","0.0489","","","0.141","0.1502","","","","","","1.089","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339216","12.898","0.002","13.6337","0.0006","19.15","0.002","104.166","0.006","94.444","0.012","94.259","0.007","3240.1","0.6","150","2","150","2","","","","","","","","9","P -1","-P 1","2","","","","- C73 H58 B Cl2 Cu F4 O2.5 P4 Se -","- C73 H58 B Cl2 Cu F4 O2.5 P4 Se -","- C146 H116 B2 Cl4 Cu2 F8 O5 P8 Se2 -","2","1","","Venkateswaran, Ramalingam; Balakrishna, Maravanji S.; Mobin, Shaikh M.; Tuononen, Heikki M.","Copper(I) complexes of bis(2-(diphenylphosphino)phenyl) ether: synthesis, reactivity, and theoretical calculations.","Inorganic chemistry","2007","46","16","6535","6541","10.1021/ic7005474","","","0.71073","MoKα","","0.0581","0.0388","","","0.0982","0.1197","","","","","","1.104","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339217","9.9404","0.0003","20.2853","0.0007","14.4831","0.0005","90","","96.217","0.002","90","","2903.25","0.17","120","2","120","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H39 Mo2 O2 P -","- C30 H39 Mo2 O2 P -","- C120 H156 Mo8 O8 P4 -","4","1","","Alvarez, M. Angeles; Amor, Inmaculada; García, M Esther; García-Vivó, Daniel; Ruiz, Miguel A.","Carbene- and carbyne-like behavior of the Mo-P multiple bond in a dimolybdenum complex inducing trigonal-pyramidal coordination of a phosphinidene ligand.","Inorganic chemistry","2007","46","16","6230","6232","10.1021/ic701055y","","","1.5418","CuKα","","0.0765","0.0724","","","0.1998","0.2048","","","","","","1.083","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339218","9.518","0.002","17.702","0.004","20.549","0.005","90","","96.351","0.004","90","","3441","1.4","100","0.1","100","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H45 Mo2 O6 P -","- C36 H45 Mo2 O6 P -","- C144 H180 Mo8 O24 P4 -","4","1","","Alvarez, M. Angeles; Amor, Inmaculada; García, M Esther; García-Vivó, Daniel; Ruiz, Miguel A.","Carbene- and carbyne-like behavior of the Mo-P multiple bond in a dimolybdenum complex inducing trigonal-pyramidal coordination of a phosphinidene ligand.","Inorganic chemistry","2007","46","16","6230","6232","10.1021/ic701055y","","x-ray","0.71073","MoKα","","0.0444","0.0305","","","0.063","0.0668","","","","","","1.057","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339219","12.401","0.0002","14.8569","0.0003","20.2993","0.0005","90","","116.633","0.002","90","","3343.13","0.13","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H39 Fe Mo2 O6 P -","- C34 H39 Fe Mo2 O6 P -","- C136 H156 Fe4 Mo8 O24 P4 -","4","1","","Alvarez, M. Angeles; Amor, Inmaculada; García, M Esther; García-Vivó, Daniel; Ruiz, Miguel A.","Carbene- and carbyne-like behavior of the Mo-P multiple bond in a dimolybdenum complex inducing trigonal-pyramidal coordination of a phosphinidene ligand.","Inorganic chemistry","2007","46","16","6230","6232","10.1021/ic701055y","","x-ray","1.5418","CuKα","","0.0343","0.0331","","","0.0864","0.0888","","","","","","1.062","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339220","9.759","0.0001","17.3399","0.0002","22.6713","0.0002","90","","97.326","0.001","90","","3805.12","0.07","100","2","100","2","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H41 Cl2 Co2 Mo2 O7 P -","- C36 H41 Cl2 Co2 Mo2 O7 P -","- C144 H164 Cl8 Co8 Mo8 O28 P4 -","4","1","","Alvarez, M. Angeles; Amor, Inmaculada; García, M Esther; García-Vivó, Daniel; Ruiz, Miguel A.","Carbene- and carbyne-like behavior of the Mo-P multiple bond in a dimolybdenum complex inducing trigonal-pyramidal coordination of a phosphinidene ligand.","Inorganic chemistry","2007","46","16","6230","6232","10.1021/ic701055y","","x-ray","1.54184","CuKα","","0.0595","0.0524","","","0.1257","0.1404","","","","","","1.089","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339221","8.77","0.005","9.733","0.005","12.857","0.005","81.219","0.005","81.435","0.005","74.993","0.005","1040.7","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H18 N4 O4 Pb -","- C24 H18 N4 O4 Pb -","- C48 H36 N8 O8 Pb2 -","2","1","","Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.","Organic-acid effect on the structures of a series of lead(II) complexes.","Inorganic chemistry","2007","46","16","6542","6555","10.1021/ic700613c","","","0.71073","MoKα","","0.0317","0.0254","","","0.0454","0.0469","","","","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339222","15.737","0.003","7.8514","0.0016","16.347","0.003","90","","99.06","0.03","90","","1994.6","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H16 N4 O4 Pb -","- C23 H10 N4 O4 Pb -","- C92 H40 N16 O16 Pb4 -","4","1","","Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.","Organic-acid effect on the structures of a series of lead(II) complexes.","Inorganic chemistry","2007","46","16","6542","6555","10.1021/ic700613c","","","0.71073","MoKα","","0.0633","0.0395","","","0.0727","0.0792","","","","","","1.039","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339223","15.106","0.005","7.885","0.005","15.741","0.005","90","0.005","93.945","0.005","90","0.005","1870.5","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H14 N4 O4 Pb -","- C22 H14 N4 O4 Pb -","- C88 H56 N16 O16 Pb4 -","4","1","","Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.","Organic-acid effect on the structures of a series of lead(II) complexes.","Inorganic chemistry","2007","46","16","6542","6555","10.1021/ic700613c","","","0.71073","MoKα","","0.0487","0.0398","","","0.0903","0.0946","","","","","","1.058","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339224","6.8124","0.0014","8.1738","0.0016","18.07","0.004","90.88","0.03","93.82","0.03","102.61","0.03","979.3","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H14 N4 O5 Pb -","- C22 H14 N4 O5 Pb -","- C44 H28 N8 O10 Pb2 -","2","1","","Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.","Organic-acid effect on the structures of a series of lead(II) complexes.","Inorganic chemistry","2007","46","16","6542","6555","10.1021/ic700613c","","","0.71073","MoKα","","0.048","0.0371","","","0.0768","0.08","","","","","","1.077","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339225","22.067","0.003","18.186","0.002","19.244","0.003","90","","90","","90","","7722.8","1.8","200","2","200","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C86 H52 N18 O13 Pb2 -","- C86 H52 N18 O13 Pb2 -","- C344 H208 N72 O52 Pb8 -","4","0.5","","Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.","Organic-acid effect on the structures of a series of lead(II) complexes.","Inorganic chemistry","2007","46","16","6542","6555","10.1021/ic700613c","","","0.71073","MoKα","","0.1222","0.0725","","","0.1585","0.1814","","","","","","1.177","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339226","9.677","0.003","11.884","0.004","11.988","0.004","100.375","0.005","112.273","0.004","95.158","0.005","1235.8","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H30 N8 O9 Pb2 -","- C52 H28 N8 O9 Pb2 -","- C52 H28 N8 O9 Pb2 -","1","0.5","","Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.","Organic-acid effect on the structures of a series of lead(II) complexes.","Inorganic chemistry","2007","46","16","6542","6555","10.1021/ic700613c","","","0.71073","MoKα","","0.0581","0.0519","","","0.1254","0.1296","","","","","","1.012","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339227","7.7814","0.0016","24.643","0.005","13.928","0.003","90","","103.83","0.03","90","","2593.4","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H18 N4 O4 Pb -","- C32 H18 N4 O4 Pb -","- C128 H72 N16 O16 Pb4 -","4","1","","Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.","Organic-acid effect on the structures of a series of lead(II) complexes.","Inorganic chemistry","2007","46","16","6542","6555","10.1021/ic700613c","","","0.71073","MoKα","","0.0727","0.0397","","","0.0733","0.0816","","","","","","1.063","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339228","6.1464","0.0012","9.902","0.002","19.151","0.004","104.74","0.03","90.03","0.03","104.59","0.03","1088.3","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H16 N4 O5 Pb -","- C26 H14 N4 O5 Pb -","- C52 H28 N8 O10 Pb2 -","2","1","","Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.","Organic-acid effect on the structures of a series of lead(II) complexes.","Inorganic chemistry","2007","46","16","6542","6555","10.1021/ic700613c","","","0.71073","MoKα","","0.0529","0.0374","","","0.0702","0.0761","","","","","","1.072","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339229","11.1446","0.0015","16.3388","0.0015","43.989","0.005","90","","90.16","0.01","90","","8009.9","1.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C69 H73 N7 O31 Pb6 -","- C69 H66 N7 O31 Pb6 -","- C276 H264 N28 O124 Pb24 -","4","0.5","","Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.","Organic-acid effect on the structures of a series of lead(II) complexes.","Inorganic chemistry","2007","46","16","6542","6555","10.1021/ic700613c","","","0.71073","MoKα","","0.1142","0.0827","","","0.1594","0.1708","","","","","","1.11","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339230","11.798","0.002","6.6642","0.0013","16.946","0.003","90","","92.23","0.03","90","","1331.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 N2 O11 Pb2 -","- C22 H22 N2 O11 Pb2 -","- C44 H44 N4 O22 Pb4 -","2","0.5","","Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.","Organic-acid effect on the structures of a series of lead(II) complexes.","Inorganic chemistry","2007","46","16","6542","6555","10.1021/ic700613c","","","0.71073","MoKα","","0.027","0.0218","","","0.0485","0.0503","","","","","","1.046","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339231","15.6058","0.0011","15.9189","0.0012","19.5961","0.0014","84.4704","0.0013","69.2801","0.0012","70.5606","0.0012","4292.5","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","methylamino-N,N-bis(2-methylene-4-adamantyl-6-tert-butyl- phenolato) zinc(II) dimer, (4)","","- C100 H134 N2 O4 Zn2 -","- C93 H126 N2 O4 Zn2 -","- C186 H252 N4 O8 Zn4 -","2","1","","Silvernail, Carter M.; Yao, Letitia J.; Hill, Lyndal M. R.; Hillmyer, Marc A.; Tolman, William B.","Structural and mechanistic studies of bis(phenolato)amine zinc(II) catalysts for the polymerization of epsilon-caprolactone.","Inorganic chemistry","2007","46","16","6565","6574","10.1021/ic700581s","","","0.71069","MoKα","","0.0838","0.0547","","","0.1154","0.1237","","","","","","1.031","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339232","16.0692","0.0009","11.7798","0.0007","16.8352","0.001","90","","109.044","0.002","90","","3012.4","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","05344","","","- C62 H94 N2 O4 Zn2 -","- C62 H94 N2 O4 Zn2 -","- C124 H188 N4 O8 Zn4 -","2","0.5","","Silvernail, Carter M.; Yao, Letitia J.; Hill, Lyndal M. R.; Hillmyer, Marc A.; Tolman, William B.","Structural and mechanistic studies of bis(phenolato)amine zinc(II) catalysts for the polymerization of epsilon-caprolactone.","Inorganic chemistry","2007","46","16","6565","6574","10.1021/ic700581s","","","0.71073","MoKα","","0.0562","0.0334","","","0.0793","0.0922","","","","","","1.08","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339233","17.6779","0.001","14.6764","0.0008","20.584","0.0011","90","","90","","90","","5340.5","0.5","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C26 H40 N P2 Tl -","- C26 H40 N P2 Tl -","- C208 H320 N8 P16 Tl8 -","8","1","","DeMott, Jessica C.; Basuli, Falguni; Kilgore, Uriah J.; Foxman, Bruce M.; Huffman, John C.; Ozerov, Oleg V.; Mindiola, Daniel J.","Silver(I) and thallium(I) complexes of a PNP ligand and their utility as PNP transfer reagents.","Inorganic chemistry","2007","46","16","6271","6276","10.1021/ic0700598","","","0.71073","MoKα","","0.0602","0.0283","","","0.0549","0.0622","","","","","","0.748","","","","has coordinates","288270","2023-12-12","22:18:42",""
"4339234","12.4563","0.0005","14.3609","0.0006","16.9195","0.0007","105.46","0.0019","91.328","0.002","95.677","0.002","2898.9","0.2","120","","120","","","","","","","","","6","P -1","-P 1","2","","","","- C56 H90 Ag2 N2 O P4 -","- C56 H90 Ag2 N2 O P4 -","- C112 H180 Ag4 N4 O2 P8 -","2","1","","DeMott, Jessica C.; Basuli, Falguni; Kilgore, Uriah J.; Foxman, Bruce M.; Huffman, John C.; Ozerov, Oleg V.; Mindiola, Daniel J.","Silver(I) and thallium(I) complexes of a PNP ligand and their utility as PNP transfer reagents.","Inorganic chemistry","2007","46","16","6271","6276","10.1021/ic0700598","","","0.71073","MoKα","","0.0594","0.0349","","0.0685","0.062","0.0685","","","","","","0.7578","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339235","10.453","0.008","12.316","0.009","13.441","0.01","78.49","0.011","82.169","0.013","85.569","0.013","1678","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H15 N O10.5 U -","- C12 H6 N O10.35 U -","- C48 H24 N4 O41.4 U4 -","4","2","","Go, Yong Bok; Wang, Xiqu; Jacobson, Allan J.","(6,3)-honeycomb structures of uranium(VI) benzenedicarboxylate derivatives: the use of noncovalent interactions to prevent interpenetration.","Inorganic chemistry","2007","46","16","6594","6600","10.1021/ic700693f","","","0.71073","MoKα","","0.0423","0.0275","","","0.061","0.0657","","","","","","1.041","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339236","12.7795","0.0009","19.7282","0.0013","15.3788","0.001","90","","92.247","0.001","90","","3874.3","0.5","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H13 K O10 U -","- C18 H13 K O10 U -","- C144 H104 K8 O80 U8 -","8","1","","Go, Yong Bok; Wang, Xiqu; Jacobson, Allan J.","(6,3)-honeycomb structures of uranium(VI) benzenedicarboxylate derivatives: the use of noncovalent interactions to prevent interpenetration.","Inorganic chemistry","2007","46","16","6594","6600","10.1021/ic700693f","","","0.71073","MoKα","","0.0277","0.0242","","","0.0633","0.0644","","","","","","1.054","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339237","12.7214","0.0008","19.6454","0.0012","17.0646","0.0014","90","","98.896","0.001","90","","4213.4","0.5","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H17 N3 O9 U -","- C19 H9 N3 O9 U -","- C152 H72 N24 O72 U8 -","8","1","","Go, Yong Bok; Wang, Xiqu; Jacobson, Allan J.","(6,3)-honeycomb structures of uranium(VI) benzenedicarboxylate derivatives: the use of noncovalent interactions to prevent interpenetration.","Inorganic chemistry","2007","46","16","6594","6600","10.1021/ic700693f","","","0.71073","MoKα","","0.0347","0.0236","","","0.0568","0.0594","","","","","","0.991","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339238","7.873","0.005","18.358","0.014","6.893","0.005","90","","115.96","0.02","90","","895.7","1.1","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H8 Br2 O10 U -","- C16 H6 Br2 O10 U -","- C32 H12 Br4 O20 U2 -","2","0.5","","Go, Yong Bok; Wang, Xiqu; Jacobson, Allan J.","(6,3)-honeycomb structures of uranium(VI) benzenedicarboxylate derivatives: the use of noncovalent interactions to prevent interpenetration.","Inorganic chemistry","2007","46","16","6594","6600","10.1021/ic700693f","","","0.71073","MoKα","","0.0957","0.0482","","","0.0881","0.099","","","","","","0.954","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339239","14.8484","0.0009","24.6631","0.0015","21.0364","0.0014","90","","90.182","0.002","90","","7703.7","0.8","150","2","150","2","","","","","","","C. Milios CM2668","5","P 1 21/n 1","-P 2yn","14","","","","- C69.5 H88.5 Mn7 N7 O26.25 -","- C69.5 H84.75 Mn7 N7 O26.25 -","- C278 H339 Mn28 N28 O105 -","4","1","","Milios, Constantinos J.; Gass, Ian A.; Vinslava, Alina; Budd, Laura; Parsons, Simon; Wernsdorfer, Wolfgang; Perlepes, Spyros P.; Christou, George; Brechin, Euan K.","Two frustrated, bitetrahedral single-molecule magnets.","Inorganic chemistry","2007","46","16","6215","6217","10.1021/ic7006638","","","0.71073","MoKα","","0.0912","0.0564","","","0.133","0.1464","","","","","","1.018","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4339240","13.3525","0.0003","14.5192","0.0004","23.566","0.0006","90","","104.008","0.002","90","","4432.8","0.2","150","","150","","","","","","","","C. Milios","5","P 1 21/n 1","-P 2yn","14","","","","- C82 H104 Mn7 N16 O26 -","- C66 H72 Mn7 N6 O26 -","- C132 H144 Mn14 N12 O52 -","2","0.5","","Milios, Constantinos J.; Gass, Ian A.; Vinslava, Alina; Budd, Laura; Parsons, Simon; Wernsdorfer, Wolfgang; Perlepes, Spyros P.; Christou, George; Brechin, Euan K.","Two frustrated, bitetrahedral single-molecule magnets.","Inorganic chemistry","2007","46","16","6215","6217","10.1021/ic7006638","","","0.71073","MoKα","","0.1062","0.0508","","0.1389","0.128","0.1389","","","","","","0.7276","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339241","16.0957","0.0002","14.28689","0.00013","18.4787","0.00016","90","","94.5153","0.0012","90","","4236.13","0.08","100","2","100","0.5","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H57 N6 O22 Tb -","- C32 H39 N6 O20.388 Tb -","- C128 H156 N24 O81.552 Tb4 -","4","1","","Marchal, Claire; Filinchuk, Yaroslav; Imbert, Daniel; Bünzli, Jean-Claude G; Mazzanti, Marinella","Toward the rational design of lanthanide coordination polymers: a new topological approach.","Inorganic chemistry","2007","46","16","6242","6244","10.1021/ic7009918","","","0.71076","synchrotron","","0.0454","0.0382","","","0.0902","0.0951","","","","","","1.017","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339242","6.66","0.005","6.66","0.005","5.818","0.005","90","0.005","90","0.005","90","0.005","258.1","0.4","293","2","293","2","","","","","","","","2","I 4/m c m","-I 4 2c","140","","Titaniumdistannide","","- Sb2 Ti -","- Sb0.5 Ti0.25 -","- Sb8 Ti4 -","16","0.5","","Armbrüster, Marc; Schnelle, Walter; Schwarz, Ulrich; Grin, Yuri","Chemical bonding in TiSb(2) and VSb(2): a quantum chemical and experimental study.","Inorganic chemistry","2007","46","16","6319","6328","10.1021/ic070284p","","","0.71073","MoKα","","0.0273","0.026","","","0.0596","0.0603","","","","","","1.208","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339243","6.562","0.005","6.562","0.005","5.643","0.005","90","0.005","90","0.005","90","0.005","243","0.3","293","2","293","2","","","","","","","","2","I 4/m c m","-I 4 2c","140","","Vanadiumdistannide","","- Sb2 V0.96 -","- Sb0.5 V0.24 -","- Sb8 V3.84 -","16","0.5","","Armbrüster, Marc; Schnelle, Walter; Schwarz, Ulrich; Grin, Yuri","Chemical bonding in TiSb(2) and VSb(2): a quantum chemical and experimental study.","Inorganic chemistry","2007","46","16","6319","6328","10.1021/ic070284p","","","0.71073","MoKα","","0.0325","0.0315","","","0.0744","0.0751","","","","","","1.037","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339244","17.6017","0.0014","17.6017","0.0014","21.056","0.002","90","","90","","120","","5649.6","0.8","295","2","295","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C38 H54 Cl4 Fe2 N48 O20 -","- C37.98 H53.94 Cl4 Fe2 N48 O19.99 -","- C113.94 H161.82 Cl12 Fe6 N144 O59.97 -","3","0.333333","","Bronisz, Robert","Tetrazol-2-yl as a donor group for incorporation of a spin-crossover function based on Fe(II) ions into a coordination network.","Inorganic chemistry","2007","46","16","6733","6739","10.1021/ic070223r","","","0.71073","MoKα","","0.0848","0.068","","","0.1892","0.2062","","","","","","1.041","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339245","17.2576","0.0008","17.2576","0.0008","20.8493","0.0013","90","","90","","120","","5377.5","0.5","90","2","90","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C38 H54 Cl4 Fe2 N48 O20 -","- C37.98 H53.94 Cl4 Fe2 N48 O19.99 -","- C113.94 H161.82 Cl12 Fe6 N144 O59.97 -","3","0.333333","","Bronisz, Robert","Tetrazol-2-yl as a donor group for incorporation of a spin-crossover function based on Fe(II) ions into a coordination network.","Inorganic chemistry","2007","46","16","6733","6739","10.1021/ic070223r","","","0.71073","MoKα","","0.0544","0.052","","","0.1413","0.1437","","","","","","1.053","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339246","17.6018","0.0008","17.6018","0.0008","21.0633","0.0014","90","","90","","120","","5651.6","0.5","295","2","230","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C38 H54 Cl4 Fe2 N48 O20 -","- C37.98 H53.94 Cl4 Fe2 N48 O19.99 -","- C113.94 H161.82 Cl12 Fe6 N144 O59.97 -","3","0.333333","","Bronisz, Robert","Tetrazol-2-yl as a donor group for incorporation of a spin-crossover function based on Fe(II) ions into a coordination network.","Inorganic chemistry","2007","46","16","6733","6739","10.1021/ic070223r","","","0.71073","MoKα","","0.0772","0.0672","","","0.1932","0.204","","","","","","1.074","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339247","11.869","0.003","11.869","0.003","19.284","0.004","90","","90","","120","","2352.6","1","250","2","293","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C15 H24 Cl2 Fe N24 O8 -","- C15 H24 Cl2 Fe N24 O8 -","- C45 H72 Cl6 Fe3 N72 O24 -","3","0.333333","","Bronisz, Robert","Tetrazol-2-yl as a donor group for incorporation of a spin-crossover function based on Fe(II) ions into a coordination network.","Inorganic chemistry","2007","46","16","6733","6739","10.1021/ic070223r","","","0.71073","MoKα","","0.0793","0.0678","","","0.1713","0.1887","","","","","","1.15","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339248","11.7898","0.0009","11.7898","0.0009","19.0756","0.0013","90","","90","","120","","2296.3","0.3","90","2","90","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C15 H24 Cl2 Fe N24 O8 -","- C15 H24 Cl2 Fe N24 O8 -","- C45 H72 Cl6 Fe3 N72 O24 -","3","0.333333","","Bronisz, Robert","Tetrazol-2-yl as a donor group for incorporation of a spin-crossover function based on Fe(II) ions into a coordination network.","Inorganic chemistry","2007","46","16","6733","6739","10.1021/ic070223r","","","0.71073","MoKα","","0.0503","0.044","","","0.1082","0.1108","","","","","","1.021","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339249","7.923","0.0008","13.3793","0.0013","17.4141","0.0018","90","","96.006","0.002","90","","1835.8","0.3","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H22 N O10 U2 -","- C11 H22 N O10 U2 -","- C44 H88 N4 O40 U8 -","4","1","","Knope, Karah E.; Cahill, Christopher L.","Hydrothermal synthesis of a novel uranium oxalate/glycolate via in-situ ligand formation.","Inorganic chemistry","2007","46","16","6607","6612","10.1021/ic700700e","","","0.71073","MoKα","","0.0291","0.0227","","","0.0475","0.0498","","","","","","1.054","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339250","9.525","0.002","16.531","0.005","13.245","0.003","90","","90","","90","","2085.5","0.9","193","2","193","2","","","","","","","","6","C m c m","-C 2c 2","63","","","","- C18 H60 In4 N12 Ni2 S8 -","- C18 In4 N12 Ni2 S8 -","- C36 In8 N24 Ni4 S16 -","2","0.125","","Zhou, Jian; Bian, Guo-Qing; Zhang, Yong; Zhu, Qin-Yu; Li, Chun-Yin; Dai, Jie","One-dimensional indium sulfides with transition metal complexes of polyamines.","Inorganic chemistry","2007","46","16","6347","6352","10.1021/ic070334q","","","0.71073","MoKα","","0.0463","0.0403","","","0.1098","0.1142","","","","","","1.184","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339251","8.9684","0.001","17.0237","0.0018","13.1317","0.0015","90","","101.815","0.002","90","","1962.4","0.4","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H26 In2 N6 Ni S4 -","- C8 H26 In2 N6 Ni S4 -","- C32 H104 In8 N24 Ni4 S16 -","4","0.5","","Zhou, Jian; Bian, Guo-Qing; Zhang, Yong; Zhu, Qin-Yu; Li, Chun-Yin; Dai, Jie","One-dimensional indium sulfides with transition metal complexes of polyamines.","Inorganic chemistry","2007","46","16","6347","6352","10.1021/ic070334q","","","0.71073","MoKα","","0.0282","0.0262","","","0.0723","0.0739","","","","","","1.057","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339252","9.9738","0.0011","20.749","0.002","19.403","0.002","90","","103.651","0.003","90","","3902","0.7","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H50 In4 N10 Ni2 O S9 -","- C16 H46 In4 N10 Ni2 O S9 -","- C64 H184 In16 N40 Ni8 O4 S36 -","4","1","","Zhou, Jian; Bian, Guo-Qing; Zhang, Yong; Zhu, Qin-Yu; Li, Chun-Yin; Dai, Jie","One-dimensional indium sulfides with transition metal complexes of polyamines.","Inorganic chemistry","2007","46","16","6347","6352","10.1021/ic070334q","","","0.71073","MoKα","","0.0981","0.0703","","","0.1262","0.1364","","","","","","1.181","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339253","27.6016","0.0003","10.8804","0.0002","20.1887","0.0003","90","","126.536","0.001","90","","4871.52","0.14","153","2","153","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C47 H54 B2 F10 N8 O3 Zn2 -","- C47 H54 B2 F10 N8 O3 Zn2 -","- C188 H216 B8 F40 N32 O12 Zn8 -","4","0.5","","Tomat, Elisa; Cuesta, Luciano; Lynch, Vincent M.; Sessler, Jonathan L.","Binuclear fluoro-bridged zinc and cadmium complexes of a schiff base expanded porphyrin: fluoride abstraction from the tetrafluoroborate anion.","Inorganic chemistry","2007","46","16","6224","6226","10.1021/ic700933p","","","0.71073","MoKα","","0.0989","0.0705","","","0.1481","0.1574","","","","","","1.184","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339254","13.811","0.001","15.527","0.001","16.203","0.001","101.226","0.002","106.446","0.002","92.269","0.002","3252.1","0.4","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C54 H74 B2 Cd2 F10 N8 O11 -","- C54 H74 B2 Cd2 F10 N8 O11 -","- C108 H148 B4 Cd4 F20 N16 O22 -","2","1","","Tomat, Elisa; Cuesta, Luciano; Lynch, Vincent M.; Sessler, Jonathan L.","Binuclear fluoro-bridged zinc and cadmium complexes of a schiff base expanded porphyrin: fluoride abstraction from the tetrafluoroborate anion.","Inorganic chemistry","2007","46","16","6224","6226","10.1021/ic700933p","","","0.71073","MoKα","","0.1207","0.0682","","","0.1502","0.1754","","","","","","1.1","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339255","42.9658","0.0007","42.9658","0.0007","29.3862","0.0009","90","","90","","90","","54249","2","98","2","98","2","","","","","","","","6","I 41/a c d :2","-I 4bd 2c","142","","","","- C48 H88 N8 Ni2 O34.625 P2 -","- C48 H32 N8 Ni2 O34.625 P2 -","- C1536 H1024 N256 Ni64 O1108 P64 -","32","1","","Ikotun, Oluwatayo F.; Armatus, N. Gabriel; Julve, Miguel; Kruger, Paul E.; Lloret, Francesc; Nieuwenhuyzen, Mark; Doyle, Robert P.","Synthesis and structural and magnetic characterization of {[(phen)(2)Ni](2)(micro-P(2)O(7))} . 27H(2)O and {[(phen)(2)Mn](2)(micro-P(2)O(7))} . 13H(2)O: rare examples of coordination complexes with the pyrophosphate ligand.","Inorganic chemistry","2007","46","16","6668","6674","10.1021/ic700439a","","","0.71073","MoKα","","0.1661","0.1063","","","0.2784","0.3496","","","","","","1.031","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339256","13.693","0.003","14.093","0.003","14.602","0.003","89.962","0.005","77.079","0.005","82.916","0.005","2724.5","1","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H58 Mn2 N8 O20 P2 -","- C48 H32 Mn2 N8 O20 P2 -","- C96 H64 Mn4 N16 O40 P4 -","2","1","","Ikotun, Oluwatayo F.; Armatus, N. Gabriel; Julve, Miguel; Kruger, Paul E.; Lloret, Francesc; Nieuwenhuyzen, Mark; Doyle, Robert P.","Synthesis and structural and magnetic characterization of {[(phen)(2)Ni](2)(micro-P(2)O(7))} . 27H(2)O and {[(phen)(2)Mn](2)(micro-P(2)O(7))} . 13H(2)O: rare examples of coordination complexes with the pyrophosphate ligand.","Inorganic chemistry","2007","46","16","6668","6674","10.1021/ic700439a","","x-ray","0.71073","MoKα","","0.1176","0.0747","","","0.1662","0.1875","","","","","","1.078","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339257","16.3836","0.0007","20.4095","0.0009","11.5435","0.0005","90","","104.724","0.004","90","","3733.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C86 H106 N2 P2 Pt -","- C86 H106 N2 P2 Pt -","- C172 H212 N4 P4 Pt2 -","2","0.5","","Rogers, Joy E.; Slagle, Jonathan E.; Krein, Douglas M.; Burke, Aaron R.; Hall, Benjamin C.; Fratini, Albert; McLean, Daniel G.; Fleitz, Paul A.; Cooper, Thomas M.; Drobizhev, Mikhail; Makarov, Nikolay S.; Rebane, Aleksander; Kim, Kye-Young; Farley, Richard; Schanze, Kirk S.","Platinum acetylide two-photon chromophores.","Inorganic chemistry","2007","46","16","6483","6494","10.1021/ic700549n","","","0.71073","MoKα","","0.1015","0.0993","","","0.1947","0.1956","","","","","","1.341","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339258","12.3121","0.0004","12.497","0.0004","22.8833","0.0007","90","","97.214","0.002","90","","3493.05","0.19","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C76 H94 N2 P2 Pt S2 -","- C76 H94 N2 P2 Pt S2 -","- C152 H188 N4 P4 Pt2 S4 -","2","0.5","","Rogers, Joy E.; Slagle, Jonathan E.; Krein, Douglas M.; Burke, Aaron R.; Hall, Benjamin C.; Fratini, Albert; McLean, Daniel G.; Fleitz, Paul A.; Cooper, Thomas M.; Drobizhev, Mikhail; Makarov, Nikolay S.; Rebane, Aleksander; Kim, Kye-Young; Farley, Richard; Schanze, Kirk S.","Platinum acetylide two-photon chromophores.","Inorganic chemistry","2007","46","16","6483","6494","10.1021/ic700549n","","","0.71073","MoKα","","0.039","0.0383","","","0.0717","0.072","","","","","","1.211","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339259","5.687","0.0002","25.3004","0.0008","13.5877","0.0004","90","","91.742","0.002","90","","1954.14","0.11","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","PhClBTEt","","","- C21 H15 Cl N5 S2 -","- C21 H15 Cl N5 S2 -","- C84 H60 Cl4 N20 S8 -","4","1","","Leitch, Alicea A.; Oakley, Richard T.; Reed, Robert W.; Thompson, Laurence K.","Electronic and magnetic interactions in pi-stacked bisthiadiazinyl radicals.","Inorganic chemistry","2007","46","16","6261","6270","10.1021/ic0700405","","","1.54178","CuKα","","0.0425","0.035","","","0.0914","0.0961","","","","","","1.065","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339260","3.6154","0.0003","21.2165","0.0014","20.2666","0.0013","90","","90.028","0.003","90","","1554.57","0.19","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 Cu N2 O10 V4 -","- C10 H8 Cu N2 O10 V4 -","- C40 H32 Cu4 N8 O40 V16 -","4","1","","Yan, Bangbo; Maggard, Paul A.","M(bipyridine)V(4)O(10) (M = Cu, Ag): hybrid analogues of low-dimensional reduced vanadates.","Inorganic chemistry","2007","46","16","6640","6646","10.1021/ic700729q","","","0.71073","MoKα","","0.0769","0.0484","","","0.1279","0.1387","","","","","","1.058","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339261","14.7305","0.0002","20.9723","0.0004","15.4816","0.0003","90","","114.939","0.001","90","0.001","4336.81","0.14","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C102 H94 N10 O14 Zn -","- C102 H94 N10 O14 Zn -","- C204 H188 N20 O28 Zn2 -","2","0.5","","Halime, Zakaria; Lachkar, Mohammed; Roisnel, Thierry; Richard, Philippe; Boitrel, Bernard","Structural and coordination studies of ""pearl oysterlike"" porphyrins.","Inorganic chemistry","2007","46","16","6338","6346","10.1021/ic0703272","","","0.71073","MoKα","","0.116","0.0612","","","0.1378","0.1598","","","","","","1.023","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339262","12.6081","0.0012","14.1098","0.0014","24.181","0.002","77.743","0.005","75.776","0.004","70.863","0.005","3898.4","0.6","102","2","102","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C92 H76 Cl4 N8 Ni O12 -","- C92 H76 Cl4 N8 Ni O12 -","- C184 H152 Cl8 N16 Ni2 O24 -","2","1","","Halime, Zakaria; Lachkar, Mohammed; Roisnel, Thierry; Richard, Philippe; Boitrel, Bernard","Structural and coordination studies of ""pearl oysterlike"" porphyrins.","Inorganic chemistry","2007","46","16","6338","6346","10.1021/ic0703272","","x-ray","0.71073","MoKα","","0.0842","0.0513","","","0.1246","0.1409","","","","","","1.04","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339263","13.1804","0.0011","17.0677","0.0014","20.0012","0.0015","64.844","0.004","73.031","0.004","69.642","0.004","3763","0.5","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C90 H64 N8 O12 Pb -","- C90 H64 N8 O12 Pb -","- C180 H128 N16 O24 Pb2 -","2","1","","Halime, Zakaria; Lachkar, Mohammed; Roisnel, Thierry; Richard, Philippe; Boitrel, Bernard","Structural and coordination studies of ""pearl oysterlike"" porphyrins.","Inorganic chemistry","2007","46","16","6338","6346","10.1021/ic0703272","","x-ray","0.71073","MoKα","","0.121","0.0651","","","0.1233","0.1394","","","","","","0.962","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339264","10.3208","0.0019","23.474","0.005","14.752","0.003","90","","97.608","0.015","90","","3542.5","1.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","5,20-diphenyl-10,15-di-p-tolil-2-pirolil-21-carbaporphyrinato copper(II)","","- C50 H34 Cu N4 O -","- C50 H34 Cu N4 O -","- C200 H136 Cu4 N16 O4 -","4","1","","Pawlicki, Miłosz; Kańska, Izabela; Latos-Grazyński, Lechosław","Copper(II) and copper(III) complexes of pyrrole-appended oxacarbaporphyrin.","Inorganic chemistry","2007","46","16","6575","6584","10.1021/ic700631t","","","1.54184","CuKα","","0.1052","0.0474","","","0.1101","0.1223","","","","","","0.781","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339265","10.6942","0.0011","11.0809","0.0011","36.563","0.004","83.401","0.006","88.734","0.007","80.383","0.007","4243.6","0.8","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C78 H81 Cu6 Mo2 N13 S10 -","- C78 H81 Cu6 Mo2 N13.002 S10.002 -","- C156 H162 Cu12 Mo4 N26.004 S20.004 -","2","1","","Zhang, Wen-Hua; Song, Ying-Lin; Ren, Zhi-Gang; Li, Hong-Xi; Li, Ling-Ling; Zhang, Yong; Lang, Jian-Ping","Construction of [(eta5-C5Me5)MoS3Cu3]-based supramolecular assemblies from the [(eta5-C5Me5)MoS3(CuNCS)3]- cluster anion and multitopic ligands with different symmetries.","Inorganic chemistry","2007","46","16","6647","6660","10.1021/ic700762x","","","0.7107","MoKα","","0.1272","0.0898","","","0.1866","0.2087","","","","","","1.136","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339266","12.1028","0.0012","19.068","0.002","12.8736","0.0013","90","","117.028","0.002","90","","2646.4","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H23 N11 O Ru -","- C26 H23 N11 O Ru -","- C104 H92 N44 O4 Ru4 -","4","1","","Cui, Ying; Mo, Hao-Jun; Chen, Jin-Can; Niu, Yan-Li; Zhong, Yong-Rui; Zheng, Kang-Cheng; Ye, Bao-Hui","Anion-selective interaction and colorimeter by an optical metalloreceptor based on ruthenium(II) 2,2'-biimidazole: hydrogen bonding and proton transfer.","Inorganic chemistry","2007","46","16","6427","6436","10.1021/ic7004562","","","0.71073","MoKα","","0.0631","0.0381","","","0.0654","0.0694","","","","","","0.969","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339267","6.463","0.0007","6.4654","0.0004","10.0262","0.0005","73.949","0.01","86.288","0.017","84.856","0.016","400.65","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- Mo2 Ni3 O11 Se -","- Mo2 Ni3 O11 Se -","- Mo4 Ni6 O22 Se2 -","2","1","","Jiang, Hai-Long; Xie, Zhi; Mao, Jiang-Gao","Ni(3)(Mo(2)O(8))(XO(3)) (X = Se, Te): the first nickel selenite- and tellurite-containing Mo4 clusters.","Inorganic chemistry","2007","46","16","6495","6501","10.1021/ic700500q","","","0.71073","MoKα","","0.0412","0.0357","","","0.0847","0.0878","","","","","","0.984","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339268","9.562","0.003","8.756","0.003","10.082","0.003","90","","103.228","0.007","90","","821.7","0.5","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Mo2 Ni3 O11 Te -","- Mo2 Ni3 O11 Te -","- Mo8 Ni12 O44 Te4 -","4","0.5","","Jiang, Hai-Long; Xie, Zhi; Mao, Jiang-Gao","Ni(3)(Mo(2)O(8))(XO(3)) (X = Se, Te): the first nickel selenite- and tellurite-containing Mo4 clusters.","Inorganic chemistry","2007","46","16","6495","6501","10.1021/ic700500q","","","0.71073","MoKα","","0.0186","0.0175","","","0.0413","0.0418","","","","","","1.106","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339269","22.046","0.002","16.9959","0.0016","23.643","0.002","90","","114.73","0.003","90","","8046.4","1.3","110","2","110","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C72 H58 B8 Cl4 Cu O15 P3 Ru6 -","- C72 H58 B8 Cl4 Cu O15 P3 Ru6 -","- C288 H232 B32 Cl16 Cu4 O60 P12 Ru24 -","4","1","","Du, Shaowu; Hodson, Bruce E.; Lei, Peng; McGrath, Thomas D.; Stone, F Gordon A","Penta- and hexaruthenium carbonyl 'raft' complexes supported by monocarborane cage ligands.","Inorganic chemistry","2007","46","16","6613","6620","10.1021/ic700746j","","","0.71073","MoKα","","0.104","0.0529","","","0.1227","0.15","","","","","","1.024","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339270","11.1475","0.0009","16.9338","0.0017","17.2434","0.0016","79.248","0.002","89.604","0.003","83.781","0.002","3178.8","0.5","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C58 H46 B8 N O12 P2 Ru5 -","- C58 H46 B8 N O12 P2 Ru5 -","- C116 H92 B16 N2 O24 P4 Ru10 -","2","1","","Du, Shaowu; Hodson, Bruce E.; Lei, Peng; McGrath, Thomas D.; Stone, F Gordon A","Penta- and hexaruthenium carbonyl 'raft' complexes supported by monocarborane cage ligands.","Inorganic chemistry","2007","46","16","6613","6620","10.1021/ic700746j","","","0.71073","MoKα","","0.0441","0.0279","","","0.0643","0.0689","","","","","","1.065","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339271","12.0923","0.0009","15.7652","0.0013","17.6006","0.0014","75.902","0.004","71.283","0.004","73.289","0.004","3001","0.4","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C55 H43 B8 Cu O12 P2 Ru5 -","- C55 H43 B8 Cu O12 P2 Ru5 -","- C110 H86 B16 Cu2 O24 P4 Ru10 -","2","1","","Du, Shaowu; Hodson, Bruce E.; Lei, Peng; McGrath, Thomas D.; Stone, F Gordon A","Penta- and hexaruthenium carbonyl 'raft' complexes supported by monocarborane cage ligands.","Inorganic chemistry","2007","46","16","6613","6620","10.1021/ic700746j","","","0.71073","MoKα","","0.0586","0.0391","","","0.0735","0.0811","","","","","","1.049","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339272","12.813","0.003","19.538","0.005","20.054","0.005","83.093","0.007","73.112","0.006","89.711","0.007","4767","2","110","2","110","2","","","","","","","","8","P -1","-P 1","2","","","","- C92 H79 Au B8 Cl6 O10 P4 Ru5 -","- C92 H79 Au B8 Cl6 O10 P4 Ru5 -","- C184 H158 Au2 B16 Cl12 O20 P8 Ru10 -","2","1","","Du, Shaowu; Hodson, Bruce E.; Lei, Peng; McGrath, Thomas D.; Stone, F Gordon A","Penta- and hexaruthenium carbonyl 'raft' complexes supported by monocarborane cage ligands.","Inorganic chemistry","2007","46","16","6613","6620","10.1021/ic700746j","","","0.71073","MoKα","","0.0487","0.032","","","0.0605","0.0675","","","","","","1.013","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339273","6.4993","0.0004","6.5962","0.0004","15.2702","0.0008","101.79","0.002","92.935","0.003","102.198","0.002","623.31","0.06","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H6 Cl N4 O3 Re -","- C11 H6 Cl N4 O3 Re -","- C22 H12 Cl2 N8 O6 Re2 -","2","1","","Kirgan, Robert; Simpson, Megan; Moore, Curtis; Day, Jeff; Bui, Loan; Tanner, Clayton; Rillema, D. Paul","Synthesis, characterization, photophysical, and computational studies of rhenium(I) tricarbonyl complexes containing the derivatives of bipyrazine.","Inorganic chemistry","2007","46","16","6464","6472","10.1021/ic700512j","","","0.71073","MoKα","","0.0106","0.01","","","0.0247","0.0251","","","","","","1.089","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339274","24.4282","0.0007","14.1116","0.0007","13.9187","0.0007","90","","90","","90","","4798.1","0.4","","","293","","","","","","","","","2","P c 21 n","P -2n -2ac","33","","","","- Lu12.713 Zn58.534 -","- Lu12.713 Zn58.536 -","- Lu50.852 Zn234.144 -","4","1","","Piao, Shuying; Lidin, Sven","Occupation waves the way you have never seen them: the orthorhombic quasicrystal approximants RE(13)Zn(58+)(delta) (RE = Ho, Er, Tm, and Lu).","Inorganic chemistry","2007","46","16","6452","6463","10.1021/ic700476w","","","0.71069","MoKα","","0.0733","0.0501","","","0.0503","0.0532","","","","2.27","2.27","1.87","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339275","24.6254","0.0006","14.0075","0.001","14.2447","0.0006","90","","90","","90","","4913.6","0.4","","","293","","","","","","","","","2","P c m n","-P 2n 2ac","62","","","","- Ho13 Zn58.711 -","- Ho13 Zn58.709 -","- Ho52 Zn234.836 -","4","0.5","","Piao, Shuying; Lidin, Sven","Occupation waves the way you have never seen them: the orthorhombic quasicrystal approximants RE(13)Zn(58+)(delta) (RE = Ho, Er, Tm, and Lu).","Inorganic chemistry","2007","46","16","6452","6463","10.1021/ic700476w","","","0.71069","MoKα","","0.0727","0.0499","","","0.0493","0.0552","","","","2.11","2.11","2.02","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339276","24.5152","0.0006","14.165","0.0007","13.948","0.0007","90","","90","","90","","4843.6","0.4","","","293","","","","","","","","","2","P c 21 n","P -2n -2ac","33","","","","- Tm12.88 Zn58.64 -","- Tm12.88 Zn58.632 -","- Tm51.52 Zn234.528 -","4","1","","Piao, Shuying; Lidin, Sven","Occupation waves the way you have never seen them: the orthorhombic quasicrystal approximants RE(13)Zn(58+)(delta) (RE = Ho, Er, Tm, and Lu).","Inorganic chemistry","2007","46","16","6452","6463","10.1021/ic700476w","","","0.71069","MoKα","","0.085","0.055","","","0.0534","0.0571","","","","2.06","2.06","1.63","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339277","24.6949","0.0001","14.2471","0.0007","14.0449","0.0006","90","","90","","90","","4941.4","0.3","","","293","","","","","","","","","2","P c 21 n","P -2n -2ac","33","","","","- Er12.887 Zn58.817 -","- Er12.887 Zn58.819 -","- Er51.548 Zn235.276 -","4","1","","Piao, Shuying; Lidin, Sven","Occupation waves the way you have never seen them: the orthorhombic quasicrystal approximants RE(13)Zn(58+)(delta) (RE = Ho, Er, Tm, and Lu).","Inorganic chemistry","2007","46","16","6452","6463","10.1021/ic700476w","","","0.71069","MoKα","","0.0806","0.0496","","","0.0518","0.0532","","","","2.59","2.59","2.01","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339278","15.74","0.0006","4.8958","0.0002","5.9311","0.0002","90","","90","","90","","457.05","0.03","273","2","273","2","","","","","","","","6","P n n m","-P 2 2n","58","","","","- C H4 Mn N O3 S -","- C H4 Mn N O3 S -","- C4 H16 Mn4 N4 O12 S4 -","4","0.5","","Austria, Cristina; Zhang, Jian; Valle, Henry; Zhang, Qichun; Chew, Emily; Nguyen, Dan-Tam; Gu, J. Y.; Feng, Pingyun; Bu, Xianhui","Amine-controlled assembly of metal-sulfite architecture from 1D chains to 3D framework.","Inorganic chemistry","2007","46","16","6283","6290","10.1021/ic070325h","","","0.71073","MoKα","","0.0201","0.0178","","","0.0507","0.0515","","","","","","1.193","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339279","14.1016","0.001","12.4216","0.0008","8.5128","0.0006","90","","105.538","0.003","90","","1436.64","0.17","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 N2 O7 S2 Zn2 -","- C10 H10 N2 O7 S2 Zn2 -","- C40 H40 N8 O28 S8 Zn8 -","4","1","","Austria, Cristina; Zhang, Jian; Valle, Henry; Zhang, Qichun; Chew, Emily; Nguyen, Dan-Tam; Gu, J. Y.; Feng, Pingyun; Bu, Xianhui","Amine-controlled assembly of metal-sulfite architecture from 1D chains to 3D framework.","Inorganic chemistry","2007","46","16","6283","6290","10.1021/ic070325h","","","0.71073","MoKα","","0.0418","0.0261","","","0.0713","0.0859","","","","","","1.125","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339280","4.9404","0.0003","8.782","0.0005","17.1114","0.0009","90","","96.395","0.004","90","","737.79","0.07","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 H5 N O3 S Zn -","- C5 H5 N O3 S Zn -","- C20 H20 N4 O12 S4 Zn4 -","4","1","","Austria, Cristina; Zhang, Jian; Valle, Henry; Zhang, Qichun; Chew, Emily; Nguyen, Dan-Tam; Gu, J. Y.; Feng, Pingyun; Bu, Xianhui","Amine-controlled assembly of metal-sulfite architecture from 1D chains to 3D framework.","Inorganic chemistry","2007","46","16","6283","6290","10.1021/ic070325h","","","0.71073","MoKα","","0.0627","0.0331","","","0.076","0.0935","","","","","","1.095","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339281","10.5652","0.0001","9.6494","0.0001","17.034","0.0002","90","","102.682","0.001","90","","1694.21","0.03","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H13 N2 O6 S2 Zn2 -","- C13 H13 N2 O6 S2 Zn2 -","- C52 H52 N8 O24 S8 Zn8 -","4","1","","Austria, Cristina; Zhang, Jian; Valle, Henry; Zhang, Qichun; Chew, Emily; Nguyen, Dan-Tam; Gu, J. Y.; Feng, Pingyun; Bu, Xianhui","Amine-controlled assembly of metal-sulfite architecture from 1D chains to 3D framework.","Inorganic chemistry","2007","46","16","6283","6290","10.1021/ic070325h","","","0.71073","MoKα","","","0.0302","","","0.0747","0.0784","","","","","","0.954","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339282","41.7541","0.0003","41.7541","0.0003","9.4252","0.0001","90","","90","","120","","14230.5","0.2","130","2","130","2","","","","","","","","7","P 32","P 32","145","","","","- C39 H95.78 Co Gd N9 O30.89 P -","- C39 H61.3333 Co Gd N9 O31.1 P -","- C351 H552 Co9 Gd9 N81 O279.9 P9 -","9","3","","Tyeklar, Zoltan; Dunham, Stephen U.; Midelfort, Katarina; Scott, Daniel M.; Sajiki, Hirano; Ong, Karen; Lauffer, Randall B.; Caravan, Peter; McMurry, Thomas J.","Structural, kinetic, and thermodynamic characterization of the interconverting isomers of MS-325, a gadolinium(III)-based magnetic resonance angiography contrast agent.","Inorganic chemistry","2007","46","16","6621","6631","10.1021/ic7006843","","","0.71073","MoKα","","0.0717","0.0568","","0.1088","0.0947","","","","1.084","1.078","1.078","","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339283","21.159","0.006","17.582","0.005","22.842","0.007","90","","98.204","0.007","90","","8411","4","115","2","115","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C39 H29 Br1.49 N7 O9 Ru -","- C39 H29 Br1.489 N7 O9 Ru -","- C312 H232 Br11.912 N56 O72 Ru8 -","8","1","","Batey, Helen D.; Whitwood, Adrian C.; Duhme-Klair, Anne-K","Synthesis, characterization, solid-state structures, and spectroscopic properties of two catechol-based luminescent chemosensors for biologically relevant oxometalates.","Inorganic chemistry","2007","46","16","6516","6528","10.1021/ic700554n","","","0.71073","MoKα","","0.0677","0.0483","","","0.123","0.1349","","","","","","1.055","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339284","7.3389","0.0006","12.8693","0.001","13.8173","0.0011","70.464","0.002","86.758","0.002","76.554","0.002","1195.84","0.17","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H16 Br N4 O6 Re -","- C24 H16 Br N4 O6 Re -","- C48 H32 Br2 N8 O12 Re2 -","2","1","","Batey, Helen D.; Whitwood, Adrian C.; Duhme-Klair, Anne-K","Synthesis, characterization, solid-state structures, and spectroscopic properties of two catechol-based luminescent chemosensors for biologically relevant oxometalates.","Inorganic chemistry","2007","46","16","6516","6528","10.1021/ic700554n","","","0.71073","MoKα","","0.0503","0.0356","","","0.0799","0.0855","","","","","","1.023","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339285","31.0136","0.0007","12.2081","0.0003","19.8174","0.0005","90","","106.638","0.001","90","","7189.1","0.3","243","2","243","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C72 H56 Cl6 Ir2 Mo2 N4 O6 P4 -","- C72 H56 Cl6 Ir2 Mo2 N4 O6 P4 -","- C288 H224 Cl24 Ir8 Mo8 N16 O24 P16 -","4","0.5","","Ohashi, Masato; Shima, Asuka; Rüffer, Tobias; Mizomoto, Hitoshi; Kaneda, Yutaka; Mashima, Kazushi","Linear metal-metal-bonded tetranuclear M-Mo-Mo-M complexes (M = Ir and Rh): oxidative metal-metal bond formation in a tetrametallic system and 1,4-addition reaction of alkyl halides.","Inorganic chemistry","2007","46","16","6702","6714","10.1021/ic062474q","","","0.71069","MoKα","","0.0453","0.0397","","","0.1021","0.1051","","","","","","1.094","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339286","16.10926","0.00018","26.5949","0.0003","16.00206","0.00019","100.595","0.0003","101.246","0.0005","77.3289","0.0005","6488.58","0.13","113","2","113","2","","","","","","","","8","P -1","-P 1","2","","","","- C146 H151 B2 Ir2 Mo2 N9 O6 P4 -","- C146 H151 B2 Ir2 Mo2 N9 O6 P4 -","- C292 H302 B4 Ir4 Mo4 N18 O12 P8 -","2","1","","Ohashi, Masato; Shima, Asuka; Rüffer, Tobias; Mizomoto, Hitoshi; Kaneda, Yutaka; Mashima, Kazushi","Linear metal-metal-bonded tetranuclear M-Mo-Mo-M complexes (M = Ir and Rh): oxidative metal-metal bond formation in a tetrametallic system and 1,4-addition reaction of alkyl halides.","Inorganic chemistry","2007","46","16","6702","6714","10.1021/ic062474q","","","0.71069","MoKα","","0.0439","0.0291","","","0.0685","0.072","","","","","","1.046","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339287","30.4565","0.0004","12.62185","0.00016","30.7539","0.0004","90","","115.304","0.0004","90","","10688","0.2","233","2","233","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C90.83 H93.67 Cl7.66 F12 Ir2 Mo2 N8 O4 P6 -","- C90.832 H93.664 Cl7.664 F12 Ir2 Mo2 N8 O4 P6 -","- C363.328 H374.656 Cl30.656 F48 Ir8 Mo8 N32 O16 P24 -","4","0.5","","Ohashi, Masato; Shima, Asuka; Rüffer, Tobias; Mizomoto, Hitoshi; Kaneda, Yutaka; Mashima, Kazushi","Linear metal-metal-bonded tetranuclear M-Mo-Mo-M complexes (M = Ir and Rh): oxidative metal-metal bond formation in a tetrametallic system and 1,4-addition reaction of alkyl halides.","Inorganic chemistry","2007","46","16","6702","6714","10.1021/ic062474q","","","0.71069","MoKα","","0.0715","0.0618","","","0.1825","0.191","","","","","","1.05","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339288","33.885","0.003","19.787","0.003","27.629","0.003","90","","126.749","0.004","90","","14843","3","114","1","114","1","","","","","","","","10","C 1 2/c 1","-C 2yc","15","","","","- C158 H144 B2 Cl6 I2 Ir2 Mo2 N8 O6 P4 -","- C158 H144 B2 Cl6 I2 Ir2 Mo2 N8 O6 P4 -","- C632 H576 B8 Cl24 I8 Ir8 Mo8 N32 O24 P16 -","4","0.5","","Ohashi, Masato; Shima, Asuka; Rüffer, Tobias; Mizomoto, Hitoshi; Kaneda, Yutaka; Mashima, Kazushi","Linear metal-metal-bonded tetranuclear M-Mo-Mo-M complexes (M = Ir and Rh): oxidative metal-metal bond formation in a tetrametallic system and 1,4-addition reaction of alkyl halides.","Inorganic chemistry","2007","46","16","6702","6714","10.1021/ic062474q","","","0.71075","MoKα","","0.0999","0.0586","","","0.1478","0.1691","","","","","","1.03","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339289","33.911","0.003","19.6687","0.0018","27.35","0.002","90","","126.895","0.003","90","","14589","2","122","1","122","1","","","","","","","","10","C 1 2/c 1","-C 2yc","15","","","","- C156.03 H136.84 B2 Cl6.49 I1.22 Ir2 Mo2 N8 O4 P4 -","- C156.028 H136.836 B2 Cl6.496 I1.22 Ir2 Mo2 N8 O4 P4 -","- C624.112 H547.344 B8 Cl25.984 I4.88 Ir8 Mo8 N32 O16 P16 -","4","0.5","","Ohashi, Masato; Shima, Asuka; Rüffer, Tobias; Mizomoto, Hitoshi; Kaneda, Yutaka; Mashima, Kazushi","Linear metal-metal-bonded tetranuclear M-Mo-Mo-M complexes (M = Ir and Rh): oxidative metal-metal bond formation in a tetrametallic system and 1,4-addition reaction of alkyl halides.","Inorganic chemistry","2007","46","16","6702","6714","10.1021/ic062474q","","","0.71075","MoKα","","0.0737","0.0528","","","0.1492","0.1601","","","","","","1.036","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4339290","7.9672","0.0013","14.871","0.002","15.172","0.003","112.833","0.002","100.06","0.002","90.316","0.002","1625.9","0.5","90","2","90","2","","","","","","","","7","P -1","-P 1","2","[Ru(Me2bpb)(NO)(vinyl-py)]BF4.toluene","","","- C34 H31 B F4 N6 O3 Ru -","- C34 H31 B F4 N6 O3 Ru -","- C68 H62 B2 F8 N12 O6 Ru2 -","2","1","","Halpenny, Genevieve M.; Olmstead, Marilyn M.; Mascharak, Pradip K.","Incorporation of a designed ruthenium nitrosyl in PolyHEMA hydrogel and light-activated delivery of NO to myoglobin.","Inorganic chemistry","2007","46","16","6601","6606","10.1021/ic700694b","","","0.71073","MoKα","","0.0594","0.0464","","","0.1202","0.1297","","","","","","1.054","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339291","15.53","0.003","14.008","0.003","9.1571","0.0018","90","","103.94","0.03","90","","1933.4","0.7","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Zn(DHP)](DMF)2","","","- C12 H18 N2 O10 P2 Zn -","- C12 H18 N2 O10 P2 Zn -","- C48 H72 N8 O40 P8 Zn4 -","4","0.5","","Liang, Junmei; Shimizu, George K. H.","Crystalline zinc diphosphonate metal-organic framework with three-dimensional microporosity.","Inorganic chemistry","2007","46","25","10449","10451","10.1021/ic701628f","","","0.71073","MoKα","","0.0296","0.0267","","","0.0675","0.0831","","","","","","1.139","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339292","6.6121","0.0005","13.2285","0.001","12.0851","0.0011","90","","90","","90","","1057.06","0.15","293","2","293","2","","","","","","","","3","C 2 2 21","C 2c 2","20","","","","- Co2 H8 N16 -","- Co2 H8 N16 -","- Co8 H32 N64 -","4","0.5","","Wang, Xiu-Teng; Wang, Zhe-Ming; Gao, Song","Honeycomb layer of cobalt(II) azide hydrazine showing weak ferromagnetism.","Inorganic chemistry","2007","46","25","10452","10454","10.1021/ic7016775","","","0.71073","MoKα","","0.1155","0.0406","","","0.0572","0.0675","","","","","","0.93","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339293","10.5135","0.0002","20.3407","0.0003","11.1139","0.0002","90","","103.114","0.001","90","","2314.75","0.07","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H30 F6 N2 Na O4 P -","- C18 H30 F6 N2 Na O4 P -","- C72 H120 F24 N8 Na4 O16 P4 -","4","1","","Sibert, John W.; Forshee, Philip B.; Hundt, Greg R.; Sargent, Andrew L.; Bott, Simon G.; Lynch, Vincent","Wurster's crowns: a comparative study of ortho- and para-phenylenediamine-containing macrocyclic receptors.","Inorganic chemistry","2007","46","25","10913","10925","10.1021/ic701560n","","","0.71073","MoKα","","0.0844","0.0469","","","0.1086","0.1237","","","","","","1.142","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339294","9.815","0.002","11.75","0.002","12.481","0.003","62.83","0.03","80.69","0.03","65.93","0.03","1168.7","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H30 F6 K N2 O4 P -","- C18 H30 F6 K N2 O4 P -","- C36 H60 F12 K2 N4 O8 P2 -","2","1","","Sibert, John W.; Forshee, Philip B.; Hundt, Greg R.; Sargent, Andrew L.; Bott, Simon G.; Lynch, Vincent","Wurster's crowns: a comparative study of ortho- and para-phenylenediamine-containing macrocyclic receptors.","Inorganic chemistry","2007","46","25","10913","10925","10.1021/ic701560n","","","0.71073","MoKα","","0.0639","0.0579","","0.1711","0.1631","","","","1.023","1.056","1.056","","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339295","11.3765","0.0003","12.145","0.0003","18.5284","0.0004","90","","95.049","0.001","90","","2550.09","0.11","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H38 B F4 Li N2 O7 -","- C20 H38 B F4 Li N2 O7 -","- C80 H152 B4 F16 Li4 N8 O28 -","4","1","","Sibert, John W.; Forshee, Philip B.; Hundt, Greg R.; Sargent, Andrew L.; Bott, Simon G.; Lynch, Vincent","Wurster's crowns: a comparative study of ortho- and para-phenylenediamine-containing macrocyclic receptors.","Inorganic chemistry","2007","46","25","10913","10925","10.1021/ic701560n","","","0.71073","MoKα","","0.1091","0.0582","","","0.1259","0.1443","","","","","","1.051","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339296","8.161","0.002","12.543","0.003","21.773","0.004","90","","96.29","0.03","90","","2215.3","0.9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H30 B F4 N2 Na O4 -","- C18 H30 B F4 N2 Na O4 -","- C72 H120 B4 F16 N8 Na4 O16 -","4","1","","Sibert, John W.; Forshee, Philip B.; Hundt, Greg R.; Sargent, Andrew L.; Bott, Simon G.; Lynch, Vincent","Wurster's crowns: a comparative study of ortho- and para-phenylenediamine-containing macrocyclic receptors.","Inorganic chemistry","2007","46","25","10913","10925","10.1021/ic701560n","","","0.71073","MoKα","","0.0977","0.052","","0.1517","0.1338","","","","1.001","1.229","1.229","","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339297","17.1206","0.0014","19.6851","0.0015","20.716","0.0016","97.01","0.002","92.467","0.002","108.341","0.002","6552.9","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C111 H93 Cl15 Mo3 O6 P7 S4 -","- C111 H72 Cl15 Mo3 O6 P7 S4 -","- C222 H144 Cl30 Mo6 O12 P14 S8 -","2","1","","Frantz, Richard; Guillamón, Eva; Lacour, Jérôme; Llusar, Rosa; Polo, Victor; Vicent, Cristian","C3-symmetric trinuclear molybdenum cluster sulfides: configurational stability, supramolecular stereocontrol, and absolute configuration assignment.","Inorganic chemistry","2007","46","25","10717","10723","10.1021/ic701522p","","","0.71073","MoKα","","0.1732","0.0806","","","0.2067","0.2615","","","","","","1.178","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339298","15.7238","0.0013","13.7996","0.0012","37.097","0.003","90","","91.693","0.002","90","","8045.9","1.2","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C84 H124 B2 Fe N2 O8 P4 -","- C84 H124 B2 Fe N2 O8 P4 -","- C336 H496 B8 Fe4 N8 O32 P16 -","4","1","","Crossland, Justin L.; Zakharov, Lev N.; Tyler, David R.","Synthesis and characterization of an iron(II) eta(2)-hydrazine complex.","Inorganic chemistry","2007","46","25","10476","10478","10.1021/ic702007r","","","0.71073","MoKα","","0.0737","0.0499","","","0.1099","0.1238","","","","","","1.024","","","","has coordinates,has disorder","179495","2020-10-21","18:00:00",""
"4339299","8.8701","0.0006","37.489","0.003","11.989","0.0008","90.055","0.003","98.337","0.003","89.994","0.003","3944.6","0.5","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H59 Ge N2 O2 Yb -","- C43 H59 Ge N2 O2 Yb -","- C172 H236 Ge4 N8 O8 Yb4 -","4","2","","Yang, Ying; Roesky, Herbert W.; Jones, Peter G.; So, Cheuk-Wai; Zhang, Zhensheng; Herbst-Irmer, Regine; Ye, Hongqi","Synthesis and structural characterization of monomeric heterobimetallic oxides with a GeII-O-M skeleton (M = Yb, Y).","Inorganic chemistry","2007","46","25","10860","10863","10.1021/ic701262x","","","0.71073","MoKα","","0.0497","0.0385","","","0.0682","0.0709","","","","","","1.096","","","","has coordinates","179495","2020-10-21","18:00:00",""
"4339300","8.8517","0.0004","37.4086","0.0016","12.0005","0.0005","90.19","0.003","98.071","0.003","90","0.003","3934.3","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H59 Ge N2 O2 Y -","- C43 H59 Ge N2 O2 Y -","- C172 H236 Ge4 N8 O8 Y4 -","4","2","","Yang, Ying; Roesky, Herbert W.; Jones, Peter G.; So, Cheuk-Wai; Zhang, Zhensheng; Herbst-Irmer, Regine; Ye, Hongqi","Synthesis and structural characterization of monomeric heterobimetallic oxides with a GeII-O-M skeleton (M = Yb, Y).","Inorganic chemistry","2007","46","25","10860","10863","10.1021/ic701262x","","","0.71073","MoKα","","0.0716","0.0556","","","0.1048","0.1095","","","","","","1.198","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339301","9.8095","0.0002","15.5889","0.0003","16.0992","0.0004","70.227","0.001","85.276","0.001","85.967","0.001","2306.49","0.09","30","","130","","","","","","","","","6","P -1","-P 1","2","","","","- C62 H126 Cu3 Mo2 N36 O16 -","- C58 H102 Cu3 Mo2 N34 O16 -","- C58 H102 Cu3 Mo2 N34 O16 -","1","0.5","","Lim, Jeong Hak; You, Young Sin; Yoo, Houng Sik; Yoon, Jung Hee; Kim, Jae Il; Koh, Eui Kwan; Hong, Chang Seop","Bimetallic M(V)(2)Cu(II)(3) (M = Mo, W) coordination complexes based on octacyanometalates: structures and magnetic variations tuned by chelated tetradentate macrocyclic ligands.","Inorganic chemistry","2007","46","25","10578","10586","10.1021/ic701243w","","","0.71073","MoKα","","0.077","0.0471","","","0.1188","0.1268","","","","","","1.056","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339302","9.8329","0.0002","15.5828","0.0004","16.0557","0.0004","70.395","0.001","85.15","0.001","85.831","0.001","2306.63","0.1","130","","130","","","","","","","","","6","P -1","-P 1","2","","","","- C62 H126 Cu3 N36 O16 W2 -","- C58 H96 Cu3 N34 O16 W2 -","- C58 H96 Cu3 N34 O16 W2 -","1","0.5","","Lim, Jeong Hak; You, Young Sin; Yoo, Houng Sik; Yoon, Jung Hee; Kim, Jae Il; Koh, Eui Kwan; Hong, Chang Seop","Bimetallic M(V)(2)Cu(II)(3) (M = Mo, W) coordination complexes based on octacyanometalates: structures and magnetic variations tuned by chelated tetradentate macrocyclic ligands.","Inorganic chemistry","2007","46","25","10578","10586","10.1021/ic701243w","","","0.71073","MoKα","","0.0548","0.0376","","","0.0821","0.0861","","","","","","1.045","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339303","8.9255","0.0011","10.0938","0.0013","19.549","0.003","78.342","0.005","83.074","0.005","69.472","0.005","1613","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H82 Cu3 N28 O5 W2 -","- C46 H72 Cu3 N28 O5 W2 -","- C46 H72 Cu3 N28 O5 W2 -","1","0.5","","Lim, Jeong Hak; You, Young Sin; Yoo, Houng Sik; Yoon, Jung Hee; Kim, Jae Il; Koh, Eui Kwan; Hong, Chang Seop","Bimetallic M(V)(2)Cu(II)(3) (M = Mo, W) coordination complexes based on octacyanometalates: structures and magnetic variations tuned by chelated tetradentate macrocyclic ligands.","Inorganic chemistry","2007","46","25","10578","10586","10.1021/ic701243w","","","0.71073","MoKα","","0.09","0.0693","","","0.1662","0.1779","","","","","","1.065","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339304","16.2688","0.0003","18.7141","0.0004","19.107","0.0004","116.087","0.001","111.588","0.001","92.149","0.001","4717.78","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C76 H122 Cu3 N28 O W2 -","- C76 H120 Cu3 N28 O W2 -","- C152 H240 Cu6 N56 O2 W4 -","2","1","","Lim, Jeong Hak; You, Young Sin; Yoo, Houng Sik; Yoon, Jung Hee; Kim, Jae Il; Koh, Eui Kwan; Hong, Chang Seop","Bimetallic M(V)(2)Cu(II)(3) (M = Mo, W) coordination complexes based on octacyanometalates: structures and magnetic variations tuned by chelated tetradentate macrocyclic ligands.","Inorganic chemistry","2007","46","25","10578","10586","10.1021/ic701243w","","","0.71073","MoKα","","0.094","0.0439","","","0.0961","0.1106","","","","","","1.029","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339305","17.003","0.003","17.453","0.003","20.335","0.003","99.286","0.003","99.113","0.003","108.721","0.003","5495.9","1.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","compound 2","","","- C34 H45 N4 Na4 O23.5 Sm2 -","- C34 H34 N4 Na4 O23.5 Sm2 -","- C136 H136 N16 Na16 O94 Sm8 -","4","2","","Natrajan, Louise S.; Timmins, Phillipa L.; Lunn, Matthew; Heath, Sarah L.","Luminescent dinuclear lanthanide complexes of 5-Me-HXTA.","Inorganic chemistry","2007","46","25","10877","10886","10.1021/ic701366f","","","0.71073","MoKα","","0.0802","0.0571","","","0.1626","0.1738","","","","","","1.016","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339306","16.9434","0.0008","17.4122","0.0008","20.3917","0.0009","99.52","0.001","99.05","0.001","108.995","0.001","5464.4","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","compound 3","","","- C35.5 H51.5 Eu2 N4 Na4 O31.75 -","- C35.5 H34 Eu2 N4 Na4 O32.25 -","- C142 H136 Eu8 N16 Na16 O129 -","4","2","","Natrajan, Louise S.; Timmins, Phillipa L.; Lunn, Matthew; Heath, Sarah L.","Luminescent dinuclear lanthanide complexes of 5-Me-HXTA.","Inorganic chemistry","2007","46","25","10877","10886","10.1021/ic701366f","","","0.71073","MoKα","","0.0879","0.0543","","","0.1372","0.1529","","","","","","1.029","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339307","16.875","0.001","17.3103","0.0011","20.2441","0.0013","99.182","0.002","97.809","0.002","108.543","0.002","5423.6","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","compound 4","","","- C34 H64 N4 Na2 O32.25 Tb2 -","- C34 H34 N4 Na2 O32.25 Tb2 -","- C136 H136 N16 Na8 O129 Tb8 -","4","2","","Natrajan, Louise S.; Timmins, Phillipa L.; Lunn, Matthew; Heath, Sarah L.","Luminescent dinuclear lanthanide complexes of 5-Me-HXTA.","Inorganic chemistry","2007","46","25","10877","10886","10.1021/ic701366f","","","0.693","Synchrotron","","0.0701","0.054","","","0.1618","0.1678","","","","","","1.078","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339308","16.9031","0.0008","17.4094","0.0008","39.6714","0.0018","94.864","0.001","99.307","0.001","108.603","0.001","10801.9","0.9","150","2","150","2","","","","","","","","6","P -1","-P 1","2","compound 5","","","- C34 H33.75 Dy2 N4 Na4 O31.13 -","- C34.375 H33.25 Dy2 N4 Na4 O31.054 -","- C275 H266 Dy16 N32 Na32 O248.432 -","8","4","","Natrajan, Louise S.; Timmins, Phillipa L.; Lunn, Matthew; Heath, Sarah L.","Luminescent dinuclear lanthanide complexes of 5-Me-HXTA.","Inorganic chemistry","2007","46","25","10877","10886","10.1021/ic701366f","","","0.71073","MoKα","","0.0988","0.0647","","","0.1787","0.1983","","","","","","1.018","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339309","16.865","0.003","17.4715","0.0019","39.741","0.009","95.086","0.012","99.109","0.011","108.664","0.012","10832","3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","compound 6","","","- C34 H44.75 Ho2 N4 Na4 O23.75 -","- C34 H33.25 Ho2 N4 Na4 O23.75 -","- C272 H266 Ho16 N32 Na32 O190 -","8","4","","Natrajan, Louise S.; Timmins, Phillipa L.; Lunn, Matthew; Heath, Sarah L.","Luminescent dinuclear lanthanide complexes of 5-Me-HXTA.","Inorganic chemistry","2007","46","25","10877","10886","10.1021/ic701366f","","","0.71073","MoKα","","0.12","0.0605","","","0.1579","0.1976","","","","","","0.922","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339310","21.0999","0.0007","20.5791","0.0007","25.8866","0.0008","90","","98.688","0.002","90","","11111.4","0.6","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","compound 7","","","- C34 H48.25 Er2 N4 Na4 O24 -","- C34 H34 Er2 N4 Na4 O24 -","- C272 H272 Er16 N32 Na32 O192 -","8","1","","Natrajan, Louise S.; Timmins, Phillipa L.; Lunn, Matthew; Heath, Sarah L.","Luminescent dinuclear lanthanide complexes of 5-Me-HXTA.","Inorganic chemistry","2007","46","25","10877","10886","10.1021/ic701366f","","","0.6749","Synchrotron","","0.0374","0.0323","","","0.0884","0.091","","","","","","1.111","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339311","16.9226","0.001","17.069","0.001","20.2256","0.0015","99.758","0.006","98.158","0.006","108.341","0.003","5344.8","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","Compound 8","","","- C34 H74.5 N4 Na4 O29.5 Yb2 -","- C34 H33.5 N4 Na4 O29.5 Yb2 -","- C136 H134 N16 Na16 O118 Yb8 -","4","2","","Natrajan, Louise S.; Timmins, Phillipa L.; Lunn, Matthew; Heath, Sarah L.","Luminescent dinuclear lanthanide complexes of 5-Me-HXTA.","Inorganic chemistry","2007","46","25","10877","10886","10.1021/ic701366f","","","0.71073","MoKα","","0.1902","0.0694","","","0.1883","0.2412","","","","","","0.944","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339312","18.674","0.002","18.674","0.002","43.801","0.003","90","","90","","120","","13228","2","173","2","173","2","","","","","","","","5","R -3 :H","-R 3","148","Compoun 12b","","","- C95 H122 N3 O10 P3 -","- C94 H118 N3 O9 P3 -","- C564 H708 N18 O54 P18 -","6","0.333333","","Matloka, Kornelia; Sah, Ajay K.; Peters, Matthew W.; Srinivasan, Priya; Gelis, Artem V.; Regalbuto, Monica; Scott, Michael J.","CMPO-functionalized C3-symmetric tripodal ligands in liquid/liquid extractions: efficient, selective recognition of Pu(IV) with low affinity for 3+ metal ions.","Inorganic chemistry","2007","46","25","10549","10563","10.1021/ic700800a","","","0.71073","MoKα","","0.1028","0.0816","","","0.1879","0.198","","","","","","1.14","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339313","17.25","0.002","18.07","0.002","21.557","0.003","87.288","0.002","66.965","0.002","71.87","0.002","5855.4","1.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Compound 16a3 CHCl3 0.5Et2O","","","- C105 H138 Cl9 N3 O9.5 P3 -","- C103 H125 Cl9 N3 O9 P3 -","- C206 H250 Cl18 N6 O18 P6 -","2","1","","Matloka, Kornelia; Sah, Ajay K.; Peters, Matthew W.; Srinivasan, Priya; Gelis, Artem V.; Regalbuto, Monica; Scott, Michael J.","CMPO-functionalized C3-symmetric tripodal ligands in liquid/liquid extractions: efficient, selective recognition of Pu(IV) with low affinity for 3+ metal ions.","Inorganic chemistry","2007","46","25","10549","10563","10.1021/ic700800a","","","0.71073","MoKα","","0.1138","0.0826","","","0.243","0.2673","","","","","","1.115","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339314","12.5597","0.0009","15.5209","0.0012","28.949","0.002","93.7","0.002","90.632","0.002","90.532","0.002","5630.9","0.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","8TbNO3 2NO3 Et2O","","","- C101 H134 N6 O19 P3 Tb -","- C97 H124 N6 O18 P3 Tb -","- C194 H248 N12 O36 P6 Tb2 -","2","1","","Matloka, Kornelia; Sah, Ajay K.; Peters, Matthew W.; Srinivasan, Priya; Gelis, Artem V.; Regalbuto, Monica; Scott, Michael J.","CMPO-functionalized C3-symmetric tripodal ligands in liquid/liquid extractions: efficient, selective recognition of Pu(IV) with low affinity for 3+ metal ions.","Inorganic chemistry","2007","46","25","10549","10563","10.1021/ic700800a","","","0.71073","MoKα","","0.112","0.0682","","","0.145","0.161","","","","","","0.901","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339315","12.4105","0.0018","13.713","0.002","33.122","0.005","88.353","0.003","82.941","0.002","66.989","0.002","5147.9","1.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","16bTb 2NO3 MeOH","","","- C101 H134 N6 O19 P3 Tb -","- C101 H119.7 N9.2 O16 P3 Tb -","- C202 H239.4 N18.4 O32 P6 Tb2 -","2","1","","Matloka, Kornelia; Sah, Ajay K.; Peters, Matthew W.; Srinivasan, Priya; Gelis, Artem V.; Regalbuto, Monica; Scott, Michael J.","CMPO-functionalized C3-symmetric tripodal ligands in liquid/liquid extractions: efficient, selective recognition of Pu(IV) with low affinity for 3+ metal ions.","Inorganic chemistry","2007","46","25","10549","10563","10.1021/ic700800a","","","0.71073","MoKα","","0.1124","0.097","","","0.2039","0.209","","","","","","1.274","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339316","20.8891","0.0013","22.9583","0.0015","23.1141","0.0015","80.308","0.001","64.914","0.001","68.352","0.001","9330.4","1","193","2","193","2","","","","","","","","6","P -1","-P 1","2","8cBiNO3 2NO3","","","- C82 H94 Bi N6 O18 P3 -","- C82 H94 Bi N5.5 O16.5 P3 -","- C328 H376 Bi4 N22 O66 P12 -","4","2","","Matloka, Kornelia; Sah, Ajay K.; Peters, Matthew W.; Srinivasan, Priya; Gelis, Artem V.; Regalbuto, Monica; Scott, Michael J.","CMPO-functionalized C3-symmetric tripodal ligands in liquid/liquid extractions: efficient, selective recognition of Pu(IV) with low affinity for 3+ metal ions.","Inorganic chemistry","2007","46","25","10549","10563","10.1021/ic700800a","","","0.71073","MoKα","","0.1313","0.0657","","","0.1579","0.178","","","","","","0.899","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339317","13.1892","0.0014","18.4213","0.0019","25.996","0.003","84.902","0.003","84.139","0.003","87.121","0.003","6252.8","1.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","[Pt(dmphen){CH2C6H4P(o-tolyl)2-C,P}]BArf","","","- C67 H44 B F24 N2 P Pt -","- C67 H44 B F24 N2 P Pt -","- C268 H176 B4 F96 N8 P4 Pt4 -","4","2","","Romeo, Raffaello; D'Amico, Giuseppina; Guido, Emanuela; Albinati, Alberto; Rizzato, Silvia","Synchronized fluxional motion and cyclometalation of ligands in platinum(II) complexes.","Inorganic chemistry","2007","46","25","10681","10692","10.1021/ic701396j","","","0.71069","MoKα","","0.0695","0.0459","","","0.105","0.1149","","","","","","1.025","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339318","33.696","0.01","9.513","0.003","30.793","0.008","90","","115.828","0.004","90","","8885","4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C54 H45 B N6 Ru S -","- C54 H45 B N6 Ru S -","- C432 H360 B8 N48 Ru8 S8 -","8","1","","Hamaguchi, Tomohiko; Ujimoto, Kikujiro; Ando, Isao","Novel 2-mercaptopyridine-ruthenium complex exhibiting electrochemically induced linkage isomerization switched on/off by protolysis.","Inorganic chemistry","2007","46","25","10455","10457","10.1021/ic701186k","","","0.71073","MoKα","","0.1922","0.0675","","","0.0891","0.1193","","","","","","0.924","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339319","9.7991","0.001","13.8489","0.0016","14.166","0.002","62.17","0.004","76.617","0.007","88.069","0.007","1647.7","0.4","90","","90","","","","","","","","local laboratory","5","P -1","-P 1","2","","","","- C35 H36 Ag N7 O10 -","- C35 H36 Ag N7 O10 -","- C70 H72 Ag2 N14 O20 -","2","1","","Stefanelli, Manuela; Mastroianni, Marco; Nardis, Sara; Licoccia, Silvia; Fronczek, Frank R.; Smith, Kevin M.; Zhu, Weihua; Ou, Zhongping; Kadish, Karl M.; Paolesse, Roberto","Functionalization of corroles: the nitration reaction.","Inorganic chemistry","2007","46","25","10791","10799","10.1021/ic7014572","","","0.71073","MoKα","","0.046","0.032","","","0.065","0.069","","","","","","1.03","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339320","13.153","0.0019","25.159","0.004","14.097","0.002","90","","93.854","0.003","90","","4654.4","1.2","110","2","110","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[Fe4(O2Cbiph)8(THF)2]","","","- C112 H88 Fe4 O18 -","- C112 H88 Fe4 O18 -","- C224 H176 Fe8 O36 -","2","0.5","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.0484","0.0414","","","0.0944","0.0978","","","","","","1.131","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339321","14.0208","0.0015","14.2725","0.0015","15.7331","0.0016","109.966","0.002","96.596","0.002","115.812","0.002","2531.4","0.5","110","2","110","2","","","","","","","","6","P -1","-P 1","2","[Fe4(O2Cbiph)8(Hind)2]","","","- C120 H88 Cl4 Fe4 N4 O16 -","- C120 H88 Cl4 Fe4 N4 O16 -","- C120 H88 Cl4 Fe4 N4 O16 -","1","0.5","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.048","0.0434","","","0.1075","0.1108","","","","","","1.038","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339322","13.559","0.006","24.633","0.011","13.817","0.006","90","","96.444","0.009","90","","4586","4","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Fe4(O2Cbiph)8(pyrazole)2]","","","- C110 H80 Fe4 N4 O16 -","- C110 H80 Fe4 N4 O16 -","- C220 H160 Fe8 N8 O32 -","2","0.5","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.0688","0.0463","","","0.0995","0.1082","","","","","","1.026","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339323","13.2698","0.0007","13.7009","0.0007","29.8852","0.0016","93.215","0.001","94.749","0.001","91.021","0.001","5404.8","0.5","110","2","110","2","","","","","","","","6","P -1","-P 1","2","[Fe4(dimepz)2]4CH2Cl2","","","- C118 H96 Cl8 Fe4 N4 O16 -","- C118 H96 Cl8 Fe4 N4 O16 -","- C236 H192 Cl16 Fe8 N8 O32 -","2","1","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.0408","0.0345","","","0.0817","0.0851","","","","","","1.029","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339324","13.2541","0.0017","14.0636","0.0019","16.056","0.002","97.388","0.002","101.633","0.002","116.504","0.002","2540.4","0.6","110","2","110","2","","","","","","","","6","P -1","-P 1","2","[Fe4(O2Cbiph)4(Hdimepz)2]2CH2Cl2","","","- C116 H92 Cl4 Fe4 N4 O16 -","- C116 H92 Cl4 Fe4 N4 O16 -","- C116 H92 Cl4 Fe4 N4 O16 -","1","0.5","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.0413","0.0375","","","0.0947","0.0978","","","","","","1.047","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339325","13.955","0.003","14.181","0.003","15.806","0.003","109.421","0.003","95.956","0.003","116.237","0.003","2527.1","0.9","110","2","110","2","","","","","","","","6","P -1","-P 1","2","[Fe4(O2Cbiph)8(acetamide)2]2C6H5Cl","","","- C120 H92 Cl2 Fe4 N2 O18 -","- C120 H92 Cl2 Fe4 N2 O18 -","- C120 H92 Cl2 Fe4 N2 O18 -","1","0.5","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.0675","0.0495","","","0.1015","0.1088","","","","","","1.044","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339326","12.598","0.002","12.617","0.002","13.368","0.002","71.827","0.003","83.311","0.003","64.997","0.003","1829.4","0.5","110","2","110","2","","","","","","","","4","P -1","-P 1","2","[Fe3(O2Cbiph)6(MeCN)4]","","","- C86 H66 Fe3 O12 -","- C86 H66 Fe3 N4 O12 -","- C86 H66 Fe3 N4 O12 -","1","0.5","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.0405","0.0381","","","0.0988","0.1009","","","","","","1.046","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339327","13.496","0.002","13.766","0.003","23.334","0.004","92.783","0.003","102.073","0.003","117.536","0.003","3705.9","1.2","110","2","110","2","","","","","","","","6","P -1","-P 1","2","[Fe3(O2Cbiph)6(MeCN)4]CH2Cl2","","","- C87 H68 Cl2 Fe3 N4 O12 -","- C87 H68 Cl2 Fe3 N4 O12 -","- C174 H136 Cl4 Fe6 N8 O24 -","2","1","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.0953","0.0647","","","0.1146","0.1246","","","","","","1.099","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339328","13.776","0.002","14.849","0.002","22.949","0.005","94.328","0.004","105.652","0.003","117.224","0.002","3909.7","1.2","110","2","110","2","","","","","","","","4","P -1","-P 1","2","[Fe3(O2Cbiph)6(THF)4]","","","- C94 H86 Fe3 O16 -","- C94 H86 Fe3 O16 -","- C188 H172 Fe6 O32 -","2","1","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.054","0.0417","","","0.0954","0.1018","","","","","","1.022","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339329","12.222","0.013","12.345","0.009","13.65","0.011","104.55","0.02","115.45","0.02","90.96","0.03","1782","3","110","2","110","2","","","","","","","","4","P -1","-P 1","2","[Fe3(O2Cbiph)6(dme)2]","","","- C86 H74 Fe3 O16 -","- C86 H74 Fe3 O16 -","- C86 H74 Fe3 O16 -","1","0.5","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.0526","0.0415","","","0.0916","0.0964","","","","","","1.065","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339330","24.96","0.007","10.012","0.003","21.217","0.006","90","","92.282","0.005","90","","5298","3","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Fe2(O2Cbiph)4(py)2]CH2Cl2","","","- C63 H48 Cl2 Fe2 N2 O8 -","- C63 H48 Cl2 Fe2 N2 O8 -","- C252 H192 Cl8 Fe8 N8 O32 -","4","0.5","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.0347","0.0328","","","0.0804","0.0816","","","","","","1.081","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339331","24.769","0.01","10.586","0.006","20.607","0.01","90","","91","0.04","90","","5402","5","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Fe2(O2Cbiph)4(1-meim)2]CH2Cl2","","","- C61 H50 Cl2 Fe2 N4 O8 -","- C61 H50 Cl2 Fe2 N4 O8 -","- C244 H200 Cl8 Fe8 N16 O32 -","4","0.5","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.0422","0.0386","","","0.0916","0.0936","","","","","","1.12","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339332","7.5094","0.0009","16.123","0.002","8.9317","0.0011","90","","107.308","0.002","90","","1032.4","0.2","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[FeCl2(meim)4]","","","- C16 H24 Cl2 Fe N8 -","- C16 H24 Cl2 Fe N8 -","- C32 H48 Cl4 Fe2 N16 -","2","0.5","","Reisner, Erwin; Telser, Joshua; Lippard, Stephen J.","A planar carboxylate-rich tetraironII complex and its conversion to linear triironII and paddlewheel diironII complexes.","Inorganic chemistry","2007","46","25","10754","10770","10.1021/ic701663j","","","0.71073","MoKα","","0.0292","0.028","","","0.0702","0.0711","","","","","","1.089","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339333","3.97083","0.00004","3.97083","","26.1057","0.0005","90","","90","","90","","411.621","0.009","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- La4 Ni3 O8 -","- La4 Ni3 O8 -","- La8 Ni6 O16 -","2","0.0625","","Poltavets, Viktor V.; Lokshin, Konstantin A.; Croft, Mark; Mandal, Tapas K.; Egami, Takeshi; Greenblatt, Martha","Crystal structures of Ln4Ni3O8 (Ln = La, Nd) triple layer T'-type nickelates.","Inorganic chemistry","2007","46","25","10887","10891","10.1021/ic701480v","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339334","3.914621","0.000033","3.914621","","25.2947","0.0005","90","","90","","90","","387.622","0.008","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Nd4 Ni3 O8 -","- Nd4 Ni3 O8 -","- Nd8 Ni6 O16 -","2","0.0625","","Poltavets, Viktor V.; Lokshin, Konstantin A.; Croft, Mark; Mandal, Tapas K.; Egami, Takeshi; Greenblatt, Martha","Crystal structures of Ln4Ni3O8 (Ln = La, Nd) triple layer T'-type nickelates.","Inorganic chemistry","2007","46","25","10887","10891","10.1021/ic701480v","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339335","17.585","0.005","19.639","0.005","20.23","0.005","90","","110.934","0.004","90","","6525","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C73 H56 Cl4 N6 O P2 Pt -","- C73 H56 Cl4 N6 O P2 Pt -","- C292 H224 Cl16 N24 O4 P8 Pt4 -","4","0.5","","Li, Xiu-Ling; Shi, Lin-Xi; Zhang, Li-Yi; Wen, Hui-Min; Chen, Zhong-Ning","Syntheses, structures, and sensitized lanthanide luminescence by Pt ‒> Ln (Ln = Eu, Nd, Yb) energy transfer for heteronuclear PtLn2 and Pt2Ln4 complexes with a terpyridyl-functionalized alkynyl ligand.","Inorganic chemistry","2007","46","25","10892","10900","10.1021/ic7015676","","","0.71073","MoKα","","0.0413","0.0372","","","0.0965","0.1004","","","","","","1.095","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339336","15.409","0.003","18.761","0.004","25.654","0.005","75.785","0.007","76.278","0.006","75.276","0.007","6831","2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C101 H56 F36 N6 Nd2 O12 P2 Pt -","- C101 H56 F36 N6 Nd2 O12 P2 Pt -","- C202 H112 F72 N12 Nd4 O24 P4 Pt2 -","2","1","","Li, Xiu-Ling; Shi, Lin-Xi; Zhang, Li-Yi; Wen, Hui-Min; Chen, Zhong-Ning","Syntheses, structures, and sensitized lanthanide luminescence by Pt ‒> Ln (Ln = Eu, Nd, Yb) energy transfer for heteronuclear PtLn2 and Pt2Ln4 complexes with a terpyridyl-functionalized alkynyl ligand.","Inorganic chemistry","2007","46","25","10892","10900","10.1021/ic7015676","","","0.71073","MoKα","","0.1003","0.071","","","0.21","0.2527","","","","","","1.057","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339337","21.161","0.006","34.02","0.008","19.924","0.005","90","","103.69","0.005","90","","13936","6","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C204 H116 Cl4 Eu4 F72 N12 O24 P4 Pt2 -","- C202 H112 Eu4 F72 N12 O24 P4 Pt2 -","- C404 H224 Eu8 F144 N24 O48 P8 Pt4 -","2","0.5","","Li, Xiu-Ling; Shi, Lin-Xi; Zhang, Li-Yi; Wen, Hui-Min; Chen, Zhong-Ning","Syntheses, structures, and sensitized lanthanide luminescence by Pt ‒> Ln (Ln = Eu, Nd, Yb) energy transfer for heteronuclear PtLn2 and Pt2Ln4 complexes with a terpyridyl-functionalized alkynyl ligand.","Inorganic chemistry","2007","46","25","10892","10900","10.1021/ic7015676","","","0.71073","MoKα","","0.1319","0.0754","","","0.187","0.239","","","","","","1.055","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339338","21.113","0.011","33.841","0.017","19.906","0.01","90","","104.437","0.006","90","","13773","12","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C204 H116 Cl4 F72 N12 O24 P4 Pt2 Yb4 -","- C204 H116 Cl4 F72 N12 O24 P4 Pt2 Yb4 -","- C408 H232 Cl8 F144 N24 O48 P8 Pt4 Yb8 -","2","0.5","","Li, Xiu-Ling; Shi, Lin-Xi; Zhang, Li-Yi; Wen, Hui-Min; Chen, Zhong-Ning","Syntheses, structures, and sensitized lanthanide luminescence by Pt ‒> Ln (Ln = Eu, Nd, Yb) energy transfer for heteronuclear PtLn2 and Pt2Ln4 complexes with a terpyridyl-functionalized alkynyl ligand.","Inorganic chemistry","2007","46","25","10892","10900","10.1021/ic7015676","","","0.71073","MoKα","","0.0921","0.0623","","","0.1614","0.1849","","","","","","1.05","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339339","9.3754","0.0007","17.3669","0.0011","11.149","0.0007","90","","116.819","0.007","90","","1620","0.2","140","1","140","1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","Compound H2L1","","","- C38 H44 N2 O2 S2 -","- C38 H44 N2 O2 S2 -","- C76 H88 N4 O4 S4 -","2","0.5","","Homden, Damien M.; Redshaw, Carl; Hughes, David L.","Vanadium complexes possessing N2O2S2-based ligands: highly active procatalysts for the homopolymerization of ethylene and copolymerization of ethylene/1-hexene.","Inorganic chemistry","2007","46","25","10827","10839","10.1021/ic701461b","","","0.71073","Mo-Kα","","0.0564","0.0493","","","0.1196","0.1251","","","","","","1.124","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339340","16.5584","0.0015","7.7388","0.0006","27.125","0.003","90","","100.499","0.008","90","","3417.7","0.6","140","1","140","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Compound H2L4","","","- C38 H48 N2 O2 S2 -","- C38 H48 N2 O2 S2 -","- C152 H192 N8 O8 S8 -","4","0.5","","Homden, Damien M.; Redshaw, Carl; Hughes, David L.","Vanadium complexes possessing N2O2S2-based ligands: highly active procatalysts for the homopolymerization of ethylene and copolymerization of ethylene/1-hexene.","Inorganic chemistry","2007","46","25","10827","10839","10.1021/ic701461b","","","0.71073","Mo-Kα","","0.077","0.0546","","","0.0978","0.1051","","","","","","1.128","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339341","9.648","0.0001","11.9119","0.0002","16.9911","0.0003","83.83","0.001","85.87","0.001","73.428","0.001","1859.01","0.05","120","1","120","1","","","","","","","","6","P -1","-P 1","2","Compound 1","","","- C40 H45 N3 O3 S2 V -","- C40 H45 N3 O3 S2 V -","- C80 H90 N6 O6 S4 V2 -","2","1","","Homden, Damien M.; Redshaw, Carl; Hughes, David L.","Vanadium complexes possessing N2O2S2-based ligands: highly active procatalysts for the homopolymerization of ethylene and copolymerization of ethylene/1-hexene.","Inorganic chemistry","2007","46","25","10827","10839","10.1021/ic701461b","","","0.71073","Mo-Kα","","0.061","0.0444","","","0.1004","0.1068","","","","","","1.041","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339342","9.6892","0.0007","11.7442","0.001","17.1594","0.0008","84.56","0.006","84.449","0.006","76.692","0.007","1885.9","0.2","140","1","140","1","","","","","","","","7","P -1","-P 1","2","Compound 3","","","- C40 H45 Cl N3 O2 S2 V -","- C40 H45 Cl N3 O2 S2 V -","- C80 H90 Cl2 N6 O4 S4 V2 -","2","1","","Homden, Damien M.; Redshaw, Carl; Hughes, David L.","Vanadium complexes possessing N2O2S2-based ligands: highly active procatalysts for the homopolymerization of ethylene and copolymerization of ethylene/1-hexene.","Inorganic chemistry","2007","46","25","10827","10839","10.1021/ic701461b","","","0.71073","Mo-Kα","","0.089","0.0439","","","0.0837","0.0931","","","","","","0.923","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339343","11.567","0.003","12.515","0.003","14.789","0.004","73.4","0.02","80.22","0.02","65.98","0.02","1870.5","0.9","140","1","140","1","","","","","","","","6","P -1","-P 1","2","Compound 7","","","- C82 H100 N4 O6 S4 V2 -","- C82 H100 N4 O6 S4 V2 -","- C82 H100 N4 O6 S4 V2 -","1","0.5","","Homden, Damien M.; Redshaw, Carl; Hughes, David L.","Vanadium complexes possessing N2O2S2-based ligands: highly active procatalysts for the homopolymerization of ethylene and copolymerization of ethylene/1-hexene.","Inorganic chemistry","2007","46","25","10827","10839","10.1021/ic701461b","","","0.71073","Mo-Kα","","0.1318","0.1","","","0.1776","0.1897","","","","","","1.223","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339344","6.9597","0.0004","15.7704","0.0009","19.2329","0.0008","90","","99.095","0.004","90","","2084.41","0.19","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 Cu2 N4 O11 -","- C18 H16 Cu2 N4 O11 -","- C72 H64 Cu8 N16 O44 -","4","1","","Biswas, Chaitali; Mukherjee, Pampa; Drew, Michael G. B.; Gómez-García, Carlos J; Clemente-Juan, Juan M; Ghosh, Ashutosh","Anion-directed synthesis of metal-organic frameworks based on 2-picolinate CuII complexes: a ferromagnetic alternating chain and two unprecedented ferromagnetic fish backbone chains.","Inorganic chemistry","2007","46","25","10771","10780","10.1021/ic701440x","","","0.71073","MoKα","","0.1187","0.0626","","","0.0908","0.1034","","","","","","1.005","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339345","8.5487","0.001","10.222","0.0013","12.8509","0.0019","102.132","0.012","101.182","0.011","97.946","0.01","1058.1","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H14 B Cu2 F4 N3 O7 -","- C18 H14 B Cu2 F4 N3 O7 -","- C36 H28 B2 Cu4 F8 N6 O14 -","2","1","","Biswas, Chaitali; Mukherjee, Pampa; Drew, Michael G. B.; Gómez-García, Carlos J; Clemente-Juan, Juan M; Ghosh, Ashutosh","Anion-directed synthesis of metal-organic frameworks based on 2-picolinate CuII complexes: a ferromagnetic alternating chain and two unprecedented ferromagnetic fish backbone chains.","Inorganic chemistry","2007","46","25","10771","10780","10.1021/ic701440x","","","0.71073","MoKα","","0.1186","0.0585","","","0.1363","0.1679","","","","","","0.9","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339346","8.5757","0.0014","10.2814","0.0017","12.933","0.002","101.685","0.014","100.89","0.014","98.156","0.014","1077.2","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H14 Cl Cu2 N3 O11 -","- C18 H14 Cl Cu2 N3 O11 -","- C36 H28 Cl2 Cu4 N6 O22 -","2","1","","Biswas, Chaitali; Mukherjee, Pampa; Drew, Michael G. B.; Gómez-García, Carlos J; Clemente-Juan, Juan M; Ghosh, Ashutosh","Anion-directed synthesis of metal-organic frameworks based on 2-picolinate CuII complexes: a ferromagnetic alternating chain and two unprecedented ferromagnetic fish backbone chains.","Inorganic chemistry","2007","46","25","10771","10780","10.1021/ic701440x","","","0.71073","MoKα","","0.0849","0.0462","","","0.1211","0.1298","","","","","","0.793","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339347","37.6511","0.001","9.2841","0.0003","27.9437","0.0009","90","","122.201","0.002","90","","8265.4","0.5","130","2","130","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C89 H84 Fe2 N14 O8 P2 -","- C89 H62 Fe2 N14 O8 P2 -","- C356 H248 Fe8 N56 O32 P8 -","4","0.5","","Kim, Jae Il; Yoo, Houng Sik; Koh, Eui Kwan; Hong, Chang Seop","Field-induced metamagnetic transition in the Fe(III)-Mn(III) bimetallic chain built by a new cyanide-bearing Fe(III) precursor.","Inorganic chemistry","2007","46","25","10461","10463","10.1021/ic702001q","","","0.71073","MoKα","","0.1345","0.0656","","","0.1483","0.1801","","","","","","1.024","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339348","10.7664","0.0011","23.771","0.002","13.8319","0.0015","90","","110.576","0.006","90","","3314.1","0.6","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C34 H29 Fe Mn N9 O5 -","- C34 H25 Fe Mn N9 O5 -","- C136 H100 Fe4 Mn4 N36 O20 -","4","1","","Kim, Jae Il; Yoo, Houng Sik; Koh, Eui Kwan; Hong, Chang Seop","Field-induced metamagnetic transition in the Fe(III)-Mn(III) bimetallic chain built by a new cyanide-bearing Fe(III) precursor.","Inorganic chemistry","2007","46","25","10461","10463","10.1021/ic702001q","","","0.71073","MoKα","","0.0396","0.0331","","","0.0841","0.0923","","","","","","1.113","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339349","12.4857","0.0004","20.3444","0.0006","14.9471","0.0005","90","","92.218","0.002","90","","3793.9","0.2","130","","130","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H38 Fe Mn N10 O4 -","- C41 H31 Fe Mn N10 O4 -","- C164 H124 Fe4 Mn4 N40 O16 -","4","1","","Kim, Jae Il; Yoo, Houng Sik; Koh, Eui Kwan; Hong, Chang Seop","Field-induced metamagnetic transition in the Fe(III)-Mn(III) bimetallic chain built by a new cyanide-bearing Fe(III) precursor.","Inorganic chemistry","2007","46","25","10461","10463","10.1021/ic702001q","","","0.71073","MoKα","","0.1721","0.0785","","","0.2056","0.2648","","","","","","0.981","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339350","10.1117","0.0006","10.1902","0.0006","13.0217","0.0007","75.635","0.001","71.7","0.001","64.207","0.001","1137.19","0.11","243","2","243","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H17 B N2 S4 -","- C25.186 H17.186 B N2 S4 -","- C50.372 H34.372 B2 N4 S8 -","2","1","","Choi, Shin Hei; Pang, Keliang; Kim, Kibong; Churchill, David G.","Cu2+ colorimetric sensing and fluorescence enhancement and Hg2+ fluorescence diminution in ""scorpionate""-like tetrathienyl-substituted boron-dipyrrins.","Inorganic chemistry","2007","46","25","10564","10577","10.1021/ic701101j","","","0.71073","MoKα","","0.0919","0.0765","","","0.237","0.2528","","","","","","1.095","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339351","10.0954","0.0005","10.0984","0.0005","12.9732","0.0006","76.643","0.001","72.481","0.001","64.638","0.001","1131.66","0.1","243","2","243","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H17 B N2 S4 -","- C25 H17 B N2 S4 -","- C50 H34 B2 N4 S8 -","2","1","","Choi, Shin Hei; Pang, Keliang; Kim, Kibong; Churchill, David G.","Cu2+ colorimetric sensing and fluorescence enhancement and Hg2+ fluorescence diminution in ""scorpionate""-like tetrathienyl-substituted boron-dipyrrins.","Inorganic chemistry","2007","46","25","10564","10577","10.1021/ic701101j","","","0.71073","MoKα","","0.148","0.1287","","","0.4276","0.449","","","","","","1.983","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339352","8.388","0.002","9.059","0.002","29.546","0.008","90","","93.666","0.004","90","","2240.5","0.9","243","2","243","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H17 B N2 S4 -","- C25 H17 B N2 S4 -","- C100 H68 B4 N8 S16 -","4","1","","Choi, Shin Hei; Pang, Keliang; Kim, Kibong; Churchill, David G.","Cu2+ colorimetric sensing and fluorescence enhancement and Hg2+ fluorescence diminution in ""scorpionate""-like tetrathienyl-substituted boron-dipyrrins.","Inorganic chemistry","2007","46","25","10564","10577","10.1021/ic701101j","","","0.71073","MoKα","","0.1773","0.0778","","","0.1737","0.2128","","","","","","1.05","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339353","5.257","","12.925","","11.734","","90","","94.79","","90","","794.502","","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 Cl2 N10 -","- C12 H14 Cl2 N10 -","- C24 H28 Cl4 N20 -","2","0.5","","Garcia-Raso, Angel; Albertí, Francisca M; Fiol, Juan J.; Tasada, Andres; Barceló-Oliver, Miquel; Molins, Elies; Escudero, Daniel; Frontera, Antonio; Quiñonero, David; Deyà, Pere M","Anion-pi interactions in bisadenine derivatives: a combined crystallographic and theoretical study.","Inorganic chemistry","2007","46","25","10724","10735","10.1021/ic701555n","","x-ray","0.71073","MoKα","","0.1521","0.0624","","","0.1958","0.2508","","","","","","1.066","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339354","10.8483","0.0018","12.347","0.003","18.14","0.003","102.894","0.017","90.66","0.016","115.787","0.019","2116.2","0.8","293","2","293","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C13 H17 Cl4 N8 O3.5 Zn -","- C13 H17 Cl4 N8 O3.5 Zn -","- C52 H68 Cl16 N32 O14 Zn4 -","4","2","","Garcia-Raso, Angel; Albertí, Francisca M; Fiol, Juan J.; Tasada, Andres; Barceló-Oliver, Miquel; Molins, Elies; Escudero, Daniel; Frontera, Antonio; Quiñonero, David; Deyà, Pere M","Anion-pi interactions in bisadenine derivatives: a combined crystallographic and theoretical study.","Inorganic chemistry","2007","46","25","10724","10735","10.1021/ic701555n","","x-ray","0.71073","MoKα","","0.073","0.0549","","","0.1435","0.153","","","","","","1.057","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339355","7.8134","0.0012","25.3269","0.0019","8.4967","0.0015","90.02","0.01","112.672","0.014","90.02","0.01","1551.5","0.4","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 Cl2 N10 -","- C12 H14 Cl2 N10 -","- C48 H56 Cl8 N40 -","4","1","","Garcia-Raso, Angel; Albertí, Francisca M; Fiol, Juan J.; Tasada, Andres; Barceló-Oliver, Miquel; Molins, Elies; Escudero, Daniel; Frontera, Antonio; Quiñonero, David; Deyà, Pere M","Anion-pi interactions in bisadenine derivatives: a combined crystallographic and theoretical study.","Inorganic chemistry","2007","46","25","10724","10735","10.1021/ic701555n","","x-ray","0.71073","MoKα","","0.0787","0.0446","","","0.1178","0.128","","","","","","1.058","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339356","11.83","0.003","12.385","0.003","12.462","0.003","106.34","0.03","94.32","0.03","93.73","0.03","1740","0.8","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H52 Al N2 O3 P S -","- C33 H52 Al N2 O3 P S -","- C66 H104 Al2 N4 O6 P2 S2 -","2","1","","Gómora-Figueroa, A Paulina; Jancik, Vojtech; Cea-Olivares, Raymundo; Toscano, Rubén A","An unknown coordination mode of the phosphite unit and a carbon-free heterocycle in two different heterobimetallic alumophosphites.","Inorganic chemistry","2007","46","25","10749","10753","10.1021/ic701614c","","","0.71073","MoKα","","0.0634","0.0521","","","0.1309","0.1385","","","","","","1.035","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4339357","27.446","0.005","16.854","0.003","16.243","0.003","90","","110.82","0.03","90","","7023","3","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C66 H102 Al2 Li2 N4 O6 P2 S2 -","- C66 H102 Al2 Li2 N4 O6 P2 S2 -","- C264 H408 Al8 Li8 N16 O24 P8 S8 -","4","0.5","","Gómora-Figueroa, A Paulina; Jancik, Vojtech; Cea-Olivares, Raymundo; Toscano, Rubén A","An unknown coordination mode of the phosphite unit and a carbon-free heterocycle in two different heterobimetallic alumophosphites.","Inorganic chemistry","2007","46","25","10749","10753","10.1021/ic701614c","","","0.71073","MoKα","","0.0751","0.0512","","","0.1164","0.1271","","","","","","1.041","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4339358","13.004","0.003","15.672","0.004","24.766","0.005","100.03","0.03","99.04","0.03","110.02","0.03","4540","2","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C90.5 H130 Al2 N4 O6 P2 S2 Zn -","- C90.5 H130 Al2 N4 O6 P2 S2 Zn -","- C181 H260 Al4 N8 O12 P4 S4 Zn2 -","2","1","","Gómora-Figueroa, A Paulina; Jancik, Vojtech; Cea-Olivares, Raymundo; Toscano, Rubén A","An unknown coordination mode of the phosphite unit and a carbon-free heterocycle in two different heterobimetallic alumophosphites.","Inorganic chemistry","2007","46","25","10749","10753","10.1021/ic701614c","","","0.71073","MoKα","","0.0731","0.0507","","","0.1148","0.1253","","","","","","1.018","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339359","33.349","0.005","4.8461","0.0007","13.0752","0.0017","90","","105.651","0.003","90","","2034.8","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","CdI2(PEA)2","CdI2(PEA)2","","- C16 H22 Cd I2 N2 -","- C16 H22 Cd I2 N2 -","- C64 H88 Cd4 I8 N8 -","4","0.5","","Wang, Wei; Qiao, Juan; Wang, Liduo; Duan, Lian; Zhang, Deqiang; Yang, Weitao; Qiu, Yong","Synthesis, structures, and optical properties of cadmium iodide/phenethylamine hybrid materials with controlled structures and emissions.","Inorganic chemistry","2007","46","24","10252","10260","10.1021/ic7007304","","","0.71073","MoKα","","0.0466","0.0424","","","0.1069","0.1104","","","","","","1.065","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339360","31.4243","0.0019","12.4831","0.0007","8.9912","0.0006","90","","96.043","0.001","90","","3507.4","0.4","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","CdI2(PEA)4","CdI2(PEA)4","","- C32 H44 Cd I2 N4 -","- C32 H44 Cd I2 N4 -","- C128 H176 Cd4 I8 N16 -","4","0.5","","Wang, Wei; Qiao, Juan; Wang, Liduo; Duan, Lian; Zhang, Deqiang; Yang, Weitao; Qiu, Yong","Synthesis, structures, and optical properties of cadmium iodide/phenethylamine hybrid materials with controlled structures and emissions.","Inorganic chemistry","2007","46","24","10252","10260","10.1021/ic7007304","","","0.71073","MoKα","","0.0499","0.0408","","","0.0994","0.1065","","","","","","1.034","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339361","29.832","0.003","5.1368","0.0005","27.674","0.003","90","","111.035","0.002","90","","3958.2","0.7","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[CdI2(PEA)2](CdS)0.038","[CdI2(PEA)2](CdS)0.038","","- C16 H22 Cd I2 N2 -","- C16 H22 Cd I2 N2 -","- C128 H176 Cd8 I16 N16 -","8","1","","Wang, Wei; Qiao, Juan; Wang, Liduo; Duan, Lian; Zhang, Deqiang; Yang, Weitao; Qiu, Yong","Synthesis, structures, and optical properties of cadmium iodide/phenethylamine hybrid materials with controlled structures and emissions.","Inorganic chemistry","2007","46","24","10252","10260","10.1021/ic7007304","","","0.71073","MoKα","","0.0755","0.0499","","","0.139","0.1534","","","","","","1.025","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339362","14.0427","0.0009","9.7998","0.0006","26.4633","0.0018","90","","94.238","0.002","90","","3631.8","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H30 N6 Pb S2 -","- C42 H30 N6 Pb S2 -","- C168 H120 N24 Pb4 S8 -","4","1","","Calatayud, David G.; López-Torres, Elena; Mendiola, M. Antonia","Diphenyllead(IV) chloride complexes with benzilthiosemicarbazones. The first bis(thiosemicarbazone) derivatives.","Inorganic chemistry","2007","46","24","10434","10443","10.1021/ic701490j","","","1.54178","CuKα","","0.0257","0.0243","","","0.0588","0.0596","","","","","","1.052","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339363","12.8952","0.0002","9.6592","0.0002","24.3891","0.0005","90","","103.167","0.0008","90","","2957.98","0.1","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H30 N6 O Pb S2 -","- C30 H30 N6 O Pb S2 -","- C120 H120 N24 O4 Pb4 S8 -","4","1","","Calatayud, David G.; López-Torres, Elena; Mendiola, M. Antonia","Diphenyllead(IV) chloride complexes with benzilthiosemicarbazones. The first bis(thiosemicarbazone) derivatives.","Inorganic chemistry","2007","46","24","10434","10443","10.1021/ic701490j","","","0.71073","MoKα","","0.0528","0.0313","","0.0462","0.0357","0.0357","","","","","","1.0618","","","","has coordinates","269108","2021-09-13","08:22:43",""
"4339364","17.3952","0.0002","18.426","0.0002","18.8946","0.0002","90","","90","","90","","6056.17","0.12","298","2","298","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C28 H31 Cl N6 O3 Pb S2 -","- C28 H25 Cl N6 O3 Pb S2 -","- C224 H200 Cl8 N48 O24 Pb8 S16 -","8","1","","Calatayud, David G.; López-Torres, Elena; Mendiola, M. Antonia","Diphenyllead(IV) chloride complexes with benzilthiosemicarbazones. The first bis(thiosemicarbazone) derivatives.","Inorganic chemistry","2007","46","24","10434","10443","10.1021/ic701490j","","","1.54178","CuKα","","0.0452","0.0308","","","0.0714","0.0793","","","","","","1.026","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339365","10.519","0.001","18.028","0.001","13.746","0.001","90","","92.89","0.001","90","","2603.4","0.3","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H28 Br2 Ni O P2 -","- C27 H28 Br2 Ni O P2 -","- C108 H112 Br8 Ni4 O4 P8 -","4","1","","Mora, Guilhem; van Zutphen, Steven; Klemps, Christian; Ricard, Louis; Jean, Yves; Le Floch, Pascal","Synthesis, X-ray, and electronic structures of a new nickel dibromide complex. Activity in the regioselective catalyzed dimerization of ethylene into 1-butene.","Inorganic chemistry","2007","46","24","10365","10371","10.1021/ic701529a","","","0.71069","MoKα","","0.0488","0.0287","","","0.0635","0.0689","","","","","","0.996","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339366","9.504","0.001","10.503","0.001","19.6","0.001","84.716","0.001","89.498","0.001","74.856","0.001","1880.3","0.3","150","0.1","150","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C43 H37 Br2 Cl Ni O P2 -","- C43 H37 Br2 Cl Ni O P2 -","- C86 H74 Br4 Cl2 Ni2 O2 P4 -","2","1","","Mora, Guilhem; van Zutphen, Steven; Klemps, Christian; Ricard, Louis; Jean, Yves; Le Floch, Pascal","Synthesis, X-ray, and electronic structures of a new nickel dibromide complex. Activity in the regioselective catalyzed dimerization of ethylene into 1-butene.","Inorganic chemistry","2007","46","24","10365","10371","10.1021/ic701529a","","","0.71069","MoKα","","0.0808","0.0409","","","0.0811","0.0921","","","","","","0.975","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339367","10.365","0.001","14.121","0.001","32.753","0.001","90","","90","","90","","4793.9","0.6","150","0.1","150","0.1","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C24 H26 Br2 Ni P2 -","- C24 H26 Br2 Ni P2 -","- C192 H208 Br16 Ni8 P16 -","8","1","","Mora, Guilhem; van Zutphen, Steven; Klemps, Christian; Ricard, Louis; Jean, Yves; Le Floch, Pascal","Synthesis, X-ray, and electronic structures of a new nickel dibromide complex. Activity in the regioselective catalyzed dimerization of ethylene into 1-butene.","Inorganic chemistry","2007","46","24","10365","10371","10.1021/ic701529a","","","0.71069","MoKα","","0.0398","0.0298","","","0.0568","0.0597","","","","","","1.013","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339368","10.9084","0.0008","13.1056","0.001","17.8439","0.0014","69.628","0.001","73.219","0.001","88.869","0.001","2280.3","0.3","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- Ca4 Cu4 O112 Si2 W16 -","- Ca4 Cu4 O112 Si2 W16 -","- Ca4 Cu4 O112 Si2 W16 -","1","0.5","","Liu, Hongsheng; Gómez-García, Carlos J; Peng, Jun; Feng, Yuhua; Su, Zhongmin; Sha, Jingquan; Wang, Lixia","Ferromagnetically coupled dimer of Cu(II)-substituted gamma-decatungstosilicate.","Inorganic chemistry","2007","46","24","10041","10043","10.1021/ic701296m","","","0.71073","MoKα","","0.0755","0.0675","","","0.1778","0.1854","","","","","","1.1","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339369","17.965","0.008","10.722","0.005","21.757","0.009","90","","101.943","0.006","90","","4100","3","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- Cu4 H0 Na8 O90 Si2 W16 -","- Cu4 Na8 O90 Si2 W16 -","- Cu8 Na16 O180 Si4 W32 -","2","0.5","","Liu, Hongsheng; Gómez-García, Carlos J; Peng, Jun; Feng, Yuhua; Su, Zhongmin; Sha, Jingquan; Wang, Lixia","Ferromagnetically coupled dimer of Cu(II)-substituted gamma-decatungstosilicate.","Inorganic chemistry","2007","46","24","10041","10043","10.1021/ic701296m","","","0.71073","MoKα","","0.1085","0.077","","","0.1789","0.1964","","","","","","1.003","","","","has coordinates","286259","2023-09-07","06:04:45",""
"4339370","10.8635","0.0012","19.81","0.002","18.502","0.002","90","","90.774","0.002","90","","3981.4","0.7","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- Cu4 K8 O92 Si2 W16 -","- Cu4 K8 O92 Si2 W16 -","- Cu8 K16 O184 Si4 W32 -","2","0.5","","Liu, Hongsheng; Gómez-García, Carlos J; Peng, Jun; Feng, Yuhua; Su, Zhongmin; Sha, Jingquan; Wang, Lixia","Ferromagnetically coupled dimer of Cu(II)-substituted gamma-decatungstosilicate.","Inorganic chemistry","2007","46","24","10041","10043","10.1021/ic701296m","","","0.71073","MoKα","","0.1287","0.0759","","","0.1982","0.2343","","","","","","1.149","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339371","12.311","0.003","22.651","0.006","5.4896","0.0014","90","","109.366","0.006","90","","1444.2","0.6","273","2","273","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- H4 Na O14 Re3 U -","- Na O17 Re3 U -","- Na4 O68 Re12 U4 -","4","0.5","","Karimova, Oxana V.; Burns, Peter C.","Structural units in three uranyl perrhenates.","Inorganic chemistry","2007","46","24","10108","10113","10.1021/ic701128b","","","0.71073","MoKα","","0.0639","0.0402","","","0.073","0.0767","","","","","","0.778","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339372","7.8844","0.0012","11.4429","0.0018","16.976","0.003","83.195","0.004","89.387","0.004","85.289","0.004","1515.7","0.4","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- H28 O33 Re2 U4 -","- O33 Re2 U4 -","- O66 Re4 U8 -","2","1","","Karimova, Oxana V.; Burns, Peter C.","Structural units in three uranyl perrhenates.","Inorganic chemistry","2007","46","24","10108","10113","10.1021/ic701128b","","","0.71073","MoKα","","0.1494","0.0559","","","0.0784","0.0911","","","","","","0.847","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339373","5.2771","0.0007","13.0997","0.0017","15.476","0.002","107.18","0.002","99.131","0.003","94.114","0.002","1001.1","0.2","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- H6 O23 Re4 U2 -","- O23 Re4 U2 -","- O46 Re8 U4 -","2","1","","Karimova, Oxana V.; Burns, Peter C.","Structural units in three uranyl perrhenates.","Inorganic chemistry","2007","46","24","10108","10113","10.1021/ic701128b","","","0.71073","MoKα","","0.0597","0.0372","","","0.0602","0.0638","","","","","","0.809","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339374","67.645","0.01","67.645","0.01","21.559","0.004","90","","90","","120","","85434","2","100","2","100","2","","","","","","","","7","P -3","-P 3","147","","","","- C318 H306 Cl18 Cu9 N72 O123 S14 -","- C315 Cl11 Cu9 N72 O94 S14 -","- C1890 Cl66 Cu54 N432 O564 S84 -","6","1","","Park, Jaejoon; Hong, Seunghee; Moon, Dohyun; Park, Mira; Lee, Kyungjin; Kang, Sangmi; Zou, Yang; John, Rohith P.; Kim, Ghyung Hwa; Lah, Myoung Soo","Porous metal-organic frameworks based on metal-organic polyhedra with nanosized cavities as supramolecular building blocks: two-fold interpenetrating primitive cubic networks of [Cu6L8]12+ nanocages.","Inorganic chemistry","2007","46","24","10208","10213","10.1021/ic7013623","","","0.7","?synchrotronsynchrotron","","0.2092","0.1307","","","0.3274","0.3634","","","","","","0.852","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339375","40.65","0.008","26.67","0.005","43.877","0.009","90","","110.02","0.03","90","","44694","17","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C228 H221 Cl12 Cu6 N48 O79 S5 -","- C228 H194 Cu6 N48 O31 S5 -","- C912 H776 Cu24 N192 O124 S20 -","4","0.5","","Park, Jaejoon; Hong, Seunghee; Moon, Dohyun; Park, Mira; Lee, Kyungjin; Kang, Sangmi; Zou, Yang; John, Rohith P.; Kim, Ghyung Hwa; Lah, Myoung Soo","Porous metal-organic frameworks based on metal-organic polyhedra with nanosized cavities as supramolecular building blocks: two-fold interpenetrating primitive cubic networks of [Cu6L8]12+ nanocages.","Inorganic chemistry","2007","46","24","10208","10213","10.1021/ic7013623","","","0.7","synchrotron","","0.1167","0.0791","","","0.2012","0.2163","","","","","","0.927","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339376","26.36","0.005","35.07","0.007","38.697","0.008","90","","90","","90","","35773","12","86","2","86","2","","","","","","","","6","C c c a :2","-C 2a 2ac","68","","","","- C200 H168 Cu6 N60 O64 S4 -","- C200 H168 Cu6 N53 O43 S4 -","- C800 H672 Cu24 N212 O172 S16 -","4","0.25","","Park, Jaejoon; Hong, Seunghee; Moon, Dohyun; Park, Mira; Lee, Kyungjin; Kang, Sangmi; Zou, Yang; John, Rohith P.; Kim, Ghyung Hwa; Lah, Myoung Soo","Porous metal-organic frameworks based on metal-organic polyhedra with nanosized cavities as supramolecular building blocks: two-fold interpenetrating primitive cubic networks of [Cu6L8]12+ nanocages.","Inorganic chemistry","2007","46","24","10208","10213","10.1021/ic7013623","","","0.7","synchrotron","","0.099","0.0818","","","0.2454","0.2598","","","","","","1.02","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339377","55.983","0.007","55.983","0.007","55.983","0.007","90","","90","","90","","175456","4","100","2","100","2","","","","","","","","5","F -4 3 c","F -4a 2 3","219","","","","- C432 H384 Cu12 N120 O120 -","- C432 H384 Cu12 N120 O120 -","- C3456 H3072 Cu96 N960 O960 -","8","0.0833333","","Park, Jaejoon; Hong, Seunghee; Moon, Dohyun; Park, Mira; Lee, Kyungjin; Kang, Sangmi; Zou, Yang; John, Rohith P.; Kim, Ghyung Hwa; Lah, Myoung Soo","Porous metal-organic frameworks based on metal-organic polyhedra with nanosized cavities as supramolecular building blocks: two-fold interpenetrating primitive cubic networks of [Cu6L8]12+ nanocages.","Inorganic chemistry","2007","46","24","10208","10213","10.1021/ic7013623","","","0.74999","synchrotron","","0.079","0.0659","","","0.2001","0.2091","","","","","","1.029","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339378","21.657","0.003","16.618","0.002","14.12","0.002","90","","98.679","0.003","90","","5023.5","1.2","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H44 La2 N26 O35 -","- C30 H42 La2 N26 O35 -","- C120 H168 La8 N104 O140 -","4","0.5","","Liu, Jing-Xin; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","Interesting anion-inclusion behavior of cucurbit[5]uril and its lanthanide-capped molecular capsule.","Inorganic chemistry","2007","46","24","10168","10173","10.1021/ic701236v","","","0.71073","MoKα","","0.041","0.0393","","","0.0995","0.1007","","","","","","1.08","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339379","14.777","0.005","17.19","0.005","22.242","0.007","90","","107.018","0.009","90","","5402","3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H52 Cl3 La2 N23 O30 -","- C30 H30 Cl3 La2 N23 O30 -","- C120 H120 Cl12 La8 N92 O120 -","4","1","","Liu, Jing-Xin; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","Interesting anion-inclusion behavior of cucurbit[5]uril and its lanthanide-capped molecular capsule.","Inorganic chemistry","2007","46","24","10168","10173","10.1021/ic701236v","","","0.71073","MoKα","","0.1077","0.0967","","","0.2408","0.2495","","","","","","1.09","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339380","10.8161","0.0001","10.8161","0.0001","9.7482","0.0001","90","","90","","120","","987.635","0.016","295","2","295","2","","","","","","","","7","P 31 2 1","P 31 2""","152","","","","- C9 H6 Ag F3 N4 O3 S -","- C9 H6 Ag F3 N4 O3 S -","- C27 H18 Ag3 F9 N12 O9 S3 -","3","0.5","","Luo, Tzuoo-Tsair; Liu, Yen-Hsiang; Chan, Chun-Chieh; Huang, Sheng-Ming; Chang, Bor-Chen; Lu, Yi-Long; Lee, Gene-Hsiang; Peng, Shih-Ming; Wang, Ju-Chun; Lu, Kuang-Lieh","Toward quartz and cristobalite: spontaneous resolution, structures, and characterization of chiral silica-mimetic silver(I)-organic materials.","Inorganic chemistry","2007","46","24","10044","10046","10.1021/ic701412q","","","0.71073","MoKα","","0.0484","0.0399","","","0.0954","0.0989","","","","","","1.052","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339381","17.236","0.0017","9.1835","0.0009","15.478","0.0016","90","","90","","90","","2450","0.4","293","2","293","2","","","","","","","synthesis as described","6","F d d 2","F 2 -2d","43","","","","- C8 H6 Ag F6 N4 P -","- C8 H6 Ag F6 N4 P -","- C64 H48 Ag8 F48 N32 P8 -","8","0.5","","Luo, Tzuoo-Tsair; Liu, Yen-Hsiang; Chan, Chun-Chieh; Huang, Sheng-Ming; Chang, Bor-Chen; Lu, Yi-Long; Lee, Gene-Hsiang; Peng, Shih-Ming; Wang, Ju-Chun; Lu, Kuang-Lieh","Toward quartz and cristobalite: spontaneous resolution, structures, and characterization of chiral silica-mimetic silver(I)-organic materials.","Inorganic chemistry","2007","46","24","10044","10046","10.1021/ic701412q","","x-ray","0.71073","MoKα","","0.0242","0.024","","","0.061","0.0611","","","","","","1.119","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339382","12.2604","0.0012","17.617","0.0017","20.0356","0.0019","90","","92.308","0.002","90","","4324","0.7","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Fe2(Tol)2(Ph,Xyl)2(THF)2]2CH2Cl2","","","- C94 H88 Cl4 Fe2 O10 -","- C94 H88 Cl4 Fe2 O10 -","- C188 H176 Cl8 Fe4 O20 -","2","0.5","","Reisner, Erwin; Abikoff, Tanya C.; Lippard, Stephen J.","Influence of steric hindrance on the core geometry and sulfoxidation chemistry of carboxylate-rich diiron(II) complexes.","Inorganic chemistry","2007","46","24","10229","10240","10.1021/ic7014176","","","0.71073","MoKα","","0.0791","0.0617","","","0.1741","0.1861","","","","","","1.082","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339383","12.9614","0.0019","23.089","0.003","13.1367","0.0019","90","","99.373","0.002","90","","3878.9","0.9","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Fe2(Ph,Xyl)4(THF)2]1/2CH2Cl2","","","- C92.5 H85 Cl Fe2 O10 -","- C92.5 H85 Cl Fe2 O10 -","- C185 H170 Cl2 Fe4 O20 -","2","0.5","","Reisner, Erwin; Abikoff, Tanya C.; Lippard, Stephen J.","Influence of steric hindrance on the core geometry and sulfoxidation chemistry of carboxylate-rich diiron(II) complexes.","Inorganic chemistry","2007","46","24","10229","10240","10.1021/ic7014176","","","0.71073","MoKα","","0.0676","0.0594","","","0.1337","0.1374","","","","","","1.193","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339384","12.313","0.004","17.466","0.006","20.457","0.007","90","","93.745","0.005","90","","4390","3","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Fe2(m-Tol)2(Ph,Xyl)2(py)2]4CH2Cl2","","","- C98 H86 Cl8 Fe2 N2 O8 -","- C98 H86 Cl8 Fe2 N2 O8 -","- C196 H172 Cl16 Fe4 N4 O16 -","2","0.5","","Reisner, Erwin; Abikoff, Tanya C.; Lippard, Stephen J.","Influence of steric hindrance on the core geometry and sulfoxidation chemistry of carboxylate-rich diiron(II) complexes.","Inorganic chemistry","2007","46","24","10229","10240","10.1021/ic7014176","","","0.71073","MoKα","","0.0787","0.0618","","","0.1313","0.1386","","","","","","1.098","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339385","11.707","0.003","14.289","0.004","24.133","0.006","93.286","0.005","95.981","0.005","111.166","0.004","3724.5","1.7","110","2","110","2","","","","","","","","5","P -1","-P 1","2","[Fe2(Ph,Xyl)4(py)2]","","","- C94 H78 Fe2 N2 O8 -","- C94 H78 Fe2 N2 O8 -","- C188 H156 Fe4 N4 O16 -","2","1","","Reisner, Erwin; Abikoff, Tanya C.; Lippard, Stephen J.","Influence of steric hindrance on the core geometry and sulfoxidation chemistry of carboxylate-rich diiron(II) complexes.","Inorganic chemistry","2007","46","24","10229","10240","10.1021/ic7014176","","","0.71073","MoKα","","0.1021","0.0626","","","0.1154","0.1285","","","","","","1.052","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339386","12.9047","0.0007","27.1966","0.0015","23.0779","0.0013","90","","92.613","0.001","90","","8091.1","0.8","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Fe2(O2CArTol)4(MeSCH2py)]CH2Cl2Et2O","","","- C96 H89 Cl2 Fe2 N O9 S -","- C96 H89 Cl2 Fe2 N O9 S -","- C384 H356 Cl8 Fe8 N4 O36 S4 -","4","1","","Reisner, Erwin; Abikoff, Tanya C.; Lippard, Stephen J.","Influence of steric hindrance on the core geometry and sulfoxidation chemistry of carboxylate-rich diiron(II) complexes.","Inorganic chemistry","2007","46","24","10229","10240","10.1021/ic7014176","","","0.71073","MoKα","","0.0778","0.0557","","","0.1219","0.1327","","","","","","1.049","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339387","12.9053","0.001","26.771","0.002","23.6564","0.0019","90","","94.139","0.001","90","","8151.7","1.1","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Fe2(O2CArTol)4(pyCH2SEt)]","","","- C94 H83 Cl4 Fe2 N O8 S -","- C94 H83 Cl4 Fe2 N O8 S -","- C376 H332 Cl16 Fe8 N4 O32 S4 -","4","1","","Reisner, Erwin; Abikoff, Tanya C.; Lippard, Stephen J.","Influence of steric hindrance on the core geometry and sulfoxidation chemistry of carboxylate-rich diiron(II) complexes.","Inorganic chemistry","2007","46","24","10229","10240","10.1021/ic7014176","","","0.71073","MoKα","","0.105","0.0811","","","0.1683","0.1794","","","","","","1.153","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339388","25.1545","0.0018","25.3801","0.0017","13.7159","0.0009","90","","90","","90","","8756.6","1","173","2","173","2","","","","","","","","7","P 21 21 2","P 2 2ab","18","[Fe2(O2CArTol)4(tBuSCH2py)]C6H5Cl1/4pentane","","","- C101.25 H91 Cl Fe2 N O8 S -","- C101.25 H91 Cl Fe2 N O8 S -","- C405 H364 Cl4 Fe8 N4 O32 S4 -","4","1","","Reisner, Erwin; Abikoff, Tanya C.; Lippard, Stephen J.","Influence of steric hindrance on the core geometry and sulfoxidation chemistry of carboxylate-rich diiron(II) complexes.","Inorganic chemistry","2007","46","24","10229","10240","10.1021/ic7014176","","","0.71073","MoKα","","0.0703","0.0597","","","0.152","0.1598","","","","","","1.094","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339389","16.5043","0.001","26.2368","0.0015","21.0392","0.0012","90","","96.019","0.001","90","","9060.2","0.9","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","[Fe2(O2CArTol)4(pyCH2SPh)]","","","- C100.5 H84.5 Cl3.5 Fe2 N O8 S -","- C100.5 H84.5 Cl3.5 Fe2 N O8 S -","- C402 H338 Cl14 Fe8 N4 O32 S4 -","4","1","","Reisner, Erwin; Abikoff, Tanya C.; Lippard, Stephen J.","Influence of steric hindrance on the core geometry and sulfoxidation chemistry of carboxylate-rich diiron(II) complexes.","Inorganic chemistry","2007","46","24","10229","10240","10.1021/ic7014176","","","0.71073","MoKα","","0.1193","0.0746","","","0.1979","0.2272","","","","","","1.035","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339390","24.7949","0.0018","26.2886","0.0019","13.7704","0.001","90","","90","","90","","8975.9","1.1","173","2","173","2","","","","","","","","7","P 21 21 2","P 2 2ab","18","[Fe2(O2CArTol)4(MesPhSCH2py)]","","","- C105 H90 Cl Fe2 N O8 S -","- C105 H90 Cl Fe2 N O8 S -","- C420 H360 Cl4 Fe8 N4 O32 S4 -","4","1","","Reisner, Erwin; Abikoff, Tanya C.; Lippard, Stephen J.","Influence of steric hindrance on the core geometry and sulfoxidation chemistry of carboxylate-rich diiron(II) complexes.","Inorganic chemistry","2007","46","24","10229","10240","10.1021/ic7014176","","","0.71073","MoKα","","0.0722","0.0538","","","0.1256","0.1367","","","","","","1.054","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339391","12.8583","0.0008","15.4052","0.001","27.3385","0.0018","88.872","0.001","78.052","0.001","71.666","0.001","5023.1","0.6","153","2","153","2","","","","","","","","7","P -1","-P 1","2","[Fe2(O2CArTol)4(iPr3PhSCH2py)]","","","- C119.5 H113 Cl2 Fe2 N O8 S -","- C119.5 H113 Cl2 Fe2 N O8 S -","- C239 H226 Cl4 Fe4 N2 O16 S2 -","2","1","","Reisner, Erwin; Abikoff, Tanya C.; Lippard, Stephen J.","Influence of steric hindrance on the core geometry and sulfoxidation chemistry of carboxylate-rich diiron(II) complexes.","Inorganic chemistry","2007","46","24","10229","10240","10.1021/ic7014176","","","0.71073","MoKα","","0.0733","0.0585","","","0.1535","0.164","","","","","","1.085","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339392","19.538","0.019","14.946","0.015","35.12","0.03","90","","105.542","0.018","90","","9881","16","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Fe2(O2CArXyl,Ph)4(pyCH2SMes)]","","","- C106.25 H93 Cl Fe2 N O8 S -","- C106.25 H93 Cl Fe2 N O8 S -","- C425 H372 Cl4 Fe8 N4 O32 S4 -","4","1","","Reisner, Erwin; Abikoff, Tanya C.; Lippard, Stephen J.","Influence of steric hindrance on the core geometry and sulfoxidation chemistry of carboxylate-rich diiron(II) complexes.","Inorganic chemistry","2007","46","24","10229","10240","10.1021/ic7014176","","","0.71073","MoKα","","0.1043","0.0858","","","0.2485","0.2638","","","","","","1.089","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339393","12.9375","0.0011","26.992","0.002","23.441","0.002","90","","93.893","0.002","90","","8166.9","1.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Fe2(O2CArTol)4(pyCH2OEt)","","","- C96 H88.5 Cl2 Fe2 N O9.75 -","- C96 H88.5 Cl2 Fe2 N O9.75 -","- C384 H354 Cl8 Fe8 N4 O39 -","4","1","","Reisner, Erwin; Abikoff, Tanya C.; Lippard, Stephen J.","Influence of steric hindrance on the core geometry and sulfoxidation chemistry of carboxylate-rich diiron(II) complexes.","Inorganic chemistry","2007","46","24","10229","10240","10.1021/ic7014176","","","0.71073","MoKα","","0.0978","0.0676","","","0.1519","0.1662","","","","","","1.071","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339394","14.0067","0.0002","22.8399","0.0004","23.0701","0.0004","90","","90.64","","90","","7379.9","0.2","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C70 H83 Cl2 Li3 O11.5 Pr Si4 -","- C70 H83 Cl2 Li3 O11.5 Pr Si4 -","- C280 H332 Cl8 Li12 O46 Pr4 Si16 -","4","1","","Giessmann, Stephan; Blaurock, Steffen; Lorenz, Volker; Edelmann, Frank T.","Structural varieties in heterobimetallic lanthanide disiloxanediolates: ""inorganic metallocenes"" versus in-plane metallacrowns.","Inorganic chemistry","2007","46","24","10383","10389","10.1021/ic701227n","","","0.71073","MoKα","","0.0535","0.0415","","","0.1162","0.1246","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339395","17.0335","0.0019","20.649","0.002","35.785","0.004","90","","90","","90","","12586","2","210","2","210","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C60 H69.29 Cl Li2 O11.64 Sc Si4 -","- C60 H69.196 Cl Li2 O11.598 Sc Si4 -","- C480 H553.568 Cl8 Li16 O92.784 Sc8 Si32 -","8","1","","Giessmann, Stephan; Blaurock, Steffen; Lorenz, Volker; Edelmann, Frank T.","Structural varieties in heterobimetallic lanthanide disiloxanediolates: ""inorganic metallocenes"" versus in-plane metallacrowns.","Inorganic chemistry","2007","46","24","10383","10389","10.1021/ic701227n","","","0.71073","MoKα","","0.0775","0.0528","","","0.1263","0.14","","","","","","1.009","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339396","13.0818","0.0006","17.1151","0.0008","17.1817","0.0008","90","","92.599","0.001","90","","3843","0.3","210","2","210","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C72 H83 Cl Li2 O12 Si4 Y -","- C72 H83 Cl Li2 O12 Si4 Y -","- C144 H166 Cl2 Li4 O24 Si8 Y2 -","2","0.5","","Giessmann, Stephan; Blaurock, Steffen; Lorenz, Volker; Edelmann, Frank T.","Structural varieties in heterobimetallic lanthanide disiloxanediolates: ""inorganic metallocenes"" versus in-plane metallacrowns.","Inorganic chemistry","2007","46","24","10383","10389","10.1021/ic701227n","","","0.71073","MoKα","","0.0743","0.0584","","","0.1802","0.1877","","","","","","1.057","","","","has coordinates,has disorder","179496","2020-10-21","18:00:00",""
"4339397","17.5599","0.0012","17.3036","0.0011","21.4873","0.0014","90","","99.681","0.002","90","","6435.9","0.7","210","2","210","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C60 H70 Cl Li2 O12 Pr Si4 -","- C60 H70 Cl Li2 O12 Pr Si4 -","- C240 H280 Cl4 Li8 O48 Pr4 Si16 -","4","1","","Giessmann, Stephan; Blaurock, Steffen; Lorenz, Volker; Edelmann, Frank T.","Structural varieties in heterobimetallic lanthanide disiloxanediolates: ""inorganic metallocenes"" versus in-plane metallacrowns.","Inorganic chemistry","2007","46","24","10383","10389","10.1021/ic701227n","","","0.71073","MoKα","","0.0434","0.0352","","","0.0901","0.0978","","","","","","0.995","","","","has coordinates","179496","2020-10-21","18:00:00",""
"4339398","9.937","0.002","13.082","0.003","15.677","0.004","90","","112.065","0.004","90","","1888.7","0.8","113.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H11 Cl4 Ga N O2 -","- C18 H11 Cl4 Ga N O2 -","- C72 H44 Cl16 Ga4 N4 O8 -","4","1","","Kuratsu, Masato; Suzuki, Shuichi; Kozaki, Masatoshi; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Okada, Keiji","Magnetic interaction of tri- and di-oxytriphenylamine radical cation FeCl4 salts.","Inorganic chemistry","2007","46","24","10153","10157","10.1021/ic7012649","","","0.7107","MoKα","","","0.0369","","","","0.04","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339399","22.743","0.006","12.608","0.003","16.053","0.004","90","","129.009","0.003","90","","3576.8","1.6","113.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H9 Cl4 Fe N O3 -","- C18 H9 Cl4 Fe N O3 -","- C144 H72 Cl32 Fe8 N8 O24 -","8","1","","Kuratsu, Masato; Suzuki, Shuichi; Kozaki, Masatoshi; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Okada, Keiji","Magnetic interaction of tri- and di-oxytriphenylamine radical cation FeCl4 salts.","Inorganic chemistry","2007","46","24","10153","10157","10.1021/ic7012649","","","0.7107","MoKα","","","0.0414","","","","0.0441","","","","","","0.997","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339400","22.738","0.006","12.651","0.002","17.862","0.005","90","","135.614","0.005","90","","3594.1","1.5","113.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H9 Cl4 Ga N O3 -","- C18 H9 Cl4 Ga N O3 -","- C144 H72 Cl32 Ga8 N8 O24 -","8","1","","Kuratsu, Masato; Suzuki, Shuichi; Kozaki, Masatoshi; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Okada, Keiji","Magnetic interaction of tri- and di-oxytriphenylamine radical cation FeCl4 salts.","Inorganic chemistry","2007","46","24","10153","10157","10.1021/ic7012649","","","0.7107","MoKα","","","0.031","","","","0.0361","","","","","","0.991","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339401","9.9281","0.0019","13.089","0.002","15.659","0.003","90","","112.12","0.004","90","","1885.1","0.6","113.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H11 Cl4 Fe N O2 -","- C18 H11 Cl4 Fe N O2 -","- C72 H44 Cl16 Fe4 N4 O8 -","4","1","","Kuratsu, Masato; Suzuki, Shuichi; Kozaki, Masatoshi; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Okada, Keiji","Magnetic interaction of tri- and di-oxytriphenylamine radical cation FeCl4 salts.","Inorganic chemistry","2007","46","24","10153","10157","10.1021/ic7012649","","","0.7107","MoKα","","","0.0332","","","","0.0373","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339402","10.0836","0.0002","17.6001","0.0004","10.8606","0.0002","90","","101.386","0.001","90","","1889.52","0.07","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H52 Ca O4 P2 -","- C40 H52 Ca O4 P2 -","- C80 H104 Ca2 O8 P4 -","2","0.5","","Crimmin, Mark R.; Barrett, Anthony G. M.; Hill, Michael S.; Hitchcock, Peter B.; Procopiou, Panayiotis A.","Bis(diphenylphosphido) derivatives of the heavier group 2 elements.","Inorganic chemistry","2007","46","24","10410","10415","10.1021/ic701608x","","x-ray","0.71073","MoKα","","0.0447","0.0375","","","0.0983","0.1025","","","","","","1.07","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339403","11.7671","0.0002","16.0751","0.0004","20.9647","0.0005","90","","104.127","0.001","90","","3845.69","0.15","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H52 O4 P2 Sr -","- C40 H52 O4 P2 Sr -","- C160 H208 O16 P8 Sr4 -","4","1","","Crimmin, Mark R.; Barrett, Anthony G. M.; Hill, Michael S.; Hitchcock, Peter B.; Procopiou, Panayiotis A.","Bis(diphenylphosphido) derivatives of the heavier group 2 elements.","Inorganic chemistry","2007","46","24","10410","10415","10.1021/ic701608x","","x-ray","0.7107","MoKα","","0.0589","0.0384","","","0.079","0.0873","","","","","","1.009","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339404","35.9158","0.0006","13.0999","0.0002","21.9088","0.0003","90","","127.42","0.001","90","","8186.6","0.2","173","2","173","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C88 H92 Ba3 O4 P6 -","- C88 H92 Ba3 O4 P6 -","- C352 H368 Ba12 O16 P24 -","4","0.5","","Crimmin, Mark R.; Barrett, Anthony G. M.; Hill, Michael S.; Hitchcock, Peter B.; Procopiou, Panayiotis A.","Bis(diphenylphosphido) derivatives of the heavier group 2 elements.","Inorganic chemistry","2007","46","24","10410","10415","10.1021/ic701608x","","x-ray","0.71073","MoKα","","0.0424","0.03","","","0.0698","0.0767","","","","","","1.023","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339405","11.2163","0.0003","20.0617","0.0004","15.4639","0.0003","90","","90","","90","","3479.66","0.13","173","2","173","2","","","","","","","synthesis as described","5","P b c a","-P 2ac 2ab","61","","","","- C36 H44 Ca O6 P2 -","- C36 H44 Ca O6 P2 -","- C144 H176 Ca4 O24 P8 -","4","0.5","","Crimmin, Mark R.; Barrett, Anthony G. M.; Hill, Michael S.; Hitchcock, Peter B.; Procopiou, Panayiotis A.","Bis(diphenylphosphido) derivatives of the heavier group 2 elements.","Inorganic chemistry","2007","46","24","10410","10415","10.1021/ic701608x","","x-ray","0.71073","MoKα","","0.0564","0.0435","","","0.1036","0.1101","","","","","","1.048","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339406","16.7496","0.0003","12.5808","0.0002","17.1857","0.0003","90","","93.159","0.001","90","","3615.93","0.11","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H44 Ba O6 P2 -","- C36 H44 Ba O6 P2 -","- C144 H176 Ba4 O24 P8 -","4","1","","Crimmin, Mark R.; Barrett, Anthony G. M.; Hill, Michael S.; Hitchcock, Peter B.; Procopiou, Panayiotis A.","Bis(diphenylphosphido) derivatives of the heavier group 2 elements.","Inorganic chemistry","2007","46","24","10410","10415","10.1021/ic701608x","","x-ray","0.71073","MoKα","","0.0369","0.0277","","","0.0598","0.0638","","","","","","1.005","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339407","10.3774","0.0006","17.6034","0.001","19.9566","0.0011","90","","103.2","0.002","90","","3549.3","0.3","100","2","100","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C29 H49 B Cl F2 Fe K O7 Sn -","- C29 H49 B Cl F2 Fe K O7 Sn -","- C116 H196 B4 Cl4 F8 Fe4 K4 O28 Sn4 -","4","1","","Boshra, Ramez; Venkatasubbaiah, Krishnan; Doshi, Ami; Lalancette, Roger A.; Kakalis, Lazaros; Jäkle, Frieder","Simultaneous fluoride binding to ferrocene-based heteronuclear bidentate Lewis acids.","Inorganic chemistry","2007","46","24","10174","10186","10.1021/ic7013754","","","1.54178","CuKα","","0.0313","0.0304","","","0.0777","0.0783","","","","","","1.092","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339408","10.3893","0.0004","17.4752","0.0007","19.3552","0.0007","90","","101.217","0.001","90","","3446.9","0.2","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C29 H49 B F3 Fe K O7 Sn -","- C29 H49 B F3 Fe K O7 Sn -","- C116 H196 B4 F12 Fe4 K4 O28 Sn4 -","4","1","","Boshra, Ramez; Venkatasubbaiah, Krishnan; Doshi, Ami; Lalancette, Roger A.; Kakalis, Lazaros; Jäkle, Frieder","Simultaneous fluoride binding to ferrocene-based heteronuclear bidentate Lewis acids.","Inorganic chemistry","2007","46","24","10174","10186","10.1021/ic7013754","","","1.54178","CuKα","","0.0291","0.0282","","","0.0722","0.0728","","","","","","1.053","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339409","8.6339","0.0001","29.1021","0.0005","16.0961","0.0003","90","","104.561","0.001","90","","3914.48","0.11","100","2","100","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C35 H54 B Cl F Fe K O7 Sn -","- C35 H54 B Cl F Fe K O7 Sn -","- C140 H216 B4 Cl4 F4 Fe4 K4 O28 Sn4 -","4","1","","Boshra, Ramez; Venkatasubbaiah, Krishnan; Doshi, Ami; Lalancette, Roger A.; Kakalis, Lazaros; Jäkle, Frieder","Simultaneous fluoride binding to ferrocene-based heteronuclear bidentate Lewis acids.","Inorganic chemistry","2007","46","24","10174","10186","10.1021/ic7013754","","","1.54178","CuKα","","0.0336","0.0321","","","0.0827","0.0836","","","","","","1.044","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339410","8.2108","0.0008","14.6444","0.0014","16.845","0.0015","84.698","0.007","78.106","0.008","80.765","0.007","1952.6","0.3","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C35 H54 B F2 Fe K O7 Sn -","- C35 H54 B F2 Fe K O7 Sn -","- C70 H108 B2 F4 Fe2 K2 O14 Sn2 -","2","1","","Boshra, Ramez; Venkatasubbaiah, Krishnan; Doshi, Ami; Lalancette, Roger A.; Kakalis, Lazaros; Jäkle, Frieder","Simultaneous fluoride binding to ferrocene-based heteronuclear bidentate Lewis acids.","Inorganic chemistry","2007","46","24","10174","10186","10.1021/ic7013754","","","1.54178","CuKα","","0.0697","0.0585","","","0.145","0.1553","","","","","","1.024","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339411","30.9945","0.0003","8.4549","0.0001","19.7835","0.0002","90","","90","","90","","5184.37","0.09","100","2","100","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C23 H37 B F2 Fe K O6.5 -","- C23 H37 B F2 Fe K O6.5 -","- C184 H296 B8 F16 Fe8 K8 O52 -","8","2","","Boshra, Ramez; Venkatasubbaiah, Krishnan; Doshi, Ami; Lalancette, Roger A.; Kakalis, Lazaros; Jäkle, Frieder","Simultaneous fluoride binding to ferrocene-based heteronuclear bidentate Lewis acids.","Inorganic chemistry","2007","46","24","10174","10186","10.1021/ic7013754","","","1.54178","CuKα","","0.0307","0.0291","","","0.076","0.077","","","","","","1.03","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339412","8.5654","0.0003","15.0371","0.0005","23.227","0.0007","90","","98.132","0.002","90","","2961.53","0.17","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H41 B F Fe K O6 -","- C29 H41 B F Fe K O6 -","- C116 H164 B4 F4 Fe4 K4 O24 -","4","1","","Boshra, Ramez; Venkatasubbaiah, Krishnan; Doshi, Ami; Lalancette, Roger A.; Kakalis, Lazaros; Jäkle, Frieder","Simultaneous fluoride binding to ferrocene-based heteronuclear bidentate Lewis acids.","Inorganic chemistry","2007","46","24","10174","10186","10.1021/ic7013754","","","1.54178","CuKα","","0.0474","0.0452","","","0.1201","0.1215","","","","","","1.072","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339413","10.6644","0.0005","11.631","0.0005","12.9048","0.0006","89.406","0.001","89.39","0.001","66.021","0.001","1462.42","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H51 N3 O Ti Zr -","- C27 H51 N3 O Ti Zr -","- C54 H102 N6 O2 Ti2 Zr2 -","2","1","","Mandal, Swadhin K.; Gurubasavaraj, Prabhuodeyara M.; Roesky, Herbert W.; Schwab, Gerald; Stalke, Dietmar; Oswald, Rainer B.; Dolle, Volker","Oxygen-bridged hybrid metallocene-nonmetallocene polymetallic catalysts of group 4 metals for bimodal activity in olefin polymerization: synthesis, characterization, and theoretical investigation.","Inorganic chemistry","2007","46","24","10158","10167","10.1021/ic7011765","","","0.71073","MoKα","","0.0241","0.0226","","","0.063","0.0637","","","","","","1.088","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339414","14.8318","0.0008","18.7743","0.001","17.7562","0.0009","90","","111.051","0.001","90","","4614.4","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H78 Hf N2 O2 Zr2 -","- C46 H78 Hf N2 O2 Zr2 -","- C184 H312 Hf4 N8 O8 Zr8 -","4","1","","Mandal, Swadhin K.; Gurubasavaraj, Prabhuodeyara M.; Roesky, Herbert W.; Schwab, Gerald; Stalke, Dietmar; Oswald, Rainer B.; Dolle, Volker","Oxygen-bridged hybrid metallocene-nonmetallocene polymetallic catalysts of group 4 metals for bimodal activity in olefin polymerization: synthesis, characterization, and theoretical investigation.","Inorganic chemistry","2007","46","24","10158","10167","10.1021/ic7011765","","","0.71073","MoKα","","0.0234","0.022","","","0.0606","0.0613","","","","","","1.037","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339415","10.947","0.005","17.908","0.005","19.308","0.005","63.446","0.005","75.227","0.005","73.788","0.005","3213.6","1.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","MnNbPYZ","","","- C80 H100 Mn8 N56 Nb4 O28 -","- C80 H100 Mn8 N56 Nb4 O28 -","- C80 H100 Mn8 N56 Nb4 O28 -","1","0.5","","Podgajny, Robert; Pinkowicz, Dawid; Korzeniak, Tomasz; Nitek, Wojciech; Rams, Michał; Sieklucka, Barbara","High Tc ferrimagnetic organic-inorganic hybrid materials with MnII-L-MnII and MnII-NC-NbIV linkages (L=pyrazine, pyrazine-N,N'-dioxide, bipyrimidine).","Inorganic chemistry","2007","46","24","10416","10425","10.1021/ic7018132","","","0.71069","MoKα","","0.1133","0.0597","","","0.0977","0.1157","","","","","","1.047","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339416","15.875","0.005","15.061","0.005","12.052","0.005","90","","108.215","0.005","90","","2737.2","1.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Pin075","","","- C48 H96 Mn8 N40 Nb4 O52 -","- C48 H96 Mn8 N40 Nb4 O52 -","- C48 H96 Mn8 N40 Nb4 O52 -","1","0.125","","Podgajny, Robert; Pinkowicz, Dawid; Korzeniak, Tomasz; Nitek, Wojciech; Rams, Michał; Sieklucka, Barbara","High Tc ferrimagnetic organic-inorganic hybrid materials with MnII-L-MnII and MnII-NC-NbIV linkages (L=pyrazine, pyrazine-N,N'-dioxide, bipyrimidine).","Inorganic chemistry","2007","46","24","10416","10425","10.1021/ic7018132","","","0.71069","MoKα","","0.0842","0.0477","","","0.0915","0.1048","","","","","","1.046","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339417","14.713","0.005","12.731","0.005","12.249","0.005","90","0.005","103.298","0.005","90","0.005","2232.9","1.5","293","2","293","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","MnNbBpym","","","- C16 H10 Mn2 N12 Nb O2 -","- C16 H10 Mn2 N12 Nb O2 -","- C64 H40 Mn8 N48 Nb4 O8 -","4","0.5","","Podgajny, Robert; Pinkowicz, Dawid; Korzeniak, Tomasz; Nitek, Wojciech; Rams, Michał; Sieklucka, Barbara","High Tc ferrimagnetic organic-inorganic hybrid materials with MnII-L-MnII and MnII-NC-NbIV linkages (L=pyrazine, pyrazine-N,N'-dioxide, bipyrimidine).","Inorganic chemistry","2007","46","24","10416","10425","10.1021/ic7018132","","x-ray","0.71069","MoKα","","0.0488","0.0317","","","0.0678","0.0761","","","","","","1.102","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339418","15.544","0.002","12.0941","0.0017","16.539","0.002","90","","95.056","0.004","90","","3097.1","0.7","130","2","130","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C22 H52 Co N4 O2 P2 Si2 -","- C22 H52 Co N4 O2 P2 Si2 -","- C88 H208 Co4 N16 O8 P8 Si8 -","4","2","","Ingleson, Michael J.; Pink, Maren; Fan, Hongjun; Caulton, Kenneth G.","Exploring the reactivity of four-coordinate PNPCoX with access to three-coordinate spin triplet PNPCo.","Inorganic chemistry","2007","46","24","10321","10334","10.1021/ic701171p","","","0.71073","MoKα","","0.0421","0.0334","","","0.0747","0.0799","","","","","","1.021","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339419","15.1049","0.0008","12.3899","0.0007","31.1504","0.0017","90","","90","","90","","5829.7","0.6","130","2","130","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C23 H52 Co N O P2 Si2 -","- C23 H52 Co N O P2 Si2 -","- C184 H416 Co8 N8 O8 P16 Si16 -","8","1","","Ingleson, Michael J.; Pink, Maren; Fan, Hongjun; Caulton, Kenneth G.","Exploring the reactivity of four-coordinate PNPCoX with access to three-coordinate spin triplet PNPCo.","Inorganic chemistry","2007","46","24","10321","10334","10.1021/ic701171p","","","0.71073","MoKα","","0.0451","0.0289","","","0.0654","0.0736","","","","","","1.03","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339420","16.842","0.004","10.587","0.002","20.98","0.005","90","","107.7","0.006","90","","3563.8","1.4","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H62 Co N2 P2 Si2 -","- C30 H62 Co N2 P2 Si2 -","- C120 H248 Co4 N8 P8 Si8 -","4","1","","Ingleson, Michael J.; Pink, Maren; Fan, Hongjun; Caulton, Kenneth G.","Exploring the reactivity of four-coordinate PNPCoX with access to three-coordinate spin triplet PNPCo.","Inorganic chemistry","2007","46","24","10321","10334","10.1021/ic701171p","","","0.71073","MoKα","","0.0797","0.0421","","","0.0891","0.1032","","","","","","0.998","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339421","11.8366","0.0016","16.075","0.002","18.212","0.002","90","","102.677","0.003","90","","3380.8","0.7","120","2","120","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C23 H52 Co F3 N O3 P2 S Si2 -","- C23 H52 Co F3 N O3 P2 S Si2 -","- C92 H208 Co4 F12 N4 O12 P8 S4 Si8 -","4","1","","Ingleson, Michael J.; Pink, Maren; Fan, Hongjun; Caulton, Kenneth G.","Exploring the reactivity of four-coordinate PNPCoX with access to three-coordinate spin triplet PNPCo.","Inorganic chemistry","2007","46","24","10321","10334","10.1021/ic701171p","","","0.71073","MoKα","","0.0823","0.0449","","","0.0991","0.1209","","","","","","1.003","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339422","11.415","0.0012","15.151","0.0016","18.1427","0.0019","90","","101.281","0.003","90","","3077.1","0.6","130","2","130","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H52 Co I N P2 Si2 -","- C22 H52 Co I N P2 Si2 -","- C88 H208 Co4 I4 N4 P8 Si8 -","4","1","","Ingleson, Michael J.; Pink, Maren; Fan, Hongjun; Caulton, Kenneth G.","Exploring the reactivity of four-coordinate PNPCoX with access to three-coordinate spin triplet PNPCo.","Inorganic chemistry","2007","46","24","10321","10334","10.1021/ic701171p","","","0.71073","MoKα","","0.0246","0.0211","","","0.0507","0.053","","","","","","1.048","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339423","15.094","0.0006","12.507","0.0005","30.9","0.0011","90","","90","","90","","5833.3","0.4","130","2","130","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C22 H52 Cl Co N P2 Si2 -","- C22 H52 Cl Co N P2 Si2 -","- C176 H416 Cl8 Co8 N8 P16 Si16 -","8","1","","Ingleson, Michael J.; Pink, Maren; Fan, Hongjun; Caulton, Kenneth G.","Exploring the reactivity of four-coordinate PNPCoX with access to three-coordinate spin triplet PNPCo.","Inorganic chemistry","2007","46","24","10321","10334","10.1021/ic701171p","","","0.71073","MoKα","","0.0301","0.0239","","","0.059","0.064","","","","","","1.073","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339424","9.1128","0.0003","12.7164","0.0005","14.2182","0.0005","107.305","0.002","104.709","0.002","93.217","0.002","1505.96","0.1","183","2","183","2","","","","","","","","4","P -1","-P 1","2","(DIPP-nacnac)CaNH2.(NH3)2","","","- C29 H49 Ca N5 -","- C29 H49 Ca N5 -","- C58 H98 Ca2 N10 -","2","1","","Ruspic, Christian; Harder, Sjoerd","Big ligands for stabilization of small functionalities in calcium chemistry.","Inorganic chemistry","2007","46","24","10426","10433","10.1021/ic701479r","","","0.71073","MoKα","","0.044","0.039","","","0.1103","0.1146","","","","","","1.051","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339425","22.4227","0.0013","12.1193","0.0007","49.354","0.003","90","","94.15","0.003","90","","13376.7","1.4","203","2","203","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","(DIPP-nacnac)CaCl.(THF)","","","- C66 H98 Ca2 Cl2 N4 O2 -","- C66 H98 Ca2 Cl2 N4 O2 -","- C528 H784 Ca16 Cl16 N32 O16 -","8","1","","Ruspic, Christian; Harder, Sjoerd","Big ligands for stabilization of small functionalities in calcium chemistry.","Inorganic chemistry","2007","46","24","10426","10433","10.1021/ic701479r","","","0.71073","MoKα","","0.1074","0.0709","","","0.1832","0.2136","","","","","","1.033","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339426","12.5335","0.0003","27.9272","0.0007","16.6225","0.0004","90","","109.086","0.001","90","","5498.5","0.2","203","2","203","2","","","","","","","","5","P 1 21 1","P 2yb","4","[(DIPP-nacnac)CaCN.THF]3","","","- C114 H159 Ca3 N9 O3 -","- C114 H159 Ca3 N9 O3 -","- C228 H318 Ca6 N18 O6 -","2","1","","Ruspic, Christian; Harder, Sjoerd","Big ligands for stabilization of small functionalities in calcium chemistry.","Inorganic chemistry","2007","46","24","10426","10433","10.1021/ic701479r","","","0.71073","MoKα","","0.0704","0.0472","","","0.1063","0.1182","","","","","","1.024","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339427","26.424","0.01","13.426","0.005","17.042","0.007","90","","117.496","0.007","90","","5363","4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C45 H44 Cl8 Fe2 N8 O11 -","- C45 H44 Cl8 Fe2 N8 O11 -","- C180 H176 Cl32 Fe8 N32 O44 -","4","0.5","","Visvaganesan, Kusalendiran; Mayilmurugan, Ramasamy; Suresh, Eringathodi; Palaniandavar, Mallayan","Iron(III) complexes of tridentate 3N ligands as functional models for catechol dioxygenases: the role of ligand N-alkyl substitution and solvent on reaction rate and product selectivity.","Inorganic chemistry","2007","46","24","10294","10306","10.1021/ic700822y","","","0.71073","MoKα","","0.1602","0.0699","","","0.1216","0.1524","","","","","","0.952","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339428","14.008","0.0009","14.5023","0.0009","7.4663","0.0005","90","","90","","90","","1516.77","0.17","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C13 H15 Cl3 Fe N3 -","- C13 H15 Cl3 Fe N3 -","- C52 H60 Cl12 Fe4 N12 -","4","0.5","","Visvaganesan, Kusalendiran; Mayilmurugan, Ramasamy; Suresh, Eringathodi; Palaniandavar, Mallayan","Iron(III) complexes of tridentate 3N ligands as functional models for catechol dioxygenases: the role of ligand N-alkyl substitution and solvent on reaction rate and product selectivity.","Inorganic chemistry","2007","46","24","10294","10306","10.1021/ic700822y","","","0.71073","MoKα","","0.0223","0.0215","","","0.0582","0.0587","","","","","","1.088","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339429","11.7917","0.0013","11.6295","0.0013","14.0247","0.0015","90","","114.309","0.002","90","","1752.7","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H19 Cl3 Fe N3 -","- C15 H19 Cl3 Fe N3 -","- C60 H76 Cl12 Fe4 N12 -","4","1","","Visvaganesan, Kusalendiran; Mayilmurugan, Ramasamy; Suresh, Eringathodi; Palaniandavar, Mallayan","Iron(III) complexes of tridentate 3N ligands as functional models for catechol dioxygenases: the role of ligand N-alkyl substitution and solvent on reaction rate and product selectivity.","Inorganic chemistry","2007","46","24","10294","10306","10.1021/ic700822y","","","0.71073","MoKα","","0.103","0.0582","","","0.0976","0.1117","","","","","","0.972","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339430","16.984","0.003","7.628","0.001","28.302","0.005","90","0.005","98.151","0.003","90","0.005","3629.6","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H21 N3 O S -","- C19 H21 N3 O S -","- C152 H168 N24 O8 S8 -","8","2","","Gennari, Marcello; Lanfranchi, Maurizio; Cammi, Roberto; Pellinghelli, Maria Angela; Marchiò, Luciano","Mononuclear and polynuclear copper(I) complexes with a new N,N',S-donor ligand and with structural analogies to the copper thionein core.","Inorganic chemistry","2007","46","24","10143","10152","10.1021/ic701189b","","","0.71073","MoKα","","0.0911","0.0409","","","0.0841","0.0919","","","","","","1.006","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339431","12.43","0.009","20.105","0.009","14.665","0.008","90","","107.1","0.03","90","","3503","4","293","2","293","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C61 H69 B3 Cu3 F12 N11 O3 S3 -","- C61 H69 B3 Cu3 F12 N11 O3 S3 -","- C122 H138 B6 Cu6 F24 N22 O6 S6 -","2","1","","Gennari, Marcello; Lanfranchi, Maurizio; Cammi, Roberto; Pellinghelli, Maria Angela; Marchiò, Luciano","Mononuclear and polynuclear copper(I) complexes with a new N,N',S-donor ligand and with structural analogies to the copper thionein core.","Inorganic chemistry","2007","46","24","10143","10152","10.1021/ic701189b","","","0.71073","MoKα","","0.1436","0.0587","","","0.0675","0.0798","","","","","","0.892","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339432","10.431","0.001","12.378","0.001","15.213","0.002","78.13","0.01","78.95","0.01","70.41","0.01","1794.8","0.3","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C37 H36 B Cu F4 N3 O P S -","- C37 H36 B Cu F3.96 N3 O P S -","- C74 H72 B2 Cu2 F7.92 N6 O2 P2 S2 -","2","1","","Gennari, Marcello; Lanfranchi, Maurizio; Cammi, Roberto; Pellinghelli, Maria Angela; Marchiò, Luciano","Mononuclear and polynuclear copper(I) complexes with a new N,N',S-donor ligand and with structural analogies to the copper thionein core.","Inorganic chemistry","2007","46","24","10143","10152","10.1021/ic701189b","","","0.71073","MoKα","","0.0702","0.0357","","","0.0683","0.0736","","","","","","1.009","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339433","15.502","0.002","16.672","0.002","18.535","0.002","106.93","0.01","100.92","0.01","93.45","0.01","4465.7","1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C76 H45 Cu6 F30 N7 O2 S8 -","- C76 H45 Cu6 F30 N7 O2 S8 -","- C152 H90 Cu12 F60 N14 O4 S16 -","2","1","","Gennari, Marcello; Lanfranchi, Maurizio; Cammi, Roberto; Pellinghelli, Maria Angela; Marchiò, Luciano","Mononuclear and polynuclear copper(I) complexes with a new N,N',S-donor ligand and with structural analogies to the copper thionein core.","Inorganic chemistry","2007","46","24","10143","10152","10.1021/ic701189b","","","0.71073","MoKα","","0.2778","0.078","","","0.0843","0.0986","","","","","","0.979","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339434","9.0677","0.0006","15.221","0.001","15.8788","0.001","60.446","0.005","87.419","0.004","89.916","0.003","1904","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","[Ni(cyklam)]3 [W(CN)8]2","","- C46 H72 N28 Ni3 W2 -","- C46 H72 N28 Ni3 W2 -","- C46 H72 N28 Ni3 W2 -","1","0.5","","Nowicka, Beata; Rams, Michał; Stadnicka, Katarzyna; Sieklucka, Barbara","Reversible guest-induced magnetic and structural single-crystal-to-single-crystal transformation in microporous coordination network {[Ni(cyclam)]3[W(CN)8]2}n.","Inorganic chemistry","2007","46","20","8123","8125","10.1021/ic701168x","","","0.71073","MoKα","","0.0731","0.0519","","","0.1099","0.121","","","","","","1.021","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339435","8.727","0.0002","15.2575","0.0004","15.9146","0.0006","67.406","0.002","87.077","0.001","87.16","0.001","1952.85","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","[Ni(cyklam)]3 [W(CN)8]2 16H2O","","- C46 H104 N28 Ni3 O16 W2 -","- C46 H72 N28 Ni3 O16 W2 -","- C46 H72 N28 Ni3 O16 W2 -","1","0.5","","Nowicka, Beata; Rams, Michał; Stadnicka, Katarzyna; Sieklucka, Barbara","Reversible guest-induced magnetic and structural single-crystal-to-single-crystal transformation in microporous coordination network {[Ni(cyclam)]3[W(CN)8]2}n.","Inorganic chemistry","2007","46","20","8123","8125","10.1021/ic701168x","","","0.71073","MoKα","","0.073","0.0632","","","0.14","0.1436","","","","","","1.199","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339436","20.1567","0.0005","9.6656","0.0002","12.1219","0.0002","90","","116.455","0.002","90","","2114.37","0.09","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H28 Cl2 N4 O4 Pt -","- C16 H28 Cl2 N4 O4 Pt -","- C64 H112 Cl8 N16 O16 Pt4 -","4","0.5","","Makarycheva-Mikhailova, Anastassiya V; Golenetskaya, Julia A.; Bokach, Nadezhda A.; Balova, Irina A.; Haukka, Matti; Kukushkin, Vadim Yu","PtII-mediated 1,3-dipolar cycloaddition of oxazoline N-oxides to nitriles as a key step to dihydrooxazolo-1,2,4-oxadiazoles.","Inorganic chemistry","2007","46","20","8323","8331","10.1021/ic701133b","","","0.71073","MoKα","","0.0192","0.0188","","","0.0456","0.0458","","","","","","1.049","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339437","20.5932","0.0006","9.1472","0.0004","14.4093","0.0004","90","","117.766","0.003","90","","2401.75","0.16","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H32 Cl2 N4 O4 Pt -","- C18 H32 Cl2 N4 O4 Pt -","- C72 H128 Cl8 N16 O16 Pt4 -","4","0.5","","Makarycheva-Mikhailova, Anastassiya V; Golenetskaya, Julia A.; Bokach, Nadezhda A.; Balova, Irina A.; Haukka, Matti; Kukushkin, Vadim Yu","PtII-mediated 1,3-dipolar cycloaddition of oxazoline N-oxides to nitriles as a key step to dihydrooxazolo-1,2,4-oxadiazoles.","Inorganic chemistry","2007","46","20","8323","8331","10.1021/ic701133b","","","0.71073","MoKα","","0.0505","0.0415","","","0.0949","0.0991","","","","","","1.061","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339438","9.4537","0.0007","10.5337","0.0005","15.6088","0.0011","90","","105.088","0.006","90","","1500.78","0.17","105","2","105","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H36 Cl2 N4 O4 Pt -","- C28 H36 Cl2 N4 O4 Pt -","- C56 H72 Cl4 N8 O8 Pt2 -","2","0.5","","Makarycheva-Mikhailova, Anastassiya V; Golenetskaya, Julia A.; Bokach, Nadezhda A.; Balova, Irina A.; Haukka, Matti; Kukushkin, Vadim Yu","PtII-mediated 1,3-dipolar cycloaddition of oxazoline N-oxides to nitriles as a key step to dihydrooxazolo-1,2,4-oxadiazoles.","Inorganic chemistry","2007","46","20","8323","8331","10.1021/ic701133b","","","0.71073","MoKα","","0.0471","0.0217","","","0.0381","0.0433","","","","","","1.051","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339439","9.1351","0.0009","9.982","0.0004","10.0486","0.0006","81.645","0.005","88.34","0.006","86.454","0.006","904.65","0.11","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H42 Cl8 D2 N6 O4 Pt -","- C26 H42 Cl8 D2 N6 O4 Pt -","- C26 H42 Cl8 D2 N6 O4 Pt -","1","0.5","","Makarycheva-Mikhailova, Anastassiya V; Golenetskaya, Julia A.; Bokach, Nadezhda A.; Balova, Irina A.; Haukka, Matti; Kukushkin, Vadim Yu","PtII-mediated 1,3-dipolar cycloaddition of oxazoline N-oxides to nitriles as a key step to dihydrooxazolo-1,2,4-oxadiazoles.","Inorganic chemistry","2007","46","20","8323","8331","10.1021/ic701133b","","","0.71073","MoKα","","0.0132","0.0131","","","0.0301","0.0301","","","","","","1.037","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339440","12.309","0.003","17.979","0.004","21.586","0.004","103.05","0.03","100.04","0.03","108.04","0.03","4268","2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- Cu10 Ge4 H64 K10 N12 Na14 O162 W34 -","- Cu10 Ge4 K10 N12 Na14 O162 W34 -","- Cu10 Ge4 K10 N12 Na14 O162 W34 -","1","0.5","","Zhang, Zhiming; Qi, Yanfei; Qin, Chao; Li, Yangguang; Wang, Enbo; Wang, Xinlong; Su, Zhongmin; Xu, Lin","Two multi-copper-containing heteropolyoxotungstates constructed from the lacunary Keggin polyoxoanion and the high-nuclear spin cluster.","Inorganic chemistry","2007","46","20","8162","8169","10.1021/ic7012864","","","0.71073","MoKα","","0.1208","0.0758","","","0.1753","0.2041","","","","","","1.027","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339441","27.629","0.006","22.898","0.005","16.095","0.003","90","","113.65","0.03","90","","9327","4","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- Cu14 H77 Na16 O164.5 Si4 W32 -","- Cu14 Na15 O164.5 Si4 W32 -","- Cu28 Na30 O329 Si8 W64 -","2","0.25","","Zhang, Zhiming; Qi, Yanfei; Qin, Chao; Li, Yangguang; Wang, Enbo; Wang, Xinlong; Su, Zhongmin; Xu, Lin","Two multi-copper-containing heteropolyoxotungstates constructed from the lacunary Keggin polyoxoanion and the high-nuclear spin cluster.","Inorganic chemistry","2007","46","20","8162","8169","10.1021/ic7012864","","","0.71073","MoKα","","0.1066","0.0584","","","0.1217","0.141","","","","","","1.023","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339442","9.972","0.0004","13.484","0.0005","16.381","0.0006","90.054","0.0006","98.811","0.006","90.094","0.006","2176.63","0.15","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H66 Co2 F8 Mo8 N24 O39 -","- C52 H66 Co2 F8 Mo8 N24 O39 -","- C52 H66 Co2 F8 Mo8 N24 O39 -","1","0.5","","Li, Shun-Li; Lan, Ya-Qian; Ma, Jian-Fang; Yang, Jin; Wang, Xiao-Hong; Su, Zhong-Min","Syntheses and structures of organic-inorganic hybrid compounds based on metal-fluconazole coordination polymers and the beta-Mo8O26 anion.","Inorganic chemistry","2007","46","20","8283","8290","10.1021/ic700913m","","","0.71069","MoKα","","0.0337","0.0268","","","0.0662","0.0701","","","","","","1.028","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339443","9.95","0.0004","13.484","0.0005","16.367","0.0007","90.644","0.001","98.923","0.001","90.18","0.05","2169.15","0.15","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H66 F8 Mo8 N24 Ni2 O39 -","- C52 H66 F8 Mo8 N24 Ni2 O39 -","- C52 H66 F8 Mo8 N24 Ni2 O39 -","1","0.5","","Li, Shun-Li; Lan, Ya-Qian; Ma, Jian-Fang; Yang, Jin; Wang, Xiao-Hong; Su, Zhong-Min","Syntheses and structures of organic-inorganic hybrid compounds based on metal-fluconazole coordination polymers and the beta-Mo8O26 anion.","Inorganic chemistry","2007","46","20","8283","8290","10.1021/ic700913m","","","0.71069","MoKα","","0.031","0.0257","","","0.0647","0.0677","","","","","","1.031","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339444","10.571","0.0006","11.737","0.0006","16.614","0.0009","78.773","0.002","86.208","0.003","82.351","0.002","2002.18","0.19","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H56 F8 Mo8 N24 O34 Zn2 -","- C52 H56 F8 Mo8 N24 O34 Zn2 -","- C52 H56 F8 Mo8 N24 O34 Zn2 -","1","0.5","","Li, Shun-Li; Lan, Ya-Qian; Ma, Jian-Fang; Yang, Jin; Wang, Xiao-Hong; Su, Zhong-Min","Syntheses and structures of organic-inorganic hybrid compounds based on metal-fluconazole coordination polymers and the beta-Mo8O26 anion.","Inorganic chemistry","2007","46","20","8283","8290","10.1021/ic700913m","","","0.71069","MoKα","","0.0306","0.0259","","","0.0651","0.0676","","","","","","1.019","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339445","12.042","0.0009","12.174","0.0009","15.041","0.0012","100.456","0.001","94.465","0.001","111.19","0.001","1996.9","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H56 Cu2 F8 Mo8 N24 O34 -","- C52 H56 Cu2 F8 Mo8 N24 O34 -","- C52 H56 Cu2 F8 Mo8 N24 O34 -","1","0.5","","Li, Shun-Li; Lan, Ya-Qian; Ma, Jian-Fang; Yang, Jin; Wang, Xiao-Hong; Su, Zhong-Min","Syntheses and structures of organic-inorganic hybrid compounds based on metal-fluconazole coordination polymers and the beta-Mo8O26 anion.","Inorganic chemistry","2007","46","20","8283","8290","10.1021/ic700913m","","","0.71069","MoKα","","0.0526","0.0387","","","0.0995","0.1069","","","","","","1.043","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339446","12.968","0.002","23.22","0.002","13.07","0.0004","90","","92.188","0.005","90","","3932.7","0.7","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H48 Ag4 F8 Mo8 N24 O30 -","- C52 H48 Ag4 F8 Mo8 N24 O30 -","- C104 H96 Ag8 F16 Mo16 N48 O60 -","2","0.5","","Li, Shun-Li; Lan, Ya-Qian; Ma, Jian-Fang; Yang, Jin; Wang, Xiao-Hong; Su, Zhong-Min","Syntheses and structures of organic-inorganic hybrid compounds based on metal-fluconazole coordination polymers and the beta-Mo8O26 anion.","Inorganic chemistry","2007","46","20","8283","8290","10.1021/ic700913m","","","0.71069","MoKα","","0.0359","0.0268","","","0.0548","0.0582","","","","","","1.023","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339447","13.0206","0.0002","17.7528","0.0002","19.5067","0.0004","90","","93.0593","0.0005","90","","4502.59","0.13","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42.5 H71.5 O4 S2 Zr -","- C42.5 H71.5 O4 S2 Zr -","- C170 H286 O16 S8 Zr4 -","4","1","","Cohen, Ad; Yeori, Adi; Goldberg, Israel; Kol, Moshe","Group 4 complexes of a new [OSSO]-type dianionic ligand. Coordination chemistry and preliminary polymerization catalysis studies.","Inorganic chemistry","2007","46","20","8114","8116","10.1021/ic701370t","","","0.71073","MoKα","","0.0782","0.0485","","","0.117","0.1314","","","","","","1.066","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339448","10.645","0.0004","12.366","0.0005","15.031","0.0008","99.888","0.002","93.642","0.002","95.419","0.003","1934.09","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H32 Ag8 F8 Fe4 N24 -","- C56 Ag8 F8 Fe4 N24 -","- C56 Ag8 F8 Fe4 N24 -","1","0.5","","Muñoz, M Carmen; Gaspar, Ana B.; Galet, Ana; Real, José A","Spin-crossover behavior in cyanide-bridged iron(II)-silver(I) bimetallic 2D Hofmann-like metal-organic frameworks.","Inorganic chemistry","2007","46","20","8182","8192","10.1021/ic700607x","","","0.71073","MoKα","","0.13","0.0618","","","0.1498","0.1882","","","","","","0.961","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339449","9.258","0.0002","12.95","0.0003","16.57","0.0004","90","","99.437","0.002","90","","1959.71","0.08","270","2","270","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H32 Ag8 Cl8 Fe4 N24 -","- C56 H32 Ag8 Cl8 Fe4 N24 -","- C56 H32 Ag8 Cl8 Fe4 N24 -","1","0.25","","Muñoz, M Carmen; Gaspar, Ana B.; Galet, Ana; Real, José A","Spin-crossover behavior in cyanide-bridged iron(II)-silver(I) bimetallic 2D Hofmann-like metal-organic frameworks.","Inorganic chemistry","2007","46","20","8182","8192","10.1021/ic700607x","","","0.71073","MoKα","","0.0644","0.0361","","","0.104","0.1274","","","","","","1.048","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339450","9.1087","0.0002","12.686","0.0003","16.314","0.0004","90","","99.696","0.002","90","","1858.2","0.08","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H16 Ag4 Cl4 Fe2 N12 -","- C28 H16 Ag4 Cl4 Fe2 N12 -","- C56 H32 Ag8 Cl8 Fe4 N24 -","2","0.5","","Muñoz, M Carmen; Gaspar, Ana B.; Galet, Ana; Real, José A","Spin-crossover behavior in cyanide-bridged iron(II)-silver(I) bimetallic 2D Hofmann-like metal-organic frameworks.","Inorganic chemistry","2007","46","20","8182","8192","10.1021/ic700607x","","","0.71073","MoKα","","0.0475","0.0341","","","0.0878","0.104","","","","","","1.04","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339451","9.45","0.0003","12.544","0.0003","16.853","0.0005","90","","101.243","0.001","90","","1959.43","0.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H32 Ag8 Br8 Fe4 N24 -","- C56 H32 Ag8 Br8 Fe4 N24 -","- C56 H32 Ag8 Br8 Fe4 N24 -","1","0.25","","Muñoz, M Carmen; Gaspar, Ana B.; Galet, Ana; Real, José A","Spin-crossover behavior in cyanide-bridged iron(II)-silver(I) bimetallic 2D Hofmann-like metal-organic frameworks.","Inorganic chemistry","2007","46","20","8182","8192","10.1021/ic700607x","","","0.71073","MoKα","","0.0571","0.0359","","","0.0894","0.1093","","","","","","1.056","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339452","16.786","0.0007","12.893","0.0006","19.156","0.001","90","","97.442","0.002","90","","4110.9","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H9 Ag2 Fe I2 N6 -","- C14 H8 Ag2 Fe I2 N6 -","- C112 H64 Ag16 Fe8 I16 N48 -","8","1","","Muñoz, M Carmen; Gaspar, Ana B.; Galet, Ana; Real, José A","Spin-crossover behavior in cyanide-bridged iron(II)-silver(I) bimetallic 2D Hofmann-like metal-organic frameworks.","Inorganic chemistry","2007","46","20","8182","8192","10.1021/ic700607x","","","0.71073","MoKα","","0.1077","0.0491","","","0.1114","0.1351","","","","","","0.925","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339453","15.578","0.0002","13.557","0.0002","16.768","0.0003","90","","112.578","0.0006","90","","3269.84","0.09","270","2","270","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C48 H32 Ag4 Fe2 I8 N16 -","- C48 Ag4 Fe2 I8 N16 -","- C96 Ag8 Fe4 I16 N32 -","2","1","","Muñoz, M Carmen; Gaspar, Ana B.; Galet, Ana; Real, José A","Spin-crossover behavior in cyanide-bridged iron(II)-silver(I) bimetallic 2D Hofmann-like metal-organic frameworks.","Inorganic chemistry","2007","46","20","8182","8192","10.1021/ic700607x","","","0.71073","MoKα","","0.1177","0.0999","","","0.2954","0.3149","","","","","","1.3","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339454","15.363","0.0004","13.418","0.0003","16.606","0.0005","90","","112.503","0.001","90","","3162.53","0.15","200","2","200","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C48 H32 Ag4 Fe2 I8 N16 -","- C48 Ag4 Fe2 I8 N16 -","- C96 Ag8 Fe4 I16 N32 -","2","1","","Muñoz, M Carmen; Gaspar, Ana B.; Galet, Ana; Real, José A","Spin-crossover behavior in cyanide-bridged iron(II)-silver(I) bimetallic 2D Hofmann-like metal-organic frameworks.","Inorganic chemistry","2007","46","20","8182","8192","10.1021/ic700607x","","","0.71073","MoKα","","0.1411","0.0984","","","0.2769","0.3117","","","","","","1.089","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339455","12.5464","0.0018","12.5464","0.0018","6.9282","0.0014","90","","90","","120","","944.5","0.3","298","2","298","2","","","","","","","","4","P 63","P 6c","173","","","","- C3 H3 In O6 -","- C3 H3 In O6 -","- C18 H18 In6 O36 -","6","1","","Su, Jie; Wang, Yingxia; Yang, Sihai; Li, Guobao; Liao, Fuhui; Lin, Jianhua","New series of indium formates: hydrothermal synthesis, structure and coordination modes.","Inorganic chemistry","2007","46","20","8403","8409","10.1021/ic7007599","","","0.71073","MoKα","","0.016","0.0158","","","0.0368","0.0369","","","","","","1","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339456","8.5742","0.0017","10.785","0.002","12.445","0.003","90","","105.72","0.03","90","","1107.8","0.4","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H6 In2 O11 -","- C5 H6 In2 O11 -","- C20 H24 In8 O44 -","4","1","","Su, Jie; Wang, Yingxia; Yang, Sihai; Li, Guobao; Liao, Fuhui; Lin, Jianhua","New series of indium formates: hydrothermal synthesis, structure and coordination modes.","Inorganic chemistry","2007","46","20","8403","8409","10.1021/ic7007599","","","0.71073","MoKα","","0.0494","0.0281","","","0.0523","0.0557","","","","","","0.931","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339457","12.4199","0.0004","12.4199","0.0004","6.0842","0.0003","90","","90","","90","","938.51","0.06","298","2","298","2","","","","","","","","4","I -4 2 d","I -4 2bw","122","","","","- C2 H3 In O5 -","- C2 H3 In O5 -","- C16 H24 In8 O40 -","8","0.5","","Su, Jie; Wang, Yingxia; Yang, Sihai; Li, Guobao; Liao, Fuhui; Lin, Jianhua","New series of indium formates: hydrothermal synthesis, structure and coordination modes.","Inorganic chemistry","2007","46","20","8403","8409","10.1021/ic7007599","","","0.71073","MoKα","","0.033","0.0244","","","0.0465","0.0477","","","","","","1.024","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339458","13.256","0.006","14.98","0.006","20.82","0.009","90","","95.641","0.007","90","","4114","3","173.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H65 Li O5 -","- C42 H65 Li O5 -","- C168 H260 Li4 O20 -","4","1","","Matsuo, Tsukasa; Kawaguchi, Hiroyuki","Anisole-diphenoxide ligands and their zirconium dichloride and dialkyl complexes.","Inorganic chemistry","2007","46","20","8426","8434","10.1021/ic7011167","","","0.7107","MoKα","","","0.0984","","","","0.237","","","","","","0.987","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339459","5.973","0.004","25.5","0.015","9.858","0.007","90","","113.752","0.009","90","","1374.3","1.6","173.1","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C32 H42 O3 -","- C32 H42 O3 -","- C64 H84 O6 -","2","0.5","","Matsuo, Tsukasa; Kawaguchi, Hiroyuki","Anisole-diphenoxide ligands and their zirconium dichloride and dialkyl complexes.","Inorganic chemistry","2007","46","20","8426","8434","10.1021/ic7011167","","","0.7107","MoKα","","","0.0543","","","","0.114","","","","","","0.966","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339460","12.018","0.007","11.985","0.007","14.529","0.009","90","","90.257","0.01","90","","2093","2","173.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C43 H56 Cl2 O4 Zr -","- C43 H56 Cl2 O4 Zr -","- C86 H112 Cl4 O8 Zr2 -","2","1","","Matsuo, Tsukasa; Kawaguchi, Hiroyuki","Anisole-diphenoxide ligands and their zirconium dichloride and dialkyl complexes.","Inorganic chemistry","2007","46","20","8426","8434","10.1021/ic7011167","","","0.7107","MoKα","","","0.063","","","","0.0754","","","","","","1.038","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339461","14.655","0.007","17.712","0.009","17.96","0.009","105.24","0.007","103.929","0.006","106.408","0.0011","4057","3","173.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C79 H113 Cl4 O6 Zr2 -","- C79 H92 Cl4 O6 Zr2 -","- C158 H184 Cl8 O12 Zr4 -","2","1","","Matsuo, Tsukasa; Kawaguchi, Hiroyuki","Anisole-diphenoxide ligands and their zirconium dichloride and dialkyl complexes.","Inorganic chemistry","2007","46","20","8426","8434","10.1021/ic7011167","","","0.7107","MoKα","","","0.0891","","","","0.1915","","","","","","1.406","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339462","9.311","0.003","14.646","0.005","17.238","0.006","95.777","0.007","92.23","0.003","102.844","0.007","2275.7","1.3","173.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C53 H62 O3 Zr -","- C53 H54 O3 Zr -","- C106 H108 O6 Zr2 -","2","1","","Matsuo, Tsukasa; Kawaguchi, Hiroyuki","Anisole-diphenoxide ligands and their zirconium dichloride and dialkyl complexes.","Inorganic chemistry","2007","46","20","8426","8434","10.1021/ic7011167","","","0.7107","MoKα","","","0.0714","","","","0.1409","","","","","","1.033","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339463","11.453","0.006","18.622","0.009","24.54","0.013","90","","104.754","0.007","90","","5061","4","173.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H76 O3 Si2 Zr -","- C50 H68 O3 Si2 Zr -","- C200 H272 O12 Si8 Zr4 -","4","1","","Matsuo, Tsukasa; Kawaguchi, Hiroyuki","Anisole-diphenoxide ligands and their zirconium dichloride and dialkyl complexes.","Inorganic chemistry","2007","46","20","8426","8434","10.1021/ic7011167","","","0.7107","MoKα","","","0.0883","","","","0.1933","","","","","","1.039","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339464","11.77","0.001","12.875","0.0008","19.1517","0.0015","90","","97.435","0.01","90","","2877.8","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H15 Cl Cu N2 O6.5 -","- C11 H15 Cl Cu N2 O6.5 -","- C88 H120 Cl8 Cu8 N16 O52 -","8","2","","Rajendiran, Venugopal; Karthik, Ramasamy; Palaniandavar, Mallayan; Stoeckli-Evans, Helen; Periasamy, Vaiyapuri Subbarayan; Akbarsha, Mohammad Abdulkader; Srinag, Bangalore Suresh; Krishnamurthy, Hanumanthappa","Mixed-ligand copper(II)-phenolate complexes: effect of coligand on enhanced DNA and protein binding, DNA cleavage, and anticancer activity.","Inorganic chemistry","2007","46","20","8208","8221","10.1021/ic700755p","","","0.71073","MoKα","","0.0676","0.0456","","","0.1204","0.1289","","","","","","1.014","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339465","8.638","0.0004","8.8289","0.0005","10.9157","0.0008","80.941","0.002","72.88","0.003","67.299","0.003","733.05","0.08","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H18 N4 O2 -","- C16 H18 N4 O2 -","- C32 H36 N8 O4 -","2","1","","Bruijnincx, Pieter C. A.; Lutz, Martin; Spek, Anthony L.; Hagen, Wilfred R.; van Koten, Gerard; Gebbink, Robertus J M Klein","Iron(III)-catecholato complexes as structural and functional models of the intradiol-cleaving catechol dioxygenases.","Inorganic chemistry","2007","46","20","8391","8402","10.1021/ic700741v","","","0.71073","MoKα","","0.1008","0.0629","","","0.1409","0.1646","","","","","","1.081","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339466","13.9987","0.0001","12.2216","0.0001","19.6864","0.0002","90","","101.913","0.0004","90","","3295.54","0.05","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H34 Fe N9 O7 -","- C32 H34 Fe N9 O7 -","- C128 H136 Fe4 N36 O28 -","4","1","","Bruijnincx, Pieter C. A.; Lutz, Martin; Spek, Anthony L.; Hagen, Wilfred R.; van Koten, Gerard; Gebbink, Robertus J M Klein","Iron(III)-catecholato complexes as structural and functional models of the intradiol-cleaving catechol dioxygenases.","Inorganic chemistry","2007","46","20","8391","8402","10.1021/ic700741v","","","0.71073","MoKα","","0.0616","0.0372","","","0.0905","0.1007","","","","","","1.091","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339467","9.4907","0.0003","10.8082","0.0004","13.2111","0.0005","106.104","0.0013","102.853","0.0012","101.803","0.0013","1217","0.08","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H19 Cl4 Fe N4 O5 -","- C22 H19 Cl4 Fe N4 O5 -","- C44 H38 Cl8 Fe2 N8 O10 -","2","1","","Bruijnincx, Pieter C. A.; Lutz, Martin; Spek, Anthony L.; Hagen, Wilfred R.; van Koten, Gerard; Gebbink, Robertus J M Klein","Iron(III)-catecholato complexes as structural and functional models of the intradiol-cleaving catechol dioxygenases.","Inorganic chemistry","2007","46","20","8391","8402","10.1021/ic700741v","","","0.71073","MoKα","","0.0657","0.0414","","","0.1026","0.1163","","","","","","1.068","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339468","7.995","0.001","17.491","0.006","11.664","0.001","90","","104.55","0.01","90","","1578.8","0.6","173","","173","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C13 H21 Au N O P S -","- C13 H21 Au N O P S -","- C52 H84 Au4 N4 O4 P4 S4 -","4","2","","Kang, Jun-Gill; Cho, Hyung-Kook; Park, Changmoon; Yun, Sock-Sung; Kim, Jae-Kyung; Broker, Grant A.; Smyth, Douglas R.; Tiekink, Edward R. T.","Supramolecular aggregation of mononuclear triorganophosphinegold(I) 2-mercaptobenzamides: solution structures, thermal decomposition, and photoluminescence.","Inorganic chemistry","2007","46","20","8228","8237","10.1021/ic701022e","","","0.7107","MoKα","","0.047","0.027","","","0.063","0.068","","","","","","1.02","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339469","10.576","0.004","11.232","0.004","10.205","0.006","114.62","0.03","90.25","0.04","91.66","0.03","1101.4","0.9","173","","173","","","","","","","","","7","P -1","-P 1","2","","","","- C25 H21 Au N O P S -","- C25 H21 Au N O P S -","- C50 H42 Au2 N2 O2 P2 S2 -","2","1","","Kang, Jun-Gill; Cho, Hyung-Kook; Park, Changmoon; Yun, Sock-Sung; Kim, Jae-Kyung; Broker, Grant A.; Smyth, Douglas R.; Tiekink, Edward R. T.","Supramolecular aggregation of mononuclear triorganophosphinegold(I) 2-mercaptobenzamides: solution structures, thermal decomposition, and photoluminescence.","Inorganic chemistry","2007","46","20","8228","8237","10.1021/ic701022e","","","0.7107","MoKα","","0.034","0.023","","","0.057","0.06","","","","","","1.02","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339470","11.028","0.002","13.24","0.007","9.756","0.002","106.01","0.03","97.11","0.02","108.65","0.03","1261.7","0.9","173","","173","","","","","","","","","7","P -1","-P 1","2","","","","- C25 H39 Au N O P S -","- C25 H39 Au N O P S -","- C50 H78 Au2 N2 O2 P2 S2 -","2","1","","Kang, Jun-Gill; Cho, Hyung-Kook; Park, Changmoon; Yun, Sock-Sung; Kim, Jae-Kyung; Broker, Grant A.; Smyth, Douglas R.; Tiekink, Edward R. T.","Supramolecular aggregation of mononuclear triorganophosphinegold(I) 2-mercaptobenzamides: solution structures, thermal decomposition, and photoluminescence.","Inorganic chemistry","2007","46","20","8228","8237","10.1021/ic701022e","","","0.7107","MoKα","","0.039","0.027","","","0.067","0.071","","","","","","1.04","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339471","8.587","0.005","15.613","0.007","16.838","0.004","90","","99.42","0.03","90","","2227","1.7","296.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H27 F2 Li N2 O6 S -","- C18 H27 F2 Li N2 O6 S -","- C72 H108 F8 Li4 N8 O24 S4 -","4","1","","Habata, Yoichi; Okazaki, Chizuko; Ogura, Kinuko; Akabori, Sadatoshi; Zhang, Xian X.; Bradshaw, Jerald S.","Polymer-like structures of LiSCN, NaSCN, KSCN, RbSCN, and CsSCN complexes with an armed monoaza-15-crown-5 ether bearing a 3',5'-difluoro-4'-hydroxybenzyl group.","Inorganic chemistry","2007","46","20","8264","8270","10.1021/ic7011606","","","0.71069","MoKα","","","0.0609","","","","0.1745","","","","","","1.221","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339472","7.9","0.003","13.041","0.004","10.909","0.004","90","","107.07","0.03","90","","1074.4","0.7","296.1","","","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C18 H25 F2 N2 Na O5 S -","- C18 H25 F2 N2 Na O5 S -","- C36 H50 F4 N4 Na2 O10 S2 -","2","1","","Habata, Yoichi; Okazaki, Chizuko; Ogura, Kinuko; Akabori, Sadatoshi; Zhang, Xian X.; Bradshaw, Jerald S.","Polymer-like structures of LiSCN, NaSCN, KSCN, RbSCN, and CsSCN complexes with an armed monoaza-15-crown-5 ether bearing a 3',5'-difluoro-4'-hydroxybenzyl group.","Inorganic chemistry","2007","46","20","8264","8270","10.1021/ic7011606","","","0.71069","MoKα","","","0.058","","","","0.1652","","","","","","1.018","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339473","8.5644","0.0019","16.354","0.002","15.51","0.002","90","","93.811","0.017","90","","2167.6","0.6","296.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 F2 K N2 O5 S -","- C18 H25 F2 K N2 O5 S -","- C72 H100 F8 K4 N8 O20 S4 -","4","1","","Habata, Yoichi; Okazaki, Chizuko; Ogura, Kinuko; Akabori, Sadatoshi; Zhang, Xian X.; Bradshaw, Jerald S.","Polymer-like structures of LiSCN, NaSCN, KSCN, RbSCN, and CsSCN complexes with an armed monoaza-15-crown-5 ether bearing a 3',5'-difluoro-4'-hydroxybenzyl group.","Inorganic chemistry","2007","46","20","8264","8270","10.1021/ic7011606","","","0.71069","MoKα","","","0.0481","","","","0.1362","","","","","","1.31","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339474","8.875","0.003","18.627","0.004","13.359","0.003","90","","93.72","0.02","90","","2203.8","1","296.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 F2 N2 O5 Rb S -","- C18 H25 F2 N2 O5 Rb S -","- C72 H100 F8 N8 O20 Rb4 S4 -","4","1","","Habata, Yoichi; Okazaki, Chizuko; Ogura, Kinuko; Akabori, Sadatoshi; Zhang, Xian X.; Bradshaw, Jerald S.","Polymer-like structures of LiSCN, NaSCN, KSCN, RbSCN, and CsSCN complexes with an armed monoaza-15-crown-5 ether bearing a 3',5'-difluoro-4'-hydroxybenzyl group.","Inorganic chemistry","2007","46","20","8264","8270","10.1021/ic7011606","","","0.71069","MoKα","","","0.0596","","","","0.1676","","","","","","1.026","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339475","8.954","0.013","18.3","0.015","13.945","0.011","90","","94.51","0.08","90","","2278","4","296.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 Cs F2 N2 O5 S -","- C18 H25 Cs F2 N2 O5 S -","- C72 H100 Cs4 F8 N8 O20 S4 -","4","1","","Habata, Yoichi; Okazaki, Chizuko; Ogura, Kinuko; Akabori, Sadatoshi; Zhang, Xian X.; Bradshaw, Jerald S.","Polymer-like structures of LiSCN, NaSCN, KSCN, RbSCN, and CsSCN complexes with an armed monoaza-15-crown-5 ether bearing a 3',5'-difluoro-4'-hydroxybenzyl group.","Inorganic chemistry","2007","46","20","8264","8270","10.1021/ic7011606","","","0.71069","MoKα","","","0.0583","","","","0.1663","","","","","","1.135","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339476","14.395","0.0004","15.65","0.0005","26.67","0.001","90","","90","","90","","6008.3","0.3","293","2","293","2","","","","","","","","5","P c 21 n","P -2n -2ac","33","","","","- C36 H60 Co3 Cr2 O42 -","- C36 H48 Co3 Cr2 O42 -","- C144 H192 Co12 Cr8 O168 -","4","1","","Coronado, Eugenio; Galan-Mascarós, José R; Martí-Gastaldo, Carlos","A ""cation-less"" oxalate-based ferromagnet formed by neutral bimetallic layers: {[Co(H2O)2]3[Cr(ox)3]2(18-crown-6)2}(infinity) (ox = oxalate dianion; 18-crown-6 = C12H24O6).","Inorganic chemistry","2007","46","20","8108","8110","10.1021/ic700808h","","","0.71073","MoKα","","0.0887","0.0615","","","0.1497","0.1655","","","","","","0.96","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339477","11.4318","0.0003","17.0988","0.0004","15.6524","0.0004","90","","92.266","0.002","90","","3057.18","0.13","100","0.1","100","0.1","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H36 Cl2 N6 Ni O12 -","- C26 H36 Cl2 N6 Ni O12 -","- C104 H144 Cl8 N24 Ni4 O48 -","4","1","","Vaiana, Lea; Regueiro-Figueroa, Martín; Mato-Iglesias, Marta; Platas-Iglesias, Carlos; Esteban-Gómez, David; de Blas, Andrés; Rodríguez-Blas, Teresa","Seven-coordination versus six-coordination in divalent first-row transition-metal complexes derived from 1,10-diaza-15-crown-5.","Inorganic chemistry","2007","46","20","8271","8282","10.1021/ic7008946","","x-ray","0.71073","MoKα","","0.1245","0.0707","","","0.1581","0.1784","","","","","","1.065","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339478","11.05","0.003","12.046","0.003","13.57","0.004","94.609","0.006","109.246","0.005","112.763","0.005","1527","0.7","100","0.2","100","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C26 H34 Cl2 N6 O11 Zn -","- C26 H34 Cl2 N6 O11 Zn -","- C52 H68 Cl4 N12 O22 Zn2 -","2","1","","Vaiana, Lea; Regueiro-Figueroa, Martín; Mato-Iglesias, Marta; Platas-Iglesias, Carlos; Esteban-Gómez, David; de Blas, Andrés; Rodríguez-Blas, Teresa","Seven-coordination versus six-coordination in divalent first-row transition-metal complexes derived from 1,10-diaza-15-crown-5.","Inorganic chemistry","2007","46","20","8271","8282","10.1021/ic7008946","","x-ray","0.71073","MoKα","","0.1536","0.0603","","","0.1242","0.1611","","","","","","1.008","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339479","34.5691","0.0018","34.5691","0.0018","13.4536","0.001","90","","90","","90","","16077.4","1.7","173","2","173","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C42 H38 B Br Co N4 -","- C42 H38 B Br Co N4 -","- C672 H608 B16 Br16 Co16 N64 -","16","1","","Jones, Matthew B.; MacBeth, Cora E.","Tripodal phenylamine-based ligands and their CoII complexes.","Inorganic chemistry","2007","46","20","8117","8119","10.1021/ic701289y","","","0.71073","MoKα","","0.1028","0.06","","","0.1274","0.1457","","","","","","1.022","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339480","14.609","0.011","15.421","0.012","15.668","0.012","90","","90","","90","","3530","5","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C38 H53 Co N5 O3 -","- C38 H53 Co N5 O3 -","- C152 H212 Co4 N20 O12 -","4","1","","Jones, Matthew B.; MacBeth, Cora E.","Tripodal phenylamine-based ligands and their CoII complexes.","Inorganic chemistry","2007","46","20","8117","8119","10.1021/ic701289y","","","0.71073","MoKα","","0.1065","0.0673","","","0.1007","0.1137","","","","","","1.01","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339481","23.7","0.005","11.66","0.002","32.091","0.011","90","","125.81","0.02","90","","7192","4","140","2","140","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C82 H96 B2 F2 Hg2 N4 -","- C82 H96 B2 F2 Hg2 N4 -","- C328 H384 B8 F8 Hg8 N16 -","4","1","","Lee, Min Hyung; Gabbaï, François P","Synthesis and properties of a cationic bidentate Lewis acid.","Inorganic chemistry","2007","46","20","8132","8138","10.1021/ic700360a","","","0.71073","MoKα","","0.0492","0.0403","","","0.1149","0.1241","","","","","","1.004","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339482","25.412","0.005","13.069","0.003","11.038","0.002","90","","96.08","0.03","90","","3645.2","1.3","140","2","140","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C40 H45 B F3 Hg N O3 S -","- C40 H45 B F3 Hg N O3 S -","- C160 H180 B4 F12 Hg4 N4 O12 S4 -","4","1","","Lee, Min Hyung; Gabbaï, François P","Synthesis and properties of a cationic bidentate Lewis acid.","Inorganic chemistry","2007","46","20","8132","8138","10.1021/ic700360a","","","0.71073","MoKα","","0.0437","0.0309","","","0.0736","0.0791","","","","","","1.003","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339483","15.453","0.004","15.453","","38.06","0.01","90","","90","","120","","7871","3","100","2","293","2","","","","","","","","7","R 3 c :H","R 3 -2""c","161","","","","- C41 H35 Cl6 Mn3 N12 Ni O10 -","- C39 H33 Mn3 N12 Ni O10 -","- C234 H198 Mn18 N72 Ni6 O60 -","6","0.333333","","Feng, Patrick L.; Beedle, Christopher C.; Wernsdorfer, Wolfgang; Koo, Changhyun; Nakano, Motohiro; Hill, Stephen; Hendrickson, David N.","Heterometallic cubane single-molecule magnets.","Inorganic chemistry","2007","46","20","8126","8128","10.1021/ic7012107","","","0.71073","MoKα","","0.0394","0.0367","","","0.099","0.1002","","","","","","1.09","","","","has coordinates","259049","2020-11-09","02:04:48",""
"4339484","14.744","0.002","14.744","","35.186","0.005","90","","90","","120","","6624.2","1.3","208","2","293","2","","","","","","","","7","R 3 c :H","R 3 -2""c","161","","","","- C29 H35 Cl6 Mn3 N12 O10 Zn -","- C27 H33 Mn3 N12 O10 Zn -","- C162 H198 Mn18 N72 O60 Zn6 -","6","0.333333","","Feng, Patrick L.; Beedle, Christopher C.; Wernsdorfer, Wolfgang; Koo, Changhyun; Nakano, Motohiro; Hill, Stephen; Hendrickson, David N.","Heterometallic cubane single-molecule magnets.","Inorganic chemistry","2007","46","20","8126","8128","10.1021/ic7012107","","","0.71073","MoKα","","0.0507","0.047","","","0.1191","0.1212","","","","","","1.038","","","","has coordinates","259049","2020-11-09","02:04:48",""
"4339485","7.452","0.006","8.103","0.006","11.452","0.008","82.32","0.02","88.47","0.03","67.021","0.012","630.7","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C7 H12 Cu3 N5 O3 S -","- C7 H12 Cu3 N5 O3 S -","- C14 H24 Cu6 N10 O6 S2 -","2","1","","Li, Pei-Xin; Jiang, Hai-Long; Feng, Mei-Ling; Mao, Jiang-Gao","New organically templated copper(I) sulfites: the role of sulfite anion as both soft and hard ligand.","Inorganic chemistry","2007","46","20","8302","8308","10.1021/ic7009622","","","0.71073","MoKα","","0.0994","0.0601","","","0.0973","0.1144","","","","","","1.082","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339486","11.267","0.004","19.993","0.009","6.752","0.003","90","","90.592","0.007","90","","1520.9","1.1","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C4 H18 Br Cu2 N2 Na O9 S2 -","- C4 H18 Br Cu2 N2 Na O9 S2 -","- C16 H72 Br4 Cu8 N8 Na4 O36 S8 -","4","1","","Li, Pei-Xin; Jiang, Hai-Long; Feng, Mei-Ling; Mao, Jiang-Gao","New organically templated copper(I) sulfites: the role of sulfite anion as both soft and hard ligand.","Inorganic chemistry","2007","46","20","8302","8308","10.1021/ic7009622","","","0.71073","MoKα","","0.0699","0.0613","","","0.1608","0.1654","","","","","","1.093","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339487","12.543","0.003","12.896","0.003","13.782","0.003","97.06","0.03","105.64","0.03","115.01","0.03","1872.4","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C80 H56 Cl8 N8 Ni8 O8.5 -","- C80 H56 Cl8 N8 Ni8 O8.5 -","- C80 H56 Cl8 N8 Ni8 O8.5 -","1","0.5","","Luo, Feng; Zheng, Ji-min; Kurmoo, Mohamedally","One-pot synthesis of Schiff-base-containing Ni8 clusters: solvothermal synthesis, structure, and magnetic properties.","Inorganic chemistry","2007","46","21","8448","8450","10.1021/ic7010259","","x-ray","0.71073","MoKα","","0.1193","0.0688","","","0.1813","0.2122","","","","","","1.042","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339488","4.6814","0.0003","4.6814","0.0003","12.7111","0.0015","90","","90","","90","","278.57","0.04","293","2","293","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- In2.46 Mg1.53 Sr -","- In2.468 Mg1.532 Sr -","- In4.936 Mg3.064 Sr2 -","2","0.0625","","Li, Bin; Corbett, John D.","Syntheses and structures of new phases AeMxIn(4-x) (Ae = Sr, Ba; M = Mg, Zn): size effects and site preferences in BaAl4-type structures.","Inorganic chemistry","2007","46","21","8812","8818","10.1021/ic701127f","","","0.71073","MoKα","","0.0131","0.0131","","","0.0296","0.0296","","","","","","0.998","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339489","4.6895","0.0007","4.6895","0.0007","12.629","0.003","90","","90","","90","","277.73","0.09","566","2","566","2","","","","","","","","3","I -4 m 2","I -4 -2","119","","","","- In3 Mg Sr -","- In3 Mg Sr -","- In6 Mg2 Sr2 -","2","0.125","","Li, Bin; Corbett, John D.","Syntheses and structures of new phases AeMxIn(4-x) (Ae = Sr, Ba; M = Mg, Zn): size effects and site preferences in BaAl4-type structures.","Inorganic chemistry","2007","46","21","8812","8818","10.1021/ic701127f","","","0.71073","MoKα","","0.0152","0.0151","","","0.0307","0.0307","","","","","","1.216","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339490","4.7093","0.0003","4.7093","0.0003","12.563","0.0015","90","","90","","90","","278.62","0.04","296","2","296","2","","","","","","","","3","I -4 m 2","I -4 -2","119","","","","- In3.15 Mg0.85 Sr -","- In3.15 Mg0.85 Sr -","- In6.3 Mg1.7 Sr2 -","2","0.125","","Li, Bin; Corbett, John D.","Syntheses and structures of new phases AeMxIn(4-x) (Ae = Sr, Ba; M = Mg, Zn): size effects and site preferences in BaAl4-type structures.","Inorganic chemistry","2007","46","21","8812","8818","10.1021/ic701127f","","","0.71073","MoKα","","0.0227","0.0227","","","0.0546","0.0546","","","","","","1.168","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339491","4.8625","0.0007","4.8625","0.0007","12.515","0.003","90","","90","","90","","295.9","0.09","296","2","293","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Ba In2.21 Mg1.79 -","- Ba In2.212 Mg1.788 -","- Ba2 In4.424 Mg3.576 -","2","0.0625","","Li, Bin; Corbett, John D.","Syntheses and structures of new phases AeMxIn(4-x) (Ae = Sr, Ba; M = Mg, Zn): size effects and site preferences in BaAl4-type structures.","Inorganic chemistry","2007","46","21","8812","8818","10.1021/ic701127f","","","0.71073","MoKα","","0.0137","0.0128","","","0.0285","0.0287","","","","","","1.191","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339492","4.833","0.002","4.833","0.002","12.478","0.01","90","","90","","90","","291.5","0.3","296","2","296","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Ba In2.95 Mg1.04 -","- Ba In2.954 Mg1.046 -","- Ba2 In5.908 Mg2.092 -","2","0.0625","","Li, Bin; Corbett, John D.","Syntheses and structures of new phases AeMxIn(4-x) (Ae = Sr, Ba; M = Mg, Zn): size effects and site preferences in BaAl4-type structures.","Inorganic chemistry","2007","46","21","8812","8818","10.1021/ic701127f","","","0.71073","MoKα","","0.015","0.015","","","0.0348","0.0348","","","","","","1.283","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339493","4.7827","0.0008","4.7827","0.0008","12.007","0.004","90","","90","","90","","274.65","0.11","296","2","296","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Ba In3.21 Zn0.79 -","- Ba In3.214 Zn0.786 -","- Ba2 In6.428 Zn1.572 -","2","0.0625","","Li, Bin; Corbett, John D.","Syntheses and structures of new phases AeMxIn(4-x) (Ae = Sr, Ba; M = Mg, Zn): size effects and site preferences in BaAl4-type structures.","Inorganic chemistry","2007","46","21","8812","8818","10.1021/ic701127f","","","0.71073","MoKα","","0.0161","0.0154","","","0.0344","0.0347","","","","","","1.158","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339494","4.627","0.001","4.627","0.001","12.098","0.005","90","","90","","90","","259.01","0.13","293","2","293","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- In3 Sr Zn -","- In3 Sr Zn -","- In6 Sr2 Zn2 -","2","0.0625","","Li, Bin; Corbett, John D.","Syntheses and structures of new phases AeMxIn(4-x) (Ae = Sr, Ba; M = Mg, Zn): size effects and site preferences in BaAl4-type structures.","Inorganic chemistry","2007","46","21","8812","8818","10.1021/ic701127f","","","0.71073","MoKα","","0.0228","0.0228","","","0.0678","0.0678","","","","","","1.016","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339495","13.729","0.004","10.05","0.003","10.16","0.003","90","","90","","90","","1401.8","0.7","273","2","273","2","","","","","","","","3","C m c a","-C 2ac 2","64","","","","- Au10 Ca4 In3 -","- Au10 Ca4 In3 -","- Au40 Ca16 In12 -","4","","","Lin, Qisheng; Corbett, John D.","Ca4Au10In3: synthesis, structure, and bonding analysis. The chemical and electronic transformations from the isotypic Zr7Ni10 intermetallic.","Inorganic chemistry","2007","46","21","8722","8727","10.1021/ic700995e","","x-ray","0.71073","MoKα","","0.0389","0.0349","","","0.0829","0.0845","","","","","","1.124","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339496","6.9992","0.0002","14.9522","0.0005","8.0418","0.0003","90","","91.873","0.002","90","","841.15","0.05","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[(CuCN)~2~(PyzNH~2~)]","catena-poly[!mu-aminopyrazinedi-!mu-cyano-)dicopper(I)]","","- C6 H5 Cu2 N5 -","- C6 H5 Cu2 N5 -","- C24 H20 Cu8 N20 -","4","1","","Tronic, Tristan A.; deKrafft, Kathryn E; Lim, Mi Jung; Ley, Amanda N.; Pike, Robert D.","Copper(I) cyanide networks: synthesis, luminescence behavior and thermal analysis. Part 1. Diimine ligands.","Inorganic chemistry","2007","46","21","8897","8912","10.1021/ic7007057","","","1.54178","CuKα","","0.0326","0.0248","","","0.0594","0.0628","","","","","","1.032","","","","has coordinates","179497","2020-10-21","18:00:00",""
"4339497","6.7878","0.0001","8.7739","0.0001","9.3384","0.0001","91.846","0.001","97.939","0.001","108.815","0.001","519.639","0.012","100","2","100","2","","","","","","","","4","P -1","-P 1","2","[(CuCN)~7~(Pym)~2~]","catena-poly[!mu-dipyrimidinehepta-!mu-cyano-)heptacopper(I)]","","- C7.5 H4 Cu3.5 N5.5 -","- C7.5 H4 Cu3.5 N5.5 -","- C15 H8 Cu7 N11 -","2","1","","Tronic, Tristan A.; deKrafft, Kathryn E; Lim, Mi Jung; Ley, Amanda N.; Pike, Robert D.","Copper(I) cyanide networks: synthesis, luminescence behavior and thermal analysis. Part 1. Diimine ligands.","Inorganic chemistry","2007","46","21","8897","8912","10.1021/ic7007057","","","1.54178","CuKα","","0.0332","0.0329","","","0.0835","0.0838","","","","","","1.141","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339498","7.436","0.0007","8.9955","0.0008","12.8669","0.001","80.271","0.005","87.092","0.005","72.335","0.004","808.3","0.12","100","2","100","2","","","","","","","","4","P -1","-P 1","2","[(CuCN)~2~Pym(NH~2~)]","catena-poly[!mu-2-aminopyrimidinedi-!mu-cyano-)dicopper(I)]","","- C12 H10 Cu4 N10 -","- C12 H10 Cu4 N10 -","- C24 H20 Cu8 N20 -","2","1","","Tronic, Tristan A.; deKrafft, Kathryn E; Lim, Mi Jung; Ley, Amanda N.; Pike, Robert D.","Copper(I) cyanide networks: synthesis, luminescence behavior and thermal analysis. Part 1. Diimine ligands.","Inorganic chemistry","2007","46","21","8897","8912","10.1021/ic7007057","","","1.54178","CuKα","","0.0268","0.0244","","","0.0615","0.0629","","","","","","1.048","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339499","3.6804","0.0001","16.4431","0.0006","16.9043","0.0006","90","","90.707","0.002","90","","1022.92","0.06","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[(CuCN)~3~(Pym(NH~2~)~2~)]","catena-poly[!mu-2,4-diaminopyrimidinetri-!mu-cyano-)tricopper(I)]","","- C7 H6 Cu3 N7 -","- C7 H6 Cu3 N7 -","- C28 H24 Cu12 N28 -","4","1","","Tronic, Tristan A.; deKrafft, Kathryn E; Lim, Mi Jung; Ley, Amanda N.; Pike, Robert D.","Copper(I) cyanide networks: synthesis, luminescence behavior and thermal analysis. Part 1. Diimine ligands.","Inorganic chemistry","2007","46","21","8897","8912","10.1021/ic7007057","","","1.54178","CuKα","","0.044","0.0378","","","0.0833","0.0856","","","","","","1.175","","","","has coordinates,has disorder","179497","2020-10-21","18:00:00",""
"4339500","9.0092","0.0004","9.2401","0.0007","10.0496","0.0004","106.253","0.004","115.356","0.003","97.651","0.004","694.24","0.08","100","2","100","2","","","","","","","","4","P -1","-P 1","2","[(CuCN)~4~(Qnz)]","catena-poly[!mu-quinazolinetetra-!mu-cyano-)tetracopper(I)]","","- C12 H6 Cu4 N6 -","- C12 H6 Cu4 N6 -","- C24 H12 Cu8 N12 -","2","1","","Tronic, Tristan A.; deKrafft, Kathryn E; Lim, Mi Jung; Ley, Amanda N.; Pike, Robert D.","Copper(I) cyanide networks: synthesis, luminescence behavior and thermal analysis. Part 1. Diimine ligands.","Inorganic chemistry","2007","46","21","8897","8912","10.1021/ic7007057","","","1.54178","CuKα","","0.0474","0.0359","","","0.0812","0.0868","","","","","","1.041","","","","has coordinates,has disorder","179498","2020-10-21","18:00:00",""
"4339501","6.928","0.0001","14.6097","0.0002","8.0592","0.0001","90","","109.201","0.001","90","","770.342","0.019","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","[(CuCN)~2~(Pdz)]","catena-poly[!mu-pyridazinedi-!mu-cyano-)dicopper(I)]","","- C6 H4 Cu2 N4 -","- C6 H4 Cu2 N4 -","- C24 H16 Cu8 N16 -","4","0.5","","Tronic, Tristan A.; deKrafft, Kathryn E; Lim, Mi Jung; Ley, Amanda N.; Pike, Robert D.","Copper(I) cyanide networks: synthesis, luminescence behavior and thermal analysis. Part 1. Diimine ligands.","Inorganic chemistry","2007","46","21","8897","8912","10.1021/ic7007057","","","1.54178","CuKα","","0.0218","0.0216","","","0.0558","0.0559","","","","","","1.153","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339502","7.1652","0.0014","7.6387","0.0015","29.683","0.006","90","","90","","90","","1624.6","0.6","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","[(CuCN)~2~(Pdz)]","catena-poly[!mu-pyridazinedi-!mu-cyano-)dicopper(I)]","","- C6 H4 Cu2 N4 -","- C6 H4 Cu2 N4 -","- C48 H32 Cu16 N32 -","8","2","","Tronic, Tristan A.; deKrafft, Kathryn E; Lim, Mi Jung; Ley, Amanda N.; Pike, Robert D.","Copper(I) cyanide networks: synthesis, luminescence behavior and thermal analysis. Part 1. Diimine ligands.","Inorganic chemistry","2007","46","21","8897","8912","10.1021/ic7007057","","","1.54178","CuKα","","0.0442","0.044","","","0.1009","0.101","","","","","","1.253","","","","has coordinates,has disorder","179498","2020-10-21","18:00:00",""
"4339503","8.3799","0.0002","14.331","0.0004","14.1163","0.0004","90","","96.151","0.002","90","","1685.5","0.08","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[(CuCN)~5~(Pdz)~2~]","catena-poly[!mu-dipyridazinepenta-!mu-cyano-)pentacopper(I)]","","- C13 H8 Cu5 N9 -","- C13 H8 Cu5 N9 -","- C52 H32 Cu20 N36 -","4","1","","Tronic, Tristan A.; deKrafft, Kathryn E; Lim, Mi Jung; Ley, Amanda N.; Pike, Robert D.","Copper(I) cyanide networks: synthesis, luminescence behavior and thermal analysis. Part 1. Diimine ligands.","Inorganic chemistry","2007","46","21","8897","8912","10.1021/ic7007057","","","1.54178","CuKα","","0.0658","0.0441","","","0.1002","0.1095","","","","","","1.014","","","","has coordinates,has disorder","179498","2020-10-21","18:00:00",""
"4339504","12.3183","0.0002","10.4748","0.0002","9.1013","0.0002","90","","116.854","0.001","90","","1047.71","0.04","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","[(CuCN)~2~(Ptz)]","catena-poly[!mu-phthalazinedi-!mu-cyano-)dicopper(I)]","","- C10 H6 Cu2 N4 -","- C10 H6 Cu2 N4 -","- C40 H24 Cu8 N16 -","4","0.5","","Tronic, Tristan A.; deKrafft, Kathryn E; Lim, Mi Jung; Ley, Amanda N.; Pike, Robert D.","Copper(I) cyanide networks: synthesis, luminescence behavior and thermal analysis. Part 1. Diimine ligands.","Inorganic chemistry","2007","46","21","8897","8912","10.1021/ic7007057","","","1.54178","CuKα","","0.022","0.0205","","","0.0554","0.0562","","","","","","1.164","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339505","10.6409","0.0002","10.804","0.0002","12.5718","0.0002","90","","108.429","0.001","90","","1371.19","0.04","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[(CuCN)~7~(Ptz)~2~)]","catena-poly[di-!mu-phthalazinehepta-!mu-cyano-)heptacopper(I)]","","- C23 H12 Cu7 N11 -","- C23 H12 Cu7 N11 -","- C46 H24 Cu14 N22 -","2","0.5","","Tronic, Tristan A.; deKrafft, Kathryn E; Lim, Mi Jung; Ley, Amanda N.; Pike, Robert D.","Copper(I) cyanide networks: synthesis, luminescence behavior and thermal analysis. Part 1. Diimine ligands.","Inorganic chemistry","2007","46","21","8897","8912","10.1021/ic7007057","","","1.54178","CuKα","","0.0287","0.0245","","","0.0585","0.0603","","","","","","1.064","","","","has coordinates,has disorder","179498","2020-10-21","18:00:00",""
"4339506","10.5566","0.0004","19.5577","0.0007","27.9525","0.0012","90","","99.786","0.003","90","","5687.2","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H38 B2 Co N18 -","- C60 H38 B2 Co N18 -","- C240 H152 B8 Co4 N72 -","4","1","","Zhao, Ningfeng; Van Stipdonk, Michael J.; Bauer, Cary; Campana, Charles; Eichhorn, David M.","Sandwich compounds of cyanotrispyrazolylborates: complexation-induced ligand isomerization.","Inorganic chemistry","2007","46","21","8662","8667","10.1021/ic700628b","","","1.54178","CuKα","","","0.0697","","","","0.1944","","","","","","1.035","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339507","10.5516","0.0005","19.6821","0.0009","28.3107","0.0014","90","","99.355","0.003","90","","5801.3","0.5","100","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H38 B2 Mn N18 -","- C60 H38 B2 Mn N18 -","- C240 H152 B8 Mn4 N72 -","4","1","","Zhao, Ningfeng; Van Stipdonk, Michael J.; Bauer, Cary; Campana, Charles; Eichhorn, David M.","Sandwich compounds of cyanotrispyrazolylborates: complexation-induced ligand isomerization.","Inorganic chemistry","2007","46","21","8662","8667","10.1021/ic700628b","","","1.54178","CuKα","","","0.1048","","","","0.266","","","","","","1.14","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339508","10.5615","0.0003","19.6216","0.0008","28.0887","0.0014","90","","99.535","0.003","90","","5740.5","0.4","100","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H38 B2 Fe N18 -","- C60 H38 B2 Fe N18 -","- C240 H152 B8 Fe4 N72 -","4","1","","Zhao, Ningfeng; Van Stipdonk, Michael J.; Bauer, Cary; Campana, Charles; Eichhorn, David M.","Sandwich compounds of cyanotrispyrazolylborates: complexation-induced ligand isomerization.","Inorganic chemistry","2007","46","21","8662","8667","10.1021/ic700628b","","","1.54178","CuKα","","","0.0911","","","","0.2719","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339509","15.077","","15.077","","8.056","","90","","90","","120","","1585.92","","293","2","","","","","","","","","","5","P -3","-P 3","147","","","","- C30 H19 B N9 Tl -","- C30 H19 B N9 Tl -","- C60 H38 B2 N18 Tl2 -","2","0.333333","","Zhao, Ningfeng; Van Stipdonk, Michael J.; Bauer, Cary; Campana, Charles; Eichhorn, David M.","Sandwich compounds of cyanotrispyrazolylborates: complexation-induced ligand isomerization.","Inorganic chemistry","2007","46","21","8662","8667","10.1021/ic700628b","","x-ray","0.71073","MoKα","","","0.0379","","","","0.1016","","","","","","1.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339510","5.0702","0.0005","11.5985","0.0012","16.9817","0.0017","90","","95.454","0.002","90","","994.12","0.17","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2,4-dinitrophenyl mesylate","","","- C7 H6 N2 O7 S -","- C7 H6 N2 O7 S -","- C28 H24 N8 O28 S4 -","4","1","","Denehy, Emma; White, Jonathan M.; Williams, Spencer J.","Electronic structure of the sulfonyl and phosphonyl groups: a computational and crystallographic study.","Inorganic chemistry","2007","46","21","8871","8886","10.1021/ic700687t","","","0.71073","MoKα","","0.0283","0.0269","","","0.0737","0.0747","","","","","","1.064","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339511","8.9498","0.0007","14.7161","0.0012","7.7765","0.0006","90","","103.312","0.001","90","","996.69","0.14","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3,4-dinitrophenyl mesylate","","","- C7 H6 N2 O7 S -","- C7 H6 N2 O7 S -","- C28 H24 N8 O28 S4 -","4","1","","Denehy, Emma; White, Jonathan M.; Williams, Spencer J.","Electronic structure of the sulfonyl and phosphonyl groups: a computational and crystallographic study.","Inorganic chemistry","2007","46","21","8871","8886","10.1021/ic700687t","","","0.71073","MoKα","","0.0371","0.0342","","","0.0972","0.0995","","","","","","1.181","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339512","8.7544","0.0006","10.6963","0.0008","12.4918","0.0009","77.982","0.001","74.54","0.001","71.626","0.001","1060.02","0.13","130","2","130","2","","","","","","","","6","P -1","-P 1","2","4-nitro-3-(trifluoromethyl)phenyl mesylate","","","- C8 H6 F3 N O5 S -","- C8 H6 F3 N O5 S -","- C32 H24 F12 N4 O20 S4 -","4","2","","Denehy, Emma; White, Jonathan M.; Williams, Spencer J.","Electronic structure of the sulfonyl and phosphonyl groups: a computational and crystallographic study.","Inorganic chemistry","2007","46","21","8871","8886","10.1021/ic700687t","","","0.71073","MoKα","","0.0426","0.0394","","","0.0996","0.1016","","","","","","1.084","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339513","7.1901","0.0005","12.1454","0.0009","9.8156","0.0007","90","","90.169","0.001","90","","857.16","0.11","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-nitrophenyl mesylate","","","- C7 H7 N O5 S -","- C7 H7 N O5 S -","- C28 H28 N4 O20 S4 -","4","1","","Denehy, Emma; White, Jonathan M.; Williams, Spencer J.","Electronic structure of the sulfonyl and phosphonyl groups: a computational and crystallographic study.","Inorganic chemistry","2007","46","21","8871","8886","10.1021/ic700687t","","","0.71073","MoKα","","0.0271","0.0261","","","0.0714","0.0721","","","","","","1.045","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339514","14.24","0.002","8.8459","0.0012","15.721","0.002","90","","116.664","0.002","90","","1769.7","0.4","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","4-cyanophenyl mesylate","","","- C8 H7 N O3 S -","- C8 H7 N O3 S -","- C64 H56 N8 O24 S8 -","8","1","","Denehy, Emma; White, Jonathan M.; Williams, Spencer J.","Electronic structure of the sulfonyl and phosphonyl groups: a computational and crystallographic study.","Inorganic chemistry","2007","46","21","8871","8886","10.1021/ic700687t","","","0.71073","MoKα","","0.0367","0.034","","","0.0875","0.0887","","","","","","1.082","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339515","6.62","0.0018","8.012","0.002","9.37","0.003","77.771","0.004","70.901","0.004","70.22","0.005","439","0.2","130","2","130","2","","","","","","","","5","P -1","-P 1","2","3-nitrophenyl mesylate","","","- C7 H7 N O5 S -","- C7 H7 N O5 S -","- C14 H14 N2 O10 S2 -","2","1","","Denehy, Emma; White, Jonathan M.; Williams, Spencer J.","Electronic structure of the sulfonyl and phosphonyl groups: a computational and crystallographic study.","Inorganic chemistry","2007","46","21","8871","8886","10.1021/ic700687t","","","0.71073","MoKα","","0.0301","0.0289","","","0.0762","0.0769","","","","","","1.067","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339516","5.6017","0.0005","7.914","0.0006","11.5595","0.0009","72.524","0.001","83.075","0.001","82.338","0.001","482.68","0.07","130","2","130","2","","","","","","","","5","P -1","-P 1","2","4-nitrobenzyl mesylate","","","- C8 H9 N O5 S -","- C8 H9 N O5 S -","- C16 H18 N2 O10 S2 -","2","1","","Denehy, Emma; White, Jonathan M.; Williams, Spencer J.","Electronic structure of the sulfonyl and phosphonyl groups: a computational and crystallographic study.","Inorganic chemistry","2007","46","21","8871","8886","10.1021/ic700687t","","","0.71073","MoKα","","0.0321","0.0308","","","0.0881","0.0895","","","","","","1.088","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339517","10.7874","0.0008","7.8525","0.0006","11.301","0.0008","90","","117.831","0.001","90","","846.56","0.11","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","4-chlorophenyl mesylate","","","- C7 H7 Cl O3 S -","- C7 H7 Cl O3 S -","- C28 H28 Cl4 O12 S4 -","4","1","","Denehy, Emma; White, Jonathan M.; Williams, Spencer J.","Electronic structure of the sulfonyl and phosphonyl groups: a computational and crystallographic study.","Inorganic chemistry","2007","46","21","8871","8886","10.1021/ic700687t","","","0.71073","MoKα","","0.0289","0.0276","","","0.0775","0.0785","","","","","","1.121","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339518","11.516","0.002","13.671","0.003","13.296","0.003","90","","99.851","0.009","90","","2062.4","0.7","180","2","180","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H30 N4 O -","- C21 H30 N4 O -","- C84 H120 N16 O4 -","4","2","","Otero, Antonio; Fernandez-Baeza, Juan; Antiñolo, Antonio; Tejeda, Juan; Lara-Sanchez, Agustín; Sanchez-Barba, Luis F; Sanchez-Molina, Margarita; Franco, Sonia; López-Solera, Maria I; Rodríguez, Ana M","Highly diastereoselective nucleophilic addition to myrtenal. Straightforward synthesis of an enantiopure scorpionate ligand.","Inorganic chemistry","2007","46","21","8475","8477","10.1021/ic701388w","","","0.71073","MoKα","","0.2346","0.0634","","","0.126","0.1742","","","","","","0.646","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339519","10.667","0.0016","13.303","0.002","17.08","0.003","90","","90","","90","","2423.7","0.7","180","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H29 Cl3 N4 O Ti -","- C21 H29 Cl3 N4 O Ti -","- C84 H116 Cl12 N16 O4 Ti4 -","4","1","","Otero, Antonio; Fernandez-Baeza, Juan; Antiñolo, Antonio; Tejeda, Juan; Lara-Sanchez, Agustín; Sanchez-Barba, Luis F; Sanchez-Molina, Margarita; Franco, Sonia; López-Solera, Maria I; Rodríguez, Ana M","Highly diastereoselective nucleophilic addition to myrtenal. Straightforward synthesis of an enantiopure scorpionate ligand.","Inorganic chemistry","2007","46","21","8475","8477","10.1021/ic701388w","","","0.71073","MoKα","","0.0755","0.0474","","","0.097","0.1105","","","","","","1.006","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339520","16.2173","0.0001","19.4524","0.0001","20.9254","0.0001","69.593","0.001","70.893","0.001","87.723","0.001","5825.43","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C115 H92 F18 N7 P6 Pt3 -","- C115 H92 F18 N7 P6 Pt3 -","- C230 H184 F36 N14 P12 Pt6 -","2","1","","Shao, Pin; Sun, Wenfang","Trinuclear platinum(II) 4,6-diphenyl-2,2'-bipyridyl complex with bis(diphenylphosphinomethyl)phenylphosphine auxiliary ligand: synthesis, structural characterization, and photophysics.","Inorganic chemistry","2007","46","21","8603","8612","10.1021/ic700757x","","","0.71073","MoKα","","0.1203","0.0526","","","0.1343","0.1506","","","","","","1.009","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339521","12.549","0.003","11.284","0.002","16.009","0.003","90","","111.72","0.03","90","","2106","0.9","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H16 Cl2 Mo2 N8 O5 -","- C12 H16 Cl2 Mo2 N8 O5 -","- C48 H64 Cl8 Mo8 N32 O20 -","4","0.5","","Pereira, Cláudia C L; Balula, Salete S.; Paz, Filipe A Almeida; Valente, Anabela A.; Pillinger, Martyn; Klinowski, Jacek; Gonçalves, Isabel S","A highly efficient dioxo(mu-oxo)molybdenum(VI) dimer catalyst for olefin epoxidation.","Inorganic chemistry","2007","46","21","8508","8510","10.1021/ic701746r","","","0.71073","MoKα","","0.0302","0.0259","","","0.0594","0.0616","","","","","","1.102","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339522","29.4764","0.0007","35.6269","0.0008","19.0523","0.0003","90","","108.747","0.0008","90","","18946.4","0.7","153.1","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C114 H261 Cl4 N7 O74 Si2 W20 Zr2 -","- C114 Cl4 N7 O74 Si2 W20 Zr2 -","- C456 Cl16 N28 O296 Si8 W80 Zr8 -","4","1","","Yamaguchi, Syuhei; Kikukawa, Yuji; Tsuchida, Kazutaka; Nakagawa, Yoshinao; Uehara, Kazuhiro; Yamaguchi, Kazuya; Mizuno, Noritaka","Synthesis and structural characterization of a gamma-Keggin-type dimeric silicotungstate with a bis(mu-hydroxo) dizirconium core [(gamma-SiW10O36)2Zr2(mu-OH)2]10-.","Inorganic chemistry","2007","46","21","8502","8504","10.1021/ic701488s","","","0.71069","MoKα","","","0.068","","","","0.202","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339523","7.0008","0.001","9.7164","0.0011","16.693","0.002","94.219","0.01","99.415","0.011","92.663","0.01","1115.2","0.2","","","100","0.3","","","","","","","","6","P -1","-P 1","2","","","","- C17 H25 N3 O3 S4 Zn -","- C17 H25 N3 O3 S4 Zn -","- C34 H50 N6 O6 S8 Zn2 -","2","1","","Neofotistou, Eleftheria; Malliakas, Christos D.; Trikalitis, Pantelis N.","Novel coordination polymers based on the tetrathioterephthalate dianion as the bridging ligand.","Inorganic chemistry","2007","46","21","8487","8489","10.1021/ic701414v","","","0.70926","MoKα","","0.1165","0.0724","","","0.1162","0.1277","","","","1.34","1.34","1.19","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339524","53.402","0.011","26.317","0.005","12.682","0.003","90","","99.28","0.03","90","","17590","7","123","2","123","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","RuBisBipyBipyCOOH","","","- C128 H100 F42 N24 O8 P7 Ru4 -","- C128 H100 F42 N24 O8 P7 Ru4 -","- C512 H400 F168 N96 O32 P28 Ru16 -","4","0.5","","Nickita, Nickita; Belousoff, Matthew J.; Bhatt, Anand I.; Bond, Alan M.; Deacon, Glen B.; Gasser, Gilles; Spiccia, Leone","Synthesis, structure, spectroscopic properties, and electrochemical oxidation of ruthenium(II) complexes Incorporating monocarboxylate bipyridine ligands.","Inorganic chemistry","2007","46","21","8638","8651","10.1021/ic700796m","","","0.71073","MoKα","","0.1599","0.0733","","","0.1729","0.2061","","","","","","0.912","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339525","18.7207","0.0007","19.7328","0.0009","20.2842","0.001","90","","93.771","0.002","90","","7477","0.6","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Ru(Phen)2(Bpy-COO)](ClO4)(H2O)7","[Ru(Phen)2(Bpy-COO)](ClO4)(H2O)7","","- C72 H50 Cl2 N12 O24 Ru2 -","- C72 H50 Cl2 N12 O24 Ru2 -","- C288 H200 Cl8 N48 O96 Ru8 -","4","0.5","","Nickita, Nickita; Belousoff, Matthew J.; Bhatt, Anand I.; Bond, Alan M.; Deacon, Glen B.; Gasser, Gilles; Spiccia, Leone","Synthesis, structure, spectroscopic properties, and electrochemical oxidation of ruthenium(II) complexes Incorporating monocarboxylate bipyridine ligands.","Inorganic chemistry","2007","46","21","8638","8651","10.1021/ic700796m","","","0.71073","MoKα","","0.0702","0.0649","","","0.141","0.1439","","","","","","1.187","","","","has coordinates,has disorder","179498","2020-10-21","18:00:00",""
"4339526","4.0953","0.0011","10.735","0.003","14.335","0.004","90","","90","","90","","630.2","0.3","120","2","120","2","","","","","","","","2","C m c m","-C 2c 2","63","","","","- Gd3 Ge4 -","- Gd3 Ge4 -","- Gd12 Ge16 -","4","0.25","","Tobash, Paul H.; DiFilippo, Gary; Bobev, Svilen; Hur, Namjung; Thompson, Joe D.; Sarrao, John L.","Structure and properties of Gd3Ge4: the orthorhombic RE3Ge4 structures revisited (RE = Y, Tb-Tm).","Inorganic chemistry","2007","46","21","8690","8697","10.1021/ic7009034","","","0.71073","MoKα","","0.0238","0.0217","","","0.0492","0.0501","","","","","","1.149","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339527","4.0629","0.0007","10.6647","0.0019","14.245","0.003","90","","90","","90","","617.2","0.2","120","2","120","2","","","","","","","","2","C m c m","-C 2c 2","63","","","","- Ge4 Tb3 -","- Ge4 Tb3 -","- Ge16 Tb12 -","4","0.25","","Tobash, Paul H.; DiFilippo, Gary; Bobev, Svilen; Hur, Namjung; Thompson, Joe D.; Sarrao, John L.","Structure and properties of Gd3Ge4: the orthorhombic RE3Ge4 structures revisited (RE = Y, Tb-Tm).","Inorganic chemistry","2007","46","21","8690","8697","10.1021/ic7009034","","","0.71073","MoKα","","0.0226","0.0214","","","0.0434","0.044","","","","","","1.205","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339528","4.0401","0.0011","10.604","0.003","14.159","0.004","90","","90","","90","","606.6","0.3","120","2","120","2","","","","","","","","2","C m c m","-C 2c 2","63","","","","- Dy3 Ge4 -","- Dy3 Ge4 -","- Dy12 Ge16 -","4","0.25","","Tobash, Paul H.; DiFilippo, Gary; Bobev, Svilen; Hur, Namjung; Thompson, Joe D.; Sarrao, John L.","Structure and properties of Gd3Ge4: the orthorhombic RE3Ge4 structures revisited (RE = Y, Tb-Tm).","Inorganic chemistry","2007","46","21","8690","8697","10.1021/ic7009034","","","0.71073","MoKα","","0.0316","0.0265","","","0.0542","0.0559","","","","","","1.12","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339529","4.0305","0.0017","10.582","0.004","14.138","0.006","90","","90","","90","","603","0.4","120","2","120","2","","","","","","","","2","C m c m","-C 2c 2","63","","","","- Ge4 Ho3 -","- Ge4 Ho3 -","- Ge16 Ho12 -","4","0.25","","Tobash, Paul H.; DiFilippo, Gary; Bobev, Svilen; Hur, Namjung; Thompson, Joe D.; Sarrao, John L.","Structure and properties of Gd3Ge4: the orthorhombic RE3Ge4 structures revisited (RE = Y, Tb-Tm).","Inorganic chemistry","2007","46","21","8690","8697","10.1021/ic7009034","","","0.71073","MoKα","","0.0257","0.0217","","","0.0447","0.0458","","","","","","1.183","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339530","4.0011","0.0014","10.521","0.004","14.074","0.005","90","","90","","90","","592.5","0.4","120","2","120","2","","","","","","","","2","C m c m","-C 2c 2","63","","","","- Er3 Ge4 -","- Er3 Ge4 -","- Er12 Ge16 -","4","0.25","","Tobash, Paul H.; DiFilippo, Gary; Bobev, Svilen; Hur, Namjung; Thompson, Joe D.; Sarrao, John L.","Structure and properties of Gd3Ge4: the orthorhombic RE3Ge4 structures revisited (RE = Y, Tb-Tm).","Inorganic chemistry","2007","46","21","8690","8697","10.1021/ic7009034","","","0.71073","MoKα","","0.032","0.0252","","","0.0526","0.0544","","","","","","1.052","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339531","3.98","0.002","10.481","0.005","14.035","0.007","90","","90","","90","","585.5","0.5","120","2","120","2","","","","","","","","2","C m c m","-C 2c 2","63","","","","- Ge4 Tm3 -","- Ge4 Tm3 -","- Ge16 Tm12 -","4","0.25","","Tobash, Paul H.; DiFilippo, Gary; Bobev, Svilen; Hur, Namjung; Thompson, Joe D.; Sarrao, John L.","Structure and properties of Gd3Ge4: the orthorhombic RE3Ge4 structures revisited (RE = Y, Tb-Tm).","Inorganic chemistry","2007","46","21","8690","8697","10.1021/ic7009034","","","0.71073","MoKα","","0.0528","0.0358","","","0.0716","0.0766","","","","","","1.046","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339532","4.0562","0.0015","10.63","0.004","14.2","0.005","90","","90","","90","","612.3","0.4","120","2","120","2","","","","","","","","2","C m c m","-C 2c 2","63","","","","- Ge4 Y3 -","- Ge4 Y3 -","- Ge16 Y12 -","4","0.25","","Tobash, Paul H.; DiFilippo, Gary; Bobev, Svilen; Hur, Namjung; Thompson, Joe D.; Sarrao, John L.","Structure and properties of Gd3Ge4: the orthorhombic RE3Ge4 structures revisited (RE = Y, Tb-Tm).","Inorganic chemistry","2007","46","21","8690","8697","10.1021/ic7009034","","","0.71073","MoKα","","0.0314","0.0247","","","0.0555","0.0582","","","","","","1.06","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339533","8.4565","0.0003","7.8249","0.0003","24.617","0.0011","90","","99.78","0.03","90","","1605.27","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- As4.43 Eu3 Li0.73 S10 -","- As4.431 Eu3 Li0.729 S10 -","- As17.724 Eu12 Li2.916 S40 -","4","1","","Bera, Tarun K.; Iyer, Ratnasabapathy G.; Malliakas, Christos D.; Kanatzidis, Mercouri G.","Eu3(AsS4)2 and AxEu(3-y)As(5-z)S10 (A = Li, Na): compounds with simple and complex thioarsenate building blocks.","Inorganic chemistry","2007","46","21","8466","8468","10.1021/ic701067r","","","0.71073","MoKα","","0.0425","0.0366","","","0.0938","0.0966","","","","","","1.074","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339534","8.43","0.0006","7.804","0.0004","25.139","0.002","90","","100.226","0.006","90","","1627.6","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- As4.54 Eu2.86 Na0.66 S10 -","- As4.54 Eu2.86 Na0.65 S10 -","- As18.16 Eu11.44 Na2.6 S40 -","4","1","","Bera, Tarun K.; Iyer, Ratnasabapathy G.; Malliakas, Christos D.; Kanatzidis, Mercouri G.","Eu3(AsS4)2 and AxEu(3-y)As(5-z)S10 (A = Li, Na): compounds with simple and complex thioarsenate building blocks.","Inorganic chemistry","2007","46","21","8466","8468","10.1021/ic701067r","","","0.71073","MoKα","","0.0568","0.0449","","","0.0981","0.1056","","","","","","1.088","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339535","9.254","0.003","9.254","0.003","27.698","0.012","90","","90","","120","","2054.2","1.3","293","2","293","2","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- As4 Eu6 S16 -","- As4 Eu6 S16 -","- As12 Eu18 S48 -","3","0.0833333","","Bera, Tarun K.; Iyer, Ratnasabapathy G.; Malliakas, Christos D.; Kanatzidis, Mercouri G.","Eu3(AsS4)2 and AxEu(3-y)As(5-z)S10 (A = Li, Na): compounds with simple and complex thioarsenate building blocks.","Inorganic chemistry","2007","46","21","8466","8468","10.1021/ic701067r","","","0.71073","MoKα","","0.0272","0.0238","","","0.058","0.0598","","","","","","1.088","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339536","17.069","0.002","18.518","0.002","19.202","0.003","90","","90","","90","","6069.4","1.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C34 H30 Cr N8 -","- C36 H30 Cr N8 -","- C288 H240 Cr8 N64 -","8","1","","Sanyal, Anasuya; Chatterjee, Sudipta; Castiñeiras, Alfonso; Sarkar, Biprajit; Singh, Priti; Fiedler, Jan; Zális, Stanislav; Kaim, Wolfgang; Goswami, Sreebrata","Singlet diradical complexes of chromium, molybdenum, and tungsten with azo anion radical ligands from M(CO)6 precursors.","Inorganic chemistry","2007","46","21","8584","8593","10.1021/ic700584x","","","0.71073","MoKα","","0.0684","0.0585","","","0.1192","0.1228","","","","","","1.322","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339537","10.4134","0.0014","17.031","0.002","16.337","0.002","90.058","0.002","104.629","0.002","89.99","0.002","2803.4","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H26 N8 W -","- C34 H26 N8 W -","- C136 H104 N32 W4 -","4","2","","Sanyal, Anasuya; Chatterjee, Sudipta; Castiñeiras, Alfonso; Sarkar, Biprajit; Singh, Priti; Fiedler, Jan; Zális, Stanislav; Kaim, Wolfgang; Goswami, Sreebrata","Singlet diradical complexes of chromium, molybdenum, and tungsten with azo anion radical ligands from M(CO)6 precursors.","Inorganic chemistry","2007","46","21","8584","8593","10.1021/ic700584x","","","0.71073","MoKα","","0.0306","0.0258","","","0.0675","0.0697","","","","","","1.047","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339538","12.887","0.014","13.048","0.014","30.18","0.03","90","","93.941","0.019","90","","5063","9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H44 Mo2 N14 O -","- C56 H44 Mo2 N14 O -","- C224 H176 Mo8 N56 O4 -","4","1","","Sanyal, Anasuya; Chatterjee, Sudipta; Castiñeiras, Alfonso; Sarkar, Biprajit; Singh, Priti; Fiedler, Jan; Zális, Stanislav; Kaim, Wolfgang; Goswami, Sreebrata","Singlet diradical complexes of chromium, molybdenum, and tungsten with azo anion radical ligands from M(CO)6 precursors.","Inorganic chemistry","2007","46","21","8584","8593","10.1021/ic700584x","","","0.71073","MoKα","","0.1546","0.0607","","","0.1212","0.1743","","","","","","1.027","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339539","12.475","0.002","14.6256","0.0019","15.548","0.003","90","","94.518","0.005","90","","2828","0.8","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H36 Dy O28 P4 Ru2 -","- C4 H36 Dy O28 P4 Ru2 -","- C16 H144 Dy4 O112 P16 Ru8 -","4","0.5","","Liu, Bin; Li, Bao-Long; Li, Yi-Zhi; Chen, Yu; Bao, Song-Song; Zheng, Li-Min","Lanthanide diruthenium(II,III) compounds showing layered and PtS-type open framework structures.","Inorganic chemistry","2007","46","21","8524","8532","10.1021/ic0621695","","","0.7107","MoKα","","0.0474","0.043","","","0.1345","0.1375","","","","","","1.041","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339540","13.15","0.06","14.91","0.07","15.69","0.07","90","","93.73","0.05","90","","3070","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H36 O28 P4 Pr Ru2 -","- C4 H36 O28 P4 Pr Ru2 -","- C16 H144 O112 P16 Pr4 Ru8 -","4","0.5","","Liu, Bin; Li, Bao-Long; Li, Yi-Zhi; Chen, Yu; Bao, Song-Song; Zheng, Li-Min","Lanthanide diruthenium(II,III) compounds showing layered and PtS-type open framework structures.","Inorganic chemistry","2007","46","21","8524","8532","10.1021/ic0621695","","","0.71073","MoKα","","0.069","0.0543","","","0.1117","0.1163","","","","","","1.047","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339541","12.495","0.018","14.45","0.02","15.39","0.02","90","","94.146","0.013","90","","2771","7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H36 Ho O28 P4 Ru2 -","- C4 H36 Ho O28 P4 Ru2 -","- C16 H144 Ho4 O112 P16 Ru8 -","4","0.5","","Liu, Bin; Li, Bao-Long; Li, Yi-Zhi; Chen, Yu; Bao, Song-Song; Zheng, Li-Min","Lanthanide diruthenium(II,III) compounds showing layered and PtS-type open framework structures.","Inorganic chemistry","2007","46","21","8524","8532","10.1021/ic0621695","","","0.71073","MoKα","","0.072","0.0489","","","0.0855","0.0892","","","","","","0.981","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339542","12.458","0.003","14.583","0.004","15.524","0.004","90","","94.497","0.004","90","","2811.6","1.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H36 O28 P4 Ru2 Tb -","- C4 H36 O28 P4 Ru2 Tb -","- C16 H144 O112 P16 Ru8 Tb4 -","4","0.5","","Liu, Bin; Li, Bao-Long; Li, Yi-Zhi; Chen, Yu; Bao, Song-Song; Zheng, Li-Min","Lanthanide diruthenium(II,III) compounds showing layered and PtS-type open framework structures.","Inorganic chemistry","2007","46","21","8524","8532","10.1021/ic0621695","","","0.71073","MoKα","","0.0382","0.0338","","","0.0955","0.0972","","","","","","1.012","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339543","12.475","0.002","14.6256","0.0019","15.548","0.003","90","","94.518","0.005","90","","2828","0.8","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H36 Gd O28 P4 Ru2 -","- C4 H36 Gd O28 P4 Ru2 -","- C16 H144 Gd4 O112 P16 Ru8 -","4","0.5","","Liu, Bin; Li, Bao-Long; Li, Yi-Zhi; Chen, Yu; Bao, Song-Song; Zheng, Li-Min","Lanthanide diruthenium(II,III) compounds showing layered and PtS-type open framework structures.","Inorganic chemistry","2007","46","21","8524","8532","10.1021/ic0621695","","","0.7107","MoKα","","0.0545","0.045","","","0.1134","0.1167","","","","","","1","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339544","12.8719","0.0019","12.783","0.002","15.692","0.002","90","","108.219","0.003","90","","2452.5","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H28 Ce O24 P4 Ru2 -","- C4 H28 Ce O24 P4 Ru2 -","- C16 H112 Ce4 O96 P16 Ru8 -","4","1","","Liu, Bin; Li, Bao-Long; Li, Yi-Zhi; Chen, Yu; Bao, Song-Song; Zheng, Li-Min","Lanthanide diruthenium(II,III) compounds showing layered and PtS-type open framework structures.","Inorganic chemistry","2007","46","21","8524","8532","10.1021/ic0621695","","","0.71073","MoKα","","0.0932","0.0549","","","0.0895","0.0961","","","","","","1.016","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339545","12.376","0.004","14.501","0.005","15.451","0.005","90","","94.416","0.003","90","","2764.7","1.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H36 Er O28 P4 Ru2 -","- C4 H36 Er O28 P4 Ru2 -","- C16 H144 Er4 O112 P16 Ru8 -","4","0.5","","Liu, Bin; Li, Bao-Long; Li, Yi-Zhi; Chen, Yu; Bao, Song-Song; Zheng, Li-Min","Lanthanide diruthenium(II,III) compounds showing layered and PtS-type open framework structures.","Inorganic chemistry","2007","46","21","8524","8532","10.1021/ic0621695","","","0.71073","MoKα","","0.0765","0.0541","","","0.1121","0.1174","","","","","","1.088","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339546","12.534","0.003","14.703","0.003","15.625","0.004","90","","94.481","0.006","90","","2870.7","1.2","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H36 Nd O28 P4 Ru2 -","- C4 H36 Nd O28 P4 Ru2 -","- C16 H144 Nd4 O112 P16 Ru8 -","4","0.5","","Liu, Bin; Li, Bao-Long; Li, Yi-Zhi; Chen, Yu; Bao, Song-Song; Zheng, Li-Min","Lanthanide diruthenium(II,III) compounds showing layered and PtS-type open framework structures.","Inorganic chemistry","2007","46","21","8524","8532","10.1021/ic0621695","","","0.7107","MoKα","","0.0363","0.0309","","","0.0717","0.0735","","","","","","0.994","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339547","12.955","0.002","12.858","0.002","15.735","0.003","90","","108.098","0.003","90","","2491.4","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H28 La O24 P4 Ru2 -","- C4 H28 La O24 P4 Ru2 -","- C16 H112 La4 O96 P16 Ru8 -","4","1","","Liu, Bin; Li, Bao-Long; Li, Yi-Zhi; Chen, Yu; Bao, Song-Song; Zheng, Li-Min","Lanthanide diruthenium(II,III) compounds showing layered and PtS-type open framework structures.","Inorganic chemistry","2007","46","21","8524","8532","10.1021/ic0621695","","","0.71073","MoKα","","0.0663","0.0463","","","0.0928","0.0972","","","","","","1.001","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339548","12.6142","0.0013","14.7918","0.0016","15.7262","0.0013","90","","94.227","0.003","90","","2926.3","0.5","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H36 La O28 P4 Ru2 -","- C4 H36 La O28 P4 Ru2 -","- C16 H144 La4 O112 P16 Ru8 -","4","0.5","","Liu, Bin; Li, Bao-Long; Li, Yi-Zhi; Chen, Yu; Bao, Song-Song; Zheng, Li-Min","Lanthanide diruthenium(II,III) compounds showing layered and PtS-type open framework structures.","Inorganic chemistry","2007","46","21","8524","8532","10.1021/ic0621695","","","0.7107","MoKα","","0.0182","0.0179","","","0.0481","0.0483","","","","","","1.022","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339549","14.428","0.009","13.924","0.009","19.35","0.01","90","","100.15","0.03","90","","3826","4","296.1","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C22 H12 Br4 Fe O2 S8 Se8 -","- C22 H12 Br4 Fe O2 S8 Se8 -","- C88 H48 Br16 Fe4 O8 S32 Se32 -","4","1","","Hayashi, Toshiki; Xiao, Xunwen; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Katori, Hiroko Aruga","Weak ferromagnetism in a semiconducting (ethylenedithiodiselena- dithiafulvalenoquinone-1,3-diselenolemethide)2.FeBr4 salt.","Inorganic chemistry","2007","46","21","8478","8480","10.1021/ic701260p","","","0.7107","MoKα","","","0.038","","","","0.053","","","","","","1.037","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339550","14.4459","0.0005","13.9377","0.0004","19.3784","0.0006","90","","100.107","0.0009","90","","3841.2","0.2","296.1","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C22 H12 Br4 Ga O2 S8 Se8 -","- C22 H12 Br4 Ga O2 S8 Se8 -","- C88 H48 Br16 Ga4 O8 S32 Se32 -","4","1","","Hayashi, Toshiki; Xiao, Xunwen; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Katori, Hiroko Aruga","Weak ferromagnetism in a semiconducting (ethylenedithiodiselena- dithiafulvalenoquinone-1,3-diselenolemethide)2.FeBr4 salt.","Inorganic chemistry","2007","46","21","8478","8480","10.1021/ic701260p","","","0.7107","MoKα","","","0.037","","","","0.046","","","","","","0.937","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339551","10.0725","0.0007","9.8937","0.0006","12.0531","0.0008","90","","105.605","0.001","90","","1156.87","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Zinc(II) meso-iminodisuccinate hydrate","","","- C8 H8.14 N O8.57 Zn2 -","- C8 H8.142 N O8.571 Zn2 -","- C32 H32.568 N4 O34.284 Zn8 -","4","1","","Feller, Russell K.; Forster, Paul M.; Wudl, Fred; Cheetham, Anthony K.","Two coordination polymers created via in situ ligand synthesis involving C-N and C-C bond formation.","Inorganic chemistry","2007","46","21","8717","8721","10.1021/ic700997c","","","0.71073","MoKα","","0.0304","0.0241","","","0.0615","0.0643","","","","","","1.025","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339552","5.011","0.003","6.526","0.003","12.305","0.007","76.868","0.008","84.988","0.008","87.619","0.008","390.3","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","Tetraaquanickel(II) 5,10-dioxo-5,10-dihydro-4,9-dioxa-pyrene-2,7-dicarboxylate","","","- C16 H12 Ni O12 -","- C16 H12 Ni O12 -","- C16 H12 Ni O12 -","1","0.5","","Feller, Russell K.; Forster, Paul M.; Wudl, Fred; Cheetham, Anthony K.","Two coordination polymers created via in situ ligand synthesis involving C-N and C-C bond formation.","Inorganic chemistry","2007","46","21","8717","8721","10.1021/ic700997c","","","0.71073","MoKα","","0.0532","0.0469","","","0.1196","0.1241","","","","","","1.07","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339553","12.8899","0.0009","19.1761","0.001","17.196","0.0013","90","","103.841","0.004","90","","4127.1","0.5","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H57 Mn N4 O11 P -","- C41 H57 Mn N4 O11 P -","- C164 H228 Mn4 N16 O44 P4 -","4","1","","Yang, Chang-Tong; Li, Yongxin; Liu, Shuang","Synthesis and structural characterization of complexes of a DO3A-conjugated triphenylphosphonium cation with diagnostically important metal ions.","Inorganic chemistry","2007","46","21","8988","8997","10.1021/ic7010452","","","0.71073","MO-Kα","","0.098","0.069","","","0.161","0.179","","","","","","1.013","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339554","28.9585","0.0009","8.1509","0.0001","19.6548","0.0006","90","","90","","90","","4639.3","0.2","150","","150","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C43 H64 Ga N5 O16 P -","- C43 H51 Ga N5 O16 P -","- C172 H204 Ga4 N20 O64 P4 -","4","1","","Yang, Chang-Tong; Li, Yongxin; Liu, Shuang","Synthesis and structural characterization of complexes of a DO3A-conjugated triphenylphosphonium cation with diagnostically important metal ions.","Inorganic chemistry","2007","46","21","8988","8997","10.1021/ic7010452","","","0.71073","MO-Kα","","0.061","0.043","","","0.094","0.1","","","","","","1.042","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339555","10.7779","0.0009","16.304","0.0017","16.452","0.0018","103.482","0.006","106.939","0.005","104.783","0.006","2521.9","0.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H69 In N4 O16.5 P -","- C45 H67 In N4 O16.5 P -","- C90 H134 In2 N8 O33 P2 -","2","1","","Yang, Chang-Tong; Li, Yongxin; Liu, Shuang","Synthesis and structural characterization of complexes of a DO3A-conjugated triphenylphosphonium cation with diagnostically important metal ions.","Inorganic chemistry","2007","46","21","8988","8997","10.1021/ic7010452","","","0.71073","MoKα","","0.0844","0.0555","","","0.1353","0.1606","","","","","","1.075","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339556","10.4723","0.0011","11.6071","0.0013","14.5877","0.0015","87.553","0.006","78.799","0.005","83.749","0.005","1728.6","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H41 Cl O5 P3 Rh -","- C35 H41 Cl O5 P3 Rh -","- C70 H82 Cl2 O10 P6 Rh2 -","2","1","","Lorenzini, Fabio; Patrick, Brian O.; James, Brian R.","Formation of a phosphine-phosphinite ligand in RhCl(PRR'2)[P,P-R'(R)POCH2P(CH2OH)2] and R'H from cis-RhCl(PRR'2)2[P(CH2OH)3] via P-C bond cleavage.","Inorganic chemistry","2007","46","21","8998","9002","10.1021/ic7012182","","","0.71073","MoKα","","0.0513","0.0318","","","0.0614","0.0678","","","","","","1.01","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339557","12.035","0.005","12.357","0.005","13.231","0.005","109.667","0.004","91.205","0.001","117.254","0.002","1610.7","1.1","295","2","295","2","","","","","","","","6","P -1","-P 1","2","compound 1","","","- C18 H39 Bi Cu I5 N2 -","- C18 H39 Bi Cu I5 N2 -","- C36 H78 Bi2 Cu2 I10 N4 -","2","1","","Chai, Wen-Xiang; Wu, Li-Ming; Li, Jun-Qian; Chen, Ling","A series of new copper iodobismuthates: structural relationships, optical band gaps affected by dimensionality, and distinct thermal stabilities.","Inorganic chemistry","2007","46","21","8698","8704","10.1021/ic700904d","","","0.71073","MoKα","","0.047","0.0378","","","0.0944","0.0977","","","","","","0.986","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339558","8.518","0.001","10.8713","0.0011","11.4253","0.0012","93.642","0.003","99.261","0.006","98.105","0.006","1029.75","0.19","295","2","295","2","","","","","","","","6","P -1","-P 1","2","compound 2","","","- C8 H20 Bi Cu I5 N -","- C8 H20 Bi Cu I5 N -","- C16 H40 Bi2 Cu2 I10 N2 -","2","1","","Chai, Wen-Xiang; Wu, Li-Ming; Li, Jun-Qian; Chen, Ling","A series of new copper iodobismuthates: structural relationships, optical band gaps affected by dimensionality, and distinct thermal stabilities.","Inorganic chemistry","2007","46","21","8698","8704","10.1021/ic700904d","","","0.71073","MoKα","","0.0459","0.0396","","","0.0993","0.102","","","","","","1.039","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339559","8.34","0.004","11","0.006","13.342","0.007","111.406","0.005","90.506","0.006","90.458","0.005","1139.4","1","295","2","295","2","","","","","","","","6","P -1","-P 1","2","compound 3","","","- C8 H12 Bi Cu2 I5 N4 -","- C8 H12 Bi Cu2 I5 N4 -","- C16 H24 Bi2 Cu4 I10 N8 -","2","1","","Chai, Wen-Xiang; Wu, Li-Ming; Li, Jun-Qian; Chen, Ling","A series of new copper iodobismuthates: structural relationships, optical band gaps affected by dimensionality, and distinct thermal stabilities.","Inorganic chemistry","2007","46","21","8698","8704","10.1021/ic700904d","","","0.71073","MoKα","","0.0591","0.0503","","","0.1334","0.1482","","","","","","1.015","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339560","8.0028","0.0006","14.6046","0.0005","18.226","0.002","90","","93.079","0.009","90","","2127.1","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H21 Fe N9 O13 -","- C13 H21 Fe N9 O13 -","- C52 H84 Fe4 N36 O52 -","4","1","","Liu, Gao-Feng; Filipović, Milos; Heinemann, Frank W.; Ivanović-Burmazović, Ivana","Seven-coordinate iron and manganese complexes with acyclic and rigid pentadentate chelates and their superoxide dismutase activity.","Inorganic chemistry","2007","46","21","8825","8835","10.1021/ic7012039","","","0.71073","MoKα","","0.0356","0.0262","","","0.0629","0.0671","","","","","","1.034","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339561","10.245","0.001","19.031","0.001","22.756","0.001","90","","90","","90","","4436.8","0.5","295","2","295","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C15 H33 Cl2 Mn N5 O3 -","- C15 H33 Cl2 Mn N5 O3 -","- C120 H264 Cl16 Mn8 N40 O24 -","8","1","","Liu, Gao-Feng; Filipović, Milos; Heinemann, Frank W.; Ivanović-Burmazović, Ivana","Seven-coordinate iron and manganese complexes with acyclic and rigid pentadentate chelates and their superoxide dismutase activity.","Inorganic chemistry","2007","46","21","8825","8835","10.1021/ic7012039","","","0.71073","MoKα","","0.1231","0.052","","","0.0962","0.1189","","","","","","0.986","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339562","14.632","0.001","11.257","0.001","14.908","0.002","90","","99.148","0.006","90","","2424.3","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H21 Cl2 Mn N7 O14 -","- C14 H21 Cl2 Mn N7 O14 -","- C56 H84 Cl8 Mn4 N28 O56 -","4","1","","Liu, Gao-Feng; Filipović, Milos; Heinemann, Frank W.; Ivanović-Burmazović, Ivana","Seven-coordinate iron and manganese complexes with acyclic and rigid pentadentate chelates and their superoxide dismutase activity.","Inorganic chemistry","2007","46","21","8825","8835","10.1021/ic7012039","","","0.71073","MoKα","","0.0519","0.0357","","","0.0778","0.0845","","","","","","1.059","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4339563","12.8622","0.0012","9.61","0.001","19.897","0.002","90","","102.027","0.003","90","","2405.4","0.4","150","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H17 Cl2 Cu2 N7 O2 -","- C24 H17 Cl2 Cu2 N7 O2 -","- C96 H68 Cl8 Cu8 N28 O8 -","4","1","","Wang, Jian; Djukic, Brandon; Cao, Jingyi; Alberola, Antonio; Razavi, Fereidoon S.; Pilkington, Melanie","A novel bis tridentate bipyridine carboxamide ligand and its complexation to copper(II): synthesis, structure, and magnetism.","Inorganic chemistry","2007","46","21","8560","8568","10.1021/ic700469v","","","0.71073","MoKα","","0.0572","0.0409","","","0.1005","0.1085","","","","","","1.026","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339564","12.7185","0.0006","17.3792","0.0009","19.4696","0.0008","110.827","0.002","99.89","0.003","97.966","0.003","3868.3","0.3","143","2","143","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H20.5 Cu2 F12 N7.5 O6.5 -","- C35 H20.5 Cu2 F12 N7.5 O6.5 -","- C140 H82 Cu8 F48 N30 O26 -","4","2","","Wang, Jian; Djukic, Brandon; Cao, Jingyi; Alberola, Antonio; Razavi, Fereidoon S.; Pilkington, Melanie","A novel bis tridentate bipyridine carboxamide ligand and its complexation to copper(II): synthesis, structure, and magnetism.","Inorganic chemistry","2007","46","21","8560","8568","10.1021/ic700469v","","","0.71073","MoKα","","0.0428","0.0321","","","0.0826","0.0901","","","","","","1.034","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339565","20.1473","0.0013","27.5052","0.0018","32.588","0.002","90","","97.021","0.003","90","","17923","2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C66 H54 N11 O14 Zn3 -","- C66 H54 N11 O14 Zn3 -","- C528 H432 N88 O112 Zn24 -","8","1","","Chen, Banglin; Ma, Shengqian; Hurtado, Eric J.; Lobkovsky, Emil B.; Zhou, Hong-Cai","A triply interpenetrated microporous metal-organic framework for selective sorption of gas molecules.","Inorganic chemistry","2007","46","21","8490","8492","10.1021/ic7014034","","","0.71073","MoKα","","0.1023","0.0575","","","0.148","0.16","","","","","","0.972","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339566","12.3393","0.0019","7.4473","0.0012","6.0339","0.001","90","","90","","90","","554.48","0.15","293","","293","","","","","","","","","4","P m c 21","P 2c -2","26","","","","- C12 H9 In O6 -","- C12 H9 In O6 -","- C24 H18 In2 O12 -","2","0.5","","Vougo-Zanda, Marie; Wang, Xiqu; Jacobson, Allan J.","Influence of ligand geometry on the formation of In-O chains in metal-oxide organic frameworks (MOOFs).","Inorganic chemistry","2007","46","21","8819","8824","10.1021/ic701126t","","","0.71073","MoKα","","0.0134","0.0134","","","0.0349","0.0349","","","","","","1.162","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339567","7.836","0.0006","25.4564","0.0019","5.7985","0.0004","90","","90","","90","","1156.66","0.15","293","","293","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C12 H9 In O6 -","- C12 H9 In O6 -","- C48 H36 In4 O24 -","4","0.5","","Vougo-Zanda, Marie; Wang, Xiqu; Jacobson, Allan J.","Influence of ligand geometry on the formation of In-O chains in metal-oxide organic frameworks (MOOFs).","Inorganic chemistry","2007","46","21","8819","8824","10.1021/ic701126t","","","0.71073","MoKα","","0.029","0.0273","","","0.0667","0.0675","","","","","","1.207","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339568","16.0978","0.0008","16.0978","0.0008","5.9217","0.0006","90","","90","","90","","1534.54","0.19","293","","293","","","","","","","","","4","P 42/n c m :2","-P 4ac 2ac","138","","","","- C16 H8 In2 O9 -","- C16 H8 In2 O9 -","- C64 H32 In8 O36 -","4","0.25","","Vougo-Zanda, Marie; Wang, Xiqu; Jacobson, Allan J.","Influence of ligand geometry on the formation of In-O chains in metal-oxide organic frameworks (MOOFs).","Inorganic chemistry","2007","46","21","8819","8824","10.1021/ic701126t","","","0.71073","MoKα","","0.0185","0.0159","","","0.0426","0.0437","","","","","","1.041","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339569","24.053","0.002","26.067","0.003","8.0593","0.0007","90","","90","","90","","5053.1","0.8","100","2","100","2","","","","","","","","6","F d d 2","F 2 -2d","43","9-ally adenine silver perchlorate complex","","","- C8 H9 Ag Cl N5 O4.5 -","- C8 H9 Ag Cl N5 O4.5 -","- C128 H144 Ag16 Cl16 N80 O72 -","16","1","","Purohit, Chandra Shekhar; Mishra, Ashutosh Kumar; Verma, Sandeep","Four-stranded coordination helices containing silver-adenine (purine) metallaquartets.","Inorganic chemistry","2007","46","21","8493","8495","10.1021/ic701465d","","x-ray","0.71073","MoKα","","0.0717","0.0529","","","0.1078","0.1388","","","","","","1.168","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339570","23.871","0.003","26.107","0.004","7.9152","0.001","90","","90","","90","","4932.8","1.2","100","2","100","2","","","","","","","","7","F d d 2","F 2 -2d","43","9-allyl adenine AgBF4 complex","","","- C8 H9 Ag B F4 N5 O0.5 -","- C8 H9 Ag B F4 N5 O0.5 -","- C128 H144 Ag16 B16 F64 N80 O8 -","16","1","","Purohit, Chandra Shekhar; Mishra, Ashutosh Kumar; Verma, Sandeep","Four-stranded coordination helices containing silver-adenine (purine) metallaquartets.","Inorganic chemistry","2007","46","21","8493","8495","10.1021/ic701465d","","x-ray","0.71073","MoKα","","0.0552","0.0393","","","0.0808","0.1189","","","","","","1.235","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339571","24.7086","0.0019","26.937","0.002","7.201","0.0005","90","","90","","90","","4792.8","0.6","293","2","100","2","","","","","","","","6","F d d 2","F 2 -2d","43","6-chloro 9-allyl purine silver nitrate","","","- C8.5 H7 Ag Cl N5 O4 -","- C8.5 H7 Ag Cl N5 O4 -","- C136 H112 Ag16 Cl16 N80 O64 -","16","1","","Purohit, Chandra Shekhar; Mishra, Ashutosh Kumar; Verma, Sandeep","Four-stranded coordination helices containing silver-adenine (purine) metallaquartets.","Inorganic chemistry","2007","46","21","8493","8495","10.1021/ic701465d","","x-ray","0.71073","MoKα","","0.0523","0.0361","","","0.0742","0.1201","","","","","","1.235","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339572","24.946","0.003","25.149","0.003","7.6705","0.0009","90","","90","","90","","4812.2","1","88","2","88","2","","","","","","","","5","F d d 2","F 2 -2d","43","9-propyl adenine silver nitrate complex","","","- C8 H11 Ag N6 O3 -","- C8 H11 Ag N6 O3 -","- C128 H176 Ag16 N96 O48 -","16","1","","Purohit, Chandra Shekhar; Mishra, Ashutosh Kumar; Verma, Sandeep","Four-stranded coordination helices containing silver-adenine (purine) metallaquartets.","Inorganic chemistry","2007","46","21","8493","8495","10.1021/ic701465d","","","0.71073","MoKα","","0.0687","0.0493","","","0.1074","0.146","","","","","","1.166","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339573","25.093","0.008","25.649","0.008","7.749","0.002","90","","90","","90","","4987","3","100","2","100","2","","","","","","","","6","F d d 2","F 2 -2d","43","9-propyl 6-chloro adenine AgNO3 com-plex","","","- C8 H9 Ag Cl N5 O3 -","- C8 H9 Ag Cl N5 O3 -","- C128 H144 Ag16 Cl16 N80 O48 -","16","1","","Purohit, Chandra Shekhar; Mishra, Ashutosh Kumar; Verma, Sandeep","Four-stranded coordination helices containing silver-adenine (purine) metallaquartets.","Inorganic chemistry","2007","46","21","8493","8495","10.1021/ic701465d","","x-ray","0.71073","MoKα","","0.059","0.045","","","0.1107","0.1454","","","","","","1.15","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339574","8.6018","0.0002","15.053","0.0004","27.7637","0.0006","90","","108.048","0.001","90","","3418.04","0.14","130","","130","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H29 Fe N7 O P -","- C41 H29 Fe N7 O P -","- C164 H116 Fe4 N28 O4 P4 -","4","1","","Kim, Jae Il; Yoo, Houng Sik; Koh, Eui Kwan; Kim, Hyoung Chan; Hong, Chang Seop","Ferrimagnetic FeIII-MnIII zigzag chain formed by a new mer-positioned ironIII cyanide precursor.","Inorganic chemistry","2007","46","21","8481","8483","10.1021/ic701361a","","","0.71073","MoKα","","0.0527","0.0417","","","0.1082","0.1151","","","","","","1.034","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339575","14.5107","0.0003","12.1967","0.0003","19.3412","0.0005","90","","91.445","0.001","90","","3421.97","0.14","130","2","130","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H31 Fe Mn N9 O7 -","- C33 H23 Fe Mn N9 O7 -","- C132 H92 Fe4 Mn4 N36 O28 -","4","1","","Kim, Jae Il; Yoo, Houng Sik; Koh, Eui Kwan; Kim, Hyoung Chan; Hong, Chang Seop","Ferrimagnetic FeIII-MnIII zigzag chain formed by a new mer-positioned ironIII cyanide precursor.","Inorganic chemistry","2007","46","21","8481","8483","10.1021/ic701361a","","","0.71073","MoKα","","0.1091","0.0648","","","0.1531","0.1781","","","","","","1.019","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339576","14.0505","0.0006","14.4887","0.0007","15.7381","0.0007","63.254","0.001","66.009","0.001","63.83","0.001","2479.7","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","[W6S8(T-PPh2)6], C6H6","[W6S8(T-PPh2)6](C6H6)","","- C102 H84 P6 S14 W6 -","- C102 H84 P6 S14 W6 -","- C102 H84 P6 S14 W6 -","1","0.5","","Perruchas, Sandrine; Flores, Samuel; Jousselme, Bruno; Lobkovsky, Emil; Abruña, Hector; Disalvo, Francis J.","[W6S8] octahedral tungsten clusters functionalized with thiophene derivatives: toward polymerizable building blocks.","Inorganic chemistry","2007","46","21","8976","8987","10.1021/ic7010748","","","0.71073","MoKα","","0.0658","0.043","","","0.1025","0.1247","","","","","","0.94","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4339577","13.2939","0.0008","13.3562","0.0009","13.3814","0.0009","82.066","0.003","67.474","0.003","60.824","0.002","1912.7","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","[W6S8(T-PEt2)6], 2(C6H6)","[W6S8(T-PEt2)6](C6H6)2","","- C30 H45 P3 S7 W3 -","- C30 H45 P3 S7 W3 -","- C60 H90 P6 S14 W6 -","2","1","","Perruchas, Sandrine; Flores, Samuel; Jousselme, Bruno; Lobkovsky, Emil; Abruña, Hector; Disalvo, Francis J.","[W6S8] octahedral tungsten clusters functionalized with thiophene derivatives: toward polymerizable building blocks.","Inorganic chemistry","2007","46","21","8976","8987","10.1021/ic7010748","","","0.71073","MoKα","","0.0444","0.0269","","","0.0496","0.0522","","","","","","1.082","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339578","13.9793","0.0009","16.2266","0.001","17.788","0.0011","115.72","0.001","91.078","0.002","91.837","0.002","3630.9","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","[W6S8(2T-PPh2)6], 6(C6H6)","[W6S8(2T-PPh2)6](C6H6)6","","- C156 H124 P6 S20 W6 -","- C156 H124 P6 S20 W6 -","- C156 H124 P6 S20 W6 -","1","0.5","","Perruchas, Sandrine; Flores, Samuel; Jousselme, Bruno; Lobkovsky, Emil; Abruña, Hector; Disalvo, Francis J.","[W6S8] octahedral tungsten clusters functionalized with thiophene derivatives: toward polymerizable building blocks.","Inorganic chemistry","2007","46","21","8976","8987","10.1021/ic7010748","","","0.71073","MoKα","","0.1275","0.0955","","","0.2015","0.2195","","","","","","1.091","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4339579","11.5202","0.001","14.0861","0.0012","15.7759","0.0014","69.288","0.004","68.914","0.004","71.871","0.003","2184.1","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","[W6S8(2T-PEt2)6]","[W6S8(2T-PEt2)6]","","- C72 H90 P6 S20 W6 -","- C72 H90 P6 S20 W6 -","- C72 H90 P6 S20 W6 -","1","0.5","","Perruchas, Sandrine; Flores, Samuel; Jousselme, Bruno; Lobkovsky, Emil; Abruña, Hector; Disalvo, Francis J.","[W6S8] octahedral tungsten clusters functionalized with thiophene derivatives: toward polymerizable building blocks.","Inorganic chemistry","2007","46","21","8976","8987","10.1021/ic7010748","","","0.71073","MoKα","","0.0681","0.0336","","","0.0719","0.0848","","","","","","1.019","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339580","18.9053","0.0012","12.4825","0.0008","23.447","0.0015","90","","106.183","0.002","90","","5313.9","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[W6S8(3T-PEt2)6]","[W6S8(3T-PEt2)6]","","- C96 H102 P6 S26 W6 -","- C96 H100.4 P6 S26 W6 -","- C192 H200.8 P12 S52 W12 -","2","0.5","","Perruchas, Sandrine; Flores, Samuel; Jousselme, Bruno; Lobkovsky, Emil; Abruña, Hector; Disalvo, Francis J.","[W6S8] octahedral tungsten clusters functionalized with thiophene derivatives: toward polymerizable building blocks.","Inorganic chemistry","2007","46","21","8976","8987","10.1021/ic7010748","","","0.71073","MoKα","","0.0728","0.0355","","","0.0644","0.0723","","","","","","0.98","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4339581","17.6565","0.0008","17.8491","0.001","18.7334","0.0011","64.432","0.002","75.92","0.002","70.635","0.002","4989.5","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","[W6S8((2T)3P)6], 4(C7H5N)","[W6S8((2T)3P)6] 4(C7H5N)","","- C100 H65 N4 P3 S22 W3 -","- C100 H65 N4 P3 S22 W3 -","- C200 H130 N8 P6 S44 W6 -","2","1","","Perruchas, Sandrine; Flores, Samuel; Jousselme, Bruno; Lobkovsky, Emil; Abruña, Hector; Disalvo, Francis J.","[W6S8] octahedral tungsten clusters functionalized with thiophene derivatives: toward polymerizable building blocks.","Inorganic chemistry","2007","46","21","8976","8987","10.1021/ic7010748","","","0.71073","MoKα","","0.0627","0.0349","","","0.0772","0.0863","","","","","","1.02","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339582","11.339","0.0005","15.8885","0.0006","17.0075","0.0007","90","","96.14","0.002","90","","3046.5","0.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H42 Cl2 N3 O8 Rh -","- C27 H41.697 Cl2 N3 O8 Rh -","- C108 H166.788 Cl8 N12 O32 Rh4 -","4","1","","Vicente, José; Chicote, María Teresa; Vicente-Hernandez, Inmaculada; Bautista, Delia","On the reactivity toward ketones of new methyl amino complexes of Rh(III) and Ag(I). Synthesis of ortho-rhodiated acetophenone methyl imine complexes.","Inorganic chemistry","2007","46","21","8939","8949","10.1021/ic700963h","","","0.71073","MoKα","","0.0399","0.0336","","","0.072","0.0744","","","","","","1.088","","","","has coordinates,has disorder","179498","2020-10-21","18:00:00",""
"4339583","10.38","0.0005","11.1724","0.0005","13.4906","0.0006","68.798","0.002","86.115","0.002","82.602","0.002","1446.08","0.12","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H36 Cl2 D6 N3 O9 Rh -","- C22 H42 Cl2 N3 O9 Rh -","- C44 H84 Cl4 N6 O18 Rh2 -","2","1","","Vicente, José; Chicote, María Teresa; Vicente-Hernandez, Inmaculada; Bautista, Delia","On the reactivity toward ketones of new methyl amino complexes of Rh(III) and Ag(I). Synthesis of ortho-rhodiated acetophenone methyl imine complexes.","Inorganic chemistry","2007","46","21","8939","8949","10.1021/ic700963h","","","0.71073","MoKα","","0.0295","0.0291","","","0.0716","0.0719","","","","","","1.08","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339584","12.1899","0.0005","14.9406","0.0006","24.722","0.001","90","","90","","90","","4502.5","0.3","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C21 H30 F3 N2 O3 Rh S -","- C21 H30 F3 N2 O3 Rh S -","- C168 H240 F24 N16 O24 Rh8 S8 -","8","1","","Vicente, José; Chicote, María Teresa; Vicente-Hernandez, Inmaculada; Bautista, Delia","On the reactivity toward ketones of new methyl amino complexes of Rh(III) and Ag(I). Synthesis of ortho-rhodiated acetophenone methyl imine complexes.","Inorganic chemistry","2007","46","21","8939","8949","10.1021/ic700963h","","","0.71073","MoKα","","0.049","0.0367","","","0.0707","0.0744","","","","","","1.08","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339585","10.4542","0.0005","11.2095","0.0006","19.9781","0.0011","77.721","0.003","82.26","0.002","73.989","0.003","2191.7","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24.5 H20 N2 O3.5 Re -","- C24.5 H20 N2 O3.5 Re -","- C98 H80 N8 O14 Re4 -","4","2","","Liddle, Brendan J.; Lindeman, Sergey V.; Reger, Daniel L.; Gardinier, James R.","A thallium mediated route to sigma-arylalkynyl complexes of bipyridyltricarbonylrhenium(I).","Inorganic chemistry","2007","46","21","8484","8486","10.1021/ic701406y","","","1.54178","CuKα","","0.0206","0.0193","","","0.0477","0.0484","","","","","","1.119","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339586","8.2628","0.0002","9.5792","0.0002","11.4401","0.0002","79.785","0.001","88.952","0.001","87.271","0.001","890.09","0.03","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H16 Br N2 O3.5 Re -","- C17 H16 Br N2 O3.5 Re -","- C34 H32 Br2 N4 O7 Re2 -","2","1","","Liddle, Brendan J.; Lindeman, Sergey V.; Reger, Daniel L.; Gardinier, James R.","A thallium mediated route to sigma-arylalkynyl complexes of bipyridyltricarbonylrhenium(I).","Inorganic chemistry","2007","46","21","8484","8486","10.1021/ic701406y","","","1.54178","CuKα","","0.0387","0.0342","","","0.0816","0.0836","","","","","","1.018","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339587","16.522","0.0001","13.8123","0.0001","19.5082","0.0002","90","","104.448","0.001","90","","4311.11","0.06","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24.64 H20.28 N2 O3.41 Re -","- C24.638 H20.276 N2 O3.4095 Re -","- C197.104 H162.208 N16 O27.276 Re8 -","8","2","","Liddle, Brendan J.; Lindeman, Sergey V.; Reger, Daniel L.; Gardinier, James R.","A thallium mediated route to sigma-arylalkynyl complexes of bipyridyltricarbonylrhenium(I).","Inorganic chemistry","2007","46","21","8484","8486","10.1021/ic701406y","","","1.54178","CuKα","","0.0224","0.0208","","","0.0471","0.0477","","","","","","1.145","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339588","13.2407","0.0002","8.8947","0.0001","14.9325","0.0002","90","","104.337","0.001","90","","1703.86","0.04","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H12 F2 N2 O5 P Re -","- C15 H12 F2 N2 O5 P Re -","- C60 H48 F8 N8 O20 P4 Re4 -","4","1","","Liddle, Brendan J.; Lindeman, Sergey V.; Reger, Daniel L.; Gardinier, James R.","A thallium mediated route to sigma-arylalkynyl complexes of bipyridyltricarbonylrhenium(I).","Inorganic chemistry","2007","46","21","8484","8486","10.1021/ic701406y","","","1.54178","CuKα","","0.0274","0.0237","","","0.0553","0.0567","","","","","","1.045","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339589","16.4742","0.0004","14.2705","0.0003","21.3045","0.0005","90","","91.849","0.001","90","","5006","0.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H22 N5 O3 Re -","- C27 H22 N5 O3 Re -","- C216 H176 N40 O24 Re8 -","8","1","","Liddle, Brendan J.; Lindeman, Sergey V.; Reger, Daniel L.; Gardinier, James R.","A thallium mediated route to sigma-arylalkynyl complexes of bipyridyltricarbonylrhenium(I).","Inorganic chemistry","2007","46","21","8484","8486","10.1021/ic701406y","","","1.54178","CuKα","","0.033","0.0285","","","0.0606","0.0622","","","","","","1.123","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339590","18.2497","0.0007","10.8047","0.0004","23.2347","0.0009","90","","107.397","0.001","90","","4371.9","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H37 N14 O5 Re -","- C45 H37 N14 O5 Re -","- C180 H148 N56 O20 Re4 -","4","1","","Liddle, Brendan J.; Lindeman, Sergey V.; Reger, Daniel L.; Gardinier, James R.","A thallium mediated route to sigma-arylalkynyl complexes of bipyridyltricarbonylrhenium(I).","Inorganic chemistry","2007","46","21","8484","8486","10.1021/ic701406y","","","0.71073","MoKα","","0.058","0.0401","","","0.0978","0.1062","","","","","","1.021","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339591","8.0513","0.0009","8.3775","0.001","5.8799","0.0007","90","","90","","90","","396.6","0.08","200","2","200","2","","","","","","","","4","P n n m","-P 2 2n","58","libethenite (mineralogical)","copper(II) hydroxyphosphate","","- Cu2 H O5 P -","- Cu2 H O5 P -","- Cu8 H4 O20 P4 -","4","0.5","","Belik, Alexei A.; Koo, Hyun-Joo; Whangbo, Myung-Hwan; Tsujii, Naohito; Naumov, Pance; Takayama-Muromachi, Eiji","Magnetic properties of synthetic libethenite Cu2PO4OH: a new spin-gap system.","Inorganic chemistry","2007","46","21","8684","8689","10.1021/ic7008418","","","0.71073","MoKα","","0.0397","0.0381","","","0.1011","0.1018","","","","","","1.364","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339592","31.645","0.0008","21.516","0.0008","16.126","0.001","90","0.002","91.265","0.002","90","0.001","10977.1","0.8","200","2","200","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C74 H112 Na Ni2 O8 P2 S6 Si6 -","- C74 H112 Na Ni2 O8 P2 S6 Si6 -","- C296 H448 Na4 Ni8 O32 P8 S24 Si24 -","4","0.5","","Lee, Chien-Ming; Chiou, Tzung-Wen; Chen, Hsin-Hung; Chiang, Chao-Yi; Kuo, Ting-Shen; Liaw, Wen-Feng","Mononuclear Ni(II)-thiolate complexes with pendant thiol and dinuclear Ni(III/II)-thiolate complexes with Ni...Ni interaction regulated by the oxidation levels of nickels and the coordinated ligands.","Inorganic chemistry","2007","46","21","8913","8923","10.1021/ic700719h","","","0.71073","MoKα","","0.1379","0.0778","","","0.2111","0.2374","","","","","","0.971","","","","has coordinates,has disorder","179498","2020-10-21","18:00:00",""
"4339593","15.6726","0.0005","25.101","0.0008","17.844","0.0006","90","","102.152","0.001","90","","6862.5","0.4","150","1","150","1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C69 H72 N Ni P3 S3 Se Si3 -","- C69 H72 N Ni P3 S3 Se Si3 -","- C276 H288 N4 Ni4 P12 S12 Se4 Si12 -","4","1","","Lee, Chien-Ming; Chiou, Tzung-Wen; Chen, Hsin-Hung; Chiang, Chao-Yi; Kuo, Ting-Shen; Liaw, Wen-Feng","Mononuclear Ni(II)-thiolate complexes with pendant thiol and dinuclear Ni(III/II)-thiolate complexes with Ni...Ni interaction regulated by the oxidation levels of nickels and the coordinated ligands.","Inorganic chemistry","2007","46","21","8913","8923","10.1021/ic700719h","","","0.71073","MoKα","","0.0926","0.0732","","","0.1508","0.1584","","","","","","1.248","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339594","15.5901","0.0007","25.147","0.0011","17.6169","0.0008","90","0.001","101.469","0.001","90","0.001","6768.7","0.5","100","2","100","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C64 H68 Cl3 N Ni O0 P3 S3 Si3 -","- C64 H68 Cl3 N Ni P3 S3 Si3 -","- C256 H272 Cl12 N4 Ni4 P12 S12 Si12 -","4","1","","Lee, Chien-Ming; Chiou, Tzung-Wen; Chen, Hsin-Hung; Chiang, Chao-Yi; Kuo, Ting-Shen; Liaw, Wen-Feng","Mononuclear Ni(II)-thiolate complexes with pendant thiol and dinuclear Ni(III/II)-thiolate complexes with Ni...Ni interaction regulated by the oxidation levels of nickels and the coordinated ligands.","Inorganic chemistry","2007","46","21","8913","8923","10.1021/ic700719h","","","0.71073","MoKα","","0.1195","0.0595","","","0.1171","0.1287","","","","","","0.796","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339595","14.1822","0.0007","27.2702","0.0013","17.4289","0.0008","90","","99.748","0.001","90","","6643.3","0.5","150","1","150","1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C69 H72 N Ni P3 S3 Se Si3 -","- C69 H72 N Ni P3 S3 Se Si3 -","- C276 H288 N4 Ni4 P12 S12 Se4 Si12 -","4","1","","Lee, Chien-Ming; Chiou, Tzung-Wen; Chen, Hsin-Hung; Chiang, Chao-Yi; Kuo, Ting-Shen; Liaw, Wen-Feng","Mononuclear Ni(II)-thiolate complexes with pendant thiol and dinuclear Ni(III/II)-thiolate complexes with Ni...Ni interaction regulated by the oxidation levels of nickels and the coordinated ligands.","Inorganic chemistry","2007","46","21","8913","8923","10.1021/ic700719h","","","0.71073","MoKα","","0.0589","0.0434","","","0.1047","0.1177","","","","","","1.075","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339596","25.743","0.007","15.211","0.004","20.582","0.006","90","","112.434","0.004","90","","7449","4","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C55 H75 Ni2 P2 S6 Si6 -","- C55 H75 Ni2 P2 S6 Si6 -","- C220 H300 Ni8 P8 S24 Si24 -","4","1","","Lee, Chien-Ming; Chiou, Tzung-Wen; Chen, Hsin-Hung; Chiang, Chao-Yi; Kuo, Ting-Shen; Liaw, Wen-Feng","Mononuclear Ni(II)-thiolate complexes with pendant thiol and dinuclear Ni(III/II)-thiolate complexes with Ni...Ni interaction regulated by the oxidation levels of nickels and the coordinated ligands.","Inorganic chemistry","2007","46","21","8913","8923","10.1021/ic700719h","","","0.71073","MoKα","","0.1724","0.0802","","","0.153","0.177","","","","","","0.956","","","","has coordinates,has disorder","179498","2020-10-21","18:00:00",""
"4339597","22.6545","0.0008","11.7349","0.0005","25.6568","0.001","90","","101.133","0.002","90","","6692.5","0.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H74 Ni2 P2 S6 Si6 -","- C54 H74 Ni2 P2 S6 Si6 -","- C216 H296 Ni8 P8 S24 Si24 -","4","1","","Lee, Chien-Ming; Chiou, Tzung-Wen; Chen, Hsin-Hung; Chiang, Chao-Yi; Kuo, Ting-Shen; Liaw, Wen-Feng","Mononuclear Ni(II)-thiolate complexes with pendant thiol and dinuclear Ni(III/II)-thiolate complexes with Ni...Ni interaction regulated by the oxidation levels of nickels and the coordinated ligands.","Inorganic chemistry","2007","46","21","8913","8923","10.1021/ic700719h","","","0.71073","MoKα","","0.1386","0.0642","","","0.1363","0.1733","","","","","","1.039","","","","has coordinates","179498","2020-10-21","18:00:00",""
"4339598","13.6148","0.0004","15.3156","0.0004","18.099","0.0006","112.955","0.001","109.818","0.001","93.002","0.001","3194.22","0.17","200","2","200","2","","","","","","","","9","P -1","-P 1","2","","","","- C98 H158 K2 N2 Ni2 O16 P2 S6 Si6 -","- C98 H158 K2 N2 Ni2 O16 P2 S6 Si6 -","- C98 H158 K2 N2 Ni2 O16 P2 S6 Si6 -","1","0.5","","Lee, Chien-Ming; Chiou, Tzung-Wen; Chen, Hsin-Hung; Chiang, Chao-Yi; Kuo, Ting-Shen; Liaw, Wen-Feng","Mononuclear Ni(II)-thiolate complexes with pendant thiol and dinuclear Ni(III/II)-thiolate complexes with Ni...Ni interaction regulated by the oxidation levels of nickels and the coordinated ligands.","Inorganic chemistry","2007","46","21","8913","8923","10.1021/ic700719h","","","0.71073","MoKα","","0.1322","0.0973","","","0.2519","0.2733","","","","","","1.062","","","","has coordinates,has disorder","179498","2020-10-21","18:00:00",""
"4339599","25.5806","0.0003","15.2565","0.0002","20.6943","0.0002","90","","112.044","0.0006","90","","7485.97","0.15","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C58 H81.5 Cl Ni2 O0.5 P2 S6 Si6 -","- C58 H81.5 Cl Ni2 O0.5 P2 S6 Si6 -","- C232 H326 Cl4 Ni8 O2 P8 S24 Si24 -","4","1","","Lee, Chien-Ming; Chiou, Tzung-Wen; Chen, Hsin-Hung; Chiang, Chao-Yi; Kuo, Ting-Shen; Liaw, Wen-Feng","Mononuclear Ni(II)-thiolate complexes with pendant thiol and dinuclear Ni(III/II)-thiolate complexes with Ni...Ni interaction regulated by the oxidation levels of nickels and the coordinated ligands.","Inorganic chemistry","2007","46","21","8913","8923","10.1021/ic700719h","","","0.71073","MoKα","","0.1076","0.0651","","","0.1923","0.2234","","","","","","1.036","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339600","14.2634","0.0002","27.432","0.0004","17.2752","0.0002","90","","100.661","0.0007","90","","6642.65","0.16","150","1","150","1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C64 H69 Cl3 N Ni P3 S3 Si3 -","- C64 H69 Cl3 N Ni P3 S3 Si3 -","- C256 H276 Cl12 N4 Ni4 P12 S12 Si12 -","4","1","","Lee, Chien-Ming; Chiou, Tzung-Wen; Chen, Hsin-Hung; Chiang, Chao-Yi; Kuo, Ting-Shen; Liaw, Wen-Feng","Mononuclear Ni(II)-thiolate complexes with pendant thiol and dinuclear Ni(III/II)-thiolate complexes with Ni...Ni interaction regulated by the oxidation levels of nickels and the coordinated ligands.","Inorganic chemistry","2007","46","21","8913","8923","10.1021/ic700719h","","","0.71073","MoKα","","0.1179","0.0562","","","0.1388","0.1626","","","","","","1.02","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339601","8.3176","0.0004","8.3176","0.0004","15.0651","0.0005","90","","90","","120","","902.61","0.07","293","2","293","2","","","","","","","","5","P -3 1 c","-P 3 2c","163","","","","- C10 H20 Mn2 N2 O12 -","- C10 H6 Mn2 N1.98 O12 -","- C20 H12 Mn4 N3.96 O24 -","2","0.166667","","Wang, Zheming; Zhang, Xueyu; Batten, Stuart R.; Kurmoo, Mohamedally; Gao, Song","[CH3NH2(CH2)2NH2CH3][M2(HCOO)6] (M = MnII and CoII): weak ferromagnetic metal formate frameworks of unique binodal 6-connected (4(12).6(3))(4(9).6(6)) topology, templated by a diammonium cation.","Inorganic chemistry","2007","46","21","8439","8441","10.1021/ic700924j","","","0.71073","MoKα","","0.0557","0.0318","","","0.0818","0.0888","","","","","","0.971","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339602","8.1805","0.0004","8.1805","0.0004","14.6798","0.0006","90","","90","","120","","850.77","0.07","293","2","293","2","","","","","","","","5","P -3 1 c","-P 3 2c","163","","","","- C10 H20 Co2 N2 O12 -","- C10 H6 Co2 N1.98 O12 -","- C20 H12 Co4 N3.96 O24 -","2","0.166667","","Wang, Zheming; Zhang, Xueyu; Batten, Stuart R.; Kurmoo, Mohamedally; Gao, Song","[CH3NH2(CH2)2NH2CH3][M2(HCOO)6] (M = MnII and CoII): weak ferromagnetic metal formate frameworks of unique binodal 6-connected (4(12).6(3))(4(9).6(6)) topology, templated by a diammonium cation.","Inorganic chemistry","2007","46","21","8439","8441","10.1021/ic700924j","","","0.71073","MoKα","","0.056","0.0321","","","0.0769","0.0818","","","","","","1.017","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339603","10.31","0.004","26.706","0.01","22.293","0.008","90","","101.944","0.007","90","","6005","4","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C65 H93 Cl Mo N4 -","- C65 H93 Cl Mo N4 -","- C260 H372 Cl4 Mo4 N16 -","4","1","","Wampler, Keith M.; Schrock, Richard R.","Tris(pyrrolyl-alpha-methyl)amines that sterically protect a trigonal metal site.","Inorganic chemistry","2007","46","21","8463","8465","10.1021/ic701472y","","","0.71073","MoKα","","0.0801","0.0513","","","0.1178","0.1315","","","","","","1.06","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339604","12.762","0.004","23.482","0.008","16.838","0.006","90","","112.086","0.005","90","","4676","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H30 Cl2 F18 Mo N6 -","- C42 H30 Cl2 F18 Mo N6 -","- C168 H120 Cl8 F72 Mo4 N24 -","4","1","","Wampler, Keith M.; Schrock, Richard R.","Tris(pyrrolyl-alpha-methyl)amines that sterically protect a trigonal metal site.","Inorganic chemistry","2007","46","21","8463","8465","10.1021/ic701472y","","","0.71073","MoKα","","0.0719","0.0512","","","0.1299","0.1458","","","","","","1.037","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339605","16.3812","0.0014","17.2603","0.0014","19.6557","0.0016","96.372","0.001","106.99","0.001","110.036","0.001","4853.5","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H40 Cl2 F18 N6 Zr -","- C44 H36 Cl2 F18 N6 Zr -","- C176 H144 Cl8 F72 N24 Zr4 -","4","2","","Wampler, Keith M.; Schrock, Richard R.","Tris(pyrrolyl-alpha-methyl)amines that sterically protect a trigonal metal site.","Inorganic chemistry","2007","46","21","8463","8465","10.1021/ic701472y","","","0.71073","MoKα","","0.076","0.0519","","","0.1431","0.1612","","","","","","1.037","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339606","12.7125","0.001","12.7513","0.001","16.955","0.002","98.466","0.002","106.561","0.002","108.853","0.001","2404.7","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H36 F18 Mo N5 -","- C50 H42 F18 Mo N6 -","- C100 H84 F36 Mo2 N12 -","2","1","","Wampler, Keith M.; Schrock, Richard R.","Tris(pyrrolyl-alpha-methyl)amines that sterically protect a trigonal metal site.","Inorganic chemistry","2007","46","21","8463","8465","10.1021/ic701472y","","","0.71073","MoKα","","0.0661","0.0479","","","0.1122","0.1229","","","","","","1.033","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339607","12.939","0.005","13.092","0.005","13.754","0.004","85.449","0.011","70.302","0.012","83.731","0.01","2178.2","1.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H27 Co2 N3 O9 -","- C37 H27 Co2 N3 O9 -","- C74 H54 Co4 N6 O18 -","2","1","","Chen, Banglin; Ma, Shengqian; Hurtado, Eric J.; Lobkovsky, Emil B.; Liang, Chengdu; Zhu, Haoguo; Dai, Sheng","Selective gas sorption within a dynamic metal-organic framework.","Inorganic chemistry","2007","46","21","8705","8709","10.1021/ic7013573","","","0.71073","MoKα","","0.0933","0.0524","","","0.1264","0.1377","","","","","","0.951","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339608","4.1687","0.0006","4.1687","0.0006","4.5543","0.0009","90","","90","","120","","68.541","0.019","292","2","292","2","","","","","","","","3","P 6/m m m","-P 6 2","191","","","","- Eu Ga Si -","- Eu Ga1.002 Si0.998 -","- Eu Ga1.002 Si0.998 -","1","0.0416667","","You, Tae-Soo; Grin, Yuri; Miller, Gordon J.","Planar versus puckered nets in the polar intermetallic series EuGaTt (Tt = Si, Ge, Sn).","Inorganic chemistry","2007","46","21","8801","8811","10.1021/ic701111e","","","0.71073","MoKα","","0.015","0.015","","","0.0323","0.0323","","","","","","1.185","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339609","4.2646","0.0006","4.2646","0.0006","18.041","0.005","90","","90","","120","","284.15","0.1","292","2","292","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Eu Ga Ge -","- Eu Ga Ge -","- Eu4 Ga4 Ge4 -","4","0.166667","","You, Tae-Soo; Grin, Yuri; Miller, Gordon J.","Planar versus puckered nets in the polar intermetallic series EuGaTt (Tt = Si, Ge, Sn).","Inorganic chemistry","2007","46","21","8801","8811","10.1021/ic701111e","","","0.71073","MoKα","","0.0324","0.0247","","","0.0504","0.0531","","","","","","1.262","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339610","4.5243","0.0005","4.5243","0.0005","18.067","0.003","90","","90","","120","","320.27","0.07","292","2","292","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Eu Ga Sn -","- Eu Ga Sn -","- Eu4 Ga4 Sn4 -","4","0.166667","","You, Tae-Soo; Grin, Yuri; Miller, Gordon J.","Planar versus puckered nets in the polar intermetallic series EuGaTt (Tt = Si, Ge, Sn).","Inorganic chemistry","2007","46","21","8801","8811","10.1021/ic701111e","","","0.71073","MoKα","","0.0363","0.0293","","","0.0565","0.0587","","","","","","1.297","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339611","17.288","0.002","20.308","0.002","21.536","0.002","76.9","0.006","66.49","0.003","66.033","0.005","6316.7","1.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C119.2 H152.4 Cl9.2 N8 O7 Pd S2 -","- C119.2 H152.4 Cl9.2 N8 O7 Pd S2 -","- C238.4 H304.8 Cl18.4 N16 O14 Pd2 S4 -","2","1","","Blight, Barry A.; Wei, Xu; Wisner, James A.; Jennings, Michael C.","[2]Pseudorotaxane and [2]rotaxane molecular shuttles: self-assembly through second-sphere coordination of thiocyanate ligands.","Inorganic chemistry","2007","46","21","8445","8447","10.1021/ic701021p","","","0.71073","MoKα","","0.3019","0.1123","","","0.2513","0.3411","","","","","","0.943","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339612","25.1506","0.0008","23.5357","0.001","21.7239","0.0008","90","","124.346","0.002","90","","10617.1","0.7","150","2","150","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C94.5 H117.1 Cl12.9 N8 O5.7 Pd S2 -","- C94.5 H117.1 Cl12.9 N8 O5.7 Pd S2 -","- C378 H468.4 Cl51.6 N32 O22.8 Pd4 S8 -","4","1","","Blight, Barry A.; Wei, Xu; Wisner, James A.; Jennings, Michael C.","[2]Pseudorotaxane and [2]rotaxane molecular shuttles: self-assembly through second-sphere coordination of thiocyanate ligands.","Inorganic chemistry","2007","46","21","8445","8447","10.1021/ic701021p","","","0.71073","MoKα","","0.138","0.0948","","","0.2385","0.2716","","","","","","1.035","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339613","28.79","0.01","28.79","0.01","28.79","0.01","90","","90","","90","","23863","14","293","2","293","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","PCN-13","","","- C48 H30 O16 Zn4 -","- C48 H24 O16 Zn4 -","- C768 H384 O256 Zn64 -","16","0.333333","","Ma, Shengqian; Wang, Xi-Sen; Collier, Christopher D.; Manis, Erika S.; Zhou, Hong-Cai","Ultramicroporous metal-organic framework based on 9,10-anthracenedicarboxylate for selective gas adsorption.","Inorganic chemistry","2007","46","21","8499","8501","10.1021/ic701507r","","","0.71073","MoKα","","0.0765","0.0578","","","0.1482","0.1546","","","","","","0.978","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339614","15.03","0.016","16.193","0.018","13.563","0.015","90","","90","","90","","3301","6","294","2","294","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C20 H38 Ce N6 Ni2 O18.5 S2 -","- C20 H32 Ce N6 Ni2 O18.5 S2 -","- C80 H128 Ce4 N24 Ni8 O74 S8 -","4","0.5","","Ouyang, Yan; Zhang, Wei; Xu, Na; Xu, Gong-Feng; Liao, Dai-Zheng; Yoshimura, Kazuyoshi; Yan, Shi-Ping; Cheng, Peng","Three-dimensional 3d-4f polymers containing heterometallic rings: syntheses, structures, and magnetic properties.","Inorganic chemistry","2007","46","21","8454","8456","10.1021/ic701097k","","","0.71073","MoKα","","0.0867","0.0492","","","0.1263","0.1542","","","","","","1.053","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339615","10.2656","0.001","18.1161","0.0018","10.3473","0.001","90","","90.528","0.005","90","","1924.2","0.3","190","2","190","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H34 Cu3 N24 O2 -","- C30 H34 Cu3 N24 O2 -","- C60 H68 Cu6 N48 O4 -","2","0.5","","Stamatatos, Theocharis C.; Papaefstathiou, Giannis S.; MacGillivray, Leonard R.; Escuer, Albert; Vicente, Ramon; Ruiz, Eliseo; Perlepes, Spyros P.","Ferromagnetic coupling in a 1D coordination polymer containing a symmetric [Cu(mu1,1-N3)2Cu(mu1,1-N3)2Cu]2+ core and based on an organic ligand obtained from the solid state.","Inorganic chemistry","2007","46","21","8843","8850","10.1021/ic070018b","","","0.71073","MoKα","","0.0635","0.0549","","","0.1233","0.1394","","","","","","1.246","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339616","15.5974","0.0007","15.5974","0.0007","8.813","0.0007","90","","90","","90","","2144","0.2","273","2","273","2","","","","","","","","2","I 4/m c m","-I 4 2c","140","","","","- Lu7 Sb3 -","- Lu7 Sb3 -","- Lu56 Sb24 -","8","0.25","","Gupta, Shalabh; Chen, Ling; Ganguli, Ashok K.; Corbett, John D.","Rare-earth metal-rich antimonides: syntheses, structures, and properties of Tm(3)Sb and Lu(7)Sb(3).","Inorganic chemistry","2007","46","6","2187","2192","10.1021/ic0619409","","","0.71073","MoKα","","0.0257","0.018","","","0.0304","0.0314","","","","","","0.949","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339617","12.648","0.0011","20.7859","0.0019","13.1824","0.0012","90","","117.061","0.002","90","","3086.2","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H38 Cr2 N8 O13 -","- C24 H36 Cr2 N8 O12.73 -","- C96 H144 Cr8 N32 O50.92 -","4","1","","Ghosh, Sanjib; Roehm, Brian; Begum, Rowshan Ara; Kut, Jerry; Hossain, Md Alamgir; Day, Victor W.; Bowman-James, Kristin","Versatile host for metallo anions and cations.","Inorganic chemistry","2007","46","23","9519","9521","10.1021/ic701371f","","","0.71073","MoKα","","0.1252","0.0616","","","0.1311","0.1464","","","","","","0.905","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339618","12.017","0.0013","13.5117","0.0014","21.94","0.002","90.252","0.002","90.942","0.002","111.305","0.002","3318.3","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H40 N8 O15 Re2 -","- C24 H40 N8 O15 Re2 -","- C96 H160 N32 O60 Re8 -","4","2","","Ghosh, Sanjib; Roehm, Brian; Begum, Rowshan Ara; Kut, Jerry; Hossain, Md Alamgir; Day, Victor W.; Bowman-James, Kristin","Versatile host for metallo anions and cations.","Inorganic chemistry","2007","46","23","9519","9521","10.1021/ic701371f","","","0.71073","MoKα","","0.0816","0.0577","","","0.1309","0.1392","","","","","","1.079","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339619","17.8194","0.0008","14.5756","0.0007","19.8223","0.0009","90","","90","","90","","5148.4","0.4","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H32 Cu2 N8 O6 -","- C24 H31.84 Cu2 N8 O6 -","- C192 H254.72 Cu16 N64 O48 -","8","1","","Ghosh, Sanjib; Roehm, Brian; Begum, Rowshan Ara; Kut, Jerry; Hossain, Md Alamgir; Day, Victor W.; Bowman-James, Kristin","Versatile host for metallo anions and cations.","Inorganic chemistry","2007","46","23","9519","9521","10.1021/ic701371f","","","0.71073","MoKα","","0.0349","0.0295","","","0.0778","0.0801","","","","","","1.068","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339620","17.624","0.001","14.705","0.001","19.728","0.001","90","","90","","90","","5112.7","0.5","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H32 N8 Ni2 O6 -","- C24 H31.52 N8 Ni2 O6 -","- C192 H252.16 N64 Ni16 O48 -","8","1","","Ghosh, Sanjib; Roehm, Brian; Begum, Rowshan Ara; Kut, Jerry; Hossain, Md Alamgir; Day, Victor W.; Bowman-James, Kristin","Versatile host for metallo anions and cations.","Inorganic chemistry","2007","46","23","9519","9521","10.1021/ic701371f","","","0.71073","MoKα","","0.0467","0.0357","","","0.0934","0.0976","","","","","","1.037","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339621","26.4936","0.0014","12.092","0.0006","21.7995","0.0012","90","","90","","90","","6983.7","0.6","100","2","100","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C32 H56 Co N9 O8 -","- C32 H56 Co N9 O8 -","- C256 H448 Co8 N72 O64 -","8","0.5","","Ghosh, Sanjib; Roehm, Brian; Begum, Rowshan Ara; Kut, Jerry; Hossain, Md Alamgir; Day, Victor W.; Bowman-James, Kristin","Versatile host for metallo anions and cations.","Inorganic chemistry","2007","46","23","9519","9521","10.1021/ic701371f","","","0.71073","MoKα","","0.0302","0.0295","","","0.0764","0.0768","","","","","","1.062","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339622","26.5844","0.0017","12.0803","0.0008","21.8519","0.0014","90","","90","","90","","7017.7","0.8","100","2","100","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C32 H56 Fe N9 O8 -","- C32 H56 Fe N9 O8 -","- C256 H448 Fe8 N72 O64 -","8","0.5","","Ghosh, Sanjib; Roehm, Brian; Begum, Rowshan Ara; Kut, Jerry; Hossain, Md Alamgir; Day, Victor W.; Bowman-James, Kristin","Versatile host for metallo anions and cations.","Inorganic chemistry","2007","46","23","9519","9521","10.1021/ic701371f","","","0.71073","MoKα","","0.043","0.0386","","","0.0801","0.0815","","","","","","0.983","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339623","13.351","0.003","24.925","0.005","19.879","0.004","90","","103.494","0.016","90","","6433","2","153","2","153","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Bis(2,2-bipyridine)ruthenium(II)[(pyridin-2-one)-amino]","","- C28 H24 B Cl4 F4 N6 O Ru -","- C26 H20 N6 O Ru -","- C208 H160 N48 O8 Ru8 -","8","2","","Wang, Peijiao; Miller, Jeremiah E.; Henling, Lawrence M.; Stern, Charlotte L.; Frank, Natia L.; Eckermann, Amanda L.; Meade, Thomas J.","Synthesis and characterization of ruthenium and rhenium nucleosides.","Inorganic chemistry","2007","46","23","9853","9862","10.1021/ic701250r","","","0.71073","MoKα","","0.1237","0.0743","","","0.2099","0.2251","","","","","","0.981","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339624","18.9576","0.001","9.5095","0.0005","14.4516","0.0008","90","","100.495","0.001","90","","2561.7","0.2","98","2","98","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C22 H23 Cl N4 O8 Re -","- C22 H23 Cl N4 O8 Re -","- C88 H92 Cl4 N16 O32 Re4 -","4","1","","Wang, Peijiao; Miller, Jeremiah E.; Henling, Lawrence M.; Stern, Charlotte L.; Frank, Natia L.; Eckermann, Amanda L.; Meade, Thomas J.","Synthesis and characterization of ruthenium and rhenium nucleosides.","Inorganic chemistry","2007","46","23","9853","9862","10.1021/ic701250r","","","0.71073","MoKα","","0.0356","0.0337","","","0.0806","0.081","","","","","","2.01","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4339625","15.5562","0.0016","16.9163","0.0017","14.3802","0.0014","90","","110.859","0.002","90","","3536.2","0.6","153","2","153","2","","","","","","","","4","C 1 c 1","C -2yc","9","","Bis-di(p-methylbenzonatemethane)ruthenium(II)[(pyridin-2-one)-amino]","","- C41 H35.5 O7.5 Ru -","- C41 H35.5 N6.5 O Ru -","- C164 H142 N26 O4 Ru4 -","4","1","","Wang, Peijiao; Miller, Jeremiah E.; Henling, Lawrence M.; Stern, Charlotte L.; Frank, Natia L.; Eckermann, Amanda L.; Meade, Thomas J.","Synthesis and characterization of ruthenium and rhenium nucleosides.","Inorganic chemistry","2007","46","23","9853","9862","10.1021/ic701250r","","","0.71073","MoKα","","0.046","0.0432","","","0.1108","0.114","","","","","","1.103","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4339626","10.7422","0.0008","14.6968","0.0011","14.7471","0.0011","76.313","0.0013","89.6555","0.0013","83.1981","0.0014","2245.6","0.3","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C52.5 H49 O7.5 Ru -","- C51 H45 O6 Ru -","- C102 H90 O12 Ru2 -","2","1","","Wang, Peijiao; Miller, Jeremiah E.; Henling, Lawrence M.; Stern, Charlotte L.; Frank, Natia L.; Eckermann, Amanda L.; Meade, Thomas J.","Synthesis and characterization of ruthenium and rhenium nucleosides.","Inorganic chemistry","2007","46","23","9853","9862","10.1021/ic701250r","","","0.71073","MoKα","","0.1036","0.0662","","","0.1737","0.1934","","","","","","1.075","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339627","16.214","0.006","25.874","0.01","26.497","0.01","90","","94.214","0.007","90","","11086","7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C91 H73 Mn9 N3 O37 -","- C91 H73 Mn9 N3 O37 -","- C364 H292 Mn36 N12 O148 -","4","1","","Mondal, Kartik Chandra; Song, You; Mukherjee, Partha Sarathi","Self-assembly of a Mn9 nanoscopic mixed-valent cluster: synthesis, crystal structure, and magnetic behavior.","Inorganic chemistry","2007","46","23","9736","9742","10.1021/ic701018x","","","0.71073","MoKα","","0.2406","0.1072","","","0.2504","0.309","","","","","","0.941","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339628","38.626","0.002","38.626","0.002","13.6978","0.0016","90","","90","","120","","17699","2","100","2","100","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C21 H49 Cs2 Mo8 N7 O28 S8 -","- C21 H49 Cs2 Mo8 N7 O28 S8 -","- C189 H441 Cs18 Mo72 N63 O252 S72 -","9","0.5","","Lemonnier, Jean-François; Floquet, Sébastien; Marrot, Jérôme; Kachmar, Ali; Bénard, Marc; Rohmer, Marie-Madeleine; Haouas, Mohamed; Taulelle, Francis; Henry, Marc; Cadot, Emmanuel","Changing the oxothiomolybdate ring from an anionic to a cationic receptor.","Inorganic chemistry","2007","46","23","9516","9518","10.1021/ic701432s","","","0.71073","MoKα","","0.1143","0.0874","","","0.2572","0.289","","","","","","1.054","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339629","14.8862","0.0008","12.5444","0.0007","21.0094","0.0012","90","","101.927","0.001","90","","3838.6","0.4","90.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H29 Cl2 N4 O3 Re -","- C48 H29 Cl2 N4 O3 Re -","- C192 H116 Cl8 N16 O12 Re4 -","4","1","","Toganoh, Motoki; Ikeda, Shinya; Furuta, Hiroyuki","Synthesis, reactivity, and properties of N-fused porphyrin rhenium(I) tricarbonyl complexes.","Inorganic chemistry","2007","46","23","10003","10015","10.1021/ic701208g","","","0.7107","MoKα","","","0.042","","","","0.043","","","","","","1.155","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339630","37.386","0.002","9.4452","0.0005","23.9734","0.0012","90","","115.175","0.001","90","","7661.3","0.7","223","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C47.5 H27 Cl N5 O5 Re -","- C47.5 H27 Cl N5 O5 Re -","- C380 H216 Cl8 N40 O40 Re8 -","8","1","","Toganoh, Motoki; Ikeda, Shinya; Furuta, Hiroyuki","Synthesis, reactivity, and properties of N-fused porphyrin rhenium(I) tricarbonyl complexes.","Inorganic chemistry","2007","46","23","10003","10015","10.1021/ic701208g","","","0.71069","MoKα","","0.0365","0.0285","","","0.0607","0.0624","","","","","","0.928","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339631","17.5151","0.0005","13.7564","0.0002","10.8123","0.0004","90","","105.532","0.002","90","","2510.03","0.13","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H22 Co3 N2 O17 -","- C14 H6 Co3 N2 O17 -","- C56 H24 Co12 N8 O68 -","4","0.5","","Huang, You-Gui; Yuan, Da-Qiang; Pan, Long; Jiang, Fei-Long; Wu, Ming-Yan; Zhang, Xu-Dong; Wei, Wei; Gao, Qiang; Lee, Jeong Yong; Li, Jing; Hong, Mao-Chun","A 3D porous cobalt-organic framework exhibiting spin-canted antiferromagnetism and field-induced spin-flop transition.","Inorganic chemistry","2007","46","23","9609","9615","10.1021/ic700559z","","","0.71073","MoKα","","","0.0816","","","0.1822","0.1914","","","","","","1.178","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339632","10.4432","0.0017","12.2726","0.0016","13.708","0.002","88.505","0.012","75.56","0.014","87.077","0.012","1699","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H46 Cl4 Mn2 N26 -","- C66 H46 Cl4 Mn2 N26 -","- C66 H46 Cl4 Mn2 N26 -","1","0.5","","Wang, Guangbin; Slebodnick, Carla; Yee, Gordon T.","TCNE dimer dianion coordination complexes, [Mn(TPA)(TCNE)]2[micro2-(TCNE)2] and [Mn(TPA)(micro4-C4(CN)8)0.5].ClO4, TPA=tris(2-pyridylmethyl)amine: synthesis, structure and magnetic properties.","Inorganic chemistry","2007","46","23","9641","9645","10.1021/ic700590c","","x-ray","0.71073","MoKα","","0.1148","0.0678","","","0.1525","0.1827","","","","","","1.071","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339633","17.17","0.003","17.17","0.003","17.1837","0.0006","90","","90","","90","","5065.9","1.3","100","2","100","2","","","","","","","","6","P 42 21 2","P 4n 2n","94","","","","- C24 H18 Cl Mn N8 O4 -","- C24 H18 Cl Mn N8 O4 -","- C192 H144 Cl8 Mn8 N64 O32 -","8","1","","Wang, Guangbin; Slebodnick, Carla; Yee, Gordon T.","TCNE dimer dianion coordination complexes, [Mn(TPA)(TCNE)]2[micro2-(TCNE)2] and [Mn(TPA)(micro4-C4(CN)8)0.5].ClO4, TPA=tris(2-pyridylmethyl)amine: synthesis, structure and magnetic properties.","Inorganic chemistry","2007","46","23","9641","9645","10.1021/ic700590c","","x-ray","0.71073","MoKα","","0.054","0.0418","","","0.1094","0.113","","","","","","0.966","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339634","11.1813","0.0007","22.9345","0.0015","15.1949","0.001","90","","98.029","0.006","90","","3858.3","0.4","170","2","170","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","azadithiolate complex","","- C36 H37 Cl2 Fe2 N O4 P2 S2 -","- C36 H37 Cl2 Fe2 N O4 P2 S2 -","- C144 H148 Cl8 Fe8 N4 O16 P8 S8 -","4","1","","Ezzaher, Salah; Capon, Jean-François; Gloaguen, Frédéric; Pétillon, François Y; Schollhammer, Philippe; Talarmin, Jean","Electron-transfer-catalyzed rearrangement of unsymmetrically substituted diiron dithiolate complexes related to the active site of the [FeFe]-hydrogenases.","Inorganic chemistry","2007","46","23","9863","9872","10.1021/ic701327w","","x-ray","0.71073","MoKα","","0.0954","0.0541","","","0.1009","0.115","","","","","","0.965","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339635","11.0438","0.0006","22.42","0.0014","14.8519","0.0009","90","","96.859","0.006","90","","3651","0.4","170","2","170","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C39 H35 Fe2 N O4 P2 S2 -","- C39 H35 Fe2 N O4 P2 S2 -","- C156 H140 Fe8 N4 O16 P8 S8 -","4","1","","Ezzaher, Salah; Capon, Jean-François; Gloaguen, Frédéric; Pétillon, François Y; Schollhammer, Philippe; Talarmin, Jean","Electron-transfer-catalyzed rearrangement of unsymmetrically substituted diiron dithiolate complexes related to the active site of the [FeFe]-hydrogenases.","Inorganic chemistry","2007","46","23","9863","9872","10.1021/ic701327w","","x-ray","0.71073","MoKα","","0.1096","0.0538","","","0.0676","0.0799","","","","","","0.958","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339636","34.495","0.005","11.8409","0.0009","20.873","0.003","90","","123.853","0.019","90","","7080","2","295","2","295","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35 H35 Fe2 N O5 P2 S2 -","- C35 H35 Fe2 N O5 P2 S2 -","- C280 H280 Fe16 N8 O40 P16 S16 -","8","1","","Ezzaher, Salah; Capon, Jean-François; Gloaguen, Frédéric; Pétillon, François Y; Schollhammer, Philippe; Talarmin, Jean","Electron-transfer-catalyzed rearrangement of unsymmetrically substituted diiron dithiolate complexes related to the active site of the [FeFe]-hydrogenases.","Inorganic chemistry","2007","46","23","9863","9872","10.1021/ic701327w","","x-ray","0.71073","MoKα","","0.1036","0.0546","","","0.0897","0.1047","","","","","","1.019","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339637","10.9362","0.0008","10.7765","0.0008","30.1258","0.0016","90","","93.908","0.005","90","","3542.2","0.4","170","2","170","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35 H35 Fe2 N O4 P2 S2 -","- C35 H35 Fe2 N O4 P2 S2 -","- C140 H140 Fe8 N4 O16 P8 S8 -","4","1","","Ezzaher, Salah; Capon, Jean-François; Gloaguen, Frédéric; Pétillon, François Y; Schollhammer, Philippe; Talarmin, Jean","Electron-transfer-catalyzed rearrangement of unsymmetrically substituted diiron dithiolate complexes related to the active site of the [FeFe]-hydrogenases.","Inorganic chemistry","2007","46","23","9863","9872","10.1021/ic701327w","","x-ray","0.71073","MoKα","","0.0921","0.0489","","","0.103","0.1225","","","","","","1.081","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339638","13.038","0.003","22.936","0.003","8.095","0.002","90","","90","","90","","2420.7","0.9","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C25 H36 N O2 P -","- C25 H36 N O2 P -","- C100 H144 N4 O8 P4 -","4","0.5","","Chakravarty, Manab; Suresh, R. Rama; Swamy, K. C. Kumara","Molecularly nonstoichiometric crystals in phosphorus compounds.","Inorganic chemistry","2007","46","23","9819","9826","10.1021/ic701173x","","","0.71073","MoKα","","0.0598","0.0485","","","0.1379","0.1459","","","","","","1.007","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339639","12.397","0.004","10.936","0.004","19.775","0.006","90","","102.33","0.03","90","","2619.1","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H36 N2 O2 P2 -","- C24 H36 N2 O2 P2 -","- C96 H144 N8 O8 P8 -","4","1","","Chakravarty, Manab; Suresh, R. Rama; Swamy, K. C. Kumara","Molecularly nonstoichiometric crystals in phosphorus compounds.","Inorganic chemistry","2007","46","23","9819","9826","10.1021/ic701173x","","","0.71073","MoKα","","0.0756","0.0437","","","0.1208","0.1476","","","","","","1.1","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339640","13.443","0.003","23.013","0.003","7.885","0.002","90","","90","","90","","2439.3","0.9","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C25 H36 N O3 P -","- C25 H36 N O3 P -","- C100 H144 N4 O12 P4 -","4","0.5","","Chakravarty, Manab; Suresh, R. Rama; Swamy, K. C. Kumara","Molecularly nonstoichiometric crystals in phosphorus compounds.","Inorganic chemistry","2007","46","23","9819","9826","10.1021/ic701173x","","","0.71073","MoKα","","0.0754","0.0639","","","0.1735","0.1843","","","","","","1.047","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339641","13.4052","0.0009","23.054","0.0016","7.9639","0.0006","90","","90","","90","","2461.2","0.3","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C25 H36 N O2.7 P -","- C25 H36 N O2.7 P -","- C100 H144 N4 O10.8 P4 -","4","0.5","","Chakravarty, Manab; Suresh, R. Rama; Swamy, K. C. Kumara","Molecularly nonstoichiometric crystals in phosphorus compounds.","Inorganic chemistry","2007","46","23","9819","9826","10.1021/ic701173x","","","0.71073","MoKα","","0.0866","0.0653","","","0.1559","0.1673","","","","","","1.078","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339642","10.457","0.0006","13.3059","0.0008","18.1144","0.001","90","","90","","90","","2520.4","0.3","273","2","273","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H36 N O2 P S -","- C25 H36 N O2 P S -","- C100 H144 N4 O8 P4 S4 -","4","1","","Chakravarty, Manab; Suresh, R. Rama; Swamy, K. C. Kumara","Molecularly nonstoichiometric crystals in phosphorus compounds.","Inorganic chemistry","2007","46","23","9819","9826","10.1021/ic701173x","","","0.71073","MoKα","","0.0363","0.0326","","","0.0877","0.0901","","","","","","1.07","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339643","10.612","0.0007","13.3067","0.0009","18.1166","0.0012","90","","90","","90","","2558.3","0.3","273","2","273","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H36 N O2 P Se -","- C25 H36 N O2 P Se -","- C100 H144 N4 O8 P4 Se4 -","4","1","","Chakravarty, Manab; Suresh, R. Rama; Swamy, K. C. Kumara","Molecularly nonstoichiometric crystals in phosphorus compounds.","Inorganic chemistry","2007","46","23","9819","9826","10.1021/ic701173x","","","0.71073","MoKα","","0.0392","0.03","","","0.0611","0.063","","","","","","0.929","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339644","10.5397","0.0008","13.2992","0.001","18.1165","0.0013","90","","90","","90","","2539.4","0.3","273","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C25 H36 N O2 P S0.56 Se0.44 -","- C25 H36 N O2 P S0.56 Se0.44 -","- C100 H144 N4 O8 P4 S2.24 Se1.76 -","4","1","","Chakravarty, Manab; Suresh, R. Rama; Swamy, K. C. Kumara","Molecularly nonstoichiometric crystals in phosphorus compounds.","Inorganic chemistry","2007","46","23","9819","9826","10.1021/ic701173x","","","0.71073","MoKα","","0.0465","0.0362","","","0.0822","0.0865","","","","","","1.001","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339645","16.191","0.002","8.1589","0.001","40.17","0.005","90","","90","","90","","5306.5","1.1","273","2","273","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C24 H36 N2 O4 P2 -","- C24 H36 N2 O4 P2 -","- C192 H288 N16 O32 P16 -","8","2","","Chakravarty, Manab; Suresh, R. Rama; Swamy, K. C. Kumara","Molecularly nonstoichiometric crystals in phosphorus compounds.","Inorganic chemistry","2007","46","23","9819","9826","10.1021/ic701173x","","","0.71073","MoKα","","0.0462","0.0382","","","0.0963","0.1008","","","","","","1.046","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339646","20.381","0.002","8.2365","0.0008","16.2347","0.0016","90","","102.806","0.002","90","","2657.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H36 N2 O3.08 P2 -","- C24 H36 N2 O3.08 P2 -","- C96 H144 N8 O12.32 P8 -","4","1","","Chakravarty, Manab; Suresh, R. Rama; Swamy, K. C. Kumara","Molecularly nonstoichiometric crystals in phosphorus compounds.","Inorganic chemistry","2007","46","23","9819","9826","10.1021/ic701173x","","","0.71073","MoKα","","0.1115","0.066","","","0.146","0.167","","","","","","1.013","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339647","20.5","0.004","8.2247","0.0016","16.182","0.003","90","","102.53","0.03","90","","2663.4","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H36 N2 O3.4 P2 -","- C24 H36 N2 O3.397 P2 -","- C96 H144 N8 O13.588 P8 -","4","1","","Chakravarty, Manab; Suresh, R. Rama; Swamy, K. C. Kumara","Molecularly nonstoichiometric crystals in phosphorus compounds.","Inorganic chemistry","2007","46","23","9819","9826","10.1021/ic701173x","","","0.71073","MoKα","","0.0681","0.0582","","","0.1574","0.1636","","","","","","1.084","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339648","16.2414","0.0017","8.1762","0.0009","40.054","0.004","90","","90","","90","","5318.9","1","273","2","273","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C24 H36 N2 O3.73 P2 -","- C24 H36 N2 O3.7275 P2 -","- C192 H288 N16 O29.82 P16 -","8","2","","Chakravarty, Manab; Suresh, R. Rama; Swamy, K. C. Kumara","Molecularly nonstoichiometric crystals in phosphorus compounds.","Inorganic chemistry","2007","46","23","9819","9826","10.1021/ic701173x","","","0.71073","MoKα","","0.1384","0.0806","","","0.1816","0.2081","","","","","","0.996","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339649","10.061","0.0005","22.2252","0.001","10.7939","0.0005","90","","109.6","0.001","90","","2273.75","0.19","223","2","223","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H36 B4 F16 N12 O V2 -","- C24 H36 B4 F16 N12 O V2 -","- C48 H72 B8 F32 N24 O2 V4 -","2","0.5","","Cissell, Julie A.; Kaur, Narpinder; Nellutla, Saritha; Dalal, Naresh S.; Vaid, Thomas P.","Synthesis, structure, and magnetic properties of [(CH3CN)5V-O-V(CH3CN)5][BF4]4.","Inorganic chemistry","2007","46","23","9672","9677","10.1021/ic700920z","","","0.71073","MoKα","","0.0584","0.0496","","","0.1324","0.1431","","","","","","1.065","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339650","8.6651","0.0007","12.4896","0.0009","17.2926","0.0013","98.231","0.002","99.95","0.002","97.4","0.002","1801.6","0.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H63 Cl Mo N O2 Si2 -","- C28 H63 Cl Mo N O2 Si2 -","- C56 H126 Cl2 Mo2 N2 O4 Si4 -","2","1","","Rosenfeld, Devon C.; Wolczanski, Peter T.; Barakat, Khaldoon A.; Buda, Corneliu; Cundari, Thomas R.; Schroeder, Frank C.; Lobkovsky, Emil B.","Synthesis and reactivity of [(silox)2Mo=NR]2Hg (R=tBu, tAmyl; silox=OSitBu3): unusual thermal stability and ready nucleophilic cleavage rationalized by electronic factors.","Inorganic chemistry","2007","46","23","9715","9735","10.1021/ic7010953","","","0.71073","MoKα","","0.0526","0.0388","","","0.0931","0.0993","","","","","","1.02","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339651","9.3696","0.0005","17.913","0.001","23.8114","0.0013","90","","99.459","0.001","90","","3942.1","0.4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H72 Mo N O2 P Si2 -","- C31 H72 Mo N O2 P Si2 -","- C124 H288 Mo4 N4 O8 P4 Si8 -","4","1","","Rosenfeld, Devon C.; Wolczanski, Peter T.; Barakat, Khaldoon A.; Buda, Corneliu; Cundari, Thomas R.; Schroeder, Frank C.; Lobkovsky, Emil B.","Synthesis and reactivity of [(silox)2Mo=NR]2Hg (R=tBu, tAmyl; silox=OSitBu3): unusual thermal stability and ready nucleophilic cleavage rationalized by electronic factors.","Inorganic chemistry","2007","46","23","9715","9735","10.1021/ic7010953","","","0.71073","MoKα","","0.0685","0.0531","","","0.1237","0.1307","","","","","","1.098","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339652","8.533","0.002","8.766","0.002","10.749","0.002","90","","105.01","0.03","90","","776.6","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C3 H10 Cl2 N2 O Pd -","- C3 H10 Cl2 N2 O Pd -","- C12 H40 Cl8 N8 O4 Pd4 -","4","1","","Walmsley, Judith A.; Zhu, Shourong; Matilla, Antonio; Donowick, Tiffanee G.; Cramp, Jessica E.; Tercero, Jose Manuel; Dalrymple, Tatyana","Cyclic tetranuclear and hexanuclear palladium(II) complexes and their host-guest chemistry.","Inorganic chemistry","2007","46","23","9945","9953","10.1021/ic700830v","","","0.71069","MoKα","","0.05","0.0312","","","0.0529","0.0593","","","","","","1.043","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339653","12.59","0.0013","12.59","0.0013","12.59","0.0013","90","","90","","90","","1995.6","0.4","293","","293","","","","","","","","","5","F m -3 m","-F 4 2 3","225","","(Me4N)2(Mo(CN)6).H2O","","- C14 H26 Mo N8 O -","- C13.92 H34.14 Mo N8 O -","- C55.68 H136.56 Mo4 N32 O4 -","4","0.0208333","","Szklarzewicz, Janusz; Matoga, Dariusz; Niezgoda, Agnieszka; Yoshioka, Daisuke; Mikuriya, Masahiro","Missing link in the ligand-field photolysis of [Mo(CN)8]4-: synthesis, X-ray crystal structure, and physicochemical properties of [Mo(CN)6]2-.","Inorganic chemistry","2007","46","23","9531","9533","10.1021/ic701395r","","","0.71073","MoKα","","0.0712","0.067","","","0.1666","0.1729","","","","","","1.202","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339654","12.5495","0.0005","11.1716","0.0004","12.3229","0.0004","90","","97.435","0.001","90","","1713.12","0.11","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 Co I4 N4 O4 -","- C28 H30 Co I4 N4 O4 -","- C56 H60 Co2 I8 N8 O8 -","2","0.5","","Shakya, Rajendra; Hindo, Sarmad Sahiel; Wu, Libo; Allard, Marco M.; Heeg, Mary Jane; Hratchian, Hrant P.; McGarvey, Bruce R.; da Rocha, Sandro R. P.; Verani, Claudio N.","Archetypical modeling and amphiphilic behavior of cobalt(II)-containing soft-materials with asymmetric tridentate ligands.","Inorganic chemistry","2007","46","23","9808","9818","10.1021/ic7011815","","","0.71073","MoKα","","0.0233","0.0203","","","0.0466","0.0479","","","","","","1.045","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339655","7.214","0.001","6.158","0.001","11.691","0.002","90","","90.41","0.03","90","","519.35","0.14","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","pyridine-4-thione","","- C5 H5 N S -","- C5 H5 N S -","- C20 H20 N4 S4 -","4","1","","Räisänen, Minna T; Runeberg, Nino; Klinga, Martti; Nieger, Martin; Bolte, Michael; Pyykkö, Pekka; Leskelä, Markku; Repo, Timo","Coordination of pyridinethiols in gold(I) complexes.","Inorganic chemistry","2007","46","23","9954","9960","10.1021/ic700453t","","","0.71073","MoKα","","0.0567","0.0369","","","0.0794","0.0848","","","","","","1.136","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339656","17.011","0.003","11.425","0.002","6.793","0.001","90","","99.79","0.03","90","","1301","0.4","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis(pyridine-4-thionato)gold(I) chloride","","- C10 H10 Au Cl N2 S2 -","- C10 Au Cl N2 S2 -","- C40 Au4 Cl4 N8 S8 -","4","1","","Räisänen, Minna T; Runeberg, Nino; Klinga, Martti; Nieger, Martin; Bolte, Michael; Pyykkö, Pekka; Leskelä, Markku; Repo, Timo","Coordination of pyridinethiols in gold(I) complexes.","Inorganic chemistry","2007","46","23","9954","9960","10.1021/ic700453t","","","0.71073","MoKα","","0.1286","0.0949","","","0.2691","0.2819","","","","","","1.864","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339657","14.837","0.001","13.797","0.001","6.995","0.001","90","","100.15","0.02","90","","1409.5","0.3","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","bis(pyridine-2-thionato)gold(I) chloride hydrate","","- C10 H12 Au Cl N2 O S2 -","- C10 H12 Au Cl N2 O S2 -","- C40 H48 Au4 Cl4 N8 O4 S8 -","4","0.5","","Räisänen, Minna T; Runeberg, Nino; Klinga, Martti; Nieger, Martin; Bolte, Michael; Pyykkö, Pekka; Leskelä, Markku; Repo, Timo","Coordination of pyridinethiols in gold(I) complexes.","Inorganic chemistry","2007","46","23","9954","9960","10.1021/ic700453t","","","0.71073","MoKα","","0.053","0.0354","","","0.0861","0.0964","","","","","","1.009","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339658","10.03","0.002","10.86","0.002","11.787","0.002","90","","98.04","0.01","90","","1271.3","0.4","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis(pyridine-4-thionato)gold(I) chloride","","- C10 H10 Au Cl N2 S2 -","- C10 H10 Au Cl N2 S2 -","- C40 H40 Au4 Cl4 N8 S8 -","4","0.5","","Räisänen, Minna T; Runeberg, Nino; Klinga, Martti; Nieger, Martin; Bolte, Michael; Pyykkö, Pekka; Leskelä, Markku; Repo, Timo","Coordination of pyridinethiols in gold(I) complexes.","Inorganic chemistry","2007","46","23","9954","9960","10.1021/ic700453t","","","0.71073","MoKα","","0.0304","0.0176","","","0.035","0.0382","","","","","","1.093","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339659","5.569","0.001","8.119","0.002","23.596","0.005","90","","90","","90","","1066.9","0.4","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","diphenyl disulfide","","- C12 H10 S2 -","- C12 H10 S2 -","- C48 H40 S8 -","4","1","","Räisänen, Minna T; Runeberg, Nino; Klinga, Martti; Nieger, Martin; Bolte, Michael; Pyykkö, Pekka; Leskelä, Markku; Repo, Timo","Coordination of pyridinethiols in gold(I) complexes.","Inorganic chemistry","2007","46","23","9954","9960","10.1021/ic700453t","","","0.71073","MoKα","","0.0376","0.0317","","","0.0779","0.0808","","","","","","1.022","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339660","5.389","0.001","11.128","0.001","23.774","0.002","90","","90.73","0.02","90","","1425.6","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis(2-pyridinium)disulfide dichloride methanol solvate","","- C10.5 H10 Cl2 N2 O0.5 S2 -","- C10.5 H10 Cl2 N2 O0.5 S2 -","- C42 H40 Cl8 N8 O2 S8 -","4","1","","Räisänen, Minna T; Runeberg, Nino; Klinga, Martti; Nieger, Martin; Bolte, Michael; Pyykkö, Pekka; Leskelä, Markku; Repo, Timo","Coordination of pyridinethiols in gold(I) complexes.","Inorganic chemistry","2007","46","23","9954","9960","10.1021/ic700453t","","","0.71073","MoKα","","0.088","0.0489","","","0.1216","0.1409","","","","","","1.096","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4339661","15.6887","0.0016","13.5545","0.0014","17.3368","0.0019","90","","90","","90","","3686.7","0.7","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C30 H46 O18 V4 -","- C30 H46 O18 V4 -","- C120 H184 O72 V16 -","4","0.5","","Tidmarsh, Ian S.; Scales, Emma; Brearley, Paul R.; Wolowska, Joanna; Sorace, Lorenzo; Caneschi, Andrea; Laye, Rebecca H.; McInnes, Eric J. L.","Synthesis, structural, and magnetic studies on a redox family of tetrametallic vanadium clusters: {VIV4}, {VIII2VIV2}, and {VIII4} butterfly complexes.","Inorganic chemistry","2007","46","23","9743","9753","10.1021/ic7011183","","","0.71073","MoKα","","0.0864","0.0504","","","0.1093","0.1482","","","","","","0.989","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339662","10.2091","0.0004","15.6663","0.0007","11.3058","0.0005","90","","91.77","0.003","90","","1807.37","0.13","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H46 O16 V4 -","- C30 H46 O16 V4 -","- C60 H92 O32 V8 -","2","0.5","","Tidmarsh, Ian S.; Scales, Emma; Brearley, Paul R.; Wolowska, Joanna; Sorace, Lorenzo; Caneschi, Andrea; Laye, Rebecca H.; McInnes, Eric J. L.","Synthesis, structural, and magnetic studies on a redox family of tetrametallic vanadium clusters: {VIV4}, {VIII2VIV2}, and {VIII4} butterfly complexes.","Inorganic chemistry","2007","46","23","9743","9753","10.1021/ic7011183","","","0.7107","MoKα","","0.0387","0.0283","","","0.0763","0.0781","","","","","","1.041","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339663","16.4089","0.0006","14.1745","0.0005","16.569","0.0005","90","","90","","90","","3853.7","0.2","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C32 H50 O16 V4 -","- C32 H50 O16 V4 -","- C128 H200 O64 V16 -","4","0.5","","Tidmarsh, Ian S.; Scales, Emma; Brearley, Paul R.; Wolowska, Joanna; Sorace, Lorenzo; Caneschi, Andrea; Laye, Rebecca H.; McInnes, Eric J. L.","Synthesis, structural, and magnetic studies on a redox family of tetrametallic vanadium clusters: {VIV4}, {VIII2VIV2}, and {VIII4} butterfly complexes.","Inorganic chemistry","2007","46","23","9743","9753","10.1021/ic7011183","","","0.7107","MoKα","","0.0533","0.0357","","","0.0978","0.1068","","","","","","0.988","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339664","16.1109","0.0002","15.7691","0.0002","16.997","0.0002","90","","99.1356","0.0009","90","","4263.39","0.09","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H42 Cl2 Cu2 N12 O Pt -","- C44 H42 Cl2 Cu2 N12 O Pt -","- C176 H168 Cl8 Cu8 N48 O4 Pt4 -","4","1","","Liu, Isiah Po-Chun; Lee, Gene-Hsiang; Peng, Shie-Ming; Bénard, Marc; Rohmer, Marie-Madeleine","Cu-Pd-Cu and Cu-Pt-Cu linear frameworks: synthesis, magnetic properties, and theoretical analysis of two mixed-metal complexes of dipyridylamide (dpa), isostructural, and isoelectronic with [Cu3(dpa)4Cl2]+.","Inorganic chemistry","2007","46","23","9602","9608","10.1021/ic070319l","","","0.71073","MoKα","","0.1146","0.0495","","","0.1028","0.1212","","","","","","1.021","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339665","16.1125","0.0002","15.761","0.0002","16.9971","0.0002","90","","99.2852","0.0005","90","","4259.84","0.09","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H42 Cl2 Cu2 N12 O Pd -","- C44 H42 Cl2 Cu2 N12 O Pd -","- C176 H168 Cl8 Cu8 N48 O4 Pd4 -","4","1","","Liu, Isiah Po-Chun; Lee, Gene-Hsiang; Peng, Shie-Ming; Bénard, Marc; Rohmer, Marie-Madeleine","Cu-Pd-Cu and Cu-Pt-Cu linear frameworks: synthesis, magnetic properties, and theoretical analysis of two mixed-metal complexes of dipyridylamide (dpa), isostructural, and isoelectronic with [Cu3(dpa)4Cl2]+.","Inorganic chemistry","2007","46","23","9602","9608","10.1021/ic070319l","","","0.71073","MoKα","","0.0491","0.0309","","","0.0743","0.0824","","","","","","1.044","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339666","23.923","0.005","19.69","0.005","47.387","0.005","90","","97.776","0.005","90","","22116","8","180","","180","","","","","","","","synthesis","6","P 1 2/c 1","-P 2yc","13","","tetra(bis(2,2'-bipyridyl)Manganese(II))di(octacyano Niobium(IV)) cluster","","- C96 H87.25 Mn4 N32 Nb2 O11.62 -","- C96 H64 Mn4 N32 Nb2 O11.625 -","- C768 H512 Mn32 N256 Nb16 O93 -","8","2","","Venkatakrishnan, Thengarai S.; Rajamani, Raghunathan; Ramasesha, S.; Sutter, Jean-Pascal","Synthesis, crystal structure, and magnetic properties of hexanuclear [{MnL2}4{Nb(CN)8}2] and Nonanuclear [{MnL2}6{Nb(CN)8}3] heterometallic clusters (L=bpy, phen).","Inorganic chemistry","2007","46","23","9569","9574","10.1021/ic062383t","","","0.71073","MoKα","","0.2909","0.0944","","0.1324","0.0946","0.0946","","","","","","1.1138","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339667","33.759","0.007","41.862","0.008","28.543","0.006","90","","125.59","0.03","90","","32803","17","180","","180","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","hexa(bis(1,10-phenanthrolinyl)Manganese(II))tri(octacyano Tungsten(IV)) cluster","","- C168 H140.5 Mn6 N48 O22.25 W3 -","- C168 H96 Mn6 N48 O22.25 W3 -","- C1344 H768 Mn48 N384 O178 W24 -","8","1","","Venkatakrishnan, Thengarai S.; Rajamani, Raghunathan; Ramasesha, S.; Sutter, Jean-Pascal","Synthesis, crystal structure, and magnetic properties of hexanuclear [{MnL2}4{Nb(CN)8}2] and Nonanuclear [{MnL2}6{Nb(CN)8}3] heterometallic clusters (L=bpy, phen).","Inorganic chemistry","2007","46","23","9569","9574","10.1021/ic062383t","","","0.71073","MoKα","","0.1123","0.0449","","0.0635","0.0506","0.0506","","","","","","1.1293","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339668","12.562","0.0008","12.9151","0.0008","16.158","0.002","101.898","0.002","100.689","0.002","113.435","0.002","2246.7","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H49 Ce Mn6 N O41 -","- C18 H31 Ce Mn6 N O32.5 -","- C36 H62 Ce2 Mn12 N2 O65 -","2","1","","Tasiopoulos, Anastasios J.; Milligan, Jr, Paul L; Abboud, Khalil A.; O'Brien, Ted A; Christou, George","Mixed transition metal-lanthanide complexes at high oxidation states: heteronuclear CeIVMnIV clusters.","Inorganic chemistry","2007","46","23","9678","9691","10.1021/ic700994p","","","0.71073","MoKα","","0.0935","0.0443","","","0.0844","0.0903","","","","","","0.794","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339669","22.6707","0.0012","14.8735","0.0008","15.7286","0.0008","90","","90","","90","","5303.6","0.5","133","2","173","2","","","","","","","","6","A e a 2","A 2 -2ab","41","","","","- C36 H50 Ce3 Mn2 N6 O30 -","- C36 H50 Ce3 Mn2 N6 O30 -","- C144 H200 Ce12 Mn8 N24 O120 -","4","0.5","","Tasiopoulos, Anastasios J.; Milligan, Jr, Paul L; Abboud, Khalil A.; O'Brien, Ted A; Christou, George","Mixed transition metal-lanthanide complexes at high oxidation states: heteronuclear CeIVMnIV clusters.","Inorganic chemistry","2007","46","23","9678","9691","10.1021/ic700994p","","","0.71073","MoKα","","0.0256","0.025","","","0.0661","0.0666","","","","","","1.041","","","","has coordinates","264242","2021-04-16","08:52:18",""
"4339670","9.3132","0.0006","12.3866","0.0008","17.4899","0.0012","87.81","0.002","83.871","0.002","75.134","0.002","1938.8","0.2","193","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H27 Ce Mn2 N9 O24 -","- C22 H21 Ce Mn2 N9 O24 -","- C44 H42 Ce2 Mn4 N18 O48 -","2","1","","Tasiopoulos, Anastasios J.; Milligan, Jr, Paul L; Abboud, Khalil A.; O'Brien, Ted A; Christou, George","Mixed transition metal-lanthanide complexes at high oxidation states: heteronuclear CeIVMnIV clusters.","Inorganic chemistry","2007","46","23","9678","9691","10.1021/ic700994p","","","0.71073","MoKα","","0.1408","0.0806","","","0.1743","0.2131","","","","","","1.112","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339671","18.4824","0.001","15.44","0.0008","18.8592","0.001","90","","104.376","0.001","90","","5213.3","0.5","173","2","173","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C31 H46.5 Ce3 Mn2 N6.5 O34.5 -","- C36 H43.5 Ce3 Mn2 N3.5 O34.5 -","- C144 H174 Ce12 Mn8 N14 O138 -","4","1","","Tasiopoulos, Anastasios J.; Milligan, Jr, Paul L; Abboud, Khalil A.; O'Brien, Ted A; Christou, George","Mixed transition metal-lanthanide complexes at high oxidation states: heteronuclear CeIVMnIV clusters.","Inorganic chemistry","2007","46","23","9678","9691","10.1021/ic700994p","","","0.71073","MoKα","","0.0857","0.0571","","","0.1256","0.1361","","","","","","1.117","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339672","12.6976","0.0007","15.9248","0.0008","23.4859","0.0012","90","","97.805","0.002","90","","4705","0.4","173","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H50 Ce3 Mn2 N4 O35 -","- C24 H50 Ce3 Mn2 N4 O35 -","- C96 H200 Ce12 Mn8 N16 O140 -","4","0.5","","Tasiopoulos, Anastasios J.; Milligan, Jr, Paul L; Abboud, Khalil A.; O'Brien, Ted A; Christou, George","Mixed transition metal-lanthanide complexes at high oxidation states: heteronuclear CeIVMnIV clusters.","Inorganic chemistry","2007","46","23","9678","9691","10.1021/ic700994p","","","0.71073","MoKα","","0.0228","0.0213","","","0.0508","0.0514","","","","","","1.168","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339673","12.2133","0.0007","13.0106","0.0008","16.6337","0.001","99.056","0.002","101.581","0.002","111.188","0.002","2336.5","0.2","173","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H43 Ce Cl Mn6 O38 -","- C20 H31.5 Ce Cl Mn6 O38 -","- C40 H63 Ce2 Cl2 Mn12 O76 -","2","1","","Tasiopoulos, Anastasios J.; Milligan, Jr, Paul L; Abboud, Khalil A.; O'Brien, Ted A; Christou, George","Mixed transition metal-lanthanide complexes at high oxidation states: heteronuclear CeIVMnIV clusters.","Inorganic chemistry","2007","46","23","9678","9691","10.1021/ic700994p","","","0.71073","MoKα","","0.097","0.0728","","","0.1594","0.1693","","","","","","1.193","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339674","17.6846","0.0008","13.7662","0.0008","22.0391","0.0013","90","","90","","90","","5365.4","0.5","273","2","273","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C56.28 H58.2 Cl2 Cu N7 O10.32 P4 -","- C48 H35 Cl2 Cu N7 O8 P4 -","- C192 H140 Cl8 Cu4 N28 O32 P16 -","4","1","","Ainscough, Eric W.; Brodie, Andrew M.; Derwahl, Andreas; Kirk, Steve; Otter, Carl A.","Conformationally rigid chelate rings in metal complexes of pyridyloxy-substituted 2,2'-dioxybiphenyl-cyclotetra- and cyclotriphosphazene platforms.","Inorganic chemistry","2007","46","23","9841","9852","10.1021/ic701241v","","","0.71073","MoKα","","0.1011","0.0684","","","0.1546","0.1689","","","","","","0.958","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339675","23.6564","0.0003","23.6564","0.0003","24.307","0.0007","90","","90","","90","","13602.8","0.5","273","2","273","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C48 H40 Cl4 Cu2 N8 O8 P4 -","- C48 H40 Cl4 Cu2 N8 O9.002 P4 -","- C384 H320 Cl32 Cu16 N64 O72.016 P32 -","8","0.5","","Ainscough, Eric W.; Brodie, Andrew M.; Derwahl, Andreas; Kirk, Steve; Otter, Carl A.","Conformationally rigid chelate rings in metal complexes of pyridyloxy-substituted 2,2'-dioxybiphenyl-cyclotetra- and cyclotriphosphazene platforms.","Inorganic chemistry","2007","46","23","9841","9852","10.1021/ic701241v","","","0.71073","MoKα","","0.0566","0.051","","","0.1608","0.1655","","","","","","1.116","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339676","13.0331","0.0001","10.467","0.0001","31.104","","90","","95.424","0.001","90","","4224.13","0.05","357","2","84","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C38.5 H35.75 Cl2 Co N8.25 O6 P3 -","- C38.542 H35.813 Cl2 Co N8.271 O6 P3 -","- C154.168 H143.252 Cl8 Co4 N33.084 O24 P12 -","4","1","","Ainscough, Eric W.; Brodie, Andrew M.; Derwahl, Andreas; Kirk, Steve; Otter, Carl A.","Conformationally rigid chelate rings in metal complexes of pyridyloxy-substituted 2,2'-dioxybiphenyl-cyclotetra- and cyclotriphosphazene platforms.","Inorganic chemistry","2007","46","23","9841","9852","10.1021/ic701241v","","","0.71073","MoKα","","0.037","0.0301","","","0.0705","0.0743","","","","","","1.07","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339677","12.9284","0.0002","10.4443","0.0002","31.9761","0.0004","90","","94.128","0.001","90","","4306.47","0.12","357","2","84","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C37 H34 Br2 Cl2 Cu N7 O6 P3 -","- C37 H34 Br2 Cl2 Cu N7 O6 P3 -","- C148 H136 Br8 Cl8 Cu4 N28 O24 P12 -","4","1","","Ainscough, Eric W.; Brodie, Andrew M.; Derwahl, Andreas; Kirk, Steve; Otter, Carl A.","Conformationally rigid chelate rings in metal complexes of pyridyloxy-substituted 2,2'-dioxybiphenyl-cyclotetra- and cyclotriphosphazene platforms.","Inorganic chemistry","2007","46","23","9841","9852","10.1021/ic701241v","","","0.71073","MoKα","","0.0892","0.0516","","","0.1014","0.1144","","","","","","1.044","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339678","10.8684","0.0015","13.1852","0.0019","13.3977","0.0019","90.424","0.009","91.364","0.009","91.055","0.009","1919","0.5","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H32 Cl Co N8 O6 P3 -","- C34 H32 Cl Co N8 O6 P3 -","- C68 H64 Cl2 Co2 N16 O12 P6 -","2","1","","Ainscough, Eric W.; Brodie, Andrew M.; Derwahl, Andreas; Kirk, Steve; Otter, Carl A.","Conformationally rigid chelate rings in metal complexes of pyridyloxy-substituted 2,2'-dioxybiphenyl-cyclotetra- and cyclotriphosphazene platforms.","Inorganic chemistry","2007","46","23","9841","9852","10.1021/ic701241v","","","0.71073","MoKα","","0.1577","0.0677","","","0.1451","0.1776","","","","","","0.953","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339679","11.7837","0.0002","14.1371","0.0003","14.4231","0.0003","109.944","0.001","95.733","0.001","112.58","0.001","2010.35","0.07","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H32 Cl2 N6 O6.5 P3 Zn -","- C36 H27 Cl2 N6 O6 P3 Zn -","- C72 H54 Cl4 N12 O12 P6 Zn2 -","2","1","","Ainscough, Eric W.; Brodie, Andrew M.; Derwahl, Andreas; Kirk, Steve; Otter, Carl A.","Conformationally rigid chelate rings in metal complexes of pyridyloxy-substituted 2,2'-dioxybiphenyl-cyclotetra- and cyclotriphosphazene platforms.","Inorganic chemistry","2007","46","23","9841","9852","10.1021/ic701241v","","","0.71073","MoKα","","0.0333","0.0276","","","0.0731","0.0759","","","","","","1.034","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339680","12.2715","0.0001","19.547","0.0002","20.5278","0.0001","90","","90.194","0.001","90","","4924","0.07","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C47 H34 Cl4 Hg N6 O8 P4 -","- C47 H34 Cl4 Hg N6 O8 P4 -","- C188 H136 Cl16 Hg4 N24 O32 P16 -","4","1","","Ainscough, Eric W.; Brodie, Andrew M.; Derwahl, Andreas; Kirk, Steve; Otter, Carl A.","Conformationally rigid chelate rings in metal complexes of pyridyloxy-substituted 2,2'-dioxybiphenyl-cyclotetra- and cyclotriphosphazene platforms.","Inorganic chemistry","2007","46","23","9841","9852","10.1021/ic701241v","","","0.71073","MoKα","","0.0277","0.0244","","","0.061","0.063","","","","","","1.095","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339681","12.9529","0.0002","10.5835","0.0001","31.5286","0.0001","90","","94.63","","90","","4308.06","0.08","357","2","85","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C38.5 H35.75 Br2 Co N8.25 O6 P3 -","- C38.428 H35.642 Br2 Co N8.214 O6 P3 -","- C153.712 H142.568 Br8 Co4 N32.856 O24 P12 -","4","1","","Ainscough, Eric W.; Brodie, Andrew M.; Derwahl, Andreas; Kirk, Steve; Otter, Carl A.","Conformationally rigid chelate rings in metal complexes of pyridyloxy-substituted 2,2'-dioxybiphenyl-cyclotetra- and cyclotriphosphazene platforms.","Inorganic chemistry","2007","46","23","9841","9852","10.1021/ic701241v","","","0.71073","MoKα","","0.0419","0.0312","","","0.062","0.0657","","","","","","1.069","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339683","6.0255","0.0014","16.659","0.004","26.139","0.006","90","","90","","90","","2623.8","1.1","291","2","291","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 Cu3 N20 -","- C16 H22 Cu3 N20 -","- C64 H88 Cu12 N80 -","4","1","","Gu, Zhi-Guo; Song, You; Zuo, Jing-Lin; You, Xiao-Zeng","Chiral molecular ferromagnets based on copper(II) polymers with end-on azido bridges.","Inorganic chemistry","2007","46","23","9522","9524","10.1021/ic7015325","","","0.71073","MoKα","","0.0873","0.0634","","","0.1288","0.1349","","","","","","1.021","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339684","11.16","0.003","12.112","0.003","12.364","0.003","115.168","0.004","101.112","0.004","106.253","0.005","1355.4","0.6","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H48 Au2 N4 O4 -","- C54 H48 Au2 N4 O4 -","- C54 H48 Au2 N4 O4 -","1","0.5","","Abdou, Hanan E.; Mohamed, Ahmed A.; Fackler, Jr, John P","Oxidative addition of small molecules to a dinuclear Au(I) amidinate complex, Au2[(2,6-Me2Ph)2N2CH]2. Syntheses and characterization of Au(II) amidinate complexes including one which possesses Au(II)-oxygen bonds.","Inorganic chemistry","2007","46","23","9692","9699","10.1021/ic700929e","","","0.71073","MoKα","","0.0758","0.0691","","","0.1964","0.1996","","","","","","1.193","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339685","16.688","0.006","10.672","0.004","19.953","0.007","90","","94.565","0.007","90","","3542","2","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38.5 H47.5 Au2 I0.5 N4 O -","- C38.5 H47.5 Au2 I0.5 N4 O -","- C154 H190 Au8 I2 N16 O4 -","4","1","","Abdou, Hanan E.; Mohamed, Ahmed A.; Fackler, Jr, John P","Oxidative addition of small molecules to a dinuclear Au(I) amidinate complex, Au2[(2,6-Me2Ph)2N2CH]2. Syntheses and characterization of Au(II) amidinate complexes including one which possesses Au(II)-oxygen bonds.","Inorganic chemistry","2007","46","23","9692","9699","10.1021/ic700929e","","","0.71073","MoKα","","0.1121","0.0581","","","0.1329","0.1852","","","","","","1.133","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339686","16.597","0.003","10.606","0.002","19.809","0.003","90","","94.155","0.006","90","","3477.8","1.1","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C70 H80 Au4 Cl4 N8 -","- C72 H84 Au4 Cl6 N8 -","- C144 H168 Au8 Cl12 N16 -","2","0.5","","Abdou, Hanan E.; Mohamed, Ahmed A.; Fackler, Jr, John P","Oxidative addition of small molecules to a dinuclear Au(I) amidinate complex, Au2[(2,6-Me2Ph)2N2CH]2. Syntheses and characterization of Au(II) amidinate complexes including one which possesses Au(II)-oxygen bonds.","Inorganic chemistry","2007","46","23","9692","9699","10.1021/ic700929e","","","0.71073","MoKα","","0.119","0.1104","","","0.2956","0.302","","","","","","1.334","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339687","8.0611","0.0012","10.9563","0.0016","11.352","0.0017","84.815","0.002","78.352","0.002","88.577","0.002","977.9","0.3","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H46 Au2 I2 N4 O -","- C38 H46 Au2 I2 N4 O -","- C38 H46 Au2 I2 N4 O -","1","0.5","","Abdou, Hanan E.; Mohamed, Ahmed A.; Fackler, Jr, John P","Oxidative addition of small molecules to a dinuclear Au(I) amidinate complex, Au2[(2,6-Me2Ph)2N2CH]2. Syntheses and characterization of Au(II) amidinate complexes including one which possesses Au(II)-oxygen bonds.","Inorganic chemistry","2007","46","23","9692","9699","10.1021/ic700929e","","","0.71073","MoKα","","0.0459","0.0422","","","0.1204","0.1249","","","","","","1.062","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339688","11.012","0.002","18.464","0.004","19.467","0.004","90","","94.86","0.03","90","","3943.9","1.4","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C43 H56 Au2 Cl2 N4 -","- C43.084 H56.168 Au2 Cl2 N4 -","- C172.336 H224.672 Au8 Cl8 N16 -","4","1","","Abdou, Hanan E.; Mohamed, Ahmed A.; Fackler, Jr, John P","Oxidative addition of small molecules to a dinuclear Au(I) amidinate complex, Au2[(2,6-Me2Ph)2N2CH]2. Syntheses and characterization of Au(II) amidinate complexes including one which possesses Au(II)-oxygen bonds.","Inorganic chemistry","2007","46","23","9692","9699","10.1021/ic700929e","","","0.71073","MoKα","","0.0878","0.0689","","","0.1707","0.1931","","","","","","1.015","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339689","8.2643","0.0009","12.545","0.002","18.595","0.003","107.546","0.013","98.551","0.012","97.4","0.011","1786.6","0.5","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","4,4,6,6-Tetrachloro-3,4-dihydro-spiro[1,3,2-naphthoxazaphosphorine- [2(lambda)**5,4(lambda)**5,6(lambda)**5][1,3,5,2,4,6]-triazatriphosphorine","","- C11 H9 Cl4 N4 O P3 -","- C11 H9 Cl4 N4 O P3 -","- C44 H36 Cl16 N16 O4 P12 -","4","2","","Ilter, Elif Ece; Asmafiliz, Nuran; Kiliç, Zeynel; Isiklan, Muhammet; Hökelek, Tuncer; Caylak, Nagihan; Sahin, Ertan","Phosphorus-nitrogen compounds. 14. Synthesis, stereogenism, and structural investigations of novel n/o spirocyclic phosphazene derivatives.","Inorganic chemistry","2007","46","23","9931","9944","10.1021/ic701216f","","","1.54184","CuKα","","0.1006","0.0685","","","0.1625","0.1848","","","","","","1.021","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339690","9.5684","0.0011","11.5791","0.0019","17.129","0.002","93.663","0.013","92.424","0.01","107.067","0.013","1806.8","0.4","296","2","296","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","3-Propyl-4,4,6,6-tetrachloro-3,4-dihydro-spiro[1,3,2-benzoxazaphosphorine- [2(lambda)**5,4(lambda)**5,6(lambda)**5][1,3,5,2,4,6]triazatriphosphorine","","- C10 H13 Cl4 N4 O P3 -","- C10 H13 Cl4 N4 O P3 -","- C40 H52 Cl16 N16 O4 P12 -","4","2","","Ilter, Elif Ece; Asmafiliz, Nuran; Kiliç, Zeynel; Isiklan, Muhammet; Hökelek, Tuncer; Caylak, Nagihan; Sahin, Ertan","Phosphorus-nitrogen compounds. 14. Synthesis, stereogenism, and structural investigations of novel n/o spirocyclic phosphazene derivatives.","Inorganic chemistry","2007","46","23","9931","9944","10.1021/ic701216f","","","1.54184","CuKα","","0.191","0.0808","","","0.2133","0.267","","","","","","1.032","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339691","8.947","0.005","11.09","0.005","17.058","0.005","90","","97.04","0.005","90","","1679.8","1.3","296","2","296","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","3-Ethyl-4,4,6,6-tetrachloro-3,4-dihydro-spiro[1,3,2-benzoxazaphosphorine- [2(lambda)**5,4(lambda)**5,6(lambda)**5][1,3,5,2,4,6]triazatriphosphorine","","- C9 H11 Cl4 N4 O P3 -","- C9 H11 Cl4 N4 O P3 -","- C36 H44 Cl16 N16 O4 P12 -","4","1","","Ilter, Elif Ece; Asmafiliz, Nuran; Kiliç, Zeynel; Isiklan, Muhammet; Hökelek, Tuncer; Caylak, Nagihan; Sahin, Ertan","Phosphorus-nitrogen compounds. 14. Synthesis, stereogenism, and structural investigations of novel n/o spirocyclic phosphazene derivatives.","Inorganic chemistry","2007","46","23","9931","9944","10.1021/ic701216f","","","0.71073","MoKα","","0.0874","0.0595","","","0.1571","0.1763","","","","","","1.049","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339692","9.311","0.005","22.628","0.005","12.208","0.005","90","0.005","99.111","0.005","90","0.005","2539.6","1.8","296","2","296","2","","","","","","","synthesis as described","6","P 1 21/a 1","-P 2yab","14","","6,6-Dichloro-bis{3-propyl-3,4-dihydro-spiro[1,3,2-benzoxazaphosphorine} [2(lambda)**5,4(lambda)**5,6(lambda)**5][1,3,5,2,4,6]triazatriphosphorine","","- C20 H26 Cl2 N5 O2 P3 -","- C20 H26 Cl2 N5 O2 P3 -","- C80 H104 Cl8 N20 O8 P12 -","4","1","","Ilter, Elif Ece; Asmafiliz, Nuran; Kiliç, Zeynel; Isiklan, Muhammet; Hökelek, Tuncer; Caylak, Nagihan; Sahin, Ertan","Phosphorus-nitrogen compounds. 14. Synthesis, stereogenism, and structural investigations of novel n/o spirocyclic phosphazene derivatives.","Inorganic chemistry","2007","46","23","9931","9944","10.1021/ic701216f","","","0.71073","MoKα","","0.1307","0.0773","","","0.1991","0.233","","","","","","1.033","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339693","16.1007","0.0017","4.4842","0.0005","9.2081","0.001","90","","124.101","0.002","90","","550.5","0.1","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ag3.12 Ba2 Cu0.88 Se5 -","- Ag3.124 Ba2 Cu0.876 Se5 -","- Ag6.248 Ba4 Cu1.752 Se10 -","2","0.25","","Assoud, Abdeljalil; Xu, Jianxiao; Kleinke, Holger","Structures and physical properties of new semiconducting polyselenides Ba2CudeltaAg4-deltaSe5 with unprecedented linear Se(3)4- units.","Inorganic chemistry","2007","46","23","9906","9911","10.1021/ic701278b","","","0.71073","MoKα","","0.0411","0.0385","","","0.0842","0.0857","","","","","","1.061","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339694","16.189","0.002","4.5528","0.0006","9.2497","0.0013","90","","124.572","0.003","90","","561.36","0.13","298","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Ag4 Ba2 Se5 -","- Ag4 Ba2 Se5 -","- Ag8 Ba4 Se10 -","2","0.25","","Assoud, Abdeljalil; Xu, Jianxiao; Kleinke, Holger","Structures and physical properties of new semiconducting polyselenides Ba2CudeltaAg4-deltaSe5 with unprecedented linear Se(3)4- units.","Inorganic chemistry","2007","46","23","9906","9911","10.1021/ic701278b","","","0.71073","MoKα","","0.0304","0.0277","","","0.0601","0.0613","","","","","","1.094","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339695","15.987","0.003","16.587","0.003","19.414","0.003","82.378","0.004","80.176","0.003","85.986","0.004","5021.9","1.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C96 H82 Mn6 N12 O33 P4 S4 -","- C96 H64 Mn6 N12 O33 P4 S4 -","- C192 H128 Mn12 N24 O66 P8 S8 -","2","1","","Du, Zi-Yi; Prosvirin, Andrey V.; Mao, Jiang-Gao","Novel manganese(II) sulfonate-phosphonates with dinuclear, tetranuclear, and hexanuclear clusters.","Inorganic chemistry","2007","46","23","9884","9894","10.1021/ic701213g","","","0.71073","MoKα","","0.0846","0.0557","","","0.1363","0.1567","","","","","","1.075","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339696","14.092","0.003","16.076","0.003","16.124","0.003","73.799","0.005","87.716","0.007","73.791","0.006","3365.4","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C120 H132 Mn6 N16 O50 P4 S4 -","- C120 H80 Mn6 N16 O50 P4 S4 -","- C120 H80 Mn6 N16 O50 P4 S4 -","1","0.5","","Du, Zi-Yi; Prosvirin, Andrey V.; Mao, Jiang-Gao","Novel manganese(II) sulfonate-phosphonates with dinuclear, tetranuclear, and hexanuclear clusters.","Inorganic chemistry","2007","46","23","9884","9894","10.1021/ic701213g","","","0.71073","MoKα","","0.0763","0.0609","","","0.1454","0.1594","","","","","","1.061","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339697","13.232","0.002","13.868","0.002","17.727","0.003","84.144","0.007","69.201","0.005","67.703","0.006","2811.6","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C96 H100 Mn6 N12 O42 P4 S4 -","- C96 H64 Mn6 N12 O42 P4 S4 -","- C96 H64 Mn6 N12 O42 P4 S4 -","1","0.5","","Du, Zi-Yi; Prosvirin, Andrey V.; Mao, Jiang-Gao","Novel manganese(II) sulfonate-phosphonates with dinuclear, tetranuclear, and hexanuclear clusters.","Inorganic chemistry","2007","46","23","9884","9894","10.1021/ic701213g","","","0.71073","MoKα","","0.0591","0.0459","","","0.1193","0.1299","","","","","","1.04","","","","has coordinates","179499","2020-10-21","18:00:00",""
"4339698","14.6347","0.0001","15.1733","0.0003","16.237","0.0003","112.272","0.001","93.13","","114.91","0.001","2925.9","0.09","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C120 H92 Mn6 N16 O30 P4 S4 -","- C120 H92 Mn6 N16 O30 P4 S4 -","- C120 H92 Mn6 N16 O30 P4 S4 -","1","0.5","","Du, Zi-Yi; Prosvirin, Andrey V.; Mao, Jiang-Gao","Novel manganese(II) sulfonate-phosphonates with dinuclear, tetranuclear, and hexanuclear clusters.","Inorganic chemistry","2007","46","23","9884","9894","10.1021/ic701213g","","","0.71073","MoKα","","0.0392","0.0321","","","0.0793","0.0869","","","","","","1.099","","","","has coordinates,has disorder","179499","2020-10-21","18:00:00",""
"4339699","14.5331","0.0017","15.438","0.002","22.174","0.003","83.964","0.005","79.984","0.005","64.913","0.004","4434.3","1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C180 H142 Mn6 N24 O44 P6 S6 -","- C180 H126 Mn6 N24 O44 P6 S6 -","- C180 H126 Mn6 N24 O44 P6 S6 -","1","0.5","","Du, Zi-Yi; Prosvirin, Andrey V.; Mao, Jiang-Gao","Novel manganese(II) sulfonate-phosphonates with dinuclear, tetranuclear, and hexanuclear clusters.","Inorganic chemistry","2007","46","23","9884","9894","10.1021/ic701213g","","","0.71073","MoKα","","0.0707","0.0612","","","0.1684","0.1783","","","","","","1.036","","","","has coordinates","264242","2021-04-16","08:52:18",""
"4339700","15.352","0.003","13.628","0.003","26.195","0.006","90","","102.03","0.003","90","","5360","2","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C108 H82 Cl2 Mn4 N16 O25 P2 S2 -","- C108 H72 Cl2 Mn4 N16 O25 P2 S2 -","- C216 H144 Cl4 Mn8 N32 O50 P4 S4 -","2","0.5","","Du, Zi-Yi; Prosvirin, Andrey V.; Mao, Jiang-Gao","Novel manganese(II) sulfonate-phosphonates with dinuclear, tetranuclear, and hexanuclear clusters.","Inorganic chemistry","2007","46","23","9884","9894","10.1021/ic701213g","","","0.71073","MoKα","","0.0935","0.0758","","","0.2296","0.2507","","","","","","1.068","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339701","13.0475","0.0008","14.888","0.0009","20.4489","0.0013","106.897","0.001","104.392","0.001","95.097","0.001","3625.4","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","[H3B(5-(CF3)Pz)]Ag[P(C6H5)3]2","","","- C40 H35 Ag B F3 N2 P2 -","- C40 H35 Ag B F3 N2 P2 -","- C160 H140 Ag4 B4 F12 N8 P8 -","4","2","","Dias, H. V. Rasika; Alidori, Simone; Lobbia, Giancarlo Gioia; Papini, Grazia; Pellei, Maura; Santini, Carlo","Small scorpionate ligands: silver(I)-organophosphane complexes of 5-CF(3)-substituted scorpionate ligand combining a B-H...Ag coordination motif.","Inorganic chemistry","2007","46","23","9708","9714","10.1021/ic701041k","","","0.71073","MoKα","","0.0691","0.0571","","","0.1504","0.1627","","","","","","1.07","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339702","12.0954","0.0005","12.4403","0.0006","14.3438","0.0006","81.045","0.001","86.313","0.001","89.387","0.001","2127.6","0.16","100","2","100","2","","","","","","","","7","P -1","-P 1","2","[H3B(5-(CF3)Pz)]Ag[P(p-C6H4CH3)3]2","","","- C46 H47 Ag B F3 N2 P2 -","- C46 H47 Ag B F3 N2 P2 -","- C92 H94 Ag2 B2 F6 N4 P4 -","2","1","","Dias, H. V. Rasika; Alidori, Simone; Lobbia, Giancarlo Gioia; Papini, Grazia; Pellei, Maura; Santini, Carlo","Small scorpionate ligands: silver(I)-organophosphane complexes of 5-CF(3)-substituted scorpionate ligand combining a B-H...Ag coordination motif.","Inorganic chemistry","2007","46","23","9708","9714","10.1021/ic701041k","","","0.71073","MoKα","","0.0386","0.0348","","","0.0901","0.0937","","","","","","1.062","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339703","11.2664","0.0015","13.7944","0.0018","14.5269","0.0019","98.657","0.003","99.151","0.003","108.727","0.002","2061.3","0.5","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C82 H94 B2 Mo2 N14 O2 Pt S4 -","- C82 H94 B2 Mo2 N14 O2 Pt S4 -","- C82 H94 B2 Mo2 N14 O2 Pt S4 -","1","0.5","","Seidel, Wolfram W.; Meel, Matthias J.; Radius, Udo; Schaffrath, Markus; Pape, Tania","On the prospects of polynuclear complexes with acetylenedithiolate bridging units.","Inorganic chemistry","2007","46","23","9616","9629","10.1021/ic7008286","","","0.71073","MoKα","","0.0534","0.0429","","","0.102","0.107","","","","","","1.037","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339704","15.751","0.004","20.272","0.005","20.29","0.005","91.679","0.006","110.126","0.005","98.225","0.006","5999","3","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C97 H112 B4 Cu4 N24 O8 S8 W4 -","- C97 H112 B4 Cu4 N24 O8 S8 W4 -","- C194 H224 B8 Cu8 N48 O16 S16 W8 -","2","1","","Seidel, Wolfram W.; Meel, Matthias J.; Radius, Udo; Schaffrath, Markus; Pape, Tania","On the prospects of polynuclear complexes with acetylenedithiolate bridging units.","Inorganic chemistry","2007","46","23","9616","9629","10.1021/ic7008286","","","0.71073","MoKα","","0.0842","0.0512","","","0.1185","0.1333","","","","","","1.006","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339705","11.132","0.004","7.671","0.005","13.498","0.007","90","","92.43","0.04","90","","1151.6","1","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 Fe N2 -","- C14 H10 Fe N2 -","- C56 H40 Fe4 N8 -","4","1","","Nemykin, Victor N.; Makarova, Elena A.; Grosland, Jeffrey O.; Hadt, Ryan G.; Koposov, Alexey Y.","Preparation, characterization, molecular and electronic structures, TDDFT, and TDDFT/PCM study of the solvatochromism in cyanovinylferrocenes.","Inorganic chemistry","2007","46","23","9591","9601","10.1021/ic700558v","","","0.71073","MoKα","","0.1125","0.0543","","0.1373","0.1154","0.1154","","","","","","0.9108","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339706","46.001","0.009","16.707","0.003","19.466","0.004","90","","90","","90","","14960","5","120","2","120","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C81 H104 Al3 N7 -","- C81 H104 Al3 N7 -","- C648 H832 Al24 N56 -","8","1","","Löbl, Jiri; Timoshkin, Alexey Y.; Cong, Trinh; Necas, Marek; Roesky, Herbert W.; Pinkas, Jiri","Alumazene adducts with pyridines: synthesis, structure, and stability studies.","Inorganic chemistry","2007","46","14","5678","5685","10.1021/ic700488p","","","0.71073","MoKα","","0.1644","0.083","","","0.1917","0.2312","","","","","","1.142","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339707","12.768","0.003","13.144","0.003","18.283","0.004","97.29","0.03","109.16","0.03","91.13","0.03","2868.7","1.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C58 H83 Al3 N6 -","- C58 H83 Al3 N6 -","- C116 H166 Al6 N12 -","2","1","","Löbl, Jiri; Timoshkin, Alexey Y.; Cong, Trinh; Necas, Marek; Roesky, Herbert W.; Pinkas, Jiri","Alumazene adducts with pyridines: synthesis, structure, and stability studies.","Inorganic chemistry","2007","46","14","5678","5685","10.1021/ic700488p","","","0.71073","MoKα","","0.2292","0.0607","","","0.0953","0.134","","","","","","0.85","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339708","12.6189","0.0002","20.3632","0.0003","24.1086","0.0004","90","","90","","90","","6194.97","0.17","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C68 H91 Al3 N6 -","- C68 H91 Al3 N6 -","- C272 H364 Al12 N24 -","4","1","","Löbl, Jiri; Timoshkin, Alexey Y.; Cong, Trinh; Necas, Marek; Roesky, Herbert W.; Pinkas, Jiri","Alumazene adducts with pyridines: synthesis, structure, and stability studies.","Inorganic chemistry","2007","46","14","5678","5685","10.1021/ic700488p","","","0.71073","MoKα","","0.0819","0.0471","","","0.1138","0.1243","","","","","","0.988","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339709","14.8422","0.0002","21.3463","0.0002","23.7846","0.0002","90","","90","","90","","7535.58","0.14","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C60 H50 Cl4 I10 O24 -","- C60 H50 Cl4 I10 O24 -","- C240 H200 Cl16 I40 O96 -","4","0.5","","Richter, Helen W.; Koser, Gerald F.; Incarvito, Christopher D.; Rheingold, Arnold L.","Preparation and structure of a solid-state hypervalent-iodine polymer containing iodine and oxygen atoms in fused 12-atom hexagonal rings.","Inorganic chemistry","2007","46","14","5555","5561","10.1021/ic0701716","","","0.71073","MoKα","","0.0515","0.0406","","","0.1121","0.1222","","","","","","1.598","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339710","11.178","0.011","20.786","0.012","12.23","0.02","90","","115.784","0.016","90","","2559","5","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C20 H42 Mn6 N15 Na2 O17 -","- C20 H36 Mn6 N15 Na2 O17 -","- C40 H72 Mn12 N30 Na4 O34 -","2","1","","Mondal, Kartik Chandra; Drew, Mike G. B.; Mukherjee, Partha Sarathi","Synthesis of a Mn6 cluster and its self-assembly of an azido-bridged polymer.","Inorganic chemistry","2007","46","14","5625","5629","10.1021/ic0702670","","","0.71073","MoKα","","0.1963","0.1143","","","0.2918","0.3479","","","","","","0.994","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339711","13.1941","0.0008","14.9897","0.0009","27.8746","0.0014","90","","90","","90","","5512.9","0.5","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C30.75 H57.75 Mn6 N15 Na2 O20.25 -","- C30.75 H56.75 Mn6 N15 Na2 O20.25 -","- C123 H227 Mn24 N60 Na8 O81 -","4","1","","Mondal, Kartik Chandra; Drew, Mike G. B.; Mukherjee, Partha Sarathi","Synthesis of a Mn6 cluster and its self-assembly of an azido-bridged polymer.","Inorganic chemistry","2007","46","14","5625","5629","10.1021/ic0702670","","","0.71073","MoKα","","0.1164","0.0598","","","0.1121","0.1241","","","","","","0.957","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339712","11.05","0.03","11.334","0.007","13.356","0.007","64.99","0.06","73.74","0.11","84.03","0.13","1455","4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H37 N3 O3 Pd -","- C34 H37 N3 O3 Pd -","- C68 H74 N6 O6 Pd2 -","2","1","","Katayev, Evgeny A.; Severin, Kay; Scopelliti, Rosario; Ustynyuk, Yuri A.","Dioxygen activation by diiminodipyrromethane complexes of Ni, Pd, and Pt.","Inorganic chemistry","2007","46","14","5465","5467","10.1021/ic700632f","","","0.71073","MoKα","","0.0915","0.0546","","","0.1053","0.1211","","","","","","1.083","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339713","12.069","0.006","24.496","0.016","10.616","0.003","90","","112.35","0.03","90","","2903","3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35.5 H33.7 Cl0.2 N3.9 Ni O1.1 -","- C35.5 H33.7 Cl0.2 N3.9 Ni O1.1 -","- C142 H134.8 Cl0.8 N15.6 Ni4 O4.4 -","4","1","","Katayev, Evgeny A.; Severin, Kay; Scopelliti, Rosario; Ustynyuk, Yuri A.","Dioxygen activation by diiminodipyrromethane complexes of Ni, Pd, and Pt.","Inorganic chemistry","2007","46","14","5465","5467","10.1021/ic700632f","","","0.71073","MoKα","","0.095","0.0536","","","0.0909","0.1061","","","","","","1.15","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339714","19.923","0.002","19.923","0.002","18.511","0.003","90","","90","","90","","7347.5","1.6","293","2","293","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C38 H44 N4 Ni2 O10.5 -","- C36 H34 N4 Ni2 O10.5 -","- C288 H272 N32 Ni16 O84 -","8","1","","Paital, Alok Ranjan; Wong, Wing Tak; Aromí, Guillem; Ray, Debashis","New [LNiII2]+ complexes incorporating 2-formyl or 2,6-diformyl-4-methyl phenol as inhibitors of the hydrolysis of the ligand L3-: Ni...Ni ferromagnetic coupling and S=2 ground states.","Inorganic chemistry","2007","46","14","5727","5733","10.1021/ic700496c","","","0.71073","MoKα","","0.149","0.0612","","","0.1351","0.1702","","","","","","1.023","","","","has coordinates","268283","2021-08-30","06:31:23",""
"4339715","13.571","0.002","14.106","0.006","23.625","0.003","90","","90","","90","","4523","2","293","2","293","2","","","","","","","","5","P n 21 a","P -2ac -2n","33","","","","- C20 H25 N5 Ni O7 -","- C20 H25 N5 Ni O7 -","- C160 H200 N40 Ni8 O56 -","8","2","","Paital, Alok Ranjan; Wong, Wing Tak; Aromí, Guillem; Ray, Debashis","New [LNiII2]+ complexes incorporating 2-formyl or 2,6-diformyl-4-methyl phenol as inhibitors of the hydrolysis of the ligand L3-: Ni...Ni ferromagnetic coupling and S=2 ground states.","Inorganic chemistry","2007","46","14","5727","5733","10.1021/ic700496c","","","0.71073","MoKα","","0.0775","0.0458","","","0.1314","0.1464","","","","","","1.118","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339716","9.0762","0.0003","10.2474","0.0004","15.1786","0.0005","86.929","0.001","86.584","0.001","64.721","0.001","1273.65","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","1","","","- C10 H12 F6 N3 P -","- C10 H12 F6 N3 P -","- C40 H48 F24 N12 P4 -","4","2","","Catalano, Vincent J.; Etogo, Anthony O.","Preparation of Au(I), Ag(I), and Pd(II) N-heterocyclic carbene complexes utilizing a methylpyridyl-substituted NHC ligand. formation of a luminescent coordination polymer.","Inorganic chemistry","2007","46","14","5608","5615","10.1021/ic070260i","","","0.71073","MoKα","","0.0704","0.0495","","","0.1262","0.1358","","","","","","1.059","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339717","13.3884","0.0006","7.5058","0.0003","23.8413","0.0011","90","","105.881","0.001","90","","2304.38","0.17","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","2","","","- C20 H22 Ag F6 N6 P -","- C20 H22 Ag F6 N6 P -","- C80 H88 Ag4 F24 N24 P4 -","4","1","","Catalano, Vincent J.; Etogo, Anthony O.","Preparation of Au(I), Ag(I), and Pd(II) N-heterocyclic carbene complexes utilizing a methylpyridyl-substituted NHC ligand. formation of a luminescent coordination polymer.","Inorganic chemistry","2007","46","14","5608","5615","10.1021/ic070260i","","","0.71073","MoKα","","0.0294","0.0284","","","0.0728","0.0734","","","","","","1.172","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339718","13.263","0.003","7.5648","0.0015","23.783","0.005","90","","105.067","0.004","90","","2304.2","0.8","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","3","","","- C20 H22 Au F6 N6 P -","- C20 H22 Au F6 N6 P -","- C80 H88 Au4 F24 N24 P4 -","4","1","","Catalano, Vincent J.; Etogo, Anthony O.","Preparation of Au(I), Ag(I), and Pd(II) N-heterocyclic carbene complexes utilizing a methylpyridyl-substituted NHC ligand. formation of a luminescent coordination polymer.","Inorganic chemistry","2007","46","14","5608","5615","10.1021/ic070260i","","","0.71073","MoKα","","0.05","0.0478","","","0.1354","0.1363","","","","","","1.182","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339719","12.9666","0.0009","20.1452","0.0014","11.7021","0.0008","90","","110.02","0.001","90","","2872.1","0.3","100","2","100","2","","","","","","","","8","C 1 c 1","C -2yc","9","4","","","- C23 H27 Ag Au B2 F8 N7 P0 -","- C23 H27 Ag Au B2 F8 N7 -","- C92 H108 Ag4 Au4 B8 F32 N28 -","4","1","","Catalano, Vincent J.; Etogo, Anthony O.","Preparation of Au(I), Ag(I), and Pd(II) N-heterocyclic carbene complexes utilizing a methylpyridyl-substituted NHC ligand. formation of a luminescent coordination polymer.","Inorganic chemistry","2007","46","14","5608","5615","10.1021/ic070260i","","","0.71073","MoKα","","0.0397","0.0348","","","0.0764","0.078","","","","","","0.946","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339720","12.4099","0.0005","15.5311","0.0006","12.5353","0.0005","90","","104.921","0.001","90","","2334.58","0.16","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","5","[Pd(CH3Im(CH3Py)2Cl](PF6)","","- C20 H22 Cl F6 N6 P Pd -","- C20 H22 Cl F6 N6 P Pd -","- C80 H88 Cl4 F24 N24 P4 Pd4 -","4","1","","Catalano, Vincent J.; Etogo, Anthony O.","Preparation of Au(I), Ag(I), and Pd(II) N-heterocyclic carbene complexes utilizing a methylpyridyl-substituted NHC ligand. formation of a luminescent coordination polymer.","Inorganic chemistry","2007","46","14","5608","5615","10.1021/ic070260i","","","0.71073","MoKα","","0.0213","0.0203","","","0.054","0.0546","","","","","","1.059","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339721","8.908","0.0002","12.61","0.0004","14.271","0.0005","94.53","0.0014","100.772","0.0013","98.109","0.0019","1549.89","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H42 N5 O13 P3 -","- C24 H42 N5 O13 P3 -","- C48 H84 N10 O26 P6 -","2","1","","Verdejo, Begoña; Ferrer, Armando; Blasco, Salvador; Castillo, Carmen Esther; González, Jorge; Latorre, Julio; Máñez, M Angeles; Basallote, Manuel García; Soriano, Conxa; García-España, Enrique","Hydrogen and copper ion-induced molecular reorganizations in scorpionand-like ligands. A potentiometric, mechanistic, and solid-state study.","Inorganic chemistry","2007","46","14","5707","5719","10.1021/ic700643n","","","0.71073","MoKα","","0.1459","0.0852","","","0.2257","0.2611","","","","","","1.553","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339722","12.447","0.005","19.152","0.005","20.39","0.005","90","0.005","124.42","0.005","90","0.005","4010","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H24 Cl2 Cu N5 O8.5 -","- C13 H20 Cl2 Cu N5 O8.5 -","- C104 H160 Cl16 Cu8 N40 O68 -","8","2","","Verdejo, Begoña; Ferrer, Armando; Blasco, Salvador; Castillo, Carmen Esther; González, Jorge; Latorre, Julio; Máñez, M Angeles; Basallote, Manuel García; Soriano, Conxa; García-España, Enrique","Hydrogen and copper ion-induced molecular reorganizations in scorpionand-like ligands. A potentiometric, mechanistic, and solid-state study.","Inorganic chemistry","2007","46","14","5707","5719","10.1021/ic700643n","","","0.71069","MoKα","","0.171","0.0724","","","0.1764","0.2417","","","","","","1.239","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339723","17.436","0.0005","10.489","0.0008","15.972","0.001","90","0.0017","105.551","0.0018","90","0.003","2814.1","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H31 Cl2 Cu N5 O8 -","- C24 H28 Cl2 Cu N5 O8 -","- C96 H112 Cl8 Cu4 N20 O32 -","4","1","","Verdejo, Begoña; Ferrer, Armando; Blasco, Salvador; Castillo, Carmen Esther; González, Jorge; Latorre, Julio; Máñez, M Angeles; Basallote, Manuel García; Soriano, Conxa; García-España, Enrique","Hydrogen and copper ion-induced molecular reorganizations in scorpionand-like ligands. A potentiometric, mechanistic, and solid-state study.","Inorganic chemistry","2007","46","14","5707","5719","10.1021/ic700643n","","","0.71073","MoKα","","0.1437","0.1097","","","0.2967","0.3119","","","","","","2.116","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339724","8.937","0.0013","16.164","0.0008","18.057","0.0019","90","","90","","90","","2608.5","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H34 Cl N5 O5 -","- C24 H34 Cl N5 O5 -","- C96 H136 Cl4 N20 O20 -","4","1","","Verdejo, Begoña; Ferrer, Armando; Blasco, Salvador; Castillo, Carmen Esther; González, Jorge; Latorre, Julio; Máñez, M Angeles; Basallote, Manuel García; Soriano, Conxa; García-España, Enrique","Hydrogen and copper ion-induced molecular reorganizations in scorpionand-like ligands. A potentiometric, mechanistic, and solid-state study.","Inorganic chemistry","2007","46","14","5707","5719","10.1021/ic700643n","","","0.71073","MoKα","","0.1238","0.065","","","0.1659","0.2065","","","","","","1.115","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339725","12.87","0.009","20.912","0.015","16.469","0.011","90","","97.562","0.013","90","","4394","5","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H24 Cu4 N12 S4 -","- C36 H24 Cu4 N12 S4 -","- C144 H96 Cu16 N48 S16 -","4","1","","Huang, Chunhui; Gou, Shaohua; Zhu, Haibin; Huang, Wei","Cleavage of C-S bonds with the formation of a tetranuclear Cu(I) cluster.","Inorganic chemistry","2007","46","14","5537","5543","10.1021/ic062059y","","","0.71073","MoKα","","0.0829","0.059","","","0.1761","0.1864","","","","","","1.027","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339726","10.5995","0.0002","19.2209","0.0007","18.1175","0.0006","90","","105.084","0.0019","90","","3563.94","0.19","150","1","150","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H35 Cl3 N4 Ni O6 S -","- C35 H35 Cl3 N4 Ni O6 S -","- C140 H140 Cl12 N16 Ni4 O24 S4 -","4","1","","Szajna-Fuller, Ewa; Chambers, Bonnie M.; Arif, Atta M.; Berreau, Lisa M.","Carboxylate coordination chemistry of a mononuclear Ni(II) center in a hydrophobic or hydrogen bond donor secondary environment: relevance to acireductone dioxygenase.","Inorganic chemistry","2007","46","14","5486","5498","10.1021/ic061316w","","","0.71073","MoKα","","0.0744","0.0529","","","0.1245","0.1351","","","","","","1.051","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339727","10.7355","0.0002","18.8996","0.0004","18.5336","0.0004","90","","101.976","0.0011","90","","3678.55","0.13","150","1","150","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34.5 H34 Cl4 N4 Ni O6 S -","- C34.5 H34 Cl4 N4 Ni O6 S -","- C138 H136 Cl16 N16 Ni4 O24 S4 -","4","1","","Szajna-Fuller, Ewa; Chambers, Bonnie M.; Arif, Atta M.; Berreau, Lisa M.","Carboxylate coordination chemistry of a mononuclear Ni(II) center in a hydrophobic or hydrogen bond donor secondary environment: relevance to acireductone dioxygenase.","Inorganic chemistry","2007","46","14","5486","5498","10.1021/ic061316w","","","0.71073","MoKα","","0.0772","0.0468","","","0.1069","0.1213","","","","","","1.026","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339728","12.7841","0.0002","17.5239","0.0004","19.5938","0.0004","77.7264","0.0012","77.8212","0.0012","70.571","0.001","3997.84","0.14","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C38.75 H36.5 Cl4.5 N4 Ni O7 -","- C38.75 H36.5 Cl4.5 N4 Ni O7 -","- C155 H146 Cl18 N16 Ni4 O28 -","4","2","","Szajna-Fuller, Ewa; Chambers, Bonnie M.; Arif, Atta M.; Berreau, Lisa M.","Carboxylate coordination chemistry of a mononuclear Ni(II) center in a hydrophobic or hydrogen bond donor secondary environment: relevance to acireductone dioxygenase.","Inorganic chemistry","2007","46","14","5486","5498","10.1021/ic061316w","","","0.71073","MoKα","","0.0857","0.0569","","","0.1378","0.1555","","","","","","1.028","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339729","32.2278","0.0009","13.1954","0.0004","18.9364","0.0003","90","","120.586","0.0015","90","","6932.5","0.3","150","1","150","1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34.5 H36 Cl2 N4 Ni O7 S -","- C34.5 H36 Cl2 N4 Ni O7 S -","- C276 H288 Cl16 N32 Ni8 O56 S8 -","8","1","","Szajna-Fuller, Ewa; Chambers, Bonnie M.; Arif, Atta M.; Berreau, Lisa M.","Carboxylate coordination chemistry of a mononuclear Ni(II) center in a hydrophobic or hydrogen bond donor secondary environment: relevance to acireductone dioxygenase.","Inorganic chemistry","2007","46","14","5486","5498","10.1021/ic061316w","","","0.71073","MoKα","","0.0966","0.0625","","","0.1554","0.1788","","","","","","1.032","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339730","11.9609","0.0003","11.9728","0.0003","13.5445","0.0003","92.1279","0.001","108.825","0.0013","116.098","0.0011","1611.71","0.07","150","1","150","1","","","","","","","","7","P -1","-P 1","2","","","","- C33 H33 Cl N4 Ni O7 S -","- C33 H33 Cl N4 Ni O7 S -","- C66 H66 Cl2 N8 Ni2 O14 S2 -","2","1","","Szajna-Fuller, Ewa; Chambers, Bonnie M.; Arif, Atta M.; Berreau, Lisa M.","Carboxylate coordination chemistry of a mononuclear Ni(II) center in a hydrophobic or hydrogen bond donor secondary environment: relevance to acireductone dioxygenase.","Inorganic chemistry","2007","46","14","5486","5498","10.1021/ic061316w","","","0.71073","MoKα","","0.0504","0.0411","","","0.0949","0.1012","","","","","","1.038","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339731","14.6776","0.0005","13.8506","0.0006","15.1681","0.0004","90","","107.619","0.002","90","","2938.93","0.18","150","1","150","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H29 Cl N4 Ni O7 -","- C31 H29 Cl N4 Ni O7 -","- C124 H116 Cl4 N16 Ni4 O28 -","4","1","","Szajna-Fuller, Ewa; Chambers, Bonnie M.; Arif, Atta M.; Berreau, Lisa M.","Carboxylate coordination chemistry of a mononuclear Ni(II) center in a hydrophobic or hydrogen bond donor secondary environment: relevance to acireductone dioxygenase.","Inorganic chemistry","2007","46","14","5486","5498","10.1021/ic061316w","","","0.71073","MoKα","","0.0965","0.0563","","","0.103","0.1173","","","","","","1.095","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339732","9.0547","0.0001","16.9928","0.0004","25.0648","0.0006","90","","93.3772","0.0014","90","","3849.89","0.14","150","1","150","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H48 Cl N7 Ni O6 -","- C37 H48 Cl N7 Ni O6 -","- C148 H192 Cl4 N28 Ni4 O24 -","4","1","","Szajna-Fuller, Ewa; Chambers, Bonnie M.; Arif, Atta M.; Berreau, Lisa M.","Carboxylate coordination chemistry of a mononuclear Ni(II) center in a hydrophobic or hydrogen bond donor secondary environment: relevance to acireductone dioxygenase.","Inorganic chemistry","2007","46","14","5486","5498","10.1021/ic061316w","","","0.71073","MoKα","","0.0964","0.0612","","","0.148","0.1824","","","","","","1.066","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339733","9.145","0.0002","19.588","0.0003","21.9762","0.0004","90","","90","","90","","3936.65","0.13","150","1","150","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H47 Cl3 N6 Ni O6 -","- C36 H47 Cl3 N6 Ni O6 -","- C144 H188 Cl12 N24 Ni4 O24 -","4","1","","Szajna-Fuller, Ewa; Chambers, Bonnie M.; Arif, Atta M.; Berreau, Lisa M.","Carboxylate coordination chemistry of a mononuclear Ni(II) center in a hydrophobic or hydrogen bond donor secondary environment: relevance to acireductone dioxygenase.","Inorganic chemistry","2007","46","14","5486","5498","10.1021/ic061316w","","","0.71073","MoKα","","0.0797","0.0581","","","0.1304","0.1482","","","","","","1.021","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339734","12.1405","0.0005","20.7461","0.0008","14.1678","0.0005","90","","109.818","0.001","90","","3357.1","0.2","243","2","243","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H38 P2 Ru S -","- C39 H38 P2 Ru S -","- C156 H152 P8 Ru4 S4 -","4","1","","Shaw, Anthony P.; Ryland, Bradford L.; Norton, Jack R.; Buccella, Daniela; Moscatelli, Alberto","Electron exchange involving a sulfur-stabilized ruthenium radical cation.","Inorganic chemistry","2007","46","14","5805","5812","10.1021/ic700580u","","","0.71073","MoKα","","0.059","0.0342","","","0.0747","0.0828","","","","","","1.014","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339735","11.4497","0.0006","23.7658","0.0013","18.9148","0.001","90","","101.435","0.001","90","","5044.8","0.5","125","2","125","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C63 H59 B P2 Ru S -","- C63 H58 B P2 Ru S -","- C252 H232 B4 P8 Ru4 S4 -","4","1","","Shaw, Anthony P.; Ryland, Bradford L.; Norton, Jack R.; Buccella, Daniela; Moscatelli, Alberto","Electron exchange involving a sulfur-stabilized ruthenium radical cation.","Inorganic chemistry","2007","46","14","5805","5812","10.1021/ic700580u","","","0.71073","MoKα","","0.0983","0.0511","","","0.104","0.1235","","","","","","1.008","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339736","11.5351","0.0011","23.674","0.002","18.6041","0.0017","90","","100.636","0.001","90","","4993.2","0.8","125","2","125","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C63 H60 B N P2 Ru -","- C63 H60 B N P2 Ru -","- C252 H240 B4 N4 P8 Ru4 -","4","1","","Shaw, Anthony P.; Ryland, Bradford L.; Norton, Jack R.; Buccella, Daniela; Moscatelli, Alberto","Electron exchange involving a sulfur-stabilized ruthenium radical cation.","Inorganic chemistry","2007","46","14","5805","5812","10.1021/ic700580u","","","0.71073","MoKα","","0.0507","0.0337","","","0.0796","0.0878","","","","","","1.024","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339737","13.8138","0.0002","33.7925","0.0007","9.8548","0.0003","90","","92.8627","0.0013","90","","4594.51","0.18","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H28 Ca0.19 La N4 O10 -","- C48 H28 Ca0.193 La N4 O10 -","- C192 H112 Ca0.772 La4 N16 O40 -","4","1","","Muniappan, Sankar; Lipstman, Sophia; George, Sumod; Goldberg, Israel","Porphyrin framework solids. Synthesis and structure of hybrid coordination polymers of tetra(carboxyphenyl)porphyrins and lanthanide-bridging ions.","Inorganic chemistry","2007","46","14","5544","5554","10.1021/ic0701099","","","0.71073","MoKα","","0.1064","0.0487","","","0.1076","0.1204","","","","","","0.914","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339738","7.4595","0.0001","11.474","0.0003","16.4767","0.0004","98.9511","0.0011","90.9863","0.0014","91.3109","0.0014","1392.4","0.05","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H16 N2 O7 Pr -","- C25 H16 N2 O7 Pr -","- C50 H32 N4 O14 Pr2 -","2","1","","Muniappan, Sankar; Lipstman, Sophia; George, Sumod; Goldberg, Israel","Porphyrin framework solids. Synthesis and structure of hybrid coordination polymers of tetra(carboxyphenyl)porphyrins and lanthanide-bridging ions.","Inorganic chemistry","2007","46","14","5544","5554","10.1021/ic0701099","","","0.71073","MoKα","","0.0392","0.0348","","","0.0984","0.1008","","","","","","1.12","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339739","9.6357","0.0002","13.9203","0.0003","17.2875","0.0005","98.1574","0.0009","89.7511","0.0009","89.1062","0.0016","2295.01","0.1","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H31 N4 O10 Pr -","- C48 H31 N4 O10 Pr -","- C96 H62 N8 O20 Pr2 -","2","1","","Muniappan, Sankar; Lipstman, Sophia; George, Sumod; Goldberg, Israel","Porphyrin framework solids. Synthesis and structure of hybrid coordination polymers of tetra(carboxyphenyl)porphyrins and lanthanide-bridging ions.","Inorganic chemistry","2007","46","14","5544","5554","10.1021/ic0701099","","","0.71073","MoKα","","0.0574","0.0415","","","0.0938","0.0996","","","","","","0.957","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339740","9.6187","0.0003","13.8934","0.0006","17.2345","0.0007","98.058","0.002","90.457","0.002","90.599","0.003","2280.19","0.15","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H28 Ca0.18 N4 O10 Sm -","- C48 H28 Ca0.181 N4 O10 Sm -","- C96 H56 Ca0.362 N8 O20 Sm2 -","2","1","","Muniappan, Sankar; Lipstman, Sophia; George, Sumod; Goldberg, Israel","Porphyrin framework solids. Synthesis and structure of hybrid coordination polymers of tetra(carboxyphenyl)porphyrins and lanthanide-bridging ions.","Inorganic chemistry","2007","46","14","5544","5554","10.1021/ic0701099","","","0.71073","MoKα","","0.067","0.0497","","","0.1121","0.1178","","","","","","1.047","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339741","18.6144","0.0004","27.9022","0.0009","11.7735","0.0008","90","","100.085","0.0013","90","","6020.5","0.5","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H30 Dy2 N4 O18 -","- C52 H30 Dy2 N4 O18 -","- C208 H120 Dy8 N16 O72 -","4","1","","Muniappan, Sankar; Lipstman, Sophia; George, Sumod; Goldberg, Israel","Porphyrin framework solids. Synthesis and structure of hybrid coordination polymers of tetra(carboxyphenyl)porphyrins and lanthanide-bridging ions.","Inorganic chemistry","2007","46","14","5544","5554","10.1021/ic0701099","","","0.71073","MoKα","","0.1241","0.0693","","","0.1725","0.1913","","","","","","0.91","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339742","9.5168","0.0002","15.0535","0.0003","18.0806","0.0004","92.6233","0.0011","103.711","0.0011","95.6065","0.0011","2498.03","0.09","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H25 Cu Dy N4 O10 -","- C49 H25 Cu Dy N4 O10 -","- C98 H50 Cu2 Dy2 N8 O20 -","2","1","","Muniappan, Sankar; Lipstman, Sophia; George, Sumod; Goldberg, Israel","Porphyrin framework solids. Synthesis and structure of hybrid coordination polymers of tetra(carboxyphenyl)porphyrins and lanthanide-bridging ions.","Inorganic chemistry","2007","46","14","5544","5554","10.1021/ic0701099","","","0.71073","MoKα","","0.0711","0.0517","","","0.1283","0.1365","","","","","","1.037","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339743","21.6348","0.0006","24.1366","0.0007","31.3773","0.0006","90","","104.292","0.0016","90","","15877.8","0.7","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C75 H46 N7 Nd2 O14 Pt1.5 -","- C75 H46 N7 Nd2 O14 Pt2 -","- C600 H368 N56 Nd16 O112 Pt16 -","8","1","","Muniappan, Sankar; Lipstman, Sophia; George, Sumod; Goldberg, Israel","Porphyrin framework solids. Synthesis and structure of hybrid coordination polymers of tetra(carboxyphenyl)porphyrins and lanthanide-bridging ions.","Inorganic chemistry","2007","46","14","5544","5554","10.1021/ic0701099","","","0.71073","MoKα","","0.1161","0.0643","","","0.1643","0.1797","","","","","","0.959","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339744","7.5676","0.001","15.352","0.002","8.4817","0.0011","90","","97.101","0.002","90","","977.8","0.2","293","2","291","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H16 Cu2 N8 O2 -","- C18 H16 Cu2 N8 O2 -","- C36 H32 Cu4 N16 O4 -","2","1","","Gu, Zhi-Guo; Zhou, Xin-Hui; Jin, Yang-Bo; Xiong, Ren-Gen; Zuo, Jing-Lin; You, Xiao-Zeng","Crystal structures and magnetic and ferroelectric properties of chiral layered metal-organic frameworks with dicyanamide as the bridging ligand.","Inorganic chemistry","2007","46","14","5462","5464","10.1021/ic070112s","","","0.71073","MoKα","","0.0751","0.0592","","","0.1259","0.1296","","","","","","1.001","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339745","13.8233","0.0006","14.0671","0.0006","14.2856","0.0006","65.175","0.002","70.147","0.002","89.561","0.002","2341.55","0.18","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C92 H79 Fe6 N13 O27 -","- C92 H77 Fe6 N13 O27 -","- C92 H77 Fe6 N13 O27 -","1","0.5","","Bagai, Rashmi; Abboud, Khalil A.; Christou, George","A new N,N,O chelate for transition metal chemistry: Fe5 and Fe6 clusters from the use of 6-hydroxymethyl-2,2'-bipyridine (hmbpH).","Inorganic chemistry","2007","46","14","5567","5575","10.1021/ic070174i","","","0.71073","MoKα","","0.0651","0.0485","","","0.1276","0.1425","","","","","","1.077","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339746","21.6352","0.0002","13.4154","0.0006","23.1971","0.0011","90","","102.456","0.002","90","","6574.4","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C53 H58 Cl2 Fe5 N11 O24 -","- C43 H43 Cl2 Fe5 N6 O24 -","- C172 H172 Cl8 Fe20 N24 O96 -","4","1","","Bagai, Rashmi; Abboud, Khalil A.; Christou, George","A new N,N,O chelate for transition metal chemistry: Fe5 and Fe6 clusters from the use of 6-hydroxymethyl-2,2'-bipyridine (hmbpH).","Inorganic chemistry","2007","46","14","5567","5575","10.1021/ic070174i","","","0.71073","MoKα","","0.0923","0.0611","","","0.1705","0.1839","","","","","","1.074","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339747","10.8226","0.0002","19.937","0.0005","15.7971","0.0004","90","","103.159","0.0014","90","","3319.04","0.13","150","1","150","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H31 Cl N4 Ni O6 -","- C37 H31 Cl N4 Ni O6 -","- C148 H124 Cl4 N16 Ni4 O24 -","4","1","","Szajna-Fuller, Ewa; Rudzka, Katarzyna; Arif, Atta M.; Berreau, Lisa M.","Acireductone dioxygenase- (ARD-) type reactivity of a nickel(II) complex having monoanionic coordination of a model substrate: product identification and comparisons to unreactive analogues.","Inorganic chemistry","2007","46","14","5499","5507","10.1021/ic061177i","","","0.71073","MoKα","","0.0609","0.0373","","","0.0825","0.0921","","","","","","1.019","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339748","18.1012","0.0003","15.7016","0.0003","22.6629","0.0002","90","","90","","90","","6441.2","0.17","150","2","150","1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C35 H33 Cl N4 Ni O6 -","- C35 H33 Cl N4 Ni O6 -","- C280 H264 Cl8 N32 Ni8 O48 -","8","1","","Szajna-Fuller, Ewa; Rudzka, Katarzyna; Arif, Atta M.; Berreau, Lisa M.","Acireductone dioxygenase- (ARD-) type reactivity of a nickel(II) complex having monoanionic coordination of a model substrate: product identification and comparisons to unreactive analogues.","Inorganic chemistry","2007","46","14","5499","5507","10.1021/ic061177i","","","0.71073","MoKα","","0.0724","0.0476","","","0.1204","0.1384","","","","","","1.014","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339749","11.2375","0.0004","13.4086","0.0005","16.0769","0.0006","107.462","0.0018","102.107","0.002","103.424","0.003","2143.36","0.15","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C47 H39 Cl3 N4 Ni O7 -","- C47 H39 Cl3 N4 Ni O7 -","- C94 H78 Cl6 N8 Ni2 O14 -","2","1","","Szajna-Fuller, Ewa; Rudzka, Katarzyna; Arif, Atta M.; Berreau, Lisa M.","Acireductone dioxygenase- (ARD-) type reactivity of a nickel(II) complex having monoanionic coordination of a model substrate: product identification and comparisons to unreactive analogues.","Inorganic chemistry","2007","46","14","5499","5507","10.1021/ic061177i","","","0.71073","MoKα","","0.0911","0.0561","","","0.1258","0.1463","","","","","","1.043","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339750","5.655","0.003","4.8531","0.0017","9.116","0.003","90","","92.95","0.05","90","","249.85","0.18","153","2","20","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Chrom-difluoride-dioxide","Chrom-difluoride-dioxide","","- Cr F2 O2 -","- Cr F2 O2 -","- Cr4 F8 O8 -","4","1","","Supeł, Joanna; Abram, Ulrich; Hagenbach, Adelheid; Seppelt, Konrad","Technetium fluoride trioxide, TcO3F, preparation and properties.","Inorganic chemistry","2007","46","14","5591","5595","10.1021/ic070333y","","","0.71073","MoKα","","0.0282","0.023","","","0.0586","0.0604","","","","","","1.105","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339751","8.2721","0.001","14.1477","0.0011","24.749","0.003","90","","92.719","0.01","90","","2893.1","0.5","173","2","20","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- F11 K2 O27 Tc9 -","- F11 K2 O27 Tc9 -","- F44 K8 O108 Tc36 -","4","1","","Supeł, Joanna; Abram, Ulrich; Hagenbach, Adelheid; Seppelt, Konrad","Technetium fluoride trioxide, TcO3F, preparation and properties.","Inorganic chemistry","2007","46","14","5591","5595","10.1021/ic070333y","","","0.71073","MoKα","","0.0628","0.036","","","0.0677","0.077","","","","","","1.029","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339752","8.201","0.002","14.583","0.004","5.3049","0.0016","90","","90.13","0.011","90","","634.4","0.3","133","2","20","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","technetium-fluoride-trioxide*technetium-trifluoride-dioxide","technetium-fluoride-trioxide*technetium-trifluoride-dioxide","","- F4 O5 Tc2 -","- F4 O5 Tc2 -","- F16 O20 Tc8 -","4","1","","Supeł, Joanna; Abram, Ulrich; Hagenbach, Adelheid; Seppelt, Konrad","Technetium fluoride trioxide, TcO3F, preparation and properties.","Inorganic chemistry","2007","46","14","5591","5595","10.1021/ic070333y","","","0.71073","MoKα","","0.0502","0.0453","","","0.0941","0.0957","","","","","","1.202","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339753","5.569","0.006","5.007","0.004","9.341","0.007","90","","91.32","0.04","90","","260.4","0.4","183","2","20","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","vanadium-trifluoride-oxide","vanadium-trifluoride-oxide","","- F3 O V -","- F3 O V -","- F12 O4 V4 -","4","1","","Supeł, Joanna; Abram, Ulrich; Hagenbach, Adelheid; Seppelt, Konrad","Technetium fluoride trioxide, TcO3F, preparation and properties.","Inorganic chemistry","2007","46","14","5591","5595","10.1021/ic070333y","","","0.71073","MoKα","","0.0288","0.0255","","","0.0664","0.0677","","","","","","1.057","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339754","8.529","0.002","9.038","0.002","11.343","0.002","90","","108.145","0.011","90","","830.9","0.3","173","2","20","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","technetium-difluoride-dioxide-hexafluoroantimonate","technetium-difluoride-dioxide-hexafluoroantimonate","","- F10 H2 O2 Sb Tc -","- F10 H2 O2 Sb Tc -","- F40 H8 O8 Sb4 Tc4 -","4","1","","Supeł, Joanna; Abram, Ulrich; Hagenbach, Adelheid; Seppelt, Konrad","Technetium fluoride trioxide, TcO3F, preparation and properties.","Inorganic chemistry","2007","46","14","5591","5595","10.1021/ic070333y","","","0.71073","MoKα","","0.0143","0.0132","","","0.0294","0.0297","","","","","","1.138","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339755","5.126","0.003","8.103","0.007","19.691","0.013","90","","95.57","0.03","90","","814","1","173","2","20","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","technetium-difluoride-dioxide-hexafluoroarsenate","technetium-difluoride-dioxide-hexafluoroarsenate","","- As F10 H2 O2 Tc -","- As F10 H2 O2 Tc -","- As4 F40 H8 O8 Tc4 -","4","1","","Supeł, Joanna; Abram, Ulrich; Hagenbach, Adelheid; Seppelt, Konrad","Technetium fluoride trioxide, TcO3F, preparation and properties.","Inorganic chemistry","2007","46","14","5591","5595","10.1021/ic070333y","","","0.71073","MoKα","","0.0822","0.0381","","","0.0757","0.0945","","","","","","1.035","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339756","5.689","0.003","5.069","0.003","9.305","0.005","90","","93.212","0.013","90","","267.9","0.3","158","2","20","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","technetiumfluoridetrioxide","technetiumfluoridetrioxide","","- F O3 Tc -","- F O3 Tc -","- F4 O12 Tc4 -","4","1","","Supeł, Joanna; Abram, Ulrich; Hagenbach, Adelheid; Seppelt, Konrad","Technetium fluoride trioxide, TcO3F, preparation and properties.","Inorganic chemistry","2007","46","14","5591","5595","10.1021/ic070333y","","","0.71073","MoKα","","0.0747","0.0613","","","0.1514","0.1578","","","","","","1.084","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339757","15.4116","0.0011","18.245","0.0013","20.7028","0.0015","89.734","0.001","71.637","0.001","71.154","0.001","5198","0.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C102 H200 Mn22 N2 O98 P8 -","- C102 H200 Mn22 N2 O98 P8 -","- C102 H200 Mn22 N2 O98 P8 -","1","0.5","","Ma, Yun-Sheng; Song, You; Li, Yi-Zhi; Zheng, Li-Min","Tridecanuclear and docosanuclear manganese phosphonate clusters with slow magnetic relaxation.","Inorganic chemistry","2007","46","14","5459","5461","10.1021/ic070104b","","","0.71073","MoKα","","0.0869","0.0568","","","0.1157","0.1216","","","","","","1.07","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339758","15.685","0.003","18.024","0.003","18.425","0.003","64.79","0.003","89.451","0.004","65.596","0.003","4203.2","1.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C130 H194 Mn13 N14 O45 P10 -","- C130 H194 Mn13 N14 O45 P10 -","- C130 H194 Mn13 N14 O45 P10 -","1","0.5","","Ma, Yun-Sheng; Song, You; Li, Yi-Zhi; Zheng, Li-Min","Tridecanuclear and docosanuclear manganese phosphonate clusters with slow magnetic relaxation.","Inorganic chemistry","2007","46","14","5459","5461","10.1021/ic070104b","","","0.71073","MoKα","","0.0715","0.0535","","","0.1129","0.1179","","","","","","1.027","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339759","10.33","0.004","13.537","0.005","19.439","0.006","81.008","0.008","82.97","0.009","82.577","0.007","2647.9","1.6","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C114 H96 Cl4 N6 O4 P4 Ru2 S2 -","- C114 H92 Cl4 N6 O4 P4 Ru2 S2 -","- C114 H92 Cl4 N6 O4 P4 Ru2 S2 -","1","0.5","","Gao, Li-Bin; Kan, Jian; Fan, Yang; Zhang, Li-Yi; Liu, Sheng-Hua; Chen, Zhong-Ning","Wirelike dinuclear ruthenium complexes connected by bis(ethynyl)oligothiophene.","Inorganic chemistry","2007","46","14","5651","5664","10.1021/ic700412m","","","0.71073","MoKα","","0.0934","0.0671","","","0.2043","0.2376","","","","","","1.106","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339760","11.783","0.002","18.919","0.004","22.607","0.005","109.165","0.002","96.648","0.003","96.144","0.002","4671.5","1.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C110 H90 N6 O3 P4 Ru2 -","- C110 H90 N6 O3 P4 Ru2 -","- C220 H180 N12 O6 P8 Ru4 -","2","1","","Gao, Li-Bin; Kan, Jian; Fan, Yang; Zhang, Li-Yi; Liu, Sheng-Hua; Chen, Zhong-Ning","Wirelike dinuclear ruthenium complexes connected by bis(ethynyl)oligothiophene.","Inorganic chemistry","2007","46","14","5651","5664","10.1021/ic700412m","","","0.71073","MoKα","","0.0584","0.0419","","","0.0863","0.0961","","","","","","1.05","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339761","12.903","0.004","18.013","0.005","20.338","0.005","90","","96.855","0.005","90","","4693","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C57 H44 N3 O P2 Ru -","- C57 H44 N3 O P2 Ru -","- C228 H176 N12 O4 P8 Ru4 -","4","1","","Gao, Li-Bin; Kan, Jian; Fan, Yang; Zhang, Li-Yi; Liu, Sheng-Hua; Chen, Zhong-Ning","Wirelike dinuclear ruthenium complexes connected by bis(ethynyl)oligothiophene.","Inorganic chemistry","2007","46","14","5651","5664","10.1021/ic700412m","","","0.71073","MoKα","","0.0917","0.0613","","","0.1476","0.173","","","","","","1.113","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339762","10.2565","0.0009","13.2338","0.0012","38.325","0.003","90","","93.396","0.001","90","","5192.8","0.8","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Ru(II)EDBTPDPP Br","ethane-1,2-diylbis(thio-2,1-phenylene)diphenylphosine)ruthenium(II)bromide","","- C60.5 H49.75 Br Cl0.75 P3 Ru S3 -","- C60.5 H49.75 Br Cl0.75 P3 Ru S3 -","- C242 H199 Br4 Cl3 P12 Ru4 S12 -","4","1","","Grapperhaus, Craig A.; Venna, Kiran B.; Mashuta, Mark S.","Carbon-sulfur bond formation via alkene addition to an oxidized ruthenium thiolate.","Inorganic chemistry","2007","46","19","8044","8050","10.1021/ic701078e","","","0.71073","MoKα","","0.0646","0.0504","","","0.1164","0.1215","","","","","","1.097","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4339763","9.297","0.003","11.347","0.004","15.335","0.005","98.446","0.005","97.67","0.005","91.537","0.005","1584.1","0.9","198","1","198","1","","","","","","","","7","P -1","-P 1","2","","","","- C10 H16 F3 N2 O3 P S2 -","- C10 H16 F3 N2 O3 P S2 -","- C40 H64 F12 N8 O12 P4 S8 -","4","2","","Weigand, Jan J.; Burford, Neil; Mahnke, Devin; Decken, Andreas","Coordination complexes of the dimethyl-thio-phosphonium cation and ligand exchange.","Inorganic chemistry","2007","46","19","7689","7691","10.1021/ic7012792","","x-ray","0.71073","MoKα","","0.0724","0.0431","","","0.1096","0.1221","","","","","","1.008","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339764","8.0799","0.0017","13.225","0.003","19.27","0.004","90","","90","","90","","2059.1","0.8","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H21 Cl2 N O3 Ti -","- C20 H21 Cl2 N O3 Ti -","- C80 H84 Cl8 N4 O12 Ti4 -","4","1","","Lee, Junseong; Kim, Youngjo; Do, Youngkyu","Novel chlorotitanium complexes containing chiral tridentate schiff base ligands for ring-opening polymerization of lactide.","Inorganic chemistry","2007","46","19","7701","7703","10.1021/ic700493p","","","0.71073","MoKα","","0.0673","0.0457","","","0.1084","0.1192","","","","","","1.014","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339765","10.9666","0.0006","12.2922","0.0007","23.8353","0.0013","90","","90","","90","","3213.1","0.3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C28 H40 Cl3 N O3 Ti -","- C28 H40 Cl3 N O3 Ti -","- C112 H160 Cl12 N4 O12 Ti4 -","4","1","","Lee, Junseong; Kim, Youngjo; Do, Youngkyu","Novel chlorotitanium complexes containing chiral tridentate schiff base ligands for ring-opening polymerization of lactide.","Inorganic chemistry","2007","46","19","7701","7703","10.1021/ic700493p","","","0.71073","MoKα","","0.0954","0.0366","","","0.0468","0.0528","","","","","","1.003","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339766","15.483","0.005","15.483","0.005","19.378","0.008","90","","90","","120","","4023","2","293","2","173","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","Hafnium","Hafnium tris(amid) Trimethylsilyl silide","","- C15 H45 Hf N3 Si4 -","- C15 H45 Hf N3 Si4 -","- C90 H270 Hf6 N18 Si24 -","6","0.333333","","Cai, Hu; Yu, Xianghua; Chen, Shujian; Qiu, He; Guzei, Ilia A.; Xue, Zi-Ling","Amide-silyl ligand exchanges and equilibria among group 4 amide and silyl complexes.","Inorganic chemistry","2007","46","19","8071","8078","10.1021/ic7010293","","","0.71073","MoKα","","0.0567","0.049","","","0.135","0.1655","","","","","","1.178","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339767","25.145","0.003","17.77","0.003","16.346","0.003","90","","97.789","0.003","90","","7236","2","100","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Zirconium","Zirconium Disilyl triamdie and Zirconium pentaamide dilithium tetra THF","","- C64 H118 Li2 N8 O4 Si2 Zr2 -","- C64 H118 Li2 N8 O4 Si2 Zr2 -","- C256 H472 Li8 N32 O16 Si8 Zr8 -","4","0.5","","Cai, Hu; Yu, Xianghua; Chen, Shujian; Qiu, He; Guzei, Ilia A.; Xue, Zi-Ling","Amide-silyl ligand exchanges and equilibria among group 4 amide and silyl complexes.","Inorganic chemistry","2007","46","19","8071","8078","10.1021/ic7010293","","","0.71073","MoKα","","0.0567","0.0396","","","0.103","0.1169","","","","","","1.041","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339768","20.429","0.013","8.454","0.005","15.971","0.01","90","","112.425","0.01","90","","2550","3","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Hafnium","Hafnium tetra(dimethylamide)","","- C16 H48 Hf2 N8 -","- C16 H48 Hf2 N8 -","- C64 H192 Hf8 N32 -","4","0.5","","Cai, Hu; Yu, Xianghua; Chen, Shujian; Qiu, He; Guzei, Ilia A.; Xue, Zi-Ling","Amide-silyl ligand exchanges and equilibria among group 4 amide and silyl complexes.","Inorganic chemistry","2007","46","19","8071","8078","10.1021/ic7010293","","","0.71073","MoKα","","0.0369","0.0358","","","0.0967","0.1","","","","","","1.014","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339769","14.408","0.003","15.04","0.003","15.586","0.003","90","","105.15","0.03","90","","3260","1.2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C26 H42 N9 O11 Pr -","- C26 H42 N9 O11 Pr -","- C104 H168 N36 O44 Pr4 -","4","2","","Gregoliński, Janusz; Slepokura, Katarzyna; Lisowski, Jerzy","Lanthanide complexes of the chiral hexaaza macrocycle and its meso-type isomer: solvent-controlled helicity inversion.","Inorganic chemistry","2007","46","19","7923","7934","10.1021/ic700831z","","","0.71073","MoKα","","0.0347","0.0287","","","0.0458","0.0468","","","","","","1.01","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339770","14.292","0.003","15.103","0.003","15.524","0.003","90","","105.52","0.03","90","","3228.7","1.2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C26 H42 Eu N9 O11 -","- C26 H42 Eu N9 O11 -","- C104 H168 Eu4 N36 O44 -","4","2","","Gregoliński, Janusz; Slepokura, Katarzyna; Lisowski, Jerzy","Lanthanide complexes of the chiral hexaaza macrocycle and its meso-type isomer: solvent-controlled helicity inversion.","Inorganic chemistry","2007","46","19","7923","7934","10.1021/ic700831z","","","0.71073","MoKα","","0.0237","0.0215","","","0.0484","0.049","","","","","","1.039","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339771","11.98","0.003","16.215","0.004","21.707","0.004","90","","105.49","0.03","90","","4063.5","1.7","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C62 H91 Dy3 N26 O27 -","- C62 H91 Dy3 N26 O27 -","- C124 H182 Dy6 N52 O54 -","2","1","","Gregoliński, Janusz; Slepokura, Katarzyna; Lisowski, Jerzy","Lanthanide complexes of the chiral hexaaza macrocycle and its meso-type isomer: solvent-controlled helicity inversion.","Inorganic chemistry","2007","46","19","7923","7934","10.1021/ic700831z","","","0.71073","MoKα","","0.0429","0.0342","","","0.0615","0.0633","","","","","","1.002","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339772","11.924","0.003","16.27","0.004","21.642","0.004","90","","105.47","0.03","90","","4046.5","1.7","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C62 H91 N26 O27 Yb3 -","- C62 H91 N26 O27 Yb3 -","- C124 H182 N52 O54 Yb6 -","2","1","","Gregoliński, Janusz; Slepokura, Katarzyna; Lisowski, Jerzy","Lanthanide complexes of the chiral hexaaza macrocycle and its meso-type isomer: solvent-controlled helicity inversion.","Inorganic chemistry","2007","46","19","7923","7934","10.1021/ic700831z","","","0.71073","MoKα","","0.0363","0.0328","","","0.0743","0.0754","","","","","","1.012","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339773","10.701","0.003","12.479","0.003","24.07","0.005","90","","90","","90","","3214.3","1.4","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H44 N9 O12 Yb -","- C26 H44 N9 O12 Yb -","- C104 H176 N36 O48 Yb4 -","4","1","","Gregoliński, Janusz; Slepokura, Katarzyna; Lisowski, Jerzy","Lanthanide complexes of the chiral hexaaza macrocycle and its meso-type isomer: solvent-controlled helicity inversion.","Inorganic chemistry","2007","46","19","7923","7934","10.1021/ic700831z","","","0.71073","MoKα","","0.0204","0.0183","","","0.0377","0.038","","","","","","1.01","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339774","11.139","0.003","12.052","0.003","13.872","0.003","87.57","0.03","67.35","0.03","64.37","0.03","1532.2","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H41.04 Eu N9 O10.52 -","- C26 H38 Eu N9 O10.526 -","- C52 H76 Eu2 N18 O21.052 -","2","1","","Gregoliński, Janusz; Slepokura, Katarzyna; Lisowski, Jerzy","Lanthanide complexes of the chiral hexaaza macrocycle and its meso-type isomer: solvent-controlled helicity inversion.","Inorganic chemistry","2007","46","19","7923","7934","10.1021/ic700831z","","","0.71073","MoKα","","0.0432","0.0283","","","0.0412","0.0428","","","","","","1.011","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339775","13.312","0.0008","17.7477","0.001","10.8177","0.0006","90","","106.38","0.003","90","","2452","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ge(Pc)(t-py)2","","","- C50 H42 Ge N10 -","- C50 H42 Ge N10 -","- C100 H84 Ge2 N20 -","2","0.5","","Cissell, Julie A.; Vaid, Thomas P.; Dipasquale, Antonio G.; Rheingold, Arnold L.","Germanium phthalocyanine, GePc, and the reduced complexes SiPc(pyridine)(2) and GePc(pyridine)(2) containing antiaromatic pi-electron circuits.","Inorganic chemistry","2007","46","19","7713","7715","10.1021/ic701248u","","","1.54178","CuKα","","0.0456","0.0406","","","0.118","0.1303","","","","","","1.094","","","","has coordinates","204147","2020-10-21","18:00:00",""
"4339776","22.909","0.0004","28.644","0.0005","21.764","0.0006","90","","105.005","0.001","90","","13794.7","0.5","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C138 H210 Ba3 N6 O8 -","- C138 H210 Ba3 N6 O8 -","- C552 H840 Ba12 N24 O32 -","4","0.5","","Davidson, Matthew G.; O'Hara, Charles T; Jones, Matthew D.; Keir, Callum G.; Mahon, Mary F.; Kociok-Köhn, Gabriele","Synthesis and structure of a molecular barium Aminebis(phenolate) and its application as an initiator for ring-opening polymerization of cyclic esters.","Inorganic chemistry","2007","46","19","7686","7688","10.1021/ic700583e","","","0.71073","MoKα","","0.0565","0.0385","","","0.088","0.1018","","","","","","1.141","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339777","4.872","0.0014","14.347","0.004","11.655","0.003","90","","114.709","0.009","90","","740.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H4 Cu N4 O2 -","- C6 H4 Cu N4 O2 -","- C24 H16 Cu4 N16 O8 -","4","1","","Liu, Fu-Chen; Zeng, Yong-Fei; Zhao, Jiong-Peng; Hu, Bo-Wen; Sañudo, E Carolina; Ribas, Joan; Bu, Xian-He","Two new copper azido polymorphs: structures, magnetic properties, and effects of ""noninnocent"" reagents in hydrothermal methods.","Inorganic chemistry","2007","46","19","7698","7700","10.1021/ic700669c","","","0.71073","MoKα","","0.0261","0.0232","","","0.0594","0.0612","","","","","","1.046","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339778","6.4068","0.0015","9.701","0.002","12.398","0.003","90","","90","","90","","770.6","0.3","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H4 Cu N4 O2 -","- C6 H4 Cu N4 O2 -","- C24 H16 Cu4 N16 O8 -","4","1","","Liu, Fu-Chen; Zeng, Yong-Fei; Zhao, Jiong-Peng; Hu, Bo-Wen; Sañudo, E Carolina; Ribas, Joan; Bu, Xian-He","Two new copper azido polymorphs: structures, magnetic properties, and effects of ""noninnocent"" reagents in hydrothermal methods.","Inorganic chemistry","2007","46","19","7698","7700","10.1021/ic700669c","","","0.71073","MoKα","","0.024","0.0194","","","0.0447","0.0462","","","","","","1.021","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339779","20.908","0.004","27.102","0.004","32.492","0.005","90","","98.239","0.004","90","","18222","5","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C162 H102 Cl6 Mn9 N42 O36 -","- C162 H102 Cl6 Mn9 N42 O36 -","- C648 H408 Cl24 Mn36 N168 O144 -","4","1","","Dey, Subrata K.; Abedin, Tareque S. M.; Dawe, Louise N.; Tandon, Santokh S.; Collins, Julie L.; Thompson, Laurence K.; Postnikov, Andrei V.; Alam, Mohammad S.; Müller, Paul","Supramolecular self-assembled polynuclear complexes from tritopic, tetratopic, and pentatopic ligands: structural, magnetic and surface studies.","Inorganic chemistry","2007","46","19","7767","7781","10.1021/ic070336a","","","0.7107","MoKα","","0.1268","0.0936","","","0.234","0.2597","","","","","","1.044","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339780","13.27","0.02","21.36","0.03","33.87","0.05","90","","90","","90","","9600","2","153","2","153","2","","","","","","","","5","I 2 2 2","I 2 2","23","","","","- C144 H134 Mn16 N72 O63 -","- C144 H96 Mn16 N72 O63 -","- C288 H192 Mn32 N144 O126 -","2","0.25","","Dey, Subrata K.; Abedin, Tareque S. M.; Dawe, Louise N.; Tandon, Santokh S.; Collins, Julie L.; Thompson, Laurence K.; Postnikov, Andrei V.; Alam, Mohammad S.; Müller, Paul","Supramolecular self-assembled polynuclear complexes from tritopic, tetratopic, and pentatopic ligands: structural, magnetic and surface studies.","Inorganic chemistry","2007","46","19","7767","7781","10.1021/ic070336a","","","0.7107","MoKα","","0.13","0.1229","","","0.3582","0.3786","","","","","","1.633","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339781","25.238","0.003","13.5859","0.0016","14.2674","0.0017","90","","93.864","0.003","90","","4880.9","1","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H20 Cu2 N10 O12 -","- C17 H16 Cu2 N10 O12 -","- C136 H128 Cu16 N80 O96 -","8","1","","Dey, Subrata K.; Abedin, Tareque S. M.; Dawe, Louise N.; Tandon, Santokh S.; Collins, Julie L.; Thompson, Laurence K.; Postnikov, Andrei V.; Alam, Mohammad S.; Müller, Paul","Supramolecular self-assembled polynuclear complexes from tritopic, tetratopic, and pentatopic ligands: structural, magnetic and surface studies.","Inorganic chemistry","2007","46","19","7767","7781","10.1021/ic070336a","","","0.7107","MoKα","","0.0559","0.0524","","","0.1393","0.1429","","","","","","1.114","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339782","8.1242","0.0005","20.8794","0.0014","8.3519","0.0006","90","","103.673","0.001","90","","1376.57","0.16","153","2","153","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C17 H22.6 Cl2 Cu2 N8 O15.8 -","- C17 H13 Cl2 Cu2 N8 O15.8 -","- C34 H26 Cl4 Cu4 N16 O31.6 -","2","1","","Dey, Subrata K.; Abedin, Tareque S. M.; Dawe, Louise N.; Tandon, Santokh S.; Collins, Julie L.; Thompson, Laurence K.; Postnikov, Andrei V.; Alam, Mohammad S.; Müller, Paul","Supramolecular self-assembled polynuclear complexes from tritopic, tetratopic, and pentatopic ligands: structural, magnetic and surface studies.","Inorganic chemistry","2007","46","19","7767","7781","10.1021/ic070336a","","","0.7107","MoKα","","0.0367","0.0363","","","0.0961","0.0966","","","","","","1.076","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339783","12.18","0.006","14.45","0.006","16.12","0.007","68.36","0.05","77.37","0.04","75.81","0.05","2531","2","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H16.6 Cl2 Cu2 N12 O12.8 -","- C15 H13 Cl2 Cu2 N12 O12.8 -","- C60 H52 Cl8 Cu8 N48 O51.2 -","4","2","","Dey, Subrata K.; Abedin, Tareque S. M.; Dawe, Louise N.; Tandon, Santokh S.; Collins, Julie L.; Thompson, Laurence K.; Postnikov, Andrei V.; Alam, Mohammad S.; Müller, Paul","Supramolecular self-assembled polynuclear complexes from tritopic, tetratopic, and pentatopic ligands: structural, magnetic and surface studies.","Inorganic chemistry","2007","46","19","7767","7781","10.1021/ic070336a","","","0.7107","MoKα","","0.1388","0.1204","","","0.3005","0.3189","","","","","","1.144","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339784","14.508","0.002","19.241","0.003","36.547","0.005","90","","90.801","0.009","90","","10201","3","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C66 H73 Cl8 Mn4 N42 O32.5 -","- C66 H72 Cl8 Mn4 N42 O32.5 -","- C264 H288 Cl32 Mn16 N168 O130 -","4","0.5","","Dey, Subrata K.; Abedin, Tareque S. M.; Dawe, Louise N.; Tandon, Santokh S.; Collins, Julie L.; Thompson, Laurence K.; Postnikov, Andrei V.; Alam, Mohammad S.; Müller, Paul","Supramolecular self-assembled polynuclear complexes from tritopic, tetratopic, and pentatopic ligands: structural, magnetic and surface studies.","Inorganic chemistry","2007","46","19","7767","7781","10.1021/ic070336a","","","0.71069","MoKα","","0.112","0.0918","","","0.2286","0.239","","","","","","1.169","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339785","15.139","0.01","10.791","0.007","21.138","0.013","90","","97.04","0.02","90","","3427","4","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C35 H27 Mn N13 O4 -","- C35 H27 Mn N13 O4 -","- C140 H108 Mn4 N52 O16 -","4","1","","Dey, Subrata K.; Abedin, Tareque S. M.; Dawe, Louise N.; Tandon, Santokh S.; Collins, Julie L.; Thompson, Laurence K.; Postnikov, Andrei V.; Alam, Mohammad S.; Müller, Paul","Supramolecular self-assembled polynuclear complexes from tritopic, tetratopic, and pentatopic ligands: structural, magnetic and surface studies.","Inorganic chemistry","2007","46","19","7767","7781","10.1021/ic070336a","","","0.7107","MoKα","","0.0958","0.0883","","","0.2083","0.2174","","","","","","1.132","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339786","7.0375","0.0009","27.752","0.004","9.9941","0.0014","90","","97.328","0.004","90","","1936","0.5","153","2","153","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 N12 -","- C18 H18 N12 -","- C72 H72 N48 -","4","1","","Dey, Subrata K.; Abedin, Tareque S. M.; Dawe, Louise N.; Tandon, Santokh S.; Collins, Julie L.; Thompson, Laurence K.; Postnikov, Andrei V.; Alam, Mohammad S.; Müller, Paul","Supramolecular self-assembled polynuclear complexes from tritopic, tetratopic, and pentatopic ligands: structural, magnetic and surface studies.","Inorganic chemistry","2007","46","19","7767","7781","10.1021/ic070336a","","","0.7107","MoKα","","0.0484","0.0453","","","0.1177","0.121","","","","","","1.08","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339787","20.236","0.003","17.716","0.002","9.7692","0.0012","90","","100.34","0.003","90","","3445.4","0.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H56 Fe N2 -","- C34 H56 Fe N2 -","- C136 H224 Fe4 N8 -","4","0.5","","Au-Yeung, Ho Yu; Lam, Chung Hei; Lam, Chi-Keung; Wong, Wai-Yeung; Lee, Hung Kay","Unusual iron(II) and cobalt(II) complexes derived from monodentate arylamido ligands.","Inorganic chemistry","2007","46","19","7695","7697","10.1021/ic700850e","","","0.71073","MoKα","","0.1634","0.0528","","","0.1115","0.1578","","","","","","0.988","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339788","8.036","0.014","10.269","0.016","14.97","0.02","75.74","0.03","76.18","0.03","70.79","0.03","1114","3","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H37 Fe N3 Si -","- C18 H37 Fe N3 Si -","- C36 H74 Fe2 N6 Si2 -","2","1","","Au-Yeung, Ho Yu; Lam, Chung Hei; Lam, Chi-Keung; Wong, Wai-Yeung; Lee, Hung Kay","Unusual iron(II) and cobalt(II) complexes derived from monodentate arylamido ligands.","Inorganic chemistry","2007","46","19","7695","7697","10.1021/ic700850e","","","0.71073","MoKα","","0.1289","0.0615","","","0.1514","0.1893","","","","","","0.985","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339789","8.0103","0.0005","10.2402","0.0006","15.1224","0.0009","76.129","0.001","76.165","0.001","70.283","0.001","1116.54","0.12","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H37 Co N3 Si -","- C18 H37 Co N3 Si -","- C36 H74 Co2 N6 Si2 -","2","1","","Au-Yeung, Ho Yu; Lam, Chung Hei; Lam, Chi-Keung; Wong, Wai-Yeung; Lee, Hung Kay","Unusual iron(II) and cobalt(II) complexes derived from monodentate arylamido ligands.","Inorganic chemistry","2007","46","19","7695","7697","10.1021/ic700850e","","","0.71073","MoKα","","0.038","0.0331","","","0.0945","0.0989","","","","","","1.048","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339790","7.8338","0.0004","20.8616","0.0011","13.6471","0.0007","90","","99.096","0.001","90","","2202.2","0.2","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H34 Cl Fe N3 Si -","- C17 H34 Cl Fe N3 Si -","- C68 H136 Cl4 Fe4 N12 Si4 -","4","1","","Au-Yeung, Ho Yu; Lam, Chung Hei; Lam, Chi-Keung; Wong, Wai-Yeung; Lee, Hung Kay","Unusual iron(II) and cobalt(II) complexes derived from monodentate arylamido ligands.","Inorganic chemistry","2007","46","19","7695","7697","10.1021/ic700850e","","","0.71073","MoKα","","0.0435","0.037","","","0.1023","0.1077","","","","","","1.04","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339791","7.8132","0.0004","20.7928","0.001","13.5337","0.0006","90","","99.453","0.001","90","","2168.81","0.18","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H34 Cl Co N3 Si -","- C17 H34 Cl Co N3 Si -","- C68 H136 Cl4 Co4 N12 Si4 -","4","1","","Au-Yeung, Ho Yu; Lam, Chung Hei; Lam, Chi-Keung; Wong, Wai-Yeung; Lee, Hung Kay","Unusual iron(II) and cobalt(II) complexes derived from monodentate arylamido ligands.","Inorganic chemistry","2007","46","19","7695","7697","10.1021/ic700850e","","","0.71073","MoKα","","0.0644","0.0447","","","0.1181","0.1302","","","","","","1.038","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339792","17.616","0.003","22.889","0.003","9.5032","0.0013","90","","90","","90","","3831.8","1","193","2","193","2","","","","","","","","5","C m c 21","C 2c -2","36","","","","- C36 H48 Al N O3 -","- C36 Al N O3 -","- C144 Al4 N4 O12 -","4","0.5","","Su, Weiping; Kobayashi, Junji; Ellern, Arkady; Kawashima, Takayuki; Verkade, John G.","Steric stabilization of a monomeric proalumatrane: experimental and theoretical studies.","Inorganic chemistry","2007","46","19","7953","7959","10.1021/ic7010327","","","0.71073","MoKα","","0.0847","0.073","","","0.1937","0.2015","","","","","","1.236","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339793","25.55","0.01","12.363","0.004","26.166","0.008","90","","106.023","0.01","90","","7944","5","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C86 H112 Al2 N2 O6 -","- C86 H112 Al2 N2 O6 -","- C344 H448 Al8 N8 O24 -","4","0.5","","Su, Weiping; Kobayashi, Junji; Ellern, Arkady; Kawashima, Takayuki; Verkade, John G.","Steric stabilization of a monomeric proalumatrane: experimental and theoretical studies.","Inorganic chemistry","2007","46","19","7953","7959","10.1021/ic7010327","","","0.71073","MoKα","","0.1926","0.0797","","","0.1811","0.2439","","","","","","0.975","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339794","13.702","0.004","11.208","0.003","23.007","0.007","90","","90.944","0.005","90","","3532.8","1.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H52 Al N O5 -","- C36 H52 Al N O5 -","- C144 H208 Al4 N4 O20 -","4","1","","Su, Weiping; Kobayashi, Junji; Ellern, Arkady; Kawashima, Takayuki; Verkade, John G.","Steric stabilization of a monomeric proalumatrane: experimental and theoretical studies.","Inorganic chemistry","2007","46","19","7953","7959","10.1021/ic7010327","","","0.71073","MoKα","","0.0718","0.0456","","","0.1136","0.1263","","","","","","1.063","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339795","26.105","0.005","12.446","0.003","24.267","0.005","90","","90","","90","","7884","3","173","2","173","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C86 H112 Al2 N2 O6 -","- C86 H112 Al2 N2 O6 -","- C344 H448 Al8 N8 O24 -","4","0.5","","Su, Weiping; Kobayashi, Junji; Ellern, Arkady; Kawashima, Takayuki; Verkade, John G.","Steric stabilization of a monomeric proalumatrane: experimental and theoretical studies.","Inorganic chemistry","2007","46","19","7953","7959","10.1021/ic7010327","","","0.71073","MoKα","","0.1247","0.0924","","","0.2529","0.2753","","","","","","1.041","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339796","14.137","0.0015","14.5845","0.0015","14.9187","0.0015","114.214","0.002","118.089","0.002","90.083","0.002","2401.5","0.4","90","2","90","2","","","","","","","","6","P -1","-P 1","2","[(C6H11NC)12Rh3](AsF6)3","","","- C84 H132 As3 F18 N12 Rh3 -","- C84 H132 As3 F18 N12 Rh3 -","- C84 H132 As3 F18 N12 Rh3 -","1","0.5","","Tran, Ngon T.; Stork, Jay R.; Pham, David; Chancellor, Christopher J.; Olmstead, Marilyn M.; Fettinger, James C.; Balch, Alan L.","Adventures in crystallization. Crystalline salts containing one, two, or even three chemically distinct cations obtained from solutions of [(cyclohexyl isocyanide)(4)Rh(I)]+.","Inorganic chemistry","2007","46","19","7998","8007","10.1021/ic7008013","","","0.71073","MoKα","","0.0471","0.0418","","","0.1076","0.1108","","","","","","1.051","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339797","12.1642","0.0007","13.3121","0.0007","20.432","0.0011","87.576","0.003","82.919","0.003","74.413","0.003","3162.4","0.3","90","2","90","2","","","","","","","","7","P -1","-P 1","2","[(C6H11NC)8Rh2](BF4)2","","","- C56 H88 B2 Cl2 F8 N8 Rh2 -","- C56 H88 B2 Cl2 F8 N8 Rh2 -","- C112 H176 B4 Cl4 F16 N16 Rh4 -","2","1","","Tran, Ngon T.; Stork, Jay R.; Pham, David; Chancellor, Christopher J.; Olmstead, Marilyn M.; Fettinger, James C.; Balch, Alan L.","Adventures in crystallization. Crystalline salts containing one, two, or even three chemically distinct cations obtained from solutions of [(cyclohexyl isocyanide)(4)Rh(I)]+.","Inorganic chemistry","2007","46","19","7998","8007","10.1021/ic7008013","","","0.71073","MoKα","","0.0568","0.0422","","","0.1006","0.106","","","","","","1.066","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339798","21.101","0.004","20.105","0.003","23.857","0.004","90","","91.086","0.004","90","","10119","3","90","2","90","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[(C6H11NC)12Rh3Cl2][(C6H11NC)8Rh2]][(C6H11NC)4Rh](Cl6).16H2O.3benzene","","","- C186 H314 Cl6 N24 O16 Rh6 -","- C186 H282 Cl6 N24 O16 Rh6 -","- C372 H564 Cl12 N48 O32 Rh12 -","2","0.5","","Tran, Ngon T.; Stork, Jay R.; Pham, David; Chancellor, Christopher J.; Olmstead, Marilyn M.; Fettinger, James C.; Balch, Alan L.","Adventures in crystallization. Crystalline salts containing one, two, or even three chemically distinct cations obtained from solutions of [(cyclohexyl isocyanide)(4)Rh(I)]+.","Inorganic chemistry","2007","46","19","7998","8007","10.1021/ic7008013","","","0.71073","MoKα","","0.207","0.1227","","","0.2888","0.3487","","","","","","1.033","","","","has coordinates,has disorder","179500","2020-10-21","18:00:00",""
"4339799","13.306","0.003","24.747","0.005","28.07","0.006","77.17","0.03","77.22","0.03","79.81","0.03","8709","4","293","2","293","2","","","","","","","","10","P -1","-P 1","2","","","","- C162 H144 Cl2 Mg N10 O2 P4 Rh2 S2 Zn -","- C121.667 H92.3333 Cl1.33333 Mg0.666667 N6.66667 O2.60667 P2.66667 Rh1.33333 S1.33333 Zn0.666667 -","- C365 H277 Cl4 Mg2 N20 O7.82 P8 Rh4 S4 Zn2 -","3","1.5","","Oliveri, Christopher G.; Heo, Jungseok; Nguyen, Sonbinh T.; Mirkin, Chad A.; Wawrzak, Zdzislaw","A convergent coordination chemistry-based approach to dissymmetric macrocyclic cofacial porphyrin complexes.","Inorganic chemistry","2007","46","19","7716","7718","10.1021/ic701424j","","","0.71073","MoKα","","0.2236","0.209","","","0.5085","0.5155","","","","","","2.21","","","","has coordinates","179500","2020-10-21","18:00:00",""
"4339800","9.4517","0.0008","9.7078","0.0009","11.9872","0.001","87.416","0.001","70.487","0.001","83.518","0.001","1030.06","0.16","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","hexa-(3,5-difluorobenzoato-O,O')-hexacopper(I,I,I,I,I,I)","","- C42 H18 Cu6 F12 O12 -","- C42 H18 Cu6 F12 O12 -","- C42 H18 Cu6 F12 O12 -","1","0.5","","Sevryugina, Yulia; Rogachev, Andrey Yu; Petrukhina, Marina A.","The first hexanuclear copper(I) carboxylate: X-ray crystal structure and reactivity in solution and gas-phase reactions.","Inorganic chemistry","2007","46","19","7870","7879","10.1021/ic7005327","","","0.71073","MoKα","","0.0701","0.0465","","","0.1008","0.1091","","","","","","1.027","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339801","9.5577","0.0005","11.9244","0.0006","12.9601","0.0007","81.512","0.001","76.664","0.001","78.814","0.001","1401.72","0.13","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","hexa-(3,5-difluorobenzoato-O,O')-hexacopper(I,I,I,I,I,I), coronene","","- C66 H30 Cu6 F12 O12 -","- C66 H30 Cu6 F12 O12 -","- C66 H30 Cu6 F12 O12 -","1","0.5","","Sevryugina, Yulia; Rogachev, Andrey Yu; Petrukhina, Marina A.","The first hexanuclear copper(I) carboxylate: X-ray crystal structure and reactivity in solution and gas-phase reactions.","Inorganic chemistry","2007","46","19","7870","7879","10.1021/ic7005327","","","0.71073","MoKα","","0.0432","0.0332","","","0.0803","0.0852","","","","","","1.033","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339802","13.606","0.0009","18.9596","0.0013","15.3574","0.0011","90","","99.957","0.001","90","","3902","0.5","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis-(3,5-difluorobenzoato-O,O')- bis-(diphenylacetylene)-dicopper(I,I), benzene solvate","","- C48 H32 Cu2 F4 O4 -","- C48 H31 Cu2 F4 O4 -","- C192 H124 Cu8 F16 O16 -","4","1","","Sevryugina, Yulia; Rogachev, Andrey Yu; Petrukhina, Marina A.","The first hexanuclear copper(I) carboxylate: X-ray crystal structure and reactivity in solution and gas-phase reactions.","Inorganic chemistry","2007","46","19","7870","7879","10.1021/ic7005327","","","0.71073","MoKα","","0.1066","0.0533","","","0.1196","0.1395","","","","","","1.015","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339803","13.4866","0.001","16.5619","0.0012","18.4314","0.0014","90","","98.799","0.001","90","","4068.5","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis-(3,5-difluorobenzoato-O,O')-bis-(diphenylacetylene)- dicopper(I,I), toluene solvate","","- C49 H34 Cu2 F4 O4 -","- C49 H34 Cu2 F4 O4 -","- C196 H136 Cu8 F16 O16 -","4","1","","Sevryugina, Yulia; Rogachev, Andrey Yu; Petrukhina, Marina A.","The first hexanuclear copper(I) carboxylate: X-ray crystal structure and reactivity in solution and gas-phase reactions.","Inorganic chemistry","2007","46","19","7870","7879","10.1021/ic7005327","","","0.71073","MoKα","","0.1059","0.058","","","0.1216","0.1425","","","","","","1.013","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339804","7.1445","0.0004","24.6212","0.0012","17.5605","0.0009","90","","95.031","0.001","90","","3077.1","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis-[bis-(3,5-difluorobenzoato-O,O')- 1,4-bis(p-tolylethynyl)benzene-dicopper(I,I)]","","- C76 H48 Cu4 F8 O8 -","- C76 H48 Cu4 F8 O8 -","- C152 H96 Cu8 F16 O16 -","2","0.5","","Sevryugina, Yulia; Rogachev, Andrey Yu; Petrukhina, Marina A.","The first hexanuclear copper(I) carboxylate: X-ray crystal structure and reactivity in solution and gas-phase reactions.","Inorganic chemistry","2007","46","19","7870","7879","10.1021/ic7005327","","","0.71073","MoKα","","0.0817","0.0539","","","0.1109","0.1217","","","","","","1.047","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339805","12.3088","0.0012","25.188","0.002","16.3565","0.0016","90","","109.486","0.002","90","","4780.6","0.8","163","2","163","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H59 I6 N U3 -","- C36 H59 I6 N U3 -","- C144 H236 I24 N4 U12 -","4","1","","Evans, William J.; Miller, Kevin A.; Ziller, Joseph W.; Greaves, John","Analysis of uranium azide and nitride complexes by atmospheric pressure chemical ionization mass spectrometry.","Inorganic chemistry","2007","46","19","8008","8018","10.1021/ic7006099","","","0.71073","MoKα","","0.0281","0.0215","","","0.0437","0.0456","","","","","","1.127","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339806","30.409","0.003","15.5193","0.0015","15.8201","0.0015","90","","90","","90","","7465.9","1.3","168","2","168","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C71 H106 N18 O U3 -","- C71 H90 N18 O U3 -","- C284 H360 N72 O4 U12 -","4","0.5","","Evans, William J.; Miller, Kevin A.; Ziller, Joseph W.; Greaves, John","Analysis of uranium azide and nitride complexes by atmospheric pressure chemical ionization mass spectrometry.","Inorganic chemistry","2007","46","19","8008","8018","10.1021/ic7006099","","","0.71073","MoKα","","0.0718","0.0418","","","0.0879","0.1053","","","","","","1.063","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339807","15.0843","0.0006","12.5588","0.0005","31.2717","0.0012","90","","90","","90","","5924.1","0.4","130","2","130","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C22 H52 N2 O P2 Ru Si2 -","- C22 H52 N2 O P2 Ru Si2 -","- C176 H416 N16 O8 P16 Ru8 Si16 -","8","1","","Walstrom, Amy; Pink, Maren; Fan, Hongjun; Tomaszewski, John; Caulton, Kenneth G.","Radical (NO) and nonradical (N(2)O) reagents convert a ruthenium(IV) nitride to the same nitrosyl complex.","Inorganic chemistry","2007","46","19","7704","7706","10.1021/ic700789y","","","0.71073","MoKα","","0.0327","0.0234","","","0.0536","0.0638","","","","","","1.123","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4339808","10.1828","0.0002","17.5508","0.0004","18.1227","0.0005","113.443","0.001","99.491","0.002","99.598","0.001","2832.55","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C57 H62 Cl6 Hg2 N4 S4 -","- C57 H62 Cl6 Hg2 N4 S4 -","- C114 H124 Cl12 Hg4 N8 S8 -","2","1","","Tamayo, Abel; Pedras, Bruno; Lodeiro, Carlos; Escriche, Lluis; Casabó, Jaume; Capelo, José Luis; Covelo, Berta; Kivekäs, Raikko; Sillanpää, Reijo","Exploring the interaction of mercury(II) by N(2)S(2) and NS(3) anthracene-containing macrocyclic ligands: photophysical, analytical, and structural studies.","Inorganic chemistry","2007","46","19","7818","7826","10.1021/ic700489e","","x-ray","0.71073","MoKα","","0.062","0.0355","","","0.0635","0.0702","","","","","","1.013","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339809","34.148","0.006","12.362","0.002","25.611","0.004","90","","115.373","0.005","90","","9768","3","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C85.21 H91.28 Cl2.42 Cu2 F6 N8 O10.86 S4 -","- C85.21 H91.284 Cl2.42 Cu2 F6 N8 O10.864 S4 -","- C340.84 H365.136 Cl9.68 Cu8 F24 N32 O43.456 S16 -","4","0.5","","Zhou, Lei; Powell, Douglas; Nicholas, Kenneth M.","Tripodal bis(imidazole) thioether copper(I) complexes: mimics of the Cu(M) site of copper hydroxylase enzymes.","Inorganic chemistry","2007","46","19","7789","7799","10.1021/ic700447k","","","0.71073","MoKα","","0.1268","0.099","","","0.2842","0.3039","","","","","","1.106","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339810","9.702","0.0012","15.521","0.002","15.775","0.002","83.976","0.005","79.171","0.005","81.07","0.005","2297.9","0.5","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C90 H108 Cu2 F12 N12 O9 P2 S2 -","- C90 H108 Cu2 F12 N12 O9 P2 S2 -","- C90 H108 Cu2 F12 N12 O9 P2 S2 -","1","0.5","","Zhou, Lei; Powell, Douglas; Nicholas, Kenneth M.","Tripodal bis(imidazole) thioether copper(I) complexes: mimics of the Cu(M) site of copper hydroxylase enzymes.","Inorganic chemistry","2007","46","19","7789","7799","10.1021/ic700447k","","","0.71073","MoKα","","0.0591","0.0457","","","0.121","0.1298","","","","","","1","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339811","14.518","0.002","18.331","0.003","17.942","0.003","90","","113.451","0.005","90","","4380.5","1.2","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C80 H80 Cl4 Cu2 F6 N8 O10 S4 -","- C78 H76 Cu2 F6 N8 O10 S4 -","- C156 H152 Cu4 F12 N16 O20 S8 -","2","0.5","","Zhou, Lei; Powell, Douglas; Nicholas, Kenneth M.","Tripodal bis(imidazole) thioether copper(I) complexes: mimics of the Cu(M) site of copper hydroxylase enzymes.","Inorganic chemistry","2007","46","19","7789","7799","10.1021/ic700447k","","","0.71073","MoKα","","0.0952","0.083","","","0.252","0.2647","","","","","","1.039","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339812","12.448","0.002","28","0.005","16.848","0.003","90","","100.739","0.005","90","","5769.4","1.7","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C48 H62 Cu F12 N6 O4 P2 S -","- C44 H52 Cu F12 N6 O3 P2 S -","- C176 H208 Cu4 F48 N24 O12 P8 S4 -","4","1","","Zhou, Lei; Powell, Douglas; Nicholas, Kenneth M.","Tripodal bis(imidazole) thioether copper(I) complexes: mimics of the Cu(M) site of copper hydroxylase enzymes.","Inorganic chemistry","2007","46","19","7789","7799","10.1021/ic700447k","","","0.71073","MoKα","","0.0674","0.0476","","","0.1133","0.1193","","","","","","1.011","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339813","19.761","0.006","22.503","0.007","36.588","0.011","90","","90","","90","","16270","9","100","2","100","2","","","","","","","","8","P n a 21","P 2c -2n","33","","","","- C78 H80 Cu2 F12 N8 O5 P2 S2 -","- C74 H70 Cu2 F12 N8 O4 P2 S2 -","- C592 H560 Cu16 F96 N64 O32 P16 S16 -","8","2","","Zhou, Lei; Powell, Douglas; Nicholas, Kenneth M.","Tripodal bis(imidazole) thioether copper(I) complexes: mimics of the Cu(M) site of copper hydroxylase enzymes.","Inorganic chemistry","2007","46","19","7789","7799","10.1021/ic700447k","","","0.71073","MoKα","","0.1243","0.0748","","","0.1693","0.1887","","","","","","1.008","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339814","13.066","0.002","14.065","0.002","20.789","0.003","90","","100.227","0.005","90","","3759.8","1","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C38 H36 Cu F6 N4 O2 P S -","- C38 H36 Cu F6 N4 O2 P S -","- C152 H144 Cu4 F24 N16 O8 P4 S4 -","4","1","","Zhou, Lei; Powell, Douglas; Nicholas, Kenneth M.","Tripodal bis(imidazole) thioether copper(I) complexes: mimics of the Cu(M) site of copper hydroxylase enzymes.","Inorganic chemistry","2007","46","19","7789","7799","10.1021/ic700447k","","","0.71073","MoKα","","0.0495","0.036","","","0.0867","0.093","","","","","","1.005","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339815","10.2304","0.0003","11.0782","0.0003","18.7722","0.0005","90","","90","","90","","2127.54","0.1","100","2","100","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C24 H30 N2 Ni O2 -","- C24 H30 N2 Ni O2 -","- C96 H120 N8 Ni4 O8 -","4","0.5","","Lu, Connie C.; Bill, Eckhard; Weyhermüller, Thomas; Bothe, Eberhard; Wieghardt, Karl","The monoanionic pi-radical redox state of alpha-iminoketones in bis(ligand)metal complexes of nickel and cobalt.","Inorganic chemistry","2007","46","19","7880","7889","10.1021/ic7008094","","","0.71073","MoKα","","0.0446","0.035","","","0.0784","0.0824","","","","","","1.084","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339816","11.237","0.003","15.009","0.004","22.035","0.006","90","","90.186","0.005","90","","3716.3","1.7","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H39 F12 N5 Ni O2 P2 -","- C30 H39 F12 N5 Ni O2 P2 -","- C120 H156 F48 N20 Ni4 O8 P8 -","4","1","","Lu, Connie C.; Bill, Eckhard; Weyhermüller, Thomas; Bothe, Eberhard; Wieghardt, Karl","The monoanionic pi-radical redox state of alpha-iminoketones in bis(ligand)metal complexes of nickel and cobalt.","Inorganic chemistry","2007","46","19","7880","7889","10.1021/ic7008094","","","0.71073","MoKα","","0.038","0.0338","","","0.083","0.0852","","","","","","1.084","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339817","10.3003","0.0005","11.1678","0.0005","18.7003","0.0007","90","","90","","90","","2151.13","0.16","100","2","100","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C24 H30 Co N2 O2 -","- C24 H30 Co N2 O2 -","- C96 H120 Co4 N8 O8 -","4","0.5","","Lu, Connie C.; Bill, Eckhard; Weyhermüller, Thomas; Bothe, Eberhard; Wieghardt, Karl","The monoanionic pi-radical redox state of alpha-iminoketones in bis(ligand)metal complexes of nickel and cobalt.","Inorganic chemistry","2007","46","19","7880","7889","10.1021/ic7008094","","","0.71073","MoKα","","0.0565","0.0372","","","0.0805","0.0877","","","","","","1.061","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339818","11.2058","0.0002","14.8769","0.0003","21.9353","0.0005","90","","90.3","0.003","90","","3656.73","0.13","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H39 Co F12 N5 O2 P2 -","- C30 H39 Co F12 N5 O2 P2 -","- C120 H156 Co4 F48 N20 O8 P8 -","4","1","","Lu, Connie C.; Bill, Eckhard; Weyhermüller, Thomas; Bothe, Eberhard; Wieghardt, Karl","The monoanionic pi-radical redox state of alpha-iminoketones in bis(ligand)metal complexes of nickel and cobalt.","Inorganic chemistry","2007","46","19","7880","7889","10.1021/ic7008094","","","0.71073","MoKα","","0.0651","0.042","","","0.0897","0.0998","","","","","","1.016","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339819","10.4378","0.0019","15.831","0.003","12.053","0.002","90","","102.938","0.003","90","","1941.1","0.6","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","03273m","","","- C20 H15 Cl Ir N3 S2 -","- C20 H15 Cl Ir N3 S2 -","- C80 H60 Cl4 Ir4 N12 S8 -","4","1","","McGee, Kari A.; Mann, Kent R.","Selective low-temperature syntheses of facial and meridional tris-cyclometalated iridium(III) complexes.","Inorganic chemistry","2007","46","19","7800","7809","10.1021/ic700440c","","","0.71069","MoKα","","0.0257","0.0205","","","0.0416","0.0429","","","","","","1.072","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339820","8.4639","0.0013","13.114","0.002","13.816","0.002","98.724","0.002","105.48","0.002","102.992","0.002","1403","0.4","173","2","173","2","","","","","","","","8","P -1","-P 1","2","04011","","","- C23 H20 Cl2 F6 Ir N4 P S2 -","- C23 H20 Cl2 F6 Ir N4 P S2 -","- C46 H40 Cl4 F12 Ir2 N8 P2 S4 -","2","1","","McGee, Kari A.; Mann, Kent R.","Selective low-temperature syntheses of facial and meridional tris-cyclometalated iridium(III) complexes.","Inorganic chemistry","2007","46","19","7800","7809","10.1021/ic700440c","","","0.71069","MoKα","","0.0418","0.0374","","","0.0975","0.1014","","","","","","1.056","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339821","15.165","0.002","21.011","0.003","11.8879","0.0018","90","","102.626","0.002","90","","3696.3","0.9","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","04053","","","- C37 H26 Cl4 Ir2 N4 S4 -","- C37 H26 Cl4 Ir2 N4 S4 -","- C148 H104 Cl16 Ir8 N16 S16 -","4","0.5","","McGee, Kari A.; Mann, Kent R.","Selective low-temperature syntheses of facial and meridional tris-cyclometalated iridium(III) complexes.","Inorganic chemistry","2007","46","19","7800","7809","10.1021/ic700440c","","","0.71073","MoKα","","0.0241","0.0212","","","0.0538","0.0553","","","","","","1.034","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339822","20.8082","0.0018","20.8082","","71.402","0.007","90","","90","","120","","26774","4","173","2","173","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","04085","","","- C27 H19 F6 Ir N3 P S3 -","- C27 H19 F5.995 Ir N3 P0.999167 S3 -","- C972 H684 F215.82 Ir36 N108 P35.97 S108 -","36","1","","McGee, Kari A.; Mann, Kent R.","Selective low-temperature syntheses of facial and meridional tris-cyclometalated iridium(III) complexes.","Inorganic chemistry","2007","46","19","7800","7809","10.1021/ic700440c","","","0.71073","MoKα","","0.0791","0.0486","","","0.1102","0.1199","","","","","","1.06","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339823","8.8704","0.0012","18.131","0.003","25.655","0.004","93.993","0.002","96.938","0.002","93.926","0.002","4073.6","1.1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","04133","","","- C26 H22 F6 Ir N4 P -","- C26 H22 F6 Ir N4 P -","- C156 H132 F36 Ir6 N24 P6 -","6","3","","McGee, Kari A.; Mann, Kent R.","Selective low-temperature syntheses of facial and meridional tris-cyclometalated iridium(III) complexes.","Inorganic chemistry","2007","46","19","7800","7809","10.1021/ic700440c","","","0.71073","MoKα","","0.0849","0.0503","","","0.0922","0.1005","","","","","","1.027","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339824","9.2872","0.0006","11.981","0.0008","16.742","0.0011","90","","99.674","0.001","90","","1836.4","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","04136","","","- C44 H32 Cl2 Ir2 N4 -","- C44 H32 Cl2 Ir2 N4 -","- C88 H64 Cl4 Ir4 N8 -","2","0.5","","McGee, Kari A.; Mann, Kent R.","Selective low-temperature syntheses of facial and meridional tris-cyclometalated iridium(III) complexes.","Inorganic chemistry","2007","46","19","7800","7809","10.1021/ic700440c","","","0.71073","MoKα","","0.0325","0.0259","","","0.0526","0.0548","","","","","","1.06","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339825","20.0238","0.0001","20.0238","0.0001","32.8668","0.0003","90","","90","","120","","11412.5","0.13","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- As2 Mn O86.5 Rb8 W20 -","- As2 Mn0.99 O86.49 Rb8.01 W19.98 -","- As12 Mn5.94 O518.94 Rb48.06 W119.88 -","6","0.333333","","Pichon, Céline; Mialane, Pierre; Rivière, Eric; Blain, Guillaume; Dolbecq, Anne; Marrot, Jérôme; Sécheresse, Francis; Duboc, Carole","The highest D value for a Mn(II) ion: investigation of a manganese(II) polyoxometalate complex by high-field electron paramagnetic resonance.","Inorganic chemistry","2007","46","19","7710","7712","10.1021/ic701193f","","","0.71073","MoKα","","0.0986","0.0735","","","0.1768","0.1898","","","","","","1.181","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339826","26.6328","0.0004","26.6328","0.0004","26.6328","0.0004","90","","90","","90","","18890.8","0.5","293","2","293","2","","","","","","","","6","F m -3 m","-F 4 2 3","225","","","","- C25.5 H39.5 Cl Fe2 N4.5 O14.5 -","- C12 H4 Fe2 O10 -","- C288 H96 Fe48 O240 -","24","0.125","","Xie, Linhua; Liu, Shuxia; Gao, Chaoying; Cao, Ruige; Cao, Jianfang; Sun, Chunyan; Su, Zhongmin","Mixed-valence iron(II, III) trimesates with open frameworks modulated by solvents.","Inorganic chemistry","2007","46","19","7782","7788","10.1021/ic062273m","","","0.71073","MoKα","","0.0987","0.0757","","","0.2265","0.248","","","","","","1.052","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339827","30.2083","0.0016","30.2083","0.0016","30.2083","0.0016","90","","90","","90","","27566","3","293","2","293","2","","","","","","","","6","F m -3 m","-F 4 2 3","225","","","","- C36.5 H37.5 Cl3 Fe4 N2.5 O19.5 -","- C24 H4 Cl Fe4 O16 -","- C576 H96 Cl24 Fe96 O384 -","24","0.125","","Xie, Linhua; Liu, Shuxia; Gao, Chaoying; Cao, Ruige; Cao, Jianfang; Sun, Chunyan; Su, Zhongmin","Mixed-valence iron(II, III) trimesates with open frameworks modulated by solvents.","Inorganic chemistry","2007","46","19","7782","7788","10.1021/ic062273m","","","0.71073","MoKα","","0.0665","0.0577","","","0.1649","0.1711","","","","","","1.045","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339828","9.7827","0.0004","18.926","0.0008","9.8318","0.0004","90","","116.249","0.001","90","","1632.62","0.12","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H34 Cl2 Fe2 N4 O12 -","- C30 H34 Cl2 Fe2 N4 O12 -","- C60 H68 Cl4 Fe4 N8 O24 -","2","0.5","","Xie, Linhua; Liu, Shuxia; Gao, Chaoying; Cao, Ruige; Cao, Jianfang; Sun, Chunyan; Su, Zhongmin","Mixed-valence iron(II, III) trimesates with open frameworks modulated by solvents.","Inorganic chemistry","2007","46","19","7782","7788","10.1021/ic062273m","","","0.71073","MoKα","","0.0326","0.0286","","","0.0697","0.0717","","","","","","1.061","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339829","13.2784","0.0001","19.324","0.0002","37.3338","0.0004","90","","90","","90","","9579.55","0.16","200","","200","","","","","","","","?","8","P 21 21 21","P 2ac 2ab","19","","","","- C46 H45 F6 N Ni O6 P4 S2 -","- C46 H45 F6 N Ni O6 P4 S2 -","- C368 H360 F48 N8 Ni8 O48 P32 S16 -","8","2","","Kitto, Heather J.; Rae, A. David; Webster, Richard D.; Willis, Anthony C.; Wild, S. Bruce","Synthesis, structure, and electrochemistry of di- and zerovalent nickel, palladium, and platinum monomers and dimers derived from an enantiopure (S,S)-tetra(tertiary phosphine).","Inorganic chemistry","2007","46","19","8059","8070","10.1021/ic700912q","","","0.71073","MoKα","","0.0615","0.0404","","0.0567","0.0463","0.0463","","","","","","1.1872","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339830","14.6487","0.0002","14.4641","0.0002","19.0842","0.0002","90","","90.1252","0.0009","90","","4043.56","0.09","200","","200","","","","","","","","?","5","P 1 21 1","P 2yb","4","","","","- C44 H47 Ni O0.5 P4 -","- C44 H47 Ni O0.5 P4 -","- C176 H188 Ni4 O2 P16 -","4","2","","Kitto, Heather J.; Rae, A. David; Webster, Richard D.; Willis, Anthony C.; Wild, S. Bruce","Synthesis, structure, and electrochemistry of di- and zerovalent nickel, palladium, and platinum monomers and dimers derived from an enantiopure (S,S)-tetra(tertiary phosphine).","Inorganic chemistry","2007","46","19","8059","8070","10.1021/ic700912q","","","0.71073","MoKα","","0.0336","0.0261","","0.0283","0.025","0.025","","","","","","1.1054","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339831","14.7451","0.0002","9.9707","0.0001","25.8889","0.0002","90","","90.3454","0.0005","90","","3806.09","0.07","200","","200","","","","","","","","?","5","P 1 21 1","P 2yb","4","","","","- C86 H89 Ni2 O0.5 P8 -","- C86 H89 Ni2 O0.5 P8 -","- C172 H178 Ni4 O P16 -","2","1","","Kitto, Heather J.; Rae, A. David; Webster, Richard D.; Willis, Anthony C.; Wild, S. Bruce","Synthesis, structure, and electrochemistry of di- and zerovalent nickel, palladium, and platinum monomers and dimers derived from an enantiopure (S,S)-tetra(tertiary phosphine).","Inorganic chemistry","2007","46","19","8059","8070","10.1021/ic700912q","","","0.71073","MoKα","","0.0306","0.0255","","0.0284","0.0259","0.0259","","","","","","1.1121","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339832","14.8875","0.0008","16.5889","0.0009","19.0688","0.0011","105.936","0.002","100.285","0.004","90.298","0.003","4448.3","0.4","200","","200","","","","","","","","?","4","P 1","P 1","1","","","","- C96 H96 P8 Pd2 -","- C96 H96 P8 Pd2 -","- C192 H192 P16 Pd4 -","2","2","","Kitto, Heather J.; Rae, A. David; Webster, Richard D.; Willis, Anthony C.; Wild, S. Bruce","Synthesis, structure, and electrochemistry of di- and zerovalent nickel, palladium, and platinum monomers and dimers derived from an enantiopure (S,S)-tetra(tertiary phosphine).","Inorganic chemistry","2007","46","19","8059","8070","10.1021/ic700912q","","","0.71073","MoKα","","0.149","0.08","","0.119","0.104","0.104","","","","","","1.92","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339833","16.867","0.002","18.898","0.003","23.275","0.003","88.282","0.002","88.36","0.002","88.004","0.002","7408.3","1.8","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H60 N3 O27 Rh15 -","- C51 H60 N3 O27 Rh15 -","- C204 H240 N12 O108 Rh60 -","4","2","","Collini, Davide; Biani, Fabrizia Fabrizi De; Fedi, Serena; Femoni, Cristina; Kaswalder, Francesco; Iapalucci, Maria Carmela; Longoni, Giuliano; Tiozzo, Cristina; Zacchini, Stefano; Zanello, Piero","Synthesis and electrochemistry of new Rh-centered and conjuncto rhodium carbonyl clusters. X-ray structure of [NEt(4)](3)[Rh(15)(CO)(27)], [NEt(4)](3)[Rh(15)(CO)(25)(MeCN)(2)] x 2MeCN, and [NEt(4)](3)[Rh(17)(CO)(37)].","Inorganic chemistry","2007","46","19","7971","7981","10.1021/ic0623718","","","0.71073","MoKα","","0.1125","0.0691","","","0.1868","0.2215","","","","","","1.031","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339834","13.943","0.002","28.788","0.005","19.538","0.003","90","","91.51","0.004","90","","7840","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C57 H72 N7 O25 Rh15 -","- C57 H72 N7 O25 Rh15 -","- C228 H288 N28 O100 Rh60 -","4","1","","Collini, Davide; Biani, Fabrizia Fabrizi De; Fedi, Serena; Femoni, Cristina; Kaswalder, Francesco; Iapalucci, Maria Carmela; Longoni, Giuliano; Tiozzo, Cristina; Zacchini, Stefano; Zanello, Piero","Synthesis and electrochemistry of new Rh-centered and conjuncto rhodium carbonyl clusters. X-ray structure of [NEt(4)](3)[Rh(15)(CO)(27)], [NEt(4)](3)[Rh(15)(CO)(25)(MeCN)(2)] x 2MeCN, and [NEt(4)](3)[Rh(17)(CO)(37)].","Inorganic chemistry","2007","46","19","7971","7981","10.1021/ic0623718","","","0.71073","MoKα","","0.1119","0.0825","","","0.1912","0.2021","","","","","","1.098","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339835","24.4555","0.0015","13.8637","0.0015","26.961","0.003","90","","109.257","0.002","90","","8629.5","1.4","273","2","273","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C61 H60 N3 O37 Rh17 -","- C61 H60 N3 O37 Rh17 -","- C244 H240 N12 O148 Rh68 -","4","1","","Collini, Davide; Biani, Fabrizia Fabrizi De; Fedi, Serena; Femoni, Cristina; Kaswalder, Francesco; Iapalucci, Maria Carmela; Longoni, Giuliano; Tiozzo, Cristina; Zacchini, Stefano; Zanello, Piero","Synthesis and electrochemistry of new Rh-centered and conjuncto rhodium carbonyl clusters. X-ray structure of [NEt(4)](3)[Rh(15)(CO)(27)], [NEt(4)](3)[Rh(15)(CO)(25)(MeCN)(2)] x 2MeCN, and [NEt(4)](3)[Rh(17)(CO)(37)].","Inorganic chemistry","2007","46","19","7971","7981","10.1021/ic0623718","","","0.71073","MoKα","","0.1428","0.1083","","","0.2294","0.2491","","","","","","1.136","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339836","13.3963","0.0013","12.3062","0.0012","13.4509","0.0013","90","","93.3","0.002","90","","2213.8","0.4","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H32 N2 O3 -","- C25 H32 N2 O3 -","- C100 H128 N8 O12 -","4","1","","Aragoni, M. Carla; Arca, Massimiliano; Bencini, Andrea; Blake, Alexander J.; Caltagirone, Claudia; Danesi, Andrea; Devillanova, Francesco A.; Garau, Alessandra; Gelbrich, Thomas; Isaia, Francesco; Lippolis, Vito; Hursthouse, Michael B.; Valtancoli, Barbara; Wilson, Claire","New fluorescent chemosensors for heavy metal ions based on functionalized pendant arm derivatives of 7-anthracenylmethyl-1,4,10-trioxa-7,13-diazacyclopentadecane.","Inorganic chemistry","2007","46","19","8088","8097","10.1021/ic700657j","","","0.71073","MoKα","","0.0733","0.0547","","","0.1453","0.1552","","","","","","1.043","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4339837","10.3932","0.001","11.8701","0.0011","12.1822","0.0012","99.017","0.002","98.096","0.001","113.352","0.001","1328.2","0.2","150","2","150","2","","","","","","","","5","P 1","P 1","1","","","","- C50 H67 Cl3 N4 O18 -","- C50 H67 Cl3 N4 O18 -","- C50 H67 Cl3 N4 O18 -","1","1","","Aragoni, M. Carla; Arca, Massimiliano; Bencini, Andrea; Blake, Alexander J.; Caltagirone, Claudia; Danesi, Andrea; Devillanova, Francesco A.; Garau, Alessandra; Gelbrich, Thomas; Isaia, Francesco; Lippolis, Vito; Hursthouse, Michael B.; Valtancoli, Barbara; Wilson, Claire","New fluorescent chemosensors for heavy metal ions based on functionalized pendant arm derivatives of 7-anthracenylmethyl-1,4,10-trioxa-7,13-diazacyclopentadecane.","Inorganic chemistry","2007","46","19","8088","8097","10.1021/ic700657j","","","0.71073","MoKα","","0.0724","0.0565","","","0.1251","0.1321","","","","","","0.956","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339838","10.0206","0.0005","7.8827","0.0004","32.782","0.003","90","","92.21","0.005","90","","2587.5","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H32 Cd N4 O9 -","- C25 H32 Cd N4 O9 -","- C100 H128 Cd4 N16 O36 -","4","1","","Aragoni, M. Carla; Arca, Massimiliano; Bencini, Andrea; Blake, Alexander J.; Caltagirone, Claudia; Danesi, Andrea; Devillanova, Francesco A.; Garau, Alessandra; Gelbrich, Thomas; Isaia, Francesco; Lippolis, Vito; Hursthouse, Michael B.; Valtancoli, Barbara; Wilson, Claire","New fluorescent chemosensors for heavy metal ions based on functionalized pendant arm derivatives of 7-anthracenylmethyl-1,4,10-trioxa-7,13-diazacyclopentadecane.","Inorganic chemistry","2007","46","19","8088","8097","10.1021/ic700657j","","","0.71073","MoKα","","0.0865","0.0503","","","0.1174","0.1335","","","","","","1.109","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339839","14.9965","0.001","10.6476","0.0007","28.1197","0.0019","90","","104.813","0.001","90","","4340.8","0.5","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H40 N4 O32 P8 Pb7 -","- C12 H26 N4 O31 P8 Pb7 -","- C48 H104 N16 O124 P32 Pb28 -","4","1","","Wu, Jie; Hou, Hongwei; Han, Huayun; Fan, Yaoting","Highly selective ferric ion sorption and exchange by crystalline metal phosphonates constructed from tetraphosphonic acids.","Inorganic chemistry","2007","46","19","7960","7970","10.1021/ic062014x","","","0.71073","MoKα","","0.0554","0.0447","","","0.1132","0.1188","","","","","","1.08","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339840","8.2607","0.0005","13.0802","0.0008","16.9503","0.0011","90","","90","","90","","1831.5","0.2","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C6 H20 N2 O14 P4 Zn2 -","- C6 H20 N2 O14 P4 Zn2 -","- C24 H80 N8 O56 P16 Zn8 -","4","1","","Wu, Jie; Hou, Hongwei; Han, Huayun; Fan, Yaoting","Highly selective ferric ion sorption and exchange by crystalline metal phosphonates constructed from tetraphosphonic acids.","Inorganic chemistry","2007","46","19","7960","7970","10.1021/ic062014x","","","0.71073","MoKα","","0.0338","0.0271","","","0.0649","0.0686","","","","","","1.016","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339841","18.9555","0.0012","10.2697","0.0005","17.0673","0.001","90","","99.486","0.004","90","","3277","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C74 H56 Cl2 O12 P2 Zn3 -","- C74 H56 Cl2 O12 P2 Zn3 -","- C148 H112 Cl4 O24 P4 Zn6 -","2","0.5","","Yang, Guo-Dong; Dai, Jing-Cao; Lian, Yun-Xia; Wu, Wen-Shi; Lin, Jian-Ming; Hu, Sheng-Min; Sheng, Tian-Lu; Fu, Zhi-Yong; Wu, Xin-Tao","[Ph(3)PCH(2)Ph](2)[Zn(3)(tp)(3)Cl(2)] and Ni(3)(tma)(2)(H(2)O)(8): two unusual claylike frameworks of metal-polycarboxylate coordination polymers (tp = terephthalate, tma = trimesate).","Inorganic chemistry","2007","46","19","7910","7916","10.1021/ic700882n","","","0.71073","MoKα","","0.0418","0.0367","","","0.0854","0.0878","","","","","","1.009","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339842","6.6643","0.0008","9.6222","0.0011","10.0889","0.0011","112.675","0.002","94.007","0.001","106.411","0.002","560.82","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 Ni3 O20 -","- C18 H6 Ni3 O20 -","- C18 H6 Ni3 O20 -","1","0.5","","Yang, Guo-Dong; Dai, Jing-Cao; Lian, Yun-Xia; Wu, Wen-Shi; Lin, Jian-Ming; Hu, Sheng-Min; Sheng, Tian-Lu; Fu, Zhi-Yong; Wu, Xin-Tao","[Ph(3)PCH(2)Ph](2)[Zn(3)(tp)(3)Cl(2)] and Ni(3)(tma)(2)(H(2)O)(8): two unusual claylike frameworks of metal-polycarboxylate coordination polymers (tp = terephthalate, tma = trimesate).","Inorganic chemistry","2007","46","19","7910","7916","10.1021/ic700882n","","","0.71073","MoKα","","0.0801","0.0538","","","0.1364","0.1554","","","","","","1.003","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339843","10.0431","0.0007","10.0905","0.0007","13.1685","0.0009","75.739","0.001","68.627","0.001","65.422","0.001","1123.03","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 Ni3 O20 -","- C18 H6 Ni3 O20 -","- C36 H12 Ni6 O40 -","2","1","","Yang, Guo-Dong; Dai, Jing-Cao; Lian, Yun-Xia; Wu, Wen-Shi; Lin, Jian-Ming; Hu, Sheng-Min; Sheng, Tian-Lu; Fu, Zhi-Yong; Wu, Xin-Tao","[Ph(3)PCH(2)Ph](2)[Zn(3)(tp)(3)Cl(2)] and Ni(3)(tma)(2)(H(2)O)(8): two unusual claylike frameworks of metal-polycarboxylate coordination polymers (tp = terephthalate, tma = trimesate).","Inorganic chemistry","2007","46","19","7910","7916","10.1021/ic700882n","","","0.71073","MoKα","","0.1004","0.0576","","","0.1447","0.1779","","","","","","1.002","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339844","4.0461","0.0008","4.0461","0.0008","8.1","0.007","90","","90","","90","","132.6","0.12","296","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","","","- La Ni O P -","- La Ni O P -","- La2 Ni2 O2 P2 -","2","0.125","","Watanabe, Takumi; Yanagi, Hiroshi; Kamiya, Toshio; Kamihara, Yoichi; Hiramatsu, Hidenori; Hirano, Masahiro; Hosono, Hideo","Nickel-based oxyphosphide superconductor with a layered crystal structure, LaNiOP.","Inorganic chemistry","2007","46","19","7719","7721","10.1021/ic701200e","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339845","10.3288","0.0005","11.9466","0.0006","23.6364","0.0012","90","","93.379","0.001","90","","2911.5","0.3","125","2","125","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H45 N4 P Si3 Zr -","- C21 H45 N4 P Si3 Zr -","- C84 H180 N16 P4 Si12 Zr4 -","4","1","","Roering, Andrew J.; MacMillan, Samantha N.; Tanski, Joseph M.; Waterman, Rory","Zirconium-catalyzed heterodehydrocoupling of primary phosphines with silanes and germanes.","Inorganic chemistry","2007","46","17","6855","6857","10.1021/ic7013144","","","0.71073","MoKα","","0.0638","0.035","","","0.0681","0.0776","","","","","","1.009","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339846","23.692","0.0017","23.692","0.0017","13.374","0.0015","90","","90","","120","","6501.2","1","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","Ca-5-aminoisophthalate","","","- C8 H15 Ca N O9 -","- C8 H13 Ca N O9 -","- C144 H234 Ca18 N18 O162 -","18","1","","Murugavel, Ramaswamy; Kumar, Parimal; Walawalkar, Mrinalini G.; Mathialagan, Ramyaa","A double helix is the repeating unit in a luminescent calcium 5-aminoisophthalate supramolecular edifice with water-filled hexagonal channels.","Inorganic chemistry","2007","46","17","6828","6830","10.1021/ic070113k","","","0.71073","MoKα","","0.0814","0.0558","","","0.1752","0.1919","","","","","","1.06","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339847","23.7031","0.0005","23.7031","0.0005","13.275","0.0003","90","","90","","120","","6459.2","0.2","151","2","151","2","","","","","","","","5","R -3 :H","-R 3","148","CALCIUM-5-AMINOISOPHTHALATE","","","- C8 H15.67 Ca N O9.33 -","- C8 H11 Ca N O9.33333 -","- C144 H198 Ca18 N18 O168 -","18","1","","Murugavel, Ramaswamy; Kumar, Parimal; Walawalkar, Mrinalini G.; Mathialagan, Ramyaa","A double helix is the repeating unit in a luminescent calcium 5-aminoisophthalate supramolecular edifice with water-filled hexagonal channels.","Inorganic chemistry","2007","46","17","6828","6830","10.1021/ic070113k","","","0.71073","MoKα","","0.1118","0.0842","","","0.2605","0.2927","","","","","","1.157","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339848","11.4081","0.0007","14.9988","0.0008","23.7741","0.0013","90","","93.337","0.002","90","","4061","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C43 H61 Fe N5 -","- C43 H61 Fe N5 -","- C172 H244 Fe4 N20 -","4","1","","Bart, Suzanne C.; Lobkovsky, Emil; Bill, Eckhard; Wieghardt, Karl; Chirik, Paul J.","Neutral-ligand complexes of bis(imino)pyridine iron: synthesis, structure, and spectroscopy.","Inorganic chemistry","2007","46","17","7055","7063","10.1021/ic700869h","","","0.71073","MoKα","","0.0526","0.0372","","","0.0972","0.1084","","","","","","1.031","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339849","18.7178","0.0012","10.6162","0.0007","19.289","0.0011","90","","106.022","0.004","90","","3684.1","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C39 H55 Fe N5 P -","- C39 H55 Fe N5 P -","- C156 H220 Fe4 N20 P4 -","4","1","","Bart, Suzanne C.; Lobkovsky, Emil; Bill, Eckhard; Wieghardt, Karl; Chirik, Paul J.","Neutral-ligand complexes of bis(imino)pyridine iron: synthesis, structure, and spectroscopy.","Inorganic chemistry","2007","46","17","7055","7063","10.1021/ic700869h","","","0.71073","MoKα","","0.0661","0.0414","","","0.1179","0.129","","","","","","0.985","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339850","16.0106","0.0012","19.5188","0.0018","25.744","0.002","90","","90","","90","","8045.2","1.1","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C43 H67 Fe N3 P2 -","- C43 H67 Fe N3 P2 -","- C344 H536 Fe8 N24 P16 -","8","1","","Bart, Suzanne C.; Lobkovsky, Emil; Bill, Eckhard; Wieghardt, Karl; Chirik, Paul J.","Neutral-ligand complexes of bis(imino)pyridine iron: synthesis, structure, and spectroscopy.","Inorganic chemistry","2007","46","17","7055","7063","10.1021/ic700869h","","","0.71073","MoKα","","0.0529","0.0402","","","0.1083","0.1171","","","","","","1.103","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339851","16.906","0.003","12.3467","0.0017","36.396","0.005","90","","95.236","0.005","90","","7565","2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C74 H102 Fe2 N10 S2 -","- C74 H102 Fe2 N10 S2 -","- C296 H408 Fe8 N40 S8 -","4","1","","Bart, Suzanne C.; Lobkovsky, Emil; Bill, Eckhard; Wieghardt, Karl; Chirik, Paul J.","Neutral-ligand complexes of bis(imino)pyridine iron: synthesis, structure, and spectroscopy.","Inorganic chemistry","2007","46","17","7055","7063","10.1021/ic700869h","","","0.71073","MoKα","","0.0629","0.0434","","","0.1117","0.1184","","","","","","1.071","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339852","19.0652","0.0016","9.4991","0.0008","18.7216","0.0016","90","","102.944","0.001","90","","3304.4","0.5","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","cis-bis(triethylphosphine)dipyridalplatinum(II) triflate","","- C24 H40 F6 N2 O6 P2 Pt S2 -","- C24 H40 F6 N2 O6 P2 Pt S2 -","- C96 H160 F24 N8 O24 P8 Pt4 S8 -","4","1","","Farrell, Joshua R.; Lavoie, David P.; Pennell, Ryan T.; Cetin, Anil; Shaw, Janet L.; Ziegler, Christopher J.","Electrochromic polymer films containing Re(I) and Pt(II) metal centers.","Inorganic chemistry","2007","46","17","6840","6842","10.1021/ic700635h","","","0.71073","MoKα","","0.041","0.0322","","","0.0735","0.0773","","","","","","1.042","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339853","16.742","0.005","9.043","0.003","26.653","0.008","90","","103.926","0.005","90","","3917","2","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","mer-tricarbonylchlorobis(4-[2,2']bithiophenyl-5-yl-pyridine)rhenium(I)","","- C21.5 H17 Cl0.5 N O1.5 Re0.5 S2 -","- C14.5 H9 Cl0.5 N O1.5 Re0.5 S2 -","- C116 H72 Cl4 N8 O12 Re4 S16 -","8","1","","Farrell, Joshua R.; Lavoie, David P.; Pennell, Ryan T.; Cetin, Anil; Shaw, Janet L.; Ziegler, Christopher J.","Electrochromic polymer films containing Re(I) and Pt(II) metal centers.","Inorganic chemistry","2007","46","17","6840","6842","10.1021/ic700635h","","","0.71073","MoKα","","0.0454","0.0374","","","0.0739","0.0764","","","","","","1.072","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339854","13.457","0.005","38.583","0.013","14.127","0.004","90","","116.578","0.011","90","","6560","4","110","2","110","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C112.5 H88 F24 N24 O2 P4 Ru4 -","- C112.5 H88 F24 N24 O2 P4 Ru4 -","- C225 H176 F48 N48 O4 P8 Ru8 -","2","1","","Yin, Jun; Elsenbaumer, Ronald L.","Syntheses of homochiral multinuclear ru complexes based on oligomeric bibenzimidazoles.","Inorganic chemistry","2007","46","17","6891","6901","10.1021/ic062148a","","","1.54184","CuKα","","0.327","0.0766","","","0.1343","0.2855","","","","","","1.04","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339855","8.8255","0.0012","8.8255","0.0012","12.564","0.003","90","","90","","90","","978.6","0.3","293","2","293","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","","","","- Bi1.6 Eu3 Sn3.4 -","- Bi Eu Sn3 -","- Bi8 Eu8 Sn24 -","8","0.25","","Ge, Ming-Hui; Corbett, John D.","Synthesis, structure, and bonding of Eu3Bi(Sn,Bi)4. A rare inverse-Cr5B3-type structure with a new tin/bismuth network.","Inorganic chemistry","2007","46","17","6864","6870","10.1021/ic070281c","","","0.71073","MoKα","","0.2584","0.2584","","","0.5202","0.5202","","","","","","2.496","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339856","10.511","0.005","11.713","0.005","13.135","0.005","64.401","0.005","74","0.005","66.774","0.005","1329.3","1","180","","180","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C23 H32 Mn2 N2 O11 -","- C23 H32 Mn2 N2 O11 -","- C46 H64 Mn4 N4 O22 -","2","1","","Stoicescu, Liliana; Jeanson, Aurélie; Duhayon, Carine; Tesouro-Vallina, Ana; Boudalis, Athanassios K.; Costes, Jean-Pierre; Tuchagues, Jean-Pierre","Structure and properties of dinuclear manganese(III) complexes with pentaanionic pentadentate ligands including alkoxo, amido, and phenoxo donors.","Inorganic chemistry","2007","46","17","6902","6910","10.1021/ic062398r","","","0.71073","MoKα","","0.1685","0.0911","","","0.2237","0.2648","","","","","","0.978","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339857","9.456","0.0005","11.0112","0.0005","13.8831","0.0006","90.821","0.004","92.597","0.004","93.403","0.004","1441.29","0.12","180","","180","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C25 H34 Mn2 N4 O9 -","- C25 H34 Mn2 N4 O9 -","- C50 H68 Mn4 N8 O18 -","2","1","","Stoicescu, Liliana; Jeanson, Aurélie; Duhayon, Carine; Tesouro-Vallina, Ana; Boudalis, Athanassios K.; Costes, Jean-Pierre; Tuchagues, Jean-Pierre","Structure and properties of dinuclear manganese(III) complexes with pentaanionic pentadentate ligands including alkoxo, amido, and phenoxo donors.","Inorganic chemistry","2007","46","17","6902","6910","10.1021/ic062398r","","x-ray","0.71073","MoKα","","0.0624","0.0426","","","0.103","0.1101","","","","","","1.064","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339858","12.205","0.0007","12.736","0.0008","19.278","0.001","99.735","0.005","96.003","0.004","101.221","0.005","2867.6","0.3","180","","180","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C24.5 H34 Mn2 N4 O9.5 -","- C24.5 H34 Mn2 N4 O9.5 -","- C98 H136 Mn8 N16 O38 -","4","2","","Stoicescu, Liliana; Jeanson, Aurélie; Duhayon, Carine; Tesouro-Vallina, Ana; Boudalis, Athanassios K.; Costes, Jean-Pierre; Tuchagues, Jean-Pierre","Structure and properties of dinuclear manganese(III) complexes with pentaanionic pentadentate ligands including alkoxo, amido, and phenoxo donors.","Inorganic chemistry","2007","46","17","6902","6910","10.1021/ic062398r","","x-ray","0.71073","","","0.0841","0.0519","","","0.1285","0.146","","","","","","0.983","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339859","25.229","0.013","20.655","0.01","33.56","0.016","90","","90","","90","","17488","15","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C102 H192 Mn22 N4 O78 -","- C102 H192 Mn22 N4 O78 -","- C408 H768 Mn88 N16 O312 -","4","0.5","","Manoli, Maria; Prescimone, Alessandro; Bagai, Rashmi; Mishra, Abhudaya; Murugesu, Muralee; Parsons, Simon; Wernsdorfer, Wolfgang; Christou, George; Brechin, Euan K.","High-spin Mn wheels.","Inorganic chemistry","2007","46","17","6968","6979","10.1021/ic7007528","","","0.71073","MoKα","","0.2461","0.0819","","","0.2312","0.2747","","","","","","0.947","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339860","25.1814","0.0012","20.8101","0.001","33.712","0.0016","90","","90","","90","","17666","1.5","150","","150","","","","","","","","M.Manoli","6","P b c a","-P 2ac 2ab","61","","","","- C109 H208 Br8 Mn22 N4 O81 -","- C92 H160 Br8 Mn22 N4 O76 -","- C368 H640 Br32 Mn88 N16 O304 -","4","0.5","","Manoli, Maria; Prescimone, Alessandro; Bagai, Rashmi; Mishra, Abhudaya; Murugesu, Muralee; Parsons, Simon; Wernsdorfer, Wolfgang; Christou, George; Brechin, Euan K.","High-spin Mn wheels.","Inorganic chemistry","2007","46","17","6968","6979","10.1021/ic7007528","","","0.71073","MoKα","","0.0762","0.0496","","0.0413","0.0366","0.0366","","","","","","1.1538","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339861","13.414","0.0004","15.906","0.0004","17.987","0.0005","66.487","0.002","82.684","0.002","71.82","0.002","3343.42","0.17","150","","150","","","","","","","","M. Manoli, MMC51","4","P -1","-P 1","2","","","","- C92 H184 Mn16 O61 -","- C80 H154 Mn16 O58 -","- C80 H154 Mn16 O58 -","1","0.5","","Manoli, Maria; Prescimone, Alessandro; Bagai, Rashmi; Mishra, Abhudaya; Murugesu, Muralee; Parsons, Simon; Wernsdorfer, Wolfgang; Christou, George; Brechin, Euan K.","High-spin Mn wheels.","Inorganic chemistry","2007","46","17","6968","6979","10.1021/ic7007528","","","0.71073","MoKα","","0.0729","0.0457","","0.1436","0.1008","0.1436","","","","","","0.9383","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4339862","14.5256","0.0006","17.4906","0.0006","17.1378","0.0008","90","","113.981","0.003","90","","3978.2","0.3","133","2","133","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35.5 H62 Cl3 N2 O3 Re S -","- C35.5 H62 Cl3 N2 O3 Re S -","- C142 H248 Cl12 N8 O12 Re4 S4 -","4","1","","Sachse, Anna; Mösch-Zanetti, Nadia C; Lyashenko, Ganna; Wielandt, J. Wolfram; Most, Kerstin; Magull, Jörg; Dall'Antonia, Fabio; Pal, Aritra; Herbst-Irmer, Regine","Rhenium(V) oxo complexes with acetylacetone derived Schiff bases: structure and catalytic epoxidation.","Inorganic chemistry","2007","46","17","7129","7135","10.1021/ic700381n","","","0.71073","MoKα","","0.0465","0.0343","","","0.0802","0.0839","","","","","","1.012","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339863","15.6414","0.0007","15.8201","0.0007","16.4334","0.0008","109.916","0.004","91.352","0.004","93.144","0.003","3813.6","0.3","133","2","133","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H47 Cl2 N O4 P Re -","- C39 H47 Cl2 N O4 P Re -","- C156 H188 Cl8 N4 O16 P4 Re4 -","4","2","","Sachse, Anna; Mösch-Zanetti, Nadia C; Lyashenko, Ganna; Wielandt, J. Wolfram; Most, Kerstin; Magull, Jörg; Dall'Antonia, Fabio; Pal, Aritra; Herbst-Irmer, Regine","Rhenium(V) oxo complexes with acetylacetone derived Schiff bases: structure and catalytic epoxidation.","Inorganic chemistry","2007","46","17","7129","7135","10.1021/ic700381n","","","0.71073","MoKα","","0.0355","0.0274","","","0.0703","0.0732","","","","","","1.023","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339864","13.4531","0.0009","16.9556","0.0013","15.5468","0.001","90","","113.56","0.005","90","","3250.7","0.4","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H52 Cl3 N2 O2 Re -","- C29 H52 Cl3 N2 O2 Re -","- C116 H208 Cl12 N8 O8 Re4 -","4","1","","Sachse, Anna; Mösch-Zanetti, Nadia C; Lyashenko, Ganna; Wielandt, J. Wolfram; Most, Kerstin; Magull, Jörg; Dall'Antonia, Fabio; Pal, Aritra; Herbst-Irmer, Regine","Rhenium(V) oxo complexes with acetylacetone derived Schiff bases: structure and catalytic epoxidation.","Inorganic chemistry","2007","46","17","7129","7135","10.1021/ic700381n","","","0.71073","MoKα","","0.0299","0.0234","","","0.0535","0.0551","","","","","","0.957","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339865","11.9939","0.001","17.4552","0.0009","16.0281","0.0013","90","","90.686","0.006","90","","3355.3","0.4","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H47 Al Ge N2 Se2 -","- C31 H47 Al Ge N2 Se2 -","- C124 H188 Al4 Ge4 N8 Se8 -","4","1","","Yang, Zhi; Ma, Xiaoli; Roesky, Herbert W.; Yang, Ying; Magull, Jörg; Ringe, Arne","Synthesis and characterization of well-defined aluminum-containing heterobimetallic selenides.","Inorganic chemistry","2007","46","17","7093","7096","10.1021/ic700945a","","","0.71073","MoKα","","0.0463","0.0301","","","0.063","0.0667","","","","","","0.963","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339866","8.7397","0.0002","11.514","0.0002","17.0729","0.0004","84.1779","0.0008","77.7817","0.0009","71.7589","0.0015","1593.59","0.06","150","","150","","","","","","","","","3","P -1","-P 1","2","","","","- C18 H24 N2 -","- C18 H24 N2 -","- C72 H96 N8 -","4","2","","Carabineiro, Sónia A; Silva, Leonel C.; Gomes, Pedro T.; Pereira, Laura C. J.; Veiros, Luís F; Pascu, Sofia I.; Duarte, M. Teresa; Namorado, Sónia; Henriques, Rui T.","Synthesis and characterization of tetrahedral and square planar Bis(iminopyrrolyl) complexes of cobalt(II).","Inorganic chemistry","2007","46","17","6880","6890","10.1021/ic062125w","","","0.71073","MoKα","","0.0741","0.0503","","0.0811","0.0635","0.0635","","","","","","1.0091","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339867","10.952","0.003","16.279","0.005","18.283","0.004","84.472","0.009","80.667","0.01","80.271","0.008","3162.3","1.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H42 Co N4 -","- C34 H42 Co N4 -","- C136 H168 Co4 N16 -","4","2","","Carabineiro, Sónia A; Silva, Leonel C.; Gomes, Pedro T.; Pereira, Laura C. J.; Veiros, Luís F; Pascu, Sofia I.; Duarte, M. Teresa; Namorado, Sónia; Henriques, Rui T.","Synthesis and characterization of tetrahedral and square planar Bis(iminopyrrolyl) complexes of cobalt(II).","Inorganic chemistry","2007","46","17","6880","6890","10.1021/ic062125w","","x-ray","0.71069","MoKα","","0.1761","0.077","","","0.1713","0.2077","","","","","","0.906","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339868","8.1966","0.0014","9.0582","0.0016","11.615","0.002","69.06","0.002","79.503","0.002","80.932","0.002","787.9","0.2","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C36 H46 Co N4 -","- C36 H46 Co N4 -","- C36 H46 Co N4 -","1","0.5","","Carabineiro, Sónia A; Silva, Leonel C.; Gomes, Pedro T.; Pereira, Laura C. J.; Veiros, Luís F; Pascu, Sofia I.; Duarte, M. Teresa; Namorado, Sónia; Henriques, Rui T.","Synthesis and characterization of tetrahedral and square planar Bis(iminopyrrolyl) complexes of cobalt(II).","Inorganic chemistry","2007","46","17","6880","6890","10.1021/ic062125w","","","0.6814","MoKα","","0.0682","0.0393","","0.054","0.0419","0.0419","","","","","","1.1132","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339869","12.3003","0.0013","18.343","0.002","12.3772","0.0014","90","","96.214","0.002","90","","2776.2","0.5","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C17 H35 Cl2 Co N O9 P3 Ru -","- C17 H25 Cl2 Co N O9 P3 Ru -","- C68 H100 Cl8 Co4 N4 O36 P12 Ru4 -","4","1","","Yi, Xiao-Yi; Lam, Tony C. H.; Sau, Yiu-Keung; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Electrophilic ruthenium(VI) nitrido complex containing Kläui's oxygen tripodal ligand.","Inorganic chemistry","2007","46","17","7193","7198","10.1021/ic7007683","","","0.71073","MoKα","","0.1036","0.0561","","","0.126","0.1424","","","","","","0.933","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339870","9.5821","0.0006","36.808","0.002","19.0222","0.0011","90","","91.143","0.001","90","","6707.8","0.7","100","2","100","2","","","","","","","","11","P 1 21/n 1","-P 2yn","14","","","","- C36 H70 Ag2 Cl4 Co2 F6 N2 O26 P6 Ru2 S2 -","- C36 H70 Ag2 Cl4 Co2 F6 N2 O26 P6 Ru2 S2 -","- C144 H280 Ag8 Cl16 Co8 F24 N8 O104 P24 Ru8 S8 -","4","1","","Yi, Xiao-Yi; Lam, Tony C. H.; Sau, Yiu-Keung; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Electrophilic ruthenium(VI) nitrido complex containing Kläui's oxygen tripodal ligand.","Inorganic chemistry","2007","46","17","7193","7198","10.1021/ic7007683","","","0.71073","MoKα","","0.0948","0.0429","","","0.0604","0.0676","","","","","","0.975","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339871","9.118","0.0007","18.1771","0.0014","17.6941","0.0014","90","","91.041","0.002","90","","2932.1","0.4","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C17 H35 Cl2 Co N O10 P3 Ru -","- C17 H35 Cl2 Co N O10 P3 Ru -","- C68 H140 Cl8 Co4 N4 O40 P12 Ru4 -","4","1","","Yi, Xiao-Yi; Lam, Tony C. H.; Sau, Yiu-Keung; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Electrophilic ruthenium(VI) nitrido complex containing Kläui's oxygen tripodal ligand.","Inorganic chemistry","2007","46","17","7193","7198","10.1021/ic7007683","","","0.71073","MoKα","","0.0453","0.0307","","","0.058","0.061","","","","","","0.955","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339872","9.7422","0.0013","10.5156","0.0013","21.845","0.003","82.109","0.003","79.394","0.002","70.706","0.002","2069.1","0.5","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C35 H50 Cl2 Co N O9 P4 Ru -","- C35 H45 Cl2 Co N O9 P4 Ru -","- C70 H90 Cl4 Co2 N2 O18 P8 Ru2 -","2","1","","Yi, Xiao-Yi; Lam, Tony C. H.; Sau, Yiu-Keung; Zhang, Qian-Feng; Williams, Ian D.; Leung, Wa-Hung","Electrophilic ruthenium(VI) nitrido complex containing Kläui's oxygen tripodal ligand.","Inorganic chemistry","2007","46","17","7193","7198","10.1021/ic7007683","","","0.71073","MoKα","","0.0715","0.0414","","","0.0791","0.0866","","","","","","0.984","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339873","13.4551","0.0002","13.4551","0.0002","9.5832","0.0002","90","","90","","90","","1734.94","0.05","100","2","100","2","","","","","","","","5","P 4 21 2","P 4ab 2ab","90","","","","- C26 H40 N2 O13 Zn2 -","- C26.08 N2 O8 Zn2 -","- C52.16 N4 O16 Zn4 -","2","0.25","","Dybtsev, Danil N.; Yutkin, Maxim P.; Peresypkina, Eugenia V.; Virovets, Alexander V.; Serre, Christian; Férey, Gérard; Fedin, Vladimir P.","Isoreticular homochiral porous metal-organic structures with tunable pore sizes.","Inorganic chemistry","2007","46","17","6843","6845","10.1021/ic7009226","","","0.71073","MoKα","","0.0536","0.0489","","","0.1918","0.1974","","","","","","1.165","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339874","18.8703","0.0003","18.8703","0.0003","27.8994","0.0012","90","","90","","90","","9934.6","0.5","90","0.2","90","0.2","","","","","","","","5","F 2 2 2","F 2 2","22","","","","- C30 H36 N2 O8 Zn2 -","- C30 N2 O8 Zn2 -","- C240 N16 O64 Zn16 -","8","0.5","","Dybtsev, Danil N.; Yutkin, Maxim P.; Peresypkina, Eugenia V.; Virovets, Alexander V.; Serre, Christian; Férey, Gérard; Fedin, Vladimir P.","Isoreticular homochiral porous metal-organic structures with tunable pore sizes.","Inorganic chemistry","2007","46","17","6843","6845","10.1021/ic7009226","","","0.71073","MoKα","","0.125","0.0724","","","0.217","0.2473","","","","","","1.494","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339875","13.3433","0.0003","13.3433","0.0003","27.8994","0.0012","90","","90","","90","","4967.3","0.3","90","0.2","90","0.2","","","","","","","","5","I -4 c 2","I -4 -2c","120","","","","- C30 H36 N2 O8 Zn2 -","- C30 N2 O8 Zn2 -","- C120 N8 O32 Zn8 -","4","0.25","","Dybtsev, Danil N.; Yutkin, Maxim P.; Peresypkina, Eugenia V.; Virovets, Alexander V.; Serre, Christian; Férey, Gérard; Fedin, Vladimir P.","Isoreticular homochiral porous metal-organic structures with tunable pore sizes.","Inorganic chemistry","2007","46","17","6843","6845","10.1021/ic7009226","","","0.71073","MoKα","","0.1194","0.0755","","","0.2269","0.274","","","","","","1.19","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339876","40.58","0.007","11.021","0.002","22.269","0.004","90","","95.43","0.004","90","","9915","3","133","2","133","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[Co8(L1)6(OH)4(H2O)4]5H2O","[Co8(L1)6(OH)4(H2O)4]5H2O","","- C96 H76 Co8 N18 O37 -","- C96 H54 Co8 N18 O37 -","- C384 H216 Co32 N72 O148 -","4","0.5","","Zou, Wen-Qiang; Wang, Ming-Sheng; Li, Yan; Wu, A-Qing; Zheng, Fa-Kun; Chen, Qi-Yong; Guo, Guo-Cong; Huang, Jin-Shun","Unprecedented (3,10)-connected 2-D metal-organic framework constructed from octanuclear cobalt(II) clusters and a new bifunctional ligand.","Inorganic chemistry","2007","46","17","6852","6854","10.1021/ic700820d","","","0.71073","MoKα","","0.0616","0.0505","","","0.1305","0.1406","","","","","","1.018","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339877","6.7203","0.0016","7.3808","0.0012","12.5627","0.0033","87.141","0.021","93.624","0.035","111.799","0.012","577.2","0.2","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H8 Ni S12 -","- C20 H8 Ni S12 -","- C20 H8 Ni S12 -","1","0.5","","Wen, He-Rui; Li, Cheng-Hui; Song, You; Zuo, Jing-Lin; Zhang, Bin; You, Xiao-Zeng","Synthesis and magnetic properties of a highly conducting neutral nickel complex with a highly conjugated tetrathiafulvalenedithiolate ligand.","Inorganic chemistry","2007","46","17","6837","6839","10.1021/ic070264n","powder diffraction","x-ray","1.54184","Kα~1~","","","","","","","","0.0824","","1.91","","","","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339878","23.472","0.004","13.582","0.002","38.636","0.006","90","","100.158","0.003","90","","12124","3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H51 I N9 P3 -","- C19 H51 I N9 P3 -","- C304 H816 I16 N144 P48 -","16","4","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.1213","0.0899","","","0.2209","0.243","","","","","","1.034","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339879","11.4844","0.001","12.8383","0.0011","14.8134","0.0013","94.308","0.002","108.88","0.002","111.935","0.002","1868.6","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H63 I N9 P3 -","- C25 H63 I N9 P3 -","- C50 H126 I2 N18 P6 -","2","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.044","0.04","","","0.1142","0.1182","","","","","","1.059","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339880","13.2048","0.0013","16.604","0.0017","14.6073","0.0015","90","","100.66","0.03","90","","3147.4","0.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H51 I N9 P3 -","- C19 H51 I N9 P3 -","- C76 H204 I4 N36 P12 -","4","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0655","0.0616","","","0.1425","0.1444","","","","","","0.982","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339881","10.322","0.003","11.793","0.003","16.481","0.004","92.571","0.006","101.898","0.005","105.756","0.006","1878.5","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H63 I N9 P3 -","- C25 H63 I N9 P3 -","- C50 H126 I2 N18 P6 -","2","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0351","0.0344","","","0.0879","0.0883","","","","","","1.086","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339882","29.3736","0.0016","11.0372","0.0006","31.7895","0.0018","90","","115.646","0.001","90","","9290.9","0.9","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H81 I N9 O2 P3 -","- C38 H81 I N9 O2 P3 -","- C304 H648 I8 N72 O16 P24 -","8","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0278","0.0256","","","0.0645","0.0657","","","","","","1.044","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339884","10.6808","0.0005","18.1223","0.0009","21.4994","0.001","90","","103.539","0.001","90","","4045.8","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H66 I2 N9 P3 -","- C26 H66 I2 N9 P3 -","- C104 H264 I8 N36 P12 -","4","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0347","0.0252","","","0.051","0.0526","","","","","","0.901","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339885","19.7423","0.001","16.8937","0.0008","17.5708","0.0008","90","","106.754","0.001","90","","5611.5","0.5","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C41 H79 Cl3 F6 N9 O6 P3 S2 -","- C41 H79 Cl3 F6 N9 O6 P3 S2 -","- C164 H316 Cl12 F24 N36 O24 P12 S8 -","4","0.5","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0485","0.0444","","","0.1107","0.1134","","","","","","1.028","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339886","10.4381","0.0007","11.1776","0.0008","17.3682","0.0012","108.413","0.001","95.749","0.001","104.783","0.001","1822.6","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H54 Cl2 I2 N7 P3 -","- C26 H54 Cl2 I2 N7 P3 -","- C52 H108 Cl4 I4 N14 P6 -","2","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0378","0.0305","","","0.073","0.0765","","","","","","1.037","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339887","9.0159","0.0006","11.4296","0.0007","14.5537","0.001","92.961","0.001","104.931","0.001","100.017","0.001","1419.65","0.16","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H43 Cl2 I N7 P3 -","- C17 H43 Cl2 I N7 P3 -","- C34 H86 Cl4 I2 N14 P6 -","2","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0305","0.0282","","","0.0742","0.076","","","","","","1.033","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339888","12.184","0.002","16","0.002","20.652","0.003","90","","101.41","0.02","90","","3946.4","1","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H65 I N9 P3 -","- C26 H65 I N9 P3 -","- C104 H260 I4 N36 P12 -","4","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0836","0.0565","","","0.1446","0.1574","","","","","","0.916","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339889","15.4068","0.0018","14.8526","0.0018","16.932","0.002","90","","96.987","0.002","90","","3845.8","0.8","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H65 Br N9 P3 -","- C27 H65 Br N9 P3 -","- C108 H260 Br4 N36 P12 -","4","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0771","0.0542","","","0.1372","0.1449","","","","","","1.035","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339890","16.5652","0.0009","18.8117","0.0011","31.811","0.0018","90","","90","","90","","9912.9","1","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H53 Br N9 P3 -","- C21 H53 Br N9 P3 -","- C252 H636 Br12 N108 P36 -","12","3","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0932","0.0598","","","0.1401","0.1478","","","","","","0.947","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339891","16.745","0.003","18.004","0.005","19.026","0.003","90","","90","","90","","5736","2","200","2","200","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C57 H71 Br N9 O2 P3 -","- C57 H71 Br N9 O2 P3 -","- C228 H284 Br4 N36 O8 P12 -","4","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0787","0.0357","","","0.0609","0.0682","","","","","","0.779","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339892","9.198","0.0006","23.3976","0.0016","19.5847","0.0013","90","","94.365","0.001","90","","4202.6","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H65 Ag2 N12 O10 P3 -","- C25 H65 Ag2 N12 O10 P3 -","- C100 H260 Ag8 N48 O40 P12 -","4","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0463","0.034","","","0.0723","0.0766","","","","","","1.045","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339893","17.9576","0.0017","17.7811","0.0017","11.7065","0.0011","90","","102.812","0.002","90","","3644.9","0.6","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C20 H55 Ag N11 O7 P3 -","- C20 H54 Ag N11 O7 P3 -","- C80 H216 Ag4 N44 O28 P12 -","4","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0465","0.0458","","","0.1186","0.1194","","","","","","1.034","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339894","9.9751","0.0017","11.719","0.002","16.369","0.003","77.702","0.004","73.267","0.004","74.62","0.004","1747.4","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H63 N10 O3 P3 -","- C25 H63 N10 O3 P3 -","- C50 H126 N20 O6 P6 -","2","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0813","0.0546","","","0.1282","0.1367","","","","","","0.965","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339895","19.0853","0.0005","19.0853","0.0005","17.4995","0.0009","90","","90","","90","","6374.2","0.4","100","2","100","2","","","","","","","","6","I -4","I -4","82","","","","- C20 H51 Cl N9 O P3 -","- C20 H51 Cl N9 O P3 -","- C160 H408 Cl8 N72 O8 P24 -","8","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0368","0.0338","","","0.0841","0.0853","","","","","","1.008","","","","has coordinates,has disorder","179501","2020-10-21","18:00:00",""
"4339896","14.0003","0.0013","15.0896","0.0013","17.9053","0.0016","90","","109.135","0.002","90","","3573.7","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H57 Cl N9 O1.5 P3 -","- C27 H57 Cl N9 O1.5 P3 -","- C108 H228 Cl4 N36 O6 P12 -","4","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.0734","0.0384","","","0.0567","0.0612","","","","","","0.825","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339897","15.875","0.005","11.885","0.004","17.003","0.006","90","","99.245","0.006","90","","3166.4","1.8","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H49 Br N9 O P3 -","- C20 H49 Br N9 O P3 -","- C80 H196 Br4 N36 O4 P12 -","4","1","","Benson, Mark A.; Zacchini, Stefano; Boomishankar, Ramamoorthy; Chan, Yuri; Steiner, Alexander","Alkylation and acylation of cyclotriphosphazenes.","Inorganic chemistry","2007","46","17","7097","7108","10.1021/ic7009463","","","0.71073","MoKα","","0.138","0.0693","","","0.1357","0.1577","","","","","","0.978","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339898","6.8811","0.0003","13.4032","0.0006","13.7612","0.0007","90","","100.039","0.001","90","","1249.75","0.1","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Sodium ed3a peroxotitanate(IV)","","","- C8 H13 N2 Na O9 Ti -","- C8 H13 N2 Na O9 Ti -","- C32 H52 N8 Na4 O36 Ti4 -","4","1","","Zhou, Zhao-Hui; Deng, Yuan-Fu; Liu, Qiong-Xin; Zhang, Hua-Lin; Mak, Thomas C. W.; Chow, Yuan L.","Selective ligand conversion of ethylenediamine tetraacetate to its triacetate on peroxotitanate(IV).","Inorganic chemistry","2007","46","17","6846","6848","10.1021/ic701256e","","","0.71073","MoKα","","0.0378","0.0363","","","0.0975","0.0988","","","","","","1.046","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339899","6.534","0.0005","15.1447","0.0012","12.3063","0.001","90","","99.705","0.001","90","","1200.35","0.16","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Ammonium ed3a peroxotitanium(IV)","","","- C8 H15 N3 O8 Ti -","- C8 H15 N3 O8 Ti -","- C32 H60 N12 O32 Ti4 -","4","1","","Zhou, Zhao-Hui; Deng, Yuan-Fu; Liu, Qiong-Xin; Zhang, Hua-Lin; Mak, Thomas C. W.; Chow, Yuan L.","Selective ligand conversion of ethylenediamine tetraacetate to its triacetate on peroxotitanate(IV).","Inorganic chemistry","2007","46","17","6846","6848","10.1021/ic701256e","","","0.71073","MoKα","","0.0714","0.0526","","","0.1121","0.1182","","","","","","0.994","","","","has coordinates","179501","2020-10-21","18:00:00",""
"4339900","6.5678","0.0006","7.0325","0.0006","20.0851","0.0019","95.202","0.002","96.759","0.002","107.235","0.002","872.14","0.14","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Ammonium edta peroxotitanium(IV)","","","- C10 H24 N4 O12 Ti -","- C10 H24 N4 O12 Ti -","- C20 H48 N8 O24 Ti2 -","2","1","","Zhou, Zhao-Hui; Deng, Yuan-Fu; Liu, Qiong-Xin; Zhang, Hua-Lin; Mak, Thomas C. W.; Chow, Yuan L.","Selective ligand conversion of ethylenediamine tetraacetate to its triacetate on peroxotitanate(IV).","Inorganic chemistry","2007","46","17","6846","6848","10.1021/ic701256e","","","0.71073","MoKα","","0.0913","0.0678","","","0.1552","0.1751","","","","","","1.029","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339901","20.1206","0.001","6.9698","0.0003","12.445","0.0006","90","","107.359","0.001","90","","1665.76","0.14","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Ammonium hydrogen edta peroxotitanium(IV)","","","- C10 H21 N3 O12 Ti -","- C10 H21 N3 O12 Ti -","- C40 H84 N12 O48 Ti4 -","4","1","","Zhou, Zhao-Hui; Deng, Yuan-Fu; Liu, Qiong-Xin; Zhang, Hua-Lin; Mak, Thomas C. W.; Chow, Yuan L.","Selective ligand conversion of ethylenediamine tetraacetate to its triacetate on peroxotitanate(IV).","Inorganic chemistry","2007","46","17","6846","6848","10.1021/ic701256e","","","0.71073","MoKα","","0.0405","0.0369","","","0.098","0.104","","","","","","0.978","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339902","6.2573","0.0004","9.6814","0.0006","11.1333","0.0007","90","","90","","90","","674.45","0.07","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C4 H6 Na2 O6 -","- C4 H6 Na2 O6 -","- C16 H24 Na8 O24 -","4","1","","Zhou, Zhao-Hui; Deng, Yuan-Fu; Liu, Qiong-Xin; Zhang, Hua-Lin; Mak, Thomas C. W.; Chow, Yuan L.","Selective ligand conversion of ethylenediamine tetraacetate to its triacetate on peroxotitanate(IV).","Inorganic chemistry","2007","46","17","6846","6848","10.1021/ic701256e","","","0.71073","MoKα","","0.0356","0.0354","","","0.0916","0.0918","","","","","","1.098","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339903","3.9374","0.0006","13.813","0.002","17.5","0.003","90","","90","","90","","951.8","0.3","153","2","153","2","","","","","","","","4","C m c m","-C 2c 2","63","","dipotassium tricopper uranium pentasulfide","","- Cu3 K2 S5 U -","- Cu3 K2 S5 U -","- Cu12 K8 S20 U4 -","4","0.25","","Gray, Danielle L.; Backus, Lisa A.; von Nidda, Hans-Albrecht Krug; Skanthakumar, S.; Loidl, Alois; Soderholm, L.; Ibers, James A.","A U(V) chalcogenide: synthesis, structure, and characterization of K2Cu3US5.","Inorganic chemistry","2007","46","17","6992","6996","10.1021/ic700774g","","","0.71073","MoKα","","0.025","0.0229","","","0.055","0.0554","","","","","","1.634","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339904","27.206","0.005","16.046","0.003","17.643","0.003","90","","129.913","0.002","90","","5907.6","1.9","213","2","213","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Mo2(DAniF)2]2H4","","","- C60 H64 Mo4 N8 O8 -","- C60 H64 Mo4 N8 O8 -","- C240 H256 Mo16 N32 O32 -","4","0.5","","Cotton, F. Albert; Murillo, Carlos A.; Zhao, Qinliang","A rare dimer of dimers having four hydride linkers joining two quadruply bonded dimolybdenum units.","Inorganic chemistry","2007","46","17","6858","6863","10.1021/ic701048d","","","0.71073","MoKα","","0.0293","0.026","","","0.0656","0.0688","","","","","","1.064","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339905","13.2556","0.0016","14.536","0.002","16.594","0.002","90","","104.131","0.008","90","","3100.6","0.7","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dichlorobis(1,2-bis(dimethylphosphino)benzene)gallium(III) tetrachlorogallate(III)","","- C20 H32 Cl6 Ga2 P4 -","- C20 H32 Cl6 Ga2 P4 -","- C80 H128 Cl24 Ga8 P16 -","4","0.5","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Preparation, characterization, and structural systematics of diphosphane and diarsane complexes of gallium(III) halides.","Inorganic chemistry","2007","46","17","7215","7223","10.1021/ic700895r","","","0.71073","MoKα","","0.0312","0.026","","","0.0613","0.064","","","","","","1.007","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339906","14.688","0.003","22.978","0.004","10.4931","0.0018","90","","90","","90","","3541.4","1.1","120","2","120","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Dibromobis(1,2-bis(dimethylphosphino)benzene)gallium(III) tetrabromogallate(III) dichloromethane solvate","","- C21 H34 Br6 Cl2 Ga2 P4 -","- C21 H34 Br6 Cl2 Ga2 P4 -","- C84 H136 Br24 Cl8 Ga8 P16 -","4","0.5","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Preparation, characterization, and structural systematics of diphosphane and diarsane complexes of gallium(III) halides.","Inorganic chemistry","2007","46","17","7215","7223","10.1021/ic700895r","","","0.71073","MoKα","","0.0506","0.0407","","","0.0934","0.0984","","","","","","1.07","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339907","15.223","0.002","23.406","0.004","11.0027","0.001","90","","90","","90","","3920.4","0.9","120","2","120","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Diiodobis(1,2-bis(dimethylphosphino)benzene)gallium(III) tetraiodogallate(III) dichloromethane solvate","","- C20.4 H32.8 Cl0.8 Ga2 I6 P4 -","- C20.4 H32.8 Cl0.8 Ga2 I6 P4 -","- C81.6 H131.2 Cl3.2 Ga8 I24 P16 -","4","0.5","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Preparation, characterization, and structural systematics of diphosphane and diarsane complexes of gallium(III) halides.","Inorganic chemistry","2007","46","17","7215","7223","10.1021/ic700895r","","","0.71073","MoKα","","0.071","0.0496","","","0.1143","0.1239","","","","","","1.043","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339908","10.139","0.002","10.593","0.003","16.028","0.004","72.765","0.012","87.616","0.012","89.878","0.012","1642.6","0.7","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","Dichloro(1,2-bis(diphenylphosphino)benzene)gallium(III) tetrachlorogallate(III)","","- C30 H24 Cl6 Ga2 P2 -","- C30 H24 Cl6 Ga2 P2 -","- C60 H48 Cl12 Ga4 P4 -","2","1","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Preparation, characterization, and structural systematics of diphosphane and diarsane complexes of gallium(III) halides.","Inorganic chemistry","2007","46","17","7215","7223","10.1021/ic700895r","","","0.71073","MoKα","","0.1081","0.0477","","","0.0846","0.1023","","","","","","0.979","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339909","7.4","0.0016","7.4685","0.0016","10.805","0.002","85.619","0.012","88.087","0.012","77.456","0.012","581.1","0.2","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","bis(tribromogallium(III)){mu2-1,2-bis(diethylphosphino)ethane}","","- C10 H24 Br6 Ga2 P2 -","- C10 H24 Br6 Ga2 P2 -","- C10 H24 Br6 Ga2 P2 -","1","0.5","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Preparation, characterization, and structural systematics of diphosphane and diarsane complexes of gallium(III) halides.","Inorganic chemistry","2007","46","17","7215","7223","10.1021/ic700895r","","","0.71073","MoKα","","0.0589","0.0375","","","0.0646","0.0709","","","","","","1.064","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339910","7.7763","0.0018","7.818","0.002","10.993","0.003","86.676","0.015","82.577","0.015","80.447","0.018","653.1","0.3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","1,2-bis(diethylphosphino)ethanebis(tri-iodogallium(III))","","- C10 H24 Ga2 I6 P2 -","- C10 H24 Ga2 I6 P2 -","- C10 H24 Ga2 I6 P2 -","1","0.5","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Preparation, characterization, and structural systematics of diphosphane and diarsane complexes of gallium(III) halides.","Inorganic chemistry","2007","46","17","7215","7223","10.1021/ic700895r","","","0.71073","MoKα","","0.0607","0.0383","","","0.081","0.0887","","","","","","1.065","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339911","9.941","0.002","10.111","0.003","10.206","0.002","90","","91.303","0.016","90","","1025.6","0.4","120","2","120","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dichloro(1,2-bis(dimethylarsino)benzene)gallium(III) tetrachlorogallate(III)","","- C10 H16 As2 Cl6 Ga2 -","- C10 H16 As2 Cl6 Ga2 -","- C20 H32 As4 Cl12 Ga4 -","2","0.5","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Preparation, characterization, and structural systematics of diphosphane and diarsane complexes of gallium(III) halides.","Inorganic chemistry","2007","46","17","7215","7223","10.1021/ic700895r","","","0.71073","MoKα","","0.0836","0.0668","","","0.1366","0.1463","","","","","","1.097","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339912","15.935","0.004","11.374","0.002","14.319","0.003","90","","90","","90","","2595.2","1","120","2","120","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","Di-iodo(1,2-bis(dimethylarsino)benzene)gallium(III) tetraiodogallate(III)","","- C10 H16 As2 Ga2 I6 -","- C10 H16 As2 Ga2 I6 -","- C40 H64 As8 Ga8 I24 -","4","0.5","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Preparation, characterization, and structural systematics of diphosphane and diarsane complexes of gallium(III) halides.","Inorganic chemistry","2007","46","17","7215","7223","10.1021/ic700895r","","","0.71073","MoKα","","0.1006","0.073","","","0.1361","0.1499","","","","","","1.14","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339913","10.1666","0.001","15.4125","0.0015","23.181","0.002","90","","99.036","0.005","90","","3587.2","0.6","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(triiodogallium(III)){mu2-1,2-bis(diphenylarsino)ethane}","","- C26 H24 As2 Ga2 I6 -","- C26 H24 As2 Ga2 I6 -","- C104 H96 As8 Ga8 I24 -","4","1","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Preparation, characterization, and structural systematics of diphosphane and diarsane complexes of gallium(III) halides.","Inorganic chemistry","2007","46","17","7215","7223","10.1021/ic700895r","","","0.71073","MoKα","","0.0628","0.045","","","0.0832","0.0913","","","","","","1.149","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339914","6.443","0.002","10.168","0.004","7.776","0.003","90","","113.15","0.03","90","","468.4","0.3","120","2","120","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Trichlorido(trimethylarsane)gallium(III)","","- C3 H9 As Cl3 Ga -","- C3 H9 As Cl3 Ga -","- C6 H18 As2 Cl6 Ga2 -","2","0.5","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Preparation, characterization, and structural systematics of diphosphane and diarsane complexes of gallium(III) halides.","Inorganic chemistry","2007","46","17","7215","7223","10.1021/ic700895r","","","0.71073","MoKα","","0.0599","0.0358","","","0.076","0.0838","","","","","","1.056","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339915","7.103","0.002","11.444","0.004","8.076","0.003","90","","114.43","0.02","90","","597.7","0.4","120","2","120","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Tri-iodido(trimethylarsane)gallium(III)","","- C3 H9 As Ga I3 -","- C3 H9 As Ga I3 -","- C6 H18 As2 Ga2 I6 -","2","0.5","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Preparation, characterization, and structural systematics of diphosphane and diarsane complexes of gallium(III) halides.","Inorganic chemistry","2007","46","17","7215","7223","10.1021/ic700895r","","","0.71073","MoKα","","0.0416","0.0284","","","0.058","0.0614","","","","","","1.079","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339916","6.677","0.003","10.674","0.006","7.877","0.004","90","","113.57","0.03","90","","514.6","0.5","120","2","120","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Tribromido(trimethylarsane)gallium(III)","","- C3 H9 As Br3 Ga -","- C3 H9 As Br3 Ga -","- C6 H18 As2 Br6 Ga2 -","2","0.5","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Preparation, characterization, and structural systematics of diphosphane and diarsane complexes of gallium(III) halides.","Inorganic chemistry","2007","46","17","7215","7223","10.1021/ic700895r","","","0.71073","MoKα","","0.132","0.0498","","","0.0809","0.0999","","","","","","0.978","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339917","9.206","0.003","19.809","0.006","11.727","0.004","90","","99.259","0.003","90","","2110.7","1.2","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C30 H34 Cl5.5 I3 N3 O U -","- C30 H34 Cl5.39 I3 N3 O U -","- C60 H68 Cl10.78 I6 N6 O2 U2 -","2","1","","Chomitz, Wayne A.; Minasian, Stefan G.; Sutton, Andrew D.; Arnold, John","Synthesis and reactivity of metal complexes supported by the tetradentate monoanionic ligand bis(2-picolyl)(2-hydroxy-3,5-di-tert-butylbenzyl)amide (BPPA).","Inorganic chemistry","2007","46","17","7199","7209","10.1021/ic700775k","","","0.71073","MoKα","","0.0743","0.0718","","","0.1746","0.1757","","","","","","1.122","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339918","9.1303","0.0007","27.55","0.002","12.3044","0.0009","90","","93.26","0.001","90","","3090","0.4","120.2","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H36 Br2 Cl2 N3 O V -","- C28 H36 Br2 Cl2 N3 O V -","- C112 H144 Br8 Cl8 N12 O4 V4 -","4","1","","Chomitz, Wayne A.; Minasian, Stefan G.; Sutton, Andrew D.; Arnold, John","Synthesis and reactivity of metal complexes supported by the tetradentate monoanionic ligand bis(2-picolyl)(2-hydroxy-3,5-di-tert-butylbenzyl)amide (BPPA).","Inorganic chemistry","2007","46","17","7199","7209","10.1021/ic700775k","","","0.7107","MoKα","","0.0765","0.0436","","0.057","","0.053","","","","","","2.05","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339919","9.536","0.002","10.359","0.002","28.345","0.004","98.173","0.002","92.209","0.002","110.14","0.002","2590.5","0.8","141.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C56 H75 N3 O5 Zr -","- C56 H46 N3 O5 Zr -","- C112 H92 N6 O10 Zr2 -","2","1","","Chomitz, Wayne A.; Minasian, Stefan G.; Sutton, Andrew D.; Arnold, John","Synthesis and reactivity of metal complexes supported by the tetradentate monoanionic ligand bis(2-picolyl)(2-hydroxy-3,5-di-tert-butylbenzyl)amide (BPPA).","Inorganic chemistry","2007","46","17","7199","7209","10.1021/ic700775k","","","0.7107","MoKα","","0.0854","0.0568","","0.0763","","0.071","","","","","","2.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339920","25.8252","0.0019","25.8252","0.0019","19.463","0.003","90","","90","","90","","12981","2","193","2","193","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28.75 H37.5 Al Cl5.5 N3 O -","- C28.75 H36 Al Cl5.5 N3 O -","- C460 H576 Al16 Cl88 N48 O16 -","16","1","","Chomitz, Wayne A.; Minasian, Stefan G.; Sutton, Andrew D.; Arnold, John","Synthesis and reactivity of metal complexes supported by the tetradentate monoanionic ligand bis(2-picolyl)(2-hydroxy-3,5-di-tert-butylbenzyl)amide (BPPA).","Inorganic chemistry","2007","46","17","7199","7209","10.1021/ic700775k","","","0.7749","","","0.0862","0.058","","","0.1405","0.1489","","","","","","0.91","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339921","25.908","0.003","25.908","0.003","19.64","0.002","90","","90","","90","","13183","3","155.2","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28.5 H37 Cl5.5 N3 O Ti -","- C28.5 H36 Cl5.5 N3 O Ti -","- C456 H576 Cl88 N48 O16 Ti16 -","16","1","","Chomitz, Wayne A.; Minasian, Stefan G.; Sutton, Andrew D.; Arnold, John","Synthesis and reactivity of metal complexes supported by the tetradentate monoanionic ligand bis(2-picolyl)(2-hydroxy-3,5-di-tert-butylbenzyl)amide (BPPA).","Inorganic chemistry","2007","46","17","7199","7209","10.1021/ic700775k","","","0.7107","MoKα","","0.0694","0.0459","","0.0636","","0.0605","","","","","","2.287","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339922","28.218","0.002","28.218","0.002","15.866","0.0009","90","","90","","90","","12633.4","1.5","157.2","","","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28 H36 Cl4 N3 O Y -","- C28 H34 Cl4 N3 O Y -","- C448 H544 Cl64 N48 O16 Y16 -","16","1","","Chomitz, Wayne A.; Minasian, Stefan G.; Sutton, Andrew D.; Arnold, John","Synthesis and reactivity of metal complexes supported by the tetradentate monoanionic ligand bis(2-picolyl)(2-hydroxy-3,5-di-tert-butylbenzyl)amide (BPPA).","Inorganic chemistry","2007","46","17","7199","7209","10.1021/ic700775k","","","0.7107","MoKα","","0.0851","0.044","","0.056","","0.0514","","","","","","2.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339923","25.573","0.004","25.573","0.004","19.42","0.005","90","","90","","90","","12700","4","453","2","453","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C29 H34 Cl5.1 Ga N3 O -","- C29 H34 Cl5.1 Ga N3 O -","- C464 H544 Cl81.6 Ga16 N48 O16 -","16","1","","Chomitz, Wayne A.; Minasian, Stefan G.; Sutton, Andrew D.; Arnold, John","Synthesis and reactivity of metal complexes supported by the tetradentate monoanionic ligand bis(2-picolyl)(2-hydroxy-3,5-di-tert-butylbenzyl)amide (BPPA).","Inorganic chemistry","2007","46","17","7199","7209","10.1021/ic700775k","","","0.71073","MoKα","","0.162","0.0862","","","0.2407","0.2528","","","","","","1.01","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339924","19.0404","0.0018","13.3413","0.0012","13.7702","0.0013","90","","90","","90","","3498","0.6","123","2","123","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C25.5 H48 Cl2 N12 O2 P4 Ru -","- C25.5 H48 Cl2 N12 O2 P4 Ru -","- C102 H192 Cl8 N48 O8 P16 Ru4 -","4","1","","Mebi, Charles A.; Frost, Brian J.","Isomerization of trans-[Ru(PTA)4Cl2] to cis-[Ru(PTA)4Cl2] in water and organic solvent: revisiting the chemistry of [Ru(PTA)4Cl2].","Inorganic chemistry","2007","46","17","7115","7120","10.1021/ic700971n","","","0.71073","MoKα","","0.0936","0.054","","","0.0941","0.1042","","","","","","0.826","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4339925","10.8018","0.0002","15.77","0.0002","21.683","0.0003","90","","97.66","","90","","3660.62","0.1","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H62 N12 O6.25 P4 Ru -","- C24 H62 N12 O6.25 P4 Ru -","- C96 H248 N48 O25 P16 Ru4 -","4","1","","Mebi, Charles A.; Frost, Brian J.","Isomerization of trans-[Ru(PTA)4Cl2] to cis-[Ru(PTA)4Cl2] in water and organic solvent: revisiting the chemistry of [Ru(PTA)4Cl2].","Inorganic chemistry","2007","46","17","7115","7120","10.1021/ic700971n","","","0.71073","MoKα","","0.0573","0.0345","","","0.0683","0.077","","","","","","1.021","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339926","7.0868","0.0003","16.9811","0.0008","30.3358","0.0015","90","","90","","90","","3650.7","0.3","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C40 H40 N6 Pt -","- C40 H40 N6 Pt -","- C160 H160 N24 Pt4 -","4","1","","Chang, Sheng-Yuan; Kavitha, Jakka; Hung, Jui-Yi; Chi, Yun; Cheng, Yi-Ming; Li, Elise Y.; Chou, Pi-Tai; Lee, Gene-Hsiang; Carty, Arthur J.","Luminescent platinum(II) complexes containing isoquinolinyl indazolate ligands: synthetic reaction pathway and photophysical properties.","Inorganic chemistry","2007","46","17","7064","7074","10.1021/ic700877n","","","0.71073","MoKα","","0.0594","0.0553","","","0.1261","0.128","","","","","","1.295","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339927","10.4558","0.0001","19.501","0.0002","10.8625","0.0001","90","","96.9912","0.0008","90","","2198.38","0.04","150","1","150","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C26 H24 N4 O2 Pt -","- C26 H24 N4 O2 Pt -","- C104 H96 N16 O8 Pt4 -","4","2","","Chang, Sheng-Yuan; Kavitha, Jakka; Hung, Jui-Yi; Chi, Yun; Cheng, Yi-Ming; Li, Elise Y.; Chou, Pi-Tai; Lee, Gene-Hsiang; Carty, Arthur J.","Luminescent platinum(II) complexes containing isoquinolinyl indazolate ligands: synthetic reaction pathway and photophysical properties.","Inorganic chemistry","2007","46","17","7064","7074","10.1021/ic700877n","","","0.71073","MoKα","","0.0277","0.0262","","","0.064","0.0647","","","","","","1.038","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339928","8.1514","0.0001","10.0314","0.0002","12.0138","0.0002","81.8893","0.0009","85.7748","0.0011","83.3597","0.001","964.37","0.03","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C20 H21 Cl2 N3 Pt -","- C20 H21 Cl2 N3 Pt -","- C40 H42 Cl4 N6 Pt2 -","2","1","","Chang, Sheng-Yuan; Kavitha, Jakka; Hung, Jui-Yi; Chi, Yun; Cheng, Yi-Ming; Li, Elise Y.; Chou, Pi-Tai; Lee, Gene-Hsiang; Carty, Arthur J.","Luminescent platinum(II) complexes containing isoquinolinyl indazolate ligands: synthetic reaction pathway and photophysical properties.","Inorganic chemistry","2007","46","17","7064","7074","10.1021/ic700877n","","","0.71073","MoKα","","0.0356","0.0288","","","0.0647","0.067","","","","","","1.1","","","","has coordinates,has disorder","179502","2020-10-21","18:00:00",""
"4339929","27.741","0.006","11.365","0.002","13.468","0.003","90","","102.735","0.002","90","","4141.7","1.5","120","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C17 H18 Cu2 F3 N4 O5 S -","- C17 H18 Cu2 F3 N4 O5 S -","- C136 H144 Cu16 F24 N32 O40 S8 -","8","1","","Yang, Lei; Powell, Douglas R.; Klein, Eric L.; Grohmann, Andreas; Houser, Robert P.","Delocalized mixed-valence bi- and trinuclear complexes with short Cu-Cu bonds.","Inorganic chemistry","2007","46","17","6831","6833","10.1021/ic7010474","","","0.71073","MoKα","","0.1174","0.0566","","","0.1191","0.14","","","","","","1.03","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339930","22.117","0.003","15.28","0.002","21.38","0.003","90","","90","","90","","7225.3","1.7","100","2","100","2","","","","","","","","8","P c c n","-P 2ab 2ac","56","","","","- C31 H44 Cu3 F3 N6 Na O8 S -","- C26 H34 Cu3 N6 Na0.5 O4 -","- C208 H272 Cu24 N48 Na4 O32 -","8","1","","Yang, Lei; Powell, Douglas R.; Klein, Eric L.; Grohmann, Andreas; Houser, Robert P.","Delocalized mixed-valence bi- and trinuclear complexes with short Cu-Cu bonds.","Inorganic chemistry","2007","46","17","6831","6833","10.1021/ic7010474","","","0.71073","MoKα","","0.0344","0.0284","","","0.0747","0.077","","","","","","1.005","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339931","12.633","0.003","19.231","0.005","15.626","0.005","90","","93.685","0.009","90","","3788.4","1.8","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C31 H44.97 Cu3 F3 N6 Na O9 S -","- C31 H44.968 Cu3 F3 N6 Na O9 S -","- C124 H179.872 Cu12 F12 N24 Na4 O36 S4 -","4","1","","Yang, Lei; Powell, Douglas R.; Klein, Eric L.; Grohmann, Andreas; Houser, Robert P.","Delocalized mixed-valence bi- and trinuclear complexes with short Cu-Cu bonds.","Inorganic chemistry","2007","46","17","6831","6833","10.1021/ic7010474","","","0.71073","MoKα","","0.123","0.0567","","","0.1038","0.114","","","","","","1.002","","","","has coordinates,has disorder","179502","2020-10-21","18:00:00",""
"4339932","20.73","0.004","8.6418","0.0016","19.063","0.004","90","","90","","90","","3415","1.2","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H50 Cr N3 O -","- C37 H50 Cr N3 O -","- C148 H200 Cr4 N12 O4 -","4","1","","Vidyaratne, Indu; Scott, Jennifer; Gambarotta, Sandro; Budzelaar, Peter H. M.","Dinitrogen activation, partial reduction, and formation of coordinated imide promoted by a chromium diiminepyridine complex.","Inorganic chemistry","2007","46","17","7040","7049","10.1021/ic700810f","","","0.71073","MoKα","","0.0499","0.0425","","","0.1102","0.1159","","","","","","1.049","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339933","25.143","0.003","11.5634","0.0014","30.241","0.004","90","","113.095","0.002","90","","8087.6","1.7","213","2","213","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H56 Cr N4 O1.5 -","- C39 H56 Cr N4 O1.5 -","- C312 H448 Cr8 N32 O12 -","8","1","","Vidyaratne, Indu; Scott, Jennifer; Gambarotta, Sandro; Budzelaar, Peter H. M.","Dinitrogen activation, partial reduction, and formation of coordinated imide promoted by a chromium diiminepyridine complex.","Inorganic chemistry","2007","46","17","7040","7049","10.1021/ic700810f","","","0.71073","MoKα","","0.0838","0.0674","","","0.1757","0.187","","","","","","1.086","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4339934","18.148","0.003","18.561","0.003","21.219","0.003","90","","103.198","0.002","90","","6958.7","1.9","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C74 H102 Cr2 N8 Na2 O2 -","- C74 H102 Cr2 N8 Na2 O2 -","- C296 H408 Cr8 N32 Na8 O8 -","4","1","","Vidyaratne, Indu; Scott, Jennifer; Gambarotta, Sandro; Budzelaar, Peter H. M.","Dinitrogen activation, partial reduction, and formation of coordinated imide promoted by a chromium diiminepyridine complex.","Inorganic chemistry","2007","46","17","7040","7049","10.1021/ic700810f","","","0.71073","MoKα","","0.08","0.0536","","","0.1357","0.1561","","","","","","1.049","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339935","12.024","0.003","16.623","0.005","18.556","0.005","90","","99.425","0.005","90","","3658.8","1.7","208","2","208","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H52 Cr N4 Na O -","- C37 H52 Cr N4 Na O -","- C148 H208 Cr4 N16 Na4 O4 -","4","1","","Vidyaratne, Indu; Scott, Jennifer; Gambarotta, Sandro; Budzelaar, Peter H. M.","Dinitrogen activation, partial reduction, and formation of coordinated imide promoted by a chromium diiminepyridine complex.","Inorganic chemistry","2007","46","17","7040","7049","10.1021/ic700810f","","","0.71073","MoKα","","0.1191","0.0789","","","0.165","0.1855","","","","","","1.051","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339936","17.776","0.006","15.697","0.005","17.961","0.006","90","","100.11","0.04","90","","4934","3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","sigma-Phenyl N-fused porphyrin chloride","","- C56.53 H45.06 B Cl6.06 N4 -","- C56.5242 H45.0484 B Cl6.0484 N4 -","- C226.097 H180.194 B4 Cl24.1936 N16 -","4","1","","Młodzianowska, Anna; Latos-Grazyński, Lechosław; Szterenberg, Ludmiła; Stepień, Marcin","Single-boron complexes of N-confused and N-fused porphyrins.","Inorganic chemistry","2007","46","17","6950","6957","10.1021/ic700647v","","","1.5418","CuKα","","0.0871","0.0625","","","0.1827","0.2002","","","","","","1.041","","","","has coordinates,has disorder","179502","2020-10-21","18:00:00",""
"4339937","16.9583","0.0008","16.346","0.0007","10.388","0.0006","90","","108.779","0.002","90","","2726.3","0.2","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H30 Co O6 -","- C32 H30 Co O6 -","- C128 H120 Co4 O24 -","4","0.5","","Barrios, Leoní A; Ribas, Joan; Aromí, Guillem; Ribas-Ariño, Jordi; Gamez, Patrick; Roubeau, Olivier; Teat, Simon J.","Preparation and structure of three solvatomorphs of the polymer [Co(dbm)2(4ptz)]n: spin canting depending on the supramolecular organization.","Inorganic chemistry","2007","46","17","7154","7162","10.1021/ic7004979","","","0.71073","MoKα","","0.0667","0.041","","","0.0988","0.1107","","","","","","0.993","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339938","12.1547","0.0005","13.4488","0.0005","15.7972","0.0007","71.85","0.002","71.099","0.002","70.895","0.002","2246.7","0.16","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H42 Co N6 O5 -","- C52 H42 Co N6 O5 -","- C104 H84 Co2 N12 O10 -","2","1","","Barrios, Leoní A; Ribas, Joan; Aromí, Guillem; Ribas-Ariño, Jordi; Gamez, Patrick; Roubeau, Olivier; Teat, Simon J.","Preparation and structure of three solvatomorphs of the polymer [Co(dbm)2(4ptz)]n: spin canting depending on the supramolecular organization.","Inorganic chemistry","2007","46","17","7154","7162","10.1021/ic7004979","","","0.8457","synchrotron","","0.0547","0.0457","","","0.1178","0.123","","","","","","1.064","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339939","10.5892","0.0008","26.548","0.002","17.1856","0.0014","90","","104.898","0.002","90","","4668.8","0.6","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C53 H45 Co N6 O5.25 -","- C53 H45 Co N6 O5.25 -","- C212 H180 Co4 N24 O21 -","4","1","","Barrios, Leoní A; Ribas, Joan; Aromí, Guillem; Ribas-Ariño, Jordi; Gamez, Patrick; Roubeau, Olivier; Teat, Simon J.","Preparation and structure of three solvatomorphs of the polymer [Co(dbm)2(4ptz)]n: spin canting depending on the supramolecular organization.","Inorganic chemistry","2007","46","17","7154","7162","10.1021/ic7004979","","","0.8457","synchrotron","","0.0607","0.0552","","","0.1531","0.1577","","","","","","1.032","","","","has coordinates,has disorder","179502","2020-10-21","18:00:00",""
"4339940","51.366","0.0006","15.024","0.0002","16.383","0.0002","90","","107.887","0.0006","90","","12032","0.3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C68 H49 Cl2 Ir2 N9 O8 -","- C68 H49 Cl2 Ir2 N9 O8 -","- C544 H392 Cl16 Ir16 N72 O64 -","8","1","","Auffrant, Audrey; Barbieri, Andrea; Barigelletti, Francesco; Lacour, Jérôme; Mobian, Pierre; Collin, Jean-Paul; Sauvage, Jean-Pierre; Ventura, Barbara","Bimetallic iridium(III) complexes consisting of Ir(ppy)(2) units (ppy = 2-phenylpyridine) and two laterally connected N/Ν chelates as bridge: synthesis, separation, and photophysical properties.","Inorganic chemistry","2007","46","17","6911","6919","10.1021/ic700494e","","","0.71073","MoKα","","0.1014","0.0593","","","0.0843","0.0936","","","","","","1.053","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339941","13.801","0.007","31.931","0.015","14.241","0.008","90","","116.438","0.019","90","","5619","5","200","2","200","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C46 H47 Ag F18 N11 P3 Ru2 S2 -","- C46 H47 Ag F18 N11 P3 Ru2 S2 -","- C184 H188 Ag4 F72 N44 P12 Ru8 S8 -","4","1","","Tamura, Motoshi; Matsuura, Noriyuki; Kawamoto, Tatsuya; Konno, Takumi","Thiolato-bridged RuIIAgIRuII trinuclear complex composed of bis(bipyridine)ruthenium(II) units with chelating 2-aminoethanethiolate: conversion to a disulfide-bridged RuIIRuII dinuclear complex.","Inorganic chemistry","2007","46","17","6834","6836","10.1021/ic700572r","","","0.71075","MoKα","","0.0905","0.0398","","","0.0692","0.074","","","","","","0.725","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339942","13.802","0.006","17.587","0.007","12.701","0.005","90","","114.89","0.013","90","","2797","2","200","2","200","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C44 H46 F24 N10 O P4 Ru2 S2 -","- C44 H44 F24 N10 O P4 Ru2 S2 -","- C88 H88 F48 N20 O2 P8 Ru4 S4 -","2","0.5","","Tamura, Motoshi; Matsuura, Noriyuki; Kawamoto, Tatsuya; Konno, Takumi","Thiolato-bridged RuIIAgIRuII trinuclear complex composed of bis(bipyridine)ruthenium(II) units with chelating 2-aminoethanethiolate: conversion to a disulfide-bridged RuIIRuII dinuclear complex.","Inorganic chemistry","2007","46","17","6834","6836","10.1021/ic700572r","","","0.71075","MoKα","","0.1262","0.0738","","","0.1459","0.1681","","","","","","1.022","","","","has coordinates,has disorder","179502","2020-10-21","18:00:00",""
"4339943","6.9494","0.0018","9.931","0.003","10.116","0.003","89.719","0.007","72.531","0.006","86.593","0.007","664.7","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- Mo Nd2 O14 Te4 -","- Mo Nd2 O14 Te4 -","- Mo2 Nd4 O28 Te8 -","2","1","","Jiang, Hai-Long; Ma, En; Mao, Jiang-Gao","New luminescent solids in the Ln-W(Mo)-Te-O-(Cl) systems.","Inorganic chemistry","2007","46","17","7012","7023","10.1021/ic700793n","","","0.71073","MoKα","","0.0249","0.0199","","","0.0405","0.042","","","","","","1.025","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339944","7.635","0.003","18.211","0.006","18.217","0.009","90","","96.866","0.006","90","","2514.7","1.8","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- Cl3 Nd5 O23 Te7 W -","- Cl3 Nd5 O23 Te7 W -","- Cl12 Nd20 O92 Te28 W4 -","4","0.5","","Jiang, Hai-Long; Ma, En; Mao, Jiang-Gao","New luminescent solids in the Ln-W(Mo)-Te-O-(Cl) systems.","Inorganic chemistry","2007","46","17","7012","7023","10.1021/ic700793n","","","0.71073","MoKα","","0.0278","0.0225","","","0.0446","0.0455","","","","","","0.959","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339945","7.64","0.0015","18.2","0.004","18.21","0.004","90","","97.04","0.03","90","","2513","0.9","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- Cl3 Mo O23 Pr5 Te7 -","- Cl3 Mo O23 Pr5 Te7 -","- Cl12 Mo4 O92 Pr20 Te28 -","4","0.5","","Jiang, Hai-Long; Ma, En; Mao, Jiang-Gao","New luminescent solids in the Ln-W(Mo)-Te-O-(Cl) systems.","Inorganic chemistry","2007","46","17","7012","7023","10.1021/ic700793n","","","0.71073","MoKα","","0.0375","0.027","","","0.0524","0.0562","","","","","","1.105","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339946","6.9894","0.0018","9.964","0.003","10.157","0.003","89.669","0.007","72.434","0.006","86.546","0.007","673.1","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- Mo O14 Pr2 Te4 -","- Mo O14 Pr2 Te4 -","- Mo2 O28 Pr4 Te8 -","2","1","","Jiang, Hai-Long; Ma, En; Mao, Jiang-Gao","New luminescent solids in the Ln-W(Mo)-Te-O-(Cl) systems.","Inorganic chemistry","2007","46","17","7012","7023","10.1021/ic700793n","","","0.71073","MoKα","","0.0248","0.021","","","0.0441","0.0454","","","","","","1.015","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339947","7.669","0.002","18.261","0.006","18.324","0.006","90","","97.037","0.001","90","","2546.8","1.4","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- Cl3 O23 Pr5 Te7 W -","- Cl3 O23 Pr5 Te7 W -","- Cl12 O92 Pr20 Te28 W4 -","4","0.5","","Jiang, Hai-Long; Ma, En; Mao, Jiang-Gao","New luminescent solids in the Ln-W(Mo)-Te-O-(Cl) systems.","Inorganic chemistry","2007","46","17","7012","7023","10.1021/ic700793n","","","0.71073","MoKα","","0.0289","0.0249","","","0.0584","0.0604","","","","","","1.051","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339948","6.8415","0.0004","6.8415","0.0004","19.958","0.002","90","","90","","120","","809","0.11","293","2","293","2","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","","","- La2 O18 Te6 W -","- La2 O18 Te6 W -","- La4 O36 Te12 W2 -","2","0.166667","","Jiang, Hai-Long; Ma, En; Mao, Jiang-Gao","New luminescent solids in the Ln-W(Mo)-Te-O-(Cl) systems.","Inorganic chemistry","2007","46","17","7012","7023","10.1021/ic700793n","","","0.71073","MoKα","","0.029","0.0255","","","0.0574","0.0592","","","","","","1.097","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339949","6.647","0.003","6.905","0.003","11.525","0.005","90.307","0.007","98.116","0.006","93.658","0.01","522.5","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- Nd2 O13 Te2 W2 -","- Nd2 O13 Te2 W2 -","- Nd4 O26 Te4 W4 -","2","1","","Jiang, Hai-Long; Ma, En; Mao, Jiang-Gao","New luminescent solids in the Ln-W(Mo)-Te-O-(Cl) systems.","Inorganic chemistry","2007","46","17","7012","7023","10.1021/ic700793n","","","0.71073","MoKα","","0.0244","0.0197","","","0.0438","0.0449","","","","","","1.036","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4339950","7.64","0.0008","18.1961","0.0016","18.2082","0.0019","90","","97.042","0.006","90","","2512.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- Cl3 Mo Nd5 O23 Te7 -","- Cl3 Mo Nd5 O23 Te7 -","- Cl12 Mo4 Nd20 O92 Te28 -","4","0.5","","Jiang, Hai-Long; Ma, En; Mao, Jiang-Gao","New luminescent solids in the Ln-W(Mo)-Te-O-(Cl) systems.","Inorganic chemistry","2007","46","17","7012","7023","10.1021/ic700793n","","","0.71073","MoKα","","0.0504","0.0378","","","0.0706","0.0759","","","","","","1.08","","","","has coordinates","179502","2020-10-21","18:00:00",""
"4343821","4.0639","","4.0639","","25.735","","90","","90","","90","","425.021","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","La2.89 Nb1.11 S2 O5 I0.22","","- I0.22 La2.89 Nb1.11 O5 S2 -","- I0.225 La2.8872 Nb1.1128 O5 S2 -","- I0.45 La5.7744 Nb2.2256 O10 S4 -","2","0.0625","","Cario, L.; Popa, A.F.; Adamson, P.; Lafond, A.; Guillot-Deudon, C.; Kabbour, H.; Clarke, S.J.; Meerschaut, A.","Cation deficient layered Ruddlesden-Popper-related oxysulfides La2 Ln M S2 O5 (Ln = La, Y; M = Nb, Ta)","Inorganic Chemistry","2007","46","","9584","9590","","","","","","","","","","","","","","","","","","","","","","has coordinates","150557","2020-10-21","18:00:00",""
"4343883","6.58","","13.5288","","9.3224","","90","","106.242","","90","","796.754","","","","","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- As4 S4 -","- As4 S4 -","- As16 S16 -","4","1","","Naumov, P.; Makreski, P.; Jovanovski, G.","Direct atomic scale observation of linkage isomerization of As4 S4 clusters during the photoinduced transition of realgar to pararealgar","Inorganic Chemistry","2007","46","","10624","10631","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4503888","14.711","0.003","7.8183","0.0012","14.539","0.003","90","","90","","90","","1672.2","0.5","295","2","295","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","[2ClPy]2[CuCl4]","","","- C10 H10 Cl6 Cu N2 -","- C10 H10 Cl6 Cu N2 -","- C40 H40 Cl24 Cu4 N8 -","4","0.5","","Awwadi, Firas F.; Willett, Roger D.; Twamley, Brendan","The Aryl Chlorine−Halide Ion Synthon and Its Role in the Control of the Crystal Structures of Tetrahalocuprate(II) Ions","Crystal Growth & Design","2007","7","4","624","","10.1021/cg060153j","","","0.71073","MoKα","","0.1185","0.0581","","","0.1104","0.1341","","","","","","1.031","","","","has coordinates","179573","2020-10-21","18:00:00",""
"4503889","15.065","0.0012","9.0869","0.0007","14.4778","0.0011","90","","117.967","0.001","90","","1750.5","0.2","297","2","297","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[2ClPy]2[CuBr4]","","","- C10 H10 Br4 Cl2 Cu N2 -","- C10 H10 Br4 Cl2 Cu N2 -","- C40 H40 Br16 Cl8 Cu4 N8 -","4","1","","Awwadi, Firas F.; Willett, Roger D.; Twamley, Brendan","The Aryl Chlorine−Halide Ion Synthon and Its Role in the Control of the Crystal Structures of Tetrahalocuprate(II) Ions","Crystal Growth & Design","2007","7","4","624","","10.1021/cg060153j","","","0.71073","MoKα","","0.0313","0.024","","","0.0567","0.0595","","","","","","1.029","","","","has coordinates","179573","2020-10-21","18:00:00",""
"4503890","6.9797","0.0014","9.534","0.002","14.017","0.003","99.49","0.02","90.77","0.02","93.85","0.02","917.6","0.3","295","2","295","2","","","","","","","","7","P -1","-P 1","2","[3ClPy]2[CuBr4] + H2O","","","- C10 H12 Br4 Cl2 Cu N2 O -","- C10 H12 Br4 Cl2 Cu N2 O -","- C20 H24 Br8 Cl4 Cu2 N4 O2 -","2","1","","Awwadi, Firas F.; Willett, Roger D.; Twamley, Brendan","The Aryl Chlorine−Halide Ion Synthon and Its Role in the Control of the Crystal Structures of Tetrahalocuprate(II) Ions","Crystal Growth & Design","2007","7","4","624","","10.1021/cg060153j","","","0.71073","MoKα","","0.107","0.0593","","","0.1166","0.1358","","","","","","1.021","","","","has coordinates","179573","2020-10-21","18:00:00",""
"4503891","7.3132","0.0011","7.7748","0.0016","15.489","0.003","81.657","0.014","79.763","0.012","69.285","0.013","807.4","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","[3ClPy]2[CuCl4]","","","- C10 H10 Cl6 Cu N2 -","- C10 H10 Cl6 Cu N2 -","- C20 H20 Cl12 Cu2 N4 -","2","1","","Awwadi, Firas F.; Willett, Roger D.; Twamley, Brendan","The Aryl Chlorine−Halide Ion Synthon and Its Role in the Control of the Crystal Structures of Tetrahalocuprate(II) Ions","Crystal Growth & Design","2007","7","4","624","","10.1021/cg060153j","","","0.71073","MoKα","","0.0504","0.0375","","","0.0876","0.0966","","","","","","1.063","","","","has coordinates","179573","2020-10-21","18:00:00",""
"4503892","17.01","0.002","7.6734","0.0009","13.8038","0.0017","90","","98.446","0.01","90","","1782.2","0.4","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[4ClPy]2[CuBr4]","","","- C10 H10 Br4 Cl2 Cu N2 -","- C10 H10 Br4 Cl2 Cu N2 -","- C40 H40 Br16 Cl8 Cu4 N8 -","4","0.5","","Awwadi, Firas F.; Willett, Roger D.; Twamley, Brendan","The Aryl Chlorine−Halide Ion Synthon and Its Role in the Control of the Crystal Structures of Tetrahalocuprate(II) Ions","Crystal Growth & Design","2007","7","4","624","","10.1021/cg060153j","","","0.71073","MoKα","","0.0757","0.0461","","","0.1142","0.1379","","","","","","1.065","","","","has coordinates","179573","2020-10-21","18:00:00",""
"4503893","7.6729","0.0018","27.637","0.007","8.7277","0.0014","90","","115.792","0.014","90","","1666.4","0.7","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[4ClPy]2[CuCL4] polymorph 1","","","- C10 H10 Cl6 Cu N2 -","- C10 H10 Cl6 Cu N2 -","- C40 H40 Cl24 Cu4 N8 -","4","1","","Awwadi, Firas F.; Willett, Roger D.; Twamley, Brendan","The Aryl Chlorine−Halide Ion Synthon and Its Role in the Control of the Crystal Structures of Tetrahalocuprate(II) Ions","Crystal Growth & Design","2007","7","4","624","","10.1021/cg060153j","","","0.71073","MoKα","","0.0875","0.0499","","","0.1006","0.1151","","","","","","1.008","","","","has coordinates","179573","2020-10-21","18:00:00",""
"4503894","16.297","0.004","7.4692","0.0015","13.738","0.003","90","","98.78","0.03","90","","1652.7","0.7","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[4-ClPy][CuCl4] polymorph 2","","","- C10 H10 Cl6 Cu N2 -","- C10 H10 Cl6 Cu N2 -","- C40 H40 Cl24 Cu4 N8 -","4","0.5","","Awwadi, Firas F.; Willett, Roger D.; Twamley, Brendan","The Aryl Chlorine−Halide Ion Synthon and Its Role in the Control of the Crystal Structures of Tetrahalocuprate(II) Ions","Crystal Growth & Design","2007","7","4","624","","10.1021/cg060153j","","","0.71073","MoKα","","0.0577","0.0389","","","0.0895","0.099","","","","","","1.039","","","","has coordinates","179573","2020-10-21","18:00:00",""
"4503895","55.83","0.03","5.559","0.003","9.734","0.002","90","","100.042","0.006","90","","2975","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","RS-atenolol","","- C14 H22 N2 O3 -","- C14 H22 N2 O3 -","- C112 H176 N16 O24 -","8","1","","Esteves de Castro, R. A.; Canotilho, João; Barbosa, Rui M.; Silva, M. Ramos; Beja, A. Matos; Paixão, J. A.; Redinha, J. Simões","Conformational Isomorphism of Organic Crystals: Racemic and Homochiral Atenolol","Crystal Growth & Design","2007","7","3","496","","10.1021/cg0601857","","","1.5418","CuKα","","0.1505","0.1296","","","0.3867","0.4145","","","","","","1.803","","","","has coordinates,has disorder","179573","2020-10-21","18:00:00",""
"4503896","54.43","0.03","5.712","0.003","9.676","0.002","90","","99.51","0.006","90","","2967","2","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","S-atenolol","","- C28 H44 N4 O6 -","- C28 H38 N4 O6 -","- C112 H152 N16 O24 -","4","1","","Esteves de Castro, R. A.; Canotilho, João; Barbosa, Rui M.; Silva, M. Ramos; Beja, A. Matos; Paixão, J. A.; Redinha, J. Simões","Conformational Isomorphism of Organic Crystals: Racemic and Homochiral Atenolol","Crystal Growth & Design","2007","7","3","496","","10.1021/cg0601857","","","1.5418","CuKα","","0.099","0.0746","","","0.1891","0.2097","","","","","","1.055","","","","has coordinates,has disorder","179573","2020-10-21","18:00:00",""
"4503897","13.435","0.003","16","0.004","14.127","0.003","90","","95.479","0.004","90","","3022.9","1.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H56 Cd3 N12 O16 S2 -","- C56 H56 Cd3 N12 O16 S2 -","- C112 H112 Cd6 N24 O32 S4 -","2","0.5","","Lu, Zhenda; Wen, Lili; Ni, Zhaoping; Li, Yizhi; Zhu, Huizhen; Meng, Qingjin","Syntheses, Structures, and Photoluminescent and Magnetic Studies of Metal−Organic Frameworks Assembled with 5-Sulfosalicylic Acid and 1,4-Bis(imidazol-1-ylmethyl)-benzene","Crystal Growth & Design","2007","7","2","268","","10.1021/cg060287x","","","0.71073","MoKα","","0.0486","0.0353","","","0.0812","0.085","","","","","","1.016","","","","has coordinates","179573","2020-10-21","18:00:00",""
"4503898","24.7921","0.0011","16.7848","0.0011","18.9685","0.001","90","","116.37","0.001","90","","7072","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H36 Co N8 O8 S -","- C35 H36 Co N8 O8 S -","- C280 H288 Co8 N64 O64 S8 -","8","1","","Lu, Zhenda; Wen, Lili; Ni, Zhaoping; Li, Yizhi; Zhu, Huizhen; Meng, Qingjin","Syntheses, Structures, and Photoluminescent and Magnetic Studies of Metal−Organic Frameworks Assembled with 5-Sulfosalicylic Acid and 1,4-Bis(imidazol-1-ylmethyl)-benzene","Crystal Growth & Design","2007","7","2","268","","10.1021/cg060287x","","","0.71073","MoKα","","0.0649","0.0449","","","0.1341","0.1459","","","","","","1.058","","","","has coordinates","179573","2020-10-21","18:00:00",""
"4503899","24.6836","0.0016","16.73","0.001","18.9155","0.001","90","","116.116","0.002","90","","7013.8","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H36 N8 Ni O8 S -","- C35 H36 N8 Ni O8 S -","- C280 H288 N64 Ni8 O64 S8 -","8","1","","Lu, Zhenda; Wen, Lili; Ni, Zhaoping; Li, Yizhi; Zhu, Huizhen; Meng, Qingjin","Syntheses, Structures, and Photoluminescent and Magnetic Studies of Metal−Organic Frameworks Assembled with 5-Sulfosalicylic Acid and 1,4-Bis(imidazol-1-ylmethyl)-benzene","Crystal Growth & Design","2007","7","2","268","","10.1021/cg060287x","","","0.71073","MoKα","","0.0945","0.0464","","","0.0722","0.0797","","","","","","1.02","","","","has coordinates","179573","2020-10-21","18:00:00",""
"4503900","13.4986","0.0011","12.4995","0.001","23.7889","0.0016","90","0.002","117.259","0.004","90","0.002","3568","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H36 Mn N8 O8 S -","- C35 H36 Mn N8 O8 S -","- C140 H144 Mn4 N32 O32 S4 -","4","1","","Lu, Zhenda; Wen, Lili; Ni, Zhaoping; Li, Yizhi; Zhu, Huizhen; Meng, Qingjin","Syntheses, Structures, and Photoluminescent and Magnetic Studies of Metal−Organic Frameworks Assembled with 5-Sulfosalicylic Acid and 1,4-Bis(imidazol-1-ylmethyl)-benzene","Crystal Growth & Design","2007","7","2","268","","10.1021/cg060287x","","","0.71073","MoKα","","0.091","0.0616","","","0.1295","0.1358","","","","","","1.028","","","","has coordinates,has disorder","179574","2020-10-21","18:00:00",""
"4503901","11.5352","0.001","23.39","0.002","25.239","0.002","90","","98.423","0.002","90","","6736.2","1","292","2","292","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetrakis[2,5-bis(4-methoxyphenyl)-1,3,4-oxadiazole-C~2~,N](u-dichloro) diiridium (III) dichloromethane solvate","","- C66 H56 Cl6 Ir2 N8 O12 -","- C66 H56 Cl6 Ir2 N8 O12 -","- C264 H224 Cl24 Ir8 N32 O48 -","4","0.5","","Chen, Lianqing; Yang, Chuluo; Li, Ming; Qin, Jingui; Gao, Jia; You, Han; Ma, Dongge","Supramolecular Architectures, Photophysics, and Electroluminescence of 1,3,4-Oxadiazole-Based Iridium(III) Complexes: From μ-Dichloro Bridged Dimer to Mononuclear Complexes","Crystal Growth & Design","2007","7","1","39","","10.1021/cg060323s","","","0.71073","MoKα","","0.0711","0.0467","","","0.1113","0.1238","","","","","","1.018","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4503902","10.271","0.0008","13.3034","0.001","14.1672","0.0011","92.396","0.001","108.366","0.001","98.271","0.001","1810.2","0.2","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","Bis(2, 5-di-p-tolyl-1, 3, 4-oxadiazolyl-C2,N)iridium (acetylacetonate)","","- C38 H35 Cl2 Ir N4 O4 -","- C38 H35 Cl2 Ir N4 O4 -","- C76 H70 Cl4 Ir2 N8 O8 -","2","1","","Chen, Lianqing; Yang, Chuluo; Li, Ming; Qin, Jingui; Gao, Jia; You, Han; Ma, Dongge","Supramolecular Architectures, Photophysics, and Electroluminescence of 1,3,4-Oxadiazole-Based Iridium(III) Complexes: From μ-Dichloro Bridged Dimer to Mononuclear Complexes","Crystal Growth & Design","2007","7","1","39","","10.1021/cg060323s","","","0.71073","MoKα","","0.0479","0.0392","","","0.0698","0.0716","","","","","","1.119","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503903","11.943","0.002","11.978","0.002","13.793","0.003","70.35","0.03","75.84","0.03","89.6","0.03","1795.6","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Bis(2,5-di-p-tolyl-1,3,4-oxadiazolyl-C2,N)iridium(O,O'-diethyldithiophosphate)","","- C36 H36 Ir N4 O4 P S2 -","- C36 H36 Ir N4 O4 P S2 -","- C72 H72 Ir2 N8 O8 P2 S4 -","2","1","","Chen, Lianqing; Yang, Chuluo; Li, Ming; Qin, Jingui; Gao, Jia; You, Han; Ma, Dongge","Supramolecular Architectures, Photophysics, and Electroluminescence of 1,3,4-Oxadiazole-Based Iridium(III) Complexes: From μ-Dichloro Bridged Dimer to Mononuclear Complexes","Crystal Growth & Design","2007","7","1","39","","10.1021/cg060323s","","","0.71073","MoKα","","0.041","0.0308","","","0.0752","0.0853","","","","","","1.095","","","","has coordinates,has disorder","194588","2020-10-21","18:00:00",""
"4503904","13.2095","0.0018","16.274","0.002","19.153","0.003","96.262","0.002","99.371","0.002","102.316","0.002","3924.5","0.9","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","Bis(2,5-di-p-tolyl-1,3,4-oxadiazolyl-C2,N)iridium(N,N'-diethyldithiocarbamate)","","- C37 H36 Ir N5 O2 S2 -","- C44 H43 Ir N10 O4 S2 -","- C88 H86 Ir2 N20 O8 S4 -","2","1","","Chen, Lianqing; Yang, Chuluo; Li, Ming; Qin, Jingui; Gao, Jia; You, Han; Ma, Dongge","Supramolecular Architectures, Photophysics, and Electroluminescence of 1,3,4-Oxadiazole-Based Iridium(III) Complexes: From μ-Dichloro Bridged Dimer to Mononuclear Complexes","Crystal Growth & Design","2007","7","1","39","","10.1021/cg060323s","","","0.71073","MoKα","","0.1037","0.0887","","","0.2481","0.2555","","","","","","1.19","","","","has coordinates","194588","2020-10-21","18:00:00",""
"4503905","6.8912","0.0011","12.0507","0.0018","21.879","0.003","90","","90.762","0.002","90","","1816.8","0.5","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 F3 O7 S -","- C18 H17 F3 O7 S -","- C72 H68 F12 O28 S4 -","4","1","","Beer, Leanne; Mandal, Swadhin K.; Reed, Robert W.; Oakley, Richard T.; Tham, Fook S.; Donnadieu, Bruno; Haddon, Robert C.","The First Electronically Stabilized Phenalenyl Radical: Effect of Substituents on Solution Chemistry and Solid-State Structure","Crystal Growth & Design","2007","7","4","802","","10.1021/cg0603366","","","0.71073","MoKα","","0.059","0.0456","","","0.1159","0.1245","","","","","","1.036","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4503906","6.8413","0.0007","22.006","0.002","12.6487","0.0013","90","","93.252","0.002","90","","1901.2","0.3","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H19 F3 O7 S -","- C19 H19 F3 O7 S -","- C76 H76 F12 O28 S4 -","4","2","","Beer, Leanne; Mandal, Swadhin K.; Reed, Robert W.; Oakley, Richard T.; Tham, Fook S.; Donnadieu, Bruno; Haddon, Robert C.","The First Electronically Stabilized Phenalenyl Radical: Effect of Substituents on Solution Chemistry and Solid-State Structure","Crystal Growth & Design","2007","7","4","802","","10.1021/cg0603366","","","0.71073","MoKα","","0.0549","0.0501","","","0.1335","0.1378","","","","","","1.059","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503907","8.0527","0.0002","10.8005","0.0003","11.1201","0.0003","90","","103.076","0.001","90","","942.07","0.04","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H7 S2 -","- C13 H7 S2 -","- C52 H28 S8 -","4","1","","Beer, Leanne; Mandal, Swadhin K.; Reed, Robert W.; Oakley, Richard T.; Tham, Fook S.; Donnadieu, Bruno; Haddon, Robert C.","The First Electronically Stabilized Phenalenyl Radical: Effect of Substituents on Solution Chemistry and Solid-State Structure","Crystal Growth & Design","2007","7","4","802","","10.1021/cg0603366","","","0.71073","MoKα","","0.0309","0.0268","","","0.0812","0.0836","","","","","","1.021","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503908","6.8553","0.0003","20.9286","0.0008","11.2302","0.0004","90","","90.228","0.001","90","","1611.2","0.11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H13 O2 P S4 -","- C15 H13 O2 P S4 -","- C60 H52 O8 P4 S16 -","4","1","","Beer, Leanne; Mandal, Swadhin K.; Reed, Robert W.; Oakley, Richard T.; Tham, Fook S.; Donnadieu, Bruno; Haddon, Robert C.","The First Electronically Stabilized Phenalenyl Radical: Effect of Substituents on Solution Chemistry and Solid-State Structure","Crystal Growth & Design","2007","7","4","802","","10.1021/cg0603366","","","0.71073","MoKα","","0.0513","0.0369","","","0.0901","0.0952","","","","","","1.054","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4503909","11.9301","0.0016","7.9101","0.0011","14.804","0.002","90","","97.731","0.003","90","","1384.3","0.3","90","2","90","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 O4 -","- C18 H16 O4 -","- C72 H64 O16 -","4","1","","Beer, Leanne; Mandal, Swadhin K.; Reed, Robert W.; Oakley, Richard T.; Tham, Fook S.; Donnadieu, Bruno; Haddon, Robert C.","The First Electronically Stabilized Phenalenyl Radical: Effect of Substituents on Solution Chemistry and Solid-State Structure","Crystal Growth & Design","2007","7","4","802","","10.1021/cg0603366","","","0.71073","MoKα","","0.0895","0.0699","","","0.1915","0.2129","","","","","","1.035","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503910","9.396","0.009","10.455","0.01","14.612","0.014","70.716","0.012","85.627","0.012","76.076","0.012","1315","2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H24 Co N5 O5.5 -","- C29 H21 Co N5 O5.5 -","- C58 H42 Co2 N10 O11 -","2","1","","Zhou, LiJun; Wang, YaoYu; Zhou, CaiHua; Wang, CuiJuan; Shi, QiZhen; Peng, ShieMing","From Hydrogen-Bonded Net-to-Net Framework to Twofold Interpenetrated (4,6) Net: Effect of Ligand Topology on the Supramolecular Structural Diversity","Crystal Growth & Design","2007","7","2","300","","10.1021/cg060369l","","","0.71073","MoKα","","0.0978","0.0636","","","0.1502","0.1749","","","","","","1.054","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4503911","8.8772","0.0003","8.9431","0.0003","15.5173","0.0004","100.03","0.002","90.082","0.002","112.987","0.002","1113.48","0.06","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H19 Co N3 O5 -","- C26 H19 Co N3 O5 -","- C52 H38 Co2 N6 O10 -","2","1","","Zhou, LiJun; Wang, YaoYu; Zhou, CaiHua; Wang, CuiJuan; Shi, QiZhen; Peng, ShieMing","From Hydrogen-Bonded Net-to-Net Framework to Twofold Interpenetrated (4,6) Net: Effect of Ligand Topology on the Supramolecular Structural Diversity","Crystal Growth & Design","2007","7","2","300","","10.1021/cg060369l","","","0.71073","MoKα","","0.0495","0.0368","","","0.086","0.0916","","","","","","1.067","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503912","17.999","0.01","8.518","0.005","10.203","0.006","90","","90","","90","","1564.3","1.6","298","2","298","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C12 H8 Cu2 N4 S3 -","- C12 H8 Cu2 N4 S3 -","- C48 H32 Cu8 N16 S12 -","4","0.5","","Hao, Zheng-Ming; Zhang, Xian-Ming","Ligand Concentration Controlled Supramolecular Isomerism in Two CuSCN Based Coordination Polymers with in Situ Synthesized 4,4‘-Dipyridylsulfide as a Co-Ligand","Crystal Growth & Design","2007","7","1","64","","10.1021/cg060371c","","","0.71073","MoKα","","0.0987","0.0635","","","0.1413","0.1836","","","","","","1.08","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503913","9.2011","0.0017","5.7246","0.001","14.876","0.003","90","","104.855","0.003","90","","757.4","0.2","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H8 Cu2 N4 S3 -","- C12 H8 Cu2 N4 S3 -","- C24 H16 Cu4 N8 S6 -","2","0.5","","Hao, Zheng-Ming; Zhang, Xian-Ming","Ligand Concentration Controlled Supramolecular Isomerism in Two CuSCN Based Coordination Polymers with in Situ Synthesized 4,4‘-Dipyridylsulfide as a Co-Ligand","Crystal Growth & Design","2007","7","1","64","","10.1021/cg060371c","","","0.71073","MoKα","","0.1191","0.0716","","","0.1711","0.1961","","","","","","0.95","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503914","5.7941","0.0005","13.0175","0.0014","13.6171","0.0015","90","","90","","90","","1027.07","0.18","120","2","","","","","","","","","","4","P b c 21","P 2c -2b","29","β-2-Salicylideneaniline","2-(Phenyliminomethyl)phenol","","- C13 H11 N O -","- C13 H11 N O -","- C52 H44 N4 O4 -","4","1","","Arod, Frédéric; Pattison, Philip; Schenk, Kurt J.; Chapuis, Gervais","Polymorphism inN-Salicylideneaniline Reconsidered","Crystal Growth & Design","2007","7","9","1679","","10.1021/cg060389n","","x-ray","0.75","synchrotron","","0.0512","0.0426","","","0.1018","0.1264","","","","","","1.156","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4503915","5.9183","0.0015","7.1869","0.0016","14.295","0.003","85.13","0.019","78.03","0.02","65.8","0.02","542.5","0.2","120","2","","","","","","","","","","4","P 1","P 1","1","α~1~-Salicylideneaniline","2-(Phenyliminomethyl)phenol","","- C13 H11 N O -","- C13 H11 N O -","- C26 H22 N2 O2 -","2","2","","Arod, Frédéric; Pattison, Philip; Schenk, Kurt J.; Chapuis, Gervais","Polymorphism inN-Salicylideneaniline Reconsidered","Crystal Growth & Design","2007","7","9","1679","","10.1021/cg060389n","","x-ray","0.7256","synchrotron","","0.1245","0.0607","","0.0714","0.0634","0.0634","","","","","","1.3627","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4503916","21.8982","0.0006","27.3098","0.0007","20.1293","0.0005","90","","90","","90","","12038","0.5","90","2","90","2","","","","","","","","4","P n a 21","P 2c -2n","33","Hexachloroazatriquinacene - 3C70 - 3PhCl","","","- C237 H18 Cl9 N -","- C237 H18 Cl9 N -","- C948 H72 Cl36 N4 -","4","1","","Pham, David; Ceron-Bertran, Jordi; Olmstead, Marilyn M.; Mascal, Mark; Balch, Alan L.","Ordered Crystals of Fullerenes Produced by Cocrystallization with Halogenated Azatriquinacenes","Crystal Growth & Design","2007","7","1","75","","10.1021/cg060438w","","","0.71073","MoKα","","0.0373","0.0339","","","0.0826","0.0856","","","","","","0.93","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503917","13.574","0.003","15.592","0.003","21.473","0.004","90","","90","","90","","4544.7","1.6","90","2","90","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","1,4,7-Tribromo-2,3,5,6,8,9-hexachloroazatriquinacene * C70","","","- C79 Br3 Cl6 N -","- C79 Br3 Cl6 N -","- C316 Br12 Cl24 N4 -","4","1","","Pham, David; Ceron-Bertran, Jordi; Olmstead, Marilyn M.; Mascal, Mark; Balch, Alan L.","Ordered Crystals of Fullerenes Produced by Cocrystallization with Halogenated Azatriquinacenes","Crystal Growth & Design","2007","7","1","75","","10.1021/cg060438w","","","0.71073","MoKα","","0.0464","0.0353","","","0.0797","0.084","","","","","","1.03","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503918","10.1657","0.0013","15.399","0.002","26.177","0.003","90","","99.566","0.003","90","","4040.8","0.9","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","C60-TBHCA","","","- C69 Br3 Cl6 N -","- C69 Br3 Cl6 N -","- C276 Br12 Cl24 N4 -","4","1","","Pham, David; Ceron-Bertran, Jordi; Olmstead, Marilyn M.; Mascal, Mark; Balch, Alan L.","Ordered Crystals of Fullerenes Produced by Cocrystallization with Halogenated Azatriquinacenes","Crystal Growth & Design","2007","7","1","75","","10.1021/cg060438w","","","0.71073","MoKα","","0.0822","0.0663","","","0.1813","0.1882","","","","","","1.028","","","","has coordinates,has disorder","179574","2020-10-21","18:00:00",""
"4503919","21.9952","0.001","10.1725","0.0005","7.6396","0.0003","90","","97.608","0.003","90","","1694.28","0.13","123","2","123","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","Compound 1 DCBCDH","","","- C12.6 H10.6 Cd N5 O0.2 S2 -","- C12 H9 Cd N5 S2 -","- C48 H36 Cd4 N20 S8 -","4","0.5","","Cordes, David B.; Hanton, Lyall R.; Spicer, Mark D.","Six-Coordinated Cd(II) Centers as Four- or Six-Connected Nodes in Coordination Polymer Networks Containing Bis(4-pyridyl)amine","Crystal Growth & Design","2007","7","2","328","","10.1021/cg0604632","","x-ray","0.71073","MoKα","","0.0371","0.0332","","","0.0942","0.0997","","","","","","1.088","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503920","24.0569","0.0012","16.084","0.0008","16.5679","0.0006","90","","132.762","0.002","90","","4706.6","0.4","123","2","123","2","","","","","","","synthesis as described","5","C 1 c 1","C -2yc","9","Compound 2 dccdb","","","- C40 H40 Cd2 N16 O14 -","- C40 H40 Cd2 N16 O14 -","- C160 H160 Cd8 N64 O56 -","4","1","","Cordes, David B.; Hanton, Lyall R.; Spicer, Mark D.","Six-Coordinated Cd(II) Centers as Four- or Six-Connected Nodes in Coordination Polymer Networks Containing Bis(4-pyridyl)amine","Crystal Growth & Design","2007","7","2","328","","10.1021/cg0604632","","x-ray","0.71073","MoKα","","0.0857","0.0449","","","0.0711","0.0788","","","","","","0.945","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503921","17.268","0.005","15.465","0.005","17.929","0.005","90","","90","","90","","4788","2","113","2","113","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Compound 3 dcbcds","","","- C20 H26 Cd N6 O8 S -","- C20 H20 Cd N6 O8 S -","- C160 H160 Cd8 N48 O64 S8 -","8","1","","Cordes, David B.; Hanton, Lyall R.; Spicer, Mark D.","Six-Coordinated Cd(II) Centers as Four- or Six-Connected Nodes in Coordination Polymer Networks Containing Bis(4-pyridyl)amine","Crystal Growth & Design","2007","7","2","328","","10.1021/cg0604632","","","0.71069","MoKα","","0.0589","0.0332","","","0.0718","0.0835","","","","","","1.051","","","","has coordinates,has disorder","179574","2020-10-21","18:00:00",""
"4503922","23.4891","0.0016","6.9729","0.0005","9.0414","0.0006","90","","105.212","0.004","90","","1428.98","0.17","123","2","123","2","","","","","","","synthesis as described","6","C 1 2/m 1","-C 2y","12","Compound 4 DCBCDS","","","- C24 H30 Cd N8 O10 S2 -","- C24 H20 Cd N8 O10 S2 -","- C48 H40 Cd2 N16 O20 S4 -","2","0.25","","Cordes, David B.; Hanton, Lyall R.; Spicer, Mark D.","Six-Coordinated Cd(II) Centers as Four- or Six-Connected Nodes in Coordination Polymer Networks Containing Bis(4-pyridyl)amine","Crystal Growth & Design","2007","7","2","328","","10.1021/cg0604632","","x-ray","0.71073","MoKα","","0.066","0.0565","","","0.1411","0.1479","","","","","","1.096","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503923","13.9318","0.0003","13.9318","0.0003","29.5213","0.0012","90","","90","","90","","5729.9","0.3","566","2","566","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","C16 H28 N12 Ni4 O8","","","- C4 H7 N3 Ni O2 -","- C4 H7 N3 Ni O2 -","- C128 H224 N96 Ni32 O64 -","32","1","","Lin, Zuodong; Li, Zhifeng; Zhang, Hongjie","Syntheses, Structures, and Magnetic Properties of Two Novel Three-Dimensional Frameworks Built from M4O4Cubanes and Dicyanamide Bridges","Crystal Growth & Design","2007","7","4","589","","10.1021/cg060468z","","","0.71073","MoKα","","0.0329","0.0308","","","0.081","0.0824","","","","","","1.07","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503924","14.053","0.0004","14.053","0.0004","29.781","0.002","90","","90","","90","","5881.4","0.5","293","2","293","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","C12 H28 N12 Co4 O8","","","- C4 H7 Co N3 O2 -","- C4 H4 Co N3 O2 -","- C128 H128 Co32 N96 O64 -","32","1","","Lin, Zuodong; Li, Zhifeng; Zhang, Hongjie","Syntheses, Structures, and Magnetic Properties of Two Novel Three-Dimensional Frameworks Built from M4O4Cubanes and Dicyanamide Bridges","Crystal Growth & Design","2007","7","4","589","","10.1021/cg060468z","","","0.71073","MoKα","","0.0841","0.0544","","","0.118","0.1325","","","","","","1.067","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503925","10.456","0.003","9.592","0.003","7.806","0.002","90","","102.79","0.005","90","","763.5","0.4","175","2","175","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H4 F4 O -","- C8 H4 F4 O -","- C32 H16 F16 O4 -","4","1","","Chopra, Deepak; Thiruvenkatam, Vijay; Manjunath, S. G.; Guru Row, Tayur N.","Variability in Halogen Interactions: In situ Cryocrystallization of Low Melting Substituted Trifluoroacetophenones","Crystal Growth & Design","2007","7","5","868","","10.1021/cg0604881","","","0.71073","MoKα","","0.0362","0.0326","","","0.0875","0.0899","","","","","","1.081","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4503926","7.478","0.003","9.884","0.004","11.222","0.005","90","","90","","90","","829.4","0.6","175","2","175","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C8 H4 Cl F3 O -","- C8 H4 Cl F3 O -","- C32 H16 Cl4 F12 O4 -","4","1","","Chopra, Deepak; Thiruvenkatam, Vijay; Manjunath, S. G.; Guru Row, Tayur N.","Variability in Halogen Interactions: In situ Cryocrystallization of Low Melting Substituted Trifluoroacetophenones","Crystal Growth & Design","2007","7","5","868","","10.1021/cg0604881","","","0.71073","MoKα","","0.0482","0.0398","","","0.1004","0.1056","","","","","","1.07","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4503927","11.862","0.01","10.237","0.009","7.298","0.006","90","","101.11","0.015","90","","869.6","1.3","135","2","135","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H4 Br F3 O -","- C8 H4 Br F3 O -","- C32 H16 Br4 F12 O4 -","4","1","","Chopra, Deepak; Thiruvenkatam, Vijay; Manjunath, S. G.; Guru Row, Tayur N.","Variability in Halogen Interactions: In situ Cryocrystallization of Low Melting Substituted Trifluoroacetophenones","Crystal Growth & Design","2007","7","5","868","","10.1021/cg0604881","","","0.71073","MoKα","","0.0783","0.0405","","","0.0842","0.0962","","","","","","0.996","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4503928","4.5037","0.0017","14.915","0.006","12.927","0.005","90","","90.456","0.006","90","","868.3","0.6","175","2","175","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H4 Br F3 O -","- C8 H4 Br F3 O -","- C32 H16 Br4 F12 O4 -","4","1","","Chopra, Deepak; Thiruvenkatam, Vijay; Manjunath, S. G.; Guru Row, Tayur N.","Variability in Halogen Interactions: In situ Cryocrystallization of Low Melting Substituted Trifluoroacetophenones","Crystal Growth & Design","2007","7","5","868","","10.1021/cg0604881","","","0.71073","MoKα","","0.049","0.032","","","0.0821","0.0891","","","","","","1.023","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4503929","11.838","0.003","6.7278","0.0017","10.692","0.003","90","","90","","90","","851.6","0.4","175","2","290","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C8 H4 F3 N O3 -","- C8 H4 F3 N O3 -","- C32 H16 F12 N4 O12 -","4","0.5","","Chopra, Deepak; Thiruvenkatam, Vijay; Manjunath, S. G.; Guru Row, Tayur N.","Variability in Halogen Interactions: In situ Cryocrystallization of Low Melting Substituted Trifluoroacetophenones","Crystal Growth & Design","2007","7","5","868","","10.1021/cg0604881","","","0.71073","MoKα","","0.0487","0.0379","","","0.0947","0.1021","","","","","","1.029","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503930","7.485","0.005","17.964","0.011","7.624","0.005","90","","97.103","0.011","90","","1017.3","1.1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H3 F5 O3 -","- C10 H3 F5 O3 -","- C40 H12 F20 O12 -","4","1","","Choudhury, Angshuman R.; Bhat, Ramakrishna G.; Guru Row, Tayur N.; Chandrasekaran, Srinivasan","Weak Csp3−H···F−C Interaction Overshadows the Strong C⋮C−H···OC Hydrogen Bond: Structure of Pentafluorophenyl Prop-2-ynyl Carbonate","Crystal Growth & Design","2007","7","5","844","","10.1021/cg060489t","","","0.71073","MoKα","","0.0762","0.0354","","","0.0735","0.0854","","","","","","0.913","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4503931","7.3166","0.0011","17.769","0.003","7.4574","0.0012","90","","98.305","0.002","90","","959.4","0.3","90","2","90","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H3 F5 O3 -","- C10 H3 F5 O3 -","- C40 H12 F20 O12 -","4","1","","Choudhury, Angshuman R.; Bhat, Ramakrishna G.; Guru Row, Tayur N.; Chandrasekaran, Srinivasan","Weak Csp3−H···F−C Interaction Overshadows the Strong C⋮C−H···OC Hydrogen Bond: Structure of Pentafluorophenyl Prop-2-ynyl Carbonate","Crystal Growth & Design","2007","7","5","844","","10.1021/cg060489t","","","0.71073","MoKα","","0.0304","0.028","","","0.0722","0.0739","","","","","","1.068","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4503932","24.14","0.003","11.7092","0.0012","14.2102","0.0017","90","","98.537","0.003","90","","3972.2","0.8","193","2","193","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H28 Br4 Cu N4 O4 S12 -","- C24 H28 Br4 Cu N4 O4 S12 -","- C96 H112 Br16 Cu4 N16 O16 S48 -","4","0.5","","Lu, Wen; Zhu, Qin-Yu; Dai, Jie; Zhang, Yong; Bian, Guo-Qing; Liu, Yu; Zhang, De-Qing","Tetrathiafulvalene-Diamide Salts with S···S and C···C Stacked Radical Couples","Crystal Growth & Design","2007","7","4","652","","10.1021/cg060490s","","","0.71073","MoKα","","0.0448","0.0406","","","0.0899","0.0924","","","","","","1.094","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4503933","7.4716","0.0011","10.4775","0.0016","13.571","0.002","112.049","0.003","91.326","0.002","99.671","0.003","966.4","0.3","173","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H14 Cl N2 O6 S6 -","- C12 H14 Cl N2 O6 S6 -","- C24 H28 Cl2 N4 O12 S12 -","2","1","","Lu, Wen; Zhu, Qin-Yu; Dai, Jie; Zhang, Yong; Bian, Guo-Qing; Liu, Yu; Zhang, De-Qing","Tetrathiafulvalene-Diamide Salts with S···S and C···C Stacked Radical Couples","Crystal Growth & Design","2007","7","4","652","","10.1021/cg060490s","","","0.71073","MoKα","","0.0379","0.0325","","","0.0769","0.0807","","","","","","1.016","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503934","7.1863","0.0009","25.31","0.003","10.2043","0.0012","90","","107.645","0.003","90","","1768.7","0.4","173","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 Br N2 O2 S6 -","- C12 H14 Br N2 O2 S6 -","- C48 H56 Br4 N8 O8 S24 -","4","1","","Lu, Wen; Zhu, Qin-Yu; Dai, Jie; Zhang, Yong; Bian, Guo-Qing; Liu, Yu; Zhang, De-Qing","Tetrathiafulvalene-Diamide Salts with S···S and C···C Stacked Radical Couples","Crystal Growth & Design","2007","7","4","652","","10.1021/cg060490s","","","0.71073","MoKα","","0.038","0.0319","","","0.0613","0.0633","","","","","","1.154","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503935","12.4906","0.0013","12.3673","0.0013","16.6196","0.0017","90","","100.954","0.002","90","","2520.5","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 F N3 O10 Zn -","- C26 H22 F N3 O10 Zn -","- C104 H88 F4 N12 O40 Zn4 -","4","1","","Xiao, Dong-Rong; Wang, En-Bo; An, Hai-Yan; Li, Yang-Guang; Xu, Lin","Syntheses and Structures of Three Unprecedented Metal−Ciprofloxacin Complexes with Helical Character","Crystal Growth & Design","2007","7","3","506","","10.1021/cg060492c","","","0.71073","MoKα","","0.0433","0.0306","","","0.0778","0.08","","","","","","1.003","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503936","25.3","0.005","10.91","0.002","19.079","0.004","90","","120.79","0.03","90","","4524","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C50 H42 F2 N6 O15 Zn2 -","- C50 H42 F2 N6 O15 Zn2 -","- C200 H168 F8 N24 O60 Zn8 -","4","0.5","","Xiao, Dong-Rong; Wang, En-Bo; An, Hai-Yan; Li, Yang-Guang; Xu, Lin","Syntheses and Structures of Three Unprecedented Metal−Ciprofloxacin Complexes with Helical Character","Crystal Growth & Design","2007","7","3","506","","10.1021/cg060492c","","","0.71073","MoKα","","0.0852","0.0513","","","0.0896","0.1006","","","","","","1.259","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503937","24.763","0.005","12.38","0.003","17.729","0.004","90","","113.2","0.03","90","","4996","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51 H50 F2 N6 O19 Zn2 -","- C51 H42 F2 N6 O19 Zn2 -","- C204 H168 F8 N24 O76 Zn8 -","4","0.5","","Xiao, Dong-Rong; Wang, En-Bo; An, Hai-Yan; Li, Yang-Guang; Xu, Lin","Syntheses and Structures of Three Unprecedented Metal−Ciprofloxacin Complexes with Helical Character","Crystal Growth & Design","2007","7","3","506","","10.1021/cg060492c","","","0.71073","MoKα","","0.059","0.0431","","","0.1136","0.1225","","","","","","1.039","","","","has coordinates,has disorder","179574","2020-10-21","18:00:00",""
"4503938","25.1148","0.0014","25.1148","0.0014","15.2765","0.0017","90","","90","","120","","8344.8","1.1","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C48 H24 F30 N15 P3 -","- C48 H24 F30 N15 P3 -","- C288 H144 F180 N90 P18 -","6","0.333333","","Chandrasekhar, Vadapalli; Thilagar, Pakkirisamy; Krishnan, Venkatasubbaiah; Bickley, James. F.; Steiner, Alexander","Click Synthesis of Fluorine-Rich Cyclotriphosphazene Hydrazones. Synthesis and Supramolecular Structures of N3P3(N(Me)NCHC6F5)6,spiro-N3P3(C12H8O2)(N(Me)NCHC6F5)4, anddispiro-N3P3(C12H8O2)2(N(Me)NCHC6F5)2","Crystal Growth & Design","2007","7","4","668","","10.1021/cg060496h","","","0.71073","MoKα","","0.0527","0.0388","","","0.0904","0.0967","","","","","","1.038","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503939","17.5169","0.0014","12.7823","0.001","21.688","0.0018","90","","106.583","0.002","90","","4654.1","0.6","100","2","546","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H24 F20 N11 O2 P3 -","- C44 H24 F20 N11 O2 P3 -","- C176 H96 F80 N44 O8 P12 -","4","1","","Chandrasekhar, Vadapalli; Thilagar, Pakkirisamy; Krishnan, Venkatasubbaiah; Bickley, James. F.; Steiner, Alexander","Click Synthesis of Fluorine-Rich Cyclotriphosphazene Hydrazones. Synthesis and Supramolecular Structures of N3P3(N(Me)NCHC6F5)6,spiro-N3P3(C12H8O2)(N(Me)NCHC6F5)4, anddispiro-N3P3(C12H8O2)2(N(Me)NCHC6F5)2","Crystal Growth & Design","2007","7","4","668","","10.1021/cg060496h","","","0.71073","MoKα","","0.1158","0.0731","","","0.1343","0.1567","","","","","","1.104","","","","has coordinates,has disorder","179574","2020-10-21","18:00:00",""
"4503940","11.1074","0.001","12.3829","0.0012","18.4333","0.0017","95.309","0.002","102.645","0.002","98.605","0.002","2425.3","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H40 F10 N7 O8 P3 -","- C48 H40 F10 N7 O8 P3 -","- C96 H80 F20 N14 O16 P6 -","2","1","","Chandrasekhar, Vadapalli; Thilagar, Pakkirisamy; Krishnan, Venkatasubbaiah; Bickley, James. F.; Steiner, Alexander","Click Synthesis of Fluorine-Rich Cyclotriphosphazene Hydrazones. Synthesis and Supramolecular Structures of N3P3(N(Me)NCHC6F5)6,spiro-N3P3(C12H8O2)(N(Me)NCHC6F5)4, anddispiro-N3P3(C12H8O2)2(N(Me)NCHC6F5)2","Crystal Growth & Design","2007","7","4","668","","10.1021/cg060496h","","","0.71073","MoKα","","0.0882","0.0628","","","0.1471","0.1602","","","","","","1.029","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4503941","10.3899","0.0011","12.8135","0.0013","13.9528","0.0015","82.283","0.002","85.887","0.002","89.235","0.002","1836","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H82 Cd3 N20 O17 S2 -","- C66 H82 Cd3 N20 O17 S2 -","- C66 H82 Cd3 N20 O17 S2 -","1","0.5","","Wen, Lili; Lu, Zhenda; Lin, Jianguo; Tian, Zhengfang; Zhu, Huizhen; Meng, Qingjin","Syntheses, Structures, and Physical Properties of Three Novel Metal−Organic Frameworks Constructed from Aromatic Polycarboxylate Acids and Flexible Imidazole-Based Synthons","Crystal Growth & Design","2007","7","1","93","","10.1021/cg0604982","","","0.71073","MoKα","","0.076","0.0424","","","0.0834","0.0874","","","","","","0.998","","","","has coordinates,has disorder","179574","2020-10-21","18:00:00",""
"4503942","9.3253","0.0006","10.9646","0.0007","19.4452","0.0013","76.604","0.001","83.509","0.001","74.188","0.001","1858.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H70 Co3 N16 O18 S2 -","- C72 H70 Co3 N16 O18 S2 -","- C72 H70 Co3 N16 O18 S2 -","1","0.5","","Wen, Lili; Lu, Zhenda; Lin, Jianguo; Tian, Zhengfang; Zhu, Huizhen; Meng, Qingjin","Syntheses, Structures, and Physical Properties of Three Novel Metal−Organic Frameworks Constructed from Aromatic Polycarboxylate Acids and Flexible Imidazole-Based Synthons","Crystal Growth & Design","2007","7","1","93","","10.1021/cg0604982","","","0.71073","MoKα","","0.0697","0.0547","","","0.1293","0.134","","","","","","1.031","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503943","30.815","0.004","10.3982","0.0013","17.918","0.002","90","","103.038","0.003","90","","5593.3","1.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H26 Cd N7 O5 -","- C28 H26 Cd N7 O5 -","- C224 H208 Cd8 N56 O40 -","8","1","","Wen, Lili; Lu, Zhenda; Lin, Jianguo; Tian, Zhengfang; Zhu, Huizhen; Meng, Qingjin","Syntheses, Structures, and Physical Properties of Three Novel Metal−Organic Frameworks Constructed from Aromatic Polycarboxylate Acids and Flexible Imidazole-Based Synthons","Crystal Growth & Design","2007","7","1","93","","10.1021/cg0604982","","","0.71073","MoKα","","0.077","0.0526","","","0.1132","0.1189","","","","","","1.055","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503944","8.889","0.002","8.91","0.002","16.624","0.004","79.859","0.006","76.747","0.006","66.467","0.006","1169.7","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H21 Cl Cu3 N20 O331 -","- C17 H21 Cl Cu3 N10 O3.31 -","- C34 H42 Cl2 Cu6 N20 O6.62 -","2","1","","Casarin, Maurizio; Cingolani, Augusto; Di Nicola, Corrado; Falcomer, Daniele; Monari, Magda; Pandolfo, Luciano; Pettinari, Claudio","The Different Supramolecular Arrangements of the Triangular [Cu3(μ3-OH)(μ-pz)3]2+(pz = Pyrazolate) Secondary Building Units. Synthesis of a Coordination Polymer with Permanent Hexagonal Channels","Crystal Growth & Design","2007","7","4","676","","10.1021/cg060501h","","","0.71073","MoKα","","0.126","0.0883","","","0.2052","0.23","","","","","","1.052","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503945","32.743","0.002","32.743","0.002","13.8177","0.0007","90","0.005","90","0.005","120","0.005","12829.3","1.4","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C36 H48 Cl6 Cu7 N24 O4 -","- C36 H44 Cl6 Cu7 N24 O4 -","- C324 H396 Cl54 Cu63 N216 O36 -","9","0.5","","Casarin, Maurizio; Cingolani, Augusto; Di Nicola, Corrado; Falcomer, Daniele; Monari, Magda; Pandolfo, Luciano; Pettinari, Claudio","The Different Supramolecular Arrangements of the Triangular [Cu3(μ3-OH)(μ-pz)3]2+(pz = Pyrazolate) Secondary Building Units. Synthesis of a Coordination Polymer with Permanent Hexagonal Channels","Crystal Growth & Design","2007","7","4","676","","10.1021/cg060501h","","","0.71073","MoKα","","0.08","0.0592","","","0.1633","0.1782","","","","","","1.02","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503946","16.8267","0.0006","16.8267","0.0006","8.9583","0.0006","90","","90","","90","","2536.4","0.2","100","2","100","2","","","","","","","","6","P -4 21 m","P -4 2ab","113","","","","- C36 H44 Cl4 Cu6 N24 O4 -","- C36 H44 Cl4 Cu6 N24 O4 -","- C72 H88 Cl8 Cu12 N48 O8 -","2","0.25","","Casarin, Maurizio; Cingolani, Augusto; Di Nicola, Corrado; Falcomer, Daniele; Monari, Magda; Pandolfo, Luciano; Pettinari, Claudio","The Different Supramolecular Arrangements of the Triangular [Cu3(μ3-OH)(μ-pz)3]2+(pz = Pyrazolate) Secondary Building Units. Synthesis of a Coordination Polymer with Permanent Hexagonal Channels","Crystal Growth & Design","2007","7","4","676","","10.1021/cg060501h","","","0.71073","MoKα","","0.0286","0.0273","","","0.0749","0.0755","","","","","","1.069","","","","has coordinates","264242","2021-04-16","08:52:18",""
"4503947","18.549","0.007","18.549","0.007","50.77","0.03","90","","90","","120","","15128","12","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C102 H188 La12 N18 Na O115.5 -","- C102 H102 La12 N18 Na O115.52 -","- C306 H306 La36 N54 Na3 O346.56 -","3","0.166667","","Xu, Jing-Yuan; Zhao, Bin; Bian, He-Dong; Gu, Wen; Yan, Shi-Ping; Cheng, Peng; Liao, Dai-Zheng; Shen, Pan-Wen","Syntheses, Structures, and Properties of Novel Cagelike Complexes Based on Dodecanuclear Lanthanide with a Large Cavity","Crystal Growth & Design","2007","7","6","1044","","10.1021/cg0605032","","","0.71073","MoKα","","0.2685","0.0695","","","0.1358","0.2182","","","","","","0.962","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503948","25.329","0.004","25.329","0.004","45.031","0.006","90","","90","","120","","25019","7","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C102 H219 N18 Na O131 Pr12 -","- C102 H188 N18 Na O131 Pr12 -","- C306 H564 N54 Na3 O393 Pr36 -","3","0.166667","","Xu, Jing-Yuan; Zhao, Bin; Bian, He-Dong; Gu, Wen; Yan, Shi-Ping; Cheng, Peng; Liao, Dai-Zheng; Shen, Pan-Wen","Syntheses, Structures, and Properties of Novel Cagelike Complexes Based on Dodecanuclear Lanthanide with a Large Cavity","Crystal Growth & Design","2007","7","6","1044","","10.1021/cg0605032","","","0.71073","MoKα","","0.2128","0.0653","","","0.1415","0.2192","","","","","","1.097","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503949","25.305","0.008","25.305","0.008","45.08","0.03","90","","90","","120","","24999","2","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C102 H219 N18 Na Nd12 O131 -","- C102 H188 N18 Na Nd12 O131 -","- C306 H564 N54 Na3 Nd36 O393 -","3","0.166667","","Xu, Jing-Yuan; Zhao, Bin; Bian, He-Dong; Gu, Wen; Yan, Shi-Ping; Cheng, Peng; Liao, Dai-Zheng; Shen, Pan-Wen","Syntheses, Structures, and Properties of Novel Cagelike Complexes Based on Dodecanuclear Lanthanide with a Large Cavity","Crystal Growth & Design","2007","7","6","1044","","10.1021/cg0605032","","","0.71073","MoKα","","0.2062","0.0617","","","0.1277","0.1938","","","","","","1.069","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503950","5.8687","0.0001","8.6852","0.0001","14.7116","0.0003","87.69","0.001","84.207","0.001","71.612","0.001","707.91","0.02","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","(E)-(3,3'-(diazene-1,2-diyl)bis(3,1-phenylene))bis(diphenylmethanol)","","- C19 H15 N O -","- C19 H15 N O -","- C38 H30 N2 O2 -","2","1","","Scott, Janet L.; Almesaker, Ann; Sumi, Yoshinori; Tanaka, Koichi","Guest Signaling Compound: trans-3,3‘-Bis(diphenylhydroxymethyl)azobenzene","Crystal Growth & Design","2007","7","6","1049","","10.1021/cg060522b","","","0.71073","MoKα","","0.0881","0.0659","","","0.1166","0.1255","","","","","","1.11","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503951","9.1808","0.0006","23.882","0.001","9.2981","0.0005","90","","112.545","0.002","90","","1882.87","0.18","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-(3,3'-(diazene-1,2-diyl)bis(3,1-phenylene))bis(diphenylmethanol) pyridine solvate","","- C24 H20 N2 O -","- C24 H20 N2 O -","- C96 H80 N8 O4 -","4","1","","Scott, Janet L.; Almesaker, Ann; Sumi, Yoshinori; Tanaka, Koichi","Guest Signaling Compound: trans-3,3‘-Bis(diphenylhydroxymethyl)azobenzene","Crystal Growth & Design","2007","7","6","1049","","10.1021/cg060522b","","","0.71073","MoKα","","0.1908","0.0582","","","0.1075","0.1425","","","","","","0.912","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503952","8.954","0.0004","9.0428","0.0004","10.9379","0.0006","102.171","0.002","98.851","0.002","105.778","0.002","811.84","0.07","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","(E)-(3,3'-(diazene-1,2-diyl)bis(3,1-phenylene))bis(diphenylmethanol) dioxane solvate","","- C21 H19 N O2 -","- C21 H19 N O2 -","- C42 H38 N2 O4 -","2","1","","Scott, Janet L.; Almesaker, Ann; Sumi, Yoshinori; Tanaka, Koichi","Guest Signaling Compound: trans-3,3‘-Bis(diphenylhydroxymethyl)azobenzene","Crystal Growth & Design","2007","7","6","1049","","10.1021/cg060522b","","","0.71073","MoKα","","0.1637","0.0589","","","0.1235","0.1606","","","","","","1.014","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503953","15.0153","0.0018","14.9868","0.0018","13.0646","0.0016","90","","114.005","0.002","90","","2685.7","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H30 N4 O5 Zn -","- C30 H30 N4 O5 Zn -","- C120 H120 N16 O20 Zn4 -","4","1","","Das, Sanjib; Bharadwaj, Parimal K.","Supramolecular Host−Guest Systems of Luminescent Zn(II) Complexes with Benzene, Nitrobenzene, and Ethanol: Selectivity of Guest Inclusion and Solid-State Fluorescence Modulation Studies","Crystal Growth & Design","2007","7","6","1192","","10.1021/cg060531k","","","0.71073","MoKα","","0.0478","0.0407","","","0.1051","0.1092","","","","","","1.054","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503954","36.917","0.005","10.959","0.005","14.071","0.005","90","0.005","101.777","0.005","90","0.005","5573","3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H31 N4 O4 Zn -","- C33 H31 N4 O4 Zn -","- C264 H248 N32 O32 Zn8 -","8","1","","Das, Sanjib; Bharadwaj, Parimal K.","Supramolecular Host−Guest Systems of Luminescent Zn(II) Complexes with Benzene, Nitrobenzene, and Ethanol: Selectivity of Guest Inclusion and Solid-State Fluorescence Modulation Studies","Crystal Growth & Design","2007","7","6","1192","","10.1021/cg060531k","","","0.71069","MoKα","","0.0613","0.0439","","","0.103","0.1105","","","","","","1.012","","","","has coordinates","268283","2021-08-30","06:31:23",""
"4503955","15.4915","0.0013","15.4649","0.0014","16.1761","0.0014","90","","91.964","0.002","90","","3873.1","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H40 N6 O9 Zn -","- C42 H40 N6 O9 Zn -","- C168 H160 N24 O36 Zn4 -","4","1","","Das, Sanjib; Bharadwaj, Parimal K.","Supramolecular Host−Guest Systems of Luminescent Zn(II) Complexes with Benzene, Nitrobenzene, and Ethanol: Selectivity of Guest Inclusion and Solid-State Fluorescence Modulation Studies","Crystal Growth & Design","2007","7","6","1192","","10.1021/cg060531k","","","0.71073","MoKα","","0.129","0.105","","","0.2126","0.2212","","","","","","1.229","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503956","14.631","0.005","15.568","0.005","16.065","0.005","90","0.005","114.475","0.005","90","0.005","3330.4","1.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H42 N4 O7 Zn -","- C34 H42 N4 O7 Zn -","- C136 H168 N16 O28 Zn4 -","4","1","","Das, Sanjib; Bharadwaj, Parimal K.","Supramolecular Host−Guest Systems of Luminescent Zn(II) Complexes with Benzene, Nitrobenzene, and Ethanol: Selectivity of Guest Inclusion and Solid-State Fluorescence Modulation Studies","Crystal Growth & Design","2007","7","6","1192","","10.1021/cg060531k","","","0.71069","MoKα","","0.1775","0.0963","","","0.2317","0.2723","","","","","","1.048","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503957","20.0657","0.0008","21.64","0.0008","7.3127","0.0003","90","","90","","90","","3175.3","0.2","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C24 H30 N4 O19 Pb2 -","- C24 H30 N4 O19 Pb2 -","- C96 H120 N16 O76 Pb8 -","4","0.5","","Zhao, Ya-Hui; Xu, Hong-Bin; Shao, Kui-Zhan; Xing, Yan; Su, Zhong-Min; Ma, Jian-Fang","Syntheses, Characterization, and Luminescent Properties of Three 3D Lead−Organic Frameworks with 1D Channels","Crystal Growth & Design","2007","7","3","513","","10.1021/cg060535p","","","0.71073","MoKα","","0.0238","0.0191","","","0.0453","0.0461","","","","","","1.051","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503958","13.369","0.005","15.588","0.005","8.082","0.005","90","0.005","90","0.005","90","0.005","1684.3","1.3","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C12 H8 N2 O7.9 Pb -","- C12 H8 N2 O7.9 Pb -","- C48 H32 N8 O31.6 Pb4 -","4","0.5","","Zhao, Ya-Hui; Xu, Hong-Bin; Shao, Kui-Zhan; Xing, Yan; Su, Zhong-Min; Ma, Jian-Fang","Syntheses, Characterization, and Luminescent Properties of Three 3D Lead−Organic Frameworks with 1D Channels","Crystal Growth & Design","2007","7","3","513","","10.1021/cg060535p","","","0.71069","MoKα","","0.0485","0.025","","","0.0601","0.0685","","","","","","1.037","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503959","17.749","0.004","17.749","0.004","6.895","0.002","90","","90","","90","","2172.1","0.9","293","2","293","2","","","","","","","","5","P 42/n m c :2","-P 4ac 2a","137","","","","- C24 H16 N4 O23 Pb4 -","- C24 H16 N4 O22.96 Pb4 -","- C48 H32 N8 O45.92 Pb8 -","2","0.125","","Zhao, Ya-Hui; Xu, Hong-Bin; Shao, Kui-Zhan; Xing, Yan; Su, Zhong-Min; Ma, Jian-Fang","Syntheses, Characterization, and Luminescent Properties of Three 3D Lead−Organic Frameworks with 1D Channels","Crystal Growth & Design","2007","7","3","513","","10.1021/cg060535p","","","0.71073","MoKα","","0.0667","0.0393","","","0.1001","0.1062","","","","","","0.995","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503960","11.8175","0.0006","11.9876","0.0006","17.907","0.0009","90","","92.109","0.001","90","","2535","0.2","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","pentacene-maleimide adduct w/ dichlorobenzene","","","- C32 H21 Cl2 N O2 -","- C32 H21 Cl4 N O2 -","- C128 H84 Cl16 N4 O8 -","4","1","","Mitzi, David B.; Afzali, Ali","Diels−Alder Adduct of Pentacene and Maleimide: Crystal Growth and the Influence of Solvent Molecules on Structure and Hydrogen Bonding","Crystal Growth & Design","2007","7","4","691","","10.1021/cg060559w","","","0.7093","MolybdenumKα","","0.068","0.068","","0.087","0.087","","","","","3.76","3.76","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503961","11.71","0.001","11.453","0.001","18.356","0.002","90","","90.262","0.002","90","","2461.8","0.4","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","pentacene-maleimide adduct w/ toluene","","","- C33 H25 N O2 -","- C33 H25 N O2 -","- C132 H100 N4 O8 -","4","1","","Mitzi, David B.; Afzali, Ali","Diels−Alder Adduct of Pentacene and Maleimide: Crystal Growth and the Influence of Solvent Molecules on Structure and Hydrogen Bonding","Crystal Growth & Design","2007","7","4","691","","10.1021/cg060559w","","","0.7093","MolybdenumKα","","0.043","0.043","","0.051","0.051","","","","","2.22","2.22","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503962","10.92","0.002","15.549","0.002","15.558","0.002","102.799","0.003","95.801","0.003","91.164","0.003","2560.4","0.7","293","","293","","","","","","","","","4","P -1","-P 1","2","pentacene-maleimide adduct w/ pyridine","","","- C67 H49 N5 O4 -","- C67 H49 N5 O4 -","- C134 H98 N10 O8 -","2","1","","Mitzi, David B.; Afzali, Ali","Diels−Alder Adduct of Pentacene and Maleimide: Crystal Growth and the Influence of Solvent Molecules on Structure and Hydrogen Bonding","Crystal Growth & Design","2007","7","4","691","","10.1021/cg060559w","","","0.7093","MolybdenumKα","","0.058","0.057","","0.057","0.057","","","","","1.46","1.46","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503963","14.2086","0.0011","7.6337","0.0006","18.6555","0.0015","90","","108.395","0.001","90","","1920.1","0.3","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","pentacene-maleimide adduct","","","- C26 H17 N O2 -","- C26 H17 N O2 -","- C104 H68 N4 O8 -","4","1","","Mitzi, David B.; Afzali, Ali","Diels−Alder Adduct of Pentacene and Maleimide: Crystal Growth and the Influence of Solvent Molecules on Structure and Hydrogen Bonding","Crystal Growth & Design","2007","7","4","691","","10.1021/cg060559w","","","0.7093","MolybdenumKα","","0.045","0.044","","0.051","0.049","","","","","2.17","2.17","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503964","14.397","0.003","9.2579","0.0016","21.485","0.004","90","","106.368","0.003","90","","2747.6","0.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 Cd2 N2 O12 S -","- C26 H22 Cd2 N2 O12 S -","- C104 H88 Cd8 N8 O48 S4 -","4","1","","Su, Yang; Zang, Shuangquan; Li, Yizhi; Zhu, Huizhen; Meng, Qingjin","Four d10Metal Coordination Polymers Containing Isomeric Thiodiphthalic Ligands: Crystal Structures and Luminescent Properties","Crystal Growth & Design","2007","7","7","1277","","10.1021/cg060572g","","","0.71073","MoKα","","0.0809","0.0524","","","0.0905","0.0985","","","","","","1","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503965","10.332","0.002","9.3363","0.0019","28.822","0.006","90","","90.21","0.004","90","","2780.2","1","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H46 N4 O25 S2 Zn4 -","- C52 H46 N4 O25 S2 Zn4 -","- C104 H92 N8 O50 S4 Zn8 -","2","0.5","","Su, Yang; Zang, Shuangquan; Li, Yizhi; Zhu, Huizhen; Meng, Qingjin","Four d10Metal Coordination Polymers Containing Isomeric Thiodiphthalic Ligands: Crystal Structures and Luminescent Properties","Crystal Growth & Design","2007","7","7","1277","","10.1021/cg060572g","","","0.71073","MoKα","","0.0874","0.0615","","","0.1331","0.1419","","","","","","1.074","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503966","7.856","0.002","26.525","0.007","10.692","0.003","90","","104.52","0.005","90","","2156.8","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H16 Cd2 N O11 S -","- C21 H16 Cd2 N O11 S -","- C84 H64 Cd8 N4 O44 S4 -","4","1","","Su, Yang; Zang, Shuangquan; Li, Yizhi; Zhu, Huizhen; Meng, Qingjin","Four d10Metal Coordination Polymers Containing Isomeric Thiodiphthalic Ligands: Crystal Structures and Luminescent Properties","Crystal Growth & Design","2007","7","7","1277","","10.1021/cg060572g","","","0.71073","MoKα","","0.0757","0.0639","","","0.166","0.1736","","","","","","1.076","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503967","9.6585","0.0007","10.8284","0.0007","12.2062","0.0008","103.776","0.001","99.415","0.001","108.169","0.001","1138.26","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H16 N2 O8 S Zn -","- C26 H16 N2 O8 S Zn -","- C52 H32 N4 O16 S2 Zn2 -","2","1","","Su, Yang; Zang, Shuangquan; Li, Yizhi; Zhu, Huizhen; Meng, Qingjin","Four d10Metal Coordination Polymers Containing Isomeric Thiodiphthalic Ligands: Crystal Structures and Luminescent Properties","Crystal Growth & Design","2007","7","7","1277","","10.1021/cg060572g","","","0.71073","MoKα","","0.0389","0.0326","","","0.0878","0.0907","","","","","","1.003","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503968","8.2178","0.0005","21.2814","0.0013","8.595","0.0005","90","","96.088","0.001","90","","1494.67","0.16","153","2","153","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- Li6 Mo12 O39 -","- Li6 Mo12 O39 -","- Li12 Mo24 O78 -","2","1","","Smit, Jared P.; Stair, Peter C.; Poeppelmeier, Kenneth R.","Polymorphism in Li2Mo4O13Revisited","Crystal Growth & Design","2007","7","3","521","","10.1021/cg060576l","","","0.71073","MoKα","","0.025","0.0225","","","0.0536","0.0547","","","","","","1.026","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503969","14.3339","0.0018","20.76","0.003","21.507","0.003","69.992","0.005","73.154","0.005","72.353","0.005","5605.5","1.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H116 La4 N16 O72 P16 -","- C48 H68 La4 N16 O72 P16 -","- C96 H136 La8 N32 O144 P32 -","2","1","","Tang, Si-Fu; Song, Jun-Ling; Li, Xiu-Ling; Mao, Jiang-Gao","Novel Luminescent Lanthanide(III) Diphosphonates with Rarely Observed Topology","Crystal Growth & Design","2007","7","2","360","","10.1021/cg060590y","","","0.71073","MoKα","","0.0605","0.0515","","","0.1253","0.1323","","","","","","1.062","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503970","10.6305","0.0005","17.0798","0.0008","16.7882","0.001","90","","92.294","0.003","90","","3045.7","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H25 Eu N4 O16 P4 -","- C12 H17 Eu N4 O16 P4 -","- C48 H68 Eu4 N16 O64 P16 -","4","1","","Tang, Si-Fu; Song, Jun-Ling; Li, Xiu-Ling; Mao, Jiang-Gao","Novel Luminescent Lanthanide(III) Diphosphonates with Rarely Observed Topology","Crystal Growth & Design","2007","7","2","360","","10.1021/cg060590y","","","0.71073","MoKα","","0.0543","0.046","","","0.1241","0.1313","","","","","","1.1","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503971","10.519","0.004","17.221","0.006","16.653","0.006","90","","91.931","0.007","90","","3014.9","1.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H25 Er N4 O16 P4 -","- C12 H17 Er N4 O16 P4 -","- C48 H68 Er4 N16 O64 P16 -","4","1","","Tang, Si-Fu; Song, Jun-Ling; Li, Xiu-Ling; Mao, Jiang-Gao","Novel Luminescent Lanthanide(III) Diphosphonates with Rarely Observed Topology","Crystal Growth & Design","2007","7","2","360","","10.1021/cg060590y","","","0.71073","MoKα","","0.1052","0.0741","","","0.1688","0.187","","","","","","1.152","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503972","17.7743","0.0016","25.311","0.002","16.5981","0.0015","90","","105.408","0.002","90","","7198.9","1.1","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C120 H104 Cl4 Cu12 N24 O8 S12 W4 -","- C120 H104 Cl4 Cu12 N24 O8 S12 W4 -","- C240 H208 Cl8 Cu24 N48 O16 S24 W8 -","2","0.25","","Liang, Kai; Zheng, He-Gen; Song, Ying-Lin; Li, Yi-Zhi; Xin, Xin-Quan","Novel Cluster Coordination Polymers Based on Tetranuclear Nest-Shaped [WOS3Cu3] Heterothiometallitic Secondary Building Units and 4,4'-Bipyridine Ligand","Crystal Growth & Design","2007","7","2","373","376","10.1021/cg0606038","","","0.71073","MoKα","","0.0419","0.0409","","","0.1023","0.1024","","","","","","1.016","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503973","9.843","0.001","12.974","0.001","17.362","0.002","97.65","0.01","101.5","0.01","108.65","0.01","2011.8","0.4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C31 H48 Br2 Cu3 N4 O S3 W -","- C31 H48 Br2 Cu3 N4 O S3 W -","- C62 H96 Br4 Cu6 N8 O2 S6 W2 -","2","1","","Liang, Kai; Zheng, He-Gen; Song, Ying-Lin; Li, Yi-Zhi; Xin, Xin-Quan","Novel Cluster Coordination Polymers Based on Tetranuclear Nest-Shaped [WOS3Cu3] Heterothiometallitic Secondary Building Units and 4,4'-Bipyridine Ligand","Crystal Growth & Design","2007","7","2","373","376","10.1021/cg0606038","","","0.71073","MoKα","","0.0548","0.0348","","","0.0638","0.0674","","","","","","0.949","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503974","9.8917","0.0008","8.2994","0.0006","24.1948","0.0018","90","","92.004","0.006","90","","1985.1","0.3","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H18 Cl3 D N4 O2 -","- C17 H18 Cl3 D N4 O2 -","- C68 H72 Cl12 D4 N16 O8 -","4","1","","Chen, Huan-Ching; Hu, Hui-Ling; Chan, Zhi-Kai; Yeh, Chun-Wei; Jia, Hsi-Wei; Wu, Chi-Phi; Chen, Jhy-Der; Wang, Ju-Chun","Ag(I) Complexes Containing FlexibleN,N‘-Di(2-pyridyl)adipoamide Ligands: Syntheses, Structures, and Ligand Conformations","Crystal Growth & Design","2007","7","4","698","","10.1021/cg060619y","","","0.71073","MoKα","","0.084","0.061","","","0.1598","0.1781","","","","","","1.047","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503975","10.909","0.002","5.2417","0.0012","14.816","0.003","90","","99.742","0.017","90","","835","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 N4 O4 -","- C16 H22 N4 O4 -","- C32 H44 N8 O8 -","2","0.5","","Chen, Huan-Ching; Hu, Hui-Ling; Chan, Zhi-Kai; Yeh, Chun-Wei; Jia, Hsi-Wei; Wu, Chi-Phi; Chen, Jhy-Der; Wang, Ju-Chun","Ag(I) Complexes Containing FlexibleN,N‘-Di(2-pyridyl)adipoamide Ligands: Syntheses, Structures, and Ligand Conformations","Crystal Growth & Design","2007","7","4","698","","10.1021/cg060619y","","","0.71073","MoKα","","0.0632","0.0474","","","0.1146","0.1282","","","","","","1.083","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503976","8.3486","0.0012","9.9271","0.001","11.5278","0.0011","99.612","0.007","104.505","0.009","103.956","0.01","870.95","0.19","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H18 Ag N5 O5 -","- C16 H18 Ag N5 O5 -","- C32 H36 Ag2 N10 O10 -","2","1","","Chen, Huan-Ching; Hu, Hui-Ling; Chan, Zhi-Kai; Yeh, Chun-Wei; Jia, Hsi-Wei; Wu, Chi-Phi; Chen, Jhy-Der; Wang, Ju-Chun","Ag(I) Complexes Containing FlexibleN,N‘-Di(2-pyridyl)adipoamide Ligands: Syntheses, Structures, and Ligand Conformations","Crystal Growth & Design","2007","7","4","698","","10.1021/cg060619y","","","0.71073","MoKα","","0.0313","0.0288","","","0.0585","0.0598","","","","","","1.016","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503977","4.9284","0.0008","10.5139","0.0019","11.6977","0.0017","110.359","0.01","92.989","0.011","93.981","0.013","565.01","0.17","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H18 Ag F6 N4 O2 P -","- C16 H18 Ag F6 N4 O2 P -","- C16 H18 Ag F6 N4 O2 P -","1","0.5","","Chen, Huan-Ching; Hu, Hui-Ling; Chan, Zhi-Kai; Yeh, Chun-Wei; Jia, Hsi-Wei; Wu, Chi-Phi; Chen, Jhy-Der; Wang, Ju-Chun","Ag(I) Complexes Containing FlexibleN,N‘-Di(2-pyridyl)adipoamide Ligands: Syntheses, Structures, and Ligand Conformations","Crystal Growth & Design","2007","7","4","698","","10.1021/cg060619y","","","0.71073","MoKα","","0.06","0.0543","","","0.1209","0.1238","","","","","","1.032","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503978","9.8724","0.0018","10.2111","0.0011","11.5477","0.0012","111.007","0.008","93.701","0.012","93.778","0.01","1079.5","0.3","295","2","295","2","","","","","","","","7","P 1","P 1","1","","","","- C18 H22 Ag B F4 N5 O2.5 -","- C18 H21 Ag B F4 N5 O2.5 -","- C36 H42 Ag2 B2 F8 N10 O5 -","2","2","","Chen, Huan-Ching; Hu, Hui-Ling; Chan, Zhi-Kai; Yeh, Chun-Wei; Jia, Hsi-Wei; Wu, Chi-Phi; Chen, Jhy-Der; Wang, Ju-Chun","Ag(I) Complexes Containing FlexibleN,N‘-Di(2-pyridyl)adipoamide Ligands: Syntheses, Structures, and Ligand Conformations","Crystal Growth & Design","2007","7","4","698","","10.1021/cg060619y","","","0.71073","MoKα","","0.0639","0.0421","","","0.075","0.0846","","","","","","1.031","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503979","9.8733","0.0019","10.3078","0.0018","11.5645","0.0014","111.169","0.01","93.351","0.013","93.971","0.013","1090.5","0.3","295","2","295","2","","","","","","","","6","P 1","P 1","1","","","","- C18 H21 Ag Cl N5 O6 -","- C18 H21 Ag Cl N5 O6 -","- C36 H42 Ag2 Cl2 N10 O12 -","2","2","","Chen, Huan-Ching; Hu, Hui-Ling; Chan, Zhi-Kai; Yeh, Chun-Wei; Jia, Hsi-Wei; Wu, Chi-Phi; Chen, Jhy-Der; Wang, Ju-Chun","Ag(I) Complexes Containing FlexibleN,N‘-Di(2-pyridyl)adipoamide Ligands: Syntheses, Structures, and Ligand Conformations","Crystal Growth & Design","2007","7","4","698","","10.1021/cg060619y","","","0.71073","MoKα","","0.0473","0.037","","","0.1057","0.1158","","","","","","1.049","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503980","17.281","0.004","14.731","0.003","23.027","0.005","90","","101.453","0.004","90","","5745","2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H19.33 Ag Cl N4 O6.67 -","- C16 H18 Ag Cl N4 O6.66667 -","- C192 H216 Ag12 Cl12 N48 O80 -","12","3","","Chen, Huan-Ching; Hu, Hui-Ling; Chan, Zhi-Kai; Yeh, Chun-Wei; Jia, Hsi-Wei; Wu, Chi-Phi; Chen, Jhy-Der; Wang, Ju-Chun","Ag(I) Complexes Containing FlexibleN,N‘-Di(2-pyridyl)adipoamide Ligands: Syntheses, Structures, and Ligand Conformations","Crystal Growth & Design","2007","7","4","698","","10.1021/cg060619y","","","0.71073","MoKα","","0.0857","0.0578","","","0.154","0.1824","","","","","","1.06","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503981","31.39","0.005","14.581","0.003","22.107","0.005","90","","119.167","0.013","90","","8835","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H45 Ag2 N10 O9 S -","- C40 H45 Ag2 N10 O9 S -","- C320 H360 Ag16 N80 O72 S8 -","8","1","","Chen, Huan-Ching; Hu, Hui-Ling; Chan, Zhi-Kai; Yeh, Chun-Wei; Jia, Hsi-Wei; Wu, Chi-Phi; Chen, Jhy-Der; Wang, Ju-Chun","Ag(I) Complexes Containing FlexibleN,N‘-Di(2-pyridyl)adipoamide Ligands: Syntheses, Structures, and Ligand Conformations","Crystal Growth & Design","2007","7","4","698","","10.1021/cg060619y","","","0.71073","MoKα","","0.064","0.0361","","","0.0796","0.0906","","","","","","1.006","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503982","12.341","0.003","13.238","0.003","15.373","0.003","99.23","0.03","90.25","0.03","105.11","0.03","2390.5","1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C70 H59 Cl2 Cu7 N14 O41.5 P W12 -","- C70 H56 Cl2 Cu7 N14 O41.5 P W12 -","- C70 H56 Cl2 Cu7 N14 O41.5 P W12 -","1","0.5","","Fan, Linlin; Xiao, Dongrong; Wang, Enbo; Li, Yangguang; Su, Zhongming; Wang, Xinlong; Liu, Jia","An Unprecedented Fivefold Interpenetrating Network Based on Polyoxometalate Building Blocks","Crystal Growth & Design","2007","7","4","592","","10.1021/cg060621p","","","0.71073","MoKα","","0.0958","0.0871","","","0.1838","0.1881","","","","","","1.178","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4503983","12.4042","0.0008","7.8426","0.0005","7.6642","0.0005","90","","99.076","0.001","90","","736.25","0.08","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H5 Cl F2 N Pd0.5 -","- C6 H5 Cl F2 N Pd0.5 -","- C24 H20 Cl4 F8 N4 Pd2 -","4","1","","Baldovino-Pantaleón, Oscar; Morales-Morales, David; Hernández-Ortega, Simón; Toscano, Rubén A.; Valdés-Martínez, Jesús","Pd−N−H···Cl−Pd Hydrogen Bonds and π−π Interactions between Fluorinated Aromatic Rings intrans-[PdCl2(NH2ArF)2]","Crystal Growth & Design","2007","7","1","117","","10.1021/cg0606388","","","0.71073","MoKα","","0.0275","0.0234","","","0.0521","0.0543","","","","","","1.038","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503984","13.8","0.001","6.187","0.001","8.582","0.001","90","","97.225","0.002","90","","726.92","0.15","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Dichloro-bis(2,5-difluoroaniline-N)-palladium(ii)","","- C12 H10 Cl2 F4 N2 Pd -","- C12 H10 Cl2 F4 N2 Pd -","- C24 H20 Cl4 F8 N4 Pd2 -","2","0.5","","Baldovino-Pantaleón, Oscar; Morales-Morales, David; Hernández-Ortega, Simón; Toscano, Rubén A.; Valdés-Martínez, Jesús","Pd−N−H···Cl−Pd Hydrogen Bonds and π−π Interactions between Fluorinated Aromatic Rings intrans-[PdCl2(NH2ArF)2]","Crystal Growth & Design","2007","7","1","117","","10.1021/cg0606388","","","0.71073","MoKα","","0.0608","0.0382","","","0.0662","0.0718","","","","","","0.986","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503985","6.075","0.001","4.558","0.001","25.034","0.003","90","","94.939","0.002","90","","690.6","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-Dichloro-bis(3,4-difluoroaniline)-palladium(ii)","","- C12 H10 Cl2 F4 N2 Pd -","- C12 H10 Cl2 F4 N2 Pd -","- C24 H20 Cl4 F8 N4 Pd2 -","2","0.5","","Baldovino-Pantaleón, Oscar; Morales-Morales, David; Hernández-Ortega, Simón; Toscano, Rubén A.; Valdés-Martínez, Jesús","Pd−N−H···Cl−Pd Hydrogen Bonds and π−π Interactions between Fluorinated Aromatic Rings intrans-[PdCl2(NH2ArF)2]","Crystal Growth & Design","2007","7","1","117","","10.1021/cg0606388","","","0.71073","MoKα","","0.03","0.0244","","","0.0503","0.0524","","","","","","1.019","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503986","4.6825","0.0003","5.9943","0.0004","25.622","0.002","90","","90.414","0.001","90","","719.15","0.09","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H5 Cl F2 N Pd0.5 -","- C6 H5 Cl F2 N Pd0.5 -","- C24 H20 Cl4 F8 N4 Pd2 -","4","1","","Baldovino-Pantaleón, Oscar; Morales-Morales, David; Hernández-Ortega, Simón; Toscano, Rubén A.; Valdés-Martínez, Jesús","Pd−N−H···Cl−Pd Hydrogen Bonds and π−π Interactions between Fluorinated Aromatic Rings intrans-[PdCl2(NH2ArF)2]","Crystal Growth & Design","2007","7","1","117","","10.1021/cg0606388","","","0.71073","MoKα","","0.0222","0.0189","","","0.043","0.0439","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4503987","4.8442","0.0003","5.9318","0.0004","25.7188","0.0016","90","","94.572","0.001","90","","736.67","0.08","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H8 Cl2 F6 N2 Pd -","- C12 H8 Cl2 F6 N2 Pd -","- C24 H16 Cl4 F12 N4 Pd2 -","2","0.5","","Baldovino-Pantaleón, Oscar; Morales-Morales, David; Hernández-Ortega, Simón; Toscano, Rubén A.; Valdés-Martínez, Jesús","Pd−N−H···Cl−Pd Hydrogen Bonds and π−π Interactions between Fluorinated Aromatic Rings intrans-[PdCl2(NH2ArF)2]","Crystal Growth & Design","2007","7","1","117","","10.1021/cg0606388","","","0.71073","MoKα","","0.0228","0.0195","","","0.0453","0.0462","","","","","","0.991","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503988","13.056","0.001","7.844","0.001","7.752","0.001","90","","98.885","0.001","90","","784.37","0.15","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichloro-bis(2,4,5-Trifluoro-phenylamine)-palladium(ii)","","- C12 H8 Cl2 F6 N2 Pd -","- C12 H8 Cl2 F6 N2 Pd -","- C24 H16 Cl4 F12 N4 Pd2 -","2","0.5","","Baldovino-Pantaleón, Oscar; Morales-Morales, David; Hernández-Ortega, Simón; Toscano, Rubén A.; Valdés-Martínez, Jesús","Pd−N−H···Cl−Pd Hydrogen Bonds and π−π Interactions between Fluorinated Aromatic Rings intrans-[PdCl2(NH2ArF)2]","Crystal Growth & Design","2007","7","1","117","","10.1021/cg0606388","","","0.71073","MoKα","","0.0332","0.0263","","","0.0584","0.061","","","","","","1.003","","","","has coordinates,has disorder","179574","2020-10-21","18:00:00",""
"4503989","23.003","0.001","6.4923","0.0003","20.888","0.001","90","","97.163","0.001","90","","3095.1","0.2","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","trans-Dichloro-bis(2,4,6-trifluoroaniline-N)-palladium(ii)","","- C12 H8 Cl2 F6 N2 Pd -","- C12 H8 Cl2 F6 N2 Pd -","- C96 H64 Cl16 F48 N16 Pd8 -","8","2","","Baldovino-Pantaleón, Oscar; Morales-Morales, David; Hernández-Ortega, Simón; Toscano, Rubén A.; Valdés-Martínez, Jesús","Pd−N−H···Cl−Pd Hydrogen Bonds and π−π Interactions between Fluorinated Aromatic Rings intrans-[PdCl2(NH2ArF)2]","Crystal Growth & Design","2007","7","1","117","","10.1021/cg0606388","","","0.71073","MoKα","","0.0743","0.0424","","","0.0691","0.0739","","","","","","0.992","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503990","4.6039","0.0009","6.86","0.0014","38.115","0.008","90","","93.143","0.004","90","","1202","0.4","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H34 N8 O8 -","- C16 H34 N8 O8 -","- C32 H68 N16 O16 -","2","0.5","","Shi, Xue-Fang; Zhang, Wen-Qin","Water Tape Assembled in 1,10-Bis(2-pyrazinylcarbonyl)-1,4,7,10-tetraazadecane via H-Bonding and π−π Stacking","Crystal Growth & Design","2007","7","4","595","","10.1021/cg0606390","","","0.71073","MoKα","","0.1023","0.0596","","","0.1397","0.1574","","","","","","1.048","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503991","13.1822","0.0009","13.5142","0.0009","13.6341","0.0009","65.703","0.001","83.157","0.001","69.709","0.001","2075.6","0.2","187","1","187","1","","","","","","","","5","P -1","-P 1","2","","[Bis(pyridine-2,6-dicarboxylato)copper(II)- bis(trans-1,2-bis(4-pyridyl)ethylene)]dicopper(I) heptahydrate","","- C38 H40 Cu3 N6 O15 -","- C38 H40 Cu3 N6 O15 -","- C76 H80 Cu6 N12 O30 -","2","1","","Hu, Ning-Hai; Li, Zhi-Gang; Xu, Jing-Wei; Jia, Heng-Qing; Niu, Jia-Jia","Self-Assembly of a Water Chain with Tetrameric and Decameric Clusters in the Channel of a Mixed-Valence CuICuIIComplex","Crystal Growth & Design","2007","7","1","15","","10.1021/cg060641r","","","0.71073","MoKα","","0.0554","0.0401","","","0.0921","0.0997","","","","","","1.01","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503992","11.446","0.005","11.893","0.005","15.502","0.008","93.71","0.03","110.76","0.03","113","0.04","1765","1.6","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H16 F2 O4 -","- C20 H16 F2 O4 -","- C80 H64 F8 O16 -","4","2","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.1572","0.0563","","","0.1369","0.1777","","","","","","0.882","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503993","19.165","0.003","8.2749","0.0013","5.4329","0.0008","90","","98.82","","90","","851.4","0.2","203","2","203","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C20 H14 F4 O4 -","- C20 H14 F4 O4 -","- C40 H28 F8 O8 -","2","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.0608","0.037","","","0.0854","0.0916","","","","","","1.037","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503994","3.9694","0.0012","10.829","0.003","10.846","0.003","74.13","0.02","81.53","0.02","87.59","0.03","443.5","0.2","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H14 F4 O4 -","- C20 H14 F4 O4 -","- C20 H14 F4 O4 -","1","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.0637","0.0456","","","0.1248","0.1325","","","","","","1.089","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503995","3.8986","0.0007","20.073","0.005","11.586","0.002","90","","96.466","0.012","90","","900.9","0.3","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H12 F6 O4 -","- C20 H12 F6 O4 -","- C40 H24 F12 O8 -","2","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.0898","0.0666","","","0.1825","0.1906","","","","","","1.128","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503996","5.128","0.002","5.4881","0.0017","17.557","0.006","93.484","0.016","97.572","0.018","104.33","0.02","472.3","0.3","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H10 F8 O4 -","- C20 H10 F8 O4 -","- C20 H10 F8 O4 -","1","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.0792","0.0679","","","0.1969","0.2108","","","","","","1.081","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503997","5.2","0.002","5.486","0.002","17.773","0.007","93.41","0.04","95.44","0.03","105.3","0.04","485","0.3","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H8 F10 O4 -","- C20 H8 F10 O4 -","- C20 H8 F10 O4 -","1","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.0778","0.0594","","","0.1647","0.1806","","","","","","1.076","","","","has coordinates","288252","2023-12-12","14:26:24",""
"4503998","11.443","0.004","4.0015","0.001","18.646","0.006","90","","96.182","0.014","90","","848.8","0.5","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 F2 O4 -","- C20 H16 F2 O4 -","- C40 H32 F4 O8 -","2","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.0724","0.0566","","","0.1526","0.167","","","","","","1.042","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4503999","4.0798","0.0011","12.561","0.003","16.697","0.006","90","","96.257","0.015","90","","850.6","0.4","203","2","203","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 F4 O4 -","- C20 H14 F4 O4 -","- C40 H28 F8 O8 -","2","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.0735","0.0546","","","0.15","0.1613","","","","","","1.083","","","","has coordinates","179574","2020-10-21","18:00:00",""
"4504000","3.832","0.002","9.876","0.006","12.178","0.006","71.04","0.04","81.01","0.04","78.94","0.05","425.6","0.4","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H14 F4 O4 -","- C20 H14 F4 O4 -","- C20 H14 F4 O4 -","1","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.068","0.0405","","","0.0974","0.1055","","","","","","0.999","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504001","3.9341","0.0014","9.978","0.004","12.089","0.004","106.49","0.03","98.19","0.03","98.82","0.02","440.9","0.3","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H12 F6 O4 -","- C20 H12 F6 O4 -","- C20 H12 F6 O4 -","1","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.0646","0.042","","","0.109","0.1166","","","","","","0.981","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504002","11.483","0.005","7.009","0.003","11.849","0.005","90","","104.5","0.04","90","","923.3","0.7","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H10 F8 O4 -","- C20 H10 F8 O4 -","- C40 H20 F16 O8 -","2","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.0954","0.0686","","","0.1843","0.2056","","","","","","1.044","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504003","11.899","0.005","5.196","0.002","15.134","0.007","90","","96.71","0.04","90","","929.3","0.7","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H10 F8 O4 -","- C20 H10 F8 O4 -","- C40 H20 F16 O8 -","2","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.0776","0.0456","","","0.1007","0.1117","","","","","","1.023","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504004","9.626","0.012","5.409","0.007","18.84","0.02","90","","98.2","0.11","90","","971","2","296","2","296","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C20 H8 F10 O4 -","- C20 H8 F10.02 O4 -","- C40 H16 F20.04 O8 -","2","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.1487","0.1012","","","0.3204","0.3539","","","","","","1.137","","","","has coordinates,has disorder","179575","2020-10-21","18:00:00",""
"4504005","4.732","0.009","11.14","0.03","17.22","0.03","90","","88.51","0.09","90","","907","3","203","2","203","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 F4 O4 -","- C20 H14 F4 O4 -","- C40 H28 F8 O8 -","2","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals","Crystal Growth & Design","2007","7","2","377","","10.1021/cg060643b","","","0.71075","MoKα","","0.117","0.0802","","","0.2526","0.2863","","","","","","1.05","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504006","5.7995","0.0001","5.2393","0.0001","31.193","0.0002","90","","91.172","0.001","90","","947.61","0.03","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 N2 O8 -","- C20 H16 N2 O8 -","- C40 H32 N4 O16 -","2","0.5","","Matsumoto, Akikazu; Furukawa, Daisuke; Mori, Yutaka; Tanaka, Toshihiro; Oka, Kunio","Change in Crystal Structure and Polymerization Reactivity for the Solid-State Polymerization of Muconic Esters","Crystal Growth & Design","2007","7","6","1078","","10.1021/cg0606444","","","0.71069","MoKα","","0.1343","0.0781","","","0.1684","0.2017","","","","","","1.162","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504007","4.177","0.003","12.58","0.01","16.677","0.01","90","","96.14","0.03","90","","871.3","1.1","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 F4 O4 -","- C20 H14 F4 O4 -","- C40 H28 F8 O8 -","2","0.5","","Matsumoto, Akikazu; Furukawa, Daisuke; Mori, Yutaka; Tanaka, Toshihiro; Oka, Kunio","Change in Crystal Structure and Polymerization Reactivity for the Solid-State Polymerization of Muconic Esters","Crystal Growth & Design","2007","7","6","1078","","10.1021/cg0606444","","","0.71075","MoKα","","0.0861","0.0401","","","0.0864","0.0978","","","","","","0.981","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504008","11.54","0.002","4.4318","0.0007","18.858","0.004","90","","102.397","0.007","90","","942","0.3","296","2","296","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C22 H18 O8 -","- C22 H18 O8 -","- C44 H36 O16 -","2","0.5","","Matsumoto, Akikazu; Furukawa, Daisuke; Mori, Yutaka; Tanaka, Toshihiro; Oka, Kunio","Change in Crystal Structure and Polymerization Reactivity for the Solid-State Polymerization of Muconic Esters","Crystal Growth & Design","2007","7","6","1078","","10.1021/cg0606444","","","0.71075","MoKα","","0.0962","0.0429","","","0.0864","0.0993","","","","","","0.929","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504009","5.99","0.005","4.855","0.003","31.941","0.014","90","","92.85","0.02","90","","927.7","1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 N2 O8 -","- C20 H16 N2 O8 -","- C40 H32 N4 O16 -","2","0.5","","Matsumoto, Akikazu; Furukawa, Daisuke; Mori, Yutaka; Tanaka, Toshihiro; Oka, Kunio","Change in Crystal Structure and Polymerization Reactivity for the Solid-State Polymerization of Muconic Esters","Crystal Growth & Design","2007","7","6","1078","","10.1021/cg0606444","","","0.71075","MoKα","","0.1634","0.0948","","","0.282","0.3172","","","","","","1.081","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504010","4.716","0.003","11.213","0.008","17.13","0.014","90","","91.32","0.06","90","","905.6","1.1","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 F4 O4 -","- C20 H14 F4 O4 -","- C40 H28 F8 O8 -","2","0.5","","Matsumoto, Akikazu; Furukawa, Daisuke; Mori, Yutaka; Tanaka, Toshihiro; Oka, Kunio","Change in Crystal Structure and Polymerization Reactivity for the Solid-State Polymerization of Muconic Esters","Crystal Growth & Design","2007","7","6","1078","","10.1021/cg0606444","","","0.71075","MoKα","","0.1426","0.0772","","","0.225","0.2692","","","","","","1.02","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504011","4.748","0.003","11.312","0.006","17.286","0.008","90","","91.4","0.04","90","","928.1","0.9","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 F4 O4 -","- C20 H14 F4 O4 -","- C40 H28 F8 O8 -","2","0.5","","Matsumoto, Akikazu; Furukawa, Daisuke; Mori, Yutaka; Tanaka, Toshihiro; Oka, Kunio","Change in Crystal Structure and Polymerization Reactivity for the Solid-State Polymerization of Muconic Esters","Crystal Growth & Design","2007","7","6","1078","","10.1021/cg0606444","","","0.71075","MoKα","","0.1306","0.0734","","","0.2365","0.277","","","","","","1.049","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504012","10.85","0.03","4.702","0.004","18.73","0.02","90","","105.67","0.02","90","","920","3","296","2","296","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C22 H18 O8 -","- C22 H18 O8 -","- C44 H36 O16 -","2","0.5","","Matsumoto, Akikazu; Furukawa, Daisuke; Mori, Yutaka; Tanaka, Toshihiro; Oka, Kunio","Change in Crystal Structure and Polymerization Reactivity for the Solid-State Polymerization of Muconic Esters","Crystal Growth & Design","2007","7","6","1078","","10.1021/cg0606444","","","0.71075","MoKα","","0.2338","0.0926","","","0.2357","0.3188","","","","","","0.937","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504013","12.866","0.005","8.321","0.005","13.307","0.005","90","0.005","108","0.005","90","0.005","1354.9","1.1","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","4-methyl-7-styrylcoumarin","4-methyl-7-styrylcoumarin","","- C18 H14 O2 -","- C18 H14 O2 -","- C72 H56 O8 -","4","1","","Moorthy, Jarugu Narasimha; Venkatakrishnan, Parthasarathy","Double [2+2] Photocycloaddition: Topochemical Conversion of 4-Methyl-7-Styrylcoumarin Dimorphs into a Strained Cyclophane","Crystal Growth & Design","2007","7","4","713","","10.1021/cg060652k","","","0.71069","MoKα","","0.1098","0.0625","","","0.1605","0.1878","","","","","","1.024","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504014","9.529","0.005","22.353","0.005","13.006","0.005","90","0.005","94.847","0.005","90","0.005","2760.4","1.9","293","2","293","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","4-methyl-7-styrylcoumarin","4-methyl-7-styrylcoumarin(polymorph2)","","- C18 H14 O2 -","- C18 H14 O2 -","- C144 H112 O16 -","8","2","","Moorthy, Jarugu Narasimha; Venkatakrishnan, Parthasarathy","Double [2+2] Photocycloaddition: Topochemical Conversion of 4-Methyl-7-Styrylcoumarin Dimorphs into a Strained Cyclophane","Crystal Growth & Design","2007","7","4","713","","10.1021/cg060652k","","","0.71069","MoKα","","0.1783","0.0615","","","0.1509","0.2","","","","","","0.987","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504015","9.374","0.003","17.514","0.005","20.342","0.006","90","","90","","90","","3339.7","1.7","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","cyclophane-bis-lactol","cyclophane-bis-lactol","","- C20 H21 O3 S -","- C20 H21 O3 S -","- C160 H168 O24 S8 -","8","1","","Moorthy, Jarugu Narasimha; Venkatakrishnan, Parthasarathy","Double [2+2] Photocycloaddition: Topochemical Conversion of 4-Methyl-7-Styrylcoumarin Dimorphs into a Strained Cyclophane","Crystal Growth & Design","2007","7","4","713","","10.1021/cg060652k","","","0.71073","MoKα","","0.0856","0.0635","","","0.1293","0.1378","","","","","","1.081","","","","has coordinates,has disorder","179575","2020-10-21","18:00:00",""
"4504016","15.6865","0.0014","5.8068","0.0007","12.6748","0.0014","90","","126.19","0.009","90","","931.8","0.2","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C4 H7 Br I N S2 -","- C4 H7 Br I N S2 -","- C16 H28 Br4 I4 N4 S8 -","4","1","","Aragoni, M. Carla; Arca, Massimiliano; Demartin, Francesco; Devillanova, Francesco A.; Gelbrich, Thomas; Garau, Alessandra; Hursthouse, Michael B.; Isaia, Francesco; Lippolis, Vito","Charge-Transfer Adducts ofN-Methylthiazolidine-2-thione with IBr and I2: An Example of Polymorphism Featuring Interpenetrating Three-Dimensional Subcomponent Assemblies and Halogen···π···Ηalogen Weak Interactions","Crystal Growth & Design","2007","7","7","1284","","10.1021/cg0606545","","","0.71073","MoKα","","0.0282","0.0218","","","0.0575","0.0601","","","","","","1.089","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504017","14.746","0.003","18.417","0.009","12.542","0.004","90","","123.96","0.02","90","","2825.1","1.9","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C4 H7 Br I N S2 -","- C4 H7 Br I N S2 -","- C48 H84 Br12 I12 N12 S24 -","12","3","","Aragoni, M. Carla; Arca, Massimiliano; Demartin, Francesco; Devillanova, Francesco A.; Gelbrich, Thomas; Garau, Alessandra; Hursthouse, Michael B.; Isaia, Francesco; Lippolis, Vito","Charge-Transfer Adducts ofN-Methylthiazolidine-2-thione with IBr and I2: An Example of Polymorphism Featuring Interpenetrating Three-Dimensional Subcomponent Assemblies and Halogen···π···Ηalogen Weak Interactions","Crystal Growth & Design","2007","7","7","1284","","10.1021/cg0606545","","","0.71073","MoKα","","0.0601","0.0368","","","0.0971","0.1067","","","","","","1.04","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504018","16.121","0.002","5.95","0.001","13.105","0.001","90","","127.53","0.01","90","","996.9","0.3","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C4 H7 I2 N S2 -","- C4 H7 I2 N S2 -","- C16 H28 I8 N4 S8 -","4","1","","Aragoni, M. Carla; Arca, Massimiliano; Demartin, Francesco; Devillanova, Francesco A.; Gelbrich, Thomas; Garau, Alessandra; Hursthouse, Michael B.; Isaia, Francesco; Lippolis, Vito","Charge-Transfer Adducts ofN-Methylthiazolidine-2-thione with IBr and I2: An Example of Polymorphism Featuring Interpenetrating Three-Dimensional Subcomponent Assemblies and Halogen···π···Ηalogen Weak Interactions","Crystal Growth & Design","2007","7","7","1284","","10.1021/cg0606545","","","0.71073","MoKα","","0.016","0.016","","","0.0423","0.0423","","","","","","1.1","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504019","26.098","0.007","6.5711","0.0018","16.638","0.005","90","","118.509","0.003","90","","2507.3","1.2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H22 N6 O8 Zn -","- C24 H22 N6 O8 Zn -","- C96 H88 N24 O32 Zn4 -","4","0.5","","Jin, Shouwen; Chen, Wanzhi; Qiu, Huayu","Syntheses and Structural Characterization of a One-Dimensional Chain, Two-Dimensional Noninterpenetrated Grid, and Three-Dimensional Polycatenane Coordination Polymers Assembled from Flexible Bidentate Imidazolyl Ligands","Crystal Growth & Design","2007","7","10","2071","","10.1021/cg060666q","","","0.71073","MoKα","","0.06","0.0489","","","0.1247","0.1356","","","","","","1.025","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504020","8.514","0.005","9.242","0.005","10.409","0.005","89.302","0.006","76.287","0.006","86.998","0.006","794.6","0.7","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H40 N4 Ni O10 -","- C28 H40 N4 Ni O10 -","- C28 H40 N4 Ni O10 -","1","0.5","","Jin, Shouwen; Chen, Wanzhi; Qiu, Huayu","Syntheses and Structural Characterization of a One-Dimensional Chain, Two-Dimensional Noninterpenetrated Grid, and Three-Dimensional Polycatenane Coordination Polymers Assembled from Flexible Bidentate Imidazolyl Ligands","Crystal Growth & Design","2007","7","10","2071","","10.1021/cg060666q","","","0.71073","MoKα","","0.0583","0.0411","","","0.0888","0.0991","","","","","","1.041","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504021","8.582","0.003","13.45","0.005","9.381","0.003","90","","106.997","0.004","90","","1035.5","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H24 Cl2 Mn N8 O4 -","- C14 H24 Cl2 Mn N8 O4 -","- C28 H48 Cl4 Mn2 N16 O8 -","2","0.5","","Jin, Shouwen; Chen, Wanzhi; Qiu, Huayu","Syntheses and Structural Characterization of a One-Dimensional Chain, Two-Dimensional Noninterpenetrated Grid, and Three-Dimensional Polycatenane Coordination Polymers Assembled from Flexible Bidentate Imidazolyl Ligands","Crystal Growth & Design","2007","7","10","2071","","10.1021/cg060666q","","","0.71073","MoKα","","0.0561","0.0378","","","0.0947","0.1086","","","","","","1.035","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504022","9.14","0.003","15.831","0.003","13.961","0.005","90","","90","","90","","2020.1","1.1","298","2","298","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C16 H16 Fe N10 S2 -","- C16 H16 Fe N10 S2 -","- C64 H64 Fe4 N40 S8 -","4","","","Jin, Shouwen; Chen, Wanzhi; Qiu, Huayu","Syntheses and Structural Characterization of a One-Dimensional Chain, Two-Dimensional Noninterpenetrated Grid, and Three-Dimensional Polycatenane Coordination Polymers Assembled from Flexible Bidentate Imidazolyl Ligands","Crystal Growth & Design","2007","7","10","2071","","10.1021/cg060666q","","","0.71073","MoKα","","0.038","0.0286","","","0.0739","0.0851","","","","","","1.003","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504023","8.681","0.008","8.861","0.009","14.809","0.014","105.63","0.013","103.226","0.012","91.186","0.013","1063.8","1.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H21 Cd N8 S2 -","- C17 H21 Cd N8 S2 -","- C34 H42 Cd2 N16 S4 -","2","1","","Jin, Shouwen; Chen, Wanzhi; Qiu, Huayu","Syntheses and Structural Characterization of a One-Dimensional Chain, Two-Dimensional Noninterpenetrated Grid, and Three-Dimensional Polycatenane Coordination Polymers Assembled from Flexible Bidentate Imidazolyl Ligands","Crystal Growth & Design","2007","7","10","2071","","10.1021/cg060666q","","","0.71073","MoKα","","0.1288","0.096","","","0.2351","0.2573","","","","","","1.036","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504024","8.153","0.0016","17.81","0.004","9.0426","0.0018","90","","110.93","0.03","90","","1226.4","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H28 Cd N10 O6 -","- C20 H28 Cd N10 O6 -","- C40 H56 Cd2 N20 O12 -","2","0.5","","Jin, Shouwen; Chen, Wanzhi; Qiu, Huayu","Syntheses and Structural Characterization of a One-Dimensional Chain, Two-Dimensional Noninterpenetrated Grid, and Three-Dimensional Polycatenane Coordination Polymers Assembled from Flexible Bidentate Imidazolyl Ligands","Crystal Growth & Design","2007","7","10","2071","","10.1021/cg060666q","","","0.71073","MoKα","","0.0608","0.0561","","","0.1561","0.161","","","","","","1.039","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504025","8.252","0.018","9.674","0.019","11.76","0.02","99.71","0.05","97.52","0.04","104.18","0.05","882","3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H42 Cd N8 O6 S2 -","- C34 H42 Cd N8 O6 S2 -","- C34 H42 Cd N8 O6 S2 -","1","0.5","","Jin, Shouwen; Chen, Wanzhi; Qiu, Huayu","Syntheses and Structural Characterization of a One-Dimensional Chain, Two-Dimensional Noninterpenetrated Grid, and Three-Dimensional Polycatenane Coordination Polymers Assembled from Flexible Bidentate Imidazolyl Ligands","Crystal Growth & Design","2007","7","10","2071","","10.1021/cg060666q","","","0.71073","MoKα","","0.075","0.0583","","","0.1543","0.1702","","","","","","1.054","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504026","13.854","0.002","13.854","0.002","17.222","0.003","90","","90","","120","","2862.6","0.8","298","2","298","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C30 H42 N14 Ni O6 -","- C30 H42 N14 Ni O6 -","- C90 H126 N42 Ni3 O18 -","3","0.166667","","Jin, Shouwen; Chen, Wanzhi; Qiu, Huayu","Syntheses and Structural Characterization of a One-Dimensional Chain, Two-Dimensional Noninterpenetrated Grid, and Three-Dimensional Polycatenane Coordination Polymers Assembled from Flexible Bidentate Imidazolyl Ligands","Crystal Growth & Design","2007","7","10","2071","","10.1021/cg060666q","","","0.71073","MoKα","","0.1129","0.0724","","","0.1898","0.2323","","","","","","1.02","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504027","13.267","0.002","19.111","0.004","14.501","0.003","90","","91.1","0.004","90","","3676","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 Co N6 O9 S2 -","- C34 H32 Co N6 O9 S2 -","- C136 H128 Co4 N24 O36 S8 -","4","1","","Huang, Kexuan; Xu, Zhengjiang; Li, Yizhi; Zheng, Hegen","Guest-Induced Helical Metallacyclic Chains in a Porous Coordination Solid Constructed from a Flexible Ester-Containing Ligand","Crystal Growth & Design","2007","7","2","202","","10.1021/cg060667i","","","0.71073","MoKα","","0.1444","0.0735","","","0.1594","0.1706","","","","","","1.183","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504028","18.23","0.004","14.013","0.003","7.3665","0.0017","90","","90.23","0.004","90","","1881.8","0.7","273","2","273","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C30 H30 Co N6 O11 S2 -","- C30 H30 Co N6 O11 S2 -","- C60 H60 Co2 N12 O22 S4 -","2","0.25","","Huang, Kexuan; Xu, Zhengjiang; Li, Yizhi; Zheng, Hegen","Guest-Induced Helical Metallacyclic Chains in a Porous Coordination Solid Constructed from a Flexible Ester-Containing Ligand","Crystal Growth & Design","2007","7","2","202","","10.1021/cg060667i","","","0.71073","MoKα","","0.0763","0.0471","","","0.0683","0.0716","","","","","","1.015","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4504029","4.9618","0.0014","16.979","0.005","18.354","0.005","90","","91.968","0.005","90","","1545.3","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H12 Cu N4 O6 S -","- C11 H12 Cu N4 O6 S -","- C44 H48 Cu4 N16 O24 S4 -","4","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Remarkably Stable Porous Assembly of Nanorods Derived from a Simple Metal−Organic Framework","Crystal Growth & Design","2007","7","2","205","","10.1021/cg0606693","","","0.71073","MoKα","","0.0958","0.0643","","","0.1426","0.1672","","","","","","1.031","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504030","7.5168","0.0008","21.771","0.002","12.1053","0.001","90","","122.872","0.005","90","","1663.8","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H18 Cu N4 O9 S -","- C11 H18 Cu N4 O9 S -","- C44 H72 Cu4 N16 O36 S4 -","4","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Remarkably Stable Porous Assembly of Nanorods Derived from a Simple Metal−Organic Framework","Crystal Growth & Design","2007","7","2","205","","10.1021/cg0606693","","","0.71073","MoKα","","0.0607","0.0478","","","0.1162","0.123","","","","","","1.036","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504031","10.6102","0.0003","16.4684","0.0004","13.9943","0.0005","90","","93.248","0.001","90","","2441.34","0.13","170","2","170","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methylamide of the 7,7-dimethyl-5-hydroxymethyl- 6-oxabicyclo[3.2.1]-1-carboxylic acid [1a]","","- C12 H21 N O3 -","- C12 H21 N O3 -","- C96 H168 N8 O24 -","8","2","","Foces-Foces, Concepción; López-Rodríguez, Matías; Pérez, Cirilo; Martín, Julio D.; Pérez-Hernández, Natalia","Role of the Molecular Conformation in the Two- and Three-Dimensional Supramolecular Structure of 10 Hydroxyl-N-alkylamides","Crystal Growth & Design","2007","7","5","905","","10.1021/cg060671u","","","0.71069","MoKα","","0.0855","0.0709","","","0.1848","0.1993","","","","","","0.992","","","","has coordinates,has disorder","179575","2020-10-21","18:00:00",""
"4504032","23.744","0.0007","11.958","0.0003","24.2389","0.0008","90","","91.506","0.002","90","","6879.8","0.4","170","2","170","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","Bencylamide of 7,7-dimethyl-5-hydroxymethyl-6-oxa-bicyclo[3.2.1] -1-carboxylic acid [1d]","","- C18 H25 N O3 -","- C18 H25 N O3 -","- C288 H400 N16 O48 -","16","2","","Foces-Foces, Concepción; López-Rodríguez, Matías; Pérez, Cirilo; Martín, Julio D.; Pérez-Hernández, Natalia","Role of the Molecular Conformation in the Two- and Three-Dimensional Supramolecular Structure of 10 Hydroxyl-N-alkylamides","Crystal Growth & Design","2007","7","5","905","","10.1021/cg060671u","","","0.71073","MoKα","","0.0987","0.0804","","","0.2125","0.2465","","","","","","1.074","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504033","15.566","0.016","8.69","0.02","21.4","0.02","90","","93.521","0.007","90","","2889","8","170","2","170","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methylamide of 7,7-diethyl-5-hydroxymethyl-6-oxa-bicyclo[3.2.1] -1-carboxylic acid [1e]","","- C14 H25 N O3 -","- C14 H25 N O3 -","- C112 H200 N8 O24 -","8","2","","Foces-Foces, Concepción; López-Rodríguez, Matías; Pérez, Cirilo; Martín, Julio D.; Pérez-Hernández, Natalia","Role of the Molecular Conformation in the Two- and Three-Dimensional Supramolecular Structure of 10 Hydroxyl-N-alkylamides","Crystal Growth & Design","2007","7","5","905","","10.1021/cg060671u","","","0.71073","MoKα","","0.0754","0.0617","","","0.1403","0.1484","","","","","","1.066","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504034","15.623","0.003","9.032","0.0016","21.497","0.011","90","","93.831","0.016","90","","3026.6","1.7","170","2","170","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethylamide of 7,7-diethyl-5-hydroxymethyl-6-oxa-bicyclo[3.2.1] -1-carboxylic acid [1f]","","- C15 H27 N O3 -","- C15 H27 N O3 -","- C120 H216 N8 O24 -","8","2","","Foces-Foces, Concepción; López-Rodríguez, Matías; Pérez, Cirilo; Martín, Julio D.; Pérez-Hernández, Natalia","Role of the Molecular Conformation in the Two- and Three-Dimensional Supramolecular Structure of 10 Hydroxyl-N-alkylamides","Crystal Growth & Design","2007","7","5","905","","10.1021/cg060671u","","","0.71073","MoKα","","0.0713","0.0641","","","0.1632","0.1722","","","","","","1.083","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504035","9.667","0.0002","12.775","0.0003","14.017","0.0004","87.533","0.002","89.161","0.001","69.512","0.001","1620.04","0.07","170","2","170","2","","","","","","","","4","P -1","-P 1","2","","Propylamide of 7,7-diethyl-5-hydroxymethyl-6-oxabicyclo[3.2.1] -1-carboxylic acid [1g]","","- C16 H29 N O3 -","- C16 H29 N O3 -","- C64 H116 N4 O12 -","4","2","","Foces-Foces, Concepción; López-Rodríguez, Matías; Pérez, Cirilo; Martín, Julio D.; Pérez-Hernández, Natalia","Role of the Molecular Conformation in the Two- and Three-Dimensional Supramolecular Structure of 10 Hydroxyl-N-alkylamides","Crystal Growth & Design","2007","7","5","905","","10.1021/cg060671u","","","0.71073","MoKα","","0.1068","0.0874","","","0.2017","0.2345","","","","","","1.055","","","","has coordinates,has disorder","179575","2020-10-21","18:00:00",""
"4504036","24.332","0.006","24.332","0.006","12.343","0.008","90","","90","","90","","7308","5","170","2","170","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Bencylamide of 7,7-diethyl-5-hydroxymethyl-6-oxa-bicyclo[3.2.1] -1-carboxylic acid [1h]","","- C20 H29 N O3 -","- C20 H29 N O3 -","- C320 H464 N16 O48 -","16","1","","Foces-Foces, Concepción; López-Rodríguez, Matías; Pérez, Cirilo; Martín, Julio D.; Pérez-Hernández, Natalia","Role of the Molecular Conformation in the Two- and Three-Dimensional Supramolecular Structure of 10 Hydroxyl-N-alkylamides","Crystal Growth & Design","2007","7","5","905","","10.1021/cg060671u","","","0.71073","MoKα","","0.1034","0.0955","","","0.2384","0.2441","","","","","","1.088","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504037","9.32","0.02","14.022","0.016","13.882","0.019","67.059","0.014","78.23","0.05","80.88","0.04","1629","5","170","2","170","2","","","","","","","","4","P -1","-P 1","2","","Methylamide of 7,7-dipropyl-5-hydroxymethyl-6-oxa-bicyclo[3.2.1] -1-carboxylic acid [1i]","","- C16 H29 N O3 -","- C16 H29 N O3 -","- C64 H116 N4 O12 -","4","2","","Foces-Foces, Concepción; López-Rodríguez, Matías; Pérez, Cirilo; Martín, Julio D.; Pérez-Hernández, Natalia","Role of the Molecular Conformation in the Two- and Three-Dimensional Supramolecular Structure of 10 Hydroxyl-N-alkylamides","Crystal Growth & Design","2007","7","5","905","","10.1021/cg060671u","","","0.71073","MoKα","","0.0678","0.0561","","","0.1465","0.155","","","","","","1.086","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504038","10.237","0.0002","16.077","0.0004","21.155","0.0006","90","","90","","90","","3481.7","0.15","170","2","170","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Ethylamide of 7,7-dipropyl-5-hydroxymethyl-6-oxa-bicyclo[3.2.1] -1-carboxylic acid [1j]","","- C17 H31 N O3 -","- C17 H31 N O3 -","- C136 H248 N8 O24 -","8","1","","Foces-Foces, Concepción; López-Rodríguez, Matías; Pérez, Cirilo; Martín, Julio D.; Pérez-Hernández, Natalia","Role of the Molecular Conformation in the Two- and Three-Dimensional Supramolecular Structure of 10 Hydroxyl-N-alkylamides","Crystal Growth & Design","2007","7","5","905","","10.1021/cg060671u","","","0.71073","MoKα","","0.102","0.0687","","","0.1817","0.2142","","","","","","1.09","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504039","24.666","0.0005","24.666","0.0005","10.555","0.0004","90","","90","","90","","6421.8","0.3","170","2","170","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","Ethylamide of 7,7-dicyclopropyl-5-hydroxymethyl-6-oxa-bicyclo[3.2.1] -1-carboxylic acid [1n]","","- C17 H27 N O3 -","- C17 H27 N O3 -","- C272 H432 N16 O48 -","16","1","","Foces-Foces, Concepción; López-Rodríguez, Matías; Pérez, Cirilo; Martín, Julio D.; Pérez-Hernández, Natalia","Role of the Molecular Conformation in the Two- and Three-Dimensional Supramolecular Structure of 10 Hydroxyl-N-alkylamides","Crystal Growth & Design","2007","7","5","905","","10.1021/cg060671u","","","0.71073","MoKα","","0.0941","0.0839","","","0.2093","0.2256","","","","","","1.045","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504040","15.39","0.0017","10.779","0.0017","23.333","0.01","90","","90","","90","","3870.7","1.8","170","2","170","2","","","","","","","","4","P n a 21","P 2c -2n","33","","Bencylamide of 7,7-dicyclopropyl-5-hydroxymethyl-6- oxa-bicyclo[3.2.1] -1-carboxylic acid [1p]","","- C22 H29 N O3 -","- C22 H29 N O3 -","- C176 H232 N8 O24 -","8","2","","Foces-Foces, Concepción; López-Rodríguez, Matías; Pérez, Cirilo; Martín, Julio D.; Pérez-Hernández, Natalia","Role of the Molecular Conformation in the Two- and Three-Dimensional Supramolecular Structure of 10 Hydroxyl-N-alkylamides","Crystal Growth & Design","2007","7","5","905","","10.1021/cg060671u","","","0.71073","MoKα","","0.0904","0.0729","","","0.1728","0.1971","","","","","","1.071","","","","has coordinates,has disorder","179575","2020-10-21","18:00:00",""
"4504041","5.0536","0.001","8.3267","0.0016","30.561","0.006","90","","92.69","0.004","90","","1284.6","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H24 Cd N2 O4 -","- C32 H24 Cd N2 O4 -","- C64 H48 Cd2 N4 O8 -","2","0.5","","Wu, Chuan-De; Ayyappan, Ponnaiyan; Evans, Owen R.; Lin, Wenbin","Synthesis and X-ray Structures of Cadmium Coordination Polymers Based on New Pyridine−Carboxylate and Imidazole−Carboxylate Linkers","Crystal Growth & Design","2007","7","9","1690","","10.1021/cg060677j","","","0.71073","MoKα","","0.0348","0.0292","","","0.0785","0.0915","","","","","","1.268","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504042","5.249","0.003","14.977","0.006","15.755","0.009","90","","94.57","0.02","90","","1234.6","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H24 Cd N2 O4 -","- C32 H24 Cd N2 O4 -","- C64 H48 Cd2 N4 O8 -","2","0.5","","Wu, Chuan-De; Ayyappan, Ponnaiyan; Evans, Owen R.; Lin, Wenbin","Synthesis and X-ray Structures of Cadmium Coordination Polymers Based on New Pyridine−Carboxylate and Imidazole−Carboxylate Linkers","Crystal Growth & Design","2007","7","9","1690","","10.1021/cg060677j","","","0.71073","MoKα","","0.0313","0.0241","","","0.0618","0.0648","","","","","","1.09","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504043","18.799","0.002","7.7538","0.001","19.174","0.003","90","","90","","90","","2794.9","0.6","566","2","566","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H12 Cd N2 O4 -","- C14 H12 Cd N2 O4 -","- C112 H96 Cd8 N16 O32 -","8","1","","Wu, Chuan-De; Ayyappan, Ponnaiyan; Evans, Owen R.; Lin, Wenbin","Synthesis and X-ray Structures of Cadmium Coordination Polymers Based on New Pyridine−Carboxylate and Imidazole−Carboxylate Linkers","Crystal Growth & Design","2007","7","9","1690","","10.1021/cg060677j","","","0.71073","MoKα","","0.0706","0.0506","","","0.1242","0.1373","","","","","","1.077","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504044","6.7085","0.0013","11.437","0.002","12.53","0.003","90","","95.41","0.03","90","","957.1","0.3","298","2","298","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C2 H11 B5 N2 O9 -","- C2 H11 B5 N2 O9 -","- C8 H44 B20 N8 O36 -","4","1","","Yang, Sihai; Li, Guobao; Tian, Shujian; Liao, Fuhui; Lin, Jianhua","Synthesis and Structure of [C2H10N2][B5O8(OH)]: A Nonmetal Pentaborate with Nonlinear Optical Properties","Crystal Growth & Design","2007","7","7","1246","1250","10.1021/cg0606794","","","0.71073","MoKα","","0.0325","0.0324","","","0.0818","0.0821","","","","","","1","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504045","11.101","0.002","7.2843","0.0015","7.5086","0.0015","90","","94.49","0.03","90","","605.3","0.2","298","2","298","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C2 H8 N2 O3 W -","- C2 H8 N2 O3 W -","- C8 H32 N8 O12 W4 -","4","1","","Yang, Sihai; Li, Guobao; Tian, Shujian; Liao, Fuhui; Lin, Jianhua","Synthesis and Structure of [C2H10N2][B5O8(OH)]: A Nonmetal Pentaborate with Nonlinear Optical Properties","Crystal Growth & Design","2007","7","7","1246","1250","10.1021/cg0606794","","","0.71073","MoKα","","0.0788","0.0785","","","0.1935","0.1949","","","","","","1","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504046","9.859","0.01","17.5","0.017","17.384","0.017","90","","91.609","0.016","90","","2998","5","153","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","hexaniobate salt","","","- H30 K Li7 Nb6 O34 -","- K Li7 Nb6 O34 -","- K4 Li28 Nb24 O136 -","4","1","","Anderson, Travis M.; Thoma, Steven G.; Bonhomme, François; Rodriguez, Mark A.; Park, Hyunsoo; Parise, John B.; Alam, Todd M.; Larentzos, James P.; Nyman, May","Lithium Polyniobates. A Lindqvist-Supported Lithium−Water Adamantane Cluster and Conversion of Hexaniobate to a Discrete Keggin Complex","Crystal Growth & Design","2007","7","4","719","","10.1021/cg0606904","","","0.71073","MoKα","","0.0573","0.0494","","","0.1499","0.1635","","","","","","0.986","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504047","20.341","0.004","10.735","0.002","21.438","0.004","90","","105.41","0.03","90","","4512.9","1.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- K Li8 Nb12 O52.5 Si -","- K Li8 Nb12 O52.5 Si -","- K4 Li32 Nb48 O210 Si4 -","4","1","","Anderson, Travis M.; Thoma, Steven G.; Bonhomme, François; Rodriguez, Mark A.; Park, Hyunsoo; Parise, John B.; Alam, Todd M.; Larentzos, James P.; Nyman, May","Lithium Polyniobates. A Lindqvist-Supported Lithium−Water Adamantane Cluster and Conversion of Hexaniobate to a Discrete Keggin Complex","Crystal Growth & Design","2007","7","4","719","","10.1021/cg0606904","","x-ray","0.49594","synchrotron","","0.0928","0.0649","","","0.1632","0.1723","","","","","","0.973","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504048","41.581","0.003","12.0465","0.0009","23.3707","0.0018","90","","92.224","0.001","90","","11697.7","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C264 H164 Cd12 N48 O58 -","- C264 H144 Cd12 N48 O58 -","- C528 H288 Cd24 N96 O116 -","2","0.25","","Wang, Xiu-Li; Bi, Yan-Feng; Lin, Hong-Yan; Liu, Guo-Cheng","Three Novel Cd(II) Metal−Organic Frameworks Constructed from Mixed Ligands of Dipyrido[3,2-d:2‘,3‘-f]quinoxaline and Benzene-dicarboxylate: From a 1-D Ribbon, 2-D Layered Network, to a 3-D Architecture","Crystal Growth & Design","2007","7","6","1086","","10.1021/cg060712m","","","0.71073","MoKα","","0.0656","0.0404","","","0.1003","0.1145","","","","","","1.061","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504049","12.617","0.006","13.153","0.006","11.107","0.005","90","","91.425","0.005","90","","1842.7","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H14 Cd N4 O5 -","- C22 H14 Cd N4 O5 -","- C88 H56 Cd4 N16 O20 -","4","1","","Wang, Xiu-Li; Bi, Yan-Feng; Lin, Hong-Yan; Liu, Guo-Cheng","Three Novel Cd(II) Metal−Organic Frameworks Constructed from Mixed Ligands of Dipyrido[3,2-d:2‘,3‘-f]quinoxaline and Benzene-dicarboxylate: From a 1-D Ribbon, 2-D Layered Network, to a 3-D Architecture","Crystal Growth & Design","2007","7","6","1086","","10.1021/cg060712m","","","0.71073","MoKα","","0.0467","0.0299","","","0.0672","0.0742","","","","","","0.995","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504050","14.8793","0.0019","13.3752","0.0017","24.586","0.003","90","","99.691","0.002","90","","4823.1","1","294","2","294","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C112 H70 Cd4 N16 O19 -","- C112 H64 Cd4 N16 O19 -","- C224 H128 Cd8 N32 O38 -","2","0.5","","Wang, Xiu-Li; Bi, Yan-Feng; Lin, Hong-Yan; Liu, Guo-Cheng","Three Novel Cd(II) Metal−Organic Frameworks Constructed from Mixed Ligands of Dipyrido[3,2-d:2‘,3‘-f]quinoxaline and Benzene-dicarboxylate: From a 1-D Ribbon, 2-D Layered Network, to a 3-D Architecture","Crystal Growth & Design","2007","7","6","1086","","10.1021/cg060712m","","","0.71073","MoKα","","0.0928","0.0418","","","0.0724","0.0874","","","","","","0.987","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504051","20.3732","0.0008","20.3732","0.0008","20.3732","0.0008","90","","90","","90","","8456.2","0.6","293","2","293","2","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C111 H188 In6 N6 O88 -","- C72 H24 In6 O54 -","- C144 H48 In12 O108 -","2","0.0416667","","Lin, Zheng-Zhong; Jiang, Fei-Long; Chen, Lian; Yue, Cheng-Yang; Yuan, Da-Qiang; Lan, An-Jian; Hong, Mao-Chun","A Highly Symmetric Porous Framework with Multi-intersecting Open Channels","Crystal Growth & Design","2007","7","9","1712","","10.1021/cg060732o","","","0.71073","MoKα","","0.0582","0.057","","","0.1477","0.1484","","","","","","1.055","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504052","14.05","0.003","12.517","0.003","15.377","0.003","90","","97.95","0.03","90","","2678.3","1","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H30 N24 O21.06 S2 Zn7 -","- C32 H30 N24 O21.06 S2 Zn7 -","- C64 H60 N48 O42.12 S4 Zn14 -","2","0.5","","Park, Hyunsoo; Krigsfeld, Gabriel; Parise, John B.","Solvothermal Synthesis and Structural Characterization of New Zn−Triazole−Sulfoisophthalate Frameworks","Crystal Growth & Design","2007","7","4","736","","10.1021/cg060741x","","x-ray","0.71073","MoKα","","0.0436","0.0401","","","0.0931","0.0947","","","","","","1.088","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504053","9.7012","0.0019","12.442","0.003","17.218","0.003","89.83","0.03","75.01","0.03","73.33","0.03","1917.5","0.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","Zinc Sodium Triazole Sulfoisophthalate","","","- C48 H52 N16 Na2 O32.8 S4 Zn5 -","- C48 H52 N16 Na2 O32.78 S4 Zn5 -","- C48 H52 N16 Na2 O32.78 S4 Zn5 -","1","0.5","","Park, Hyunsoo; Krigsfeld, Gabriel; Parise, John B.","Solvothermal Synthesis and Structural Characterization of New Zn−Triazole−Sulfoisophthalate Frameworks","Crystal Growth & Design","2007","7","4","736","","10.1021/cg060741x","","x-ray","0.49594","synchrotron","","0.0513","0.0476","","","0.1274","0.1296","","","","","","1.124","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504054","7.7069","0.0002","8.4282","0.0002","14.4344","0.0003","79.638","0.001","74.987","0.001","72.616","0.001","858.87","0.04","173","2","173","2","","","","","","","","5","P -1","-P 1","2","piroxicam:succinic acid cocrystal (2:1)","4-Hydroxy-2-methyl-N-(2-pyridyl)-2H-1,2-benzothiazine -3-carboxamide-1,1-dioxide succinic acid","","- C17 H16 N3 O6 S -","- C17 H16 N3 O6 S -","- C34 H32 N6 O12 S2 -","2","1","","Childs, Scott L.; Hardcastle, Kenneth I.","Cocrystals of Piroxicam with Carboxylic Acids","Crystal Growth & Design","2007","7","7","1291","","10.1021/cg060742p","","","1.54178","CuKα","","0.03","0.0296","","","0.0817","0.0822","","","","","","1.058","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504055","6.9743","0.0006","12.3558","0.0009","14.9892","0.0014","114.045","0.006","92.672","0.007","95.105","0.006","1170.02","0.18","173","2","173","2","","","","","","","","5","P -1","-P 1","2","piroxicam:1-hydroxy-2-naphthoic acid cocrystal (1:1)","4-Hydroxy-2-methyl-N-(2-pyridyl)-2H-1,2-benzothiazine -3-carboxamide-1,1-dioxide 1-hydroxy-2-naphthoic acid","","- C26 H21 N3 O7 S -","- C26 H21 N3 O7 S -","- C52 H42 N6 O14 S2 -","2","1","","Childs, Scott L.; Hardcastle, Kenneth I.","Cocrystals of Piroxicam with Carboxylic Acids","Crystal Growth & Design","2007","7","7","1291","","10.1021/cg060742p","","","1.54178","CuKα","","0.0632","0.048","","","0.124","0.1447","","","","","","1.058","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504056","8.4286","0.0006","9.7241","0.0006","15.206","0.0009","94.674","0.003","105.723","0.003","97.953","0.003","1178.83","0.13","173","2","173","2","","","","","","","","5","P -1","-P 1","2","piroxicam:caprylic acid cocrystal (1:1)","4-Hydroxy-2-methyl-N-(2-pyridyl)-2H-1,2-benzothiazine -3-carboxamide-1,1-dioxide 1-heptanecarboxylic acid","","- C23 H29 N3 O6 S -","- C23 H29 N3 O6 S -","- C46 H58 N6 O12 S2 -","2","1","","Childs, Scott L.; Hardcastle, Kenneth I.","Cocrystals of Piroxicam with Carboxylic Acids","Crystal Growth & Design","2007","7","7","1291","","10.1021/cg060742p","","","1.54178","CuKα","","0.1379","0.0855","","","0.2029","0.2715","","","","","","1.075","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504057","15.692","0.008","16.195","0.007","6.999","0.003","90","","101.72","0.011","90","","1741.6","1.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","piroxicam:malonic acid","4-Hydroxy-2-methyl-N-(2-pyridyl)-2H-1,2-benzothiazine -3-carboxamide-1,1-dioxide malonic acid","","- C30 H26 N6 O8 S2 -","- C30 H26 N6 O8 S2 -","- C60 H52 N12 O16 S4 -","2","0.5","","Childs, Scott L.; Hardcastle, Kenneth I.","Cocrystals of Piroxicam with Carboxylic Acids","Crystal Growth & Design","2007","7","7","1291","","10.1021/cg060742p","","","1.54178","CuKα","","0.1243","0.0853","","","0.2426","0.2641","","","","","","1.057","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504058","9.3201","0.001","16.4366","0.0017","14.2134","0.0015","90","","100.561","0.002","90","","2140.5","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","piroxicam:4-hydroxybenzoic acid cocrystal, Form 1 (1:1)","4-Hydroxy-2-methyl-N-(2-pyridyl)-2H-1,2-benzothiazine -3-carboxamide-1,1-dioxide 4-hydroxybenzoic acid","","- C22 H19 N3 O7 S -","- C22 H19 N3 O7 S -","- C88 H76 N12 O28 S4 -","4","1","","Childs, Scott L.; Hardcastle, Kenneth I.","Cocrystals of Piroxicam with Carboxylic Acids","Crystal Growth & Design","2007","7","7","1291","","10.1021/cg060742p","","","0.71073","MoKα","","0.0573","0.0508","","","0.1166","0.1205","","","","","","1.07","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504059","7.4086","0.001","10.9004","0.0015","12.9268","0.0017","95.965","0.003","100.576","0.003","96.858","0.002","1010.3","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","piroxicam:4-hydroxybenzoic acid cocrystal, Form 2 (1:1)","4-Hydroxy-2-methyl-N-(2-pyridyl)-2H-1,2-benzothiazine -3-carboxamide-1,1-dioxide 4-hydroxybenzoic acid","","- C22 H19 N3 O7 S -","- C22 H19 N3 O7 S -","- C44 H38 N6 O14 S2 -","2","1","","Childs, Scott L.; Hardcastle, Kenneth I.","Cocrystals of Piroxicam with Carboxylic Acids","Crystal Growth & Design","2007","7","7","1291","","10.1021/cg060742p","","","0.71073","MoKα","","0.0669","0.0532","","","0.1388","0.1468","","","","","","1.132","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504060","8.7433","0.0012","10.9557","0.0015","16.633","0.002","86.335","0.003","89.03","0.002","84.809","0.003","1583.4","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","piroxicam:fumaric acid cocrystal (4:1)","4-Hydroxy-2-methyl-N-(2-pyridyl)-2H-1,2-benzothiazine -3-carboxamide-1,1-dioxide fumaric acid","","- C32 H28 N6 O10 S2 -","- C32 H28 N6 O10 S2 -","- C64 H56 N12 O20 S4 -","2","1","","Childs, Scott L.; Hardcastle, Kenneth I.","Cocrystals of Piroxicam with Carboxylic Acids","Crystal Growth & Design","2007","7","7","1291","","10.1021/cg060742p","","","0.71073","MoKα","","0.0592","0.0481","","","0.1138","0.12","","","","","","1.031","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504061","10.579","0.0008","21.0495","0.0016","9.2413","0.0008","90","","95.152","0.004","90","","2049.6","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","piroxicam:benzoic acid cocrystal (1:1)","4-Hydroxy-2-methyl-N-(2-pyridyl)-2H-1,2-benzothiazine -3-carboxamide-1,1-dioxide benzoic acid","","- C22 H19 N3 O6 S -","- C22 H19 N3 O6 S -","- C88 H76 N12 O24 S4 -","4","1","","Childs, Scott L.; Hardcastle, Kenneth I.","Cocrystals of Piroxicam with Carboxylic Acids","Crystal Growth & Design","2007","7","7","1291","","10.1021/cg060742p","","","1.54178","CuKα","","0.0645","0.0395","","","0.092","0.104","","","","","","1.003","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504062","10.5355","0.0013","12.7289","0.0014","13.1794","0.0014","102.048","0.006","99.758","0.007","109.836","0.008","1569.5","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","piroxicam:p-dioxane solvate (4:1)","4-Hydroxy-2-methyl-N-(2-pyridyl)-2H-1,2-benzothiazine -3-carboxamide-1,1-dioxide 1,4-diethylene dioxide","","- C16 H15 N3 O4.5 S -","- C16 H15 N3 O4.5 S -","- C64 H60 N12 O18 S4 -","4","2","","Childs, Scott L.; Hardcastle, Kenneth I.","Cocrystals of Piroxicam with Carboxylic Acids","Crystal Growth & Design","2007","7","7","1291","","10.1021/cg060742p","","","1.54178","CuKα","","0.1053","0.0584","","","0.1828","0.2303","","","","","","1.115","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504063","19.2377","0.0014","19.2377","0.0014","18.325","0.003","90","","90","","90","","6781.9","1.3","118","2","118","2","","","","","","","","6","P 43","P 4cw","78","","","","- C46 H73 Cu5 Gd N12 O27 -","- C46 H52 Cu5 Gd N12 O25 -","- C184 H208 Cu20 Gd4 N48 O100 -","4","1","","Zaleski, Curtis M.; Cutland-Van Noord, Annabel D.; Kampf, Jeff W.; Pecoraro, Vincent L.","Controlling the Polymorph of LnIII(NO3)3-x(OH)x[15-MCCuII(N)S-pheHA-5] Complexes through Solvent Type and LnIIIIon Choice","Crystal Growth & Design","2007","7","6","1098","","10.1021/cg060743h","","","0.71073","MoKα","","0.0413","0.0368","","","0.0964","0.099","","","","","","1.093","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504064","8.627","0.008","9.035","0.006","13.469","0.008","90","","101.92","0.05","90","","1027.2","1.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1-ethyl-3-methylimidazolium hexafluorophosphate","","","- C6 H11 F6 N2 P -","- C6 H11 F6 N2 P -","- C24 H44 F24 N8 P4 -","4","1","","Reichert, W. Matthew; Holbrey, John D.; Swatloski, Richard P.; Gutowski, Keith E.; Visser, Ann E.; Nieuwenhuyzen, Mark; Seddon, Kenneth R.; Rogers, Robin D.","Solid-State Analysis of Low-Melting 1,3-Dialkylimidazolium Hexafluorophosphate Salts (Ionic Liquids) by Combined X-ray Crystallographic and Computational Analyses","Crystal Growth & Design","2007","7","6","1106","","10.1021/cg060746u","","","0.71073","MoKα","","0.0587","0.0416","","","0.0987","0.1077","","","","","","1.044","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504065","8.253","0.005","11.799","0.007","11.681","0.007","90","","91.853","0.011","90","","1136.9","1.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1-ethyl-2,3-dimethylimidazolium hexafluorophosphate","","","- C7 H13 F6 N2 P -","- C7 H13 F6 N2 P -","- C28 H52 F24 N8 P4 -","4","1","","Reichert, W. Matthew; Holbrey, John D.; Swatloski, Richard P.; Gutowski, Keith E.; Visser, Ann E.; Nieuwenhuyzen, Mark; Seddon, Kenneth R.; Rogers, Robin D.","Solid-State Analysis of Low-Melting 1,3-Dialkylimidazolium Hexafluorophosphate Salts (Ionic Liquids) by Combined X-ray Crystallographic and Computational Analyses","Crystal Growth & Design","2007","7","6","1106","","10.1021/cg060746u","","","0.71073","MoKα","","0.1104","0.083","","","0.2066","0.2212","","","","","","1.075","","","","has coordinates,has disorder","179575","2020-10-21","18:00:00",""
"4504066","8.315","0.004","12.863","0.007","12.748","0.008","90","","106.87","0.04","90","","1304.8","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1-ethyl-2,3,4,5-tetramethylimidazolium hexafluorophosphate","","","- C9 H17 F6 N2 P -","- C9 H17 F6 N2 P -","- C36 H68 F24 N8 P4 -","4","1","","Reichert, W. Matthew; Holbrey, John D.; Swatloski, Richard P.; Gutowski, Keith E.; Visser, Ann E.; Nieuwenhuyzen, Mark; Seddon, Kenneth R.; Rogers, Robin D.","Solid-State Analysis of Low-Melting 1,3-Dialkylimidazolium Hexafluorophosphate Salts (Ionic Liquids) by Combined X-ray Crystallographic and Computational Analyses","Crystal Growth & Design","2007","7","6","1106","","10.1021/cg060746u","","","0.71073","MoKα","","0.1402","0.0618","","","0.117","0.1483","","","","","","1.028","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504067","8.9541","0.0009","8.0375","0.0008","9.6548","0.0009","90","","116.416","0.002","90","","622.29","0.11","153","2","153","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","1-sec-butyl-3-methylimidazolium hexafluorophosphate","","","- C8 H15 F6 N2 P -","- C8 H15 F5.96 N2 P -","- C16 H30 F11.92 N4 P2 -","2","0.5","","Reichert, W. Matthew; Holbrey, John D.; Swatloski, Richard P.; Gutowski, Keith E.; Visser, Ann E.; Nieuwenhuyzen, Mark; Seddon, Kenneth R.; Rogers, Robin D.","Solid-State Analysis of Low-Melting 1,3-Dialkylimidazolium Hexafluorophosphate Salts (Ionic Liquids) by Combined X-ray Crystallographic and Computational Analyses","Crystal Growth & Design","2007","7","6","1106","","10.1021/cg060746u","","","0.71073","MoKα","","0.0833","0.0738","","","0.2147","0.2261","","","","","","1.108","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504068","8.139","0.0008","8.4796","0.0008","9.1333","0.0009","90","","103.697","0.002","90","","612.41","0.1","153","2","153","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","1-tert-butyl-3-methylimidazolium hexafluorophosphate","","","- C8 H15 F6 N2 P -","- C8 H15 F6 N2 P -","- C16 H30 F12 N4 P2 -","2","0.5","","Reichert, W. Matthew; Holbrey, John D.; Swatloski, Richard P.; Gutowski, Keith E.; Visser, Ann E.; Nieuwenhuyzen, Mark; Seddon, Kenneth R.; Rogers, Robin D.","Solid-State Analysis of Low-Melting 1,3-Dialkylimidazolium Hexafluorophosphate Salts (Ionic Liquids) by Combined X-ray Crystallographic and Computational Analyses","Crystal Growth & Design","2007","7","6","1106","","10.1021/cg060746u","","","0.71073","MoKα","","0.0536","0.0431","","","0.1166","0.1232","","","","","","1.057","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504069","9.737","0.003","9.737","0.003","14.161","0.005","90","","90","","90","","1342.6","0.8","173","2","173","2","","","","","","","","5","P 42/n c m :2","-P 4ac 2ac","138","1,3-di-iso-propylimidazolium hexafluorophosphate","","","- C9 H17 F6 N2 P -","- C9 H17 F6 N2 P -","- C36 H68 F24 N8 P4 -","4","0.25","","Reichert, W. Matthew; Holbrey, John D.; Swatloski, Richard P.; Gutowski, Keith E.; Visser, Ann E.; Nieuwenhuyzen, Mark; Seddon, Kenneth R.; Rogers, Robin D.","Solid-State Analysis of Low-Melting 1,3-Dialkylimidazolium Hexafluorophosphate Salts (Ionic Liquids) by Combined X-ray Crystallographic and Computational Analyses","Crystal Growth & Design","2007","7","6","1106","","10.1021/cg060746u","","","0.71073","MoKα","","0.034","0.0284","","","0.0844","0.0874","","","","","","1.115","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504070","20.4684","0.0014","9.8087","0.0006","9.3107","0.0006","90","","99.339","0.001","90","","1844.5","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1-decyl-3-methylimidazolium hexafluorophosphate","","","- C14 H27 F6 N2 P -","- C14 H27 F6 N2 P -","- C56 H108 F24 N8 P4 -","4","1","","Reichert, W. Matthew; Holbrey, John D.; Swatloski, Richard P.; Gutowski, Keith E.; Visser, Ann E.; Nieuwenhuyzen, Mark; Seddon, Kenneth R.; Rogers, Robin D.","Solid-State Analysis of Low-Melting 1,3-Dialkylimidazolium Hexafluorophosphate Salts (Ionic Liquids) by Combined X-ray Crystallographic and Computational Analyses","Crystal Growth & Design","2007","7","6","1106","","10.1021/cg060746u","","","0.71073","MoKα","","0.0509","0.0436","","","0.109","0.115","","","","","","1.08","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504071","24.2881","0.001","9.8845","0.0005","9.2292","0.0004","90","","90.508","0.001","90","","2215.62","0.17","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1-tetradecyl-3-methylimidazolium hexafluorophosphate","","","- C18 H35 F6 N2 P -","- C18 H35 F6 N2 P -","- C72 H140 F24 N8 P4 -","4","1","","Reichert, W. Matthew; Holbrey, John D.; Swatloski, Richard P.; Gutowski, Keith E.; Visser, Ann E.; Nieuwenhuyzen, Mark; Seddon, Kenneth R.; Rogers, Robin D.","Solid-State Analysis of Low-Melting 1,3-Dialkylimidazolium Hexafluorophosphate Salts (Ionic Liquids) by Combined X-ray Crystallographic and Computational Analyses","Crystal Growth & Design","2007","7","6","1106","","10.1021/cg060746u","","","0.71073","MoKα","","0.1249","0.0511","","","0.0927","0.1182","","","","","","1.004","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504072","12.8865","0.0015","16.3849","0.0019","21.553","0.003","90","","104.326","0.002","90","","4409.3","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- Cl4 H74 Na6 Ni6 O98 W18 -","- Cl4 Na6 Ni6 O98 W18 -","- Cl8 Na12 Ni12 O196 W36 -","2","0.5","","Wang, Jingping; Ma, Pengtao; Shen, Yue; Niu, Jingyang","A Novel Polyoxotungstate [Ni4(H2O)2(α-NiW9O34)2]16-Based on an Old Structure with a New Component","Crystal Growth & Design","2007","7","4","603","","10.1021/cg060751y","","","0.71073","MoKα","","0.0717","0.0512","","","0.1225","0.1316","","","","","","0.994","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504073","7.418","0.003","18.016","0.005","14.851","0.003","90","","90","","90","","1984.7","1.1","293","2","293","2","","","","","","","","5","C c m 21","C 2c -2c","36","","","","- C10 H26 Mn O15 S2 -","- C10 H20 Mn O15 S2 -","- C40 H80 Mn4 O60 S8 -","4","0.5","","Braga, Dario; Gandolfi, Massimo; Lusi, Matteo; Polito, Marco; Rubini, Katia; Grepioni, Fabrizia","Solution and Solid-State Preparation of 18-Crown-6 and 15-Crown-5 Adducts of Hydrogen Sulfate Salts and an Investigation of the Reversible Dehydration Processes","Crystal Growth & Design","2007","7","5","919","","10.1021/cg0607598","","","0.71073","MoKα","","0.0555","0.054","","","0.1516","0.1546","","","","","","1.038","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504074","7.511","0.003","18.212","0.006","14.92","0.006","90","","90","","90","","2040.9","1.3","293","2","293","2","","","","","","","","5","C c m 21","C 2c -2c","36","","","","- C10 H26 Cd O15 S2 -","- C10 H20 Cd O15 S2 -","- C40 H80 Cd4 O60 S8 -","4","0.5","","Braga, Dario; Gandolfi, Massimo; Lusi, Matteo; Polito, Marco; Rubini, Katia; Grepioni, Fabrizia","Solution and Solid-State Preparation of 18-Crown-6 and 15-Crown-5 Adducts of Hydrogen Sulfate Salts and an Investigation of the Reversible Dehydration Processes","Crystal Growth & Design","2007","7","5","919","","10.1021/cg0607598","","","0.71073","MoKα","","0.0566","0.0541","","","0.1271","0.131","","","","","","0.969","","","","has coordinates,has disorder","179575","2020-10-21","18:00:00",""
"4504075","7.6336","0.0004","10.5457","0.0005","12.9774","0.0006","103.899","0.001","105.679","0.001","96.469","0.001","958.59","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H30 O13 S -","- C10 H30 O13 S -","- C20 H60 O26 S2 -","2","1","","Braga, Dario; Gandolfi, Massimo; Lusi, Matteo; Polito, Marco; Rubini, Katia; Grepioni, Fabrizia","Solution and Solid-State Preparation of 18-Crown-6 and 15-Crown-5 Adducts of Hydrogen Sulfate Salts and an Investigation of the Reversible Dehydration Processes","Crystal Growth & Design","2007","7","5","919","","10.1021/cg0607598","","","0.71073","MoKα","","0.0966","0.0615","","","0.1701","0.2019","","","","","","0.979","","","","has coordinates,has disorder","179575","2020-10-21","18:00:00",""
"4504076","10.336","0.005","10.418","0.006","10.648","0.003","76.58","0.04","77.71","0.03","76.96","0.04","1070.8","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H26 O14 Pb S2 -","- C12 H26 O14 Pb S2 -","- C24 H52 O28 Pb2 S4 -","2","1","","Braga, Dario; Gandolfi, Massimo; Lusi, Matteo; Polito, Marco; Rubini, Katia; Grepioni, Fabrizia","Solution and Solid-State Preparation of 18-Crown-6 and 15-Crown-5 Adducts of Hydrogen Sulfate Salts and an Investigation of the Reversible Dehydration Processes","Crystal Growth & Design","2007","7","5","919","","10.1021/cg0607598","","","0.71073","MoKα","","0.0399","0.0348","","","0.0897","0.0927","","","","","","1.037","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504077","11.079","0.004","8.22","0.004","11.525","0.005","90","","112.95","0.05","90","","966.5","0.8","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H30 O12 S -","- C12 H24 O12 S -","- C24 H48 O24 S2 -","2","1","","Braga, Dario; Gandolfi, Massimo; Lusi, Matteo; Polito, Marco; Rubini, Katia; Grepioni, Fabrizia","Solution and Solid-State Preparation of 18-Crown-6 and 15-Crown-5 Adducts of Hydrogen Sulfate Salts and an Investigation of the Reversible Dehydration Processes","Crystal Growth & Design","2007","7","5","919","","10.1021/cg0607598","","","0.71073","MoKα","","0.2205","0.0883","","","0.2382","0.3356","","","","","","0.896","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504078","7.317","0.003","19.835","0.009","11.93","0.003","90","","94.86","0.03","90","","1725.2","1.1","292","2","292","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-bis[(imidazol-1-yl)methyl]-4-methylphenol-oxalic acid","","- C17 H18 N4 O5 -","- C17 H18 N4 O5 -","- C68 H72 N16 O20 -","4","1","","Wang, Wen-Hai; Xi, Pei-Hua; Su, Xiao-Yu; Lan, Jing-Bo; Mao, Zhi-Hua; You, Jing-Song; Xie, Ru-Gang","Supramolecular Assemblies of Multifunctional Diimidazole and Dicarboxylic Acids via Various Hydrogen Bonds and X···π (X = π, CH) Interactions","Crystal Growth & Design","2007","7","4","741","","10.1021/cg060764b","","","0.71073","MoKα","","0.1013","0.0452","","","0.1059","0.1262","","","","","","0.981","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504079","7.319","0.004","11.978","0.005","12.368","0.008","107.28","0.04","95.95","0.05","90.14","0.04","1029.1","1","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","2,6-bis[(imidazol-1-yl)methyl]-4-methylphenol-isophthalic acid","","- C23 H22 N4 O5 -","- C23 H22 N4 O5 -","- C46 H44 N8 O10 -","2","1","","Wang, Wen-Hai; Xi, Pei-Hua; Su, Xiao-Yu; Lan, Jing-Bo; Mao, Zhi-Hua; You, Jing-Song; Xie, Ru-Gang","Supramolecular Assemblies of Multifunctional Diimidazole and Dicarboxylic Acids via Various Hydrogen Bonds and X···π (X = π, CH) Interactions","Crystal Growth & Design","2007","7","4","741","","10.1021/cg060764b","","","0.71073","MoKα","","0.1057","0.061","","","0.1867","0.215","","","","","","1.086","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504080","7.319","0.003","12.089","0.004","12.159","0.003","77.06","0.03","89.94","0.03","77.35","0.03","1021.7","0.6","292","2","292","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H22 N4 O5 -","- C23 H22 N4 O5 -","- C46 H44 N8 O10 -","2","1","","Wang, Wen-Hai; Xi, Pei-Hua; Su, Xiao-Yu; Lan, Jing-Bo; Mao, Zhi-Hua; You, Jing-Song; Xie, Ru-Gang","Supramolecular Assemblies of Multifunctional Diimidazole and Dicarboxylic Acids via Various Hydrogen Bonds and X···π (X = π, CH) Interactions","Crystal Growth & Design","2007","7","4","741","","10.1021/cg060764b","","","0.71073","MoKα","","0.1135","0.0703","","","0.1711","0.1944","","","","","","0.94","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504081","19.704","0.007","7.299","0.002","25.698","0.007","90","","108.3","0.03","90","","3509","1.9","292","2","292","2","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","","","- C38 H38 N8 O6 -","- C38 H38 N8 O6 -","- C152 H152 N32 O24 -","4","0.5","","Wang, Wen-Hai; Xi, Pei-Hua; Su, Xiao-Yu; Lan, Jing-Bo; Mao, Zhi-Hua; You, Jing-Song; Xie, Ru-Gang","Supramolecular Assemblies of Multifunctional Diimidazole and Dicarboxylic Acids via Various Hydrogen Bonds and X···π (X = π, CH) Interactions","Crystal Growth & Design","2007","7","4","741","","10.1021/cg060764b","","","0.71073","MoKα","","0.1635","0.0689","","","0.169","0.2101","","","","","","0.972","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504082","5.887","0.01","19.37","0.03","31.41","0.05","90","","92.16","0.03","90","","3579","10","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Venlafaxine hydrochloride","","","- C17 H28 Cl N O2 -","- C17 H28 Cl N O2 -","- C136 H224 Cl8 N8 O16 -","8","2","","Roy, Saikat; Bhatt, Prashant M.; Nangia, Ashwini; Kruger, Gert J.","Stable Polymorph of Venlafaxine Hydrochloride by Solid-to-Solid Phase Transition at High Temperature","Crystal Growth & Design","2007","7","3","476","","10.1021/cg0607699","","","0.71073","MoKα","","0.3293","0.1073","","","0.2029","0.3127","","","","","","0.95","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504083","6.321","0.002","6.5597","0.0011","8.38","0.004","79.82","0.03","102.34","0.03","90.94","0.02","334","0.2","293","","293","","","","","","","","F.P.A.Fabbiani","4","P -1","-P 1","2","","","","- C6 H10 N2 O2 -","- C6 H10 N2 O2 -","- C12 H20 N4 O4 -","2","1","","Fabbiani, Francesca P. A.; Allan, David R.; David, William I. F.; Davidson, Alistair J.; Lennie, Alistair R.; Parsons, Simon; Pulham, Colin R.; Warren, John E.","High-Pressure Studies of Pharmaceuticals: An Exploration of the Behavior of Piracetam","Crystal Growth & Design","2007","7","6","1115","","10.1021/cg0607710","","","0.6765","Synchrotron","","0.1381","0.1149","","0.3004","0.2806","0.3004","","","","","","1.0642","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504084","6.442","0.002","6.353","0.0011","8.737","0.003","81.43","0.03","112.88","0.02","91.38","0.02","325.53","0.17","293","","293","","","","","","","","F.P.A.Fabbiani","4","P -1","-P 1","2","","","","- C6 H10 N2 O2 -","- C6 H10 N2 O2 -","- C12 H20 N4 O4 -","2","1","","Fabbiani, Francesca P. A.; Allan, David R.; David, William I. F.; Davidson, Alistair J.; Lennie, Alistair R.; Parsons, Simon; Pulham, Colin R.; Warren, John E.","High-Pressure Studies of Pharmaceuticals: An Exploration of the Behavior of Piracetam","Crystal Growth & Design","2007","7","6","1115","","10.1021/cg0607710","","","0.6765","Synchrotron","","0.1184","0.0881","","0.2297","0.2096","0.2297","","","","","","1.0488","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504085","6.3903","0.0007","6.2932","0.0011","8.645","0.0016","81.106","0.012","113.68","0.012","91.295","0.011","314.26","0.09","293","","293","","","","","","","","F.P.A.Fabbiani","4","P -1","-P 1","2","","","","- C6 H10 N2 O2 -","- C6 H10 N2 O2 -","- C12 H20 N4 O4 -","2","1","","Fabbiani, Francesca P. A.; Allan, David R.; David, William I. F.; Davidson, Alistair J.; Lennie, Alistair R.; Parsons, Simon; Pulham, Colin R.; Warren, John E.","High-Pressure Studies of Pharmaceuticals: An Exploration of the Behavior of Piracetam","Crystal Growth & Design","2007","7","6","1115","","10.1021/cg0607710","","","0.6765","Synchrotron","","0.0924","0.0801","","0.207","0.1952","0.207","","","","","","1.0597","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504086","6.263","0.002","6.2063","0.001","8.412","0.003","80.77","0.03","114.69","0.02","91.12","0.02","292.83","0.16","293","","293","","","","","","","","F.P.A.Fabbiani","4","P -1","-P 1","2","","","","- C6 H10 N2 O2 -","- C6 H10 N2 O2 -","- C12 H20 N4 O4 -","2","1","","Fabbiani, Francesca P. A.; Allan, David R.; David, William I. F.; Davidson, Alistair J.; Lennie, Alistair R.; Parsons, Simon; Pulham, Colin R.; Warren, John E.","High-Pressure Studies of Pharmaceuticals: An Exploration of the Behavior of Piracetam","Crystal Growth & Design","2007","7","6","1115","","10.1021/cg0607710","","","0.6765","Synchrotron","","0.1023","0.0882","","0.2185","0.208","0.2185","","","","","","1.0634","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504087","6.169","0.002","6.1602","0.0011","8.287","0.003","80.41","0.03","115.33","0.03","91.15","0.02","280.21","0.16","293","","293","","","","","","","","F.P.A.Fabbiani","4","P -1","-P 1","2","","","","- C6 H10 N2 O2 -","- C6 H10 N2 O2 -","- C12 H20 N4 O4 -","2","1","","Fabbiani, Francesca P. A.; Allan, David R.; David, William I. F.; Davidson, Alistair J.; Lennie, Alistair R.; Parsons, Simon; Pulham, Colin R.; Warren, John E.","High-Pressure Studies of Pharmaceuticals: An Exploration of the Behavior of Piracetam","Crystal Growth & Design","2007","7","6","1115","","10.1021/cg0607710","","","0.6765","Synchrotron","","0.1108","0.0915","","0.2401","0.2204","0.2401","","","","","","1.0636","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504088","6.217","0.002","7.0356","0.0009","10.0593","0.0013","84.711","0.012","76.83","0.02","75.77","0.02","414.97","0.16","293","2","293","2","","","","","","","F.P.A.Fabbiani","4","P -1","-P 1","2","","","","- C6 H14 N2 O4 -","- C6 H14 N2 O4 -","- C12 H28 N4 O8 -","2","1","","Fabbiani, Francesca P. A.; Allan, David R.; David, William I. F.; Davidson, Alistair J.; Lennie, Alistair R.; Parsons, Simon; Pulham, Colin R.; Warren, John E.","High-Pressure Studies of Pharmaceuticals: An Exploration of the Behavior of Piracetam","Crystal Growth & Design","2007","7","6","1115","","10.1021/cg0607710","","","0.6765","Synchrotron","","0.0461","0.0349","","0.0907","0.0833","0.0907","","","","","","1.0588","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504089","16.931","0.004","16.931","0.004","16.931","0.004","95.34","0.004","95.34","0.004","95.34","0.004","4786","2","298","2","298","2","","","","","","","","5","R -3 :R","-P 3*","148","","","","- C28 H29.67 N11 O7.33 Zn -","- C28 H29.67 N11 O7.33333 Zn -","- C168 H178.02 N66 O44 Zn6 -","6","1","","Chi, Yingnan; Huang, Kunlin; Zhang, Shaowen; Cui, Fengyun; Xu, Yanqing; Hu, Changwen","Self-Assembly of a CsCl-like 3D Supramolecular Network from [Zn6(HL)6(H2L)6]6+Metallamacrocycles and (H2O)20Clusters (H2L = 4-(2-Pyridyl)-6-(4-pyridyl)-2-aminopyrimidine)","Crystal Growth & Design","2007","7","12","2449","","10.1021/cg0607809","","","0.71073","MoKα","","0.2774","0.0778","","","0.1751","0.283","","","","","","0.953","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4504090","8.4834","0.0017","9.1242","0.0018","12.712","0.003","96.1","0.03","104.73","0.03","110.41","0.03","871","0.4","113","2","113","2","","","","","","","","3","P -1","-P 1","2","","9-(4-methoxyphenyl)-9H-xanthen-9-ol cyclohexane clathrate","","- C23 H22 O3 -","- C23 H22 O3 -","- C46 H44 O6 -","2","1","","Jacobs, Ayesha; Faleni, Nobathembu; Nassimbeni, Luigi R.; Taljaard, Jana H.","Inclusion by a Xanthenol Host: Relating Structure to the Kinetics of Desolvation and Guest Exchange","Crystal Growth & Design","2007","7","6","1003","","10.1021/cg060792u","","","0.71073","MoKα","","0.0523","0.0383","","","0.0955","0.1026","","","","","","1.044","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504091","8.4075","0.0017","9.0908","0.0018","12.442","0.003","97.04","0.03","101.33","0.03","111.15","0.03","849.9","0.4","113","2","113","2","","","","","","","","3","P -1","-P 1","2","","9-(4-methoxyphenyl)-9H-xanthen-9-ol dioxane clathrate","","- C22 H20 O4 -","- C22 H20 O4 -","- C44 H40 O8 -","2","1","","Jacobs, Ayesha; Faleni, Nobathembu; Nassimbeni, Luigi R.; Taljaard, Jana H.","Inclusion by a Xanthenol Host: Relating Structure to the Kinetics of Desolvation and Guest Exchange","Crystal Growth & Design","2007","7","6","1003","","10.1021/cg060792u","","","0.71073","MoKα","","0.0682","0.0396","","","0.0854","0.0943","","","","","","1.03","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504092","9.0685","0.0018","9.6815","0.0019","12.311","0.003","72.36","0.03","73.95","0.03","78.05","0.03","980.9","0.4","113","2","113","2","","","","","","","","4","P -1","-P 1","2","","9-(4-methoxyphenyl)-9H-xanthen-9-ol dimethylforamide clathrate","","- C23 H23 N O4 -","- C23 H23 N O4 -","- C46 H46 N2 O8 -","2","1","","Jacobs, Ayesha; Faleni, Nobathembu; Nassimbeni, Luigi R.; Taljaard, Jana H.","Inclusion by a Xanthenol Host: Relating Structure to the Kinetics of Desolvation and Guest Exchange","Crystal Growth & Design","2007","7","6","1003","","10.1021/cg060792u","","","0.71073","MoKα","","0.0607","0.0416","","","0.101","0.1096","","","","","","1.033","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504093","6.72548","0.00007","6.77937","0.00014","17.2898","0.0005","88.255","0.001","89.478","0.002","62.598","0.001","699.53","0.03","110","2","110","2","","","","","","","","4","P -1","-P 1","2","","","","- H22 Mg O15 S -","- H22 Mg O15 S -","- H44 Mg2 O30 S2 -","2","1","","Genceli, F. Elif; Lutz, Martin; Spek, Anthony L.; Witkamp, Geert-Jan","Crystallization and Characterization of a New Magnesium Sulfate Hydrate MgSO4·11H2O","Crystal Growth & Design","2007","7","12","2460","","10.1021/cg060794e","","","0.71073","MoKα","","0.0313","0.0222","","","0.0545","0.0577","","","","","","1.084","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504094","10.1936","0.0015","9.0611","0.0013","20.667","0.003","90","","102.475","0.003","90","","1863.8","0.5","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Zn-5,15-di(4-methylphenyl)-10,20-di(4-nitrophenyl)porphyrin","","- C46 H30 N6 O4 Zn -","- C46 H30 N6 O4 Zn -","- C92 H60 N12 O8 Zn2 -","2","0.5","","Adilov, Salimgerey; Thalladi, Venkat R.","Layered Porphyrin Coordination Polymers Based on Zinc···Nitro Recognition: Reversible Intercalation of Nitrobenzene","Crystal Growth & Design","2007","7","3","481","","10.1021/cg0607957","","","0.71073","MoKα","","0.075","0.0624","","","0.1881","0.2015","","","","","","1.033","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504095","11.321","0.002","11.925","0.002","18.146","0.003","90","","94.312","0.004","90","","2442.8","0.7","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Zn-5,15-di(4-methylphenyl)-10,20-di(4-nitrophenyl) porphyrin-Nitrobenzene Solvate","","- C58 H40 N8 O8 Zn -","- C58 H40 N8 O8 Zn -","- C116 H80 N16 O16 Zn2 -","2","0.5","","Adilov, Salimgerey; Thalladi, Venkat R.","Layered Porphyrin Coordination Polymers Based on Zinc···Nitro Recognition: Reversible Intercalation of Nitrobenzene","Crystal Growth & Design","2007","7","3","481","","10.1021/cg0607957","","","0.71073","MoKα","","0.0986","0.0663","","","0.1506","0.1661","","","","","","1.003","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504096","7.371","0.006","8.701","0.004","9.303","0.005","90","","109.05","0.04","90","","564","0.6","123","2","123","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","4-Ethynylpyridine","4-Ethynylpyridine","","- C7 H5 N -","- C7 H5 N -","- C28 H20 N4 -","4","0.5","","Thalladi, Venkat R.; Dabros, Marta; Gehrke, Annette; Weiss, Hans-Christoph; Boese, Roland","Crystal Engineering with ⋮C−H···N and C−H···N Hydrogen Bonds","Crystal Growth & Design","2007","7","4","598","","10.1021/cg060806w","","","0.71073","MoKα","","0.0971","0.0876","","","0.2181","0.2365","","","","","","1.066","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504097","3.8294","0.0012","6.0334","0.0017","12.139","0.005","90","","96.23","0.03","90","","278.81","0.17","135","2","135","2","","","","","","","","3","P 1 c 1","P -2yc","7","3-Ethynylpyridine","3-Ethynylpyridine","","- C7 H5 N -","- C7 H5 N -","- C14 H10 N2 -","2","1","","Thalladi, Venkat R.; Dabros, Marta; Gehrke, Annette; Weiss, Hans-Christoph; Boese, Roland","Crystal Engineering with ⋮C−H···N and C−H···N Hydrogen Bonds","Crystal Growth & Design","2007","7","4","598","","10.1021/cg060806w","","","0.71073","MoKα","","0.0785","0.0756","","","0.191","0.1964","","","","","","1.043","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504098","8.329","0.003","17.494","0.008","8.327","0.003","90","","90","","90","","1213.3","0.8","180","2","180","2","","","","","","","","3","P n a 21","P 2c -2n","33","2-Ethynylpyridine","2-Ethynylpyridine","","- C7 H5 N -","- C7 H5 N -","- C56 H40 N8 -","8","2","","Thalladi, Venkat R.; Dabros, Marta; Gehrke, Annette; Weiss, Hans-Christoph; Boese, Roland","Crystal Engineering with ⋮C−H···N and C−H···N Hydrogen Bonds","Crystal Growth & Design","2007","7","4","598","","10.1021/cg060806w","","","0.71073","MoKα","","0.0961","0.0551","","","0.1199","0.1385","","","","","","1.036","","","","has coordinates","179575","2020-10-21","18:00:00",""
"4504099","3.871","0.0006","13.89","0.002","10.2043","0.0015","90","","94.547","0.004","90","","546.94","0.14","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","5-Ethynylpyrimidine","5-Ethynylpyrimidine","","- C6 H4 N2 -","- C6 H4 N2 -","- C24 H16 N8 -","4","1","","Thalladi, Venkat R.; Dabros, Marta; Gehrke, Annette; Weiss, Hans-Christoph; Boese, Roland","Crystal Engineering with ⋮C−H···N and C−H···N Hydrogen Bonds","Crystal Growth & Design","2007","7","4","598","","10.1021/cg060806w","","","0.71073","MoKα","","0.0847","0.0622","","","0.1679","0.1858","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504100","7.631","0.002","9.3667","0.0013","9.5372","0.0013","110.347","0.002","102.058","0.003","109.887","0.003","558.13","0.18","120","2","120","2","","","","","","","","4","P -1","-P 1","2","benzene-1,3,5-triphosphonic acid","benzene-1,3,5-triphosphonic acid","","- C6 H9 O9 P3 -","- C6 H9 O9 P3 -","- C12 H18 O18 P6 -","2","1","","Hix, Gary B.; Caignaert, Vincent; Rueff, Jean-Michel; Le Pluart, Loïc; Warren, John E.; Jaffrès, Paul-Alain","A Supramolecular Ladderlike Structure Formed by the Auto-Assembly of Benzene-1,3,5-triphosphonic Acid","Crystal Growth & Design","2007","7","2","208","","10.1021/cg060813k","","","0.6904","synchrotron","","0.0702","0.051","","","0.1269","0.1373","","","","","","1.023","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504101","25.22","0.02","10.017","0.007","15.757","0.011","90","","103.794","0.011","90","","3866","5","173.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14.5 H15 Hg I2 N4 O0.5 -","- C14.5 H15 Hg I2 N4 O0.5 -","- C116 H120 Hg8 I16 N32 O4 -","8","1","","Wang, Xiao-Feng; Lv, Yang; Okamura, Taka-aki; Kawaguchi, Hiroyuki; Wu, Gang; Sun, Wei-Yin; Ueyama, Norikazu","Structure Variation of Mercury(II) Halide Complexes with Different Imidazole-Containing Ligands","Crystal Growth & Design","2007","7","6","1125","","10.1021/cg060814c","","","0.7107","MoKα","","","0.058","","","","0.209","","","","","","1.003","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504102","12.93","0.005","9.969","0.004","15.716","0.006","90","","90.365","0.008","90","","2025.7","1.4","173.1","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C16 H17 Br3 Hg N4 O0.5 -","- C16 H13 Br3 Hg N4 O0.5 -","- C64 H52 Br12 Hg4 N16 O2 -","4","1","","Wang, Xiao-Feng; Lv, Yang; Okamura, Taka-aki; Kawaguchi, Hiroyuki; Wu, Gang; Sun, Wei-Yin; Ueyama, Norikazu","Structure Variation of Mercury(II) Halide Complexes with Different Imidazole-Containing Ligands","Crystal Growth & Design","2007","7","6","1125","","10.1021/cg060814c","","","0.7107","MoKα","","","0.038","","","","0.093","","","","","","1.016","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504103","8.419","0.003","9.236","0.003","12.274","0.004","102.489","0.003","95.987","0.005","91.462","0.003","925.6","0.5","173.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C14 H13 Br Hg I2 N4 -","- C14 H13 Br Hg I2 N4 -","- C28 H26 Br2 Hg2 I4 N8 -","2","1","","Wang, Xiao-Feng; Lv, Yang; Okamura, Taka-aki; Kawaguchi, Hiroyuki; Wu, Gang; Sun, Wei-Yin; Ueyama, Norikazu","Structure Variation of Mercury(II) Halide Complexes with Different Imidazole-Containing Ligands","Crystal Growth & Design","2007","7","6","1125","","10.1021/cg060814c","","","0.7107","MoKα","","","0.037","","","","0.125","","","","","","0.997","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504104","21.676","0.017","15.86","0.011","18.097","0.012","90","","121.5","0.02","90","","5305","7","200","","200","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[Hg3I6(F1)2]-2DMF","","- C36 H38 Hg3 I6 N14 O2 -","- C36 H38 Hg3 I6 N14 O2 -","- C144 H152 Hg12 I24 N56 O8 -","4","0.5","","Wang, Xiao-Feng; Lv, Yang; Okamura, Taka-aki; Kawaguchi, Hiroyuki; Wu, Gang; Sun, Wei-Yin; Ueyama, Norikazu","Structure Variation of Mercury(II) Halide Complexes with Different Imidazole-Containing Ligands","Crystal Growth & Design","2007","7","6","1125","","10.1021/cg060814c","","","0.71075","MoKα","","0.0625","0.034","","","0.0366","0.0397","","","","","","0.95","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504105","8.913","0.003","13.306","0.005","37.689","0.011","80.808","0.012","87.933","0.012","72.027","0.013","4197","2","200","","200","","","","","","","","","6","P -1","-P 1","2","","[Hg3I6(timpt)2]-4(H2O)","","- C66 H62 Hg3 I6 N18 O4 -","- C66 H54 Hg3 I6 N18 O4 -","- C132 H108 Hg6 I12 N36 O8 -","2","1","","Wang, Xiao-Feng; Lv, Yang; Okamura, Taka-aki; Kawaguchi, Hiroyuki; Wu, Gang; Sun, Wei-Yin; Ueyama, Norikazu","Structure Variation of Mercury(II) Halide Complexes with Different Imidazole-Containing Ligands","Crystal Growth & Design","2007","7","6","1125","","10.1021/cg060814c","","","0.71075","MoKα","","0.1319","0.0765","","","0.1991","0.2273","","","","","","1.037","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504106","11.585","0.005","11.901","0.003","19.438","0.005","90","","93.407","0.014","90","","2675.2","1.5","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H24 Br4 Hg2 N6 -","- C21 H24 Br4 Hg2 N6 -","- C84 H96 Br16 Hg8 N24 -","4","1","","Wang, Xiao-Feng; Lv, Yang; Okamura, Taka-aki; Kawaguchi, Hiroyuki; Wu, Gang; Sun, Wei-Yin; Ueyama, Norikazu","Structure Variation of Mercury(II) Halide Complexes with Different Imidazole-Containing Ligands","Crystal Growth & Design","2007","7","6","1125","","10.1021/cg060814c","","","0.71075","MoKα","","0.0702","0.0481","","","0.1021","0.1103","","","","","","1.038","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504107","28.808","0.012","11.585","0.004","19.238","0.009","90","","127.723","0.012","90","","5078","4","200","","200","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[Hg2Cl4(titmb)]","","- C21 H24 Cl4 Hg2 N6 -","- C21 H24 Cl4 Hg2 N6 -","- C168 H192 Cl32 Hg16 N48 -","8","1","","Wang, Xiao-Feng; Lv, Yang; Okamura, Taka-aki; Kawaguchi, Hiroyuki; Wu, Gang; Sun, Wei-Yin; Ueyama, Norikazu","Structure Variation of Mercury(II) Halide Complexes with Different Imidazole-Containing Ligands","Crystal Growth & Design","2007","7","6","1125","","10.1021/cg060814c","","","0.71075","MoKα","","0.1272","0.0871","","","0.1803","0.1979","","","","","","1.055","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504108","10.224","0.002","32.116","0.006","21.038","0.004","90","","97.93","0.03","90","","6842","2","293","2","293","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C60 H40 Cl4 Cu5 Gd3 N10 O27 -","- C60 H40 Cl4 Cu5 Gd3 N10 O27 -","- C240 H160 Cl16 Cu20 Gd12 N40 O108 -","4","0.5","","Luo, Feng; Hu, De-xin; Xue, Lin; Che, Yun-xia; Zheng, Ji-min","Pillared 3d−4f Frameworks with Rare 3D Architecture Showing the Coexistence of Ferromagnetic and Antiferromagnetic Interactions between Gadolinium Ions","Crystal Growth & Design","2007","7","5","851","","10.1021/cg060823l","","","0.71073","MoKα","","0.049","0.032","","","0.0682","0.0726","","","","","","1.076","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504109","12.6161","0.0016","7.27","0.0006","13.6053","0.0017","90","","104.746","0.006","90","","1206.8","0.2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C6 H14 F6 Ga2 N2 O3 Se -","- C6 H14 F6 Ga2 N2 O3 Se -","- C24 H56 F24 Ga8 N8 O12 Se4 -","4","1","","Feng, Mei-Ling; Li, Xiu-Ling; Mao, Jiang-Gao","New Organically Templated Gallium and Indium Selenites or Selenates with One-, Two-, and Three-Dimensional Structures","Crystal Growth & Design","2007","7","4","770","","10.1021/cg060824d","","","0.71073","MoKα","","0.0646","0.0524","","","0.1318","0.1376","","","","","","1.17","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504110","9.1107","0.0006","8.0382","0.0006","10.8302","0.0009","90","","90.045","0.007","90","","793.13","0.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C2 H10 F3 Ga N2 O3 Se -","- C2 H10 F3 Ga N2 O3 Se -","- C8 H40 F12 Ga4 N8 O12 Se4 -","4","1","","Feng, Mei-Ling; Li, Xiu-Ling; Mao, Jiang-Gao","New Organically Templated Gallium and Indium Selenites or Selenates with One-, Two-, and Three-Dimensional Structures","Crystal Growth & Design","2007","7","4","770","","10.1021/cg060824d","","","0.71073","MoKα","","0.0407","0.035","","","0.0886","0.0923","","","","","","1.011","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504111","9.3066","0.0005","8.3012","0.0005","11.2923","0.0007","90","","92.329","0.004","90","","871.68","0.09","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C2 H10 F3 In N2 O3 Se -","- C2 H10 F3 In N2 O3 Se -","- C8 H40 F12 In4 N8 O12 Se4 -","4","1","","Feng, Mei-Ling; Li, Xiu-Ling; Mao, Jiang-Gao","New Organically Templated Gallium and Indium Selenites or Selenates with One-, Two-, and Three-Dimensional Structures","Crystal Growth & Design","2007","7","4","770","","10.1021/cg060824d","","","0.71073","MoKα","","0.0275","0.0239","","","0.05","0.0513","","","","","","1.098","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504112","6.377","","9.282","0.0002","11.4112","0.0001","66.531","0.011","77.448","0.013","71.889","0.012","585.47","0.06","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C6 H14 F Ga N2 O8 Se -","- C6 H12 F Ga N2 O8 Se -","- C12 H24 F2 Ga2 N4 O16 Se2 -","2","1","","Feng, Mei-Ling; Li, Xiu-Ling; Mao, Jiang-Gao","New Organically Templated Gallium and Indium Selenites or Selenates with One-, Two-, and Three-Dimensional Structures","Crystal Growth & Design","2007","7","4","770","","10.1021/cg060824d","","","0.71073","MoKα","","0.0535","0.041","","","0.1042","0.1118","","","","","","1.062","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504113","8.9941","0.0001","9.4963","0.0003","11.2959","0.0001","77.128","0.01","68.073","0.008","83.776","0.012","872.17","0.07","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H36 F2 Ga4 N4 O26 Se6 -","- C14 H28 F2 Ga4 N4 O26 Se6 -","- C14 H28 F2 Ga4 N4 O26 Se6 -","1","0.5","","Feng, Mei-Ling; Li, Xiu-Ling; Mao, Jiang-Gao","New Organically Templated Gallium and Indium Selenites or Selenates with One-, Two-, and Three-Dimensional Structures","Crystal Growth & Design","2007","7","4","770","","10.1021/cg060824d","","","0.71073","MoKα","","0.042","0.0317","","","0.0724","0.0771","","","","","","0.99","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504114","6.8035","0.0015","9.861","0.002","12.956","0.003","90","","90","","90","","869.2","0.3","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C2 H10 F3 In N2 O4 Se -","- C2 H10 F3 In N2 O4 Se -","- C8 H40 F12 In4 N8 O16 Se4 -","4","1","","Feng, Mei-Ling; Li, Xiu-Ling; Mao, Jiang-Gao","New Organically Templated Gallium and Indium Selenites or Selenates with One-, Two-, and Three-Dimensional Structures","Crystal Growth & Design","2007","7","4","770","","10.1021/cg060824d","","","0.71073","MoKα","","0.0235","0.0217","","","0.0514","0.0521","","","","","","1.093","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504115","8.3749","0.0016","12.118","0.002","10.648","0.003","90","","110.478","0.008","90","","1012.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C3 H9 In N O10 Se -","- C3 H5 In N O10 Se -","- C12 H20 In4 N4 O40 Se4 -","4","1","","Feng, Mei-Ling; Li, Xiu-Ling; Mao, Jiang-Gao","New Organically Templated Gallium and Indium Selenites or Selenates with One-, Two-, and Three-Dimensional Structures","Crystal Growth & Design","2007","7","4","770","","10.1021/cg060824d","","","0.71073","MoKα","","0.0377","0.0321","","","0.0696","0.073","","","","","","0.978","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504116","19.9271","0.0007","19.9271","0.0007","19.9271","0.0007","90","","90","","90","","7912.8","0.5","123","2","123","2","","","","","","","","6","I -4 3 d","I -4bd 2c 3","220","","","","- C18 H12 Ag Cl N6 O4 -","- C18 H12 Ag0.99 Cl N6 O4 -","- C288 H192 Ag15.84 Cl16 N96 O64 -","16","0.333333","","Zhou, Xiao-Ping; Zhang, Xuanjun; Lin, Shi-Hong; Li, Dan","Anion−π-Interaction-Directed Self-Assembly of Ag(I) Coordination Networks","Crystal Growth & Design","2007","7","3","485","","10.1021/cg0608256","","","0.71073","MoKα","","0.0483","0.0477","","","0.1292","0.13","","","","","","1.065","","","","has coordinates,has disorder","179576","2020-10-21","18:00:00",""
"4504117","19.8773","0.0004","19.8773","0.0004","19.8773","0.0004","90","","90","","90","","7853.7","0.3","293","2","293","2","","","","","","","","6","I -4 3 d","I -4bd 2c 3","220","","","","- C18 H12 Ag B F4 N6 -","- C18 H12 Ag0.99 B F4 N6 -","- C288 H192 Ag15.84 B16 F64 N96 -","16","0.333333","","Zhou, Xiao-Ping; Zhang, Xuanjun; Lin, Shi-Hong; Li, Dan","Anion−π-Interaction-Directed Self-Assembly of Ag(I) Coordination Networks","Crystal Growth & Design","2007","7","3","485","","10.1021/cg0608256","","","0.71073","MoKα","","0.0622","0.0581","","","0.1464","0.1499","","","","","","1.113","","","","has coordinates,has disorder","179576","2020-10-21","18:00:00",""
"4504118","20.425","0.0007","20.425","0.0007","20.425","0.0007","90","","90","","90","","8520.9","0.5","293","2","293","2","","","","","","","","6","I a -3 d","-I 4bd 2c 3","230","","","","- C18 H12 Ag F6 N6 P -","- C18 H12 Ag0.99 F6 N6 P -","- C288 H192 Ag15.84 F96 N96 P16 -","16","0.166667","","Zhou, Xiao-Ping; Zhang, Xuanjun; Lin, Shi-Hong; Li, Dan","Anion−π-Interaction-Directed Self-Assembly of Ag(I) Coordination Networks","Crystal Growth & Design","2007","7","3","485","","10.1021/cg0608256","","","0.71073","MoKα","","0.1109","0.0762","","","0.1886","0.2148","","","","","","1.036","","","","has coordinates,has disorder","179576","2020-10-21","18:00:00",""
"4504119","10.7077","0.0015","15.062","0.002","16.372","0.002","80.844","0.002","72.76","0.002","89.823","0.002","2487","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H27 Ag4 F12 N12 O9.5 -","- C44 H27 Ag4 F12 N12 O9.5 -","- C88 H54 Ag8 F24 N24 O19 -","2","1","","Zhou, Xiao-Ping; Zhang, Xuanjun; Lin, Shi-Hong; Li, Dan","Anion−π-Interaction-Directed Self-Assembly of Ag(I) Coordination Networks","Crystal Growth & Design","2007","7","3","485","","10.1021/cg0608256","","","0.71073","MoKα","","0.1035","0.0872","","","0.2403","0.2609","","","","","","1.03","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504120","12.829","0.003","40.672","0.008","18.528","0.004","90","","109.99","0.03","90","","9085","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C66 H56 N2 O24 Zn5 -","- C66 H56 N2 O24 Zn5 -","- C264 H224 N8 O96 Zn20 -","4","0.5","","Fang, Qian-Rong; Zhu, Guang-Shan; Jin, Zhao; Xue, Ming; Wei, Xiao; Wang, De-Jun; Qiu, Shi-Lun","A Novel Metal−Organic Framework with the Diamondoid Topology Constructed from Pentanuclear Zinc−Carboxylate Clusters","Crystal Growth & Design","2007","7","6","1035","","10.1021/cg060829a","","","0.71073","MoKα","","0.1604","0.0934","","","0.2548","0.2773","","","","","","1.089","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504121","5.2813","0.0005","16.227","0.002","8.5998","0.001","90","","90.732","0.005","90","","736.94","0.14","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C2 H5 Na O6 P2 Zn -","- C2 H5 Na O6 P2 Zn -","- C8 H20 Na4 O24 P8 Zn4 -","4","1","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","Mix-Solvothermal Syntheses, Characterization, and Properties of New Zinc Diphosphonates with Zn−O−P Chains, Layers, and 3D Frameworks","Crystal Growth & Design","2007","7","6","1134","","10.1021/cg060833m","","","0.71073","MoKα","","0.0303","0.0266","","","0.0574","0.0591","","","","","","1.082","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504122","8.2032","0.0003","9.171","0.0004","10.2152","0.0003","88.608","0.002","81.726","0.002","88.466","0.002","760.07","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H10 K2 O12 P4 Zn2 -","- C4 H10 K2 O12 P4 Zn2 -","- C8 H20 K4 O24 P8 Zn4 -","2","1","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","Mix-Solvothermal Syntheses, Characterization, and Properties of New Zinc Diphosphonates with Zn−O−P Chains, Layers, and 3D Frameworks","Crystal Growth & Design","2007","7","6","1134","","10.1021/cg060833m","","","0.71073","MoKα","","","0.0419","","","0.1041","0.1061","","","","","","1.275","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504123","28.419","0.005","8.5688","0.0013","14.951","0.002","90","","100.925","0.002","90","","3574.8","1","130.15","","130.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C5 H17 N2 O12 P4 Zn3 -","- C5 H8 N2 O12 P4 Zn3 -","- C40 H64 N16 O96 P32 Zn24 -","8","1","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","Mix-Solvothermal Syntheses, Characterization, and Properties of New Zinc Diphosphonates with Zn−O−P Chains, Layers, and 3D Frameworks","Crystal Growth & Design","2007","7","6","1134","","10.1021/cg060833m","","","0.71073","MoKα","","0.0333","0.0306","","","0.0988","0.1006","","","","","","1.131","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504124","10.0172","0.0009","20.938","0.002","8.7611","0.0008","90","","90","","90","","1837.6","0.3","130.15","","130.15","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C6 H20 N2 O12 P4 Zn3 -","- C6 H12 N2 O12 P4 Zn3 -","- C24 H48 N8 O48 P16 Zn12 -","4","0.5","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","Mix-Solvothermal Syntheses, Characterization, and Properties of New Zinc Diphosphonates with Zn−O−P Chains, Layers, and 3D Frameworks","Crystal Growth & Design","2007","7","6","1134","","10.1021/cg060833m","","","0.71073","MoKα","","0.0554","0.0502","","","0.1084","0.1111","","","","","","1.165","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504125","11.6226","0.0009","8.1412","0.0006","11.8917","0.0009","90","","96.381","0.003","90","","1118.24","0.15","130.15","","130.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C5 H14 N O6 P2 Zn -","- C5 H14 N O6 P2 Zn -","- C20 H56 N4 O24 P8 Zn4 -","4","1","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","Mix-Solvothermal Syntheses, Characterization, and Properties of New Zinc Diphosphonates with Zn−O−P Chains, Layers, and 3D Frameworks","Crystal Growth & Design","2007","7","6","1134","","10.1021/cg060833m","","","0.71073","MoKα","","0.0308","0.0274","","","0.064","0.0656","","","","","","1.142","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504126","14.14","0.0014","4.8817","0.0004","14.4106","0.0014","90","","91.175","0.005","90","","994.51","0.16","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H9 K O6 P2 Zn -","- C4 H9 K O6 P2 Zn -","- C16 H36 K4 O24 P8 Zn4 -","4","1","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","Mix-Solvothermal Syntheses, Characterization, and Properties of New Zinc Diphosphonates with Zn−O−P Chains, Layers, and 3D Frameworks","Crystal Growth & Design","2007","7","6","1134","","10.1021/cg060833m","","","0.71073","MoKα","","0.0428","0.0391","","","0.0831","0.0854","","","","","","1.162","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504127","13.9243","0.0012","8.9409","0.0007","8.9821","0.0008","90","","95.037","0.005","90","","1113.92","0.16","130.15","","130.15","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C4 H10 Cl K O6 P2 Zn -","- C4 H10 Cl K O6 P2 Zn -","- C16 H40 Cl4 K4 O24 P8 Zn4 -","4","1","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","Mix-Solvothermal Syntheses, Characterization, and Properties of New Zinc Diphosphonates with Zn−O−P Chains, Layers, and 3D Frameworks","Crystal Growth & Design","2007","7","6","1134","","10.1021/cg060833m","","","0.71073","MoKα","","0.0237","0.0221","","","0.0532","0.0538","","","","","","1.1","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504128","4.8852","0.0018","9.986","0.004","10.432","0.004","92.918","0.004","98.418","0.006","90.801","0.006","502.7","0.3","130.15","","130.15","","","","","","","","","6","P -1","-P 1","2","","","","- C4 H13 N O6 P2 Zn -","- C4 H13 N O6 P2 Zn -","- C8 H26 N2 O12 P4 Zn2 -","2","1","","Fu, Ruibiao; Hu, Shengmin; Wu, Xintao","Mix-Solvothermal Syntheses, Characterization, and Properties of New Zinc Diphosphonates with Zn−O−P Chains, Layers, and 3D Frameworks","Crystal Growth & Design","2007","7","6","1134","","10.1021/cg060833m","","","0.71073","MoKα","","0.0244","0.0218","","","0.0556","0.0575","","","","","","1.112","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504129","9.3247","0.0016","17.011","0.003","31.447","0.006","90","","90","","90","","4988.2","1.6","273","2","273","2","","","","","","","","7","I b a m","-I 2 2c","72","","","","- C18 H18 Cu2 I2 N3 Nd O9 -","- C18 H9 Cu2 I2 N3 Nd O9 -","- C144 H72 Cu16 I16 N24 Nd8 O72 -","8","0.5","","Gu, Xiaojun; Xue, Dongfeng","Incorporating Metal Clusters into Three-Dimensional Ln(III)−Cu(I) Coordination Frameworks through Linear Ligands","Crystal Growth & Design","2007","7","9","1726","","10.1021/cg060836z","","","0.71073","MoKα","","0.033","0.0284","","","0.0816","0.0852","","","","","","0.858","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504130","21.148","0.003","9.2771","0.0016","17.264","0.003","90","","106.404","0.003","90","","3249.2","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Cu N2 Nd O9 -","- C14 H8 Cu N2 Nd O9 -","- C112 H64 Cu8 N16 Nd8 O72 -","8","1","","Gu, Xiaojun; Xue, Dongfeng","Incorporating Metal Clusters into Three-Dimensional Ln(III)−Cu(I) Coordination Frameworks through Linear Ligands","Crystal Growth & Design","2007","7","9","1726","","10.1021/cg060836z","","","0.71073","MoKα","","0.0225","0.0201","","","0.049","0.0504","","","","","","1.056","","","","has coordinates,has disorder","179576","2020-10-21","18:00:00",""
"4504131","21.296","0.005","9.203","0.002","17.063","0.004","90","","105.939","0.003","90","","3215.6","1.3","273","2","273","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Cu Eu N2 O9 -","- C14 H8 Cu Eu N2 O9 -","- C112 H64 Cu8 Eu8 N16 O72 -","8","1","","Gu, Xiaojun; Xue, Dongfeng","Incorporating Metal Clusters into Three-Dimensional Ln(III)−Cu(I) Coordination Frameworks through Linear Ligands","Crystal Growth & Design","2007","7","9","1726","","10.1021/cg060836z","","","0.71073","MoKα","","0.0284","0.0235","","","0.0577","0.0603","","","","","","1.014","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504132","36.29","0.015","9.659","0.004","7.363","0.003","90","","97.289","0.012","90","","2560.1","1.8","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H32 Cu N4 O13 -","- C18 H32 Cu N4 O13 -","- C72 H128 Cu4 N16 O52 -","4","0.5","","Choudhury, Somnath Ray; Jana, Atish Dipankar; Colacio, Enrique; Lee, Hon Man; Mostafa, Golam; Mukhopadhyay, Subrata","Crowned Tetrameric Spirocyclic Water Chain: An Unusual Building Block of a Supramolecular Metal−Organic Host","Crystal Growth & Design","2007","7","2","212","","10.1021/cg060837r","","x-ray","0.71073","MoKα","","0.072","0.0619","","","0.1541","0.1591","","","","","","1.056","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504133","5.881","0.004","13.609","0.008","30.225","0.018","90","","90","","90","","2419","3","103","2","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H31 N O4 -","- C29 H29 N O4 -","- C116 H116 N4 O16 -","4","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","0.1713","0.1171","","","0.2812","0.3487","","","","","","1.032","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504134","13.696","0.002","5.997","0.0007","17.017","0.004","90","","101.213","0.007","90","","1371","0.4","296.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C31 H35 N O4 -","- C31 H33 N O4 -","- C62 H66 N2 O8 -","2","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","","0.049","","","","0.057","","","","","","0.563","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504135","13.92","0.02","5.883","0.007","17.85","0.02","90","","107.98","0.02","90","","1390","3","123.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C32 H37 N O4 -","- C32 H35 N O4 -","- C64 H70 N2 O8 -","2","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","","0.052","","","","0.07","","","","","","0.735","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504136","5.972","0.0006","32.194","0.004","13.442","0.003","90","","90","","90","","2584.4","0.7","296.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C30 H33 N O4 -","- C30 H31 N O4 -","- C120 H124 N4 O16 -","4","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","","0.138","","","","0.171","","","","","","2.63","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504137","5.961","0.003","13.052","0.006","32.917","0.017","90","","90","","90","","2561","2","103","2","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H35 N O4 -","- C31 H35 N O4 -","- C124 H140 N4 O16 -","4","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","0.0804","0.0643","","","0.1427","0.1541","","","","","","1.085","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504138","6.059","0.0007","34.837","0.005","13.478","0.003","90","","90","","90","","2844.9","0.8","296.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H37 N O4 -","- C32 H35 N O4 -","- C128 H140 N4 O16 -","4","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","","0.146","","","","0.175","","","","","","3.138","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504139","13.72","0.02","5.605","0.007","18.35","0.03","90","0.01","105.995","0.012","90","0.01","1356","3","103","2","103","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C33 H39 N O4 -","- C33 H39 N O4 -","- C66 H78 N2 O8 -","2","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","0.2617","0.1483","","","0.3367","0.4386","","","","","","1.025","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504140","6.026","0.007","13.604","0.016","31.8","0.04","90","","90","","90","","2607","5","103","2","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H35 N O4 -","- C31 H35 N O4 -","- C124 H140 N4 O16 -","4","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","0.1726","0.1158","","","0.2521","0.3019","","","","","","1.111","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504141","6.025","0.006","13.348","0.015","33.02","0.04","90","","90","","90","","2656","5","103","2","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H37 N O4 -","- C32 H37 N O4 -","- C128 H148 N4 O16 -","4","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","0.2029","0.1577","","","0.3585","0.4","","","","","","1.203","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504142","13.746","0.002","6.088","0.0006","34.185","0.006","90","","90","","90","","2860.8","0.7","296.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C33 H39 N O4 -","- C33 H37 N O4 -","- C132 H148 N4 O16 -","4","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","","0.072","","","","0.084","","","","","","1.219","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504143","38.87","0.006","5.989","0.0007","13.752","0.003","90","","109.505","0.006","90","","3017.6","0.9","296.1","","","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C34 H41 N O4 -","- C34 H39 N O4 -","- C136 H156 N4 O16 -","4","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","","0.059","","","","0.065","","","","","","1.168","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504144","13.519","0.01","6.014","0.004","17.972","0.013","90","0.003","109.965","0.003","90","0.003","1373.4","1.7","103","2","103","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C33 H39 N O4 -","- C33 H39 N O4 -","- C66 H78 N2 O8 -","2","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","0.0954","0.0664","","","0.1455","0.18","","","","","","1.145","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504145","5.992","0.008","13.568","0.019","35.49","0.05","90","","90","","90","","2885","7","103","2","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C34 H41 N O4 -","- C34 H41 N O4 -","- C136 H164 N4 O16 -","4","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","0.1886","0.1324","","","0.2932","0.3437","","","","","","1.131","","","","has coordinates,has disorder","179576","2020-10-21","18:00:00",""
"4504146","13.54","0.02","6.29","0.009","17.04","0.03","90","","104.41","0.02","90","","1406","4","293.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C35 H35 N O4 -","- C35 H33 N O4 -","- C70 H66 N2 O8 -","2","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","","0.054","","","","0.055","","","","","","0.663","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504147","14.064","0.002","6.195","0.0012","17.464","0.005","90","","107.012","0.009","90","","1455","0.5","296.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C36 H37 N O4 -","- C36 H35 N O4 -","- C72 H70 N2 O8 -","2","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","","0.129","","","","0.151","","","","","","2.763","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504148","5.828","0.008","13.762","0.017","37.55","0.05","90","","90","","90","","3012","7","103","2","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C37 H39 N O4 -","- C37 H39 N O4 -","- C148 H156 N4 O16 -","4","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","0.1703","0.1187","","","0.2517","0.301","","","","","","1.09","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504149","5.943","0.006","13.683","0.013","38.1","0.04","90","","90","","90","","3098","5","103","2","103","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C38 H41 N O4 -","- C38 H41 N O4 -","- C152 H164 N4 O16 -","4","1","","Kodama, Koichi; Kobayashi, Yuka; Saigo, Kazuhiko","Role of the Relative Molecular Length of the Components in Ternary Inclusion Crystals in the Chiral Recognition and Assembly of Supramolecular Helical Architectures","Crystal Growth & Design","2007","7","5","935","","10.1021/cg060849c","","","0.7107","MoKα","","0.1948","0.1528","","","0.3408","0.3838","","","","","","1.15","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504150","11.7926","0.0009","7.1528","0.0005","23.8166","0.0017","90","","100.538","0.001","90","","1975","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H7 N O S2 -","- C10 H7 N O S2 -","- C80 H56 N8 O8 S16 -","8","2","","Barreiro, Elena; Casas, José S.; Couce, María D.; Sánchez, Agustín; Sordo, José; Varela, José M.; Vázquez-López, Ezequiel M.","The Influence of 5-Substituents on the Supramolecular Structures of Rhodanine Derivatives","Crystal Growth & Design","2007","7","10","1964","","10.1021/cg060859d","","","0.71073","MoKα","","0.0875","0.0391","","","0.0778","0.0878","","","","","","0.861","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504151","21.264","0.003","6.329","0.0008","18.977","0.002","90","","106.507","0.002","90","","2448.7","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C11 H7 D3 N O2.5 S2.5 -","- C11 H7 N O2.5 S2.5 -","- C88 H56 N8 O20 S20 -","8","1","","Barreiro, Elena; Casas, José S.; Couce, María D.; Sánchez, Agustín; Sordo, José; Varela, José M.; Vázquez-López, Ezequiel M.","The Influence of 5-Substituents on the Supramolecular Structures of Rhodanine Derivatives","Crystal Growth & Design","2007","7","10","1964","","10.1021/cg060859d","","","0.71073","MoKα","","0.0959","0.0627","","","0.1637","0.1771","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504152","9.1964","0.0007","9.4261","0.0008","9.7147","0.0008","72.006","0.002","81.908","0.001","86.912","0.002","792.92","0.11","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H11 Br2 N O3 S2 -","- C13 H11 Br2 N O3 S2 -","- C26 H22 Br4 N2 O6 S4 -","2","1","","Barreiro, Elena; Casas, José S.; Couce, María D.; Sánchez, Agustín; Sordo, José; Varela, José M.; Vázquez-López, Ezequiel M.","The Influence of 5-Substituents on the Supramolecular Structures of Rhodanine Derivatives","Crystal Growth & Design","2007","7","10","1964","","10.1021/cg060859d","","","0.71073","MoKα","","0.0377","0.0303","","","0.0704","0.0721","","","","","","0.989","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504153","35.062","0.002","8.2816","0.0006","18.1147","0.0013","90","","106.941","0.001","90","","5031.7","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C11 H7 D3 N O2.5 S2.5 -","- C11 H7 N O2.5 S2.5 -","- C176 H112 N16 O40 S40 -","16","2","","Barreiro, Elena; Casas, José S.; Couce, María D.; Sánchez, Agustín; Sordo, José; Varela, José M.; Vázquez-López, Ezequiel M.","The Influence of 5-Substituents on the Supramolecular Structures of Rhodanine Derivatives","Crystal Growth & Design","2007","7","10","1964","","10.1021/cg060859d","","","0.71073","MoKα","","0.0713","0.0444","","","0.1272","0.1419","","","","","","0.863","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504154","5.1827","0.0007","10.5154","0.0016","20.731","0.003","90","","92.494","0.003","90","","1128.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H9 N O2 S2 -","- C11 H9 N O2 S2 -","- C44 H36 N4 O8 S8 -","4","1","","Barreiro, Elena; Casas, José S.; Couce, María D.; Sánchez, Agustín; Sordo, José; Varela, José M.; Vázquez-López, Ezequiel M.","The Influence of 5-Substituents on the Supramolecular Structures of Rhodanine Derivatives","Crystal Growth & Design","2007","7","10","1964","","10.1021/cg060859d","","","0.71073","MoKα","","0.1236","0.0443","","","0.0746","0.0911","","","","","","0.816","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504155","6.0546","0.0007","21.357","0.002","7.3517","0.0008","90","","107.167","0.002","90","","908.28","0.17","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H9 N O S2 -","- C8 H9 N O S2 -","- C32 H36 N4 O4 S8 -","4","1","","Barreiro, Elena; Casas, José S.; Couce, María D.; Sánchez, Agustín; Sordo, José; Varela, José M.; Vázquez-López, Ezequiel M.","The Influence of 5-Substituents on the Supramolecular Structures of Rhodanine Derivatives","Crystal Growth & Design","2007","7","10","1964","","10.1021/cg060859d","","","0.71073","MoKα","","0.077","0.0447","","","0.0927","0.1013","","","","","","0.897","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504156","19.299","0.002","5.2501","0.0006","19.85","0.002","90","","92.381","0.002","90","","2009.5","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C9 H11 N O S2 -","- C9 H11 N O S2 -","- C72 H88 N8 O8 S16 -","8","1","","Barreiro, Elena; Casas, José S.; Couce, María D.; Sánchez, Agustín; Sordo, José; Varela, José M.; Vázquez-López, Ezequiel M.","The Influence of 5-Substituents on the Supramolecular Structures of Rhodanine Derivatives","Crystal Growth & Design","2007","7","10","1964","","10.1021/cg060859d","","","0.71073","MoKα","","0.0763","0.0414","","","0.0824","0.0912","","","","","","0.922","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504157","23.485","0.003","26.55","0.003","7.9344","0.001","90","","97.379","0.003","90","","4906.3","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10.5 H15 N O1.5 S2 -","- C10.5 H15 N O1.5 S2 -","- C168 H240 N16 O24 S32 -","16","2","","Barreiro, Elena; Casas, José S.; Couce, María D.; Sánchez, Agustín; Sordo, José; Varela, José M.; Vázquez-López, Ezequiel M.","The Influence of 5-Substituents on the Supramolecular Structures of Rhodanine Derivatives","Crystal Growth & Design","2007","7","10","1964","","10.1021/cg060859d","","","0.71073","MoKα","","0.2642","0.0483","","","0.0673","0.1015","","","","","","0.776","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504158","11.378","0.005","9.825","0.005","7.245","0.003","90","","120.08","0.02","90","","700.8","0.6","298","2","133","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","4-Carboxyphenylboronic acid","","","- C7 H7 B O4 -","- C7 H7 B O4 -","- C28 H28 B4 O16 -","4","0.5","","SeethaLekshmi, Nanappan; Pedireddi, Venkateswara Rao","Solid-State Structures of 4-Carboxyphenylboronic Acid and Its Hydrates","Crystal Growth & Design","2007","7","5","944","","10.1021/cg060860c","","","0.71073","MoKα","","0.0871","0.0758","","","0.2161","0.2277","","","","","","1.084","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504159","7.566","0.005","11.929","0.007","9.769","0.006","90","","90","","90","","881.7","0.9","298","2","298","2","","","","","","","","4","C c c 2","C 2 -2c","37","4-Carboxyphenylboronic acid hydrate","","","- C7 H9 B O5 -","- C7 H9 B O5 -","- C28 H36 B4 O20 -","4","0.5","","SeethaLekshmi, Nanappan; Pedireddi, Venkateswara Rao","Solid-State Structures of 4-Carboxyphenylboronic Acid and Its Hydrates","Crystal Growth & Design","2007","7","5","944","","10.1021/cg060860c","","","0.71073","MoKα","","0.0794","0.0713","","","0.1587","0.1627","","","","","","1.433","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504160","13.14","0.003","18.138","0.005","25.328","0.007","90","","90","","90","","6037","3","133","2","133","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","4-Carboxyphenylboronic acid hydrate","","","- C7 H7.5 B O4.25 -","- C7 H7.5 B O4.25 -","- C224 H240 B32 O136 -","32","1","","SeethaLekshmi, Nanappan; Pedireddi, Venkateswara Rao","Solid-State Structures of 4-Carboxyphenylboronic Acid and Its Hydrates","Crystal Growth & Design","2007","7","5","944","","10.1021/cg060860c","","","0.71073","MoKα","","0.081","0.0523","","","0.1335","0.1414","","","","","","1.058","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504161","17.4826","0.0019","14.2661","0.0016","8.3567","0.0013","90","","95.276","0.002","90","","2075.4","0.5","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C9 H10 Gd O7 -","- C9 H10 Gd O7 -","- C72 H80 Gd8 O56 -","8","1","","Hu, De-Xin; Luo, Feng; Che, Yun-Xia; Zheng, Ji-Min","Construction of Lanthanide Metal−Organic Frameworks by Flexible Aliphatic Dicarboxylate Ligands Plus a Rigidm-Phthalic Acid Ligand","Crystal Growth & Design","2007","7","9","1733","","10.1021/cg0608615","","","0.71073","MoKα","","0.0307","0.0232","","","0.0528","0.0556","","","","","","1.038","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504162","7.9862","0.0009","14.9936","0.0017","19.864","0.002","90","","93.875","0.002","90","","2373.1","0.4","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H26 O17 Sm2 -","- C18 H20 O17 Sm2 -","- C72 H80 O68 Sm8 -","4","0.5","","Hu, De-Xin; Luo, Feng; Che, Yun-Xia; Zheng, Ji-Min","Construction of Lanthanide Metal−Organic Frameworks by Flexible Aliphatic Dicarboxylate Ligands Plus a Rigidm-Phthalic Acid Ligand","Crystal Growth & Design","2007","7","9","1733","","10.1021/cg0608615","","","0.71073","MoKα","","0.0484","0.0411","","","0.0843","0.0862","","","","","","1.296","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504163","17.541","0.002","14.2888","0.0018","8.3715","0.001","90","","95.332","0.002","90","","2089.2","0.4","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C9 H10 Dy O7 -","- C9 H10 Dy O7 -","- C72 H80 Dy8 O56 -","8","1","","Hu, De-Xin; Luo, Feng; Che, Yun-Xia; Zheng, Ji-Min","Construction of Lanthanide Metal−Organic Frameworks by Flexible Aliphatic Dicarboxylate Ligands Plus a Rigidm-Phthalic Acid Ligand","Crystal Growth & Design","2007","7","9","1733","","10.1021/cg0608615","","","0.71073","MoKα","","0.0305","0.0265","","","0.067","0.0688","","","","","","1.036","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504164","9.5593","0.0019","12.298","0.003","15.836","0.003","71.08","0.03","84.47","0.03","70.51","0.03","1660","0.7","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H34 La2 O24 -","- C24 H22 La2 O24 -","- C48 H44 La4 O48 -","2","1","","Hu, De-Xin; Luo, Feng; Che, Yun-Xia; Zheng, Ji-Min","Construction of Lanthanide Metal−Organic Frameworks by Flexible Aliphatic Dicarboxylate Ligands Plus a Rigidm-Phthalic Acid Ligand","Crystal Growth & Design","2007","7","9","1733","","10.1021/cg0608615","","x-ray","0.71073","MoKα","","0.0766","0.0508","","","0.1488","0.1735","","","","","","1.013","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504165","17.507","0.004","14.196","0.003","8.3366","0.0017","90","","95.4","0.03","90","","2062.7","0.8","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C9 H10 O7 Y -","- C9 H10 O7 Y -","- C72 H80 O56 Y8 -","8","1","","Hu, De-Xin; Luo, Feng; Che, Yun-Xia; Zheng, Ji-Min","Construction of Lanthanide Metal−Organic Frameworks by Flexible Aliphatic Dicarboxylate Ligands Plus a Rigidm-Phthalic Acid Ligand","Crystal Growth & Design","2007","7","9","1733","","10.1021/cg0608615","","x-ray","0.71073","MoKα","","0.0404","0.0303","","","0.0671","0.07","","","","","","0.978","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504166","6.7577","0.0014","10.003","0.002","10.49","0.002","92.79","0.03","107.95","0.03","108.78","0.03","630","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H12 Er O8 -","- C11 H12 Er O8 -","- C22 H24 Er2 O16 -","2","1","","Hu, De-Xin; Luo, Feng; Che, Yun-Xia; Zheng, Ji-Min","Construction of Lanthanide Metal−Organic Frameworks by Flexible Aliphatic Dicarboxylate Ligands Plus a Rigidm-Phthalic Acid Ligand","Crystal Growth & Design","2007","7","9","1733","","10.1021/cg0608615","","","0.71073","MoKα","","0.0238","0.0225","","","0.0545","0.055","","","","","","1.05","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504167","14.678","0.004","5.951","0.002","9.03","0.002","90","","105.72","0.04","90","","759.3","0.4","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-Chlorophenylboronic acid","","- C6 H6 B Cl O2 -","- C6 H6 B Cl O2 -","- C24 H24 B4 Cl4 O8 -","4","1","","Shimpi, Manishkumar R.; SeethaLekshmi, Nanappan; Pedireddi, Venkateswara Rao","Supramolecular Architecture in Some 4-Halophenylboronic Acids","Crystal Growth & Design","2007","7","10","1958","","10.1021/cg060863p","","","0.71073","MoKα","","0.0466","0.0385","","","0.1115","0.133","","","","","","1.104","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504168","5.01","0.003","7.241","0.004","10.989","0.006","103.3","0.08","97.06","0.09","100.52","0.09","375.7","0.4","133","2","133","2","","","","","","","","5","P -1","-P 1","2","4-Bromophenylboronic acid","","","- C6 H6 B Br O2 -","- C6 H6 B Br O2 -","- C12 H12 B2 Br2 O4 -","2","1","","Shimpi, Manishkumar R.; SeethaLekshmi, Nanappan; Pedireddi, Venkateswara Rao","Supramolecular Architecture in Some 4-Halophenylboronic Acids","Crystal Growth & Design","2007","7","10","1958","","10.1021/cg060863p","","","0.71073","MoKα","","0.0687","0.0622","","","0.1607","0.1651","","","","","","0.97","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504169","14.427","0.009","24.973","0.001","9.901","0.006","90","","90","","90","","3567","3","133","2","133","2","","","","","","","","5","I b a m","-I 2 2c","72","","4-Bromophenylboronic acid hydrate","","- C6 H6 B Br O2.75 -","- C6 H6 B Br O2.75 -","- C96 H96 B16 Br16 O44 -","16","1","","Shimpi, Manishkumar R.; SeethaLekshmi, Nanappan; Pedireddi, Venkateswara Rao","Supramolecular Architecture in Some 4-Halophenylboronic Acids","Crystal Growth & Design","2007","7","10","1958","","10.1021/cg060863p","","","0.71073","MoKα","","0.1099","0.0728","","","0.2058","0.2311","","","","","","1.011","","","","has coordinates","264242","2021-04-16","08:52:18",""
"4504170","15.157","0.008","24.837","0.001","9.872","0.005","90","","90","","90","","3716","3","133","2","133","2","","","","","","","","5","I b a m","-I 2 2c","72","4-Iodophenylboronic acid hydrate","","","- C6 H6 B I O2.5 -","- C6 H6 B I O2.5 -","- C96 H96 B16 I16 O40 -","16","1","","Shimpi, Manishkumar R.; SeethaLekshmi, Nanappan; Pedireddi, Venkateswara Rao","Supramolecular Architecture in Some 4-Halophenylboronic Acids","Crystal Growth & Design","2007","7","10","1958","","10.1021/cg060863p","","","0.71073","MoKα","","0.0862","0.0563","","","0.1554","0.1848","","","","","","1.021","","","","has coordinates","264242","2021-04-16","08:52:18",""
"4504171","19.28","0.006","18.881","0.006","9.854","0.003","90","","90","","90","","3587.1","1.9","133","2","133","2","","","","","","","","5","I b a m","-I 2 2c","72","","4-Iodophenylboronic acid hydrate","","- C12 H12 B2 I2 O5 -","- C12 H12 B2 I2 O5 -","- C96 H96 B16 I16 O40 -","8","0.5","","Shimpi, Manishkumar R.; SeethaLekshmi, Nanappan; Pedireddi, Venkateswara Rao","Supramolecular Architecture in Some 4-Halophenylboronic Acids","Crystal Growth & Design","2007","7","10","1958","","10.1021/cg060863p","","","0.71073","MoKα","","0.063","0.0525","","","0.1794","0.1951","","","","","","1.088","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504172","11.442","0.002","11.905","0.002","17.169","0.003","107.62","0.03","91.67","0.03","102.37","0.03","2166.1","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- H60 K12 Ni7 O95 Si2 W16 -","- K12 Ni7 O95 Si2 W16 -","- K12 Ni7 O95 Si2 W16 -","1","0.5","","Zhang, Zhiming; Wang, Enbo; Qi, Yanfei; Li, Yangguang; Mao, Baodong; Su, Zhongmin","Synthesis, Characterization, and Crystal Structures of Double-Cubane-Substituted and Asymmetric Penta-Ni-Substituted Dimeric Polyoxometalates","Crystal Growth & Design","2007","7","7","1305","","10.1021/cg060868m","","","0.71073","MoKα","","0.1562","0.0865","","","0.1921","0.2339","","","","","","1.02","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504173","18.435","0.004","21.92","0.004","25.095","0.005","81.44","0.03","73.87","0.03","85.31","0.03","9624","4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- H106 K6 Na18 Ni10 O185 Si4 W34 -","- K6 Na18 Ni10 O185 Si4 W34 -","- K12 Na36 Ni20 O370 Si8 W68 -","2","1","","Zhang, Zhiming; Wang, Enbo; Qi, Yanfei; Li, Yangguang; Mao, Baodong; Su, Zhongmin","Synthesis, Characterization, and Crystal Structures of Double-Cubane-Substituted and Asymmetric Penta-Ni-Substituted Dimeric Polyoxometalates","Crystal Growth & Design","2007","7","7","1305","","10.1021/cg060868m","","","0.71073","MoKα","","0.1181","0.0675","","","0.1684","0.2011","","","","","","1.066","","","","has coordinates,has disorder","179576","2020-10-21","18:00:00",""
"4504174","10.3691","0.0005","10.4155","0.0005","11.0993","0.0005","64.144","0.001","71.293","0.001","63.249","0.001","951.65","0.08","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C33 H53 N11 O13 -","- C33 H53 N11 O13 -","- C33 H53 N11 O13 -","1","1","","Kang, Sung Ok; Powell, Douglas; Day, Victor W.; Bowman-James, Kristin","Crystallized Water: Internal and External Ice Fragments in Polycyclic Hosts","Crystal Growth & Design","2007","7","4","606","","10.1021/cg0608817","","","0.71073","MoKα","","0.0446","0.0433","","","0.1125","0.1136","","","","","","1.046","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504175","10.6489","0.001","11.7894","0.001","11.9457","0.0012","88.667","0.003","81.501","0.003","64.577","0.003","1338.3","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H37.35 N8 O7.88 -","- C24 H37.35 N8 O7.871 -","- C48 H74.7 N16 O15.742 -","2","1","","Kang, Sung Ok; Powell, Douglas; Day, Victor W.; Bowman-James, Kristin","Crystallized Water: Internal and External Ice Fragments in Polycyclic Hosts","Crystal Growth & Design","2007","7","4","606","","10.1021/cg0608817","","","0.71073","MoKα","","0.0559","0.0481","","","0.1316","0.1371","","","","","","1.061","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504176","7.608","0.002","7.987","0.002","10.443","0.002","104.5","0.03","94.35","0.03","116.79","0.03","535.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C5 H13 Cl Mg0.5 N3 O4 -","- C5 H13 Cl Mg0.5 N3 O4 -","- C10 H26 Cl2 Mg N6 O8 -","2","1","","Mastropietro, Teresa F.; Armentano, Donatella; Marino, Nadia; De Munno, Giovanni; Anastassopoulou, Jane; Theophanides, Theophilos","Supramolecular Assemblies of Nucleobase Derivative 1-Mecyt with Mg(II) and Ni(II) and Solid-State Transformation of Ni(II) Phase: A Comprehensive Evidence of Their Different Reactivity toward 1-Mecyt [1-Mecyt = 1-Methylcytosine]","Crystal Growth & Design","2007","7","4","609","","10.1021/cg060894k","","","0.71073","MoKα","","0.0478","0.0431","","","0.115","0.1195","","","","","","1.009","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504177","7.502","0.001","7.584","0.001","10.383","0.001","104.85","0.01","94.05","0.01","116.11","0.01","501.16","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C5 H13 Cl N3 Ni0.5 O4 -","- C5 H13 Cl N3 Ni0.5 O4 -","- C10 H26 Cl2 N6 Ni O8 -","2","1","","Mastropietro, Teresa F.; Armentano, Donatella; Marino, Nadia; De Munno, Giovanni; Anastassopoulou, Jane; Theophanides, Theophilos","Supramolecular Assemblies of Nucleobase Derivative 1-Mecyt with Mg(II) and Ni(II) and Solid-State Transformation of Ni(II) Phase: A Comprehensive Evidence of Their Different Reactivity toward 1-Mecyt [1-Mecyt = 1-Methylcytosine]","Crystal Growth & Design","2007","7","4","609","","10.1021/cg060894k","","","0.71073","MoKα","","0.038","0.0366","","","0.1029","0.1045","","","","","","1.065","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504178","27.6819","0.0006","7.3574","0.0002","14.5039","0.0004","90","","101.251","0.002","90","","2897.19","0.13","293","2","273","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H14 Cl2 N6 Ni O2 -","- C10 H14 Cl2 N6 Ni O2 -","- C80 H112 Cl16 N48 Ni8 O16 -","8","1","","Mastropietro, Teresa F.; Armentano, Donatella; Marino, Nadia; De Munno, Giovanni; Anastassopoulou, Jane; Theophanides, Theophilos","Supramolecular Assemblies of Nucleobase Derivative 1-Mecyt with Mg(II) and Ni(II) and Solid-State Transformation of Ni(II) Phase: A Comprehensive Evidence of Their Different Reactivity toward 1-Mecyt [1-Mecyt = 1-Methylcytosine]","Crystal Growth & Design","2007","7","4","609","","10.1021/cg060894k","","","0.71073","MoKα","","0.0269","0.0231","","","0.0924","0.1029","","","","","","0.889","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504179","13.992","0.004","5.7153","0.0014","31.126","0.008","90","","100.513","0.005","90","","2447.3","1.1","123","2","123","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C58 H48 Cu N6 O9 -","- C58 H48 Cu N6 O9 -","- C116 H96 Cu2 N12 O18 -","2","0.5","","Wu, Shu-Ting; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","pH-Dependent Assembly of Supramolecular Architectures from 0D to 2D Networks","Crystal Growth & Design","2007","7","9","1746","","10.1021/cg0608965","","","0.71073","MoKα","","0.0818","0.0698","","","0.1412","0.1472","","","","","","1.165","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504180","30.283","0.005","15.139","0.002","14.457","0.002","90","","112.776","0.003","90","","6111.1","1.6","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C58 H66 Cu2 N6 O19 -","- C58 H66 Cu2 N6 O19 -","- C232 H264 Cu8 N24 O76 -","4","0.5","","Wu, Shu-Ting; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","pH-Dependent Assembly of Supramolecular Architectures from 0D to 2D Networks","Crystal Growth & Design","2007","7","9","1746","","10.1021/cg0608965","","","0.71073","MoKα","","0.0458","0.04","","","0.105","0.1085","","","","","","1.098","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504181","5.8317","0.0012","21.157","0.004","20.679","0.004","90","","94.343","0.003","90","","2544.1","0.9","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C58 H44 Cu2 N6 O8 -","- C58 H44 Cu2 N6 O8 -","- C116 H88 Cu4 N12 O16 -","2","0.5","","Wu, Shu-Ting; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","pH-Dependent Assembly of Supramolecular Architectures from 0D to 2D Networks","Crystal Growth & Design","2007","7","9","1746","","10.1021/cg0608965","","","0.71073","MoKα","","0.039","0.0358","","","0.0896","0.0913","","","","","","1.072","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504182","14.016","0.003","18.492","0.004","19.353","0.004","66.22","0.003","79.948","0.004","88.39","0.003","4514.7","1.7","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C97 H92 Cu3 N11 O21 -","- C97 H74 Cu3 N11 O21 -","- C194 H148 Cu6 N22 O42 -","2","1","","Wu, Shu-Ting; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","pH-Dependent Assembly of Supramolecular Architectures from 0D to 2D Networks","Crystal Growth & Design","2007","7","9","1746","","10.1021/cg0608965","","","0.71073","MoKα","","0.0612","0.0527","","","0.1431","0.1506","","","","","","1.002","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504183","5.688","0.0016","17.917","0.005","20.904","0.006","90","","92.959","0.005","90","","2127.5","1","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H42 Cu3 N4 O12 -","- C48 H42 Cu3 N4 O12 -","- C96 H84 Cu6 N8 O24 -","2","0.5","","Wu, Shu-Ting; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","pH-Dependent Assembly of Supramolecular Architectures from 0D to 2D Networks","Crystal Growth & Design","2007","7","9","1746","","10.1021/cg0608965","","","0.71073","MoKα","","0.059","0.048","","","0.1209","0.1257","","","","","","1.04","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504184","9.5464","0.0007","17.0621","0.0011","14.0941","0.001","90","","105.456","0.001","90","","2212.6","0.3","150","","150","","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C40 H44 Cu2 F8 N8 O4 V2 -","- C40 H44 Cu2 F8 N8 O4 V2 -","- C80 H88 Cu4 F16 N16 O8 V4 -","2","0.5","","Welk, Margaret E.; Stern, Charlotte L.; Poeppelmeier, Kenneth R.; Norquist, Alexander J.","Effects of Reaction Gel Dehydration on the Synthesis of Cu(NC5H5)4VOF4and [Cu(NC5H5)4VOF4][Cu(NC5H5)4(H2O)VOF4]·H2O","Crystal Growth & Design","2007","7","5","956","","10.1021/cg0609062","","","0.71073","MoKα","","0.0624","0.0335","","0.0818","0.0764","0.0764","","","","","","0.8623","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504185","10.5023","0.0005","13.0806","0.0007","31.097","0.0016","90","","90","","90","","4272","0.4","150","","150","","","","","","","","","7","C 2 2 21","C 2c 2","20","","","","- C20 H20 Cu F4 N4 O V -","- C20 H20 Cu F4 N4 O V -","- C160 H160 Cu8 F32 N32 O8 V8 -","8","1","","Welk, Margaret E.; Stern, Charlotte L.; Poeppelmeier, Kenneth R.; Norquist, Alexander J.","Effects of Reaction Gel Dehydration on the Synthesis of Cu(NC5H5)4VOF4and [Cu(NC5H5)4VOF4][Cu(NC5H5)4(H2O)VOF4]·H2O","Crystal Growth & Design","2007","7","5","956","","10.1021/cg0609062","","","0.71073","MoKα","","0.0422","0.0279","","0.0779","0.0673","0.0673","","","","","","0.8833","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504186","9.8937","0.0004","14.9532","0.0007","18.5593","0.0008","90","","90","","90","","2745.7","0.2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H43 N O3 P2 Pd -","- C24 H43 N O3 P2 Pd -","- C96 H172 N4 O12 P8 Pd4 -","4","1","","Johansson, Roger; Öhrström, Lars; Wendt, Ola F.","Hydrogen Bond Control of Dimensionality in Organometallic {2,6-Bis[(di-t-butylphosphino)methyl]phenyl}palladium(II) Compounds: Dimers, Chains, and a 3D-Net with an Apparent Channel Structure","Crystal Growth & Design","2007","7","10","1974","","10.1021/cg060913q","","","0.71073","MoKα","","0.0609","0.032","","","0.067","0.0691","","","","","","1.008","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504187","11.2561","0.0007","15.9146","0.001","30.6537","0.0017","90","","90","","90","","5491.2","0.6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H44 O2.5 P2 Pd -","- C24 H43 O2.456 P2 Pd -","- C192 H344 O19.648 P16 Pd8 -","8","1","","Johansson, Roger; Öhrström, Lars; Wendt, Ola F.","Hydrogen Bond Control of Dimensionality in Organometallic {2,6-Bis[(di-t-butylphosphino)methyl]phenyl}palladium(II) Compounds: Dimers, Chains, and a 3D-Net with an Apparent Channel Structure","Crystal Growth & Design","2007","7","10","1974","","10.1021/cg060913q","","","0.71073","MoKα","","0.1682","0.0567","","","0.1424","0.1783","","","","","","0.98","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504188","16.669","0.002","16.669","0.002","19.018","0.004","90","","90","","120","","4576.3","1.2","150","2","150","2","","","","","","","","6","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C27 H43 N O2 P2 Pd -","- C27.16 H43 N O2 P2 Pd -","- C162.96 H258 N6 O12 P12 Pd6 -","6","0.5","","Johansson, Roger; Öhrström, Lars; Wendt, Ola F.","Hydrogen Bond Control of Dimensionality in Organometallic {2,6-Bis[(di-t-butylphosphino)methyl]phenyl}palladium(II) Compounds: Dimers, Chains, and a 3D-Net with an Apparent Channel Structure","Crystal Growth & Design","2007","7","10","1974","","10.1021/cg060913q","","","0.71073","MoKα","","0.0596","0.0377","","","0.0929","0.0994","","","","","","0.953","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504189","16.7118","0.0017","16.7118","0.0017","19.2905","0.0017","90","","90","","120","","4665.7","0.8","293","2","293","2","","","","","","","","6","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C26 H40 N O2 P2 Pd -","- C26.325 H43 N O2 P2 Pd -","- C157.95 H258 N6 O12 P12 Pd6 -","6","0.5","","Johansson, Roger; Öhrström, Lars; Wendt, Ola F.","Hydrogen Bond Control of Dimensionality in Organometallic {2,6-Bis[(di-t-butylphosphino)methyl]phenyl}palladium(II) Compounds: Dimers, Chains, and a 3D-Net with an Apparent Channel Structure","Crystal Growth & Design","2007","7","10","1974","","10.1021/cg060913q","","","0.71073","MoKα","","0.067","0.0318","","","0.055","0.0571","","","","","","0.995","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504190","11.9666","0.0017","11.9666","0.0017","15.485","0.003","90","","90","","90","","2217.4","0.6","293","2","293","2","","","","","","","","6","I 41 2 2","I 4bw 2bw","98","","","","- C7 H7 Cl N2 O4 Pb -","- C7 H7 Cl N2 O4 Pb -","- C56 H56 Cl8 N16 O32 Pb8 -","8","0.5","","Wang, Xian-Wen; Han, Lei; Cai, Tie-Jun; Zheng, Yue-Qing; Chen, Jing-Zhong; Deng, Qian","A Novel Chiral Doubly Folded Interpenetrating 3D Metal-Organic Framework Based on the Flexible Zwitterionic Ligand","Crystal Growth & Design","2007","7","6","1027","","10.1021/cg060922z","","","0.71073","MoKα","","0.0215","0.0204","","","0.0514","0.0518","","","","","","1.166","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504191","6.7169","0.0007","9.0656","0.0008","9.1565","0.001","74.93","0.007","74.262","0.008","70.52","0.007","497.03","0.09","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","catena-((μ6-pyridine-2,4,6-carboxylato)- μ3-hydroxy-aqua-di-manganese(II))","","- C8 H5 Mn2 N O8 -","- C8 H5 Mn2 N O8 -","- C16 H10 Mn4 N2 O16 -","2","1","","Wang, Xian-Wen; Dong, You-Ren; Zheng, Yue-Qing; Chen, Jing-Zhong","A Novel Five-Connected BN Topological Network Metal−Organic Framework Mn(II) Cluster Complex","Crystal Growth & Design","2007","7","4","613","","10.1021/cg060940g","","","0.71073","MoKα","","0.0544","0.0359","","","0.123","0.1621","","","","","","1.185","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504192","22.9851","0.0009","22.9851","0.0009","12.4864","0.001","90","","90","","120","","5713","0.6","273","2","273","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C18 H42 O6 P3 Sb Se6 -","- C18 H42 O6 P3 Sb Se6 -","- C108 H252 O36 P18 Sb6 Se36 -","6","0.333333","","Chang, Hao-Wei; Sarkar, Bijay; Liu, C. W.","Synthesis of Sb2Se3Nanowires via a Solvothermal Route from the Single Source Precursor Sb[Se2P(OiPr)2]3","Crystal Growth & Design","2007","7","12","2691","","10.1021/cg060954m","","","0.71073","MoKα","","0.0461","0.0341","","","0.0866","0.0955","","","","","","1.036","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504193","16.7786","0.0014","18.1213","0.0015","4.7826","0.0004","90","","90","","90","","1454.1","0.2","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","2,3-Phenazinediamine tetrahydrated","2,3-Phenazinediamine tetrahydrated","","- C12 H18 N4 O4 -","- C12 H18 N4 O4 -","- C48 H72 N16 O16 -","4","1","","Upreti, Shailesh; Datta, Ayan; Ramanan, Arunachalam","Role of Nonbonding Interactions in the Crystal Growth of Phenazinediamine Tetrahydrate: New Insights into the Occurrence of 2D Water Layers in Crystal Hydrates","Crystal Growth & Design","2007","7","5","966","","10.1021/cg060958r","","","0.71073","MoKα","","0.0855","0.081","","","0.1931","0.2018","","","","","","1.343","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504194","11.426","0.004","13.704","0.004","14.625","0.005","110.958","0.005","94.824","0.005","93.252","0.006","2121.6","1.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H78 Cu4 N24 O27 S8 -","- C60 H56 Cu4 N24 O27 S8 -","- C60 H56 Cu4 N24 O27 S8 -","1","0.5","","Guo, Dong-Sheng; Liu, Yu","A Novel Supramolecular Assembly Constructed by Cu/imidazole Complex with 1,2-Alternatep-Sulfonatothiacalix[4]arene","Crystal Growth & Design","2007","7","6","1038","","10.1021/cg0700014","","","0.71073","MoKα","","0.1348","0.0633","","","0.1403","0.1741","","","","","","1","","","","has coordinates,has disorder","179576","2020-10-21","18:00:00",""
"4504195","9.9881","0.0005","9.9881","0.0005","19.464","0.002","90","","90","","120","","1681.6","0.2","173","2","173","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C24 H22 Co N6 O4 -","- C24 H22 Co N6 O4 -","- C72 H66 Co3 N18 O12 -","3","0.5","","Montney, Matthew R.; Mallika Krishnan, Subhashree; Patel, Niral M.; Supkowski, Ronald M.; LaDuca, Robert L.","Divalent Metal Succinate/4,4‘-Dipyridylamine Extended Solids: From Helical Chains to Diverse Three-Dimensional Networks Featuring Double, Quadruple, or Self-Interpenetration","Crystal Growth & Design","2007","7","6","1145","","10.1021/cg070008l","","","0.71073","MoKα","","0.0634","0.0426","","","0.0822","0.0872","","","","","","0.963","","","","has coordinates,has disorder","179576","2020-10-21","18:00:00",""
"4504196","15.8537","0.0016","16.7071","0.0017","16.6416","0.0017","90","","90","","90","","4407.8","0.8","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C22 H20 Cl N6 Ni O2 -","- C22 H20 Cl N6 Ni O2 -","- C176 H160 Cl8 N48 Ni8 O16 -","8","1","","Montney, Matthew R.; Mallika Krishnan, Subhashree; Patel, Niral M.; Supkowski, Ronald M.; LaDuca, Robert L.","Divalent Metal Succinate/4,4‘-Dipyridylamine Extended Solids: From Helical Chains to Diverse Three-Dimensional Networks Featuring Double, Quadruple, or Self-Interpenetration","Crystal Growth & Design","2007","7","6","1145","","10.1021/cg070008l","","","0.71073","MoKα","","0.0445","0.037","","","0.088","0.0918","","","","","","1.087","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504197","16.751","0.002","16.751","0.002","40.752","0.012","90","","90","","90","","11435","4","293","2","293","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","","","","- C14 H14 Cu N3 O4.5 -","- C14 H14 Cu N3 O4.5 -","- C448 H448 Cu32 N96 O144 -","32","1","","Montney, Matthew R.; Mallika Krishnan, Subhashree; Patel, Niral M.; Supkowski, Ronald M.; LaDuca, Robert L.","Divalent Metal Succinate/4,4‘-Dipyridylamine Extended Solids: From Helical Chains to Diverse Three-Dimensional Networks Featuring Double, Quadruple, or Self-Interpenetration","Crystal Growth & Design","2007","7","6","1145","","10.1021/cg070008l","","","0.71073","MoKα","","0.0911","0.0595","","","0.1273","0.1428","","","","","","1.025","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504198","16.9319","0.0017","10.7847","0.0011","18.3104","0.0018","90","","113.265","0.002","90","","3071.7","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H13 N3 O5 Zn -","- C14 H13 N3 O5 Zn -","- C112 H104 N24 O40 Zn8 -","8","1","","Montney, Matthew R.; Mallika Krishnan, Subhashree; Patel, Niral M.; Supkowski, Ronald M.; LaDuca, Robert L.","Divalent Metal Succinate/4,4‘-Dipyridylamine Extended Solids: From Helical Chains to Diverse Three-Dimensional Networks Featuring Double, Quadruple, or Self-Interpenetration","Crystal Growth & Design","2007","7","6","1145","","10.1021/cg070008l","","","0.71073","MoKα","","0.1378","0.0583","","","0.1219","0.1612","","","","","","1.01","","","","has coordinates,has disorder","179576","2020-10-21","18:00:00",""
"4504199","12.5","0.003","16.55","0.004","14.409","0.004","90","","90","","90","","2980.9","1.3","173","2","173","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C14 H15 Cd N3 O5 -","- C14 H15 Cd N3 O5 -","- C112 H120 Cd8 N24 O40 -","8","","","Montney, Matthew R.; Mallika Krishnan, Subhashree; Patel, Niral M.; Supkowski, Ronald M.; LaDuca, Robert L.","Divalent Metal Succinate/4,4‘-Dipyridylamine Extended Solids: From Helical Chains to Diverse Three-Dimensional Networks Featuring Double, Quadruple, or Self-Interpenetration","Crystal Growth & Design","2007","7","6","1145","","10.1021/cg070008l","","","0.71073","MoKα","","0.05","0.0289","","","0.0657","0.0777","","","","","","1.098","","","","has coordinates","179576","2020-10-21","18:00:00",""
"4504200","9.558","0.002","7.5277","0.0016","25.132","0.006","90","","100.63","0.004","90","","1777.2","0.7","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 Cu N2 O8 -","- C15 H18 Cu N2 O8 -","- C60 H72 Cu4 N8 O32 -","4","1","","Song, Xue-Yan; Li,; Liao, Dai-Zheng; Jiang, Zong-Hui; Yan, Shi-Ping","Extended Tapes of Cyclic Water Hexamers in an Unusual Oxalate-Bridged One-Dimensional Copper(II) Complex","Crystal Growth & Design","2007","7","7","1220","","10.1021/cg070017u","","","0.71073","MoKα","","0.0938","0.0503","","","0.1234","0.143","","","","","","1.089","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504201","28.08","0.006","13.84","0.003","21.812","0.004","90","","120.14","0.03","90","","7331","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C78 H54 Co4 N12 O20 -","- C78 H54 Co4 N12 O20 -","- C312 H216 Co16 N48 O80 -","4","0.5","","Liu, Cai-Ming; Gao, Song; Zhang, De-Qing; Zhu, Dao-Ben","Three-Dimensional Eight- or Four-Connected Metal−Organic Frameworks Tuned by Hydrothermal Temperatures","Crystal Growth & Design","2007","7","7","1312","","10.1021/cg0700216","","","0.71073","MoKα","","0.0722","0.0516","","","0.1627","0.1734","","","","","","1.007","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504202","21.293","0.004","7.159","0.001","22.218","0.004","90","","105.07","0.03","90","","3270.4","1.1","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C68 H52 Co3 N10 O21 -","- C68 H52 Co3 N10 O21 -","- C136 H104 Co6 N20 O42 -","2","0.5","","Liu, Cai-Ming; Gao, Song; Zhang, De-Qing; Zhu, Dao-Ben","Three-Dimensional Eight- or Four-Connected Metal−Organic Frameworks Tuned by Hydrothermal Temperatures","Crystal Growth & Design","2007","7","7","1312","","10.1021/cg0700216","","","0.71073","MoKα","","0.111","0.0739","","","0.1795","0.2015","","","","","","1.09","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504203","13.6343","0.0006","11.9334","0.0005","13.7862","0.0006","90","","112.796","0.001","90","","2067.86","0.16","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Cu N2 O4 S2 -","- C20 H20 Cu N2 O4 S2 -","- C80 H80 Cu4 N8 O16 S8 -","4","1","","Won, Tae-Jin; Clegg, Jack K.; Lindoy, Leonard F.; McMurtrie, John C.","Cobalt(II), Copper(II), and Zinc(II) Framework Systems Derived from Ditopic Pyridyl-Acetylacetone and Pyridyl-Pyrazole Ligands","Crystal Growth & Design","2007","7","5","972","","10.1021/cg0700317","","","0.71073","MoKα","","0.0332","0.0271","","","0.0694","0.0725","","","","","","1.031","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504204","11.0421","0.0009","14.8315","0.0012","17.5303","0.0015","90","","102.19","0.001","90","","2806.2","0.4","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C21 H22 Cl3 Cu N2 O4.5 S2 -","- C21 H21 Cl3 Cu N2 O4.5 S2 -","- C84 H84 Cl12 Cu4 N8 O18 S8 -","4","0.5","","Won, Tae-Jin; Clegg, Jack K.; Lindoy, Leonard F.; McMurtrie, John C.","Cobalt(II), Copper(II), and Zinc(II) Framework Systems Derived from Ditopic Pyridyl-Acetylacetone and Pyridyl-Pyrazole Ligands","Crystal Growth & Design","2007","7","5","972","","10.1021/cg0700317","","","0.71073","MoKα","","0.0945","0.0774","","","0.2168","0.2334","","","","","","1.037","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504205","10.72","0.003","14.938","0.004","16.088","0.004","90","","99.899","0.005","90","","2537.9","1.2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H24 N2 O6 S2 Zn -","- C20 H20 N2 O6 S2 Zn -","- C80 H80 N8 O24 S8 Zn4 -","4","0.5","","Won, Tae-Jin; Clegg, Jack K.; Lindoy, Leonard F.; McMurtrie, John C.","Cobalt(II), Copper(II), and Zinc(II) Framework Systems Derived from Ditopic Pyridyl-Acetylacetone and Pyridyl-Pyrazole Ligands","Crystal Growth & Design","2007","7","5","972","","10.1021/cg0700317","","","0.71073","MoKα","","0.0649","0.0428","","","0.1085","0.1195","","","","","","1.028","","","","has coordinates,has disorder","179577","2020-10-21","18:00:00",""
"4504206","14.8219","0.0006","14.8219","0.0006","11.5312","0.0007","90","","90","","90","","2533.3","0.2","150","2","150","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C22 H28 N2 O6 S2 Zn -","- C22 H28 N2 O6 S2 Zn -","- C88 H112 N8 O24 S8 Zn4 -","4","0.5","","Won, Tae-Jin; Clegg, Jack K.; Lindoy, Leonard F.; McMurtrie, John C.","Cobalt(II), Copper(II), and Zinc(II) Framework Systems Derived from Ditopic Pyridyl-Acetylacetone and Pyridyl-Pyrazole Ligands","Crystal Growth & Design","2007","7","5","972","","10.1021/cg0700317","","","0.71073","MoKα","","0.038","0.0353","","","0.0983","0.0996","","","","","","1.11","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4504207","7.389","0.0008","9.904","0.001","20.499","0.002","90","","90","","90","","1500.1","0.3","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C10 H12 Cl3 Co N3 S -","- C10 H12 Cl3 Co N3 S -","- C40 H48 Cl12 Co4 N12 S4 -","4","1","","Won, Tae-Jin; Clegg, Jack K.; Lindoy, Leonard F.; McMurtrie, John C.","Cobalt(II), Copper(II), and Zinc(II) Framework Systems Derived from Ditopic Pyridyl-Acetylacetone and Pyridyl-Pyrazole Ligands","Crystal Growth & Design","2007","7","5","972","","10.1021/cg0700317","","","0.71073","MoKα","","0.0231","0.0224","","","0.0519","0.0521","","","","","","1.029","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4504208","18.016","0.002","9.353","0.001","17.336","0.0019","90","","107.934","0.002","90","","2779.2","0.5","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C10 H12 Cl2 N3 O0.5 S Zn -","- C10 H12 Cl2 N3 O0.5 S Zn -","- C80 H96 Cl16 N24 O4 S8 Zn8 -","8","1","","Won, Tae-Jin; Clegg, Jack K.; Lindoy, Leonard F.; McMurtrie, John C.","Cobalt(II), Copper(II), and Zinc(II) Framework Systems Derived from Ditopic Pyridyl-Acetylacetone and Pyridyl-Pyrazole Ligands","Crystal Growth & Design","2007","7","5","972","","10.1021/cg0700317","","","0.71073","MoKα","","0.0354","0.0266","","","0.0643","0.0681","","","","","","1.029","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504209","17.1609","0.0012","17.1609","0.0012","12.6734","0.0019","90","","90","","120","","3232.2","0.6","298","2","298","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C21 H12 Co3 N3 O14 -","- C21 H9 Co3 N3 O14 -","- C126 H54 Co18 N18 O84 -","6","0.166667","","Zhang, Xian-Ming; Zheng, Yan-Zhen; Li, Cui-Rui; Zhang, Wei-Xiong; Chen, Xiao-Ming","Unprecedented (3,9)-Connected (42.6)3(46.621.89) Net Constructed by Trinuclear Mixed-Valence Cobalt Clusters","Crystal Growth & Design","2007","7","5","980","","10.1021/cg070038o","","","0.71073","MoKα","","0.0604","0.0489","","","0.1077","0.1224","","","","","","1.108","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504210","17.122","0.003","17.122","0.003","12.53","0.004","90","","90","","120","","3181.2","1.3","100","2","100","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C21 H12 Co3 N3 O14 -","- C21 H9 Co3 N3 O14 -","- C126 H54 Co18 N18 O84 -","6","0.166667","","Zhang, Xian-Ming; Zheng, Yan-Zhen; Li, Cui-Rui; Zhang, Wei-Xiong; Chen, Xiao-Ming","Unprecedented (3,9)-Connected (42.6)3(46.621.89) Net Constructed by Trinuclear Mixed-Valence Cobalt Clusters","Crystal Growth & Design","2007","7","5","980","","10.1021/cg070038o","","","0.71073","MoKα","","0.0665","0.0497","","","0.1073","0.1149","","","","","","1.056","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504211","10.1666","0.0002","11.3757","0.0002","20.3238","0.0006","90","","91.6694","0.0009","90","","2349.49","0.09","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(4,4'-bipyridine)silver(I) 1-phenyl-closo-1-monocarbadecaborane acetonitrile clathrate","","- C19 H25 Ag B9 N3 -","- C19 H25 Ag B9 N3 -","- C76 H100 Ag4 B36 N12 -","4","1","","Cunha-Silva, Luís; Ahmad, Ruksanna; Carr, Michael J.; Franken, Andreas; Kennedy, John D.; Hardie, Michaele J.","One-Dimensional Coordination Polymers with Phenyl-carbaborane Anions: Ag(I)/4,4‘-Bipyridine and 2,3-Bis-(2-pyridyl)pyrazine Complexes","Crystal Growth & Design","2007","7","4","658","","10.1021/cg070048p","","","0.71073","MoKα","","0.1158","0.0939","","","0.2211","0.2402","","","","","","1.042","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504212","12.1354","0.0009","20.8408","0.0015","14.1118","0.0011","90","","112.174","0.004","90","","3305.1","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[(4,4'-bipyridine)(1-phenyl-6,7,8,9,10-pentaiodo-closo-1-monocarbadecaborane)silver(I)] acetonitrile clathrate","","- C19 H20 Ag B9 I5 N3 -","- C19 H20 Ag B9 I5 N3 -","- C76 H80 Ag4 B36 I20 N12 -","4","1","","Cunha-Silva, Luís; Ahmad, Ruksanna; Carr, Michael J.; Franken, Andreas; Kennedy, John D.; Hardie, Michaele J.","One-Dimensional Coordination Polymers with Phenyl-carbaborane Anions: Ag(I)/4,4‘-Bipyridine and 2,3-Bis-(2-pyridyl)pyrazine Complexes","Crystal Growth & Design","2007","7","4","658","","10.1021/cg070048p","","","0.71073","MoKα","","0.0535","0.0386","","","0.0876","0.0962","","","","","","1.135","","","","has coordinates,has disorder","179577","2020-10-21","18:00:00",""
"4504213","9.556","0.0002","11.774","0.0002","16.6977","0.0003","97.0146","0.0007","96.2209","0.0007","109.393","0.0009","1736.45","0.06","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","[(4,4'-bipyridine)(1-phenyl-7,8,9,10,11,12-hexaiodo-closo-1-monocarbadodecaborane)silver(I)] acetonitrile clathrate","","- C19 H21 Ag B11 I6 N3 -","- C19 H21 Ag B11 I6 N3 -","- C38 H42 Ag2 B22 I12 N6 -","2","1","","Cunha-Silva, Luís; Ahmad, Ruksanna; Carr, Michael J.; Franken, Andreas; Kennedy, John D.; Hardie, Michaele J.","One-Dimensional Coordination Polymers with Phenyl-carbaborane Anions: Ag(I)/4,4‘-Bipyridine and 2,3-Bis-(2-pyridyl)pyrazine Complexes","Crystal Growth & Design","2007","7","4","658","","10.1021/cg070048p","","","0.71073","MoKα","","0.0755","0.0543","","","0.1481","0.1658","","","","","","1.007","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504214","11.8844","0.0002","14.1195","0.0002","15.1552","0.0002","90","","95.362","0.001","90","","2531.94","0.07","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[(2,3-bis(2-pyridyl)pyrazine)(1-phenyl-closo-1-monocarbadecaborane)silver(I)] acetonitrile clathrate","","- C22 H25.5 Ag B9 N4.5 -","- C22 H24 Ag B9 N4.5 -","- C88 H96 Ag4 B36 N18 -","4","1","","Cunha-Silva, Luís; Ahmad, Ruksanna; Carr, Michael J.; Franken, Andreas; Kennedy, John D.; Hardie, Michaele J.","One-Dimensional Coordination Polymers with Phenyl-carbaborane Anions: Ag(I)/4,4‘-Bipyridine and 2,3-Bis-(2-pyridyl)pyrazine Complexes","Crystal Growth & Design","2007","7","4","658","","10.1021/cg070048p","","","0.71073","MoKα","","0.0399","0.0365","","","0.0966","0.1","","","","","","1.032","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504215","12.2071","0.0001","12.8065","0.0001","23.8761","0.0003","98.978","0.001","92.003","0.001","106.649","0.001","3519.73","0.06","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","[tri(2,3-bis(2-pyridyl)pyrazine)disilver(I)](1-(4-bromophenyl)-closo-1-monocarbadodecaborane) acetonitrile clathrate","","- C58 H63 Ag2 B22 Br2 N13 -","- C58 H63 Ag2 B22 Br2 N13 -","- C116 H126 Ag4 B44 Br4 N26 -","2","1","","Cunha-Silva, Luís; Ahmad, Ruksanna; Carr, Michael J.; Franken, Andreas; Kennedy, John D.; Hardie, Michaele J.","One-Dimensional Coordination Polymers with Phenyl-carbaborane Anions: Ag(I)/4,4‘-Bipyridine and 2,3-Bis-(2-pyridyl)pyrazine Complexes","Crystal Growth & Design","2007","7","4","658","","10.1021/cg070048p","","","0.71073","MoKα","","0.0958","0.0535","","","0.124","0.1441","","","","","","1.02","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504216","24.6696","0.0006","12.174","0.0004","21.0898","0.0005","90","","124.454","0.002","90","","5222.8","0.3","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[(2,3-bis(2-pyridyl)pyrazine)(1-phenyl-6-bromo-closo-1-monocarbadodecaborane)silver(I)]","","- C21 H23 Ag B9 Br N4 -","- C21 H23 Ag B9 Br N4 -","- C168 H184 Ag8 B72 Br8 N32 -","8","1","","Cunha-Silva, Luís; Ahmad, Ruksanna; Carr, Michael J.; Franken, Andreas; Kennedy, John D.; Hardie, Michaele J.","One-Dimensional Coordination Polymers with Phenyl-carbaborane Anions: Ag(I)/4,4‘-Bipyridine and 2,3-Bis-(2-pyridyl)pyrazine Complexes","Crystal Growth & Design","2007","7","4","658","","10.1021/cg070048p","","","0.71073","MoKα","","0.1485","0.1254","","","0.3882","0.4117","","","","","","1.667","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504217","12.2599","0.0009","12.1377","0.0009","21.1716","0.0016","90","","90","","90","","3150.5","0.4","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C34 H14 Cu2 F8 N2 O8 -","- C34 H14 Cu2 F8 N2 O8 -","- C136 H56 Cu8 F32 N8 O32 -","4","0.5","","Wang, Zhenqiang; Kravtsov, Victor Ch.; Walsh, Rosa B.; Zaworotko, Michael J.","Guest-Dependent Cavities in Two-Dimensional Metal−Organic Frameworks Sustained by Tetrafluoro-1,3-benzenedicarboxylate","Crystal Growth & Design","2007","7","6","1154","","10.1021/cg070055d","","","0.71073","MoKα","","0.0641","0.0476","","","0.0981","0.1047","","","","","","1.089","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504218","11.2399","0.0009","12.9837","0.0011","13.4073","0.0011","89.579","0.001","67.174","0.001","79.601","0.001","1769.5","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H16 Cl Cu2 F8 N2 O8 -","- C37 H14 Cl Cu2 F8 N2 O8 -","- C74 H28 Cl2 Cu4 F16 N4 O16 -","2","1","","Wang, Zhenqiang; Kravtsov, Victor Ch.; Walsh, Rosa B.; Zaworotko, Michael J.","Guest-Dependent Cavities in Two-Dimensional Metal−Organic Frameworks Sustained by Tetrafluoro-1,3-benzenedicarboxylate","Crystal Growth & Design","2007","7","6","1154","","10.1021/cg070055d","","","0.71073","MoKα","","0.0593","0.0442","","","0.0998","0.1075","","","","","","1.026","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504219","11.3895","0.0011","12.7032","0.0012","13.2957","0.0013","89.2","0.002","69.464","0.002","78.878","0.002","1764.6","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H16 Cl0.5 Cu2 F8 N2 O8 -","- C37 H16 Cl0.5 Cu2 F8 N2 O8 -","- C74 H32 Cl Cu4 F16 N4 O16 -","2","1","","Wang, Zhenqiang; Kravtsov, Victor Ch.; Walsh, Rosa B.; Zaworotko, Michael J.","Guest-Dependent Cavities in Two-Dimensional Metal−Organic Frameworks Sustained by Tetrafluoro-1,3-benzenedicarboxylate","Crystal Growth & Design","2007","7","6","1154","","10.1021/cg070055d","","","0.71073","MoKα","","0.074","0.0539","","","0.1258","0.137","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504220","13.2869","0.001","13.5884","0.0011","19.2207","0.0015","90","","103.692","0.001","90","","3371.6","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H30 Cu2 F8 O12 -","- C30 H30 Cu2 F8 O12 -","- C120 H120 Cu8 F32 O48 -","4","1","","Wang, Zhenqiang; Kravtsov, Victor Ch.; Walsh, Rosa B.; Zaworotko, Michael J.","Guest-Dependent Cavities in Two-Dimensional Metal−Organic Frameworks Sustained by Tetrafluoro-1,3-benzenedicarboxylate","Crystal Growth & Design","2007","7","6","1154","","10.1021/cg070055d","","","0.71073","MoKα","","0.0868","0.0535","","","0.1151","0.1289","","","","","","1.026","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504221","13.0006","0.0014","12.9131","0.0013","20.042","0.002","90","","103.889","0.002","90","","3266.2","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H21.5 Cu2 F8.5 N2 O9.25 -","- C30.896 H13 Cu2 F8.576 N2 O9.16 -","- C123.584 H52 Cu8 F34.304 N8 O36.64 -","4","1","","Wang, Zhenqiang; Kravtsov, Victor Ch.; Walsh, Rosa B.; Zaworotko, Michael J.","Guest-Dependent Cavities in Two-Dimensional Metal−Organic Frameworks Sustained by Tetrafluoro-1,3-benzenedicarboxylate","Crystal Growth & Design","2007","7","6","1154","","10.1021/cg070055d","","","0.71073","MoKα","","0.1124","0.0565","","","0.1152","0.1271","","","","","","0.923","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504222","17.1422","0.0008","27.0769","0.0012","19.0568","0.0009","90","","95.093","0.001","90","","8810.4","0.7","150","1","150","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H70.5 B6 F24 N29.5 O3 Zn3 -","- C56 H70.5 B6 F24 N29.5 O3 Zn3 -","- C224 H282 B24 F96 N118 O12 Zn12 -","4","1","","Reger, Daniel L.; Watson, Russell P.; Smith, Mark D.; Pellechia, Perry J.","Metallacyclic Zinc Complexes of Alkylidene-Linked Bitopic Bis(pyrazolyl)methane Ligands: Unusual Exocyclic Bridging Fluoride Ligands","Crystal Growth & Design","2007","7","6","1163","","10.1021/cg070078s","","","0.71073","MoKα","","0.0839","0.0492","","","0.1187","0.1277","","","","","","0.878","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504223","16.3869","0.0006","12.7873","0.0005","43.2225","0.0017","90","","91.901","0.001","90","","9052","0.6","150","1","150","1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H40 B3 F13 N17 O0.5 Zn2 -","- C34 H39 B3 F13 N17 O0.5 Zn2 -","- C272 H312 B24 F104 N136 O4 Zn16 -","8","1","","Reger, Daniel L.; Watson, Russell P.; Smith, Mark D.; Pellechia, Perry J.","Metallacyclic Zinc Complexes of Alkylidene-Linked Bitopic Bis(pyrazolyl)methane Ligands: Unusual Exocyclic Bridging Fluoride Ligands","Crystal Growth & Design","2007","7","6","1163","","10.1021/cg070078s","","","0.71073","MoKα","","0.07","0.0463","","","0.1031","0.1119","","","","","","0.937","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4504224","20.5797","0.0012","15.8645","0.0009","28.6555","0.0017","90","","96.286","0.001","90","","9299.4","0.9","150","1","150","1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C59 H82 B6 F24 N28 O5 Zn3 -","- C59 H82 B6 F24 N28 O5 Zn3 -","- C236 H328 B24 F96 N112 O20 Zn12 -","4","0.5","","Reger, Daniel L.; Watson, Russell P.; Smith, Mark D.; Pellechia, Perry J.","Metallacyclic Zinc Complexes of Alkylidene-Linked Bitopic Bis(pyrazolyl)methane Ligands: Unusual Exocyclic Bridging Fluoride Ligands","Crystal Growth & Design","2007","7","6","1163","","10.1021/cg070078s","","","0.71073","MoKα","","0.0797","0.0694","","","0.206","0.2133","","","","","","1.102","","","","has coordinates,has disorder","179577","2020-10-21","18:00:00",""
"4504225","10.374","","10.122","","12.521","","90","","96.62","","90","","1306.01","","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18 Ag2 B2 F8 N6 -","- C24 H18 Ag2 B2 F8 N6 -","- C48 H36 Ag4 B4 F16 N12 -","2","0.5","","Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong","Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands","Crystal Growth & Design","2007","7","12","2481","","10.1021/cg070080j","","","0.71073","MoKα","","0.0289","0.0241","","","0.0623","0.065","","","","","","1.088","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504226","8.314","","9.078","","9.898","","106.08","","96.76","","116.83","","614.345","","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H9 Ag N4 O3 -","- C12 H9 Ag N4 O3 -","- C24 H18 Ag2 N8 O6 -","2","1","","Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong","Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands","Crystal Growth & Design","2007","7","12","2481","","10.1021/cg070080j","","","0.71073","MoKα","","0.0378","0.0311","","","0.0844","0.0873","","","","","","1.049","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504227","8.238","0.002","9.466","0.002","9.944","0.002","107.55","0.03","106.65","0.03","105.25","0.03","654.5","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H18 Ag2 Cl2 N6 O8 -","- C24 H18 Ag2 Cl2 N6 O8 -","- C24 H18 Ag2 Cl2 N6 O8 -","1","0.5","","Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong","Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands","Crystal Growth & Design","2007","7","12","2481","","10.1021/cg070080j","","","0.71073","MoKα","","0.062","0.0613","","","0.1759","0.1769","","","","","","1.046","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504228","10.774","0.002","16.613","0.002","8.481","0.004","90","","98.97","","90","","1499.4","0.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C13 H9 Ag F3 N3 O3 S -","- C13 H9 Ag F3 N3 O3 S -","- C52 H36 Ag4 F12 N12 O12 S4 -","4","1","","Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong","Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands","Crystal Growth & Design","2007","7","12","2481","","10.1021/cg070080j","","","0.71073","MoKα","","0.1097","0.066","","","0.1483","0.1707","","","","","","1.028","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504229","18.125","0.002","13.0397","0.0015","11.0126","0.0012","90","","90","","90","","2602.8","0.5","293","2","293","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C12 H11 Ag N4 O4 -","- C12 H11 Ag N4 O4 -","- C96 H88 Ag8 N32 O32 -","8","","","Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong","Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands","Crystal Growth & Design","2007","7","12","2481","","10.1021/cg070080j","","","0.71073","MoKα","","0.0272","0.0208","","","0.0517","0.0556","","","","","","1.002","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504230","10.714","0.002","16.729","0.002","7.669","0.003","90","","96.5","","90","","1365.7","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22 Cl2 Cu N6 O10 -","- C24 H22 Cl2 Cu N6 O10 -","- C48 H44 Cl4 Cu2 N12 O20 -","2","0.5","","Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong","Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands","Crystal Growth & Design","2007","7","12","2481","","10.1021/cg070080j","","","0.71073","MoKα","","0.0656","0.0494","","","0.1227","0.134","","","","","","0.975","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504231","7.6579","0.0016","9.948","0.002","11.14","0.002","86.299","0.004","71.545","0.004","81.353","0.004","795.7","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H17 Co0.5 N4 O7 -","- C12 H17 Co0.5 N4 O7 -","- C24 H34 Co N8 O14 -","2","1","","Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong","Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands","Crystal Growth & Design","2007","7","12","2481","","10.1021/cg070080j","","","0.71073","MoKα","","0.0695","0.0504","","","0.1296","0.1444","","","","","","1.068","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504232","7.0234","0.001","11.5342","0.001","14.1741","0.001","90","","100.793","0.01","90","","1127.9","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22 Cl2 Cu N6 O2 -","- C24 H22 Cl2 Cu N6 O2 -","- C48 H44 Cl4 Cu2 N12 O4 -","2","0.5","","Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong","Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands","Crystal Growth & Design","2007","7","12","2481","","10.1021/cg070080j","","","0.71073","MoKα","","0.0598","0.0347","","","0.0832","0.0883","","","","","","1.036","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504233","7.426","","8.957","","9.773","","97.17","","105.17","","90.86","","621.718","","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 N8 O8 Zn -","- C24 H22 N8 O8 Zn -","- C24 H22 N8 O8 Zn -","1","0.5","","Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong","Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands","Crystal Growth & Design","2007","7","12","2481","","10.1021/cg070080j","","","0.71073","MoKα","","0.0303","0.0272","","","0.0766","0.079","","","","","","1.049","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504234","8.148","","9.688","","11.095","","103.06","","97.85","","104.11","","810.214","","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H15 Cu N3 O4 -","- C16 H15 Cu N3 O4 -","- C32 H30 Cu2 N6 O8 -","2","1","","Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong","Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands","Crystal Growth & Design","2007","7","12","2481","","10.1021/cg070080j","","","0.71073","MoKα","","0.0394","0.0322","","","0.0914","0.0977","","","","","","1.036","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504235","14.564","0.003","17.469","0.004","15.039","0.003","90","","91.97","0.03","90","","3823.9","1.4","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C15 H30 Cu7 I7 N5 -","- C15 H24 Cu7 I7 N5 -","- C60 H96 Cu28 I28 N20 -","4","0.5","","Bi, Minghui; Li, Guanghua; Hua, Jia; Liu, Yunling; Liu, Xiaomin; Hu, Yawei; Shi, Zhan; Feng, Shouhua","Two Isomers with FSC Topology Constructed from Cu6I6(DABCO)4and Cu8I8(DABCO)6Building Blocks","Crystal Growth & Design","2007","7","10","2066","","10.1021/cg0700824","","","0.71073","MoKα","","0.0762","0.0529","","","0.1321","0.1432","","","","","","1.042","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504236","10.29","0.002","11.102","0.002","17.022","0.003","82.3","0.03","88.41","0.03","69.13","0.03","1800.2","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C3.33 H6.67 Cu1.56 I1.56 N1.11 -","- C3.33333 H5.33333 Cu1.55333 I1.55556 N1.11111 -","- C30 H48 Cu13.98 I14 N10 -","9","4.5","","Bi, Minghui; Li, Guanghua; Hua, Jia; Liu, Yunling; Liu, Xiaomin; Hu, Yawei; Shi, Zhan; Feng, Shouhua","Two Isomers with FSC Topology Constructed from Cu6I6(DABCO)4and Cu8I8(DABCO)6Building Blocks","Crystal Growth & Design","2007","7","10","2066","","10.1021/cg0700824","","","0.71073","MoKα","","0.0483","0.0359","","","0.0767","0.0826","","","","","","1.082","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504237","11.242","0.003","16.963","0.004","13.898","0.004","90","","90","","90","","2650.3","1.2","123","2","123","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C18 H28 Cu3 N4 O17 -","- C18 H28 Cu3 N4 O17 -","- C72 H112 Cu12 N16 O68 -","4","0.5","","Chen, Wen-Xian; Wu, Shu-Ting; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","Construction of a Three-fold Parallel Interpenetration Network and Bilayer Structure Based on Copper(II) and Trimesic Acid","Crystal Growth & Design","2007","7","6","1171","","10.1021/cg070119k","","","0.71073","MoKα","","0.085","0.0789","","","0.1854","0.1899","","","","","","1.134","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504238","18.887","0.004","10.761","0.002","14.488","0.003","90","","126.1","0.003","90","","2379.2","0.8","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H24 Cu4 N4 O16 -","- C18 H24 Cu4 N4 O16 -","- C72 H96 Cu16 N16 O64 -","4","0.5","","Chen, Wen-Xian; Wu, Shu-Ting; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun","Construction of a Three-fold Parallel Interpenetration Network and Bilayer Structure Based on Copper(II) and Trimesic Acid","Crystal Growth & Design","2007","7","6","1171","","10.1021/cg070119k","","","0.71073","MoKα","","0.0268","0.0257","","","0.0692","0.0699","","","","","","1.076","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504239","24.347","0.003","10.9654","0.0015","19.683","0.002","90","","109.054","0.004","90","","4967","1.1","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H28 N4 O2 -","- C30 H28 N4 O2 -","- C240 H224 N32 O16 -","8","1","","Rafilovich, Michal; Bernstein, Joel; Hickey, Magali B.; Tauber, Michael","Benzidine: A Co-Crystallization Agent for Proton Acceptors","Crystal Growth & Design","2007","7","9","1777","","10.1021/cg0701325","","","0.71073","MoKα","","0.0761","0.045","","","0.1109","0.1302","","","","","","1.03","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504240","36.415","0.006","9.5649","0.0015","24.719","0.004","90","","131.294","0.004","90","","6468.8","1.8","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H35 N2 O3.5 S2 -","- C36 H35 N2 O3.5 S2 -","- C288 H280 N16 O28 S16 -","8","1","","Rafilovich, Michal; Bernstein, Joel; Hickey, Magali B.; Tauber, Michael","Benzidine: A Co-Crystallization Agent for Proton Acceptors","Crystal Growth & Design","2007","7","9","1777","","10.1021/cg0701325","","","0.71073","MoKα","","0.1638","0.049","","","0.1063","0.1468","","","","","","0.937","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504241","11.074","0.002","18.891","0.003","12.097","0.002","90","","103.069","0.005","90","","2465.1","0.7","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H27 N2 O P -","- C30 H27 N2 O P -","- C120 H108 N8 O4 P4 -","4","1","","Rafilovich, Michal; Bernstein, Joel; Hickey, Magali B.; Tauber, Michael","Benzidine: A Co-Crystallization Agent for Proton Acceptors","Crystal Growth & Design","2007","7","9","1777","","10.1021/cg0701325","","","0.71073","MoKα","","0.0796","0.049","","","0.1295","0.1515","","","","","","0.974","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504242","28.129","0.006","25.034","0.005","15.343","0.003","90","","90","","90","","10804","4","150","2","150","2","","","","","","","","5","C m c a","-C 2ac 2","64","Copper(II) terephthalate","","","- C23 H27 Cu2 N2 O11.5 -","- C23.816 H20.5 Cu2 N2 O11.908 -","- C381.056 H328 Cu32 N32 O190.528 -","16","","","Xue, Dong-Xu; Lin, Yan-Yong; Cheng, Xiao-Ning; Chen, Xiao-Ming","A Tetracarboxylate−Bridged Dicopper(II) Paddle-Wheel-Based 2-D Porous Coordination Polymer with Gas Sorption Properties","Crystal Growth & Design","2007","7","7","1332","","10.1021/cg070144q","","","0.71073","MoKα","","0.1088","0.0706","","","0.1571","0.1817","","","","","","1.036","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504243","27.948","0.005","25.11","0.005","15.232","0.003","90","","90","","90","","10689","4","293","2","293","2","","","","","","","","5","C m c a","-C 2ac 2","64","Copper(II) terephthalate","","","- C19 H16 Cu2 N O10 -","- C19 H17 Cu2 N O10 -","- C304 H272 Cu32 N16 O160 -","16","","","Xue, Dong-Xu; Lin, Yan-Yong; Cheng, Xiao-Ning; Chen, Xiao-Ming","A Tetracarboxylate−Bridged Dicopper(II) Paddle-Wheel-Based 2-D Porous Coordination Polymer with Gas Sorption Properties","Crystal Growth & Design","2007","7","7","1332","","10.1021/cg070144q","","","0.71073","MoKα","","0.1536","0.0931","","","0.1965","0.2243","","","","","","1.052","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504244","9.3753","0.0011","19.717","0.003","9.866","0.0013","90","","90","","90","","1823.8","0.4","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C19 H20 N2 O6 -","- C19 H20 N2 O6 -","- C76 H80 N8 O24 -","4","1","","López, Concepción; Claramunt, Rosa M.; García, María Ángeles; Pinilla, Elena; Torres, M. Rosario; Alkorta, Ibon; Elguero, José","Cocrystals of 3,5-Dimethyl-1H-pyrazole and Salicylic Acid: Controlled Formation of Trimers via O−H···N Hydrogen Bonds†","Crystal Growth & Design","2007","7","6","1176","","10.1021/cg0701527","","","0.71073","MoKα","","0.1572","0.0402","","","0.0679","0.0893","","","","","","0.795","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4504245","7.751","0.008","10.954","0.011","20.77","0.02","90","","92.3","0.02","90","","1762","3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 N4 O3 -","- C17 H22 N4 O3 -","- C68 H88 N16 O12 -","4","1","","López, Concepción; Claramunt, Rosa M.; García, María Ángeles; Pinilla, Elena; Torres, M. Rosario; Alkorta, Ibon; Elguero, José","Cocrystals of 3,5-Dimethyl-1H-pyrazole and Salicylic Acid: Controlled Formation of Trimers via O−H···N Hydrogen Bonds†","Crystal Growth & Design","2007","7","6","1176","","10.1021/cg0701527","","","0.71073","MoKα","","0.1451","0.0566","","","0.1436","0.1819","","","","","","0.883","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504246","8.1241","0.0008","12.9932","0.0012","11.6524","0.0011","90","","94.967","0.002","90","","1225.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H10 F N3 O3 -","- C13 H10 F N3 O3 -","- C52 H40 F4 N12 O12 -","4","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.0922","0.0521","","","0.1496","0.1731","","","","","","1.096","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504247","7.919","0.004","13.692","0.006","11.777","0.006","90","","94.517","0.01","90","","1273","1.1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 N4 O3 -","- C14 H10 N4 O3 -","- C56 H40 N16 O12 -","4","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.097","0.0501","","","0.1361","0.1527","","","","","","0.971","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504248","8.4419","0.0017","12.987","0.003","12.399","0.003","90","","96.59","0.03","90","","1350.4","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H10 I N3 O3 -","- C13 H10 I N3 O3 -","- C52 H40 I4 N12 O12 -","4","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.0963","0.0647","","","0.159","0.1775","","","","","","0.912","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504249","8.4078","0.0009","12.7289","0.0013","12.3376","0.0013","90","","97.552","0.002","90","","1308.9","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","N-(3-bromophenyl)-N'-(4-nitrophenyl)urea","N-(3-bromophenyl)-N'-(4-nitrophenyl)urea","","- C13 H10 Br N3 O3 -","- C13 H10 Br N3 O3 -","- C52 H40 Br4 N12 O12 -","4","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.1042","0.0481","","","0.095","0.1137","","","","","","0.967","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504250","6.8807","0.0005","12.7415","0.001","15.2876","0.0011","84.972","0.001","81.159","0.001","80.654","0.001","1304.06","0.17","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H13 N3 O3 -","- C14 H13 N3 O3 -","- C56 H52 N12 O12 -","4","2","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.0544","0.0433","","","0.1163","0.1245","","","","","","1.037","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504251","9.4442","0.0019","7.3883","0.0015","23.863","0.005","90","","97.73","0.03","90","","1649.9","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N4 O4 -","- C16 H18 N4 O4 -","- C64 H72 N16 O16 -","4","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.1977","0.0783","","","0.1839","0.2408","","","","","","1.093","","","","has coordinates","288183","2023-12-08","14:42:59",""
"4504252","7.9488","0.0007","10.4797","0.0009","11.9563","0.001","114.671","0.001","95.441","0.002","101.2","0.001","870.37","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","DMF solvate of N-(4-cyanophenyl)-N'-(4-nitrophenyl)urea","","- C17 H17 N5 O4 -","- C17 H17 N5 O4 -","- C34 H34 N10 O8 -","2","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.1107","0.0619","","","0.1542","0.181","","","","","","1.017","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504253","7.4728","0.001","10.2624","0.0014","12.541","0.0017","105.841","0.002","104.695","0.003","95.11","0.003","881.9","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","N-(4-carboxamidophenyl)-N'-(nitrophenyl)urea.DMF","N-(4-carboxamidophenyl)-N'-(nitrophenyl)urea.DMF","","- C17 H19 N5 O5 -","- C17 H19 N5 O5 -","- C34 H38 N10 O10 -","2","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.0974","0.0632","","","0.1543","0.174","","","","","","1.027","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504254","10.184","0.002","13.346","0.003","15.502","0.003","66.82","0.03","88.22","0.03","68.75","0.03","1789.8","0.9","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","DMSO solvate of N-(4-iodophenyl)-N'-(4'-nitrophenyl)-urea","","- C15 H16 I N3 O4 S -","- C15 H16 I N3 O4 S -","- C60 H64 I4 N12 O16 S4 -","4","2","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.1665","0.0768","","","0.1835","0.2286","","","","","","1.013","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504255","8.4835","0.0013","9.569","0.0014","11.8457","0.0018","105.069","0.003","103.506","0.003","98.203","0.003","881.4","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","DMSO solvate of N-(4-nitropheny)-N'-(4-carboxamidophenyl)-urea","DMSO solvate of N-(4-nitropheny)-N'-(4-carboxamidophenyl)-urea","","- C16 H18 N4 O5 S -","- C16 H18 N4 O5 S -","- C32 H36 N8 O10 S2 -","2","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.1315","0.0626","","","0.1123","0.1368","","","","","","0.974","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504256","16.0665","0.001","5.7448","0.0004","39.1","0.003","90","","100.115","0.002","90","","3552.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H19 N3 O4 S -","- C16 H19 N3 O4 S -","- C128 H152 N24 O32 S8 -","8","2","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.1569","0.0649","","","0.1891","0.2356","","","","","","0.867","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504257","6.0509","0.0006","12.4575","0.0012","12.5937","0.0011","78.12","0.002","82.891","0.002","80.105","0.002","911.3","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H19 N3 O5 S -","- C17 H19 N3 O5 S -","- C34 H38 N6 O10 S2 -","2","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.098","0.0531","","","0.1352","0.1559","","","","","","0.889","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504258","9.1958","0.001","9.5491","0.001","10.5716","0.0011","69.999","0.001","79.348","0.001","69.591","0.001","815.29","0.15","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H15 F2 N3 O4 S -","- C15 H15 F2 N3 O4 S -","- C30 H30 F4 N6 O8 S2 -","2","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.0393","0.0365","","","0.096","0.0979","","","","","","1.048","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504259","6.7307","0.001","10.2019","0.0015","10.284","0.0015","77.995","0.003","84.11","0.003","75.686","0.003","668.3","0.17","298","2","298","2","","","","","","","","4","P -1","-P 1","2","hydrate of N-(4-nitropheny)-N'-(3-hydroxyphenyl)-urea","hydrate of N-(4-nitropheny)-N'-(3-hydroxyphenyl)-urea","","- C13 H13 N3 O5 -","- C13 H13 N3 O5 -","- C26 H26 N6 O10 -","2","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.0842","0.0502","","","0.1125","0.128","","","","","","1.003","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504260","6.071","0.0012","7.5613","0.0015","31.715","0.006","89.95","0.03","87.01","0.03","85.23","0.03","1448.8","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H16 N4 O3 -","- C15 H16 N4 O3 -","- C60 H64 N16 O12 -","4","2","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.18","0.0749","","","0.1893","0.2719","","","","","","1.025","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504261","14.3837","0.0015","9.3167","0.001","13.3889","0.0014","90","","104.847","0.002","90","","1734.3","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(4'-iodobiphenyl)-4'-(nitrophenyl)-urea","","- C19 H14 I N3 O3 -","- C19 H14 I N3 O3 -","- C76 H56 I4 N12 O12 -","4","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.1094","0.0518","","","0.0942","0.1143","","","","","","0.964","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504262","9.851","0.003","56.994","0.018","9.211","0.003","90","","90","","90","","5171","3","298","2","566","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C14 H13 N3 O3 -","- C14 H13 N3 O3 -","- C224 H208 N48 O48 -","16","1","","Reddy, L. Sreenivas; Chandran, Sreekanth K.; George, Sumod; Babu, N. Jagadeesh; Nangia, Ashwini","Crystal Structures ofN-Aryl-N'-4-Nitrophenyl Ureas: Molecular Conformation and Weak Interactions Direct the Strong Hydrogen Bond Synthon","Crystal Growth & Design","2007","7","12","2675","2690","10.1021/cg070155j","","","0.71073","MoKα","","0.0413","0.0404","","","0.1088","0.1096","","","","","","1.117","","","","has coordinates","211134","2020-10-21","18:00:00",""
"4504263","8.307","0.002","8.894","0.002","9.179","0.002","110.23","0.004","103.873","0.005","97.109","0.005","601.7","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H20 N4 O10 -","- C28 H20 N4 O10 -","- C28 H20 N4 O10 -","1","0.5","","Cheney, Miranda L.; McManus, Gregory J.; Perman, Jason A.; Wang, Zhenqiang; Zaworotko, Michael J.","The Role of Cocrystals in Solid-State Synthesis: Cocrystal-Controlled Solid-State Synthesis of Imides","Crystal Growth & Design","2007","7","4","616","","10.1021/cg0701729","","","0.71073","MoKα","","0.1396","0.0788","","","0.2227","0.3243","","","","","","1.042","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504264","11.405","0.002","12.457","0.002","15.885","0.003","90.911","0.003","100.914","0.003","115.482","0.002","1988.3","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H20.66667 N4.66667 O8.66667 -","- C30 H20.6667 N4.66667 O8.66667 -","- C90 H62 N14 O26 -","3","1.5","","Cheney, Miranda L.; McManus, Gregory J.; Perman, Jason A.; Wang, Zhenqiang; Zaworotko, Michael J.","The Role of Cocrystals in Solid-State Synthesis: Cocrystal-Controlled Solid-State Synthesis of Imides","Crystal Growth & Design","2007","7","4","616","","10.1021/cg0701729","","","0.71073","MoKα","","0.2532","0.106","","","0.2653","0.369","","","","","","0.833","","","","has coordinates","259535","2020-12-04","06:05:01",""
"4504265","7.006","0.002","9.99","0.003","10.19","0.004","83.081","0.007","81.603","0.007","76.866","0.008","684.3","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H26 N2 O12 -","- C32 H26 N2 O12 -","- C32 H26 N2 O12 -","1","0.5","","Cheney, Miranda L.; McManus, Gregory J.; Perman, Jason A.; Wang, Zhenqiang; Zaworotko, Michael J.","The Role of Cocrystals in Solid-State Synthesis: Cocrystal-Controlled Solid-State Synthesis of Imides","Crystal Growth & Design","2007","7","4","616","","10.1021/cg0701729","","","0.71073","MoKα","","0.0959","0.0677","","","0.1546","0.1744","","","","","","1.047","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504266","7.1569","0.0014","8.1962","0.0017","15.448","0.003","98.287","0.004","102.202","0.004","96.564","0.004","866.6","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H24 N5 O8 -","- C42 H24 N5 O8 -","- C42 H24 N5 O8 -","1","0.5","","Cheney, Miranda L.; McManus, Gregory J.; Perman, Jason A.; Wang, Zhenqiang; Zaworotko, Michael J.","The Role of Cocrystals in Solid-State Synthesis: Cocrystal-Controlled Solid-State Synthesis of Imides","Crystal Growth & Design","2007","7","4","616","","10.1021/cg0701729","","","0.71073","MoKα","","0.1282","0.0869","","","0.2019","0.2323","","","","","","1.018","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504267","11.309","0.003","12.204","0.004","16.403","0.005","89.651","0.006","77.343","0.005","64.623","0.006","1985.8","1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C29.33333 H20 N4 O8.66667 S0.66667 -","- C29.3333 H20 N4 O8.66667 S0.666667 -","- C88 H60 N12 O26 S2 -","3","1.5","","Cheney, Miranda L.; McManus, Gregory J.; Perman, Jason A.; Wang, Zhenqiang; Zaworotko, Michael J.","The Role of Cocrystals in Solid-State Synthesis: Cocrystal-Controlled Solid-State Synthesis of Imides","Crystal Growth & Design","2007","7","4","616","","10.1021/cg0701729","","","0.71073","MoKα","","0.2714","0.0915","","","0.2108","0.2723","","","","","","0.741","","","","has coordinates","259535","2020-12-04","06:05:01",""
"4504268","7.5532","0.0006","7.642","0.0006","8.4674","0.0007","71.386","0.001","73.065","0.001","74.956","0.001","435.56","0.06","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H5 Cd N2 O2 -","- C8 H5 Cd N2 O5 -","- C16 H10 Cd2 N4 O10 -","2","1","","Wang, Chih-Chieh; Kuo, Chen-Tsung; Yang, Jing-Chun; Lee, Gene-Hsiang; Shih, Wei-Ju; Sheu, Hwo-Shuenn","Assemblies of Two New Metal−Organic Frameworks Constructed from Cd(II) with 2,2‘-Bipyrimidine and Cyclic Oxocarbon Dianions CnOn2-(n= 4, 5)","Crystal Growth & Design","2007","7","8","1476","","10.1021/cg070189r","","","0.71073","MoKα","","0.0195","0.0188","","","0.0468","0.0473","","","","","","1.01","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504269","11.3146","0.0006","7.6357","0.0004","11.8779","0.0006","90","","107.616","0.001","90","","978.07","0.09","295","2","295","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C9 H5 Cd N2 O6 -","- C9 H5 Cd N2 O6 -","- C36 H20 Cd4 N8 O24 -","4","0.5","","Wang, Chih-Chieh; Kuo, Chen-Tsung; Yang, Jing-Chun; Lee, Gene-Hsiang; Shih, Wei-Ju; Sheu, Hwo-Shuenn","Assemblies of Two New Metal−Organic Frameworks Constructed from Cd(II) with 2,2‘-Bipyrimidine and Cyclic Oxocarbon Dianions CnOn2-(n= 4, 5)","Crystal Growth & Design","2007","7","8","1476","","10.1021/cg070189r","","","0.71073","MoKα","","0.0257","0.0231","","","0.0544","0.0557","","","","","","1.026","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504270","10.494","0.0011","10.726","0.0012","13.95","0.0015","82.294","0.002","69.289","0.002","72.665","0.003","1401.3","0.3","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C54 H58 Br2 N18 O3 Zn2 -","- C54 H58 Br2 N18 O3 Zn2 -","- C54 H58 Br2 N18 O3 Zn2 -","1","1","","Ye, Qiong; Song, Yu-Mei; Fu, Da-Wei; Wang, Guo-Xi; Xiong, Ren-Gen; Chan, Philip Wai Hong; Huang, Songping D.","Deuteration Effect of Ferroelectricity and Permittivity on Homochiral Zinc Coordination Compound","Crystal Growth & Design","2007","7","9","1568","","10.1021/cg070190q","","","0.71073","MoKα","","0.0766","0.0648","","","0.1395","0.1424","","","","","","1.071","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504271","10.5121","0.0009","10.7994","0.0009","13.9968","0.0012","82.225","0.002","69.143","0.001","72.457","0.001","1415.1","0.2","293","2","293","2","","","","","","","","7","P 1","P 1","1","","","","- C54 H56 Br2 D2 N18 O3 Zn2 -","- C54 H56 Br2 D2 N18 O3 Zn2 -","- C54 H56 Br2 D2 N18 O3 Zn2 -","1","1","","Ye, Qiong; Song, Yu-Mei; Fu, Da-Wei; Wang, Guo-Xi; Xiong, Ren-Gen; Chan, Philip Wai Hong; Huang, Songping D.","Deuteration Effect of Ferroelectricity and Permittivity on Homochiral Zinc Coordination Compound","Crystal Growth & Design","2007","7","9","1568","1570","10.1021/cg070190q","","","0.71073","MoKα","","0.0748","0.0568","","","0.1142","0.1176","","","","","","1.051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504272","15.4071","0.0012","20.45","0.002","9.9044","0.001","90","","90","","90","","3120.6","0.5","293","2","293","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C40 H22 Mn N8 O4 -","- C40 H22 Mn N8 O4 -","- C160 H88 Mn4 N32 O16 -","4","","","Wei, Yongqin; Yu, Yunfang; Wu, Kechen","Highly Stable Diamondoid Network Coordination Polymer [Mn(NCP)2]nwith Notable NLO, Magnetic, and Luminescence Properties","Crystal Growth & Design","2007","7","11","2262","","10.1021/cg070192a","","","0.71073","MoKα","","0.0598","0.0467","","","0.1106","0.1189","","","","","","0.975","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504273","30.154","0.005","5.396","0.001","22.978","0.004","90","","106.76","0.01","90","","3580","1.1","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","4,4'-bipyridyl-Bis[Di-(4-nitrophenyl)phosphato] Zinc(II) complex","","- C34 H24 N6 O16 P2 Zn -","- C34 H16 N6 O16 P2 Zn -","- C136 H64 N24 O64 P8 Zn4 -","4","0.5","","Marivel, Samipillai; Shimpi, Manishkumar R.; Pedireddi, Venkateswara Rao","Novel Supramolecular Assemblies of Coordination Polymers of Zn(II) and Bis(4-nitrophenyl)phosphoric Acid with Some Aza-Donor Compounds","Crystal Growth & Design","2007","7","9","1791","","10.1021/cg070194v","","","0.71073","MoKα","","0.0507","0.0368","","","0.0943","0.1083","","","","","","0.957","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504274","25.78","0.004","13.529","0.002","10.874","0.002","90","","90","","90","","3792.6","1.1","298","2","298","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","1,2-Bis(4-pyridyl)ethane - bis-di(4-nitrophenyl) phosphonato zinc complex","","- C36 H28 N6 O16 P2 Zn -","- C36 H24 N6 O16 P2 Zn -","- C144 H96 N24 O64 P8 Zn4 -","4","0.5","","Marivel, Samipillai; Shimpi, Manishkumar R.; Pedireddi, Venkateswara Rao","Novel Supramolecular Assemblies of Coordination Polymers of Zn(II) and Bis(4-nitrophenyl)phosphoric Acid with Some Aza-Donor Compounds","Crystal Growth & Design","2007","7","9","1791","","10.1021/cg070194v","","","0.71073","MoKα","","0.0537","0.0421","","","0.1245","0.1346","","","","","","1.08","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504275","25.742","0.006","13.556","0.003","10.828","0.002","90","","90","","90","","3778.5","1.4","298","2","298","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","1,2-Bis(4-pyridyl)ethene - bis-di(4-nitrophenyl) phosphato zinc complex","","- C36 H26 N6 O16 P2 Zn -","- C36 H24 N6 O16 P2 Zn -","- C144 H96 N24 O64 P8 Zn4 -","4","0.5","","Marivel, Samipillai; Shimpi, Manishkumar R.; Pedireddi, Venkateswara Rao","Novel Supramolecular Assemblies of Coordination Polymers of Zn(II) and Bis(4-nitrophenyl)phosphoric Acid with Some Aza-Donor Compounds","Crystal Growth & Design","2007","7","9","1791","","10.1021/cg070194v","","","0.71073","MoKα","","0.0491","0.0379","","","0.1165","0.1282","","","","","","0.82","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504276","10.727","0.003","16.014","0.004","23.426","0.006","98.86","0.01","92.6","0.01","94.44","0.01","3957.5","1.8","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","4,4'-Trimethylenedipyridine-Bis[Di-(4-nitrophenyl)phosphato] Zinc(II) complex","","- C74 H60 N12 O32 P4 Zn2 -","- C74 H60 N12 O32 P4 Zn2 -","- C148 H120 N24 O64 P8 Zn4 -","2","1","","Marivel, Samipillai; Shimpi, Manishkumar R.; Pedireddi, Venkateswara Rao","Novel Supramolecular Assemblies of Coordination Polymers of Zn(II) and Bis(4-nitrophenyl)phosphoric Acid with Some Aza-Donor Compounds","Crystal Growth & Design","2007","7","9","1791","","10.1021/cg070194v","","","0.71073","MoKα","","0.0947","0.0472","","","0.0973","0.1339","","","","","","0.916","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504277","9.2466","0.0016","10.2483","0.0018","10.6261","0.0019","108.031","0.003","94.958","0.003","106.695","0.002","900","0.3","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H36 N4 O18 S2 Zn2 -","- C28 H36 N4 O18 S2 Zn2 -","- C28 H36 N4 O18 S2 Zn2 -","1","0.5","","Wu, La-Mei; Teng, Han-Bing; Feng, Xi-Chun; Ke, Xian-Bing; Zhu, Qi-Feng; Su, Jiang-Tao; Xu, Wen-Jin; Hu, Xian-Ming","Supramolecular Networks in Crystals of Metal(II) Complexes with Water-Soluble Salicylaldehyde-2-sulfobenzoylhydrazone Anion Ligand","Crystal Growth & Design","2007","7","7","1337","","10.1021/cg070196f","","","0.71073","MoKα","","0.0243","0.0226","","","0.0611","0.062","","","","","","1.045","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504278","9.2399","0.0007","10.2621","0.0007","10.5794","0.0008","108.032","0.001","95.29","0.001","105.993","0.001","899.51","0.11","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H36 Co2 N4 O18 S2 -","- C28 H36 Co2 N4 O18 S2 -","- C28 H36 Co2 N4 O18 S2 -","1","0.5","","Wu, La-Mei; Teng, Han-Bing; Feng, Xi-Chun; Ke, Xian-Bing; Zhu, Qi-Feng; Su, Jiang-Tao; Xu, Wen-Jin; Hu, Xian-Ming","Supramolecular Networks in Crystals of Metal(II) Complexes with Water-Soluble Salicylaldehyde-2-sulfobenzoylhydrazone Anion Ligand","Crystal Growth & Design","2007","7","7","1337","","10.1021/cg070196f","","","0.71073","MoKα","","0.0255","0.024","","","0.0636","0.0646","","","","","","1.032","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504279","9.1452","0.0011","10.379","0.0012","10.7212","0.0012","107.715","0.002","95.322","0.002","103.939","0.002","925.54","0.19","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H36 Mn2 N4 O18 S2 -","- C28 H36 Mn2 N4 O18 S2 -","- C28 H36 Mn2 N4 O18 S2 -","1","0.5","","Wu, La-Mei; Teng, Han-Bing; Feng, Xi-Chun; Ke, Xian-Bing; Zhu, Qi-Feng; Su, Jiang-Tao; Xu, Wen-Jin; Hu, Xian-Ming","Supramolecular Networks in Crystals of Metal(II) Complexes with Water-Soluble Salicylaldehyde-2-sulfobenzoylhydrazone Anion Ligand","Crystal Growth & Design","2007","7","7","1337","","10.1021/cg070196f","","","0.71073","MoKα","","0.073","0.0448","","","0.1002","0.1371","","","","","","0.959","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504280","7.4869","0.0007","9.9503","0.0009","12.2777","0.0011","70.241","0.001","76.782","0.001","79.467","0.001","832.42","0.13","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H32 N4 Ni2 O16 S2 -","- C28 H32 N4 Ni2 O16 S2 -","- C28 H32 N4 Ni2 O16 S2 -","1","0.5","","Wu, La-Mei; Teng, Han-Bing; Feng, Xi-Chun; Ke, Xian-Bing; Zhu, Qi-Feng; Su, Jiang-Tao; Xu, Wen-Jin; Hu, Xian-Ming","Supramolecular Networks in Crystals of Metal(II) Complexes with Water-Soluble Salicylaldehyde-2-sulfobenzoylhydrazone Anion Ligand","Crystal Growth & Design","2007","7","7","1337","","10.1021/cg070196f","","","0.71073","MoKα","","0.0271","0.0239","","","0.059","0.061","","","","","","1.067","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504281","7.6787","0.0009","11.1756","0.0013","12.6173","0.0015","77.358","0.002","76.905","0.002","84.316","0.003","1027.6","0.2","292","2","292","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H48 Cu2 N4 O24 S2 -","- C28 H48 Cu2 N4 O24 S2 -","- C28 H48 Cu2 N4 O24 S2 -","1","0.5","","Wu, La-Mei; Teng, Han-Bing; Feng, Xi-Chun; Ke, Xian-Bing; Zhu, Qi-Feng; Su, Jiang-Tao; Xu, Wen-Jin; Hu, Xian-Ming","Supramolecular Networks in Crystals of Metal(II) Complexes with Water-Soluble Salicylaldehyde-2-sulfobenzoylhydrazone Anion Ligand","Crystal Growth & Design","2007","7","7","1337","","10.1021/cg070196f","","","0.71073","MoKα","","0.0386","0.0352","","","0.1041","0.1112","","","","","","1.091","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504282","9.1032","0.0011","10.8342","0.0013","17.829","0.003","103.492","0.002","99.696","0.002","104.718","0.001","1604.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H19 N17 O1.5 S3 Zn1.5 -","- C22 H15 N17 O1.5 S3 Zn1.5 -","- C44 H30 N34 O3 S6 Zn3 -","2","1","","Liu, Yuan-Yuan; Huang, Yong-Quan; Shi, Wei; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping","Syntheses, Structures, and Characterization of a Series of Novel Zinc(II) and Cadmium(II) Compounds Based on 2,6-Di-(1,2,4-triazole-4-yl)pyridine","Crystal Growth & Design","2007","7","8","1483","","10.1021/cg070208x","","","0.71073","MoKα","","0.0433","0.0376","","","0.1277","0.1325","","","","","","1.082","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504283","7.954","0.003","8.984","0.004","9.863","0.004","71.192","0.004","86.803","0.004","64.858","0.004","601.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H14 Cd N16 S2 -","- C20 H14 Cd N16 S2 -","- C20 H14 Cd N16 S2 -","1","0.5","","Liu, Yuan-Yuan; Huang, Yong-Quan; Shi, Wei; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping","Syntheses, Structures, and Characterization of a Series of Novel Zinc(II) and Cadmium(II) Compounds Based on 2,6-Di-(1,2,4-triazole-4-yl)pyridine","Crystal Growth & Design","2007","7","8","1483","","10.1021/cg070208x","","","0.71073","MoKα","","0.0243","0.0225","","","0.0578","0.0587","","","","","","1.051","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504284","7.0837","0.0014","9.878","0.002","12.549","0.003","94.59","0.03","103.44","0.03","102.43","0.03","826.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H13 Cd N7 O7 -","- C11 H9 Cd N7 O7 -","- C22 H18 Cd2 N14 O14 -","2","1","","Liu, Yuan-Yuan; Huang, Yong-Quan; Shi, Wei; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping","Syntheses, Structures, and Characterization of a Series of Novel Zinc(II) and Cadmium(II) Compounds Based on 2,6-Di-(1,2,4-triazole-4-yl)pyridine","Crystal Growth & Design","2007","7","8","1483","","10.1021/cg070208x","","","0.71073","MoKα","","0.0445","0.0373","","","0.0938","0.0956","","","","","","1.047","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504285","8.3824","0.0003","8.3824","0.0003","8.3824","0.0003","96.86","","96.86","","96.86","","575.22","0.04","153","2","153","2","","","","","","","","3","R 3 c :R","P 3* -2n","161","","","","- B2 Ba O4 -","- B2 Ba O4 -","- B12 Ba6 O24 -","6","1","","Pan, Shilie; Smit, Jared P.; Lanier, Courtney H.; Marvel, Michael R.; Marks, Laurence D.; Poeppelmeier, Kenneth R.","Optical Floating Zone Growth of β-BaB2O4from a LiBa2B5O10-Based Solvent","Crystal Growth & Design","2007","7","8","1561","","10.1021/cg0702232","","","0.71073","MoKα","","0.0214","0.0209","","","0.0517","0.0518","","","","","","1.025","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504286","6.091","0.0006","11.4576","0.0012","10.686","0.0011","90","","105.626","0.002","90","","718.19","0.13","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 N12 O2 Zn -","- C10 H10 N12 O2 Zn -","- C20 H20 N24 O4 Zn2 -","2","0.5","","Li, Zhen; Li, Mian; Zhou, Xiao-Ping; Wu, Tao; Li, Dan; Ng, Seik Weng","Metal-Directed Supramolecular Architectures: From Mononuclear to 3D Frameworks Based on In Situ Tetrazole Ligand Synthesis","Crystal Growth & Design","2007","7","10","1992","","10.1021/cg0702333","","","0.71073","MoKα","","0.0364","0.0311","","","0.0774","0.0802","","","","","","1.051","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504287","13.0083","0.001","7.316","0.0006","16.8582","0.0013","90","","101.922","0.001","90","","1569.8","0.2","295","2","295","2","","","","","","","","5","C 1 2/n 1","-C 2yac","15","","","","- C10 H12 Cu N12 O3 -","- C10 H12 Cu N12 O3 -","- C40 H48 Cu4 N48 O12 -","4","0.5","","Li, Zhen; Li, Mian; Zhou, Xiao-Ping; Wu, Tao; Li, Dan; Ng, Seik Weng","Metal-Directed Supramolecular Architectures: From Mononuclear to 3D Frameworks Based on In Situ Tetrazole Ligand Synthesis","Crystal Growth & Design","2007","7","10","1992","","10.1021/cg0702333","","","0.71073","MoKα","","0.045","0.0414","","","0.1113","0.1135","","","","","","1.129","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504288","8.7615","0.0006","18.5982","0.0013","9.0395","0.0006","90","","105.503","0.001","90","","1419.38","0.17","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H6 Cd N12 -","- C10 H6 Cd N12 -","- C40 H24 Cd4 N48 -","4","2","","Li, Zhen; Li, Mian; Zhou, Xiao-Ping; Wu, Tao; Li, Dan; Ng, Seik Weng","Metal-Directed Supramolecular Architectures: From Mononuclear to 3D Frameworks Based on In Situ Tetrazole Ligand Synthesis","Crystal Growth & Design","2007","7","10","1992","","10.1021/cg0702333","","","0.71073","MoKα","","0.0301","0.0291","","","0.0769","0.0775","","","","","","1.058","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504289","3.5465","0.0006","12.373","0.002","14.679","0.003","90","","92.638","0.003","90","","643.4","0.2","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H3 Ag N6 -","- C5 H3 Ag N6 -","- C20 H12 Ag4 N24 -","4","1","","Li, Zhen; Li, Mian; Zhou, Xiao-Ping; Wu, Tao; Li, Dan; Ng, Seik Weng","Metal-Directed Supramolecular Architectures: From Mononuclear to 3D Frameworks Based on In Situ Tetrazole Ligand Synthesis","Crystal Growth & Design","2007","7","10","1992","","10.1021/cg0702333","","","0.71073","MoKα","","0.0338","0.0292","","","0.0634","0.0652","","","","","","1.083","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504290","20.1345","0.0005","10.5451","0.0003","13.3534","0.0003","90","","131.39","","90","","2127.04","0.09","293","2","293","2","","","","","","","","6","C 1 2/n 1","-C 2yac","15","","","","- C5 H4 Cd2 N6 O5 S -","- C5 H4 Cd2 N6 O5 S -","- C40 H32 Cd16 N48 O40 S8 -","8","1","","Li, Zhen; Li, Mian; Zhou, Xiao-Ping; Wu, Tao; Li, Dan; Ng, Seik Weng","Metal-Directed Supramolecular Architectures: From Mononuclear to 3D Frameworks Based on In Situ Tetrazole Ligand Synthesis","Crystal Growth & Design","2007","7","10","1992","","10.1021/cg0702333","","","0.71073","MoKα","","0.0242","0.0233","","","0.0588","0.0597","","","","","","1.082","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504291","13.244","0.0007","5.9984","0.0003","9.0482","0.0002","90","","90","","90","","718.81","0.05","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Carboxylic Acid-4-Nitropyridine-1-Oxide","","- C6 H4 N2 O5 -","- C6 H4 N2 O5 -","- C24 H16 N8 O20 -","4","1","","Wu, Wenshi; Wu, Dongsheng; Cheng, Wendan; Zhang, Hao; Dai, Jincao","Syntheses, Crystal Growths, and Nonlinear Optical Properties for 2-Carboxylic acid-4-nitropyridine-1-oxide Crystals with Two Different Arrangements of Chromophores","Crystal Growth & Design","2007","7","11","2316","","10.1021/cg0702378","","","0.71073","MoKα","","0.0327","0.0301","","","0.0827","0.0864","","","","","","1.02","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504292","5.5509","0.0003","9.8139","0.0007","13.2554","0.0003","90","","90","","90","","722.1","0.07","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2-Carboxylic Acid-4-Nitropyridine-1-Oxide","","- C6 H4 N2 O5 -","- C6 H4 N2 O5 -","- C24 H16 N8 O20 -","4","1","","Wu, Wenshi; Wu, Dongsheng; Cheng, Wendan; Zhang, Hao; Dai, Jincao","Syntheses, Crystal Growths, and Nonlinear Optical Properties for 2-Carboxylic acid-4-nitropyridine-1-oxide Crystals with Two Different Arrangements of Chromophores","Crystal Growth & Design","2007","7","11","2316","","10.1021/cg0702378","","","0.71073","MoKα","","0.0565","0.0482","","","0.1131","0.1216","","","","","","0.948","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504293","10.358","0.005","16.092","0.007","9.243","0.004","90","","92.219","0.008","90","","1539.5","1.2","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 N5 O2 -","- C15 H17 N5 O2 -","- C60 H68 N20 O8 -","4","1","","Wang, Cui-Juan; Ma, Hai-Rui; Wang, Yao-Yu; Liu, Ping; Zhou, Li-Jun; Shi, Qi-Zhen; Peng, Shie-Ming","Subtle Structural Changes in Coordination Chains: Influence of the Flexibility of the Precursor Ligands and of the Solvent","Crystal Growth & Design","2007","7","9","1811","","10.1021/cg070246g","","","0.71073","MoKα","","0.0681","0.0397","","","0.1001","0.11","","","","","","1.058","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504294","8.4716","0.001","8.7904","0.0014","15.2105","0.0018","88.106","0.01","87.745","0.009","82.924","0.009","1122.8","0.3","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H22 Cu N6 O4 -","- C21 H22 Cu N6 O4 -","- C42 H44 Cu2 N12 O8 -","2","1","","Wang, Cui-Juan; Ma, Hai-Rui; Wang, Yao-Yu; Liu, Ping; Zhou, Li-Jun; Shi, Qi-Zhen; Peng, Shie-Ming","Subtle Structural Changes in Coordination Chains: Influence of the Flexibility of the Precursor Ligands and of the Solvent","Crystal Growth & Design","2007","7","9","1811","","10.1021/cg070246g","","","0.71073","MoKα","","0.1253","0.0525","","","0.1031","0.1262","","","","","","0.873","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504295","8.5396","0.0003","16.4589","0.0006","16.1176","0.0005","90","","97.415","0.002","90","","2246.42","0.13","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19.25 H19.5 Cl0.5 Cu N5 O4 -","- C20 H19.5 Cl2 Cu N5 O4 -","- C80 H78 Cl8 Cu4 N20 O16 -","4","1","","Wang, Cui-Juan; Ma, Hai-Rui; Wang, Yao-Yu; Liu, Ping; Zhou, Li-Jun; Shi, Qi-Zhen; Peng, Shie-Ming","Subtle Structural Changes in Coordination Chains: Influence of the Flexibility of the Precursor Ligands and of the Solvent","Crystal Growth & Design","2007","7","9","1811","","10.1021/cg070246g","","","0.71073","MoKα","","0.0862","0.0633","","","0.1965","0.2083","","","","","","1.064","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504296","17.814","0.006","8.72","0.003","18.811","0.006","90","","100.237","0.006","90","","2875.5","1.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H20 Cl3 Cu N5 O4 -","- C21 H21 Cl6 Cu N5 O4 -","- C84 H84 Cl24 Cu4 N20 O16 -","4","0.5","","Wang, Cui-Juan; Ma, Hai-Rui; Wang, Yao-Yu; Liu, Ping; Zhou, Li-Jun; Shi, Qi-Zhen; Peng, Shie-Ming","Subtle Structural Changes in Coordination Chains: Influence of the Flexibility of the Precursor Ligands and of the Solvent","Crystal Growth & Design","2007","7","9","1811","","10.1021/cg070246g","","","0.71073","MoKα","","0.1276","0.0844","","","0.2387","0.2749","","","","","","1.023","","","","has coordinates,has disorder","179577","2020-10-21","18:00:00",""
"4504297","8.4903","0.0019","16.417","0.004","16.134","0.004","90","","97.919","0.003","90","","2227.4","0.9","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19.5 H21 Cu N5 O4.5 -","- C19.5 H21 Cu N5 O4.5 -","- C78 H84 Cu4 N20 O18 -","4","1","","Wang, Cui-Juan; Ma, Hai-Rui; Wang, Yao-Yu; Liu, Ping; Zhou, Li-Jun; Shi, Qi-Zhen; Peng, Shie-Ming","Subtle Structural Changes in Coordination Chains: Influence of the Flexibility of the Precursor Ligands and of the Solvent","Crystal Growth & Design","2007","7","9","1811","","10.1021/cg070246g","","","0.71073","MoKα","","0.077","0.052","","","0.1466","0.1629","","","","","","1.023","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504298","20.212","0.007","8.517","0.003","18.456","0.009","90","","121.319","0.005","90","","2714.2","1.9","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H33 Cu N5 O6 -","- C25 H31 Cu N5 O6 -","- C100 H124 Cu4 N20 O24 -","4","0.5","","Wang, Cui-Juan; Ma, Hai-Rui; Wang, Yao-Yu; Liu, Ping; Zhou, Li-Jun; Shi, Qi-Zhen; Peng, Shie-Ming","Subtle Structural Changes in Coordination Chains: Influence of the Flexibility of the Precursor Ligands and of the Solvent","Crystal Growth & Design","2007","7","9","1811","","10.1021/cg070246g","","","0.71073","MoKα","","0.0784","0.0483","","","0.1299","0.1414","","","","","","0.977","","","","has coordinates,has disorder","179577","2020-10-21","18:00:00",""
"4504299","8.988","0.003","10.602","0.003","13.55","0.004","69.213","0.004","84.875","0.005","67.454","0.004","1113.2","0.6","293","2","293","2","","","","","","","synthesized","6","P -1","-P 1","2","","","","- C22 H25 Cu N3 O3 S -","- C22 H25 Cu N3 O3 S -","- C44 H50 Cu2 N6 O6 S2 -","2","1","","Alam, Md. Akhtarul; Koner, Rik Rani; Das, Amrita; Nethaji, Munirathinum; Ray, Manabendra","Rationalizing the Effects of Amino Acid Side Chain, Pyridine, and Imidazole on the Assembly and Reversible Disassembly of a Octanuclear Cu(II) Complex","Crystal Growth & Design","2007","7","9","1818","","10.1021/cg070250s","","","0.71073","MoKα","","0.1137","0.0733","","","0.1498","0.1603","","","","","","1.466","","","","has coordinates","179577","2020-10-21","18:00:00",""
"4504300","13.337","0.008","8.622","0.005","23.425","0.016","90","","106.032","0.009","90","","2589","3","298","2","298","2","","","","","","","Synthesized","6","P 1 21 1","P 2yb","4","Cu2(L-Salmet)2","","","- C48 H55 Cu4 N4 O12 S4 -","- C48 H55 Cu4 N4 O12 S4 -","- C96 H110 Cu8 N8 O24 S8 -","2","1","","Alam, Md. Akhtarul; Koner, Rik Rani; Das, Amrita; Nethaji, Munirathinum; Ray, Manabendra","Rationalizing the Effects of Amino Acid Side Chain, Pyridine, and Imidazole on the Assembly and Reversible Disassembly of a Octanuclear Cu(II) Complex","Crystal Growth & Design","2007","7","9","1818","","10.1021/cg070250s","","x-ray","0.71073","MoKα","","0.0586","0.055","","","0.1625","0.1664","","","","","","1.174","","","","has coordinates,has disorder","179578","2020-10-21","18:00:00",""
"4504301","6.9706","0.0007","21.827","0.002","11.0363","0.0012","90","","100.638","0.007","90","","1650.3","0.3","298","2","298","2","","","","","","","Synthesis","6","P 1 21 1","P 2yb","4","Cusalmetim","","","- C15 H19 Cu N3 O3 S -","- C15 H19 Cu N3 O3 S -","- C60 H76 Cu4 N12 O12 S4 -","4","2","","Alam, Md. Akhtarul; Koner, Rik Rani; Das, Amrita; Nethaji, Munirathinum; Ray, Manabendra","Rationalizing the Effects of Amino Acid Side Chain, Pyridine, and Imidazole on the Assembly and Reversible Disassembly of a Octanuclear Cu(II) Complex","Crystal Growth & Design","2007","7","9","1818","","10.1021/cg070250s","","","0.71073","MoKα","","0.0806","0.0509","","","0.1064","0.1149","","","","","","1.248","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504302","9.2596","0.0004","9.7379","0.0004","26.6724","0.0014","90","","90","","90","","2405.03","0.19","298","2","298","2","","","","","","","Synthesis","5","P 21 21 21","P 2ac 2ab","19","SaltyrCu","","","- C26 H25 Cu N3 O4 -","- C26 H25 Cu N3 O4 -","- C104 H100 Cu4 N12 O16 -","4","1","","Alam, Md. Akhtarul; Koner, Rik Rani; Das, Amrita; Nethaji, Munirathinum; Ray, Manabendra","Rationalizing the Effects of Amino Acid Side Chain, Pyridine, and Imidazole on the Assembly and Reversible Disassembly of a Octanuclear Cu(II) Complex","Crystal Growth & Design","2007","7","9","1818","","10.1021/cg070250s","","","0.71073","MoKα","","0.0456","0.0314","","","0.0497","0.0513","","","","","","1.184","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504303","19.625","0.012","9.617","0.006","41.56","0.03","90","","92.26","0.011","90","","7838","9","293","2","293","2","","","","","","","Synthesized","5","P 1 21 1","P 2yb","4","Cu(Salhis)imidazole H2O","","","- C128 H136 Cu8 N40 O36 -","- C128 H136 Cu8 N40 O36 -","- C256 H272 Cu16 N80 O72 -","2","1","","Alam, Md. Akhtarul; Koner, Rik Rani; Das, Amrita; Nethaji, Munirathinum; Ray, Manabendra","Rationalizing the Effects of Amino Acid Side Chain, Pyridine, and Imidazole on the Assembly and Reversible Disassembly of a Octanuclear Cu(II) Complex","Crystal Growth & Design","2007","7","9","1818","","10.1021/cg070250s","","x-ray","0.71073","MoKα","","0.208","0.1044","","","0.2324","0.2932","","","","","","0.955","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504304","6.6687","0.0013","8.0335","0.0016","11.706","0.002","80.01","0.03","83.27","0.03","83.93","0.03","611","0.2","293","2","293","2","","","","","","","","2","P -1","-P 1","2","Trans-DPDSB","Trans,trans-2,5-Diphenyl-1,4-distyrylbenzene","","- C34 H26 -","- C34 H26 -","- C34 H26 -","1","0.5","","Xie, Zengqi; Wang, Huan; Li, Feng; Xie, Weijie; Liu, Linlin; Yang, Bing; Ye, Ling; Ma, Yuguang","Crystal Structure of a Highly Luminescent Slice Crystal Grown in the Vapor Phase: A New Polymorph of 2,5-Diphenyl-1,4-distyrylbenzene","Crystal Growth & Design","2007","7","12","2512","","10.1021/cg070270u","","","0.71073","MoKα","","0.0794","0.0463","","","0.124","0.1369","","","","","","1.048","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504305","9.584","0.001","12.5631","0.0014","16.8097","0.0018","76.777","0.002","87.428","0.003","68.209","0.002","1827.7","0.3","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H60 N12 O17 Zn4 -","- C74 H60 N12 O17 Zn4 -","- C74 H60 N12 O17 Zn4 -","1","0.5","","Tian, Zhengfang; Lin, Jianguo; Su, Yang; Wen, Lili; Liu, Yangmei; Zhu, Huizhen; Meng, Qing-Jin","Flexible Ligand, Structural, and Topological Diversity: Isomerism in Zn(NO3)2Coordination Polymers","Crystal Growth & Design","2007","7","9","1863","","10.1021/cg070274z","","","0.71073","MoKα","","0.0975","0.0633","","","0.1223","0.129","","","","","","1.085","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504306","9.601","0.003","9.69","0.003","11.815","0.003","108.367","0.005","103.743","0.005","91.988","0.005","1006.2","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H18 N4 O4 Zn -","- C22 H18 N4 O4 Zn -","- C44 H36 N8 O8 Zn2 -","2","1","","Tian, Zhengfang; Lin, Jianguo; Su, Yang; Wen, Lili; Liu, Yangmei; Zhu, Huizhen; Meng, Qing-Jin","Flexible Ligand, Structural, and Topological Diversity: Isomerism in Zn(NO3)2Coordination Polymers","Crystal Growth & Design","2007","7","9","1863","","10.1021/cg070274z","","","0.71073","MoKα","","0.059","0.0478","","","0.1005","0.1036","","","","","","1.003","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504307","11.6702","0.0006","13.916","0.0007","16.0247","0.0008","69.041","0.001","69.716","0.001","84.264","0.001","2278.7","0.2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C84 H88 Cd4 Cl2 N12 O28 P2 S2 -","- C84 H56 Cd4 Cl2 N12 O28 P2 S2 -","- C84 H56 Cd4 Cl2 N12 O28 P2 S2 -","1","0.5","","Du, Zi-Yi; Li, Xiu-Ling; Liu, Qing-Yan; Mao, Jiang-Gao","Novel Cadmium(II) Phosphonatophenylsulfonate Cluster Compounds: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2007","7","8","1501","","10.1021/cg070280v","","","0.71073","MoKα","","0.0454","0.0383","","","0.0861","0.0915","","","","","","1.038","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504308","17.152","0.004","21.12","0.005","21.207","0.005","84.59","0.009","76.168","0.009","67.475","0.006","6890","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C120 H108 Cd6 N16 O38 P4 S4 -","- C120 H80 Cd6 N16 O38 P4 S4 -","- C240 H160 Cd12 N32 O76 P8 S8 -","2","1","","Du, Zi-Yi; Li, Xiu-Ling; Liu, Qing-Yan; Mao, Jiang-Gao","Novel Cadmium(II) Phosphonatophenylsulfonate Cluster Compounds: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2007","7","8","1501","","10.1021/cg070280v","","","0.71073","MoKα","","0.1297","0.081","","","0.1828","0.2181","","","","","","1.108","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504309","20.4331","0.0001","11.7979","0.0002","23.9485","0.0003","90","","112.723","0.001","90","","5325.11","0.12","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C42 H52 Cd3 N6 O22 P2 S2 -","- C42 H32 Cd3 N6 O22 P2 S2 -","- C168 H128 Cd12 N24 O88 P8 S8 -","4","0.5","","Du, Zi-Yi; Li, Xiu-Ling; Liu, Qing-Yan; Mao, Jiang-Gao","Novel Cadmium(II) Phosphonatophenylsulfonate Cluster Compounds: Syntheses, Structures, and Luminescent Properties","Crystal Growth & Design","2007","7","8","1501","","10.1021/cg070280v","","","0.71073","MoKα","","0.0494","0.0409","","","0.0925","0.0966","","","","","","1.139","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504310","42.521","0.009","14.948","0.003","6.7923","0.0014","90","","97.825","0.004","90","","4277","1.5","100","1","100","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H10 N4 O2 -","- C8 H10 N4 O2 -","- C160 H200 N80 O40 -","20","2.5","","Enright, Gary D.; Terskikh, Victor V.; Brouwer, Darren H.; Ripmeester, John A.","The Structure of Two Anhydrous Polymorphs of Caffeine from Single-Crystal Diffraction and Ultrahigh-Field Solid-State13C NMR Spectroscopy","Crystal Growth & Design","2007","7","8","1406","","10.1021/cg070291o","","","0.71073","MoKα","","0.1355","0.0584","","","0.1234","0.1598","","","","","","1","","","","has coordinates,has disorder","179578","2020-10-21","18:00:00",""
"4504311","14.831","0.003","14.831","0.003","6.7648","0.0019","90","","90","","120","","1288.6","0.5","125","2","125","1","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- C15 H10 N5 O2 -","- C16.32 H20.4 N8.16 O4.08 -","- C48.96 H61.2 N24.48 O12.24 -","3","0.0833333","","Enright, Gary D.; Terskikh, Victor V.; Brouwer, Darren H.; Ripmeester, John A.","The Structure of Two Anhydrous Polymorphs of Caffeine from Single-Crystal Diffraction and Ultrahigh-Field Solid-State13C NMR Spectroscopy","Crystal Growth & Design","2007","7","8","1406","","10.1021/cg070291o","","","0.71073","MoKα","","0.078","0.0569","","","0.1449","0.1795","","","","","","1.194","","","","has coordinates,has disorder","179578","2020-10-21","18:00:00",""
"4504312","9.3888","0.0014","10.1152","0.0014","11.571","0.0017","90","","90","","90","","1098.9","0.3","190","2","190","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C2 H2 Cl N4 Zn -","- C2 H2 Cl N4 Zn -","- C16 H16 Cl8 N32 Zn8 -","8","1","","Park, Hyunsoo; Krigsfeld, Gabriel; Teat, Simon J.; Parise, John B.","Synthesis and Structural Determination of Four Novel Metal−Organic Frameworks in a Zn−3-Amino-1,2,4-Triazole System","Crystal Growth & Design","2007","7","7","1343","","10.1021/cg070295t","","x-ray","0.7749","synchrotron","","0.0316","0.0302","","","0.0855","0.0869","","","","","","1.024","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504313","9.1976","0.0011","10.3412","0.0013","12.5765","0.0015","90","","90","","90","","1196.2","0.3","190","2","190","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C3 H4 N4 O2 Zn -","- C3 H4 N4 O2 Zn -","- C24 H32 N32 O16 Zn8 -","8","1","","Park, Hyunsoo; Krigsfeld, Gabriel; Teat, Simon J.; Parise, John B.","Synthesis and Structural Determination of Four Novel Metal−Organic Frameworks in a Zn−3-Amino-1,2,4-Triazole System","Crystal Growth & Design","2007","7","7","1343","","10.1021/cg070295t","","x-ray","0.7749","synchrotron","","0.0453","0.0349","","","0.1007","0.1102","","","","","","1.026","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504314","15.0448","0.0006","15.0448","0.0006","15.0448","0.0006","90","","90","","90","","3405.3","0.2","190","2","190","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","","","- C12 H30 N26 O13.98 Zn5 -","- C12 H30 N26 O13.98 Zn5 -","- C48 H120 N104 O55.92 Zn20 -","4","0.166667","","Park, Hyunsoo; Krigsfeld, Gabriel; Teat, Simon J.; Parise, John B.","Synthesis and Structural Determination of Four Novel Metal−Organic Frameworks in a Zn−3-Amino-1,2,4-Triazole System","Crystal Growth & Design","2007","7","7","1343","","10.1021/cg070295t","","x-ray","0.7749","synchrotron","","0.0491","0.0398","","","0.1015","0.1072","","","","","","1.079","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504315","19.2576","0.0009","19.2576","0.0009","20.2861","0.0019","90","","90","","90","","7523.2","0.9","190","2","190","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C17 H26.02 N28 O8.87 Zn5 -","- C17 H26.02 N28 O8.87 Zn5 -","- C136 H208.16 N224 O70.96 Zn40 -","8","0.5","","Park, Hyunsoo; Krigsfeld, Gabriel; Teat, Simon J.; Parise, John B.","Synthesis and Structural Determination of Four Novel Metal−Organic Frameworks in a Zn−3-Amino-1,2,4-Triazole System","Crystal Growth & Design","2007","7","7","1343","","10.1021/cg070295t","","x-ray","0.7749","synchrotron","","0.0579","0.0492","","","0.1539","0.1627","","","","","","1.07","","","","has coordinates,has disorder","179578","2020-10-21","18:00:00",""
"4504316","21.1088","0.0012","34.334","0.002","20.1564","0.0012","90","","90","","90","","14608.3","1.5","100","2","100","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C30 H33 Cd N11 O12 -","- C30 H33 Cd N11 O12 -","- C480 H528 Cd16 N176 O192 -","16","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Isomerism in Coordination Complexes and Polymers Derived from Bispyridylurea Ligands: Effect of Solvents, Conformational Flexibility, and Positional Isomerism of the Ligands","Crystal Growth & Design","2007","7","10","2096","","10.1021/cg070301l","","","0.71073","MoKα","","0.0321","0.0294","","","0.079","0.0863","","","","","","1.076","","","","has coordinates,has disorder","179578","2020-10-21","18:00:00",""
"4504317","9.6223","0.001","10.2423","0.0011","12.8397","0.0013","90","","95.364","0.002","90","","1259.9","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H20 Cd N10 O8 -","- C22 H20 Cd N10 O8 -","- C44 H40 Cd2 N20 O16 -","2","0.5","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Isomerism in Coordination Complexes and Polymers Derived from Bispyridylurea Ligands: Effect of Solvents, Conformational Flexibility, and Positional Isomerism of the Ligands","Crystal Growth & Design","2007","7","10","2096","","10.1021/cg070301l","","","0.71073","MoKα","","0.0445","0.0331","","","0.0857","0.1026","","","","","","1.123","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504318","16.212","0.004","18.776","0.005","13.907","0.004","90","","90","","90","","4233","2","100","2","100","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C11 H16 Cd N6 O10 -","- C11 H16 Cd N6 O10 -","- C88 H128 Cd8 N48 O80 -","8","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Isomerism in Coordination Complexes and Polymers Derived from Bispyridylurea Ligands: Effect of Solvents, Conformational Flexibility, and Positional Isomerism of the Ligands","Crystal Growth & Design","2007","7","10","2096","","10.1021/cg070301l","","","0.71073","MoKα","","0.1546","0.0748","","","0.1525","0.1784","","","","","","0.984","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504319","7.435","0.002","13.696","0.004","14.03","0.004","102.141","0.004","92.28","0.005","92.164","0.005","1394.1","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H58 Cd N18 O14 -","- C52 H58 Cd N18 O14 -","- C52 H58 Cd N18 O14 -","1","0.5","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Isomerism in Coordination Complexes and Polymers Derived from Bispyridylurea Ligands: Effect of Solvents, Conformational Flexibility, and Positional Isomerism of the Ligands","Crystal Growth & Design","2007","7","10","2096","","10.1021/cg070301l","","","0.71073","MoKα","","0.0545","0.0489","","","0.1195","0.1226","","","","","","1.008","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504320","24.516","0.003","15.3297","0.0019","14.5307","0.0018","90","","120.428","0.002","90","","4708.8","1","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H44 Cd N18 O12 -","- C44 H44 Cd N18 O12 -","- C176 H176 Cd4 N72 O48 -","4","0.5","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Isomerism in Coordination Complexes and Polymers Derived from Bispyridylurea Ligands: Effect of Solvents, Conformational Flexibility, and Positional Isomerism of the Ligands","Crystal Growth & Design","2007","7","10","2096","","10.1021/cg070301l","","","0.71073","MoKα","","0.0486","0.0351","","","0.0818","0.0877","","","","","","1.017","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504321","6.1823","0.0015","10.254","0.003","10.921","0.003","87.022","0.004","79.039","0.004","77.888","0.004","664.5","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H24 Cd N10 O10 -","- C22 H24 Cd N10 O10 -","- C22 H24 Cd N10 O10 -","1","0.5","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Isomerism in Coordination Complexes and Polymers Derived from Bispyridylurea Ligands: Effect of Solvents, Conformational Flexibility, and Positional Isomerism of the Ligands","Crystal Growth & Design","2007","7","10","2096","","10.1021/cg070301l","","","0.71073","MoKα","","0.0444","0.0393","","","0.1094","0.1344","","","","","","1.153","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504322","7.5913","0.0005","17.5116","0.0012","16.5963","0.0012","90","","99.378","0.001","90","","2176.8","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 Cd N6 O11 -","- C15 H18 Cd N6 O11 -","- C60 H72 Cd4 N24 O44 -","4","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Isomerism in Coordination Complexes and Polymers Derived from Bispyridylurea Ligands: Effect of Solvents, Conformational Flexibility, and Positional Isomerism of the Ligands","Crystal Growth & Design","2007","7","10","2096","","10.1021/cg070301l","","","0.71073","MoKα","","0.0472","0.0437","","","0.0976","0.0995","","","","","","1.181","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504323","9.8645","0.0008","11.2616","0.0009","14.312","0.0011","69.646","0.001","78.814","0.001","81.987","0.001","1457.9","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H48 Cd N18 O14 -","- C44 H48 Cd N18 O14 -","- C44 H48 Cd N18 O14 -","1","0.5","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Isomerism in Coordination Complexes and Polymers Derived from Bispyridylurea Ligands: Effect of Solvents, Conformational Flexibility, and Positional Isomerism of the Ligands","Crystal Growth & Design","2007","7","10","2096","","10.1021/cg070301l","","","0.71073","MoKα","","0.0431","0.041","","","0.114","0.1201","","","","","","1.096","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504324","24.8649","0.0006","24.8649","0.0006","14.9468","0.0007","90","","90","","90","","9241.1","0.5","293","2","293","2","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","","","- C10 H15 N4 O0.5 -","- C10 H15 N4 O0.5 -","- C320 H480 N128 O16 -","32","1","","He, Jun; Zhang, Jing-Xiang; Tan, Gui-Ping; Yin, Ye-Gao; Zhang, Dan; Hu, Mei-Hong","Second Ligand-Directed Assembly of Photoluminescent Zn(II) Coordination Frameworks","Crystal Growth & Design","2007","7","8","1508","","10.1021/cg070320v","","","0.71073","MoKα","","0.0871","0.0709","","","0.1896","0.2083","","","","","","1.055","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504325","16.2045","0.0013","17.6022","0.0014","17.9025","0.0014","90","","90","","90","","5106.4","0.7","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C23 H25 N6 O4 Zn -","- C23 H25 N6 O4 Zn -","- C184 H200 N48 O32 Zn8 -","8","1","","He, Jun; Zhang, Jing-Xiang; Tan, Gui-Ping; Yin, Ye-Gao; Zhang, Dan; Hu, Mei-Hong","Second Ligand-Directed Assembly of Photoluminescent Zn(II) Coordination Frameworks","Crystal Growth & Design","2007","7","8","1508","","10.1021/cg070320v","","","0.71073","MoKα","","0.06","0.043","","","0.1035","0.1131","","","","","","1.044","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504326","8.8594","0.0015","11.698","0.002","14.955","0.003","90","","90","","90","","1549.9","0.5","293","2","293","2","","","","","","","","5","P 2 2 21","P 2c 2","17","","","","- C14 H15 N4 O2 Zn -","- C14 H15 N4 O2 Zn -","- C56 H60 N16 O8 Zn4 -","4","1","","He, Jun; Zhang, Jing-Xiang; Tan, Gui-Ping; Yin, Ye-Gao; Zhang, Dan; Hu, Mei-Hong","Second Ligand-Directed Assembly of Photoluminescent Zn(II) Coordination Frameworks","Crystal Growth & Design","2007","7","8","1508","","10.1021/cg070320v","","","0.71073","MoKα","","0.0459","0.0398","","","0.0927","0.1051","","","","","","1.081","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504327","9.5327","0.0006","9.8051","0.0006","18.9863","0.0012","96.074","0.001","100.82","0.001","109.675","0.001","1613.68","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H28.33 N4 O15.16 Zn2 -","- C28 H28.34 N4 O15.17 Zn2 -","- C56 H56.68 N8 O30.34 Zn4 -","2","1","","He, Jun; Zhang, Jing-Xiang; Tan, Gui-Ping; Yin, Ye-Gao; Zhang, Dan; Hu, Mei-Hong","Second Ligand-Directed Assembly of Photoluminescent Zn(II) Coordination Frameworks","Crystal Growth & Design","2007","7","8","1508","","10.1021/cg070320v","","","0.71073","MoKα","","0.0575","0.0451","","","0.1078","0.1145","","","","","","1.026","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504328","4.7735","0.001","6.7584","0.0014","12.087","0.003","85.662","0.003","88.264","0.003","82.804","0.003","385.68","0.15","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H5 O5 Zn -","- C8 H5 O5 Zn -","- C16 H10 O10 Zn2 -","2","1","","Wang, Ji-Jiang; Gou, Lei; Hu, Huai-Ming; Han, Zhong-Xi; Li, Dong-Sheng; Xue, Gang-Lin; Yang, Meng-Lin; Shi, Qi-Zhen","Ligand and pH-Controlled ZnIIBilayer Coordination Polymers Based on Biphenyl-3,3‘,4,4‘-tetracarboxylate","Crystal Growth & Design","2007","7","8","1514","","10.1021/cg0703240","","","0.71073","MoKα","","0.0432","0.034","","","0.0864","0.0894","","","","","","1.039","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504329","13.3835","0.001","6.9617","0.0005","15.6162","0.0011","90","","110.193","0.001","90","","1365.56","0.17","296","2","296","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C13 H12 N O6.5 Zn -","- C13 H12 N O6.5 Zn -","- C52 H48 N4 O26 Zn4 -","4","1","","Wang, Ji-Jiang; Gou, Lei; Hu, Huai-Ming; Han, Zhong-Xi; Li, Dong-Sheng; Xue, Gang-Lin; Yang, Meng-Lin; Shi, Qi-Zhen","Ligand and pH-Controlled ZnIIBilayer Coordination Polymers Based on Biphenyl-3,3‘,4,4‘-tetracarboxylate","Crystal Growth & Design","2007","7","8","1514","","10.1021/cg0703240","","","0.71073","MoKα","","0.0398","0.0296","","","0.0702","0.0767","","","","","","1.027","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504330","12.0568","0.0019","24.049","0.004","10.6693","0.0017","90","","105.964","0.002","90","","2974.3","0.8","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C72 H50 N8 O17 Zn2 -","- C72 H48 N8 O17 Zn2 -","- C144 H96 N16 O34 Zn4 -","2","0.5","","Wang, Ji-Jiang; Gou, Lei; Hu, Huai-Ming; Han, Zhong-Xi; Li, Dong-Sheng; Xue, Gang-Lin; Yang, Meng-Lin; Shi, Qi-Zhen","Ligand and pH-Controlled ZnIIBilayer Coordination Polymers Based on Biphenyl-3,3‘,4,4‘-tetracarboxylate","Crystal Growth & Design","2007","7","8","1514","","10.1021/cg0703240","","","0.71073","MoKα","","0.0573","0.0383","","","0.0864","0.0963","","","","","","1.043","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504331","9.2671","0.0017","10.8252","0.0019","12.39","0.002","97.306","0.002","106.614","0.002","93.547","0.002","1175.1","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H20 N2 O8 Zn -","- C28 H20 N2 O8 Zn -","- C56 H40 N4 O16 Zn2 -","2","1","","Wang, Ji-Jiang; Gou, Lei; Hu, Huai-Ming; Han, Zhong-Xi; Li, Dong-Sheng; Xue, Gang-Lin; Yang, Meng-Lin; Shi, Qi-Zhen","Ligand and pH-Controlled ZnIIBilayer Coordination Polymers Based on Biphenyl-3,3‘,4,4‘-tetracarboxylate","Crystal Growth & Design","2007","7","8","1514","","10.1021/cg0703240","","","0.71073","MoKα","","0.1429","0.0674","","","0.1123","0.1395","","","","","","0.996","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504332","10.34","0.0012","19.931","0.002","10.3723","0.0012","90","","119.813","0.001","90","","1854.7","0.4","173","2","173","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C4 H8 N20 Zn2 -","- C4 H8 N20 Zn2 -","- C16 H32 N80 Zn8 -","4","1","","Wang, Xian−Wen; Chen, Jing-Zhong; Liu, Jian-Hong","Photoluminescent Zn(II) Metal−Organic Frameworks Built from Tetrazole Ligand: 2D Four-Connected Regular Honeycomb (4363)-net","Crystal Growth & Design","2007","7","7","1227","","10.1021/cg070330w","","","0.71073","MoKα","","0.0683","0.0543","","","0.1584","0.1632","","","","","","1.069","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504333","6.3449","0.0005","10.4301","0.0007","6.6211","0.0005","90","","90","","90","","438.17","0.06","293","2","293","2","","","","","","","","5","P b c m","-P 2c 2b","57","","","","- C H3 N5 O Zn -","- C H3 N5 O Zn -","- C4 H12 N20 O4 Zn4 -","4","0.5","","Wang, Xian−Wen; Chen, Jing-Zhong; Liu, Jian-Hong","Photoluminescent Zn(II) Metal−Organic Frameworks Built from Tetrazole Ligand: 2D Four-Connected Regular Honeycomb (4363)-net","Crystal Growth & Design","2007","7","7","1227","","10.1021/cg070330w","","","0.71073","MoKα","","0.0233","0.02","","","0.0556","0.058","","","","","","1.157","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504334","12.2204","0.0015","13.387","0.003","14.26","0.003","115.38","0.02","95.156","0.012","91.053","0.013","2095","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H46 Cl Mn2 N7 O15.5 -","- C37 H43 Cl Mn2 N7 O15.365 -","- C74 H86 Cl2 Mn4 N14 O30.73 -","2","1","","Nastase, Silviu; Tuna, Floriana; Maxim, Catalin; Muryn, Christopher A.; Avarvari, Narcis; Winpenny, Richard E. P.; Andruh, Marius","Supramolecular Dimers and Chains Resulting from Second Coordination Sphere Interactions","Crystal Growth & Design","2007","7","9","1825","","10.1021/cg070332g","","","0.71073","MoKα","","0.077","0.0385","","","0.0867","0.1068","","","","","","1.033","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504335","9.277","0.003","11.163","0.004","11.396","0.004","70.286","0.004","67.456","0.004","67.131","0.004","979.4","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H22 N6 O14 Zn5 -","- C36 H22 N6 O14 Zn5 -","- C36 H22 N6 O14 Zn5 -","1","0.5","","Yang, En-Cui; Zhao, Hong-Kun; Ding, Bin; Wang, Xiu-Guang; Zhao, Xiao-Jun","Four Novel Three-Dimensional Triazole-Based Zinc(II) Metal−Organic Frameworks Controlled by the Spacers of Dicarboxylate Ligands: Hydrothermal Synthesis, Crystal Structure, and Luminescence Properties","Crystal Growth & Design","2007","7","10","2009","","10.1021/cg070356n","","","0.71073","MoKα","","0.0458","0.0361","","","0.0869","0.0902","","","","","","1.037","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504336","4.8109","0.0003","22.4828","0.0015","9.7706","0.0006","90","","99.738","0.001","90","","1041.59","0.11","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H9 N3 O2 Zn -","- C10 H9 N3 O2 Zn -","- C40 H36 N12 O8 Zn4 -","4","1","","Yang, En-Cui; Zhao, Hong-Kun; Ding, Bin; Wang, Xiu-Guang; Zhao, Xiao-Jun","Four Novel Three-Dimensional Triazole-Based Zinc(II) Metal−Organic Frameworks Controlled by the Spacers of Dicarboxylate Ligands: Hydrothermal Synthesis, Crystal Structure, and Luminescence Properties","Crystal Growth & Design","2007","7","10","2009","","10.1021/cg070356n","","","0.71073","MoKα","","0.0227","0.0195","","","0.0498","0.0508","","","","","","1.036","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504337","11.2054","0.0018","9.9383","0.0016","8.8327","0.0014","90","","92.627","0.002","90","","982.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H8 N3 O2 Zn -","- C9 H8 N3 O2 Zn -","- C36 H32 N12 O8 Zn4 -","4","1","","Yang, En-Cui; Zhao, Hong-Kun; Ding, Bin; Wang, Xiu-Guang; Zhao, Xiao-Jun","Four Novel Three-Dimensional Triazole-Based Zinc(II) Metal−Organic Frameworks Controlled by the Spacers of Dicarboxylate Ligands: Hydrothermal Synthesis, Crystal Structure, and Luminescence Properties","Crystal Growth & Design","2007","7","10","2009","","10.1021/cg070356n","","","0.71073","MoKα","","0.0219","0.0189","","","0.051","0.052","","","","","","1.017","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504338","9.85","0.002","8.976","0.002","19.99","0.004","90","","90","","90","","1767.4","0.6","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C8.5 H7 N3 O2 Zn -","- C8.5 H7 N3 O2 Zn -","- C68 H56 N24 O16 Zn8 -","8","1","","Yang, En-Cui; Zhao, Hong-Kun; Ding, Bin; Wang, Xiu-Guang; Zhao, Xiao-Jun","Four Novel Three-Dimensional Triazole-Based Zinc(II) Metal−Organic Frameworks Controlled by the Spacers of Dicarboxylate Ligands: Hydrothermal Synthesis, Crystal Structure, and Luminescence Properties","Crystal Growth & Design","2007","7","10","2009","","10.1021/cg070356n","","","0.71073","MoKα","","0.026","0.0209","","","0.0575","0.0598","","","","","","1.018","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504339","12.237","0.002","15.295","0.003","9.6444","0.0019","90","","108.791","0.004","90","","1708.9","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H18 Co N2 O8 P2 -","- C14 H18 Co N2 O8 P2 -","- C56 H72 Co4 N8 O32 P8 -","4","0.5","","Fu, Shu-Juan; Cheng, Ching-Yuan; Lin, Kuan-Jiuh","A Reversible Octahedral to Trigonal−Bipyramidal Cobalt Coordination Change in an Aquo-Accessible Coordination Network","Crystal Growth & Design","2007","7","8","1381","","10.1021/cg070361r","","","0.71073","MoKα","","0.084","0.0469","","","0.1091","0.127","","","","","","1.025","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504340","5.5422","0.0006","10.9953","0.0012","12.9331","0.0013","86.572","0.002","82.114","0.002","84.112","0.002","775.71","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H12 Co N2 O6 P2 -","- C14 H12 Co N2 O6 P2 -","- C28 H24 Co2 N4 O12 P4 -","2","1","","Fu, Shu-Juan; Cheng, Ching-Yuan; Lin, Kuan-Jiuh","A Reversible Octahedral to Trigonal−Bipyramidal Cobalt Coordination Change in an Aquo-Accessible Coordination Network","Crystal Growth & Design","2007","7","8","1381","","10.1021/cg070361r","","","0.71073","MoKα","","0.0864","0.0555","","","0.1425","0.1705","","","","","","1.044","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504341","6.9389","0.0014","18.353","0.004","7.7976","0.0016","90","","98.445","0.004","90","","982.3","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H9 Cu N O7 -","- C8 H9 Cu N O7 -","- C32 H36 Cu4 N4 O28 -","4","1","","Lin, Jian-Guo; Su, Yang; Tian, Zheng-Fang; Qiu, Ling; Wen, Li-Li; Lu, Zhen-Da; Li, Yi-Zhi; Meng, Qing-Jin","Organic‒Inorganic Hybrid Coordination Polymers Based on 6-Methylpyridine-2,4-dicarboxylic Acid N-Oxide (MPDCO) Ligand: Preparations, Interpenetrating Structures, and Magnetic and Luminescent Properties","Crystal Growth & Design","2007","7","12","2526","","10.1021/cg070363b","","","0.71073","MoKα","","0.0869","0.0505","","","0.0911","0.0972","","","","","","1.026","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504342","18.758","0.004","10.859","0.002","20.596","0.004","90","","114.928","0.004","90","","3804.4","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H17 Co N3 O7 -","- C18 H17.004 Co N3 O7.0015 -","- C144 H136.032 Co8 N24 O56.012 -","8","1","","Lin, Jian-Guo; Su, Yang; Tian, Zheng-Fang; Qiu, Ling; Wen, Li-Li; Lu, Zhen-Da; Li, Yi-Zhi; Meng, Qing-Jin","Organic‒Inorganic Hybrid Coordination Polymers Based on 6-Methylpyridine-2,4-dicarboxylic Acid N-Oxide (MPDCO) Ligand: Preparations, Interpenetrating Structures, and Magnetic and Luminescent Properties","Crystal Growth & Design","2007","7","12","2526","","10.1021/cg070363b","","","0.71073","MoKα","","0.0938","0.052","","","0.0977","0.1066","","","","","","0.855","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504343","18.656","0.005","10.847","0.003","20.452","0.005","90","","115.032","0.005","90","","3750","1.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H17 N3 Ni O7 -","- C18 H17.002 N3 Ni O7.001 -","- C144 H136.016 N24 Ni8 O56.008 -","8","1","","Lin, Jian-Guo; Su, Yang; Tian, Zheng-Fang; Qiu, Ling; Wen, Li-Li; Lu, Zhen-Da; Li, Yi-Zhi; Meng, Qing-Jin","Organic‒Inorganic Hybrid Coordination Polymers Based on 6-Methylpyridine-2,4-dicarboxylic Acid N-Oxide (MPDCO) Ligand: Preparations, Interpenetrating Structures, and Magnetic and Luminescent Properties","Crystal Growth & Design","2007","7","12","2526","","10.1021/cg070363b","","","0.71073","MoKα","","0.0612","0.043","","","0.085","0.0891","","","","","","1.018","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504344","18.867","0.003","13.511","0.002","16.415","0.003","90","","106.892","0.004","90","","4003.8","1.1","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H20 Co N3 O7 -","- C20 H20 Co N3 O7 -","- C160 H160 Co8 N24 O56 -","8","1","","Lin, Jian-Guo; Su, Yang; Tian, Zheng-Fang; Qiu, Ling; Wen, Li-Li; Lu, Zhen-Da; Li, Yi-Zhi; Meng, Qing-Jin","Organic‒Inorganic Hybrid Coordination Polymers Based on 6-Methylpyridine-2,4-dicarboxylic Acid N-Oxide (MPDCO) Ligand: Preparations, Interpenetrating Structures, and Magnetic and Luminescent Properties","Crystal Growth & Design","2007","7","12","2526","","10.1021/cg070363b","","","0.71073","MoKα","","0.0804","0.0534","","","0.1168","0.123","","","","","","1.098","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504345","19.073","0.004","13.329","0.003","16.272","0.004","90","","107.395","0.005","90","","3947.5","1.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H20.75 N3 Ni O7.375 -","- C20 H20.75 N3 Ni O7.375 -","- C160 H166 N24 Ni8 O59 -","8","1","","Lin, Jian-Guo; Su, Yang; Tian, Zheng-Fang; Qiu, Ling; Wen, Li-Li; Lu, Zhen-Da; Li, Yi-Zhi; Meng, Qing-Jin","Organic‒Inorganic Hybrid Coordination Polymers Based on 6-Methylpyridine-2,4-dicarboxylic Acid N-Oxide (MPDCO) Ligand: Preparations, Interpenetrating Structures, and Magnetic and Luminescent Properties","Crystal Growth & Design","2007","7","12","2526","","10.1021/cg070363b","","","0.71073","MoKα","","0.057","0.039","","","0.0884","0.0935","","","","","","1.014","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504346","19.437","0.002","13.4396","0.0015","16.7213","0.0019","90","","106.056","0.002","90","","4197.6","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H22 N3 O8 Zn -","- C20 H22 N3 O8 Zn -","- C160 H176 N24 O64 Zn8 -","8","1","","Lin, Jian-Guo; Su, Yang; Tian, Zheng-Fang; Qiu, Ling; Wen, Li-Li; Lu, Zhen-Da; Li, Yi-Zhi; Meng, Qing-Jin","Organic‒Inorganic Hybrid Coordination Polymers Based on 6-Methylpyridine-2,4-dicarboxylic Acid N-Oxide (MPDCO) Ligand: Preparations, Interpenetrating Structures, and Magnetic and Luminescent Properties","Crystal Growth & Design","2007","7","12","2526","","10.1021/cg070363b","","","0.71073","MoKα","","0.0782","0.05","","","0.1092","0.1165","","","","","","1.041","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504347","19.429","0.003","13.436","0.002","16.728","0.003","90","","106.133","0.003","90","","4194.8","1.2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H20 Cd N3 O7 -","- C20 H20 Cd N3 O7 -","- C160 H160 Cd8 N24 O56 -","8","1","","Lin, Jian-Guo; Su, Yang; Tian, Zheng-Fang; Qiu, Ling; Wen, Li-Li; Lu, Zhen-Da; Li, Yi-Zhi; Meng, Qing-Jin","Organic‒Inorganic Hybrid Coordination Polymers Based on 6-Methylpyridine-2,4-dicarboxylic Acid N-Oxide (MPDCO) Ligand: Preparations, Interpenetrating Structures, and Magnetic and Luminescent Properties","Crystal Growth & Design","2007","7","12","2526","","10.1021/cg070363b","","","0.71073","MoKα","","0.0646","0.0495","","","0.1313","0.1382","","","","","","1.074","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504348","11.431","0.006","8.625","0.004","11.571","0.007","90","","116.38","0.04","90","","1022","1","203","2","203","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H13 N O -","- C12 H13 N O -","- C48 H52 N4 O4 -","4","1","","Mori, Yutaka; Chiba, Tsuyoshi; Odani, Toru; Matsumoto, Akikazu","Molecular Arrangement and Photoreaction of Sorbamides and Hexadienyl Carbamates with Various N-Substituents in the Solid State","Crystal Growth & Design","2007","7","7","1356","","10.1021/cg070366o","","","0.71075","MoKα","","0.0639","0.0428","","","0.1173","0.126","","","","","","1.025","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504349","9.8398","0.0005","19.3105","0.0011","23.9105","0.0013","90","","100.863","0.002","90","","4461.9","0.4","296","2","296","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C16 H21 N O -","- C16 H21 N O -","- C192 H252 N12 O12 -","12","3","","Mori, Yutaka; Chiba, Tsuyoshi; Odani, Toru; Matsumoto, Akikazu","Molecular Arrangement and Photoreaction of Sorbamides and Hexadienyl Carbamates with Various N-Substituents in the Solid State","Crystal Growth & Design","2007","7","7","1356","","10.1021/cg070366o","","","0.71069","MoKα","","0.1578","0.081","","","0.2271","0.2737","","","","","","1.002","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504350","17.898","0.003","5.0508","0.0006","20.856","0.003","90","","95.256","0.006","90","","1877.4","0.5","296","2","296","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C20 H29 N O -","- C20 H29 N O -","- C80 H116 N4 O4 -","4","1","","Mori, Yutaka; Chiba, Tsuyoshi; Odani, Toru; Matsumoto, Akikazu","Molecular Arrangement and Photoreaction of Sorbamides and Hexadienyl Carbamates with Various N-Substituents in the Solid State","Crystal Growth & Design","2007","7","7","1356","","10.1021/cg070366o","","","0.71069","MoKα","","0.3099","0.0888","","","0.2162","0.3226","","","","","","0.874","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504351","17.536","0.008","5.17","0.0019","25.026","0.011","90","","107.11","0.02","90","","2168.5","1.6","203","2","203","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C24 H37 N O -","- C24 H37 N O -","- C96 H148 N4 O4 -","4","1","","Mori, Yutaka; Chiba, Tsuyoshi; Odani, Toru; Matsumoto, Akikazu","Molecular Arrangement and Photoreaction of Sorbamides and Hexadienyl Carbamates with Various N-Substituents in the Solid State","Crystal Growth & Design","2007","7","7","1356","","10.1021/cg070366o","","","0.71075","MoKα","","0.2285","0.0586","","","0.0797","0.1062","","","","","","0.78","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504352","12.678","0.003","4.8825","0.001","18.413","0.004","90","","92.683","0.008","90","","1138.5","0.4","203","2","203","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C13 H15 N O -","- C13 H15 N O -","- C52 H60 N4 O4 -","4","1","","Mori, Yutaka; Chiba, Tsuyoshi; Odani, Toru; Matsumoto, Akikazu","Molecular Arrangement and Photoreaction of Sorbamides and Hexadienyl Carbamates with Various N-Substituents in the Solid State","Crystal Growth & Design","2007","7","7","1356","","10.1021/cg070366o","","","0.71075","MoKα","","0.0989","0.0469","","","0.0954","0.1072","","","","","","0.914","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504353","7.5223","0.0016","4.8304","0.0011","19.125","0.005","90","","91.465","0.007","90","","694.7","0.3","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H17 N O -","- C17 H17 N O -","- C34 H34 N2 O2 -","2","1","","Mori, Yutaka; Chiba, Tsuyoshi; Odani, Toru; Matsumoto, Akikazu","Molecular Arrangement and Photoreaction of Sorbamides and Hexadienyl Carbamates with Various N-Substituents in the Solid State","Crystal Growth & Design","2007","7","7","1356","","10.1021/cg070366o","","","0.71069","MoKα","","0.0904","0.0572","","","0.1352","0.1588","","","","","","1.067","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504354","4.8485","0.001","13.756","0.004","22.096","0.005","90","","90","","90","","1473.7","0.6","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H19 N O -","- C18 H19 N O -","- C72 H76 N4 O4 -","4","1","","Mori, Yutaka; Chiba, Tsuyoshi; Odani, Toru; Matsumoto, Akikazu","Molecular Arrangement and Photoreaction of Sorbamides and Hexadienyl Carbamates with Various N-Substituents in the Solid State","Crystal Growth & Design","2007","7","7","1356","","10.1021/cg070366o","","","0.71075","MoKα","","0.1136","0.0667","","","0.16","0.1917","","","","","","1.061","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504355","9.077","0.0009","13.2357","0.0015","19.652","0.002","90","","90","","90","","2361","0.4","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H15 N O -","- C13 H15 N O -","- C104 H120 N8 O8 -","8","1","","Mori, Yutaka; Chiba, Tsuyoshi; Odani, Toru; Matsumoto, Akikazu","Molecular Arrangement and Photoreaction of Sorbamides and Hexadienyl Carbamates with Various N-Substituents in the Solid State","Crystal Growth & Design","2007","7","7","1356","","10.1021/cg070366o","","","0.71075","MoKα","","0.1245","0.0749","","","0.1409","0.1592","","","","","","1.094","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504356","5.043","0.002","7.064","0.003","32.897","0.013","90","","90","","90","","1171.9","0.8","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H15 N O2 -","- C13 H15 N O2 -","- C52 H60 N4 O8 -","4","1","","Mori, Yutaka; Chiba, Tsuyoshi; Odani, Toru; Matsumoto, Akikazu","Molecular Arrangement and Photoreaction of Sorbamides and Hexadienyl Carbamates with Various N-Substituents in the Solid State","Crystal Growth & Design","2007","7","7","1356","","10.1021/cg070366o","","","0.71069","MoKα","","0.0874","0.0725","","","0.1889","0.2083","","","","","","1.074","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504357","17.426","0.007","4.757","0.002","18.249","0.008","90","","108.36","0.04","90","","1435.8","1.1","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H17 N O2 -","- C17 H17 N O2 -","- C68 H68 N4 O8 -","4","1","","Mori, Yutaka; Chiba, Tsuyoshi; Odani, Toru; Matsumoto, Akikazu","Molecular Arrangement and Photoreaction of Sorbamides and Hexadienyl Carbamates with Various N-Substituents in the Solid State","Crystal Growth & Design","2007","7","7","1356","","10.1021/cg070366o","","","0.71069","MoKα","","0.0709","0.0511","","","0.1189","0.1281","","","","","","1.056","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504358","4.6807","0.0018","12.728","0.005","13.782","0.006","64","0.03","81.56","0.03","80.17","0.04","724.7","0.5","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H17 N O2 -","- C17 H17 N O2 -","- C34 H34 N2 O4 -","2","1","","Mori, Yutaka; Chiba, Tsuyoshi; Odani, Toru; Matsumoto, Akikazu","Molecular Arrangement and Photoreaction of Sorbamides and Hexadienyl Carbamates with Various N-Substituents in the Solid State","Crystal Growth & Design","2007","7","7","1356","","10.1021/cg070366o","","","0.71075","MoKα","","0.1568","0.0582","","","0.1139","0.1381","","","","","","0.823","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504359","6.9426","0.0004","7.2048","0.0005","9.3201","0.0006","92.459","0.004","91.38","0.004","107.319","0.004","444.31","0.05","203","2","203","2","","","","","","","","3","P -1","-P 1","2","","2-amino-4-methyl-6-(3-pyridyl)pyrimidine","","- C10 H10 N4 -","- C10 H10 N4 -","- C20 H20 N8 -","2","1","","B. Aakeröy, Christer; Schultheiss, Nate; Desper, John; Moore, Curtis","Balancing Hydrogen-Bond Donors and Acceptors in a Family of Bifunctional Aromatic N-Heterocycles","Crystal Growth & Design","2007","7","11","2324","","10.1021/cg070373c","","","0.71073","MoKα","","0.0625","0.05","","","0.1507","0.1613","","","","","","1.119","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504360","5.5629","0.0004","7.4679","0.0006","22.108","0.0018","90","","90","","90","","918.44","0.12","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-amino-4-(4-pyridyl)-6-methylpyrimidine","","- C10 H10 N4 -","- C10 H10 N4 -","- C40 H40 N16 -","4","1","","B. Aakeröy, Christer; Schultheiss, Nate; Desper, John; Moore, Curtis","Balancing Hydrogen-Bond Donors and Acceptors in a Family of Bifunctional Aromatic N-Heterocycles","Crystal Growth & Design","2007","7","11","2324","","10.1021/cg070373c","","","0.71073","MoKα","","0.0383","0.0365","","","0.1003","0.1022","","","","","","1.05","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504361","12.7944","0.0009","12.9712","0.0009","23.1035","0.0015","90","","90.246","0.004","90","","3834.2","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","NS10b 2-amino-4-(4-pyridyl)-6-methylpyrimidine","","- C10 H10 N4 -","- C10 H10 N4 -","- C160 H160 N64 -","16","4","","B. Aakeröy, Christer; Schultheiss, Nate; Desper, John; Moore, Curtis","Balancing Hydrogen-Bond Donors and Acceptors in a Family of Bifunctional Aromatic N-Heterocycles","Crystal Growth & Design","2007","7","11","2324","","10.1021/cg070373c","","","0.71073","MoKα","","0.1495","0.1079","","","0.265","0.3066","","","","","","1.26","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504362","11.6368","0.0008","7.2494","0.0005","24.7339","0.0017","90","","90","","90","","2086.5","0.2","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-amino-4-(6-methoxy-3-pyridyl)-6-methylpyrimidine","","- C11 H12 N4 O -","- C11 H12 N4 O -","- C88 H96 N32 O8 -","8","1","","B. Aakeröy, Christer; Schultheiss, Nate; Desper, John; Moore, Curtis","Balancing Hydrogen-Bond Donors and Acceptors in a Family of Bifunctional Aromatic N-Heterocycles","Crystal Growth & Design","2007","7","11","2324","","10.1021/cg070373c","","","0.71073","MoKα","","0.0507","0.0415","","","0.1056","0.1124","","","","","","1.023","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504363","7.2432","0.0008","7.7893","0.0008","12.695","0.0013","107.292","0.002","91.059","0.002","98.566","0.002","674.75","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","1-(2-amino-4-methylpyrimidin-6-yl)-2-(3-methoxypyridin-5-yl)ethyne, (CH2Cl2)0.5","","- C13.5 H13 Cl N4 O -","- C13.5 H13 Cl N4 O -","- C27 H26 Cl2 N8 O2 -","2","1","","B. Aakeröy, Christer; Schultheiss, Nate; Desper, John; Moore, Curtis","Balancing Hydrogen-Bond Donors and Acceptors in a Family of Bifunctional Aromatic N-Heterocycles","Crystal Growth & Design","2007","7","11","2324","","10.1021/cg070373c","","","0.71073","MoKα","","0.0887","0.0677","","","0.1755","0.1922","","","","","","1.253","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504364","8.6286","0.0006","15.3249","0.001","8.178","0.0006","90","","115.507","0.001","90","","976","0.12","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(2-aminopyrimidin-5-yl)-2-(pyrid-3-yl)ethyne","","- C12 H9 N3 -","- C12 H9 N3 -","- C48 H36 N12 -","4","1","","B. Aakeröy, Christer; Schultheiss, Nate; Desper, John; Moore, Curtis","Balancing Hydrogen-Bond Donors and Acceptors in a Family of Bifunctional Aromatic N-Heterocycles","Crystal Growth & Design","2007","7","11","2324","","10.1021/cg070373c","","","0.71073","MoKα","","0.0624","0.0563","","","0.178","0.1887","","","","","","1.464","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504365","5.132","0.002","10.542","0.004","15.457","0.006","83.343","0.019","89.94","0.03","88.14","0.03","830.2","0.6","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","1-(6-amino-3-pyridyl)-2-(4-{benzimidazol-1-yl}phenyl) ethyne","","- C21 H16 N4 -","- C21 H16 N4 -","- C42 H32 N8 -","2","1","","B. Aakeröy, Christer; Schultheiss, Nate; Desper, John; Moore, Curtis","Balancing Hydrogen-Bond Donors and Acceptors in a Family of Bifunctional Aromatic N-Heterocycles","Crystal Growth & Design","2007","7","11","2324","","10.1021/cg070373c","","","0.71073","MoKα","","0.2814","0.0881","","","0.1876","0.2667","","","","","","0.823","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504366","17.8214","0.0007","7.2722","0.0004","17.3881","0.0009","90","","90","","90","","2253.51","0.19","233","2","233","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C16 H26 Cl4 N4 O3 -","- C16 H26 Cl4 N4 O3 -","- C64 H104 Cl16 N16 O12 -","4","0.5","","Solchinger, Alexander; Wurst, Klaus; Kopacka, Holger; Bildstein, Benno","Supramolecular Stabilization of Hemiacetals ofN-Alkyl(Benz)Imidazole Aldehydes","Crystal Growth & Design","2007","7","12","2380","","10.1021/cg070377h","","","0.71073","MoKα","","0.0682","0.0509","","","0.1293","0.14","","","","","","1.061","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504367","8.8472","0.0006","11.6962","0.0009","9.7839","0.0004","90","","107.008","0.004","90","","968.15","0.11","233","2","233","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H12 N2 O2 -","- C10 H12 N2 O2 -","- C40 H48 N8 O8 -","4","1","","Solchinger, Alexander; Wurst, Klaus; Kopacka, Holger; Bildstein, Benno","Supramolecular Stabilization of Hemiacetals ofN-Alkyl(Benz)Imidazole Aldehydes","Crystal Growth & Design","2007","7","12","2380","","10.1021/cg070377h","","","0.71073","MoKα","","0.0572","0.0393","","","0.0917","0.0981","","","","","","1.054","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504368","13.576","0.006","12.124","0.005","13.478","0.006","90","","90","","90","","2218.4","1.7","293","2","293","2","","","","","","","","4","P b a n :2","-P 2ab 2b","50","","","","- C4 H14 Mg O11 -","- C4 H14 Mg O11 -","- C32 H112 Mg8 O88 -","8","1","","Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K.","Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues","Crystal Growth & Design","2007","7","8","1522","","10.1021/cg070388a","","","0.71073","MoKα","","0.064","0.0452","","","0.1172","0.1278","","","","","","1.081","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504369","10.815","0.004","7.332","0.002","10.033","0.003","90","","111.529","0.005","90","","740.1","0.4","273","2","273","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C4 H8 Mg O8 -","- C4 H8 Mg O8 -","- C16 H32 Mg4 O32 -","4","1","","Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K.","Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues","Crystal Growth & Design","2007","7","8","1522","","10.1021/cg070388a","","","0.71073","MoKα","","0.0548","0.0442","","","0.1179","0.1271","","","","","","1.056","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504370","7.9134","0.0006","11.1318","0.0008","18.3143","0.0014","90","","90","","90","","1613.3","0.2","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H18 Mg2 O17 -","- C8 H18 Mg2 O17 -","- C32 H72 Mg8 O68 -","4","1","","Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K.","Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues","Crystal Growth & Design","2007","7","8","1522","","10.1021/cg070388a","","","0.71073","MoKα","","0.0352","0.0338","","","0.0894","0.0918","","","","","","0.856","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504371","7.553","0.0007","8.8704","0.0009","10.5761","0.001","90","","90","","90","","708.58","0.12","273","2","293","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C4 H6 Mg O7 -","- C4 H6 Mg O7 -","- C16 H24 Mg4 O28 -","4","0.5","","Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K.","Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues","Crystal Growth & Design","2007","7","8","1522","","10.1021/cg070388a","","","0.71073","MoKα","","0.033","0.0315","","","0.082","0.0834","","","","","","1.084","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504372","5.1708","0.0014","9.359","0.003","11.765","0.003","90","","90","","90","","569.3","0.3","273","2","273","2","","","","","","","","4","I 2 2 2","I 2 2","23","","","","- C4 H4 Mg O6 -","- C4 H4 Mg O6 -","- C16 H16 Mg4 O24 -","4","0.5","","Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K.","Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues","Crystal Growth & Design","2007","7","8","1522","","10.1021/cg070388a","","","0.71073","MoKα","","0.0563","0.0523","","","0.1287","0.1311","","","","","","1.132","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504373","5.8204","0.0008","9.8167","0.0013","14.926","0.002","90","","92.252","0.002","90","","852.2","0.2","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H10 Mg O9 -","- C4 H10 Mg O9 -","- C16 H40 Mg4 O36 -","4","1","","Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K.","Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues","Crystal Growth & Design","2007","7","8","1522","","10.1021/cg070388a","","","0.71073","MoKα","","0.0464","0.0414","","","0.1069","0.1106","","","","","","1.073","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504374","10.0616","0.0014","11.2358","0.0016","14.92","0.002","90","","90","","90","","1686.7","0.4","273","2","273","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C4 H10 Mg O9 -","- C4 H10 Mg O9 -","- C32 H80 Mg8 O72 -","8","1","","Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K.","Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues","Crystal Growth & Design","2007","7","8","1522","","10.1021/cg070388a","","","0.71073","MoKα","","0.0849","0.0575","","","0.1237","0.1359","","","","","","1.292","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504375","5.8316","0.0018","13.034","0.004","10.226","0.003","90","","99.286","0.005","90","","767.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H8 Mg O8 -","- C4 H8 Mg O8 -","- C16 H32 Mg4 O32 -","4","1","","Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K.","Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues","Crystal Growth & Design","2007","7","8","1522","","10.1021/cg070388a","","","0.71073","MoKα","","0.0428","0.0385","","","0.1074","0.1124","","","","","","1.091","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504376","6.866","0.004","9.204","0.005","9.459","0.005","90","","108.156","0.009","90","","568","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C4 H4 Mg O6 -","- C4 H4 Mg O6 -","- C16 H16 Mg4 O24 -","4","0.5","","Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K.","Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues","Crystal Growth & Design","2007","7","8","1522","","10.1021/cg070388a","","","0.71073","MoKα","","0.0984","0.0581","","","0.1345","0.1447","","","","","","1.162","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504377","7.69","0.0015","18.853","0.003","19.405","0.006","90","","90.13","0.04","90","","2813.3","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H39 Co2 O25 -","- C16 H39 Co2 O25 -","- C64 H156 Co8 O100 -","4","0.5","","Huang, You-Gui; Gong, Ya-Qiong; Jiang, Fei-Long; Yuan, Da-Qiang; Wu, Ming-Yan; Gao, Qiang; Wei,; Hong, Mao-Chun","Formation of an Infinite Three-Dimensional Water Network by the Hierarchic Assembly of Bilayer Water Nanotubes of Octamers","Crystal Growth & Design","2007","7","8","1385","","10.1021/cg070401r","","","0.71073","MoKα","","0.1023","0.0878","","","0.2431","0.2618","","","","","","1.074","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504378","8.358","0.002","9.105","0.002","18.954","0.004","90","","90","","90","","1442.4","0.6","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H10 Cl2 N4 -","- C15 H10 Cl2 N4 -","- C60 H40 Cl8 N16 -","4","1","","Lu, Zhengliang; Gamez, Patrick; Mutikainen, Ilpo; Turpeinen, Urho; Reedijk, Jan","Supramolecular Assemblies Generated from Both Lone-Pair···π and C−H···π Binding Interactions","Crystal Growth & Design","2007","7","9","1669","","10.1021/cg0704302","","","0.71073","MoKα","","0.0822","0.0372","","","0.0634","0.0755","","","","","","1.058","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504379","16.588","0.003","13.599","0.003","7.735","0.002","90","","107.72","0.03","90","","1662.1","0.7","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H20 N4 O2 -","- C19 H20 N4 O2 -","- C76 H80 N16 O8 -","4","0.5","","Lu, Zhengliang; Gamez, Patrick; Mutikainen, Ilpo; Turpeinen, Urho; Reedijk, Jan","Supramolecular Assemblies Generated from Both Lone-Pair···π and C−H···π Binding Interactions","Crystal Growth & Design","2007","7","9","1669","","10.1021/cg0704302","","","0.71073","MoKα","","0.082","0.04","","","0.0773","0.0907","","","","","","1.06","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504380","13.173","0.005","8.493","0.005","12.555","0.005","90","","90","","90","","1404.6","1.1","89","2","89","2","","","","","","","","7","P n a 21","P 2c -2n","33","compound 1 cbao","","","- C11 H11 Ag B F4 N3 S -","- C11 H11 Ag B F4 N3 S -","- C44 H44 Ag4 B4 F16 N12 S4 -","4","1","","Black, Cory A.; Hanton, Lyall R.","An Atypical Network: Noninterpenetrating (10,3)-d Nets Using an Unsymmetrical Flexible Ligand and Ag(I) as Three-Connected Nodes","Crystal Growth & Design","2007","7","9","1868","","10.1021/cg070437j","","","0.71069","MoKα","","0.0542","0.0439","","","0.1202","0.1278","","","","","","1.109","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504381","13.08","0.004","8.564","0.003","12.607","0.004","90","","90","","90","","1412.2","0.8","90","2","90","2","","","","","","","","7","P n a 21","P 2c -2n","33","compound 2 cban","","","- C11 H11 Ag Cl N3 O4 S -","- C11 H11 Ag Cl N3 O4 S -","- C44 H44 Ag4 Cl4 N12 O16 S4 -","4","1","","Black, Cory A.; Hanton, Lyall R.","An Atypical Network: Noninterpenetrating (10,3)-d Nets Using an Unsymmetrical Flexible Ligand and Ag(I) as Three-Connected Nodes","Crystal Growth & Design","2007","7","9","1868","","10.1021/cg070437j","","","0.71073","MoKα","","0.0315","0.026","","","0.0584","0.0606","","","","","","1.038","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504382","13.939","0.005","8.334","0.005","12.856","0.005","90","","90","","90","","1493.5","1.2","123","2","123","2","","","","","","","","7","P n a 21","P 2c -2n","33","compound 3 cbam","","","- C11 H11 Ag F6 N3 P S -","- C11 H11 Ag F6 N3 P S -","- C44 H44 Ag4 F24 N12 P4 S4 -","4","1","","Black, Cory A.; Hanton, Lyall R.","An Atypical Network: Noninterpenetrating (10,3)-d Nets Using an Unsymmetrical Flexible Ligand and Ag(I) as Three-Connected Nodes","Crystal Growth & Design","2007","7","9","1868","","10.1021/cg070437j","","","0.71069","MoKα","","0.0276","0.0216","","","0.0508","0.0531","","","","","","1.024","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504383","31.7406","0.0007","31.7406","0.0007","31.7406","0.0007","90","","90","","90","","31977.6","1.2","100","2","100","2","","","","","","","","7","P 41 3 2","P 4bd 2ab 3","213","","","","- C88 H68 Ag3 F18 O2 Sb3 Se8 -","- C88 H68 Ag2.999 F18 O2 Sb3 Se8 -","- C1056 H816 Ag35.988 F216 O24 Sb36 Se96 -","12","0.5","","Huang, Guo; Xu, Hanhui; Zhou, Xiao-Ping; Xu, Zhengtao; Li, Kunhao; Zeller, Matthias; Hunter, Allen D.","Assembly of Large Aromatic Selenoether Ligands into Cubic and Non-interpenetrated (10, 3)-aNets","Crystal Growth & Design","2007","7","12","2542","","10.1021/cg070447k","","","0.71073","MoKα","","0.0848","0.0585","","","0.1711","0.1956","","","","","","1.071","","","","has coordinates,has disorder","179578","2020-10-21","18:00:00",""
"4504384","24.1021","0.0006","24.1021","0.0006","24.1021","0.0006","90","","90","","90","","14001.2","0.6","90","2","90","2","","","","","","","","8","P 21 3","P 2ac 2ab 3","198","","","","- C126 H87 Ag3 B F4 N3 O6 Se12 -","- C126 H87 Ag3 B F4 N3 O6 Se12 -","- C504 H348 Ag12 B4 F16 N12 O24 Se48 -","4","0.333333","","Huang, Guo; Xu, Hanhui; Zhou, Xiao-Ping; Xu, Zhengtao; Li, Kunhao; Zeller, Matthias; Hunter, Allen D.","Assembly of Large Aromatic Selenoether Ligands into Cubic and Non-interpenetrated (10, 3)-aNets","Crystal Growth & Design","2007","7","12","2542","","10.1021/cg070447k","","","0.71073","MoKα","","0.0525","0.0445","","","0.1539","0.1604","","","","","","1.215","","","","has coordinates,has disorder","179578","2020-10-21","18:00:00",""
"4504385","8.8541","0.0003","32.115","0.005","10.0644","0.0011","90","","104.036","0.007","90","","2776.4","0.5","298","2","298","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","nevirapine hemihydrate","","- C15 H15 N4 O1.5 -","- C15 H15 N4 O1.5 -","- C120 H120 N32 O12 -","8","2","","Pereira, Bruno G.; Fonte-Boa, Fabio D.; Resende, Jackson A. L. C.; Pinheiro, Carlos B.; Fernandes, Nelson G.; Yoshida, Maria I.; Vianna-Soares, Cristina D.","Pseudopolymorphs and Intrinsic Dissolution of Nevirapine","Crystal Growth & Design","2007","7","10","2016","2023","10.1021/cg0704495","","","0.71073","MoKα","","0.1343","0.0531","","","0.0913","0.1124","","","","","","1.005","","","","has coordinates","211132","2020-10-21","18:00:00",""
"4504386","7.9249","0.0016","8.6013","0.0017","12.7431","0.0025","95.43","0.03","90.16","0.03","112.33","0.02","799.2","0.3","298","2","298","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","nevirapine hemi-ethyl acetate solvate","","- C17 H18 N4 O2 -","- C17 H18 N4 O2 -","- C34 H36 N8 O4 -","2","1","","Pereira, Bruno G.; Fonte-Boa, Fabio D.; Resende, Jackson A. L. C.; Pinheiro, Carlos B.; Fernandes, Nelson G.; Yoshida, Maria I.; Vianna-Soares, Cristina D.","Pseudopolymorphs and Intrinsic Dissolution of Nevirapine","Crystal Growth & Design","2007","7","10","2016","2023","10.1021/cg0704495","","","0.71073","MoKα","","0.0942","0.0554","","","0.1335","0.1553","","","","","","1.014","","","","has coordinates,has disorder","211132","2020-10-21","18:00:00",""
"4504387","13.903","0.005","7.959","0.005","14.655","0.005","90","0.005","90","","90","","1621.6","1.3","84","2","84","2","","","","","","","","4","P m n a","-P 2ac 2","53","(H4TETA)(Hfum)4 3.3 (H2O)","","","- C22 H40.6 N4 O19.3 -","- C22 H38 N4 O18 -","- C44 H76 N8 O36 -","2","0.25","","Wichmann, Kathrin A.; Boyd, Peter D. W.; Söhnel, Tilo; Allen, Grant R.; Phillips, Anthony R. J.; Cooper, Garth J. S.","Characterization of Dicarboxylic Salts of Protonated Triethylenetetramine Useful for the Treatment of Copper-Related Pathologies†","Crystal Growth & Design","2007","7","9","1844","","10.1021/cg0704549","","","0.71073","MoKα","","0.0725","0.0668","","","0.1482","0.1517","","","","","","1.143","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504388","13.261","0.005","9.342","0.005","11.266","0.005","90","0.005","91.01","0.005","90","0.005","1395.5","1.1","83","","83","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","(H4TETA)(Hmal)4 2(H2O)","","","- C22 H39 N4 O18 -","- C22 H36 N4 O17 -","- C44 H72 N8 O34 -","2","0.5","","Wichmann, Kathrin A.; Boyd, Peter D. W.; Söhnel, Tilo; Allen, Grant R.; Phillips, Anthony R. J.; Cooper, Garth J. S.","Characterization of Dicarboxylic Salts of Protonated Triethylenetetramine Useful for the Treatment of Copper-Related Pathologies†","Crystal Growth & Design","2007","7","9","1844","","10.1021/cg0704549","","","0.71069","MoKα","","0.0534","0.0449","","","0.1172","0.1241","","","","","","1.157","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504389","14.0595","0.0002","9.1692","0.0001","13.6466","0.0002","90","","92.47","0.001","90","","1757.61","0.04","84","2","84","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","(H4TETA)(suc)","","","- C14 H30 N4 O8 -","- C14 H30 N4 O8 -","- C56 H120 N16 O32 -","4","0.5","","Wichmann, Kathrin A.; Boyd, Peter D. W.; Söhnel, Tilo; Allen, Grant R.; Phillips, Anthony R. J.; Cooper, Garth J. S.","Characterization of Dicarboxylic Salts of Protonated Triethylenetetramine Useful for the Treatment of Copper-Related Pathologies†","Crystal Growth & Design","2007","7","9","1844","","10.1021/cg0704549","","","0.71073","MoKα","","0.0389","0.0339","","","0.0874","0.0909","","","","","","1.137","","","","has coordinates","208246","2020-10-21","18:00:00",""
"4504390","33.573","0.007","46.947","0.011","9.467","0.002","90","","90","","90","","14921","6","294.15","","294.15","","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C140 H168 Ag8 N40 O28 -","- C140 H160 Ag8 N40 O28 -","- C560 H640 Ag32 N160 O112 -","4","0.25","","Song, Li; Du, Shao-Wu; Lin, Jian-Di; Zhou, Hui; Li, Tao","A 3D Metal‒Organic Framework with Rare 3-Fold Interpenetrating Dia-g Nets Based on Silver(I) and Novel Tetradentate Imidazolate Ligand: Synthesis, Structure, and Possible Ferroelectric Property","Crystal Growth & Design","2007","7","11","2268","","10.1021/cg070458d","","","0.71073","MoKα","","0.0663","0.0578","","","0.1628","0.1791","","","","","","1.051","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504391","37.783","0.009","11.207","0.003","8.53","0.002","90","","94.835","0.001","90","","3599","1.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 Cl4 Fe S8 Se8 -","- C20 H16 Cl4 Fe S8 Se8 -","- C80 H64 Cl16 Fe4 S32 Se32 -","4","0.5","","Zhang, Bin; Laurence Pratt, Francis; Kurmoo, Mohamedally; Okano, Yoshinori; Kobayashi, Hayao; Zhu, Daoben","A Hybrid Organic‒Inorganic Conductor κ′-BETS2FeCl4, BETS = Bis(ethylenedithio)tetraselenafulvalene","Crystal Growth & Design","2007","7","12","2548","","10.1021/cg0704605","","","0.71073","MoKα","","0.0754","0.0518","","","0.1245","0.137","","","","","","0.97","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504392","11.0983","0.0007","11.0983","0.0007","19.6865","0.0019","90","","90","","90","","2424.8","0.3","173","2","173","2","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","Co-pyrimidine helix","","","- C4 H4 Co F6 N2 O5 Si -","- C4 H4 Co F6 N2 O5 Si -","- C32 H32 Co8 F48 N16 O40 Si8 -","8","1","","Cordes, David, B.; Rogers, Robin D.","Enantiomorphic Helical Coordination Polymers of {[M(pyrimidine)(OH2)4][SiF6]·H2O}∞(M = Co2+, Cu2+, Zn2+)","Crystal Growth & Design","2007","7","10","1943","","10.1021/cg070462p","","","0.71073","MoKα","","0.1107","0.0854","","","0.2103","0.2233","","","","","","1.117","","","","has coordinates,has disorder","179578","2020-10-21","18:00:00",""
"4504393","11.1513","0.0006","11.1513","0.0006","19.3206","0.0014","90","","90","","90","","2402.5","0.3","173","2","173","2","","","","","","","","7","P 41 21 2","P 4abw 2nw","92","Cu-pyrimidine helix","","","- C4 H14 Cu F6 N2 O5 Si -","- C4 H14 Cu F6 N2 O5 Si -","- C32 H112 Cu8 F48 N16 O40 Si8 -","8","1","","Cordes, David, B.; Rogers, Robin D.","Enantiomorphic Helical Coordination Polymers of {[M(pyrimidine)(OH2)4][SiF6]·H2O}∞(M = Co2+, Cu2+, Zn2+)","Crystal Growth & Design","2007","7","10","1943","","10.1021/cg070462p","","","0.71073","MoKα","","0.0484","0.0295","","","0.0521","0.0561","","","","","","0.927","","","","has coordinates,has disorder","179578","2020-10-21","18:00:00",""
"4504394","11.186","0.0002","11.186","0.0002","19.7088","0.0004","90","","90","","90","","2466.1","0.08","173","2","173","2","","","","","","","","7","P 41 21 2","P 4abw 2nw","92","Zn-pyrimidine helix","","","- C4 H14 F6 N2 O5 Si Zn -","- C4 H14 F6 N2 O5 Si Zn -","- C32 H112 F48 N16 O40 Si8 Zn8 -","8","1","","Cordes, David, B.; Rogers, Robin D.","Enantiomorphic Helical Coordination Polymers of {[M(pyrimidine)(OH2)4][SiF6]·H2O}∞(M = Co2+, Cu2+, Zn2+)","Crystal Growth & Design","2007","7","10","1943","","10.1021/cg070462p","","","0.71073","MoKα","","0.09","0.0482","","","0.0755","0.0853","","","","","","0.65","","","","has coordinates,has disorder","179578","2020-10-21","18:00:00",""
"4504395","10.077","0.003","11.465","0.003","11.957","0.003","115.208","0.005","102.393","0.005","101.113","0.005","1155.9","0.5","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H15 Ag2 F6 N O4 -","- C22 H15 Ag2 F6 N O4 -","- C44 H30 Ag4 F12 N2 O8 -","2","1","","Akhbari, Kamran; Morsali, Ali","One-Dimensional Corrugated Tape AgICoordination Polymers Constructed of Ag−C Bonds","Crystal Growth & Design","2007","7","10","2024","","10.1021/cg0704652","","","0.71073","MoKα","","0.0694","0.0552","","","0.1047","0.1111","","","","","","1.07","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504396","10.1623","0.0006","11.6994","0.0007","13.3822","0.0012","104.428","0.005","103.912","0.005","108.466","0.005","1370.37","0.19","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H19 Ag2 F6 N O4 -","- C30 H19 Ag2 F6 N O4 -","- C60 H38 Ag4 F12 N2 O8 -","2","1","","Akhbari, Kamran; Morsali, Ali","One-Dimensional Corrugated Tape AgICoordination Polymers Constructed of Ag−C Bonds","Crystal Growth & Design","2007","7","10","2024","","10.1021/cg0704652","","","0.71073","MoKα","","0.0377","0.0294","","","0.0711","0.0767","","","","","","0.992","","","","has coordinates,has disorder","179578","2020-10-21","18:00:00",""
"4504397","11.862","0.002","18.883","0.003","22.445","0.004","96.668","0.003","94.163","0.003","95.226","0.002","4955.1","1.4","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C90 H108 N8 O45 S6 -","- C90 H108 N8 O45 S6 -","- C180 H216 N16 O90 S12 -","2","1","","Liu, Yu; Li, Qiang; Guo, Dong-Sheng; Chen, Kun","Polymeric Capsules and Honeycomb Aggregates Formed byp-Sulfonatocalix[6]arene with Phenanthrolinium Compounds","Crystal Growth & Design","2007","7","9","1672","","10.1021/cg0704854","","","0.7107","MoKα","","0.1008","0.0726","","","0.1764","0.1986","","","","","","1.072","","","","has coordinates","179578","2020-10-21","18:00:00",""
"4504398","18.256","0.003","18.995","0.003","20.708","0.004","104.437","0.003","107.218","0.006","109.746","0.008","5948.6","1.9","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C87 H185 N6 O55.5 S6 -","- C87 H72 N6 O55.5 S6 -","- C174 H144 N12 O111 S12 -","2","1","","Liu, Yu; Li, Qiang; Guo, Dong-Sheng; Chen, Kun","Polymeric Capsules and Honeycomb Aggregates Formed byp-Sulfonatocalix[6]arene with Phenanthrolinium Compounds","Crystal Growth & Design","2007","7","9","1672","","10.1021/cg0704854","","","0.7107","MoKα","","0.1677","0.1415","","","0.3945","0.4195","","","","","","1.381","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504399","6.2515","0.0018","9.199","0.003","19.577","0.006","90","","90","","90","","1125.8","0.6","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H12 N2 O2 -","- C13 H12 N2 O2 -","- C52 H48 N8 O8 -","4","1","","Wang, Yong-Tao; Tang, Gui-Mei; Liu, Zhi-Min; Yi, Xiang-Hui","Can One-Dimensional Water Be Controlled by Transformation of Substitution Groups Based on Organic Hosts?","Crystal Growth & Design","2007","7","11","2272","","10.1021/cg070487o","","","0.71073","MoKα","","0.0545","0.0471","","","0.1114","0.1165","","","","","","0.992","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504400","4.721","0.002","9.606","0.005","31.948","0.015","90","","91.149","0.008","90","","1448.5","1.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 N2 O4 -","- C14 H18 N2 O4 -","- C56 H72 N8 O16 -","4","1","","Wang, Yong-Tao; Tang, Gui-Mei; Liu, Zhi-Min; Yi, Xiang-Hui","Can One-Dimensional Water Be Controlled by Transformation of Substitution Groups Based on Organic Hosts?","Crystal Growth & Design","2007","7","11","2272","","10.1021/cg070487o","","","0.71073","MoKα","","0.1246","0.0572","","","0.1103","0.129","","","","","","0.978","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504401","4.874","0.0001","10.5636","0.0003","30.8767","0.001","90","","90","","90","","1589.75","0.08","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H20 N2 O4 -","- C15 H20 N2 O4 -","- C60 H80 N8 O16 -","4","1","","Wang, Yong-Tao; Tang, Gui-Mei; Liu, Zhi-Min; Yi, Xiang-Hui","Can One-Dimensional Water Be Controlled by Transformation of Substitution Groups Based on Organic Hosts?","Crystal Growth & Design","2007","7","11","2272","","10.1021/cg070487o","","","0.71073","MoKα","","0.0884","0.0447","","","0.0812","0.0911","","","","","","0.976","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4504402","8.9189","0.0005","10.2904","0.0005","27.9198","0.0014","90","","90","","90","","2562.5","0.2","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H34 N2 O6 -","- C29 H34 N2 O6 -","- C116 H136 N8 O24 -","4","1","","Imai, Yoshitane; Kawaguchi, Kakuhiro; Murata, Katuzo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio","Tunable Two-Component Host System with Multiple Chiral Points Composed of Cyclohexanediamine and 1,1‘-Binaphthyl-2,2‘-dicarboxylic Acid","Crystal Growth & Design","2007","7","9","1676","","10.1021/cg070507m","","","0.71073","MoKα","","0.0452","0.0399","","","0.0937","0.1013","","","","","","1.068","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504403","8.8746","0.0005","10.4445","0.0006","28.283","0.0015","90","","90","","90","","2621.6","0.3","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C30 H36 N2 O6 -","- C30 H36 N2 O6 -","- C120 H144 N8 O24 -","4","1","","Imai, Yoshitane; Kawaguchi, Kakuhiro; Murata, Katuzo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio","Tunable Two-Component Host System with Multiple Chiral Points Composed of Cyclohexanediamine and 1,1‘-Binaphthyl-2,2‘-dicarboxylic Acid","Crystal Growth & Design","2007","7","9","1676","","10.1021/cg070507m","","","0.71073","MoKα","","0.0485","0.0443","","","0.1091","0.1118","","","","","","1.067","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504404","9.1854","0.0006","15.1465","0.0011","36.763","0.003","90","","90","","90","","5114.7","0.7","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C59 H66 N2 O11 -","- C59 H65 N2 O11 -","- C236 H260 N8 O44 -","4","1","","Imai, Yoshitane; Kawaguchi, Kakuhiro; Murata, Katuzo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio","Tunable Two-Component Host System with Multiple Chiral Points Composed of Cyclohexanediamine and 1,1‘-Binaphthyl-2,2‘-dicarboxylic Acid","Crystal Growth & Design","2007","7","9","1676","","10.1021/cg070507m","","","0.71073","MoKα","","0.0571","0.0497","","","0.1165","0.1227","","","","","","1.053","","","","has coordinates,has disorder","179579","2020-10-21","18:00:00",""
"4504405","8.5634","0.0005","19.2808","0.0011","8.6971","0.0005","90","","108.028","0.001","90","","1365.47","0.14","289","2","289","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H8 Cu2 N10 -","- C12 H8 Cu2 N10 -","- C48 H32 Cu8 N40 -","4","1","","Tang, Yun-Zhi; Wang, Guo-Xi; Ye, Qiong; Xiong, Ren-Gen; Yuan, Rong-Xin","Heterometallic Tetrazole Coordination Polymer Formed through 2 + 3 Cycloaddition Reaction between Inorganic Complexes in the Presence of Lewis Acid","Crystal Growth & Design","2007","7","12","2382","","10.1021/cg070528g","","","0.71073","MoKα","","0.0266","0.0254","","","0.069","0.0697","","","","","","1.059","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504406","6.6799","0.0005","17.8844","0.0014","14.9376","0.0012","90","","90","","90","","1784.5","0.2","293","2","293","2","","","","","","","","6","P b c m","-P 2c 2b","57","","","","- C12 H8 Cd2 Cl3 Cu N10 -","- C12 H8 Cd2 Cl3 Cu N10 -","- C48 H32 Cd8 Cl12 Cu4 N40 -","4","0.5","","Tang, Yun-Zhi; Wang, Guo-Xi; Ye, Qiong; Xiong, Ren-Gen; Yuan, Rong-Xin","Heterometallic Tetrazole Coordination Polymer Formed through 2 + 3 Cycloaddition Reaction between Inorganic Complexes in the Presence of Lewis Acid","Crystal Growth & Design","2007","7","12","2382","2386","10.1021/cg070528g","","","0.71073","MoKα","","0.0226","0.0214","","","0.055","0.0556","","","","","","1.063","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504407","10.6215","0.0012","11.8452","0.0013","14.125","0.0016","109.281","0.002","90.098","0.002","113.112","0.002","1525.1","0.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H27 Cl4 Cu N6 S2 -","- C27 H27 Cl4 Cu N6 S2 -","- C54 H54 Cl8 Cu2 N12 S4 -","2","1","","Lenthall, Joseph T.; Anderson, Kirsty M.; Smith, Stephen J.; Steed, Jonathan W.","Crystal Packing in Equilibrating Systems: A Single Crystal Containing Three Isomers of CuCl(1-pyridin-2-yl-3-p-tolyl-thiourea)2","Crystal Growth & Design","2007","7","9","1858","","10.1021/cg070533k","","","0.71073","MoKα","","0.125","0.059","","","0.0936","0.11","","","","","","0.991","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504408","25.271","0.002","19.6049","0.0014","21.8179","0.0016","90","","101.369","0.003","90","","10597.3","1.4","120","2","120","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C208 H208 Cl8 Cu8 N48 S16 -","- C208 H208 Cl8 Cu8 N48 S16 -","- C416 H416 Cl16 Cu16 N96 S32 -","2","0.5","","Lenthall, Joseph T.; Anderson, Kirsty M.; Smith, Stephen J.; Steed, Jonathan W.","Crystal Packing in Equilibrating Systems: A Single Crystal Containing Three Isomers of CuCl(1-pyridin-2-yl-3-p-tolyl-thiourea)2","Crystal Growth & Design","2007","7","9","1858","","10.1021/cg070533k","","","0.71073","MoKα","","0.1752","0.0776","","","0.1044","0.1262","","","","","","1.023","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504409","14.237","0.003","14.275","0.002","14.525","0.003","89.983","0.014","78.98","0.016","78.002","0.012","2831.8","0.9","0","2","0","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H49 Cl5 Cu2 N12 S4 -","- C53 H49 Cl5 Cu2 N12 S4 -","- C106 H98 Cl10 Cu4 N24 S8 -","2","1","","Lenthall, Joseph T.; Anderson, Kirsty M.; Smith, Stephen J.; Steed, Jonathan W.","Crystal Packing in Equilibrating Systems: A Single Crystal Containing Three Isomers of CuCl(1-pyridin-2-yl-3-p-tolyl-thiourea)2","Crystal Growth & Design","2007","7","9","1858","","10.1021/cg070533k","","","0.71073","MoKα","","0.2357","0.1777","","","0.4275","0.4587","","","","","","1.602","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504410","16.221","0.002","19.434","0.003","14.943","0.002","90","","114.198","0.002","90","","4296.7","1","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C90 H72 Cd3 N18 O4 S2 -","- C90 H70 Cd3 N18 O4 S2 -","- C180 H140 Cd6 N36 O8 S4 -","2","0.5","","Zheng, Nanfeng; Zhang, Jian; Bu, Xianhui; Feng, Pingyun","Cadmium−Porphyrin Coordination Networks: Rich Coordination Modes and Three-Dimensional Four-Connected CdSO4and (3,5)-Connected hms Nets","Crystal Growth & Design","2007","7","12","2576","","10.1021/cg0705456","","","0.71073","MoKα","","","0.0424","","","0.1147","0.1292","","","","","","1.063","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504411","13.615","0.002","18.578","0.003","14.846","0.003","90","","103.143","0.003","90","","3656.8","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C45 H29 Cd N9 -","- C45 H29 Cd N9 -","- C180 H116 Cd4 N36 -","4","0.5","","Zheng, Nanfeng; Zhang, Jian; Bu, Xianhui; Feng, Pingyun","Cadmium−Porphyrin Coordination Networks: Rich Coordination Modes and Three-Dimensional Four-Connected CdSO4and (3,5)-Connected hms Nets","Crystal Growth & Design","2007","7","12","2576","","10.1021/cg0705456","","","0.71073","MoKα","","","0.0758","","","0.2294","0.2453","","","","","","1.079","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504412","12.852","0.007","15.668","0.007","20.39","0.01","90","","90","","90","","4106","4","293","2","293","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","","","- C40 H28 Cd N8 S2 -","- C40 H28 Cd N8 S2 -","- C160 H112 Cd4 N32 S8 -","4","0.5","","Zheng, Nanfeng; Zhang, Jian; Bu, Xianhui; Feng, Pingyun","Cadmium−Porphyrin Coordination Networks: Rich Coordination Modes and Three-Dimensional Four-Connected CdSO4and (3,5)-Connected hms Nets","Crystal Growth & Design","2007","7","12","2576","","10.1021/cg0705456","","","0.71073","MoKα","","","0.0639","","","0.2047","0.2427","","","","","","1.056","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504413","20.49","0.003","25.064","0.004","16.563","0.003","90","","90.683","0.003","90","","8506","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H24 Cd2 I2 N8 -","- C40 H24 Cd2 I2 N8 -","- C320 H192 Cd16 I16 N64 -","8","1","","Zheng, Nanfeng; Zhang, Jian; Bu, Xianhui; Feng, Pingyun","Cadmium−Porphyrin Coordination Networks: Rich Coordination Modes and Three-Dimensional Four-Connected CdSO4and (3,5)-Connected hms Nets","Crystal Growth & Design","2007","7","12","2576","","10.1021/cg0705456","","","0.71073","MoKα","","","0.0591","","","0.1786","0.1982","","","","","","1.064","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504414","28.386","0.004","7.5189","0.0008","19.822","0.002","90","","111.757","0.003","90","","3929.3","0.8","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C9 H28 Cl In N6 Te2 Zn -","- C9 H28 Cl In N6 Te2 Zn -","- C72 H224 Cl8 In8 N48 Te16 Zn8 -","8","1","","Zhou, Jian; Zhang, Yong; Bian, Guo-Qing; Zhu, Qin-Yu; Li, Chun-Ying; Dai, Jie","Solvothermal Synthesis of a Series of Telluridoindate Compounds Displaying Three Types of One-Dimensional Polymeric Anion Chains with the Formula {[InTe2]-}\ιnfty","Crystal Growth & Design","2007","7","9","1889","","10.1021/cg070552u","","","0.71073","MoKα","","0.0496","0.0404","","","0.0987","0.1043","","","","","","1.094","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504415","9.1779","0.0011","18.639","0.002","14.5452","0.0018","90","","94.255","0.003","90","","2481.3","0.5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H32 In2 N8 Ni Te4 -","- C8 H32 In2 N8 Ni Te4 -","- C32 H128 In8 N32 Ni4 Te16 -","4","1","","Zhou, Jian; Zhang, Yong; Bian, Guo-Qing; Zhu, Qin-Yu; Li, Chun-Ying; Dai, Jie","Solvothermal Synthesis of a Series of Telluridoindate Compounds Displaying Three Types of One-Dimensional Polymeric Anion Chains with the Formula {[InTe2]-}\ιnfty","Crystal Growth & Design","2007","7","9","1889","","10.1021/cg070552u","","","0.71073","MoKα","","0.0878","0.0688","","","0.1458","0.1549","","","","","","1.139","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4504416","9.2263","0.0013","18.718","0.003","14.579","0.002","90","","94.04","0.004","90","","2511.5","0.6","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H32 Co In2 N8 Te4 -","- C8 H32 Co In2 N8 Te4 -","- C32 H128 Co4 In8 N32 Te16 -","4","1","","Zhou, Jian; Zhang, Yong; Bian, Guo-Qing; Zhu, Qin-Yu; Li, Chun-Ying; Dai, Jie","Solvothermal Synthesis of a Series of Telluridoindate Compounds Displaying Three Types of One-Dimensional Polymeric Anion Chains with the Formula {[InTe2]-}\ιnfty","Crystal Growth & Design","2007","7","9","1889","","10.1021/cg070552u","","","0.7107","MoKα","","0.1354","0.1147","","","0.2819","0.2935","","","","","","1.208","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4504417","8.7694","0.0012","16.239","0.003","17.691","0.003","113.937","0.003","90.396","0.002","102.834","0.002","2231.8","0.6","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H52 In4 Mn2 N13 Te8 -","- C13 H52 In4 Mn2 N13 Te8 -","- C26 H104 In8 Mn4 N26 Te16 -","2","1","","Zhou, Jian; Zhang, Yong; Bian, Guo-Qing; Zhu, Qin-Yu; Li, Chun-Ying; Dai, Jie","Solvothermal Synthesis of a Series of Telluridoindate Compounds Displaying Three Types of One-Dimensional Polymeric Anion Chains with the Formula {[InTe2]-}\ιnfty","Crystal Growth & Design","2007","7","9","1889","","10.1021/cg070552u","","","0.71073","MoKα","","0.044","0.0358","","","0.075","0.0789","","","","","","1.156","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504418","8.7193","0.0012","16.186","0.003","17.674","0.003","113.825","0.003","90.17","0.002","102.773","0.002","2213.4","0.6","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H52 Fe2 In4 N13 Te8 -","- C13 H48 Fe2 In4 N13 Te8 -","- C26 H96 Fe4 In8 N26 Te16 -","2","1","","Zhou, Jian; Zhang, Yong; Bian, Guo-Qing; Zhu, Qin-Yu; Li, Chun-Ying; Dai, Jie","Solvothermal Synthesis of a Series of Telluridoindate Compounds Displaying Three Types of One-Dimensional Polymeric Anion Chains with the Formula {[InTe2]-}\ιnfty","Crystal Growth & Design","2007","7","9","1889","","10.1021/cg070552u","","","0.71073","MoKα","","0.0641","0.0464","","","0.1001","0.1117","","","","","","1.001","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504419","8.6878","0.0011","16.1364","0.0011","17.6635","0.0019","66.251","0.007","89.949","0.009","77.34","0.008","2200.8","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H52 In4 N13 Te8 Zn2 -","- C13 H48 In4 N13 Te8 Zn2 -","- C26 H96 In8 N26 Te16 Zn4 -","2","1","","Zhou, Jian; Zhang, Yong; Bian, Guo-Qing; Zhu, Qin-Yu; Li, Chun-Ying; Dai, Jie","Solvothermal Synthesis of a Series of Telluridoindate Compounds Displaying Three Types of One-Dimensional Polymeric Anion Chains with the Formula {[InTe2]-}\ιnfty","Crystal Growth & Design","2007","7","9","1889","","10.1021/cg070552u","","","0.71073","MoKα","","0.0945","0.0638","","","0.128","0.1424","","","","","","1.111","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504420","7.785","0.0005","10.302","0.0012","15.0958","0.0011","90.999","0.005","90.994","0.005","112.195","0.005","1120.45","0.17","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H16 Au2 N10 Ni -","- C14 H16 Au2 N10 Ni -","- C28 H32 Au4 N20 Ni2 -","2","1","","Katz, Michael J.; Kaluarachchi, Harini; Batchelor, Raymond J.; Schatte, Gabriele; Leznoff, Daniel B.","A Concert of Weak Interactions Generates the Very Complex {Cu(tmeda)[Au(CN)4]2}·1/3H2O Structure","Crystal Growth & Design","2007","7","10","1946","","10.1021/cg070557r","","","0.71073","MoKα","","0.0378","0.0309","","0.0755","0.0719","0.0755","","","","","","1.036","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504421","49.06","0.002","24.6174","0.0008","11.4733","0.0006","90","","100.313","0.002","90","","13632.8","1","293","","293.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H50 Au6 Cu3 N30 O -","- C42 H50 Au6 Cu3 N30 O -","- C336 H400 Au48 Cu24 N240 O8 -","8","1","","Katz, Michael J.; Kaluarachchi, Harini; Batchelor, Raymond J.; Schatte, Gabriele; Leznoff, Daniel B.","A Concert of Weak Interactions Generates the Very Complex {Cu(tmeda)[Au(CN)4]2}·1/3H2O Structure","Crystal Growth & Design","2007","7","10","1946","","10.1021/cg070557r","","","1.5418","Copper","","0.0698","0.0364","","0.1225","0.049","0.049","","","","","","0.8671","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504422","34.3092","0.0016","34.3092","","14.4613","0.0004","90","","90","","120","","14742.1","0.8","100","2","100","2","","","","","","","","3","P 3 1 c","P 3 -2c","159","","","","- C43 H40 O5 -","- C43 H40 O5 -","- C774 H720 O90 -","18","3","","Clark, Thomas E.; Makha, Mohamed; Sobolev, Alexandre N.; Dalgarno, Scott J.; Atwood, Jerry L.; Raston, Colin L.","Structural Diversity of Methyl-Substituted Inclusion Complexes of Calix[5]arene","Crystal Growth & Design","2007","7","10","2059","","10.1021/cg0705658","","","0.71073","MoKα","","0.1051","0.0698","","","0.1348","0.1528","","","","","","1.002","","","","has coordinates,has disorder","179579","2020-10-21","18:00:00",""
"4504423","33.821","0.004","33.821","","14.57","0.002","90","","90","","120","","14433","3","153","2","153","2","","","","","","","","3","P 3 1 c","P 3 -2c","159","","","","- C42 H38 O5 -","- C42 H38 O5 -","- C756 H684 O90 -","18","3","","Clark, Thomas E.; Makha, Mohamed; Sobolev, Alexandre N.; Dalgarno, Scott J.; Atwood, Jerry L.; Raston, Colin L.","Structural Diversity of Methyl-Substituted Inclusion Complexes of Calix[5]arene","Crystal Growth & Design","2007","7","10","2059","","10.1021/cg0705658","","","0.71073","MoKα","","0.0915","0.0563","","","0.129","0.1535","","","","","","1.016","","","","has coordinates,has disorder","179579","2020-10-21","18:00:00",""
"4504424","26.78","0.001","8.5173","0.0004","29.317","0.001","90","","90","","90","","6687","0.5","100","2","100","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C43 H40 O5 -","- C43 H40 O5 -","- C344 H320 O40 -","8","1","","Clark, Thomas E.; Makha, Mohamed; Sobolev, Alexandre N.; Dalgarno, Scott J.; Atwood, Jerry L.; Raston, Colin L.","Structural Diversity of Methyl-Substituted Inclusion Complexes of Calix[5]arene","Crystal Growth & Design","2007","7","10","2059","","10.1021/cg0705658","","","0.71073","MoKα","","0.1476","0.0788","","","0.1776","0.2073","","","","","","1.004","","","","has coordinates,has disorder","179579","2020-10-21","18:00:00",""
"4504425","27.6777","0.0005","8.3899","0.0002","29.483","0.0007","90","","90","","90","","6846.3","0.3","100","2","100","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C44 H42 O5 -","- C44 H42 O5 -","- C352 H336 O40 -","8","1","","Clark, Thomas E.; Makha, Mohamed; Sobolev, Alexandre N.; Dalgarno, Scott J.; Atwood, Jerry L.; Raston, Colin L.","Structural Diversity of Methyl-Substituted Inclusion Complexes of Calix[5]arene","Crystal Growth & Design","2007","7","10","2059","","10.1021/cg0705658","","","0.71073","MoKα","","0.1058","0.04","","","0.0646","0.0783","","","","","","1.004","","","","has coordinates,has disorder","179579","2020-10-21","18:00:00",""
"4504426","11.9659","0.0006","14.989","0.006","43.029","0.004","84.36","0.01","87.57","0.01","78.03","0.01","7511","3","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C78 H70 O10 -","- C78 H70 O10 -","- C390 H350 O50 -","5","2.5","","Clark, Thomas E.; Makha, Mohamed; Sobolev, Alexandre N.; Dalgarno, Scott J.; Atwood, Jerry L.; Raston, Colin L.","Structural Diversity of Methyl-Substituted Inclusion Complexes of Calix[5]arene","Crystal Growth & Design","2007","7","10","2059","","10.1021/cg0705658","","","1.54178","CuKα","","0.1103","0.0424","","","0.0657","0.0747","","","","","","0.916","","","","has coordinates,has disorder","179579","2020-10-21","18:00:00",""
"4504427","13.8955","0.0014","9.4945","0.001","16.461","0.002","90","","92.421","0.009","90","","2169.8","0.4","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H6 Cl N4 O2 Rh -","- C8 H6 Cl N4 O2 Rh -","- C64 H48 Cl8 N32 O16 Rh8 -","8","2","","Jakonen, Minna; Oresmaa, Larisa; Haukka, Matti","Solid-State Packing of the Square-Planar [RhI(H2bim)(CO)2]2[A] Complexes (H2bim = 2,2-biimidazole; [A] = 2[Cl], 2[RhICl2(CO)2], [FeIICl4], [CoIICl4])","Crystal Growth & Design","2007","7","12","2620","","10.1021/cg070577t","","","0.71073","MoKα","","0.0394","0.0246","","","0.0449","0.0488","","","","","","1.064","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504428","10.5835","0.0015","42.639","0.005","7.0497","0.0007","90","","107.101","0.01","90","","3040.7","0.7","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H6 Cl2 N4 O4 Rh2 -","- C10 H6 Cl2 N4 O4 Rh2 -","- C80 H48 Cl16 N32 O32 Rh16 -","8","2","","Jakonen, Minna; Oresmaa, Larisa; Haukka, Matti","Solid-State Packing of the Square-Planar [RhI(H2bim)(CO)2]2[A] Complexes (H2bim = 2,2-biimidazole; [A] = 2[Cl], 2[RhICl2(CO)2], [FeIICl4], [CoIICl4])","Crystal Growth & Design","2007","7","12","2620","","10.1021/cg070577t","","","0.71073","MoKα","","0.072","0.037","","","0.0577","0.065","","","","","","1.015","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504429","13.6176","0.0009","10.8665","0.0003","17.652","0.0009","90","","108.36","0.002","90","","2479.1","0.2","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H12 Cl4 Fe N8 O4 Rh2 -","- C16 H12 Cl4 Fe N8 O4 Rh2 -","- C64 H48 Cl16 Fe4 N32 O16 Rh8 -","4","1","","Jakonen, Minna; Oresmaa, Larisa; Haukka, Matti","Solid-State Packing of the Square-Planar [RhI(H2bim)(CO)2]2[A] Complexes (H2bim = 2,2-biimidazole; [A] = 2[Cl], 2[RhICl2(CO)2], [FeIICl4], [CoIICl4])","Crystal Growth & Design","2007","7","12","2620","","10.1021/cg070577t","","","0.71073","MoKα","","0.0707","0.0413","","","0.0814","0.09","","","","","","1.096","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504430","13.572","0.0004","10.8474","0.0004","17.6778","0.0004","90","","108.279","0.002","90","","2471.22","0.13","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H12 Cl4 Co N8 O4 Rh2 -","- C16 H12 Cl4 Co N8 O4 Rh2 -","- C64 H48 Cl16 Co4 N32 O16 Rh8 -","4","1","","Jakonen, Minna; Oresmaa, Larisa; Haukka, Matti","Solid-State Packing of the Square-Planar [RhI(H2bim)(CO)2]2[A] Complexes (H2bim = 2,2-biimidazole; [A] = 2[Cl], 2[RhICl2(CO)2], [FeIICl4], [CoIICl4])","Crystal Growth & Design","2007","7","12","2620","","10.1021/cg070577t","","","0.71073","MoKα","","0.058","0.041","","","0.0943","0.1005","","","","","","1.133","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504431","34.524","0.005","16.597","0.002","13.7907","0.0018","90","","99.763","0.002","90","","7787.6","1.8","187","2","187","2","","","","","","","","7","C 1 2 1","C 2y","5","Cu3 [C12H8N2]3 [C28H19S4O16] Cl[H2O]17.63","","","- C64 H78.25 Cl Cu3 N6 O33.63 S4 -","- C64 H43 Cl Cu3 N6 O33.668 S4 -","- C256 H172 Cl4 Cu12 N24 O134.672 S16 -","4","1","","Liu, Ce; Luo, Fang; Liao, Wuping; Li, Deqian; Wang, Xiaofei; Dronskowski, Richard","pH-Dependent Syntheses and Structures of Two Copper(II)/Phenanthroline/p-Sulfonatocalix[4]arene Supramolecular Compounds with 1D Water-Filled Channels","Crystal Growth & Design","2007","7","11","2282","","10.1021/cg070579d","","","0.71073","MoKα","","0.0859","0.0648","","","0.1627","0.1793","","","","","","1.032","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504432","12.5929","0.0009","14.6637","0.0011","18.4977","0.0014","72.48","0.001","70.664","0.001","79.622","0.001","3061.3","0.4","187","2","187","2","","","","","","","","6","P -1","-P 1","2","Cu2 [C12H8N2] [C28H20S4O16] [H2O]23.01","","","- C40 H74.02 Cu2 N2 O39.01 S4 -","- C40 H28 Cu2 N2 O39.02 S4 -","- C80 H56 Cu4 N4 O78.04 S8 -","2","1","","Liu, Ce; Luo, Fang; Liao, Wuping; Li, Deqian; Wang, Xiaofei; Dronskowski, Richard","pH-Dependent Syntheses and Structures of Two Copper(II)/Phenanthroline/p-Sulfonatocalix[4]arene Supramolecular Compounds with 1D Water-Filled Channels","Crystal Growth & Design","2007","7","11","2282","","10.1021/cg070579d","","","0.71073","MoKα","","0.0993","0.0762","","","0.2057","0.2187","","","","","","1.031","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504433","9.478","0.003","7.021","0.002","13.893","0.004","90","","107.49","0.04","90","","881.8","0.5","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","cytosinium diaquabis(oxalato)manganate(II)","","- C12 H16 Mn N6 O12 -","- C12 H16 Mn N6 O12 -","- C24 H32 Mn2 N12 O24 -","2","0.5","","García-Terán, Juan P.; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; Beobide, Garikoitz; Román, Pascual","Molecular Recognition of Protonated Cytosine Ribbons by Metal‒Oxalato Frameworks","Crystal Growth & Design","2007","7","12","2594","","10.1021/cg0705916","","","0.71073","MoKα","","0.0881","0.0473","","","0.1222","0.1268","","","","","","0.921","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504434","9.492","0.002","6.948","0.002","13.499","0.002","90","","107.14","0.02","90","","850.7","0.3","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","cytosinium diaquabis(oxalato)cobaltate(II)","","- C12 H16 Co N6 O12 -","- C12 H16 Co N6 O12 -","- C24 H32 Co2 N12 O24 -","2","0.5","","García-Terán, Juan P.; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; Beobide, Garikoitz; Román, Pascual","Molecular Recognition of Protonated Cytosine Ribbons by Metal‒Oxalato Frameworks","Crystal Growth & Design","2007","7","12","2594","","10.1021/cg0705916","","","0.71073","MoKα","","0.1026","0.0348","","","0.1388","0.1443","","","","","","0.92","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504435","9.55","0.001","6.967","0.001","13.767","0.003","90","","107.7","0.02","90","","872.6","0.3","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","cytosinium diaquabis(oxalato)cuprate(II)","","- C12 H16 Cu N6 O12 -","- C12 H16 Cu N6 O12 -","- C24 H32 Cu2 N12 O24 -","2","0.5","","García-Terán, Juan P.; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; Beobide, Garikoitz; Román, Pascual","Molecular Recognition of Protonated Cytosine Ribbons by Metal‒Oxalato Frameworks","Crystal Growth & Design","2007","7","12","2594","","10.1021/cg0705916","","","0.71073","MoKα","","0.0764","0.045","","","0.1005","0.1101","","","","","","0.904","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504436","9.528","0.002","6.962","0.001","13.565","0.002","90","","107.18","0.02","90","","859.7","0.3","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","cytosinium diaquabis(oxalato)zincate(II)","","- C12 H16 N6 O12 Zn -","- C12 H16 N6 O12 Zn -","- C24 H32 N12 O24 Zn2 -","2","0.5","","García-Terán, Juan P.; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; Beobide, Garikoitz; Román, Pascual","Molecular Recognition of Protonated Cytosine Ribbons by Metal‒Oxalato Frameworks","Crystal Growth & Design","2007","7","12","2594","","10.1021/cg0705916","","","0.71073","MoKα","","0.1134","0.0426","","","0.1156","0.1243","","","","","","0.978","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504437","10.392","0.008","11.996","0.009","14.882","0.011","90","","90.648","0.013","90","","1855","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 N3 O5 Zn -","- C20 H19 N3 O5 Zn -","- C80 H76 N12 O20 Zn4 -","4","1","","Braverman, Maxwell A.; LaDuca, Robert L.","Luminescent Two- and Three-Dimensional Zinc Coordination Polymers Containing Isomers of Phenylenediacetate and a Kinked Tethering Organodiimine","Crystal Growth & Design","2007","7","11","2343","","10.1021/cg070599f","","","0.71073","MoKα","","0.0691","0.0408","","","0.0836","0.0933","","","","","","1.028","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504438","18.673","0.0005","12.8309","0.0003","17.4384","0.0004","90","","109.707","0.001","90","","3933.38","0.17","173","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H38 N6 O10 Zn2 -","- C40 H38 N6 O10 Zn2 -","- C160 H152 N24 O40 Zn8 -","4","1","","Braverman, Maxwell A.; LaDuca, Robert L.","Luminescent Two- and Three-Dimensional Zinc Coordination Polymers Containing Isomers of Phenylenediacetate and a Kinked Tethering Organodiimine","Crystal Growth & Design","2007","7","11","2343","","10.1021/cg070599f","","","0.71073","MoKα","","0.0532","0.0367","","","0.0952","0.1057","","","","","","1.025","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504439","8.972","0.011","13.188","0.017","15.573","0.019","90","","90","","90","","1843","4","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C20 H17 N3 O4 Zn -","- C20 H17 N3 O4 Zn -","- C80 H68 N12 O16 Zn4 -","4","1","","Braverman, Maxwell A.; LaDuca, Robert L.","Luminescent Two- and Three-Dimensional Zinc Coordination Polymers Containing Isomers of Phenylenediacetate and a Kinked Tethering Organodiimine","Crystal Growth & Design","2007","7","11","2343","","10.1021/cg070599f","","","0.71073","MoKα","","0.104","0.0541","","","0.1001","0.1146","","","","","","1.042","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504440","14.8904","0.0012","28.226","0.002","9.9562","0.0009","90","","106.306","0.002","90","","4016.2","0.6","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H43 N4 Ni2 O17.5 -","- C36 H42 N4 Ni2 O17.5 -","- C144 H168 N16 Ni8 O70 -","4","1","","Hu, Sheng; Zhang, Jie-Peng; Li, Hao-Xiang; Tong, Ming-Liang; Chen, Xiao-Ming; Kitagawa, Susumu","A Dynamic Microporous Metal‒Organic Framework with BCT Zeolite Topology: Construction, Structure, and Adsorption Behavior","Crystal Growth & Design","2007","7","11","2286","","10.1021/cg070602v","","","0.71073","MoKα","","0.0807","0.069","","","0.1679","0.1746","","","","","","1.155","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504441","13.717","0.002","14.226","0.002","17.487","0.003","74.664","0.004","89.778","0.005","84.475","0.005","3274.8","0.9","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C59.5 H75.5 N3.5 O33 S4 -","- C59.5 H48 N3.5 O33 S4 -","- C119 H96 N7 O66 S8 -","2","1","","Liu, Yu; Chen, Kun; Guo, Dong-Sheng; Li, Qiang; Song, Hai-Bin","Comparable Inclusion and Aggregation Structures ofp-Sulfonatothiacalix[4]arene andp-Sulfonatocalix[4]arene upon Complexation with Quinoline Guests","Crystal Growth & Design","2007","7","12","2601","","10.1021/cg070607s","","","0.7107","MoKα","","0.0808","0.0656","","","0.1844","0.1986","","","","","","1.087","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504442","14.1505","0.0015","14.4629","0.0018","19.925","0.003","78.034","0.009","75.103","0.009","62.032","0.006","3462.5","0.8","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H61.5 N4 O26.75 S8 -","- C60.09 H44.08 N4.01 O26.51 S8 -","- C120.18 H88.16 N8.02 O53.02 S16 -","2","1","","Liu, Yu; Chen, Kun; Guo, Dong-Sheng; Li, Qiang; Song, Hai-Bin","Comparable Inclusion and Aggregation Structures ofp-Sulfonatothiacalix[4]arene andp-Sulfonatocalix[4]arene upon Complexation with Quinoline Guests","Crystal Growth & Design","2007","7","12","2601","","10.1021/cg070607s","","","0.7107","MoKα","","0.1103","0.0894","","","0.2488","0.2705","","","","","","1.057","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504443","13.946","0.002","14.5569","0.0018","16.7522","0.0013","61.272","0.008","72.327","0.011","83.847","0.012","2838.5","0.7","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C46.5 H49 N2.5 O26.25 S8 -","- C46.5 H32 N2.5 O26.25 S8 -","- C93 H64 N5 O52.5 S16 -","2","1","","Liu, Yu; Chen, Kun; Guo, Dong-Sheng; Li, Qiang; Song, Hai-Bin","Comparable Inclusion and Aggregation Structures ofp-Sulfonatothiacalix[4]arene andp-Sulfonatocalix[4]arene upon Complexation with Quinoline Guests","Crystal Growth & Design","2007","7","12","2601","","10.1021/cg070607s","","","0.7107","MoKα","","0.079","0.0634","","","0.1895","0.2044","","","","","","1.062","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504444","12.3509","0.0018","13.869","0.002","16.973","0.003","69.059","0.002","76.398","0.002","82.312","0.002","2635.2","0.7","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H54 N2.5 O25 S4 -","- C39.75 H29 N2.5 O25 S4 -","- C79.5 H58 N5 O50 S8 -","2","1","","Liu, Yu; Chen, Kun; Guo, Dong-Sheng; Li, Qiang; Song, Hai-Bin","Comparable Inclusion and Aggregation Structures ofp-Sulfonatothiacalix[4]arene andp-Sulfonatocalix[4]arene upon Complexation with Quinoline Guests","Crystal Growth & Design","2007","7","12","2601","","10.1021/cg070607s","","","0.71073","MoKα","","0.1506","0.0913","","","0.2548","0.3142","","","","","","1.05","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4504445","7.3433","0.0013","8.5921","0.0015","12.889","0.002","90","","90","","90","","813.2","0.2","293","2","293","2","","","","","","","","5","A m a 2","A 2 -2a","40","","","","- C6 H4 Cu2 N2 S2 -","- C6 H4 Cu2 N2 S2 -","- C24 H16 Cu8 N8 S8 -","4","0.5","","Wang, Jing; Zhang, Yue-Hua; Li, Hao-Xiang; Lin, Zhuo-Jia; Tong, Ming-Liang","Construction of Pyridinethiolate-Bridged 2D and 3D Coordination Networks of d10Metal Halides via Solvothermalin SituDisulfide Cleavage Reactions","Crystal Growth & Design","2007","7","11","2352","","10.1021/cg070622x","","","0.71073","MoKα","","0.0206","0.0204","","","0.0483","0.0484","","","","","","1.096","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504446","4.2314","0.0008","10.732","0.002","18.842","0.004","90","","91.697","0.004","90","","855.3","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 H5 Ag2 Cl2 N S -","- C5 H5 Ag2 Cl2 N S -","- C20 H20 Ag8 Cl8 N4 S4 -","4","1","","Wang, Jing; Zhang, Yue-Hua; Li, Hao-Xiang; Lin, Zhuo-Jia; Tong, Ming-Liang","Construction of Pyridinethiolate-Bridged 2D and 3D Coordination Networks of d10Metal Halides via Solvothermalin SituDisulfide Cleavage Reactions","Crystal Growth & Design","2007","7","11","2352","","10.1021/cg070622x","","","0.71073","MoKα","","0.0618","0.0573","","","0.1298","0.133","","","","","","1.026","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504447","14.2925","0.0011","21.7939","0.0017","19.689","0.0016","90","","100.709","0.002","90","","6026.1","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H24 Cu15 N15 S15 -","- C39 H24 Cu15 N15 S15 -","- C156 H96 Cu60 N60 S60 -","4","0.5","","Wang, Jing; Zhang, Yue-Hua; Li, Hao-Xiang; Lin, Zhuo-Jia; Tong, Ming-Liang","Construction of Pyridinethiolate-Bridged 2D and 3D Coordination Networks of d10Metal Halides via Solvothermalin SituDisulfide Cleavage Reactions","Crystal Growth & Design","2007","7","11","2352","","10.1021/cg070622x","","","0.71073","MoKα","","0.0826","0.0549","","","0.1067","0.1184","","","","","","1.037","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504448","22.106","0.002","4.1222","0.0004","15.5059","0.0015","90","","97.947","0.002","90","","1399.4","0.2","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C5 H5 Cu4 I4 N S -","- C5 H5 Cu4 I4 N S -","- C20 H20 Cu16 I16 N4 S4 -","4","0.5","","Wang, Jing; Zhang, Yue-Hua; Li, Hao-Xiang; Lin, Zhuo-Jia; Tong, Ming-Liang","Construction of Pyridinethiolate-Bridged 2D and 3D Coordination Networks of d10Metal Halides via Solvothermalin SituDisulfide Cleavage Reactions","Crystal Growth & Design","2007","7","11","2352","","10.1021/cg070622x","","","0.71073","MoKα","","0.0732","0.0708","","","0.1937","0.1969","","","","","","1.051","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504449","16.022","0.003","4.0404","0.0007","25.154","0.004","90","","90","","90","","1628.4","0.5","293","2","293","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","","","- C10 H10 Ag3 Cl3 N2 S2 -","- C10 H10 Ag3 Cl3 N2 S2 -","- C40 H40 Ag12 Cl12 N8 S8 -","4","0.5","","Wang, Jing; Zhang, Yue-Hua; Li, Hao-Xiang; Lin, Zhuo-Jia; Tong, Ming-Liang","Construction of Pyridinethiolate-Bridged 2D and 3D Coordination Networks of d10Metal Halides via Solvothermalin SituDisulfide Cleavage Reactions","Crystal Growth & Design","2007","7","11","2352","","10.1021/cg070622x","","","0.71073","MoKα","","0.0705","0.0598","","","0.1396","0.1457","","","","","","1.116","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504450","8.7094","0.0007","13.8869","0.0013","19.5034","0.0017","90","","90","","90","","2358.9","0.4","293","2","293","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C20 H16 Mn N4 S6 -","- C20 H16 Mn N4 S6 -","- C80 H64 Mn4 N16 S24 -","4","0.5","","Fu, Ming-Lai; Guo, Guo-Cong; Liu, Xi; Zou, Jian-Ping; Xu, Gang; Huang, Jin-Shun","[Mn(2,2′-bipy)2S6]n: A Homochiral Hybrid of Manganese Polysulfido Compound with a One-Dimensional Mn-S6-Mn Helical Chain","Crystal Growth & Design","2007","7","12","2387","","10.1021/cg070637v","","","0.71073","MoKα","","0.0573","0.047","","","0.1282","0.1381","","","","","","0.912","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504451","12.402","0.003","5.1053","0.001","14.286","0.003","90","","109.84","0.03","90","","850.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H24 N2 O2 -","- C20 H24 N2 O2 -","- C40 H48 N4 O4 -","2","0.5","","Rajput, Lalit; Singha, Subhankar; Biradha, Kumar","Comparative Structural Studies on Homologues of Amides and Reverse Amides: Unprecedented 4-fold Interpenetrated Quartz Network, New β-Sheet, and Two-Dimensional Layers","Crystal Growth & Design","2007","7","12","2788","","10.1021/cg0706417","","","0.71073","MoKα","","0.1217","0.0505","","","0.1216","0.1496","","","","","","1.016","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504452","7.737","0.0015","8.129","0.0016","10.546","0.002","90","","102.05","0.03","90","","648.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 N4 O2 -","- C14 H14 N4 O2 -","- C28 H28 N8 O4 -","2","0.5","","Rajput, Lalit; Singha, Subhankar; Biradha, Kumar","Comparative Structural Studies on Homologues of Amides and Reverse Amides: Unprecedented 4-fold Interpenetrated Quartz Network, New β-Sheet, and Two-Dimensional Layers","Crystal Growth & Design","2007","7","12","2788","","10.1021/cg0706417","","","0.71073","MoKα","","0.0628","0.0461","","","0.117","0.139","","","","","","1","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504453","9.484","0.0019","7.772","0.0016","10.702","0.002","90","","108.21","0.03","90","","749.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H18 N4 O2 -","- C16 H18 N4 O2 -","- C32 H36 N8 O4 -","2","0.5","","Rajput, Lalit; Singha, Subhankar; Biradha, Kumar","Comparative Structural Studies on Homologues of Amides and Reverse Amides: Unprecedented 4-fold Interpenetrated Quartz Network, New β-Sheet, and Two-Dimensional Layers","Crystal Growth & Design","2007","7","12","2788","","10.1021/cg0706417","","","0.71073","MoKα","","0.0664","0.0437","","","0.1149","0.145","","","","","","1.004","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504454","8.2247","0.0016","9.6843","0.0019","21.939","0.004","96","0.03","96.18","0.03","105.83","0.03","1655","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 N4 O2 -","- C18 H22 N4 O2 -","- C72 H88 N16 O8 -","4","2","","Rajput, Lalit; Singha, Subhankar; Biradha, Kumar","Comparative Structural Studies on Homologues of Amides and Reverse Amides: Unprecedented 4-fold Interpenetrated Quartz Network, New β-Sheet, and Two-Dimensional Layers","Crystal Growth & Design","2007","7","12","2788","","10.1021/cg0706417","","","0.71073","MoKα","","0.1783","0.056","","","0.1132","0.1479","","","","","","0.971","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504455","4.8241","0.001","8.2326","0.0016","24.212","0.005","93.71","0.03","95.14","0.03","105.71","0.03","918","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H26 N4 O2 -","- C20 H26 N4 O2 -","- C40 H52 N8 O4 -","2","1","","Rajput, Lalit; Singha, Subhankar; Biradha, Kumar","Comparative Structural Studies on Homologues of Amides and Reverse Amides: Unprecedented 4-fold Interpenetrated Quartz Network, New β-Sheet, and Two-Dimensional Layers","Crystal Growth & Design","2007","7","12","2788","","10.1021/cg0706417","","","0.71073","MoKα","","0.1536","0.0623","","","0.1755","0.2067","","","","","","1.128","","","","has coordinates,has disorder","179579","2020-10-21","18:00:00",""
"4504456","5.255","0.0011","21.051","0.004","6.815","0.0014","90","","106.62","0.03","90","","722.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 N4 O2 -","- C18 H14 N4 O2 -","- C36 H28 N8 O4 -","2","0.5","","Rajput, Lalit; Singha, Subhankar; Biradha, Kumar","Comparative Structural Studies on Homologues of Amides and Reverse Amides: Unprecedented 4-fold Interpenetrated Quartz Network, New β-Sheet, and Two-Dimensional Layers","Crystal Growth & Design","2007","7","12","2788","","10.1021/cg0706417","","","0.71073","MoKα","","0.1207","0.0683","","","0.1402","0.1838","","","","","","1.05","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504457","6.9253","0.0014","16.063","0.003","6.8924","0.0014","90","","107.39","0.03","90","","731.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 N4 O4 -","- C14 H14 N4 O4 -","- C28 H28 N8 O8 -","2","0.5","","Rajput, Lalit; Singha, Subhankar; Biradha, Kumar","Comparative Structural Studies on Homologues of Amides and Reverse Amides: Unprecedented 4-fold Interpenetrated Quartz Network, New β-Sheet, and Two-Dimensional Layers","Crystal Growth & Design","2007","7","12","2788","","10.1021/cg0706417","","","0.71073","MoKα","","0.0711","0.0547","","","0.1648","0.1764","","","","","","1.081","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504458","8.6286","0.0012","8.6286","0.0012","17.727","0.004","90","","90","","120","","1143","0.3","293","2","293","2","","","","","","","","4","P 32 2 1","P 32 2""","154","","","","- C16 H18 N4 O2 -","- C16 H18 N4 O2 -","- C48 H54 N12 O6 -","3","0.5","","Rajput, Lalit; Singha, Subhankar; Biradha, Kumar","Comparative Structural Studies on Homologues of Amides and Reverse Amides: Unprecedented 4-fold Interpenetrated Quartz Network, New β-Sheet, and Two-Dimensional Layers","Crystal Growth & Design","2007","7","12","2788","","10.1021/cg0706417","","","0.71073","MoKα","","0.2048","0.0758","","","0.1653","0.2103","","","","","","1.037","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504459","11.694","0.002","11.655","0.002","15.421","0.003","90","","109.33","0.03","90","","1983.3","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H26 N4 O4 -","- C18 H22 N4 O4 -","- C72 H88 N16 O16 -","4","1","","Rajput, Lalit; Singha, Subhankar; Biradha, Kumar","Comparative Structural Studies on Homologues of Amides and Reverse Amides: Unprecedented 4-fold Interpenetrated Quartz Network, New β-Sheet, and Two-Dimensional Layers","Crystal Growth & Design","2007","7","12","2788","","10.1021/cg0706417","","","0.71073","MoKα","","0.1301","0.076","","","0.2697","0.3111","","","","","","1.051","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504460","11.378","0.002","16.38","0.003","22.925","0.005","90","","90","","90","","4272.6","1.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C20 H30 N4 O4 -","- C20 H26 N4 O4 -","- C160 H208 N32 O32 -","8","1","","Rajput, Lalit; Singha, Subhankar; Biradha, Kumar","Comparative Structural Studies on Homologues of Amides and Reverse Amides: Unprecedented 4-fold Interpenetrated Quartz Network, New β-Sheet, and Two-Dimensional Layers","Crystal Growth & Design","2007","7","12","2788","","10.1021/cg0706417","","","0.71073","MoKα","","0.157","0.0725","","","0.1875","0.2319","","","","","","1.007","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504461","9.617","0.002","10.046","0.002","23.158","0.005","90","","98.59","0.004","90","","2212.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 Co N4 O4 -","- C24 H24 Co N4 O4 -","- C96 H96 Co4 N16 O16 -","4","1","","Martin, David P.; Braverman, Maxwell A.; LaDuca, Robert L.","Two- and Three-Dimensional Divalent Metal Isophthalate Coordination Polymers Incorporating Flexible Bispyridylmethylpiperazine Tethers: Structure Direction through Coordination Geometry Preferences, Carboxylate Binding Mode, and Ligand Conformation","Crystal Growth & Design","2007","7","12","2609","","10.1021/cg700664u","","","0.71073","MoKα","","0.0311","0.027","","","0.0715","0.0738","","","","","","1.037","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504462","9.663","0.002","10.332","0.003","23.208","0.006","90","","100.398","0.004","90","","2279","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 Cd N4 O4 -","- C24 H24 Cd N4 O4 -","- C96 H96 Cd4 N16 O16 -","4","1","","Martin, David P.; Braverman, Maxwell A.; LaDuca, Robert L.","Two- and Three-Dimensional Divalent Metal Isophthalate Coordination Polymers Incorporating Flexible Bispyridylmethylpiperazine Tethers: Structure Direction through Coordination Geometry Preferences, Carboxylate Binding Mode, and Ligand Conformation","Crystal Growth & Design","2007","7","12","2609","","10.1021/cg700664u","","","0.71073","MoKα","","0.0633","0.0395","","","0.0764","0.0839","","","","","","1.017","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504463","9.3093","0.0018","25.642","0.005","10.235","0.002","90","","98.818","0.003","90","","2414.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H28 N4 Ni O6 -","- C24 H28 N4 Ni O6 -","- C96 H112 N16 Ni4 O24 -","4","1","","Martin, David P.; Braverman, Maxwell A.; LaDuca, Robert L.","Two- and Three-Dimensional Divalent Metal Isophthalate Coordination Polymers Incorporating Flexible Bispyridylmethylpiperazine Tethers: Structure Direction through Coordination Geometry Preferences, Carboxylate Binding Mode, and Ligand Conformation","Crystal Growth & Design","2007","7","12","2609","","10.1021/cg700664u","","","0.71073","MoKα","","0.0623","0.0389","","","0.0838","0.0927","","","","","","1.011","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504464","15.982","0.005","15.038","0.004","20.859","0.006","90","","109.946","0.004","90","","4712","2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H26 N4 O5 Zn -","- C24 H26 N4 O5 Zn -","- C192 H208 N32 O40 Zn8 -","8","1","","Martin, David P.; Braverman, Maxwell A.; LaDuca, Robert L.","Two- and Three-Dimensional Divalent Metal Isophthalate Coordination Polymers Incorporating Flexible Bispyridylmethylpiperazine Tethers: Structure Direction through Coordination Geometry Preferences, Carboxylate Binding Mode, and Ligand Conformation","Crystal Growth & Design","2007","7","12","2609","","10.1021/cg700664u","","","0.71073","MoKα","","0.0331","0.0267","","","0.0631","0.0657","","","","","","1.051","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504465","7.8538","0.0005","11.0219","0.0007","11.6693","0.0008","108.674","0.001","105.812","0.001","104.108","0.001","857.9","0.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H20 N O7 Pr -","- C15 H20 N O7 Pr -","- C30 H40 N2 O14 Pr2 -","2","1","","Lill, Daniel T. de; Cahill, Christopher L.","Synthesis and Characterization of a Praseodymium‒Adipate Framework Templated with 1,2-bis(4-Pyridyl)ethane: Host‒Guest Interactions and Structural Survey","Crystal Growth & Design","2007","7","12","2390","","10.1021/cg700741v","","","0.71073","MoKα","","0.0763","0.0502","","","0.0555","0.0611","","","","","","1.032","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504466","13.3613","0.0004","13.9821","0.0004","17.0305","0.0005","68.085","0.01","71.179","0.011","87.876","0.014","2781.3","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H122 N20 Ni8 O77 Si2 W18 -","- C30 H100 N20 Ni8 O77 Si2 W18 -","- C30 H100 N20 Ni8 O77 Si2 W18 -","1","0.5","","Zhao, Jun-Wei; Li, Bing; Zheng, Shou-Tian; Yang, Guo-Yu","Two-Dimensional Extended (4,4)-Topological Network Constructed from Tetra-NiII-Substituted Sandwich-Type Keggin Polyoxometalate Building Blocks and NiII-Organic Cation Bridges","Crystal Growth & Design","2007","7","12","2658","","10.1021/cg700783b","","","0.71073","MoKα","","0.1046","0.0742","","","0.1692","0.1939","","","","","","1.127","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504467","13.338","0.003","13.978","0.003","17.049","0.003","68.159","0.006","71.1","0.008","87.683","0.009","2779.7","1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H120 Ge2 N20 Ni8 O76 W18 -","- C30 H100 Ge2 N20 Ni8 O76 W18 -","- C30 H100 Ge2 N20 Ni8 O76 W18 -","1","0.5","","Zhao, Jun-Wei; Li, Bing; Zheng, Shou-Tian; Yang, Guo-Yu","Two-Dimensional Extended (4,4)-Topological Network Constructed from Tetra-NiII-Substituted Sandwich-Type Keggin Polyoxometalate Building Blocks and NiII-Organic Cation Bridges","Crystal Growth & Design","2007","7","12","2658","","10.1021/cg700783b","","","0.71073","MoKα","","0.0646","0.0499","","","0.1061","0.1167","","","","","","1.095","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504468","13.357","0.0019","13.997","0.002","17.129","0.002","67.468","0.004","71.986","0.005","88.698","0.006","2796.2","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H114 N20 Ni8 O74 P2 W18 -","- C30 H100 N20 Ni8 O74 P2 W18 -","- C30 H100 N20 Ni8 O74 P2 W18 -","1","0.5","","Zhao, Jun-Wei; Li, Bing; Zheng, Shou-Tian; Yang, Guo-Yu","Two-Dimensional Extended (4,4)-Topological Network Constructed from Tetra-NiII-Substituted Sandwich-Type Keggin Polyoxometalate Building Blocks and NiII-Organic Cation Bridges","Crystal Growth & Design","2007","7","12","2658","","10.1021/cg700783b","","","0.71073","MoKα","","0.0514","0.0462","","","0.1255","0.1279","","","","","","1.02","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504469","11.607","0.003","26.232","0.007","7.5531","0.0019","90","","95.686","0.004","90","","2288.4","1","105","","105","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C14 H11 Cl2 Co N2 O14 Pt -","- C14 H11 Cl2 Co N2 O14 Pt -","- C56 H44 Cl8 Co4 N8 O56 Pt4 -","4","0.5","","Hafizović, Jasmina; Krivokapić, Alexander; Szeto, Kai C.; Jakobsen, Søren; Lillerud, Karl Petter; Olsbye, Unni; Tilset, Mats","Tailoring the Dimensionality of Metal‒Organic Frameworks Incorporating Pt and Pd. From Molecular Complexes to 3D Networks","Crystal Growth & Design","2007","7","11","2302","","10.1021/cg7008094","","","0.71073","MoKα","","0.0342","0.0207","","0.0401","0.0217","0.0217","","","","","","1.0355","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504470","7.6642","0.0011","10.7953","0.0015","13.982","0.002","71.459","0.002","85.22","0.002","86.616","0.002","1092.3","0.3","105","","105","","","","","","","","","7","P -1","-P 1","2","","","","- C14 H15 Ce Cl2 N2 O13.5 Pt -","- C14 H18 Ce Cl2 N2 O13.5 Pt -","- C28 H36 Ce2 Cl4 N4 O27 Pt2 -","2","1","","Hafizović, Jasmina; Krivokapić, Alexander; Szeto, Kai C.; Jakobsen, Søren; Lillerud, Karl Petter; Olsbye, Unni; Tilset, Mats","Tailoring the Dimensionality of Metal‒Organic Frameworks Incorporating Pt and Pd. From Molecular Complexes to 3D Networks","Crystal Growth & Design","2007","7","11","2302","","10.1021/cg7008094","","","0.71073","MoKα","","0.0206","0.0181","","0.0215","0.0204","0.0204","","","","","","0.9793","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504471","23.34","0.004","12.766","0.002","14.903","0.003","90","","90","","90","","4440.5","1.4","105","","105","","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C32 H48 Cl2 N8 O14 Pt Zn2 -","- C32 H48 Cl2 N8 O14 Pt Zn2 -","- C128 H192 Cl8 N32 O56 Pt4 Zn8 -","4","1","","Hafizović, Jasmina; Krivokapić, Alexander; Szeto, Kai C.; Jakobsen, Søren; Lillerud, Karl Petter; Olsbye, Unni; Tilset, Mats","Tailoring the Dimensionality of Metal‒Organic Frameworks Incorporating Pt and Pd. From Molecular Complexes to 3D Networks","Crystal Growth & Design","2007","7","11","2302","","10.1021/cg7008094","","","0.71073","MoKα","","0.0507","0.0362","","0.0526","0.0393","0.0393","","","","","","1.029","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504472","11.1428","0.0015","11.8561","0.0016","12.5867","0.0017","78.65","0.004","70.04","0.004","63.599","0.004","1397.9","0.3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H34 N8 O10 Se -","- C24 H34 N8 O10 Se -","- C48 H68 N16 O20 Se2 -","2","1","","Sansam, Benedict C. R.; Anderson, Kirsty M.; Steed, Jonathan W.","A Simple Strategy for Crystal Engineering Water Clusters","Crystal Growth & Design","2007","7","12","2649","","10.1021/cg700932s","","","0.71073","MoKα","","0.187","0.0776","","","0.1151","0.1453","","","","","","0.945","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504473","6.3084","0.0003","13.7082","0.0006","18.1822","0.0008","90","","99.075","0.002","90","","1552.66","0.12","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H24 Co N8 O6 S2 -","- C32 H24 Co N8 O6 S2 -","- C64 H48 Co2 N16 O12 S4 -","2","0.5","","Jana, Atish Dipankar; Manna, Subal Chandra; Rosair, Georgina M.; Drew, Michael G. B.; Mostafa, Golam; Ray Chaudhuri, Nirmalendu","4,4‘-Dipyridyl-N,N‘-dioxide Complexes of Metal-Thiocyanate/Selenocyanate: π-Stacked Molecular Rods as Three-Dimensional Support for Two-Dimensional Polymeric Sheets and Intra/Interchain S···S Interaction Dependent Architecture of the (8) Synthon Driven Assembly of One-Dimensional Polymeric Chains","Crystal Growth & Design","2007","7","7","1365","","10.1021/cg060762r","","","0.71073","MoKα","","0.0409","0.0319","","","0.0871","0.0902","","","","","","1.102","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4504474","7.3668","0.0008","9.8897","0.0011","12.0087","0.0013","78.997","0.009","80.858","0.009","87.796","0.009","847.88","0.16","150","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H14 Co N4 O5 Se2 -","- C12 H14 Co N4 O5 Se2 -","- C24 H28 Co2 N8 O10 Se4 -","2","1","","Jana, Atish Dipankar; Manna, Subal Chandra; Rosair, Georgina M.; Drew, Michael G. B.; Mostafa, Golam; Ray Chaudhuri, Nirmalendu","4,4‘-Dipyridyl-N,N‘-dioxide Complexes of Metal-Thiocyanate/Selenocyanate: π-Stacked Molecular Rods as Three-Dimensional Support for Two-Dimensional Polymeric Sheets and Intra/Interchain S···S Interaction Dependent Architecture of the (8) Synthon Driven Assembly of One-Dimensional Polymeric Chains","Crystal Growth & Design","2007","7","7","1365","","10.1021/cg060762r","","","0.71073","MoKα","","0.0759","0.0428","","","0.0962","0.1006","","","","","","0.878","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4504475","7.2846","0.0009","9.82","0.002","12.0205","0.0016","77.731","0.015","80.242","0.01","88.515","0.014","828","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H14 Co N4 O5 S2 -","- C12 H14 Co N4 O5 S2 -","- C24 H28 Co2 N8 O10 S4 -","2","1","","Jana, Atish Dipankar; Manna, Subal Chandra; Rosair, Georgina M.; Drew, Michael G. B.; Mostafa, Golam; Ray Chaudhuri, Nirmalendu","4,4‘-Dipyridyl-N,N‘-dioxide Complexes of Metal-Thiocyanate/Selenocyanate: π-Stacked Molecular Rods as Three-Dimensional Support for Two-Dimensional Polymeric Sheets and Intra/Interchain S···S Interaction Dependent Architecture of the (8) Synthon Driven Assembly of One-Dimensional Polymeric Chains","Crystal Growth & Design","2007","7","7","1365","","10.1021/cg060762r","","","0.71073","MoKα","","0.1116","0.0809","","","0.2521","0.263","","","","","","1.08","","","","has coordinates","179579","2020-10-21","18:00:00",""
"4511303","13.9599","0.0006","14.1007","0.0005","10.4394","0.0003","90","","116.581","0.003","90","","1837.74","0.12","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Salicyaldehyde Thiosemicarbazone","","","- C8 H9 N3 O S -","- C8 H9 N3 O S -","- C64 H72 N24 O8 S8 -","8","1","","Novaković, Sladjana B.; Fraisse, Bernard; Bogdanović, Goran A.; Spasojević-de Biré, Anne","Experimental Charge Density Evidence for the Existence of High Polarizability of the Electron Density of the Free Electron Pairs on the Sulfur Atom of the Thioureido Group, NH−C(S)−NH2, Induced by N−H···S and C−H···S Interactions","Crystal Growth & Design","2007","7","2","191","","10.1021/cg060497+","","","0.71073","MoKα","","0.0401","0.0401","","","0.1157","0.1157","","","","","","1.062","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511305","9.8402","0.0016","10.1297","0.0016","10.5669","0.0017","117.517","0.002","95.8","0.002","99.945","0.002","900.2","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H18 N2 O2 S -","- C20 H18 N2 O2 S -","- C40 H36 N4 O4 S2 -","2","1","","Roy, Saikat; Nangia, Ashwini","Kinetic and Thermodynamic Conformational Polymorphs of Bis(p-tolyl) Ketonep-Tosylhydrazone: The Curtin−Hammett Principle in Crystallization","Crystal Growth & Design","2007","7","10","2047","","10.1021/cg070542t","","","0.71073","MoKα","","0.0617","0.0524","","","0.132","0.1392","","","","","","1.03","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511306","8.0184","0.0008","11.9872","0.0012","13.5855","0.0013","112.826","0.002","106.592","0.002","93.964","0.002","1129.26","0.19","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H19 Br2 N2 O2 S -","- C23 H19 Br2 N2 O2 S -","- C46 H38 Br4 N4 O4 S2 -","2","1","","Roy, Saikat; Nangia, Ashwini","Kinetic and Thermodynamic Conformational Polymorphs of Bis(p-tolyl) Ketonep-Tosylhydrazone: The Curtin−Hammett Principle in Crystallization","Crystal Growth & Design","2007","7","10","2047","","10.1021/cg070542t","","","0.71073","MoKα","","0.0631","0.0391","","","0.0899","0.0998","","","","","","1.03","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511307","22.0093","0.0013","11.9763","0.0007","15.1853","0.0009","90","","100.937","0.001","90","","3930","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 N2 O2 S -","- C22 H22 N2 O2 S -","- C176 H176 N16 O16 S8 -","8","1","","Roy, Saikat; Nangia, Ashwini","Kinetic and Thermodynamic Conformational Polymorphs of Bis(p-tolyl) Ketonep-Tosylhydrazone: The Curtin−Hammett Principle in Crystallization","Crystal Growth & Design","2007","7","10","2047","","10.1021/cg070542t","","","0.71073","MoKα","","0.0435","0.0408","","","0.1047","0.1066","","","","","","1.072","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511308","11.4666","0.0007","15.5694","0.0009","22.2113","0.0013","90","","90","","90","","3965.3","0.4","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C20 H16 Br2 N2 O2 S -","- C20 H16 Br2 N2 O2 S -","- C160 H128 Br16 N16 O16 S8 -","8","1","","Roy, Saikat; Nangia, Ashwini","Kinetic and Thermodynamic Conformational Polymorphs of Bis(p-tolyl) Ketonep-Tosylhydrazone: The Curtin−Hammett Principle in Crystallization","Crystal Growth & Design","2007","7","10","2047","","10.1021/cg070542t","","","0.71073","MoKα","","0.0344","0.0241","","","0.0589","0.064","","","","","","1.031","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511309","22.25","0.003","12.1201","0.0015","15.2891","0.0019","90","","100.538","0.002","90","","4053.5","0.9","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 N2 O2 S -","- C22 H22 N2 O2 S -","- C176 H176 N16 O16 S8 -","8","1","","Roy, Saikat; Nangia, Ashwini","Kinetic and Thermodynamic Conformational Polymorphs of Bis(p-tolyl) Ketonep-Tosylhydrazone: The Curtin−Hammett Principle in Crystallization","Crystal Growth & Design","2007","7","10","2047","","10.1021/cg070542t","","","0.71073","MoKα","","0.0715","0.0501","","","0.1307","0.1432","","","","","","1.037","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511310","12.3523","0.0016","9.2366","0.0012","16.492","0.002","90","","103.942","0.002","90","","1826.2","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 F2 N2 O2 S -","- C20 H16 F2 N2 O2 S -","- C80 H64 F8 N8 O8 S4 -","4","1","","Roy, Saikat; Nangia, Ashwini","Kinetic and Thermodynamic Conformational Polymorphs of Bis(p-tolyl) Ketonep-Tosylhydrazone: The Curtin−Hammett Principle in Crystallization","Crystal Growth & Design","2007","7","10","2047","","10.1021/cg070542t","","","0.71073","MoKα","","0.0397","0.0334","","","0.0855","0.0901","","","","","","1.048","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511311","7.9816","0.0016","11.793","0.002","13.501","0.003","112.409","0.003","106.616","0.003","93.815","0.003","1103.5","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H19 Cl2 N2 O2 S -","- C23 H19 Cl2 N2 O2 S -","- C46 H38 Cl4 N4 O4 S2 -","2","1","","Roy, Saikat; Nangia, Ashwini","Kinetic and Thermodynamic Conformational Polymorphs of Bis(p-tolyl) Ketonep-Tosylhydrazone: The Curtin−Hammett Principle in Crystallization","Crystal Growth & Design","2007","7","10","2047","","10.1021/cg070542t","","","0.71073","MoKα","","0.0524","0.0418","","","0.108","0.1164","","","","","","1.023","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511312","42.043","0.008","8.0381","0.0016","12.345","0.003","90","","104.08","0.03","90","","4046.6","1.6","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H22 N2 O2 S -","- C22 H22 N2 O2 S -","- C176 H176 N16 O16 S8 -","8","1","","Roy, Saikat; Nangia, Ashwini","Kinetic and Thermodynamic Conformational Polymorphs of Bis(p-tolyl) Ketonep-Tosylhydrazone: The Curtin−Hammett Principle in Crystallization","Crystal Growth & Design","2007","7","10","2047","","10.1021/cg070542t","","","0.71073","MoKα","","0.1839","0.0724","","","0.1405","0.1903","","","","","","0.95","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511313","8.2971","0.0005","39.758","0.003","5.9349","0.0004","90","","97.294","0.001","90","","1941.9","0.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 N2 O2 S -","- C22 H22 N2 O2 S -","- C88 H88 N8 O8 S4 -","4","1","","Roy, Saikat; Nangia, Ashwini","Kinetic and Thermodynamic Conformational Polymorphs of Bis(p-tolyl) Ketonep-Tosylhydrazone: The Curtin−Hammett Principle in Crystallization","Crystal Growth & Design","2007","7","10","2047","","10.1021/cg070542t","","","0.71073","MoKα","","0.052","0.0464","","","0.1128","0.116","","","","","","1.135","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511314","22.4996","0.0017","11.4602","0.0007","15.431","0.0009","90","","102.552","0.002","90","","3883.8","0.4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 Cl2 N2 O2 S -","- C20 H16 Cl2 N2 O2 S -","- C160 H128 Cl16 N16 O16 S8 -","8","1","","Roy, Saikat; Nangia, Ashwini","Kinetic and Thermodynamic Conformational Polymorphs of Bis(p-tolyl) Ketonep-Tosylhydrazone: The Curtin−Hammett Principle in Crystallization","Crystal Growth & Design","2007","7","10","2047","","10.1021/cg070542t","","","0.71073","MoKα","","0.0329","0.0317","","","0.0833","0.0842","","","","","","1.057","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511315","7.9174","0.0018","11.701","0.003","13.248","0.003","111.862","0.004","107.198","0.004","93.619","0.004","1067.2","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C22.5 H23 Cl N2 O2 S -","- C22.5 H23 Cl N2 O2 S -","- C45 H46 Cl2 N4 O4 S2 -","2","1","","Roy, Saikat; Nangia, Ashwini","Kinetic and Thermodynamic Conformational Polymorphs of Bis(p-tolyl) Ketonep-Tosylhydrazone: The Curtin−Hammett Principle in Crystallization","Crystal Growth & Design","2007","7","10","2047","","10.1021/cg070542t","","","0.71073","MoKα","","0.0702","0.0579","","","0.1385","0.1462","","","","","","1.028","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4511316","14.426","0.006","6.808","0.002","16.712","0.008","90","","99.429","0.016","90","","1619.1","1.1","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N3 O8 -","- C16 H15 N3 O8 -","- C64 H60 N12 O32 -","4","1","","Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C.","Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment","Crystal Growth & Design","2007","7","3","531","","10.1021/cg060777p","","","0.71073","MoKα","","0.0869","0.0472","","0.1121","0.1008","0.1121","","","","","","0.8269","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511317","14.473","0.006","6.872","0.002","16.755","0.007","90","","99.721","0.017","90","","1642.5","1.1","160","","160","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N3 O8 -","- C16 H15 N3 O8 -","- C64 H60 N12 O32 -","4","1","","Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C.","Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment","Crystal Growth & Design","2007","7","3","531","","10.1021/cg060777p","","","0.71073","MoKα","","0.0783","0.0443","","0.1234","0.1156","0.1234","","","","","","0.8367","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511318","14.432","0.006","6.873","0.003","16.709","0.007","90","","99.656","0.018","90","","1633.9","1.2","175","","175","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N3 O8 -","- C16 H15 N3 O8 -","- C64 H60 N12 O32 -","4","1","","Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C.","Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment","Crystal Growth & Design","2007","7","3","531","","10.1021/cg060777p","","","0.71073","MoKα","","0.0926","0.0439","","0.1083","0.0992","0.1083","","","","","","0.8074","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511319","14.471","0.004","6.893","0.002","16.805","0.007","90","","99.64","0.013","90","","1652.6","1","190","","190","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N3 O8 -","- C16 H15 N3 O8 -","- C64 H60 N12 O32 -","4","1","","Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C.","Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment","Crystal Growth & Design","2007","7","3","531","","10.1021/cg060777p","","","0.71073","MoKα","","0.0849","0.041","","0.1154","0.1068","0.1154","","","","","","0.8002","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511320","14.46","0.005","6.9","0.002","16.821","0.005","90","","99.628","0.013","90","","1654.7","0.9","200","","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N3 O8 -","- C16 H15 N3 O8 -","- C64 H60 N12 O32 -","4","1","","Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C.","Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment","Crystal Growth & Design","2007","7","3","531","","10.1021/cg060777p","","","0.71073","MoKα","","0.0719","0.04","","0.1042","0.0975","0.1042","","","","","","0.8294","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511321","14.491","0.005","6.912","0.0016","16.848","0.005","90","","99.631","0.012","90","","1663.7","0.9","210","","210","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N3 O8 -","- C16 H15 N3 O8 -","- C64 H60 N12 O32 -","4","1","","Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C.","Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment","Crystal Growth & Design","2007","7","3","531","","10.1021/cg060777p","","","0.71073","MoKα","","0.0776","0.0387","","0.0994","0.0931","0.0994","","","","","","0.7576","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511322","14.46","0.008","6.921","0.003","16.875","0.007","90","","99.644","0.016","90","","1664.9","1.4","225","","225","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N3 O8 -","- C16 H15 N3 O8 -","- C64 H60 N12 O32 -","4","1","","Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C.","Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment","Crystal Growth & Design","2007","7","3","531","","10.1021/cg060777p","","","0.71073","MoKα","","0.1017","0.0425","","0.1098","0.0968","0.1098","","","","","","0.7875","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511323","14.457","0.006","6.943","0.002","16.878","0.006","90","","99.648","0.015","90","","1670.2","1","250","","250","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N3 O8 -","- C16 H15 N3 O8 -","- C64 H60 N12 O32 -","4","1","","Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C.","Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment","Crystal Growth & Design","2007","7","3","531","","10.1021/cg060777p","","","0.71073","MoKα","","0.0836","0.0406","","0.1056","0.0964","0.1056","","","","","","0.7955","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511324","14.469","0.006","6.995","0.002","16.938","0.006","90","","99.715","0.015","90","","1689.7","1","300","","300","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N3 O8 -","- C16 H15 N3 O8 -","- C64 H60 N12 O32 -","4","1","","Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C.","Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment","Crystal Growth & Design","2007","7","3","531","","10.1021/cg060777p","","","0.71073","MoKα","","0.0803","0.0388","","0.1036","0.0943","0.1036","","","","","","0.7691","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511325","6.605","0.004","7.872","0.005","8.47","0.007","87.15","0.03","84.31","0.03","67.09","0.02","403.6","0.5","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C9 H11 N O2 -","- C9 H11 N O2 -","- C18 H22 N2 O4 -","2","1","","Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C.","Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment","Crystal Growth & Design","2007","7","3","531","","10.1021/cg060777p","","","0.71073","MoKα","","0.0757","0.0536","","0.162","0.152","0.162","","","","","","0.9533","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511326","6.619","0.005","7.963","0.005","8.543","0.007","88.12","0.03","84.75","0.03","66.7","0.03","411.8","0.5","200","","200","","","","","","","","","4","P -1","-P 1","2","","","","- C9 H11 N O2 -","- C9 H11 N O2 -","- C18 H22 N2 O4 -","2","1","","Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C.","Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment","Crystal Growth & Design","2007","7","3","531","","10.1021/cg060777p","","","0.71073","MoKα","","0.0818","0.0548","","0.17","0.1584","0.17","","","","","","0.9179","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511327","6.648","0.007","8.056","0.012","8.631","0.01","89.06","0.05","85.29","0.04","66.2","0.05","421.4","0.9","300","","300","","","","","","","","","4","P -1","-P 1","2","","","","- C9 H11 N O2 -","- C9 H11 N O2 -","- C18 H22 N2 O4 -","2","1","","Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C.","Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment","Crystal Growth & Design","2007","7","3","531","","10.1021/cg060777p","","","0.71073","MoKα","","0.0897","0.0523","","0.1525","0.1379","0.1525","","","","","","0.8745","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511329","4.315","0.003","19.046","0.011","5.83","0.003","90","","94.72","0.009","90","","477.5","0.5","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H9 N3 O2 -","- C10 H9 N3 O2 -","- C20 H18 N6 O4 -","2","1","","Zhao, Xia-Xia; Ma, Jian-Ping; Dong, Yu-Bin; Huang, Ru-Qi; Lai, Tianshu","Construction of Metal−Organic Frameworks (M = Cd(II), Co(II), Zn(II), and Cu(II)) Based on Semirigid Oxadiazole Bridging Ligands by Solution and Hydrothermal Reactions","Crystal Growth & Design","2007","7","6","1058","","10.1021/cg060583+","","","0.71073","MoKα","","0.0755","0.0598","","","0.1444","0.153","","","","","","0.997","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511330","7.8585","0.0016","8.6387","0.0018","17.281","0.004","78.394","0.003","83.515","0.003","65.892","0.003","1048.3","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H16 Cd0.5 N9 O4 -","- C20 H16 Cd0.5 N9 O4 -","- C40 H32 Cd N18 O8 -","2","1","","Zhao, Xia-Xia; Ma, Jian-Ping; Dong, Yu-Bin; Huang, Ru-Qi; Lai, Tianshu","Construction of Metal−Organic Frameworks (M = Cd(II), Co(II), Zn(II), and Cu(II)) Based on Semirigid Oxadiazole Bridging Ligands by Solution and Hydrothermal Reactions","Crystal Growth & Design","2007","7","6","1058","","10.1021/cg060583+","","","0.71073","MoKα","","0.0676","0.0577","","","0.1355","0.1425","","","","","","1.072","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511331","7.913","0.002","8.575","0.002","17.175","0.005","77.358","0.005","81.104","0.005","65.633","0.005","1033.1","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H32 Cu N18 O8 -","- C40 H32 Cu N18 O8 -","- C40 H32 Cu N18 O8 -","1","0.5","","Zhao, Xia-Xia; Ma, Jian-Ping; Dong, Yu-Bin; Huang, Ru-Qi; Lai, Tianshu","Construction of Metal−Organic Frameworks (M = Cd(II), Co(II), Zn(II), and Cu(II)) Based on Semirigid Oxadiazole Bridging Ligands by Solution and Hydrothermal Reactions","Crystal Growth & Design","2007","7","6","1058","","10.1021/cg060583+","","","0.71073","MoKα","","0.1913","0.0966","","","0.1921","0.2346","","","","","","0.983","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511332","7.853","0.002","8.349","0.003","17.153","0.005","76.715","0.005","78.033","0.005","68.386","0.005","1008.2","0.5","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H36 Cl2 Cu N16 O4 -","- C40 H36 Cl2 Cu N16 O4 -","- C40 H36 Cl2 Cu N16 O4 -","1","0.5","","Zhao, Xia-Xia; Ma, Jian-Ping; Dong, Yu-Bin; Huang, Ru-Qi; Lai, Tianshu","Construction of Metal−Organic Frameworks (M = Cd(II), Co(II), Zn(II), and Cu(II)) Based on Semirigid Oxadiazole Bridging Ligands by Solution and Hydrothermal Reactions","Crystal Growth & Design","2007","7","6","1058","","10.1021/cg060583+","","","0.71073","MoKα","","0.1145","0.0744","","","0.1509","0.1782","","","","","","1.007","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511333","10.015","0.003","16.303","0.005","5.9874","0.0017","90","","90","","90","","977.6","0.5","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C20 H16 Co N6 O4 -","- C20 H16 Co N6 O4 -","- C40 H32 Co2 N12 O8 -","2","0.5","","Zhao, Xia-Xia; Ma, Jian-Ping; Dong, Yu-Bin; Huang, Ru-Qi; Lai, Tianshu","Construction of Metal−Organic Frameworks (M = Cd(II), Co(II), Zn(II), and Cu(II)) Based on Semirigid Oxadiazole Bridging Ligands by Solution and Hydrothermal Reactions","Crystal Growth & Design","2007","7","6","1058","","10.1021/cg060583+","","","0.71073","MoKα","","0.0306","0.0295","","","0.0914","0.0921","","","","","","1","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511334","10.0177","0.0014","16.292","0.002","5.9802","0.0009","90","","90","","90","","976","0.2","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C20 H16 N6 O4 Zn -","- C20 H16 N6 O4 Zn -","- C40 H32 N12 O8 Zn2 -","2","0.5","","Zhao, Xia-Xia; Ma, Jian-Ping; Dong, Yu-Bin; Huang, Ru-Qi; Lai, Tianshu","Construction of Metal−Organic Frameworks (M = Cd(II), Co(II), Zn(II), and Cu(II)) Based on Semirigid Oxadiazole Bridging Ligands by Solution and Hydrothermal Reactions","Crystal Growth & Design","2007","7","6","1058","","10.1021/cg060583+","","","0.71073","MoKα","","0.0248","0.0244","","","0.0622","0.0624","","","","","","1.085","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511335","23.024","0.018","10.095","0.008","8.741","0.007","90","","103.054","0.01","90","","1979","3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H18 Co N6 O5 -","- C20 H18 Co N6 O5 -","- C80 H72 Co4 N24 O20 -","4","0.5","","Zhao, Xia-Xia; Ma, Jian-Ping; Dong, Yu-Bin; Huang, Ru-Qi; Lai, Tianshu","Construction of Metal−Organic Frameworks (M = Cd(II), Co(II), Zn(II), and Cu(II)) Based on Semirigid Oxadiazole Bridging Ligands by Solution and Hydrothermal Reactions","Crystal Growth & Design","2007","7","6","1058","","10.1021/cg060583+","","","0.71073","MoKα","","0.0475","0.0412","","","0.1047","0.1082","","","","","","1.058","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511336","10.0508","0.0005","10.1032","0.0005","13.1931","0.0008","75.7076","0.0019","68.6728","0.0015","65.407","0.0015","1127.51","0.11","333.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 Ni3 O20 -","- C18 H10 Ni3 O20 -","- C36 H20 Ni6 O40 -","2","1","","Noro, Shin-ichiro; Akutagawa, Tomoyuki; Nakamura, Takayoshi","Formation of Strong OH2···-O2C Hydrogen Bonds in a Trinuclear Core-Based Nickel 1,3,5-Benzenetricarboxylate Coordination Polymer","Crystal Growth & Design","2007","7","6","1205","","10.1021/cg060819+","","","0.71075","MoKα","","","0.0298","","","","0.089","","","","","","0.969","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511337","10.0453","0.0004","10.0964","0.0005","13.1545","0.0006","75.7238","0.0015","68.5836","0.0012","65.4318","0.0012","1122.48","0.09","253.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 Ni3 O20 -","- C18 H10 Ni3 O20 -","- C36 H20 Ni6 O40 -","2","1","","Noro, Shin-ichiro; Akutagawa, Tomoyuki; Nakamura, Takayoshi","Formation of Strong OH2···-O2C Hydrogen Bonds in a Trinuclear Core-Based Nickel 1,3,5-Benzenetricarboxylate Coordination Polymer","Crystal Growth & Design","2007","7","6","1205","","10.1021/cg060819+","","","0.71075","MoKα","","","0.036","","","","0.1241","","","","","","1.244","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511338","10.0604","0.0005","10.1121","0.0006","13.2151","0.0008","75.664","0.0018","68.6105","0.0015","65.3574","0.0015","1130.52","0.11","363.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 Ni3 O20 -","- C18 H10 Ni3 O20 -","- C36 H20 Ni6 O40 -","2","1","","Noro, Shin-ichiro; Akutagawa, Tomoyuki; Nakamura, Takayoshi","Formation of Strong OH2···-O2C Hydrogen Bonds in a Trinuclear Core-Based Nickel 1,3,5-Benzenetricarboxylate Coordination Polymer","Crystal Growth & Design","2007","7","6","1205","","10.1021/cg060819+","","","0.71075","MoKα","","","0.0386","","","","0.1495","","","","","","1.126","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511339","10.0511","0.0006","10.1076","0.0007","13.1964","0.0007","75.624","0.003","68.638","0.002","65.382","0.003","1127.66","0.12","353.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 Ni3 O20 -","- C18 H10 Ni3 O20 -","- C36 H20 Ni6 O40 -","2","1","","Noro, Shin-ichiro; Akutagawa, Tomoyuki; Nakamura, Takayoshi","Formation of Strong OH2···-O2C Hydrogen Bonds in a Trinuclear Core-Based Nickel 1,3,5-Benzenetricarboxylate Coordination Polymer","Crystal Growth & Design","2007","7","6","1205","","10.1021/cg060819+","","","0.71075","MoKα","","","0.0342","","","","0.1173","","","","","","1.074","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511340","10.0138","0.0004","10.0901","0.0004","13.2226","0.0005","75.3466","0.0008","67.8473","0.0009","65.7244","0.0009","1120.36","0.08","143.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 Ni3 O20 -","- C18 H10 Ni3 O20 -","- C36 H20 Ni6 O40 -","2","1","","Noro, Shin-ichiro; Akutagawa, Tomoyuki; Nakamura, Takayoshi","Formation of Strong OH2···-O2C Hydrogen Bonds in a Trinuclear Core-Based Nickel 1,3,5-Benzenetricarboxylate Coordination Polymer","Crystal Growth & Design","2007","7","6","1205","","10.1021/cg060819+","","","0.71075","MoKα","","","0.0324","","","","0.1104","","","","","","1.222","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511341","6.6978","0.0005","9.6542","0.0008","10.1056","0.0007","112.708","0.003","93.919","0.002","106.591","0.002","565.79","0.08","393.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 Ni3 O20 -","- C18 H10 Ni3 O20 -","- C18 H10 Ni3 O20 -","1","0.5","","Noro, Shin-ichiro; Akutagawa, Tomoyuki; Nakamura, Takayoshi","Formation of Strong OH2···-O2C Hydrogen Bonds in a Trinuclear Core-Based Nickel 1,3,5-Benzenetricarboxylate Coordination Polymer","Crystal Growth & Design","2007","7","6","1205","","10.1021/cg060819+","","","0.71075","MoKα","","","0.0289","","","","0.0836","","","","","","1.166","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511342","6.6827","0.0006","9.6566","0.0008","10.1084","0.001","112.735","0.003","93.964","0.004","106.524","0.003","564.84","0.09","373.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H22 Ni3 O20 -","- C18 H10 Ni3 O20 -","- C18 H10 Ni3 O20 -","1","0.5","","Noro, Shin-ichiro; Akutagawa, Tomoyuki; Nakamura, Takayoshi","Formation of Strong OH2···-O2C Hydrogen Bonds in a Trinuclear Core-Based Nickel 1,3,5-Benzenetricarboxylate Coordination Polymer","Crystal Growth & Design","2007","7","6","1205","","10.1021/cg060819+","","","0.71075","MoKα","","","0.0309","","","","0.0962","","","","","","1.155","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511343","9.3079","0.0003","9.6357","0.0002","13.0894","0.0004","75.1009","0.0017","71.3861","0.0011","70.6065","0.0016","1034.32","0.05","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 Cl2 N2 O4 -","- C22 H20 Cl2 N2 O4 -","- C44 H40 Cl4 N4 O8 -","2","1","","Parkin, Andrew; Wozniak, Krzysztof; Wilson, Chick C.","From Proton Disorder to Proton Migration: A Continuum in the Hydrogen Bond of a Proton Sponge in the Solid State","Crystal Growth & Design","2007","7","8","1393","","10.1021/cg0606848","","","0.71073","MoKα","","0.0643","0.0405","","0.1085","0.0996","0.1085","","","","","","0.9209","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511344","9.3029","0.0003","9.6265","0.0002","13.0322","0.0004","75.1325","0.0017","71.2289","0.0012","70.6196","0.0016","1027.63","0.05","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 Cl2 N2 O4 -","- C22 H20 Cl2 N2 O4 -","- C44 H40 Cl4 N4 O8 -","2","1","","Parkin, Andrew; Wozniak, Krzysztof; Wilson, Chick C.","From Proton Disorder to Proton Migration: A Continuum in the Hydrogen Bond of a Proton Sponge in the Solid State","Crystal Growth & Design","2007","7","8","1393","","10.1021/cg0606848","","","0.71073","MoKα","","0.0619","0.0393","","0.1042","0.0955","0.1042","","","","","","0.9292","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511345","9.3119","0.0003","9.6483","0.0002","13.1559","0.0004","75.0966","0.0017","71.5688","0.0012","70.5777","0.0016","1042.15","0.05","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 Cl2 N2 O4 -","- C22 H20 Cl2 N2 O4 -","- C44 H40 Cl4 N4 O8 -","2","1","","Parkin, Andrew; Wozniak, Krzysztof; Wilson, Chick C.","From Proton Disorder to Proton Migration: A Continuum in the Hydrogen Bond of a Proton Sponge in the Solid State","Crystal Growth & Design","2007","7","8","1393","","10.1021/cg0606848","","","0.71073","MoKα","","0.0705","0.0437","","0.1203","0.1085","0.1203","","","","","","0.9181","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511346","9.3059","0.0004","9.6606","0.0003","13.2242","0.0006","75.09","0.002","71.7689","0.0016","70.562","0.002","1049.13","0.07","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 Cl2 N2 O4 -","- C22 H20 Cl2 N2 O4 -","- C44 H40 Cl4 N4 O8 -","2","1","","Parkin, Andrew; Wozniak, Krzysztof; Wilson, Chick C.","From Proton Disorder to Proton Migration: A Continuum in the Hydrogen Bond of a Proton Sponge in the Solid State","Crystal Growth & Design","2007","7","8","1393","","10.1021/cg0606848","","","0.71073","MoKα","","0.0896","0.0511","","0.1575","0.1331","0.1575","","","","","","0.8534","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511347","9.3087","0.0004","9.6777","0.0003","13.3077","0.0005","75.117","0.002","71.9947","0.0015","70.47","0.002","1058.66","0.07","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 Cl2 N2 O4 -","- C22 H20 Cl2 N2 O4 -","- C44 H40 Cl4 N4 O8 -","2","1","","Parkin, Andrew; Wozniak, Krzysztof; Wilson, Chick C.","From Proton Disorder to Proton Migration: A Continuum in the Hydrogen Bond of a Proton Sponge in the Solid State","Crystal Growth & Design","2007","7","8","1393","","10.1021/cg0606848","","","0.71073","MoKα","","0.1023","0.0543","","0.157","0.1337","0.157","","","","","","0.9141","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511348","14.384","0.005","4.9751","0.0016","22.709","0.007","90","","102.085","0.006","90","","1589.1","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H13 F2 N3 O2 -","- C19 H13 F2 N3 O2 -","- C76 H52 F8 N12 O8 -","4","1","","Zhu, Yuan-Yuan; Wu, Jing; Li, Chuang; Zhu, Jiang; Hou, Jun-Li; Li, Chang-Zhi; Jiang, Xi-Kui; Li, Zhan-Ting","F···H−N and MeO···H−N Hydrogen-Bonding in the Solid States of Aromatic Amides and Hydrazides: A Comparison Study","Crystal Growth & Design","2007","7","8","1490","","10.1021/cg070257+","","","0.71073","MoKα","","0.1067","0.063","","","0.1376","0.1546","","","","","","1.009","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511349","18.5875","0.0018","7.3555","0.0007","20.905","0.002","90","","114.532","0.002","90","","2600.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H28 N2 O9 -","- C28 H28 N2 O9 -","- C112 H112 N8 O36 -","4","1","","Zhu, Yuan-Yuan; Wu, Jing; Li, Chuang; Zhu, Jiang; Hou, Jun-Li; Li, Chang-Zhi; Jiang, Xi-Kui; Li, Zhan-Ting","F···H−N and MeO···H−N Hydrogen-Bonding in the Solid States of Aromatic Amides and Hydrazides: A Comparison Study","Crystal Growth & Design","2007","7","8","1490","","10.1021/cg070257+","","","0.71073","MoKα","","0.0549","0.0422","","","0.1078","0.1292","","","","","","1.083","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511350","4.7817","0.0008","6.9484","0.0012","18.366","0.003","90","","93.863","0.003","90","","608.83","0.18","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 F2 N2 O2 -","- C14 H10 F2 N2 O2 -","- C28 H20 F4 N4 O4 -","2","0.5","","Zhu, Yuan-Yuan; Wu, Jing; Li, Chuang; Zhu, Jiang; Hou, Jun-Li; Li, Chang-Zhi; Jiang, Xi-Kui; Li, Zhan-Ting","F···H−N and MeO···H−N Hydrogen-Bonding in the Solid States of Aromatic Amides and Hydrazides: A Comparison Study","Crystal Growth & Design","2007","7","8","1490","","10.1021/cg070257+","","","0.71073","MoKα","","0.0588","0.0448","","","0.1069","0.1138","","","","","","1.003","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511351","4.8304","0.0009","12.954","0.003","14.672","0.003","105.165","0.004","90.387","0.004","97.674","0.004","877.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H15 F3 N2 O2 -","- C21 H15 F3 N2 O2 -","- C42 H30 F6 N4 O4 -","2","1","","Zhu, Yuan-Yuan; Wu, Jing; Li, Chuang; Zhu, Jiang; Hou, Jun-Li; Li, Chang-Zhi; Jiang, Xi-Kui; Li, Zhan-Ting","F···H−N and MeO···H−N Hydrogen-Bonding in the Solid States of Aromatic Amides and Hydrazides: A Comparison Study","Crystal Growth & Design","2007","7","8","1490","","10.1021/cg070257+","","","0.71073","MoKα","","0.1104","0.0681","","","0.1577","0.1915","","","","","","1.092","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511352","4.8124","0.0008","6.1524","0.0011","11.728","0.002","88.794","0.003","81.757","0.003","88.045","0.003","343.41","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 Cl2 N2 O2 -","- C14 H10 Cl2 N2 O2 -","- C14 H10 Cl2 N2 O2 -","1","0.5","","Zhu, Yuan-Yuan; Wu, Jing; Li, Chuang; Zhu, Jiang; Hou, Jun-Li; Li, Chang-Zhi; Jiang, Xi-Kui; Li, Zhan-Ting","F···H−N and MeO···H−N Hydrogen-Bonding in the Solid States of Aromatic Amides and Hydrazides: A Comparison Study","Crystal Growth & Design","2007","7","8","1490","","10.1021/cg070257+","","","0.71073","MoKα","","0.0582","0.0545","","","0.1345","0.1397","","","","","","1.063","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511353","7.5701","0.0008","8.4178","0.0009","13.5441","0.0015","82.489","0.002","75.873","0.002","84.66","0.002","828.11","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H12 F4 N2 O2 -","- C20 H12 F4 N2 O2 -","- C40 H24 F8 N4 O4 -","2","1","","Zhu, Yuan-Yuan; Wu, Jing; Li, Chuang; Zhu, Jiang; Hou, Jun-Li; Li, Chang-Zhi; Jiang, Xi-Kui; Li, Zhan-Ting","F···H−N and MeO···H−N Hydrogen-Bonding in the Solid States of Aromatic Amides and Hydrazides: A Comparison Study","Crystal Growth & Design","2007","7","8","1490","","10.1021/cg070257+","","","0.71073","MoKα","","0.0578","0.0397","","","0.0746","0.0786","","","","","","1.007","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511354","6.2494","0.0004","15.578","0.002","15.62","0.002","110.665","0.005","100.549","0.006","82.736","0.007","1395.6","0.3","296.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C27 H33 Br N2 O7 S -","- C27 H32 Br N2 O7 S -","- C54 H64 Br2 N4 O14 S2 -","2","1","","Horiguchi, Masahiro; Okuhara, Shinichiro; Shimano, Eiji; Fujimoto, Daisuke; Takahashi, Hiroki; Tsue, Hirohito; Tamura, Rui","Mechanistic Flexibility of Solvent-Assisted Solid-to-Solid Polymorphic Transition Causing Preferential Enrichment: Significant Contribution of π/π and CH/π Interactions as Well as Hydrogen Bonds","Crystal Growth & Design","2007","7","9","1643","","10.1021/cg070083w","","","0.71069","MoKα","","","0.1072","","","","0.1877","","","","","","0.968","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511355","6.246","0.004","15.485","0.01","15.505","0.012","110.59","0.05","96.95","0.06","79.95","0.05","1379.4","1.7","296.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C27 H33 Cl N2 O7 S -","- C27 H32 Cl N2 O7 S -","- C54 H64 Cl2 N4 O14 S2 -","2","1","","Horiguchi, Masahiro; Okuhara, Shinichiro; Shimano, Eiji; Fujimoto, Daisuke; Takahashi, Hiroki; Tsue, Hirohito; Tamura, Rui","Mechanistic Flexibility of Solvent-Assisted Solid-to-Solid Polymorphic Transition Causing Preferential Enrichment: Significant Contribution of π/π and CH/π Interactions as Well as Hydrogen Bonds","Crystal Growth & Design","2007","7","9","1643","","10.1021/cg070083w","","","0.71075","MoKα","","","0.0806","","","","0.1194","","","","","","0.999","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4511356","19.451","0.001","10.994","0.001","15.087","0.001","90","","121.24","0.01","90","","2758.5","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H20 N4 O16 Zr -","- C28 H20 N4 O16 Zr -","- C112 H80 N16 O64 Zr4 -","4","0.5","","Imaz, Inhar; Thillet, Anthony; Sutter, Jean-Pascal","Charge-Assisted Hydrogen-Bonded Assemblage of an Anionic {M(C2O4)4}4-Building Unit and Organic Cations: A Versatile Approach to Hybrid Supramolecular Architectures","Crystal Growth & Design","2007","7","9","1753","","10.1021/cg060905+","","","0.71073","MoKα","","0.09","0.072","","","0.2311","0.2593","","","","","","1.237","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511357","9.983","0.001","21.343","0.002","17.433","0.002","90","","103.2","0.04","90","","3616.3","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H32 N4 O18 Zr -","- C32 H32 N4 O18 Zr -","- C128 H128 N16 O72 Zr4 -","4","0.5","","Imaz, Inhar; Thillet, Anthony; Sutter, Jean-Pascal","Charge-Assisted Hydrogen-Bonded Assemblage of an Anionic {M(C2O4)4}4-Building Unit and Organic Cations: A Versatile Approach to Hybrid Supramolecular Architectures","Crystal Growth & Design","2007","7","9","1753","","10.1021/cg060905+","","","0.71073","MoKα","","0.0532","0.0432","","","0.1324","0.1584","","","","","","1.178","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4511358","8.796","0.005","10.674","0.005","19.617","0.008","90","","101.95","0.04","90","","1801.9","1.5","180","2","180","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C32 H32 N4 O20 Zr -","- C32 H32 N4 O20 Zr -","- C64 H64 N8 O40 Zr2 -","2","0.5","","Imaz, Inhar; Thillet, Anthony; Sutter, Jean-Pascal","Charge-Assisted Hydrogen-Bonded Assemblage of an Anionic {M(C2O4)4}4-Building Unit and Organic Cations: A Versatile Approach to Hybrid Supramolecular Architectures","Crystal Growth & Design","2007","7","9","1753","","10.1021/cg060905+","","","0.71073","MoKα","","0.0295","0.0273","","","0.079","0.088","","","","","","1.206","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4511359","18.167","0.003","11.556","0.003","13.384","0.003","90","","91.3","0.08","90","","2809.1","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H24 N8 O16 Zr -","- C24 H24 N8 O16 Zr -","- C96 H96 N32 O64 Zr4 -","4","0.5","","Imaz, Inhar; Thillet, Anthony; Sutter, Jean-Pascal","Charge-Assisted Hydrogen-Bonded Assemblage of an Anionic {M(C2O4)4}4-Building Unit and Organic Cations: A Versatile Approach to Hybrid Supramolecular Architectures","Crystal Growth & Design","2007","7","9","1753","","10.1021/cg060905+","","","0.71073","MoKα","","0.0643","0.0371","","","0.0977","0.1398","","","","","","1.203","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4511360","7.729","0.001","11.696","0.001","16.978","0.001","74.42","0.09","83.32","0.01","72.45","0.07","1408.5","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H54 N8 O39 Zr2 -","- C40 H54 N8 O39 Zr2 -","- C40 H54 N8 O39 Zr2 -","1","0.5","","Imaz, Inhar; Thillet, Anthony; Sutter, Jean-Pascal","Charge-Assisted Hydrogen-Bonded Assemblage of an Anionic {M(C2O4)4}4-Building Unit and Organic Cations: A Versatile Approach to Hybrid Supramolecular Architectures","Crystal Growth & Design","2007","7","9","1753","","10.1021/cg060905+","","","0.71073","MoKα","","0.131","0.0674","","","0.1503","0.1881","","","","","","1.147","","","","has coordinates","179660","2020-10-21","18:00:00",""
"4511361","15.3204","0.0002","8.9683","0.001","21.3005","0.0004","90","","109.577","0.001","90","","2757.5","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H28 N4 O20 Zr -","- C20 H28 N4 O20 Zr -","- C80 H112 N16 O80 Zr4 -","4","1","","Imaz, Inhar; Thillet, Anthony; Sutter, Jean-Pascal","Charge-Assisted Hydrogen-Bonded Assemblage of an Anionic {M(C2O4)4}4-Building Unit and Organic Cations: A Versatile Approach to Hybrid Supramolecular Architectures","Crystal Growth & Design","2007","7","9","1753","","10.1021/cg060905+","","","0.71073","MoKα","","0.0686","0.035","","","0.0905","0.1336","","","","","","1.139","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4511362","9.039","0.004","13.392","0.006","19.109","0.006","90","","98.3","0.03","90","","2288.9","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H26 N4 O17 Zr -","- C16 H26 N4 O17 Zr -","- C64 H104 N16 O68 Zr4 -","4","1","","Imaz, Inhar; Thillet, Anthony; Sutter, Jean-Pascal","Charge-Assisted Hydrogen-Bonded Assemblage of an Anionic {M(C2O4)4}4-Building Unit and Organic Cations: A Versatile Approach to Hybrid Supramolecular Architectures","Crystal Growth & Design","2007","7","9","1753","","10.1021/cg060905+","","","0.71073","MoKα","","0.1066","0.0582","","","0.1355","0.2079","","","","","","1.1","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4511363","10.247","0.002","12.096","0.002","13.312","0.002","90","","90.92","0.06","90","","1649.8","0.5","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C28 H23 K N4 O22 Zr -","- C28 H23 K N4 O22 Zr -","- C56 H46 K2 N8 O44 Zr2 -","2","0.5","","Imaz, Inhar; Thillet, Anthony; Sutter, Jean-Pascal","Charge-Assisted Hydrogen-Bonded Assemblage of an Anionic {M(C2O4)4}4-Building Unit and Organic Cations: A Versatile Approach to Hybrid Supramolecular Architectures","Crystal Growth & Design","2007","7","9","1753","","10.1021/cg060905+","","","0.71073","MoKα","","0.0562","0.0333","","","0.0917","0.1403","","","","","","1.253","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7004821","9.8914","0.0006","9.8914","","7.3184","0.0005","90","","90","","120","","620.1","0.06","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ge La1.44 O4.39 Sr0.23 -","- Ge La1.44167 O4.389 Sr0.225 -","- Ge6 La8.65 O26.334 Sr1.35 -","6","0.5","","León-Reina, L; Porras-Vázquez, J M; Losilla, E. R.; Sheptyakov, D. V.; Llobet, A.; Aranda, M. A. G.","Low temperature crystal structures of apatite oxygen-conductors containing interstitial oxygen.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2058","2064","","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004822","9.69541","0.00016","9.69541","","7.21843","0.00012","90","","90","","120","","587.632","0.014","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- La4.32 O13.13 Si3 Sr0.68 -","- La4.325 O13.1266 Si3 Sr0.675 -","- La8.65 O26.2532 Si6 Sr1.35 -","2","0.166667","","León-Reina, L; Porras-Vázquez, J M; Losilla, E. R.; Sheptyakov, D. V.; Llobet, A.; Aranda, M. A. G.","Low temperature crystal structures of apatite oxygen-conductors containing interstitial oxygen.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2058","2064","","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004823","9.7158","0.0005","9.7158","","7.1884","0.0004","90","","90","","120","","587.65","0.04","","","","","","","","","","","","3","P 63/m","-P 6c","176","","","","- La1.55 O4.33 Si -","- La1.555 O4.3334 Si -","- La9.33 O26.0004 Si6 -","6","0.5","","León-Reina, L; Porras-Vázquez, J M; Losilla, E. R.; Sheptyakov, D. V.; Llobet, A.; Aranda, M. A. G.","Low temperature crystal structures of apatite oxygen-conductors containing interstitial oxygen.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2058","2064","","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004827","20.463","0.004","14.819","0.003","23.023","0.005","90","","111.75","0.03","90","","6485","3","220","2","220","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C60 H66 Co N6 O18 Zn2 -","- C60 H66 Co N6 O18 Zn2 -","- C240 H264 Co4 N24 O72 Zn8 -","4","1","","Wang, Yonghui; Bredenkötter, Björn; Rieger, Bernhard; Volkmer, Dirk","Two-dimensional metal-organic frameworks (MOFs) constructed from heterotrinuclear coordination units and 4,4'-biphenyldicarboxylate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","6","689","696","10.1039/b609733b","","x-ray","0.71073","MoKα","","0.1376","0.0755","","","0.1814","0.2047","","","","","","1.015","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004828","11.491","0.002","14.837","0.003","19.386","0.004","90","","101.53","0.03","90","","3238.5","1.1","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C60 H66 Cd N6 O18 Zn2 -","- C60 H66 Cd N6 O18 Zn2 -","- C120 H132 Cd2 N12 O36 Zn4 -","2","0.5","","Wang, Yonghui; Bredenkötter, Björn; Rieger, Bernhard; Volkmer, Dirk","Two-dimensional metal-organic frameworks (MOFs) constructed from heterotrinuclear coordination units and 4,4'-biphenyldicarboxylate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","6","689","696","10.1039/b609733b","","x-ray","0.71073","MoKα","","0.0701","0.0501","","","0.1442","0.1537","","","","","","1.023","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004829","11.67","0.002","14.742","0.003","19.391","0.004","90","","102.29","0.03","90","","3259.6","1.2","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C60 H66 N6 Ni O18 Zn2 -","- C60 H66 N6 Ni O18 Zn2 -","- C120 H132 N12 Ni2 O36 Zn4 -","2","0.5","","Wang, Yonghui; Bredenkötter, Björn; Rieger, Bernhard; Volkmer, Dirk","Two-dimensional metal-organic frameworks (MOFs) constructed from heterotrinuclear coordination units and 4,4'-biphenyldicarboxylate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","6","689","696","10.1039/b609733b","","x-ray","0.71073","MoKα","","0.1252","0.0838","","","0.2247","0.2515","","","","","","1","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004830","11.5367","0.0001","12.4167","0.0002","23.1596","0.0004","90","","91.422","0.001","90","","3316.54","0.08","293","2","293","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C48 H87 Mn4 N5 O24 -","- C48 H87 Mn4 N5 O24 -","- C96 H174 Mn8 N10 O48 -","2","1","","Huang, Deguang; Zhang, Xiaofeng; Ma, Chengbing; Chen, Hui; Chen, Changneng; Liu, Qiutian; Zhang, Chunxi; Liao, Daizheng; Li, Licun","Aggregation of tetranuclear Mn building blocks with alkali ion. Syntheses, crystal structures and chemical behaviors of monomer, dimer and polymer containing [Mn4(mu3-O)2]8+ units.","Dalton transactions (Cambridge, England : 2003)","2007","","6","680","688","10.1039/b609948c","","","0.71073","MoKα","","0.0811","0.0615","","","0.1278","0.1499","","","","","","1.283","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004831","22.3403","0.0001","14.8704","0.0001","26.4903","0.0004","90","","90","","90","","8800.32","0.15","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C30 H36 K Mn4 N7 O20 -","- C30 H27 K Mn4 N7 O20 -","- C240 H216 K8 Mn32 N56 O160 -","8","1","","Huang, Deguang; Zhang, Xiaofeng; Ma, Chengbing; Chen, Hui; Chen, Changneng; Liu, Qiutian; Zhang, Chunxi; Liao, Daizheng; Li, Licun","Aggregation of tetranuclear Mn building blocks with alkali ion. Syntheses, crystal structures and chemical behaviors of monomer, dimer and polymer containing [Mn4(mu3-O)2]8+ units.","Dalton transactions (Cambridge, England : 2003)","2007","","6","680","688","10.1039/b609948c","","","0.71073","MoKα","","0.0709","0.045","","","0.1005","0.121","","","","","","1.217","","","","has coordinates,has disorder","179752","2020-10-21","18:00:00",""
"7004832","23.3702","0.0002","25.8446","0.0005","16.3161","0.0002","90","","123.979","0.001","90","","8172","0.2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C58 H77 Cl0 K Mn8 N10 O40 -","- C58 H74 K Mn8 N10 O40 -","- C232 H296 K4 Mn32 N40 O160 -","4","0.5","","Huang, Deguang; Zhang, Xiaofeng; Ma, Chengbing; Chen, Hui; Chen, Changneng; Liu, Qiutian; Zhang, Chunxi; Liao, Daizheng; Li, Licun","Aggregation of tetranuclear Mn building blocks with alkali ion. Syntheses, crystal structures and chemical behaviors of monomer, dimer and polymer containing [Mn4(mu3-O)2]8+ units.","Dalton transactions (Cambridge, England : 2003)","2007","","6","680","688","10.1039/b609948c","","","0.71073","MoKα","","0.0626","0.0452","","","0.1035","0.1169","","","","","","1.104","","","","has coordinates,has disorder","179752","2020-10-21","18:00:00",""
"7004833","22.861","0.005","25.778","0.005","16.294","0.003","90","","122.94","0.03","90","","8059","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C58 H77 Mn8 N10 Na O40 -","- C58 H74 Mn8 N10 Na O40 -","- C232 H296 Mn32 N40 Na4 O160 -","4","0.5","","Huang, Deguang; Zhang, Xiaofeng; Ma, Chengbing; Chen, Hui; Chen, Changneng; Liu, Qiutian; Zhang, Chunxi; Liao, Daizheng; Li, Licun","Aggregation of tetranuclear Mn building blocks with alkali ion. Syntheses, crystal structures and chemical behaviors of monomer, dimer and polymer containing [Mn4(mu3-O)2]8+ units.","Dalton transactions (Cambridge, England : 2003)","2007","","6","680","688","10.1039/b609948c","","","0.71073","MoKα","","0.061","0.0376","","","0.0942","0.1016","","","","","","0.94","","","","has coordinates,has disorder","179752","2020-10-21","18:00:00",""
"7004834","7.304","0.003","13.015","0.003","13.057","0.003","72.148","0.019","76.32","0.03","81.02","0.03","1143.2","0.6","280","2","280","2","","","","","","","","6","P -1","-P 1","2","[Pt{4'-(Ph)terpy}CN]BF4","","","- C24 H18 B F4 N5 Pt -","- C24 H18 B F4 N5 Pt -","- C48 H36 B2 F8 N10 Pt2 -","2","1","","Field, John S.; Haines, Raymond J.; Ledwaba, Lesibana P.; McGuire, Jr, Robert; Munro, Orde Q.; Low, Murray R.; McMillin, David R.","Synthesis, electrochemistry and luminescence of [Pt{4'-(R)trpy}(CN)](+) (R = Ph, o-CH(3)C(6)H(4), o-ClC(6)H(4) or o-CF(3)C(6)H(4); trpy = 2,2':6',2''-terpyridine): crystal structure of [Pt{4'-(Ph)trpy}(CN)]BF(4) x CH(3)CN.","Dalton transactions (Cambridge, England : 2003)","2007","","2","192","199","10.1039/b611244g","","","0.71073","MoKα","","0.0644","0.0553","","","0.154","0.1599","","","","","","1.103","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004835","12.264","0.0004","13.959","0.0005","30.07","0.001","90","","90","","90","","5147.8","0.3","150","","150","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C47 H53 B F12 N8 P2 Ru S3 -","- C47 H53 B F12 N8 P2 Ru S3 -","- C188 H212 B4 F48 N32 P8 Ru4 S12 -","4","1","","Bailey, Philip J.; McCormack, Chiara; Parsons, Simon; Rudolphi, Felix; Perucha, Alejandro Sanchez; Wood, Peter","Tripodal borate ligands from tris(dimethylamino)borane: the first synthesis of a chiral tris(methimazolyl)borate ligand, and the crystal structure of a single diastereomer pseudo-C3-symmetric Ru(II) complex.","Dalton transactions (Cambridge, England : 2003)","2007","","4","476","480","10.1039/b611331a","","","0.71073","MoKα","","0.0664","0.0648","","","0.1295","0.13","","","","","","1.346","","","","has coordinates,has disorder","179752","2020-10-21","18:00:00",""
"7004836","12.0739","0.0002","11.4142","0.0002","25.3935","0.0004","90","","99.3207","0.0007","90","","3453.37","0.1","150","","150","","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H35 N5 O P Re S4 -","- C30 H35 N5 O P Re S4 -","- C120 H140 N20 O4 P4 Re4 S16 -","4","1","","Cowley, Andrew R.; Dilworth, Jonathan R.; Donnelly, Paul S.; Ross, Susan J.","Rhenium diazenide ternary complexes with dithiocarbamate ligands: towards new rhenium radiopharmaceuticals.","Dalton transactions (Cambridge, England : 2003)","2007","","1","73","82","10.1039/B611403B","","","0.71073","MoKα","","","0.0347","","","","0.0403","","","","","","1.0398","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004837","11.4395","0.0003","12.0609","0.0003","14.285","0.0004","78.9889","0.001","75.11","0.001","86.1885","0.0013","1869.35","0.09","150","","150","","","","","","","","synthesis as described","8","P -1","-P 1","2","","","","- C34 H37 Cl2 N5 O2 P Re S4 -","- C34 H37 Cl2 N5 O2 P Re S4 -","- C68 H74 Cl4 N10 O4 P2 Re2 S8 -","2","1","","Cowley, Andrew R.; Dilworth, Jonathan R.; Donnelly, Paul S.; Ross, Susan J.","Rhenium diazenide ternary complexes with dithiocarbamate ligands: towards new rhenium radiopharmaceuticals.","Dalton transactions (Cambridge, England : 2003)","2007","","1","73","82","10.1039/B611403B","","","0.71073","MoKα","","","0.0365","","","","0.0382","","","","","","1.0793","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004838","16.1725","0.0004","10.597","0.0003","18.8348","0.0005","90","","90","","90","","3227.91","0.15","150","","150","","","","","","","","synthesis as described","7","P c a 21","P 2c -2ac","29","","","","- C31 H32 N4 O P Re S4 -","- C31 H32 N4 O P Re S4 -","- C124 H128 N16 O4 P4 Re4 S16 -","4","1","","Cowley, Andrew R.; Dilworth, Jonathan R.; Donnelly, Paul S.; Ross, Susan J.","Rhenium diazenide ternary complexes with dithiocarbamate ligands: towards new rhenium radiopharmaceuticals.","Dalton transactions (Cambridge, England : 2003)","2007","","1","73","82","10.1039/B611403B","","","0.71073","MoKα","","0.0569","0.0353","","0.0638","0.0399","0.0399","","","","","","1.0889","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004839","33.1722","0.0004","11.2208","0.0002","25.2507","0.0003","90","","129.797","0.0006","90","","7221.26","0.19","150","","150","","","","","","","","synthesis as described","8","C 1 2/c 1","-C 2yc","15","","","","- C32.5 H37.5 Cl N4 O1.25 P Re S4 -","- C32.501 H37.5015 Cl0.998 N4 O1.2505 P Re S4 -","- C260.008 H300.012 Cl7.984 N32 O10.004 P8 Re8 S32 -","8","1","","Cowley, Andrew R.; Dilworth, Jonathan R.; Donnelly, Paul S.; Ross, Susan J.","Rhenium diazenide ternary complexes with dithiocarbamate ligands: towards new rhenium radiopharmaceuticals.","Dalton transactions (Cambridge, England : 2003)","2007","","1","73","82","10.1039/B611403B","","","0.71073","MoKα","","","0.0337","","","","0.0418","","","","","","0.992","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004840","13.71","0.0002","17.5722","0.0002","20.1587","0.0003","90","","93.2214","0.0008","90","","4848.86","0.12","150","","150","","","","","","","","synthesis as described","8","P 1 21/c 1","-P 2ybc","14","","","","- C43 H40 Cl6 N4 O P Re S4 -","- C43 H40 Cl6 N4 O P Re S4 -","- C172 H160 Cl24 N16 O4 P4 Re4 S16 -","4","1","","Cowley, Andrew R.; Dilworth, Jonathan R.; Donnelly, Paul S.; Ross, Susan J.","Rhenium diazenide ternary complexes with dithiocarbamate ligands: towards new rhenium radiopharmaceuticals.","Dalton transactions (Cambridge, England : 2003)","2007","","1","73","82","10.1039/B611403B","","","0.71073","MoKα","","","0.0338","","","","0.0385","","","","","","1.0473","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004841","16.7286","0.0002","9.6479","0.0002","24.879","0.0003","90","","93.653","0.0004","90","","4007.21","0.11","150","","150","","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C44 H41 Cl2 N4 O P2 Re -","- C44 H41 Cl2 N4 O P2 Re -","- C176 H164 Cl8 N16 O4 P8 Re4 -","4","1","","Cowley, Andrew R.; Dilworth, Jonathan R.; Donnelly, Paul S.; Ross, Susan J.","Rhenium diazenide ternary complexes with dithiocarbamate ligands: towards new rhenium radiopharmaceuticals.","Dalton transactions (Cambridge, England : 2003)","2007","","1","73","82","10.1039/B611403B","","","0.71073","MoKα","","","0.0278","","","","0.0311","","","","","","1.0528","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004842","18.243","0.004","10.0941","0.0016","14.012","0.0015","90","","116.552","0.003","90","","2308.1","0.7","173","2","173","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C20 H28 B Cl N6 O W -","- C20 H28 B Cl N6 O W -","- C80 H112 B4 Cl4 N24 O4 W4 -","4","1","","Adams, Christopher J.; Bartlett, Ian M.; Carlton, Susannah; Connelly, Neil G.; Harding, David J.; Hayward, Owen D.; Orpen, A. Guy; Patron, Elena; Ray, Christopher D.; Rieger, Philip H.","The d4/d3 redox pairs [MX(CO)(eta-RC[triple bond, length as m-dash]CR)Tp']z (z=0 and 1): structural consequences of electron transfer and implications for the inverse halide order.","Dalton transactions (Cambridge, England : 2003)","2007","","1","62","72","10.1039/b611472e","","","0.71073","MoKα","","0.0363","0.0265","","","0.0437","0.0457","","","","","","0.923","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004843","8.1371","0.001","11.77","0.003","13.3634","0.0015","87.723","0.007","84.451","0.012","85.235","0.012","1268.8","0.4","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C20 H28 B2 Cl F4 N6 O W -","- C20 H28 B2 Cl F4 N6 O W -","- C40 H56 B4 Cl2 F8 N12 O2 W2 -","2","1","","Adams, Christopher J.; Bartlett, Ian M.; Carlton, Susannah; Connelly, Neil G.; Harding, David J.; Hayward, Owen D.; Orpen, A. Guy; Patron, Elena; Ray, Christopher D.; Rieger, Philip H.","The d4/d3 redox pairs [MX(CO)(eta-RC[triple bond, length as m-dash]CR)Tp']z (z=0 and 1): structural consequences of electron transfer and implications for the inverse halide order.","Dalton transactions (Cambridge, England : 2003)","2007","","1","62","72","10.1039/b611472e","","","0.71073","MoKα","","0.0255","0.0199","","","0.0406","0.0415","","","","","","0.966","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004844","10.297","0.003","11.663","0.002","13.9347","0.0016","88.343","0.01","70.03","0.02","78.054","0.009","1537.2","0.6","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C24 H36 B Br Cl3 N6 O W -","- C24 H36 B Br Cl3 N6 O W -","- C48 H72 B2 Br2 Cl6 N12 O2 W2 -","2","1","","Adams, Christopher J.; Bartlett, Ian M.; Carlton, Susannah; Connelly, Neil G.; Harding, David J.; Hayward, Owen D.; Orpen, A. Guy; Patron, Elena; Ray, Christopher D.; Rieger, Philip H.","The d4/d3 redox pairs [MX(CO)(eta-RC[triple bond, length as m-dash]CR)Tp']z (z=0 and 1): structural consequences of electron transfer and implications for the inverse halide order.","Dalton transactions (Cambridge, England : 2003)","2007","","1","62","72","10.1039/b611472e","","","0.71073","MoKα","","0.0475","0.039","","","0.0945","0.0974","","","","","","0.997","","","","has coordinates,has disorder","179752","2020-10-21","18:00:00",""
"7004845","8.1498","0.0015","11.8631","0.0019","13.4742","0.0014","89.028","0.01","85.677","0.007","85.247","0.011","1294.5","0.3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C20 H28 B2 Br F4 N6 O W -","- C20 H28 B2 Br F4 N6 O W -","- C40 H56 B4 Br2 F8 N12 O2 W2 -","2","1","","Adams, Christopher J.; Bartlett, Ian M.; Carlton, Susannah; Connelly, Neil G.; Harding, David J.; Hayward, Owen D.; Orpen, A. Guy; Patron, Elena; Ray, Christopher D.; Rieger, Philip H.","The d4/d3 redox pairs [MX(CO)(eta-RC[triple bond, length as m-dash]CR)Tp']z (z=0 and 1): structural consequences of electron transfer and implications for the inverse halide order.","Dalton transactions (Cambridge, England : 2003)","2007","","1","62","72","10.1039/b611472e","","","0.71073","MoKα","","0.0375","0.0293","","","0.0571","0.0583","","","","","","0.89","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004846","12.209","0.003","17.02","0.004","13.196","0.003","90","0.006","115.095","0.005","90","0.006","2483.3","1","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C21 H28 B N7 O S W -","- C21 H28 B N7 O S W -","- C84 H112 B4 N28 O4 S4 W4 -","4","1","","Adams, Christopher J.; Bartlett, Ian M.; Carlton, Susannah; Connelly, Neil G.; Harding, David J.; Hayward, Owen D.; Orpen, A. Guy; Patron, Elena; Ray, Christopher D.; Rieger, Philip H.","The d4/d3 redox pairs [MX(CO)(eta-RC[triple bond, length as m-dash]CR)Tp']z (z=0 and 1): structural consequences of electron transfer and implications for the inverse halide order.","Dalton transactions (Cambridge, England : 2003)","2007","","1","62","72","10.1039/b611472e","","","0.71073","MoKα","","0.1533","0.0539","","","0.0689","0.0876","","","","","","0.865","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004847","9.6165","0.0013","15.04","0.002","10.4448","0.0014","90","","111.16","0.002","90","","1408.8","0.3","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C16 H18 Au4 Co2 N16 -","- C16 H6 Au4 Co2 N16 -","- C32 H12 Au8 Co4 N32 -","2","0.25","","Suárez-Varela, José; Sakiyama, Hiroshi; Cano, Joan; Colacio, Enrique","Interplay between covalent and aurophilic interactions in a series of isostructural 3D Hoffman-like frameworks containing bipyrimidine and dicyanoaurate bridges. X-Ray structure and magnetic properties of {(mu-Au(CN)(2)](2)[(M(NH(3))(2))(2)(mu-bpym)]}[Au(CN)(2)](2) (M = Ni(II), Co(II) and Cu(II)).","Dalton transactions (Cambridge, England : 2003)","2007","","2","249","256","10.1039/b611684a","","","0.71073","MoKα","","0.0273","0.0229","","","0.0524","0.0539","","","","","","1.076","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004848","9.5057","0.0011","14.9669","0.0017","10.3484","0.0012","90","","110.275","0.002","90","","1381.1","0.3","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C16 H18 Au4 N16 Ni2 O0 -","- C16 H6 Au4 N16 Ni2 -","- C32 H12 Au8 N32 Ni4 -","2","0.25","","Suárez-Varela, José; Sakiyama, Hiroshi; Cano, Joan; Colacio, Enrique","Interplay between covalent and aurophilic interactions in a series of isostructural 3D Hoffman-like frameworks containing bipyrimidine and dicyanoaurate bridges. X-Ray structure and magnetic properties of {(mu-Au(CN)(2)](2)[(M(NH(3))(2))(2)(mu-bpym)]}[Au(CN)(2)](2) (M = Ni(II), Co(II) and Cu(II)).","Dalton transactions (Cambridge, England : 2003)","2007","","2","249","256","10.1039/b611684a","","","0.71073","MoKα","","0.0831","0.0774","","","0.1913","0.1944","","","","","","1.084","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004849","9.5517","0.0012","15.1144","0.0018","10.511","0.0013","90","","113.722","0.002","90","","1389.2","0.3","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C16 H18 Au4 Cu2 N16 -","- C16 H6 Au4 Cu2 N16 -","- C32 H12 Au8 Cu4 N32 -","2","0.25","","Suárez-Varela, José; Sakiyama, Hiroshi; Cano, Joan; Colacio, Enrique","Interplay between covalent and aurophilic interactions in a series of isostructural 3D Hoffman-like frameworks containing bipyrimidine and dicyanoaurate bridges. X-Ray structure and magnetic properties of {(mu-Au(CN)(2)](2)[(M(NH(3))(2))(2)(mu-bpym)]}[Au(CN)(2)](2) (M = Ni(II), Co(II) and Cu(II)).","Dalton transactions (Cambridge, England : 2003)","2007","","2","249","256","10.1039/b611684a","","","0.71073","MoKα","","0.0858","0.0799","","","0.1827","0.1875","","","","","","1.084","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004850","15.532","0.0005","11.9704","0.0004","20.2072","0.0007","90","","103.215","0.001","90","","3657.5","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H48 Br5 N3 O3 Re -","- C24 H48 Br5 N3 O3 Re -","- C96 H192 Br20 N12 O12 Re4 -","4","1","","Cuevas, Alicia; Kremer, Carlos; Hummert, Markus; Schumann, Herbert; Lloret, Francesc; Julve, Miguel; Faus, Juan","Magnetic properties and molecular structures of binuclear (2-pyrazinecarboxylate)-bridged complexes containing Re(IV) and M(II) (M = Co, Ni).","Dalton transactions (Cambridge, England : 2003)","2007","","3","342","350","10.1039/b611888g","","","0.71073","MoKα","","0.2295","0.0775","","","0.1079","0.149","","","","","","0.948","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004851","23.399","0.005","17.198","0.005","20.778","0.005","90","","102.377","0.005","90","","8167","4","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C37 H33 Br5 N8 Ni O2 Re -","- C37 H33 Br5 N8 Ni O2 Re -","- C296 H264 Br40 N64 Ni8 O16 Re8 -","8","1","","Cuevas, Alicia; Kremer, Carlos; Hummert, Markus; Schumann, Herbert; Lloret, Francesc; Julve, Miguel; Faus, Juan","Magnetic properties and molecular structures of binuclear (2-pyrazinecarboxylate)-bridged complexes containing Re(IV) and M(II) (M = Co, Ni).","Dalton transactions (Cambridge, England : 2003)","2007","","3","342","350","10.1039/b611888g","","","0.71069","MoKα","","0.1346","0.0597","","","0.0954","0.1185","","","","","","1.008","","","","has coordinates,has disorder","179752","2020-10-21","18:00:00",""
"7004852","23.483","0.003","17.0434","0.0016","20.7","0.003","90","","101.962","0.016","90","","8104.9","1.8","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C37 H33 Br5 Co N8 O2 Re -","- C37 H33 Br5 Co N8 O2 Re -","- C296 H264 Br40 Co8 N64 O16 Re8 -","8","1","","Cuevas, Alicia; Kremer, Carlos; Hummert, Markus; Schumann, Herbert; Lloret, Francesc; Julve, Miguel; Faus, Juan","Magnetic properties and molecular structures of binuclear (2-pyrazinecarboxylate)-bridged complexes containing Re(IV) and M(II) (M = Co, Ni).","Dalton transactions (Cambridge, England : 2003)","2007","","3","342","350","10.1039/b611888g","","","0.71073","MoKα","","0.0332","0.0225","","","0.0466","0.0483","","","","","","0.922","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004853","16.771","0.009","17.947","0.008","7.952","0.004","90","","104.58","0.02","90","","2316","2","296","2","296","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","trans(Cl,Cl)cis(P,P)-dichlorobis((3- aminopropyl)dimethylphosphine)cobalt(iii) hexafluorophosphate acetonitrile solvate","trans(Cl,Cl)cis(P,P)-dichlorobis((3-aminopropyl)dimethylphosphine)cobalt(III) hexafluorophosphate acetonitrile solvate","","- C12 H31 Cl2 Co F6 N3 P3 -","- C12 H31 Cl2 Co F6 N3 P3 -","- C48 H124 Cl8 Co4 F24 N12 P12 -","4","0.5","","Suzuki, Takayoshi; Fujiiwara, Katsuhiro; Takagi, Hideo D.; Kashiwabara, Kazuo","Preparation and characterization of mixed-ligand cobalt(III) complexes containing (3-aminopropyl)dimethylphosphine (pdmp). Conformation of the six-membered pdmp chelate ring.","Dalton transactions (Cambridge, England : 2003)","2007","","3","308","319","10.1039/b612025c","","","0.71075","MoKα","","0.061","0.0543","","","0.166","0.1745","","","","","","1.161","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004854","8.178","0.011","10.073","0.013","12.811","0.016","105.659","0.012","94.09","0.02","98.15","0.02","999","2","193","2","193","2","","","","","","","","7","P -1","-P 1","2","trans(Cl,Cl)cis(P,P)-dichlorobis((3- aminopropyl)dimethylphosphine)cobalt(iii) hexafluorophosphate","trans(Cl,Cl)cis(P,P)-dichlorobis((3-aminopropyl)dimethylphosphine)cobalt(III) hexafluorophosphate","","- C10 H28 Cl2 Co F6 N2 P3 -","- C10 H28 Cl2 Co F6 N2 P3 -","- C20 H56 Cl4 Co2 F12 N4 P6 -","2","1","","Suzuki, Takayoshi; Fujiiwara, Katsuhiro; Takagi, Hideo D.; Kashiwabara, Kazuo","Preparation and characterization of mixed-ligand cobalt(III) complexes containing (3-aminopropyl)dimethylphosphine (pdmp). Conformation of the six-membered pdmp chelate ring.","Dalton transactions (Cambridge, England : 2003)","2007","","3","308","319","10.1039/b612025c","","","0.7107","MoKα","","0.059","0.0421","","","0.0908","0.0985","","","","","","1.078","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004855","11.4228","0.0015","11.4228","0.0015","18.262","0.003","90","","90","","90","","2382.8","0.6","296","2","296","2","","","","","","","","6","P 42/n b c :2","-P 4ac 2b","133","trans-Dichlorobis(1,3- bis(dimethylphosphino)propane)cobalt(iii) Perchlorate","trans-Dichlorobis(1,3-bis(dimethylphosphino)propane)cobalt(III) Perchlorate","","- C14 H36 Cl3 Co O4 P4 -","- C14 H36 Cl3 Co O4 P4 -","- C56 H144 Cl12 Co4 O16 P16 -","4","0.25","","Suzuki, Takayoshi; Fujiiwara, Katsuhiro; Takagi, Hideo D.; Kashiwabara, Kazuo","Preparation and characterization of mixed-ligand cobalt(III) complexes containing (3-aminopropyl)dimethylphosphine (pdmp). Conformation of the six-membered pdmp chelate ring.","Dalton transactions (Cambridge, England : 2003)","2007","","3","308","319","10.1039/b612025c","","","0.71069","MoKα","","0.0656","0.0427","","","0.122","0.1354","","","","","","1.095","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004856","10.6831","0.0013","12.793","0.003","7.807","0.002","107.309","0.019","96.862","0.017","88.801","0.016","1011.2","0.4","296","2","296","2","","","","","","","","7","P -1","-P 1","2","Bis(1,2-diaminoethane)((3- aminopropyl)dimethylphosphine)cobalt(iii) Dichloride Hexafluorophosphate","Bis(1,2-diaminoethane)((3-aminopropyl)dimethylphosphine)cobalt(III) Dichloride Hexafluorophosphate","","- C9 H30 Cl2 Co F6 N5 P2 -","- C9 H30 Cl2 Co F6 N5 P2 -","- C18 H60 Cl4 Co2 F12 N10 P4 -","2","1","","Suzuki, Takayoshi; Fujiiwara, Katsuhiro; Takagi, Hideo D.; Kashiwabara, Kazuo","Preparation and characterization of mixed-ligand cobalt(III) complexes containing (3-aminopropyl)dimethylphosphine (pdmp). Conformation of the six-membered pdmp chelate ring.","Dalton transactions (Cambridge, England : 2003)","2007","","3","308","319","10.1039/b612025c","","","0.71069","MoKα","","0.0634","0.0434","","","0.1241","0.135","","","","","","1.036","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004857","10.924","0.005","15.016","0.005","13.904","0.005","90","","90.129","0.017","90","","2280.7","1.5","296","2","296","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","Bis(N,N-dimethyldithiocarbamato)((3- aminopropyl)dimethylphosphine)cobalt(iii) Hexafluorophosphate","Bis(N,N-dimethyldithiocarbamato)((3-aminopropyl)dimethylphosphine)cobalt(III) Hexafluorophosphate","","- C11 H26 Co F6 N3 P2 S4 -","- C11 H26 Co F6 N3 P2 S4 -","- C44 H104 Co4 F24 N12 P8 S16 -","4","1","","Suzuki, Takayoshi; Fujiiwara, Katsuhiro; Takagi, Hideo D.; Kashiwabara, Kazuo","Preparation and characterization of mixed-ligand cobalt(III) complexes containing (3-aminopropyl)dimethylphosphine (pdmp). Conformation of the six-membered pdmp chelate ring.","Dalton transactions (Cambridge, England : 2003)","2007","","3","308","319","10.1039/b612025c","","","0.71075","MoKα","","0.0397","0.0361","","","0.1116","0.1148","","","","","","1.091","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004858","17.854","0.004","14.294","0.004","22.041","0.005","90","","93.825","0.009","90","","5612","2","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","trans(P,N)-(N,N-Dimethyldithiocarbamato)bis((3- aminopropyl)dimethylphosphine) cobalt(iii) Bis(tetraphenylborate)","trans(P,N)-(N,N-Dimethyldithiocarbamato)bis((3-aminopropyl)dimethylphosphine) cobalt(III) Bis(tetraphenylborate)","","- C61 H74 B2 Co N3 P2 S2 -","- C61 H74 B2 Co N3 P2 S2 -","- C244 H296 B8 Co4 N12 P8 S8 -","4","1","","Suzuki, Takayoshi; Fujiiwara, Katsuhiro; Takagi, Hideo D.; Kashiwabara, Kazuo","Preparation and characterization of mixed-ligand cobalt(III) complexes containing (3-aminopropyl)dimethylphosphine (pdmp). Conformation of the six-membered pdmp chelate ring.","Dalton transactions (Cambridge, England : 2003)","2007","","3","308","319","10.1039/b612025c","","","0.71075","MoKα","","0.052","0.0394","","","0.1126","0.1205","","","","","","1.055","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004859","16.765","0.005","11.701","0.003","31.311","0.01","90","","94.258","0.012","90","","6125","3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","trans(P,N)-(pentane-2,4-dionato)bis((3-aminopropyl) dimethylphosphine)cobalt(iii) Bis(hexafluorophospate) Hemi(diethyl ether) Solvate","trans(P,N)-(pentane-2,4-dionato)bis((3-aminopropyl) dimethylphosphine)cobalt(III) Bis(hexafluorophospate) Hemi(diethyl ether) Solvate","","- C17 H40 Co F12 N2 O2.5 P4 -","- C17 H40 Co F12 N2 O2.5 P4 -","- C136 H320 Co8 F96 N16 O20 P32 -","8","2","","Suzuki, Takayoshi; Fujiiwara, Katsuhiro; Takagi, Hideo D.; Kashiwabara, Kazuo","Preparation and characterization of mixed-ligand cobalt(III) complexes containing (3-aminopropyl)dimethylphosphine (pdmp). Conformation of the six-membered pdmp chelate ring.","Dalton transactions (Cambridge, England : 2003)","2007","","3","308","319","10.1039/b612025c","","","0.71075","MoKα","","0.0886","0.0598","","","0.1589","0.1751","","","","","","1.05","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004860","15.177","0.003","16.827","0.002","21.443","0.004","90","","90","","90","","5476.2","1.6","293","2","293","2","","","","","","","","7","I b c a","-I 2b 2c","73","trans(N,N)-(pentane-2,4-dionato)bis((3-aminopropyl) dimethylphosphine)cobalt(iii) Bis(hexafluorophospate)","trans(N,N)-(pentane-2,4-dionato)bis((3-aminopropyl) dimethylphosphine)cobalt(III) Bis(hexafluorophospate)","","- C15 H35 Co F12 N2 O2 P4 -","- C15 H35 Co F12 N2 O2 P4 -","- C120 H280 Co8 F96 N16 O16 P32 -","8","0.5","","Suzuki, Takayoshi; Fujiiwara, Katsuhiro; Takagi, Hideo D.; Kashiwabara, Kazuo","Preparation and characterization of mixed-ligand cobalt(III) complexes containing (3-aminopropyl)dimethylphosphine (pdmp). Conformation of the six-membered pdmp chelate ring.","Dalton transactions (Cambridge, England : 2003)","2007","","3","308","319","10.1039/b612025c","","","0.71075","MoKα","","0.0471","0.0409","","","0.1244","0.1351","","","","","","1.103","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004861","9.9079","0.0004","13.2057","0.0004","16.0316","0.0006","90","","90","","90","","2097.59","0.13","173","2","100","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C9 H27 B Cl5 P3 Pt -","- C9 H27 B Cl5 P3 Pt -","- C36 H108 B4 Cl20 P12 Pt4 -","4","1","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","1.5418","CuKα","","0.0364","0.0333","","","0.0806","0.0823","","","","","","1.044","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004862","11.8318","0.0012","9.7063","0.0009","15.8277","0.0016","90","","92.467","0.002","90","","1816","0.3","173","2","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 B Cl3 P -","- C18 H15 B Cl3 P -","- C72 H60 B4 Cl12 P4 -","4","1","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","0.71074","MoKα","","0.0728","0.0419","","","0.1123","0.1225","","","","","","1.074","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7004863","9.896","0.002","11.707","0.002","12.654","0.003","84.45","0.03","79.32","0.03","85.85","0.03","1431.6","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H52 B2 Cl10 P4 Pt2 -","- C52 H52 B2 Cl10 P4 Pt2 -","- C52 H52 B2 Cl10 P4 Pt2 -","1","0.5","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","","0.71073","MoKα","","0.0694","0.0612","","","0.1365","0.142","","","","","","0.886","","","","has coordinates,has disorder","179752","2020-10-21","18:00:00",""
"7004864","6.2473","0.0007","10.8165","0.0011","17.5194","0.0018","90","","90","","90","","1183.9","0.2","173","2","100","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C8 H11 B Cl3 P -","- C8 H11 B Cl3 P -","- C32 H44 B4 Cl12 P4 -","4","1","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","0.71074","MoKα","","0.0393","0.0287","","","0.0599","0.0635","","","","","","1.006","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7004865","14.229","0.003","16.041","0.003","19.92","0.004","90","","97.22","0.03","90","","4510.6","1.6","100","2","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C43 H74 Cl4 P2 Pt2 -","- C43 H74 Cl4 P2 Pt2 -","- C172 H296 Cl16 P8 Pt8 -","4","0.5","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","0.71074","MoKα","","0.0215","0.0198","","","0.0468","0.0474","","","","","","1.049","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004866","28.471","0.006","11.886","0.002","19.635","0.004","90","","100.45","0.03","90","","6534","2","100","2","100","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H30 B Cl3 P2 Pt -","- C36 H30 B Cl3 P2 Pt -","- C288 H240 B8 Cl24 P16 Pt8 -","8","1","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","0.71074","MoKα","","0.0193","0.0182","","","0.0439","0.0446","","","","","","1.06","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004867","14.938","0.003","10.071","0.002","18.279","0.004","90","","101.18","0.03","90","","2697.7","1","173","2","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 B Cl3 P2 Pt -","- C26 H26 B Cl3 P2 Pt -","- C104 H104 B4 Cl12 P8 Pt4 -","4","1","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","0.71074","MoKα","","0.0227","0.0202","","","0.0562","0.0635","","","","","","1.029","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004868","17.466","0.004","6.0751","0.0012","21.219","0.004","90","","113.81","0.03","90","","2059.9","0.9","173","2","100","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C16 H22 B Cl3 P2 Pt -","- C16 H22 B Cl3 P2 Pt -","- C64 H88 B4 Cl12 P8 Pt4 -","4","2","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","0.71074","MoKα","","0.0299","0.027","","","0.0582","0.064","","","","","","1.063","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004869","11.066","0.002","10.003","0.002","16.371","0.005","90","","129.95","0.02","90","","1389.2","0.7","173","2","100","","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C25 H22 B2 Cl6 P2 -","- C25 H22 B2 Cl6 P2 -","- C50 H44 B4 Cl12 P4 -","2","1","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","0.71074","MoKα","","0.0304","0.0293","","","0.0671","0.0677","","","","","","1.054","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7004870","12.306","0.003","13.214","0.003","20.313","0.004","90","","93.35","0.03","90","","3297.5","1.3","173","2","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H36 B3 Cl9 P4 Pt2 -","- C12 H36 B3 Cl9 P4 Pt2 -","- C48 H144 B12 Cl36 P16 Pt8 -","4","1","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","0.71074","MoKα","","0.0291","0.0248","","","0.0487","0.05","","","","","","1.057","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004871","29.9175","0.0016","20.673","0.0011","11.5155","0.0006","90","","90","","90","","7122.2","0.7","173","2","173","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C31 H40 Cl2 P4 Pt -","- C31 H40 Cl2 P4 Pt -","- C248 H320 Cl16 P32 Pt8 -","8","1","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","0.71074","MoKα","","0.0287","0.0215","","","0.0698","0.0724","","","","","","1.034","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004872","10.125","0.002","11.154","0.002","16.404","0.003","90","","90","","90","","1852.6","0.6","100","2","100","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C10 H28 B Cl2 N P2 Pt -","- C10 H28 B Cl2 N P2 Pt -","- C40 H112 B4 Cl8 N4 P8 Pt4 -","4","1","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","0.71074","MoKα","","0.0191","0.019","","","0.0492","0.0493","","","","","","1.071","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004873","5.893","0.0016","22.748","0.009","12.946","0.004","90","","95.56","0.03","90","","1727.3","1","100","2","100","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H22 B Cl O2 P2 Pt -","- C12 H22 B Cl O2 P2 Pt -","- C48 H88 B4 Cl4 O8 P8 Pt4 -","4","1","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","1.5418","CuKα","","0.063","0.062","","","0.1543","0.1582","","","","","","1.055","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004874","14.4914","0.0003","9.3235","0.0002","16.1496","0.0003","90","","90.477","0.001","90","","2181.91","0.08","100","2","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H26 B2 O4 P2 Pt -","- C18 H26 B2 O4 P2 Pt -","- C72 H104 B8 O16 P8 Pt4 -","4","1","","Charmant, Jonathan P. H.; Fan, Cheng; Norman, Nicholas C.; Pringle, Paul G.","Synthesis and reactivity of dichloroboryl complexes of platinum(II).","Dalton transactions (Cambridge, England : 2003)","2007","","1","114","123","10.1039/b612039n","","x-ray","1.5418","CuKα","","0.0286","0.0278","","","0.076","0.0767","","","","","","1.099","","","","has coordinates,has disorder","179752","2020-10-21","18:00:00",""
"7004875","11.8822","0.0008","25.396","0.002","13.13","0.001","90","","92.2","0.3","90","","3959.2","0.9","293","","293","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C40 H58 N2 O4 Zn -","- C40 H52 N2 O4 Zn -","- C160 H208 N8 O16 Zn4 -","4","1","","Rotthaus, Olaf; Jarjayes, Olivier; Thomas, Fabrice; Philouze, Christian; Saint-Aman, Eric; Pierre, Jean-Louis","Up to four phenoxyl radicals coordinated to two metal ions in copper and zinc complexes?","Dalton transactions (Cambridge, England : 2003)","2007","","8","889","895","10.1039/b612068g","","","0.71073","MoKα","","0.0624","0.0624","","0.086","","0.086","","","1.842","","","1.842","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7004876","7.7954","0.0002","12.1336","0.0003","12.522","0.0003","68.0679","0.0011","88.8912","0.0009","86.7614","0.0011","1096.93","0.05","150","","150","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C36 H58 N10 O9 S2 -","- C36 H58 N10 O9 S2 -","- C36 H58 N10 O9 S2 -","1","0.5","","Cowley, Andrew R.; Dilworth, Jonathan R.; Donnelly, Paul S.; Heslop, Julia M.; Ratcliffe, Steven J.","Bifunctional chelators for copper radiopharmaceuticals: the synthesis of [Cu(ATSM)-amino acid] and [Cu(ATSM)-octreotide] conjugates.","Dalton transactions (Cambridge, England : 2003)","2007","","2","209","217","10.1039/b612142j","","","0.71073","MoKα","","","0.0603","","","","0.0777","","","","","","1.0308","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004877","27.3837","0.0004","7.2624","0.0002","27.4189","0.0004","90","","119.604","0.0008","90","","4741.01","0.17","150","","150","","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C18.5 H26.5 N7.5 Ni O3.5 S2 -","- C18.5 H26.5 N7.5 Ni O3.5 S2 -","- C148 H212 N60 Ni8 O28 S16 -","8","1","","Cowley, Andrew R.; Dilworth, Jonathan R.; Donnelly, Paul S.; Heslop, Julia M.; Ratcliffe, Steven J.","Bifunctional chelators for copper radiopharmaceuticals: the synthesis of [Cu(ATSM)-amino acid] and [Cu(ATSM)-octreotide] conjugates.","Dalton transactions (Cambridge, England : 2003)","2007","","2","209","217","10.1039/b612142j","","","0.71073","MoKα","","0.0662","0.032","","0.0557","0.0358","0.0358","","","","","","1.0999","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7004878","10.4913","0.0015","10.4913","0.0015","5.4814","0.0011","90","","90","","120","","522.49","0.15","295","2","295","2","","","","","","","","6","P -3","-P 3","147","","","","- C12 H24 Cl2 Cu O10 S4 -","- C12 H24 Cl2 Cu O9.98 S4.02 -","- C12 H24 Cl2 Cu O9.98 S4.02 -","1","0.166667","","Chaka, Gezahegn; Kandegedara, Ashoka; Heeg, Mary Jane; Rorabacher, D. B.","Comparative study of donor atom effects on the thermodynamic and electron-transfer kinetic properties of copper(II/I) complexes with sexadentate macrocyclic ligands. [CuII/I([18]aneS4N2)] and [CuII/I([18]aneS4O2)].","Dalton transactions (Cambridge, England : 2003)","2007","","4","449","458","10.1039/b612252c","","","0.71073","MoKα","","0.0421","0.0336","","","0.0678","0.0703","","","","","","1.085","","","","has coordinates,has disorder","179752","2020-10-21","18:00:00",""
"7004879","15.5531","0.0008","9.8811","0.0004","24.7535","0.0012","90","","90","","90","","3804.2","0.3","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H24 Cl Cu O6 S4 -","- C12 H24 Cl Cu O6 S4 -","- C96 H192 Cl8 Cu8 O48 S32 -","8","1","","Chaka, Gezahegn; Kandegedara, Ashoka; Heeg, Mary Jane; Rorabacher, D. B.","Comparative study of donor atom effects on the thermodynamic and electron-transfer kinetic properties of copper(II/I) complexes with sexadentate macrocyclic ligands. [CuII/I([18]aneS4N2)] and [CuII/I([18]aneS4O2)].","Dalton transactions (Cambridge, England : 2003)","2007","","4","449","458","10.1039/b612252c","","","0.71073","MoKα","","0.0574","0.0356","","","0.0732","0.0809","","","","","","1.044","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004880","6.753","0.002","18.304","0.006","7.371","0.002","90","","90","","90","","911.1","0.5","150","2","150","2","","","","","","","?","6","P n a 21","P 2c -2n","33","","","","- C2 H0 F7 N O4 S2 -","- C2 F7 N O4 S2 -","- C8 F28 N4 O16 S8 -","4","1","","Hnyk, Drahomír; Brain, Paul T.; Rankin, David W. H.; Robertson, Heather E.; Smart, Bruce A.; Banks, R. Eric; Murtagh, Vincent","The molecular structure of N-fluorobis(trifluoromethanesulfonyl)imide, NF(SO(2)CF(3))(2), as studied in the gas phase by electron diffraction restrained by ab initio calculations.","Dalton transactions (Cambridge, England : 2003)","2007","","2","265","271","10.1039/b612318j","","","0.71073","MoKα","","","0.0745","","","0.0794","","","","","1.1075","1.1075","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7004881","6.7769","0.001","10.969","0.0001","31.09","0.0003","90","","90","","90","","2311.1","0.3","273.1","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H24 Cl Cu N5 O8 -","- C21 H19 Cl Cu N5 O8 -","- C84 H76 Cl4 Cu4 N20 O32 -","4","1","","Yajima, Tatsuo; Takamido, Reiko; Shimazaki, Yuichi; Odani, Akira; Nakabayashi, Yasuo; Yamauchi, Osamu","Pi-pi stacking assisted binding of aromatic amino acids by copper(II)-aromatic diimine complexes. Effects of ring substituents on ternary complex stability.","Dalton transactions (Cambridge, England : 2003)","2007","","3","299","307","10.1039/b612394e","","","0.71069","MoKα","","","0.0629","","","","0.2048","","","","","","1.001","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004882","9.9415","0.0008","11.9758","0.0007","10.0268","0.0008","90","","94.766","0.007","90","","1189.64","0.15","296.1","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21 H22 Cl Cu N5 O9 -","- C21 H20 Cl Cu N5 O9 -","- C42 H40 Cl2 Cu2 N10 O18 -","2","1","","Yajima, Tatsuo; Takamido, Reiko; Shimazaki, Yuichi; Odani, Akira; Nakabayashi, Yasuo; Yamauchi, Osamu","Pi-pi stacking assisted binding of aromatic amino acids by copper(II)-aromatic diimine complexes. Effects of ring substituents on ternary complex stability.","Dalton transactions (Cambridge, England : 2003)","2007","","3","299","307","10.1039/b612394e","","","1.54178","CuKα","","","0.0472","","","","0.1256","","","","","","1.01","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004883","7.3939","0.0017","18.858","0.004","8.849","0.002","90","","109.26","0.004","90","","1164.8","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H6 Mn N8 O -","- C8 H6 Mn N8 O -","- C32 H24 Mn4 N32 O4 -","4","1","","Manson, Jamie L.; Schlueter, John A.; Nygren, Cara L.","Mn(dca)2(pym)2 and Mn(dca)2(pym)(H2O) {dca = dicyanamide; pym = pyrimidine}: New coordination polymers exhibiting 1- and 2-D topologies.","Dalton transactions (Cambridge, England : 2003)","2007","","6","646","652","10.1039/b612474g","","","0.71073","MoKα","","0.0273","0.0241","","","0.0656","0.0681","","","","","","1.023","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004884","13.6213","0.0016","7.5799","0.0009","14.7671","0.0019","90","","90","","90","","1524.7","0.3","297","2","297","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C12 H8 Mn N10 -","- C12 H8 Mn N10 -","- C48 H32 Mn4 N40 -","4","0.5","","Manson, Jamie L.; Schlueter, John A.; Nygren, Cara L.","Mn(dca)2(pym)2 and Mn(dca)2(pym)(H2O) {dca = dicyanamide; pym = pyrimidine}: New coordination polymers exhibiting 1- and 2-D topologies.","Dalton transactions (Cambridge, England : 2003)","2007","","6","646","652","10.1039/b612474g","","","0.71073","MoKα","","0.2042","0.0824","","","0.1759","0.2239","","","","","","1.039","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004885","16.955","0.003","33.696","0.007","18.155","0.004","90","","116.24","0.03","90","","9303","4","193","2","193","2","","","","","","","Synthesis","5","P 1 21/c 1","-P 2ybc","14","(Phosphinephosphonate)Pd(DCP-OMe)","","","- C101 H106 O12 P6 Pd3 -","- C101 H106 O12 P6 Pd3 -","- C404 H424 O48 P24 Pd12 -","4","1","","Reisinger, Corinna M.; Nowack, Rüdiger J; Volkmer, Dirk; Rieger, Bernhard","Novel palladium complexes employing mixed phosphine phosphonates and phosphine phosphinates as anionic chelating [P,O] ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","2","272","278","10.1039/b612694d","","x-ray","0.71073","MoKα","","0.1329","0.0909","","","0.2618","0.2887","","","","","","1.07","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004886","12.8238","0.0002","16.8615","0.0002","15.0661","0.0002","90","","90.7013","0.0006","90","","3257.48","0.08","150","1","150","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C53 H89.5 Cd2 Cl2 N10.5 O10 S2 -","- C53 H89.5 Cd2 Cl2 N10.5 O10 S2 -","- C106 H179 Cd4 Cl4 N21 O20 S4 -","2","0.5","","Allred, Russell A.; Huefner, Sara A.; Rudzka, Katarzyna; Arif, Atta M.; Berreau, Lisa M.","A cadmium hydroxide complex of a N3S-donor ligand containing two hydrogen bond donors: synthesis, characterization, and CO2 reactivity.","Dalton transactions (Cambridge, England : 2003)","2007","","3","351","357","10.1039/b612748g","","","0.71073","MoKα","","0.0547","0.039","","","0.0945","0.1049","","","","","","1.032","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7004887","19.738","0.001","10.9365","0.0009","13.908","0.002","90","","97.549","0.002","90","","2976.2","0.5","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C32 H80 Cl8 Co2 Cu4 N8 O8 Pb2 -","- C32 H80 Cl8 Co2 Cu4 N8 O8 Pb2 -","- C64 H160 Cl16 Co4 Cu8 N16 O16 Pb4 -","2","0.5","","Nesterov, Dmytro S.; Kokozay, Volodymyr N.; Skelton, Brian W.; Jezierska, Julia; Ozarowski, Andrew","Self-assembly of the unique heterotrimetallic Cu/Co/M complexes possessing triangular antiferromagnetic {Cu2CoPb}2 and linear ferromagnetic {Cu2CoCd2} cores.","Dalton transactions (Cambridge, England : 2003)","2007","","5","558","564","10.1039/b612788f","","","0.71073","MoKα","","0.051","0.04","","","0.081","0.111","","","","0.92","0.92","1.05","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7004888","8.125","0.003","20.612","0.008","11.551","0.004","90","","109.099","0.007","90","","1828","1.2","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C18 H48 Cd2 Cl6 Co Cu2 N4 O6 -","- C18 H48 Cd2 Cl6 Co Cu2 N4 O6 -","- C36 H96 Cd4 Cl12 Co2 Cu4 N8 O12 -","2","0.5","","Nesterov, Dmytro S.; Kokozay, Volodymyr N.; Skelton, Brian W.; Jezierska, Julia; Ozarowski, Andrew","Self-assembly of the unique heterotrimetallic Cu/Co/M complexes possessing triangular antiferromagnetic {Cu2CoPb}2 and linear ferromagnetic {Cu2CoCd2} cores.","Dalton transactions (Cambridge, England : 2003)","2007","","5","558","564","10.1039/b612788f","","","0.71073","MoKα","","0.112","0.073","","","","0.19","","","","1.228","1.228","1.204","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7004889","9.7705","0.0002","13.5108","0.0002","13.577","0.0002","110.932","0.0008","108.895","0.0008","101.181","0.0009","1483.38","0.05","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","6","P -1","-P 1","2","bis((diacetyl-2-(4-N-methyl-3-thiosemicarbazonato)-3-(4'-N- methinimino-3'-thiosemicarbazonato) zinc (ii)))","","","- C32 H72 N14 O8 S12 Zn2 -","- C32 H72 N14 O8 S12 Zn2 -","- C32 H72 N14 O8 S12 Zn2 -","1","0.5","","Christlieb, Martin; Cowley, Andrew R.; Dilworth, Jonathan R.; Donnelly, Paul S.; Paterson, Brett M.; Struthers, Harriet S. R.; White, Jonathan M.","New bimetallic compounds based on the bis(thiosemicarbazonato) motif.","Dalton transactions (Cambridge, England : 2003)","2007","","3","327","331","10.1039/b612907b","","","0.71073","MoKα","","0.0608","0.0332","","0.0619","0.0383","0.0383","","","","","","1.1058","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7004890","14.2293","0.001","16.2421","0.0012","14.954","0.0011","90","","110.67","0.001","90","","3233.6","0.4","130","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H82 Cu4 N26 O6 S6 -","- C44 H82 Cu4 N26 O6 S6 -","- C88 H164 Cu8 N52 O12 S12 -","2","0.5","","Christlieb, Martin; Cowley, Andrew R.; Dilworth, Jonathan R.; Donnelly, Paul S.; Paterson, Brett M.; Struthers, Harriet S. R.; White, Jonathan M.","New bimetallic compounds based on the bis(thiosemicarbazonato) motif.","Dalton transactions (Cambridge, England : 2003)","2007","","3","327","331","10.1039/b612907b","","","0.71073","MoKα","","0.0459","0.0328","","","0.069","0.0713","","","","","","0.928","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004891","7.9171","0.001","14.8595","0.0012","17.201","0.002","102.126","0.009","91.064","0.012","95.307","0.007","1968.5","0.4","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C11 H21 I3 N4 O2 Pt2 -","- C11 H21 I3 N4 O2 Pt2 -","- C44 H84 I12 N16 O8 Pt8 -","4","2","","Eisenwiener, Alexander; Neuburger, Markus; Kaden, Thomas A.","Cu(2+) and Pt(2+) complexes of pyrazole and triazole based dinucleating ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","2","218","233","10.1039/b612948j","","","0.71073","MoKα","","0.1011","0.0536","","0.0991","0.0609","0.0609","","","","","","1.0272","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004892","9.846","0.0008","11.252","0.0009","31.761","0.003","90","","90","","90","","3518.7","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Ethoxo(2-oxo-3,5-di-tert-butylbenzaldehyde 2S-(1,1,3- triphenylpropoxo) imine)oxovanadium(V)","","","- C38 H44 N O4 V -","- C38 H44 N O4 V -","- C152 H176 N4 O16 V4 -","4","1","","Hsieh, Sheng-Hsiung; Kuo, Ya-Pei; Gau, Han-Mou","Synthesis, characterization, and structures of oxovanadium(V) complexes of Schiff bases of beta-amino alcohols as tunable catalysts for the asymmetric oxidation of organic sulfides and asymmetric alkynylation of aldehydes.","Dalton transactions (Cambridge, England : 2003)","2007","","1","97","106","10.1039/b613212j","","","0.71073","MoKα","","0.0696","0.0556","","","0.1556","0.1661","","","","","","1.059","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004893","8.2505","0.0007","11.0013","0.001","9.4013","0.0008","90","","109.72","0.002","90","","803.28","0.12","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Ethoxo(2-oxo-benzaldehyde 2S-(2-tert-butylethoxo) imine)oxovanadium(V)","","","- C15 H22 N O4 V -","- C15 H22 N O4 V -","- C30 H44 N2 O8 V2 -","2","1","","Hsieh, Sheng-Hsiung; Kuo, Ya-Pei; Gau, Han-Mou","Synthesis, characterization, and structures of oxovanadium(V) complexes of Schiff bases of beta-amino alcohols as tunable catalysts for the asymmetric oxidation of organic sulfides and asymmetric alkynylation of aldehydes.","Dalton transactions (Cambridge, England : 2003)","2007","","1","97","106","10.1039/b613212j","","","0.71073","MoKα","","0.0273","0.0265","","","0.0733","0.0739","","","","","","1.025","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004894","6.3509","0.0004","19.3947","0.0012","25.8562","0.0016","90","","90","","90","","3184.8","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Ethoxo(2-oxo-3,5-di-tert-butylbenzaldehyde 2S-(1R,3- diphenylpropoxo) imine)oxovanadium(V)","","","- C32 H40 N O4 V -","- C32 H40 N O4 V -","- C128 H160 N4 O16 V4 -","4","1","","Hsieh, Sheng-Hsiung; Kuo, Ya-Pei; Gau, Han-Mou","Synthesis, characterization, and structures of oxovanadium(V) complexes of Schiff bases of beta-amino alcohols as tunable catalysts for the asymmetric oxidation of organic sulfides and asymmetric alkynylation of aldehydes.","Dalton transactions (Cambridge, England : 2003)","2007","","1","97","106","10.1039/b613212j","","","0.71073","MoKα","","0.0757","0.053","","","0.1367","0.1501","","","","","","1.018","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004895","10.928","0.0008","12.6932","0.001","19.5875","0.0015","90","","90","","90","","2717","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(2-propoxo)(2-oxobenzaldehyde 2S-(1,1,3-triphenylpropoxo) imine)oxovanadium(V)","","","- C31 H30 N O4 V -","- C31 H30 N O4 V -","- C124 H120 N4 O16 V4 -","4","1","","Hsieh, Sheng-Hsiung; Kuo, Ya-Pei; Gau, Han-Mou","Synthesis, characterization, and structures of oxovanadium(V) complexes of Schiff bases of beta-amino alcohols as tunable catalysts for the asymmetric oxidation of organic sulfides and asymmetric alkynylation of aldehydes.","Dalton transactions (Cambridge, England : 2003)","2007","","1","97","106","10.1039/b613212j","","","0.71073","MoKα","","0.0699","0.0369","","","0.0807","0.0923","","","","","","0.92","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004896","19.337","0.003","12.1087","0.0019","21.685","0.004","90","","91.105","0.003","90","","5076.5","1.5","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H29.5 Cl Fe N10 O4.5 -","- C21 H29.5 Cl Fe N10 O4.5 -","- C168 H236 Cl8 Fe8 N80 O36 -","8","2","","Brewer, Cynthia T.; Brewer, Greg; Butcher, Ray J.; Carpenter, Everett E.; Schmiedekamp, Ann M.; Viragh, Carol","Synthesis and characterization of a spin crossover iron(II)-iron(III) mixed valence supramolecular pseudo-dimer exhibiting chiral recognition, hydrogen bonding, and pi-pi interactions.","Dalton transactions (Cambridge, England : 2003)","2007","","3","295","298","10.1039/b613282k","","","0.71073","MoKα","","0.1083","0.0681","","","0.1315","0.149","","","","","","1.13","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7004897","19.553","0.002","12.2348","0.0014","21.783","0.003","90","","90.548","0.002","90","","5210.8","1.1","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H58 Cl2 Fe2 N20 O8.5 -","- C42 H58 Cl2 Fe2 N20 O8.5 -","- C168 H232 Cl8 Fe8 N80 O34 -","4","1","","Brewer, Cynthia T.; Brewer, Greg; Butcher, Ray J.; Carpenter, Everett E.; Schmiedekamp, Ann M.; Viragh, Carol","Synthesis and characterization of a spin crossover iron(II)-iron(III) mixed valence supramolecular pseudo-dimer exhibiting chiral recognition, hydrogen bonding, and pi-pi interactions.","Dalton transactions (Cambridge, England : 2003)","2007","","3","295","298","10.1039/b613282k","","","0.71073","MoKα","","0.1485","0.0614","","","0.1162","0.1529","","","","","","1.041","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7004898","18.222","0.003","18.222","0.003","32.411","0.005","90","","90","","120","","9320","3","100","2","100","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C36 H30 Cl3 Cr Mn3 N12 O6 -","- C36 H30 Cl3 Cr Mn3 N12 O6 -","- C216 H180 Cl18 Cr6 Mn18 N72 O36 -","6","0.333333","","Khanra, Sumit; Biswas, Biplab; Golze, Christian; Büchner, Bernd; Kataev, Vladislav; Weyhermüller, Thomas; Chaudhuri, Phalguni","A spin-frustrated star-shaped heterotetranuclear CrIIIMnII3 species and its magnetic and HF-EPR measurements.","Dalton transactions (Cambridge, England : 2003)","2007","","4","481","487","10.1039/b613293f","","","1.54178","CuKα","","0.0913","0.0758","","","0.1577","0.1629","","","","","","1.114","","","","has coordinates","179752","2020-10-21","18:00:00",""
"7004899","32.27","0.011","11.21","0.005","20.783","0.006","90","","103.22","0.03","90","","7319","5","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H104 Cl8 Mn8 O28 -","- C42 H104 Cl8 Mn8 O28 -","- C168 H416 Cl32 Mn32 O112 -","4","0.5","","Jerzykiewicz, Lucjan B.; Utko, Józef; Duczmal, Marek; Sobota, Piotr","Syntheses, structure, and properties of a manganese-calcium cluster containing a Mn4Ca2 core.","Dalton transactions (Cambridge, England : 2003)","2007","","8","825","826","10.1039/b613320g","","","0.71073","MoKα","","0.0549","0.0354","","","0.0657","0.0702","","","","","","1.078","","","","has coordinates,has disorder","179752","2020-10-21","18:00:00",""
"7004900","11.114","0.006","14.025","0.006","18.057","0.009","90","","119.97","0.04","90","","2438","2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H62 Ca2 Cl4 Mn4 N2 O16 -","- C28 H62 Ca2 Cl4 Mn4 N2 O16 -","- C56 H124 Ca4 Cl8 Mn8 N4 O32 -","2","0.5","","Jerzykiewicz, Lucjan B.; Utko, Józef; Duczmal, Marek; Sobota, Piotr","Syntheses, structure, and properties of a manganese-calcium cluster containing a Mn4Ca2 core.","Dalton transactions (Cambridge, England : 2003)","2007","","8","825","826","10.1039/b613320g","","","0.71073","MoKα","","0.0803","0.0377","","","0.0674","0.0725","","","","","","0.825","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004901","12.977","0.003","12.362","0.003","23.523","0.003","90","","91.24","0.01","90","","3772.7","1.4","100","1","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H52 Cl4 Mn4 O12 -","- C20 H52 Cl4 Mn4 O12 -","- C80 H208 Cl16 Mn16 O48 -","4","1","","Jerzykiewicz, Lucjan B.; Utko, Józef; Duczmal, Marek; Sobota, Piotr","Syntheses, structure, and properties of a manganese-calcium cluster containing a Mn4Ca2 core.","Dalton transactions (Cambridge, England : 2003)","2007","","8","825","826","10.1039/b613320g","","","0.71073","MoKα","","0.0507","0.037","","","0.0727","0.0769","","","","","","1.066","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004902","29.7688","0.0003","16.5518","0.0002","25.3298","0.0003","90","","106.502","0.0008","90","","11966.6","0.2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H88 N8 Na O31.5 P2 -","- C36 H65 N8 Na O29.5 P2 -","- C288 H520 N64 Na8 O236 P16 -","8","1","","Försterová, Michaela; Svobodová, Ivona; Lubal, Premysl; Táborský, Petr; Kotek, Jan; Hermann, Petr; Lukes, Ivan","Thermodynamic study of lanthanide(III) complexes with bifunctional monophosphinic acid analogues of H4dota and comparative kinetic study of yttrium(III) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","5","535","549","10.1039/b613404a","","","0.71073","MoKα","","0.1047","0.0908","","","0.2672","0.2806","","","","","","1.041","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7004903","11.9291","0.0004","16.0112","0.0004","17.234","0.0006","96.1631","0.0019","91.9137","0.0013","108.627","0.0018","3093.22","0.17","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H87 Cl N8 Na O30.5 P2 -","- C36 H72 Cl N8 Na O27 P2 -","- C72 H144 Cl2 N16 Na2 O54 P4 -","2","1","","Försterová, Michaela; Svobodová, Ivona; Lubal, Premysl; Táborský, Petr; Kotek, Jan; Hermann, Petr; Lukes, Ivan","Thermodynamic study of lanthanide(III) complexes with bifunctional monophosphinic acid analogues of H4dota and comparative kinetic study of yttrium(III) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","5","535","549","10.1039/b613404a","","","0.71073","MoKα","","0.0728","0.0535","","","0.1467","0.1577","","","","","","1.075","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004904","14.049","0.005","9.693","0.005","26.772","0.008","90","","91.352","0.005","90","","3645","3","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C74 H122 N4 O4 Yb2 -","- C74 H122 N4 O4 Yb2 -","- C148 H244 N8 O8 Yb4 -","2","0.5","","Delbridge, Ewan E.; Dugah, Divine T.; Nelson, Chassidy R.; Skelton, Brian W.; White, Allan H.","Synthesis, structure and oxidation of new ytterbium(II) bis(phenolate) compounds and their catalytic activity towards epsilon-caprolactone.","Dalton transactions (Cambridge, England : 2003)","2007","","1","143","153","10.1039/b613409b","","","0.71073","MoKα","","0.088","0.063","","0.167","","0.129","","","1.217","","","1.217","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7004905","14.057","0.001","14.137","0.001","23.703","0.002","99.451","0.001","95.457","0.002","119.492","0.001","3958.5","0.5","298","","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H122 K N2 O10 Yb -","- C74 H122 K N2 O10 Yb -","- C148 H244 K2 N4 O20 Yb2 -","2","1","","Delbridge, Ewan E.; Dugah, Divine T.; Nelson, Chassidy R.; Skelton, Brian W.; White, Allan H.","Synthesis, structure and oxidation of new ytterbium(II) bis(phenolate) compounds and their catalytic activity towards epsilon-caprolactone.","Dalton transactions (Cambridge, England : 2003)","2007","","1","143","153","10.1039/b613409b","","","0.71073","MoKα","","0.054","0.043","","0.114","0.084","","","","1.135","","","1.135","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7004906","11.11","0.001","14.063","0.002","31.033","0.004","90","","90","","90","","4848.6","1","170","","170","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C43 H72 F3 N2 O8 S Yb -","- C43 H72 F3 N2 O8 S Yb -","- C172 H288 F12 N8 O32 S4 Yb4 -","4","1","","Delbridge, Ewan E.; Dugah, Divine T.; Nelson, Chassidy R.; Skelton, Brian W.; White, Allan H.","Synthesis, structure and oxidation of new ytterbium(II) bis(phenolate) compounds and their catalytic activity towards epsilon-caprolactone.","Dalton transactions (Cambridge, England : 2003)","2007","","1","143","153","10.1039/b613409b","","","0.71073","MoKα","","0.054","0.058","","0.062","","0.093","","","1.318","","","1.451","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7004907","19.296","0.004","11.907","0.002","23.054","0.005","90","","94.87","0.03","90","","5277.7","1.8","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H80 Cl4 N6 P2 Ru2 -","- C43 H80 Cl4 N6 P2 Ru2 -","- C172 H320 Cl16 N24 P8 Ru8 -","4","1","","Zhang, Jing; Gandelman, Mark; Shimon, Linda J. W.; Milstein, David","Electron-rich, bulky PNN-type ruthenium complexes: synthesis, characterization and catalysis of alcohol dehydrogenation.","Dalton transactions (Cambridge, England : 2003)","2007","","1","107","113","10.1039/b613438f","","","0.71073","MoKα","","0.0842","0.061","","","0.1513","0.1607","","","","","","1.056","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004908","12.357","0.003","16.863","0.003","19.073","0.004","90","","95.09","0.03","90","","3958.7","1.5","120","2","120","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C38 H50 Cl F3 N2 O3 P2 Ru S -","- C38 H50 Cl F3 N2 O3 P2 Ru S -","- C152 H200 Cl4 F12 N8 O12 P8 Ru4 S4 -","4","1","","Zhang, Jing; Gandelman, Mark; Shimon, Linda J. W.; Milstein, David","Electron-rich, bulky PNN-type ruthenium complexes: synthesis, characterization and catalysis of alcohol dehydrogenation.","Dalton transactions (Cambridge, England : 2003)","2007","","1","107","113","10.1039/b613438f","","","0.71073","MoKα","","0.0614","0.0454","","","0.08","0.0856","","","","","","1.041","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004909","12.53","0.0003","16.715","0.0004","29.106","0.0006","90","0.001","90","0.0011","90","0.0011","6095.9","0.2","120","2","120","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C23 H43 B2 F8 N2 O3 P Ru -","- C23 H43 B2 F8 N2 O3 P Ru -","- C184 H344 B16 F64 N16 O24 P8 Ru8 -","8","1","","Zhang, Jing; Gandelman, Mark; Shimon, Linda J. W.; Milstein, David","Electron-rich, bulky PNN-type ruthenium complexes: synthesis, characterization and catalysis of alcohol dehydrogenation.","Dalton transactions (Cambridge, England : 2003)","2007","","1","107","113","10.1039/b613438f","","","0.71073","MoKα","","0.0782","0.0458","","","0.1039","0.1122","","","","","","1.05","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004910","7.6852","0.0009","3.5113","0.0003","8.1103","0.0017","90","","111.78","0.014","90","","203.23","0.06","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C H5 Na O4 -","- C H5 Na O4 -","- C2 H10 Na2 O8 -","2","1","","Walker, Martin; Morrison, Carole A.; Allan, David R.; Pulham, Colin R.; Marshall, William G.","A new high pressure phase of sodium formate dihydrate; an experimental and computational study.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2014","2019","10.1039/b613444k","","","0.71073","MoKα","","0.086","0.0827","","0.0918","0.0893","0.0893","","","","","","1.1988","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7004911","7.6914","0.0009","3.51868","0.00027","8.1102","0.0009","90","","111.806","0.008","90","","203.79","0.04","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C D5 Na O4 -","- C D5 Na O4 -","- C2 D10 Na2 O8 -","2","1","","Walker, Martin; Morrison, Carole A.; Allan, David R.; Pulham, Colin R.; Marshall, William G.","A new high pressure phase of sodium formate dihydrate; an experimental and computational study.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2014","2019","10.1039/b613444k","powder diffraction","","","","","","","","","","","","","1.1","","","","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004912","15.004","0.003","7.906","0.002","9.4253","0.0015","90","","110.785","0.015","90","","1045.3","0.4","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","1,2-bis(methylthiomethyl)benzene","1,2-bis(methylthiomethyl)benzene","","- C10 H14 S2 -","- C10 H14 S2 -","- C40 H56 S8 -","4","0.5","","Levason, William; Nirwan, Manisha; Ratnani, Raju; Reid, Gillian; Tsoureas, Nikolaos; Webster, Michael","Transition metal complexes with wide-angle dithio-, diseleno- and ditelluroethers: properties and structural systematics.","Dalton transactions (Cambridge, England : 2003)","2007","","4","439","448","10.1039/b613501c","","","0.71073","MoKα","","0.0314","0.0269","","","0.0647","0.0675","","","","","","1.071","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004913","15.614","0.002","9.1855","0.0015","20.982","0.003","90","","109.356","0.01","90","","2839.2","0.7","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Bis(1,2-bis(methylthiomethyl)benzene)palladium(ii) hexafluorophosphate(V)","Bis(1,2-bis(methylthiomethyl)benzene)palladium(II) hexafluorophosphate(V)","","- C20 H28 F12 P2 Pd S4 -","- C20 H28 F12 P2 Pd S4 -","- C80 H112 F48 P8 Pd4 S16 -","4","1","","Levason, William; Nirwan, Manisha; Ratnani, Raju; Reid, Gillian; Tsoureas, Nikolaos; Webster, Michael","Transition metal complexes with wide-angle dithio-, diseleno- and ditelluroethers: properties and structural systematics.","Dalton transactions (Cambridge, England : 2003)","2007","","4","439","448","10.1039/b613501c","","","0.71073","MoKα","","0.0665","0.0574","","","0.1469","0.1521","","","","","","1.122","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004914","12.356","0.002","12.027","0.002","18.368","0.004","90","","96.621","0.009","90","","2711.4","0.9","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Cis-dichlorobis(1,2-bis(methylthiomethyl)benzene)rhodium(iii) hexafluorophosphate(V)","Cis-dichlorobis(1,2-bis(methylthiomethyl)benzene)rhodium(III) hexafluorophosphate(V)","","- C20 H28 Cl2 F6 P Rh S4 -","- C20 H28 Cl2 F6 P Rh S4 -","- C80 H112 Cl8 F24 P4 Rh4 S16 -","4","1","","Levason, William; Nirwan, Manisha; Ratnani, Raju; Reid, Gillian; Tsoureas, Nikolaos; Webster, Michael","Transition metal complexes with wide-angle dithio-, diseleno- and ditelluroethers: properties and structural systematics.","Dalton transactions (Cambridge, England : 2003)","2007","","4","439","448","10.1039/b613501c","","","0.71073","MoKα","","0.1154","0.0515","","","0.0829","0.098","","","","","","1.015","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004915","8.401","0.002","9.182","0.002","15.308","0.003","90","","101.282","0.01","90","","1158","0.4","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","trans-dichlorobis(1,2- bis(methylthiomethyl)benzene)ruthenium(ii)","trans-dichlorobis(1,2-bis(methylthiomethyl)benzene)ruthenium(II)","","- C20 H28 Cl2 Ru S4 -","- C20 H28 Cl2 Ru S4 -","- C40 H56 Cl4 Ru2 S8 -","2","0.5","","Levason, William; Nirwan, Manisha; Ratnani, Raju; Reid, Gillian; Tsoureas, Nikolaos; Webster, Michael","Transition metal complexes with wide-angle dithio-, diseleno- and ditelluroethers: properties and structural systematics.","Dalton transactions (Cambridge, England : 2003)","2007","","4","439","448","10.1039/b613501c","","","0.71073","MoKα","","0.0345","0.0267","","","0.0607","0.0643","","","","","","1.035","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004916","12.515","0.002","12.0649","0.0016","18.63","0.003","90","","95.422","0.008","90","","2800.4","0.7","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","cis-dichlorobis(1,2- bis(methylselenomethyl)benzene)rhodium(iii) hexafluorophosphate","cis-dichlorobis(1,2-bis(methylselenomethyl)benzene)rhodium(III) hexafluorophosphate","","- C20 H28 Cl2 F6 P Rh Se4 -","- C20 H28 Cl2 F6 P Rh Se4 -","- C80 H112 Cl8 F24 P4 Rh4 Se16 -","4","1","","Levason, William; Nirwan, Manisha; Ratnani, Raju; Reid, Gillian; Tsoureas, Nikolaos; Webster, Michael","Transition metal complexes with wide-angle dithio-, diseleno- and ditelluroethers: properties and structural systematics.","Dalton transactions (Cambridge, England : 2003)","2007","","4","439","448","10.1039/b613501c","","","0.71073","MoKα","","0.1308","0.0672","","","0.0878","0.1016","","","","","","1.02","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004917","10.111","0.003","7.746","0.002","15.129","0.004","90","","102.987","0.012","90","","1154.6","0.6","120","2","120","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","bis(1,2-bis(methylthiomethyl)benzene)copper(i) tetrafluoroborate","bis(1,2-bis(methylthiomethyl)benzene)copper(I) tetrafluoroborate","","- C20 H28 B Cu F4 S4 -","- C20 H28 B Cu F4 S4 -","- C40 H56 B2 Cu2 F8 S8 -","2","0.5","","Levason, William; Nirwan, Manisha; Ratnani, Raju; Reid, Gillian; Tsoureas, Nikolaos; Webster, Michael","Transition metal complexes with wide-angle dithio-, diseleno- and ditelluroethers: properties and structural systematics.","Dalton transactions (Cambridge, England : 2003)","2007","","4","439","448","10.1039/b613501c","","","0.71073","MoKα","","0.0779","0.0395","","","0.0758","0.0884","","","","","","1.023","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004918","15.8366","0.001","20.3931","0.0015","16.5289","0.001","90","","99.405","0.004","90","","5266.4","0.6","120","2","120","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","bis(1,2-bis(methyltelluromethyl)benzene)silver(i) tetrafluoroborate","bis(1,2-bis(methyltelluromethyl)benzene)silver(I) tetrafluoroborate","","- C20 H28 Ag B F4 Te4 -","- C20 H27.9093 Ag B F4 Te4 -","- C160 H223.274 Ag8 B8 F32 Te32 -","8","2","","Levason, William; Nirwan, Manisha; Ratnani, Raju; Reid, Gillian; Tsoureas, Nikolaos; Webster, Michael","Transition metal complexes with wide-angle dithio-, diseleno- and ditelluroethers: properties and structural systematics.","Dalton transactions (Cambridge, England : 2003)","2007","","4","439","448","10.1039/b613501c","","","0.71073","MoKα","","0.0549","0.0323","","","0.0652","0.0727","","","","","","1.024","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004919","21.604","0.003","13.415","0.002","13.5021","0.0012","90","","124.612","0.008","90","","3220.6","0.8","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Bis(dichloro(p-cymene)ruthenium)(mu2-1,2- bis(methylthiomethyl)benzene)","Bis{dichloro(p-cymene)ruthenium}(mu2-1,2-bis(methylthiomethyl)benzene)","","- C30 H42 Cl4 Ru2 S2 -","- C30 H42 Cl4 Ru2 S2 -","- C120 H168 Cl16 Ru8 S8 -","4","0.5","","Levason, William; Nirwan, Manisha; Ratnani, Raju; Reid, Gillian; Tsoureas, Nikolaos; Webster, Michael","Transition metal complexes with wide-angle dithio-, diseleno- and ditelluroethers: properties and structural systematics.","Dalton transactions (Cambridge, England : 2003)","2007","","4","439","448","10.1039/b613501c","","","0.71073","MoKα","","0.0572","0.0375","","","0.0823","0.0908","","","","","","1.04","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004920","11.0425","0.0002","15.4028","0.0003","16.0274","0.0004","90","","90","","90","","2726.03","0.1","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H24 F6 N2 O4 Pd2 -","- C24 H24 F6 N2 O4 Pd2 -","- C96 H96 F24 N8 O16 Pd8 -","4","1","","Bedford, Robin B.; Betham, Michael; Butts, Craig P.; Coles, Simon J.; Cutajar, Marica; Gelbrich, Thomas; Hursthouse, Michael B.; Scully, P. Noelle; Wimperis, Stephen","Five-coordinate Pd(II) orthometallated triarylphosphite complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","4","459","466","10.1039/b613524b","","","0.71073","MoKα","","0.0343","0.0296","","","0.0671","0.0688","","","","","","1.053","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004921","14.3703","0.0002","18.2612","0.0002","19.3131","0.0002","71.258","0.007","74.58","0.005","82.499","0.005","4621","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C83 H101 F6 O4 P5 Pd -","- C83 H101 F6 O4 P5 Pd -","- C166 H202 F12 O8 P10 Pd2 -","2","1","","Bedford, Robin B.; Betham, Michael; Butts, Craig P.; Coles, Simon J.; Cutajar, Marica; Gelbrich, Thomas; Hursthouse, Michael B.; Scully, P. Noelle; Wimperis, Stephen","Five-coordinate Pd(II) orthometallated triarylphosphite complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","4","459","466","10.1039/b613524b","","","0.71073","MoKα","","0.0987","0.0608","","","0.1255","0.1348","","","","","","1.038","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004922","12.7089","0.0013","24.953","0.003","16.2793","0.0019","90","","94.354","0.01","90","","5147.7","1","120","2","120","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C53 H49 Cl2 F6 O3 P3 Pd Sb -","- C53 H49 Cl2 F6 O3 P4 Pd Sb -","- C212 H196 Cl8 F24 O12 P16 Pd4 Sb4 -","4","1","","Bedford, Robin B.; Betham, Michael; Butts, Craig P.; Coles, Simon J.; Cutajar, Marica; Gelbrich, Thomas; Hursthouse, Michael B.; Scully, P. Noelle; Wimperis, Stephen","Five-coordinate Pd(II) orthometallated triarylphosphite complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","4","459","466","10.1039/b613524b","","","0.71073","MoKα","","0.058","0.0384","","","0.0839","0.0925","","","","","","1.04","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004923","10.294","0.002","15.29","0.003","18.798","0.005","105.391","0.015","93.38","0.02","94.9","0.02","2831.9","1.1","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H55 Cl2 F6 O3 P5 Pd -","- C60 H55 Cl2 F6 O3 P5 Pd -","- C120 H110 Cl4 F12 O6 P10 Pd2 -","2","1","","Bedford, Robin B.; Betham, Michael; Butts, Craig P.; Coles, Simon J.; Cutajar, Marica; Gelbrich, Thomas; Hursthouse, Michael B.; Scully, P. Noelle; Wimperis, Stephen","Five-coordinate Pd(II) orthometallated triarylphosphite complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","4","459","466","10.1039/b613524b","","","0.71073","MoKα","","0.0606","0.0462","","","0.1113","0.1191","","","","","","1.046","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004924","8.2186","0.0009","9.9407","0.001","10.7834","0.0011","90","","98.985","0.002","90","","870.18","0.16","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C5 H4 Cl N O5 Ru -","- C5 H4 Cl N O5 Ru -","- C20 H16 Cl4 N4 O20 Ru4 -","4","1","","Johnson, Tony R.; Mann, Brian E.; Teasdale, Ian P.; Adams, Harry; Foresti, Roberta; Green, Colin J.; Motterlini, Roberto","Metal carbonyls as pharmaceuticals? [Ru(CO)3Cl(glycinate)], a CO-releasing molecule with an extensive aqueous solution chemistry.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1500","1508","10.1039/b613629j","","","0.71073","MoKα","","0.041","0.0287","","","0.0529","0.0558","","","","","","1.061","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004925","5.767","0.005","35.76","0.04","11.05","0.012","90","","97.39","0.018","90","","2260","4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H7 Cl2 N O5 Ru -","- C6 H7 Cl2 N O5 Ru -","- C48 H56 Cl16 N8 O40 Ru8 -","8","2","","Johnson, Tony R.; Mann, Brian E.; Teasdale, Ian P.; Adams, Harry; Foresti, Roberta; Green, Colin J.; Motterlini, Roberto","Metal carbonyls as pharmaceuticals? [Ru(CO)3Cl(glycinate)], a CO-releasing molecule with an extensive aqueous solution chemistry.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1500","1508","10.1039/b613629j","","","0.71073","MoKα","","0.2139","0.1493","","","0.3437","0.3759","","","","","","1.14","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004926","10.572","0.006","8.576","0.004","12.235","0.007","90","","99.83","0.02","90","","1093","1","93","2","93","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","trimethyltin(IV)-tropolonate","trimethyltin(IV)-tropolonate","","- C10 H14 O2 Sn -","- C10 H14 O2 Sn -","- C40 H56 O8 Sn4 -","4","1","","Deák, Andrea; Király, Péter; Tárkányi, Gábor","Preparation and structural characterization of trimethyltin(IV) tropolonate. Investigation of a rare methyl-migrational dismutation in the solution, solid and liquid states.","Dalton transactions (Cambridge, England : 2003)","2007","","2","234","239","10.1039/b613692c","","","0.7107","MoKα","","0.029","0.0238","","","0.0691","0.0712","","","","","","1.258","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004927","10.732","0.004","14.192","0.006","10.561","0.004","90","","98.24","0.04","90","","1591.9","1.1","295","2","295","2","","","","","","","obtained from the melt, from Me3Sn(trop) dismutation","4","P 1 21/c 1","-P 2ybc","14","dimethyltin(IV)-bis(tropolonate)","dimethyltin(IV)-bis(tropolonate)","","- C16 H16 O4 Sn -","- C16 H16 O4 Sn -","- C64 H64 O16 Sn4 -","4","1","","Deák, Andrea; Király, Péter; Tárkányi, Gábor","Preparation and structural characterization of trimethyltin(IV) tropolonate. Investigation of a rare methyl-migrational dismutation in the solution, solid and liquid states.","Dalton transactions (Cambridge, England : 2003)","2007","","2","234","239","10.1039/b613692c","","","0.7107","MoKα","","0.0457","0.0329","","","0.0943","0.1223","","","","","","1.245","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004928","17.6128","0.0002","7.6004","0.0001","13.0501","0.0001","90","","104.868","0.001","90","","1688.45","0.03","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C4 H20 F6 Mn3 N4 O8 S2 -","- C4 H20 F6 Mn3 N4 O8 S2 -","- C16 H80 F24 Mn12 N16 O32 S8 -","4","1","","Behera, J. N.; Rao, C. N. R.","Synthesis, structure and magnetic properties of an amine-templated Mn2+ (S = 5/2) sulfate with the Kagome structure.","Dalton transactions (Cambridge, England : 2003)","2007","","6","669","673","10.1039/b613732f","","","0.71073","MoKα","","0.0417","0.0324","","","0.0862","0.0924","","","","","","1.044","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004929","18.566","0.004","15.313","0.003","16.854","0.003","90","","116.03","0.03","90","","4305.6","1.8","180","2","293","2","","","","","","","Crystals were grown by slow evaporation of a mixed acetonitrile/ethanol solution","8","P 1 21/c 1","-P 2ybc","14","","","","- C42 H47 Cl3 N2 O5 P2 Pd2 S -","- C42 H47 Cl3 N2 O5 P2 Pd2 S -","- C168 H188 Cl12 N8 O20 P8 Pd8 S4 -","4","1","","Siedle, Gabriel; Lassahn, Paul-Gerhard; Lozan, Vasile; Janiak, Christoph; Kersting, Berthold","Coordination chemistry of dinucleating P2N2S ligands: preparation and characterization of cationic palladium complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","1","52","61","10.1039/b613789j","","","0.71073","MoKα","","0.1173","0.0403","","","0.0859","0.1248","","","","","","0.849","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004930","12.666","0.003","14.142","0.003","14.318","0.003","60.85","0.03","72.15","0.03","81.52","0.03","2132","1.1","180","2","180","2","","","","","","","Crystals were grown by slow evaporation of a methanolic solution","8","P -1","-P 1","2","","","","- C40 H45 Cl3 N2 O8 P2 Pd2 S -","- C40 H45 Cl3 N2 O8 P2 Pd2 S -","- C80 H90 Cl6 N4 O16 P4 Pd4 S2 -","2","1","","Siedle, Gabriel; Lassahn, Paul-Gerhard; Lozan, Vasile; Janiak, Christoph; Kersting, Berthold","Coordination chemistry of dinucleating P2N2S ligands: preparation and characterization of cationic palladium complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","1","52","61","10.1039/b613789j","","","0.71073","MoKα","","0.041","0.0288","","","0.0667","0.0718","","","","","","1.046","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004931","15.572","0.003","13.029","0.003","26.549","0.005","90","","94.43","0.03","90","","5370.4","1.9","180","2","180","2","","","","","","","Crystals were grown by slow evaporation of a mixed acetonitrile/ethanol solution","9","P 1 21/c 1","-P 2ybc","14","","","","- C40 H41 Cl I2 N2 O4 P2 Pd2 S -","- C40 H41 Cl I2 N2 O4 P2 Pd2 S -","- C160 H164 Cl4 I8 N8 O16 P8 Pd8 S4 -","4","1","","Siedle, Gabriel; Lassahn, Paul-Gerhard; Lozan, Vasile; Janiak, Christoph; Kersting, Berthold","Coordination chemistry of dinucleating P2N2S ligands: preparation and characterization of cationic palladium complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","1","52","61","10.1039/b613789j","","","0.71073","MoKα","","0.1864","0.0817","","","0.234","0.2935","","","","","","0.981","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004932","19.193","0.004","14.913","0.003","17.329","0.004","90","","115.18","0.03","90","","4489","2","180","2","293","2","","","","","","","Crystals were grown by slow evaporation of a mixed acetonitrile/ethanol solution","8","P 1 21/c 1","-P 2ybc","14","","","","- C44 H47 Cl N4 O5 P2 Pd2 S -","- C44 H47 Cl N4 O5 P2 Pd2 S -","- C176 H188 Cl4 N16 O20 P8 Pd8 S4 -","4","1","","Siedle, Gabriel; Lassahn, Paul-Gerhard; Lozan, Vasile; Janiak, Christoph; Kersting, Berthold","Coordination chemistry of dinucleating P2N2S ligands: preparation and characterization of cationic palladium complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","1","52","61","10.1039/b613789j","","","0.71073","MoKα","","0.108","0.0478","","","0.1076","0.137","","","","","","0.921","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004933","12.694","0.003","14.676","0.003","15.751","0.003","65.73","0.03","69.65","0.03","89.49","0.03","2477","1.3","180","2","293","2","","","","","","","Crystals were grown by slow evaporation of a mixed acetonitrile/methanol solution","8","P -1","-P 1","2","","","","- C45 H52 Cl2 N4 O10 P2 Pd2 S -","- C45 H52 Cl2 N4 O10 P2 Pd2 S -","- C90 H104 Cl4 N8 O20 P4 Pd4 S2 -","2","1","","Siedle, Gabriel; Lassahn, Paul-Gerhard; Lozan, Vasile; Janiak, Christoph; Kersting, Berthold","Coordination chemistry of dinucleating P2N2S ligands: preparation and characterization of cationic palladium complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","1","52","61","10.1039/b613789j","","","0.71073","MoKα","","0.0706","0.0396","","","0.0852","0.0962","","","","","","0.968","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004934","12.403","0.01","12.503","0.01","24.41","0.02","99.73","0.019","90.22","0.02","95.631","0.017","3712","5","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C36 H80 Cl4 N24 O35.5 P Pd S4 W3 -","- C36 H36 Cl4 N24 O35.5 P Pd S4 W3 -","- C72 H72 Cl8 N48 O71 P2 Pd2 S8 W6 -","2","1","","Hernández Molina, Rita; Kalinina, Irina; Sokolov, Maxim; Clausen, Maria; González Platas, Javier; Vicent, Cristian; Llusar, Rosa","Synthesis, structure and reactivity of cuboidal-type cluster aqua complexes with W3PdS4 4+ core.","Dalton transactions (Cambridge, England : 2003)","2007","","5","550","557","10.1039/b613790c","","","0.71073","MoKα","","0.1524","0.0655","","","0.1456","0.1891","","","","","","0.988","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004935","20.414","0.019","22.16","0.02","24.51","0.02","90","","90","","90","","11088","17","293","2","293","2","","","","","","","","9","P b c a","-P 2ac 2ab","61","","","","- C24 H58 Cl4 N12 O24.5 P Pd S4 W3 -","- C24 H23 Cl4 N12 O24.5 P Pd S4 W3 -","- C192 H184 Cl32 N96 O196 P8 Pd8 S32 W24 -","8","1","","Hernández Molina, Rita; Kalinina, Irina; Sokolov, Maxim; Clausen, Maria; González Platas, Javier; Vicent, Cristian; Llusar, Rosa","Synthesis, structure and reactivity of cuboidal-type cluster aqua complexes with W3PdS4 4+ core.","Dalton transactions (Cambridge, England : 2003)","2007","","5","550","557","10.1039/b613790c","","","0.71073","MoKα","","0.1243","0.0644","","","0.1484","0.1774","","","","","","1.073","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004936","11.739","0.001","14.836","0.001","33.41","0.002","98.463","0.01","100.082","0.01","101.608","0.01","5510.4","0.8","170","2","170","2","","","","","","","see text","6","P -1","-P 1","2","","","","- C56 H130 O61 Pd2 S16 W6 -","- C56 H92 O61 Pd2 S16 W6 -","- C112 H184 O122 Pd4 S32 W12 -","2","1","","Hernández Molina, Rita; Kalinina, Irina; Sokolov, Maxim; Clausen, Maria; González Platas, Javier; Vicent, Cristian; Llusar, Rosa","Synthesis, structure and reactivity of cuboidal-type cluster aqua complexes with W3PdS4 4+ core.","Dalton transactions (Cambridge, England : 2003)","2007","","5","550","557","10.1039/b613790c","","x-ray","0.71073","MoKα","","0.1377","0.0767","","","0.1897","0.2181","","","","","","1.187","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004937","9.3967","0.0011","11.7846","0.0014","14.3926","0.0017","66.798","0.002","75.999","0.002","69.868","0.002","1364.9","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H38 Cl Cu N3 -","- C28 H38 Cl Cu N3 -","- C56 H76 Cl2 Cu2 N6 -","2","1","","Bröring, Martin; Prikhodovski, Serguei; Brandt, Carsten D.; Tejero, Esther Cónsul; Köhler, Silke","Monomeric and polymeric copper and zinc tripyrrins.","Dalton transactions (Cambridge, England : 2003)","2007","","2","200","208","10.1039/b613800d","","","0.71073","MoKα","","0.0386","0.0362","","","0.0918","0.0928","","","","","","1.142","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004938","10.078","0.002","11.205","0.002","12.676","0.003","111.376","0.003","102.728","0.003","94.852","0.004","1278.6","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H34 Cu N6 -","- C28 H34 Cu N6 -","- C56 H68 Cu2 N12 -","2","1","","Bröring, Martin; Prikhodovski, Serguei; Brandt, Carsten D.; Tejero, Esther Cónsul; Köhler, Silke","Monomeric and polymeric copper and zinc tripyrrins.","Dalton transactions (Cambridge, England : 2003)","2007","","2","200","208","10.1039/b613800d","","","0.71073","MoKα","","0.0545","0.0524","","","0.1266","0.1279","","","","","","1.195","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004939","17.07","0.003","10.78","0.002","17.74","0.004","90","","114.5","0.03","90","","2970.5","1.2","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H34 Ag Cu N5 -","- C28 H34 Ag Cu N5 -","- C112 H136 Ag4 Cu4 N20 -","4","1","","Bröring, Martin; Prikhodovski, Serguei; Brandt, Carsten D.; Tejero, Esther Cónsul; Köhler, Silke","Monomeric and polymeric copper and zinc tripyrrins.","Dalton transactions (Cambridge, England : 2003)","2007","","2","200","208","10.1039/b613800d","","","0.71073","MoKα","","0.071","0.0423","","","0.0963","0.1053","","","","","","0.899","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004940","11.6588","0.0009","16.2256","0.0011","15.5222","0.0017","90","","110.596","0.01","90","","2748.7","0.5","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H38 Cu N4 Se -","- C29 H38 Cu N4 Se -","- C116 H152 Cu4 N16 Se4 -","4","1","","Bröring, Martin; Prikhodovski, Serguei; Brandt, Carsten D.; Tejero, Esther Cónsul; Köhler, Silke","Monomeric and polymeric copper and zinc tripyrrins.","Dalton transactions (Cambridge, England : 2003)","2007","","2","200","208","10.1039/b613800d","","","0.71073","MoKα","","0.0767","0.0377","","","0.0705","0.078","","","","","","0.848","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004941","9.8897","0.0008","11.6757","0.001","24.055","0.002","94.958","0.001","96.649","0.001","96.056","0.001","2729.8","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H34 Cu N6 -","- C30 H34 Cu N6 -","- C120 H136 Cu4 N24 -","4","2","","Bröring, Martin; Prikhodovski, Serguei; Brandt, Carsten D.; Tejero, Esther Cónsul; Köhler, Silke","Monomeric and polymeric copper and zinc tripyrrins.","Dalton transactions (Cambridge, England : 2003)","2007","","2","200","208","10.1039/b613800d","","","0.71073","MoKα","","0.047","0.041","","","0.1028","0.1064","","","","","","1.05","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004942","10.3015","0.0008","11.2634","0.0009","12.6692","0.001","112.049","0.001","102.318","0.001","95.442","0.001","1306.06","0.18","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H34 N6 Zn -","- C28 H34 N6 Zn -","- C56 H68 N12 Zn2 -","2","1","","Bröring, Martin; Prikhodovski, Serguei; Brandt, Carsten D.; Tejero, Esther Cónsul; Köhler, Silke","Monomeric and polymeric copper and zinc tripyrrins.","Dalton transactions (Cambridge, England : 2003)","2007","","2","200","208","10.1039/b613800d","","","0.71073","MoKα","","0.0374","0.0361","","","0.0876","0.0884","","","","","","1.111","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004943","15.1908","0.0011","8.1931","0.0006","19.5802","0.0016","90","","97.272","0.009","90","","2417.3","0.3","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H30 N6 Zn -","- C26 H30 N6 Zn -","- C104 H120 N24 Zn4 -","4","1","","Bröring, Martin; Prikhodovski, Serguei; Brandt, Carsten D.; Tejero, Esther Cónsul; Köhler, Silke","Monomeric and polymeric copper and zinc tripyrrins.","Dalton transactions (Cambridge, England : 2003)","2007","","2","200","208","10.1039/b613800d","","","0.71073","MoKα","","0.0487","0.0311","","","0.0702","0.074","","","","","","0.896","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004944","15.5919","0.0008","17.4451","0.0009","19.8805","0.001","90","","90","","90","","5407.5","0.5","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C28 H38 N6 Zn -","- C28 H38 N6 Zn -","- C224 H304 N48 Zn8 -","8","1","","Bröring, Martin; Prikhodovski, Serguei; Brandt, Carsten D.; Tejero, Esther Cónsul; Köhler, Silke","Monomeric and polymeric copper and zinc tripyrrins.","Dalton transactions (Cambridge, England : 2003)","2007","","2","200","208","10.1039/b613800d","","","0.71073","MoKα","","0.0404","0.0381","","","0.0954","0.0972","","","","","","1.109","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004945","11.3125","0.0012","16.229","0.0011","16.033","0.0016","90","","109.224","0.011","90","","2779.4","0.5","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H38 N4 Se Zn -","- C29 H38 N4 Se Zn -","- C116 H152 N16 Se4 Zn4 -","4","1","","Bröring, Martin; Prikhodovski, Serguei; Brandt, Carsten D.; Tejero, Esther Cónsul; Köhler, Silke","Monomeric and polymeric copper and zinc tripyrrins.","Dalton transactions (Cambridge, England : 2003)","2007","","2","200","208","10.1039/b613800d","","","0.71073","MoKα","","0.0674","0.0342","","","0.0629","0.0684","","","","","","0.848","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004946","11.2771","0.0011","16.1722","0.0012","15.9937","0.0015","90","","108.955","0.011","90","","2758.7","0.5","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H38 N4 S Zn -","- C29 H38 N4 S Zn -","- C116 H152 N16 S4 Zn4 -","4","1","","Bröring, Martin; Prikhodovski, Serguei; Brandt, Carsten D.; Tejero, Esther Cónsul; Köhler, Silke","Monomeric and polymeric copper and zinc tripyrrins.","Dalton transactions (Cambridge, England : 2003)","2007","","2","200","208","10.1039/b613800d","","","0.71073","MoKα","","0.0535","0.0301","","","0.0636","0.068","","","","","","0.877","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004947","9.3616","0.0009","11.0049","0.001","14.7717","0.0014","83.966","0.002","89.846","0.002","86.132","0.002","1509.9","0.2","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H38 N6 Zn -","- C32 H38 N6 Zn -","- C64 H76 N12 Zn2 -","2","1","","Bröring, Martin; Prikhodovski, Serguei; Brandt, Carsten D.; Tejero, Esther Cónsul; Köhler, Silke","Monomeric and polymeric copper and zinc tripyrrins.","Dalton transactions (Cambridge, England : 2003)","2007","","2","200","208","10.1039/b613800d","","","0.71073","MoKα","","0.044","0.0406","","","0.0967","0.0983","","","","","","1.143","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004948","15.439","0.003","11.262","0.003","14.071","0.003","90","","103.78","0.02","90","","2376.2","1","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","cyclooctadiene-(3,4,7,8-tetramethyl-1,10-phenanthroline,N,N')- chloro-iridium(i) chloromethane solvate","cyclooctadiene-(3,4,7,8-tetramethyl-1,10-phenanthroline,N,N')-chloro-iridium(I) chloromethane solvate","","- C25 H30 Cl3 Ir N2 -","- C25 H28 Cl3 Ir N2 -","- C100 H112 Cl12 Ir4 N8 -","4","1","","Crotti, Corrado; Farnetti, Erica; Filipuzzi, Serena; Stener, Mauro; Zangrando, Ennio; Moras, Paolo","Evaluation of the donor ability of phenanthrolines in iridium complexes by means of synchrotron radiation photoemission spectroscopy and DFT calculations.","Dalton transactions (Cambridge, England : 2003)","2007","","1","133","142","10.1039/b613837c","","","1.54178","CuKα","","0.0614","0.0571","","","0.1562","0.161","","","","","","1.059","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004949","11.392","0.003","14.036","0.003","30.605","0.005","90","","90","","90","","4893.7","1.8","200","2","200","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","cyclooctadiene-(3,4,7,8-tetramethyl-1,10-phenanthroline,N,N')- iodo-iridium(i) chloromethane solvate","cyclooctadiene-(3,4,7,8-tetramethyl-1,10-phenanthroline,N,N')-iodo-iridium(I) chloromethane solvate","","- C25 H30 Cl2 I Ir N2 -","- C25 H30 Cl2 I Ir N2 -","- C200 H240 Cl16 I8 Ir8 N16 -","8","2","","Crotti, Corrado; Farnetti, Erica; Filipuzzi, Serena; Stener, Mauro; Zangrando, Ennio; Moras, Paolo","Evaluation of the donor ability of phenanthrolines in iridium complexes by means of synchrotron radiation photoemission spectroscopy and DFT calculations.","Dalton transactions (Cambridge, England : 2003)","2007","","1","133","142","10.1039/b613837c","","","1.54178","CuKα","","0.0575","0.051","","","0.141","0.16","","","","","","1.13","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004950","14.4472","0.0006","21.045","0.0012","16.494","0.0009","90","","99.35","0.004","90","","4948.2","0.4","100","2","100","2","","","","","","","Synthesized by the authors. See text","7","C 1 2/c 1","-C 2yc","15","","","","- C38 H24 Br2 F12 Fe N10 P2 -","- C38 H24 Br2 F12 Fe N10 P2 -","- C152 H96 Br8 F48 Fe4 N40 P8 -","4","0.5","","Medlycott, Elaine A.; Udachin, Konstantin A.; Hanan, Garry S.","Non-covalent polymerisation in the solid state: halogen-halogen vs. methyl-methyl interactions in the complexes of 2,4-di(2-pyridyl)-1,3,5-triazine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","4","430","438","10.1039/b613883g","","","1.54178","CuKα","","0.128","0.0961","","","0.2665","0.289","","","","","","1.089","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004951","8.5536","0.0002","13.685","0.0002","18.9796","0.0003","91.086","0.001","102.348","0.001","91.973","0.001","2168.21","0.07","100","2","100","2","","","","","","","Synthesized by the authors. See text","7","P -1","-P 1","2","","","","- C40 H27 Br2 F12 N11 Ni P2 -","- C40 H27 Br2 F12 N11 Ni P2 -","- C80 H54 Br4 F24 N22 Ni2 P4 -","2","1","","Medlycott, Elaine A.; Udachin, Konstantin A.; Hanan, Garry S.","Non-covalent polymerisation in the solid state: halogen-halogen vs. methyl-methyl interactions in the complexes of 2,4-di(2-pyridyl)-1,3,5-triazine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","4","430","438","10.1039/b613883g","","","1.54178","CuKα","","0.0893","0.0528","","","0.1216","0.1338","","","","","","0.91","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004952","8.5175","0.0002","13.7974","0.0003","18.9148","0.0004","89.911","0.001","78.497","0.001","87.853","0.001","2176.64","0.08","100","2","100","2","","","","","","","Synthesized by the authors. See text","7","P -1","-P 1","2","","","","- C40 H27 Br2 Cu F12 N11 P2 -","- C40 H27 Br2 Cu F12 N11 P2 -","- C80 H54 Br4 Cu2 F24 N22 P4 -","2","1","","Medlycott, Elaine A.; Udachin, Konstantin A.; Hanan, Garry S.","Non-covalent polymerisation in the solid state: halogen-halogen vs. methyl-methyl interactions in the complexes of 2,4-di(2-pyridyl)-1,3,5-triazine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","4","430","438","10.1039/b613883g","","","1.54178","CuKα","","0.0352","0.0318","","","0.0841","0.0869","","","","","","1.027","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004953","14.8156","0.0002","21.3172","0.0004","16.7458","0.0003","90","","95.393","0.001","90","","5265.37","0.15","150","2","150","2","","","","","","","Synthesized by the authors. See text","8","C 1 2/c 1","-C 2yc","15","","","","- C44 H36 Br2 Cu F12 N10 O2 P2 -","- C44 H36 Br2 Cu F12 N10 O2 P2 -","- C176 H144 Br8 Cu4 F48 N40 O8 P8 -","4","0.5","","Medlycott, Elaine A.; Udachin, Konstantin A.; Hanan, Garry S.","Non-covalent polymerisation in the solid state: halogen-halogen vs. methyl-methyl interactions in the complexes of 2,4-di(2-pyridyl)-1,3,5-triazine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","4","430","438","10.1039/b613883g","","","1.54178","CuKα","","0.0679","0.0617","","","0.1792","0.1889","","","","","","1.046","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004954","8.9622","0.0003","33.0144","0.0008","13.3712","0.0004","90","","92.053","0.002","90","","3953.8","0.2","150","2","150","2","","","","","","","Synthesized by the authors. See text","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H30 F12 Fe N10 P2 -","- C40 H30 F12 Fe N10 P2 -","- C160 H120 F48 Fe4 N40 P8 -","4","1","","Medlycott, Elaine A.; Udachin, Konstantin A.; Hanan, Garry S.","Non-covalent polymerisation in the solid state: halogen-halogen vs. methyl-methyl interactions in the complexes of 2,4-di(2-pyridyl)-1,3,5-triazine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","4","430","438","10.1039/b613883g","","","1.54178","CuKα","","0.0477","0.038","","","0.0988","0.1096","","","","","","1.002","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004955","22.1997","0.0019","22.1997","0.0019","16.819","0.003","90","","90","","90","","8288.9","1.8","125","2","125","2","","","","","","","","6","I 41/a c d :2","-I 4bd 2c","142","","","","- C40 H30 Co F12 N10 P2 -","- C40 H30 Co F12 N10 P2 -","- C320 H240 Co8 F96 N80 P16 -","8","0.25","","Medlycott, Elaine A.; Udachin, Konstantin A.; Hanan, Garry S.","Non-covalent polymerisation in the solid state: halogen-halogen vs. methyl-methyl interactions in the complexes of 2,4-di(2-pyridyl)-1,3,5-triazine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","4","430","438","10.1039/b613883g","","","0.7107","MoKα","","0.061","0.0354","","","0.0943","0.1142","","","","","","1.073","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004956","22.2925","0.0003","22.2925","0.0003","16.6862","0.0004","90","","90","","90","","8292.3","0.3","150","2","150","2","","","","","","","Synthesized by the authors. See text","6","I 41/a c d :2","-I 4bd 2c","142","","","","- C40 H30 F12 N10 Ni P2 -","- C40 H30 F12 N10 Ni P2 -","- C320 H240 F96 N80 Ni8 P16 -","8","0.25","","Medlycott, Elaine A.; Udachin, Konstantin A.; Hanan, Garry S.","Non-covalent polymerisation in the solid state: halogen-halogen vs. methyl-methyl interactions in the complexes of 2,4-di(2-pyridyl)-1,3,5-triazine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","4","430","438","10.1039/b613883g","","","1.54178","CuKα","","0.0566","0.0416","","","0.114","0.1365","","","","","","1.094","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004957","22.598","0.004","22.598","0.004","17.155","0.007","90","","90","","90","","8761","4","100","2","100","2","","","","","","","Synthesized by the authors. See text","6","I 41/a c d :2","-I 4bd 2c","142","","","","- C40 H30 Cu F12 N10 P2 -","- C40 H30 Cu F12 N10 P2 -","- C320 H240 Cu8 F96 N80 P16 -","8","0.25","","Medlycott, Elaine A.; Udachin, Konstantin A.; Hanan, Garry S.","Non-covalent polymerisation in the solid state: halogen-halogen vs. methyl-methyl interactions in the complexes of 2,4-di(2-pyridyl)-1,3,5-triazine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","4","430","438","10.1039/b613883g","","","1.54178","CuKα","","0.0428","0.0296","","","0.0797","0.0955","","","","","","1.022","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004958","24.9536","0.001","3.9351","0.0002","19.0793","0.0008","90","","110.007","0.002","90","","1760.43","0.14","150","2","150","2","","","","","","","Synthesized by the authors. See text","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 Br N5 O2 -","- C19 H16 Br N5 O2 -","- C76 H64 Br4 N20 O8 -","4","1","","Medlycott, Elaine A.; Udachin, Konstantin A.; Hanan, Garry S.","Non-covalent polymerisation in the solid state: halogen-halogen vs. methyl-methyl interactions in the complexes of 2,4-di(2-pyridyl)-1,3,5-triazine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","4","430","438","10.1039/b613883g","","","1.54178","CuKα","","0.0556","0.044","","","0.1135","0.1215","","","","","","1.048","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7004959","10.8658","0.0007","16.388","0.001","17.404","0.001","79.556","0.001","78.603","0.001","82.235","0.001","2971.8","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H64 B N4 O6 P2 Re -","- C60 H64 B N4 O6 P2 Re -","- C120 H128 B2 N8 O12 P4 Re2 -","2","1","","Albertin, Gabriele; Antoniutti, Stefano; Bacchi, Alessia; Celebrin, Alessandro; Pelizzi, Giancarlo; Zanardo, Gianluigi","Reactions of manganese and rhenium complexes with organic azides: preparation of tetraazabutadiene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","6","661","668","10.1039/b613964g","","","0.71073","MoKα","","0.0378","0.0285","","","0.0814","0.086","","","","","","1.032","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004960","12.417","0.005","15.3","0.005","15.668","0.005","104.047","0.005","107.164","0.005","94.608","0.005","2721.7","1.7","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C57 H88 Ga3 -","- C57 H88 Ga3 -","- C114 H176 Ga6 -","2","1","","Uhl, Werner; Claesener, Michael; Haddadpour, Sima; Jasper, Beate; Hepp, Alexander","The reactions of dialkylgallium hydrides with tert-butylethynylbenzenes‒a systematic investigation into the course of hydrogallation reactions.","Dalton transactions (Cambridge, England : 2003)","2007","","4","417","423","10.1039/b614003c","","","0.71069","MoKα","","0.0898","0.0577","","","0.1243","0.1386","","","","","","0.978","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004961","17.6535","0.0003","17.6535","0.0003","25.9914","0.0004","90","","90","","120","","7014.9","0.2","100","2","100","2","","","","","","","","3","P -3 c 1","-P 3 2""c","165","","","","- C75 H123 Ga3 -","- C75 H123 Ga3 -","- C300 H492 Ga12 -","4","0.333333","","Uhl, Werner; Claesener, Michael; Haddadpour, Sima; Jasper, Beate; Hepp, Alexander","The reactions of dialkylgallium hydrides with tert-butylethynylbenzenes‒a systematic investigation into the course of hydrogallation reactions.","Dalton transactions (Cambridge, England : 2003)","2007","","4","417","423","10.1039/b614003c","","","1.54178","CuKα","","0.0613","0.0424","","","0.1039","0.1088","","","","","","0.858","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004962","27.889","0.008","12.053","0.003","19.249","0.005","90","","111.919","0.006","90","","6003","3","153","2","153","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C30 H52 Ga2 -","- C30 H52 Ga2 -","- C240 H416 Ga16 -","8","1","","Uhl, Werner; Claesener, Michael; Haddadpour, Sima; Jasper, Beate; Hepp, Alexander","The reactions of dialkylgallium hydrides with tert-butylethynylbenzenes‒a systematic investigation into the course of hydrogallation reactions.","Dalton transactions (Cambridge, England : 2003)","2007","","4","417","423","10.1039/b614003c","","","0.71073","MoKα","","0.2311","0.0857","","","0.1384","0.1841","","","","","","0.944","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004963","12.62","0.003","31.033","0.006","18.64","0.004","90","","99.11","0.03","90","","7208","3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C80 H118 N6 Sm -","- C80 H118 N6 Sm -","- C320 H472 N24 Sm4 -","4","1","","Heitmann, Dennis; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Stasch, Andreas","Homoleptic lanthanide(II)-bis(guanidinate) complexes, [Ln(Giso)(2)] (Giso = [(ArN)(2)CN(C(6)H(11))(2)](-), Ar = C(6)H(3)Pr(i)(2)-2,6): planar 4-coordinate (Ln = Sm or Eu) vs distorted tetrahedral (Ln = Yb) geometries.","Dalton transactions (Cambridge, England : 2003)","2007","","2","187","189","10.1039/b614028a","","","0.71073","MoKα","","0.0554","0.0392","","","0.081","0.0874","","","","","","1.031","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004964","12.631","0.003","30.988","0.006","18.627","0.004","90","","99.16","0.03","90","","7198","3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C80 H118 Eu N6 -","- C80 H118 Eu N6 -","- C320 H472 Eu4 N24 -","4","1","","Heitmann, Dennis; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Stasch, Andreas","Homoleptic lanthanide(II)-bis(guanidinate) complexes, [Ln(Giso)(2)] (Giso = [(ArN)(2)CN(C(6)H(11))(2)](-), Ar = C(6)H(3)Pr(i)(2)-2,6): planar 4-coordinate (Ln = Sm or Eu) vs distorted tetrahedral (Ln = Yb) geometries.","Dalton transactions (Cambridge, England : 2003)","2007","","2","187","189","10.1039/b614028a","","","0.71073","MoKα","","0.0475","0.0387","","","0.0843","0.089","","","","","","1.066","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004965","13.822","0.003","16.195","0.003","17.916","0.004","89.75","0.03","78.04","0.03","84.48","0.03","3904.7","1.5","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C88 H128 N6 Yb -","- C88 H120 N6 Yb -","- C176 H240 N12 Yb2 -","2","1","","Heitmann, Dennis; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Stasch, Andreas","Homoleptic lanthanide(II)-bis(guanidinate) complexes, [Ln(Giso)(2)] (Giso = [(ArN)(2)CN(C(6)H(11))(2)](-), Ar = C(6)H(3)Pr(i)(2)-2,6): planar 4-coordinate (Ln = Sm or Eu) vs distorted tetrahedral (Ln = Yb) geometries.","Dalton transactions (Cambridge, England : 2003)","2007","","2","187","189","10.1039/b614028a","","","0.71073","MoKα","","0.0544","0.0426","","","0.093","0.0983","","","","","","1.029","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004966","11.277","0.002","11.998","0.002","17.583","0.004","76.56","0.03","88.31","0.03","71.46","0.03","2191.2","0.9","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H67 I N3 O Yb -","- C44 H67 I N3 O Yb -","- C88 H134 I2 N6 O2 Yb2 -","2","1","","Heitmann, Dennis; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Stasch, Andreas","Homoleptic lanthanide(II)-bis(guanidinate) complexes, [Ln(Giso)(2)] (Giso = [(ArN)(2)CN(C(6)H(11))(2)](-), Ar = C(6)H(3)Pr(i)(2)-2,6): planar 4-coordinate (Ln = Sm or Eu) vs distorted tetrahedral (Ln = Yb) geometries.","Dalton transactions (Cambridge, England : 2003)","2007","","2","187","189","10.1039/b614028a","","","0.71073","MoKα","","0.051","0.0367","","","0.0792","0.0853","","","","","","1.037","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004967","10.53","0.002","13.562","0.003","15.958","0.003","80.99","0.03","71.19","0.03","80.4","0.03","2114.1","0.8","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H64 I N3 Yb -","- C44 H64 I N3 Yb -","- C88 H128 I2 N6 Yb2 -","2","1","","Heitmann, Dennis; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Stasch, Andreas","Homoleptic lanthanide(II)-bis(guanidinate) complexes, [Ln(Giso)(2)] (Giso = [(ArN)(2)CN(C(6)H(11))(2)](-), Ar = C(6)H(3)Pr(i)(2)-2,6): planar 4-coordinate (Ln = Sm or Eu) vs distorted tetrahedral (Ln = Yb) geometries.","Dalton transactions (Cambridge, England : 2003)","2007","","2","187","189","10.1039/b614028a","","","0.71073","MoKα","","0.0383","0.032","","","0.0713","0.0742","","","","","","1.028","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004968","27.1086","0.0004","10.4113","0.0002","17.4684","0.0003","90","","95.292","0.002","90","","4909.19","0.15","180","2","180","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C103 H89 F24 Fe2 N14 P4 -","- C103 H89 F24 Fe2 N14 P4 -","- C206 H178 F48 Fe4 N28 P8 -","2","0.5","","Kerckhoffs, Jessica M. C. A.; Peberdy, Jemma C.; Meistermann, Isabelle; Childs, Laura J.; Isaac, Christian J.; Pearmund, Christopher R.; Reudegger, Veronika; Khalid, Syma; Alcock, Nathaniel W.; Hannon, Michael J.; Rodger, Alison","Enantiomeric resolution of supramolecular helicates with different surface topographies.","Dalton transactions (Cambridge, England : 2003)","2007","","7","734","742","10.1039/b614093a","","","0.71073","MoKα","","0.1385","0.06","","","0.1147","0.1361","","","","","","0.89","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004969","10.123","0.003","15.505","0.004","34.664","0.009","90","","90","","90","","5441","3","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C17 H25 B10 Co3 O5 S2 -","- C17 H25 B10 Co3 O5 S2 -","- C136 H200 B80 Co24 O40 S16 -","8","1","","Chen, Yin-Qiang; Zhang, Jiasheng; Cai, Shuyi; Hou, Xiu-Feng; Schumann, Herbert; Jin, Guo-Xin","Syntheses and structures of heterometallic clusters by the reaction of o-carboranyl cobaltadichalcogenolato complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","7","749","758","10.1039/b614123d","","","0.71073","MoKα","","0.1007","0.038","","","0.0576","0.0674","","","","","","0.773","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004970","11.789","0.004","11.507","0.004","14.342","0.005","90","","96.995","0.005","90","","1931.1","1.2","298","2","298","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C23 H38 B20 Co2 Mo O2 S4 -","- C24 H30 B20 Co2 Mo O2 S4 -","- C48 H60 B40 Co4 Mo2 O4 S8 -","2","0.5","","Chen, Yin-Qiang; Zhang, Jiasheng; Cai, Shuyi; Hou, Xiu-Feng; Schumann, Herbert; Jin, Guo-Xin","Syntheses and structures of heterometallic clusters by the reaction of o-carboranyl cobaltadichalcogenolato complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","7","749","758","10.1039/b614123d","","","0.71073","MoKα","","0.0886","0.0394","","","0.0788","0.0878","","","","","","0.786","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004971","11.6","0.004","12.85","0.004","12.982","0.004","86.541","0.004","77.776","0.004","85.741","0.004","1884","1.1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C30 H49 B10 Co Mo N2 O2 S2 -","- C24 H35 B10 Co Mo N2 O2 S2 -","- C48 H70 B20 Co2 Mo2 N4 O4 S4 -","2","1","","Chen, Yin-Qiang; Zhang, Jiasheng; Cai, Shuyi; Hou, Xiu-Feng; Schumann, Herbert; Jin, Guo-Xin","Syntheses and structures of heterometallic clusters by the reaction of o-carboranyl cobaltadichalcogenolato complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","7","749","758","10.1039/b614123d","","","0.71073","MoKα","","0.0897","0.0527","","","0.1172","0.1251","","","","","","0.866","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004972","10.709","0.003","10.383","0.003","16.57","0.004","90","","108.06","0.004","90","","1751.7","0.8","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C16 H35 B20 Co Mo O2 Se4 -","- C16 H35 B20 Co Mo O2 Se4 -","- C32 H70 B40 Co2 Mo2 O4 Se8 -","2","1","","Chen, Yin-Qiang; Zhang, Jiasheng; Cai, Shuyi; Hou, Xiu-Feng; Schumann, Herbert; Jin, Guo-Xin","Syntheses and structures of heterometallic clusters by the reaction of o-carboranyl cobaltadichalcogenolato complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","7","749","758","10.1039/b614123d","","","0.71073","MoKα","","0.0856","0.0539","","","0.1079","0.1163","","","","","","0.88","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004973","13.778","0.003","14.753","0.003","17.735","0.004","95.409","0.004","101.631","0.004","90.833","0.004","3513.1","1.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H35 B20 Co O2 S4 W -","- C16 H35 B20 Co O2 S4 W -","- C64 H140 B80 Co4 O8 S16 W4 -","4","2","","Chen, Yin-Qiang; Zhang, Jiasheng; Cai, Shuyi; Hou, Xiu-Feng; Schumann, Herbert; Jin, Guo-Xin","Syntheses and structures of heterometallic clusters by the reaction of o-carboranyl cobaltadichalcogenolato complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","7","749","758","10.1039/b614123d","","","0.71073","MoKα","","0.1305","0.0623","","","0.1233","0.1623","","","","","","0.833","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004974","12.095","0.007","13.725","0.008","14.006","0.008","72.538","0.007","68.77","0.007","66.64","0.007","1956","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H35 B20 Co O2 Se4 W -","- C16 H35 B20 Co O2 Se4 W -","- C32 H70 B40 Co2 O4 Se8 W2 -","2","1","","Chen, Yin-Qiang; Zhang, Jiasheng; Cai, Shuyi; Hou, Xiu-Feng; Schumann, Herbert; Jin, Guo-Xin","Syntheses and structures of heterometallic clusters by the reaction of o-carboranyl cobaltadichalcogenolato complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","7","749","758","10.1039/b614123d","","","0.71073","MoKα","","0.0512","0.0428","","","0.103","0.1046","","","","","","1.002","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004975","11.295","0.004","36.04","0.011","15.458","0.005","90","","99.897","0.006","90","","6199","4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H30 B20 Co2 Ni S4 -","- C14 H30 B20 Co2 Ni S4 -","- C112 H240 B160 Co16 Ni8 S32 -","8","2","","Chen, Yin-Qiang; Zhang, Jiasheng; Cai, Shuyi; Hou, Xiu-Feng; Schumann, Herbert; Jin, Guo-Xin","Syntheses and structures of heterometallic clusters by the reaction of o-carboranyl cobaltadichalcogenolato complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","7","749","758","10.1039/b614123d","","","0.71073","MoKα","","0.1844","0.0546","","","0.0809","0.1021","","","","","","0.706","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004976","35.789","0.012","9.574","0.003","23.449","0.008","90","","117.63","0.005","90","","7118","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H30 B9 Co2 N8 S4 -","- C24 H23 B9 Co2 N8 S4 -","- C192 H184 B72 Co16 N64 S32 -","8","1","","Chen, Yin-Qiang; Zhang, Jiasheng; Cai, Shuyi; Hou, Xiu-Feng; Schumann, Herbert; Jin, Guo-Xin","Syntheses and structures of heterometallic clusters by the reaction of o-carboranyl cobaltadichalcogenolato complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","7","749","758","10.1039/b614123d","","","0.71073","MoKα","","0.1522","0.0725","","","0.1502","0.1863","","","","","","0.978","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004977","38.96","0.008","13.84","0.003","22.006","0.004","90","","117.77","0.03","90","","10499","5","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H43 N18 O0.5 Ru2 -","- C48 H42 N18 O0.5 Ru2 -","- C384 H336 N144 O4 Ru16 -","8","1","","Derossi, Sofia; Adams, Harry; Ward, Michael D.","Hydrogen-bonded assemblies of ruthenium(II)-biimidazole complex cations and cyanometallate anions: structures and photophysics.","Dalton transactions (Cambridge, England : 2003)","2007","","1","33","36","10.1039/b614346f","","","0.71073","MoKα","","0.0612","0.04","","","0.0866","0.0937","","","","","","1.088","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7004978","45.31","0.009","14.86","0.003","22.98","0.005","90","","117.9","0.03","90","","13674","6","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C66 H55 Co N26 Ru2 -","- C66 H55 Co N26 Ru2 -","- C528 H440 Co8 N208 Ru16 -","8","1","","Derossi, Sofia; Adams, Harry; Ward, Michael D.","Hydrogen-bonded assemblies of ruthenium(II)-biimidazole complex cations and cyanometallate anions: structures and photophysics.","Dalton transactions (Cambridge, England : 2003)","2007","","1","33","36","10.1039/b614346f","","","0.71073","MoKα","","0.1235","0.0616","","","0.1435","0.1746","","","","","","1.025","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004979","9.861","0.007","9.412","0.004","23.889","0.01","90","","94.97","0.06","90","","2209","2","173","2","173","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H62 Li2 N4 O2 Si2 -","- C42 H62 Li2 N4 O2 Si2 -","- C84 H124 Li4 N8 O4 Si4 -","2","0.5","","Hitchcock, Peter B.; Lappert, Michael F.; Merle, Philippe G.","Synthesis and structures of selected benzamidinates of Li, Na, Al, Zr and Sn(II) using the C1-symmetric ligands [N(SiMe3)C(C6H4Me-4 or Ph)NPh]-.","Dalton transactions (Cambridge, England : 2003)","2007","","5","585","594","10.1039/b614351b","","","0.71073","MoKα","","0.1046","0.0736","","","0.199","0.2272","","","","","","1.027","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004980","11.6469","0.0004","14.5539","0.0003","20.9017","0.0006","90","","90.016","0.001","90","","3543","0.17","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","[MeAl{Me3SiNC(C6H4Me)NPh}2]","","","- C35 H45 Al N4 Si2 -","- C35 H45 Al N4 Si2 -","- C140 H180 Al4 N16 Si8 -","4","1","","Hitchcock, Peter B.; Lappert, Michael F.; Merle, Philippe G.","Synthesis and structures of selected benzamidinates of Li, Na, Al, Zr and Sn(II) using the C1-symmetric ligands [N(SiMe3)C(C6H4Me-4 or Ph)NPh]-.","Dalton transactions (Cambridge, England : 2003)","2007","","5","585","594","10.1039/b614351b","","x-ray","0.71073","MoKα","","0.0865","0.0519","","","0.1165","0.1334","","","","","","1.014","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004981","10.2505","0.0003","12.4069","0.0003","14.8217","0.0003","105.102","0.001","101.05","0.001","93.509","0.001","1773.81","0.08","173","2","173","2","","","","","","","synthesis as described","6","P -1","-P 1","2","[Al{Me3SiNC(PhMe)NPh}2(Cl/Me)]","","","- C34.52 H43.56 Al Cl0.48 N4 Si2 -","- C34.521 H42 Al Cl0.479 N4 Si2 -","- C69.042 H84 Al2 Cl0.958 N8 Si4 -","2","1","","Hitchcock, Peter B.; Lappert, Michael F.; Merle, Philippe G.","Synthesis and structures of selected benzamidinates of Li, Na, Al, Zr and Sn(II) using the C1-symmetric ligands [N(SiMe3)C(C6H4Me-4 or Ph)NPh]-.","Dalton transactions (Cambridge, England : 2003)","2007","","5","585","594","10.1039/b614351b","","x-ray","0.71073","MoKα","","0.0556","0.0428","","","0.1088","0.117","","","","","","1.016","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004982","10.945","0.004","11.592","0.003","14.515","0.005","90.22","0.02","111.95","0.03","91.32","0.03","1707.5","1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","[Sn{Me3SiNC(C6H4-Me)NPh}2]","","","- C34 H42 N4 Si2 Sn -","- C34 H42 N4 Si2 Sn -","- C68 H84 N8 Si4 Sn2 -","2","1","","Hitchcock, Peter B.; Lappert, Michael F.; Merle, Philippe G.","Synthesis and structures of selected benzamidinates of Li, Na, Al, Zr and Sn(II) using the C1-symmetric ligands [N(SiMe3)C(C6H4Me-4 or Ph)NPh]-.","Dalton transactions (Cambridge, England : 2003)","2007","","5","585","594","10.1039/b614351b","","","0.71073","MoKα","","0.0309","0.0273","","","0.0698","0.0718","","","","","","1.015","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004983","14.1992","0.0005","16.9004","0.0007","17.7967","0.0007","114.887","0.002","98.208","0.002","105.088","0.002","3582","0.3","173","2","173","2","","","","","","","synthesis as described","6","P -1","-P 1","2","[ZrCl{Me3SiNC(C6H4Me)NPh}3].3(toluene)","","","- C72 H87 Cl N6 Si3 Zr -","- C72 H79 Cl N6 Si3 Zr -","- C144 H158 Cl2 N12 Si6 Zr2 -","2","1","","Hitchcock, Peter B.; Lappert, Michael F.; Merle, Philippe G.","Synthesis and structures of selected benzamidinates of Li, Na, Al, Zr and Sn(II) using the C1-symmetric ligands [N(SiMe3)C(C6H4Me-4 or Ph)NPh]-.","Dalton transactions (Cambridge, England : 2003)","2007","","5","585","594","10.1039/b614351b","","x-ray","0.71073","MoKα","","0.1034","0.0818","","","0.2103","0.2258","","","","","","1.099","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004984","10.7511","0.0003","10.9732","0.0003","24.2691","0.0006","77.1925","0.0015","88.8729","0.0016","63.9531","0.0015","2498.45","0.12","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","[{Na(tmeda)(Me3SiNC(C6H4-Me)NPh)}2]","","","- C46 H74 N8 Na2 Si2 -","- C46 H74 N8 Na2 Si2 -","- C92 H148 N16 Na4 Si4 -","2","1","","Hitchcock, Peter B.; Lappert, Michael F.; Merle, Philippe G.","Synthesis and structures of selected benzamidinates of Li, Na, Al, Zr and Sn(II) using the C1-symmetric ligands [N(SiMe3)C(C6H4Me-4 or Ph)NPh]-.","Dalton transactions (Cambridge, England : 2003)","2007","","5","585","594","10.1039/b614351b","","x-ray","0.71073","MoKα","","0.0658","0.0462","","","0.1051","0.1159","","","","","","1.031","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004985","6.6672","0.0005","17.708","0.002","10.1078","0.0009","90","","102.654","0.006","90","","1164.37","0.19","173","2","173","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","[PhNC(NH2)(C6H4Me)]","","","- C14 H14 N2 -","- C14 H14 N2 -","- C56 H56 N8 -","4","1","","Hitchcock, Peter B.; Lappert, Michael F.; Merle, Philippe G.","Synthesis and structures of selected benzamidinates of Li, Na, Al, Zr and Sn(II) using the C1-symmetric ligands [N(SiMe3)C(C6H4Me-4 or Ph)NPh]-.","Dalton transactions (Cambridge, England : 2003)","2007","","5","585","594","10.1039/b614351b","","x-ray","0.71073","MoKα","","0.0768","0.0557","","","0.1404","0.1538","","","","","","1.049","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7004986","11.358","0.002","14.476","0.003","17.519","0.003","86.512","0.012","89.13","0.012","82.367","0.017","2849.6","0.9","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H45 Li N O2 P Si2 -","- C23 H45 Li N O2 P Si2 -","- C92 H180 Li4 N4 O8 P4 Si8 -","4","2","","Izod, Keith; Stewart, John C.; Clegg, William; Harrington, Ross W.","Alkali metal complexes of sterically demanding amino-functionalized secondary phosphanide ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","2","257","264","10.1039/b614373c","","","0.71073","MoKα","","0.0736","0.0547","","","0.1451","0.1538","","","","","","1.197","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004987","9.8078","0.0015","11.4689","0.0016","13.6466","0.0009","90.93","0.009","103.882","0.009","103.782","0.015","1442.9","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H45 N3 Na P Si2 -","- C21 H45 N3 Na P Si2 -","- C42 H90 N6 Na2 P2 Si4 -","2","1","","Izod, Keith; Stewart, John C.; Clegg, William; Harrington, Ross W.","Alkali metal complexes of sterically demanding amino-functionalized secondary phosphanide ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","2","257","264","10.1039/b614373c","","","0.71069","MoKα","","0.0512","0.0339","","","0.0864","0.0942","","","","","","1.072","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004988","14.4291","0.0019","11.2424","0.0015","19.756","0.003","90","","93.555","0.002","90","","3198.6","0.8","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H52 K N4 P Si2 -","- C24 H52 K N4 P Si2 -","- C96 H208 K4 N16 P4 Si8 -","4","1","","Izod, Keith; Stewart, John C.; Clegg, William; Harrington, Ross W.","Alkali metal complexes of sterically demanding amino-functionalized secondary phosphanide ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","2","257","264","10.1039/b614373c","","","0.71073","MoKα","","0.0675","0.0531","","","0.1349","0.1486","","","","","","1.094","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004989","11.1503","0.0015","13.5201","0.0018","15.406","0.002","109.582","0.002","97.502","0.002","110.175","0.002","1972.8","0.5","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H112 N4 Na4 O2 P4 Si8 -","- C56 H112 N4 Na4 O2 P4 Si8 -","- C56 H112 N4 Na4 O2 P4 Si8 -","1","0.5","","Izod, Keith; Stewart, John C.; Clegg, William; Harrington, Ross W.","Alkali metal complexes of sterically demanding amino-functionalized secondary phosphanide ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","2","257","264","10.1039/b614373c","","","0.71069","MoKα","","0.0636","0.0535","","","0.1089","0.1121","","","","","","1.257","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004990","14.603","0.002","10.0903","0.0014","23.551","0.003","90","","122.27","0.006","90","","2934.2","0.7","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H92 K2 N8 P2 Si4 -","- C42 H92 K2 N8 P2 Si4 -","- C84 H184 K4 N16 P4 Si8 -","2","0.5","","Izod, Keith; Stewart, John C.; Clegg, William; Harrington, Ross W.","Alkali metal complexes of sterically demanding amino-functionalized secondary phosphanide ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","2","257","264","10.1039/b614373c","","","0.71073","MoKα","","0.0631","0.0474","","","0.1086","0.1171","","","","","","1.107","","","","has coordinates,has disorder","179753","2020-10-21","18:00:00",""
"7004991","19.1066","0.0012","23.3433","0.001","23.6269","0.0017","90","","90","","90","","10537.9","1.1","200","","","","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C90 H122 Cl4 Co4 N16 O33 -","- C90 H109 Cl4 Co4 N16 O33 -","- C360 H436 Cl16 Co16 N64 O132 -","4","0.5","","Isele, Katharina; Gigon, Fabienne; Williams, Alan F.; Bernardinelli, Gérald; Franz, Patrick; Decurtins, Silvio","Synthesis, structure and properties of {M4O4} cubanes containing nickel(II) and cobalt(II).","Dalton transactions (Cambridge, England : 2003)","2007","","3","332","341","10.1039/b614424a","","","0.71073","MoKα","","","0.037","","","","0.037","","","","","","1.51","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004992","26.129","0.005","10.1329","0.0018","30.099","0.005","90","","93.113","0.005","90","","7957","2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H108 O36 P4 Re4 U2 -","- C48 H108 O36 P4 Re4 U2 -","- C192 H432 O144 P16 Re16 U8 -","4","1","","John, Gordon H.; May, Iain; Sarsfield, Mark J.; Collison, David; Helliwell, Madeleine","Dimeric uranyl complexes with bridging perrhenates.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1603","1610","10.1039/b614481k","","","0.71073","MoKα","","0.0572","0.036","","","0.0715","0.0781","","","","","","0.998","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004993","15.002","0.003","16.58","0.003","17.205","0.003","83.219","0.003","86.142","0.003","78.133","0.003","4154.6","1.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H108 Cl8 O24 P4 Re4 U2 -","- C50 H108 Cl8 O24 P4 Re4 U2 -","- C100 H216 Cl16 O48 P8 Re8 U4 -","2","1","","John, Gordon H.; May, Iain; Sarsfield, Mark J.; Collison, David; Helliwell, Madeleine","Dimeric uranyl complexes with bridging perrhenates.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1603","1610","10.1039/b614481k","","","0.71073","MoKα","","0.0962","0.0723","","","0.1729","0.1876","","","","","","1.053","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004994","13.414","0.0004","15.906","0.0004","17.987","0.0005","66.487","0.002","82.684","0.002","71.82","0.002","3343.42","0.17","150","","150","","","","","","","","M. Manoli, MMC51","4","P -1","-P 1","2","","","","- C92 H184 Mn16 O61 -","- C80 H154 Mn16 O58 -","- C80 H154 Mn16 O58 -","1","0.5","","Manoli, Maria; Prescimone, Alessandro; Mishra, Abhudaya; Parsons, Simon; Christou, George; Brechin, Euan K.","A high-spin molecular wheel from self-assembled 'Mn rods'.","Dalton transactions (Cambridge, England : 2003)","2007","","5","532","534","10.1039/b614492f","","","0.71073","MoKα","","0.0729","0.0457","","0.1436","0.1008","0.1436","","","","","","0.9383","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7004995","14.032","0.007","25.477","0.012","8.293","0.004","90","","93.152","0.007","90","","2960","2","158","2","158","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 B Cu2 F4 N9 O S2 -","- C24 H26 B Cu2 F4 N9 O S2 -","- C96 H104 B4 Cu8 F16 N36 O4 S8 -","4","1","","de Geest, Duncan J.; Noble, Andy; Moubaraki, Boujemaa; Murray, Keith S.; Larsen, David S.; Brooker, Sally","Dicopper(II) complexes of a new pyrazolate-containing Schiff-base macrocycle and related acyclic ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","4","467","475","10.1039/b614637f","","","0.71073","MoKα","","0.1753","0.0588","","","0.1175","0.1365","","","","","","0.757","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004996","16.272","0.005","14.165","0.004","11.528","0.003","90","","95.869","0.004","90","","2643.2","1.3","165","2","165","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H25 Cu2 N11 O S2 -","- C21 H25 Cu2 N11 O S2 -","- C84 H100 Cu8 N44 O4 S8 -","4","1","","de Geest, Duncan J.; Noble, Andy; Moubaraki, Boujemaa; Murray, Keith S.; Larsen, David S.; Brooker, Sally","Dicopper(II) complexes of a new pyrazolate-containing Schiff-base macrocycle and related acyclic ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","4","467","475","10.1039/b614637f","","","0.71073","MoKα","","0.0965","0.0554","","","0.1248","0.1368","","","","","","1.069","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004997","8.7717","0.0005","12.2099","0.0008","14.7707","0.0009","103.909","0.003","102.286","0.003","106.107","0.003","1407.49","0.16","89","2","89","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H32 Cu2 N6 O8 -","- C25 H32 Cu2 N6 O8 -","- C50 H64 Cu4 N12 O16 -","2","1","","de Geest, Duncan J.; Noble, Andy; Moubaraki, Boujemaa; Murray, Keith S.; Larsen, David S.; Brooker, Sally","Dicopper(II) complexes of a new pyrazolate-containing Schiff-base macrocycle and related acyclic ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","4","467","475","10.1039/b614637f","","","0.71073","MoKα","","0.0428","0.0305","","","0.0656","0.0704","","","","","","1.024","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004998","7.6521","0.0005","29.525","0.002","12.4181","0.0008","90","","96.076","0.002","90","","2789.8","0.3","89","2","89","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 Cu2 N8 O7 -","- C22 H34 Cu2 N8 O7 -","- C88 H136 Cu8 N32 O28 -","4","1","","de Geest, Duncan J.; Noble, Andy; Moubaraki, Boujemaa; Murray, Keith S.; Larsen, David S.; Brooker, Sally","Dicopper(II) complexes of a new pyrazolate-containing Schiff-base macrocycle and related acyclic ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","4","467","475","10.1039/b614637f","","","0.71073","MoKα","","0.0569","0.0546","","","0.1402","0.1411","","","","","","1.244","","","","has coordinates","179753","2020-10-21","18:00:00",""
"7004999","32.9247","0.0013","12.8185","0.0005","10.2151","0.0004","90","","90","","90","","4311.2","0.3","150","2","150","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C78 H63 Cl2 Co7 N36 O1.5 -","- C78 H63 Cl2 Co7 N36 O1.5 -","- C156 H126 Cl4 Co14 N72 O3 -","2","0.5","","Wang, Wen-Zhen; Ismayilov, Rayyat Huseyn; Lee, Gene-Hsiang; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming","The nano-scale molecule with the longest delocalized metal-metal bonds: linear heptacobalt(II) metal string complexes [Co7(micro7-L)4X2].","Dalton transactions (Cambridge, England : 2003)","2007","","8","830","839","10.1039/b614661a","","","0.71073","MoKα","","0.1494","0.0826","","","0.226","0.2818","","","","","","1.024","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005000","30.641","0.001","16.2874","0.0006","22.2876","0.0007","90","","109.727","0.002","90","","10470.1","0.6","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C98 H106 Co7 N38 O S2 -","- C98 H106 Co7 N38 O S2 -","- C392 H424 Co28 N152 O4 S8 -","4","0.5","","Wang, Wen-Zhen; Ismayilov, Rayyat Huseyn; Lee, Gene-Hsiang; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming","The nano-scale molecule with the longest delocalized metal-metal bonds: linear heptacobalt(II) metal string complexes [Co7(micro7-L)4X2].","Dalton transactions (Cambridge, England : 2003)","2007","","8","830","839","10.1039/b614661a","","","0.71073","MoKα","","0.2063","0.0881","","","0.2592","0.3302","","","","","","1.061","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005001","13.5397","0.0002","10.3523","0.0002","28.4128","0.0005","90","","91.776","0.0009","90","","3980.62","0.12","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C80 H62 Cl2 Co7 N32 O -","- C80 H62 Cl2 Co7 N32 O -","- C160 H124 Cl4 Co14 N64 O2 -","2","0.5","","Wang, Wen-Zhen; Ismayilov, Rayyat Huseyn; Lee, Gene-Hsiang; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming","The nano-scale molecule with the longest delocalized metal-metal bonds: linear heptacobalt(II) metal string complexes [Co7(micro7-L)4X2].","Dalton transactions (Cambridge, England : 2003)","2007","","8","830","839","10.1039/b614661a","","","0.71073","MoKα","","0.1417","0.0787","","","0.2672","0.3174","","","","","","1.095","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005002","27.7926","0.0008","20.7712","0.0005","30.0433","0.0008","90","","95.0229","0.001","90","","17277","0.8","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C82.5 H63 Cl Co7 N34 O S2 -","- C82.5 H63 Cl Co7 N34 O S2 -","- C660 H504 Cl8 Co56 N272 O8 S16 -","8","1","","Wang, Wen-Zhen; Ismayilov, Rayyat Huseyn; Lee, Gene-Hsiang; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming","The nano-scale molecule with the longest delocalized metal-metal bonds: linear heptacobalt(II) metal string complexes [Co7(micro7-L)4X2].","Dalton transactions (Cambridge, England : 2003)","2007","","8","830","839","10.1039/b614661a","","","0.71073","MoKα","","0.191","0.0899","","","0.2705","0.3299","","","","","","1.118","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005003","21.5338","0.0007","21.5338","0.0007","15.5334","0.0008","90","","90","","90","","7202.9","0.5","150","2","150","2","","","","","","","","7","P 42 b c","P 4c -2ab","106","","","","- C24 H42 Cl2 Fe N2 O12 P4 -","- C24 H42 Cl2 Fe N2 O12 P4 -","- C192 H336 Cl16 Fe8 N16 O96 P32 -","8","1","","Burrows, Andrew D.; Dodds, Deborah; Kirk, Andrew S.; Lowe, John P.; Mahon, Mary F.; Warren, John E.; Whittlesey, Michael K.","Substitution and derivatization reactions of a water soluble iron(II) complex containing a self-assembled tetradentate phosphine ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","5","570","580","10.1039/b614726g","","","0.6751","Synchrotron","","0.0822","0.0552","","","0.1454","0.1646","","","","","","1.01","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005004","7.626","0.0001","13.831","0.0002","16.735","0.0003","90","","90","","90","","1765.13","0.05","150","2","150","2","","","","","","","","6","P 2 n n","P -2n 2","34","","","","- C24 H43 Fe N8 O12.5 P4 -","- C24 H42 Fe N8 O12.5 P4 -","- C48 H84 Fe2 N16 O25 P8 -","2","0.5","","Burrows, Andrew D.; Dodds, Deborah; Kirk, Andrew S.; Lowe, John P.; Mahon, Mary F.; Warren, John E.; Whittlesey, Michael K.","Substitution and derivatization reactions of a water soluble iron(II) complex containing a self-assembled tetradentate phosphine ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","5","570","580","10.1039/b614726g","","","0.71073","MoKα","","0.0369","0.0322","","","0.0587","0.0598","","","","","","1.044","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005005","8.002","0.0001","17.335","0.0002","15.644","0.0002","90","","101.004","0.001","90","","2130.15","0.05","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C12 H32 Cl2 Fe N2 O7 P4 -","- C12 H32 Cl2 Fe N2 O7 P4 -","- C48 H128 Cl8 Fe4 N8 O28 P16 -","4","1","","Burrows, Andrew D.; Dodds, Deborah; Kirk, Andrew S.; Lowe, John P.; Mahon, Mary F.; Warren, John E.; Whittlesey, Michael K.","Substitution and derivatization reactions of a water soluble iron(II) complex containing a self-assembled tetradentate phosphine ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","5","570","580","10.1039/b614726g","","","0.71073","MoKα","","0.0364","0.031","","","0.0621","0.0639","","","","","","1.127","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005006","15.704","0.0005","9.775","0.0003","17.643","0.0005","90","","110.309","0.002","90","","2539.95","0.14","150","2","150","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C14 H34 Fe N4 O8 P4 S2 -","- C14 H31 Fe N4 O8 P4 S2 -","- C56 H124 Fe4 N16 O32 P16 S8 -","4","1","","Burrows, Andrew D.; Dodds, Deborah; Kirk, Andrew S.; Lowe, John P.; Mahon, Mary F.; Warren, John E.; Whittlesey, Michael K.","Substitution and derivatization reactions of a water soluble iron(II) complex containing a self-assembled tetradentate phosphine ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","5","570","580","10.1039/b614726g","","","0.71073","MoKα","","0.0944","0.0472","","","0.0947","0.1118","","","","","","1.029","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005007","33.162","0.0004","9.607","0.0001","27.886","0.0004","90","","93.686","0.001","90","","8865.75","0.19","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H31.63 Fe N8 O6.81 P4 -","- C12 H31 Fe N8 O6.8125 P4 -","- C192 H496 Fe16 N128 O109 P64 -","16","2","","Burrows, Andrew D.; Dodds, Deborah; Kirk, Andrew S.; Lowe, John P.; Mahon, Mary F.; Warren, John E.; Whittlesey, Michael K.","Substitution and derivatization reactions of a water soluble iron(II) complex containing a self-assembled tetradentate phosphine ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","5","570","580","10.1039/b614726g","","","0.71073","MoKα","","0.051","0.0398","","","0.0883","0.0925","","","","","","1.077","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005008","8.69","0.0001","16.308","0.0002","32.298","0.0005","90","","91.948","0.001","90","","4574.51","0.1","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H33.4 Fe N2 O10.7 P4 -","- C13 H30 Fe N2 O10.7 P4 -","- C104 H240 Fe8 N16 O85.6 P32 -","8","2","","Burrows, Andrew D.; Dodds, Deborah; Kirk, Andrew S.; Lowe, John P.; Mahon, Mary F.; Warren, John E.; Whittlesey, Michael K.","Substitution and derivatization reactions of a water soluble iron(II) complex containing a self-assembled tetradentate phosphine ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","5","570","580","10.1039/b614726g","","","0.71073","MoKα","","0.1983","0.079","","","0.1521","0.1973","","","","","","1.018","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005009","16.344","0.0008","14.2436","0.0007","20.7566","0.001","90","","90","","90","","4832.1","0.4","150","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C14 H32 Fe N2 O13 P4 S -","- C14 H32 Fe N2 O13 P4 S -","- C112 H256 Fe8 N16 O104 P32 S8 -","8","1","","Burrows, Andrew D.; Dodds, Deborah; Kirk, Andrew S.; Lowe, John P.; Mahon, Mary F.; Warren, John E.; Whittlesey, Michael K.","Substitution and derivatization reactions of a water soluble iron(II) complex containing a self-assembled tetradentate phosphine ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","5","570","580","10.1039/b614726g","","","0.71073","MoKα","","0.0566","0.0364","","","0.0787","0.0854","","","","","","0.949","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005010","9.446","0.0002","16.495","0.0003","13.462","0.0003","90","","90.274","0.001","90","","2097.51","0.07","150","2","150","2","","","","","","","","7","P 1 n 1","P -2yac","7","","","","- C27.9 H49.8 Fe N2 O17.3 P4 S -","- C27.9 H49.8 Fe N2 O17.3 P4 S -","- C55.8 H99.6 Fe2 N4 O34.6 P8 S2 -","2","1","","Burrows, Andrew D.; Dodds, Deborah; Kirk, Andrew S.; Lowe, John P.; Mahon, Mary F.; Warren, John E.; Whittlesey, Michael K.","Substitution and derivatization reactions of a water soluble iron(II) complex containing a self-assembled tetradentate phosphine ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","5","570","580","10.1039/b614726g","","","0.71073","MoKα","","0.0686","0.0599","","","0.1251","0.1281","","","","","","1.096","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005011","14.85","0.0004","19.2194","0.0006","13.7915","0.0004","90","","110.538","0.005","90","","3686","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H48 F3 N3 O Pd -","- C39 H48 F3 N3 O Pd -","- C156 H192 F12 N12 O4 Pd4 -","4","1","","Kokatam, Swarna-Latha; Chaudhuri, Phalguni; Weyhermüller, Thomas; Wieghardt, Karl","Molecular and electronic structure of square planar complexes [PdII(tbpy)(L N,O IP)]0, [PdII(tbpy)(LN,O ISQ)](PF6), and [PdII(tbpy)(L N,O IBQ)](PF6)(BF4).2CH2Cl2: an o-iminophenolato based ligand centered, three-membered redox series.","Dalton transactions (Cambridge, England : 2003)","2007","","3","373","378","10.1039/b614745c","","","0.71073","MoKα","","0.0303","0.0261","","","0.0603","0.0623","","","","","","1.075","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005012","17.7791","0.0005","20.999","0.0007","21.6489","0.0007","90","","90","","90","","8082.5","0.4","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C39 H48 F9 N3 O P Pd -","- C39 H48 F9 N3 O P Pd -","- C312 H384 F72 N24 O8 P8 Pd8 -","8","1","","Kokatam, Swarna-Latha; Chaudhuri, Phalguni; Weyhermüller, Thomas; Wieghardt, Karl","Molecular and electronic structure of square planar complexes [PdII(tbpy)(L N,O IP)]0, [PdII(tbpy)(LN,O ISQ)](PF6), and [PdII(tbpy)(L N,O IBQ)](PF6)(BF4).2CH2Cl2: an o-iminophenolato based ligand centered, three-membered redox series.","Dalton transactions (Cambridge, England : 2003)","2007","","3","373","378","10.1039/b614745c","","","0.71073","MoKα","","0.0746","0.0417","","","0.0803","0.0928","","","","","","1.037","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005013","37.901","0.002","11.5338","0.0006","26.74","0.002","90","","124.352","0.006","90","","9650.4","1.2","100","2","100","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C41 H52 B Cl4 F13 N3 O P Pd -","- C41 H52 B Cl4 F13 N3 O P Pd -","- C328 H416 B8 Cl32 F104 N24 O8 P8 Pd8 -","8","1","","Kokatam, Swarna-Latha; Chaudhuri, Phalguni; Weyhermüller, Thomas; Wieghardt, Karl","Molecular and electronic structure of square planar complexes [PdII(tbpy)(L N,O IP)]0, [PdII(tbpy)(LN,O ISQ)](PF6), and [PdII(tbpy)(L N,O IBQ)](PF6)(BF4).2CH2Cl2: an o-iminophenolato based ligand centered, three-membered redox series.","Dalton transactions (Cambridge, England : 2003)","2007","","3","373","378","10.1039/b614745c","","","0.71073","MoKα","","0.0791","0.0536","","","0.1201","0.1329","","","","","","1.043","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005014","16.948","0.003","11.14","0.002","18.296","0.004","90","","98.73","0.03","90","","3414.3","1.2","150","2","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H42 Ag2 N12 O12 Pd2 -","- C22 H42 Ag2 N12 O12 Pd2 -","- C88 H168 Ag8 N48 O48 Pd8 -","4","0.5","","Shen, Wei-Zheng; Costisella, Burkhard; Lippert, Bernhard","Pd2Ag triangle supported by two micro3-amidopyridine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","8","851","858","10.1039/b614751h","","","0.71073","MoKα","","","0.0855","","","","0.2267","","","","","","0.983","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005015","18.175","0.004","12.672","0.003","20.633","0.004","90","","90","","90","","4752.1","1.8","150","2","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C16 H28 N8 O8 Pd -","- C16 H28 N8 O8 Pd -","- C128 H224 N64 O64 Pd8 -","8","1","","Shen, Wei-Zheng; Costisella, Burkhard; Lippert, Bernhard","Pd2Ag triangle supported by two micro3-amidopyridine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","8","851","858","10.1039/b614751h","","","0.71073","MoKα","","","0.0387","","","","0.0817","","","","","","0.801","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005016","16.152","0.003","16.152","0.003","17.855","0.008","90","","90","","90","","4658","2","168","2","168","2","","","","","","","","7","I -4","I -4","82","","","","- C80 H76 B4 Cu4 F16 N24 O8 -","- C54 H44 Cu4 N20 O8 -","- C108 H88 Cu8 N40 O16 -","2","0.25","","Klingele, Julia; Boas, John F.; Pilbrow, John R.; Moubaraki, Boujemaa; Murray, Keith S.; Berry, Kevin J.; Hunter, Keith A.; Jameson, Geoffrey B.; Boyd, Peter D. W.; Brooker, Sally","A [2 x 2] nickel(ii) grid and a copper(ii) square result from differing binding modes of a pyrazine-based diamide ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","6","633","645","10.1039/b614796h","","","0.71073","MoKα","","0.1252","0.0613","","","0.1286","0.1479","","","","","","0.859","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005017","13.9483","0.0002","14.1741","0.0002","26.0046","0.0002","82.338","0.001","86.135","0.001","87.723","0.001","5081.28","0.11","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C21.5 H22 B1.5 Cu F6 N6.75 O2.13 -","- C21.5 H22 B1.5 Cu F6 N6.75 O2.125 -","- C172 H176 B12 Cu8 F48 N54 O17 -","8","4","","Klingele, Julia; Boas, John F.; Pilbrow, John R.; Moubaraki, Boujemaa; Murray, Keith S.; Berry, Kevin J.; Hunter, Keith A.; Jameson, Geoffrey B.; Boyd, Peter D. W.; Brooker, Sally","A [2 x 2] nickel(ii) grid and a copper(ii) square result from differing binding modes of a pyrazine-based diamide ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","6","633","645","10.1039/b614796h","","","0.71073","MoKα","","0.084","0.0673","","","0.1976","0.2126","","","","","","1.049","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005018","5.04","0.0002","20.6432","0.0006","17.8496","0.0002","90","","93.204","0.002","90","","1854.2","0.09","83","2","83","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 N6 O2 -","- C20 H20 N6 O2 -","- C80 H80 N24 O8 -","4","1","","Klingele, Julia; Boas, John F.; Pilbrow, John R.; Moubaraki, Boujemaa; Murray, Keith S.; Berry, Kevin J.; Hunter, Keith A.; Jameson, Geoffrey B.; Boyd, Peter D. W.; Brooker, Sally","A [2 x 2] nickel(ii) grid and a copper(ii) square result from differing binding modes of a pyrazine-based diamide ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","6","633","645","10.1039/b614796h","","","0.71073","MoKα","","0.1226","0.0604","","","0.1066","0.1315","","","","","","1.063","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005019","21.7134","0.0003","21.8434","0.0003","26.2468","0.0001","108.823","0.001","103.04","0.001","90.721","0.001","11429.8","0.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C80 H78 B2 F8 N24 Ni4 O8 -","- C80 H76 B2 F8 N24 Ni4 O8 -","- C320 H304 B8 F32 N96 Ni16 O32 -","4","2","","Klingele, Julia; Boas, John F.; Pilbrow, John R.; Moubaraki, Boujemaa; Murray, Keith S.; Berry, Kevin J.; Hunter, Keith A.; Jameson, Geoffrey B.; Boyd, Peter D. W.; Brooker, Sally","A [2 x 2] nickel(ii) grid and a copper(ii) square result from differing binding modes of a pyrazine-based diamide ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","6","633","645","10.1039/b614796h","","","0.71073","MoKα","","0.1484","0.0629","","","0.1392","0.1629","","","","","","0.746","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005020","37.69","0.02","24.5","0.01","22.63","0.01","90","","119.77","0.02","90","","18139","15","213.2","","213","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C182 H182 Fe4 O P8 -","- C182 H172 Fe4 O P8 -","- C728 H688 Fe16 O4 P32 -","4","0.5","","Tanaka, Yuya; Ozawa, Takehiro; Inagaki, Akiko; Akita, Munetaka","Redox-active polyiron complexes with tetra(ethynylphenyl)ethene and [2,2]paracyclophane spacers containing ethynylphenyl units: extension to higher dimensional molecular wire.","Dalton transactions (Cambridge, England : 2003)","2007","","9","928","933","10.1039/b614803d","","","0.7107","MoKα","","","0.1061","","","","0.3326","","","","","","1.108","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005021","11.5863","0.0003","12.591","0.0004","19.0145","0.0006","78.832","0.002","74.601","0.002","62.805","0.001","2370.21","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","Tetraalkylammonium polyoxometalate","Tetraalkylammonium polyoxometalate","","- C32 H72 N2 O19 W6 -","- C32 H72 N2 O19 W6 -","- C64 H144 N4 O38 W12 -","2","1","","Rickert, Paul G.; Antonio, Mark R.; Firestone, Millicent A.; Kubatko, Karrie-Ann; Szreder, Tomasz; Wishart, James F.; Dietz, Mark L.","Tetraalkylphosphonium polyoxometalates: electroactive, ""task-specific"" ionic liquids.","Dalton transactions (Cambridge, England : 2003)","2007","","5","529","531","10.1039/b614950m","","","0.71073","MoKα","","0.032","0.0272","","","0.0641","0.0669","","","","","","1.133","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005022","13.368","0.002","14.379","0.002","15.938","0.002","65.408","0.002","74.714","0.002","79.138","0.002","2676.3","0.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C52.75 H56.75 N16.25 O6.25 Zn2 -","- C52 H56 N16 O6 Zn2 -","- C104 H112 N32 O12 Zn4 -","2","1","","Naskar, Subhendu; Corbella, Montserrat; Blake, Alexander J.; Chattopadhyay, Shyamal Kumar","Versatility of 2,6-diacetylpyridine (dap) hydrazones in generating varied molecular architectures: synthesis and structural characterization of a binuclear double helical Zn(II) complex and a Mn(II) coordination polymer.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1150","1159","10.1039/b615004g","","","0.71073","MoKα","","0.0496","0.0369","","","0.0937","0.0982","","","","","","0.96","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005023","25.393","0.004","9.3846","0.0013","28.321","0.004","90","","99.473","0.003","90","","6656.9","1.7","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C67 H67 Mn3 N21 O10 S2 -","- C63 H55 Mn3 N21 O8 -","- C252 H220 Mn12 N84 O32 -","4","0.5","","Naskar, Subhendu; Corbella, Montserrat; Blake, Alexander J.; Chattopadhyay, Shyamal Kumar","Versatility of 2,6-diacetylpyridine (dap) hydrazones in generating varied molecular architectures: synthesis and structural characterization of a binuclear double helical Zn(II) complex and a Mn(II) coordination polymer.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1150","1159","10.1039/b615004g","","","0.71073","MoKα","","0.0886","0.0458","","","0.0893","0.0964","","","","","","0.85","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005024","17.977","0.019","25.31","0.03","22.76","0.02","90","","109.884","0.018","90","","9738","18","303","2","303","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C99 H81 Cu6 N19 O2 P2 -","- C99 H81 Cu6 N19 O2 P2 -","- C396 H324 Cu24 N76 O8 P8 -","4","1","","Mezei, Gellert; Rivera-Carrillo, Marlyn; Raptis, Raphael G.","Trigonal-prismatic CuII6-pyrazolato cages: structural and electrochemical study, evidence of charge delocalisation.","Dalton transactions (Cambridge, England : 2003)","2007","","1","37","40","10.1039/b615018g","","","0.71073","MoKα","","0.1191","0.0604","","","0.1518","0.2014","","","","","","1.113","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005025","11.6703","0.0014","20.722","0.002","21.286","0.003","97.971","0.002","90.476","0.002","90.654","0.002","5097.3","1.1","302","2","302","2","","","","","","","","7","P -1","-P 1","2","","","","- C101 H79 Cl10 Cu6 N19 O2 P2 -","- C101 H79 Cl10 Cu6 N19 O2 P2 -","- C202 H158 Cl20 Cu12 N38 O4 P4 -","2","1","","Mezei, Gellert; Rivera-Carrillo, Marlyn; Raptis, Raphael G.","Trigonal-prismatic CuII6-pyrazolato cages: structural and electrochemical study, evidence of charge delocalisation.","Dalton transactions (Cambridge, England : 2003)","2007","","1","37","40","10.1039/b615018g","","","0.71073","MoKα","","0.0687","0.0483","","","0.1353","0.1493","","","","","","1.01","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005026","19.588","0.002","20.268","0.002","27.541","0.003","90","","90","","90","","10934","2","299","2","299","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C105 H86 Cl13 Cu6 N19 O3 P2 -","- C105 H86 Cl13 Cu6 N19 O3 P2 -","- C420 H344 Cl52 Cu24 N76 O12 P8 -","4","1","","Mezei, Gellert; Rivera-Carrillo, Marlyn; Raptis, Raphael G.","Trigonal-prismatic CuII6-pyrazolato cages: structural and electrochemical study, evidence of charge delocalisation.","Dalton transactions (Cambridge, England : 2003)","2007","","1","37","40","10.1039/b615018g","","","0.71073","MoKα","","0.0723","0.0392","","","0.0796","0.1012","","","","","","0.979","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005027","7.5684","0.0015","10.878","0.002","12.426","0.003","111.59","0.03","96.93","0.03","108.3","0.03","870.2","0.5","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H9 Fe2 N O7 S2 -","- C13 H9 Fe2 N O7 S2 -","- C26 H18 Fe4 N2 O14 S4 -","2","1","","Jiang, Shi; Liu, Jianhui; Shi, Yu; Wang, Zhen; Akermark, Björn; Sun, Licheng","Fe-S complexes containing five-membered heterocycles: novel models for the active site of hydrogenases with unusual low reduction potential.","Dalton transactions (Cambridge, England : 2003)","2007","","8","896","902","10.1039/b615037c","","","0.71073","MoKα","","0.0396","0.0335","","","0.0935","0.1065","","","","","","1.027","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005028","25.2878","0.0017","7.572","0.0005","22.6997","0.0015","90","","121.103","0.001","90","","3721.7","0.4","273","2","273","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H9 Fe2 N O6 S3 -","- C13 H9 Fe2 N O6 S3 -","- C104 H72 Fe16 N8 O48 S24 -","8","1","","Jiang, Shi; Liu, Jianhui; Shi, Yu; Wang, Zhen; Akermark, Björn; Sun, Licheng","Fe-S complexes containing five-membered heterocycles: novel models for the active site of hydrogenases with unusual low reduction potential.","Dalton transactions (Cambridge, England : 2003)","2007","","8","896","902","10.1039/b615037c","","","0.71073","MoKα","","0.0515","0.0427","","","0.1284","0.1349","","","","","","1.041","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005029","9.16","0.004","18.101","0.008","12.148","0.006","90","","109.265","0.008","90","","1901.4","1.5","273","2","273","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C13 H8 Br Fe2 N O6 S3 -","- C13 H8 Br Fe2 N O6 S3 -","- C52 H32 Br4 Fe8 N4 O24 S12 -","4","1","","Jiang, Shi; Liu, Jianhui; Shi, Yu; Wang, Zhen; Akermark, Björn; Sun, Licheng","Fe-S complexes containing five-membered heterocycles: novel models for the active site of hydrogenases with unusual low reduction potential.","Dalton transactions (Cambridge, England : 2003)","2007","","8","896","902","10.1039/b615037c","","","0.71073","MoKα","","0.089","0.0433","","","0.0747","0.0857","","","","","","0.79","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005030","10.4705","0.0007","6.7453","0.0005","18.4712","0.0013","90","","93.13","0.001","90","","1302.61","0.16","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H11 Cr N O6 -","- C11 H11 Cr N O6 -","- C44 H44 Cr4 N4 O24 -","4","1","","Stander, Elzet; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparing alpha,beta-unsaturated Fischer-type carbene complexes via an unforeseen route.","Dalton transactions (Cambridge, England : 2003)","2007","","4","424","429","10.1039/b615079a","","","0.71073","MoKα","","0.0366","0.033","","","0.0797","0.0817","","","","","","1.045","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005031","10.5753","0.0005","6.8567","0.0003","18.7407","0.0009","90","","93.036","0.001","90","","1357.01","0.11","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Complex 2b","","","- C11 H11 N O6 W -","- C11 H11 N O6 W -","- C44 H44 N4 O24 W4 -","4","1","","Stander, Elzet; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparing alpha,beta-unsaturated Fischer-type carbene complexes via an unforeseen route.","Dalton transactions (Cambridge, England : 2003)","2007","","4","424","429","10.1039/b615079a","","","0.71073","MoKα","","0.0196","0.0176","","","0.0394","0.0402","","","","","","1.012","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005032","6.8048","0.0005","8.7412","0.0006","12.1146","0.0009","71.563","0.001","85.909","0.001","81.968","0.001","676.63","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H13 Cr N O5 S -","- C11 H13 Cr N O5 S -","- C22 H26 Cr2 N2 O10 S2 -","2","1","","Stander, Elzet; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparing alpha,beta-unsaturated Fischer-type carbene complexes via an unforeseen route.","Dalton transactions (Cambridge, England : 2003)","2007","","4","424","429","10.1039/b615079a","","","0.71073","MoKα","","0.0361","0.0314","","","0.0752","0.0772","","","","","","1.09","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005033","9.0563","0.0006","17.9987","0.0011","9.3987","0.0006","90","","112.183","0.001","90","","1418.61","0.16","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Complex 3b","","","- C11 H13 N O5 S W -","- C11 H13 N O5 S W -","- C44 H52 N4 O20 S4 W4 -","4","1","","Stander, Elzet; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparing alpha,beta-unsaturated Fischer-type carbene complexes via an unforeseen route.","Dalton transactions (Cambridge, England : 2003)","2007","","4","424","429","10.1039/b615079a","","","0.71073","MoKα","","0.025","0.0223","","","0.0513","0.0524","","","","","","1.048","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005034","18.132","0.0008","18.8215","0.0007","23.11","0.0009","90","","90","","90","","7886.8","0.5","173","2","173","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C38 H60 N2 O2 Zn2 -","- C38 H60 N2 O2 Zn2 -","- C304 H480 N16 O16 Zn16 -","8","","","Doyle, David J.; Gibson, Vernon C.; White, Andrew J. P.","Synthesis and structures of bimetallic and polymeric zinc coordination compounds supported by salicylaldiminato and anilido-aldimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","3","358","363","10.1039/b615080b","","","0.71073","MoKα","","0.0659","0.0632","","","0.1493","0.1517","","","","","","1.169","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005035","8.9147","0.0005","14.7627","0.0009","16.4967","0.0009","88.863","0.006","86.406","0.004","72.948","0.005","2071.5","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H60 N4 Zn2 -","- C45 H60 N4 Zn2 -","- C90 H120 N8 Zn4 -","2","1","","Doyle, David J.; Gibson, Vernon C.; White, Andrew J. P.","Synthesis and structures of bimetallic and polymeric zinc coordination compounds supported by salicylaldiminato and anilido-aldimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","3","358","363","10.1039/b615080b","","","1.54248","CuKα","","0.0494","0.0415","","","0.1199","0.1247","","","","","","1.111","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005036","11.5694","0.0006","13.4841","0.0008","14.3159","0.0007","90","","98.626","0.004","90","","2208.1","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C48 H66 N4 Zn2 -","- C48 H66 N4 Zn2 -","- C96 H132 N8 Zn4 -","2","0.5","","Doyle, David J.; Gibson, Vernon C.; White, Andrew J. P.","Synthesis and structures of bimetallic and polymeric zinc coordination compounds supported by salicylaldiminato and anilido-aldimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","3","358","363","10.1039/b615080b","","","0.71073","MoKα","","0.108","0.0447","","","0.0948","0.1106","","","","","","0.91","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005037","9.154","0.002","10.703","0.003","13.401","0.002","90","","90","","90","","1313","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C8 H6 Cl4 N4 Re -","- C8 H6 Cl4 N4 Re -","- C32 H24 Cl16 N16 Re4 -","4","1","","Chiozzone, Raúl; González, Ricardo; Kremer, Carlos; Cerdá, María Fernanda; Armentano, Donatella; De Munno, Giovanni; Martínez-Lillo, José; Faus, Juan","A novel series of rhenium-bipyrimidine complexes: synthesis, crystal structure and electrochemical properties.","Dalton transactions (Cambridge, England : 2003)","2007","","6","653","660","10.1039/b615136a","","","0.71073","MoKα","","0.0459","0.0422","","","0.1059","0.1095","","","","","","1.058","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005038","9.6216","0.0009","10.8583","0.001","13.4431","0.0011","90","","90","","90","","1404.5","0.2","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C8 H6 Br4 N4 Re -","- C8 H6 Br4 N4 Re -","- C32 H24 Br16 N16 Re4 -","4","1","","Chiozzone, Raúl; González, Ricardo; Kremer, Carlos; Cerdá, María Fernanda; Armentano, Donatella; De Munno, Giovanni; Martínez-Lillo, José; Faus, Juan","A novel series of rhenium-bipyrimidine complexes: synthesis, crystal structure and electrochemical properties.","Dalton transactions (Cambridge, England : 2003)","2007","","6","653","660","10.1039/b615136a","","","0.71073","MoKα","","0.0394","0.0299","","","0.0646","0.0671","","","","","","0.989","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005039","9.0661","0.0009","12.635","0.0012","14.2539","0.0013","89.361","0.002","86.606","0.002","82.236","0.002","1615","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H26 Cl4 N4 P Re -","- C32 H26 Cl4 N4 P Re -","- C64 H52 Cl8 N8 P2 Re2 -","2","1","","Chiozzone, Raúl; González, Ricardo; Kremer, Carlos; Cerdá, María Fernanda; Armentano, Donatella; De Munno, Giovanni; Martínez-Lillo, José; Faus, Juan","A novel series of rhenium-bipyrimidine complexes: synthesis, crystal structure and electrochemical properties.","Dalton transactions (Cambridge, England : 2003)","2007","","6","653","660","10.1039/b615136a","","","0.71073","MoKα","","0.0241","0.02","","","0.0473","0.0489","","","","","","1.027","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005040","16.227","0.003","11.094","0.002","18.502","0.004","90","","105.87","0.03","90","","3203.8","1.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H42 Br4 N5 Re -","- C24 H42 Br4 N5 Re -","- C96 H168 Br16 N20 Re4 -","4","2","","Chiozzone, Raúl; González, Ricardo; Kremer, Carlos; Cerdá, María Fernanda; Armentano, Donatella; De Munno, Giovanni; Martínez-Lillo, José; Faus, Juan","A novel series of rhenium-bipyrimidine complexes: synthesis, crystal structure and electrochemical properties.","Dalton transactions (Cambridge, England : 2003)","2007","","6","653","660","10.1039/b615136a","","","0.71073","MoKα","","0.0734","0.0501","","","0.1143","0.1218","","","","","","0.892","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005041","9.499","0.003","10.728","0.003","17.016","0.005","85.394","0.006","85.031","0.005","87.978","0.005","1721.2","0.9","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H44 Cl2 Cu2 N6 O10 -","- C30 H44 Cl2 Cu2 N6 O10 -","- C60 H88 Cl4 Cu4 N12 O20 -","2","1","","Qian, Jing; Gu, Wen; Liu, Hui; Gao, Fengxian; Feng, Li; Yan, Shiping; Liao, Daizheng; Cheng, Peng","The first dinuclear copper(II) and zinc(II) complexes containing novel Bis-TACN: syntheses, structures, and DNA cleavage activities.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1060","1066","10.1039/b615148e","","","0.71073","MoKα","","0.1239","0.0701","","","0.1696","0.2103","","","","","","1.025","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005042","9.4956","0.0013","10.7621","0.0014","17.158","0.002","86.368","0.002","85.878","0.002","88.869","0.002","1745.2","0.4","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H44 Cl2 N6 O10 Zn2 -","- C30 H44 Cl2 N6 O10 Zn2 -","- C60 H88 Cl4 N12 O20 Zn4 -","2","1","","Qian, Jing; Gu, Wen; Liu, Hui; Gao, Fengxian; Feng, Li; Yan, Shiping; Liao, Daizheng; Cheng, Peng","The first dinuclear copper(II) and zinc(II) complexes containing novel Bis-TACN: syntheses, structures, and DNA cleavage activities.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1060","1066","10.1039/b615148e","","","0.71073","MoKα","","0.0746","0.055","","","0.1522","0.166","","","","","","1.077","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005043","8.3937","0.0016","27.97","0.006","10.273","0.002","90","","102.069","0.015","90","","2358.5","0.8","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C18 H36 Cl3 Cu2 N4 O2 -","- C18 H36 Cl3 Cu2 N4 O2 -","- C72 H144 Cl12 Cu8 N16 O8 -","4","1","","Silversides, Jon D.; Allan, Cheryll C.; Archibald, Stephen J.","Copper(II) cyclam-based complexes for radiopharmaceutical applications: synthesis and structural analysis.","Dalton transactions (Cambridge, England : 2003)","2007","","9","971","978","10.1039/b615329a","","","0.71073","MoKα","","0.1278","0.0681","","","0.1662","0.1982","","","","","","0.933","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005044","8.5304","0.0015","15.337","0.003","9.01","0.002","90","","90.472","0.018","90","","1178.7","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H38 Cu N4 O12 -","- C18 H38 Cu N4 O12 -","- C36 H76 Cu2 N8 O24 -","2","0.5","","Silversides, Jon D.; Allan, Cheryll C.; Archibald, Stephen J.","Copper(II) cyclam-based complexes for radiopharmaceutical applications: synthesis and structural analysis.","Dalton transactions (Cambridge, England : 2003)","2007","","9","971","978","10.1039/b615329a","","","0.71073","MoKα","","0.0471","0.038","","","0.1065","0.1115","","","","","","1.127","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005045","7.946","0.002","16.644","0.003","8.775","0.002","90","","95.49","0.02","90","","1155.2","0.4","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C18 H34 Cu N4 O10 -","- C18 H34 Cu N4 O10 -","- C36 H68 Cu2 N8 O20 -","2","0.5","","Silversides, Jon D.; Allan, Cheryll C.; Archibald, Stephen J.","Copper(II) cyclam-based complexes for radiopharmaceutical applications: synthesis and structural analysis.","Dalton transactions (Cambridge, England : 2003)","2007","","9","971","978","10.1039/b615329a","","","0.71073","MoKα","","0.0726","0.0498","","","0.1319","0.1428","","","","","","0.975","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005046","14.064","0.0015","9.473","0.0011","17.359","0.002","90","","90","","90","","2312.7","0.5","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C14 H32 Cl2 Cu N4 O12 -","- C14 H32 Cl2 Cu N4 O12 -","- C56 H128 Cl8 Cu4 N16 O48 -","4","1","","Silversides, Jon D.; Allan, Cheryll C.; Archibald, Stephen J.","Copper(II) cyclam-based complexes for radiopharmaceutical applications: synthesis and structural analysis.","Dalton transactions (Cambridge, England : 2003)","2007","","9","971","978","10.1039/b615329a","","","0.71073","MoKα","","0.1522","0.1132","","","0.2791","0.3102","","","","","","1.022","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005047","11.3969","0.0003","12.1672","0.0003","22.5037","0.0007","75.107","0.001","84.427","0.002","80.851","0.002","2972.18","0.14","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H74 N2 O5 S Zn -","- C60 H74 N2 O5 S Zn -","- C120 H148 N4 O10 S2 Zn2 -","2","1","","Lin, Hung-Chih; Huang, Chiung-Cheng; Shi, Chih-Hau; Liao, Yong-Hong; Chen, Chien-Chih; Lin, Ying-Chih; Liu, Yi-Hong","Synthesis of alkynylated photo-luminescent Zn(II) and Mg(II) Schiff base complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","7","781","791","10.1039/b615380a","","","0.71073","MoKα","","0.1532","0.0911","","","0.2415","0.2834","","","","","","1.28","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005048","9.1749","0.0002","10.6334","0.0002","22.2367","0.0005","87.214","0.001","84.016","0.001","89.086","0.001","2154.92","0.08","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C49 H47 N5 O5 Zn -","- C49 H47 N5 O5 Zn -","- C98 H94 N10 O10 Zn2 -","2","1","","Lin, Hung-Chih; Huang, Chiung-Cheng; Shi, Chih-Hau; Liao, Yong-Hong; Chen, Chien-Chih; Lin, Ying-Chih; Liu, Yi-Hong","Synthesis of alkynylated photo-luminescent Zn(II) and Mg(II) Schiff base complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","7","781","791","10.1039/b615380a","","","0.71073","MoKα","","0.0981","0.0645","","","0.1649","0.19","","","","","","1.052","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005049","23.745","0.006","13.068","0.005","17.161","0.006","90","","132.328","0.002","90","","3937","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H38 Cl2 Fe N8 O10 -","- C32 H38 Cl2 Fe N8 O10 -","- C128 H152 Cl8 Fe4 N32 O40 -","4","0.5","","Matouzenko, Galina S.; Perrin, Monique; Le Guennic, Boris; Genre, Caroline; Molnár, Gábor; Bousseksou, Azzedine; Borshch, Serguei A.","Spin crossover behavior in a family of iron(II) zigzag chain coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","9","934","942","10.1039/b615410g","","","0.71073","MoKα","","0.1368","0.0707","","","0.1846","0.2284","","","","","","1.018","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005050","22.897","0.002","13.968","0.002","16.456","0.002","90","","133.195","0.005","90","","3836.9","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H30 Cl2 Fe N8 O9 -","- C30 H30 Cl2 Fe N8 O9 -","- C120 H120 Cl8 Fe4 N32 O36 -","4","0.5","","Matouzenko, Galina S.; Perrin, Monique; Le Guennic, Boris; Genre, Caroline; Molnár, Gábor; Bousseksou, Azzedine; Borshch, Serguei A.","Spin crossover behavior in a family of iron(II) zigzag chain coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","9","934","942","10.1039/b615410g","","","0.71073","MoKα","","0.1673","0.1005","","","0.2652","0.3278","","","","","","1.04","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005051","19.2417","0.001","18.0033","0.0012","21.9848","0.0014","90","","105.376","0.01","90","","7343.2","0.9","150","","150","","","","","","","","see text","8","P 1 21/c 1","-P 2ybc","14","","","","- C40 H35 Cl2 N O P2 Pt Si -","- C40 H35 Cl2 N O P2 Pt Si -","- C320 H280 Cl16 N8 O8 P16 Pt8 Si8 -","8","2","","van Duren, Ruben; van der Vlugt, Jarl Ivar; Kooijman, Huub; Spek, Anthony L.; Vogt, Dieter","Platinum-catalyzed hydroformylation of terminal and internal octenes.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1053","1059","10.1039/b615428j","","x-ray","0.71073","MoKα","","0.0384","0.0285","","","0.0675","0.0719","","","","","","1.032","","","","has coordinates","189241","2020-10-21","18:00:00",""
"7005052","19.523","0.013","15.659","0.009","24.697","0.014","90","","105.81","0.02","90","","7265","8","173.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C84 H76 B2 N10 Ni2 O6 -","- C84 H76 B2 N10 Ni2 O6 -","- C336 H304 B8 N40 Ni8 O24 -","4","0.5","","Nagataki, Takayuki; Ishii, Kenta; Tachi, Yoshimitsu; Itoh, Shinobu","Ligand effects on Ni(II)-catalysed alkane-hydroxylation with m-CPBA.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1120","1128","10.1039/b615503k","","","0.71075","MoKα","","","0.028","","","","0.0345","","","","","","0.998","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005053","11.663","0.008","13.381","0.009","13.386","0.009","96.83","0.02","93.04","0.02","107.82","0.03","1966","2","173.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C47 H47 B N4 Ni O2 -","- C47 H47 B N4 Ni O2 -","- C94 H94 B2 N8 Ni2 O4 -","2","1","","Nagataki, Takayuki; Ishii, Kenta; Tachi, Yoshimitsu; Itoh, Shinobu","Ligand effects on Ni(II)-catalysed alkane-hydroxylation with m-CPBA.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1120","1128","10.1039/b615503k","","","0.71075","MoKα","","","0.0514","","","","0.0671","","","","","","1.001","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005054","7.6143","0.0017","15.539","0.005","31.036","0.01","90","","90","","90","","3672.1","1.9","171.1","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C45 H44 B N5 Ni O3 -","- C45 H44 B N5 Ni O3 -","- C180 H176 B4 N20 Ni4 O12 -","4","1","","Nagataki, Takayuki; Ishii, Kenta; Tachi, Yoshimitsu; Itoh, Shinobu","Ligand effects on Ni(II)-catalysed alkane-hydroxylation with m-CPBA.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1120","1128","10.1039/b615503k","","","0.71075","MoKα","","","0.026","","","","0.0333","","","","","","0.997","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005055","12.679","0.006","21.18","0.014","20.233","0.012","90","","97.1","0.03","90","","5392","5","171.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C57 H74 B N3 Ni O7 -","- C57 H71 B N3 Ni O7 -","- C228 H284 B4 N12 Ni4 O28 -","4","1","","Nagataki, Takayuki; Ishii, Kenta; Tachi, Yoshimitsu; Itoh, Shinobu","Ligand effects on Ni(II)-catalysed alkane-hydroxylation with m-CPBA.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1120","1128","10.1039/b615503k","","","0.71075","MoKα","","","0.0383","","","","0.055","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005056","11.123","0.005","12.914","0.007","22.138","0.013","96.61","0.02","92.99","0.02","89.191","0.02","3154","3","171.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C29 H38 N6 Ni O7 -","- C29 H38 N6 Ni O7 -","- C116 H152 N24 Ni4 O28 -","4","2","","Nagataki, Takayuki; Ishii, Kenta; Tachi, Yoshimitsu; Itoh, Shinobu","Ligand effects on Ni(II)-catalysed alkane-hydroxylation with m-CPBA.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1120","1128","10.1039/b615503k","","","0.71075","MoKα","","","0.0399","","","","0.0538","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005057","11.556","0.003","21.132","0.008","24.131","0.011","90","","92.054","0.017","90","","5889","4","171.1","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C31 H41 N3 Ni O3 -","- C31 H41 N3 Ni O3 -","- C248 H328 N24 Ni8 O24 -","8","2","","Nagataki, Takayuki; Ishii, Kenta; Tachi, Yoshimitsu; Itoh, Shinobu","Ligand effects on Ni(II)-catalysed alkane-hydroxylation with m-CPBA.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1120","1128","10.1039/b615503k","","","0.71075","MoKα","","","0.032","","","","0.0399","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005058","11.887","0.006","20.791","0.01","11.743","0.005","90","","93.758","0.018","90","","2896","2","171.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H38 N4 Ni O4 -","- C29 H38 N4 Ni O4 -","- C116 H152 N16 Ni4 O16 -","4","1","","Nagataki, Takayuki; Ishii, Kenta; Tachi, Yoshimitsu; Itoh, Shinobu","Ligand effects on Ni(II)-catalysed alkane-hydroxylation with m-CPBA.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1120","1128","10.1039/b615503k","","","0.71075","MoKα","","","0.0229","","","","0.0326","","","","","","0.996","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005059","12.217","0.007","12.711","0.006","14.359","0.009","90","","92.65","0.02","90","","2227","2","171.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H27 N3 Ni O5 -","- C23 H27 N3 Ni O5 -","- C92 H108 N12 Ni4 O20 -","4","1","","Nagataki, Takayuki; Ishii, Kenta; Tachi, Yoshimitsu; Itoh, Shinobu","Ligand effects on Ni(II)-catalysed alkane-hydroxylation with m-CPBA.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1120","1128","10.1039/b615503k","","","0.71075","MoKα","","","0.0288","","","","0.0355","","","","","","1.008","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005060","12.478","0.008","14.135","0.008","14.821","0.008","62.383","0.015","82.53","0.02","70.83","0.02","2187","2","171.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C50 H54 B N3 Ni O4 -","- C50 H54 B N3 Ni O4 -","- C100 H108 B2 N6 Ni2 O8 -","2","1","","Nagataki, Takayuki; Ishii, Kenta; Tachi, Yoshimitsu; Itoh, Shinobu","Ligand effects on Ni(II)-catalysed alkane-hydroxylation with m-CPBA.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1120","1128","10.1039/b615503k","","","0.71075","MoKα","","","0.0321","","","","0.0392","","","","","","1.028","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005061","8.8386","0.0009","9.3207","0.0009","10.0246","0.001","63.784","0.001","68.158","0.001","78.077","0.002","686.82","0.12","100","2","100","2","","","","","","","","4","P -1","-P 1","2","alpha-OMe-4-cydpm","","","- C17 H13 N3 O -","- C17 H13 N3 O -","- C34 H26 N6 O2 -","2","1","","Halper, Sara R.; Stork, Jay R.; Cohen, Seth M.","Preparation and characterization of asymmetric alpha-alkoxy dipyrrin ligands and their metal complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1067","1074","10.1039/b615801c","","","0.71073","MoKα","","0.0481","0.0436","","","0.1179","0.1219","","","","","","1.071","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005062","11.9083","0.0007","11.9234","0.0007","12.0192","0.0007","69.481","0.001","88.643","0.001","78.756","0.001","1565.77","0.16","100","2","100","2","","","","","","","","5","P -1","-P 1","2","(Zn(alpha-OMe-4-mecdpm)!2$)","","","- C36 H30 N4 O6 Zn -","- C36 H30 N4 O6 Zn -","- C72 H60 N8 O12 Zn2 -","2","1","","Halper, Sara R.; Stork, Jay R.; Cohen, Seth M.","Preparation and characterization of asymmetric alpha-alkoxy dipyrrin ligands and their metal complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1067","1074","10.1039/b615801c","","","0.71073","MoKα","","0.0284","0.0273","","","0.0718","0.0727","","","","","","1.021","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005063","27.775","0.0005","27.775","0.0005","17.732","0.0007","90","","90","","120","","11846.7","0.6","100","2","100","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C168 H140 Mn13 O51 -","- C168 H138 Mn13 O51 -","- C504 H414 Mn39 O153 -","3","0.166667","","Ferguson, Alan; Thomson, Katrina; Parkin, Andrew; Cooper, Paul; Milios, Constantinos J.; Brechin, Euan K.; Murrie, Mark","Synthesis and characterisation of a mixed-valence Mn13 complex with S6 symmetry by using 2-phenoxybenzoate.","Dalton transactions (Cambridge, England : 2003)","2007","","7","728","730","10.1039/b615856k","","","0.6894","synchrotron","","0.0747","0.0587","","","0.1956","0.2123","","","","","","1.118","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005064","13.6606","0.0017","14.6604","0.0018","15.285","0.0019","96.396","0.002","98.395","0.002","98.598","0.002","2966.4","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C126 H88 Fe2 N16 O22 -","- C126 H88 Fe2 N16 O22 -","- C126 H88 Fe2 N16 O22 -","1","0.5","","Eryazici, Ibrahim; Wang, Pingshan; Moorefield, Charles N.; Panzer, Matthew; Durmus, Semih; Shreiner, Carol D.; Newkome, George R.","Design, characterization, and X-ray structure of an interlocked dinuclear chair-like metallomacrocycle: [Fe(II)2(3,5-bis(2,2':6',2''-terpyridin-4'-phen-3-yl)toluene)2][4PF6-].","Dalton transactions (Cambridge, England : 2003)","2007","","6","626","628","10.1039/b616014j","","","0.71073","MoKα","","0.0706","0.0549","","","0.1358","0.1433","","","","","","1.04","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005065","16.036","0.003","14.195","0.003","31.549","0.006","90","","103.22","0.03","90","","6991","3","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Catena-(trans-biscyano-tetra-agua-(2,4,6-tri(2-pyridyl)-1,3,5- triazine)-tetracyano-iron(iii)-praseodimiun(iii) octahydrate","","","- C24 H36 Fe N12 O12 Pr -","- C24 H12 Fe N12 O12 Pr -","- C192 H96 Fe8 N96 O96 Pr8 -","8","1","","Zhao, Hanhua; Lopez, Nazario; Prosvirin, Andrey; Chifotides, Helen T.; Dunbar, Kim R.","Lanthanide-3d cyanometalate chains Ln(III)-M(III) (Ln=Pr, Nd, Sm, Eu, Gd, Tb; M=Fe) with the tridentate ligand 2,4,6-tri(2-pyridyl)-1,3,5-triazine (tptz): evidence of ferromagnetic interactions for the Sm(III)-M(III) compounds (M=Fe, Cr).","Dalton transactions (Cambridge, England : 2003)","2007","","8","878","888","10.1039/b616016f","","","0.71073","MoKα","","0.0729","0.0587","","","0.1305","0.1375","","","","","","1.087","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005066","15.927","0.003","14.139","0.003","31.462","0.006","90","","103.18","0.03","90","","6898","3","150","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Catena-(trans-biscyano-tetra-agua-(2,4,6-tri(2-pyridyl)-1,3,5- triazine)-tetracyano-iron(iii)-Neodymium(iii) octahydrate","","","- C24 H36 Fe N12 Nd O12 -","- C24 H12 Fe N12 Nd O12 -","- C192 H96 Fe8 N96 Nd8 O96 -","8","1","","Zhao, Hanhua; Lopez, Nazario; Prosvirin, Andrey; Chifotides, Helen T.; Dunbar, Kim R.","Lanthanide-3d cyanometalate chains Ln(III)-M(III) (Ln=Pr, Nd, Sm, Eu, Gd, Tb; M=Fe) with the tridentate ligand 2,4,6-tri(2-pyridyl)-1,3,5-triazine (tptz): evidence of ferromagnetic interactions for the Sm(III)-M(III) compounds (M=Fe, Cr).","Dalton transactions (Cambridge, England : 2003)","2007","","8","878","888","10.1039/b616016f","","","0.71073","MoKα","","0.0904","0.0752","","","0.1708","0.1787","","","","","","1.111","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005067","15.897","0.003","14.13","0.003","31.522","0.006","90","","103.19","0.03","90","","6894","3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Catena-(trans-biscyano-tetra-agua-(2,4,6-tri(2-pyridyl)-1,3,5- triazine)-tetracyano-iron(iii)-samarium(iii) octahydrate","","","- C24 H36 Fe N12 O12 Sm -","- C24 H12 Fe N12 O12 Sm -","- C192 H96 Fe8 N96 O96 Sm8 -","8","1","","Zhao, Hanhua; Lopez, Nazario; Prosvirin, Andrey; Chifotides, Helen T.; Dunbar, Kim R.","Lanthanide-3d cyanometalate chains Ln(III)-M(III) (Ln=Pr, Nd, Sm, Eu, Gd, Tb; M=Fe) with the tridentate ligand 2,4,6-tri(2-pyridyl)-1,3,5-triazine (tptz): evidence of ferromagnetic interactions for the Sm(III)-M(III) compounds (M=Fe, Cr).","Dalton transactions (Cambridge, England : 2003)","2007","","8","878","888","10.1039/b616016f","","","0.71073","MoKα","","0.0822","0.0639","","","0.1571","0.1711","","","","","","1.055","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005068","16.067","0.003","14.056","0.003","31.35","0.006","90","","103.34","0.03","90","","6889","3","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Catena-(trans-biscyano-tetra-agua-(2,4,6-tri(2-pyridyl)-1,3,5- triazine)-tetracyano-iron(iii)-europium(iii) hexahydrate","","","- C24 H32 Eu Fe N12 O10 -","- C24 H12 Eu Fe N12 O10 -","- C192 H96 Eu8 Fe8 N96 O80 -","8","1","","Zhao, Hanhua; Lopez, Nazario; Prosvirin, Andrey; Chifotides, Helen T.; Dunbar, Kim R.","Lanthanide-3d cyanometalate chains Ln(III)-M(III) (Ln=Pr, Nd, Sm, Eu, Gd, Tb; M=Fe) with the tridentate ligand 2,4,6-tri(2-pyridyl)-1,3,5-triazine (tptz): evidence of ferromagnetic interactions for the Sm(III)-M(III) compounds (M=Fe, Cr).","Dalton transactions (Cambridge, England : 2003)","2007","","8","878","888","10.1039/b616016f","","","0.71073","MoKα","","0.0728","0.0617","","","0.1502","0.1559","","","","","","1.186","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005069","16.074","0.003","14.072","0.003","31.417","0.006","90","","103.38","0.03","90","","6913","3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Catena-(trans-biscyano-tetra-agua-(2,4,6-tri(2-pyridyl)-1,3,5- triazine)-tetracyano-iron(iii)-gadolinium(iii) hexahydrate","","","- C24 H32 Fe Gd N12 O10 -","- C24 H12 Fe Gd N12 O10 -","- C192 H96 Fe8 Gd8 N96 O80 -","8","1","","Zhao, Hanhua; Lopez, Nazario; Prosvirin, Andrey; Chifotides, Helen T.; Dunbar, Kim R.","Lanthanide-3d cyanometalate chains Ln(III)-M(III) (Ln=Pr, Nd, Sm, Eu, Gd, Tb; M=Fe) with the tridentate ligand 2,4,6-tri(2-pyridyl)-1,3,5-triazine (tptz): evidence of ferromagnetic interactions for the Sm(III)-M(III) compounds (M=Fe, Cr).","Dalton transactions (Cambridge, England : 2003)","2007","","8","878","888","10.1039/b616016f","","","0.71073","MoKα","","0.1288","0.0716","","","0.1727","0.1947","","","","","","1.046","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005070","15.951","0.004","14.086","0.004","31.266","0.008","90","","103.017","0.004","90","","6845","3","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Catena-(trans-biscyano-tetra-agua-(2,4,6-tri(2-pyridyl)-1,3,5- triazine)-tetracyano-iron(iii)-terbium(iii) octahydrate","","","- C24 H36 Fe N12 O12 Tb -","- C24 H12 Fe N12 O12 Tb -","- C192 H96 Fe8 N96 O96 Tb8 -","8","1","","Zhao, Hanhua; Lopez, Nazario; Prosvirin, Andrey; Chifotides, Helen T.; Dunbar, Kim R.","Lanthanide-3d cyanometalate chains Ln(III)-M(III) (Ln=Pr, Nd, Sm, Eu, Gd, Tb; M=Fe) with the tridentate ligand 2,4,6-tri(2-pyridyl)-1,3,5-triazine (tptz): evidence of ferromagnetic interactions for the Sm(III)-M(III) compounds (M=Fe, Cr).","Dalton transactions (Cambridge, England : 2003)","2007","","8","878","888","10.1039/b616016f","","","0.71073","MoKα","","0.0829","0.0619","","","0.1339","0.1425","","","","","","1.088","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005071","15.813","0.003","14.07","0.003","31.523","0.006","90","","103.31","0.03","90","","6825","2","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Catena-(trans-biscyano-tetra-agua-(2,4,6-tri(2-pyridyl)-1,3,5- triazine)-tetracyano-cobalt(iii)-samarium(iii) octahydrate","","","- C24 H36 Co N12 O12 Sm -","- C32 H16 Co1.33333 N16 O16 Sm1.33333 -","- C192 H96 Co8 N96 O96 Sm8 -","6","0.75","","Zhao, Hanhua; Lopez, Nazario; Prosvirin, Andrey; Chifotides, Helen T.; Dunbar, Kim R.","Lanthanide-3d cyanometalate chains Ln(III)-M(III) (Ln=Pr, Nd, Sm, Eu, Gd, Tb; M=Fe) with the tridentate ligand 2,4,6-tri(2-pyridyl)-1,3,5-triazine (tptz): evidence of ferromagnetic interactions for the Sm(III)-M(III) compounds (M=Fe, Cr).","Dalton transactions (Cambridge, England : 2003)","2007","","8","878","888","10.1039/b616016f","","","0.71073","MoKα","","0.0806","0.0564","","","0.1272","0.1374","","","","","","1.036","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005072","16.069","0.003","14.39","0.003","32.076","0.006","90","","102.45","0.03","90","","7243","3","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Catena-(trans-biscyano-N,N-dimethyl-formamide-tri-agua-(2,4,6- tri(2-pyridyl)-1,3,5-triazine)-tetracyano-iron(iii)-lanthamium(iii) pentahydrate","","","- C27 H35 Fe La N13 O9 -","- C27 H19 Fe La N13 O8.5 -","- C216 H152 Fe8 La8 N104 O68 -","8","1","","Zhao, Hanhua; Lopez, Nazario; Prosvirin, Andrey; Chifotides, Helen T.; Dunbar, Kim R.","Lanthanide-3d cyanometalate chains Ln(III)-M(III) (Ln=Pr, Nd, Sm, Eu, Gd, Tb; M=Fe) with the tridentate ligand 2,4,6-tri(2-pyridyl)-1,3,5-triazine (tptz): evidence of ferromagnetic interactions for the Sm(III)-M(III) compounds (M=Fe, Cr).","Dalton transactions (Cambridge, England : 2003)","2007","","8","878","888","10.1039/b616016f","","","0.71073","MoKα","","0.0746","0.0606","","","0.151","0.1604","","","","","","1.069","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005073","9.724","0.0019","13.477","0.003","16.552","0.003","74.62","0.03","88.44","0.03","81.45","0.03","2068.1","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Catena-(trans-biscyano-tri-N,N-dimethyl-formamide-agua- (3,4,7,8-tetramethyl-1,10-phenanthroline)-tetracyano-iron(iii)- samarium(iii) dihydrate","","","- C31 H43 Fe N11 O6 Sm -","- C31 H37 Fe N11 O6 Sm -","- C62 H74 Fe2 N22 O12 Sm2 -","2","1","","Zhao, Hanhua; Lopez, Nazario; Prosvirin, Andrey; Chifotides, Helen T.; Dunbar, Kim R.","Lanthanide-3d cyanometalate chains Ln(III)-M(III) (Ln=Pr, Nd, Sm, Eu, Gd, Tb; M=Fe) with the tridentate ligand 2,4,6-tri(2-pyridyl)-1,3,5-triazine (tptz): evidence of ferromagnetic interactions for the Sm(III)-M(III) compounds (M=Fe, Cr).","Dalton transactions (Cambridge, England : 2003)","2007","","8","878","888","10.1039/b616016f","","","0.71073","MoKα","","0.0826","0.0636","","","0.1661","0.1753","","","","","","1.107","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005074","20.322","0.004","19.728","0.004","13.473","0.003","90","","106.48","0.03","90","","5180","2","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Catena-(trans-biscyano-di-agua-bis-(3,4,7,8-tetramethyl-1,10- phenanthroline)-tetracyano-iron(iii)-samarium(iii) hydrate","","","- C39 H66 Fe N10 O16 Sm -","- C39 H40 Fe N10 O16 Sm -","- C156 H160 Fe4 N40 O64 Sm4 -","4","1","","Zhao, Hanhua; Lopez, Nazario; Prosvirin, Andrey; Chifotides, Helen T.; Dunbar, Kim R.","Lanthanide-3d cyanometalate chains Ln(III)-M(III) (Ln=Pr, Nd, Sm, Eu, Gd, Tb; M=Fe) with the tridentate ligand 2,4,6-tri(2-pyridyl)-1,3,5-triazine (tptz): evidence of ferromagnetic interactions for the Sm(III)-M(III) compounds (M=Fe, Cr).","Dalton transactions (Cambridge, England : 2003)","2007","","8","878","888","10.1039/b616016f","","","0.71073","MoKα","","0.0677","0.0476","","","0.1028","0.11","","","","","","1.07","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005075","13.214","0.003","13.998","0.003","14.075","0.003","105.38","0.03","92.56","0.03","92.76","0.03","2502.8","1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Catena-(trans-biscyano-di-agua-bis-(3,4,7,8-tetramethyl-1,10- phenanthroline)-tetracyano-chromium(iii)-samarium(iii) nonahydrate","","","- C39 H58 Cr N10 O12 Sm -","- C39 H35 Cr N10 O11.5 Sm -","- C78 H70 Cr2 N20 O23 Sm2 -","2","1","","Zhao, Hanhua; Lopez, Nazario; Prosvirin, Andrey; Chifotides, Helen T.; Dunbar, Kim R.","Lanthanide-3d cyanometalate chains Ln(III)-M(III) (Ln=Pr, Nd, Sm, Eu, Gd, Tb; M=Fe) with the tridentate ligand 2,4,6-tri(2-pyridyl)-1,3,5-triazine (tptz): evidence of ferromagnetic interactions for the Sm(III)-M(III) compounds (M=Fe, Cr).","Dalton transactions (Cambridge, England : 2003)","2007","","8","878","888","10.1039/b616016f","","","0.71073","MoKα","","0.1107","0.0813","","","0.2042","0.2224","","","","","","1.049","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005076","10.787","0.003","15.713","0.003","20.904","0.004","69.76","0.02","79.648","0.01","78.22","0.02","3231.3","1.3","290","2","290","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H70 O7 Si4 Ti2 -","- C68 H70 O7 Si4 Ti2 -","- C136 H140 O14 Si8 Ti4 -","2","1","","Fandos, Rosa; Gallego, Beatriz; Otero, Antonio; Rodríguez, Ana; Ruiz, María José; Terreros, Pilar","Synthesis and characterization of complexes containing Ti-O-Si moieties. Catalytic activity in olefin epoxidation.","Dalton transactions (Cambridge, England : 2003)","2007","","8","871","877","10.1039/b616064f","","","0.71073","MoKα","","0.3409","0.0822","","","0.1133","0.1627","","","","","","0.938","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005077","10.959","0.003","18.851","0.005","23.007","0.006","82.568","0.005","80.411","0.005","82.677","0.005","4620","2","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H55 Cl2 O4.5 Si2 Ti2 -","- C46 H55 Cl2 O4.5 Si2 Ti2 -","- C184 H220 Cl8 O18 Si8 Ti8 -","4","2","","Fandos, Rosa; Gallego, Beatriz; Otero, Antonio; Rodríguez, Ana; Ruiz, María José; Terreros, Pilar","Synthesis and characterization of complexes containing Ti-O-Si moieties. Catalytic activity in olefin epoxidation.","Dalton transactions (Cambridge, England : 2003)","2007","","8","871","877","10.1039/b616064f","","","0.71073","MoKα","","0.1799","0.0704","","","0.1337","0.1771","","","","","","0.956","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005078","6.772","0.0016","14.61","0.003","7.809","0.003","90","","107.73","0.03","90","","735.9","0.4","173","2","173","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C12 H16 F6 Fe N P -","- C12 H16 F6 Fe N P -","- C24 H32 F12 Fe2 N2 P2 -","2","0.5","","Kowalski, Konrad; Suwaki, Natsuko; Zakrzewski, Janusz; White, Andrew J. P.; Long, Nicholas J.; Mann, David J.","In vitro DNA scission activity of heterometallocenes.","Dalton transactions (Cambridge, England : 2003)","2007","","7","743","748","10.1039/b616191j","","","1.54248","CuKα","","0.0416","0.0382","","","0.1046","0.1059","","","","","","1.107","","","","has coordinates,has disorder","179754","2020-10-21","18:00:00",""
"7005079","11.5709","0.0005","13.0745","0.0006","16.8376","0.0008","104.099","0.002","108.569","0.003","102.959","0.003","2212.11","0.19","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C88 H84 N16 S4 Zn2 -","- C88 H84 N16 S4 Zn2 -","- C88 H84 N16 S4 Zn2 -","1","0.5","","Galardon, Erwan; Giorgi, Michel; Artaud, Isabelle","Modeling the inhibition of peptide deformylase by hydroxamic acids: influence of the sulfur donor.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1047","1052","10.1039/b616212f","","","0.71073","MoKα","","0.0596","0.0441","","","0.1203","0.1321","","","","","","1.084","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005080","13.3479","0.0002","20.2042","0.0004","12.7996","0.0003","90","","115.779","0.0009","90","","3108.32","0.11","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H30 Cl N5 O6 S Zn -","- C30 H30 Cl N5 O6 S Zn -","- C120 H120 Cl4 N20 O24 S4 Zn4 -","4","1","","Galardon, Erwan; Giorgi, Michel; Artaud, Isabelle","Modeling the inhibition of peptide deformylase by hydroxamic acids: influence of the sulfur donor.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1047","1052","10.1039/b616212f","","","0.71073","MoKα","","0.0702","0.0526","","","0.1039","0.1139","","","","","","1.083","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005081","11.9261","0.0002","22.287","0.0005","17.3416","0.0004","90","","90","","90","","4609.35","0.17","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C35 H50 Cl N9 O3 S2 Zn2 -","- C35 H48 Cl N9 O3 S2 Zn2 -","- C140 H192 Cl4 N36 O12 S8 Zn8 -","4","1","","Galardon, Erwan; Giorgi, Michel; Artaud, Isabelle","Modeling the inhibition of peptide deformylase by hydroxamic acids: influence of the sulfur donor.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1047","1052","10.1039/b616212f","","","0.71073","MoKα","","0.0717","0.0627","","","0.1835","0.195","","","","","","1.064","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005082","9.3819","0.0016","19.48","0.004","14.6718","0.0016","90","","90.031","0.019","90","","2681.4","0.8","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H24 N4 Pt -","- C32 H24 N4 Pt -","- C128 H96 N16 Pt4 -","4","1","","Kennedy, Frazer; Shavaleev, Nail M.; Koullourou, Thelma; Bell, Zoë R; Jeffery, John C.; Faulkner, Stephen; Ward, Michael D.","Sensitised near-infrared luminescence from lanthanide(III) centres using Re(I) and Pt(II) diimine complexes as energy donors in d-f dinuclear complexes based on 2,3-bis(2-pyridyl)pyrazine.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1492","1499","10.1039/b616423d","","","0.71073","MoKα","","0.0649","0.0394","","","0.0644","0.0702","","","","","","0.996","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005083","9.525","0.002","13.034","0.003","23.796","0.006","105.83","0.03","90.746","0.019","108.622","0.017","2677.1","1.2","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C42 H21 Cl F18 Gd N4 O11 Re -","- C42 H21 Cl F18 Gd N4 O11 Re -","- C84 H42 Cl2 F36 Gd2 N8 O22 Re2 -","2","1","","Kennedy, Frazer; Shavaleev, Nail M.; Koullourou, Thelma; Bell, Zoë R; Jeffery, John C.; Faulkner, Stephen; Ward, Michael D.","Sensitised near-infrared luminescence from lanthanide(III) centres using Re(I) and Pt(II) diimine complexes as energy donors in d-f dinuclear complexes based on 2,3-bis(2-pyridyl)pyrazine.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1492","1499","10.1039/b616423d","","","0.71073","MoKα","","0.0883","0.0649","","","0.1795","0.1907","","","","","","1.067","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005084","6.4657","0.0016","19.437","0.005","17.053","0.004","90","","94.969","0.005","90","","2135.1","0.9","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H11 Cl4 N4 O3 Re -","- C18 H11 Cl4 N4 O3 Re -","- C72 H44 Cl16 N16 O12 Re4 -","4","1","","Kennedy, Frazer; Shavaleev, Nail M.; Koullourou, Thelma; Bell, Zoë R; Jeffery, John C.; Faulkner, Stephen; Ward, Michael D.","Sensitised near-infrared luminescence from lanthanide(III) centres using Re(I) and Pt(II) diimine complexes as energy donors in d-f dinuclear complexes based on 2,3-bis(2-pyridyl)pyrazine.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1492","1499","10.1039/b616423d","","","0.71073","MoKα","","0.0456","0.0334","","","0.0897","0.0949","","","","","","1.118","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005085","8.849","0.004","38.843","0.011","13.404","0.005","90","","101.26","0.04","90","","4519","3","173","2","173","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C41 H22 Cl F9 Gd N4 O9 Re S3 -","- C41 H22 Cl F9 Gd N4 O9 Re S3 -","- C164 H88 Cl4 F36 Gd4 N16 O36 Re4 S12 -","4","1","","Kennedy, Frazer; Shavaleev, Nail M.; Koullourou, Thelma; Bell, Zoë R; Jeffery, John C.; Faulkner, Stephen; Ward, Michael D.","Sensitised near-infrared luminescence from lanthanide(III) centres using Re(I) and Pt(II) diimine complexes as energy donors in d-f dinuclear complexes based on 2,3-bis(2-pyridyl)pyrazine.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1492","1499","10.1039/b616423d","","","0.71073","MoKα","","0.0516","0.0342","","","0.073","0.0782","","","","","","1.03","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005086","8.528","0.005","10.051","0.005","10.707","0.006","66.006","0.008","67.762","0.008","67.683","0.008","747.9","0.7","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H36 Cl6 O9 Re2 -","- C16 H36 Cl6 O9 Re2 -","- C16 H36 Cl6 O9 Re2 -","1","0.5","","Noh, Wontae; Girolami, Gregory S.","Rhenium oxohalides: synthesis and crystal structures of ReO3Cl(THF)2, ReOCl4(THF), Re2O3Cl6(THF)2, and Re2O3Cl6(H2O)2.","Dalton transactions (Cambridge, England : 2003)","2007","","6","674","679","10.1039/b616495a","","","0.71073","MoKα","","0.0561","0.0388","","","0.061","0.0655","","","","","","0.991","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005087","7.724","0.002","12.795","0.003","12.204","0.003","90","","98.412","0.004","90","","1193.1","0.5","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H16 Cl O5 Re -","- C8 H16 Cl O5 Re -","- C32 H64 Cl4 O20 Re4 -","4","1","","Noh, Wontae; Girolami, Gregory S.","Rhenium oxohalides: synthesis and crystal structures of ReO3Cl(THF)2, ReOCl4(THF), Re2O3Cl6(THF)2, and Re2O3Cl6(H2O)2.","Dalton transactions (Cambridge, England : 2003)","2007","","6","674","679","10.1039/b616495a","","","0.71073","MoKα","","0.0404","0.0297","","","0.0714","0.0749","","","","","","0.956","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005088","15.22","0.004","7.996","0.002","16.717","0.007","90","","91.089","0.003","90","","2034.1","1.1","193","2","193","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C4 H8 Cl4 O2 Re -","- C4 H8 Cl4 O2 Re -","- C32 H64 Cl32 O16 Re8 -","8","1","","Noh, Wontae; Girolami, Gregory S.","Rhenium oxohalides: synthesis and crystal structures of ReO3Cl(THF)2, ReOCl4(THF), Re2O3Cl6(THF)2, and Re2O3Cl6(H2O)2.","Dalton transactions (Cambridge, England : 2003)","2007","","6","674","679","10.1039/b616495a","","","0.71073","MoKα","","0.0455","0.0361","","","0.0752","0.0789","","","","","","1.015","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005089","8.285","0.002","9.252","0.003","12.07","0.003","91.525","0.004","90.116","0.004","92.49","0.004","924","0.4","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H16 Cl6 O5 Re2 -","- C8 H16 Cl6 O5 Re2 -","- C16 H32 Cl12 O10 Re4 -","2","1","","Noh, Wontae; Girolami, Gregory S.","Rhenium oxohalides: synthesis and crystal structures of ReO3Cl(THF)2, ReOCl4(THF), Re2O3Cl6(THF)2, and Re2O3Cl6(H2O)2.","Dalton transactions (Cambridge, England : 2003)","2007","","6","674","679","10.1039/b616495a","","","0.71073","MoKα","","0.0574","0.0364","","","0.0803","0.0862","","","","","","0.945","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005090","7.5666","0.0006","8.5632","0.0007","11.8893","0.001","70.087","0.001","76.185","0.002","70.401","0.002","675.56","0.1","243","2","243","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H24 B2 Cl2 N8 Se4 Zn2 -","- C16 H24 B2 Cl2 N8 Se4 Zn2 -","- C16 H24 B2 Cl2 N8 Se4 Zn2 -","1","0.5","","Landry, Victoria K.; Buccella, Daniela; Pang, Keliang; Parkin, Gerard","Bis- and tris(2-seleno-1-methylimidazolyl)hydroborato complexes, {[BseMe]ZnX}2(X=Cl, I), [BseMe]2Zn and [TseMe]Re(CO)3: structural evidence that the [BseMe] ligand is not merely a ""heavier"" version of the sulfur counterpart, [BmMe].","Dalton transactions (Cambridge, England : 2003)","2007","","8","866","870","10.1039/b616630j","","","0.71073","MoKα","","0.0527","0.0337","","","0.0732","0.0803","","","","","","1.024","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005091","9.5572","0.0004","14.3524","0.0005","18.9224","0.0008","90","","93.455","0.001","90","","2590.84","0.18","243","2","243","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H24 B2 N8 Se4 Zn -","- C16 H24 B2 N8 Se4 Zn -","- C64 H96 B8 N32 Se16 Zn4 -","4","1","","Landry, Victoria K.; Buccella, Daniela; Pang, Keliang; Parkin, Gerard","Bis- and tris(2-seleno-1-methylimidazolyl)hydroborato complexes, {[BseMe]ZnX}2(X=Cl, I), [BseMe]2Zn and [TseMe]Re(CO)3: structural evidence that the [BseMe] ligand is not merely a ""heavier"" version of the sulfur counterpart, [BmMe].","Dalton transactions (Cambridge, England : 2003)","2007","","8","866","870","10.1039/b616630j","","","0.71073","MoKα","","0.052","0.0301","","","0.0657","0.0725","","","","","","1.147","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005092","14.5312","0.0009","14.5312","0.0009","18.233","0.002","90","","90","","120","","3334.2","0.5","243","2","243","2","","","","","","","","7","R 3 :H","R 3","146","","","","- C15 H16 B N6 O3 Re Se3 -","- C15 H16 B N6 O3 Re Se3 -","- C90 H96 B6 N36 O18 Re6 Se18 -","6","0.666667","","Landry, Victoria K.; Buccella, Daniela; Pang, Keliang; Parkin, Gerard","Bis- and tris(2-seleno-1-methylimidazolyl)hydroborato complexes, {[BseMe]ZnX}2(X=Cl, I), [BseMe]2Zn and [TseMe]Re(CO)3: structural evidence that the [BseMe] ligand is not merely a ""heavier"" version of the sulfur counterpart, [BmMe].","Dalton transactions (Cambridge, England : 2003)","2007","","8","866","870","10.1039/b616630j","","","0.71073","MoKα","","0.0616","0.034","","","0.0587","0.0665","","","","","","1.056","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005093","7.7612","0.0004","8.8013","0.0005","11.926","0.0007","70.852","0.001","78.267","0.001","70.854","0.001","722.81","0.07","243","2","243","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H24 B2 I2 N8 Se4 Zn2 -","- C16 H24 B2 I2 N8 Se4 Zn2 -","- C16 H24 B2 I2 N8 Se4 Zn2 -","1","0.5","","Landry, Victoria K.; Buccella, Daniela; Pang, Keliang; Parkin, Gerard","Bis- and tris(2-seleno-1-methylimidazolyl)hydroborato complexes, {[BseMe]ZnX}2(X=Cl, I), [BseMe]2Zn and [TseMe]Re(CO)3: structural evidence that the [BseMe] ligand is not merely a ""heavier"" version of the sulfur counterpart, [BmMe].","Dalton transactions (Cambridge, England : 2003)","2007","","8","866","870","10.1039/b616630j","","","0.71073","MoKα","","0.0454","0.0306","","","0.0601","0.0652","","","","","","1.017","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005094","30.443","0.004","7.6038","0.0011","18.798","0.003","90","","120.551","0.002","90","","3747.3","0.9","273","2","273","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H15 Fe2 N3 O4 S2 -","- C16 H15 Fe2 N3 O4 S2 -","- C128 H120 Fe16 N24 O32 S16 -","8","1","","Duan, Lele; Wang, Mei; Li, Ping; Na, Yong; Wang, Ning; Sun, Licheng","Carbene-pyridine chelating 2Fe2S hydrogenase model complexes as highly active catalysts for the electrochemical reduction of protons from weak acid (HOAc).","Dalton transactions (Cambridge, England : 2003)","2007","","13","1277","1283","10.1039/b616645h","","","0.71073","MoKα","","0.0422","0.0342","","","0.0851","0.0894","","","","","","1.047","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005095","12.445","0.009","14.269","0.01","28.52","0.02","90","","90","","90","","5065","6","273","2","273","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C23 H20 Fe2 N4 O5 S2 -","- C23 H20 Fe2 N4 O5 S2 -","- C184 H160 Fe16 N32 O40 S16 -","8","1","","Duan, Lele; Wang, Mei; Li, Ping; Na, Yong; Wang, Ning; Sun, Licheng","Carbene-pyridine chelating 2Fe2S hydrogenase model complexes as highly active catalysts for the electrochemical reduction of protons from weak acid (HOAc).","Dalton transactions (Cambridge, England : 2003)","2007","","13","1277","1283","10.1039/b616645h","","","0.71073","MoKα","","0.0874","0.0508","","","0.0902","0.1024","","","","","","1.02","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005096","9.285","0.004","10.784","0.004","12.913","0.005","105.748","0.005","97.211","0.004","103.396","0.005","1185.8","0.8","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H20 Fe2 N4 O4 S2 -","- C22 H20 Fe2 N4 O4 S2 -","- C44 H40 Fe4 N8 O8 S4 -","2","1","","Duan, Lele; Wang, Mei; Li, Ping; Na, Yong; Wang, Ning; Sun, Licheng","Carbene-pyridine chelating 2Fe2S hydrogenase model complexes as highly active catalysts for the electrochemical reduction of protons from weak acid (HOAc).","Dalton transactions (Cambridge, England : 2003)","2007","","13","1277","1283","10.1039/b616645h","","","0.71073","MoKα","","0.0536","0.0388","","","0.0938","0.1017","","","","","","1.048","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005097","13.1151","0.0008","8.0075","0.0005","17.4989","0.0011","90","","90","","90","","1837.7","0.2","243","2","243","2","","","","","","","","6","P m c 21","P 2c -2","26","","","","- C15 H22 B N7 Ni O -","- C15 H22 B N7 Ni O -","- C60 H88 B4 N28 Ni4 O4 -","4","1","","Landry, Victoria K.; Pang, Keliang; Quan, Stephanie M.; Parkin, Gerard","Tetrahedral nickel nitrosyl complexes with tripodal [N3] and [Se3] donor ancillary ligands: structural and computational evidence that a linear nitrosyl is a trivalent ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","8","820","824","10.1039/b616674a","","","0.71073","MoKα","","0.0703","0.0371","","","0.0821","0.0959","","","","","","1.005","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005098","14.5179","0.0005","14.5179","0.0005","73.73","0.005","90","","90","","120","","13458.1","1.1","243","2","243","2","","","","","","","","8","R -3 c :H","-R 3 2""c","167","","","","- C45 H47.5 B N7 Ni O P0.5 Se3 -","- C45 H47.5 B N7 Ni O P0.5 Se3 -","- C540 H570 B12 N84 Ni12 O12 P6 Se36 -","12","0.333333","","Landry, Victoria K.; Pang, Keliang; Quan, Stephanie M.; Parkin, Gerard","Tetrahedral nickel nitrosyl complexes with tripodal [N3] and [Se3] donor ancillary ligands: structural and computational evidence that a linear nitrosyl is a trivalent ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","8","820","824","10.1039/b616674a","","","0.71073","MoKα","","0.0583","0.0315","","","0.0609","0.0648","","","","","","1.083","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005099","8.6989","0.0005","10.0246","0.0006","12.3181","0.0007","67.338","0.003","82.783","0.003","83.862","0.003","981.38","0.1","173","2","173","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C42 H50 In2 N4 -","- C42 H50 In2 N4 -","- C42 H50 In2 N4 -","1","0.5","","Hill, Michael S.; Hitchcock, Peter B.; Pongtavornpinyo, Ruti","Solid- and solution-state structures of indium 'alkene analogues'.","Dalton transactions (Cambridge, England : 2003)","2007","","7","731","733","10.1039/b616747k","","x-ray","0.71073","MoKα","","0.0407","0.0325","","","0.0725","0.0757","","","","","","1.057","","","","has coordinates","179754","2020-10-21","18:00:00",""
"7005100","13.9231","0.0003","34.7614","0.001","14.023","0.0003","90","","118.272","0.001","90","","5977.3","0.3","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C63 H75 In3 N6 O3 -","- C63 H75 In3 N6 O3 -","- C252 H300 In12 N24 O12 -","4","1","","Hill, Michael S.; Hitchcock, Peter B.; Pongtavornpinyo, Ruti","Solid- and solution-state structures of indium 'alkene analogues'.","Dalton transactions (Cambridge, England : 2003)","2007","","7","731","733","10.1039/b616747k","","x-ray","0.71073","MoKα","","0.0781","0.0509","","","0.0962","0.106","","","","","","1.107","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005101","18.7486","0.0007","52.014","0.002","13.1492","0.0005","90","","131.918","0.003","90","","9541.6","0.8","163","2","163","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C72 H128 Cl8 N12 O36 Zn -","- C72 H128 Cl8 N12 O36 Zn -","- C288 H512 Cl32 N48 O144 Zn4 -","4","1","","An, Yan; Lin, Yan-Yong; Wang, Hui; Sun, Hong-Zhe; Tong, Ming-Liang; Ji, Liang-Nian; Mao, Zong-Wan","Cleavage of double-strand DNA by zinc complexes of dicationic 2,2'-dipyridyl derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","12","1250","1254","10.1039/b616754c","","","1.54178","CuKα","","0.0833","0.0735","","","0.2039","0.2149","","","","","","1.057","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005102","17.34","0.003","37.132","0.006","13.715","0.002","90","","90","","90","","8831","2","153","2","153","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C72 H129 Br Cl5 N8 O20.5 Zn -","- C72 H129 Br Cl5 N8 O20.5 Zn -","- C288 H516 Br4 Cl20 N32 O82 Zn4 -","4","1","","An, Yan; Lin, Yan-Yong; Wang, Hui; Sun, Hong-Zhe; Tong, Ming-Liang; Ji, Liang-Nian; Mao, Zong-Wan","Cleavage of double-strand DNA by zinc complexes of dicationic 2,2'-dipyridyl derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","12","1250","1254","10.1039/b616754c","","","0.71073","MoKα","","0.0734","0.0579","","","0.1515","0.1652","","","","","","1.031","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005103","14.013","0.002","18.013","0.002","21.635","0.003","74.25","0.01","81.17","0.01","76.99","0.01","5096.2","1.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C47 H36 Cl3 Eu N10 O15 -","- C47 H36 Cl3 Eu N10 O15 -","- C188 H144 Cl12 Eu4 N40 O60 -","4","2","","Amoroso, Angelo J.; Burrows, Miles W.; Haigh, Robert; Hatcher, Malcolm; Jones, Mark; Kynast, Ulrich; Malik, K. M. Abdul; Sendor, Dorota","The synthesis and characterisation of europium terpyridine-N-oxide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1630","1638","10.1039/b616758f","","","0.71073","MoKα","","0.0484","0.0362","","","0.096","0.1003","","","","","","1.075","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005104","23.635","0.005","16.988","0.003","26.075","0.005","90","","100.52","0.03","90","","10293","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C49 H40 Cl3 Eu N11 O18.5 -","- C49 H39 Cl3 Eu N11 O18.5 -","- C392 H312 Cl24 Eu8 N88 O148 -","8","1","","Amoroso, Angelo J.; Burrows, Miles W.; Haigh, Robert; Hatcher, Malcolm; Jones, Mark; Kynast, Ulrich; Malik, K. M. Abdul; Sendor, Dorota","The synthesis and characterisation of europium terpyridine-N-oxide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1630","1638","10.1039/b616758f","","","0.71073","MoKα","","0.1358","0.0863","","","0.2491","0.2784","","","","","","1.02","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005105","16.196","0.003","14.781","0.003","24.469","0.005","90","","106.47","0.03","90","","5617","2","150","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C51 H42 Cl3 Eu N12 O21 -","- C51 H42 Cl3 Eu N12 O21 -","- C204 H168 Cl12 Eu4 N48 O84 -","4","1","","Amoroso, Angelo J.; Burrows, Miles W.; Haigh, Robert; Hatcher, Malcolm; Jones, Mark; Kynast, Ulrich; Malik, K. M. Abdul; Sendor, Dorota","The synthesis and characterisation of europium terpyridine-N-oxide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1630","1638","10.1039/b616758f","","","0.71073","MoKα","","0.0756","0.0491","","","0.1204","0.1457","","","","","","1.124","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005106","17.386","0.005","11.819","0.005","26.162","0.005","90","","106.219","0.005","90","","5162","3","150","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H56 Cu4 I7 N8 O8 Y -","- C24 H56 Cu4 I7 N8 O8 Y -","- C96 H224 Cu16 I28 N32 O32 Y4 -","4","1","","Mishra, Shashank; Pfalzgraf, Liliane G Hubert; Jeanneau, Erwann; Chermette, Henry","From discrete [Y(DMF)8][Cu4(mu3-I)2(mu-I)3I2] ion pairs to extended [Y(DMF)6(H2O)2][Cu7(mu4-I)3(mu3-I)2(mu-I)4(I)]1infinity and [Y(DMF)6(H2O)3][Cu(I)7Cu(II)2(mu3-I)8(mu-I)6]2infinity arrays by H-bond templating in a confined solvent-free environment.","Dalton transactions (Cambridge, England : 2003)","2007","","4","410","413","10.1039/b616800k","","","0.71073","MoKα","","0.0861","0.0495","","0.0817","0.0566","0.0566","","","","","","1.0819","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005107","19.761","0.005","13.862","0.005","21.33","0.005","90","","114.768","0.005","90","","5305","3","150","","150","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H42 Cu7 I10 N6 O8 Y -","- C18 H42 Cu7 I10 N6 O8 Y -","- C72 H168 Cu28 I40 N24 O32 Y4 -","4","1","","Mishra, Shashank; Pfalzgraf, Liliane G Hubert; Jeanneau, Erwann; Chermette, Henry","From discrete [Y(DMF)8][Cu4(mu3-I)2(mu-I)3I2] ion pairs to extended [Y(DMF)6(H2O)2][Cu7(mu4-I)3(mu3-I)2(mu-I)4(I)]1infinity and [Y(DMF)6(H2O)3][Cu(I)7Cu(II)2(mu3-I)8(mu-I)6]2infinity arrays by H-bond templating in a confined solvent-free environment.","Dalton transactions (Cambridge, England : 2003)","2007","","4","410","413","10.1039/b616800k","","","0.71069","MoKα","","0.2045","0.0973","","0.1597","0.0969","0.0969","","","","","","1.1134","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005108","13.7471","0.0014","13.7471","0.0014","60.04","0.005","90","","90","","120","","9826.4","1.6","150","","150","","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C18 H42 Cu9 I14 N6 O9 Y -","- C18 H42 Cu9 I14 N6 O9 Y -","- C108 H252 Cu54 I84 N36 O54 Y6 -","6","0.166667","","Mishra, Shashank; Pfalzgraf, Liliane G Hubert; Jeanneau, Erwann; Chermette, Henry","From discrete [Y(DMF)8][Cu4(mu3-I)2(mu-I)3I2] ion pairs to extended [Y(DMF)6(H2O)2][Cu7(mu4-I)3(mu3-I)2(mu-I)4(I)]1infinity and [Y(DMF)6(H2O)3][Cu(I)7Cu(II)2(mu3-I)8(mu-I)6]2infinity arrays by H-bond templating in a confined solvent-free environment.","Dalton transactions (Cambridge, England : 2003)","2007","","4","410","413","10.1039/b616800k","","","0.71073","MoKα","","0.1407","0.089","","0.0839","0.0763","0.0763","","","","","","1.0663","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005109","10.4143","0.0003","13.9395","0.0004","14.7757","0.0004","98.334","0.002","104.786","0.002","110.78","0.002","1872.1","0.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H29 Cl3 N8 S4 -","- C37 H29 Cl3 N8 S4 -","- C74 H58 Cl6 N16 S8 -","2","1","","Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; Kurmoo, Mohamedally","A stepwise approach to the formation of heterometallic discrete complexes and infinite architectures.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1129","1139","10.1039/b616841h","","","0.71073","MoKα","","0.1189","0.0639","","","0.1679","0.2006","","","","","","1.032","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005110","8.1586","0.0003","11.9152","0.0004","14.0232","0.0005","96.836","0.002","93.167","0.001","96.595","0.001","1341.28","0.08","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H11 N3 S2 -","- C15 H10 N3 S2 -","- C60 H40 N12 S8 -","4","2","","Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; Kurmoo, Mohamedally","A stepwise approach to the formation of heterometallic discrete complexes and infinite architectures.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1129","1139","10.1039/b616841h","","","0.71073","MoKα","","0.0648","0.051","","","0.133","0.1414","","","","","","1.074","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005111","10.9471","0.0004","14.3923","0.0005","14.6576","0.0009","108.838","0.002","103.726","0.002","103.735","0.002","1995.54","0.17","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H52 N6 Ni S4 -","- C40 H52 N6 Ni S4 -","- C80 H104 N12 Ni2 S8 -","2","1","","Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; Kurmoo, Mohamedally","A stepwise approach to the formation of heterometallic discrete complexes and infinite architectures.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1129","1139","10.1039/b616841h","","","0.71073","MoKα","","0.0918","0.0458","","","0.1015","0.1377","","","","","","1.04","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005112","9.4747","0.0006","17.9376","0.0015","11.8826","0.0009","90","","96.283","0.003","90","","2007.4","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H52 N6 Pd S4 -","- C40 H52 N6 Pd S4 -","- C80 H104 N12 Pd2 S8 -","2","0.5","","Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; Kurmoo, Mohamedally","A stepwise approach to the formation of heterometallic discrete complexes and infinite architectures.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1129","1139","10.1039/b616841h","","","0.71073","MoKα","","0.0819","0.045","","","0.1036","0.1338","","","","","","1.006","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005113","17.2827","0.0007","18.2012","0.0005","25.7071","0.001","90","","90","","90","","8086.6","0.5","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C40 H52 N6 S4 Zn -","- C40 H32 N6 S4 Zn -","- C320 H256 N48 S32 Zn8 -","8","1","","Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; Kurmoo, Mohamedally","A stepwise approach to the formation of heterometallic discrete complexes and infinite architectures.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1129","1139","10.1039/b616841h","","","0.71073","MoKα","","0.156","0.0779","","","0.2127","0.2609","","","","","","1.046","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005114","11.9427","0.0004","13.0629","0.0005","14.7549","0.0006","77.514","0.002","71.562","0.002","81.054","0.002","2122.59","0.14","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H55 Hg N7 S4 -","- C42 H55 Hg N7 S4 -","- C84 H110 Hg2 N14 S8 -","2","1","","Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; Kurmoo, Mohamedally","A stepwise approach to the formation of heterometallic discrete complexes and infinite architectures.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1129","1139","10.1039/b616841h","","","0.71073","MoKα","","0.0351","0.0268","","","0.0704","0.0848","","","","","","1.121","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005115","8.4793","0.0006","8.6656","0.0007","25.7473","0.0018","84.402","0.004","88.143","0.004","80.473","0.004","1856.6","0.2","173","2","173","2","","","","","","","","9","P -1","-P 1","2","","","","- C58 H94 B2 F8 N18 Ni2 O6 Pd S4 -","- C58 H94 B2 F8 N18 Ni2 O6 Pd S4 -","- C58 H94 B2 F8 N18 Ni2 O6 Pd S4 -","1","0.5","","Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; Kurmoo, Mohamedally","A stepwise approach to the formation of heterometallic discrete complexes and infinite architectures.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1129","1139","10.1039/b616841h","","","0.71073","MoKα","","0.1166","0.0665","","","0.1683","0.1884","","","","","","1.032","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005116","15.4567","0.0004","13.0732","0.0004","22.4156","0.0006","90","","106.58","0.001","90","","4341.2","0.2","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H42 N4 Na2 Ni O5 S9 -","- C34 H36 N4 Na2 Ni O5 S9 -","- C136 H144 N16 Na8 Ni4 O20 S36 -","4","0.5","","Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; Kurmoo, Mohamedally","A stepwise approach to the formation of heterometallic discrete complexes and infinite architectures.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1129","1139","10.1039/b616841h","","","0.71073","MoKα","","0.0686","0.0538","","","0.155","0.1704","","","","","","1.049","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005117","15.3267","0.0005","12.8644","0.0005","22.9486","0.001","90","","107.949","0.001","90","","4304.5","0.3","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H42 N4 Na2 O5 Pd S9 -","- C34 H24 N4 Na2 O5 Pd S9 -","- C136 H96 N16 Na8 O20 Pd4 S36 -","4","0.5","","Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; Kurmoo, Mohamedally","A stepwise approach to the formation of heterometallic discrete complexes and infinite architectures.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1129","1139","10.1039/b616841h","","","0.71073","MoKα","","0.077","0.0603","","","0.184","0.2041","","","","","","1.055","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005118","15.9344","0.0004","12.743","0.0003","37.3352","0.0008","90","","99.385","0.001","90","","7479.5","0.3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H38 Hg N5 Na O1.2 S5 -","- C34 H35 Hg N5 Na O1.2 S5 -","- C272 H280 Hg8 N40 Na8 O9.6 S40 -","8","2","","Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; Kurmoo, Mohamedally","A stepwise approach to the formation of heterometallic discrete complexes and infinite architectures.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1129","1139","10.1039/b616841h","","","0.71073","MoKα","","0.0951","0.0553","","","0.1488","0.1778","","","","","","1.066","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005119","13.369","0.001","10.018","0.001","16.13","0.001","90","","96.42","0.01","90","","2146.8","0.3","198","2","198","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H21 N P2 -","- C26 H21 N P2 -","- C104 H84 N4 P8 -","4","1","","Braun, Leonie; Liptau, Patrick; Kehr, Gerald; Ugolotti, Juri; Fröhlich, Roland; Erker, Gerhard","Bis(diphenylphosphino)acetonitrile: synthesis, ligand properties and application in catalytic carbon-carbon coupling.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1409","1415","10.1039/b616847g","","","0.71073","MoKα","","0.0911","0.05","","","0.0932","0.1061","","","","","","1.028","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005120","25.646","0.001","13.888","0.001","19.939","0.001","90","","113.07","0.01","90","","6533.8","0.8","198","2","198","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H25 Cl6 N P2 Pd -","- C28 H25 Cl6 N P2 Pd -","- C224 H200 Cl48 N8 P16 Pd8 -","8","1","","Braun, Leonie; Liptau, Patrick; Kehr, Gerald; Ugolotti, Juri; Fröhlich, Roland; Erker, Gerhard","Bis(diphenylphosphino)acetonitrile: synthesis, ligand properties and application in catalytic carbon-carbon coupling.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1409","1415","10.1039/b616847g","","","0.71073","MoKα","","0.0916","0.0597","","","0.1636","0.1837","","","","","","1.026","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005121","25.648","0.001","13.987","0.001","19.879","0.001","90","","112.99","0.01","90","","6564.9","0.8","198","2","198","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H25 Cl6 N P2 Pt -","- C28 H25 Cl6 N P2 Pt -","- C224 H200 Cl48 N8 P16 Pt8 -","8","1","","Braun, Leonie; Liptau, Patrick; Kehr, Gerald; Ugolotti, Juri; Fröhlich, Roland; Erker, Gerhard","Bis(diphenylphosphino)acetonitrile: synthesis, ligand properties and application in catalytic carbon-carbon coupling.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1409","1415","10.1039/b616847g","","","0.71073","MoKα","","0.0651","0.0462","","","0.1228","0.1332","","","","","","1.024","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005122","10.5","0.001","16.922","0.001","20.542","0.001","95.98","0.01","103.71","0.01","104.75","0.01","3376.1","0.5","198","2","198","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H40 Cl N O0.5 P2 Ru -","- C38 H40 Cl N O0.5 P2 Ru -","- C152 H160 Cl4 N4 O2 P8 Ru4 -","4","2","","Braun, Leonie; Liptau, Patrick; Kehr, Gerald; Ugolotti, Juri; Fröhlich, Roland; Erker, Gerhard","Bis(diphenylphosphino)acetonitrile: synthesis, ligand properties and application in catalytic carbon-carbon coupling.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1409","1415","10.1039/b616847g","","","0.71073","MoKα","","0.0837","0.0472","","","0.0967","0.1094","","","","","","1.041","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005123","10.8201","0.0018","17.638","0.002","33.626","0.005","90","","90","","90","","6417.4","1.6","105","2","105","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C26 H60 N8 Zr -","- C26 H60 N8 Zr -","- C208 H480 N64 Zr8 -","8","1","","Devi, Anjana; Bhakta, Raghunandan; Milanov, Andrian; Hellwig, Malte; Barreca, Davide; Tondello, Eugene; Thomas, Reji; Ehrhart, Peter; Winter, Manuela; Fischer, Roland","Synthesis and characterisation of zirconium-amido guanidinato complex: a potential precursor for ZrO2 thin films.","Dalton transactions (Cambridge, England : 2003)","2007","","17","1671","1676","10.1039/b616861b","","","0.71073","MoKα","","0.1809","0.0634","","","0.0967","0.1353","","","","","","1.02","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005124","28.363","0.004","11.0249","0.0014","15.054","0.003","90","","98.081","0.013","90","","4660.6","1.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H46 N8 P4 Pd2 S2 -","- C30 H46 N8 P4 Pd2 S2 -","- C120 H184 N32 P16 Pd8 S8 -","4","0.5","","Chang, Xiaohong; Kim, Mi-Young; Kim, Yong-Joo; Huh, Hyun Sue; Lee, Soon W.","Dinuclear palladium-azido complexes containing thiophene derivatives: reactivity toward organic isocyanides and isothiocyanates.","Dalton transactions (Cambridge, England : 2003)","2007","","7","792","801","10.1039/b616901e","","","0.71073","MoKα","","0.1216","0.0697","","","0.1747","0.2104","","","","","","1.025","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005125","39.276","0.008","8.758","0.002","14.875","0.003","90","","90","","90","","5116.7","1.9","293","2","293","2","","","","","","","","6","P c a b","-P 2bc 2ac","61","","","","- C50 H62 N6 P2 Pd2 S2 -","- C50 H62 N6 P2 Pd2 S2 -","- C200 H248 N24 P8 Pd8 S8 -","4","0.5","","Chang, Xiaohong; Kim, Mi-Young; Kim, Yong-Joo; Huh, Hyun Sue; Lee, Soon W.","Dinuclear palladium-azido complexes containing thiophene derivatives: reactivity toward organic isocyanides and isothiocyanates.","Dalton transactions (Cambridge, England : 2003)","2007","","7","792","801","10.1039/b616901e","","","0.71073","MoKα","","0.061","0.0389","","","0.0917","0.1053","","","","","","1.003","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005126","8.5056","0.0017","12.325","0.002","13.107","0.004","87.887","0.017","76.69","0.02","81.063","0.016","1320.9","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H62 Cl4 N4 P4 Pd2 S2 -","- C40 H62 Cl4 N4 P4 Pd2 S2 -","- C40 H62 Cl4 N4 P4 Pd2 S2 -","1","0.5","","Chang, Xiaohong; Kim, Mi-Young; Kim, Yong-Joo; Huh, Hyun Sue; Lee, Soon W.","Dinuclear palladium-azido complexes containing thiophene derivatives: reactivity toward organic isocyanides and isothiocyanates.","Dalton transactions (Cambridge, England : 2003)","2007","","7","792","801","10.1039/b616901e","","","0.71073","MoKα","","0.0655","0.0463","","","0.1135","0.1251","","","","","","1.019","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005127","8.48","0.003","14.312","0.005","15.312","0.007","93.17","0.03","93.88","0.03","102.56","0.03","1805","1.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C68 H98 Cl2 N6 O4 S2 V2 -","- C68 H98 Cl2 N6 O4 S2 V2 -","- C68 H98 Cl2 N6 O4 S2 V2 -","1","0.5","","Janas, Zofia; Wiśniewska, Dorota; Jerzykiewicz, Lucjan B.; Sobota, Piotr; Drabent, Krzysztof; Szczegot, Krzysztof","Synthesis, structural studies and reactivity of vanadium complexes with tridentate (OSO) ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2065","2069","10.1039/b616961a","","","0.71073","MoKα","","0.0846","0.0568","","","0.1552","0.1723","","","","","","1.043","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005128","10.799","0.0001","16.216","0.0002","21.679","0.0003","90","","90","","90","","3796.35","0.08","173","2","173","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C19 H21 Cl N O3 P Pd -","- C19 H21 Cl N O3 P Pd -","- C152 H168 Cl8 N8 O24 P8 Pd8 -","8","1","","Agostinho, Magno; Braunstein, Pierre; Welter, Richard","Phosphinito- and phosphonito-oxazoline Pd(II) complexes as CO/ethylene insertion intermediates: synthesis and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2007","","7","759","770","10.1039/b616962g","","","0.71069","MoKα","","0.0618","0.03","","","0.0903","0.0978","","","","","","0.767","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005129","12.415","0.0003","10.876","0.0002","15.581","0.0004","90","","96.334","0.0009","90","","2090.99","0.08","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C21 H25 Cl N O3 P Pd -","- C21 H25 Cl N O3 P Pd -","- C84 H100 Cl4 N4 O12 P4 Pd4 -","4","1","","Agostinho, Magno; Braunstein, Pierre; Welter, Richard","Phosphinito- and phosphonito-oxazoline Pd(II) complexes as CO/ethylene insertion intermediates: synthesis and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2007","","7","759","770","10.1039/b616962g","","","0.71073","MoKα","","0.0599","0.0347","","","0.0861","0.1235","","","","","","0.956","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005130","27.511","0.0005","10.411","0.0002","20.747","0.0005","90","","117.16","0.0008","90","","5287.07","0.19","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C22 H27 F3 N O7 P Pd S -","- C22 H27 F3 N O7 P Pd S -","- C176 H216 F24 N8 O56 P8 Pd8 S8 -","8","1","","Agostinho, Magno; Braunstein, Pierre; Welter, Richard","Phosphinito- and phosphonito-oxazoline Pd(II) complexes as CO/ethylene insertion intermediates: synthesis and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2007","","7","759","770","10.1039/b616962g","","","0.7107","MoKα","","0.0775","0.0434","","","0.1161","0.1441","","","","","","0.878","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005131","18.617","0.0005","12.404","0.0006","11.676","0.0013","90","","104.533","0.0017","90","","2610","0.3","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C23 H25 F3 N O7 P Pd S -","- C23 H25 F3 N O7 P Pd S -","- C92 H100 F12 N4 O28 P4 Pd4 S4 -","4","1","","Agostinho, Magno; Braunstein, Pierre; Welter, Richard","Phosphinito- and phosphonito-oxazoline Pd(II) complexes as CO/ethylene insertion intermediates: synthesis and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2007","","7","759","770","10.1039/b616962g","","","0.71073","MoKα","","0.1534","0.0668","","","0.1374","0.1823","","","","","","0.964","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005132","12.186","0.001","14.617","0.001","16.104","0.001","90","","105.62","0.05","90","","2762.6","0.8","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C25 H29 F3 N O7 P Pd S -","- C25 H29 F3 N O7 P Pd S -","- C100 H116 F12 N4 O28 P4 Pd4 S4 -","4","1","","Agostinho, Magno; Braunstein, Pierre; Welter, Richard","Phosphinito- and phosphonito-oxazoline Pd(II) complexes as CO/ethylene insertion intermediates: synthesis and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2007","","7","759","770","10.1039/b616962g","","","0.7107","MoKα","","0.1133","0.0445","","","0.092","0.1164","","","","","","0.985","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005133","29.656","0.0001","8.965","0.0001","8.687","0.0004","90","","90","","90","","2309.58","0.11","173","2","173","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C19 H22 Cl4 N O2 P Pd -","- C19 H22 Cl4 N O2 P Pd -","- C76 H88 Cl16 N4 O8 P4 Pd4 -","4","1","","Agostinho, Magno; Braunstein, Pierre; Welter, Richard","Phosphinito- and phosphonito-oxazoline Pd(II) complexes as CO/ethylene insertion intermediates: synthesis and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2007","","7","759","770","10.1039/b616962g","","","0.71073","MoKα","","0.0369","0.0323","","","0.0861","0.0887","","","","","","1.139","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005134","11.58","0.0002","9.109","0.0002","22.666","0.0004","90","","90.671","0.0009","90","","2390.7","0.08","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C20 H23 F3 N O5 P Pd S -","- C20 H23 F3 N O5 P Pd S -","- C80 H92 F12 N4 O20 P4 Pd4 S4 -","4","1","","Agostinho, Magno; Braunstein, Pierre; Welter, Richard","Phosphinito- and phosphonito-oxazoline Pd(II) complexes as CO/ethylene insertion intermediates: synthesis and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2007","","7","759","770","10.1039/b616962g","","","0.71073","MoKα","","0.0809","0.0362","","","0.0816","0.0943","","","","","","0.898","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005135","8.785","0.001","28.238","0.003","9.672","0.001","90","","114.84","0.05","90","","2177.4","1","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 Cl2 N O3 P Pd -","- C20 H22 Cl2 N O3 P Pd -","- C80 H88 Cl8 N4 O12 P4 Pd4 -","4","1","","Agostinho, Magno; Braunstein, Pierre; Welter, Richard","Phosphinito- and phosphonito-oxazoline Pd(II) complexes as CO/ethylene insertion intermediates: synthesis and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2007","","7","759","770","10.1039/b616962g","","","0.7107","MoKα","","0.0506","0.0345","","","0.0919","0.1096","","","","","","1.123","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005136","5.6124","0.0003","13.1456","0.0007","12.61","0.0007","90","","95.721","0.002","90","","925.71","0.09","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H11 Fe N O -","- C11 H11 Fe N O -","- C44 H44 Fe4 N4 O4 -","4","1","","Salazar-Mendoza, Domingo; Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; De Cian, André","Arranging up to six ferrocene carboxamides around metal centres.","Dalton transactions (Cambridge, England : 2003)","2007","","5","565","569","10.1039/b617112p","","","0.71073","MoKα","","0.0338","0.0269","","","0.0681","0.0701","","","","","","1.074","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005137","22.4039","0.0005","13.9424","0.0003","23.4953","0.0006","90","","115.879","0.001","90","","6603.1","0.3","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C66 H68 B2 Co F8 Fe6 N6 O7 -","- C66 H66 B2 Co F8 Fe6 N6 O7 -","- C264 H264 B8 Co4 F32 Fe24 N24 O28 -","4","1","","Salazar-Mendoza, Domingo; Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; De Cian, André","Arranging up to six ferrocene carboxamides around metal centres.","Dalton transactions (Cambridge, England : 2003)","2007","","5","565","569","10.1039/b617112p","","","0.71073","MoKα","","0.0587","0.0381","","","0.11","0.1286","","","","","","1.061","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005138","16.878","0.0006","19.529","0.0008","19.386","0.0008","90","","91.926","0.003","90","","6386.2","0.4","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C66 H66 B2 Co F8 Fe6 N6 O6 -","- C66 H66 B2 Co F8 Fe6 N6 O6 -","- C264 H264 B8 Co4 F32 Fe24 N24 O24 -","4","1","","Salazar-Mendoza, Domingo; Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; De Cian, André","Arranging up to six ferrocene carboxamides around metal centres.","Dalton transactions (Cambridge, England : 2003)","2007","","5","565","569","10.1039/b617112p","","","0.71073","MoKα","","0.1972","0.0779","","","0.1583","0.1969","","","","","","1.076","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005139","16.8422","0.0005","19.561","0.0005","19.3563","0.0005","90","","92.055","0.002","90","","6372.8","0.3","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C66 H66 B2 F8 Fe6 N6 Ni O6 -","- C66 H66 B2 F8 Fe6 N6 Ni O6 -","- C264 H264 B8 F32 Fe24 N24 Ni4 O24 -","4","1","","Salazar-Mendoza, Domingo; Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; De Cian, André","Arranging up to six ferrocene carboxamides around metal centres.","Dalton transactions (Cambridge, England : 2003)","2007","","5","565","569","10.1039/b617112p","","","0.71073","MoKα","","0.1263","0.0544","","","0.1432","0.1831","","","","","","1.007","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005140","10.011","0.0004","12.257","0.0004","12.336","0.0004","110.917","0.002","91.71","0.0019","90.417","0.0013","1413.04","0.09","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C54 H60 Cu F6 Fe4 N4 O12 S2 -","- C54 H60 Cu F6 Fe4 N4 O12 S2 -","- C54 H60 Cu F6 Fe4 N4 O12 S2 -","1","0.5","","Salazar-Mendoza, Domingo; Baudron, Stéphane A; Hosseini, Mir Wais; Kyritsakas, Nathalie; De Cian, André","Arranging up to six ferrocene carboxamides around metal centres.","Dalton transactions (Cambridge, England : 2003)","2007","","5","565","569","10.1039/b617112p","","","0.71073","MoKα","","0.09","0.0473","","","0.0781","0.0889","","","","","","1.032","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005141","15.2619","0.0008","19.9179","0.0011","18.4954","0.001","90","","110.175","0.001","90","","5277.4","0.5","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C44 H64 Cu2 F12 N8 O4 P2 -","- C44 H64 Cu2 F12 N8 O4 P2 -","- C176 H256 Cu8 F48 N32 O16 P8 -","4","1","","Yang, Lei; Powell, Douglas R.; Houser, Robert P.","Structural variation in copper(I) complexes with pyridylmethylamide ligands: structural analysis with a new four-coordinate geometry index, tau4.","Dalton transactions (Cambridge, England : 2003)","2007","","9","955","964","10.1039/b617136b","","","0.71073","MoKα","","0.029","0.0271","","","0.0756","0.0766","","","","","","1.025","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005142","9.5739","0.0016","8.542","0.0014","25.145","0.004","90","","99.355","0.005","90","","2029","0.6","87","2","87","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 Cu F6 N4 O2 P -","- C16 H20 Cu F6 N4 O2 P -","- C64 H80 Cu4 F24 N16 O8 P4 -","4","1","","Yang, Lei; Powell, Douglas R.; Houser, Robert P.","Structural variation in copper(I) complexes with pyridylmethylamide ligands: structural analysis with a new four-coordinate geometry index, tau4.","Dalton transactions (Cambridge, England : 2003)","2007","","9","955","964","10.1039/b617136b","","","0.71073","MoKα","","0.0278","0.0259","","","0.0718","0.0733","","","","","","1.007","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005143","9.336","0.003","9.732","0.003","25.406","0.008","82.221","0.005","81.962","0.005","74.409","0.005","2190","1.2","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H44 Cu F6 N4 O2 P -","- C52 H44 Cu F6 N4 O2 P -","- C104 H88 Cu2 F12 N8 O4 P2 -","2","1","","Yang, Lei; Powell, Douglas R.; Houser, Robert P.","Structural variation in copper(I) complexes with pyridylmethylamide ligands: structural analysis with a new four-coordinate geometry index, tau4.","Dalton transactions (Cambridge, England : 2003)","2007","","9","955","964","10.1039/b617136b","","","0.71073","MoKα","","0.0575","0.0527","","","0.1343","0.1376","","","","","","1.009","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005144","8.008","0.002","11.738","0.004","17.289","0.005","86.917","0.005","89.583","0.005","84.15","0.005","1614.3","0.8","97","2","97","2","","","","","","","","8","P -1","-P 1","2","","","","- C29 H30 Cl2 Cu F6 N3 O P2 -","- C29 H30 Cl2 Cu F6 N3 O P2 -","- C58 H60 Cl4 Cu2 F12 N6 O2 P4 -","2","1","","Yang, Lei; Powell, Douglas R.; Houser, Robert P.","Structural variation in copper(I) complexes with pyridylmethylamide ligands: structural analysis with a new four-coordinate geometry index, tau4.","Dalton transactions (Cambridge, England : 2003)","2007","","9","955","964","10.1039/b617136b","","","0.71073","MoKα","","0.0614","0.0474","","","0.1204","0.1268","","","","","","1.05","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005145","10.1288","0.0002","17.4431","0.0003","17.6656","0.0003","90","","99.828","0.002","90","","3075.31","0.1","100","2","100","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H50 Cl2 Cu N6 O9 -","- C22 H48 Cl2 Cu N6 O9 -","- C88 H192 Cl8 Cu4 N24 O36 -","4","1","","Bernhardt, Paul V.; Bramley, Richard; Geue, Rodney J.; Ralph, Stephen F.; Sargeson, Alan M.","An expanded cavity hexaamine cage for copper(II).","Dalton transactions (Cambridge, England : 2003)","2007","","12","1244","1249","10.1039/b617153b","","x-ray","0.71073","MoKα","","0.08","0.0602","","","0.1759","0.189","","","","","","1.304","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005146","17.2239","0.0005","19.2234","0.0006","20.3456","0.0006","90","","97.705","0.001","90","","6675.6","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C69 H99 O6 P2 Rh -","- C69 H99 O6 P2 Rh -","- C276 H396 O24 P8 Rh4 -","4","1","","Rubio, Miguel; Suárez, Andrés; del Río, Diego; Galindo, Agustín; Alvarez, Eleuterio; Pizzano, Antonio","Rhodium diphosphite pincer complexes. Rare preferred in-plane olefin conformation in square-planar compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","4","407","409","10.1039/b617164h","","","0.71073","MoKα","","0.0392","0.0311","","","0.0797","0.085","","","","","","1.052","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005147","10.4092","0.0011","18.8544","0.0018","26.636","0.003","90","","90","","90","","5227.6","0.9","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C56 H71 O6 P2 Rh -","- C56 H71 O6 P2 Rh -","- C224 H284 O24 P8 Rh4 -","4","1","","Rubio, Miguel; Suárez, Andrés; del Río, Diego; Galindo, Agustín; Alvarez, Eleuterio; Pizzano, Antonio","Rhodium diphosphite pincer complexes. Rare preferred in-plane olefin conformation in square-planar compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","4","407","409","10.1039/b617164h","","","0.71073","MoKα","","0.0421","0.0352","","","0.0717","0.0747","","","","","","1.019","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005148","11.8923","0.0004","5.5608","0.0002","15.7983","0.0005","90","","99.3695","0.0014","90","","1030.81","0.06","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 Cu N6 S2 -","- C18 H24 Cu N6 S2 -","- C36 H48 Cu2 N12 S4 -","2","0.5","","López-Torres, Elena; Cowley, Andrew R.; Dilworth, Jonathan R.","Complexation versus thiadiazole formation for reactions of thiosemicarbazides with copper(II).","Dalton transactions (Cambridge, England : 2003)","2007","","12","1194","1196","10.1039/b617186a","","","0.71073","MoKα","","0.0478","0.0324","","0.0505","0.0379","0.0379","","","","","","1.0768","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005149","7.39","0.0002","9.9448","0.0002","16.1842","0.0003","80.9969","0.001","88.6086","0.001","85.1073","0.0009","1170.4","0.05","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","6","P -1","-P 1","2","","","","- C18 H20 Cl4 Cu N6 S2 -","- C18 H20 Cl4 Cu N6 S2 -","- C36 H40 Cl8 Cu2 N12 S4 -","2","1","","López-Torres, Elena; Cowley, Andrew R.; Dilworth, Jonathan R.","Complexation versus thiadiazole formation for reactions of thiosemicarbazides with copper(II).","Dalton transactions (Cambridge, England : 2003)","2007","","12","1194","1196","10.1039/b617186a","","","0.71073","MoKα","","0.0421","0.031","","0.0488","0.0357","0.0357","","","","","","1.0827","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005150","17.607","0.002","8.835","0.001","22.375","0.003","90","","102.81","0.01","90","","3394","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H56 I16 N8 Pb3 S8 -","- C16 H56 I16 N8 Pb3 S8 -","- C32 H112 I32 N16 Pb6 S16 -","2","0.5","","Louvain, Nicolas; Bi, Wenhua; Mercier, Nicolas; Buzaré, Jean-Yves; Legein, Christophe; Corbel, Gwenaël","PbnI4n+2(2n+2)- ribbons (n = 3, 5) as dimensional reductions of 2D perovskite layers in cystamine cation based hybrids, also incorporating iodine molecules or reversible guest water molecules.","Dalton transactions (Cambridge, England : 2003)","2007","","9","965","970","10.1039/b617225c","","x-ray","0.71073","MoKα","","","0.0462","","","","0.0795","","","","","","1.012","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005151","23.232","0.001","8.7714","0.0003","25.812","0.001","90","","100.98","0.01","90","","5163.6","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H92 I22 N12 O4 Pb5 S12 -","- C24 H84 I22 N12 O4 Pb5 S12 -","- C48 H168 I44 N24 O8 Pb10 S24 -","2","0.5","","Louvain, Nicolas; Bi, Wenhua; Mercier, Nicolas; Buzaré, Jean-Yves; Legein, Christophe; Corbel, Gwenaël","PbnI4n+2(2n+2)- ribbons (n = 3, 5) as dimensional reductions of 2D perovskite layers in cystamine cation based hybrids, also incorporating iodine molecules or reversible guest water molecules.","Dalton transactions (Cambridge, England : 2003)","2007","","9","965","970","10.1039/b617225c","","x-ray","0.71073","MoKα","","","0.0516","","","","0.0933","","","","","","0.965","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005152","23.2561","0.0001","8.7779","0.0001","25.5704","0.0001","90","","100.366","0.001","90","","5134.74","0.07","293","2","353","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H88 I22 N12 O2 Pb5 S12 -","- C24 H94 I22 N12 O2 Pb5 S12 -","- C48 H188 I44 N24 O4 Pb10 S24 -","2","0.5","","Louvain, Nicolas; Bi, Wenhua; Mercier, Nicolas; Buzaré, Jean-Yves; Legein, Christophe; Corbel, Gwenaël","PbnI4n+2(2n+2)- ribbons (n = 3, 5) as dimensional reductions of 2D perovskite layers in cystamine cation based hybrids, also incorporating iodine molecules or reversible guest water molecules.","Dalton transactions (Cambridge, England : 2003)","2007","","9","965","970","10.1039/b617225c","","x-ray","0.71073","MoKα","","","0.0553","","","","0.1029","","","","","","1.008","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005153","11.4941","0.0005","11.6541","0.0005","23.092","0.001","90","","91.45","0.01","90","","3092.3","0.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H14 Br4 N2 Pb S2 -","- C4 H14 Br4 N2 Pb S2 -","- C32 H112 Br32 N16 Pb8 S16 -","8","1","","Louvain, Nicolas; Bi, Wenhua; Mercier, Nicolas; Buzaré, Jean-Yves; Legein, Christophe; Corbel, Gwenaël","PbnI4n+2(2n+2)- ribbons (n = 3, 5) as dimensional reductions of 2D perovskite layers in cystamine cation based hybrids, also incorporating iodine molecules or reversible guest water molecules.","Dalton transactions (Cambridge, England : 2003)","2007","","9","965","970","10.1039/b617225c","","x-ray","0.71073","MoKα","","","0.045","","","","0.0792","","","","","","1.069","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005154","8.2995","0.0012","11.9091","0.0016","15.662","0.002","90","","90","","90","","1548","0.4","213","2","213","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C14 H18 Cl2 Fe N P -","- C14 H18 Cl2 Fe N P -","- C56 H72 Cl8 Fe4 N4 P4 -","4","1","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Aminoalkylferrocenyldichlorophosphanes: facile synthesis of versatile chiral starting materials.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1377","1382","10.1039/b617257a","","","0.71073","MoKα","","0.0258","0.0234","","","0.057","0.0583","","","","","","1.06","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005155","10.2696","0.001","10.762","0.0009","13.4203","0.0013","90","","100.198","0.012","90","","1459.8","0.2","208","2","208","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H16 Cl2 Fe N P -","- C13 H16 Cl2 Fe N P -","- C52 H64 Cl8 Fe4 N4 P4 -","4","1","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Aminoalkylferrocenyldichlorophosphanes: facile synthesis of versatile chiral starting materials.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1377","1382","10.1039/b617257a","","","0.71073","MoKα","","0.0437","0.0261","","","0.0573","0.0599","","","","","","0.869","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005156","16.0644","0.0016","26.933","0.003","28.661","0.003","90","","90","","90","","12401","2","213","2","213","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C114 H174 Fe6 Li12 N6 O3 P6 -","- C102 H146 Fe6 Li12 N6 O3 P6 -","- C408 H584 Fe24 Li48 N24 O12 P24 -","4","1","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Aminoalkylferrocenyldichlorophosphanes: facile synthesis of versatile chiral starting materials.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1377","1382","10.1039/b617257a","","","0.71073","MoKα","","0.0542","0.0379","","","0.0894","0.0921","","","","","","0.804","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005157","10.0968","0.0015","12.1986","0.0018","12.968","0.002","65.532","0.003","71.067","0.003","85.882","0.003","1371.5","0.4","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H32 Fe N P Si -","- C31 H32 Fe N P Si -","- C62 H64 Fe2 N2 P2 Si2 -","2","1","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Aminoalkylferrocenyldichlorophosphanes: facile synthesis of versatile chiral starting materials.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1377","1382","10.1039/b617257a","","","0.71073","MoKα","","0.0757","0.0551","","","0.1239","0.1372","","","","","","1.14","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005158","10.4014","0.0009","10.6429","0.0011","13.2272","0.0012","74.919","0.011","75.272","0.01","69.639","0.011","1303.6","0.2","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H31 Fe N Si -","- C31 H31 Fe N Si -","- C62 H62 Fe2 N2 Si2 -","2","1","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Aminoalkylferrocenyldichlorophosphanes: facile synthesis of versatile chiral starting materials.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1377","1382","10.1039/b617257a","","","0.71073","MoKα","","0.056","0.0308","","","0.0644","0.068","","","","","","0.804","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005159","10.2987","0.0001","21.979","0.0002","14.6812","0.0001","90","","95.219","0.001","90","","3309.39","0.05","130","2","130","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C37 H44 Cl2 Fe N P Si -","- C31 H30 Cl2 Fe N P Si -","- C124 H120 Cl8 Fe4 N4 P4 Si4 -","4","1","","Tschirschwitz, Steffen; Lönnecke, Peter; Hey-Hawkins, Evamarie","Aminoalkylferrocenyldichlorophosphanes: facile synthesis of versatile chiral starting materials.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1377","1382","10.1039/b617257a","","","0.71073","MoKα","","0.0487","0.0374","","","0.0961","0.1042","","","","","","1.102","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005160","9.885","0.002","45.2","0.009","7.484","0.002","90","","111.043","0.01","90","","3120.9","1.2","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","catena-(mu-terephthalato)-(4,4'dipirydine-N,N'oxide)- bis(aquo)cobalt(ii) hexa(aquo)cobalt(ii) terephthalate hydrate","catena-(mu-terephthalato)-(4,4'dipirydine-N,N'oxide)-bis(aquo)cobalt(II) hexa(aquo)cobalt(II) terephthalate hydrate","","- C26 H34 Co2 N2 O19 -","- C26 H34 Co2 N2 O19 -","- C104 H136 Co8 N8 O76 -","4","1","","Manna, Subal Chandra; Zangrando, Ennio; Ribas, Joan; Ray Chaudhuri, Nirmalendu","Cobalt(II)-(dpyo)-dicarboxylate networks: unique H-bonded assembly and rare bridging mode of dpyo in one of them [dpyo = 4,4'-dipyridyl N,N'-dioxide].","Dalton transactions (Cambridge, England : 2003)","2007","","14","1383","1391","10.1039/b617278d","","","0.71073","Mokα","","0.0601","0.0417","","","0.0932","0.0992","","","","","","0.932","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005161","14.133","0.003","5.462","0.003","15.281","0.004","90","","94.35","0.02","90","","1176.2","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","catena-oxalate-(4,4'pyridine-N,N'dioxide)-cobalt(ii)","catena-oxalate-(4,4'pyridine-N,N'dioxide)-cobalt(II)","","- C12 H8 Co N2 O6 -","- C12 H8 Co N2 O6 -","- C48 H32 Co4 N8 O24 -","4","0.5","","Manna, Subal Chandra; Zangrando, Ennio; Ribas, Joan; Ray Chaudhuri, Nirmalendu","Cobalt(II)-(dpyo)-dicarboxylate networks: unique H-bonded assembly and rare bridging mode of dpyo in one of them [dpyo = 4,4'-dipyridyl N,N'-dioxide].","Dalton transactions (Cambridge, England : 2003)","2007","","14","1383","1391","10.1039/b617278d","","","0.71073","Mokα","","0.0736","0.0409","","","0.0937","0.1053","","","","","","0.911","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005162","5.308","0.002","7.285","0.003","9.814","0.003","86.53","0.02","82.54","0.02","74.31","0.02","362.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","catena-diaquo-(4,4'-bipyridineoxide,O,O')-fumarate-cobalt(ii)","catena-diaquo-(4,4'-bipyridineoxide,O,O')-fumarate-cobalt(II)","","- C14 H14 Co N2 O8 -","- C14 H14 Co N2 O8 -","- C14 H14 Co N2 O8 -","1","0.5","","Manna, Subal Chandra; Zangrando, Ennio; Ribas, Joan; Ray Chaudhuri, Nirmalendu","Cobalt(II)-(dpyo)-dicarboxylate networks: unique H-bonded assembly and rare bridging mode of dpyo in one of them [dpyo = 4,4'-dipyridyl N,N'-dioxide].","Dalton transactions (Cambridge, England : 2003)","2007","","14","1383","1391","10.1039/b617278d","","","0.71073","Mokα","","0.0592","0.049","","","0.1227","0.1313","","","","","","1.1","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005163","20.444","0.007","12.367","0.004","9.933","0.003","90","","90","","90","","2511.4","1.4","298","2","298","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C17 H30 B10 Co Rh S2 -","- C17 H30 B10 Co Rh S2 -","- C68 H120 B40 Co4 Rh4 S8 -","4","0.5","","Liu, Shuang; Jin, Guo-Xin","A facile and general approach to the Rh-M (M = Co, Rh) single bond supported by ortho-carborane-1,2-dichalcogenolato ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","9","949","954","10.1039/b617295d","","","0.71073","MoKα","","0.0725","0.0402","","","0.0904","0.097","","","","","","0.941","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005164","20.729","0.005","12.437","0.003","9.953","0.002","90","","90","","90","","2565.9","1","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C17 H30 B10 Co Rh Se2 -","- C17 H30 B10 Co Rh Se2 -","- C68 H120 B40 Co4 Rh4 Se8 -","4","0.5","","Liu, Shuang; Jin, Guo-Xin","A facile and general approach to the Rh-M (M = Co, Rh) single bond supported by ortho-carborane-1,2-dichalcogenolato ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","9","949","954","10.1039/b617295d","","","0.71073","MoKα","","0.0913","0.0429","","","0.0866","0.0956","","","","","","0.826","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005165","20.371","0.007","12.197","0.004","10.192","0.003","90","","90","","90","","2532.4","1.4","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C17 H30 B10 Rh2 S2 -","- C17 H30 B10 Rh2 S2 -","- C68 H120 B40 Rh8 S8 -","4","0.5","","Liu, Shuang; Jin, Guo-Xin","A facile and general approach to the Rh-M (M = Co, Rh) single bond supported by ortho-carborane-1,2-dichalcogenolato ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","9","949","954","10.1039/b617295d","","","0.71073","MoKα","","0.0545","0.0375","","","0.0711","0.0753","","","","","","1.028","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005166","12.933","0.003","10.155","0.003","20.411","0.005","90","","105.42","0.004","90","","2584.2","1.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H30 B10 Rh2 Se2 -","- C17 H30 B10 Rh2 Se2 -","- C68 H120 B40 Rh8 Se8 -","4","1","","Liu, Shuang; Jin, Guo-Xin","A facile and general approach to the Rh-M (M = Co, Rh) single bond supported by ortho-carborane-1,2-dichalcogenolato ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","9","949","954","10.1039/b617295d","","","0.71073","MoKα","","0.1069","0.0446","","","0.0697","0.0772","","","","","","0.72","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005167","9.247","0.003","12.611","0.004","16.472","0.005","90","","90","","90","","1920.9","1","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C12 H20 B10 Rh2 S2 -","- C12 H20 B10 Rh2 S2 -","- C48 H80 B40 Rh8 S8 -","4","0.5","","Liu, Shuang; Jin, Guo-Xin","A facile and general approach to the Rh-M (M = Co, Rh) single bond supported by ortho-carborane-1,2-dichalcogenolato ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","9","949","954","10.1039/b617295d","","","0.71073","MoKα","","0.0474","0.0285","","","0.0541","0.0581","","","","","","0.863","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005168","19.1563","0.0005","8.9531","0.0002","16.6221","0.0004","90","","114.633","0.001","90","","2591.39","0.11","296","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H30 F6 N4 O16 U2 -","- C12 H26 F6 N4 O16 U2 -","- C48 H104 F24 N16 O64 U8 -","4","1","","Wang, Chih-Min; Wu, Yi-Ying; Chen, Pei-Lin; Lii, Kwang-Hwa","Organically templated uranium(IV) fluorooxalates with layer structures: (H4TREN)[U2F6(C2O4)3].4H2O (TREN = tris(2-aminoethyl)amine) and (H4APPIP)[U2F6(C2O4)3].4H2O (APPIP = 1,4-bis(3-amino-propyl)piperazine).","Dalton transactions (Cambridge, England : 2003)","2007","","10","1034","1037","10.1039/b617333k","","","0.71073","MoKα","","0.0414","0.0249","","","0.0514","0.0532","","","","","","0.913","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005169","10.3309","0.0008","15.5639","0.0011","17.5369","0.0011","90","","95.43","0.004","90","","2807.1","0.3","296","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H36 F6 N4 O16 U2 -","- C16 H36 F6 N4 O16 U2 -","- C64 H144 F24 N16 O64 U8 -","4","1","","Wang, Chih-Min; Wu, Yi-Ying; Chen, Pei-Lin; Lii, Kwang-Hwa","Organically templated uranium(IV) fluorooxalates with layer structures: (H4TREN)[U2F6(C2O4)3].4H2O (TREN = tris(2-aminoethyl)amine) and (H4APPIP)[U2F6(C2O4)3].4H2O (APPIP = 1,4-bis(3-amino-propyl)piperazine).","Dalton transactions (Cambridge, England : 2003)","2007","","10","1034","1037","10.1039/b617333k","","","0.71073","MoKα","","0.0345","0.0249","","","0.059","0.0626","","","","","","1.016","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005170","7.1104","0.0006","7.5366","0.0006","19.7004","0.0015","90","","96.569","0.005","90","","1048.78","0.15","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H28 Au2 N6 S2 -","- C14 H28 Au2 N6 S2 -","- C28 H56 Au4 N12 S4 -","2","0.5","","Heathcote, Robert; Howell, James A. S.; Jennings, Nicola; Cartlidge, David; Cobden, Lisa; Coles, Simon; Hursthouse, Michael","Gold(I)-isocyanide and gold(I)-carbene complexes as substrates for the laser decoration of gold onto ceramic surfaces.","Dalton transactions (Cambridge, England : 2003)","2007","","13","1309","1315","10.1039/b617347k","","","0.71073","MoKα","","0.0702","0.0469","","","0.1021","0.1124","","","","","","0.997","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005171","6.0866","0.0005","7.367","0.001","10.6488","0.0008","99.559","0.009","94.174","0.007","111.73","0.013","432.68","0.09","293","2","293","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","pyrimidine-4,6-dicarboxylic acid dihydrate","","- C6 H8 N2 O6 -","- C6 H8 N2 O6 -","- C12 H16 N4 O12 -","2","1","","Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; García-Terán, Juan P; Román, Pascual","Rational design of 1-D metal-organic frameworks based on the novel pyrimidine-4,6-dicarboxylate ligand. New insights into pyrimidine through magnetic interaction.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2669","2680","10.1039/b617348a","","","0.71073","MoKα","","0.0762","0.0601","","","0.1433","0.151","","","","","","0.991","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005172","4.329","0.001","12.36","0.002","14.06","0.002","90","","94.51","0.02","90","","750","0.2","293","2","293","2","","","","","","","synthesis as described","5","C 1 c 1","C -2yc","9","potassium pyrimidine-4,6-dicarboxylate acid","potassium pyrimidine-4,6-dicarboxylate acid","","- C6 H3 K N2 O4 -","- C6 H3 K N2 O4 -","- C24 H12 K4 N8 O16 -","4","1","","Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; García-Terán, Juan P; Román, Pascual","Rational design of 1-D metal-organic frameworks based on the novel pyrimidine-4,6-dicarboxylate ligand. New insights into pyrimidine through magnetic interaction.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2669","2680","10.1039/b617348a","","","0.71073","MoKα","","0.0769","0.0341","","","0.0633","0.0686","","","","","","0.757","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005173","6.8143","0.0003","18.127","0.0008","6.3397","0.0002","90","","90","","90","","783.1","0.05","293","2","293","2","","","","","","","synthesis as described","5","P n m a","-P 2ac 2n","62","potassium pyrimidine-4,6-dicarboxylate","potassium pyrimidine-4,6-dicarboxylate","","- C6 H2 K2 N2 O4 -","- C6 H2 K2 N2 O4 -","- C24 H8 K8 N8 O16 -","4","0.5","","Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; García-Terán, Juan P; Román, Pascual","Rational design of 1-D metal-organic frameworks based on the novel pyrimidine-4,6-dicarboxylate ligand. New insights into pyrimidine through magnetic interaction.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2669","2680","10.1039/b617348a","","","0.71073","MoKα","","0.0712","0.0409","","","0.0905","0.1002","","","","","","1.039","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005174","7.3475","0.0005","12.1276","0.0004","12.357","0.0006","90","","120.973","0.004","90","","944.1","0.09","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","catena-[(mu-pyrimidine-4,6-dicarboxylato-N,O:N,O)- diaqua-iron(II)-water (1/1)]","","- C6 H8 Fe N2 O7 -","- C6 H8 Fe N2 O7 -","- C24 H32 Fe4 N8 O28 -","4","1","","Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; García-Terán, Juan P; Román, Pascual","Rational design of 1-D metal-organic frameworks based on the novel pyrimidine-4,6-dicarboxylate ligand. New insights into pyrimidine through magnetic interaction.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2669","2680","10.1039/b617348a","","","0.71069","MoKα","","0.0426","0.0368","","","0.087","0.0885","","","","","","1.08","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005175","7.279","0.001","12.095","0.002","12.185","0.003","90","","120.21","0.02","90","","927.1","0.4","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","catena-[(mu-pyrimidine-4,6-dicarboxylato-N,O:N,O)- diaqua-manganese(II)-water (1/1)]","","- C6 H8 Co N2 O7 -","- C6 H8 Co N2 O7 -","- C24 H32 Co4 N8 O28 -","4","1","","Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; García-Terán, Juan P; Román, Pascual","Rational design of 1-D metal-organic frameworks based on the novel pyrimidine-4,6-dicarboxylate ligand. New insights into pyrimidine through magnetic interaction.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2669","2680","10.1039/b617348a","","","0.71069","MoKα","","0.0892","0.0396","","","0.0798","0.0894","","","","","","0.84","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005176","7.285","0.001","12.167","0.002","12.254","0.002","90","","120.29","0.01","90","","937.9","0.3","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","catena-[(mu-pyrimidine-4,6-dicarboxylato-N,O:N,O)- diaqua-zinc(II)-water (1/1)]","","- C6 H8 N2 O7 Zn -","- C6 H8 N2 O7 Zn -","- C24 H32 N8 O28 Zn4 -","4","1","","Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; García-Terán, Juan P; Román, Pascual","Rational design of 1-D metal-organic frameworks based on the novel pyrimidine-4,6-dicarboxylate ligand. New insights into pyrimidine through magnetic interaction.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2669","2680","10.1039/b617348a","","","0.71069","MoKα","","0.0931","0.0334","","","0.0694","0.0752","","","","","","0.731","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005177","6.977","0.002","12.234","0.003","12.008","0.003","90","","120.44","0.03","90","","883.7","0.5","293","2","293","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","catena-[(mu-pyrimidine-4,6-dicarboxylato-N,O:N,O)- diaqua-copper(II)]","","- C6 H6 Cu N2 O6.2 -","- C6 H6 Cu N2 O6.2 -","- C24 H24 Cu4 N8 O24.8 -","4","0.5","","Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; García-Terán, Juan P; Román, Pascual","Rational design of 1-D metal-organic frameworks based on the novel pyrimidine-4,6-dicarboxylate ligand. New insights into pyrimidine through magnetic interaction.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2669","2680","10.1039/b617348a","","","0.71069","MoKα","","0.1125","0.0409","","","0.0819","0.0879","","","","","","0.689","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005178","9.928","0.001","16.232","0.001","13.412","0.001","90","","115.14","0.01","90","","1956.6","0.3","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","catena-((mu-pyrimidine-4,6-dicarboxylato-N,O:N,O)-(2,2'- dipyridylamine) -zinc(ii)-water (1/4))","catena-[(mu-pyrimidine-4,6-dicarboxylato-N,O:N,O)-(2,2'-dipyridylamine) -zinc(II)-water (1/4)]","","- C16 H19 Cu N5 O8 -","- C16 H19 Cu N5 O8 -","- C64 H76 Cu4 N20 O32 -","4","1","","Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; García-Terán, Juan P; Román, Pascual","Rational design of 1-D metal-organic frameworks based on the novel pyrimidine-4,6-dicarboxylate ligand. New insights into pyrimidine through magnetic interaction.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2669","2680","10.1039/b617348a","","","0.71069","MoKα","","0.0663","0.0348","","","0.0755","0.0799","","","","","","0.841","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005179","15.3067","0.0018","16.4584","0.0019","18.009","0.002","111.511","0.002","93.653","0.002","112.056","0.002","3803.8","0.8","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C65 H83.5 N10.5 Ni4 O18.25 -","- C65 H83.5 N10.5 Ni4 O18.25 -","- C130 H167 N21 Ni8 O36.5 -","2","1","","Fondo, Matilde; García-Deibe, Ana M; Ocampo, Noelia; Sanmartín, Jesús; Bermejo, Manuel R.","Asymmetric self-assembly with atmospheric CO2 fixation of a pentanuclear carbonate NiI) complex based on dissimilar building blocks.","Dalton transactions (Cambridge, England : 2003)","2007","","4","414","416","10.1039/b617374h","","","0.71073","MoKα","","0.0638","0.0476","","","0.1449","0.1595","","","","","","1.091","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005180","12.093","0.001","26.699","0.002","22.907","0.0019","90","","104.105","0.002","90","","7173","1","120","0.1","120","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C62.5 H85.5 N8 Ni5 O21.2 -","- C62.5 H85.5 N8 Ni5 O21.2 -","- C250 H342 N32 Ni20 O84.8 -","4","1","","Fondo, Matilde; García-Deibe, Ana M; Ocampo, Noelia; Sanmartín, Jesús; Bermejo, Manuel R.","Asymmetric self-assembly with atmospheric CO2 fixation of a pentanuclear carbonate NiI) complex based on dissimilar building blocks.","Dalton transactions (Cambridge, England : 2003)","2007","","4","414","416","10.1039/b617374h","","","0.71073","MoKα","","0.1245","0.0642","","","0.159","0.1955","","","","","","1.043","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005181","9.979","0.0014","21.449","0.003","19.317","0.003","90","","99.998","0.002","90","","4071.8","1","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33.5 H50 N4 Ni3 O14.5 -","- C33.5 H50 N4 Ni3 O14.5 -","- C134 H200 N16 Ni12 O58 -","4","1","","Fondo, Matilde; García-Deibe, Ana M; Ocampo, Noelia; Sanmartín, Jesús; Bermejo, Manuel R.","Asymmetric self-assembly with atmospheric CO2 fixation of a pentanuclear carbonate NiI) complex based on dissimilar building blocks.","Dalton transactions (Cambridge, England : 2003)","2007","","4","414","416","10.1039/b617374h","","","0.71073","MoKα","","0.0476","0.0359","","","0.0988","0.1043","","","","","","1.064","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005182","9.452","0.0006","14.333","0.0017","20.2351","0.0019","103.546","0.008","99.832","0.007","95.962","0.005","2596.2","0.4","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H56 K4 Nb6 O33 Ru2 -","- C20 H28 K4 Nb6 O33 Ru2 -","- C40 H56 K8 Nb12 O66 Ru4 -","2","1","","Laurencin, Danielle; Thouvenot, René; Boubekeur, Kamal; Proust, Anna","Synthesis and reactivity of {Ru(p-cymene)}2+ derivatives of [Nb6O19]8-: a rational approach towards fluxional organometallic derivatives of polyoxometalates.","Dalton transactions (Cambridge, England : 2003)","2007","","13","1334","1345","10.1039/b617390j","","","0.71073","MoKα","","0.0809","0.0373","","","0.0838","0.0947","","","","","","1.08","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005183","10.58","0.0003","15.0793","0.0003","17.7612","0.0005","98.443","0.002","100.975","0.001","103.106","0.002","2655.29","0.12","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C104 H96 Ag4 N4 O2 P8 Te8 -","- C104 H96 Ag4 N4 O2 P8 Te8 -","- C104 H96 Ag4 N4 O2 P8 Te8 -","1","0.5","","Copsey, May C.; Panneerselvam, Arunkumar; Afzaal, Mohammad; Chivers, Tristram; O'Brien, Paul","Syntheses, X-ray structures and AACVD studies of group 11 ditelluroimidodiphosphinate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1528","1538","10.1039/B617429A","","","0.71073","MoKα","","0.0479","0.0359","","","0.0901","0.0971","","","","","","1.104","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005184","14.5139","0.0005","14.7985","0.0006","16.3057","0.0009","72.726","0.002","67.473","0.003","69.256","0.003","2972.1","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H168 Ag6 N6 P12 Te12 -","- C72 H168 Ag6 N6 P12 Te12 -","- C72 H168 Ag6 N6 P12 Te12 -","1","0.5","","Copsey, May C.; Panneerselvam, Arunkumar; Afzaal, Mohammad; Chivers, Tristram; O'Brien, Paul","Syntheses, X-ray structures and AACVD studies of group 11 ditelluroimidodiphosphinate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1528","1538","10.1039/B617429A","","","0.71073","MoKα","","0.0999","0.0457","","","0.08","0.0956","","","","","","0.996","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005185","8.656","0.0002","43.2277","0.0008","9.907","0.0002","90","","113.363","0.002","90","","3403.06","0.13","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H43 Au N P3 Te2 -","- C30 H43 Au N P3 Te2 -","- C120 H172 Au4 N4 P12 Te8 -","4","1","","Copsey, May C.; Panneerselvam, Arunkumar; Afzaal, Mohammad; Chivers, Tristram; O'Brien, Paul","Syntheses, X-ray structures and AACVD studies of group 11 ditelluroimidodiphosphinate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1528","1538","10.1039/B617429A","","","0.71073","MoKα","","0.0482","0.0387","","","0.1062","0.1116","","","","","","1.045","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005186","14.0073","0.0003","14.4237","0.0004","16.5375","0.0004","83.975","0.001","76.891","0.002","62.512","0.001","2886.75","0.13","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H84 Cu3 N3 P6 Te6 -","- C36 H84 Cu3 N3 P6 Te6 -","- C72 H168 Cu6 N6 P12 Te12 -","2","1","","Copsey, May C.; Panneerselvam, Arunkumar; Afzaal, Mohammad; Chivers, Tristram; O'Brien, Paul","Syntheses, X-ray structures and AACVD studies of group 11 ditelluroimidodiphosphinate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1528","1538","10.1039/B617429A","","","0.71073","MoKα","","0.0718","0.0511","","","0.1313","0.1445","","","","","","1.065","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005187","40.6123","0.0013","14.7952","0.0004","20.0041","0.0007","90","","98.17","0.001","90","","11897.8","0.7","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Pt4-rectangle","","","- C98 H154 N10 O14 P8 Pt4 -","- C98 H154 N10 O14 P8 Pt4 -","- C392 H616 N40 O56 P32 Pt16 -","4","0.5","","Ghosh, Sushobhan; Mukherjee, Partha Sarathi","Self-assembly of metal-organic hybrid nanoscopic rectangles.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2542","2546","10.1039/b617513a","","","0.71073","MoKα","","0.1479","0.0823","","","0.2179","0.2427","","","","","","1.106","","","","has coordinates,has disorder","179755","2020-10-21","18:00:00",""
"7005188","9.73","0.0003","13.4343","0.0005","10.8514","0.0004","90","","95.9521","0.0016","90","","1410.8","0.09","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Cl4 N12 O3 Re2 -","- C20 H20 Cl4 N12 O3 Re2 -","- C40 H40 Cl8 N24 O6 Re4 -","2","0.5","","Cowley, Andrew R.; Dilworth, Jonathan R.; Salichou, Maria","Syntheses and structures of pyrazolylmethane complexes of rhenium(III), (IV) and (V).","Dalton transactions (Cambridge, England : 2003)","2007","","16","1621","1629","10.1039/b617549j","","","0.71073","MoKα","","0.0781","0.0312","","0.0703","0.0311","0.0311","","","","","","1.1131","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005189","15.7338","0.0002","15.8808","0.0002","22.0122","0.0003","90","","106.552","0.0007","90","","5272.18","0.12","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 Cl9 N6 O4 Re2 -","- C12 H12 Cl9 N6 O4 Re2 -","- C96 H96 Cl72 N48 O32 Re16 -","8","2","","Cowley, Andrew R.; Dilworth, Jonathan R.; Salichou, Maria","Syntheses and structures of pyrazolylmethane complexes of rhenium(III), (IV) and (V).","Dalton transactions (Cambridge, England : 2003)","2007","","16","1621","1629","10.1039/b617549j","","","0.71073","MoKα","","0.064","0.0415","","0.0697","0.0489","0.0489","","","","","","1.0792","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005190","11.7127","0.0002","16.3","0.0003","18.0939","0.0003","90","","98.4918","0.0007","90","","3416.56","0.1","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H31 Cl2 N4 O7 Re -","- C36 H31 Cl2 N4 O7 Re -","- C144 H124 Cl8 N16 O28 Re4 -","4","1","","Cowley, Andrew R.; Dilworth, Jonathan R.; Salichou, Maria","Syntheses and structures of pyrazolylmethane complexes of rhenium(III), (IV) and (V).","Dalton transactions (Cambridge, England : 2003)","2007","","16","1621","1629","10.1039/b617549j","","","0.71073","MoKα","","0.0646","0.0324","","0.0513","0.0369","0.0369","","","","","","1.0853","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005191","15.2626","0.0005","10.7896","0.0004","8.54","0.0003","90","","95.1189","0.0017","90","","1400.74","0.09","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","6","C 1 2/m 1","-C 2y","12","","","","- C18 H22 Cl4 N10 O3 Re2 -","- C18 H22 Cl4 N10 O3 Re2 -","- C36 H44 Cl8 N20 O6 Re4 -","2","0.25","","Cowley, Andrew R.; Dilworth, Jonathan R.; Salichou, Maria","Syntheses and structures of pyrazolylmethane complexes of rhenium(III), (IV) and (V).","Dalton transactions (Cambridge, England : 2003)","2007","","16","1621","1629","10.1039/b617549j","","","0.71073","MoKα","","0.034","0.0261","","0.0394","0.029","0.029","","","","","","1.0971","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005192","23.632","0.002","14.6528","0.0015","18.8956","0.0019","90","","114.155","0.001","90","","5970.2","1","103","2","103","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H52 Cu4 N28 O20 -","- C44 H52 Cu4 N28 O20 -","- C176 H208 Cu16 N112 O80 -","4","0.5","","Roy, Somnath; Mandal, Tarak Nath; Barik, Anil Kumar; Pal, Sachindranath; Butcher, Ray J.; El Fallah, Mohamed Salah; Tercero, Javier; Kar, Susanta Kumar","An orthogonal ferromagnetically coupled tetracopper(II) 2 x 2 homoleptic grid supported by micro-O4 bridges and its DFT study.","Dalton transactions (Cambridge, England : 2003)","2007","","12","1229","1234","10.1039/b617587b","","","0.71073","MoKα","","0.0525","0.0456","","","0.1088","0.1133","","","","","","1.084","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005193","10.8963","0.0007","11.8685","0.0007","13.8678","0.0008","72.529","0.004","84.277","0.005","73.318","0.004","1638.51","0.18","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H48 N2 O4 -","- C32 H48 N2 O4 -","- C64 H96 N4 O8 -","2","1","","Jiménez, Claudio A; Belmar, Julio B.; Alderete, Joel; Delgado, Fernando S.; López-Rodríguez, Matías; Peña, Octavio; Julve, Miguel; Ruiz-Perez, Catalina","New anionic cobalt complexes using highly hindered bis-amides with varying donor abilities as ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2135","2144","10.1039/b617604f","","x-ray","0.71073","Mokα","","0.1451","0.0753","","","0.1972","0.2383","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005194","10.6809","0.0011","13.3817","0.0007","24.854","0.003","82.51","0.007","87.684","0.008","85.375","0.006","3509","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H48 N4 O4 -","- C36 H44 N2 O4 -","- C144 H176 N8 O16 -","4","2","","Jiménez, Claudio A; Belmar, Julio B.; Alderete, Joel; Delgado, Fernando S.; López-Rodríguez, Matías; Peña, Octavio; Julve, Miguel; Ruiz-Perez, Catalina","New anionic cobalt complexes using highly hindered bis-amides with varying donor abilities as ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2135","2144","10.1039/b617604f","","x-ray","0.71073","Mokα","","0.1403","0.0716","","","0.1376","0.163","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005195","10.0272","0.0009","10.7263","0.0007","21.2662","0.0008","77.855","0.004","76.457","0.004","64.83","0.005","1996.5","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C43 H56 N2 O5 -","- C43 H56 N2 O5 -","- C86 H112 N4 O10 -","2","1","","Jiménez, Claudio A; Belmar, Julio B.; Alderete, Joel; Delgado, Fernando S.; López-Rodríguez, Matías; Peña, Octavio; Julve, Miguel; Ruiz-Perez, Catalina","New anionic cobalt complexes using highly hindered bis-amides with varying donor abilities as ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2135","2144","10.1039/b617604f","","x-ray","0.71073","Mokα","","0.1988","0.0973","","","0.2565","0.3123","","","","","","1.039","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005196","17.724","0.003","11.2234","0.001","19.6969","0.001","90","","106.593","0.008","90","","3755","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H48 Co N2 Na O6 -","- C36 H44 Co N2 Na O6 -","- C144 H176 Co4 N8 Na4 O24 -","4","1","","Jiménez, Claudio A; Belmar, Julio B.; Alderete, Joel; Delgado, Fernando S.; López-Rodríguez, Matías; Peña, Octavio; Julve, Miguel; Ruiz-Perez, Catalina","New anionic cobalt complexes using highly hindered bis-amides with varying donor abilities as ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2135","2144","10.1039/b617604f","","x-ray","0.71073","Mokα","","0.1257","0.0639","","","0.1853","0.2176","","","","","","1.056","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005197","22.653","0.0003","18.558","0.0003","17.246","0.0003","90","","128.203","0.0006","90","","5697.32","0.16","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H42 Cl2 Cu2 N6 -","- C31 H43 Cl Cu N3 -","- C248 H344 Cl8 Cu8 N24 -","8","1","","Sessler, Jonathan L.; Melfi, Patricia J.; Tomat, Elisa; Lynch, Vincent M.","Copper(II) and oxovanadium(v) complexes of hexaphyrin(1.0.1.0.0.0).","Dalton transactions (Cambridge, England : 2003)","2007","","6","629","632","10.1039/b617620h","","","0.7107","MoKα","","0.059","0.0411","","","0.1003","0.1037","","","","","","2.056","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005198","12.696","0.0005","12.819","0.0005","13.91","0.0006","74.891","0.002","65.956","0.0019","81.427","0.0019","1993.6","0.14","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H53 N6 O3 V -","- C44 H53 N6 O3 V -","- C88 H106 N12 O6 V2 -","2","1","","Sessler, Jonathan L.; Melfi, Patricia J.; Tomat, Elisa; Lynch, Vincent M.","Copper(II) and oxovanadium(v) complexes of hexaphyrin(1.0.1.0.0.0).","Dalton transactions (Cambridge, England : 2003)","2007","","6","629","632","10.1039/b617620h","","","0.71073","MoKα","","0.1803","0.0714","","","0.104","0.1278","","","","","","1.118","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005199","9.4886","0.0007","8.7913","0.0005","11.1434","0.0009","90","","109.044","0.006","90","","878.67","0.11","133","2","133","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 Mo2 O8 S2 -","- C12 H24 Mo2 O8 S2 -","- C24 H48 Mo4 O16 S4 -","2","0.5","","Ma, Xiaoli; Schulzke, Carola; Schmidt, Hans-Georg; Noltemeyer, Mathias","Structural, electrochemical and oxygen atom transfer properties of a molybdenum selenoether complex [Mo2O4(OC3H6SeC3H6O)2] and its thioether analogue [Mo2O4(OC3H6SC3H6O)2].","Dalton transactions (Cambridge, England : 2003)","2007","","18","1773","1780","10.1039/b617652f","","","0.71073","MoKα","","0.031","0.0278","","","0.0773","0.0783","","","","","","1.29","","","","has coordinates","179755","2020-10-21","18:00:00",""
"7005200","9.5298","0.0014","8.8814","0.0014","11.2161","0.0017","90","","108.874","0.002","90","","898.3","0.2","103","2","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 Mo2 O8 Se2 -","- C12 H24 Mo2 O8 Se2 -","- C24 H48 Mo4 O16 Se4 -","2","0.5","","Ma, Xiaoli; Schulzke, Carola; Schmidt, Hans-Georg; Noltemeyer, Mathias","Structural, electrochemical and oxygen atom transfer properties of a molybdenum selenoether complex [Mo2O4(OC3H6SeC3H6O)2] and its thioether analogue [Mo2O4(OC3H6SC3H6O)2].","Dalton transactions (Cambridge, England : 2003)","2007","","18","1773","1780","10.1039/b617652f","","","0.71073","MoKα","","0.018","0.0179","","","0.0431","0.0432","","","","","","1.197","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005201","9.301","0.003","11.589","0.003","12.641","0.003","76.76","0.02","85.04","0.02","77.46","0.02","1293.7","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H34 Cl Cu N5 O6 -","- C24 H34 Cl Cu N5 O6 -","- C48 H68 Cl2 Cu2 N10 O12 -","2","1","","Li, Feng; Li, Li; Delgado, Rita; Drew, Michael G. B.; Félix, Vítor","New dioxadiaza- and trioxadiaza-macrocycles containing one dibenzofuran unit with two amino pendant arms: synthesis, protonation and complexation studies.","Dalton transactions (Cambridge, England : 2003)","2007","","13","1316","1324","10.1039/b617704b","","","0.71073","MoKα","","0.1575","0.071","","","0.1595","0.1769","","","","","","0.881","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005202","9.073","0.004","9.073","0.004","7.607","0.005","90","","90","","120","","542.3","0.5","298","2","298","2","","","","","","","","6","P 63/m m c","-P 6c 2c","194","","","","- C7 H8 Cd Cu N3 O2 -","- C6.9996 H8.0016 Cd Cu N3 O2 -","- C13.9992 H16.0032 Cd2 Cu2 N6 O4 -","2","0.0833333","","Sato, Naoki; Nishikiori, Shin-Ichi","Crystal structure and dynamic properties of a bimetallic cyano complex Cd(C4H8O2)Cu(CN)3 with an interpenetrating 3D framework containing a 1,4-dioxane bridging ligand as a rotor.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1115","1119","10.1039/b617894d","","","0.710688","MoKα","","0.0416","0.0379","","","0.1109","0.1134","","","","","","1.134","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005203","31.429","0.003","9.9882","0.0008","16.6318","0.0014","90","","103.333","0.002","90","","5080.3","0.8","150","2","150","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C46 H74 Cl2 N10 O8 -","- C46 H74 Cl2 N10 O8 -","- C184 H296 Cl8 N40 O32 -","4","1","","Derossi, Sofia; Farrell, David T.; Harding, Charles J.; McKee, Vickie; Nelson, Jane","N-methylation of macrobicycles reduces encapsulation ability.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1762","1772","10.1039/B617907J","","","0.71073","MoKα","","0.0965","0.0438","","","0.0969","0.1233","","","","","","0.987","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005204","16.1316","0.0011","18.2444","0.0013","17.4585","0.0012","90","","92.086","0.001","90","","5134.8","0.6","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H69 Cl2 Cu2 N10 O10.5 -","- C45 H69 Cl2 Cu2 N10 O10.5 -","- C180 H276 Cl8 Cu8 N40 O42 -","4","1","","Derossi, Sofia; Farrell, David T.; Harding, Charles J.; McKee, Vickie; Nelson, Jane","N-methylation of macrobicycles reduces encapsulation ability.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1762","1772","10.1039/B617907J","","","0.71073","MoKα","","0.0732","0.0491","","","0.1345","0.1494","","","","","","1.093","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005205","16.1365","0.0007","18.2403","0.0008","17.3928","0.0008","90","","92.219","0.001","90","","5115.5","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H69 Cl2 Cu2 N14 O8.5 -","- C43 H69 Cl2 Cu2 N14 O8.5 -","- C172 H276 Cl8 Cu8 N56 O34 -","4","1","","Derossi, Sofia; Farrell, David T.; Harding, Charles J.; McKee, Vickie; Nelson, Jane","N-methylation of macrobicycles reduces encapsulation ability.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1762","1772","10.1039/B617907J","","","0.71073","MoKα","","0.0513","0.039","","","0.116","0.1272","","","","","","1.068","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005206","22.37","0.003","15.246","0.002","17.26","0.003","90","","90","","90","","5886.6","1.5","150","2","150","2","","","","","","","","6","A b a 2","A 2 -2ab","41","","","","- C48 H74 Cl2 Cu2 N12 O11 -","- C48 H72 Cl2 Cu2 N12 O11 -","- C192 H288 Cl8 Cu8 N48 O44 -","4","","","Derossi, Sofia; Farrell, David T.; Harding, Charles J.; McKee, Vickie; Nelson, Jane","N-methylation of macrobicycles reduces encapsulation ability.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1762","1772","10.1039/B617907J","","","0.71073","MoKα","","0.1375","0.0944","","","0.2214","0.245","","","","","","1.14","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005207","11.9441","0.0005","13.3353","0.0006","18.3828","0.0008","106.332","0.001","104.34","0.001","102.945","0.001","2582.9","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C47 H72 Cl2 Cu2 N10 O11 -","- C43 H66 Cl2 Cu2 N8 O11 -","- C86 H132 Cl4 Cu4 N16 O22 -","2","1","","Derossi, Sofia; Farrell, David T.; Harding, Charles J.; McKee, Vickie; Nelson, Jane","N-methylation of macrobicycles reduces encapsulation ability.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1762","1772","10.1039/B617907J","","","0.71073","MoKα","","0.0423","0.0331","","","0.0855","0.0898","","","","","","1.07","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005208","10.241","0.002","10.3565","0.0019","10.819","0.002","89.755","0.004","90.118","0.006","98.288","0.005","1135.5","0.4","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H31 Cl2 Cu3 N10 O18.5 -","- C38 H22 Cl2 Cu3 N10 O18.5 -","- C38 H22 Cl2 Cu3 N10 O18.5 -","1","0.5","","Tandon, Santokh S.; Dawe, Louise N.; Milway, Victoria A.; Collins, Julie L.; Thompson, Laurence K.","Linear copper ?chain? complexes with bulky tritopic hydrazone ligands?structural and magnetic studies","Dalton Transactions","2007","","19","1948","","10.1039/B618067A","","","0.7107","MoKα","","0.0447","0.044","","","0.1218","0.1226","","","","","","1.062","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005209","13.31","0.003","16.369","0.003","18.756","0.004","90","","106.994","0.004","90","","3908","1.4","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35.5 H31.5 Cl2 Cu2 N8.5 O11.5 -","- C35.5 H24.5 Cl2 Cu2 N8.5 O11.5 -","- C142 H98 Cl8 Cu8 N34 O46 -","4","1","","Tandon, Santokh S.; Dawe, Louise N.; Milway, Victoria A.; Collins, Julie L.; Thompson, Laurence K.","Linear copper ?chain? complexes with bulky tritopic hydrazone ligands?structural and magnetic studies","Dalton Transactions","2007","","19","1948","","10.1039/B618067A","","","0.7107","MoKα","","0.0806","0.076","","","0.2046","0.2088","","","","","","1.105","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005210","8.2559","0.0015","10.671","0.002","21.686","0.004","85.018","0.005","81.688","0.005","82.852","0.005","1871.1","0.6","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H58 Cu5 N20 O30 -","- C64 H58 Cu5 N20 O30 -","- C64 H58 Cu5 N20 O30 -","1","0.5","","Tandon, Santokh S.; Dawe, Louise N.; Milway, Victoria A.; Collins, Julie L.; Thompson, Laurence K.","Linear copper ?chain? complexes with bulky tritopic hydrazone ligands?structural and magnetic studies","Dalton Transactions","2007","","19","1948","","10.1039/B618067A","","","0.7107","MoKα","","0.0509","0.0484","","","0.1206","0.1231","","","","","","1.052","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005211","13.829","0.0002","14.612","0.0002","13.806","0.0002","90","","90","","90","","2789.77","0.07","150","2","150","2","","","","","","","synthesized by the authors","4","P n m a","-P 2ac 2n","62","","","","- C7 H27 B8 N -","- C7 H27 B8 N -","- C56 H216 B64 N8 -","8","1","","Londesborough, Michael G. S.; Janousek, Zbynek; Stíbr, Bohumil; Hnyk, Drahomír; Plesek, Jaromír; Císarová, Ivana","The [2,5,12-C3B8H15]- anion, the first representative of the eleven-vertex hypho family of tricarbaboranes.","Dalton transactions (Cambridge, England : 2003)","2007","","12","1221","1228","10.1039/b618082e","","","0.71073","MoKα","","0.0477","0.0412","","","0.116","0.1206","","","","","","1.1","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005212","16.222","0.008","13.12","0.006","10.932","0.009","90","","127.88","0.06","90","","1836","2","293","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C16 H16 Cl3 N O Pt S -","- C16 H16 Cl3 N O Pt S -","- C64 H64 Cl12 N4 O4 Pt4 S4 -","4","1","","Capapé, Alejandro; Crespo, Margarita; Granell, Jaume; Font-Bardía, Mercè; Solans, Xavier","A comparative study of the structures and reactivity of cyclometallated platinum compounds of N-benzylidenebenzylamines and cycloplatination of a primary amine.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2030","2039","10.1039/b618128g","","","0.71073","MoKα","","0.0369","0.0342","","","0.0811","0.0822","","","","","","1.1","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005213","6.23","0.003","27.614","0.009","12.442","0.003","90","","96.6","0.03","90","","2126.3","1.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H23 Cl2 N O Pt S -","- C19 H23 Cl2 N O Pt S -","- C76 H92 Cl8 N4 O4 Pt4 S4 -","4","1","","Capapé, Alejandro; Crespo, Margarita; Granell, Jaume; Font-Bardía, Mercè; Solans, Xavier","A comparative study of the structures and reactivity of cyclometallated platinum compounds of N-benzylidenebenzylamines and cycloplatination of a primary amine.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2030","2039","10.1039/b618128g","","","0.71069","MoKα","","0.0614","0.0424","","","0.0715","0.1339","","","","","","0.725","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005214","10.301","0.005","22.018","0.009","10.85","0.004","90","","109.34","0.03","90","","2322","1.8","293","2","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C23 H23 Cl2 N O Pt S -","- C23 H23 Cl2 N O Pt S -","- C92 H92 Cl8 N4 O4 Pt4 S4 -","4","1","","Capapé, Alejandro; Crespo, Margarita; Granell, Jaume; Font-Bardía, Mercè; Solans, Xavier","A comparative study of the structures and reactivity of cyclometallated platinum compounds of N-benzylidenebenzylamines and cycloplatination of a primary amine.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2030","2039","10.1039/b618128g","","","0.71073","MoKα","","0.041","0.0281","","","0.0724","0.0921","","","","","","1.191","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005215","12.1214","0.0012","18.8045","0.0019","19.074","0.002","90","","93.19","0.002","90","","4340.9","0.8","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H34 Cl12 P4 Sn -","- C31 H34 Cl12 P4 Sn -","- C124 H136 Cl48 P16 Sn4 -","4","1","","Boyall, Alice J.; Dillon, Keith B.; Howard, Judith A. K.; Monks, Philippa K.; Thompson, Amber L.","Novel (n + 1 + 1) cycloaddition reactions; the formation of cyclic tetraphosphonium dications with four linked phosphorus atoms and an organic backbone.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1374","1376","10.1039/b618157k","","","0.71073","MoKα","","0.0963","0.0596","","","0.0859","0.0945","","","","","","1.103","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005216","13.4942","0.0004","14.1464","0.0005","17.867","0.0006","100.565","0.001","93.135","0.001","111.495","0.001","3091.88","0.18","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H42 Cl20 P4 Sn1.5 -","- C44 H42 Cl20 P4 Sn1.5 -","- C88 H84 Cl40 P8 Sn3 -","2","1","","Boyall, Alice J.; Dillon, Keith B.; Howard, Judith A. K.; Monks, Philippa K.; Thompson, Amber L.","Novel (n + 1 + 1) cycloaddition reactions; the formation of cyclic tetraphosphonium dications with four linked phosphorus atoms and an organic backbone.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1374","1376","10.1039/b618157k","","","0.71073","MoKα","","0.1152","0.0627","","","0.1583","0.1764","","","","","","0.916","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005217","9.3983","0.0001","10.9971","0.0001","13.7916","0.0001","100.652","0.0006","99.7287","0.0006","91.2631","0.0006","1378.62","0.02","123","","123","","","","","","","","","6","P -1","-P 1","2","","","","- C60 H78 N6 O2 P2 Pt -","- C60 H78 N6 O2 P2 Pt -","- C60 H78 N6 O2 P2 Pt -","1","0.5","","Beves, Jonathon E.; Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Shardlow, Ellen J.","[n + n]-Heterometallomacrocyclic complexes (n > or = 2) prepared from platinum(II)-centred ditopic 2,2':6',2''-terpyridine ligands: dimensional cataloguing by pulsed-field gradient spin-echo NMR spectroscopy.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1593","1602","10.1039/b618197j","","","0.71073","MoKα","","0.0206","0.0203","","0.0229","0.0228","0.0228","","","","","","1.0943","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005218","9.3237","0.0005","13.3692","0.0007","15.5613","0.0007","104.458","0.003","104.998","0.003","107.061","0.002","1676.15","0.16","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C84 H66 N6 O2 P2 Pt -","- C84 H66 N6 O2 P2 Pt -","- C84 H66 N6 O2 P2 Pt -","1","0.5","","Beves, Jonathon E.; Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Shardlow, Ellen J.","[n + n]-Heterometallomacrocyclic complexes (n > or = 2) prepared from platinum(II)-centred ditopic 2,2':6',2''-terpyridine ligands: dimensional cataloguing by pulsed-field gradient spin-echo NMR spectroscopy.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1593","1602","10.1039/b618197j","","","0.71073","MoKα","","0.0511","0.0431","","0.052","0.0475","0.0475","","","","","","1.1209","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005219","3.9572","0.0001","12.1228","0.0004","14.6442","0.0004","87.701","0.0019","83.9528","0.0019","82.9919","0.0017","693.12","0.03","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H13 N3 O -","- C18 H13 N3 O -","- C36 H26 N6 O2 -","2","1","","Beves, Jonathon E.; Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Shardlow, Ellen J.","[n + n]-Heterometallomacrocyclic complexes (n > or = 2) prepared from platinum(II)-centred ditopic 2,2':6',2''-terpyridine ligands: dimensional cataloguing by pulsed-field gradient spin-echo NMR spectroscopy.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1593","1602","10.1039/b618197j","","","0.71073","MoKα","","0.063","0.0376","","0.078","0.0437","0.0437","","","","","","1.1075","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005220","13.1917","0.0013","13.1781","0.0014","14.9388","0.0015","87.971","0.008","78.721","0.008","61.217","0.007","2226.9","0.4","170","2","170","2","","","","","","","","8","P -1","-P 1","2","","","","- C31 H56 Cs F3 N2 O10 S4 Te -","- C31 H56 Cs F3 N2 O10 S4 Te -","- C62 H112 Cs2 F6 N4 O20 S8 Te2 -","2","1","","Tyrra, Wieland; Naumann, Dieter; Buslei, Sigrid; Kremer, Silke; Pantenburg, Ingo; Scherer, Harald","Perfluoroalkyl(dithiocarbamato) tellurium(II) compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1829","1837","10.1039/b618240b","","","0.71073","MoKα","","0.0871","0.0689","","","0.1893","0.203","","","","","","1.066","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005221","15.8596","0.0014","14.8867","0.0009","19.4238","0.0017","90","","91.203","0.007","90","","4584.9","0.6","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C47 H46 F3 N3 P2 S4 Te -","- C47 H46 F3 N3 P2 S4 Te -","- C188 H184 F12 N12 P8 S16 Te4 -","4","1","","Tyrra, Wieland; Naumann, Dieter; Buslei, Sigrid; Kremer, Silke; Pantenburg, Ingo; Scherer, Harald","Perfluoroalkyl(dithiocarbamato) tellurium(II) compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1829","1837","10.1039/b618240b","","","0.71073","MoKα","","0.0824","0.0496","","","0.1166","0.1308","","","","","","0.935","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005222","15.3944","0.0008","14.7103","0.0009","20.9587","0.0011","90","","94.076","0.004","90","","4734.2","0.5","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C52 H44 Cl F3 N2 P2 S2 Te -","- C52 H44 Cl F3 N2 P2 S2 Te -","- C208 H176 Cl4 F12 N8 P8 S8 Te4 -","4","1","","Tyrra, Wieland; Naumann, Dieter; Buslei, Sigrid; Kremer, Silke; Pantenburg, Ingo; Scherer, Harald","Perfluoroalkyl(dithiocarbamato) tellurium(II) compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1829","1837","10.1039/b618240b","","","0.71073","MoKα","","0.0499","0.0383","","","0.1027","0.1107","","","","","","1.05","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005223","8.094","0.0011","11.7267","0.0013","16.101","0.002","90","","92.147","0.01","90","","1527.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 N2 S4 Te -","- C10 H16 N2 S4 Te -","- C40 H64 N8 S16 Te4 -","4","1","","Tyrra, Wieland; Naumann, Dieter; Buslei, Sigrid; Kremer, Silke; Pantenburg, Ingo; Scherer, Harald","Perfluoroalkyl(dithiocarbamato) tellurium(II) compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1829","1837","10.1039/b618240b","","","0.71073","MoKα","","0.0624","0.0333","","","0.0615","0.0676","","","","","","1.008","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005224","15.406","0.0015","15.406","0.0015","12.1612","0.0015","90","","90","","90","","2886.4","0.5","293","2","293","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C60 H56 N4 S8 Te -","- C60 H56 N4 S8 Te -","- C120 H112 N8 S16 Te2 -","2","0.25","","Tyrra, Wieland; Naumann, Dieter; Buslei, Sigrid; Kremer, Silke; Pantenburg, Ingo; Scherer, Harald","Perfluoroalkyl(dithiocarbamato) tellurium(II) compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1829","1837","10.1039/b618240b","","","0.71073","MoKα","","0.0851","0.0436","","","0.0756","0.0874","","","","","","0.95","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005225","5.3464","0.0006","11.5521","0.0013","13.1243","0.0014","71.846","0.008","81.774","0.008","81.59","0.008","757.84","0.15","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H38 N8 O2 -","- C34 H38 N8 O2 -","- C34 H38 N8 O2 -","1","0.5","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.0693","0.0421","","","0.0977","0.1116","","","","","","1.012","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005226","13.6489","0.0007","13.6489","0.0007","40.211","0.004","90","","90","","120","","6487.4","0.8","150","2","150","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C102 H114 Cl6 N24 Nd2 O30 -","- C102 H114 Cl5.98 N24 Nd2 O29.92 -","- C204 H228 Cl11.96 N48 Nd4 O59.84 -","2","0.166667","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.0793","0.0744","","","0.2238","0.2298","","","","","","1.09","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005227","13.8557","0.0004","13.8557","0.0004","40.129","0.003","90","","90","","120","","6671.8","0.6","150","2","150","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C102 H114 Cl6 La2 N24 O30 -","- C102 H114 Cl5.98 La2 N24 O29.92 -","- C204 H228 Cl11.96 La4 N48 O59.84 -","2","0.166667","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.1445","0.1191","","","0.3149","0.3344","","","","","","1.138","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005228","21.772","0.0002","22.2268","0.0003","24.6165","0.0003","69.865","0.001","83.754","0.001","70.519","0.001","10543.9","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C146 H196 Cl12 N37 Nd4 O69.5 -","- C146 H167 Cl12 N37 Nd4 O69.5 -","- C292 H334 Cl24 N74 Nd8 O139 -","2","1","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.106","0.0848","","","0.2427","0.2673","","","","","","1.077","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005229","25.4319","0.0014","16.249","0.0008","28.1488","0.0014","90","","98.599","0.003","90","","11501.5","1","150","2","150","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C70.5 H89.5 Cl6 La2 N18.5 O36 -","- C70.5 H83.5 Cl6 La2 N18.5 O36 -","- C282 H334 Cl24 La8 N74 O144 -","4","1","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.0941","0.0632","","","0.1847","0.2002","","","","","","1.057","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005230","12.822","0.005","13.698","0.005","13.94","0.006","87.044","0.015","74.85","0.02","83.25","0.02","2346.3","1.6","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H47 Cl3 La N9 O17 -","- C36 H47 Cl3 La N9 O17 -","- C72 H94 Cl6 La2 N18 O34 -","2","1","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.209","0.156","","","0.3606","0.3951","","","","","","1.376","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005231","14.5305","0.0009","14.6421","0.0009","24.2903","0.0015","91.3","0.003","105.283","0.002","103.157","0.002","4835.5","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C80 H104 Cl5 N19 O30 Yb2 -","- C80 H104 Cl5 N19 O30 Yb2 -","- C160 H208 Cl10 N38 O60 Yb4 -","2","1","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.0677","0.0431","","","0.0977","0.1108","","","","","","0.995","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005232","14.2898","0.0004","14.6413","0.0004","22.2647","0.0006","93.076","0.001","96.059","0.001","103.804","0.001","4483.4","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C71.5 H90.5 Cl5 N18.5 O34 Yb2 -","- C71.5 H90.5 Cl5 N18.5 O34 Yb2 -","- C143 H181 Cl10 N37 O68 Yb4 -","2","1","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.0454","0.0383","","","0.0983","0.103","","","","","","1.086","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005233","10.3119","0.0011","14.1937","0.0011","16.5841","0.0015","85.976","0.004","74.542","0.004","73.206","0.003","2239.7","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H42 Cl3 La N8 O16 -","- C34 H38 Cl3 La N8 O16 -","- C68 H76 Cl6 La2 N16 O32 -","2","1","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.0686","0.0649","","","0.1693","0.1719","","","","","","1.086","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005234","21.4427","0.0011","15.7294","0.0007","28.4809","0.0014","90","","104.093","0.002","90","","9316.9","0.8","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C70.5 H83.5 Cl5 N17.5 O30 Yb2 -","- C70.5 H81.5 Cl5 N17.5 O30 Yb2 -","- C282 H326 Cl20 N70 O120 Yb8 -","4","1","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.09","0.0681","","","0.1626","0.1732","","","","","","1.054","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005235","15.3123","0.0012","18.8994","0.0016","34.341","0.003","90","","97.066","0.005","90","","9862.6","1.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C74 H98 Cl5 La2 N21 O39 -","- C74 H92 Cl5 La2 N21 O39 -","- C296 H368 Cl20 La8 N84 O156 -","4","1","","Ronson, Tanya K.; Adams, Harry; Harding, Lindsay P.; Pope, Simon J. A.; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Polynuclear lanthanide complexes of a series of bridging ligands containing two tridentate N,N',O-donor units: structures and luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2007","","10","1006","1022","10.1039/b618258e","","","0.71073","MoKα","","0.1284","0.0831","","","0.1987","0.2343","","","","","","1.138","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005236","13.4319","0.001","10.9629","0.0008","20.163","0.0014","90","","90.586","0.001","90","","2968.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H48 N20 Ni4 O10 -","- C48 H40 N20 Ni4 O10 -","- C96 H80 N40 Ni8 O20 -","2","0.5","","Wu, Da-Yu; Huang, Wei; Hua, Wei-Jie; Song, You; Duan, Chun-Ying; Li, Shu-Hua; Meng, Qing-Jin","Metal complexes formed by metal-assisted solvolysis of di-pyridylketone azine: structures and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1838","1845","10.1039/b618286k","","","0.71073","MoKα","","0.0746","0.0537","","","0.1715","0.1857","","","","","","1.046","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005237","15.491","0.002","15.491","0.002","45.272","0.01","90","","90","","90","","10864","3","293","2","293","2","","","","","","","","6","I 41/a c d :2","-I 4bd 2c","142","","","","- C48 H44 Cl4 Cu6 N14 O8 -","- C48 H44 Cl4 Cu6 N14 O8 -","- C384 H352 Cl32 Cu48 N112 O64 -","8","0.25","","Wu, Da-Yu; Huang, Wei; Hua, Wei-Jie; Song, You; Duan, Chun-Ying; Li, Shu-Hua; Meng, Qing-Jin","Metal complexes formed by metal-assisted solvolysis of di-pyridylketone azine: structures and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1838","1845","10.1039/b618286k","","","0.71073","MoKα","","0.0475","0.0326","","","0.0853","0.0882","","","","","","1.02","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005238","10.544","0.003","12.379","0.003","13.988","0.003","64.968","0.004","68.102","0.004","73.782","0.004","1518.8","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H24 Cl3 Cu2 N7 O5 -","- C26 H24 Cl3 Cu2 N7 O5 -","- C52 H48 Cl6 Cu4 N14 O10 -","2","1","","Wu, Da-Yu; Huang, Wei; Hua, Wei-Jie; Song, You; Duan, Chun-Ying; Li, Shu-Hua; Meng, Qing-Jin","Metal complexes formed by metal-assisted solvolysis of di-pyridylketone azine: structures and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1838","1845","10.1039/b618286k","","","0.71073","MoKα","","0.0699","0.0544","","","0.1415","0.1491","","","","","","1.01","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005239","25.593","0.002","14.9494","0.0014","16.2415","0.0015","90","","116.503","0.002","90","","5561","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H19 Cl Cu2 N12 O5 -","- C23 H19 Cl Cu2 N12 O5 -","- C184 H152 Cl8 Cu16 N96 O40 -","8","1","","Wu, Da-Yu; Huang, Wei; Hua, Wei-Jie; Song, You; Duan, Chun-Ying; Li, Shu-Hua; Meng, Qing-Jin","Metal complexes formed by metal-assisted solvolysis of di-pyridylketone azine: structures and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1838","1845","10.1039/b618286k","","","0.71073","MoKα","","0.0738","0.0446","","","0.1007","0.1076","","","","","","1.02","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005240","12.2327","0.0004","13.1476","0.0004","20.8703","0.0006","83.244","0.002","73.803","0.001","77.343","0.001","3139.3","0.17","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C74 H55 Cl6 Ir N2 O3 -","- C74 H55 Cl6 Ir N2 O3 -","- C148 H110 Cl12 Ir2 N4 O6 -","2","1","","Velusamy, Marappan; Thomas, K. R. Justin; Chen, Chih-Hsin; Lin, Jiann T.; Wen, Yuh S.; Hsieh, Wan-Ting; Lai, Chin-Hung; Chou, Pi-Tai","Synthesis, structure and electroluminescent properties of cyclometalated iridium complexes possessing sterically hindered ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3025","3034","10.1039/b618311e","","","0.71073","MoKα","","0.0293","0.0278","","","0.0755","0.0768","","","","","","1.071","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005241","10.247","0.001","11.045","0.003","11.72","0.003","117.21","0.02","94.27","0.02","107.61","0.01","1088.4","0.5","193.2","","193.2","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H44 Cl4 O4 P2 Ru -","- C42 H44 Cl4 O4 P2 Ru -","- C42 H44 Cl4 O4 P2 Ru -","1","0.5","","Bennett, Martin A.; Byrnes, Matthew J.; Willis, Anthony C.","Bis(acetylacetonato)ruthenium(II) complexes containing alkynyldiphenylphosphines. Formation and redox behaviour of [Ru(acac)2(Ph2PC triple bond CR)2] (R=H, Me, Ph) complexes and the binuclear complex cis-[{Ru(acac)2}2(micro-Ph2PC triple bond CPPh2)}2].","Dalton transactions (Cambridge, England : 2003)","2007","","17","1677","1686","10.1039/b618365d","","","1.5418","CuKα","","0.0313","0.0282","","0.0355","0.0349","0.0349","","","1.591","","","1.628","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005242","9.79","0.0009","11.1192","0.0008","11.1518","0.0009","104.946","0.006","93.248","0.007","97.52","0.007","1157.6","0.17","193.2","","193.2","","","","","","","","","7","P -1","-P 1","2","","","","- C42 H44 Cl4 F6 O4 P3 Ru -","- C42 H44 Cl4 F6 O4 P3 Ru -","- C42 H44 Cl4 F6 O4 P3 Ru -","1","0.5","","Bennett, Martin A.; Byrnes, Matthew J.; Willis, Anthony C.","Bis(acetylacetonato)ruthenium(II) complexes containing alkynyldiphenylphosphines. Formation and redox behaviour of [Ru(acac)2(Ph2PC triple bond CR)2] (R=H, Me, Ph) complexes and the binuclear complex cis-[{Ru(acac)2}2(micro-Ph2PC triple bond CPPh2)}2].","Dalton transactions (Cambridge, England : 2003)","2007","","17","1677","1686","10.1039/b618365d","","","1.5418","CuKα","","0.0573","0.036","","0.0452","0.0414","0.0414","","","1.306","","","1.362","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005243","16.317","0.004","16.469","0.006","18.975","0.004","65.46","0.02","66.17","0.02","60.76","0.02","3915","2","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C81 H82 Cl2 O8 P4 Ru2 -","- C80.866 H78.72 Cl2 O8 P4 Ru2 -","- C161.732 H157.44 Cl4 O16 P8 Ru4 -","2","1","","Bennett, Martin A.; Byrnes, Matthew J.; Willis, Anthony C.","Bis(acetylacetonato)ruthenium(II) complexes containing alkynyldiphenylphosphines. Formation and redox behaviour of [Ru(acac)2(Ph2PC triple bond CR)2] (R=H, Me, Ph) complexes and the binuclear complex cis-[{Ru(acac)2}2(micro-Ph2PC triple bond CPPh2)}2].","Dalton transactions (Cambridge, England : 2003)","2007","","17","1677","1686","10.1039/b618365d","","","0.7107","MoKα","","0.1292","0.0417","","0.0547","0.0439","0.0439","","","1.323","","","1.538","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005244","12.096","0.004","22.508","0.004","27.778","0.003","90","","102.41","0.02","90","","7386","3","193.2","","193.2","","","","","","","","local","6","P 1 21/n 1","-P 2yn","14","","","","- C75.5 H76 Cl O8 P4 Ru2 -","- C75.5 H76 Cl O8 P4 Ru2 -","- C302 H304 Cl4 O32 P16 Ru8 -","4","1","","Bennett, Martin A.; Byrnes, Matthew J.; Willis, Anthony C.","Bis(acetylacetonato)ruthenium(II) complexes containing alkynyldiphenylphosphines. Formation and redox behaviour of [Ru(acac)2(Ph2PC triple bond CR)2] (R=H, Me, Ph) complexes and the binuclear complex cis-[{Ru(acac)2}2(micro-Ph2PC triple bond CPPh2)}2].","Dalton transactions (Cambridge, England : 2003)","2007","","17","1677","1686","10.1039/b618365d","","","1.5418","CuKα","","0.0521","0.0393","","0.0523","0.0444","0.0444","","","","","","1.1497","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005245","23.065","0.005","7.4423","0.0015","9.846","0.002","90","","90","","90","","1690.1","0.6","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C8 H6 Co3 K N6 O7 -","- C8 Co3 K N6 O7 -","- C32 Co12 K4 N24 O28 -","4","0.5","","Rodríguez-Diéguez, Antonio; Kivekäs, Raikko; Sakiyama, Hiroshi; Debdoubi, Ahderrahmane; Colacio, Enrique","A novel 3D cyano-bridged mixed-valence CoII/CoIII canted antiferromagnet constructed from defective cubanes. Synthesis, X-ray structure and magnetic properties.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2145","2149","10.1039/b618479k","","","0.71073","MoKα","","0.1113","0.0639","","","0.1693","0.1858","","","","","","1.091","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005246","8.5468","0.0008","8.5592","0.0007","19.1536","0.0018","90","","95.64","0.005","90","","1394.4","0.2","300","2","300","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Bis[2,6-di(pyrazol-1-yl)pyridine]iron(II) ditetrafluoroborate","","- C22 H18 B2 F8 Fe N10 -","- C22 H18 B2 F8 Fe N10 -","- C44 H36 B4 F16 Fe2 N20 -","2","1","","Carbonera, Chiara; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Anion doping as a probe of cooperativity in the molecular spin-crossover compound [FeL2][BF4]2 (L = 2,6-di{pyrazol-1-yl}pyridine).","Dalton transactions (Cambridge, England : 2003)","2007","","13","1284","1292","10.1039/b618480d","","","0.71073","MoKα","","0.0386","0.0335","","","0.09","0.0954","","","","","","1.033","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005247","8.4966","0.0007","8.5537","0.0006","18.43","0.0015","90","","98.353","0.004","90","","1325.23","0.18","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Bis[2,6-di(pyrazol-1-yl)pyridine]iron(II) ditetrafluoroborate","","- C22 H18 B2 F8 Fe N10 -","- C22 H18 B2 F8 Fe N10 -","- C44 H36 B4 F16 Fe2 N20 -","2","1","","Carbonera, Chiara; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Anion doping as a probe of cooperativity in the molecular spin-crossover compound [FeL2][BF4]2 (L = 2,6-di{pyrazol-1-yl}pyridine).","Dalton transactions (Cambridge, England : 2003)","2007","","13","1284","1292","10.1039/b618480d","","","0.71073","MoKα","","0.0301","0.0298","","","0.0748","0.0753","","","","","","1.155","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005248","8.5441","0.0006","8.5611","0.0006","19.2084","0.0013","90","","95.582","0.004","90","","1398.37","0.17","300","2","300","2","","","","","","","","8","P 1 21 1","P 2yb","4","","Bis[2,6-di(pyrazol-1-yl)pyridine]iron(II) 1.56:0.44 tetrafluoroborate: perchlorate salt","","- C22 H18 B1.56 Cl0.44 F6.24 Fe N10 O1.76 -","- C22 H18 B2 F8 Fe N10 -","- C44 H36 B4 F16 Fe2 N20 -","2","1","","Carbonera, Chiara; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Anion doping as a probe of cooperativity in the molecular spin-crossover compound [FeL2][BF4]2 (L = 2,6-di{pyrazol-1-yl}pyridine).","Dalton transactions (Cambridge, England : 2003)","2007","","13","1284","1292","10.1039/b618480d","","","0.71073","MoKα","","0.0832","0.0456","","","0.1159","0.1366","","","","","","1.021","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005249","8.5049","0.0003","8.5662","0.0004","18.4963","0.0007","90","","98.411","0.002","90","","1333.05","0.09","150","2","150","2","","","","","","","","8","P 1 21 1","P 2yb","4","","Bis[2,6-di(pyrazol-1-yl)pyridine]iron(II) 1.56:0.44 tetrafluoroborate: perchlorate salt","","- C22 H18 B1.56 Cl0.44 F6.24 Fe N10 O1.76 -","- C22 H18 B1.56 Cl0.44 F6.24 Fe N10 O1.76 -","- C44 H36 B3.12 Cl0.88 F12.48 Fe2 N20 O3.52 -","2","1","","Carbonera, Chiara; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Anion doping as a probe of cooperativity in the molecular spin-crossover compound [FeL2][BF4]2 (L = 2,6-di{pyrazol-1-yl}pyridine).","Dalton transactions (Cambridge, England : 2003)","2007","","13","1284","1292","10.1039/b618480d","","","0.71073","MoKα","","0.0611","0.0497","","","0.1004","0.1034","","","","","","1.077","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005250","8.5693","0.0003","8.5868","0.0003","19.3352","0.0007","90","","95.597","0.002","90","","1415.96","0.09","300","2","300","2","","","","","","","","8","P 1 21 1","P 2yb","4","","Bis[2,6-di(pyrazol-1-yl)pyridine]iron(II) 0.87:1.13 tetrafluoroborate: perchlorate salt","","- C22 H18 B0.87 Cl1.13 F3.48 Fe N10 O4.52 -","- C22 H18 B0.87 Cl1.13 F8 Fe N10 -","- C44 H36 B1.74 Cl2.26 F16 Fe2 N20 -","2","1","","Carbonera, Chiara; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Anion doping as a probe of cooperativity in the molecular spin-crossover compound [FeL2][BF4]2 (L = 2,6-di{pyrazol-1-yl}pyridine).","Dalton transactions (Cambridge, England : 2003)","2007","","13","1284","1292","10.1039/b618480d","","","0.71073","MoKα","","0.0848","0.0501","","","0.1343","0.1551","","","","","","1.02","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005251","8.5348","0.0003","8.5892","0.0003","18.6089","0.0006","90","","98.567","0.002","90","","1348.94","0.08","150","2","150","2","","","","","","","","8","P 1 21 1","P 2yb","4","","Bis[2,6-di(pyrazol-1-yl)pyridine]iron(II) 0.87:1.13 tetrafluoroborate: perchlorate salt","","- C22 H18 B0.87 Cl1.13 F3.48 Fe N10 O4.52 -","- C22 H18 B0.87 Cl1.13 F3.48 Fe N10 O4.52 -","- C44 H36 B1.74 Cl2.26 F6.96 Fe2 N20 O9.04 -","2","1","","Carbonera, Chiara; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Anion doping as a probe of cooperativity in the molecular spin-crossover compound [FeL2][BF4]2 (L = 2,6-di{pyrazol-1-yl}pyridine).","Dalton transactions (Cambridge, England : 2003)","2007","","13","1284","1292","10.1039/b618480d","","","0.71073","MoKα","","0.0452","0.0398","","","0.0989","0.1016","","","","","","1.074","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005252","14.4602","0.0017","9.3419","0.0011","20.202","0.002","90","","99.32","0.006","90","","2693","0.5","150","2","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","Bis[2,6-di(pyrazol-1-yl)pyridine]iron(II) 0.32:1.68 tetrafluoroborate: perchlorate salt","","- C22 H18 B0.32 Cl1.68 F1.28 Fe N10 O6.72 -","- C22 H18 B0.32 Cl1.68 F1.28 Fe N10 O6.72 -","- C88 H72 B1.28 Cl6.72 F5.12 Fe4 N40 O26.88 -","4","0.5","","Carbonera, Chiara; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Anion doping as a probe of cooperativity in the molecular spin-crossover compound [FeL2][BF4]2 (L = 2,6-di{pyrazol-1-yl}pyridine).","Dalton transactions (Cambridge, England : 2003)","2007","","13","1284","1292","10.1039/b618480d","","","0.71073","MoKα","","0.0358","0.0318","","","0.0752","0.0776","","","","","","1.037","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005253","10.251","0.002","12.816","0.003","15.326","0.003","65.67","0.03","85.14","0.03","82.35","0.03","1817.3","0.8","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H33 O10 P5 W2 -","- C29 H33 O10 P5 W2 -","- C58 H66 O20 P10 W4 -","2","1","","Jones, Cameron; Schulten, Christian; Stasch, Andreas","Differing reactivities of P?CMe and P?CBut towards a triphosphabenzene and a tetraphosphabarrelene: synthesis of new phosphaalkyne pentamers (P5C5MenBut5?n, n = 0, 1 or 2)","Dalton Transactions","2007","","19","1929","","10.1039/b618515k","","","0.71073","MoKα","","0.061","0.0457","","","0.1034","0.1113","","","","","","1.046","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005254","12.395","0.003","17.632","0.004","18.169","0.004","90","","107.19","0.03","90","","3793.4","1.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H39 O9 P5 W2 -","- C31 H39 O9 P5 W2 -","- C124 H156 O36 P20 W8 -","4","1","","Jones, Cameron; Schulten, Christian; Stasch, Andreas","Differing reactivities of P?CMe and P?CBut towards a triphosphabenzene and a tetraphosphabarrelene: synthesis of new phosphaalkyne pentamers (P5C5MenBut5?n, n = 0, 1 or 2)","Dalton Transactions","2007","","19","1929","","10.1039/b618515k","","","0.71073","MoKα","","0.0567","0.0382","","","0.0802","0.0872","","","","","","1.034","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005255","17.121","0.002","17.121","0.002","19.397","0.004","90","","90","","90","","5685.8","1.5","150","2","150","2","","","","","","","","3","P 41","P 4w","76","","","","- C25 H45 P5 -","- C25 H45 P5 -","- C200 H360 P40 -","8","2","","Jones, Cameron; Schulten, Christian; Stasch, Andreas","Differing reactivities of P?CMe and P?CBut towards a triphosphabenzene and a tetraphosphabarrelene: synthesis of new phosphaalkyne pentamers (P5C5MenBut5?n, n = 0, 1 or 2)","Dalton Transactions","2007","","19","1929","","10.1039/b618515k","","","0.71073","MoKα","","0.0585","0.0486","","","0.1062","0.1115","","","","","","1.014","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005256","16.36","0.005","17.733","0.005","9.758","0.005","90","","125.619","0.005","90","","2301.3","1.5","293","2","293","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","Copper-alkoxide-phosphinate","","","- C39 H56 Cl2 Cu2 N8 O8 P2 -","- C39 H48 Cl2 Cu2 N8 O8 P2 -","- C78 H96 Cl4 Cu4 N16 O16 P4 -","2","0.25","","Ramaswamy Murugavel; Ramasamy Pothiraja; Nayanmoni Gogoi; Rodolphe Clérac; Lollita Lecren; Ray J. Butcher; Munirathinam Nethaji","Synthesis, magnetic behaviour, and X-ray structures of dinuclear copper complexes with multiple bridges. Efficient and selective catalysts for polymerization of 2,6-dimethylphenol","Dalton Transactions","2007","","23","2405","","10.1039/b618559b","","","0.71073","MoKα","","0.0649","0.0508","","","0.1466","0.1539","","","","","","1.075","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005257","13.206","0.002","13.439","0.002","13.497","0.002","71.321","0.003","61.987","0.002","69.552","0.003","1945.9","0.5","103","2","103","2","","","","","","","","6","P -1","-P 1","2","Copper-alkoxide-phosphinate","","","- C74 H80 Cu2 N8 O10 P4 -","- C74 H80 Cu2 N8 O10 P4 -","- C74 H80 Cu2 N8 O10 P4 -","1","0.5","","Ramaswamy Murugavel; Ramasamy Pothiraja; Nayanmoni Gogoi; Rodolphe Clérac; Lollita Lecren; Ray J. Butcher; Munirathinam Nethaji","Synthesis, magnetic behaviour, and X-ray structures of dinuclear copper complexes with multiple bridges. Efficient and selective catalysts for polymerization of 2,6-dimethylphenol","Dalton Transactions","2007","","23","2405","","10.1039/b618559b","","","0.71073","MoKα","","0.0605","0.0476","","","0.1249","0.1306","","","","","","1.005","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005258","12.083","0.001","14.324","0.002","20.217","0.003","90","","105.02","0.05","90","","3379.6","1.1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H104 N8 O8 Pd4 -","- C60 H104 N8 O8 Pd4 -","- C120 H208 N16 O16 Pd8 -","2","0.5","","Siri, Olivier; Braunstein, Pierre; Taquet, Jean-philippe; Collin, Jean-Paul; Welter, Richard","Tetranuclear palladium complexes with benzoquinonediimine ligands: synthesis, molecular structure and electrochemistry.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1481","1483","10.1039/b618567c","","","0.71069","MoKα","","0.1854","0.1154","","","0.1412","0.1578","","","","","","1.214","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005259","9.683","0.0003","10.465","0.0003","11.21","0.0004","62.56","0.0015","88.279","0.0018","77.124","0.002","979.32","0.06","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H58 N4 O5 Pd2 -","- C36 H58 N4 O5 Pd2 -","- C36 H58 N4 O5 Pd2 -","1","0.5","","Siri, Olivier; Braunstein, Pierre; Taquet, Jean-philippe; Collin, Jean-Paul; Welter, Richard","Tetranuclear palladium complexes with benzoquinonediimine ligands: synthesis, molecular structure and electrochemistry.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1481","1483","10.1039/b618567c","","","0.71073","MoKα","","0.043","0.0341","","","0.0774","0.0829","","","","","","1.019","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005260","8.621","0.0012","25.904","0.004","11.7424","0.0017","90","","97.255","0.002","90","","2601.3","0.7","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H18 F12 N4 P2 Pt -","- C22 H18 F12 N4 P2 Pt -","- C88 H72 F48 N16 P8 Pt4 -","4","1","","Ching, H. Y. Vincent; Clegg, Jack K.; Rendina, Louis M.","Synthesis and preliminary DNA-binding studies of diimineplatinum(II) complexes containing 3- or 4-pyridineboronic acid.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2121","2126","10.1039/b618668h","","","0.71073","MoKα","","0.1037","0.0848","","","0.1506","0.1553","","","","","","1.385","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005261","9.132","0.005","19.071","0.005","9.973","0.005","90","","104.076","0.005","90","","1684.7","1.3","100","1","100","1","","","","","","","","7","P 1 21 1","P 2yb","4","(3,5,6-tri-O-(2-picolyl)-1,2-isopropylidene-alpha-D- glucofuranose) CoII (PF6)2","[3,5,6-tri-O-(2-picolyl)-1,2-isopropylidene-α-D-glucofuranose] CoII (PF6)2","","- C27 H33 Co F12 N3 O7 P2 -","- C27 H31 Co F12 N3 O7 P2 -","- C54 H62 Co2 F24 N6 O14 P4 -","2","1","","Cisnetti, Federico; Guillot, Régis; Desmadril, Michel; Pelosi, Giorgio; Policar, Clotilde","Glycoligands and Co(II) glycocomplexes. Investigation of the variation of the sugar-scaffold on the structure and chirality measured by circular dichroism.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1473","1476","10.1039/b618714e","","","0.71069","MoKα","","0.0441","0.0349","","","0.0812","0.0844","","","","","","1.035","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005262","10.004","0.005","15.277","0.005","18.573","0.005","90","","90","","90","","2838.5","1.9","100","1","100","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","(2,3,5-tri-O-(2-picolyl)-alpha-D-methyl-lyxofuranoside Co(ii)) 2(ClO4)","[2,3,5-tri-O-(2-picolyl)-α-D-methyl-lyxofuranoside Co(II)] 2(ClO4)","","- C24 H27 Cl2 Co N3 O13 -","- C24 H27 Cl2 Co N3 O13 -","- C96 H108 Cl8 Co4 N12 O52 -","4","1","","Cisnetti, Federico; Guillot, Régis; Desmadril, Michel; Pelosi, Giorgio; Policar, Clotilde","Glycoligands and Co(II) glycocomplexes. Investigation of the variation of the sugar-scaffold on the structure and chirality measured by circular dichroism.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1473","1476","10.1039/b618714e","","x-ray","0.71069","MoKα","","0.0363","0.0335","","","0.0841","0.0853","","","","","","1.044","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005263","9.1512","0.0007","19.1282","0.0015","10.0022","0.0008","90","","104.159","0.001","90","","1697.7","0.2","100","1","100","1","","","","","","","","7","P 1 21 1","P 2yb","4","(3,5,6-tri-O-(2-picolyl)-1,2-isopropylidene-alpha-L- glucofuranose Co(ii)) (PF6)2","[3,5,6-tri-O-(2-picolyl)-1,2-isopropylidene-α-L-glucofuranose Co(II)] (PF6)2","","- C27 H33 Co F12 N3 O7 P2 -","- C27 H31 Co F12 N3 O7 P2 -","- C54 H62 Co2 F24 N6 O14 P4 -","2","1","","Cisnetti, Federico; Guillot, Régis; Desmadril, Michel; Pelosi, Giorgio; Policar, Clotilde","Glycoligands and Co(II) glycocomplexes. Investigation of the variation of the sugar-scaffold on the structure and chirality measured by circular dichroism.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1473","1476","10.1039/b618714e","","x-ray","0.71073","MoKα","","0.0652","0.0491","","","0.1152","0.1213","","","","","","1.056","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005264","8.6422","0.0005","17.6321","0.0011","17.8479","0.001","90","","90","","90","","2719.7","0.3","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C24 H31 Cl F6 Ir N2 Sb -","- C24 H31 Cl F6 Ir N2 Sb -","- C96 H124 Cl4 F24 Ir4 N8 Sb4 -","4","1","","Daniel Carmona; M. Pilar Lamata; Fernando Viguri; Ricardo Rodríguez; Fernando J. Lahoz; Isabel T. Dobrinovitch; Luis A. Oro","Pentamethylcyclopentadienyl-iridium(iii) complexes with pyridylamino ligands: synthesis and applications as asymmetric catalysts for Diels?Alder reactions","Dalton Transactions","2007","","19","1911","","10.1039/b618720j","","","0.71073","MoKα","","0.036","0.0304","","","0.0543","0.0557","","","","","","0.97","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005265","9.6957","0.0006","14.0751","0.0009","24.621","0.0016","90","","90","","90","","3360","0.4","173","2","173","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C29 H45 Cl F6 Ir N2 O Sb -","- C29 H42 Cl F6 Ir N2 O Sb -","- C116 H168 Cl4 F24 Ir4 N8 O4 Sb4 -","4","1","","Daniel Carmona; M. Pilar Lamata; Fernando Viguri; Ricardo Rodríguez; Fernando J. Lahoz; Isabel T. Dobrinovitch; Luis A. Oro","Pentamethylcyclopentadienyl-iridium(iii) complexes with pyridylamino ligands: synthesis and applications as asymmetric catalysts for Diels?Alder reactions","Dalton Transactions","2007","","19","1911","","10.1039/b618720j","","","0.71073","MoKα","","0.0568","0.0431","","","0.0567","0.0593","","","","","","0.913","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005266","9.6645","0.0008","9.7425","0.0008","10.1365","0.0008","65.4","0.001","68.462","0.001","72.742","0.001","795.43","0.11","173","2","173","2","","","","","","","","7","P 1","P 1","1","","","","- C24 H35 F12 Ir N2 O2 Sb2 -","- C24 H35 F12 Ir N2 O2 Sb2 -","- C24 H35 F12 Ir N2 O2 Sb2 -","1","1","","Daniel Carmona; M. Pilar Lamata; Fernando Viguri; Ricardo Rodríguez; Fernando J. Lahoz; Isabel T. Dobrinovitch; Luis A. Oro","Pentamethylcyclopentadienyl-iridium(iii) complexes with pyridylamino ligands: synthesis and applications as asymmetric catalysts for Diels?Alder reactions","Dalton Transactions","2007","","19","1911","","10.1039/b618720j","","","0.71073","MoKα","","0.0351","0.0338","","","0.0768","0.0776","","","","","","1.032","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005267","27.6069","0.0003","17.8695","0.0002","32.0957","0.0004","90","","90","","90","","15833.5","0.3","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Tetrakis(3(5)-(pyrid-2-yl)pyrazolido)dicopper(ii) dichloroform hemihydrate solvate","Tetrakis[3{5}-(pyrid-2-yl)pyrazolido]dicopper(II) dichloroform hemihydrate solvate","","- C34 H27 Cl6 Cu2 N12 O0.5 -","- C34 H27 Cl6 Cu2 N12 O0.5 -","- C544 H432 Cl96 Cu32 N192 O8 -","16","2","","Mokuolu, Q. Folshade; Foguet-Albiol, Dolos; Jones, Leigh F.; Wolowska, Joanna; Kowalczyk, Radoslaw M.; Kilner, Colin A.; Christou, George; McGowan, Patrick C.; Halcrow, Malcolm A.","Four copper(II) pyrazolido complexes derived from reactions of 3{5}-substituted pyrazoles with CuF(2) or Cu(OH)(2).","Dalton transactions (Cambridge, England : 2003)","2007","","14","1392","1399","10.1039/b618780c","","","0.71073","MoKα","","0.1032","0.0568","","","0.1399","0.1639","","","","","","1.039","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005268","18.978","0.004","17.233","0.003","22.798","0.005","90","","114.117","0.008","90","","6805","2","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Octakis(3(5)-phenylpyrazolido)tetracopper(ii) hemi-pentane solvate","Octakis[3{5}-phenylpyrazolido]tetracopper(II) hemi-pentane solvate","","- C74.5 H62 Cu4 N16 -","- C74.32 H61.86 Cu4 N15.96 -","- C297.28 H247.44 Cu16 N63.84 -","4","1","","Mokuolu, Q. Folshade; Foguet-Albiol, Dolos; Jones, Leigh F.; Wolowska, Joanna; Kowalczyk, Radoslaw M.; Kilner, Colin A.; Christou, George; McGowan, Patrick C.; Halcrow, Malcolm A.","Four copper(II) pyrazolido complexes derived from reactions of 3{5}-substituted pyrazoles with CuF(2) or Cu(OH)(2).","Dalton transactions (Cambridge, England : 2003)","2007","","14","1392","1399","10.1039/b618780c","","","0.71073","MoKα","","0.0819","0.0425","","","0.1017","0.1185","","","","","","1.008","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005269","17.0552","0.0001","20.9288","0.0001","25.8492","0.0002","90.5532","0.0002","103.568","0.0003","106.779","0.0004","8557.63","0.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","Pentakis(3(5)-(4-fluorophenyl)pyrazolido)tetrakis(5-(4- fluorophenyl)pyrazole) trifluorotetracopper(ii) dichloromethane (1/0.75) 3(5)-(4-fluorophenyl)pyrazole (1/0.25) solvate","Pentakis[3{5}-(4-fluorophenyl)pyrazolido]tetrakis[5-(4-fluorophenyl)pyrazole] trifluorotetracopper(II) dichloromethane (1/0.75) 3{5}-(4-fluorophenyl)pyrazole (1/0.25) solvate","","- C84 H61.25 Cl1.5 Cu4 F12.25 N18.5 -","- C84 H61.25 Cl1.5 Cu4 F12.25 N18.5 -","- C336 H245 Cl6 Cu16 F49 N74 -","4","2","","Mokuolu, Q. Folshade; Foguet-Albiol, Dolos; Jones, Leigh F.; Wolowska, Joanna; Kowalczyk, Radoslaw M.; Kilner, Colin A.; Christou, George; McGowan, Patrick C.; Halcrow, Malcolm A.","Four copper(II) pyrazolido complexes derived from reactions of 3{5}-substituted pyrazoles with CuF(2) or Cu(OH)(2).","Dalton transactions (Cambridge, England : 2003)","2007","","14","1392","1399","10.1039/b618780c","","","0.71073","MoKα","","0.0937","0.0626","","","0.1748","0.1994","","","","","","1.058","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005270","36.1535","0.0006","7.6937","0.0001","10.9951","0.0002","90","","90","","90","","3058.33","0.09","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","Bis(5-(4-fluorophenyl)pyrazolido)-bis(5-(4- fluorophenyl)pyrazole)copper(ii)","Bis[5-{4-fluorophenyl}pyrazolido]-bis[5-{4-fluorophenyl}pyrazole]copper(II)","","- C36 H26 Cu F4 N8 -","- C36 H26 Cu F4 N8 -","- C144 H104 Cu4 F16 N32 -","4","1","","Mokuolu, Q. Folshade; Foguet-Albiol, Dolos; Jones, Leigh F.; Wolowska, Joanna; Kowalczyk, Radoslaw M.; Kilner, Colin A.; Christou, George; McGowan, Patrick C.; Halcrow, Malcolm A.","Four copper(II) pyrazolido complexes derived from reactions of 3{5}-substituted pyrazoles with CuF(2) or Cu(OH)(2).","Dalton transactions (Cambridge, England : 2003)","2007","","14","1392","1399","10.1039/b618780c","","","0.71073","MoKα","","0.0757","0.0589","","","0.1481","0.1616","","","","","","1.042","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005271","11.7637","0.0007","8.6051","0.0005","13.7051","0.0008","90","","112.08","0.001","90","","1285.59","0.13","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H17 Cl Ge W -","- C12 H17 Cl Ge W -","- C48 H68 Cl4 Ge4 W4 -","4","1","","Khalimon, Andrey Yu.; Dorogov, Konstantin Yu.; Churakov, Andrei V.; Kuzmina, Lyudmila G.; Lemenovskii, Dmitry A.; Howard, Judith A. K.; Nikonov, Georgii I.","Synthesis and structural studies of germyl and germyl/stannyl substituted tungstenocenes","Dalton Transactions","2007","","23","2440","","10.1039/b618806k","","","0.71073","MoKα","","0.0305","0.0277","","","0.0695","0.0707","","","","","","1.1","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005272","13.7812","0.0003","8.9668","0.0002","29.2034","0.0006","90","","100.515","0.001","90","","3548.16","0.13","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H22 Cl2 Ge Sn W -","- C14 H22 Cl2 Ge Sn W -","- C112 H176 Cl16 Ge8 Sn8 W8 -","8","2","","Khalimon, Andrey Yu.; Dorogov, Konstantin Yu.; Churakov, Andrei V.; Kuzmina, Lyudmila G.; Lemenovskii, Dmitry A.; Howard, Judith A. K.; Nikonov, Georgii I.","Synthesis and structural studies of germyl and germyl/stannyl substituted tungstenocenes","Dalton Transactions","2007","","23","2440","","10.1039/b618806k","","","0.71073","MoKα","","0.0322","0.0265","","","0.0578","0.0595","","","","","","1.055","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005273","15.5322","0.0003","8.7717","0.0002","14.2873","0.0002","90","","90.741","0.001","90","","1946.39","0.06","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H26 Br1.71 Cl0.29 Ge Sn W -","- C16 H26 Br1.71 Cl0.29 Ge Sn W -","- C64 H104 Br6.84 Cl1.16 Ge4 Sn4 W4 -","4","1","","Khalimon, Andrey Yu.; Dorogov, Konstantin Yu.; Churakov, Andrei V.; Kuzmina, Lyudmila G.; Lemenovskii, Dmitry A.; Howard, Judith A. K.; Nikonov, Georgii I.","Synthesis and structural studies of germyl and germyl/stannyl substituted tungstenocenes","Dalton Transactions","2007","","23","2440","","10.1039/b618806k","","","0.71073","MoKα","","0.0401","0.0375","","","0.1155","0.1171","","","","","","1.093","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005274","10.5494","0.0003","13.8654","0.0004","13.0943","0.0004","90","","97.093","0.001","90","","1900.67","0.1","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H27 Br Ge Sn W -","- C16 H27 Br Ge Sn W -","- C64 H108 Br4 Ge4 Sn4 W4 -","4","1","","Khalimon, Andrey Yu.; Dorogov, Konstantin Yu.; Churakov, Andrei V.; Kuzmina, Lyudmila G.; Lemenovskii, Dmitry A.; Howard, Judith A. K.; Nikonov, Georgii I.","Synthesis and structural studies of germyl and germyl/stannyl substituted tungstenocenes","Dalton Transactions","2007","","23","2440","","10.1039/b618806k","","","0.71073","MoKα","","0.0512","0.035","","","0.0749","0.079","","","","","","1.022","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005275","7.2615","0.0001","12.0539","0.0002","19.1113","0.0003","90","","90","","90","","1672.8","0.04","150","2","150","2","","","","","","","","7","P 21 n m","P -2 2ac","31","","","","- C24 H30 B2 F8 Mo2 N8 O2 -","- C24 H30 B2 F8 Mo2 N8 O2 -","- C48 H60 B4 F16 Mo4 N16 O4 -","2","0.5","","Brown, Douglas J.; Chisholm, Malcolm H.; Gribble, Christopher W.","Substitution chemistry of MM quadruply bonded complexes (M = Mo or W) supported by the anion of 2-hydroxy-6-methylpyridine.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1793","1801","10.1039/b618957a","","","0.71073","MoKα","","0.0324","0.0282","","","0.0671","0.0687","","","","","","1.034","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005276","6.252","0.0008","9.6115","0.0012","12.8642","0.0016","90","","103.816","0.002","90","","750.66","0.16","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","catena-(mu4-5-(pyrimidil)tetrazolate)-aquo-sodium(i)","catena-(mu4-5-(pyrimidil)tetrazolate)-aquo-sodium(i)","","- C5 H5 N6 Na O -","- C5 H5 N6 Na O -","- C20 H20 N24 Na4 O4 -","4","1","","Rodríguez-Diéguez, A; Salinas-Castillo, A; Galli, S.; Masciocchi, N.; M Gutiérrez-Zorrilla, J; Vitoria, P.; Colacio, E.","Synthesis, X-ray structures and luminescence properties of three multidimensional metal-organic frameworks incorporating the versatile 5-(pyrimidyl)tetrazolato bridging ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1821","1828","10.1039/b618981d","","","0.71073","MoKα","","0.0585","0.0546","","","0.1328","0.1345","","","","","","1.242","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005277","9.0559","0.0003","9.0559","0.0003","15.78","0.0013","90","","90","","90","","1294.11","0.12","100","2","100","2","","","","","","","","4","P 42/n n m :2","-P 4ac 2bc","134","catena-bis(mu4-5-(pyrimidil)tetrazolate)-cadmium(ii)","catena-bis(mu4-5-(pyrimidil)tetrazolate)-cadmium(ii)","","- C10 H6 Cd N12 -","- C10 H6 Cd N12 -","- C40 H24 Cd4 N48 -","4","0.25","","Rodríguez-Diéguez, A; Salinas-Castillo, A; Galli, S.; Masciocchi, N.; M Gutiérrez-Zorrilla, J; Vitoria, P.; Colacio, E.","Synthesis, X-ray structures and luminescence properties of three multidimensional metal-organic frameworks incorporating the versatile 5-(pyrimidyl)tetrazolato bridging ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1821","1828","10.1039/b618981d","","","0.71073","MoKα","","0.0225","0.0202","","","0.0561","0.0585","","","","","","1.169","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005278","16.10858","0.0008","6.60053","0.00031","17.24252","0.00089","90","","95.1767","0.0044","90","","1825.84","0.16","298","","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","catena-(mu-chloro)-(mu-N,N'-azide)-bis(mu4-5- (pyrimidil)tetrazolate-aquo)‒cadmium(ii)","catena-(mu-chloro)-(mu-N,N'-azide)-bis(mu4-5-(pyrimidil)tetrazolate-aquo)- -cadmium(ii)","","- C5 H5 Cd Cl0.5 N7.5 O -","- C5 H3 Cd Cl0.5 N7.5 O -","- C40 H24 Cd8 Cl4 N60 O8 -","8","1","","Rodríguez-Diéguez, A; Salinas-Castillo, A; Galli, S.; Masciocchi, N.; M Gutiérrez-Zorrilla, J; Vitoria, P.; Colacio, E.","Synthesis, X-ray structures and luminescence properties of three multidimensional metal-organic frameworks incorporating the versatile 5-(pyrimidyl)tetrazolato bridging ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1821","1828","10.1039/b618981d","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","","1.706","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005279","8.8321","0.0014","11.5748","0.0018","42.316","0.007","90","","90","","90","","4326","1.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","2,2-bis(benzanthracenol imine)binaphthyl, dichloromethane","2,2-bis(benzanthracenol imine)binaphthyl, dichloromethane","","- C59 H38 Cl2 N2 O2 -","- C59 H38 Cl2 N2 O2 -","- C236 H152 Cl8 N8 O8 -","4","1","","Wiznycia, Alexander V.; Desper, John; Levy, Christopher J.","Iron(II) and zinc(II) monohelical binaphthyl-salen complexes with overlapping benz[a]anthryl sidearms.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1520","1527","10.1039/B700001D","","","0.71073","MoKα","","0.0957","0.0928","","","0.1882","0.1896","","","","","","1.353","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005280","12.5693","0.0017","32.926","0.004","12.6967","0.0017","90","","119.512","0.002","90","","4572.8","1","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","(2,2-bis(benzanthracenol imine)binaphthyl Zn(ii))2 (CH2CL2)2 (Et2O)","[2,2-bis(benzanthracenol imine)binaphthyl Zn(II)]2 (CH2CL2)2 (Et2O)","","- C122 H82 Cl4 N4 O5 Zn2 -","- C122 H82 Cl4 N4 O5 Zn2 -","- C244 H164 Cl8 N8 O10 Zn4 -","2","1","","Wiznycia, Alexander V.; Desper, John; Levy, Christopher J.","Iron(II) and zinc(II) monohelical binaphthyl-salen complexes with overlapping benz[a]anthryl sidearms.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1520","1527","10.1039/B700001D","","","0.71073","MoKα","","0.0572","0.0547","","","0.1475","0.1504","","","","","","1.335","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005281","12.6954","0.0003","12.6954","0.0003","24.3493","0.001","90","","90","","120","","3398.68","0.18","100","2","100","2","","","","","","","","5","P 32","P 32","145","(2,2-bis(benzanthracenol imine)binaphthyl Fe(ii)) (Et2O)","[2,2-bis(benzanthracenol imine)binaphthyl Fe(II)] (Et2O)","","- C62 H44 Fe N2 O3 -","- C62 H44 Fe N2 O3 -","- C186 H132 Fe3 N6 O9 -","3","1","","Wiznycia, Alexander V.; Desper, John; Levy, Christopher J.","Iron(II) and zinc(II) monohelical binaphthyl-salen complexes with overlapping benz[a]anthryl sidearms.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1520","1527","10.1039/B700001D","","","0.71073","MoKα","","0.0622","0.0524","","","0.1178","0.1231","","","","","","1.017","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005282","10.62","0.0011","14.2098","0.0005","19.5531","0.0014","90","","94.577","0.008","90","","2941.3","0.4","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H32 Cl2 I N P2 Pt -","- C28 H32 Cl2 I N P2 Pt -","- C112 H128 Cl8 I4 N4 P8 Pt4 -","4","1","","Hoseini, S. Jafar; Mohamadikish, Maryam; Kamali, Katayon; Heinemann, Frank W.; Rashidi, Mehdi","Organoplatinum complexes containing bis(diphenylphosphino)amine as ligand: uncommon case of N-H . . . I-Pt hydrogen bonding.","Dalton transactions (Cambridge, England : 2003)","2007","","17","1697","1704","10.1039/b700009j","","","0.71073","MoKα","","0.0378","0.0277","","","0.067","0.0702","","","","","","1.314","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005283","7.2175","0.0007","21.8066","0.0018","11.5739","0.0013","90","","101.632","0.005","90","","1784.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C33 H20 Co5 N2 O18 -","- C33 H20 Co5 N2 O18 -","- C66 H40 Co10 N4 O36 -","2","0.5","","Jia, Hong-Peng; Li, Wei; Ju, Zhan-Feng; Zhang, Jie","[Co5(mu3-OH)2(btec)2(bpp)]n: a three-dimensional homometallic molecular metamagnet built from the mixed hydroxide/carboxylate-bridged ferrimagnetic-like chains.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3699","3704","10.1039/b700041c","","","0.71073","MoKα","","0.0576","0.0476","","","0.1063","0.1122","","","","","","1.105","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005284","9.3313","0.001","12.8655","0.0014","13.1271","0.0014","110.35","0.002","95.181","0.002","102.478","0.002","1418.9","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H27.6 Cl2 Cu N5 O4.3 -","- C28 H27 Cl2 Cu N5 O4.3 -","- C56 H54 Cl4 Cu2 N10 O8.6 -","2","1","","Chen, Jacky; Russo, Robert; Chao, Wilson; Margerum, Lawrence D.; Malachowski, Mitchell R.; White, Ryan; Thawley, Zachary; Thayer, Angelina; Rheingold, Arnold L.; Zakharov, Lev N.","Synthesis, structure, redox properties and azide binding for a series of biphenyl-based Cu(II) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2571","2579","10.1039/b700114b","","","0.71073","MoKα","","0.0393","0.0356","","","0.0906","0.0926","","","","","","1.002","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005285","11.211","0.015","12.976","0.017","13.812","0.018","90","","110.18","0.01","90","","1886","4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H46 Cu2 N4 O18 -","- C30 H40 Cu2 N4 O18 -","- C60 H80 Cu4 N8 O36 -","2","0.5","","Sílvia Carvalho; Rita Delgado; Michael G. B. Drew; Vítor Félix","Dicopper(ii) complexes of a new di-para-xylyldioxatetraazamacrocycle and cascade species with dicarboxylate anions: thermodynamics and structural properties","Dalton Transactions","2007","","23","2431","","10.1039/b700115k","","","0.71073","MoKα","","0.1446","0.0995","","","0.1757","0.1923","","","","","","1.098","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005286","19.2","0.02","9.219","0.011","20.23","0.02","90","","94.08","0.01","90","","3572","7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H48 Cl2 Cu2 N4 O10 -","- C28 H46 Cl2 Cu2 N4 O10 -","- C112 H184 Cl8 Cu8 N16 O40 -","4","1","","Sílvia Carvalho; Rita Delgado; Michael G. B. Drew; Vítor Félix","Dicopper(ii) complexes of a new di-para-xylyldioxatetraazamacrocycle and cascade species with dicarboxylate anions: thermodynamics and structural properties","Dalton Transactions","2007","","23","2431","","10.1039/b700115k","","","0.71073","MoKα","","0.0748","0.0582","","","0.1099","0.1154","","","","","","1.192","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005287","14.8684","","14.8724","","10.3644","","90","","92.58","","90","","2289.54","","","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","?","- C68 H112 Cu4 F4 N12 O48 S4 -","- C68 H112 Cu4 F4 N12 O48 S4 -","","","","Overgaard, Jacob; Turel, Iztok; Hibbs, David E.","Experimental electron density study of a complex between copper(II) and the antibacterial quinolone family member ciprofloxacin.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2171","2178","10.1039/b700248c","","","","","","","","","","","","","","","","","","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005288","10.2419","0.0007","19.1519","0.0013","10.3873","0.0007","90","","102.053","0.001","90","","1992.6","0.2","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C32 H66 N3 O3 Si3 Tm -","- C32 H66 N3 O3 Si3 Tm -","- C64 H132 N6 O6 Si6 Tm2 -","2","1","","Lukesová, Lenka; Ward, Benjamin D.; Bellemin-Laponnaz, Stéphane; Wadepohl, Hubert; Gade, Lutz H.","High tacticity control in organolanthanide polymerization catalysis: formation of isotactic poly(alpha-alkenes) with a chiral C3-symmetric thulium complex.","Dalton transactions (Cambridge, England : 2003)","2007","","9","920","922","10.1039/b700269f","","x-ray","0.71073","MoKα","","0.0381","0.0324","","","0.0738","0.0769","","","","","","1.05","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005289","11.1678","0.001","20.3453","0.0018","22.558","0.002","90","","90","","90","","5125.5","0.8","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C47 H72 N3 O3 Si3 Tm -","- C47 H72 N3 O3 Si3 Tm -","- C188 H288 N12 O12 Si12 Tm4 -","4","1","","Lukesová, Lenka; Ward, Benjamin D.; Bellemin-Laponnaz, Stéphane; Wadepohl, Hubert; Gade, Lutz H.","High tacticity control in organolanthanide polymerization catalysis: formation of isotactic poly(alpha-alkenes) with a chiral C3-symmetric thulium complex.","Dalton transactions (Cambridge, England : 2003)","2007","","9","920","922","10.1039/b700269f","","x-ray","0.71073","MoKα","","0.0303","0.0247","","","0.0537","0.0563","","","","","","1.067","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005290","9.28","0.0002","9.4132","0.0002","14.9675","0.0003","90","","99.63","0.001","90","","1289.05","0.05","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 Mn3 O18 -","- C18 H18 Mn3 O18 -","- C36 H36 Mn6 O36 -","2","0.5","","Jordi Gómez-Segura; Javier Campo; Inhar Imaz; Klaus Wurst; Jaume Veciana; Philippe Gerbier; Daniel Ruiz-Molina","New insights into the thermal stability of Mn12 clusters: The case of complex [Mn12O12(O2CC?CH)16(H2O)4]?3H2O and its thermolysis derived [Mn3(O2CC?CH)6(H2O)4]?2H2O complex","Dalton Transactions","2007","","23","2450","","10.1039/b700298j","","","0.71073","MoKα","","0.022","0.0193","","","0.0486","0.0498","","","","","","1.067","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005291","15.3409","0.0013","7.8053","0.0006","15.4746","0.0014","90","","96.164","0.007","90","","1842.2","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H6 B F10 N O -","- C21 H6 B F10 N O -","- C84 H24 B4 F40 N4 O4 -","4","1","","Ugolotti, Juri; Hellstrom, Sondra; Britovsek, George J. P.; Jones, Tim S.; Hunt, Patricia; White, Andrew J. P.","Synthesis and characterisation of luminescent fluorinated organoboron compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1425","1432","10.1039/b700317j","","","1.54248","CuKα","","0.0558","0.035","","","0.0855","0.096","","","","","","0.993","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005292","26.97","0.0011","10.5284","0.0004","37.9995","0.0014","90","","104.723","0.003","90","","10435.7","0.7","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C27.5 H8 B Cl F15 N O -","- C27.5 H8 B Cl F15 N O -","- C440 H128 B16 Cl16 F240 N16 O16 -","16","2","","Ugolotti, Juri; Hellstrom, Sondra; Britovsek, George J. P.; Jones, Tim S.; Hunt, Patricia; White, Andrew J. P.","Synthesis and characterisation of luminescent fluorinated organoboron compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1425","1432","10.1039/b700317j","","","1.54248","CuKα","","0.0643","0.0514","","","0.1298","0.1365","","","","","","1.111","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005293","8.0303","0.0008","12.2898","0.0012","13.6929","0.0015","86.956","0.008","89.875","0.009","85.67","0.008","1345.6","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H12 B2 F10 N2 O3 -","- C30 H12 B2 F10 N2 O3 -","- C60 H24 B4 F20 N4 O6 -","2","1","","Ugolotti, Juri; Hellstrom, Sondra; Britovsek, George J. P.; Jones, Tim S.; Hunt, Patricia; White, Andrew J. P.","Synthesis and characterisation of luminescent fluorinated organoboron compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1425","1432","10.1039/b700317j","","","1.54248","CuKα","","0.0914","0.0498","","","0.0993","0.1169","","","","","","1.046","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005294","12.6799","0.0016","14.5846","0.0018","15.753","0.002","115.166","0.014","100.8","0.014","96.971","0.015","2522.9","0.7","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H25.42 Cl2 N5 O2.21 Pd -","- C25 H25.422 Cl2 N5 O2.211 Pd -","- C100 H101.688 Cl8 N20 O8.844 Pd4 -","4","2","","Bröring, Martin; Kleeberg, Christian","Cyclometalation vs. Werner-type coordination of sterically enforced palladium(II)-1,3-bis(pyridyl-2-imino)isoindolines (Pd-BPIs).","Dalton transactions (Cambridge, England : 2003)","2007","","11","1101","1103","10.1039/b700400a","","x-ray","0.71073","MoKα","","0.0574","0.0427","","","0.1112","0.1174","","","","","","1.05","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005295","8.5886","0.0016","11.834","0.003","12.123","0.003","90.44","0.03","97.63","0.02","104.77","0.02","1179.8","0.5","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H44 Cl2 N10 O4 Pd4 -","- C48 H44 Cl2 N10 O4 Pd4 -","- C48 H44 Cl2 N10 O4 Pd4 -","1","0.5","","Bröring, Martin; Kleeberg, Christian","Cyclometalation vs. Werner-type coordination of sterically enforced palladium(II)-1,3-bis(pyridyl-2-imino)isoindolines (Pd-BPIs).","Dalton transactions (Cambridge, England : 2003)","2007","","11","1101","1103","10.1039/b700400a","","x-ray","0.71073","MoKα","","0.1626","0.0869","","","0.2055","0.2451","","","","","","0.829","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005296","8.2486","0.0016","9.0047","0.0018","9.1825","0.0018","77.67","0.03","67.55","0.03","83.75","0.03","615.5","0.3","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H34 Mn2 N6 -","- C24 H34 Mn2 N6 -","- C24 H34 Mn2 N6 -","1","0.5","","Brinkmann, Christine; García, Felipe; Morey, James V.; McPartlin, Mary; Singh, Sanjay; Wheatley, Andrew E. H.; Wright, Dominic S.","Stepwise nucleophilic substitution of manganocene, syntheses and structures of the dimer [CpMn(hpp)]2 and the unusual manganate cage [LiMn(hpp)3]2 (hppH = 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2,a]pyrimidine).","Dalton transactions (Cambridge, England : 2003)","2007","","16","1570","1572","10.1039/b700409e","","","0.71073","MoKα","","0.0243","0.023","","","0.0722","0.0733","","","","","","1.006","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005297","14.668","0.003","18.026","0.004","18.697","0.004","90","","107.01","0.03","90","","4727.3","1.9","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H72 Li2 Mn2 N18 -","- C42 H72 Li2 Mn2 N18 -","- C168 H288 Li8 Mn8 N72 -","4","1","","Brinkmann, Christine; García, Felipe; Morey, James V.; McPartlin, Mary; Singh, Sanjay; Wheatley, Andrew E. H.; Wright, Dominic S.","Stepwise nucleophilic substitution of manganocene, syntheses and structures of the dimer [CpMn(hpp)]2 and the unusual manganate cage [LiMn(hpp)3]2 (hppH = 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2,a]pyrimidine).","Dalton transactions (Cambridge, England : 2003)","2007","","16","1570","1572","10.1039/b700409e","","","0.71073","MoKα","","0.0767","0.0521","","","0.1064","0.1142","","","","","","1.071","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005298","9.0203","0.0008","9.69","0.0009","19.3728","0.0017","93.704","0.002","99.887","0.002","111.292","0.002","1539.4","0.2","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H32 Cl4 N10 O4 P6 -","- C13 H32 Cl4 N10 O4 P6 -","- C26 H64 Cl8 N20 O8 P12 -","2","1","","Coles, Simon J.; Davies, David B.; Eaton, Robert J.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.; Uslu, Aylin","Stereogenic properties of spiranes combined with four equivalent conventional centres of chirality.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2040","2047","10.1039/b700464h","","","0.6895","synchrotron","","0.0879","0.0536","","","0.1261","0.1415","","","","","","1.052","","","","has coordinates,has disorder","179756","2020-10-21","18:00:00",""
"7005299","10.376","0.005","15.323","0.008","20.706","0.01","108.439","0.009","97.965","0.01","90.189","0.009","3089","3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H32 Cl4 N10 O4 P6 -","- C13 H32 Cl4 N10 O4 P6 -","- C52 H128 Cl16 N40 O16 P24 -","4","2","","Coles, Simon J.; Davies, David B.; Eaton, Robert J.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.; Uslu, Aylin","Stereogenic properties of spiranes combined with four equivalent conventional centres of chirality.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2040","2047","10.1039/b700464h","","","0.6903","synchrotron","","0.145","0.0919","","","0.2287","0.2697","","","","","","1.031","","","","has coordinates","179756","2020-10-21","18:00:00",""
"7005300","19.44","0.004","8.0225","0.0012","25.177","0.009","90","","110.62","0.02","90","","3675","1.7","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H46 Cl4 N10 O4 P6 -","- C19 H46 Cl4 N10 O4 P6 -","- C76 H184 Cl16 N40 O16 P24 -","4","1","","Coles, Simon J.; Davies, David B.; Eaton, Robert J.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.; Uslu, Aylin","Stereogenic properties of spiranes combined with four equivalent conventional centres of chirality.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2040","2047","10.1039/b700464h","","","0.71073","MoKα","","0.093","0.0646","","","0.1675","0.1872","","","","","","1.046","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005301","14.6321","0.0004","16.2001","0.0004","22.2191","0.0005","94.006","0.001","102.129","0.001","94.726","0.001","5111.2","0.2","83","2","83","2","","","","","","","","7","P -1","-P 1","2","","","","- C86 H84 Cu4 F24 N16 O2 P4 -","- C86 H84 Cu4 F24 N16 O2 P4 -","- C172 H168 Cu8 F48 N32 O4 P8 -","2","1","","Price, Jason R.; Lan, Yanhua; Brooker, Sally","Pyridazine-bridged copper(I) complexes of bis-bidentate ligands: tetranuclear [2 x 2] grid versus dinuclear side-by-side architectures as a function of ligand substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1807","1820","10.1039/B700503B","","","0.71073","MoKα","","0.0593","0.0408","","","0.103","0.1093","","","","","","1.084","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005302","20.4033","0.0007","13.4597","0.0004","21.0965","0.0007","90","","93.697","0.002","90","","5781.5","0.3","83","2","83","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C72 H40 Cl16 Cu4 N16 -","- C72 H40 Cl16 Cu4 N16 -","- C144 H80 Cl32 Cu8 N32 -","2","0.5","","Price, Jason R.; Lan, Yanhua; Brooker, Sally","Pyridazine-bridged copper(I) complexes of bis-bidentate ligands: tetranuclear [2 x 2] grid versus dinuclear side-by-side architectures as a function of ligand substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1807","1820","10.1039/B700503B","","","0.71073","MoKα","","0.0777","0.0519","","","0.1418","0.1511","","","","","","1.05","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005303","14.914","0.0018","15.2869","0.0019","26.383","0.003","96.46","0.007","97.077","0.007","111.931","0.007","5454.5","1.2","83","2","83","2","","","","","","","","7","P -1","-P 1","2","","","","- C96 H88 Cu4 F40 N16 O8 P4 -","- C96 H88 Cu4 F40 N16 O8 P4 -","- C192 H176 Cu8 F80 N32 O16 P8 -","2","1","","Price, Jason R.; Lan, Yanhua; Brooker, Sally","Pyridazine-bridged copper(I) complexes of bis-bidentate ligands: tetranuclear [2 x 2] grid versus dinuclear side-by-side architectures as a function of ligand substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1807","1820","10.1039/B700503B","","","0.71073","MoKα","","0.2404","0.1729","","","0.4722","0.5069","","","","","","1.923","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005304","12.706","0.002","5.5894","0.0008","22.376","0.004","90","","102.667","0.009","90","","1550.4","0.4","89","2","89","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H10 F4 N4 -","- C18 H10 F4 N4 -","- C72 H40 F16 N16 -","4","1","","Price, Jason R.; Lan, Yanhua; Brooker, Sally","Pyridazine-bridged copper(I) complexes of bis-bidentate ligands: tetranuclear [2 x 2] grid versus dinuclear side-by-side architectures as a function of ligand substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1807","1820","10.1039/B700503B","","","0.71073","MoKα","","0.036","0.0317","","","0.0864","0.0908","","","","","","1.04","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005305","13.5144","0.0005","27.3551","0.0012","22.2181","0.001","90","","90","","90","","8213.8","0.6","83","2","83","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C96 H80 Cu2 F12 N8 P2 -","- C96 H80 Cu2 F12 N8 P2 -","- C384 H320 Cu8 F48 N32 P8 -","4","0.5","","Price, Jason R.; Lan, Yanhua; Brooker, Sally","Pyridazine-bridged copper(I) complexes of bis-bidentate ligands: tetranuclear [2 x 2] grid versus dinuclear side-by-side architectures as a function of ligand substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1807","1820","10.1039/B700503B","","","0.71073","MoKα","","0.1349","0.0533","","","0.0814","0.1044","","","","","","1.034","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7005306","8.5883","0.0002","9.9822","0.0002","24.5153","0.0006","90","","98.491","0.001","90","","2078.66","0.08","83","2","83","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 N4 -","- C24 H26 N4 -","- C96 H104 N16 -","4","1","","Price, Jason R.; Lan, Yanhua; Brooker, Sally","Pyridazine-bridged copper(I) complexes of bis-bidentate ligands: tetranuclear [2 x 2] grid versus dinuclear side-by-side architectures as a function of ligand substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1807","1820","10.1039/B700503B","","","0.71073","MoKα","","0.1512","0.0749","","","0.155","0.1865","","","","","","0.989","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005307","45.818","0.006","16.454","0.002","30.973","0.005","90","","101.412","0.008","90","","22889","6","89","2","89","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C109 H110.3 Cu4 F24 N16 O0.65 P4 -","- C109 H110.3 Cu4 F24 N16 O0.65 P4 -","- C872 H882.4 Cu32 F192 N128 O5.2 P32 -","8","1","","Price, Jason R.; Lan, Yanhua; Brooker, Sally","Pyridazine-bridged copper(I) complexes of bis-bidentate ligands: tetranuclear [2 x 2] grid versus dinuclear side-by-side architectures as a function of ligand substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1807","1820","10.1039/B700503B","","","0.71073","MoKα","","0.1557","0.0906","","","0.2246","0.2805","","","","","","1.041","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005308","11.9865","0.0007","3.7315","0.0002","17.5501","0.0011","90","","90","","90","","784.97","0.08","295","2","295","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C8 H7 N5 -","- C8 H7 N5 -","- C32 H28 N20 -","4","1","","Ismayilov, Rayyat Huseyn; Wang, Wen-Zhen; Lee, Gene-Hsiang; Wang, Rui-Ren; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming","New versatile ligand family, pyrazine-modulated oligo-alpha-pyridylamino ligands, from coordination polymer to extended metal atom chains.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2898","2907","10.1039/b700533d","","","0.71073","MoKα","","0.0647","0.0546","","","0.1212","0.1266","","","","","","1.082","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005309","15.1795","0.0004","10.8102","0.0003","15.3382","0.0004","90","","90","","90","","2516.9","0.12","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C16 H22 Cl2 Cu N10 O12 -","- C16 H22 Cl2 Cu N10 O12 -","- C64 H88 Cl8 Cu4 N40 O48 -","4","0.5","","Ismayilov, Rayyat Huseyn; Wang, Wen-Zhen; Lee, Gene-Hsiang; Wang, Rui-Ren; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming","New versatile ligand family, pyrazine-modulated oligo-alpha-pyridylamino ligands, from coordination polymer to extended metal atom chains.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2898","2907","10.1039/b700533d","","","0.71073","MoKα","","0.0448","0.0343","","","0.0903","0.0973","","","","","","1.058","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005310","9.2206","0.0002","7.7428","0.0002","14.8613","0.0003","90","","93.7248","0.0012","90","","1058.76","0.04","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 Co N12 S2 -","- C18 H14 Co N12 S2 -","- C36 H28 Co2 N24 S4 -","2","0.5","","Ismayilov, Rayyat Huseyn; Wang, Wen-Zhen; Lee, Gene-Hsiang; Wang, Rui-Ren; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming","New versatile ligand family, pyrazine-modulated oligo-alpha-pyridylamino ligands, from coordination polymer to extended metal atom chains.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2898","2907","10.1039/b700533d","","","0.71073","MoKα","","0.0947","0.0762","","","0.243","0.2518","","","","","","1.254","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005311","19.2247","0.0003","10.3082","0.0002","21.5836","0.0004","90","","108.044","0.0013","90","","4066.91","0.13","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C35.25 H32 Cl2.5 N20 Ni3 O0.75 -","- C35.25 H32 Cl2.5 N20 Ni3 O0.75 -","- C141 H128 Cl10 N80 Ni12 O3 -","4","1","","Ismayilov, Rayyat Huseyn; Wang, Wen-Zhen; Lee, Gene-Hsiang; Wang, Rui-Ren; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming","New versatile ligand family, pyrazine-modulated oligo-alpha-pyridylamino ligands, from coordination polymer to extended metal atom chains.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2898","2907","10.1039/b700533d","","","0.71073","MoKα","","0.1128","0.0489","","","0.1082","0.1335","","","","","","0.977","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005312","13.7908","0.0003","10.3096","0.0002","14.7425","0.0003","90","","96.5009","0.0011","90","","2082.58","0.07","150","2","150","2","","","","","","","","6","P 1 2 1","P 2y","3","","","","- C33 H29 Cl3 Cr3 N20 O1.5 -","- C33 H26 Cl2.99 Cr3 N20 O1.5 -","- C66 H52 Cl5.98 Cr6 N40 O3 -","2","1","","Ismayilov, Rayyat Huseyn; Wang, Wen-Zhen; Lee, Gene-Hsiang; Wang, Rui-Ren; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming","New versatile ligand family, pyrazine-modulated oligo-alpha-pyridylamino ligands, from coordination polymer to extended metal atom chains.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2898","2907","10.1039/b700533d","","","0.71073","MoKα","","0.0908","0.0591","","","0.1604","0.1788","","","","","","1.018","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005313","18.4859","0.0003","16.6988","0.0003","25.1757","0.0004","90","","90","","90","","7771.5","0.2","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C34 H25 N22 Ni3 O0.5 S2 -","- C34 H25 N22 Ni3 O0.5 S2 -","- C272 H200 N176 Ni24 O4 S16 -","8","1","","Ismayilov, Rayyat Huseyn; Wang, Wen-Zhen; Lee, Gene-Hsiang; Wang, Rui-Ren; Liu, Isiah Po-Chun; Yeh, Chen-Yu; Peng, Shie-Ming","New versatile ligand family, pyrazine-modulated oligo-alpha-pyridylamino ligands, from coordination polymer to extended metal atom chains.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2898","2907","10.1039/b700533d","","","0.71073","MoKα","","0.121","0.0586","","","0.147","0.1808","","","","","","1.076","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005314","19.657","0.004","19.758","0.004","23.241","0.005","94.39","0.03","108.43","0.03","119.51","0.03","7152","4","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C122 H119 Cl6.5 Cu2 N23 O43 S8 Zn2 -","- C122 H119 Cl6.5 Cu2 N23 O43 S8 Zn2 -","- C244 H238 Cl13 Cu4 N46 O86 S16 Zn4 -","2","1","","Riis-Johannessen, T; Harding, Lindsay P.; Jeffery, John C.; Moon, Ryan; Rice, Craig R.","Allosteric deprogramming of a trinuclear heterometallic helicate.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1577","1587","10.1039/b700539c","","","0.71073","MoKα","","0.1252","0.0877","","","0.2458","0.2704","","","","","","1.125","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005315","20.516","0.004","26.356","0.005","23.514","0.005","90","","93.22","0.03","90","","12694","4","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C116 H128 Cl5 Cu N20 O38 S4 Zn2 -","- C116 H128 Cl5 Cu N20 O38 S4 Zn2 -","- C464 H512 Cl20 Cu4 N80 O152 S16 Zn8 -","4","1","","Riis-Johannessen, T; Harding, Lindsay P.; Jeffery, John C.; Moon, Ryan; Rice, Craig R.","Allosteric deprogramming of a trinuclear heterometallic helicate.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1577","1587","10.1039/b700539c","","","0.71073","MoKα","","0.1233","0.0714","","","0.2023","0.2596","","","","","","0.797","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005316","14.73","0.005","19.399","0.004","21.653","0.004","90","","95.65","0.03","90","","6157","3","173","2","173","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C58 H49 B Cl6 Mo N7 O5 P Ru -","- C58 H49 B Cl6 Mo N7 O5 P Ru -","- C232 H196 B4 Cl24 Mo4 N28 O20 P4 Ru4 -","4","1","","Adams, Christopher J.; Connelly, Neil G.; Onganusorn, Sriwipha","Cyanide-bridged linkage isomers with catecholateruthenium(ii) centres bound to Mn(i) or M(alkyne) units","Dalton Transactions","2007","","19","1904","","10.1039/B700549K","","","0.71073","MoKα","","0.1502","0.0564","","","0.1132","0.1444","","","","","","0.92","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005317","10.795","0.002","15.43","0.003","17.984","0.004","90.51","0.03","106.82","0.03","95.17","0.03","2853.8","1.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H27 Cr N O4 P2 -","- C31 H27 Cr N O4 P2 -","- C124 H108 Cr4 N4 O16 P8 -","4","2","","Bowen, Lucy E.; Haddow, Mairi F.; Orpen, A. Guy; Wass, Duncan F.","One electron oxidation of chromium N,N-bis(diarylphosphino)amine and bis(diarylphosphino)methane complexes relevant to ethene trimerisation and tetramerisation.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1160","1168","10.1039/b700559h","","","0.71073","MoKα","","0.0669","0.0515","","","0.1007","0.1101","","","","","","1.37","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005318","10.85","0.002","13.509","0.003","13.657","0.003","76.4","0.03","67.08","0.03","81.53","0.03","1788.5","0.8","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H33 Cl2 Cr N O8 P2 -","- C34 H33 Cl2 Cr N O8 P2 -","- C68 H66 Cl4 Cr2 N2 O16 P4 -","2","1","","Bowen, Lucy E.; Haddow, Mairi F.; Orpen, A. Guy; Wass, Duncan F.","One electron oxidation of chromium N,N-bis(diarylphosphino)amine and bis(diarylphosphino)methane complexes relevant to ethene trimerisation and tetramerisation.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1160","1168","10.1039/b700559h","","","0.71073","MoKα","","0.0925","0.0506","","","0.1203","0.1373","","","","","","1.03","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005319","11.398","0.002","19.022","0.004","18.46","0.004","90","","101.33","0.03","90","","3924.4","1.4","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C32 H31 B Cr F4 N2 O8 P2 -","- C32 H31 B Cr F4 N2 O8 P2 -","- C128 H124 B4 Cr4 F16 N8 O32 P8 -","4","1","","Bowen, Lucy E.; Haddow, Mairi F.; Orpen, A. Guy; Wass, Duncan F.","One electron oxidation of chromium N,N-bis(diarylphosphino)amine and bis(diarylphosphino)methane complexes relevant to ethene trimerisation and tetramerisation.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1160","1168","10.1039/b700559h","","","1.54178","CuKα","","0.0856","0.048","","","0.1093","0.1203","","","","","","0.977","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005320","11.807","0.009","17.767","0.011","17.847","0.009","80.5","0.06","86.84","0.04","74.8","0.06","3563","4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H32 Cl2 Cr O8 P2 -","- C34 H32 Cl2 Cr O8 P2 -","- C136 H128 Cl8 Cr4 O32 P8 -","4","2","","Bowen, Lucy E.; Haddow, Mairi F.; Orpen, A. Guy; Wass, Duncan F.","One electron oxidation of chromium N,N-bis(diarylphosphino)amine and bis(diarylphosphino)methane complexes relevant to ethene trimerisation and tetramerisation.","Dalton transactions (Cambridge, England : 2003)","2007","","11","1160","1168","10.1039/b700559h","","","0.71073","MoKα","","0.071","0.0472","","","0.1224","0.1383","","","","","","1.024","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005321","10.627","0.002","13.614","0.003","19.419","0.004","92.28","0.03","90.11","0.03","106.27","0.03","2694.6","1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H30 Cl8 O14 P2 Ru2 -","- C52 H30 Cl8 O14 P2 Ru2 -","- C104 H60 Cl16 O28 P4 Ru4 -","2","1","","Adams, Christopher J.; Charmant, Jonathan P. H.; Connelly, Neil G.; Gill, Martin; Kantacha, Anob; Onganusorn, Sriwipha; Orpen, A. Guy","Homobinuclear cyanide-bridged linkage isomers containing the redox-active unit [(micro-XY)Ru(CO)2L(o-O2C6Cl4)] (XY=CN or NC).","Dalton transactions (Cambridge, England : 2003)","2007","","22","2283","2294","10.1039/b700648a","","","0.71073","MoKα","","0.0302","0.027","","","0.0605","0.0619","","","","","","1.063","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005322","13.9435","0.0006","15.6637","0.0007","18.5668","0.0008","95.542","0.001","110.313","0.001","94.399","0.001","3758.7","0.3","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C35.5 H36 Cl5 N2 O4 P Ru -","- C35.5 H36 Cl5 N2 O4 P Ru -","- C142 H144 Cl20 N8 O16 P4 Ru4 -","4","2","","Adams, Christopher J.; Charmant, Jonathan P. H.; Connelly, Neil G.; Gill, Martin; Kantacha, Anob; Onganusorn, Sriwipha; Orpen, A. Guy","Homobinuclear cyanide-bridged linkage isomers containing the redox-active unit [(micro-XY)Ru(CO)2L(o-O2C6Cl4)] (XY=CN or NC).","Dalton transactions (Cambridge, England : 2003)","2007","","22","2283","2294","10.1039/b700648a","","","0.71073","MoKα","","0.1032","0.0438","","","0.082","0.0991","","","","","","0.975","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005323","62.9641","0.0011","9.5138","0.0002","24.0104","0.0004","90","","93.624","0.001","90","","14354.1","0.5","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C69.5 H66 Cl9 N2 O8 P2 Ru2 -","- C69.5 H66 Cl9 N2 O8 P2 Ru2 -","- C556 H528 Cl72 N16 O64 P16 Ru16 -","8","1","","Adams, Christopher J.; Charmant, Jonathan P. H.; Connelly, Neil G.; Gill, Martin; Kantacha, Anob; Onganusorn, Sriwipha; Orpen, A. Guy","Homobinuclear cyanide-bridged linkage isomers containing the redox-active unit [(micro-XY)Ru(CO)2L(o-O2C6Cl4)] (XY=CN or NC).","Dalton transactions (Cambridge, England : 2003)","2007","","22","2283","2294","10.1039/b700648a","","","1.54178","CuKα","","0.0513","0.0339","","","0.0783","0.087","","","","","","1.005","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005324","14.928","0.0009","25.8112","0.0016","16.5709","0.001","90","","110.103","0.001","90","","5995.9","0.6","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C54 H32 Cl10 N O8 P2 Ru2 -","- C54 H32 Cl10 N O8 P2 Ru2 -","- C216 H128 Cl40 N4 O32 P8 Ru8 -","4","1","","Adams, Christopher J.; Charmant, Jonathan P. H.; Connelly, Neil G.; Gill, Martin; Kantacha, Anob; Onganusorn, Sriwipha; Orpen, A. Guy","Homobinuclear cyanide-bridged linkage isomers containing the redox-active unit [(micro-XY)Ru(CO)2L(o-O2C6Cl4)] (XY=CN or NC).","Dalton transactions (Cambridge, England : 2003)","2007","","22","2283","2294","10.1039/b700648a","","","0.71073","MoKα","","0.1518","0.0622","","","0.1161","0.1377","","","","","","0.863","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005325","12.433","0.012","14.524","0.012","17.893","0.016","82.55","0.03","72.74","0.03","77.12","0.03","3001","5","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C55 H34 Cl12 N O11 P2 Ru2 -","- C55 H34 Cl12 N O11 P2 Ru2 -","- C110 H68 Cl24 N2 O22 P4 Ru4 -","2","1","","Adams, Christopher J.; Charmant, Jonathan P. H.; Connelly, Neil G.; Gill, Martin; Kantacha, Anob; Onganusorn, Sriwipha; Orpen, A. Guy","Homobinuclear cyanide-bridged linkage isomers containing the redox-active unit [(micro-XY)Ru(CO)2L(o-O2C6Cl4)] (XY=CN or NC).","Dalton transactions (Cambridge, England : 2003)","2007","","22","2283","2294","10.1039/b700648a","","","1.54178","CuKα","","0.1387","0.0687","","","0.18","0.222","","","","","","1.028","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005326","11.4316","0.0014","9.4232","0.001","17.547","0.002","90","","102.805","0.006","90","","1843.2","0.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H24 B9 P -","- C15 H24 B9 P -","- C60 H96 B36 P4 -","4","1","","Ioppolo, Joseph A.; Clegg, Jack K.; Rendina, Louis M.","Dicarba-closo-dodecaborane(12) derivatives of phosphonium salts: easy formation of nido-carborane phosphonium zwitterions.","Dalton transactions (Cambridge, England : 2003)","2007","","20","1982","1985","10.1039/b700689f","","","0.71073","MoKα","","0.059","0.0444","","","0.1179","0.1318","","","","","","1.085","","","","has coordinates","192777","2020-10-21","18:00:00",""
"7005327","12.4875","0.0015","12.8921","0.0015","13.5629","0.0017","79.429","0.002","77.367","0.003","85.85","0.002","2093.3","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H22 F18 N3 Nd O6 -","- C42 H22 F18 N3 Nd O6 -","- C84 H44 F36 N6 Nd2 O12 -","2","1","","Lazarides, Theodore; Alamiry, Mohammed A. H.; Adams, Harry; Pope, Simon J. A.; Faulkner, Stephen; Weinstein, Julia A.; Ward, Michael D.","Anthracene as a sensitiser for near-infrared luminescence in complexes of Nd(III), Er(III) and Yb(III): an unexpected sensitisation mechanism based on electron transfer.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1484","1491","10.1039/b700714k","","","0.71073","MoKα","","0.0633","0.0472","","","0.1005","0.1067","","","","","","0.957","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005328","12.6188","0.0011","12.9157","0.0011","13.4422","0.0012","79.884","0.001","77.75","0.001","88.007","0.001","2107.6","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H22 F18 Gd N3 O6 -","- C42 H22 F18 Gd N3 O6 -","- C84 H44 F36 Gd2 N6 O12 -","2","1","","Lazarides, Theodore; Alamiry, Mohammed A. H.; Adams, Harry; Pope, Simon J. A.; Faulkner, Stephen; Weinstein, Julia A.; Ward, Michael D.","Anthracene as a sensitiser for near-infrared luminescence in complexes of Nd(III), Er(III) and Yb(III): an unexpected sensitisation mechanism based on electron transfer.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1484","1491","10.1039/b700714k","","","0.71073","MoKα","","0.0593","0.0527","","","0.1426","0.1493","","","","","","1.065","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005329","12.81","0.004","12.924","0.004","13.32","0.004","101.129","0.005","101.725","0.005","91.392","0.005","2114","1.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H22 Er F18 N3 O6 -","- C42 H22 Er F18 N3 O6 -","- C84 H44 Er2 F36 N6 O12 -","2","1","","Lazarides, Theodore; Alamiry, Mohammed A. H.; Adams, Harry; Pope, Simon J. A.; Faulkner, Stephen; Weinstein, Julia A.; Ward, Michael D.","Anthracene as a sensitiser for near-infrared luminescence in complexes of Nd(III), Er(III) and Yb(III): an unexpected sensitisation mechanism based on electron transfer.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1484","1491","10.1039/b700714k","","","0.71073","MoKα","","0.0812","0.0623","","","0.1574","0.1702","","","","","","1.019","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005330","12.812","0.005","12.88","0.005","13.24","0.005","101.505","0.005","101.437","0.005","91.816","0.005","2092.7","1.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H22 F18 N3 O6 Yb -","- C42 H22 F18 N3 O6 Yb -","- C84 H44 F36 N6 O12 Yb2 -","2","1","","Lazarides, Theodore; Alamiry, Mohammed A. H.; Adams, Harry; Pope, Simon J. A.; Faulkner, Stephen; Weinstein, Julia A.; Ward, Michael D.","Anthracene as a sensitiser for near-infrared luminescence in complexes of Nd(III), Er(III) and Yb(III): an unexpected sensitisation mechanism based on electron transfer.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1484","1491","10.1039/b700714k","","","0.71073","MoKα","","0.0409","0.0374","","","0.0945","0.0974","","","","","","1.052","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005331","20.513","0.005","8.4782","0.0015","21.624","0.003","90","","110.566","0.015","90","","3521","1.2","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H28 I2 Ir N6 O4 Rh -","- C32 H28 I2 Ir N6 O4 Rh -","- C128 H112 I8 Ir4 N24 O16 Rh4 -","4","0.5","","Adams, Christopher J.; Baber, R. Angharad; Connelly, Neil G.; Harding, Phimphaka; Hayward, Owen D.; Kandiah, Mathivathani; Orpen, A. Guy","Iodination of triazenide-bridged rhodium and iridium complexes: oxidative addition vs. one-electron oxidation.","Dalton transactions (Cambridge, England : 2003)","2007","","13","1325","1333","10.1039/b700736a","","","0.71073","MoKα","","0.0492","0.0305","","","0.0721","0.0788","","","","","","0.982","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005332","30.696","0.004","11.6049","0.0015","18.233","0.002","90","","90","","90","","6495","1.4","173","2","173","2","","","","","","","","8","P 21 21 2","P 2 2ab","18","","","","- C54 H82 F3 I3 N7.5 O3 P0.5 Rh2 -","- C54 H82 F3 I3 N7.5 O3 P0.5 Rh2 -","- C216 H328 F12 I12 N30 O12 P2 Rh8 -","4","1","","Adams, Christopher J.; Baber, R. Angharad; Connelly, Neil G.; Harding, Phimphaka; Hayward, Owen D.; Kandiah, Mathivathani; Orpen, A. Guy","Iodination of triazenide-bridged rhodium and iridium complexes: oxidative addition vs. one-electron oxidation.","Dalton transactions (Cambridge, England : 2003)","2007","","13","1325","1333","10.1039/b700736a","","","0.71073","MoKα","","0.0839","0.0464","","","0.1148","0.1389","","","","","","1.017","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005333","8.9001","0.0015","9.642","0.002","13.51","0.005","94.177","0.018","100.254","0.014","98.35","0.02","1122.9","0.5","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H32 Cl2 I4 Ir2 N6 O4 -","- C33 H32 Cl2 I4 Ir2 N6 O4 -","- C33 H32 Cl2 I4 Ir2 N6 O4 -","1","0.5","","Adams, Christopher J.; Baber, R. Angharad; Connelly, Neil G.; Harding, Phimphaka; Hayward, Owen D.; Kandiah, Mathivathani; Orpen, A. Guy","Iodination of triazenide-bridged rhodium and iridium complexes: oxidative addition vs. one-electron oxidation.","Dalton transactions (Cambridge, England : 2003)","2007","","13","1325","1333","10.1039/b700736a","","","0.71073","MoKα","","0.0448","0.033","","","0.0924","0.0969","","","","","","1.032","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005334","9.252","0.002","18.05","0.003","19.716","0.004","90","","97.006","0.014","90","","3268","1.1","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C33 H29 I2 N3 O P Rh -","- C33 H29 I2 N3 O P Rh -","- C132 H116 I8 N12 O4 P4 Rh4 -","4","1","","Adams, Christopher J.; Baber, R. Angharad; Connelly, Neil G.; Harding, Phimphaka; Hayward, Owen D.; Kandiah, Mathivathani; Orpen, A. Guy","Iodination of triazenide-bridged rhodium and iridium complexes: oxidative addition vs. one-electron oxidation.","Dalton transactions (Cambridge, England : 2003)","2007","","13","1325","1333","10.1039/b700736a","","","0.71073","MoKα","","0.107","0.0432","","","0.0624","0.075","","","","","","0.876","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005335","12.277","0.003","12.861","0.0009","16.837","0.004","90","","98.572","0.008","90","","2628.8","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 Gd N4 O14 -","- C21 H15 Gd N4 O14 -","- C84 H60 Gd4 N16 O56 -","4","1","","Charbonnière, Loïc J; Mameri, Samir; Flot, David; Waltz, Fanny; Zandanel, Christelle; Ziessel, Raymond F.","A disymmetric terpyridine based ligand for the formation of luminescent di-aquo lanthanide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2245","2253","10.1039/b700837f","","","0.873","","","0.049","0.0414","","","0.0999","0.1032","","","","","","1.052","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005336","15.623","0.002","15.623","0.002","21.354","0.004","90","","90","","90","","5212","1.4","293","2","293","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C92 H120 N12 S4 Yb4 -","- C92 H120 N12 S4 Yb4 -","- C184 H240 N24 S8 Yb8 -","2","0.25","","Ma, Liping; Zhang, Jie; Cai, Ruifang; Chen, Zhenxia; Zhou, Xigeng","Facile construction of novel organolanthanide square-planar macrocycles through addition of carbodiimide to an amino group.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2718","2722","10.1039/b700845g","","","0.71073","MoKα","","0.1084","0.0787","","","0.2119","0.2332","","","","","","1.113","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005337","15.6756","0.001","15.6756","0.001","21.494","0.003","90","","90","","90","","5281.6","0.9","293","2","293","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C92 H120 Er4 N12 S4 -","- C92 H120 Er4 N12 S4 -","- C184 H240 Er8 N24 S8 -","2","0.25","","Ma, Liping; Zhang, Jie; Cai, Ruifang; Chen, Zhenxia; Zhou, Xigeng","Facile construction of novel organolanthanide square-planar macrocycles through addition of carbodiimide to an amino group.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2718","2722","10.1039/b700845g","","","0.71073","MoKα","","0.1415","0.1026","","","0.2506","0.2766","","","","","","1.195","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005338","29.4","0.008","16.934","0.004","30.963","0.012","90","","112.029","0.003","90","","14290","8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C116 H152 N12 S4 Yb4 -","- C116 H152 N12 S4 Yb4 -","- C464 H608 N48 S16 Yb16 -","4","0.5","","Ma, Liping; Zhang, Jie; Cai, Ruifang; Chen, Zhenxia; Zhou, Xigeng","Facile construction of novel organolanthanide square-planar macrocycles through addition of carbodiimide to an amino group.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2718","2722","10.1039/b700845g","","","0.71073","MoKα","","0.1388","0.0856","","","0.2587","0.3094","","","","","","1.038","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005339","29.382","0.003","16.9543","0.0019","30.951","0.004","90","","111.8","0.001","90","","14316","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C116 H152 Er4 N12 S4 -","- C116 H152 Er4 N12 S4 -","- C464 H608 Er16 N48 S16 -","4","0.5","","Ma, Liping; Zhang, Jie; Cai, Ruifang; Chen, Zhenxia; Zhou, Xigeng","Facile construction of novel organolanthanide square-planar macrocycles through addition of carbodiimide to an amino group.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2718","2722","10.1039/b700845g","","","0.71073","MoKα","","0.1227","0.0723","","","0.2444","0.3088","","","","","","1.079","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005340","39.904","0.005","16.2272","0.0019","20.398","0.002","90","","105.941","0.002","90","","12700","3","123","2","123","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C128 H126 B2 Cl2 Cu6 N22 O14 -","- C126 H118 B2 Cl2 Cu6 N22 O12 -","- C504 H472 B8 Cl8 Cu24 N88 O48 -","4","0.5","","Afrati, Tereza; Zaleski, Curtis M.; Dendrinou-Samara, Catherine; Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.; Kessissoglou, Dimitris P.","Di-2-pyridyl ketone oxime in copper chemistry: di-, tri-, penta- and hexanuclear complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2658","2668","10.1039/b700902j","","","0.71073","MoKα","","0.0742","0.0494","","","0.1447","0.1566","","","","","","1.082","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005341","17.0171","0.0015","17.4816","0.0016","18.7802","0.0018","67.822","0.005","63.093","0.005","62.629","0.005","4321.8","0.7","108","2","108","2","","","","","","","","6","P -1","-P 1","2","","","","- C79 H68 Cl3 Cu5 N21 O23 -","- C79 H64 Cl3 Cu5 N21 O21 -","- C158 H128 Cl6 Cu10 N42 O42 -","2","1","","Afrati, Tereza; Zaleski, Curtis M.; Dendrinou-Samara, Catherine; Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.; Kessissoglou, Dimitris P.","Di-2-pyridyl ketone oxime in copper chemistry: di-, tri-, penta- and hexanuclear complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2658","2668","10.1039/b700902j","","","0.71073","MoKα","","0.0683","0.0476","","","0.1316","0.1408","","","","","","1.131","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005342","10.4704","0.0004","21.4926","0.0008","12.0294","0.0005","90","","90.799","0.001","90","","2706.79","0.18","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H23 F4 Ir N8 -","- C29 H23 F4 Ir N8 -","- C116 H92 F16 Ir4 N32 -","4","1","","Chang, Chau-Jiun; Yang, Cheng-Han; Chen, Kellen; Chi, Yun; Shu, Ching-Fong; Ho, Mei-Lin; Yeh, Yu-Shan; Chou, Pi-Tai","Color tuning associated with heteroleptic cyclometalated Ir(iii) complexes: influence of the ancillary ligand","Dalton Transactions","2007","","19","1881","","10.1039/b700998d","","","0.71073","MoKα","","0.0481","0.0384","","","0.073","0.0761","","","","","","1.148","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005343","8.217","0.004","11.453","0.002","13.079","0.004","81.11","0.02","73.58","0.04","80.57","0.03","1157.1","0.7","150","2","150","2","","","","","","","","6","P -1","-P 1","2","N-((pyrid-2yl)methyl) 1'- (diphenylphosphino)ferrocenecarboxamide","N-{(pyrid-2yl)methyl} 1'-(diphenylphosphino)ferrocenecarboxamide","","- C29 H25 Fe N2 O P -","- C29 H25 Fe N2 O P -","- C58 H50 Fe2 N4 O2 P2 -","2","1","","Kühnert, Janett; Dusek, Michal; Demel, Jan; Lang, Heinrich; Stepnicka, Petr","Synthesis, coordination and catalytic use of 1-(diphenylphosphino)-1'-carbamoylferrocenes with pyridyl-containing N-substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2802","2811","10.1039/b701012e","","","0.71073","MoKα","","0.0424","0.0291","","","0.0705","0.0724","","","","","","0.991","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005344","8.709","0.004","11.067","0.002","13.459","0.007","87.88","0.02","75.51","0.04","77.53","0.02","1226.1","0.9","150","2","150","2","","","","","","","","6","P -1","-P 1","2","N-(2-(2-pyridyl)ethyl) 1'- (diphennylphosphino)ferrocenecarboxamide","N-[2-(2-pyridyl)ethyl] 1'-(diphennylphosphino)ferrocenecarboxamide","","- C30 H27 Fe N2 O P -","- C30 H27 Fe N2 O P -","- C60 H54 Fe2 N4 O2 P2 -","2","1","","Kühnert, Janett; Dusek, Michal; Demel, Jan; Lang, Heinrich; Stepnicka, Petr","Synthesis, coordination and catalytic use of 1-(diphenylphosphino)-1'-carbamoylferrocenes with pyridyl-containing N-substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2802","2811","10.1039/b701012e","","","0.71073","MoKα","","0.0549","0.0308","","","0.0624","0.0646","","","","","","0.882","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005345","11.069","0.002","12.65","0.003","13.042","0.004","93.48","0.02","102.39","0.02","91.18","0.02","1779.3","0.8","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C64 H56 Cl14 Fe2 N4 O2 P2 Pd -","- C60 H54 Cl2 Fe2 N4 O2 P2 Pd -","- C60 H54 Cl2 Fe2 N4 O2 P2 Pd -","1","0.5","","Kühnert, Janett; Dusek, Michal; Demel, Jan; Lang, Heinrich; Stepnicka, Petr","Synthesis, coordination and catalytic use of 1-(diphenylphosphino)-1'-carbamoylferrocenes with pyridyl-containing N-substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2802","2811","10.1039/b701012e","","","0.71073","MoKα","","0.0446","0.0329","","","0.0962","0.0982","","","","","","0.984","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005346","9.343","0.002","10.403","0.003","15.822","0.005","100.4","0.02","99.44","0.02","93.87","0.02","1484.6","0.7","150","2","150","2","","","","","","","","8","P -1","-P 1","2","trans-dichloro(N-(2-(pyrid-2-yl-kappa.N)methyl) 1'- (diphenylphosphino-kappa.P)ferrocenecarboxamide) -acetic acid (1/1)","trans-dichloro[N-{2-(pyrid-2-yl-kappa.N)methyl} 1'-(diphenylphosphino-kappa.P)ferrocenecarboxamide] - acetic acid (1/1)","","- C31 H29 Cl2 Fe N2 O3 P Pd -","- C31 H29 Cl2 Fe N2 O3 P Pd -","- C62 H58 Cl4 Fe2 N4 O6 P2 Pd2 -","2","1","","Kühnert, Janett; Dusek, Michal; Demel, Jan; Lang, Heinrich; Stepnicka, Petr","Synthesis, coordination and catalytic use of 1-(diphenylphosphino)-1'-carbamoylferrocenes with pyridyl-containing N-substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2802","2811","10.1039/b701012e","","","0.71073","MoKα","","0.0462","0.0253","","","0.0475","0.049","","","","","","0.887","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005347","12.541","0.001","17.3","0.003","21.57","0.004","90","","101.99","0.01","90","","4577.7","1.2","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C68 H62 Cl28 Fe2 N4 O2 P2 Pd2 -","- C68 H62 Cl28 Fe2 N4 O2 P2 Pd2 -","- C136 H124 Cl56 Fe4 N8 O4 P4 Pd4 -","2","0.5","","Kühnert, Janett; Dusek, Michal; Demel, Jan; Lang, Heinrich; Stepnicka, Petr","Synthesis, coordination and catalytic use of 1-(diphenylphosphino)-1'-carbamoylferrocenes with pyridyl-containing N-substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2802","2811","10.1039/b701012e","","","0.71073","MoKα","","0.0795","0.0435","","","0.1252","0.1308","","","","","","1.064","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005348","12.126","0.005","14.786","0.006","15.987","0.006","90","","92.446","0.006","90","","2864","2","113.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H31 I2 N4 O3 Rh -","- C27 H31 I2 N4 O3 Rh -","- C108 H124 I8 N16 O12 Rh4 -","4","1","","Fujihara, Tetsuaki; Obora, Yasushi; Tokunaga, Makoto; Tsuji, Yasushi","Rhodium(III) complexes with a bidentate N-heterocyclic carbene ligand bearing flexible dendritic frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1567","1569","10.1039/b701104k","","","0.7107","MoKα","","","0.0417","","","","0.0976","","","","","","0.993","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005349","9.338","0.004","13.972","0.006","20.243","0.008","72.083","0.012","85.573","0.014","78.379","0.009","2461.2","1.8","113.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C53 H50 I2 N5 O6 Rh -","- C53 H50 I2 N5 O6 Rh -","- C106 H100 I4 N10 O12 Rh2 -","2","1","","Fujihara, Tetsuaki; Obora, Yasushi; Tokunaga, Makoto; Tsuji, Yasushi","Rhodium(III) complexes with a bidentate N-heterocyclic carbene ligand bearing flexible dendritic frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1567","1569","10.1039/b701104k","","","0.7107","MoKα","","","0.0426","","","","0.1017","","","","","","1.072","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005350","9.685","0.002","13.321","0.003","12.691","0.003","90","","94.34","0.002","90","","1632.6","0.6","113.1","","","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C11 H15 I2 N4 O2 Rh -","- C11 H15 I2 N4 O2 Rh -","- C44 H60 I8 N16 O8 Rh4 -","4","1","","Fujihara, Tetsuaki; Obora, Yasushi; Tokunaga, Makoto; Tsuji, Yasushi","Rhodium(III) complexes with a bidentate N-heterocyclic carbene ligand bearing flexible dendritic frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1567","1569","10.1039/b701104k","","","0.7107","MoKα","","","0.0192","","","","0.0591","","","","","","1.088","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005351","17.399","0.005","13.501","0.004","14.678","0.005","90","","90.611","0.015","90","","3447.7","1.8","93","","93","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H42 Cu N10 O10 Ru -","- C32 H42 Cu N10 O10 Ru -","- C128 H168 Cu4 N40 O40 Ru4 -","4","0.5","","White, Vivienne A.; Johnstone, Russell D. L.; McCall, Keri L.; Long, Nicholas J.; Slawin, Alexandra M. Z.; Robertson, Neil","Binuclear and trinuclear complexes of exoO(2)-cyclam.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2942","2948","10.1039/b701166k","","","0.71073","MoKα","","0.1089","0.0873","","0.1016","0.093","0.093","","","","","","1.0608","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005352","18.942","0.003","8.7935","0.0013","27.143","0.004","90","","109.138","0.008","90","","4271.2","1.1","110","2","110","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C43 H35 B7 F3 Fe2 N O6 P2 -","- C43 H35 B7 F3 Fe2 N O6 P2 -","- C172 H140 B28 F12 Fe8 N4 O24 P8 -","4","1","","Franken, Andreas; Hodson, Bruce E.; McGrath, Thomas D.; Stone, F Gordon A","Synthesis and reactivity of fluorinated ferracarborane anions.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2254","2262","10.1039/b701219e","","","0.71073","MoKα","","0.086","0.0483","","","0.085","0.1003","","","","","","1.016","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005353","16.6161","0.0009","13.4715","0.0008","20.3842","0.001","90","","106.618","0.003","90","","4372.3","0.4","110","2","110","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C43 H35 B7 F3 Fe2 N O6 P2 -","- C43 H35 B7 F3 Fe2 N O6 P2 -","- C172 H140 B28 F12 Fe8 N4 O24 P8 -","4","1","","Franken, Andreas; Hodson, Bruce E.; McGrath, Thomas D.; Stone, F Gordon A","Synthesis and reactivity of fluorinated ferracarborane anions.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2254","2262","10.1039/b701219e","","","0.71073","MoKα","","0.1515","0.0823","","","0.1929","0.2279","","","","","","1.128","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005354","11.074","0.005","12.705","0.005","16.503","0.007","89.392","0.012","75.878","0.012","84.497","0.012","2241.1","1.6","110","2","110","2","","","","","","","","8","P -1","-P 1","2","","","","- C43 H34 B7 F4 Fe2 N O6 P2 -","- C43 H34.02 B7 F3.98 Fe2 N O6 P2 -","- C86 H68.04 B14 F7.96 Fe4 N2 O12 P4 -","2","1","","Franken, Andreas; Hodson, Bruce E.; McGrath, Thomas D.; Stone, F Gordon A","Synthesis and reactivity of fluorinated ferracarborane anions.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2254","2262","10.1039/b701219e","","","0.71073","MoKα","","0.102","0.0599","","","0.145","0.1765","","","","","","1.028","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005355","17.3552","0.0013","10.4426","0.0007","22.5348","0.0015","90","","95.363","0.004","90","","4066.2","0.5","110","2","110","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C40 H33 B7 F3 Fe N O3 P2 -","- C40 H33 B7 F3 Fe N O3 P2 -","- C160 H132 B28 F12 Fe4 N4 O12 P8 -","4","1","","Franken, Andreas; Hodson, Bruce E.; McGrath, Thomas D.; Stone, F Gordon A","Synthesis and reactivity of fluorinated ferracarborane anions.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2254","2262","10.1039/b701219e","","","0.71073","MoKα","","0.1264","0.0629","","","0.1166","0.1443","","","","","","1.016","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005356","7.7205","0.0004","30.2753","0.0013","13.3901","0.0006","90","","105.357","0.002","90","","3018.1","0.2","110","2","110","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C6 H5 B7 F3 Fe2 N O6 -","- C6 H5 B7 F3 Fe2 N O6 -","- C48 H40 B56 F24 Fe16 N8 O48 -","8","2","","Franken, Andreas; Hodson, Bruce E.; McGrath, Thomas D.; Stone, F Gordon A","Synthesis and reactivity of fluorinated ferracarborane anions.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2254","2262","10.1039/b701219e","","","0.71073","MoKα","","0.0429","0.0308","","","0.0656","0.0717","","","","","","1.043","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005357","9.902","0.0013","11.1053","0.0014","13.2738","0.0016","76.602","0.008","77.069","0.008","63.929","0.007","1263","0.3","110","2","110","2","","","","","","","","8","P -1","-P 1","2","","","","- C15 H29 B7 F3 Fe2 N2 O4 P -","- C15 H29 B7 F3 Fe2 N2 O4 P -","- C30 H58 B14 F6 Fe4 N4 O8 P2 -","2","1","","Franken, Andreas; Hodson, Bruce E.; McGrath, Thomas D.; Stone, F Gordon A","Synthesis and reactivity of fluorinated ferracarborane anions.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2254","2262","10.1039/b701219e","","","0.71073","MoKα","","0.0936","0.0525","","","0.1135","0.1326","","","","","","1.029","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005358","10.6883","0.001","11.8062","0.001","13.7445","0.001","104.35","0.03","90.04","0.04","115.51","0.04","1505","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C67 H74 Au2 N4 P2 -","- C67 H74 Au2 N4 P2 -","- C67 H74 Au2 N4 P2 -","1","0.5","","Stol, Marianne; Snelders, Dennis J. M.; Kooijman, Huub; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard","A new, easily recyclable arylating agent based on a diphosphino-digold(I) complex.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2589","2593","10.1039/b701271c","","","0.71073","MoKα","","0.0234","0.0208","","","0.0516","0.0527","","","","","","1.088","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005359","11.9928","0.0004","7.5678","0.0003","17.5866","0.0006","90","","90","","90","","1596.14","0.1","273","2","273","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C10 H15 Mn N O6 S3 -","- C10 H15 Mn N O6 S3 -","- C40 H60 Mn4 N4 O24 S12 -","4","1","","Li, Fengyan; Xu, Lin; Gao, Guanggang; Qu, Xiaosu; Yang, Yanyan","A new one-dimensional Mn(II) complex containing two enantiomeric subunits with mixed carboxylate, pyridine and sulfinate bridges.","Dalton transactions (Cambridge, England : 2003)","2007","","17","1661","1664","10.1039/b701346a","","","0.71073","MoKα","","0.035","0.0331","","","0.0896","0.0908","","","","","","1.056","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005360","11.155","0.0003","12.232","0.0004","14.519","0.0004","83.764","0.001","74.61","0.001","63.773","0.001","1713.32","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H34 Cl2 N10 Ni O8 -","- C28 H34 Cl2 N10 Ni O8 -","- C56 H68 Cl4 N20 Ni2 O16 -","2","1","","Lee, Way-Zen; Tseng, Huan-Sheng; Kuo, Ting-Shen","Ligand-controlled nuclearity in nickel bis(benzimidazolyl) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2563","2570","10.1039/b701367a","","","0.71073","MoKα","","0.0625","0.0501","","","0.1359","0.1631","","","","","","1.139","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005361","11.315","0.0001","12.765","0.0002","12.94","0.0002","85.837","0.001","89.379","0.001","69.304","0.001","1743.56","0.04","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H88 N10 Ni2 O15 S2 -","- C68 H84 N10 Ni2 O15 S2 -","- C68 H84 N10 Ni2 O15 S2 -","1","0.5","","Lee, Way-Zen; Tseng, Huan-Sheng; Kuo, Ting-Shen","Ligand-controlled nuclearity in nickel bis(benzimidazolyl) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2563","2570","10.1039/b701367a","","","0.71073","MoKα","","0.0749","0.0672","","","0.1693","0.1756","","","","","","1.188","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005362","16.034","0.0004","22.001","0.0006","16.185","0.0005","90","","104.247","0.002","90","","5533.9","0.3","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H53 Cl N10 Ni2 O13 -","- C42 H53 Cl N10 Ni2 O13 -","- C168 H212 Cl4 N40 Ni8 O52 -","4","1","","Lee, Way-Zen; Tseng, Huan-Sheng; Kuo, Ting-Shen","Ligand-controlled nuclearity in nickel bis(benzimidazolyl) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2563","2570","10.1039/b701367a","","","0.71073","MoKα","","0.1578","0.0909","","","0.2538","0.3015","","","","","","1.082","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005363","20.0019","0.0003","21.339","0.0005","15.992","0.0004","90","","128.443","0.001","90","","5346.1","0.2","200","2","200","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C43 H51 Cl N10 Ni2 O7 -","- C43 H51 Cl N10 Ni2 O7 -","- C172 H204 Cl4 N40 Ni8 O28 -","4","0.5","","Lee, Way-Zen; Tseng, Huan-Sheng; Kuo, Ting-Shen","Ligand-controlled nuclearity in nickel bis(benzimidazolyl) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2563","2570","10.1039/b701367a","","","0.71073","MoKα","","0.0563","0.0469","","","0.137","0.1424","","","","","","1.097","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005364","11.973","0.002","19.921","0.004","18.832","0.004","90","","94.64","0.03","90","","4477","1.5","150","2","150","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C38 H48 Cl2 N10 Ni O11 S -","- C38 H48 Cl2 N10 Ni O11 S -","- C152 H192 Cl8 N40 Ni4 O44 S4 -","4","2","","Lee, Way-Zen; Tseng, Huan-Sheng; Kuo, Ting-Shen","Ligand-controlled nuclearity in nickel bis(benzimidazolyl) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2563","2570","10.1039/b701367a","","","0.71073","MoKα","","0.1151","0.087","","","0.2457","0.2795","","","","","","1.063","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005365","8.485","0.0002","11.869","0.0003","12.982","0.0004","113.657","0.001","99.923","0.001","100.447","0.001","1133.25","0.05","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H54 Cl4 N10 Ni2 O4 -","- C40 H54 Cl4 N10 Ni2 O4 -","- C40 H54 Cl4 N10 Ni2 O4 -","1","0.5","","Lee, Way-Zen; Tseng, Huan-Sheng; Kuo, Ting-Shen","Ligand-controlled nuclearity in nickel bis(benzimidazolyl) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2563","2570","10.1039/b701367a","","","0.71073","MoKα","","0.0632","0.0502","","","0.1376","0.1467","","","","","","1.096","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005366","12.381","0.0006","14.638","0.0007","15.553","0.0009","90","","90","","90","","2818.7","0.3","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C28 H33 Cl2 N5 Ni O3 S -","- C28 H33 Cl2 N5 Ni O3 S -","- C112 H132 Cl8 N20 Ni4 O12 S4 -","4","1","","Lee, Way-Zen; Tseng, Huan-Sheng; Kuo, Ting-Shen","Ligand-controlled nuclearity in nickel bis(benzimidazolyl) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2563","2570","10.1039/b701367a","","","0.71073","MoKα","","0.0971","0.0614","","","0.1321","0.1615","","","","","","1.039","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005367","8.967","0.002","14.267","0.004","15.313","0.004","96.09","0.02","97.72","0.02","94.94","0.03","1920.3","0.9","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H36 N6 Ni O5 P2 S4 -","- C35 H36 N6 Ni O5 P2 S4 -","- C70 H72 N12 Ni2 O10 P4 S8 -","2","1","","Aragoni, M. Carla; Arca, Massimiliano; Devillanova, Francesco A.; Hursthouse, Michael B.; Huth, Susanne L.; Isaia, Francesco; Lippolis, Vito; Mancini, Annalisa; Soddu, Serena; Verani, Gaetano","Investigation into the reactivity of the coordinatively unsaturated phosphonodithioato [Ni(MeOpdt)2] towards 2,4,6-tris(2-pyridyl)-1,3,5-triazine: goals and achievements.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2127","2134","10.1039/b701458a","","","0.71073","MoKα","","0.1435","0.0745","","","0.109","0.125","","","","","","1.016","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005368","16.8179","0.0003","17.2357","0.0003","19.2582","0.0003","90","","92.892","0.001","90","","5575.23","0.16","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C52 H52 N12 Ni O8 P2 S4 -","- C52 H52 N12 Ni O8 P2 S4 -","- C208 H208 N48 Ni4 O32 P8 S16 -","4","1","","Aragoni, M. Carla; Arca, Massimiliano; Devillanova, Francesco A.; Hursthouse, Michael B.; Huth, Susanne L.; Isaia, Francesco; Lippolis, Vito; Mancini, Annalisa; Soddu, Serena; Verani, Gaetano","Investigation into the reactivity of the coordinatively unsaturated phosphonodithioato [Ni(MeOpdt)2] towards 2,4,6-tris(2-pyridyl)-1,3,5-triazine: goals and achievements.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2127","2134","10.1039/b701458a","","","0.71073","MoKα","","0.0798","0.0445","","","0.1021","0.1161","","","","","","1.016","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005369","13.8112","0.0007","10.7778","0.0004","7.2354","0.0003","90","","99.16","0.002","90","","1063.29","0.08","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 Ni O4 P2 S4 -","- C16 H20 Ni O4 P2 S4 -","- C32 H40 Ni2 O8 P4 S8 -","2","0.5","","Aragoni, M. Carla; Arca, Massimiliano; Devillanova, Francesco A.; Hursthouse, Michael B.; Huth, Susanne L.; Isaia, Francesco; Lippolis, Vito; Mancini, Annalisa; Soddu, Serena; Verani, Gaetano","Investigation into the reactivity of the coordinatively unsaturated phosphonodithioato [Ni(MeOpdt)2] towards 2,4,6-tris(2-pyridyl)-1,3,5-triazine: goals and achievements.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2127","2134","10.1039/b701458a","","","0.71073","MoKα","","0.0442","0.0327","","","0.0677","0.0722","","","","","","1.063","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005370","10.7548","0.0013","15.3966","0.0019","25.22","0.002","90","","91.758","0.009","90","","4174.1","0.8","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H24 I6 N12 Ni -","- C36 H24 I6 N12 Ni -","- C144 H96 I24 N48 Ni4 -","4","1","","Aragoni, M. Carla; Arca, Massimiliano; Devillanova, Francesco A.; Hursthouse, Michael B.; Huth, Susanne L.; Isaia, Francesco; Lippolis, Vito; Mancini, Annalisa; Soddu, Serena; Verani, Gaetano","Investigation into the reactivity of the coordinatively unsaturated phosphonodithioato [Ni(MeOpdt)2] towards 2,4,6-tris(2-pyridyl)-1,3,5-triazine: goals and achievements.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2127","2134","10.1039/b701458a","","","0.71073","MoKα","","0.065","0.0427","","","0.0904","0.1016","","","","","","1.021","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005371","27.215","0.005","8.5211","0.0017","17.543","0.004","90","","92.96","0.03","90","","4062.8","1.4","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H24 Br4 N12 Ni2 -","- C36 H24 Br4 N12 Ni2 -","- C144 H96 Br16 N48 Ni8 -","4","0.5","","Aragoni, M. Carla; Arca, Massimiliano; Devillanova, Francesco A.; Hursthouse, Michael B.; Huth, Susanne L.; Isaia, Francesco; Lippolis, Vito; Mancini, Annalisa; Soddu, Serena; Verani, Gaetano","Investigation into the reactivity of the coordinatively unsaturated phosphonodithioato [Ni(MeOpdt)2] towards 2,4,6-tris(2-pyridyl)-1,3,5-triazine: goals and achievements.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2127","2134","10.1039/b701458a","","","0.71073","MoKα","","0.0466","0.037","","","0.0966","0.1007","","","","","","1.09","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005372","21.018","0.005","7.6267","0.0016","16.295","0.004","90","","104.475","0.005","90","","2529.1","1","153","2","153","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C18 H33 Cl Mn0.5 N6 Ni O4.5 S2 -","- C18 H33 Cl Mn0.5 N6 Ni O4.5 S2 -","- C72 H132 Cl4 Mn2 N24 Ni4 O18 S8 -","4","1","","Bieńko, Alina; Kłak, Julia; Mroziński, Jerzy; Boca, Roman; Brüdgam, Irene; Hartl, Hans","Trinuclear thiocyanate-bridged compounds of the type [ML]2[Mn(NCS)4](ClO4)2 (where M = Cu(II), Ni(II); L = N-dl-5,7,7,12,14,14-hexamethyl-1,4,8,11-tetraazacyclotetradeca-4,11-diene).","Dalton transactions (Cambridge, England : 2003)","2007","","25","2681","2688","10.1039/b701465a","","","0.71073","MoKα","","0.0903","0.0486","","","0.1141","0.1329","","","","","","1.035","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005373","41.297","0.009","7.5712","0.0017","16.417","0.004","90","","96.972","0.005","90","","5095","2","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C18 H32 Cl Cu Mn0.5 N6 O4 S2 -","- C18 H32 Cl Cu Mn0.5 N6 O4 S2 -","- C144 H256 Cl8 Cu8 Mn4 N48 O32 S16 -","8","1","","Bieńko, Alina; Kłak, Julia; Mroziński, Jerzy; Boca, Roman; Brüdgam, Irene; Hartl, Hans","Trinuclear thiocyanate-bridged compounds of the type [ML]2[Mn(NCS)4](ClO4)2 (where M = Cu(II), Ni(II); L = N-dl-5,7,7,12,14,14-hexamethyl-1,4,8,11-tetraazacyclotetradeca-4,11-diene).","Dalton transactions (Cambridge, England : 2003)","2007","","25","2681","2688","10.1039/b701465a","","","0.71073","MoKα","","0.0678","0.0382","","","0.0896","0.1052","","","","","","0.96","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005374","9.2919","0.0004","9.2919","0.0004","9.2919","0.0004","90","","90","","90","","802.26","0.06","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","4","P 21 3","P 2ac 2ab 3","198","","","","- C7 H16 B N -","- C7 H16 B N -","- C28 H64 B4 N4 -","4","0.333333","","Wann, Derek A.; Blockhuys, Frank; Van Alsenoy, Christian; Robertson, Heather E.; Himmel, Hans-Jörg; Tang, Christina Y.; Cowley, Andrew R.; Downs, Anthony J.; Rankin, David W. H.","Molecular structures of free quinuclidine and its adducts with metal trihydrides, MH3 (M=B, Al or Ga), studied by gas-phase electron diffraction, X-ray diffraction and quantum chemical calculations.","Dalton transactions (Cambridge, England : 2003)","2007","","17","1687","1696","10.1039/b701476g","","","0.71073","MoKα","","0.0475","0.0333","","0.0471","0.0354","0.0354","","","","","","1.1445","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005375","5.966","0.0007","3.884","0.0005","26.33","0.002","90","","94.788","0.008","90","","607.99","0.12","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H12 N2 O2 -","- C16 H12 N2 O2 -","- C32 H24 N4 O4 -","2","0.5","","Maji, Somnath; Sarkar, Biprajit; Mobin, Shaikh M.; Fiedler, Jan; Kaim, Wolfgang; Lahiri, Goutam Kumar","Non-innocent behaviour of ancillary and bridging ligands in homovalent and mixed-valent ruthenium complexes [A2Ru(?-L)RuA2]n, A = 2,4-pentanedionato or 2-phenylazopyridine, L2? = 2,5-bis(2-oxidophenyl)pyrazine","Dalton Transactions","2007","","23","2411","","10.1039/b701511a","","","0.71073","MoKα","","0.2034","0.0517","","","0.0972","0.1372","","","","","","0.983","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005376","39.887","0.003","14.955","0.0012","22.318","0.0018","90","","113.966","0.001","90","","12165.2","1.7","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C58.25 H63.25 Cl6.75 Co2 N4 O8.5 -","- C58.25 H62 Cl6.75 Co2 N4 O8.5 -","- C466 H496 Cl54 Co16 N32 O68 -","8","1","","Clegg, Jack K.; Bray, David J.; Gloe, Kerstin; Gloe, Karsten; Hayter, Michael J.; Jolliffe, Katrina A.; Lawrance, Geoffrey A.; Meehan, George V.; McMurtrie, John C.; Lindoy, Leonard F.; Wenzel, Marco","Neutral (bis-beta-diketonato) iron(III), cobalt(II), nickel(II), copper(II) and zinc(II) metallocycles: structural, electrochemical and solvent extraction studies.","Dalton transactions (Cambridge, England : 2003)","2007","","17","1719","1730","10.1039/b701575e","","","0.71073","MoKα","","0.1084","0.0685","","","0.133","0.1506","","","","","","1.055","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005377","12.434","0.007","17.76","0.01","18.194","0.01","111.153","0.01","107.481","0.009","102.511","0.01","3327","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H84 N4 O8 Zn2 -","- C68 H84 N4 O8 Zn2 -","- C136 H168 N8 O16 Zn4 -","2","1","","Clegg, Jack K.; Bray, David J.; Gloe, Kerstin; Gloe, Karsten; Hayter, Michael J.; Jolliffe, Katrina A.; Lawrance, Geoffrey A.; Meehan, George V.; McMurtrie, John C.; Lindoy, Leonard F.; Wenzel, Marco","Neutral (bis-beta-diketonato) iron(III), cobalt(II), nickel(II), copper(II) and zinc(II) metallocycles: structural, electrochemical and solvent extraction studies.","Dalton transactions (Cambridge, England : 2003)","2007","","17","1719","1730","10.1039/b701575e","","","0.71073","MoKα","","0.1247","0.0635","","","0.1659","0.2032","","","","","","1.015","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005378","12.204","0.0016","17.332","0.002","18.061","0.002","117.185","0.002","99.516","0.002","102.001","0.002","3171.7","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H84 N4 Ni2 O8 -","- C68 H84 N4 Ni2 O8 -","- C136 H168 N8 Ni4 O16 -","2","1","","Clegg, Jack K.; Bray, David J.; Gloe, Kerstin; Gloe, Karsten; Hayter, Michael J.; Jolliffe, Katrina A.; Lawrance, Geoffrey A.; Meehan, George V.; McMurtrie, John C.; Lindoy, Leonard F.; Wenzel, Marco","Neutral (bis-beta-diketonato) iron(III), cobalt(II), nickel(II), copper(II) and zinc(II) metallocycles: structural, electrochemical and solvent extraction studies.","Dalton transactions (Cambridge, England : 2003)","2007","","17","1719","1730","10.1039/b701575e","","","0.71073","MoKα","","0.086","0.051","","","0.1368","0.1594","","","","","","1.034","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005379","15.296","0.0019","16.55","0.002","15.081","0.0019","90","","90","","90","","3817.7","0.8","150","2","150","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C42 H42 N2 O8 Zn2 -","- C42 H42 N2 O8 Zn2 -","- C168 H168 N8 O32 Zn8 -","4","0.5","","Clegg, Jack K.; Bray, David J.; Gloe, Kerstin; Gloe, Karsten; Hayter, Michael J.; Jolliffe, Katrina A.; Lawrance, Geoffrey A.; Meehan, George V.; McMurtrie, John C.; Lindoy, Leonard F.; Wenzel, Marco","Neutral (bis-beta-diketonato) iron(III), cobalt(II), nickel(II), copper(II) and zinc(II) metallocycles: structural, electrochemical and solvent extraction studies.","Dalton transactions (Cambridge, England : 2003)","2007","","17","1719","1730","10.1039/b701575e","","","0.71073","MoKα","","0.0513","0.0357","","","0.0955","0.1065","","","","","","1.034","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005380","12.2678","0.0013","17.4001","0.0019","18.1212","0.0019","117.271","0.002","100.105","0.001","101.529","0.002","3206.6","0.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H84 Co2 N4 O8 -","- C68 H84 Co2 N4 O8 -","- C136 H168 Co4 N8 O16 -","2","1","","Clegg, Jack K.; Bray, David J.; Gloe, Kerstin; Gloe, Karsten; Hayter, Michael J.; Jolliffe, Katrina A.; Lawrance, Geoffrey A.; Meehan, George V.; McMurtrie, John C.; Lindoy, Leonard F.; Wenzel, Marco","Neutral (bis-beta-diketonato) iron(III), cobalt(II), nickel(II), copper(II) and zinc(II) metallocycles: structural, electrochemical and solvent extraction studies.","Dalton transactions (Cambridge, England : 2003)","2007","","17","1719","1730","10.1039/b701575e","","","0.71073","MoKα","","0.061","0.044","","","0.1107","0.1217","","","","","","1.024","","","","has coordinates,has disorder","192777","2020-10-21","18:00:00",""
"7005381","32.3","0.02","9.811","0.006","14.041","0.01","90","","111.228","0.016","90","","4148","5","93","2","93","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H68 Cl2 P2 Rh2 -","- C40 H68 Cl2 P2 Rh2 -","- C160 H272 Cl8 P8 Rh8 -","4","0.5","","Jimenez-Rodriguez, Cristina; Pogorzelec, Peter J.; Eastham, Graham R.; Slawin, Alexandra M. Z.; Cole-Hamilton, David J.","Rhodium catalysed methanol carbonylation in the presence of bis(ditertiarybutylphosphinomethyl)benzene","Dalton Transactions","2007","","37","4160","","10.1039/b701582h","","","0.71073","MoKα","","0.0933","0.0671","","","0.1517","0.1669","","","","","","1.012","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005382","8.476","0.003","10.474","0.004","16.257","0.006","77.071","0.007","75.674","0.007","74.635","0.006","1328.9","0.9","125","2","125","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H44 Cl O P2 Rh -","- C25 H44 Cl O P2 Rh -","- C50 H88 Cl2 O2 P4 Rh2 -","2","1","","Jimenez-Rodriguez, Cristina; Pogorzelec, Peter J.; Eastham, Graham R.; Slawin, Alexandra M. Z.; Cole-Hamilton, David J.","Rhodium catalysed methanol carbonylation in the presence of bis(ditertiarybutylphosphinomethyl)benzene","Dalton Transactions","2007","","37","4160","","10.1039/b701582h","","","0.71073","MoKα","","0.1202","0.0537","","","0.0971","0.1076","","","","","","0.764","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005383","12.2158","0.0012","12.7064","0.0013","19.6855","0.0019","102.122","0.002","106.79","0.002","100.582","0.002","2760.9","0.5","125","2","125","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H44 I O P2 Rh -","- C25 H44 I O P2 Rh -","- C100 H176 I4 O4 P8 Rh4 -","4","2","","Jimenez-Rodriguez, Cristina; Pogorzelec, Peter J.; Eastham, Graham R.; Slawin, Alexandra M. Z.; Cole-Hamilton, David J.","Rhodium catalysed methanol carbonylation in the presence of bis(ditertiarybutylphosphinomethyl)benzene","Dalton Transactions","2007","","37","4160","","10.1039/b701582h","","","0.71073","MoKα","","0.0619","0.043","","","0.0997","0.107","","","","","","0.966","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005384","9.9029","0.0012","11.3875","0.0014","34.978","0.004","87.539","0.002","86.579","0.002","76.306","0.002","3823.8","0.8","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H50 I6 P2 -","- C26 H50 I6 P2 -","- C104 H200 I24 P8 -","4","2","","Jimenez-Rodriguez, Cristina; Pogorzelec, Peter J.; Eastham, Graham R.; Slawin, Alexandra M. Z.; Cole-Hamilton, David J.","Rhodium catalysed methanol carbonylation in the presence of bis(ditertiarybutylphosphinomethyl)benzene","Dalton Transactions","2007","","37","4160","","10.1039/b701582h","","","0.71073","MoKα","","0.0745","0.0508","","","0.1058","0.1135","","","","","","1.043","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005385","8.3007","0.0007","11.7644","0.0009","37.825","0.003","83.566","0.003","86.832","0.003","89.997","0.003","3664.8","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","bis(ethylenedithio)tetrathiafulvalene mercury(ii) thiocyanate","","","- C23 H16 Hg N3 S19 -","- C23 H16 Hg N3 S19 -","- C92 H64 Hg4 N12 S76 -","4","2","","Schlueter, John A.; Geiser, Urs; Whited, Michael A.; Drichko, Natalia; Salameh, Belal; Petukhov, Konstantin; Dressel, Martin","Two alternating BEDT-TTF packing motifs in alpha-kappa-(BEDT-TTF)2Hg(SCN)3.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2580","2588","10.1039/b701641g","","","0.71073","MoKα","","0.0928","0.079","","","0.2194","0.2243","","","","","","1.611","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005386","11.052","0.003","22.395","0.007","12.428","0.004","90","","102.388","0.005","90","","3004.4","1.6","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H29 N5 O2 P Ru -","- C34 H29 N5 O2 P Ru -","- C136 H116 N20 O8 P4 Ru4 -","4","1","","Pointillart, Fabrice; Bernot, Kevin; Sorace, Lorenzo; Sessoli, Roberta; Gatteschi, Dante","Ferromagnetic interactions in Ru(III)-nitronyl nitroxide radical complex: a potential 2p4d building block for molecular magnets.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2689","2695","10.1039/B701657C","","","0.71073","MoKα","","0.0592","0.049","","","0.12","0.1279","","","","","","1.16","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005387","15.492","0.004","18.354","0.005","19.038","0.006","112.12","0.004","93.65","0.005","100.473","0.006","4879","2","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H45 Cl N5 O10 P Ru -","- C46 H45 Cl N5 O10 P Ru -","- C184 H180 Cl4 N20 O40 P4 Ru4 -","4","2","","Pointillart, Fabrice; Bernot, Kevin; Sorace, Lorenzo; Sessoli, Roberta; Gatteschi, Dante","Ferromagnetic interactions in Ru(III)-nitronyl nitroxide radical complex: a potential 2p4d building block for molecular magnets.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2689","2695","10.1039/B701657C","","","0.71073","MoKα","","0.2252","0.0714","","","0.1532","0.201","","","","","","0.856","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005388","16.3589","0.0005","20.2605","0.0006","38.621","0.001","90","","90","","90","","12800.5","0.6","100","1","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C103.5 H129.5 Au4 Cl15 O26 P4 -","- C103.5 H129.5 Au4 Cl15 O26 P4 -","- C414 H518 Au16 Cl60 O104 P16 -","4","1","","Poorters, Laurent; Armspach, Dominique; Matt, Dominique; Toupet, Loïc","alpha-TEPHOS: a cyclodextrin-derived tetraphosphine for multiple metal binding.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3195","3202","10.1039/b701684k","","","0.71073","MoKα","","0.1224","0.0947","","","0.2089","0.227","","","","","","1.148","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005389","39.3856","0.0011","19.755","0.0006","20.7631","0.0005","90","","116.655","0.001","90","","14438.1","0.7","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C59 H54 Cl6 Mn3 N14 O12 W -","- C59 H36 Cl6 Mn3 N14 O11.98 W -","- C472 H288 Cl48 Mn24 N112 O95.84 W8 -","8","1","","Ko, Hyun Hee; Lim, Jeong Hak; Yoo, Houng Sik; Kang, Jun Sung; Kim, Hyoung Chan; Koh, Eui Kwan; Hong, Chang Seop","Two WV-MnIII bimetallic assemblies built by octacyanotungstate(v) and MnIII Schiff bases: molecular structures and a spin-flop transition.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2070","2076","10.1039/b701704a","","","0.71073","MoKα","","0.124","0.0601","","","0.1453","0.1773","","","","","","1.052","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7005390","14.2217","0.0004","13.3935","0.0003","43.7623","0.0011","90","","97.799","0.002","90","","8258.7","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C74 H88 Mn3 N14 O20 W -","- C74 H72 Mn3 N14 O20 W -","- C296 H288 Mn12 N56 O80 W4 -","4","1","","Ko, Hyun Hee; Lim, Jeong Hak; Yoo, Houng Sik; Kang, Jun Sung; Kim, Hyoung Chan; Koh, Eui Kwan; Hong, Chang Seop","Two WV-MnIII bimetallic assemblies built by octacyanotungstate(v) and MnIII Schiff bases: molecular structures and a spin-flop transition.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2070","2076","10.1039/b701704a","","","0.71073","MoKα","","0.2498","0.0778","","","0.1982","0.2679","","","","","","0.925","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7005391","11.1115","0.0006","14.8951","0.0008","17.5202","0.0009","90","","90","","90","","2899.7","0.3","173","2","173","2","","","","","","","","5","A m a 2","A 2 -2a","40","","","","- C8 H23 B9 I8 N2 -","- C8 H23 B9 I8 N2 -","- C32 H92 B36 I32 N8 -","4","0.5","","Teixidor, Francesc; Barberà, Gemma; Kivekäs, Raikko; Sillanpää, Reijo; Viñas, Clara","""Water-stable boron-iodinated dicarbollide dianions [7,8-nido-C2H2B9I9]2- and [7,8-nido-C2H2B9I8H]2-"".","Dalton transactions (Cambridge, England : 2003)","2007","","17","1668","1670","10.1039/b701787a","","x-ray","0.71073","Mokα","","0.0562","0.0407","","","0.0855","0.0923","","","","","","1.04","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005392","10.444","0.002","10.444","0.002","10.444","0.002","90","","90","","90","","1139.2","0.4","","","","","","","","","","","","4","F d -3 m :1","F 4d 2 3 -1d","227","","","","- Ca16 F8 Nb16 O48 -","- Ca16 F8 Nb16 O48 -","- Ca16 F8 Nb16 O48 -","","","","Françoise Le Berre; Marie-Pierre Crosnier-Lopez; Cyrille Galven; Jean-Louis Fourquet; Christophe Legein; Monique Body; Jean-Yves Buzaré","Ca2+/vacancies and O2?/F? ordering in new oxyfluoride pyrochlores Li2xCa1.5?x?0.5?xM2O6F (M = Nb,Ta) for 0 ?x? 0.5","Dalton Transactions","2007","","23","2457","","10.1039/b701863k","","","","","","","","","","","","","","","","","","","","","has coordinates","208167","2020-10-21","18:00:00",""
"7005393","10.4506","0.0007","10.4506","0.0007","10.4506","0.0007","90","","90","","90","","1141.36","0.13","","","","","","","","","","","","4","P 43 3 2","P 4acd 2ab 3","212","","","","- Ca12 F8 Nb16 O48 -","- Ca12 F8 Nb16 O48 -","- Ca12 F8 Nb16 O48 -","","","","Françoise Le Berre; Marie-Pierre Crosnier-Lopez; Cyrille Galven; Jean-Louis Fourquet; Christophe Legein; Monique Body; Jean-Yves Buzaré","Ca2+/vacancies and O2?/F? ordering in new oxyfluoride pyrochlores Li2xCa1.5?x?0.5?xM2O6F (M = Nb,Ta) for 0 ?x? 0.5","Dalton Transactions","2007","","23","2457","","10.1039/b701863k","","","","","","","","","","","","","","","","","","","","","has coordinates","203899","2020-10-21","18:00:00",""
"7005394","14.8938","0.0007","22.594","0.001","35.296","0.002","90","","101.776","0.004","90","","11627.5","1","100","1","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C133 H148 N16 O22 -","- C133 H148 N16 O22 -","- C532 H592 N64 O88 -","4","0.5","","Halime, Zakaria; Lachkar, Mohammed; Toupet, Loïc; Coutsolelos, Athanassios G.; Boitrel, Bernard","Coordination and structural studies of crowned-porphyrins.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3684","3689","10.1039/b701889d","","","0.71073","MoKα","","0.168","0.1095","","","0.3279","0.3504","","","","","","1.14","","","","has coordinates,has disorder","179757","2020-10-21","18:00:00",""
"7005395","23.755","0.001","8.6928","0.0004","30.912","0.001","90","","108.134","0.001","90","","6066.2","0.4","100","1","293","2","","","","","","","","6","P 1 2/a 1","-P 2ya","13","","","","- C63 H63 Cl3 N8 O11 Zn -","- C63 H63 Cl3 N8 O11 Zn -","- C252 H252 Cl12 N32 O44 Zn4 -","4","1","","Halime, Zakaria; Lachkar, Mohammed; Toupet, Loïc; Coutsolelos, Athanassios G.; Boitrel, Bernard","Coordination and structural studies of crowned-porphyrins.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3684","3689","10.1039/b701889d","","","0.71069","MoKα","","0.0995","0.043","","","0.0996","0.1073","","","","","","0.861","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005396","17.2553","0.0004","20.8685","0.0005","18.5943","0.0005","90","","101.284","0.002","90","","6566.2","0.3","120","1","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C64 H64 Cl6 N8 O11 Pb -","- C64 H64 Cl6 N8 O11 Pb -","- C256 H256 Cl24 N32 O44 Pb4 -","4","1","","Halime, Zakaria; Lachkar, Mohammed; Toupet, Loïc; Coutsolelos, Athanassios G.; Boitrel, Bernard","Coordination and structural studies of crowned-porphyrins.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3684","3689","10.1039/b701889d","","","0.71069","MoKα","","0.0917","0.0484","","","0.1348","0.1413","","","","","","0.995","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005397","14.2001","0.0012","11.2746","0.0006","14.3556","0.001","90","","101.345","0.009","90","","2253.4","0.3","220","2","220","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 Cu2 I2 N6 -","- C18 H24 Cu2 I2 N6 -","- C72 H96 Cu8 I8 N24 -","4","1","","Jess, Inke; Taborsky, Petr; Pospísil, Jirí; Näther, Christian","Synthesis, crystal structure, thermal and luminescence properties of CuX(2,3-dimethylpyrazine) (X=Cl, Br, I) coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2263","2270","10.1039/b701905j","","","0.71073","MoKα","","0.0547","0.0376","","","0.0853","0.0913","","","","","","0.951","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005398","9.8505","0.0005","12.8482","0.0007","13.5837","0.0008","90","","103.152","0.006","90","","1674.08","0.16","220","2","220","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H8 Cu I N2 -","- C6 H8 Cu I N2 -","- C48 H64 Cu8 I8 N16 -","8","2","","Jess, Inke; Taborsky, Petr; Pospísil, Jirí; Näther, Christian","Synthesis, crystal structure, thermal and luminescence properties of CuX(2,3-dimethylpyrazine) (X=Cl, Br, I) coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2263","2270","10.1039/b701905j","","","0.71073","MoKα","","0.0645","0.0363","","","0.0738","0.0821","","","","","","0.976","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005399","4.321","0.0009","17.974","0.003","13.1672","0.0016","90","","92.63","0.03","90","","1021.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H8 Cu2 I2 N2 -","- C6 H8 Cu2 I2 N2 -","- C24 H32 Cu8 I8 N8 -","4","1","","Jess, Inke; Taborsky, Petr; Pospísil, Jirí; Näther, Christian","Synthesis, crystal structure, thermal and luminescence properties of CuX(2,3-dimethylpyrazine) (X=Cl, Br, I) coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2263","2270","10.1039/b701905j","","","0.71073","MoKα","","0.07","0.0325","","","0.0723","0.08","","","","","","0.996","","","","has coordinates","179757","2020-10-21","18:00:00",""
"7005400","18.7077","0.0002","13.95732","0.0001","20.6417","0.0003","90","","90","","90","","5389.74","0.1","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C27 H32 B F4 N5 Pd -","- C27 H32 B F4 N5 Pd -","- C216 H256 B8 F32 N40 Pd8 -","8","1","","Suijkerbuijk, Bart M. J. M.; Aerts, Bas N. H.; Dijkstra, Harm P.; Lutz, Martin; Spek, Anthony L.; van Koten, Gerard; Klein Gebbink, Robertus J. M.","""Click"" 1,2,3-triazoles as tunable ligands for late transition metal complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","13","1273","1276","10.1039/b701978p","","","0.71073","MoKα","","0.0436","0.0263","","","0.0531","0.0591","","","","","","1.035","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005401","18.6226","0.0004","13.9422","0.0007","20.7557","0.0006","90","","90","","90","","5389","0.3","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C27 H32 B F4 N5 Pt -","- C27 H32 B F4 N5 Pt -","- C216 H256 B8 F32 N40 Pt8 -","8","1","","Suijkerbuijk, Bart M. J. M.; Aerts, Bas N. H.; Dijkstra, Harm P.; Lutz, Martin; Spek, Anthony L.; van Koten, Gerard; Klein Gebbink, Robertus J. M.","""Click"" 1,2,3-triazoles as tunable ligands for late transition metal complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","13","1273","1276","10.1039/b701978p","","","0.71073","MoKα","","0.0244","0.0162","","","0.034","0.0371","","","","","","1.053","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005402","11.1861","0.0003","12.05785","0.00013","12.9754","0.0004","78.165","0.001","68.692","0.001","63.542","0.001","1457.75","0.06","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C27.5 H33 B Cl F4 N5 Pt -","- C27.5 H33 B Cl F4 N5 Pt -","- C55 H66 B2 Cl2 F8 N10 Pt2 -","2","1","","Suijkerbuijk, Bart M. J. M.; Aerts, Bas N. H.; Dijkstra, Harm P.; Lutz, Martin; Spek, Anthony L.; van Koten, Gerard; Klein Gebbink, Robertus J. M.","""Click"" 1,2,3-triazoles as tunable ligands for late transition metal complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","13","1273","1276","10.1039/b701978p","","","0.71073","MoKα","","0.0227","0.0182","","","0.0366","0.0377","","","","","","1.049","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005403","10.5401","0.0005","10.8373","0.0005","13.5859","0.0005","90.459","0.002","112.708","0.002","99.581","0.002","1407.14","0.11","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H34 B F4 N5 Pt -","- C28 H34 B F4 N5 Pt -","- C56 H68 B2 F8 N10 Pt2 -","2","1","","Suijkerbuijk, Bart M. J. M.; Aerts, Bas N. H.; Dijkstra, Harm P.; Lutz, Martin; Spek, Anthony L.; van Koten, Gerard; Klein Gebbink, Robertus J. M.","""Click"" 1,2,3-triazoles as tunable ligands for late transition metal complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","13","1273","1276","10.1039/b701978p","","","0.71073","MoKα","","0.0132","0.0117","","","0.0272","0.0276","","","","","","1.074","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005404","11.9866","0.0006","12.5344","0.0006","13.7972","0.0007","66.677","0.004","78.628","0.004","72.036","0.004","1804.07","0.17","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H20 N6 O4 -","- C17 H20 N6 O4 -","- C68 H80 N24 O16 -","4","2","","Klingele, Julia; Prikhod'ko, Alexander I.; Leibeling, Guido; Demeshko, Serhiy; Dechert, Sebastian; Meyer, Franc","Pyrazolate-based copper(II) and nickel(II) [2 x 2] grid complexes: protonation-dependent self-assembly, structures and properties.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2003","2013","10.1039/b701981e","","","0.71073","MoKα","","0.0397","0.0338","","","0.0914","0.0938","","","","","","1.065","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005405","22.8617","0.0011","22.8617","0.0011","13.8078","0.0006","90","","90","","90","","7216.7","0.6","133","2","133","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H72 Cu4 N24 O16 -","- C68 H72 Cu4 N24 O16 -","- C272 H288 Cu16 N96 O64 -","4","0.25","","Klingele, Julia; Prikhod'ko, Alexander I.; Leibeling, Guido; Demeshko, Serhiy; Dechert, Sebastian; Meyer, Franc","Pyrazolate-based copper(II) and nickel(II) [2 x 2] grid complexes: protonation-dependent self-assembly, structures and properties.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2003","2013","10.1039/b701981e","","","0.71073","MoKα","","0.0421","0.0319","","","0.0731","0.0772","","","","","","1.025","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005406","22.7567","0.0009","22.7567","0.0009","13.7394","0.0007","90","","90","","90","","7115.2","0.5","133","2","133","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H72 N24 Ni4 O16 -","- C68 H72 N24 Ni4 O16 -","- C272 H288 N96 Ni16 O64 -","4","0.25","","Klingele, Julia; Prikhod'ko, Alexander I.; Leibeling, Guido; Demeshko, Serhiy; Dechert, Sebastian; Meyer, Franc","Pyrazolate-based copper(II) and nickel(II) [2 x 2] grid complexes: protonation-dependent self-assembly, structures and properties.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2003","2013","10.1039/b701981e","","","0.71073","MoKα","","0.0422","0.0288","","","0.0647","0.0673","","","","","","1.006","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005407","22.8396","0.001","22.8396","0.001","13.7885","0.0007","90","","90","","90","","7192.7","0.6","133","2","133","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C68 H72 Cu2 N24 Ni2 O16 -","- C68 H72 Cu2 N24 Ni2 O16 -","- C272 H288 Cu8 N96 Ni8 O64 -","4","0.25","","Klingele, Julia; Prikhod'ko, Alexander I.; Leibeling, Guido; Demeshko, Serhiy; Dechert, Sebastian; Meyer, Franc","Pyrazolate-based copper(II) and nickel(II) [2 x 2] grid complexes: protonation-dependent self-assembly, structures and properties.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2003","2013","10.1039/b701981e","","","0.71073","MoKα","","0.045","0.0281","","","0.0574","0.0602","","","","","","1.003","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005408","16.542","0.002","26.674","0.004","8.788","0.001","90","","90","","90","","3877.6","0.9","193","2","193","2","","","","","","","","6","I b a 2","I 2 -2c","45","","","","- C8 H26 As N6 Nd Se4 -","- C8 H26 As N6 Nd Se4 -","- C64 H208 As8 N48 Nd8 Se32 -","8","1","","Jia, Dingxian; Zhu, Aimei; Deng, Jie; Zhang, Yong; Dai, Jie","Direct solvothermal growth, crystal structures, and optical properties of one-dimensional lanthanide selenidoarsenate(v) polymers [Ln(dien)2(micro3-AsSe4)] (Ln = Nd, Sm): the first example of an AsSe4(3-) anion acting as a ligand to a lanthanide complex.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2083","2086","10.1039/b701995e","","","0.71073","MoKα","","0.0305","0.0284","","","0.0577","0.0588","","","","","","1.111","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005409","8.8353","0.0008","16.2766","0.0017","26.525","0.003","90","","90","","90","","3814.5","0.7","193","2","193","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C8 H26 As N6 Se4 Sm -","- C8 H13 As N6 Se4 Sm -","- C64 H104 As8 N48 Se32 Sm8 -","8","1","","Jia, Dingxian; Zhu, Aimei; Deng, Jie; Zhang, Yong; Dai, Jie","Direct solvothermal growth, crystal structures, and optical properties of one-dimensional lanthanide selenidoarsenate(v) polymers [Ln(dien)2(micro3-AsSe4)] (Ln = Nd, Sm): the first example of an AsSe4(3-) anion acting as a ligand to a lanthanide complex.","Dalton transactions (Cambridge, England : 2003)","2007","","20","2083","2086","10.1039/b701995e","","","0.71073","MoKα","","0.0678","0.0589","","","0.102","0.1048","","","","","","1.261","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005410","8.603","0.0001","10.641","0.0002","14.761","0.0003","102.936","0.001","100.006","0.001","104.594","0.001","1235.97","0.04","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H54 Cu6 N6 O18 -","- C42 H54 Cu6 N6 O18 -","- C42 H54 Cu6 N6 O18 -","1","0.5","","Burrows, Andrew D.; Cassar, Kevin; Mahon, Mary F.; Warren, John E.","The stepwise formation of mixed-metal coordination networks using complexes of 3-cyanoacetylacetonate.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2499","2509","10.1039/b702074k","","","0.71073","MoKα","","0.0657","0.0387","","","0.0907","0.0997","","","","","","1.043","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005411","15.332","0.0002","13.022","0.0002","21.352","0.0004","90","","113.265","0.001","90","","3916.36","0.11","123","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 Fe N3 O6 -","- C18 H18 Fe N3 O6 -","- C144 H144 Fe8 N24 O48 -","8","2","","Burrows, Andrew D.; Cassar, Kevin; Mahon, Mary F.; Warren, John E.","The stepwise formation of mixed-metal coordination networks using complexes of 3-cyanoacetylacetonate.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2499","2509","10.1039/b702074k","","","0.71073","MoKα","","0.1643","0.0526","","","0.1112","0.146","","","","","","0.958","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005412","7.7735","0.0002","8.421","0.0002","13.4553","0.0004","91.187","0.001","97.692","0.001","117.238","0.001","772.71","0.04","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H12 Ag Cu N3 O7 -","- C12 H12 Ag Cu N3 O7 -","- C24 H24 Ag2 Cu2 N6 O14 -","2","1","","Burrows, Andrew D.; Cassar, Kevin; Mahon, Mary F.; Warren, John E.","The stepwise formation of mixed-metal coordination networks using complexes of 3-cyanoacetylacetonate.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2499","2509","10.1039/b702074k","","","0.6751","Synchrotron","","0.0242","0.0216","","","0.0564","0.0581","","","","","","1.043","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005413","14.046","0.0001","11.322","0.0001","15.011","0.0001","90","","116.65","0.001","90","","2133.57","0.03","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 Ag Fe N4 O9 -","- C18 H18 Ag Fe N4 O9 -","- C72 H72 Ag4 Fe4 N16 O36 -","4","1","","Burrows, Andrew D.; Cassar, Kevin; Mahon, Mary F.; Warren, John E.","The stepwise formation of mixed-metal coordination networks using complexes of 3-cyanoacetylacetonate.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2499","2509","10.1039/b702074k","","","0.71073","MoKα","","0.0305","0.0266","","","0.0691","0.0712","","","","","","1.054","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005414","17.271","0.0002","12.552","0.0002","18.951","0.0003","90","","111.217","0.001","90","","3829.83","0.1","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H36 Ag2 Fe2 N6 O17 -","- C29 H36 Ag2 Fe2 N6 O17 -","- C116 H144 Ag8 Fe8 N24 O68 -","4","1","","Burrows, Andrew D.; Cassar, Kevin; Mahon, Mary F.; Warren, John E.","The stepwise formation of mixed-metal coordination networks using complexes of 3-cyanoacetylacetonate.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2499","2509","10.1039/b702074k","","","0.71073","MoKα","","0.1123","0.0587","","","0.1348","0.1586","","","","","","1.012","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005415","11.1107","0.0005","11.3532","0.0005","13.0922","0.0006","99.941","0.001","93.406","0.001","96.678","0.001","1610.3","0.13","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H30 Ag Fe2 N5 O13 -","- C26 H30 Ag Fe2 N5 O13 -","- C52 H60 Ag2 Fe4 N10 O26 -","2","1","","Burrows, Andrew D.; Cassar, Kevin; Mahon, Mary F.; Warren, John E.","The stepwise formation of mixed-metal coordination networks using complexes of 3-cyanoacetylacetonate.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2499","2509","10.1039/b702074k","","","0.846","Synchrotron","","0.0515","0.0427","","","0.1006","0.1063","","","","","","1.067","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005416","7.6634","0.0005","9.6825","0.0007","27.1105","0.0019","90","","90","","90","","2011.6","0.2","173","2","150","2","","","","","","","","6","P c c m","-P 2 2c","49","","","","- C26 H31.8 Ag Fe2 N4 O11.4 -","- C26 H27 Ag Fe2 N4 O11.4 -","- C52 H54 Ag2 Fe4 N8 O22.8 -","2","0.25","","Burrows, Andrew D.; Cassar, Kevin; Mahon, Mary F.; Warren, John E.","The stepwise formation of mixed-metal coordination networks using complexes of 3-cyanoacetylacetonate.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2499","2509","10.1039/b702074k","","","0.846","Synchrotron","","0.0814","0.0646","","","0.2246","0.242","","","","","","1.036","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005417","3.7884","0.0002","13.4634","0.0006","12.8252","0.0006","90","","93.679","0.001","90","","652.8","0.05","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H6 Ag N O2 -","- C6 H6 Ag N O2 -","- C24 H24 Ag4 N4 O8 -","4","1","","Burrows, Andrew D.; Cassar, Kevin; Mahon, Mary F.; Warren, John E.","The stepwise formation of mixed-metal coordination networks using complexes of 3-cyanoacetylacetonate.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2499","2509","10.1039/b702074k","","","0.6751","Synchrotron","","0.0354","0.0268","","","0.0618","0.0652","","","","","","1.004","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005418","6.3584","0.001","18.8244","0.0011","13.625","0.002","90","","92.281","0.01","90","","1629.5","0.4","150","2","150","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C6 H12 Ag2 N4 S6 W -","- C6 H12 Ag2 N4 S6 W -","- C24 H48 Ag8 N16 S24 W4 -","4","1","","Beheshti, Azizolla; Clegg, William; Dale, Sophie H.; Hyvadi, Reza; Hussaini, Farzanh","Synthesis and characterization of mixed-metal complexes of Ag/Cu and W/Mo and a complex of Ag with heterocyclic thione ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2949","2956","10.1039/b702129a","","","0.71073","MoKα","","0.0894","0.0456","","","0.0902","0.1044","","","","","","1.002","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005419","14.69","0.003","11.06","0.002","21.173","0.004","90","","95.55","0.03","90","","3423.9","1.1","150","2","150","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C20 H40 Ag2 N8 S8 W -","- C20 H40 Ag2 N8 S8 W -","- C80 H160 Ag8 N32 S32 W4 -","4","0.5","","Beheshti, Azizolla; Clegg, William; Dale, Sophie H.; Hyvadi, Reza; Hussaini, Farzanh","Synthesis and characterization of mixed-metal complexes of Ag/Cu and W/Mo and a complex of Ag with heterocyclic thione ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2949","2956","10.1039/b702129a","","","0.71073","MoKα","","0.0278","0.0194","","","0.0358","0.0376","","","","","","1.042","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7005420","14.405","0.0019","11.0792","0.0015","21.036","0.004","90","","99.087","0.002","90","","3315.1","0.9","150","2","150","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C20 H40 Cu2 N8 S8 W -","- C20 H40 Cu2 N8 S8 W -","- C80 H160 Cu8 N32 S32 W4 -","4","0.5","","Beheshti, Azizolla; Clegg, William; Dale, Sophie H.; Hyvadi, Reza; Hussaini, Farzanh","Synthesis and characterization of mixed-metal complexes of Ag/Cu and W/Mo and a complex of Ag with heterocyclic thione ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2949","2956","10.1039/b702129a","","","0.71073","MoKα","","0.0177","0.0167","","","0.0411","0.0415","","","","","","1.088","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7005421","8.6065","0.0007","13.3546","0.0011","13.7726","0.0011","111.035","0.001","107.816","0.001","90.096","0.001","1395.5","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C5 H10 Ag I N2 S -","- C5 H10 Ag I N2 S -","- C30 H60 Ag6 I6 N12 S6 -","6","3","","Beheshti, Azizolla; Clegg, William; Dale, Sophie H.; Hyvadi, Reza; Hussaini, Farzanh","Synthesis and characterization of mixed-metal complexes of Ag/Cu and W/Mo and a complex of Ag with heterocyclic thione ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2949","2956","10.1039/b702129a","","","0.71073","MoKα","","0.0476","0.0438","","","0.1031","0.1048","","","","","","1.201","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7005422","8.6994","0.001","12.5576","0.0013","9.8201","0.0011","90","","100.011","0.003","90","","1056.4","0.2","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H18 F5 N3 O2 V -","- C4 H18 F5 N3 O2 V -","- C16 H72 F20 N12 O8 V4 -","4","1","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","Hydrothermal chemistry of oligomeric vanadium oxyfluorides.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2271","2282","10.1039/b702146a","","","0.71073","MoKα","","0.0418","0.0338","","","0.0741","0.0884","","","","","","1.291","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005423","8.66","0.002","9.16","0.002","11.64","0.003","109.46","0.008","93.61","0.003","91.86","0.008","867.5","0.4","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H26 F10 N4 O2 V2 -","- C6 H26 F10 N4 O2 V2 -","- C12 H52 F20 N8 O4 V4 -","2","1","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","Hydrothermal chemistry of oligomeric vanadium oxyfluorides.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2271","2282","10.1039/b702146a","","","0.71073","MoKα","","0.0748","0.0498","","","0.1485","0.24","","","","","","1.123","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005424","8.884","0.004","9.143","0.004","11.951","0.005","103.008","0.006","108.336","0.008","92.849","0.007","890.2","0.7","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H28 F8 N4 O5 V2 -","- C6 H28 F8 N4 O5 V2 -","- C12 H56 F16 N8 O10 V4 -","2","1","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","Hydrothermal chemistry of oligomeric vanadium oxyfluorides.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2271","2282","10.1039/b702146a","","","0.71073","MoKα","","0.0787","0.0569","","","0.142","0.2354","","","","","","1.004","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005425","8.6285","0.0014","10.6742","0.0018","10.7766","0.0014","90","","96.651","0.005","90","","985.9","0.3","125","2","125","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H16 F6 N3 V -","- C4 H16 F6 N3 V -","- C16 H64 F24 N12 V4 -","4","1","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","Hydrothermal chemistry of oligomeric vanadium oxyfluorides.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2271","2282","10.1039/b702146a","","","0.71073","MoKα","","0.0363","0.0351","","","0.1015","0.1026","","","","","","1.113","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005426","5.5691","0.0018","7.181","0.002","9.391","0.003","101.073","0.012","97.506","0.011","95.107","0.01","362.89","0.19","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H14 F6 N2 O4 V2 -","- C10 H14 F6 N2 O4 V2 -","- C10 H14 F6 N2 O4 V2 -","1","0.5","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","Hydrothermal chemistry of oligomeric vanadium oxyfluorides.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2271","2282","10.1039/b702146a","","","0.71073","MoKα","","0.0321","0.0317","","","0.1376","0.1381","","","","","","1.457","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005427","7.0882","0.0019","21.769","0.005","12.964","0.004","90","","98.95","0.008","90","","1976","0.9","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H18 F6 N2 O4 V2 -","- C6 H18 F6 N2 O4 V2 -","- C36 H108 F36 N12 O24 V12 -","6","1.5","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","Hydrothermal chemistry of oligomeric vanadium oxyfluorides.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2271","2282","10.1039/b702146a","","","0.7107","MoKα","","0.0956","0.0487","","","0.1552","0.1857","","","","","","0.92","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005428","7.9286","0.0019","10.591","0.003","8.497","0.002","90","","97.834","0.006","90","","706.8","0.3","93","2","93","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C6 H22 F8 N4 O2 V2 -","- C6 H22 F8 N4 O2 V2 -","- C12 H44 F16 N8 O4 V4 -","2","0.5","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","Hydrothermal chemistry of oligomeric vanadium oxyfluorides.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2271","2282","10.1039/b702146a","","","0.71073","MoKα","","0.0535","0.0418","","","0.1325","0.173","","","","","","1.602","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005429","9.953","0.003","10.621","0.002","15.3669","0.0005","90","","104.139","0.008","90","","1575.2","0.6","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H42 F14 N8 O7 V4 -","- C12 H42 F14 N8 O7 V4 -","- C24 H84 F28 N16 O14 V8 -","2","0.5","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","Hydrothermal chemistry of oligomeric vanadium oxyfluorides.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2271","2282","10.1039/b702146a","","","0.7107","MoKα","","0.0377","0.0331","","","0.0806","0.0832","","","","","","1.054","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005430","8.275","0.003","9.706","0.0019","10.2315","0.0019","63.134","0.019","85.33","0.03","78.59","0.02","718.6","0.4","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H22 F7 N3 O3 V2 -","- C6 H22 F7 N3 O3 V2 -","- C12 H44 F14 N6 O6 V4 -","2","1","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","Hydrothermal chemistry of oligomeric vanadium oxyfluorides.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2271","2282","10.1039/b702146a","","","0.71073","MoKα","","0.033","0.0309","","","0.0796","0.0806","","","","","","1.048","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005431","14.488","0.002","15.586","0.002","16.1046","0.0001","90","","90","","90","","3636.6","0.7","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","040017","","","- C24 H15 N O S -","- C24 H15 N O S -","- C192 H120 N8 O8 S8 -","8","1","","Schmiege, Benjamin M.; Carney, Michael J.; Small, Brooke L.; Gerlach, Deidra L.; Halfen, Jason A.","Alternatives to pyridinediimine ligands: syntheses and structures of metal complexes supported by donor-modified alpha-diimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2547","2562","10.1039/b702197f","","","0.71073","MoKα","","0.1001","0.0473","","","0.0863","0.1031","","","","","","0.99","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005432","9.336","0.002","12.515","0.0008","23.12","0.003","90","","90","","90","","2701.3","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","040023","","","- C28 H33 Cl2 Fe N3 -","- C28 H33 Cl2 Fe N3 -","- C112 H132 Cl8 Fe4 N12 -","4","1","","Schmiege, Benjamin M.; Carney, Michael J.; Small, Brooke L.; Gerlach, Deidra L.; Halfen, Jason A.","Alternatives to pyridinediimine ligands: syntheses and structures of metal complexes supported by donor-modified alpha-diimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2547","2562","10.1039/b702197f","","","0.71073","MoKα","","0.0674","0.044","","","0.0853","0.0941","","","","","","1.017","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005433","11.348","0.002","15.047","0.003","16.062","0.003","85.13","0.05","77.33","0.04","76.89","0.06","2604.3","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","040026","","","- C28 H24.5 Cl2 Fe N3.5 -","- C28 H24.5 Cl2 Fe N3.5 -","- C112 H98 Cl8 Fe4 N14 -","4","2","","Schmiege, Benjamin M.; Carney, Michael J.; Small, Brooke L.; Gerlach, Deidra L.; Halfen, Jason A.","Alternatives to pyridinediimine ligands: syntheses and structures of metal complexes supported by donor-modified alpha-diimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2547","2562","10.1039/b702197f","","","0.71073","MoKα","","0.0905","0.0552","","","0.1322","0.1584","","","","","","1.019","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005434","12.309","0.001","14.355","0.003","14.553","0.002","89.42","0.02","77.51","0.01","77.48","0.01","2449.1","0.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","040031","","","- C26 H27 Cl2 Fe N3 O -","- C26 H27 Cl2 Fe N3 O -","- C104 H108 Cl8 Fe4 N12 O4 -","4","2","","Schmiege, Benjamin M.; Carney, Michael J.; Small, Brooke L.; Gerlach, Deidra L.; Halfen, Jason A.","Alternatives to pyridinediimine ligands: syntheses and structures of metal complexes supported by donor-modified alpha-diimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2547","2562","10.1039/b702197f","","","0.71073","MoKα","","0.1247","0.068","","","0.146","0.173","","","","","","1.004","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005435","19.107","0.002","16.5813","0.0007","14.816","0.0001","90","","102.74","0.001","90","","4578.4","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","050003","","","- C24 H25 Cl2 Mn N3 -","- C24 H25 Cl2 Mn N3 -","- C192 H200 Cl16 Mn8 N24 -","8","1","","Schmiege, Benjamin M.; Carney, Michael J.; Small, Brooke L.; Gerlach, Deidra L.; Halfen, Jason A.","Alternatives to pyridinediimine ligands: syntheses and structures of metal complexes supported by donor-modified alpha-diimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2547","2562","10.1039/b702197f","","","0.71073","MoKα","","0.0392","0.0312","","","0.0762","0.0803","","","","","","1.04","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005436","10.69","0.002","30.399","0.006","11.998","0.002","90","","90","","90","","3898.9","1.2","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","040028","","","- C42 H43 Cl2 Fe N4 P -","- C42 H43 Cl2 Fe N4 P -","- C168 H172 Cl8 Fe4 N16 P4 -","4","1","","Schmiege, Benjamin M.; Carney, Michael J.; Small, Brooke L.; Gerlach, Deidra L.; Halfen, Jason A.","Alternatives to pyridinediimine ligands: syntheses and structures of metal complexes supported by donor-modified alpha-diimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2547","2562","10.1039/b702197f","","","0.71073","MoKα","","0.0855","0.0503","","","0.093","0.1044","","","","","","1.018","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005437","38.587","0.006","38.587","0.006","10.062","0.002","90","","90","","120","","12975","4","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","040029","","","- C28 H25 Cl2 Fe N3 S -","- C28 H25 Cl2 Fe N3 S -","- C504 H450 Cl36 Fe18 N54 S18 -","18","1","","Schmiege, Benjamin M.; Carney, Michael J.; Small, Brooke L.; Gerlach, Deidra L.; Halfen, Jason A.","Alternatives to pyridinediimine ligands: syntheses and structures of metal complexes supported by donor-modified alpha-diimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2547","2562","10.1039/b702197f","","","0.71073","MoKα","","0.1886","0.082","","","0.2008","0.255","","","","","","1.007","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005438","10.463","0.001","25.473","0.002","12.291","0.002","90","","95.59","0.02","90","","3260.3","0.7","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","040039","","","- C33 H30.5 Cl3 Fe N4.5 S -","- C33 H30.5 Cl3 Fe N4.5 S -","- C132 H122 Cl12 Fe4 N18 S4 -","4","1","","Schmiege, Benjamin M.; Carney, Michael J.; Small, Brooke L.; Gerlach, Deidra L.; Halfen, Jason A.","Alternatives to pyridinediimine ligands: syntheses and structures of metal complexes supported by donor-modified alpha-diimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2547","2562","10.1039/b702197f","","","0.71073","MoKα","","0.1349","0.0661","","","0.1362","0.1673","","","","","","1.005","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005439","10.095","0.001","13.842","0.001","20.837","0.003","92.33","0.02","92.33","0.01","92.78","0.02","2903.2","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","040041","","","- C29 H25 Cl5 Fe N2 S -","- C29 H25 Cl5 Fe N2 S -","- C116 H100 Cl20 Fe4 N8 S4 -","4","2","","Schmiege, Benjamin M.; Carney, Michael J.; Small, Brooke L.; Gerlach, Deidra L.; Halfen, Jason A.","Alternatives to pyridinediimine ligands: syntheses and structures of metal complexes supported by donor-modified alpha-diimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2547","2562","10.1039/b702197f","","","0.71073","MoKα","","0.1265","0.0665","","","0.1442","0.1733","","","","","","1.008","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005440","11.8801","0.0013","17.027","0.002","16.671","0.002","90","","92.91","0.02","90","","3367.9","0.7","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","050019","","","- C36 H40 Cl2 Fe N2 O0.5 S -","- C36 H40 Cl2 Fe N2 O0.5 S -","- C144 H160 Cl8 Fe4 N8 O2 S4 -","4","1","","Schmiege, Benjamin M.; Carney, Michael J.; Small, Brooke L.; Gerlach, Deidra L.; Halfen, Jason A.","Alternatives to pyridinediimine ligands: syntheses and structures of metal complexes supported by donor-modified alpha-diimine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2547","2562","10.1039/b702197f","","","0.71073","MoKα","","0.0699","0.0438","","","0.0957","0.1068","","","","","","1.016","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005441","14.218","0.019","27.76","0.04","17.21","0.02","90","","102.077","0.012","90","","6642","15","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C56.5 H52 Er K N16 O9.5 Ru2 -","- C56.5 H34 Er K N16 O9.5 Ru2 -","- C226 H136 Er4 K4 N64 O38 Ru8 -","4","1","","Baca, Svetlana G.; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Three-component coordination networks based on [Ru(phen)(CN)4]2? anions, near-infrared luminescent lanthanide(iii) cations, and ancillary oligopyridine ligands: structures and photophysical properties","Dalton Transactions","2007","","23","2419","","10.1039/b702235b","","","0.71073","MoKα","","0.0673","0.0531","","","0.153","0.1713","","","","","","1.003","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005442","14.36","0.0009","27.9387","0.0016","17.3122","0.0011","90","","100.949","0.003","90","","6819.2","0.7","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C112 H100 K2 N32 Nd2 O18 Ru4 -","- C112 H84 K2 N32 Nd2 O18 Ru4 -","- C224 H168 K4 N64 Nd4 O36 Ru8 -","2","0.5","","Baca, Svetlana G.; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Three-component coordination networks based on [Ru(phen)(CN)4]2? anions, near-infrared luminescent lanthanide(iii) cations, and ancillary oligopyridine ligands: structures and photophysical properties","Dalton Transactions","2007","","23","2419","","10.1039/b702235b","","","0.71073","MoKα","","0.0764","0.0575","","","0.1931","0.2083","","","","","","1.111","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005443","14.4","0.003","28.05","0.006","17.4","0.004","90","","100.91","0.03","90","","6901","3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C116 H110 K2 N32 O19 Pr2 Ru4 -","- C116 H88 K2 N32 O19 Pr2 Ru4 -","- C232 H176 K4 N64 O38 Pr4 Ru8 -","2","0.5","","Baca, Svetlana G.; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Three-component coordination networks based on [Ru(phen)(CN)4]2? anions, near-infrared luminescent lanthanide(iii) cations, and ancillary oligopyridine ligands: structures and photophysical properties","Dalton Transactions","2007","","23","2419","","10.1039/b702235b","","","0.71073","MoKα","","0.0867","0.0585","","","0.1734","0.207","","","","","","1.163","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005444","25.548","0.003","26.416","0.003","11.7932","0.0011","90","","90","","90","","7958.9","1.5","150","2","150","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C72 H80 Er2 N22 O20 Ru3 -","- C72 H76 Er2 N22 O20 Ru3 -","- C288 H304 Er8 N88 O80 Ru12 -","4","0.5","","Baca, Svetlana G.; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Three-component coordination networks based on [Ru(phen)(CN)4]2? anions, near-infrared luminescent lanthanide(iii) cations, and ancillary oligopyridine ligands: structures and photophysical properties","Dalton Transactions","2007","","23","2419","","10.1039/b702235b","","","0.71073","MoKα","","0.0425","0.0405","","","0.106","0.1079","","","","","","1.101","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005445","25.497","0.003","26.744","0.002","11.8709","0.0011","90","","90","","90","","8094.7","1.4","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C72 H80 N22 Nd2 O20 Ru3 -","- C72 H76 N22 Nd2 O20 Ru3 -","- C288 H304 N88 Nd8 O80 Ru12 -","4","0.5","","Baca, Svetlana G.; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Three-component coordination networks based on [Ru(phen)(CN)4]2? anions, near-infrared luminescent lanthanide(iii) cations, and ancillary oligopyridine ligands: structures and photophysical properties","Dalton Transactions","2007","","23","2419","","10.1039/b702235b","","","0.71073","MoKα","","0.0422","0.0344","","","0.0841","0.0896","","","","","","1.029","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005446","25.8453","0.0014","25.9396","0.0015","11.8135","0.0005","90","","90","","90","","7920","0.7","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C72 H80 N22 O20 Ru3 Yb2 -","- C72 H68 N22 O20 Ru3 Yb2 -","- C288 H272 N88 O80 Ru12 Yb8 -","4","0.5","","Baca, Svetlana G.; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Three-component coordination networks based on [Ru(phen)(CN)4]2? anions, near-infrared luminescent lanthanide(iii) cations, and ancillary oligopyridine ligands: structures and photophysical properties","Dalton Transactions","2007","","23","2419","","10.1039/b702235b","","","0.71073","MoKα","","0.06","0.0521","","","0.1058","0.1104","","","","","","1.183","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005447","10.8466","0.0006","27.2848","0.0015","31.3415","0.0019","90","","90","","90","","9275.4","0.9","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C78 H77 N24 Nd2 O15.5 Ru3 -","- C78 H62 N24 Nd2 O15.5 Ru3 -","- C312 H248 N96 Nd8 O62 Ru12 -","4","1","","Baca, Svetlana G.; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Three-component coordination networks based on [Ru(phen)(CN)4]2? anions, near-infrared luminescent lanthanide(iii) cations, and ancillary oligopyridine ligands: structures and photophysical properties","Dalton Transactions","2007","","23","2419","","10.1039/b702235b","","","0.71073","MoKα","","0.0811","0.062","","","0.1466","0.1583","","","","","","1.065","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005448","21.4922","0.0012","26.3727","0.0015","17.183","0.001","90","","90","","90","","9739.5","1","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C156 H196 N48 Nd4 O52 Ru6 -","- C156 H132 N48 Nd4 O52 Ru6 -","- C312 H264 N96 Nd8 O104 Ru12 -","2","0.25","","Baca, Svetlana G.; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Three-component coordination networks based on [Ru(phen)(CN)4]2? anions, near-infrared luminescent lanthanide(iii) cations, and ancillary oligopyridine ligands: structures and photophysical properties","Dalton Transactions","2007","","23","2419","","10.1039/b702235b","","","0.71073","MoKα","","0.0656","0.0608","","","0.1673","0.1698","","","","","","1.177","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005449","15.55","0.003","15.8","0.003","17.72","0.004","111.07","0.03","95.38","0.03","95.64","0.03","4003.6","1.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H69 Er2 N22 O19.5 Ru3 -","- C56 H44 Er2 N22 O19.5 Ru3 -","- C112 H88 Er4 N44 O39 Ru6 -","2","1","","Baca, Svetlana G.; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Three-component coordination networks based on [Ru(phen)(CN)4]2? anions, near-infrared luminescent lanthanide(iii) cations, and ancillary oligopyridine ligands: structures and photophysical properties","Dalton Transactions","2007","","23","2419","","10.1039/b702235b","","","0.71073","MoKα","","0.1123","0.0828","","","0.1755","0.1901","","","","","","1.142","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005450","15.4596","0.0006","15.7478","0.0006","17.2375","0.0007","110.36","0.002","94.733","0.002","94.567","0.002","3894.5","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H78 N22 O24 Ru3 Yb2 -","- C56 H50 N22 O24 Ru3 Yb2 -","- C112 H100 N44 O48 Ru6 Yb4 -","2","1","","Baca, Svetlana G.; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Ward, Michael D.","Three-component coordination networks based on [Ru(phen)(CN)4]2? anions, near-infrared luminescent lanthanide(iii) cations, and ancillary oligopyridine ligands: structures and photophysical properties","Dalton Transactions","2007","","23","2419","","10.1039/b702235b","","","0.71073","MoKα","","0.0385","0.0306","","","0.0826","0.0868","","","","","","0.955","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005451","49.293","0.009","23.145","0.004","25.561","0.005","90","","106.793","0.003","90","","27919","9","123","1","123","1","","","","","","","","9","C 1 2/c 1","-C 2yc","15","PSM-168","","","- C138 H138 F9 Fe3 N3 O26 P6 Pd3 S3 -","- C138 H96 F9 Fe3 N3 O26 P6 Pd3 S3 -","- C1104 H768 F72 Fe24 N24 O208 P48 Pd24 S24 -","8","1","","Ghosh, Sushobhan; Turner, David R.; Batten, Stuart R.; Mukherjee, Partha Sarathi","Self-assembly of a heterometallic molecular triangle using an ambidentate ligand and self-selection for a single linkage isomer","Dalton Transactions","2007","","19","1869","","10.1039/b702353g","","","0.71073","MoKα","","0.1248","0.0854","","","0.2078","0.2413","","","","","","1.034","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005452","17.39","0.002","18.1344","0.0015","19.6577","0.0019","115.297","0.007","96.581","0.011","92.182","0.009","5541.6","1","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C100 H114 Cl2 N6 O4 P2 Pt Zn2 -","- C100 H114 Cl2 N6 O4 P2 Pt Zn2 -","- C200 H228 Cl4 N12 O8 P4 Pt2 Zn4 -","2","1","","Kuil, Mark; Goudriaan, P. Elsbeth; Kleij, Arjan W.; Tooke, Duncan M.; Spek, Anthony L.; van Leeuwen, Piet W. N. M.; Reek, Joost N. H.","Rigid bis-zinc(II) salphen building blocks for the formation of template-assisted bidentate ligands and their application in catalysis.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2311","2320","10.1039/b702375h","","","0.71073","MoKα","","0.0506","0.0347","","","0.0792","0.083","","","","","","1.049","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005453","16.799","0.002","18.411","0.003","20.4292","0.0018","110.621","0.008","107.51","0.01","96.557","0.012","5465.4","1.4","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C100.8 H115.6 Cl1.6 N6 O4 P2 Zn2 -","- C100.8 H115.6 Cl1.6 N6 O4 P2 Zn2 -","- C201.6 H231.2 Cl3.2 N12 O8 P4 Zn4 -","2","1","","Kuil, Mark; Goudriaan, P. Elsbeth; Kleij, Arjan W.; Tooke, Duncan M.; Spek, Anthony L.; van Leeuwen, Piet W. N. M.; Reek, Joost N. H.","Rigid bis-zinc(II) salphen building blocks for the formation of template-assisted bidentate ligands and their application in catalysis.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2311","2320","10.1039/b702375h","","","0.71073","MoKα","","0.0722","0.0515","","","0.1358","0.1448","","","","","","1.085","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005454","32.6639","0.001","12.4434","0.001","25.3741","0.001","90","","97.312","0.001","90","","10229.4","1","150","","150","","","","","","","","see text","8","C 1 2/c 1","-C 2yc","15","","","","- C101 H117 Cl N6 O4 P2 Pd Zn2 -","- C101 H117 Cl N6 O4 P2 Pd Zn2 -","- C404 H468 Cl4 N24 O16 P8 Pd4 Zn8 -","4","0.5","","Kuil, Mark; Goudriaan, P. Elsbeth; Kleij, Arjan W.; Tooke, Duncan M.; Spek, Anthony L.; van Leeuwen, Piet W. N. M.; Reek, Joost N. H.","Rigid bis-zinc(II) salphen building blocks for the formation of template-assisted bidentate ligands and their application in catalysis.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2311","2320","10.1039/b702375h","","x-ray","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005455","14.2336","0.0001","14.246","0.0001","17.5082","0.0001","95.9592","0.0004","99.1182","0.0004","100.717","0.0004","3411.51","0.04","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H48 B Cl2 F24 Ir P2 -","- C70 H48 B Cl2 F24 Ir P2 -","- C140 H96 B2 Cl4 F48 Ir2 P4 -","2","1","","Moxham, Gemma L.; Brayshaw, Simon K.; Weller, Andrew S.","[Ir(PPh3)2(H)2(ClCH2CH2Cl)][BArF4]: a well characterised transition metal dichloroethane complex.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1759","1761","10.1039/b702399e","","","0.71073","MoKα","","0.0525","0.0335","","","0.063","0.0687","","","","","","1.012","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005456","10.767","0.005","8.076","0.004","13.357","0.006","90","","99.987","0.01","90","","1143.8","0.9","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H5 Cl Mn N O4 -","- C9 H5 Cl Mn N O4 -","- C36 H20 Cl4 Mn4 N4 O16 -","4","1","","Alvarez, Celedonio M.; García-Rodríguez, Raúl; Miguel, Daniel","Pyridine-2-carboxaldehyde as ligand: synthesis and derivatization of carbonyl complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3546","3554","10.1039/b702418e","","","0.71073","MoKα","","0.1192","0.0686","","","0.1289","0.1457","","","","","","0.988","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005457","10.693","0.003","8.987","0.003","11.888","0.003","90","","90.21","0.005","90","","1142.4","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H5 Br N O4 Re -","- C9 H5 Br N O4 Re -","- C36 H20 Br4 N4 O16 Re4 -","4","1","","Alvarez, Celedonio M.; García-Rodríguez, Raúl; Miguel, Daniel","Pyridine-2-carboxaldehyde as ligand: synthesis and derivatization of carbonyl complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3546","3554","10.1039/b702418e","","","0.71073","MoKα","","0.0282","0.022","","","0.05","0.0516","","","","","","1.046","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005458","14.421","0.009","9.983","0.006","9.449","0.006","90","","104.949","0.011","90","","1314.3","1.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 Cl Mo N O3 -","- C12 H12 Cl Mo N O3 -","- C48 H48 Cl4 Mo4 N4 O12 -","4","1","","Alvarez, Celedonio M.; García-Rodríguez, Raúl; Miguel, Daniel","Pyridine-2-carboxaldehyde as ligand: synthesis and derivatization of carbonyl complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3546","3554","10.1039/b702418e","","","0.71073","MoKα","","0.0701","0.0644","","","0.1651","0.1773","","","","","","1.062","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005459","6.9586","0.0017","7.873","0.0019","15.422","0.004","94.524","0.005","102.427","0.005","97.655","0.005","812.7","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H12 Br Mn N2 O5 -","- C13 H12 Br Mn N2 O5 -","- C26 H24 Br2 Mn2 N4 O10 -","2","1","","Alvarez, Celedonio M.; García-Rodríguez, Raúl; Miguel, Daniel","Pyridine-2-carboxaldehyde as ligand: synthesis and derivatization of carbonyl complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3546","3554","10.1039/b702418e","","","0.71073","MoKα","","0.1017","0.0581","","","0.155","0.1845","","","","","","1.03","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005460","18.262","0.007","10.629","0.004","16.641","0.006","90","","90.685","0.008","90","","3230","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H12 Cl Mn N2 O5 -","- C13 H12 Cl Mn N2 O5 -","- C104 H96 Cl8 Mn8 N16 O40 -","8","1","","Alvarez, Celedonio M.; García-Rodríguez, Raúl; Miguel, Daniel","Pyridine-2-carboxaldehyde as ligand: synthesis and derivatization of carbonyl complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3546","3554","10.1039/b702418e","","","0.71073","MoKα","","0.111","0.0966","","","0.2774","0.2833","","","","","","1.116","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005461","10.372","0.005","9.448","0.005","18.5","0.009","90","","98.479","0.009","90","","1793.1","1.6","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H19 Cl Mo N2 O4 -","- C16 H19 Cl Mo N2 O4 -","- C64 H76 Cl4 Mo4 N8 O16 -","4","1","","Alvarez, Celedonio M.; García-Rodríguez, Raúl; Miguel, Daniel","Pyridine-2-carboxaldehyde as ligand: synthesis and derivatization of carbonyl complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3546","3554","10.1039/b702418e","","","0.71073","MoKα","","0.0836","0.0613","","","0.1479","0.157","","","","","","1.097","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005462","11.206","0.005","7.084","0.003","16.026","0.007","90","","98.857","0.008","90","","1257","0.9","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C9 H5 Cl Mn N O8 -","- C9 H5 Cl Mn N O8 -","- C36 H20 Cl4 Mn4 N4 O32 -","4","1","","Alvarez, Celedonio M.; García-Rodríguez, Raúl; Miguel, Daniel","Pyridine-2-carboxaldehyde as ligand: synthesis and derivatization of carbonyl complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3546","3554","10.1039/b702418e","","","0.71073","MoKα","","0.0309","0.0283","","","0.0731","0.0749","","","","","","1.054","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005463","8.547","0.007","8.892","0.007","10.399","0.009","70.449","0.014","72.368","0.015","74.795","0.016","698.3","1","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C10 H5 F3 N O7 Re S -","- C10 H5 F3 N O7 Re S -","- C20 H10 F6 N2 O14 Re2 S2 -","2","1","","Alvarez, Celedonio M.; García-Rodríguez, Raúl; Miguel, Daniel","Pyridine-2-carboxaldehyde as ligand: synthesis and derivatization of carbonyl complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3546","3554","10.1039/b702418e","","","0.71073","MoKα","","0.1009","0.0905","","","0.2182","0.2266","","","","","","1.093","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005464","7.834","0.004","9.046","0.005","14.035","0.008","100.666","0.01","99.137","0.01","112.88","0.011","870.8","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C13 H12 F3 Mo N O6 S -","- C13 H12 F3 Mo N O6 S -","- C26 H24 F6 Mo2 N2 O12 S2 -","2","1","","Alvarez, Celedonio M.; García-Rodríguez, Raúl; Miguel, Daniel","Pyridine-2-carboxaldehyde as ligand: synthesis and derivatization of carbonyl complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3546","3554","10.1039/b702418e","","","0.71073","MoKα","","0.0515","0.0374","","","0.0851","0.0905","","","","","","0.947","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005465","8.48","0.006","12.703","0.009","15.187","0.01","71.046","0.014","81.004","0.012","74.722","0.013","1488.1","1.8","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C28 H20 F3 N O7 P Re S -","- C28 H20 F3 N O7 P Re S -","- C56 H40 F6 N2 O14 P2 Re2 S2 -","2","1","","Alvarez, Celedonio M.; García-Rodríguez, Raúl; Miguel, Daniel","Pyridine-2-carboxaldehyde as ligand: synthesis and derivatization of carbonyl complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3546","3554","10.1039/b702418e","","","0.71073","MoKα","","0.0489","0.0418","","","0.1057","0.1137","","","","","","0.992","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005466","13.331","0.005","13.619","0.006","19.907","0.008","70.546","0.007","80.191","0.008","89.759","0.008","3353","2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C66 H49 B F24 Mo N O4 P -","- C66 H49 B F24 Mo N O4 P -","- C132 H98 B2 F48 Mo2 N2 O8 P2 -","2","1","","Alvarez, Celedonio M.; García-Rodríguez, Raúl; Miguel, Daniel","Pyridine-2-carboxaldehyde as ligand: synthesis and derivatization of carbonyl complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3546","3554","10.1039/b702418e","","","0.71073","MoKα","","0.0871","0.0629","","","0.1626","0.1871","","","","","","1.021","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005467","9.997","0.004","11.983","0.005","13.481","0.006","73.203","0.006","87.14","0.006","85.074","0.006","1539.8","1.1","90","","90","","","","","","","","local laboratory","7","P -1","-P 1","2","","","","- C50 H62 Ag4 Cl6 N16 O4 S4 -","- C50 H60 Ag4 Cl6 N16 O4 S4 -","- C50 H60 Ag4 Cl6 N16 O4 S4 -","1","0.5","","Onodera, Kuniaki; Kasuga, Noriko Chikaraishi; Takashima, Tomomi; Hara, Akihiro; Amano, Akifumi; Murakami, Hideyuki; Nomiya, Kenji","Synthesis, reaction and structure of a highly light-stable silver(I) cluster with an Ag4S4N4 core having a tridentate 4N-morpholyl 2-acetylpyridine thiosemicarbazone ligand: use of water-soluble silver(I) carboxylates as a silver(I) source.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3646","3652","10.1039/b702427d","","","0.71073","MoKα","","0.0345","0.0308","","","0.0814","0.0928","","","","","","1.132","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005468","11.005","0.011","11.477","0.011","12.859","0.013","70.353","0.002","76.622","0.002","65.256","0.002","1381","2","90","","90","","","","","","","","local laboratory","7","P -1","-P 1","2","","","","- C60 H60 Ag2 N8 O2 P2 S2 -","- C60 H60 Ag2 N8 O2 P2 S2 -","- C60 H60 Ag2 N8 O2 P2 S2 -","1","0.5","","Onodera, Kuniaki; Kasuga, Noriko Chikaraishi; Takashima, Tomomi; Hara, Akihiro; Amano, Akifumi; Murakami, Hideyuki; Nomiya, Kenji","Synthesis, reaction and structure of a highly light-stable silver(I) cluster with an Ag4S4N4 core having a tridentate 4N-morpholyl 2-acetylpyridine thiosemicarbazone ligand: use of water-soluble silver(I) carboxylates as a silver(I) source.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3646","3652","10.1039/b702427d","","","0.71073","MoKα","","0.0258","0.0231","","","0.0638","0.0701","","","","","","1.026","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005469","13.348","0.002","14.701","0.003","15.139","0.003","105.026","0.002","102.176","0.002","100.29","0.002","2717.6","0.9","113","","113","","","","","","","","local laboratory","7","P -1","-P 1","2","","","","- C60 H60 Ag2 N8 O2 P2 S2 -","- C60 H60 Ag2 N8 O2 P2 S2 -","- C120 H120 Ag4 N16 O4 P4 S4 -","2","1","","Onodera, Kuniaki; Kasuga, Noriko Chikaraishi; Takashima, Tomomi; Hara, Akihiro; Amano, Akifumi; Murakami, Hideyuki; Nomiya, Kenji","Synthesis, reaction and structure of a highly light-stable silver(I) cluster with an Ag4S4N4 core having a tridentate 4N-morpholyl 2-acetylpyridine thiosemicarbazone ligand: use of water-soluble silver(I) carboxylates as a silver(I) source.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3646","3652","10.1039/b702427d","","","0.71073","MoKα","","0.0586","0.0462","","","0.1021","0.1099","","","","","","1.07","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005470","6.8833","0.0007","9.4457","0.0009","11.4636","0.001","89.368","0.011","72.801","0.011","77.584","0.011","694.25","0.13","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","Dinitrosyl-bis[tris(hydroxymethyl)phoshine]iron(II)","","- C6 H18 Fe N2 O8 P2 -","- C6 H18 Fe N2 O8 P2 -","- C12 H36 Fe2 N4 O16 P4 -","2","1","","Dillinger, Sandra A. T.; Schmalle, Helmut W.; Fox, Thomas; Berke, Heinz","Developing iron nitrosyl complexes as NO donor prodrugs.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3562","3571","10.1039/b702461d","","","0.71073","MoKα","","0.0612","0.0496","","","0.1414","0.1539","","","","","","1.091","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005471","7.6992","0.001","8.5741","0.0011","11.2515","0.0015","95.919","0.015","106.994","0.015","109.827","0.014","651.11","0.18","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","Dinitrosyl-(1,2-bis(hydroxymethylphosphino)ethane)iron(II)","","- C6 H16 Fe N2 O6 P2 -","- C6 H16 Fe N2 O6 P2 -","- C12 H32 Fe2 N4 O12 P4 -","2","1","","Dillinger, Sandra A. T.; Schmalle, Helmut W.; Fox, Thomas; Berke, Heinz","Developing iron nitrosyl complexes as NO donor prodrugs.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3562","3571","10.1039/b702461d","","","0.71073","MoKα","","0.0348","0.0268","","","0.0716","0.0791","","","","","","1.078","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005472","6.6305","0.0009","7.9844","0.0012","9.7216","0.0014","106.336","0.017","90.782","0.017","113.684","0.016","447.57","0.14","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","Bis-(dinitrosyl-2-aminoethanethiol) hydrochloride S-bridged dinuclear iron(II)","","- C4 H18 Cl2 Fe2 N6 O6 S2 -","- C4 H18 Cl2 Fe2 N6 O6 S2 -","- C4 H18 Cl2 Fe2 N6 O6 S2 -","1","0.5","","Dillinger, Sandra A. T.; Schmalle, Helmut W.; Fox, Thomas; Berke, Heinz","Developing iron nitrosyl complexes as NO donor prodrugs.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3562","3571","10.1039/b702461d","","","0.71073","MoKα","","0.0601","0.0463","","","0.1408","0.1468","","","","","","1.055","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005473","6.3097","0.0005","6.8752","0.0005","24.5366","0.0017","90.403","0.008","93.515","0.008","116.319","0.008","951.58","0.14","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","Bis-[dinitrosyl-cysteamine-iron(II)] iodide water","","- C4 H18 Fe2 I2 N6 O5 S2 -","- C4 H18 Fe2 I2 N6 O5 S2 -","- C8 H36 Fe4 I4 N12 O10 S4 -","2","1","","Dillinger, Sandra A. T.; Schmalle, Helmut W.; Fox, Thomas; Berke, Heinz","Developing iron nitrosyl complexes as NO donor prodrugs.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3562","3571","10.1039/b702461d","","","0.71073","MoKα","","0.0351","0.0283","","","0.0767","0.0815","","","","","","1.009","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005474","6.4219","0.0013","7.626","0.002","8.345","0.002","75.61","0.03","80.83","0.03","85.15","0.03","390.37","0.17","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","Bis[(μ-pyrimidine-2-thionate)dinitrosyl-iron]","","- C8 H8 Fe2 N8 O4 S2 -","- C8 H8 Fe2 N8 O4 S2 -","- C8 H8 Fe2 N8 O4 S2 -","1","0.5","","Dillinger, Sandra A. T.; Schmalle, Helmut W.; Fox, Thomas; Berke, Heinz","Developing iron nitrosyl complexes as NO donor prodrugs.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3562","3571","10.1039/b702461d","","","0.71073","MoKα","","0.0387","0.0319","","","0.1066","0.1106","","","","","","1.09","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005475","7.0648","0.0004","11.4932","0.0007","18.8432","0.001","90","","91.237","0.007","90","","1529.66","0.15","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Iodo-2-mercaptopyrimidine-dinitrosyl-iron(-I) diethylether","","- C8 H14 Fe I N4 O3 S -","- C8 H14 Fe I N4 O3 S -","- C32 H56 Fe4 I4 N16 O12 S4 -","4","1","","Dillinger, Sandra A. T.; Schmalle, Helmut W.; Fox, Thomas; Berke, Heinz","Developing iron nitrosyl complexes as NO donor prodrugs.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3562","3571","10.1039/b702461d","","","0.71073","MoKα","","0.0823","0.0479","","","0.1252","0.1312","","","","","","1.005","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005476","24.693","0.003","6.6317","0.001","8.2556","0.0016","90","","90","","90","","1351.9","0.4","183","2","183","2","","","","","","","","7","P n a 21","P 2c -2n","33","","Trinitrosyl(tris(hydroxymethyl)phosphino)iron(II) hexafluorophosphate","","- C3 H9 F6 Fe N3 O6 P2 -","- C3 H9 F6 Fe N3 O6 P2 -","- C12 H36 F24 Fe4 N12 O24 P8 -","4","1","","Dillinger, Sandra A. T.; Schmalle, Helmut W.; Fox, Thomas; Berke, Heinz","Developing iron nitrosyl complexes as NO donor prodrugs.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3562","3571","10.1039/b702461d","","","0.71073","MoKα","","0.1627","0.0949","","","0.2201","0.2612","","","","","","1.229","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005477","19.466","0.0009","6.5409","0.0004","19.0131","0.0009","90","","115.104","0.005","90","","2192.2","0.2","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Dinitrosyl-bis(1,3,5-triaza-7-phosphatricyclo(3,3,1,1)decane) iron(ii) tetrahydrofurane","Dinitrosyl-bis(1,3,5-triaza-7-phosphatricyclo[3,3,1,1]decane) iron(II) tetrahydrofurane","","- C16 H32 Fe N8 O3 P2 -","- C16 H32 Fe N8 O3 P2 -","- C64 H128 Fe4 N32 O12 P8 -","4","0.5","","Dillinger, Sandra A. T.; Schmalle, Helmut W.; Fox, Thomas; Berke, Heinz","Developing iron nitrosyl complexes as NO donor prodrugs.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3562","3571","10.1039/b702461d","","","0.71073","MoKα","","0.0676","0.0458","","","0.1164","0.1215","","","","","","0.883","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005478","22.535","0.003","22.535","0.003","22.535","0.003","90","","90","","90","","11444","3","123","2","123","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","tetraethylammonium hexa(dicyanonitrosomethanido)cerate","tetraethylammonium hexa(dicyanonitrosomethanido)cerate","","- C42 H60 Ce N21 O6 -","- C42 H60 Ce N21 O6 -","- C336 H480 Ce8 N168 O48 -","8","0.166667","","Chesman, Anthony S. R.; Turner, David R.; Izgorodina, Ekaterina I.; Batten, Stuart R.; Deacon, Glen B.","Homoleptic 12-coordinate lanthanoids with eta(2)-nitroso ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1371","1373","10.1039/b702473h","","","0.71073","MoKα","","0.091","0.0303","","","0.0681","0.0863","","","","","","0.92","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005479","22.3927","0.0004","22.3927","0.0004","22.3927","0.0004","90","","90","","90","","11228.4","0.3","123","1","123","1","","","","","","","","5","I a -3","-I 2b 2c 3","206","tetraethylammonium hexa(dicyanonitrosomethanido)gadolinium(iii)","tetraethylammonium hexa(dicyanonitrosomethanido)gadolinium(III)","","- C42 H60 Gd N21 O6 -","- C42 H60 Gd N21 O6 -","- C336 H480 Gd8 N168 O48 -","8","0.166667","","Chesman, Anthony S. R.; Turner, David R.; Izgorodina, Ekaterina I.; Batten, Stuart R.; Deacon, Glen B.","Homoleptic 12-coordinate lanthanoids with eta(2)-nitroso ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1371","1373","10.1039/b702473h","","","0.71073","MoKα","","0.046","0.0261","","","0.058","0.0685","","","","","","1.027","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005480","22.5835","0.0001","22.5835","0.0001","22.5835","0.0001","90","","90","","90","","11517.9","0.09","123","2","123","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","tetraethylammonium (hexa(dicyanonitrosomethanido)lanthanate(iii))","tetraethylammonium [hexa(dicyanonitrosomethanido)lanthanate(III)]","","- C42 H60 La N21 O6 -","- C42 H60 La N21 O6 -","- C336 H480 La8 N168 O48 -","8","0.166667","","Chesman, Anthony S. R.; Turner, David R.; Izgorodina, Ekaterina I.; Batten, Stuart R.; Deacon, Glen B.","Homoleptic 12-coordinate lanthanoids with eta(2)-nitroso ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1371","1373","10.1039/b702473h","","","0.71073","MoKα","","0.0569","0.0374","","","0.0857","0.098","","","","","","1.062","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005481","22.4898","0.0003","22.4898","0.0003","22.4898","0.0003","90","","90","","90","","11375.1","0.3","123","2","123","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","tetraethylammonium hexa(dicyanonitrosomethanido)neodymiate(iii)","tetraethylammonium hexa(dicyanonitrosomethanido)neodymiate(III)","","- C42 H60 N21 Nd O6 -","- C42 H60 N21 Nd O6 -","- C336 H480 N168 Nd8 O48 -","8","0.166667","","Chesman, Anthony S. R.; Turner, David R.; Izgorodina, Ekaterina I.; Batten, Stuart R.; Deacon, Glen B.","Homoleptic 12-coordinate lanthanoids with eta(2)-nitroso ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","14","1371","1373","10.1039/b702473h","","","0.71073","MoKα","","0.0414","0.0265","","","0.0525","0.0588","","","","","","1.063","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005482","29.884","0.002","29.884","0.002","9.7853","0.0013","90","","90","","120","","7568","1.2","294","2","294","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C14 H12 Mn N6 O2 Ru -","- C14 H10 Mn N6 O2 Ru -","- C252 H180 Mn18 N108 O36 Ru18 -","18","1","","Xia, Jun; Shi, Wei; Chen, Xiao-Yan; Wang, Hong-Sheng; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping","A CNT-like coordination tube with cyano-bridges","Dalton Transactions","2007","","23","2373","","10.1039/b702500a","","","0.71073","MoKα","","0.046","0.0302","","","0.0781","0.0879","","","","","","0.991","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005483","21.0616","0.0014","10.2915","0.0006","8.7973","0.0005","90","","90","","90","","1906.9","0.2","120","2","120","2","","","","","","","","8","P n m a","-P 2ac 2n","62","catena-((mu-cis-bis(3,5-dimethyl-1H- pyrazolyl)selenide)mercury(ii)) dichloride methylsulfoxide solvate","catena-{[mu-cis-bis(3,5-dimethyl-1H-pyrazolyl)selenide]mercury(II)} dichloride methylsulfoxide solvate","","- C12 H20 Cl2 Hg N4 O S Se -","- C12 H20 Cl2 Hg N4 O S Se -","- C48 H80 Cl8 Hg4 N16 O4 S4 Se4 -","4","0.5","","Seredyuk, Maksym; Haukka, Matti; Fritsky, Igor O.; Kozłowski, Henryk; Krämer, Roland; Pavlenko, Vadim A.; Gütlich, Philipp","Bis(3,5-dimethyl-1H-pyrazolyl)selenide‒a new bidentate bent connector for preparation of 1D and 2D co-ordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3183","3194","10.1039/b702574b","","","0.71073","MoKα","","0.0346","0.0267","","","0.0509","0.0534","","","","","","1.108","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005484","9.3331","0.0003","10.4321","0.0008","12.819","0.0009","110.626","0.006","97.843","0.003","91.907","0.004","1152.71","0.13","120","2","120","2","","","","","","","","6","P -1","-P 1","2","catena-((mu-trans-bis(3,5-dimethyl-1H-pyrazolyl)selenide)bis (thiocyanato)mercury(ii)) hexakix(bis)mercurate(ii)","catena-{[mu-trans-bis(3,5-dimethyl-1H-pyrazolyl)selenide]bis [thiocyanato]mercury(II)} hexakix(bis)mercurate(II)","","- C14 H14 Hg2 N8 S4 Se -","- C14 H14 Hg2 N8 S4 Se -","- C28 H28 Hg4 N16 S8 Se2 -","2","1","","Seredyuk, Maksym; Haukka, Matti; Fritsky, Igor O.; Kozłowski, Henryk; Krämer, Roland; Pavlenko, Vadim A.; Gütlich, Philipp","Bis(3,5-dimethyl-1H-pyrazolyl)selenide‒a new bidentate bent connector for preparation of 1D and 2D co-ordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3183","3194","10.1039/b702574b","","","0.71073","MoKα","","0.0316","0.0201","","","0.0367","0.039","","","","","","1.053","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005485","16.043","0.003","12.451","0.002","30.597","0.006","90","","96.44","0.03","90","","6073.2","1.9","120","2","120","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","catena-(bis(mu-cis-bis(3,5-dimethyl-1H-pyrazolyl)selenide) (mu-trans-bis(3,5-dimethyl-1H-pyrazolyl)selenide)tetrachlorocopper(ii)) methylsulfoxide solvate hydrate","catena-{bis[mu-cis-bis(3,5-dimethyl-1H-pyrazolyl)selenide] [mu-trans-bis(3,5-dimethyl-1H-pyrazolyl)selenide]tetrachlorocopper(II)} methylsulfoxide solvate hydrate","","- C19 H30.95 Cl2 Cu N6 O3.98 S2 Se1.5 -","- C19 H27 Cl2 Cu N6 O3.965 S2 Se1.5 -","- C152 H216 Cl16 Cu8 N48 O31.72 S16 Se12 -","8","1","","Seredyuk, Maksym; Haukka, Matti; Fritsky, Igor O.; Kozłowski, Henryk; Krämer, Roland; Pavlenko, Vadim A.; Gütlich, Philipp","Bis(3,5-dimethyl-1H-pyrazolyl)selenide‒a new bidentate bent connector for preparation of 1D and 2D co-ordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3183","3194","10.1039/b702574b","","","0.71073","MoKα","","0.0478","0.0379","","","0.091","0.0989","","","","","","1.067","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005486","11.427","0.004","13.537","0.004","18.835","0.004","90","","93.16","0.03","90","","2909.1","1.5","120","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","(monoaqua-catena-((bis(mu-cis-bis(3,5-dimethyl-1H- pyrazolyl)selenide)) copper(ii))) dibromide monohydrate","[monoaqua-catena-{(bis[mu-cis-bis(3,5-dimethyl-1H-pyrazolyl)selenide]) copper(II)}] dibromide monohydrate","","- C20 H30 Br2 Cu N8 O2 Se2 -","- C20 H30 Br2 Cu N8 O2 Se2 -","- C80 H120 Br8 Cu4 N32 O8 Se8 -","4","0.5","","Seredyuk, Maksym; Haukka, Matti; Fritsky, Igor O.; Kozłowski, Henryk; Krämer, Roland; Pavlenko, Vadim A.; Gütlich, Philipp","Bis(3,5-dimethyl-1H-pyrazolyl)selenide‒a new bidentate bent connector for preparation of 1D and 2D co-ordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3183","3194","10.1039/b702574b","","","0.71073","MoKα","","0.0627","0.053","","","0.1378","0.1459","","","","","","1.084","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005487","13.2301","0.0004","13.2301","0.0004","15.8544","0.0004","90","","90","","90","","2775.08","0.14","120","2","120","2","","","","","","","","6","I -4 c 2","I -4 -2c","120","catena-((bis(mu-trans-bis(3,5-dimethyl-1H- pyrazolyl)selenide)) zinc(ii)) dinitrate","catena-{(bis[mu-trans-bis(3,5-dimethyl-1H-pyrazolyl)selenide]) zinc(II)} dinitrate","","- C20 H28 N10 O6 Se2 Zn -","- C20 H28 N10 O6 Se2 Zn -","- C80 H112 N40 O24 Se8 Zn4 -","4","0.25","","Seredyuk, Maksym; Haukka, Matti; Fritsky, Igor O.; Kozłowski, Henryk; Krämer, Roland; Pavlenko, Vadim A.; Gütlich, Philipp","Bis(3,5-dimethyl-1H-pyrazolyl)selenide‒a new bidentate bent connector for preparation of 1D and 2D co-ordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3183","3194","10.1039/b702574b","","","0.71073","MoKα","","0.0283","0.0242","","","0.0591","0.0607","","","","","","1.121","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005488","10.944","0.002","13.516","0.003","23.043","0.005","90","","90","","90","","3408.5","1.2","120","2","120","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","catena-(bis((mu-cis-bis(3,5-dimethyl-1H- pyrazolyl)selenide))cadmium(ii)) bis(mu-tiocyanate)","catena-{bis([mu-cis-bis(3,5-dimethyl-1H-pyrazolyl)selenide])cadmium(II)} bis(mu-tiocyanate)","","- C12 H14 Cd N6 S2 Se -","- C12 H14 Cd N6 S2 Se -","- C96 H112 Cd8 N48 S16 Se8 -","8","1","","Seredyuk, Maksym; Haukka, Matti; Fritsky, Igor O.; Kozłowski, Henryk; Krämer, Roland; Pavlenko, Vadim A.; Gütlich, Philipp","Bis(3,5-dimethyl-1H-pyrazolyl)selenide‒a new bidentate bent connector for preparation of 1D and 2D co-ordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3183","3194","10.1039/b702574b","","","0.71073","MoKα","","0.0477","0.0365","","","0.0716","0.0747","","","","","","1.182","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005489","9.695","0.0002","9.9608","0.0003","12.4645","0.0003","76.013","0.001","86.852","0.002","61.82","0.002","1027.09","0.05","120","2","120","2","","","","","","","","6","P -1","-P 1","2","catena-(bis((mu-cis-bis(3,5-dimethyl-1H- pyrazolyl)selenide))cadmium(ii)) bis(tricyanocadmate(ii)) methanol solvate","catena-{bis([mu-cis-bis(3,5-dimethyl-1H-pyrazolyl)selenide])cadmium(II)} bis(tricyanocadmate(II)) methanol solvate","","- C27 H32 Cd3 N14 O Se2 -","- C26 H28 Cd2.996 N14 Se2 -","- C26 H28 Cd2.996 N14 Se2 -","1","0.5","","Seredyuk, Maksym; Haukka, Matti; Fritsky, Igor O.; Kozłowski, Henryk; Krämer, Roland; Pavlenko, Vadim A.; Gütlich, Philipp","Bis(3,5-dimethyl-1H-pyrazolyl)selenide‒a new bidentate bent connector for preparation of 1D and 2D co-ordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3183","3194","10.1039/b702574b","","","0.71073","MoKα","","0.0395","0.036","","","0.0978","0.0997","","","","","","1.098","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005490","22.5978","0.0008","10.5625","0.0003","15.1083","0.0005","90","","116.217","0.002","90","","3235.21","0.19","120","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","mu-dicyanoaurate-(bisaqua(bis(bis(3,5-dimethyl-1H- pyrazolyl)selenide)) iron(ii)) dicyanoaurate","mu-dicyanoaurate-{bisaqua(bis[bis(3,5-dimethyl-1H-pyrazolyl)selenide]) iron(II)} dicyanoaurate","","- C24 H32 Au2 Fe N12 O2 Se2 -","- C24 H32 Au2 Fe N12 O2 Se2 -","- C96 H128 Au8 Fe4 N48 O8 Se8 -","4","0.5","","Seredyuk, Maksym; Haukka, Matti; Fritsky, Igor O.; Kozłowski, Henryk; Krämer, Roland; Pavlenko, Vadim A.; Gütlich, Philipp","Bis(3,5-dimethyl-1H-pyrazolyl)selenide‒a new bidentate bent connector for preparation of 1D and 2D co-ordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3183","3194","10.1039/b702574b","","","0.71073","MoKα","","0.0354","0.0262","","","0.0579","0.061","","","","","","1.053","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005491","8.476","0.002","8.939","0.002","15.576","0.004","90","","90","","90","","1180.1","0.5","297","2","297","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C11 H14 Cl N O Se -","- C11 H14 Cl N O Se -","- C44 H56 Cl4 N4 O4 Se4 -","4","1","","Kulcsar, Monika; Beleaga, Anca; Silvestru, Cristian; Nicolescu, Alina; Deleanu, Calin; Todasca, Cristina; Silvestru, Anca","Solid state structure and solution behaviour of organoselenium(II) compounds containing 2-{E(CH2CH2)2NCH2}C6H4 groups (E = O, NMe).","Dalton transactions (Cambridge, England : 2003)","2007","","21","2187","2196","10.1039/b702629c","","","0.71073","MoKα","","0.0235","0.0227","","","0.0519","0.0522","","","","","","1.11","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005492","7.8591","0.0013","15.772","0.003","11.3391","0.0019","90","","96.523","0.003","90","","1396.4","0.4","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H17 I N2 Se -","- C12 H17 I N2 Se -","- C48 H68 I4 N8 Se4 -","4","1","","Kulcsar, Monika; Beleaga, Anca; Silvestru, Cristian; Nicolescu, Alina; Deleanu, Calin; Todasca, Cristina; Silvestru, Anca","Solid state structure and solution behaviour of organoselenium(II) compounds containing 2-{E(CH2CH2)2NCH2}C6H4 groups (E = O, NMe).","Dalton transactions (Cambridge, England : 2003)","2007","","21","2187","2196","10.1039/b702629c","","","0.71073","MoKα","","0.0661","0.0566","","","0.1133","0.117","","","","","","1.264","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005493","15.7733","0.0013","9.5329","0.0008","17.403","0.0014","90","","110.053","0.002","90","","2458.2","0.4","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H34 N4 Se2 -","- C24 H34 N4 Se2 -","- C96 H136 N16 Se8 -","4","1","","Kulcsar, Monika; Beleaga, Anca; Silvestru, Cristian; Nicolescu, Alina; Deleanu, Calin; Todasca, Cristina; Silvestru, Anca","Solid state structure and solution behaviour of organoselenium(II) compounds containing 2-{E(CH2CH2)2NCH2}C6H4 groups (E = O, NMe).","Dalton transactions (Cambridge, England : 2003)","2007","","21","2187","2196","10.1039/b702629c","","","0.71073","MoKα","","0.06","0.047","","","0.1001","0.1055","","","","","","1.093","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005494","8.2818","0.0007","14.3309","0.0012","10.7167","0.0009","90","","97.337","0.001","90","","1261.5","0.18","297","2","297","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H14 I N O Se -","- C11 H14 I N O Se -","- C44 H56 I4 N4 O4 Se4 -","4","1","","Kulcsar, Monika; Beleaga, Anca; Silvestru, Cristian; Nicolescu, Alina; Deleanu, Calin; Todasca, Cristina; Silvestru, Anca","Solid state structure and solution behaviour of organoselenium(II) compounds containing 2-{E(CH2CH2)2NCH2}C6H4 groups (E = O, NMe).","Dalton transactions (Cambridge, England : 2003)","2007","","21","2187","2196","10.1039/b702629c","","","0.71073","MoKα","","0.0354","0.0318","","","0.0652","0.0667","","","","","","1.174","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005495","16.141","0.002","12.6448","0.0016","6.9126","0.0009","90","","90","","90","","1410.9","0.3","297","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C11 H15 Br2 N O Se -","- C11 H15 Br2 N O Se -","- C44 H60 Br8 N4 O4 Se4 -","4","1","","Kulcsar, Monika; Beleaga, Anca; Silvestru, Cristian; Nicolescu, Alina; Deleanu, Calin; Todasca, Cristina; Silvestru, Anca","Solid state structure and solution behaviour of organoselenium(II) compounds containing 2-{E(CH2CH2)2NCH2}C6H4 groups (E = O, NMe).","Dalton transactions (Cambridge, England : 2003)","2007","","21","2187","2196","10.1039/b702629c","","","0.71073","MoKα","","0.0821","0.0685","","","0.1244","0.1298","","","","","","1.173","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005496","12.0689","0.0014","18.435","0.002","10.1788","0.0012","90","","93.069","0.002","90","","2261.4","0.4","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H28 N2 O2 Se2 -","- C22 H28 N2 O2 Se2 -","- C88 H112 N8 O8 Se8 -","4","1","","Kulcsar, Monika; Beleaga, Anca; Silvestru, Cristian; Nicolescu, Alina; Deleanu, Calin; Todasca, Cristina; Silvestru, Anca","Solid state structure and solution behaviour of organoselenium(II) compounds containing 2-{E(CH2CH2)2NCH2}C6H4 groups (E = O, NMe).","Dalton transactions (Cambridge, England : 2003)","2007","","21","2187","2196","10.1039/b702629c","","","0.71073","MoKα","","0.0658","0.0497","","","0.1024","0.109","","","","","","1.126","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005497","9.2813","0.001","9.8308","0.0008","27.659","0.003","90","","90","","90","","2523.7","0.4","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H29 N P2 S -","- C28 H29 N P2 S -","- C112 H116 N4 P8 S4 -","4","1","","Weng, Zhiqiang; Teo, Shihui; Andy Hor, T. S.","Chromium(III) catalysed ethylene tetramerization promoted by bis(phosphino)amines with an N-functionalized pendant.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3493","3498","10.1039/b702636f","","","0.71073","MoKα","","0.1113","0.0838","","","0.1564","0.1758","","","","","","1.077","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005498","11.3331","0.0013","16.3009","0.0019","17.286","0.002","90","","99.248","0.004","90","","3151.9","0.6","223","2","223","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H32 Cl3 Cr N2 P2 S -","- C30 H32 Cl3 Cr N2 P2 S -","- C120 H128 Cl12 Cr4 N8 P8 S4 -","4","1","","Weng, Zhiqiang; Teo, Shihui; Andy Hor, T. S.","Chromium(III) catalysed ethylene tetramerization promoted by bis(phosphino)amines with an N-functionalized pendant.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3493","3498","10.1039/b702636f","","","0.71073","MoKα","","0.1918","0.1172","","","0.1964","0.2264","","","","","","1.095","","","","has coordinates,has disorder","179758","2020-10-21","18:00:00",""
"7005499","11.213","0.002","16.453","0.003","34.766","0.007","90","","90","","90","","6414","2","223","2","223","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C31 H34 Cl3 Cr N2 P2 S -","- C31 H34 Cl3 Cr N2 P2 S -","- C248 H272 Cl24 Cr8 N16 P16 S8 -","8","1","","Weng, Zhiqiang; Teo, Shihui; Andy Hor, T. S.","Chromium(III) catalysed ethylene tetramerization promoted by bis(phosphino)amines with an N-functionalized pendant.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3493","3498","10.1039/b702636f","","","0.71073","MoKα","","0.1024","0.0713","","","0.1314","0.1432","","","","","","1.112","","","","has coordinates","179758","2020-10-21","18:00:00",""
"7005500","12.4773","0.0002","10.4794","0.0002","14.4129","0.0002","90","","111.492","0.001","90","","1753.52","0.05","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Hexacarbony-bis(9-(3-dimethylamino-propyl)-9- phosphabicyclo(3.3.1)nonane)-dicobalt","Hexacarbony-bis(9-(3-dimethylamino-propyl)-9- phosphabicyclo[3.3.1]nonane)-dicobalt","","- C32 H52 Co2 N2 O6 P2 -","- C32 H52 Co2 N2 O6 P2 -","- C64 H104 Co4 N4 O12 P4 -","2","0.5","","Bungu, Peter N.; Otto, Stefanus","Bicyclic phosphines as ligands for cobalt catalysed hydroformylation. Crystal structures of [Co(Phoban[3.3.1]-Q)(CO)(3)](2) (Q = C(2)H(5), C(5)H(11), C(3)H(6)NMe(2), C(6)H(11)).","Dalton transactions (Cambridge, England : 2003)","2007","","27","2876","2884","10.1039/b702709e","","","0.71073","MoKα","","0.079","0.0559","","","0.1412","0.1563","","","","","","1.031","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005501","11.403","0.002","14.964","0.003","16.632","0.003","90","","90","","90","","2838","0.9","293","2","293","2","","","","","","","","5","C m c a","-C 2ac 2","64","Hexacarbonyl-bis(9-ethyl-9-phosphabicyclo(3.3.1)nonane)- dicobalt","Hexacarbonyl-bis(9-ethyl-9-phosphabicyclo[3.3.1]nonane)-dicobalt","","- C26 H38 Co2 O6 P2 -","- C26 H38 Co2 O6 P2 -","- C104 H152 Co8 O24 P8 -","4","","","Bungu, Peter N.; Otto, Stefanus","Bicyclic phosphines as ligands for cobalt catalysed hydroformylation. Crystal structures of [Co(Phoban[3.3.1]-Q)(CO)(3)](2) (Q = C(2)H(5), C(5)H(11), C(3)H(6)NMe(2), C(6)H(11)).","Dalton transactions (Cambridge, England : 2003)","2007","","27","2876","2884","10.1039/b702709e","","","0.71073","MoKα","","0.1004","0.0925","","","0.2109","0.2145","","","","","","1.199","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005502","9.2166","0.0018","9.3388","0.0019","11.667","0.002","92.67","0.03","109.75","0.03","109.15","0.03","878.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Hexacarbony-bis(9-pentyl-9-phosphabicyclo(3.3.1)nonane)- dicobalt","Hexacarbony-bis(9-pentyl-9-phosphabicyclo[3.3.1]nonane)-dicobalt","","- C32 H50 Co2 O6 P2 -","- C32 H50 Co2 O6 P2 -","- C32 H50 Co2 O6 P2 -","1","0.5","","Bungu, Peter N.; Otto, Stefanus","Bicyclic phosphines as ligands for cobalt catalysed hydroformylation. Crystal structures of [Co(Phoban[3.3.1]-Q)(CO)(3)](2) (Q = C(2)H(5), C(5)H(11), C(3)H(6)NMe(2), C(6)H(11)).","Dalton transactions (Cambridge, England : 2003)","2007","","27","2876","2884","10.1039/b702709e","","","0.71073","MoKα","","0.0671","0.0396","","","0.0927","0.1048","","","","","","1.025","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005503","11.058","0.005","10.035","0.005","15.622","0.005","90","0.005","98.695","0.005","90","0.005","1713.6","1.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Hexacarbony-bis(9-cyclohexyl-9-phosphabicyclo(3.3.1)nonane)- dicobalt","Hexacarbony-bis(9-cyclohexyl-9-phosphabicyclo[3.3.1]nonane)-dicobalt","","- C34 H50 Co2 O6 P2 -","- C34 H50 Co2 O6 P2 -","- C68 H100 Co4 O12 P4 -","2","0.5","","Bungu, Peter N.; Otto, Stefanus","Bicyclic phosphines as ligands for cobalt catalysed hydroformylation. Crystal structures of [Co(Phoban[3.3.1]-Q)(CO)(3)](2) (Q = C(2)H(5), C(5)H(11), C(3)H(6)NMe(2), C(6)H(11)).","Dalton transactions (Cambridge, England : 2003)","2007","","27","2876","2884","10.1039/b702709e","","","0.71069","MoKα","","0.031","0.0253","","","0.0626","0.0655","","","","","","1.034","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005504","9.9003","0.0002","18.4544","0.0004","17.5559","0.0004","90","","98.506","0.001","90","","3172.25","0.12","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","2-Cyclopentadienyl-1,3-bis-(2,6-diisopropyl-phenyl)-1,3,2- diazaphospholene","2-Cyclopentadienyl-1,3-bis-(2,6-diisopropyl-phenyl)-1,3,2-diazaphospholene","","- C35 H49 N2 O P -","- C35 H49 N2 O P -","- C140 H196 N8 O4 P4 -","4","1","","Sebastian Burck; Dietrich Gudat; Martin Nieger; Jürgen Tirreé","Structures, dynamic behaviour, and reactivity of P-cyclopentadienyl-substituted 1,3,2-diazaphospholenes","Dalton Transactions","2007","","19","1891","","10.1039/b702720f","","","0.71073","MoKα","","0.0736","0.0562","","","0.168","0.1798","","","","","","1.095","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005505","9.9703","0.0002","10.6255","0.0003","13.799","0.0004","75.585","0.001","85.812","0.001","69.263","0.001","1323.93","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","2-pentamethylcyclopentadienyl-1,3-bis-mesityl-1,3,2- diazaphospholene","2-pentamethylcyclopentadienyl-1,3-bis-mesityl-1,3,2-diazaphospholene","","- C30 H39 N2 P -","- C30 H39 N2 P -","- C60 H78 N4 P2 -","2","1","","Sebastian Burck; Dietrich Gudat; Martin Nieger; Jürgen Tirreé","Structures, dynamic behaviour, and reactivity of P-cyclopentadienyl-substituted 1,3,2-diazaphospholenes","Dalton Transactions","2007","","19","1891","","10.1039/b702720f","","","0.71073","MoKα","","0.0714","0.044","","","0.1118","0.122","","","","","","0.976","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005506","8.595","0.0003","21.7213","0.0008","14.6049","0.0006","90","","92.711","0.002","90","","2723.6","0.18","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Dimethoxyethane-lithium-eta$5-2-(1,3-dimesityl-1,3,2- diazaphospholenyl)-cyclopentadienide","Dimethoxyethane-lithium-eta^5-2-(1,3-dimesityl-1,3,2-diazaphospholenyl)- cyclopentadienide","","- C29 H38 Li N2 O2 P -","- C29 H38 Li N2 O2 P -","- C116 H152 Li4 N8 O8 P4 -","4","1","","Sebastian Burck; Dietrich Gudat; Martin Nieger; Jürgen Tirreé","Structures, dynamic behaviour, and reactivity of P-cyclopentadienyl-substituted 1,3,2-diazaphospholenes","Dalton Transactions","2007","","19","1891","","10.1039/b702720f","","","0.71073","MoKα","","0.0895","0.0496","","","0.114","0.1243","","","","","","0.967","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005507","9.7567","0.0012","11.936","0.002","17.698","0.002","93.138","0.009","94.637","0.009","105.79","0.009","1970.4","0.5","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C36.5 H41 B9 Cl N P2 Rh -","- C36.5 H41 B9 Cl N P2 Rh -","- C73 H82 B18 Cl2 N2 P4 Rh2 -","2","1","","Macías, Ramón; Bould, Jonathan; Holub, Josef; Kennedy, John D.; Stíbr, Bohumil; Thornton-Pett, Mark","Polyhedral metallaheteroborane chemistry. Synthesis, spectroscopy, structure and dynamics of eleven-vertex {RhNB(9)} and {PtCB(9)} metallaheteroboranes.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2885","2897","10.1039/b702767b","","","0.71069","MoKα","","0.0465","0.0347","","","0.0861","0.091","","","","","","1.029","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005508","18.217","0.002","13.785","0.002","20.778","0.004","90","","99.89","0.01","90","","5140.3","1.4","200","2","200","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C18 H35 B9 O P2 Pt -","- C18 H35 B9 O P2 Pt -","- C144 H280 B72 O8 P16 Pt8 -","8","2","","Macías, Ramón; Bould, Jonathan; Holub, Josef; Kennedy, John D.; Stíbr, Bohumil; Thornton-Pett, Mark","Polyhedral metallaheteroborane chemistry. Synthesis, spectroscopy, structure and dynamics of eleven-vertex {RhNB(9)} and {PtCB(9)} metallaheteroboranes.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2885","2897","10.1039/b702767b","","x-ray","0.71073","MoKα","","0.0362","0.0202","","","0.0488","0.0505","","","","","","0.972","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005509","19.257","0.003","8.2868","0.0014","5.8376","0.0007","90","","95.48","0.012","90","","927.3","0.2","298.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H23 Fe N O -","- C22 H23 Fe N O -","- C44 H46 Fe2 N2 O2 -","2","1","","Suzaki, Yuji; Osakada, Kohtaro","Ferrocene-containing [2]- and [3]rotaxanes. Preparation via an end-capping cross-metathesis reaction and electrochemical properties","Dalton Transactions","2007","","23","2376","","10.1039/b702785k","","","0.71069","MoKα","","","0.0739","","","","0.1071","","","","","","1.305","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005510","22.261","0.005","7.449","0.003","11.557","0.003","90","","119.668","0.015","90","","1665.2","0.9","298.1","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H18 Fe O4 -","- C18 H18 Fe O4 -","- C72 H72 Fe4 O16 -","4","0.5","","Suzaki, Yuji; Osakada, Kohtaro","Ferrocene-containing [2]- and [3]rotaxanes. Preparation via an end-capping cross-metathesis reaction and electrochemical properties","Dalton Transactions","2007","","23","2376","","10.1039/b702785k","","","0.71069","MoKα","","","0.0394","","","","0.0552","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005511","8.2067","0.0015","19.623","0.005","18.758","0.004","90","","97.321","0.01","90","","2996.2","1.1","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","dichlorogallium{1,1,1-tris(dimethylarsinomethyl)ethane}trichlorogallium tetrachlorogallate(III)","","- C11 H27 As3 Cl9 Ga3 -","- C11 H27 As3 Cl9 Ga3 -","- C44 H108 As12 Cl36 Ga12 -","4","1","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Structural diversity in gallium(III) complexes of the tripodal triarsine MeC(CH2AsMe2)3.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2207","2210","10.1039/b702791e","","","0.71073","MoKα","","0.109","0.0696","","","0.1247","0.1439","","","","","","1.092","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005512","20.823","0.002","12.6145","0.0015","15.486","0.002","90","","98.03","0.007","90","","4027.9","0.8","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,1,1-tris(dimethylarsinomethyl)ethane-tris(triiodogallium(III)) dichloromethane solvate","","- C12 H29 As3 Cl2 Ga3 I9 -","- C12 H29 As3 Cl2 Ga3 I9 -","- C48 H116 As12 Cl8 Ga12 I36 -","4","1","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Structural diversity in gallium(III) complexes of the tripodal triarsine MeC(CH2AsMe2)3.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2207","2210","10.1039/b702791e","","","0.71073","MoKα","","0.1422","0.0621","","","0.1008","0.121","","","","","","1.035","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005513","9.7853","0.0015","15.267","0.003","17.119","0.003","90","","100.952","0.01","90","","2510.9","0.8","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Dichloro(1,1,1-tris(dimethylarsinomethyl)ethane)gallium(iii) tetrachlorogallate(iii)","Dichloro(1,1,1-tris(dimethylarsinomethyl)ethane)gallium(III) tetrachlorogallate(III)","","- C11 H27 As3 Cl5.75 Ga2 I0.25 -","- C11 H27 As3 Cl5.751 Ga2 I0.249 -","- C44 H108 As12 Cl23.004 Ga8 I0.996 -","4","1","","Cheng, Fei; Hector, Andrew L.; Levason, William; Reid, Gillian; Webster, Michael; Zhang, Wenjian","Structural diversity in gallium(III) complexes of the tripodal triarsine MeC(CH2AsMe2)3.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2207","2210","10.1039/b702791e","","","0.71073","MoKα","","0.0858","0.0546","","","0.0978","0.1116","","","","","","1.115","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005514","8.3491","0.0015","15.467","0.003","11.696","0.002","90","","91.917","0.01","90","","1509.5","0.5","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Diiodo(1,2-bis(methylthiomethyl)benzene)cobalt(II)","","- C10 H14 Co I2 S2 -","- C10 H14 Co I2 S2 -","- C40 H56 Co4 I8 S8 -","4","1","","Evans, John; Levason, William; Manning, Joanna M.; Reid, Gillian; Tsoureas, Nikolaos; Webster, Michael","Reversible structural isomerisation in rare thioether complexes of cobalt(II)‒effects of ligand architecture.","Dalton transactions (Cambridge, England : 2003)","2007","","20","1986","1988","10.1039/b702792c","","","0.71073","MoKα","","0.0425","0.027","","","0.0481","0.0513","","","","","","1.053","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005515","8.1358","0.0005","10.8094","0.001","23.431","0.003","90","","98.816","0.005","90","","2036.3","0.3","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diiodo(tetrakis(methylthiomethyl)methane)cobalt(II) dichloromethane solvate","","- C10 H22 Cl2 Co I2 S4 -","- C10 H22 Cl2 Co I2 S4 -","- C40 H88 Cl8 Co4 I8 S16 -","4","1","","Evans, John; Levason, William; Manning, Joanna M.; Reid, Gillian; Tsoureas, Nikolaos; Webster, Michael","Reversible structural isomerisation in rare thioether complexes of cobalt(II)‒effects of ligand architecture.","Dalton transactions (Cambridge, England : 2003)","2007","","20","1986","1988","10.1039/b702792c","","","0.71073","MoKα","","0.0309","0.0207","","","0.0401","0.0428","","","","","","1.046","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005516","19.3194","0.0009","20.3567","0.0009","22.6289","0.0008","90","","90","","90","","8899.5","0.7","150","1","150","1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C53 H50 Cl N3 O P2 Ru -","- C53 H50 Cl N3 O P2 Ru -","- C424 H400 Cl8 N24 O8 P16 Ru8 -","8","2","","Sui-Seng, Christine; Hadzovic, Alen; Lough, Alan J.; Morris, Robert H.","Novel hydrido-ruthenium(II) complexes with histidine derivatives and their application in the hydrogenation of ketones.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2536","2541","10.1039/b702803b","","","0.71073","MoKα","","0.1681","0.0694","","","0.116","0.1513","","","","","","0.971","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005517","8.9749","0.0001","9.0823","0.0001","21.0062","0.0003","96.5555","0.0008","96.9372","0.0007","109.343","0.0008","1581.92","0.03","200","","200","","","","","","","","from RMITU","4","P -1","-P 1","2","","","","- C38 H32 P2 Pt -","- C38 H32 P2 Pt -","- C76 H64 P4 Pt2 -","2","1","","Bennett, Martin A.; Bhargava, Suresh K.; Messelhäuser, Johannes; Privér, Steven H; Welling, Lee L.; Willis, Anthony C.","ortho-Metallated complexes of platinum(II) and diplatinum(I) containing the carbanions (2-diphenylphosphino)phenyl and (2-diphenylphosphino)-n-tolyl (n = 5, 6).","Dalton transactions (Cambridge, England : 2003)","2007","","29","3158","3169","10.1039/b702808c","","","0.7107","MoKα","","0.0415","0.0306","","0.0391","","0.0361","","","0.962","","","0.961","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005518","16.461","0.0001","34.3557","0.0002","25.2509","0.0001","90","","90","","90","","14280.1","0.13","200","","200","","","","","","","","?","6","P b c a","-P 2ac 2ab","61","","","","- C75.92 H69.8 F6 O1.48 P5 Pt2 -","- C75.92 H67.8 F6 O1.48 P5 Pt2 -","- C607.36 H542.4 F48 O11.84 P40 Pt16 -","8","1","","Bennett, Martin A.; Bhargava, Suresh K.; Messelhäuser, Johannes; Privér, Steven H; Welling, Lee L.; Willis, Anthony C.","ortho-Metallated complexes of platinum(II) and diplatinum(I) containing the carbanions (2-diphenylphosphino)phenyl and (2-diphenylphosphino)-n-tolyl (n = 5, 6).","Dalton transactions (Cambridge, England : 2003)","2007","","29","3158","3169","10.1039/b702808c","","","0.71073","MoKα","","","0.0227","","","","0.0235","","","","","","1.0788","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005519","12.6553","0.0001","23.2268","0.0002","20.6302","0.0002","90","","93.1174","0.0003","90","","6055.11","0.09","200","","200","","","","","","","","?","4","P 1 21/n 1","-P 2yn","14","","","","- C74 H62 P4 Pt2 -","- C74 H62 P4 Pt2 -","- C296 H248 P16 Pt8 -","4","1","","Bennett, Martin A.; Bhargava, Suresh K.; Messelhäuser, Johannes; Privér, Steven H; Welling, Lee L.; Willis, Anthony C.","ortho-Metallated complexes of platinum(II) and diplatinum(I) containing the carbanions (2-diphenylphosphino)phenyl and (2-diphenylphosphino)-n-tolyl (n = 5, 6).","Dalton transactions (Cambridge, England : 2003)","2007","","29","3158","3169","10.1039/b702808c","","","0.71073","MoKα","","","0.0174","","","","0.0174","","","","","","1.088","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005520","21.0147","0.0005","9.7799","0.0003","15.0753","0.0004","90","","92.0661","0.0012","90","","3096.29","0.15","200","","200","","","","","","","","?","4","C 1 2/c 1","-C 2yc","15","","","","- C38 H32 P2 Pt -","- C38 H32 P2 Pt -","- C152 H128 P8 Pt4 -","4","0.5","","Bennett, Martin A.; Bhargava, Suresh K.; Messelhäuser, Johannes; Privér, Steven H; Welling, Lee L.; Willis, Anthony C.","ortho-Metallated complexes of platinum(II) and diplatinum(I) containing the carbanions (2-diphenylphosphino)phenyl and (2-diphenylphosphino)-n-tolyl (n = 5, 6).","Dalton transactions (Cambridge, England : 2003)","2007","","29","3158","3169","10.1039/b702808c","","","0.71073","MoKα","","","0.0246","","","","0.0281","","","","","","1.0817","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005521","20.195","0.0003","23.2688","0.0003","24.9714","0.0003","90","","90","","90","","11734.4","0.3","200","","200","","","","","","","","","4","I b c a","-I 2b 2c","73","","","","- C72 H56 P4 Pt2 -","- C72 H56 P4 Pt2 -","- C576 H448 P32 Pt16 -","8","0.5","","Bennett, Martin A.; Bhargava, Suresh K.; Messelhäuser, Johannes; Privér, Steven H; Welling, Lee L.; Willis, Anthony C.","ortho-Metallated complexes of platinum(II) and diplatinum(I) containing the carbanions (2-diphenylphosphino)phenyl and (2-diphenylphosphino)-n-tolyl (n = 5, 6).","Dalton transactions (Cambridge, England : 2003)","2007","","29","3158","3169","10.1039/b702808c","","","0.7107","MoKα","","0.0649","0.0398","","0.0619","","0.0534","","","2.034","","","1.935","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005522","18.823","0.0001","10.481","0.0001","21.433","0.0002","90","","114.59","","90","","3844.91","0.06","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H26 N8 O6 Re2 -","- C42 H26 N8 O6 Re2 -","- C168 H104 N32 O24 Re8 -","4","1","","Sathiyendiran, Malaichamy; Chang, Che-Hao; Chuang, Chuan-Hung; Luo, Tzuoo-Tsair; Wen, Yuh-Sheng; Lu, Kuang-Lieh","Rigidity-modulated conformation control: a strategy for incorporating flexible building motifs into metallacycles","Dalton Transactions","2007","","19","1872","","10.1039/b702810e","","","0.71073","MoKα","","0.035","0.0263","","","0.0651","0.0738","","","","","","1.197","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005523","13.3125","0.0015","13.6261","0.0018","15.5143","0.0013","73.052","0.009","91.069","0.008","119.326","0.011","2320.9","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C53 H34 N4 O10 Re2 -","- C53 H34 N4 O10 Re2 -","- C106 H68 N8 O20 Re4 -","2","1","","Sathiyendiran, Malaichamy; Chang, Che-Hao; Chuang, Chuan-Hung; Luo, Tzuoo-Tsair; Wen, Yuh-Sheng; Lu, Kuang-Lieh","Rigidity-modulated conformation control: a strategy for incorporating flexible building motifs into metallacycles","Dalton Transactions","2007","","19","1872","","10.1039/b702810e","","","0.71073","MoKα","","0.0993","0.034","","","0.0769","0.0949","","","","","","0.994","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005524","12.765","0.0006","18.9399","0.001","20.229","0.001","72.876","0.003","88.447","0.003","80.926","0.003","4614.5","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- O88.5 Rb10 Ru2 Si2 W22 -","- O88.5 Rb10 Ru2 Si2 W22 -","- O177 Rb20 Ru4 Si4 W44 -","2","1","","Sadakane, Masahiro; Tsukuma, Daisuke; Dickman, Michael H.; Bassil, Bassem S.; Kortz, Ulrich; Capron, Mickaël; Ueda, Wataru","Dimerization of mono-ruthenium substituted alpha-Keggin-type tungstosilicate [alpha-SiW11O39RuIII(H2O)]5- to micro-oxo-bridged dimer in aqueous solution: synthesis, structure, and redox studies.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2833","2838","10.1039/b702813j","","","0.71073","MoKα","","0.088","0.0542","","","0.1436","0.1666","","","","","","1.055","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005525","7.7083","0.0007","12.2654","0.0006","15.8917","0.0013","90","","90","","90","","1502.5","0.2","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H15 N5 Ni S2 -","- C12 H15 N5 Ni S2 -","- C48 H60 N20 Ni4 S8 -","4","1","","Chattopadhyay, Shouvik; Drew, Michael G. B.; Diaz, Carmen; Ghosh, Ashutosh","The first metamagnetic thiocyanato-bridged one-dimensional nickel(II) complex.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2492","2494","10.1039/b702814h","","","0.71073","MoKα","","0.0609","0.0479","","","0.0837","0.0893","","","","","","1.056","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005526","8.7786","0.0016","12.928","0.003","13.292","0.003","110.949","0.005","96.458","0.005","106.949","0.005","1307.4","0.5","93","2","93","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H25 P Se -","- C35 H25 P Se -","- C70 H50 P2 Se2 -","2","1","","Hua, Guoxiong; Li, Yang; Slawin, Alexandra M. Z.; Woollins, J. Derek","Stereoselective synthesis of olefins by a reductive coupling reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1477","1480","10.1039/b702818k","","","0.71073","MoKα","","0.093","0.0563","","","0.0926","0.1082","","","","","","0.945","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005527","9.7367","0.0018","10.2143","0.0017","14.483","0.002","91.593","0.01","91.994","0.011","114.825","0.008","1305.1","0.4","93","2","93","2","","","","","","","","2","P -1","-P 1","2","","","","- C38 H28 -","- C38 H28 -","- C76 H56 -","2","1","","Hua, Guoxiong; Li, Yang; Slawin, Alexandra M. Z.; Woollins, J. Derek","Stereoselective synthesis of olefins by a reductive coupling reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1477","1480","10.1039/b702818k","","","0.7107","MoKα","","0.1042","0.0699","","","0.1437","0.1631","","","","","","1.158","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005528","5.872","0.003","7.437","0.003","11.851","0.007","83.77","0.03","89.75","0.03","81.48","0.02","508.8","0.4","93","2","93","2","","","","","","","","2","P -1","-P 1","2","","","","- C30 H22 -","- C30 H22 -","- C30 H22 -","1","0.5","","Hua, Guoxiong; Li, Yang; Slawin, Alexandra M. Z.; Woollins, J. Derek","Stereoselective synthesis of olefins by a reductive coupling reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1477","1480","10.1039/b702818k","","","0.7107","MoKα","","0.1009","0.0788","","","0.1955","0.2176","","","","","","1.071","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005529","9.786","0.003","9.186","0.003","10.804","0.003","90","","108.007","0.008","90","","923.6","0.5","93","2","93","2","","","","","","","","2","P 1 21 1","P 2yb","4","","","","- C26 H20 -","- C26 H20 -","- C52 H40 -","2","1","","Hua, Guoxiong; Li, Yang; Slawin, Alexandra M. Z.; Woollins, J. Derek","Stereoselective synthesis of olefins by a reductive coupling reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1477","1480","10.1039/b702818k","","","0.71073","MoKα","","0.0357","0.0341","","","0.0871","0.0886","","","","","","1.051","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005530","9.5954","0.0012","15.3661","0.0019","16.1322","0.0019","90","","93.312","0.003","90","","2374.6","0.5","93","2","93","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C30 H28 O4 -","- C30 H28 O4 -","- C120 H112 O16 -","4","1","","Hua, Guoxiong; Li, Yang; Slawin, Alexandra M. Z.; Woollins, J. Derek","Stereoselective synthesis of olefins by a reductive coupling reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","15","1477","1480","10.1039/b702818k","","","0.71073","MoKα","","0.0653","0.0517","","","0.1188","0.1262","","","","","","1.076","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005531","6.6108","0.0002","14.3741","0.0005","7.6321","0.0002","90","","95.83","0.002","90","","721.48","0.04","120","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- As2 Fe2 H4 O9 -","- As2 Fe2 H4 O9 -","- As8 Fe8 H16 O36 -","4","1","","Wiggin, Seth B.; Hughes, Robert W.; Price, Daniel J.; Weller, Mark T.","Iron arsenate frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2935","2941","10.1039/b702847d","","","0.71073","MoKα","","","0.0326","","","","0.0833","","","","","","1.08","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005532","10.1348","0.0001","10.822","0.0002","14.3264","0.0002","90","","90.158","0.003","90","","1571.3","0.04","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H22 As8 Fe6 N2 O34 -","- C4 H22 As8 Fe6 N2 O34 -","- C8 H44 As16 Fe12 N4 O68 -","2","0.5","","Wiggin, Seth B.; Hughes, Robert W.; Price, Daniel J.; Weller, Mark T.","Iron arsenate frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2935","2941","10.1039/b702847d","","","0.71073","MoKα","","0.0227","0.0205","","","0.048","0.049","","","","","","1.086","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005533","6.7503","0.0002","7.7757","0.0003","11.2924","0.0003","72.396","0.002","80.801","0.002","79.085","0.002","551.4","0.03","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H12 As6 Fe4 N2 O22 -","- C4 H12 As6 Fe4 N2 O22 -","- C4 H12 As6 Fe4 N2 O22 -","1","0.5","","Wiggin, Seth B.; Hughes, Robert W.; Price, Daniel J.; Weller, Mark T.","Iron arsenate frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2935","2941","10.1039/b702847d","","","0.71073","MoKα","","0.0366","0.0308","","","0.0702","0.0726","","","","","","1.064","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005534","6.6375","0.0018","22.195","0.006","17.312","0.006","90","","94.14","0.02","90","","2543.7","1.3","120","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H22 As5 Fe5 N2 O26 -","- C4 H22 As5 Fe5 N2 O26 -","- C16 H88 As20 Fe20 N8 O104 -","4","1","","Wiggin, Seth B.; Hughes, Robert W.; Price, Daniel J.; Weller, Mark T.","Iron arsenate frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2935","2941","10.1039/b702847d","","","0.71073","MoKα","","","0.0541","","","","0.1317","","","","","","1.039","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005535","6.6364","0.0003","10.8179","0.0004","12.2213","0.0005","109.927","0.002","100.807","0.002","101.32","0.002","777.4","0.06","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H21 As7 Fe6 N2 O31 -","- C6 H21 As7 Fe6 N2 O31 -","- C6 H21 As7 Fe6 N2 O31 -","1","0.5","","Wiggin, Seth B.; Hughes, Robert W.; Price, Daniel J.; Weller, Mark T.","Iron arsenate frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2935","2941","10.1039/b702847d","","","0.71073","MoKα","","0.0464","0.0441","","","0.1208","0.1223","","","","","","1.059","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005536","5.2652","0.0003","5.4841","0.0003","7.3932","0.0004","110.669","0.003","105.318","0.003","98.16","0.004","185.984","0.019","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- As2 Fe2 H2 Li2 O10 -","- As2 Fe2 H2 Li2 O10 -","- As2 Fe2 H2 Li2 O10 -","1","0.5","","Wiggin, Seth B.; Hughes, Robert W.; Price, Daniel J.; Weller, Mark T.","Iron arsenate frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2935","2941","10.1039/b702847d","","","0.71073","MoKα","","0.0316","0.027","","","0.0662","0.0686","","","","","","0.956","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005537","11.658","0.003","14.597","0.004","19.874","0.005","91.661","0.005","97.236","0.004","100.182","0.004","3297.7","1.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H44 Ag2 N2 O4 S2 -","- C30 H44 Ag2 N2 O4 S2 -","- C120 H176 Ag8 N8 O16 S8 -","4","2","","Barreiro, Elena; Casas, José S; Couce, María D; Sánchez, Agustín; Seoane, Rafael; Sordo, José; Varela, José M; Vázquez-López, Ezequiel M","Synthesis and antimicrobial activities of silver(I) sulfanylcarboxylates. Structural isomers with identically or unequally coordinated Ag centers in an Ag4S4 ring.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3074","3085","10.1039/b702936e","","","0.71073","MoKα","","0.0554","0.0336","","","0.0634","0.0684","","","","","","1.017","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005538","13.115","0.005","17.31","0.005","27.739","0.005","90","0.005","99.078","0.005","90","0.005","6218","3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H96 Ag4 N4 O8 S4 -","- C52 H96 Ag4 N4 O8 S4 -","- C208 H384 Ag16 N16 O32 S16 -","4","1","","Barreiro, Elena; Casas, José S; Couce, María D; Sánchez, Agustín; Seoane, Rafael; Sordo, José; Varela, José M; Vázquez-López, Ezequiel M","Synthesis and antimicrobial activities of silver(I) sulfanylcarboxylates. Structural isomers with identically or unequally coordinated Ag centers in an Ag4S4 ring.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3074","3085","10.1039/b702936e","","","0.71069","MoKα","","0.0803","0.059","","","0.1273","0.1364","","","","","","1.192","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005539","8.0242","0.0005","9.3141","0.0006","15.3597","0.001","96.607","0.001","97.359","0.001","92.542","0.001","1128.9","0.13","218","2","218","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H34 Cl Cu N4 Na O11 -","- C16 H34 Cl Cu N4 Na O11 -","- C32 H68 Cl2 Cu2 N8 Na2 O22 -","2","1","","Heroux, Katie J.; Woodin, Katrina S.; Tranchemontagne, David J.; Widger, Peter C. B.; Southwick, Evan; Wong, Edward H.; Weisman, Gary R.; Tomellini, Sterling A.; Wadas, Thaddeus J.; Anderson, Carolyn J.; Kassel, Scott; Golen, James A.; Rheingold, Arnold L.","The long and short of it: the influence of N-carboxyethyl versusN-carboxymethyl pendant arms on in vitro and in vivo behavior of copper complexes of cross-bridged tetraamine macrocycles.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2150","2162","10.1039/b702938a","","","0.71073","MoKα","","0.0372","0.0358","","","0.1","0.1011","","","","","","1.054","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005540","27.6657","0.0019","7.9539","0.0006","10.7296","0.0007","90","","90","","90","","2361.1","0.3","213","2","213","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C19 H37 Cl Cu N4 O9 -","- C19 H37 Cl Cu N4 O9 -","- C76 H148 Cl4 Cu4 N16 O36 -","4","1","","Heroux, Katie J.; Woodin, Katrina S.; Tranchemontagne, David J.; Widger, Peter C. B.; Southwick, Evan; Wong, Edward H.; Weisman, Gary R.; Tomellini, Sterling A.; Wadas, Thaddeus J.; Anderson, Carolyn J.; Kassel, Scott; Golen, James A.; Rheingold, Arnold L.","The long and short of it: the influence of N-carboxyethyl versusN-carboxymethyl pendant arms on in vitro and in vivo behavior of copper complexes of cross-bridged tetraamine macrocycles.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2150","2162","10.1039/b702938a","","","0.71073","MoKα","","0.0261","0.0246","","","0.0605","0.0614","","","","","","1.028","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005541","8.7623","0.0005","17.9633","0.001","17.2184","0.001","90","","93.218","0.001","90","","2705.9","0.3","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H38 Cl2 Cu N4 O14 -","- C18 H38 Cl2 Cu N4 O14 -","- C72 H152 Cl8 Cu4 N16 O56 -","4","1","","Heroux, Katie J.; Woodin, Katrina S.; Tranchemontagne, David J.; Widger, Peter C. B.; Southwick, Evan; Wong, Edward H.; Weisman, Gary R.; Tomellini, Sterling A.; Wadas, Thaddeus J.; Anderson, Carolyn J.; Kassel, Scott; Golen, James A.; Rheingold, Arnold L.","The long and short of it: the influence of N-carboxyethyl versusN-carboxymethyl pendant arms on in vitro and in vivo behavior of copper complexes of cross-bridged tetraamine macrocycles.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2150","2162","10.1039/b702938a","","","0.71073","MoKα","","0.0521","0.0404","","","0.1005","0.1075","","","","","","1.027","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005542","15.6342","0.0017","34.587","0.004","9.4238","0.001","90","","90","","90","","5095.8","1","213","2","213","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C37 H70 Cl3 Cu2 N8 Na3 O21 -","- C37 H67 Cl3 Cu2 N8 Na3 O21 -","- C148 H268 Cl12 Cu8 N32 Na12 O84 -","4","1","","Heroux, Katie J.; Woodin, Katrina S.; Tranchemontagne, David J.; Widger, Peter C. B.; Southwick, Evan; Wong, Edward H.; Weisman, Gary R.; Tomellini, Sterling A.; Wadas, Thaddeus J.; Anderson, Carolyn J.; Kassel, Scott; Golen, James A.; Rheingold, Arnold L.","The long and short of it: the influence of N-carboxyethyl versusN-carboxymethyl pendant arms on in vitro and in vivo behavior of copper complexes of cross-bridged tetraamine macrocycles.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2150","2162","10.1039/b702938a","","","0.71073","MoKα","","0.0612","0.0538","","","0.1291","0.1355","","","","","","1.07","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005543","13.2828","0.0008","15.6644","0.0007","18.5844","0.0012","90","","105.269","0.007","90","","3730.3","0.4","200","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C90.79 H72.79 Cl2.36 N2 O7 Ti2 -","- C90.788 H72.7874 Cl2.364 N2 O7 Ti2 -","- C181.576 H145.575 Cl4.728 N4 O14 Ti4 -","2","0.5","","Bernardinelli, Gérald; Seidel, Thomas M.; Kündig, E Peter; Prins, Leonard J.; Kolarovic, Andrej; Mba, Miriam; Pontini, Marta; Licini, Giulia","Stereoselective dimerization of racemic C3-symmetric Ti(IV) amine triphenolate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","16","1573","1576","10.1039/b702958f","","","0.71073","MoKα","","","0.044","","","","0.042","","","","","","1.33","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005544","9.4056","0.0007","11.264","0.005","29.3343","0.0017","90","","96.343","0.008","90","","3088.8","1.4","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(iPr2Im)2(CN)(Ph)Ni(ii)","(iPr2Im)2(CN)(Ph)Ni(II)","","- C29 H37 N5 Ni O -","- C29 H37 N5 Ni O -","- C116 H148 N20 Ni4 O4 -","4","1","","Schaub, Thomas; Döring, Christian; Radius, Udo","Efficient nickel mediated carbon-carbon bond cleavage of organonitriles.","Dalton transactions (Cambridge, England : 2003)","2007","","20","1993","2002","10.1039/b702959d","","","0.71073","MoKα","","0.0567","0.0399","","","0.1009","0.1094","","","","","","1.007","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005545","15.0661","0.0019","9.8684","0.0012","38.201","0.006","90","","93.117","0.018","90","","5671.3","1.3","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(iPr2Im)2(CN)(2,4-Dimethoxyphenyl)Ni(ii)","(iPr2Im)2(CN)(2,4-Dimethoxyphenyl)Ni(II)","","- C27 H41 N5 Ni O2 -","- C27 H41 N5 Ni O2 -","- C216 H328 N40 Ni8 O16 -","8","2","","Schaub, Thomas; Döring, Christian; Radius, Udo","Efficient nickel mediated carbon-carbon bond cleavage of organonitriles.","Dalton transactions (Cambridge, England : 2003)","2007","","20","1993","2002","10.1039/b702959d","","","0.71073","MoKα","","0.1014","0.0507","","","0.1081","0.1308","","","","","","0.951","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005546","8.9864","0.0018","9.6288","0.0019","16.85","0.003","104.83","0.03","92.53","0.03","92.19","0.03","1406.2","0.5","203","2","203","2","","","","","","","","4","P -1","-P 1","2","(iPr2Im)2(CN)(2-Pyridyl)Ni(ii)","(iPr2Im)2(CN)(2-Pyridyl)Ni(II)","","- C27.5 H37 N6 Ni -","- C27.5 H37 N6 Ni -","- C55 H74 N12 Ni2 -","2","1","","Schaub, Thomas; Döring, Christian; Radius, Udo","Efficient nickel mediated carbon-carbon bond cleavage of organonitriles.","Dalton transactions (Cambridge, England : 2003)","2007","","20","1993","2002","10.1039/b702959d","","","0.71073","MoKα","","0.0502","0.0395","","","0.1033","0.1087","","","","","","1.032","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005547","14.8825","0.0012","9.708","0.0005","23.203","0.002","90","","104.665","0.01","90","","3243.1","0.4","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(iPr2Im)2(CN)(SiMe3)Ni(ii)","(iPr2Im)2(CN)(SiMe3)Ni(II)","","- C29 H49 N5 Ni Si -","- C29 H49 N5 Ni Si -","- C116 H196 N20 Ni4 Si4 -","4","1","","Schaub, Thomas; Döring, Christian; Radius, Udo","Efficient nickel mediated carbon-carbon bond cleavage of organonitriles.","Dalton transactions (Cambridge, England : 2003)","2007","","20","1993","2002","10.1039/b702959d","","","0.71073","MoKα","","0.1096","0.0504","","","0.0931","0.1107","","","","","","0.944","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005548","11.3397","0.0006","13.1546","0.0006","9.3845","0.0007","90","","98.118","0.009","90","","1385.85","0.14","203","2","203","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","(iPr2Im)2(CN)2Ni(ii)","(iPr2Im)2(CN)2Ni(II)","","- C26 H38 N6 Ni -","- C26 H38 N6 Ni -","- C52 H76 N12 Ni2 -","2","0.25","","Schaub, Thomas; Döring, Christian; Radius, Udo","Efficient nickel mediated carbon-carbon bond cleavage of organonitriles.","Dalton transactions (Cambridge, England : 2003)","2007","","20","1993","2002","10.1039/b702959d","","","0.71073","MoKα","","0.0327","0.0319","","","0.0806","0.0811","","","","","","1.173","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005549","31.961","0.004","10.228","0.002","23.529","0.006","90","","124.61","0.02","90","","6330","3","203","2","203","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","(iPr2Im)2(CN)(C4H8CN)Ni(ii) benzene solvate","(iPr2Im)2(CN)(C4H8CN)Ni(II) benzene solvate","","- C30 H46 N6 Ni -","- C30 H46 N6 Ni -","- C240 H368 N48 Ni8 -","8","1","","Schaub, Thomas; Döring, Christian; Radius, Udo","Efficient nickel mediated carbon-carbon bond cleavage of organonitriles.","Dalton transactions (Cambridge, England : 2003)","2007","","20","1993","2002","10.1039/b702959d","","","0.71073","MoKα","","0.0473","0.0396","","","0.1036","0.1092","","","","","","1.04","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005550","10.203","0.003","10.203","0.003","17.908","0.004","90","","90","","120","","1614.5","0.8","200","2","200","2","","","","","","","","5","P -3 c 1","-P 3 2""c","165","","","","- C18 H30 Cl2 O23 Yb -","- C18 H30 Cl2 O23 Yb -","- C36 H60 Cl4 O46 Yb2 -","2","0.166667","","Starynowicz, Przemysław","An ytterbium(II) complex with dimethyl ester of oxydiacetic acid.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2779","2783","10.1039/b702971c","","","0.71073","MoKα","","0.219","0.04","","","0.0776","0.101","","","","","","0.901","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005551","10.407","0.0001","12.0343","0.0001","12.47","0.0002","89.464","0.001","72.864","0.001","70.868","0.001","1403.4","0.03","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","(PbCl(C6H3iPr2NC(Me)CHC(Me)NC6H3iPr2))","","","- C29 H41 Cl N2 Pb -","- C29 H41 Cl N2 Pb -","- C58 H82 Cl2 N4 Pb2 -","2","1","","Chen, Matthew; Fulton, J. Robin; Hitchcock, Peter B.; Johnstone, Nick C.; Lappert, Michael F.; Protchenko, Andrey V.","Synthesis and theoretical studies on rare three-coordinate lead complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2770","2778","10.1039/b702994b","","x-ray","0.71073","MoKα","","0.0223","0.0197","","","0.0443","0.0453","","","","","","1.071","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005552","10.4137","0.0002","12.084","0.0004","12.4677","0.0004","89.224","0.002","72.815","0.002","70.638","0.002","1407.89","0.07","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C29 H41 Br N2 Pb -","- C29 H41 Br N2 Pb -","- C58 H82 Br2 N4 Pb2 -","2","1","","Chen, Matthew; Fulton, J. Robin; Hitchcock, Peter B.; Johnstone, Nick C.; Lappert, Michael F.; Protchenko, Andrey V.","Synthesis and theoretical studies on rare three-coordinate lead complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2770","2778","10.1039/b702994b","","x-ray","0.71073","MoKα","","0.0401","0.0372","","","0.0939","0.0949","","","","","","1.26","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005553","22.3656","0.0005","11.2144","0.0003","11.6021","0.0003","90","","101.411","0.001","90","","2852.48","0.12","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H41 I N2 Pb -","- C29 H41 I N2 Pb -","- C116 H164 I4 N8 Pb4 -","4","1","","Chen, Matthew; Fulton, J. Robin; Hitchcock, Peter B.; Johnstone, Nick C.; Lappert, Michael F.; Protchenko, Andrey V.","Synthesis and theoretical studies on rare three-coordinate lead complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2770","2778","10.1039/b702994b","","x-ray","0.71073","MoKα","","0.0413","0.0332","","","0.0714","0.0739","","","","","","1.166","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005554","11.9346","0.0001","13.3033","0.0001","14.6879","0.0002","97.37","","100.251","0.001","115.65","0.001","2012.46","0.04","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C38 H62 N3 Pb Si2 -","- C38 H62 N3 Pb Si2 -","- C76 H124 N6 Pb2 Si4 -","2","1","","Chen, Matthew; Fulton, J. Robin; Hitchcock, Peter B.; Johnstone, Nick C.; Lappert, Michael F.; Protchenko, Andrey V.","Synthesis and theoretical studies on rare three-coordinate lead complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2770","2778","10.1039/b702994b","","x-ray","0.71073","MoKα","","0.0289","0.025","","","0.0562","0.0578","","","","","","1.027","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005555","9.581","0.003","10.365","0.003","38.296","0.012","90","","90","","90","","3803","2","133","2","133","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C42 H52 Li2 N4 O2 -","- C42 H52 Li2 N4 O2 -","- C168 H208 Li8 N16 O8 -","4","1","","Meyer, Nils; Roesky, Peter W.","Chiral bridged aminotroponiminate complexes of the lanthanides.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2652","2657","10.1039/b703020g","","","0.71073","MoKα","","0.0794","0.0598","","","0.1246","0.1326","","","","","","1.076","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005556","8.8136","0.0011","14.005","0.002","34.259","0.005","90","","90","","90","","4228.7","1","210","2","210","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C42 H52 Cl Ho N4 O2 -","- C42 H52 Cl Ho N4 O2 -","- C168 H208 Cl4 Ho4 N16 O8 -","4","1","","Meyer, Nils; Roesky, Peter W.","Chiral bridged aminotroponiminate complexes of the lanthanides.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2652","2657","10.1039/b703020g","","","0.71073","MoKα","","0.0886","0.055","","","0.1135","0.1272","","","","","","0.928","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005557","9.0455","0.0002","19.2532","0.0006","26.6334","0.0009","90","","90","","90","","4638.3","0.2","200","2","200","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C52 H60 Cl Er N4 O -","- C52 H60 Cl Er N4 O -","- C208 H240 Cl4 Er4 N16 O4 -","4","1","","Meyer, Nils; Roesky, Peter W.","Chiral bridged aminotroponiminate complexes of the lanthanides.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2652","2657","10.1039/b703020g","","","0.71073","MoKα","","0.0466","0.0395","","","0.091","0.0938","","","","","","1.031","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005558","8.7538","0.0007","15.9058","0.0009","15.8563","0.0014","90","","103.728","0.007","90","","2144.7","0.3","200","2","200","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C46 H60 Cl N4 O3 Yb -","- C46 H60 Cl N4 O3 Yb -","- C92 H120 Cl2 N8 O6 Yb2 -","2","1","","Meyer, Nils; Roesky, Peter W.","Chiral bridged aminotroponiminate complexes of the lanthanides.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2652","2657","10.1039/b703020g","","","0.71073","MoKα","","0.0896","0.0821","","","0.2152","0.2188","","","","","","1.273","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005559","8.7575","0.0005","15.8985","0.0007","15.8618","0.001","90","","103.662","0.005","90","","2146","0.2","200","2","200","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C46 H60 Cl N4 O3 Yb -","- C46 H60 Cl N4 O3 Yb -","- C92 H120 Cl2 N8 O6 Yb2 -","2","1","","Meyer, Nils; Roesky, Peter W.","Chiral bridged aminotroponiminate complexes of the lanthanides.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2652","2657","10.1039/b703020g","","","0.71073","MoKα","","0.0494","0.0417","","","0.1013","0.1038","","","","","","0.968","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005560","21.976","0.004","22.716","0.005","9.944","0.002","90","","90","","90","","4964.1","1.7","200","2","200","2","","","","","","","","7","P 21 21 2","P 2 2ab","18","","","","- C50 H68 Cl2 Li N4 O4 Yb -","- C50 H68 Cl2 Li N4 O4 Yb -","- C200 H272 Cl8 Li4 N16 O16 Yb4 -","4","1","","Meyer, Nils; Roesky, Peter W.","Chiral bridged aminotroponiminate complexes of the lanthanides.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2652","2657","10.1039/b703020g","","","0.71073","MoKα","","0.0418","0.0355","","","0.0856","0.0882","","","","","","1.02","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005561","9.3793","0.0005","15.7831","0.0011","14.0708","0.0008","90","","105.487","0.004","90","","2007.3","0.2","200","2","200","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C47 H57 N4 O2 Yb -","- C47 H57 N4 O2 Yb -","- C94 H114 N8 O4 Yb2 -","2","1","","Meyer, Nils; Roesky, Peter W.","Chiral bridged aminotroponiminate complexes of the lanthanides.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2652","2657","10.1039/b703020g","","","0.71073","MoKα","","0.0829","0.0763","","","0.1949","0.1995","","","","","","1.081","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005562","8.3651","0.0002","10.8743","0.0003","20.4975","0.0007","80.968","0.002","81.369","0.002","71.935","0.002","1740.42","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C33.5 H29 Cl N2 O9 Os3 -","- C33.5 H29 Cl N2 O9 Os3 -","- C67 H58 Cl2 N4 O18 Os6 -","2","1","","Cooke, Craig E.; Ramnial, Taramatee; Jennings, Michael C.; Pomeroy, Roland K.; Clyburne, Jason A. C.","Non-classical NHC transfers from the reaction of (IMes)AgCl with osmium carbonyl clusters.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1755","1758","10.1039/b703071c","","","0.71073","MoKα","","0.0437","0.034","","","0.0802","0.0836","","","","","","1.028","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005563","8.1388","0.0006","12.5307","0.0009","18.048","0.001","93.746","0.004","97.217","0.004","97.567","0.003","1803.9","0.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H24 Ag Cl N2 O10 Os3 -","- C31 H24 Ag Cl N2 O10 Os3 -","- C62 H48 Ag2 Cl2 N4 O20 Os6 -","2","1","","Cooke, Craig E.; Ramnial, Taramatee; Jennings, Michael C.; Pomeroy, Roland K.; Clyburne, Jason A. C.","Non-classical NHC transfers from the reaction of (IMes)AgCl with osmium carbonyl clusters.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1755","1758","10.1039/b703071c","","","0.71073","MoKα","","0.1152","0.0538","","","0.0996","0.1181","","","","","","0.943","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005564","14.5755","0.0008","21.6908","0.0016","17.6188","0.0011","90","","106.714","0.003","90","","5334.9","0.6","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C41 H25 Ag Cl2 N2 O20 Os6 -","- C41 H25 Ag Cl2 N2 O20 Os6 -","- C164 H100 Ag4 Cl8 N8 O80 Os24 -","4","0.5","","Cooke, Craig E.; Ramnial, Taramatee; Jennings, Michael C.; Pomeroy, Roland K.; Clyburne, Jason A. C.","Non-classical NHC transfers from the reaction of (IMes)AgCl with osmium carbonyl clusters.","Dalton transactions (Cambridge, England : 2003)","2007","","18","1755","1758","10.1039/b703071c","","","0.71073","MoKα","","0.1404","0.0737","","","0.1721","0.2044","","","","","","1.01","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005565","17.895","0.0004","8.7368","0.0002","24.0711","0.0006","90","","105.98","0.0009","90","","3617.96","0.15","173","","173","","","","","","","","","8","C 1 c 1","C -2yc","9","","","","- C30 H47 Cl Cu F3 N7 O3 S -","- C30 H47 Cl Cu F3 N7 O3 S -","- C120 H188 Cl4 Cu4 F12 N28 O12 S4 -","4","1","","Petrovic, Dejan; Bannenberg, Thomas; Randoll, Sören; Jones, Peter G.; Tamm, Matthias","Synthesis and reactivity of copper(I) complexes containing a bis(imidazolin-2-imine) pincer ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2812","2822","10.1039/b703183a","","","0.71073","MoKα","","0.0479","0.0406","","","0.0916","0.0957","","","","","","1.026","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005566","9.3457","0.0001","16.0642","0.0001","28.0336","0.0002","89.1268","0.0003","81.5051","0.0003","74.4997","0.0005","4009.85","0.06","173","","173","","","","","","","","","7","P -1","-P 1","2","","","","- C33 H54 Cu F6 N7 O4 P -","- C33 H54 Cu F6 N7 O4 P -","- C132 H216 Cu4 F24 N28 O16 P4 -","4","2","","Petrovic, Dejan; Bannenberg, Thomas; Randoll, Sören; Jones, Peter G.; Tamm, Matthias","Synthesis and reactivity of copper(I) complexes containing a bis(imidazolin-2-imine) pincer ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2812","2822","10.1039/b703183a","","","0.71073","MoKα","","0.0621","0.049","","","0.1161","0.1228","","","","","","1.047","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005567","14.9281","0.0012","10.1533","0.0008","22.6904","0.0016","90","","98.363","0.003","90","","3402.6","0.5","133","","133","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H47 Cl3 Cu2 N7 -","- C29 H47 Cl3 Cu2 N7 -","- C116 H188 Cl12 Cu8 N28 -","4","1","","Petrovic, Dejan; Bannenberg, Thomas; Randoll, Sören; Jones, Peter G.; Tamm, Matthias","Synthesis and reactivity of copper(I) complexes containing a bis(imidazolin-2-imine) pincer ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2812","2822","10.1039/b703183a","","","0.71073","MoKα","","0.0365","0.0284","","","0.0723","0.0781","","","","","","1.043","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005568","10.3778","0.0014","10.8771","0.0014","15.85","0.002","78.792","0.003","76.017","0.003","87.24","0.003","1703","0.4","133","","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H53 Br Cu N7 O -","- C32 H53 Br Cu N7 O -","- C64 H106 Br2 Cu2 N14 O2 -","2","1","","Petrovic, Dejan; Bannenberg, Thomas; Randoll, Sören; Jones, Peter G.; Tamm, Matthias","Synthesis and reactivity of copper(I) complexes containing a bis(imidazolin-2-imine) pincer ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2812","2822","10.1039/b703183a","","","0.71073","MoKα","","0.0875","0.0404","","","0.0772","0.093","","","","","","1.011","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005569","25.874","0.0002","12.8859","0.0001","29.9331","0.0003","90","","104.44","","90","","9664.71","0.14","200","2","200","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C99 H76 F18 N12 O5 P3 Rh3 -","- C99 H72 F18 N12 O5 P3 Rh3 -","- C396 H288 F72 N48 O20 P12 Rh12 -","4","1","","Su, Wei Lin; Yu, Yu Cheng; Tseng, Mei Ching; Wang, Shao Pin; Huang, Wen Liang","Photophysical and electrochemical properties of new ortho-metalated complexes of rhodium(III) containing 2,2'-dipyridylketone and 2,2'-dipyridylamine. An experimental and theoretical study.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3440","3449","10.1039/b703216a","","","0.71073","MoKα","","0.0874","0.0551","","","0.1413","0.1607","","","","","","1.053","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005570","11.1828","0.0002","16.6037","0.0004","31.8082","0.0008","90","","90","","90","","5906","0.2","200","2","200","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C32 H25 F6 N5 P Rh -","- C32 H25 F6 N5 P Rh -","- C256 H200 F48 N40 P8 Rh8 -","8","1","","Su, Wei Lin; Yu, Yu Cheng; Tseng, Mei Ching; Wang, Shao Pin; Huang, Wen Liang","Photophysical and electrochemical properties of new ortho-metalated complexes of rhodium(III) containing 2,2'-dipyridylketone and 2,2'-dipyridylamine. An experimental and theoretical study.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3440","3449","10.1039/b703216a","","","0.71073","MoKα","","0.0658","0.0389","","","0.0998","0.1281","","","","","","1.105","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005571","8.3231","0.0003","9.7685","0.0003","9.9897","0.0003","68.85","0.002","78.751","0.002","83.055","0.002","741.81","0.04","296","2","296","2","","","","","","","","5","P 1","P 1","1","","","","- C25 H39 Cl2 N5 O2 -","- C25 H39 Cl2 N5 O2 -","- C25 H39 Cl2 N5 O2 -","1","1","","Houghton, Jennifer; Dyson, Gavin; Douthwaite, Richard E.; Whitwood, Adrian C.; Kariuki, Benson M.","Structural variation, dynamics, and catalytic application of palladium(II) complexes of di-N-heterocyclic carbene-amine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3065","3073","10.1039/b703248j","","","1.54178","CuKα","","0.0814","0.0781","","","0.1751","0.1796","","","","","","1.057","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005572","11.6678","0.0007","13.3876","0.0008","18.3438","0.0011","86.42","0.002","80.429","0.001","89.483","0.001","2820","0.3","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C68 H76 B2 N6 -","- C68 H76 B2 N6 -","- C136 H152 B4 N12 -","2","1","","Houghton, Jennifer; Dyson, Gavin; Douthwaite, Richard E.; Whitwood, Adrian C.; Kariuki, Benson M.","Structural variation, dynamics, and catalytic application of palladium(II) complexes of di-N-heterocyclic carbene-amine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3065","3073","10.1039/b703248j","","","0.71073","MoKα","","0.066","0.0466","","","0.1118","0.1212","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005573","12.959","0.0011","13.4961","0.0011","16.319","0.0014","105.876","0.002","102.093","0.002","92.241","0.002","2670.2","0.4","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H37 Cl2 N5 Pd -","- C25 H37 Cl2 N5 Pd -","- C100 H148 Cl8 N20 Pd4 -","4","2","","Houghton, Jennifer; Dyson, Gavin; Douthwaite, Richard E.; Whitwood, Adrian C.; Kariuki, Benson M.","Structural variation, dynamics, and catalytic application of palladium(II) complexes of di-N-heterocyclic carbene-amine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3065","3073","10.1039/b703248j","","","0.71073","MoKα","","0.1012","0.0474","","","0.0986","0.1171","","","","","","0.965","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005574","13.3436","0.0009","12.2206","0.0009","18.1927","0.0014","90","","94.253","0.002","90","","2958.5","0.4","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H37 B2 F8 N7 Pd -","- C22 H37 B2 F8 N7 Pd -","- C88 H148 B8 F32 N28 Pd4 -","4","1","","Houghton, Jennifer; Dyson, Gavin; Douthwaite, Richard E.; Whitwood, Adrian C.; Kariuki, Benson M.","Structural variation, dynamics, and catalytic application of palladium(II) complexes of di-N-heterocyclic carbene-amine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3065","3073","10.1039/b703248j","","","0.71073","MoKα","","0.0628","0.0445","","","0.0978","0.105","","","","","","1.044","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005575","17.7978","0.0011","17.6584","0.0011","18.0403","0.0012","90","","100.926","0.002","90","","5566.9","0.6","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C62 H74 B2 N Na O7 S -","- C62 H72 B2 N Na O7 S -","- C248 H288 B8 N4 Na4 O28 S4 -","4","1","","Elsegood, Mark R. J.; Kelly, Paul F.; Reid, Gillian; Staniland, Paul M.","Sulfimidation‒a new and versatile strategy for the post ring-closure derivatisation of mixed thia/oxa crowns.","Dalton transactions (Cambridge, England : 2003)","2007","","17","1665","1667","10.1039/b703252h","","","0.71073","MoKα","","0.1275","0.0561","","","0.1248","0.1624","","","","","","1.024","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005576","13.6709","0.0006","14.251","0.0007","22.0061","0.001","95.678","0.002","98.668","0.002","114.616","0.002","3790.3","0.3","150","2","150","2","","","","","","","","9","P -1","-P 1","2","","","","- C74 H88 B2 Cl6 D2 N Na O10 S2 -","- C74 H90 B2 Cl6 N Na O10 S2 -","- C148 H180 B4 Cl12 N2 Na2 O20 S4 -","2","1","","Elsegood, Mark R. J.; Kelly, Paul F.; Reid, Gillian; Staniland, Paul M.","Sulfimidation‒a new and versatile strategy for the post ring-closure derivatisation of mixed thia/oxa crowns.","Dalton transactions (Cambridge, England : 2003)","2007","","17","1665","1667","10.1039/b703252h","","","0.71073","MoKα","","0.117","0.0719","","","0.1948","0.2376","","","","","","1.032","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005577","10.616","0.002","40.964","0.009","13.602","0.003","90","","96.722","0.004","90","","5874","2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H84 Cl N O5 P2 Pd2 -","- C56 H84 Cl N O5 P2 Pd2 -","- C224 H336 Cl4 N4 O20 P8 Pd8 -","4","1","","Krishna, Heera; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam; Murugavel, Ramaswamy; Prabusankar, Ganesan","Unusual reactivity of a sterically hindered diphosphazane ligand, EtN{P(OR)(2)}(2), (R = C(6)H(3)(Pr(I))(2)-2,6) towards (eta(3)-allyl)palladium precursors.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2908","2914","10.1039/b703308g","","","0.71073","MoKα","","0.0837","0.0529","","","0.1193","0.1305","","","","","","0.998","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005578","13.714","0.003","15.294","0.003","16.424","0.003","78.172","0.004","81.154","0.004","80.768","0.004","3301.8","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C115 H172 Cl10 N2 O10 P4 Pd8 -","- C115 H146 Cl10 N2 O10 P4 Pd8 -","- C115 H146 Cl10 N2 O10 P4 Pd8 -","1","0.5","","Krishna, Heera; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam; Murugavel, Ramaswamy; Prabusankar, Ganesan","Unusual reactivity of a sterically hindered diphosphazane ligand, EtN{P(OR)(2)}(2), (R = C(6)H(3)(Pr(I))(2)-2,6) towards (eta(3)-allyl)palladium precursors.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2908","2914","10.1039/b703308g","","","0.71073","MoKα","","0.101","0.0737","","","0.221","0.2411","","","","","","0.978","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005579","10.6926","0.0013","22.839","0.003","24.066","0.003","90","","98.332","0.002","90","","5815.1","1.3","273","2","273","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C53 H79 Cl2 N O5 P2 Pd2 -","- C53 H78 Cl2 N O5 P2 Pd2 -","- C212 H312 Cl8 N4 O20 P8 Pd8 -","4","1","","Krishna, Heera; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam; Murugavel, Ramaswamy; Prabusankar, Ganesan","Unusual reactivity of a sterically hindered diphosphazane ligand, EtN{P(OR)(2)}(2), (R = C(6)H(3)(Pr(I))(2)-2,6) towards (eta(3)-allyl)palladium precursors.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2908","2914","10.1039/b703308g","","","0.71073","MoKα","","0.0989","0.0656","","","0.1167","0.1265","","","","","","1.159","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005580","12.134","0.002","17.393","0.003","27.747","0.005","85.016","0.004","79.956","0.004","73.461","0.004","5523.3","1.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C106 H158 Cl2 N2 O12 P4 Pd2 -","- C106 H158 Cl2 N2 O12 P4 Pd2 -","- C212 H316 Cl4 N4 O24 P8 Pd4 -","2","1","","Krishna, Heera; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam; Murugavel, Ramaswamy; Prabusankar, Ganesan","Unusual reactivity of a sterically hindered diphosphazane ligand, EtN{P(OR)(2)}(2), (R = C(6)H(3)(Pr(I))(2)-2,6) towards (eta(3)-allyl)palladium precursors.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2908","2914","10.1039/b703308g","","","0.71073","MoKα","","0.1491","0.089","","","0.1796","0.205","","","","","","1.034","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005581","13.465","0.007","14.582","0.008","15.016","0.008","68.274","0.009","70.498","0.008","74.301","0.009","2545","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H73 N O5 P2 -","- C50 H73 N O5 P2 -","- C100 H146 N2 O10 P4 -","2","1","","Krishna, Heera; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam; Murugavel, Ramaswamy; Prabusankar, Ganesan","Unusual reactivity of a sterically hindered diphosphazane ligand, EtN{P(OR)(2)}(2), (R = C(6)H(3)(Pr(I))(2)-2,6) towards (eta(3)-allyl)palladium precursors.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2908","2914","10.1039/b703308g","","","0.71073","MoKα","","0.0905","0.0637","","","0.1522","0.1662","","","","","","1.089","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005582","29.2141","0.0009","9.1678","0.0002","20.1846","0.0006","90","","123.056","0.002","90","","4531","0.2","293","2","293","2","","","","","","","synthesis","6","C 1 2/c 1","-C 2yc","15","","","","- C49 H42 N2 O4 P4 S2 -","- C49 H42 N2 O4 P4 S2 -","- C196 H168 N8 O16 P16 S8 -","4","0.5","","Cadierno, Victorio; Díez, Josefina; García-Alvarez, Joaquín; Gimeno, José","Silver(I) complexes of N-thiophosphorylated bis(iminophosphorane) ligands: from monomers to polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2760","2769","10.1039/b703348f","","","1.5418","CuKα","","0.0697","0.0436","","","0.103","0.1139","","","","","","0.896","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005583","11.128","0.0011","11.3219","0.0009","18.135","0.0002","87.206","0.006","77.029","0.009","70.753","0.007","2101.3","0.3","200","2","200","2","","","","","","","synthesis","9","P -1","-P 1","2","","","","- C66 H84 Ag2 F12 N4 O8 P8 S4 Sb2 -","- C66 H84 Ag2 F12 N4 O8 P8 S4 Sb2 -","- C66 H84 Ag2 F12 N4 O8 P8 S4 Sb2 -","1","0.5","","Cadierno, Victorio; Díez, Josefina; García-Alvarez, Joaquín; Gimeno, José","Silver(I) complexes of N-thiophosphorylated bis(iminophosphorane) ligands: from monomers to polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2760","2769","10.1039/b703348f","","","1.5418","CuKα","","0.0495","0.0389","","","0.1034","0.1582","","","","","","1.156","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005584","25.8436","0.001","10.8312","0.0005","20.3081","0.001","90","","109.556","0.005","90","","5356.7","0.4","150","2","150","2","","","","","","","synthesis","10","P 1 2/c 1","-P 2yc","13","","","","- C101 H90 Ag2 Cl2 F12 N4 O8 P8 S4 Sb2 -","- C101 H90 Ag2 Cl2 F12 N4 O8 P8 S4 Sb2 -","- C202 H180 Ag4 Cl4 F24 N8 O16 P16 S8 Sb4 -","2","0.5","","Cadierno, Victorio; Díez, Josefina; García-Alvarez, Joaquín; Gimeno, José","Silver(I) complexes of N-thiophosphorylated bis(iminophosphorane) ligands: from monomers to polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2760","2769","10.1039/b703348f","","","1.5418","CuKα","","0.0497","0.0458","","","0.1206","0.1268","","","","","","1.045","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005585","12.165","0.0002","12.5716","0.0002","16.45","0.0004","80.715","0.001","80.171","0.001","68.973","0.001","2300.02","0.08","293","2","293","2","","","","","","","synthesis","9","P -1","-P 1","2","","","","- C36 H48 Ag F6 N2 O4 P4 S2 Sb -","- C36 H48 Ag F6 N2 O4 P4 S2 Sb -","- C72 H96 Ag2 F12 N4 O8 P8 S4 Sb2 -","2","1","","Cadierno, Victorio; Díez, Josefina; García-Alvarez, Joaquín; Gimeno, José","Silver(I) complexes of N-thiophosphorylated bis(iminophosphorane) ligands: from monomers to polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2760","2769","10.1039/b703348f","","","1.5418","CuKα","","0.0913","0.0825","","","0.2396","0.2505","","","","","","1.058","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005586","17.9823","0.0003","15.1788","0.0003","24.4432","0.0006","90","","102.802","0.001","90","","6505.9","0.2","150","2","150","2","","","","","","","synthesis","11","P 1 21/c 1","-P 2ybc","14","","","","- C60 H52 Ag Cl4 F6 Fe N2 O4 P4 S2 Sb -","- C60 H52 Ag Cl4 F6 Fe N2 O4 P4 S2 Sb -","- C240 H208 Ag4 Cl16 F24 Fe4 N8 O16 P16 S8 Sb4 -","4","1","","Cadierno, Victorio; Díez, Josefina; García-Alvarez, Joaquín; Gimeno, José","Silver(I) complexes of N-thiophosphorylated bis(iminophosphorane) ligands: from monomers to polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2760","2769","10.1039/b703348f","","","1.5418","CuKα","","0.0971","0.0743","","","0.2007","0.2171","","","","","","1.069","","","","has coordinates,has disorder","179759","2020-10-21","18:00:00",""
"7005587","10.7467","0.0015","8.6769","0.0012","11.5977","0.0016","90","","115.636","0.002","90","","975","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H20 Fe N4 O3 -","- C22 H20 Fe N4 O3 -","- C44 H40 Fe2 N8 O6 -","2","1","","Wei, Kai-Ju; Ni, Jia; Xie, Yong-Shu; Liu, Yangzhong; Liu, Qing-Liang","Self-assembled hetero-bimetallic coordination cage and cation-clusters with micro(2)-Cl bridging using a flexible two-arm ferrocene amide linker.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3390","3397","10.1039/b703363j","","","0.71073","MoKα","","0.0483","0.0438","","","0.1028","0.1058","","","","","","1.028","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005588","17.4718","0.0013","22.0788","0.0016","51.605","0.004","90","","90","","90","","19907","3","123","2","123","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C92 H92 Cl4 Cu2 Fe4 N16 O30 -","- C92 H90 Cl4 Cu2 Fe4 N16 O30 -","- C736 H720 Cl32 Cu16 Fe32 N128 O240 -","8","0.25","","Wei, Kai-Ju; Ni, Jia; Xie, Yong-Shu; Liu, Yangzhong; Liu, Qing-Liang","Self-assembled hetero-bimetallic coordination cage and cation-clusters with micro(2)-Cl bridging using a flexible two-arm ferrocene amide linker.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3390","3397","10.1039/b703363j","","","0.71073","MoKα","","0.0733","0.0578","","","0.1525","0.1672","","","","","","1.092","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005589","18.45","0.02","22.31","0.02","54.77","0.07","90","","90","","90","","22544","4","298","2","298","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C88 H76 Cl4 Fe4 N16 Ni2 O22 -","- C88 H76 Cl4 Fe4 N16 Ni2 O22 -","- C704 H608 Cl32 Fe32 N128 Ni16 O176 -","8","0.25","","Wei, Kai-Ju; Ni, Jia; Xie, Yong-Shu; Liu, Yangzhong; Liu, Qing-Liang","Self-assembled hetero-bimetallic coordination cage and cation-clusters with micro(2)-Cl bridging using a flexible two-arm ferrocene amide linker.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3390","3397","10.1039/b703363j","","","0.71073","MoKα","","0.1783","0.1012","","","0.2504","0.3331","","","","","","1.089","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005590","17.9062","0.0008","21.4295","0.0009","53.006","0.002","90","","90","","90","","20339.5","1.5","293","2","293","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C46 H46 Cl2 Co Fe N8 O13 -","- C46 H46 Cl2 Co Fe2 N8 O13 -","- C736 H736 Cl32 Co16 Fe32 N128 O208 -","16","0.5","","Wei, Kai-Ju; Ni, Jia; Xie, Yong-Shu; Liu, Yangzhong; Liu, Qing-Liang","Self-assembled hetero-bimetallic coordination cage and cation-clusters with micro(2)-Cl bridging using a flexible two-arm ferrocene amide linker.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3390","3397","10.1039/b703363j","","","0.71073","MoKα","","0.0987","0.0869","","","0.2515","0.2649","","","","","","1.081","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005591","8.9762","0.0013","8.5219","0.0012","40.736","0.006","90","","93.164","0.003","90","","3111.3","0.8","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H44 B2 O -","- C36 H44 B2 O -","- C144 H176 B8 O4 -","4","1","","Cui, Yi; Li, Fenghong; Lu, Zheng-Hong; Wang, Suning","Three-coordinate organoboron with a B=N bond: substituent effects, luminescence/electroluminescence and reactions with fluoride.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2634","2643","10.1039/b703366d","","","0.71073","MoKα","","0.2035","0.0986","","","0.3214","0.356","","","","","","1.054","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7005592","8.2148","0.001","11.6163","0.0013","12.2308","0.0014","105.341","0.002","94.143","0.002","106.575","0.002","1064.9","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","1","","","- C26 H28 B N -","- C26 H28 B N -","- C52 H56 B2 N2 -","2","1","","Cui, Yi; Li, Fenghong; Lu, Zheng-Hong; Wang, Suning","Three-coordinate organoboron with a B=N bond: substituent effects, luminescence/electroluminescence and reactions with fluoride.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2634","2643","10.1039/b703366d","","","0.71073","MoKα","","0.0955","0.0548","","","0.1406","0.1558","","","","","","0.917","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005593","22.3981","0.0018","8.1607","0.0007","12.217","0.001","90","","90","","90","","2233.1","0.3","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","2","","","- C27 H30 B N -","- C27 H30 B N -","- C108 H120 B4 N4 -","4","1","","Cui, Yi; Li, Fenghong; Lu, Zheng-Hong; Wang, Suning","Three-coordinate organoboron with a B=N bond: substituent effects, luminescence/electroluminescence and reactions with fluoride.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2634","2643","10.1039/b703366d","","","0.71073","MoKα","","0.0686","0.0384","","","0.0795","0.0868","","","","","","0.9","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005594","8.635","0.004","11.606","0.006","12.262","0.007","99.281","0.009","98.716","0.009","107.487","0.009","1130.3","1","296","2","296","2","","","","","","","","4","P -1","-P 1","2","3","","","- C27 H30 B N -","- C27 H30 B N -","- C54 H60 B2 N2 -","2","1","","Cui, Yi; Li, Fenghong; Lu, Zheng-Hong; Wang, Suning","Three-coordinate organoboron with a B=N bond: substituent effects, luminescence/electroluminescence and reactions with fluoride.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2634","2643","10.1039/b703366d","","","0.71073","MoKα","","0.0843","0.0549","","","0.159","0.1761","","","","","","0.983","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005595","8.4989","0.0011","10.0999","0.0014","14.424","0.002","100.384","0.002","106.956","0.002","103.731","0.002","1108.2","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","4","","","- C27 H30 B N -","- C27 H30 B N -","- C54 H60 B2 N2 -","2","1","","Cui, Yi; Li, Fenghong; Lu, Zheng-Hong; Wang, Suning","Three-coordinate organoboron with a B=N bond: substituent effects, luminescence/electroluminescence and reactions with fluoride.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2634","2643","10.1039/b703366d","","","0.71073","MoKα","","0.1386","0.0533","","","0.1197","0.1419","","","","","","0.832","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005596","11.4353","0.001","18.5158","0.0015","11.949","0.001","90","","92.268","0.001","90","","2528","0.4","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","5","","","- C32 H32 B N -","- C32 H32 B N -","- C128 H128 B4 N4 -","4","1","","Cui, Yi; Li, Fenghong; Lu, Zheng-Hong; Wang, Suning","Three-coordinate organoboron with a B=N bond: substituent effects, luminescence/electroluminescence and reactions with fluoride.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2634","2643","10.1039/b703366d","","","0.71073","MoKα","","0.0945","0.0496","","","0.111","0.123","","","","","","0.905","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005597","17.183","0.008","17.183","0.008","8.128","0.006","90","","90","","90","","2400","2","173","2","173","2","","","","","","","","7","P 4 n c","P 4 -2n","104","","","","- C40 H39 Cu F12 N8 O7.5 P2 -","- C40 H36 Cu F12 N8 O9 P2 -","- C80 H72 Cu2 F24 N16 O18 P4 -","2","0.25","","Hoffart, Dennis J.; Habermehl, Nicolle C.; Loeb, Stephen J.","4,4'-Bipyridine-N-monoxide. A hybrid ligand for building networks using a combination of metal-ligand and hydrogen-bonding interactions.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2870","2875","10.1039/b703456c","","","0.71073","MoKα","","0.0831","0.0676","","","0.1599","0.1719","","","","","","1.111","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005598","20.624","0.0018","21.3105","0.0019","22.366","0.002","63.191","0.002","64.445","0.002","82.821","0.002","7885.5","1.2","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C41.33 H42 B0.67 F6.67 N8 O18 Pd S1.33 -","- C41.3333 H32 B0.666667 F6.66667 N8 O18 Pd S1.33333 -","- C248 H192 B4 F40 N48 O108 Pd6 S8 -","6","3","","Hoffart, Dennis J.; Habermehl, Nicolle C.; Loeb, Stephen J.","4,4'-Bipyridine-N-monoxide. A hybrid ligand for building networks using a combination of metal-ligand and hydrogen-bonding interactions.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2870","2875","10.1039/b703456c","","","0.71073","MoKα","","0.104","0.0797","","","0.2219","0.2481","","","","","","1.018","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005599","17.559","0.004","14.088","0.004","19.738","0.005","90","","94.894","0.004","90","","4865","2","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C46 H40 F6 N10 O11 Pt S2 -","- C46 H38 F6 N10 O11 Pt S2 -","- C184 H152 F24 N40 O44 Pt4 S8 -","4","1","","Hoffart, Dennis J.; Habermehl, Nicolle C.; Loeb, Stephen J.","4,4'-Bipyridine-N-monoxide. A hybrid ligand for building networks using a combination of metal-ligand and hydrogen-bonding interactions.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2870","2875","10.1039/b703456c","","","0.71073","MoKα","","0.1524","0.0998","","","0.2123","0.2369","","","","","","1.075","","","","has coordinates","179759","2020-10-21","18:00:00",""
"7005600","17.347","0.004","17.347","0.004","8.061","0.004","90","","90","","90","","2425.7","1.4","173","2","173","2","","","","","","","","7","P 4 n c","P 4 -2n","104","","","","- C42 H36 F6 N8 O12 S2 Zn -","- C42 H36 F6 N8 O12 S2 Zn -","- C84 H72 F12 N16 O24 S4 Zn2 -","2","0.25","","Hoffart, Dennis J.; Habermehl, Nicolle C.; Loeb, Stephen J.","4,4'-Bipyridine-N-monoxide. A hybrid ligand for building networks using a combination of metal-ligand and hydrogen-bonding interactions.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2870","2875","10.1039/b703456c","","","0.71073","MoKα","","0.106","0.0997","","","0.2657","0.2704","","","","","","1.189","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005601","8.9469","0.0001","14.1332","0.0001","15.0562","0.0001","90","","97.9716","0.0004","90","","1885.43","0.03","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H21 Cl2 N4 O6 P3 -","- C10 H21 Cl2 N4 O6 P3 -","- C40 H84 Cl8 N16 O24 P12 -","4","1","","Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.","A spiro to ansa rearrangement in cyclotriphosphazene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2792","2801","10.1039/b703541a","","","0.71073","MoKα","","0.044","0.0402","","","0.1099","0.1136","","","","","","1.019","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005602","10.34","0.007","9.123","0.01","14.023","0.008","90","","97.23","0.06","90","","1312.3","1.9","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H10 Cl3 N4 O2 P3 -","- C4 H10 Cl3 N4 O2 P3 -","- C16 H40 Cl12 N16 O8 P12 -","4","1","","Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.","A spiro to ansa rearrangement in cyclotriphosphazene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2792","2801","10.1039/b703541a","","","0.71073","MoKα","","0.0705","0.0423","","","0.0947","0.106","","","","","","1.003","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005603","8.231","0.003","17.426","0.004","9.8503","0.0016","90","","94.76","0.03","90","","1408","0.7","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C6 H13 Cl3 N5 O P3 -","- C6 H13 Cl3 N5 O P3 -","- C24 H52 Cl12 N20 O4 P12 -","4","1","","Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.","A spiro to ansa rearrangement in cyclotriphosphazene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2792","2801","10.1039/b703541a","","","0.71073","MoKα","","0.1126","0.089","","","0.1635","0.1701","","","","","","1.272","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005604","8.6657","0.0001","13.9489","0.0003","15.3589","0.0004","90","","99.215","0.001","90","","1832.58","0.07","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H20 Cl2 N3 O7 P3 -","- C10 H20 Cl2 N3 O7 P3 -","- C40 H80 Cl8 N12 O28 P12 -","4","1","","Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.","A spiro to ansa rearrangement in cyclotriphosphazene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2792","2801","10.1039/b703541a","","","0.71073","MoKα","","0.0641","0.0533","","","0.1212","0.1285","","","","","","1.019","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005605","7.9956","0.0002","15.7971","0.0005","14.8388","0.0004","90","","101.751","0.002","90","","1834.97","0.09","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H20 Cl2 N3 O7 P3 -","- C10 H20 Cl2 N3 O7 P3 -","- C40 H80 Cl8 N12 O28 P12 -","4","1","","Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.","A spiro to ansa rearrangement in cyclotriphosphazene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2792","2801","10.1039/b703541a","","","0.71073","MoKα","","0.0531","0.0358","","","0.0805","0.0881","","","","","","1.003","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005606","6.7181","0.0005","12.6485","0.0012","13.7542","0.0011","90","","90","","90","","1168.75","0.17","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C3 H8 Cl3 N4 O2 P3 -","- C3 H8 Cl3 N4 O2 P3 -","- C12 H32 Cl12 N16 O8 P12 -","4","1","","Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.","A spiro to ansa rearrangement in cyclotriphosphazene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2792","2801","10.1039/b703541a","","","0.71073","MoKα","","0.0263","0.0243","","","0.0583","0.0595","","","","","","1.033","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005607","15.8813","0.001","5.9401","0.0004","24.6234","0.0014","90","","92.246","0.003","90","","2321.1","0.3","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C3 H7 Cl3 N3 O3 P3 -","- C3 H7 Cl3 N3 O3 P3 -","- C24 H56 Cl24 N24 O24 P24 -","8","1","","Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.","A spiro to ansa rearrangement in cyclotriphosphazene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2792","2801","10.1039/b703541a","","","0.71073","MoKα","","0.0752","0.0641","","","0.174","0.1834","","","","","","1.12","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005608","17.2569","0.0012","11.011","0.0008","7.9969","0.0004","90","","96.47","0.006","90","","1509.86","0.17","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H10 Cl3 N4 O2 P3 -","- C8 H10 Cl3 N4 O2 P3 -","- C32 H40 Cl12 N16 O8 P12 -","4","1","","Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.","A spiro to ansa rearrangement in cyclotriphosphazene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2792","2801","10.1039/b703541a","","","0.71073","MoKα","","0.0937","0.085","","","0.2306","0.2347","","","","","","1.211","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005609","8.7423","0.0004","8.0657","0.0005","17.2362","0.001","90","","96.165","0.004","90","","1208.34","0.12","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C3 H7 Cl3 N3 O3 P3 -","- C3 H7 Cl3 N3 O3 P3 -","- C12 H28 Cl12 N12 O12 P12 -","4","1","","Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.","A spiro to ansa rearrangement in cyclotriphosphazene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2792","2801","10.1039/b703541a","","","0.71073","MoKα","","0.1199","0.0983","","","0.2467","0.2653","","","","","","1.185","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005610","8.5409","0.0002","17.1394","0.0003","10.6213","0.0003","90","","109.588","0.001","90","","1464.83","0.06","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H9 Cl3 N3 O3 P3 -","- C8 H9 Cl3 N3 O3 P3 -","- C32 H36 Cl12 N12 O12 P12 -","4","1","","Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.","A spiro to ansa rearrangement in cyclotriphosphazene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2792","2801","10.1039/b703541a","","","0.71073","MoKα","","0.0412","0.0307","","","0.076","0.0814","","","","","","1.072","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005611","9.6475","0.0002","8.1876","0.0002","17.5451","0.0004","90","","98.544","0.002","90","","1370.5","0.05","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H12 Cl3 N4 O2 P3 -","- C6 H12 Cl3 N4 O2 P3 -","- C24 H48 Cl12 N16 O8 P12 -","4","1","","Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Shaw, Robert A.","A spiro to ansa rearrangement in cyclotriphosphazene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2792","2801","10.1039/b703541a","","","0.71073","MoKα","","0.0329","0.0256","","","0.0638","0.0671","","","","","","1.124","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005612","22.1927","0.0017","22.1927","0.0017","22.1927","0.0017","90","","90","","90","","10930.3","1.5","295","2","295","2","","","","","","","","5","I a -3","-I 2b 2c 3","206","","","","- C42 H61 Fe6 N3 O20 -","- C42 H61 Fe6 N3 O20 -","- C336 H488 Fe48 N24 O160 -","8","0.166667","","Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano; Zazzaroni, Enrico","Synthesis and X-ray structure of the [{Fe3(CO)9(micro3-O)}2H]3- trianion: dimerization of a metal carbonyl cluster via formation of an exceptionally short hydrogen bond.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2644","2651","10.1039/b703628k","","","0.71073","MoKα","","0.0958","0.0505","","","0.0849","0.101","","","","","","1.012","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005613","13.0952","0.0003","13.0952","0.0003","18.566","0.001","90","","90","","120","","2757.23","0.17","295","2","295","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- C22 H9 Cs3 Fe6 O21 -","- C22.92 H8.68 Cs3 Fe6 O20.96 -","- C68.76 H26.04 Cs9 Fe18 O62.88 -","3","0.0833333","","Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano; Zazzaroni, Enrico","Synthesis and X-ray structure of the [{Fe3(CO)9(micro3-O)}2H]3- trianion: dimerization of a metal carbonyl cluster via formation of an exceptionally short hydrogen bond.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2644","2651","10.1039/b703628k","","","0.71073","MoKα","","0.0251","0.0225","","","0.0567","0.0591","","","","","","1.108","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005614","9.3755","0.0011","9.4461","0.0011","17.669","0.002","90.984","0.002","96.28","0.002","101.695","0.002","1521.9","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H16 Cs2 Fe4 O15 -","- C21 H16 Cs2 Fe4 O15 -","- C42 H32 Cs4 Fe8 O30 -","2","1","","Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano; Zazzaroni, Enrico","Synthesis and X-ray structure of the [{Fe3(CO)9(micro3-O)}2H]3- trianion: dimerization of a metal carbonyl cluster via formation of an exceptionally short hydrogen bond.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2644","2651","10.1039/b703628k","","","0.71073","MoKα","","0.0414","0.0293","","","0.0665","0.0722","","","","","","1.02","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005615","21.8548","0.0006","8.0635","0.0002","8.53","0.0002","90","","98.599","0.002","90","","1486.31","0.07","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","bis(2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecin- 12-aminium) hexafluorosilicate dihydrate","bis(2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecin- 12-aminium) hexafluorosilicate dihydrate","","- C24 H40 F6 N2 O10 Si -","- C24 H40 F6 N2 O10 Si -","- C48 H80 F12 N4 O20 Si2 -","2","0.5","","Gelmboldt, Vladimir O.; Ganin, Eduard V.; Fonari, Marina S.; Simonov, Yurii A.; Koroeva, Larisa V.; Ennan, Alim A.; Basok, Stepan S.; Shova, Sergiu; Kählig, Hanspeter; Arion, Vladimir B.; Keppler, Bernhard K.","Two new ""onium"" fluorosilicates, the products of interaction of fluorosilicic acid with 12-membered macrocycles: structures and spectroscopic properties.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2915","2924","10.1039/B703645K","","","0.71073","MoKα","","0.0752","0.0493","","","0.137","0.1515","","","","","","1.111","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005616","14.8889","0.0007","9.3635","0.0005","20.3291","0.0009","90","","93.9","0.003","90","","2827.6","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","bis(1,4,7-trioxa-10-azoniacyclododecane) bis(aquapentafluorosilicate) trihydrate","bis(1,4,7-trioxa-10-azoniacyclododecane) bis(aquapentafluorosilicate) trihydrate","","- C16 H46 F10 N2 O11 Si2 -","- C16 H44 F10 N2 O10.25 Si2 -","- C64 H176 F40 N8 O41 Si8 -","4","1","","Gelmboldt, Vladimir O.; Ganin, Eduard V.; Fonari, Marina S.; Simonov, Yurii A.; Koroeva, Larisa V.; Ennan, Alim A.; Basok, Stepan S.; Shova, Sergiu; Kählig, Hanspeter; Arion, Vladimir B.; Keppler, Bernhard K.","Two new ""onium"" fluorosilicates, the products of interaction of fluorosilicic acid with 12-membered macrocycles: structures and spectroscopic properties.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2915","2924","10.1039/B703645K","","","0.71073","MoKα","","0.0512","0.041","","","0.1148","0.1199","","","","","","1.063","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005617","16.291","0.002","16.3","0.002","9.1949","0.0012","90","","90","","90","","2441.6","0.5","100","2","100","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C13 H14 N4 O -","- C13 H14 N4 O -","- C104 H112 N32 O8 -","8","1","","Diaz, Pilar; Tovilla, Jorge A.; Ballester, Pablo; Benet-Buchholz, Jordi; Vilar, Ramón","Synthesis, structural characterization and anion binding studies of palladium macrocycles with hydrogen-bonding ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3516","3525","10.1039/b703660d","","","0.71073","MoKα","","0.07","0.0634","","","0.1827","0.1901","","","","","","1.058","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005618","10.5821","0.0018","13.149","0.003","4.5942","0.0008","90","","90","","90","","639.3","0.2","100","2","100","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C13 H16 N4 O2 -","- C13 H16 N4 O2 -","- C26 H32 N8 O4 -","2","0.5","","Diaz, Pilar; Tovilla, Jorge A.; Ballester, Pablo; Benet-Buchholz, Jordi; Vilar, Ramón","Synthesis, structural characterization and anion binding studies of palladium macrocycles with hydrogen-bonding ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3516","3525","10.1039/b703660d","","","0.71073","MoKα","","0.077","0.0712","","","0.2021","0.2063","","","","","","1.157","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005619","18.6063","0.0011","21.5364","0.0013","27.1103","0.0016","90","","90","","90","","10863.4","1.1","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C88 H90 F12 N8 O15.25 P4 Pd2 S4 -","- C88 H90 F12 N8 O15.25 P4 Pd2 S4 -","- C352 H360 F48 N32 O61 P16 Pd8 S16 -","4","1","","Diaz, Pilar; Tovilla, Jorge A.; Ballester, Pablo; Benet-Buchholz, Jordi; Vilar, Ramón","Synthesis, structural characterization and anion binding studies of palladium macrocycles with hydrogen-bonding ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3516","3525","10.1039/b703660d","","","0.71073","MoKα","","0.1067","0.0854","","","0.2381","0.2552","","","","","","1.091","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005620","15.8443","0.0007","18.8383","0.0009","20.6983","0.0008","95.68","0.002","94.482","0.002","104.57","0.002","5915.8","0.5","153","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C100.25 H94.5 F12 N8 O18.75 P4 Pd2 S4 -","- C100.25 H94.5 F12 N8 O18.75 P4 Pd2 S4 -","- C200.5 H189 F24 N16 O37.5 P8 Pd4 S8 -","2","1","","Diaz, Pilar; Tovilla, Jorge A.; Ballester, Pablo; Benet-Buchholz, Jordi; Vilar, Ramón","Synthesis, structural characterization and anion binding studies of palladium macrocycles with hydrogen-bonding ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3516","3525","10.1039/b703660d","","","0.71073","MoKα","","0.1796","0.0841","","","0.2237","0.269","","","","","","0.968","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005621","15.828","0.003","16.901","0.003","20.704","0.004","71.936","0.004","86.141","0.004","87.923","0.004","5252.9","1.7","100","2","100","2","","","","","","","","10","P -1","-P 1","2","","","","- C99 H86 Cl2 F12 Fe2 N8 O17 P4 Pd2 S4 -","- C99 H86 Cl2 F12 Fe2 N8 O17 P4 Pd2 S4 -","- C198 H172 Cl4 F24 Fe4 N16 O34 P8 Pd4 S8 -","2","1","","Diaz, Pilar; Tovilla, Jorge A.; Ballester, Pablo; Benet-Buchholz, Jordi; Vilar, Ramón","Synthesis, structural characterization and anion binding studies of palladium macrocycles with hydrogen-bonding ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3516","3525","10.1039/b703660d","","","0.71073","MoKα","","0.1402","0.0973","","","0.2504","0.2967","","","","","","1.056","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005622","20.8851","0.0005","26.4514","0.0007","9.3916","0.0001","90","","99.6484","0.0014","90","","5114.91","0.19","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H31 Dy N4 O10 -","- C48 H31 Dy N4 O10 -","- C192 H124 Dy4 N16 O40 -","4","0.5","","Lipstman, Sophia; Muniappan, Sankar; George, Sumod; Goldberg, Israel","Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and lanthanide ions in crystalline solids.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3273","3281","10.1039/b703698a","","","0.71073","MoKα","","0.0363","0.0319","","","0.0793","0.0811","","","","","","1.055","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005623","21.3217","0.0003","26.5463","0.0005","9.6369","0.0001","90","","105.891","0.0009","90","","5246.16","0.14","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H31 N4 O10 Sm -","- C48 H31 N4 O10 Sm -","- C192 H124 N16 O40 Sm4 -","4","0.5","","Lipstman, Sophia; Muniappan, Sankar; George, Sumod; Goldberg, Israel","Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and lanthanide ions in crystalline solids.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3273","3281","10.1039/b703698a","","","0.71073","MoKα","","0.0304","0.0282","","","0.0783","0.0793","","","","","","1.114","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005624","21.2748","0.0006","26.6527","0.001","9.6303","0.0003","90","","105.503","0.002","90","","5262","0.3","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H31 N4 O10 Pr -","- C48 H31 N4 O10 Pr -","- C192 H124 N16 O40 Pr4 -","4","0.5","","Lipstman, Sophia; Muniappan, Sankar; George, Sumod; Goldberg, Israel","Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and lanthanide ions in crystalline solids.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3273","3281","10.1039/b703698a","","","0.71073","MoKα","","0.0625","0.0473","","","0.1232","0.1296","","","","","","1.053","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005625","21.3667","0.0004","26.5131","0.0006","9.6096","0.0002","90","","106.132","0.0016","90","","5229.47","0.19","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H31 Gd N4 O10 -","- C48 H31 Gd N4 O10 -","- C192 H124 Gd4 N16 O40 -","4","0.5","","Lipstman, Sophia; Muniappan, Sankar; George, Sumod; Goldberg, Israel","Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and lanthanide ions in crystalline solids.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3273","3281","10.1039/b703698a","","","0.71073","MoKα","","0.0507","0.0401","","","0.097","0.0994","","","","","","1.101","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005626","9.4217","0.0008","22.1411","0.0019","26.34","0.006","90","","90","","90","","5494.7","1.4","110","2","110","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C48 H26 Ca0.19 Er N4 O10 -","- C48 H26 Ca0.187 Er N4 O10 -","- C192 H104 Ca0.748 Er4 N16 O40 -","4","0.5","","Lipstman, Sophia; Muniappan, Sankar; George, Sumod; Goldberg, Israel","Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and lanthanide ions in crystalline solids.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3273","3281","10.1039/b703698a","","","0.71073","MoKα","","0.0837","0.0424","","","0.1012","0.1095","","","","","","0.865","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005627","21.5598","0.0003","24.0771","0.0003","31.2327","0.0006","90","","105.02","0.0005","90","","15658.9","0.4","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C75 H50 N7 O15 Sm2 -","- C75 H50 N7 O15 Sm2 -","- C600 H400 N56 O120 Sm16 -","8","1","","Lipstman, Sophia; Muniappan, Sankar; George, Sumod; Goldberg, Israel","Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and lanthanide ions in crystalline solids.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3273","3281","10.1039/b703698a","","","0.71073","MoKα","","0.1001","0.0665","","","0.1633","0.1752","","","","","","1.028","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005628","21.6137","0.0008","23.9695","0.0007","30.9377","0.0011","90","","106.192","0.0017","90","","15392.1","0.9","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C150 H94 Cu3 Dy4 N14 O30 -","- C150 H94 Cu3 Dy4 N14 O30 -","- C600 H376 Cu12 Dy16 N56 O120 -","4","0.5","","Lipstman, Sophia; Muniappan, Sankar; George, Sumod; Goldberg, Israel","Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and lanthanide ions in crystalline solids.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3273","3281","10.1039/b703698a","","","0.71073","MoKα","","0.1126","0.0581","","","0.1362","0.1476","","","","","","1.064","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005629","21.5909","0.0003","24.0263","0.0004","31.1146","0.0005","90","","105.795","0.0008","90","","15531.3","0.4","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C75 H45 Cu0.26 Eu2 N7 O15 -","- C75 H45 Cu0.26 Eu2 N7 O15 -","- C600 H360 Cu2.08 Eu16 N56 O120 -","8","1","","Lipstman, Sophia; Muniappan, Sankar; George, Sumod; Goldberg, Israel","Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and lanthanide ions in crystalline solids.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3273","3281","10.1039/b703698a","","","0.71073","MoKα","","0.0733","0.0461","","","0.1095","0.118","","","","","","1.003","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005630","8.7631","0.0002","15.9735","0.0004","19.0533","0.0006","100.128","0.0009","95.4584","0.0008","102.206","0.002","2541.75","0.12","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H33 N5 O10 Yb -","- C51 H33 N5 O10 Yb -","- C102 H66 N10 O20 Yb2 -","2","1","","Lipstman, Sophia; Muniappan, Sankar; George, Sumod; Goldberg, Israel","Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and lanthanide ions in crystalline solids.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3273","3281","10.1039/b703698a","","","0.71073","MoKα","","0.0695","0.0463","","","0.1058","0.1162","","","","","","0.995","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005631","8.8318","0.0002","15.854","0.0003","19.1824","0.0005","99.6993","0.0009","96.4107","0.0009","101.92","0.0016","2560.39","0.1","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H31 Er N4 O10 -","- C48 H31 Er N4 O10 -","- C96 H62 Er2 N8 O20 -","2","1","","Lipstman, Sophia; Muniappan, Sankar; George, Sumod; Goldberg, Israel","Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and lanthanide ions in crystalline solids.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3273","3281","10.1039/b703698a","","","0.71073","MoKα","","0.071","0.0506","","","0.1222","0.1298","","","","","","1","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005632","8.5175","0.0002","28.1745","0.0006","21.4217","0.0005","90","","97.1026","0.0007","90","","5101.3","0.2","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C51 H36 Er N5 O10 -","- C51 H36 Er N5 O10 -","- C204 H144 Er4 N20 O40 -","4","1","","Lipstman, Sophia; Muniappan, Sankar; George, Sumod; Goldberg, Israel","Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and lanthanide ions in crystalline solids.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3273","3281","10.1039/b703698a","","","0.71073","MoKα","","0.0818","0.0535","","","0.1246","0.1338","","","","","","1.101","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005633","10.691","0.002","13.868","0.003","28.711","0.006","90","","97.64","0.03","90","","4219","1.5","180","2","180","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C40 H30 B2 F8 Fe N14 -","- C40 H30 B2 F8 Fe N14 -","- C160 H120 B8 F32 Fe4 N56 -","4","1","","Rajadurai, Chandrasekar; Qu, Zhirong; Fuhr, Olaf; Gopalan, Balaji; Kruk, Robert; Ghafari, Mohammed; Ruben, Mario","Lattice-solvent controlled spin transitions in iron(II) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3531","3537","10.1039/b703700g","","","0.71073","MoKα","","0.0679","0.0564","","","0.1528","0.1607","","","","","","1.013","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005634","19.503","0.004","19.129","0.004","11.409","0.002","90","","90","","90","","4256.4","1.5","180","2","180","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C40 H30 B2 F8 Fe N14 -","- C40 H30 B2 F8 Fe N14 -","- C160 H120 B8 F32 Fe4 N56 -","4","1","","Rajadurai, Chandrasekar; Qu, Zhirong; Fuhr, Olaf; Gopalan, Balaji; Kruk, Robert; Ghafari, Mohammed; Ruben, Mario","Lattice-solvent controlled spin transitions in iron(II) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3531","3537","10.1039/b703700g","","","0.71073","MoKα","","0.0545","0.0514","","","0.1429","0.146","","","","","","1.042","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005635","10.808","0.002","13.925","0.003","28.685","0.006","90","","97.77","0.03","90","","4277.5","1.5","150","2","150","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C40 H30 Cl2 Fe N14 O8 -","- C40 H30 Cl2 Fe N14 O8 -","- C160 H120 Cl8 Fe4 N56 O32 -","4","1","","Rajadurai, Chandrasekar; Qu, Zhirong; Fuhr, Olaf; Gopalan, Balaji; Kruk, Robert; Ghafari, Mohammed; Ruben, Mario","Lattice-solvent controlled spin transitions in iron(II) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3531","3537","10.1039/b703700g","","","0.71073","MoKα","","0.0508","0.0375","","","0.0892","0.094","","","","","","1.026","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005636","30.688","0.002","11.6319","0.0007","25.9213","0.0017","90","","102.344","0.001","90","","9039","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H21 I3 N18 Zn2 -","- C27 H21 I3 N18 Zn2 -","- C216 H168 I24 N144 Zn16 -","8","1","","Chan, Zhi-Kai; Chen, Tsun-Ren; Chen, Jhy-Der; Wang, Ju-Chun; Liu, C. W.","Crystal structures and solution behaviors of dinuclear d(10)-metal complexes containing anions of N,N'-bis(pyrimidine-2-yl)formamidine.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3450","3458","10.1039/b703727a","","","0.71073","MoKα","","0.0571","0.0303","","","0.0542","0.0564","","","","","","1.031","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005637","11.287","0.002","12.424","0.003","31.198","0.006","90","","96.391","0.005","90","","4347.7","1.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H21 Cl N18 O4 Zn2 -","- C27 H21 Cl N18 O4 Zn2 -","- C108 H84 Cl4 N72 O16 Zn8 -","4","1","","Chan, Zhi-Kai; Chen, Tsun-Ren; Chen, Jhy-Der; Wang, Ju-Chun; Liu, C. W.","Crystal structures and solution behaviors of dinuclear d(10)-metal complexes containing anions of N,N'-bis(pyrimidine-2-yl)formamidine.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3450","3458","10.1039/b703727a","","","0.71073","MoKα","","0.1208","0.0718","","","0.1543","0.1654","","","","","","1.03","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005638","11.3194","0.0012","29.1565","0.0019","12.6256","0.001","90","","94.187","0.009","90","","4155.8","0.6","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H21 Cd2 N19 O3 -","- C27 H21 Cd2 N19 O3 -","- C108 H84 Cd8 N76 O12 -","4","1","","Chan, Zhi-Kai; Chen, Tsun-Ren; Chen, Jhy-Der; Wang, Ju-Chun; Liu, C. W.","Crystal structures and solution behaviors of dinuclear d(10)-metal complexes containing anions of N,N'-bis(pyrimidine-2-yl)formamidine.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3450","3458","10.1039/b703727a","","","0.71073","MoKα","","0.0647","0.0375","","","0.0802","0.0865","","","","","","1.026","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005639","24.002","0.003","12.6232","0.0016","32.299","0.004","90","","111.264","0.008","90","","9120","2","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C27 H21 Cd2 Cl N18 O4 -","- C27 H21 Cd2 Cl N18 O4 -","- C216 H168 Cd16 Cl8 N144 O32 -","8","1","","Chan, Zhi-Kai; Chen, Tsun-Ren; Chen, Jhy-Der; Wang, Ju-Chun; Liu, C. W.","Crystal structures and solution behaviors of dinuclear d(10)-metal complexes containing anions of N,N'-bis(pyrimidine-2-yl)formamidine.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3450","3458","10.1039/b703727a","","","0.71073","MoKα","","0.0993","0.0496","","","0.113","0.1235","","","","","","1","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005640","14.2507","0.0017","15.775","0.002","10.3758","0.0014","90","","90","","90","","2332.5","0.5","295","2","295","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C18 H14 Cl2 Hg2 N12 -","- C18 H14 Cl2 Hg2 N12 -","- C72 H56 Cl8 Hg8 N48 -","4","1","","Chan, Zhi-Kai; Chen, Tsun-Ren; Chen, Jhy-Der; Wang, Ju-Chun; Liu, C. W.","Crystal structures and solution behaviors of dinuclear d(10)-metal complexes containing anions of N,N'-bis(pyrimidine-2-yl)formamidine.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3450","3458","10.1039/b703727a","","","0.71073","MoKα","","0.0551","0.0333","","","0.0651","0.0732","","","","","","1.084","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005641","14.466","0.002","16.1116","0.0015","10.3394","0.0014","90","","90","","90","","2409.8","0.5","295","2","295","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C18 H14 Br2 Hg2 N12 -","- C18 H14 Br2 Hg2 N12 -","- C72 H56 Br8 Hg8 N48 -","4","1","","Chan, Zhi-Kai; Chen, Tsun-Ren; Chen, Jhy-Der; Wang, Ju-Chun; Liu, C. W.","Crystal structures and solution behaviors of dinuclear d(10)-metal complexes containing anions of N,N'-bis(pyrimidine-2-yl)formamidine.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3450","3458","10.1039/b703727a","","","0.71073","MoKα","","0.106","0.0493","","","0.0878","0.1077","","","","","","1.037","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005642","15.6846","0.0016","10.1364","0.0015","16.822","0.002","90","","105.659","0.007","90","","2575.2","0.6","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 Hg2 I2 N12 -","- C18 H14 Hg2 I2 N12 -","- C72 H56 Hg8 I8 N48 -","4","1","","Chan, Zhi-Kai; Chen, Tsun-Ren; Chen, Jhy-Der; Wang, Ju-Chun; Liu, C. W.","Crystal structures and solution behaviors of dinuclear d(10)-metal complexes containing anions of N,N'-bis(pyrimidine-2-yl)formamidine.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3450","3458","10.1039/b703727a","","","0.71073","MoKα","","0.1197","0.0552","","","0.1088","0.135","","","","","","1.004","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005643","24.7548","0.0014","11.321","0.0006","30.2286","0.0015","90","","90","","90","","8471.5","0.8","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C14 H104 Mo12 N2 O58 S12 -","- C14 H32 Mo12 N2 O58 S12 -","- C56 H128 Mo48 N8 O232 S48 -","4","0.5","","Lemonnier, Jean-François; Floquet, Sébastien; Kachmar, Ali; Rohmer, Marie-Madeleine; Bénard, Marc; Marrot, Jerôme; Terazzi, Emmanuel; Piguet, Claude; Cadot, Emmanuel","Host-guest adaptability within oxothiomolybdenum wheels: structures, studies in solution and DFT calculations.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3043","3054","10.1039/b703770H","","","0.71073","MoKα","","0.0549","0.0427","","","0.1191","0.1341","","","","","","1.209","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005644","18.4395","0.0004","18.4395","0.0004","11.543","0.0006","90","","90","","90","","3924.8","0.2","293","2","293","2","","","","","","","","5","P 42/m n m","-P 4n 2n","136","","","","- C8 K2 Mo12 O56 S12 -","- C8.04 K2 Mo12 O56 S12 -","- C16.08 K4 Mo24 O112 S24 -","2","0.125","","Lemonnier, Jean-François; Floquet, Sébastien; Kachmar, Ali; Rohmer, Marie-Madeleine; Bénard, Marc; Marrot, Jerôme; Terazzi, Emmanuel; Piguet, Claude; Cadot, Emmanuel","Host-guest adaptability within oxothiomolybdenum wheels: structures, studies in solution and DFT calculations.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3043","3054","10.1039/b703770H","","","0.71073","MoKα","","0.0437","0.0333","","","0.0988","0.1221","","","","","","1.213","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005645","13.0709","0.0003","27.1242","0.0005","30.5257","0.0006","90","","97.899","0.001","90","","10719.8","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C17 H38 Mo14 N2 O60 S14 -","- C17 H38 Mo14 N2 O60 S14 -","- C68 H152 Mo56 N8 O240 S56 -","4","0.5","","Lemonnier, Jean-François; Floquet, Sébastien; Kachmar, Ali; Rohmer, Marie-Madeleine; Bénard, Marc; Marrot, Jerôme; Terazzi, Emmanuel; Piguet, Claude; Cadot, Emmanuel","Host-guest adaptability within oxothiomolybdenum wheels: structures, studies in solution and DFT calculations.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3043","3054","10.1039/b703770H","","","0.71073","MoKα","","0.0685","0.0483","","","0.1359","0.1632","","","","","","1.164","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005646","7.4144","0.0009","8.2275","0.0009","10.9023","0.0013","76.965","0.014","82.505","0.013","63.267","0.013","578.35","0.14","213","2","213","2","","","","","","","","5","P -1","-P 1","2","Copper(ii) acetate 2:1 complex with 4,4'-Bipyridazine, Dihydrate","Copper(II) acetate 2:1 complex with 4,4'-Bipyridazine, Dihydrate","","- C16 H26 Cu2 N4 O12 -","- C16 H26 Cu2 N4 O12 -","- C16 H26 Cu2 N4 O12 -","1","0.5","","Konstantin V. Domasevitch; Il'ya A. Gural'skiy; Pavlo V. Solntsev; Eduard B. Rusanov; Harald Krautscheid; Judith A. K. Howard; Alexander N. Chernega","4,4'-Bipyridazine: a new twist for the synthesis of coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3140","3148","10.1039/b703911e","","","0.71073","MoKα","","0.0319","0.0272","","","0.0742","0.075","","","","","","1.061","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005647","6.075","0.0001","16.9431","0.0003","11.9592","0.0002","90","","101.38","0.001","90","","1206.75","0.04","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Zinc(ii) Nitrate 1:1 Complex with 4,4'-Bipyridazine","Zinc(II) Nitrate 1:1 Complex with 4,4'-Bipyridazine","","- C8 H6 N6 O6 Zn -","- C8 H6 N6 O6 Zn -","- C32 H24 N24 O24 Zn4 -","4","1","","Konstantin V. Domasevitch; Il'ya A. Gural'skiy; Pavlo V. Solntsev; Eduard B. Rusanov; Harald Krautscheid; Judith A. K. Howard; Alexander N. Chernega","4,4'-Bipyridazine: a new twist for the synthesis of coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3140","3148","10.1039/b703911e","","","0.71073","MoKα","","0.0388","0.0279","","","0.067","0.0717","","","","","","1.054","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005648","15.1065","0.0013","11.8885","0.0009","11.0631","0.001","90","","90","","90","","1986.9","0.3","213","2","213","2","","","","","","","","6","P n a 21","P 2c -2n","33","Copper(ii) Dithionate 1:2 Complex with 4,4'-Bipyridazine, Dihydrate","Copper(II) Dithionate 1:2 Complex with 4,4'-Bipyridazine, Dihydrate","","- C16 H16 Cu N8 O8 S2 -","- C16 H16 Cu N8 O8 S2 -","- C64 H64 Cu4 N32 O32 S8 -","4","1","","Konstantin V. Domasevitch; Il'ya A. Gural'skiy; Pavlo V. Solntsev; Eduard B. Rusanov; Harald Krautscheid; Judith A. K. Howard; Alexander N. Chernega","4,4'-Bipyridazine: a new twist for the synthesis of coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3140","3148","10.1039/b703911e","","","0.71073","MoKα","","0.0506","0.0438","","","0.1053","0.1068","","","","","","1.048","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005649","10.494","0.0006","10.9798","0.0008","18.3058","0.0013","90","","98.572","0.005","90","","2085.7","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Copper(ii) Trifluoroacetate 2:3 Complex with 4,4'-Bipyridazine","Copper(II) Trifluoroacetate 2:3 Complex with 4,4'-Bipyridazine","","- C32 H18 Cu2 F12 N12 O8 -","- C32 H18 Cu2 F12 N12 O8 -","- C64 H36 Cu4 F24 N24 O16 -","2","0.5","","Konstantin V. Domasevitch; Il'ya A. Gural'skiy; Pavlo V. Solntsev; Eduard B. Rusanov; Harald Krautscheid; Judith A. K. Howard; Alexander N. Chernega","4,4'-Bipyridazine: a new twist for the synthesis of coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3140","3148","10.1039/b703911e","","","0.71073","MoKα","","0.0657","0.0434","","","0.1043","0.1116","","","","","","1.035","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005650","12.0861","0.0008","14.6555","0.0008","21.5673","0.0015","90","","104.025","0.008","90","","3706.3","0.4","213","2","213","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","Copper(ii) Tetrafluoroborate 1:2 Complex with 4,4'- Bipyridazine, Solvate with 3.33 Water","Copper(II) Tetrafluoroborate 1:2 Complex with 4,4'-Bipyridazine, Solvate with 3.33 Water","","- C48 H46 B6 Cu3 F24 N24 O10 -","- C48 H36 B6 Cu3 F24 N24 O10 -","- C96 H72 B12 Cu6 F48 N48 O20 -","2","0.5","","Konstantin V. Domasevitch; Il'ya A. Gural'skiy; Pavlo V. Solntsev; Eduard B. Rusanov; Harald Krautscheid; Judith A. K. Howard; Alexander N. Chernega","4,4'-Bipyridazine: a new twist for the synthesis of coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3140","3148","10.1039/b703911e","","","0.71073","MoKα","","0.0811","0.0594","","","0.1574","0.1657","","","","","","0.943","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005651","15.4234","0.0009","15.7761","0.0012","19.1034","0.0012","90","","108.591","0.006","90","","4405.7","0.5","213","2","213","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Dihydroxotricopper(ii) Trifluoroacetate Complex with 4,4'- Bipyridazine, Tetrahydrate","Dihydroxotricopper(II) Trifluoroacetate Complex with 4,4'-Bipyridazine, Tetrahydrate","","- C32 H26 Cu3 F12 N12 O13 -","- C32 H26 Cu3 F12 N12 O13 -","- C128 H104 Cu12 F48 N48 O52 -","4","0.5","","Konstantin V. Domasevitch; Il'ya A. Gural'skiy; Pavlo V. Solntsev; Eduard B. Rusanov; Harald Krautscheid; Judith A. K. Howard; Alexander N. Chernega","4,4'-Bipyridazine: a new twist for the synthesis of coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3140","3148","10.1039/b703911e","","","0.71073","MoKα","","0.0472","0.0358","","","0.0935","0.0968","","","","","","0.943","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005652","6.617","0.002","13.132","0.004","6.642","0.002","90","","114.23","0.02","90","","526.3","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Copper(i) Chloride 2:1 Complex with 4,4'-Bipyridazine","Copper(I) Chloride 2:1 Complex with 4,4'-Bipyridazine","","- C8 H6 Cl2 Cu2 N4 -","- C8 H6 Cl2 Cu2 N4 -","- C16 H12 Cl4 Cu4 N8 -","2","0.5","","Konstantin V. Domasevitch; Il'ya A. Gural'skiy; Pavlo V. Solntsev; Eduard B. Rusanov; Harald Krautscheid; Judith A. K. Howard; Alexander N. Chernega","4,4'-Bipyridazine: a new twist for the synthesis of coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3140","3148","10.1039/b703911e","","","0.71073","MoKα","","0.0399","0.0315","","","0.0845","0.089","","","","","","1.073","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005653","6.712","0.002","13.45","0.004","6.807","0.003","90","","112.79","0.03","90","","566.5","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Copper(i) Bromide 2:1 Complex with 4,4'-Bipyridazine","Copper(I) Bromide 2:1 Complex with 4,4'-Bipyridazine","","- C8 H6 Br2 Cu2 N4 -","- C8 H6 Br2 Cu2 N4 -","- C16 H12 Br4 Cu4 N8 -","2","0.5","","Konstantin V. Domasevitch; Il'ya A. Gural'skiy; Pavlo V. Solntsev; Eduard B. Rusanov; Harald Krautscheid; Judith A. K. Howard; Alexander N. Chernega","4,4'-Bipyridazine: a new twist for the synthesis of coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3140","3148","10.1039/b703911e","","","0.71073","MoKα","","0.0491","0.038","","","0.0933","0.0987","","","","","","1.05","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005654","10.1405","0.0005","10.1405","0.0005","11.9784","0.0007","90","","90","","90","","1231.74","0.11","213","2","213","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","Copper(i) Iodide 2:1 Complex with 4,4'-Bipyridazine","Copper(I) Iodide 2:1 Complex with 4,4'-Bipyridazine","","- C8 H6 Cu2 I2 N4 -","- C8 H6 Cu2 I2 N4 -","- C32 H24 Cu8 I8 N16 -","4","0.5","","Konstantin V. Domasevitch; Il'ya A. Gural'skiy; Pavlo V. Solntsev; Eduard B. Rusanov; Harald Krautscheid; Judith A. K. Howard; Alexander N. Chernega","4,4'-Bipyridazine: a new twist for the synthesis of coordination polymers.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3140","3148","10.1039/b703911e","","","0.71073","MoKα","","0.013","0.0117","","","0.0238","0.024","","","","","","0.966","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005655","10.115","0.0008","16.3586","0.0009","18.1262","0.0014","90","","108.113","0.003","90","","2850.7","0.4","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H28 La N7 O10 -","- C26 H28 La N7 O10 -","- C104 H112 La4 N28 O40 -","4","1","","Kataoka, Yumiko; Paul, Dharam; Miyake, Hiroyuki; Shinoda, Satoshi; Tsukube, Hiroshi","A Cl- anion-responsive luminescent Eu3+ complex with a chiral tripod: ligand substituent effects on ternary complex stoichiometry and anion sensing selectivity.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2784","2791","10.1039/b703944a","","","0.7107","MoKα","","0.0435","0.0368","","","0.0605","0.0622","","","","","","1.256","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005656","9.4234","0.0001","9.624","0.0001","13.7241","0.0002","75.383","0.013","73.862","0.013","71.909","0.012","1117.55","0.11","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H28 N4 O -","- C26 H28 N4 O -","- C52 H56 N8 O2 -","2","1","","Kataoka, Yumiko; Paul, Dharam; Miyake, Hiroyuki; Shinoda, Satoshi; Tsukube, Hiroshi","A Cl- anion-responsive luminescent Eu3+ complex with a chiral tripod: ligand substituent effects on ternary complex stoichiometry and anion sensing selectivity.","Dalton transactions (Cambridge, England : 2003)","2007","","26","2784","2791","10.1039/b703944a","","","0.7107","MoKα","","0.0744","0.062","","","0.115","0.1196","","","","","","1.187","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005657","13.8787","0.0011","18.264","0.002","31.816","0.0014","90","","90","","90","","8064.7","1.1","173","2","173","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C42 H34 Cl2 N4 O8 P2 Pd -","- C42 H34 Cl2 N4 O8 P2 Pd -","- C336 H272 Cl16 N32 O64 P16 Pd8 -","8","1","","Kealey, Steven; Long, Nicholas J.; Miller, Philip W.; White, Andrew J. P.; Hitchcock, Peter B.; Gee, Antony","Variable coordination behaviour of pyrazole-containing N,P and N,P(O) ligands towards palladium(II).","Dalton transactions (Cambridge, England : 2003)","2007","","26","2823","2832","10.1039/b704051b","","","0.71073","MoKα","","0.0613","0.0407","","","0.086","0.0915","","","","","","1.037","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005658","9.9204","0.0003","10.2022","0.0003","11.5173","0.0003","71.592","0.002","78.246","0.002","87.496","0.001","1082.56","0.06","173","2","173","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C22 H18 Cl3 N2 O P -","- C22 H18 Cl3 N2 O P -","- C44 H36 Cl6 N4 O2 P2 -","2","1","","Kealey, Steven; Long, Nicholas J.; Miller, Philip W.; White, Andrew J. P.; Hitchcock, Peter B.; Gee, Antony","Variable coordination behaviour of pyrazole-containing N,P and N,P(O) ligands towards palladium(II).","Dalton transactions (Cambridge, England : 2003)","2007","","26","2823","2832","10.1039/b704051b","","x-ray","0.71073","MoKα","","0.0569","0.0481","","","0.1239","0.1297","","","","","","1.111","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005659","14.5729","0.0003","12.3105","0.0001","24.1681","0.0004","90","","98.68","0.001","90","","4286.09","0.12","173","2","173","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C43 H39 Cl5 N4 O2 P2 Pd -","- C43 H35 Cl5 N4 O2 P2 Pd -","- C172 H140 Cl20 N16 O8 P8 Pd4 -","4","1","","Kealey, Steven; Long, Nicholas J.; Miller, Philip W.; White, Andrew J. P.; Hitchcock, Peter B.; Gee, Antony","Variable coordination behaviour of pyrazole-containing N,P and N,P(O) ligands towards palladium(II).","Dalton transactions (Cambridge, England : 2003)","2007","","26","2823","2832","10.1039/b704051b","","x-ray","0.71073","MoKα","","0.0839","0.0575","","","0.1436","0.1593","","","","","","1.019","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005660","10.1514","0.0003","11.8973","0.0003","12.9736","0.0003","74.004","0.001","67.062","0.001","77.013","0.002","1374.87","0.06","173","2","173","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C46 H38 Cl14 N4 O2 P2 Pd -","- C46 H38 Cl14 N4 O2 P2 Pd -","- C46 H38 Cl14 N4 O2 P2 Pd -","1","0.5","","Kealey, Steven; Long, Nicholas J.; Miller, Philip W.; White, Andrew J. P.; Hitchcock, Peter B.; Gee, Antony","Variable coordination behaviour of pyrazole-containing N,P and N,P(O) ligands towards palladium(II).","Dalton transactions (Cambridge, England : 2003)","2007","","26","2823","2832","10.1039/b704051b","","x-ray","0.71073","MoKα","","0.0471","0.042","","","0.1105","0.1151","","","","","","0.932","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005661","8.5748","0.0003","19.1391","0.0007","17.7847","0.0006","90","","91.343","0.002","90","","2917.92","0.18","173","2","173","2","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H38 Cl14 N4 O10 P2 Pd -","- C46 H38 Cl14 N4 O10 P2 Pd -","- C92 H76 Cl28 N8 O20 P4 Pd2 -","2","0.5","","Kealey, Steven; Long, Nicholas J.; Miller, Philip W.; White, Andrew J. P.; Hitchcock, Peter B.; Gee, Antony","Variable coordination behaviour of pyrazole-containing N,P and N,P(O) ligands towards palladium(II).","Dalton transactions (Cambridge, England : 2003)","2007","","26","2823","2832","10.1039/b704051b","","x-ray","0.71073","MoKα","","0.0976","0.0596","","","0.1364","0.1576","","","","","","1.009","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005662","6.42","0.001","8.001","0.001","12.943","0.002","87.76","0.02","76.47","0.02","80.73","0.01","637.94","0.17","293","2","293","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C12 H14 N4 O3 -","- C12 H14 N4 O3 -","- C24 H28 N8 O6 -","2","1","","Bernhardt, Paul V.; Chin, Piao; Sharpe, Philip C.; Richardson, Des R.","Hydrazone chelators for the treatment of iron overload disorders: iron coordination chemistry and biological activity.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3232","3244","10.1039/b704102k","","x-ray","0.71069","MoKα","","0.051","0.0341","","","0.0914","0.1017","","","","","","1.027","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005663","8.469","0.001","13.836","0.002","9.806","0.002","90","","105.64","0.01","90","","1106.5","0.3","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 N4 O -","- C12 H10 N4 O -","- C48 H40 N16 O4 -","4","1","","Bernhardt, Paul V.; Chin, Piao; Sharpe, Philip C.; Richardson, Des R.","Hydrazone chelators for the treatment of iron overload disorders: iron coordination chemistry and biological activity.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3232","3244","10.1039/b704102k","","x-ray","0.71069","MoKα","","0.0924","0.04","","","0.102","0.1236","","","","","","1.012","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005664","26.311","0.003","26.311","0.003","11.27","0.001","90","","90","","120","","6756.6","1.2","293","2","293","2","","","","","","","synthesis as described","5","R -3 :H","-R 3","148","","","","- C13 H14 Br N3 O3 -","- C13 H14 Br N3 O3 -","- C234 H252 Br18 N54 O54 -","18","1","","Bernhardt, Paul V.; Chin, Piao; Sharpe, Philip C.; Richardson, Des R.","Hydrazone chelators for the treatment of iron overload disorders: iron coordination chemistry and biological activity.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3232","3244","10.1039/b704102k","","x-ray","0.71073","MoKα","","0.2601","0.0477","","","0.0766","0.1179","","","","","","0.927","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005665","4.618","0.001","22.759","0.003","10.663","0.003","90","","96.98","0.02","90","","1112.4","0.4","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H11 N3 O2 -","- C13 H11 N3 O2 -","- C52 H44 N12 O8 -","4","1","","Bernhardt, Paul V.; Chin, Piao; Sharpe, Philip C.; Richardson, Des R.","Hydrazone chelators for the treatment of iron overload disorders: iron coordination chemistry and biological activity.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3232","3244","10.1039/b704102k","","x-ray","0.71073","MoKα","","0.1686","0.0494","","","0.1151","0.1589","","","","","","0.956","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005666","6.839","0.005","16.527","0.005","15.507","0.005","90","","90.079","0.005","90","","1752.7","1.5","293","2","293","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 Br Cl N3 O7 -","- C13 H15 Br Cl N3 O7 -","- C52 H60 Br4 Cl4 N12 O28 -","4","1","","Bernhardt, Paul V.; Chin, Piao; Sharpe, Philip C.; Richardson, Des R.","Hydrazone chelators for the treatment of iron overload disorders: iron coordination chemistry and biological activity.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3232","3244","10.1039/b704102k","","x-ray","0.71073","MoKα","","0.08","0.0405","","","0.1","0.1157","","","","","","1.018","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005667","10.434","0.001","10.72","0.0006","14.691","0.002","90","","90","","90","","1643.2","0.3","293","2","293","2","","","","","","","synthesis as described","6","P c 21 n","P -2n -2ac","33","","","","- C13 H13 Br Cl N3 O6 -","- C13 H13 Br Cl N3 O6 -","- C52 H52 Br4 Cl4 N12 O24 -","4","1","","Bernhardt, Paul V.; Chin, Piao; Sharpe, Philip C.; Richardson, Des R.","Hydrazone chelators for the treatment of iron overload disorders: iron coordination chemistry and biological activity.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3232","3244","10.1039/b704102k","","x-ray","0.71073","MoKα","","0.1363","0.0386","","","0.0658","0.0833","","","","","","1.01","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005668","13.833","0.003","14.191","0.003","16.863","0.002","69.8","0.01","89.23","0.01","64.05","0.02","2756","1.1","150","2","150","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C28 H22 Br2 Fe N6 O3 -","- C28 H22 Br2 Fe N6 O3 -","- C112 H88 Br8 Fe4 N24 O12 -","4","2","","Bernhardt, Paul V.; Chin, Piao; Sharpe, Philip C.; Richardson, Des R.","Hydrazone chelators for the treatment of iron overload disorders: iron coordination chemistry and biological activity.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3232","3244","10.1039/b704102k","","x-ray","0.71073","MoKα","","0.2005","0.0811","","","0.1962","0.2568","","","","","","1.003","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005669","8.2708","0.0004","19.7579","0.0011","13.1996","0.0007","90","","103.53","0.001","90","","2097.13","0.19","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H24 N2 O8 Ru S2 -","- C16 H24 N2 O8 Ru S2 -","- C64 H96 N8 O32 Ru4 S8 -","4","1","","Rachford, Aaron A.; Petersen, Jeffrey L.; Rack, Jeffrey J.","Phototriggered sulfoxide isomerization in [Ru(pic)2(dmso)2].","Dalton transactions (Cambridge, England : 2003)","2007","","30","3245","3251","10.1039/b704205a","","","0.71073","MoKα","","0.0372","0.0343","","","0.091","0.094","","","","","","1.077","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005670","14.127","0.001","19.57","0.002","21.228","0.002","90","","90","","90","","5868.8","0.9","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","catena-(bis(mu-trifluoromethanesulfonato-\1kO:\2kO')bis (mu- (1,3-di-tert-butyl-2,4-bis(o-methoxyphenoxy)-(1,3,2,4) diazadiphosphetidine-1kappaP:2kappaP')disilver(i))","catena-[bis(μ-trifluoromethanesulfonato-\1kO:\2kO')bis (μ-(1,3-di-tert-butyl-2,4-bis(o-methoxyphenoxy)-[1,3,2,4] diazadiphosphetidine-1κP:2κP')disilver(I)]","","- C46 H64 Ag2 F6 N4 O14 P4 S2 -","- C46 H64 Ag2 F6 N4 O14 P4 S2 -","- C184 H256 Ag8 F24 N16 O56 P16 S8 -","4","1","","Chandrasekaran, P.; Mague, Joel T.; Balakrishna, Maravanji S.","One-dimensional silver(I) coordination polymers containing cyclodiphosphazane, cis-{(o-MeOC(6)H(4)O)P(mu-N(t)Bu)}(2).","Dalton transactions (Cambridge, England : 2003)","2007","","27","2957","2962","10.1039/b704303a","","","0.71073","MoKα","","0.102","0.0805","","","0.1427","0.152","","","","","","1.091","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005671","16.482","0.001","16.069","0.001","22.312","0.002","90","","105.269","0.001","90","","5700.7","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H32 Ag N3 O4 P2 -","- C23 H32 Ag N3 O4 P2 -","- C184 H256 Ag8 N24 O32 P16 -","8","2","","Chandrasekaran, P.; Mague, Joel T.; Balakrishna, Maravanji S.","One-dimensional silver(I) coordination polymers containing cyclodiphosphazane, cis-{(o-MeOC(6)H(4)O)P(mu-N(t)Bu)}(2).","Dalton transactions (Cambridge, England : 2003)","2007","","27","2957","2962","10.1039/b704303a","","","0.71073","MoKα","","0.0484","0.0427","","","0.1091","0.1128","","","","","","1.031","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005672","10.3173","0.0015","10.8014","0.0016","11.578","0.0016","83.15","0.002","84.599","0.002","66.184","0.001","1170.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H34 Cu3 N4 O16 -","- C52 H34 Cu3 N4 O16 -","- C52 H34 Cu3 N4 O16 -","1","0.5","","Han, Zhengbo; He, Yongke; Ge, Chunhua; Ribas, Joan; Xu, Lin","Hydrothermal syntheses, crystal structures and magnetic properties of two copper(II) complexes involved in situ ligand synthesis.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3020","3024","10.1039/B704327a","","","0.71073","MoKα","","0.0382","0.0324","","","0.0858","0.0902","","","","","","1.045","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005673","8.4691","0.0017","12.6394","0.0015","13.0665","0.0014","95.437","0.009","108.129","0.012","91.521","0.014","1321","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H44 Cu6 N4 O28 -","- C52 H44 Cu6 N4 O28 -","- C52 H44 Cu6 N4 O28 -","1","0.5","","Han, Zhengbo; He, Yongke; Ge, Chunhua; Ribas, Joan; Xu, Lin","Hydrothermal syntheses, crystal structures and magnetic properties of two copper(II) complexes involved in situ ligand synthesis.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3020","3024","10.1039/B704327a","","","0.71073","MoKα","","0.0706","0.0557","","","0.1456","0.1656","","","","","","1.071","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005674","15.1631","0.0004","29.3035","0.0007","7.5829","0.0002","90","","90","","90","","3369.32","0.15","150","2","150","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C11 H17 Cl2 N3 O5 Pt -","- C11 H17 Cl2 N3 O5 Pt -","- C88 H136 Cl16 N24 O40 Pt8 -","8","1","","Lasri, Jamal; Adília Januário Charmier, M; da Silva, M Fátima C Guedes; Pombeiro, Armando J. L.","Mixed unsymmetric oxadiazoline and/or imine platinum(II) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3259","3266","10.1039/b704329e","","","0.71069","MoKα","","0.0345","0.0283","","","0.0684","0.0701","","","","","","1.173","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005675","13.283","0.014","12.077","0.014","29.76","0.03","90","","96.159","0.01","90","","4747","9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C53 H48 Br N3 P4 W -","- C53 H48 Br N3 P4 W -","- C212 H192 Br4 N12 P16 W4 -","4","1","","Chan, Yun Fu; Chippindale, Ann M.; Colquhoun, Howard M.; Drew, Michael G. B.; Williams, David J.","Extended-chain, multinuclear transition metal complexes bridged by cyanodiazenido(1-), [N=N-C[triple bond, length as m-dash]N]-, ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3538","3545","10.1039/b704367h","","","0.71073","MoKα","","0.1329","0.0821","","","0.1966","0.2193","","","","","","1.07","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005676","27.888","0.004","13.2256","0.0011","17.4034","0.0012","90","","107.467","0.008","90","","6123","1.1","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C116.7 H113.4 Br2 Cl5.4 N6 O8 P8 Rh2 W2 -","- C116.7 H113.4 Br2 Cl5.4 N6 O8 P8 Rh2 W2 -","- C233.4 H226.8 Br4 Cl10.8 N12 O16 P16 Rh4 W4 -","2","0.5","","Chan, Yun Fu; Chippindale, Ann M.; Colquhoun, Howard M.; Drew, Michael G. B.; Williams, David J.","Extended-chain, multinuclear transition metal complexes bridged by cyanodiazenido(1-), [N=N-C[triple bond, length as m-dash]N]-, ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3538","3545","10.1039/b704367h","","","1.54178","CuKα","","0.0889","0.0684","","","0.1694","0.1796","","","","","","1.165","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005677","12.4189","0.0008","16.2144","0.0011","18.3904","0.0006","81.823","0.005","83.808","0.005","79.185","0.005","3587.9","0.4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C116 H106 Br2 Cl32 N6 P8 Pd W2 -","- C116 H106 Br2 Cl32 N6 P8 Pd W2 -","- C116 H106 Br2 Cl32 N6 P8 Pd W2 -","1","0.5","","Chan, Yun Fu; Chippindale, Ann M.; Colquhoun, Howard M.; Drew, Michael G. B.; Williams, David J.","Extended-chain, multinuclear transition metal complexes bridged by cyanodiazenido(1-), [N=N-C[triple bond, length as m-dash]N]-, ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3538","3545","10.1039/b704367h","","","1.54178","CuKα","","0.0765","0.0551","","","0.1306","0.1402","","","","","","1.047","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005678","12.3745","0.0002","16.1371","0.0001","18.3672","0.0002","66.321","0.001","77.507","0.001","72.376","0.001","3182.37","0.07","120","2","120","2","","","","","","","","9","P -1","-P 1","2","","","","- C130 H114 Br2 F12 Mn N6 O4 P8 W2 -","- C130 H114 Br2 F12 Mn N6 O4 P8 W2 -","- C130 H114 Br2 F12 Mn N6 O4 P8 W2 -","1","0.5","","Chan, Yun Fu; Chippindale, Ann M.; Colquhoun, Howard M.; Drew, Michael G. B.; Williams, David J.","Extended-chain, multinuclear transition metal complexes bridged by cyanodiazenido(1-), [N=N-C[triple bond, length as m-dash]N]-, ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3538","3545","10.1039/b704367h","","","0.71073","MoKα","","0.0427","0.0348","","","0.0905","0.0943","","","","","","1.062","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005679","12.55","0.014","16.589","0.018","18.41","0.02","66.441","0.01","77.086","0.01","72.451","0.01","3327","6","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C130 H114 Br2 F12 N6 Ni O4 P8 W2 -","- C130 H114 Br2 F12 N6 Ni O4 P8 W2 -","- C130 H114 Br2 F12 N6 Ni O4 P8 W2 -","1","0.5","","Chan, Yun Fu; Chippindale, Ann M.; Colquhoun, Howard M.; Drew, Michael G. B.; Williams, David J.","Extended-chain, multinuclear transition metal complexes bridged by cyanodiazenido(1-), [N=N-C[triple bond, length as m-dash]N]-, ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3538","3545","10.1039/b704367h","","","0.71073","MoKα","","0.142","0.0928","","","0.1675","0.1892","","","","","","1.07","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005680","12.3596","0.0015","16.162","0.002","18.3412","0.0019","66.374","0.01","77.31","0.01","72.154","0.01","3175.4","0.7","120","2","120","2","","","","","","","","9","P -1","-P 1","2","","","","- C130 H114 Br2 F12 N6 O4 P8 W2 Zn -","- C130 H114 Br2 F12 N6 O4 P8 W2 Zn -","- C130 H114 Br2 F12 N6 O4 P8 W2 Zn -","1","0.5","","Chan, Yun Fu; Chippindale, Ann M.; Colquhoun, Howard M.; Drew, Michael G. B.; Williams, David J.","Extended-chain, multinuclear transition metal complexes bridged by cyanodiazenido(1-), [N=N-C[triple bond, length as m-dash]N]-, ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3538","3545","10.1039/b704367h","","","0.71073","MoKα","","0.0794","0.0493","","","0.103","0.1166","","","","","","0.776","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005681","13.4062","0.0003","13.6587","0.0003","16.5249","0.0005","94.185","0.001","110.576","0.001","105.646","0.0013","2680.26","0.12","150","","150","2","","","","","","","?","10","P -1","-P 1","2","","","","- C54 H53 B Br Cl2 F4 N3 O P4 W -","- C54 H53 B Br Cl2 F4 N3 O P4 W -","- C108 H106 B2 Br2 Cl4 F8 N6 O2 P8 W2 -","2","1","","Chan, Yun Fu; Chippindale, Ann M.; Colquhoun, Howard M.; Drew, Michael G. B.; Williams, David J.","Extended-chain, multinuclear transition metal complexes bridged by cyanodiazenido(1-), [N=N-C[triple bond, length as m-dash]N]-, ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3538","3545","10.1039/b704367h","","","0.71073","MoKα","","0.1152","0.0528","","0.1075","0.0583","0.0584","","","","","","1.1188","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005682","7.913","0.0016","11.833","0.002","11.894","0.002","115.45","0.03","102.53","0.03","102.35","0.03","920.2","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H19 Cl Cu N4 O3 -","- C18 H19 Cl Cu N4 O3 -","- C36 H38 Cl2 Cu2 N8 O6 -","2","1","","Maheswari, Palanisamy Uma; Lappalainen, Kristian; Sfregola, Michael; Barends, Sharief; Gamez, Patrick; Turpeinen, Urho; Mutikainen, Ilpo; van Wezel, Gilles P.; Reedijk, Jan","Structure and DNA cleavage properties of two copper(II) complexes of the pyridine-pyrazole-containing ligands mbpzbpy and Hmpzbpya.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3676","3683","10.1039/b704390b","","","0.71073","MoKα","","0.0922","0.067","","","0.1713","0.193","","","","","","0.965","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005683","18.391","0.003","15.522","0.003","9.122","0.0018","90","","104.03","0.03","90","","2526.3","0.9","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H29 Br2 Cu N6 O2.5 -","- C22 H29 Br2 Cu N6 O2.5 -","- C88 H116 Br8 Cu4 N24 O10 -","4","0.5","","Maheswari, Palanisamy Uma; Lappalainen, Kristian; Sfregola, Michael; Barends, Sharief; Gamez, Patrick; Turpeinen, Urho; Mutikainen, Ilpo; van Wezel, Gilles P.; Reedijk, Jan","Structure and DNA cleavage properties of two copper(II) complexes of the pyridine-pyrazole-containing ligands mbpzbpy and Hmpzbpya.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3676","3683","10.1039/b704390b","","","0.71073","MoKα","","0.0454","0.0287","","","0.0615","0.0676","","","","","","1.048","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005684","9.544","0.006","18.426","0.011","17.134","0.01","90","","105.156","0.012","90","","2908","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H21 B F15 P -","- C27 H21 B F15 P -","- C108 H84 B4 F60 P4 -","4","1","","Welch, Gregory C.; Cabrera, Lourdes; Chase, Preston A.; Hollink, Emily; Masuda, Jason D.; Wei, Pingrong; Stephan, Douglas W.","Tuning Lewis acidity using the reactivity of ""frustrated Lewis pairs"": facile formation of phosphine-boranes and cationic phosphonium-boranes.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3407","3414","10.1039/b704417h","","","0.71073","MoKα","","0.0634","0.0385","","","0.1065","0.1143","","","","","","0.945","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005685","14.235","0.003","25.588","0.005","21.701","0.003","90","","101.113","0.005","90","","7756","2","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H35 B Cl2 F15 P -","- C37 H35 B Cl2 F15 P -","- C296 H280 B8 Cl16 F120 P8 -","8","2","","Welch, Gregory C.; Cabrera, Lourdes; Chase, Preston A.; Hollink, Emily; Masuda, Jason D.; Wei, Pingrong; Stephan, Douglas W.","Tuning Lewis acidity using the reactivity of ""frustrated Lewis pairs"": facile formation of phosphine-boranes and cationic phosphonium-boranes.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3407","3414","10.1039/b704417h","","","0.71073","MoKα","","0.1809","0.1082","","","0.2841","0.3517","","","","","","1.085","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005686","8.955","0.005","15.767","0.009","19.743","0.011","90","","90.482","0.012","90","","2787","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H19 B F15 P -","- C26 H19 B F15 P -","- C104 H76 B4 F60 P4 -","4","1","","Welch, Gregory C.; Cabrera, Lourdes; Chase, Preston A.; Hollink, Emily; Masuda, Jason D.; Wei, Pingrong; Stephan, Douglas W.","Tuning Lewis acidity using the reactivity of ""frustrated Lewis pairs"": facile formation of phosphine-boranes and cationic phosphonium-boranes.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3407","3414","10.1039/b704417h","","","0.71073","MoKα","","0.0796","0.0436","","","0.1008","0.1061","","","","","","0.862","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005687","9.3212","0.0007","16.4421","0.0013","17.8541","0.0014","90","","91.044","0.001","90","","2735.9","0.4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H22 B F14 P -","- C27 H22 B F14 P -","- C108 H88 B4 F56 P4 -","4","1","","Welch, Gregory C.; Cabrera, Lourdes; Chase, Preston A.; Hollink, Emily; Masuda, Jason D.; Wei, Pingrong; Stephan, Douglas W.","Tuning Lewis acidity using the reactivity of ""frustrated Lewis pairs"": facile formation of phosphine-boranes and cationic phosphonium-boranes.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3407","3414","10.1039/b704417h","","","0.71073","MoKα","","0.0639","0.046","","","0.1222","0.1376","","","","","","1.065","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005688","9.6218","0.0012","17.225","0.002","18.468","0.002","67.652","0.002","76.712","0.003","88.612","0.002","2748.3","0.6","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H20 B F14 P -","- C26 H20 B F14 P -","- C104 H80 B4 F56 P4 -","4","2","","Welch, Gregory C.; Cabrera, Lourdes; Chase, Preston A.; Hollink, Emily; Masuda, Jason D.; Wei, Pingrong; Stephan, Douglas W.","Tuning Lewis acidity using the reactivity of ""frustrated Lewis pairs"": facile formation of phosphine-boranes and cationic phosphonium-boranes.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3407","3414","10.1039/b704417h","","","0.71073","MoKα","","0.0793","0.0548","","","0.1537","0.1684","","","","","","1.044","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005689","9.2909","0.0007","12.4894","0.0009","18.1813","0.0013","90","","102.579","0.002","90","","2059.1","0.3","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C11 H28 Br Cl2 Co N4 O10 -","- C11 H28 Br Cl2 Co N4 O10 -","- C44 H112 Br4 Cl8 Co4 N16 O40 -","4","1","","Broge, Louise; Søtofte, Inger; Jensen, Kristian; Jensen, Nicolai; Pretzmann, Ulla; Springborg, Johan","Bowl adamanzanes‒bicyclic tetraamines: syntheses and crystal structures of complexes with cobalt(III) and chelating coordinated oxo-anions.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3826","3839","10.1039/b704451h","","","0.71073","MoKα","","0.0496","0.0425","","","0.1076","0.1125","","","","","","1.036","","","","has coordinates,has disorder","179760","2020-10-21","18:00:00",""
"7005690","18.2694","0.0009","12.2362","0.0006","19.6977","0.0009","90","","114.909","0.001","90","","3993.8","0.3","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H30.5 Cl2 Co N4 O11.75 -","- C11 H29 Cl2 Co N4 O11.75 -","- C88 H232 Cl16 Co8 N32 O94 -","8","2","","Broge, Louise; Søtofte, Inger; Jensen, Kristian; Jensen, Nicolai; Pretzmann, Ulla; Springborg, Johan","Bowl adamanzanes‒bicyclic tetraamines: syntheses and crystal structures of complexes with cobalt(III) and chelating coordinated oxo-anions.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3826","3839","10.1039/b704451h","","","0.71073","MoKα","","0.087","0.0667","","","0.1665","0.1809","","","","","","1.046","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005691","8.2636","0.0004","16.6364","0.0007","13.8078","0.0006","90","","94.608","0.001","90","","1892.11","0.15","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 Co F3 N4 O7 S2 -","- C12 H24 Co F3 N4 O7 S2 -","- C48 H96 Co4 F12 N16 O28 S8 -","4","1","","Broge, Louise; Søtofte, Inger; Jensen, Kristian; Jensen, Nicolai; Pretzmann, Ulla; Springborg, Johan","Bowl adamanzanes‒bicyclic tetraamines: syntheses and crystal structures of complexes with cobalt(III) and chelating coordinated oxo-anions.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3826","3839","10.1039/b704451h","","","0.71073","MoKα","","0.0397","0.0361","","","0.0841","0.0863","","","","","","1.067","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005692","17.2058","0.0007","11.4473","0.0005","9.5525","0.0004","90","","90","","90","","1881.46","0.14","120","2","120","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C11 H25 Cl4 Co N4 O2 Zn -","- C12 H25 Cl4 Co N4 O2 Zn -","- C48 H100 Cl16 Co4 N16 O8 Zn4 -","4","0.5","","Broge, Louise; Søtofte, Inger; Jensen, Kristian; Jensen, Nicolai; Pretzmann, Ulla; Springborg, Johan","Bowl adamanzanes‒bicyclic tetraamines: syntheses and crystal structures of complexes with cobalt(III) and chelating coordinated oxo-anions.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3826","3839","10.1039/b704451h","","","0.71073","MoKα","","0.0208","0.0195","","","0.0483","0.049","","","","","","1.082","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005693","9.024","0.0006","13.3493","0.0009","15.3487","0.0011","90","","95.272","0.002","90","","1841.1","0.2","120","2","120","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C11 H24 Cl Co N6 O10 -","- C11 H24 Cl Co N6 O10 -","- C44 H96 Cl4 Co4 N24 O40 -","4","1","","Broge, Louise; Søtofte, Inger; Jensen, Kristian; Jensen, Nicolai; Pretzmann, Ulla; Springborg, Johan","Bowl adamanzanes‒bicyclic tetraamines: syntheses and crystal structures of complexes with cobalt(III) and chelating coordinated oxo-anions.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3826","3839","10.1039/b704451h","","","0.71073","MoKα","","0.0383","0.0367","","","0.0888","0.0898","","","","","","1.047","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005694","11.4032","0.0006","11.9183","0.0006","27.5618","0.0013","90","","90","","90","","3745.8","0.3","120","2","120","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C12 H25.33 Cl1.5 Co N4 Na0.5 O9.67 -","- C12 H25.33 Cl1.5 Co N4 Na0.5 O9.665 -","- C96 H202.64 Cl12 Co8 N32 Na4 O77.32 -","8","2","","Broge, Louise; Søtofte, Inger; Jensen, Kristian; Jensen, Nicolai; Pretzmann, Ulla; Springborg, Johan","Bowl adamanzanes‒bicyclic tetraamines: syntheses and crystal structures of complexes with cobalt(III) and chelating coordinated oxo-anions.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3826","3839","10.1039/b704451h","","","0.71073","MoKα","","0.0671","0.0489","","","0.0899","0.0982","","","","","","1.002","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005695","8.559","0.0001","11.301","0.0002","14.915","0.0003","105.971","0.0012","96.897","0.0013","108.969","0.0014","1276.35","0.04","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H38 Cl2 N2 Si4 Sn -","- C13 H38 Cl2 N2 Si4 Sn -","- C26 H76 Cl4 N4 Si8 Sn2 -","2","1","","Dickie, Diane A.; Lee, Peter T. K.; Labeodan, Ojisamola A.; Schatte, Gabriele; Weinberg, Noham; Lewis, Andrew R.; Bernard, Guy M.; Wasylishen, Roderick E.; Clyburne, Jason A. C.","Flexible coordination of the carboxylate ligand in tin(II) amides and a 1,3-diaza-2,4-distannacyclobutanediyl.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2862","2869","10.1039/b704588c","","","0.71073","MoKα","","0.0277","0.0247","","","0.0562","0.0582","","","","","","1.061","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005696","10.429","0.002","13.276","0.003","14.405","0.003","104.92","0.03","110.62","0.03","101.7","0.03","1706.1","0.9","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C64 H74 Cl4 N2 O4 Si4 Sn2 -","- C64 H74 Cl4 N2 O4 Si4 Sn2 -","- C64 H74 Cl4 N2 O4 Si4 Sn2 -","1","0.5","","Dickie, Diane A.; Lee, Peter T. K.; Labeodan, Ojisamola A.; Schatte, Gabriele; Weinberg, Noham; Lewis, Andrew R.; Bernard, Guy M.; Wasylishen, Roderick E.; Clyburne, Jason A. C.","Flexible coordination of the carboxylate ligand in tin(II) amides and a 1,3-diaza-2,4-distannacyclobutanediyl.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2862","2869","10.1039/b704588c","","","0.71073","MoKα","","0.0473","0.0348","","","0.0737","0.0763","","","","","","1.131","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005697","17.229","0.0002","19.548","0.0002","20.444","0.0002","90","","95.453","0.0006","90","","6854.23","0.13","173","2","173","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C63 H88 Cl2 N2 O4 Si4 Sn2 -","- C63 H88 Cl2 N2 O4 Si4 Sn2 -","- C252 H352 Cl8 N8 O16 Si16 Sn8 -","4","1","","Dickie, Diane A.; Lee, Peter T. K.; Labeodan, Ojisamola A.; Schatte, Gabriele; Weinberg, Noham; Lewis, Andrew R.; Bernard, Guy M.; Wasylishen, Roderick E.; Clyburne, Jason A. C.","Flexible coordination of the carboxylate ligand in tin(II) amides and a 1,3-diaza-2,4-distannacyclobutanediyl.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2862","2869","10.1039/b704588c","","","0.71073","MoKα","","0.0704","0.0368","","","0.0716","0.083","","","","","","1.019","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005698","11.8023","0.0006","12.5695","0.0009","14.217","0.001","67.446","0.003","65.69","0.002","76.473","0.003","1767.8","0.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C66 H94 Cl4 N2 O4 Si4 Sn2 -","- C66 H94 Cl4 N2 O4 Si4 Sn2 -","- C66 H94 Cl4 N2 O4 Si4 Sn2 -","1","0.5","","Dickie, Diane A.; Lee, Peter T. K.; Labeodan, Ojisamola A.; Schatte, Gabriele; Weinberg, Noham; Lewis, Andrew R.; Bernard, Guy M.; Wasylishen, Roderick E.; Clyburne, Jason A. C.","Flexible coordination of the carboxylate ligand in tin(II) amides and a 1,3-diaza-2,4-distannacyclobutanediyl.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2862","2869","10.1039/b704588c","","","0.71073","MoKα","","0.0701","0.0635","","","0.1723","0.1769","","","","","","1.06","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005699","10.5733","0.0006","11.8229","0.0006","13.8362","0.0007","67.293","0.001","79.968","0.001","89.719","0.001","1567.46","0.14","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H36 Cl2 N O2 Si Sn -","- C29 H36 Cl2 N O2 Si Sn -","- C58 H72 Cl4 N2 O4 Si2 Sn2 -","2","1","","Dickie, Diane A.; Lee, Peter T. K.; Labeodan, Ojisamola A.; Schatte, Gabriele; Weinberg, Noham; Lewis, Andrew R.; Bernard, Guy M.; Wasylishen, Roderick E.; Clyburne, Jason A. C.","Flexible coordination of the carboxylate ligand in tin(II) amides and a 1,3-diaza-2,4-distannacyclobutanediyl.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2862","2869","10.1039/b704588c","","","0.71073","MoKα","","0.0466","0.0433","","","0.1173","0.1189","","","","","","1.053","","","","has coordinates","179760","2020-10-21","18:00:00",""
"7005700","10.8922","0.0003","11.7957","0.0003","12.324","0.0003","77.2409","0.0016","75.5426","0.0016","87.3334","0.0017","1495.34","0.07","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H78 N2 O5 Si2 Sn2 -","- C60 H78 N2 O5 Si2 Sn2 -","- C60 H78 N2 O5 Si2 Sn2 -","1","0.5","","Dickie, Diane A.; Lee, Peter T. K.; Labeodan, Ojisamola A.; Schatte, Gabriele; Weinberg, Noham; Lewis, Andrew R.; Bernard, Guy M.; Wasylishen, Roderick E.; Clyburne, Jason A. C.","Flexible coordination of the carboxylate ligand in tin(II) amides and a 1,3-diaza-2,4-distannacyclobutanediyl.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2862","2869","10.1039/b704588c","","","0.71073","MoKα","","0.0567","0.0427","","","0.092","0.0999","","","","","","1.054","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005701","9.6006","0.0007","13.8728","0.001","15.8526","0.0011","94.061","0.002","95.855","0.002","99.201","0.002","2065.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H30 Cl6 N2 P2 Pd -","- C37 H30 Cl6.02 N2 P2 Pd -","- C74 H60 Cl12.04 N4 P4 Pd2 -","2","1","","Aguirre, Pedro A.; Lagos, Carolina A.; Moya, Sergio A.; Zúñiga, César; Vera-Oyarce, Cristian; Sola, Eduardo; Peris, Gabriel; Bayón, J Carles","Methoxycarbonylation of olefins catalyzed by palladium complexes bearing P,N-donor ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5419","5426","10.1039/b704615b","","","0.71073","MoKα","","0.1774","0.0858","","","0.2292","0.2871","","","","","","1.031","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005702","6.8208","0.0002","9.3822","0.0003","15.0516","0.0006","97.848","0.002","90.932","0.002","96.928","0.002","946.7","0.06","173","2","173","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C12 H18 Cl3 N O2 Si2 Ti -","- C12 H18 Cl3 N O2 Si2 Ti -","- C24 H36 Cl6 N2 O4 Si4 Ti2 -","2","1","","Evans, Lloyd T. J.; Coles, Martyn P.; Geoffrey, F.; Cloke, N.; Hitchcock, Peter B.","Deactivation pathways of ethylene polymerization catalysts derived from titanium and zirconium 1,3-bis(furyl)-1,1,3,3-tetramethyldisilazide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2707","2717","10.1039/b704625a","","x-ray","0.71073","MoKα","","0.0931","0.0848","","","0.2494","0.2547","","","","","","1.061","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005703","27.1916","0.0004","11.2759","0.0002","29.9679","0.0004","90","","110.992","0.001","90","","8578.6","0.2","173","2","173","2","","","","","","","synthesis as described","7","C 1 2/c 1","-C 2yc","15","","","","- C14 H22 Cl3 N O2 Si2 Ti -","- C14 H22 Cl3 N O2 Si2 Ti -","- C224 H352 Cl48 N16 O32 Si32 Ti16 -","16","2","","Evans, Lloyd T. J.; Coles, Martyn P.; Geoffrey, F.; Cloke, N.; Hitchcock, Peter B.","Deactivation pathways of ethylene polymerization catalysts derived from titanium and zirconium 1,3-bis(furyl)-1,1,3,3-tetramethyldisilazide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2707","2717","10.1039/b704625a","","x-ray","0.7107","MoKα","","0.0673","0.0397","","","0.0818","0.0917","","","","","","1.018","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005704","15.7737","0.0013","8.0018","0.0008","16.6741","0.0014","90","","113.423","0.005","90","","1931.1","0.3","173","2","173","2","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H36 Cl6 N2 O4 Si4 Zr2 -","- C24 H36 Cl6 N2 O4 Si4 Zr2 -","- C48 H72 Cl12 N4 O8 Si8 Zr4 -","2","0.5","","Evans, Lloyd T. J.; Coles, Martyn P.; Geoffrey, F.; Cloke, N.; Hitchcock, Peter B.","Deactivation pathways of ethylene polymerization catalysts derived from titanium and zirconium 1,3-bis(furyl)-1,1,3,3-tetramethyldisilazide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2707","2717","10.1039/b704625a","","x-ray","0.71073","MoKα","","0.0615","0.044","","","0.0971","0.1065","","","","","","1.089","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005705","8.7913","0.0003","10.3992","0.0004","14.8782","0.0007","102.02","0.002","97.133","0.003","109.483","0.002","1226.24","0.09","173","2","173","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C35 H52 Cl6 N2 O4 Si4 Zr2 -","- C35 H44 Cl6 N2 O4 Si4 Zr2 -","- C35 H44 Cl6 N2 O4 Si4 Zr2 -","1","0.5","","Evans, Lloyd T. J.; Coles, Martyn P.; Geoffrey, F.; Cloke, N.; Hitchcock, Peter B.","Deactivation pathways of ethylene polymerization catalysts derived from titanium and zirconium 1,3-bis(furyl)-1,1,3,3-tetramethyldisilazide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2707","2717","10.1039/b704625a","","x-ray","0.71073","MoKα","","0.0505","0.0349","","","0.0723","0.0789","","","","","","1.015","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005706","11.4136","0.0008","12.1506","0.0008","15.176","0.0013","89.866","0.004","69.51","0.004","84.79","0.005","1962.4","0.3","173","2","173","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C30.5 H50 Cl2 N2 O4 Si4 Ti -","- C30.5 H44 Cl2 N2 O4 Si4 Ti -","- C61 H88 Cl4 N4 O8 Si8 Ti2 -","2","1","","Evans, Lloyd T. J.; Coles, Martyn P.; Geoffrey, F.; Cloke, N.; Hitchcock, Peter B.","Deactivation pathways of ethylene polymerization catalysts derived from titanium and zirconium 1,3-bis(furyl)-1,1,3,3-tetramethyldisilazide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2707","2717","10.1039/b704625a","","x-ray","0.71073","MoKα","","0.1134","0.0762","","","0.1587","0.1741","","","","","","1.203","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005707","20.2313","0.0008","10.0263","0.0004","19.8693","0.0005","90","","115.341","0.002","90","","3642.6","0.2","173","2","173","2","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H44 Cl2 N2 O4 Si4 Zr -","- C28 H44 Cl2 N2 O4 Si4 Zr -","- C112 H176 Cl8 N8 O16 Si16 Zr4 -","4","1","","Evans, Lloyd T. J.; Coles, Martyn P.; Geoffrey, F.; Cloke, N.; Hitchcock, Peter B.","Deactivation pathways of ethylene polymerization catalysts derived from titanium and zirconium 1,3-bis(furyl)-1,1,3,3-tetramethyldisilazide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2707","2717","10.1039/b704625a","","x-ray","0.71073","MoKα","","0.0854","0.0462","","","0.0889","0.1027","","","","","","1.011","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005708","13.5158","0.0008","14.9602","0.0008","17.5348","0.0007","90","","99.427","0.003","90","","3497.6","0.3","173","2","173","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H44 Cl N2 O4 Si4 Ti -","- C28 H44 Cl N2 O4 Si4 Ti -","- C112 H176 Cl4 N8 O16 Si16 Ti4 -","4","1","","Evans, Lloyd T. J.; Coles, Martyn P.; Geoffrey, F.; Cloke, N.; Hitchcock, Peter B.","Deactivation pathways of ethylene polymerization catalysts derived from titanium and zirconium 1,3-bis(furyl)-1,1,3,3-tetramethyldisilazide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2707","2717","10.1039/b704625a","","x-ray","0.71073","MoKα","","0.0737","0.0451","","","0.0962","0.1101","","","","","","1.034","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005709","14.9193","0.0003","24.7954","0.0006","14.0215","0.0002","90","","97.15","0.002","90","","5146.64","0.18","295","","295","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H66 Cl3 N9 Ni4 O24 -","- C30 H50 Cl3 N9 Ni4 O24 -","- C120 H200 Cl12 N36 Ni16 O96 -","4","0.5","","Mandal, Debashree; Bertolasi, Valerio; Aromí, Guillem; Ray, Debashis","A ketone oximate based cyclic cationic [Ni(II)4] inverse metallacrown from simultaneous chelation and bridging of two ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","20","1989","1992","10.1039/b704678m","","","0.71073","MoKα","","0.0782","0.0458","","","0.115","0.1287","","","","","","1.022","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005710","12.37","0.003","17.427","0.002","22.378","0.005","90","","90","","90","","4824.1","1.7","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Di-*ìì*-alkoxo-(1-[(2-Hydroxy-3,5-di-*tert*-butyl-benzylidene)-amino] -indan-2-ol)iron(III) chloride","","","- C48.3 H58.6 Cl2.6 Fe2 N2 O4 -","- C48.3 H58.6 Cl2.6 Fe2 N2 O4 -","- C193.2 H234.4 Cl10.4 Fe8 N8 O16 -","4","1","","Howard, Judith A. K.; Ilyashenko, Gennadiy; Sparkes, Hazel A.; Whiting, Andrew","Development of new transition metal catalysts for the oxidation of a hydroxamic acid with in situ Diels-Alder trapping of the acyl nitroso derivative.","Dalton transactions (Cambridge, England : 2003)","2007","","21","2108","2111","10.1039/b704728b","","","0.71073","MoKα","","0.0824","0.0553","","","0.1096","0.1201","","","","","","1.067","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005711","13.389","0.002","13.389","0.002","9.174","0.003","90","","90","","120","","1424.2","0.6","296","2","296","2","","","","","","","","7","P -3","-P 3","147","","","","- C18 H24 Cl3 Fe K N10 O12 -","- C18 H24 Cl3 Fe K N10 O12 -","- C36 H48 Cl6 Fe2 K2 N20 O24 -","2","0.333333","","Brewer, Greg; Butcher, Ray J.; Viragh, Carol; White, Genevieve","Supramolecular assemblies prepared from an iron(ii) tripodal imidazole complex. A molecular scaffolding for the self assembly of icosahedral complexes of K+, Rb+, Cs+ and NH4+ cations","Dalton Transactions","2007","","37","4132","","10.1039/b704823h","","","0.71073","MoKα","","0.0266","0.0245","","","0.0672","0.0689","","","","","","1.057","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7005712","13.4744","0.0008","13.4744","0.0008","9.3487","0.0011","90","","90","","120","","1469.9","0.2","173","2","173","2","","","","","","","","7","P -3","-P 3","147","","","","- C18 H24 Cl3 Fe N10 O12 Rb -","- C18 H24 Cl3 Fe N10 O12 Rb -","- C36 H48 Cl6 Fe2 N20 O24 Rb2 -","2","0.333333","","Brewer, Greg; Butcher, Ray J.; Viragh, Carol; White, Genevieve","Supramolecular assemblies prepared from an iron(ii) tripodal imidazole complex. A molecular scaffolding for the self assembly of icosahedral complexes of K+, Rb+, Cs+ and NH4+ cations","Dalton Transactions","2007","","37","4132","","10.1039/b704823h","","","0.71073","MoKα","","0.0292","0.0233","","","0.0571","0.0595","","","","","","1.039","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7005713","9.7997","0.0009","16.6091","0.0016","16.043","0.0015","90","","90","","90","","2611.2","0.4","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C18 H24 Cl2 Mn N10 O8 -","- C18 H24 Cl2 Mn N10 O8 -","- C72 H96 Cl8 Mn4 N40 O32 -","4","1","","Brewer, Greg; Butcher, Ray J.; Viragh, Carol; White, Genevieve","Supramolecular assemblies prepared from an iron(ii) tripodal imidazole complex. A molecular scaffolding for the self assembly of icosahedral complexes of K+, Rb+, Cs+ and NH4+ cations","Dalton Transactions","2007","","37","4132","","10.1039/b704823h","","","0.71073","MoKα","","0.0412","0.0326","","","0.0702","0.0737","","","","","","1.032","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7005714","13.5873","0.0004","13.5873","0.0004","9.3764","0.0006","90","","90","","120","","1499.11","0.11","293","2","293","2","","","","","","","","6","P -3","-P 3","147","","","","- C18 H28 Cl3 Fe N11 O12 -","- C18 H28 Cl3 Fe N11 O12 -","- C36 H56 Cl6 Fe2 N22 O24 -","2","0.333333","","Brewer, Greg; Butcher, Ray J.; Viragh, Carol; White, Genevieve","Supramolecular assemblies prepared from an iron(II) tripodal imidazole complex. A molecular scaffolding for the self assembly of icosahedral complexes of K+, Rb+, Cs+ and NH4+ cations","Dalton Transactions","2007","","37","4132","","10.1039/b704823h","","","0.71073","MoKα","","0.0362","0.0333","","","0.0967","0.0999","","","","","","1.044","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7005715","13.5022","0.0013","13.5022","0.0013","9.5419","0.0013","90","","90","","120","","1506.5","0.3","173","2","173","2","","","","","","","","7","P -3","-P 3","147","","","","- C18 H24 Cl3 Cs Fe N10 O12 -","- C18 H24 Cl3 Cs Fe N10 O12 -","- C36 H48 Cl6 Cs2 Fe2 N20 O24 -","2","0.333333","","Brewer, Greg; Butcher, Ray J.; Viragh, Carol; White, Genevieve","Supramolecular assemblies prepared from an iron(ii) tripodal imidazole complex. A molecular scaffolding for the self assembly of icosahedral complexes of K+, Rb+, Cs+ and NH4+ cations","Dalton Transactions","2007","","37","4132","","10.1039/b704823h","","","0.71073","MoKα","","0.0523","0.0381","","","0.0989","0.1015","","","","","","1.128","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7005716","13.4838","0.0004","13.4838","0.0004","9.352","0.0006","90","","90","","120","","1472.52","0.11","173","2","173","2","","","","","","","","6","P -3","-P 3","147","","","","- C18 H28 Cl3 Fe N11 O12 -","- C18 H28.02 Cl3 Fe N11 O12 -","- C36 H56.04 Cl6 Fe2 N22 O24 -","2","0.333333","","Brewer, Greg; Butcher, Ray J.; Viragh, Carol; White, Genevieve","Supramolecular assemblies prepared from an iron(ii) tripodal imidazole complex. A molecular scaffolding for the self assembly of icosahedral complexes of K+, Rb+, Cs+ and NH4+ cations","Dalton Transactions","2007","","37","4132","","10.1039/b704823h","","","0.71073","MoKα","","0.03","0.027","","","0.0742","0.0761","","","","","","1.069","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7005717","7.0434","0.0018","8.121","0.002","19.607","0.005","90","","100.262","0.004","90","","1103.6","0.5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 Fe I O4 -","- C9 H7 Fe I O4 -","- C36 H28 Fe4 I4 O16 -","4","1","","Scapens, David; Adams, Harry; Johnson, Tony R.; Mann, Brian E.; Sawle, Philip; Aqil, Rehan; Perrior, Trevor; Motterlini, Roberto","[(Eta-C5H4R)Fe(CO)2X], X = Cl, Br, I, NO3, CO2Me and [(eta-C5H4R)Fe(CO)3]+, R = (CH2)nCO2Me (n = 0-2), and CO2CH2CH2OH: a new group of CO-releasing molecules.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4962","4973","10.1039/b704832g","","","0.71073","MoKα","","0.053","0.0368","","","0.0924","0.1004","","","","","","1.001","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005718","7.037","0.002","8.134","0.002","19.058","0.006","90","","96.053","0.018","90","","1084.8","0.5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 Fe N O7 -","- C9 H7 Fe N O7 -","- C36 H28 Fe4 N4 O28 -","4","1","","Scapens, David; Adams, Harry; Johnson, Tony R.; Mann, Brian E.; Sawle, Philip; Aqil, Rehan; Perrior, Trevor; Motterlini, Roberto","[(Eta-C5H4R)Fe(CO)2X], X = Cl, Br, I, NO3, CO2Me and [(eta-C5H4R)Fe(CO)3]+, R = (CH2)nCO2Me (n = 0-2), and CO2CH2CH2OH: a new group of CO-releasing molecules.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4962","4973","10.1039/b704832g","","","0.71073","MoKα","","0.0396","0.036","","","0.1077","0.1131","","","","","","1.168","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005719","6.5711","0.0014","12.667","0.003","14.092","0.003","90","","97.571","0.004","90","","1162.7","0.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 Fe O6 -","- C11 H10 Fe O6 -","- C44 H40 Fe4 O24 -","4","1","","Scapens, David; Adams, Harry; Johnson, Tony R.; Mann, Brian E.; Sawle, Philip; Aqil, Rehan; Perrior, Trevor; Motterlini, Roberto","[(Eta-C5H4R)Fe(CO)2X], X = Cl, Br, I, NO3, CO2Me and [(eta-C5H4R)Fe(CO)3]+, R = (CH2)nCO2Me (n = 0-2), and CO2CH2CH2OH: a new group of CO-releasing molecules.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4962","4973","10.1039/b704832g","","","0.71073","MoKα","","0.0387","0.0299","","","0.0762","0.0802","","","","","","1.058","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005720","7.0283","0.0006","23.8","0.002","9.6737","0.0008","90","","90.931","0.004","90","","1617.9","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H7 Cl4 Fe2 O5 -","- C10 H7 Cl4 Fe2 O5 -","- C40 H28 Cl16 Fe8 O20 -","4","1","","Scapens, David; Adams, Harry; Johnson, Tony R.; Mann, Brian E.; Sawle, Philip; Aqil, Rehan; Perrior, Trevor; Motterlini, Roberto","[(Eta-C5H4R)Fe(CO)2X], X = Cl, Br, I, NO3, CO2Me and [(eta-C5H4R)Fe(CO)3]+, R = (CH2)nCO2Me (n = 0-2), and CO2CH2CH2OH: a new group of CO-releasing molecules.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4962","4973","10.1039/b704832g","","","0.71073","MoKα","","0.0203","0.0192","","","0.0528","0.0534","","","","","","1.061","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005721","6.525","0.003","6.757","0.003","10.099","0.005","87.774","0.008","86.467","0.008","73.748","0.007","426.5","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H14 Fe2 O8 -","- C18 H14 Fe2 O8 -","- C18 H14 Fe2 O8 -","1","0.5","","Scapens, David; Adams, Harry; Johnson, Tony R.; Mann, Brian E.; Sawle, Philip; Aqil, Rehan; Perrior, Trevor; Motterlini, Roberto","[(Eta-C5H4R)Fe(CO)2X], X = Cl, Br, I, NO3, CO2Me and [(eta-C5H4R)Fe(CO)3]+, R = (CH2)nCO2Me (n = 0-2), and CO2CH2CH2OH: a new group of CO-releasing molecules.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4962","4973","10.1039/b704832g","","","0.71073","MoKα","","0.0778","0.0677","","","0.1856","0.1893","","","","","","1.296","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005722","7.283","0.004","8.083","0.004","17.632","0.008","103.139","0.005","97.091","0.005","98.965","0.005","984.7","0.9","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H18 Fe2 O10 -","- C20 H18 Fe2 O10 -","- C40 H36 Fe4 O20 -","2","1","","Scapens, David; Adams, Harry; Johnson, Tony R.; Mann, Brian E.; Sawle, Philip; Aqil, Rehan; Perrior, Trevor; Motterlini, Roberto","[(Eta-C5H4R)Fe(CO)2X], X = Cl, Br, I, NO3, CO2Me and [(eta-C5H4R)Fe(CO)3]+, R = (CH2)nCO2Me (n = 0-2), and CO2CH2CH2OH: a new group of CO-releasing molecules.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4962","4973","10.1039/b704832g","","","0.71073","MoKα","","0.0255","0.0235","","","0.0595","0.0609","","","","","","1.064","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005723","6.6386","0.0008","12.6126","0.0016","13.5047","0.0017","67.996","0.002","83.392","0.002","77.062","0.002","1021.2","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H7 Cl Fe O4 -","- C9 H7 Cl Fe O4 -","- C36 H28 Cl4 Fe4 O16 -","4","2","","Scapens, David; Adams, Harry; Johnson, Tony R.; Mann, Brian E.; Sawle, Philip; Aqil, Rehan; Perrior, Trevor; Motterlini, Roberto","[(Eta-C5H4R)Fe(CO)2X], X = Cl, Br, I, NO3, CO2Me and [(eta-C5H4R)Fe(CO)3]+, R = (CH2)nCO2Me (n = 0-2), and CO2CH2CH2OH: a new group of CO-releasing molecules.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4962","4973","10.1039/b704832g","","","0.71073","MoKα","","0.0354","0.0277","","","0.0705","0.0732","","","","","","1.041","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005724","6.8607","0.0008","18.92","0.002","8.0278","0.0009","90","","90.881","0.007","90","","1041.9","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 Br Fe O4 -","- C9 H7 Br Fe O4 -","- C36 H28 Br4 Fe4 O16 -","4","1","","Scapens, David; Adams, Harry; Johnson, Tony R.; Mann, Brian E.; Sawle, Philip; Aqil, Rehan; Perrior, Trevor; Motterlini, Roberto","[(Eta-C5H4R)Fe(CO)2X], X = Cl, Br, I, NO3, CO2Me and [(eta-C5H4R)Fe(CO)3]+, R = (CH2)nCO2Me (n = 0-2), and CO2CH2CH2OH: a new group of CO-releasing molecules.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4962","4973","10.1039/b704832g","","","0.71073","MoKα","","0.0964","0.0562","","","0.1215","0.1381","","","","","","0.929","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005725","12.55","0.0007","13.5977","0.0007","24.671","0.0015","90","","97.102","0.012","90","","4177.8","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H38 F5 O4 P3 Pt -","- C45 H38 F5 O4 P3 Pt -","- C180 H152 F20 O16 P12 Pt4 -","4","1","","Díez, Alvaro; Forniés, Juan; Gómez, Julio; Lalinde, Elena; Martín, Antonio; Moreno, M. Teresa; Sánchez, Sergio","One-dimensional phosphinite platinum chains based on hydrogen bonding interactions and phosphinite tetranuclear platinum(II)-thallium(I) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3653","3660","10.1039/b704852a","","","0.71073","MoKα","","0.0543","0.0327","","","0.0848","0.0982","","","","","","1.05","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005726","12.126","0.002","12.9612","0.0018","15.926","0.002","97.277","0.017","108.073","0.017","112.454","0.016","2111.8","0.7","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C86 H80 Cl6 O6 P6 Pt2 Tl2 -","- C86 H80 Cl6 O6 P6 Pt2 Tl2 -","- C86 H80 Cl6 O6 P6 Pt2 Tl2 -","1","0.5","","Díez, Alvaro; Forniés, Juan; Gómez, Julio; Lalinde, Elena; Martín, Antonio; Moreno, M. Teresa; Sánchez, Sergio","One-dimensional phosphinite platinum chains based on hydrogen bonding interactions and phosphinite tetranuclear platinum(II)-thallium(I) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3653","3660","10.1039/b704852a","","","0.71073","MoKα","","0.0379","0.0279","","","0.0604","0.0637","","","","","","1.054","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005727","17.1175","0.0004","18.3866","0.0004","24.3578","0.0005","90","","90","","90","","7666.2","0.3","100","1","100","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","s63","","","- C42 H41 O3 P3 Pt -","- C42 H41 O3 P3 Pt -","- C336 H328 O24 P24 Pt8 -","8","1","","Díez, Alvaro; Forniés, Juan; Gómez, Julio; Lalinde, Elena; Martín, Antonio; Moreno, M. Teresa; Sánchez, Sergio","One-dimensional phosphinite platinum chains based on hydrogen bonding interactions and phosphinite tetranuclear platinum(II)-thallium(I) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3653","3660","10.1039/b704852a","","","0.71073","MoKα","","0.0992","0.0559","","","0.0707","0.0796","","","","","","1.093","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005728","8.182","0.0006","6.818","0.0003","12.445","0.0008","90","","104.171","0.003","90","","673.12","0.07","120","2","120","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C12 H8 Cl2 N2 O2 Os -","- C12 H8 Cl2 N2 O2 Os -","- C24 H16 Cl4 N4 O4 Os2 -","2","1","","Jakonen, Minna; Hirva, Pipsa; Haukka, Matti; Chardon-Noblat, Sylvie; Lafolet, Frédéric; Chauvin, Jérôme; Deronzier, Alain","An alternative synthesis method for [Os(NN)(CO)(2)X(2)] complexes (NN = 2,2'-bipyridine, 4,4'-dimethyl-2,2'-bipyridine; X = Cl, Br, I). Electrochemical and photochemical properties and behavior.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3314","3324","10.1039/b704931e","","","0.71073","MoKα","","0.0347","0.0307","","","0.0625","0.0634","","","","","","1.109","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005729","8.0674","0.0016","15.938","0.003","10.325","0.002","90","","101.2","0.03","90","","1302.3","0.5","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H8 Cl2 N2 O2 Os -","- C12 H8 Cl2 N2 O2 Os -","- C48 H32 Cl8 N8 O8 Os4 -","4","1","","Jakonen, Minna; Hirva, Pipsa; Haukka, Matti; Chardon-Noblat, Sylvie; Lafolet, Frédéric; Chauvin, Jérôme; Deronzier, Alain","An alternative synthesis method for [Os(NN)(CO)(2)X(2)] complexes (NN = 2,2'-bipyridine, 4,4'-dimethyl-2,2'-bipyridine; X = Cl, Br, I). Electrochemical and photochemical properties and behavior.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3314","3324","10.1039/b704931e","","","0.71073","MoKα","","0.0702","0.0339","","","0.0453","0.0514","","","","","","1.036","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005730","6.3432","0.0003","18.1482","0.0009","13.4114","0.0008","90","","101.766","0.003","90","","1511.45","0.14","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H12 Cl2 N2 O2 Os -","- C14 H12 Cl2 N2 O2 Os -","- C56 H48 Cl8 N8 O8 Os4 -","4","0.5","","Jakonen, Minna; Hirva, Pipsa; Haukka, Matti; Chardon-Noblat, Sylvie; Lafolet, Frédéric; Chauvin, Jérôme; Deronzier, Alain","An alternative synthesis method for [Os(NN)(CO)(2)X(2)] complexes (NN = 2,2'-bipyridine, 4,4'-dimethyl-2,2'-bipyridine; X = Cl, Br, I). Electrochemical and photochemical properties and behavior.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3314","3324","10.1039/b704931e","","","0.71073","MoKα","","0.0274","0.022","","","0.0439","0.0457","","","","","","1.043","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005731","8.2462","0.0004","6.9197","0.0002","12.6228","0.0004","90","","102.933","0.003","90","","702","0.05","120","2","120","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C12 H8 Br2 N2 O2 Os -","- C12 H8 Br2 N2 O2 Os -","- C24 H16 Br4 N4 O4 Os2 -","2","1","","Jakonen, Minna; Hirva, Pipsa; Haukka, Matti; Chardon-Noblat, Sylvie; Lafolet, Frédéric; Chauvin, Jérôme; Deronzier, Alain","An alternative synthesis method for [Os(NN)(CO)(2)X(2)] complexes (NN = 2,2'-bipyridine, 4,4'-dimethyl-2,2'-bipyridine; X = Cl, Br, I). Electrochemical and photochemical properties and behavior.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3314","3324","10.1039/b704931e","","","0.71073","MoKα","","0.031","0.0255","","","0.0442","0.0457","","","","","","0.922","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005732","8.417","0.0004","7.0934","0.0004","13.1254","0.0006","90","","101.737","0.004","90","","767.27","0.07","120","2","120","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C12 H8 I2 N2 O2 Os -","- C12 H8 I2 N2 O2 Os -","- C24 H16 I4 N4 O4 Os2 -","2","1","","Jakonen, Minna; Hirva, Pipsa; Haukka, Matti; Chardon-Noblat, Sylvie; Lafolet, Frédéric; Chauvin, Jérôme; Deronzier, Alain","An alternative synthesis method for [Os(NN)(CO)(2)X(2)] complexes (NN = 2,2'-bipyridine, 4,4'-dimethyl-2,2'-bipyridine; X = Cl, Br, I). Electrochemical and photochemical properties and behavior.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3314","3324","10.1039/b704931e","","","0.71073","MoKα","","0.0363","0.026","","","0.0386","0.0407","","","","","","0.835","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005733","10.5247","0.0016","10.5607","0.0016","15.696","0.002","80.483","0.003","80.585","0.003","88.619","0.003","1697.4","0.4","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C35 H30 N2 O8 Rh2 -","- C35 H30 N2 O8 Rh2 -","- C70 H60 N4 O16 Rh4 -","2","1","","Takamizawa, Satoshi; Kohbara, Masa-aki","Closed-pore crystal capable of adsorbing CO2 onto isolated cavities generated by disorderly mixing of substituents on host skeleton.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3640","3645","10.1039/b704977c","","","0.71073","MoKα","","0.0542","0.0391","","","0.0846","0.0974","","","","","","1.035","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005734","10.3271","0.001","10.4903","0.001","15.6507","0.0015","80.105","0.002","80.621","0.002","86.903","0.002","1647.4","0.3","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C35 H30 N2 O8 Rh2 -","- C35 H30 N2 O8 Rh2 -","- C70 H60 N4 O16 Rh4 -","2","1","","Takamizawa, Satoshi; Kohbara, Masa-aki","Closed-pore crystal capable of adsorbing CO2 onto isolated cavities generated by disorderly mixing of substituents on host skeleton.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3640","3645","10.1039/b704977c","","","0.71073","MoKα","","0.029","0.0252","","","0.0618","0.0681","","","","","","1.08","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005735","10.548","0.0007","10.5517","0.0008","15.6898","0.0011","80.607","0.002","80.563","0.002","88.756","0.002","1699.5","0.2","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C35 H30 N2 O8 Rh2 -","- C35 H30 N2 O8 Rh2 -","- C70 H60 N4 O16 Rh4 -","2","1","","Takamizawa, Satoshi; Kohbara, Masa-aki","Closed-pore crystal capable of adsorbing CO2 onto isolated cavities generated by disorderly mixing of substituents on host skeleton.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3640","3645","10.1039/b704977c","","","0.71073","MoKα","","0.0495","0.0337","","","0.072","0.0827","","","","","","1.022","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005736","10.3535","0.0008","10.4929","0.0008","15.6133","0.0012","80.184","0.002","80.752","0.002","87.085","0.001","1649.2","0.2","90","","90","","","","","","","","","5","P -1","-P 1","2","","","","- C35.11 H30 N2 O8.23 Rh2 -","- C35.111 H30 N2 O8.222 Rh2 -","- C70.222 H60 N4 O16.444 Rh4 -","2","1","","Takamizawa, Satoshi; Kohbara, Masa-aki","Closed-pore crystal capable of adsorbing CO2 onto isolated cavities generated by disorderly mixing of substituents on host skeleton.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3640","3645","10.1039/b704977c","","","0.71073","MoKα","","0.0394","0.0293","","","0.0676","0.0754","","","","","","1.032","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005737","12.454","0.0011","13.3645","0.0016","17.766","0.002","86.727","0.01","71.861","0.009","86.425","0.009","2802.4","0.5","180","","180","","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C28 H42 B Cl2 N Ru -","- C28 H42 B Cl2 N Ru -","- C112 H168 B4 Cl8 N4 Ru4 -","4","2","","Jérôme Vergnaud; Tahra Ayed; Khansaa Hussein; Laure Vendier; Mary Grellier; Ghenwa Bouhadir; Jean-Claude Barthelat; Sylviane Sabo-Etienne; Didier Bourissou","Synthesis, structure and coordination of the ambiphilic ligand (2-picolyl)BCy2","Dalton Transactions","2007","","23","2370","","10.1039/b704993p","","","","MoKα","","0.1292","0.0663","","","0.1613","0.1768","","","","","","0.882","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005738","14.2973","0.0008","10.1773","0.0005","21.9682","0.0011","90","","97.2812","0.0044","90","","3170.8","0.3","100","","100","","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H56 B2 N2 -","- C36 H56 B2 N2 -","- C144 H224 B8 N8 -","4","1","","Jérôme Vergnaud; Tahra Ayed; Khansaa Hussein; Laure Vendier; Mary Grellier; Ghenwa Bouhadir; Jean-Claude Barthelat; Sylviane Sabo-Etienne; Didier Bourissou","Synthesis, structure and coordination of the ambiphilic ligand (2-picolyl)BCy2","Dalton Transactions","2007","","23","2370","","10.1039/b704993p","","","","MoKα","","0.0843","0.061","","","0.1342","0.1453","","","","","","1.084","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005739","15.276","0.002","18.394","0.001","34.794","0.003","90","","90","","90","","9776.7","1.6","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C46 H51.5 Au Cl N8 O3.75 P4 -","- C46 H44 Au Cl N8 O3.75 P4 -","- C368 H352 Au8 Cl8 N64 O30 P32 -","8","2","","Humphreys, Anthony S.; Filipovska, Aleksandra; Berners-Price, Susan J; Koutsantonis, George A.; Skelton, Brian W.; White, Allan H.","Gold(I) chloride adducts of 1,3-bis(di-2-pyridylphosphino)propane: synthesis, structural studies and antitumour activity.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4943","4950","10.1039/b705008a","","","0.71073","MoKα","","0.0965","0.0571","","","0.134","0.1476","","","","","","1.046","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005740","13.4748","0.0009","13.4748","0.0009","53.133","0.003","90","","90","","90","","9647.4","1.1","150","2","100","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C44 H50 Au Cl N8 O5 P4 -","- C44 H50 Au Cl N8 O5 P4 -","- C352 H400 Au8 Cl8 N64 O40 P32 -","8","0.5","","Humphreys, Anthony S.; Filipovska, Aleksandra; Berners-Price, Susan J; Koutsantonis, George A.; Skelton, Brian W.; White, Allan H.","Gold(I) chloride adducts of 1,3-bis(di-2-pyridylphosphino)propane: synthesis, structural studies and antitumour activity.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4943","4950","10.1039/b705008a","","","0.71073","MoKα","","0.0456","0.0287","","","0.0848","0.0921","","","","","","1.118","","","","has coordinates","188980","2020-10-21","18:00:00",""
"7005741","9.189","0.006","11.499","0.007","12.259","0.008","95.62","0.04","103.85","0.03","92.06","0.03","1249.3","1.4","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H22 Au2 Cl2 N4 P2 -","- C23 H22 Au2 Cl2 N4 P2 -","- C46 H44 Au4 Cl4 N8 P4 -","2","1","","Humphreys, Anthony S.; Filipovska, Aleksandra; Berners-Price, Susan J; Koutsantonis, George A.; Skelton, Brian W.; White, Allan H.","Gold(I) chloride adducts of 1,3-bis(di-2-pyridylphosphino)propane: synthesis, structural studies and antitumour activity.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4943","4950","10.1039/b705008a","","","0.5594","synchrotron","","0.0551","0.0525","","","0.134","0.1354","","","","","","1.198","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005742","15.076","0.003","9.821","0.002","16.555","0.005","90","","111.21","0.03","90","","2285.1","1.1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H24 Mg1.5 N2 O8 -","- C20 H24 Mg1.5 N2 O8 -","- C80 H96 Mg6 N8 O32 -","4","1","","Davies, Robert P.; Less, Robert J.; Lickiss, Paul D.; White, Andrew J. P.","Framework materials assembled from magnesium carboxylate building units.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2528","2535","10.1039/b705028c","","","0.71073","MoKα","","0.1735","0.1157","","","0.2769","0.2895","","","","","","1.642","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005743","8.9778","0.0018","17.253","0.0019","9.873","0.002","90","","92.618","0.018","90","","1527.7","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 Mg1.5 O7 -","- C14 H12 Mg1.5 O7 -","- C56 H48 Mg6 O28 -","4","1","","Davies, Robert P.; Less, Robert J.; Lickiss, Paul D.; White, Andrew J. P.","Framework materials assembled from magnesium carboxylate building units.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2528","2535","10.1039/b705028c","","","0.71073","MoKα","","0.0853","0.0443","","","0.1049","0.114","","","","","","0.94","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005744","13.7835","0.0012","18.384","0.002","12.1948","0.0015","90","","113.96","0.01","90","","2823.8","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H30 Mg1.5 N2 O8 -","- C29 H30 Mg1.5 N2 O8 -","- C116 H120 Mg6 N8 O32 -","4","1","","Davies, Robert P.; Less, Robert J.; Lickiss, Paul D.; White, Andrew J. P.","Framework materials assembled from magnesium carboxylate building units.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2528","2535","10.1039/b705028c","","","0.71073","MoKα","","0.0551","0.0416","","","0.1178","0.1237","","","","","","1.084","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005745","16.5986","0.0019","16.5986","0.0019","43.035","0.007","90","","90","","120","","10268","2","173","2","173","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C18.33 H25 Mg N2.33 O8.33 -","- C18.36 H25.06 Mg N2.34 O8.34 -","- C330.48 H451.08 Mg18 N42.12 O150.12 -","18","0.5","","Davies, Robert P.; Less, Robert J.; Lickiss, Paul D.; White, Andrew J. P.","Framework materials assembled from magnesium carboxylate building units.","Dalton transactions (Cambridge, England : 2003)","2007","","24","2528","2535","10.1039/b705028c","","","1.54248","CuKα","","0.0543","0.0529","","","0.1432","0.1441","","","","","","1.069","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005746","13.81","0.0002","14.221","0.0002","16.192","0.0003","106.282","0.001","108.843","0.001","105.071","0.001","2665.09","0.08","123","1","123","1","","","","","","","","5","P -1","-P 1","2","mbn367","","","- C62 H43 F12 P2 Pt2 -","- C62 H43 F12 P2 Pt2 -","- C124 H86 F24 P4 Pt4 -","2","1","","Jesús R. Berenguer; María Bernechea; Elena Lalinde","C?H and P?C(Ph) activation competitive processes caused by interaction with the solvate [cis-Pt(C6F5)2(thf)2]","Dalton Transactions","2007","","23","2384","","10.1039/b705041k","","","0.71073","MoKα","","0.0505","0.0343","","","0.073","0.0786","","","","","","1.021","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005747","13.728","0.0003","14.5479","0.0003","16.4307","0.0004","67.721","0.001","87.877","0.001","64.424","0.001","2707.24","0.11","293","2","293","2","","","","","","","","7","P -1","-P 1","2","mbn138","","","- C54 H40 Cl3 F10 P2 Pt2 Si -","- C54 H40 Cl3 F10 P2 Pt2 Si -","- C108 H80 Cl6 F20 P4 Pt4 Si2 -","2","1","","Jesús R. Berenguer; María Bernechea; Elena Lalinde","C?H and P?C(Ph) activation competitive processes caused by interaction with the solvate [cis-Pt(C6F5)2(thf)2]","Dalton Transactions","2007","","23","2384","","10.1039/b705041k","","","0.71073","MoKα","","0.0748","0.0437","","","0.1059","0.1278","","","","","","1.011","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005748","7.2432","0.0002","8.8278","0.0002","9.6628","0.0002","81.368","0.006","84.698","0.006","74.897","0.006","588.84","0.03","173.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C28 H34 N4 -","- C28 H34 N4 -","- C28 H34 N4 -","1","0.5","","Mikata, Yuji; So, Haruka; Yamashita, Azusa; Kawamura, Ayano; Mikuriya, Masahiro; Fukui, Kôichi; Ichimura, Akio; Yano, Shigenobu","Quinoline-based tetradendate nitrogen ligands stabilize the bis(micro-oxo) dinuclear manganese(iii,iii) core.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3330","3334","10.1039/b705080a","","","0.7107","MoKα","","","0.039","","","","0.111","","","","","","1.055","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005749","12.9335","0.0004","12.9335","0.0004","32.623","0.0013","90","","90","","90","","5457","0.3","173.1","","","","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C54 H66 Cl2 Mn2 N10 O12 -","- C54 H66 Cl2 Mn2 N10 O12 -","- C216 H264 Cl8 Mn8 N40 O48 -","4","0.5","","Mikata, Yuji; So, Haruka; Yamashita, Azusa; Kawamura, Ayano; Mikuriya, Masahiro; Fukui, Kôichi; Ichimura, Akio; Yano, Shigenobu","Quinoline-based tetradendate nitrogen ligands stabilize the bis(micro-oxo) dinuclear manganese(iii,iii) core.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3330","3334","10.1039/b705080a","","","0.7107","MoKα","","","0.0503","","","","0.136","","","","","","1.122","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005750","16.018","0.006","21.574","0.007","17.179","0.006","90","","112.419","0.0011","90","","5488","3","173","2","173","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C52 H62 Cl2 Mn2 N8 O11 -","- C52 H60 Cl2 Mn2 N8 O11 -","- C208 H240 Cl8 Mn8 N32 O44 -","4","1","","Mikata, Yuji; So, Haruka; Yamashita, Azusa; Kawamura, Ayano; Mikuriya, Masahiro; Fukui, Kôichi; Ichimura, Akio; Yano, Shigenobu","Quinoline-based tetradendate nitrogen ligands stabilize the bis(micro-oxo) dinuclear manganese(iii,iii) core.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3330","3334","10.1039/b705080a","","","0.7107","MoKα","","0.0934","0.0827","","","0.2164","0.2285","","","","","","1.165","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005751","14.65","0.005","15.525","0.003","16.489","0.005","90","","108.71","0.02","90","","3552.1","1.8","293","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H31 As Fe N7 -","- C40 H28 As Fe N7 -","- C160 H112 As4 Fe4 N28 -","4","1","","Toma, Luminita Marilena; Lescouëzec, Rodrigue; Uriel, Santiago; Llusar, Rosa; Ruiz-Pérez, Catalina; Vaissermann, Jacqueline; Lloret, Francesc; Julve, Miguel","4,2-Ribbon like ferromagnetic cyano-bridged Fe(III)2Ni(II) chains: a magneto-structural study.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3690","3698","10.1039/b705084b","","","0.71069","MoKα","","0.1004","0.0431","","","0.1153","0.1322","","","","","","0.976","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005752","7.5343","0.0004","15.239","0.0009","14.7064","0.0009","90","","92.842","0.001","90","","1686.44","0.17","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H28 Fe2 N12 Ni O6 -","- C28 H28 Fe2 N12 Ni O6 -","- C56 H56 Fe4 N24 Ni2 O12 -","2","0.5","","Toma, Luminita Marilena; Lescouëzec, Rodrigue; Uriel, Santiago; Llusar, Rosa; Ruiz-Pérez, Catalina; Vaissermann, Jacqueline; Lloret, Francesc; Julve, Miguel","4,2-Ribbon like ferromagnetic cyano-bridged Fe(III)2Ni(II) chains: a magneto-structural study.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3690","3698","10.1039/b705084b","","","0.71073","MoKα","","0.0578","0.0346","","","0.0702","0.0756","","","","","","0.96","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005753","7.3716","0.0006","15.615","0.0011","15.2953","0.0006","90","","93.457","0.005","90","","1757.4","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H28 Fe2 N12 Ni O6 -","- C32 H16 Fe2 N12 Ni O6 -","- C64 H32 Fe4 N24 Ni2 O12 -","2","0.5","","Toma, Luminita Marilena; Lescouëzec, Rodrigue; Uriel, Santiago; Llusar, Rosa; Ruiz-Pérez, Catalina; Vaissermann, Jacqueline; Lloret, Francesc; Julve, Miguel","4,2-Ribbon like ferromagnetic cyano-bridged Fe(III)2Ni(II) chains: a magneto-structural study.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3690","3698","10.1039/b705084b","","x-ray","0.71073","Mokα","","0.0957","0.0531","","","0.0994","0.1142","","","","","","1.069","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005754","16.7287","0.0002","13.7692","0.0002","20.6788","0.0003","90","","90","","90","","4763.17","0.11","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","6","P b c a","-P 2ac 2ab","61","","","","- C17 H27 N7 O3 S3 Zn -","- C17 H27 N7 O3 S3 Zn -","- C136 H216 N56 O24 S24 Zn8 -","8","1","","Christlieb, Martin; Struthers, Harriet S. R.; Bonnitcha, Paul D.; Cowley, Andrew R.; Dilworth, Jonathan R.","The exocyclic functionalisation of bis(thiosemicarbazonate) complexes of zinc and copper: the synthesis of monomeric and dimeric species.","Dalton transactions (Cambridge, England : 2003)","2007","","43","5043","5054","10.1039/b705087a","","","0.71073","MoKα","","0.0661","0.0406","","0.0713","0.0471","0.0471","","","","","","1.0465","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005755","7.513","","18.803","","8.653","","90","","99.12","","90","","1206.93","","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C7 H16 B9 N -","- C7 H16 B9 N -","- C28 H64 B36 N4 -","4","1","","Viñas, Clara; Laromaine, Anna; Teixidor, Francesc; Horáková, Hana; Langauf, Ales; Vespalec, Radim; Mata, Ignasi; Molins, Elies","Synthesis and investigation of the boron cluster anion [7-(2'-pyridyl)-7,8-nido-dicarbaundecaborate] and its protonated form.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3369","3377","10.1039/b705160c","","","0.71073","MoKα","","0.1419","0.0505","","","0.1159","0.1381","","","","","","1.043","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005756","11.664","0.005","14.087","0.005","15.255","0.005","73.545","0.005","70.608","0.005","78.101","0.005","2250","1.5","123","2","123","2","","","","","","","synthesis as described","7","P -1","-P 1","2","NaTm from DMF/Et2O","","","- C27 H52 B2 N13 Na2 O7.5 S6 -","- C27 H51 B2 N13 Na2 O7.5 S6 -","- C54 H102 B4 N26 Na4 O15 S12 -","2","1","","Biernat, Anne; Schwalbe, Matthias; Wallace, Dawn; Reglinski, John; Spicer, Mark D.","The first bona-fide sodium complex of hydrotris(methimazolyl)borate: an example of sodium exhibiting a preference for sulfur over oxygen.","Dalton transactions (Cambridge, England : 2003)","2007","","22","2242","2244","10.1039/b705161c","","x-ray","0.71069","MoKα","","0.0485","0.0336","","","0.0873","0.093","","","","","","1.033","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005757","7.2132","0.0002","8.9996","0.0003","10.936","0.0004","71.2063","0.0016","81.2558","0.0017","81.4946","0.0018","660.54","0.04","293","","293","","","","","","","","synthesis as described","5","P 1","P 1","1","(Co(N-acetyl-(-)-ephedrine)!2$).2H!2$O","[Co(N-acetyl-(-)-ephedrine)~2~].2H~2~O","","- C24 H36 Co N2 O8 -","- C24 H36 Co N2 O8 -","- C24 H36 Co N2 O8 -","1","1","","Vargas-Díaz, Gabriela; López-Sandoval, Horacio; Vázquez-Palma, Adriana B.; Flores-Alamo, Marcos; Peña-Hueso, Adrián; Sánchez-Ruíz, Sonia A.; Flores-Parra, Angelina; Contreras, Rosalinda; Barba-Behrens, Norah","Stereochemistry of optically active nickel(ii) and cobalt(ii) coordination compounds derived from N-acetyl aminoalcohols","Dalton Transactions","2007","","37","4185","","10.1039/b705195f","","x-ray","0.71073","MoKα","","0.0346","0.0306","","0.0446","0.0369","0.0369","","","","","","1.0848","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005758","17.44","0.006","17.44","0.006","7.085","0.003","90","","90","","120","","1866.2","1.2","293","","293","","","","","","","","","5","P 3","P 3","143","(Co(N-acetyl-(+)-pseudoephedrine)!2$).2H!2$O","[Co(N-acetyl-(+)-pseudoephedrine)~2~].2H~2~O","","- C24 H36 Co N2 O8 -","- C24 H36 Co N2 O8 -","- C72 H108 Co3 N6 O24 -","3","1","","Vargas-Díaz, Gabriela; López-Sandoval, Horacio; Vázquez-Palma, Adriana B.; Flores-Alamo, Marcos; Peña-Hueso, Adrián; Sánchez-Ruíz, Sonia A.; Flores-Parra, Angelina; Contreras, Rosalinda; Barba-Behrens, Norah","Stereochemistry of optically active nickel(ii) and cobalt(ii) coordination compounds derived from N-acetyl aminoalcohols","Dalton Transactions","2007","","37","4185","","10.1039/b705195f","","","0.71073","MoKα","","0.0598","0.0339","","0.0498","0.038","0.038","","","","","","1.091","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005759","7.3617","0.0002","7.3785","0.0002","11.3521","0.0003","84.928","0.0013","75.9946","0.0014","84.7652","0.0012","594.4","0.03","293","","293","","","","","","","","synthesis as described","5","P 1","P 1","1","(Co(N-(-)-acetyl-phenylephrine)!2$).2H!2$O","[Co(N-(-)-acetyl-phenylephrine)~2~].2H~2~O","","- C22 H32 Co N2 O10 -","- C22 H32 Co N2 O10 -","- C22 H32 Co N2 O10 -","1","1","","Vargas-Díaz, Gabriela; López-Sandoval, Horacio; Vázquez-Palma, Adriana B.; Flores-Alamo, Marcos; Peña-Hueso, Adrián; Sánchez-Ruíz, Sonia A.; Flores-Parra, Angelina; Contreras, Rosalinda; Barba-Behrens, Norah","Stereochemistry of optically active nickel(ii) and cobalt(ii) coordination compounds derived from N-acetyl aminoalcohols","Dalton Transactions","2007","","37","4185","","10.1039/b705195f","","x-ray","0.7107","MoKα","","0.0539","0.0361","","0.0596","0.0402","0.0402","","","","","","1.0054","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005760","8.6971","0.0002","26.2558","0.0008","10.6396","0.0003","90","","90","","90","","2429.55","0.12","293","","293","","","","","","","","synthesis as described","5","C 2 c b","C -2ac 2","41","Compound X","[Co(N-acetyl-(+)-ephedrine)~2~]","","- C24 H32 Co N2 O6 -","- C24 H32 Co N2 O6 -","- C96 H128 Co4 N8 O24 -","4","","","Vargas-Díaz, Gabriela; López-Sandoval, Horacio; Vázquez-Palma, Adriana B.; Flores-Alamo, Marcos; Peña-Hueso, Adrián; Sánchez-Ruíz, Sonia A.; Flores-Parra, Angelina; Contreras, Rosalinda; Barba-Behrens, Norah","Stereochemistry of optically active nickel(ii) and cobalt(ii) coordination compounds derived from N-acetyl aminoalcohols","Dalton Transactions","2007","","37","4185","","10.1039/b705195f","","x-ray","0.7107","MoKα","","0.0579","0.0308","","0.2346","0.0379","0.0379","","","","","","1.0262","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005761","7.251","0.0002","8.9808","0.0003","10.9121","0.0004","70.355","0.0015","81.6001","0.0014","81.6535","0.0014","658.53","0.04","293","","293","","","","","","","","synthesis as described","5","P 1","P 1","1","(Ni(N-acetyl-(+)-ephedrine)!2$).2H!2$O","[Ni(N-acetyl-(+)-ephedrine)~2~].2H~2~O","","- C24 H36 N2 Ni O8 -","- C24 H36 N2 Ni O8 -","- C24 H36 N2 Ni O8 -","1","1","","Vargas-Díaz, Gabriela; López-Sandoval, Horacio; Vázquez-Palma, Adriana B.; Flores-Alamo, Marcos; Peña-Hueso, Adrián; Sánchez-Ruíz, Sonia A.; Flores-Parra, Angelina; Contreras, Rosalinda; Barba-Behrens, Norah","Stereochemistry of optically active nickel(ii) and cobalt(ii) coordination compounds derived from N-acetyl aminoalcohols","Dalton Transactions","2007","","37","4185","","10.1039/b705195f","","x-ray","0.71073","MoKα","","0.0527","0.0462","","0.0672","0.0562","0.0562","","","","","","1.0838","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005762","7.2261","0.0003","8.9289","0.0003","10.9475","0.0004","70.6653","0.0016","81.6681","0.0014","82.4279","0.0017","656.81","0.04","293","","293","","","","","","","","synthesis as described","5","P 1","P 1","1","(Ni(N-acetyl-(-)-ephedrine)!2$).2H!2$O","[Ni(N-acetyl-(-)-ephedrine)~2~].2H~2~O","","- C24 H36 N2 Ni O8 -","- C24 H36 N2 Ni O8 -","- C24 H36 N2 Ni O8 -","1","1","","Vargas-Díaz, Gabriela; López-Sandoval, Horacio; Vázquez-Palma, Adriana B.; Flores-Alamo, Marcos; Peña-Hueso, Adrián; Sánchez-Ruíz, Sonia A.; Flores-Parra, Angelina; Contreras, Rosalinda; Barba-Behrens, Norah","Stereochemistry of optically active nickel(ii) and cobalt(ii) coordination compounds derived from N-acetyl aminoalcohols","Dalton Transactions","2007","","37","4185","","10.1039/b705195f","","x-ray","0.7107","MoKα","","0.051","0.0367","","0.07","0.0414","0.0414","","","","","","1.0612","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005763","17.611","0.012","17.611","0.012","7.158","0.006","90","","90","","120","","1923","2","293","","293","","","","","","","","","5","P 3","P 3","143","(Ni(N-acetyl-(+)-pseudoephedrine)!2$).2H!2$O","[Ni(N-acetyl-(+)-pseudoephedrine)~2~].2H~2~O","","- C24 H36 N2 Ni O8 -","- C24 H36 N2 Ni O8 -","- C72 H108 N6 Ni3 O24 -","3","1","","Vargas-Díaz, Gabriela; López-Sandoval, Horacio; Vázquez-Palma, Adriana B.; Flores-Alamo, Marcos; Peña-Hueso, Adrián; Sánchez-Ruíz, Sonia A.; Flores-Parra, Angelina; Contreras, Rosalinda; Barba-Behrens, Norah","Stereochemistry of optically active nickel(ii) and cobalt(ii) coordination compounds derived from N-acetyl aminoalcohols","Dalton Transactions","2007","","37","4185","","10.1039/b705195f","","","0.71073","MoKα","","0.0738","0.031","","0.0607","0.0346","0.0346","","","","","","1.0815","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005764","7.369","0.002","7.37","0.0019","11.279","0.003","76.023","0.014","85.64","0.02","84.945","0.018","591.2","0.3","293","","293","","","","","","","","","5","P 1","P 1","1","","[Ni(N-(-)-acetyl-phenylephrine)~2~].2H~2~O","","- C22 H32 N2 Ni O10 -","- C22 H32 N2 Ni O10 -","- C22 H32 N2 Ni O10 -","1","1","","Vargas-Díaz, Gabriela; López-Sandoval, Horacio; Vázquez-Palma, Adriana B.; Flores-Alamo, Marcos; Peña-Hueso, Adrián; Sánchez-Ruíz, Sonia A.; Flores-Parra, Angelina; Contreras, Rosalinda; Barba-Behrens, Norah","Stereochemistry of optically active nickel(ii) and cobalt(ii) coordination compounds derived from N-acetyl aminoalcohols","Dalton Transactions","2007","","37","4185","","10.1039/b705195f","","","0.7107","MoKα","","0.0312","0.0304","","0.0429","0.0413","0.0413","","","","","","1.0076","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005765","11.7263","0.0011","28.622","0.003","12.2079","0.0013","90","","96.464","0.005","90","","4071.3","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Fe(SBH(OMe)3)2]NO3 - pentanes","","","- C39 H34 Fe N5 O13 -","- C39 H34 Fe N5 O13 -","- C156 H136 Fe4 N20 O52 -","4","1","","Charkoudian, Louise K.; Pham, David M.; Kwon, Ashley M.; Vangeloff, Abbey D.; Franz, Katherine J.","Modifications of boronic ester pro-chelators triggered by hydrogen peroxide tune reactivity to inhibit metal-promoted oxidative stress.","Dalton transactions (Cambridge, England : 2003)","2007","","43","5031","5042","10.1039/b705199a","","","0.71073","MoKα","","0.1673","0.0731","","","0.2157","0.2733","","","","","","0.984","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005766","11.4645","0.0009","13.6942","0.0011","8.5467","0.0008","90","","92.025","0.004","90","","1341","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","SBH(m-OMe)","","","- C15 H14 N2 O3 -","- C15 H14 N2 O3 -","- C60 H56 N8 O12 -","4","1","","Charkoudian, Louise K.; Pham, David M.; Kwon, Ashley M.; Vangeloff, Abbey D.; Franz, Katherine J.","Modifications of boronic ester pro-chelators triggered by hydrogen peroxide tune reactivity to inhibit metal-promoted oxidative stress.","Dalton transactions (Cambridge, England : 2003)","2007","","43","5031","5042","10.1039/b705199a","","","0.71073","MoKα","","0.0627","0.0415","","","0.105","0.1122","","","","","","1.108","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005767","17.8735","0.0016","12.7925","0.001","9.0933","0.0009","90","","90","","90","","2079.2","0.3","298","2","298","2","","","","","","","","5","P c a 21","P 2c -2ac","29","BSBH(m-OMe)","","","- C21 H25 B N2 O4 -","- C21 H25 B N2 O4 -","- C84 H100 B4 N8 O16 -","4","1","","Charkoudian, Louise K.; Pham, David M.; Kwon, Ashley M.; Vangeloff, Abbey D.; Franz, Katherine J.","Modifications of boronic ester pro-chelators triggered by hydrogen peroxide tune reactivity to inhibit metal-promoted oxidative stress.","Dalton transactions (Cambridge, England : 2003)","2007","","43","5031","5042","10.1039/b705199a","","","0.71073","MoKα","","0.0666","0.0427","","","0.1057","0.1185","","","","","","1.014","","","","has coordinates,has disorder","202017","2020-10-21","18:00:00",""
"7005768","11.5979","0.0003","14.0704","0.0003","9.4947","0.0003","90","","110.133","0.001","90","","1454.74","0.07","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","SBH(m-OEt)","","","- C16 H16 N2 O3 -","- C16 H16 N2 O3 -","- C64 H64 N8 O12 -","4","1","","Charkoudian, Louise K.; Pham, David M.; Kwon, Ashley M.; Vangeloff, Abbey D.; Franz, Katherine J.","Modifications of boronic ester pro-chelators triggered by hydrogen peroxide tune reactivity to inhibit metal-promoted oxidative stress.","Dalton transactions (Cambridge, England : 2003)","2007","","43","5031","5042","10.1039/b705199a","","","0.71073","MoKα","","0.0635","0.0392","","","0.1005","0.1081","","","","","","0.983","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005769","18.293","0.007","8.639","0.003","29.494","0.01","90","","100.504","0.005","90","","4583","3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[BSBH(m-OEt)]2 - H2O","","","- C44 H56 B2 N4 O9 -","- C44 H56 B2 N4 O9 -","- C176 H224 B8 N16 O36 -","4","1","","Charkoudian, Louise K.; Pham, David M.; Kwon, Ashley M.; Vangeloff, Abbey D.; Franz, Katherine J.","Modifications of boronic ester pro-chelators triggered by hydrogen peroxide tune reactivity to inhibit metal-promoted oxidative stress.","Dalton transactions (Cambridge, England : 2003)","2007","","43","5031","5042","10.1039/b705199a","","","0.71073","MoKα","","0.1576","0.0828","","","0.2349","0.2631","","","","","","1.074","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005770","14.787","0.007","13.198","0.006","8.225","0.002","90","","101.262","0.005","90","","1574.3","1.1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","SBH(OMe)3","","","- C17 H18 N2 O5 -","- C17 H18 N2 O5 -","- C68 H72 N8 O20 -","4","1","","Charkoudian, Louise K.; Pham, David M.; Kwon, Ashley M.; Vangeloff, Abbey D.; Franz, Katherine J.","Modifications of boronic ester pro-chelators triggered by hydrogen peroxide tune reactivity to inhibit metal-promoted oxidative stress.","Dalton transactions (Cambridge, England : 2003)","2007","","43","5031","5042","10.1039/b705199a","","","0.71073","MoKα","","0.1105","0.05","","","0.095","0.1092","","","","","","0.914","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005771","12.0078","0.0006","12.9849","0.0012","13.8084","0.0012","64.962","0.003","69.1","0.005","73.2","0.005","1797.9","0.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H106 Bi2 Br4 N4 O4 -","- C66 H106 Bi2 Br4 N4 O4 -","- C66 H106 Bi2 Br4 N4 O4 -","1","0.5","","Brym, Markus; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.; Rose, Richard P.; Stasch, Andreas; Turner, David R.","Ligand effects in the syntheses and structures of novel heteroleptic and homoleptic bismuth(III) formamidinate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3282","3288","10.1039/b705202b","","","0.71073","MoKα","","0.0868","0.0666","","","0.153","0.1636","","","","","","1.023","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005772","14.599","0.003","10.93","0.002","14.697","0.003","90","","93.6","0.03","90","","2340.5","0.8","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H54 Bi2 Br4 N4 O2 -","- C42 H54 Bi2 Br4 N4 O2 -","- C84 H108 Bi4 Br8 N8 O4 -","2","0.5","","Brym, Markus; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.; Rose, Richard P.; Stasch, Andreas; Turner, David R.","Ligand effects in the syntheses and structures of novel heteroleptic and homoleptic bismuth(III) formamidinate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3282","3288","10.1039/b705202b","","","0.71073","MoKα","","0.0818","0.0541","","","0.1212","0.1335","","","","","","0.982","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005773","20.719","0.004","7.7269","0.0015","24.432","0.005","90","","90","","90","","3911.4","1.3","123","2","123","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C42 H54 Bi Br N4 O2 -","- C42 H54 Bi Br N4 O2 -","- C168 H216 Bi4 Br4 N16 O8 -","4","1","","Brym, Markus; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.; Rose, Richard P.; Stasch, Andreas; Turner, David R.","Ligand effects in the syntheses and structures of novel heteroleptic and homoleptic bismuth(III) formamidinate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3282","3288","10.1039/b705202b","","","0.71073","MoKα","","0.0685","0.0606","","","0.1509","0.1584","","","","","","1.034","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005774","13.8771","0.0002","18.1526","0.0003","19.576","0.0003","84.116","0.001","70.507","0.001","67.968","0.001","4307.73","0.12","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C104 H86 Bi2 Br2 N8 O -","- C104 H86 Bi2 Br2 N8 O -","- C208 H172 Bi4 Br4 N16 O2 -","2","1","","Brym, Markus; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.; Rose, Richard P.; Stasch, Andreas; Turner, David R.","Ligand effects in the syntheses and structures of novel heteroleptic and homoleptic bismuth(III) formamidinate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3282","3288","10.1039/b705202b","","","0.71073","MoKα","","0.0674","0.0382","","","0.0757","0.0842","","","","","","0.978","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005775","14.505","0.003","38.248","0.008","22.094","0.004","90","","108.64","0.03","90","","11615","5","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C130 H172 Bi2 N12 O -","- C130 H172 Bi2 N12 O -","- C520 H688 Bi8 N48 O4 -","4","1","","Brym, Markus; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.; Rose, Richard P.; Stasch, Andreas; Turner, David R.","Ligand effects in the syntheses and structures of novel heteroleptic and homoleptic bismuth(III) formamidinate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3282","3288","10.1039/b705202b","","","0.71073","MoKα","","0.0839","0.0473","","","0.078","0.0873","","","","","","0.995","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005776","25.183","0.0002","12.6656","0.0002","16.4914","0.0004","90","","104.166","0.001","90","","5100.11","0.15","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C57 H69 Bi N6 -","- C57 H69 Bi N6 -","- C228 H276 Bi4 N24 -","4","1","","Brym, Markus; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.; Rose, Richard P.; Stasch, Andreas; Turner, David R.","Ligand effects in the syntheses and structures of novel heteroleptic and homoleptic bismuth(III) formamidinate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3282","3288","10.1039/b705202b","","","0.71073","MoKα","","0.0471","0.034","","","0.0826","0.0879","","","","","","1.031","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005777","10.6257","0.0002","34.5254","0.0009","14.719","0.0004","90","","109.626","0.001","90","","5086.1","0.2","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C54 H79 Bi N4 -","- C54 H79 Bi N4 -","- C216 H316 Bi4 N16 -","4","1","","Brym, Markus; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.; Rose, Richard P.; Stasch, Andreas; Turner, David R.","Ligand effects in the syntheses and structures of novel heteroleptic and homoleptic bismuth(III) formamidinate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3282","3288","10.1039/b705202b","","","0.71073","MoKα","","0.1979","0.0699","","","0.0888","0.118","","","","","","0.937","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005778","46.047","0.009","16.728","0.003","28.311","0.006","90","","112.74","0.03","90","","20112","8","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C97 H137 Bi3 Cl6 N6 O2 -","- C97 H137 Bi3 Cl6 N6 O2 -","- C776 H1096 Bi24 Cl48 N48 O16 -","8","1","","Brym, Markus; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.; Rose, Richard P.; Stasch, Andreas; Turner, David R.","Ligand effects in the syntheses and structures of novel heteroleptic and homoleptic bismuth(III) formamidinate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3282","3288","10.1039/b705202b","","","0.71073","MoKα","","0.0805","0.0434","","","0.0923","0.1047","","","","","","1.002","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005779","12.59","0.0002","10.0842","0.0002","14.5569","0.0002","90","0.001","110.319","0.001","90","0.001","1733.14","0.05","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(Re(CO)3(NH2CH2CH(pz)2))Br","","","- C12 H15 Br N5 O4 Re -","- C12 H15 Br N5 O4 Re -","- C48 H60 Br4 N20 O16 Re4 -","4","1","","Maria, Leonor; Cunha, Susana; Videira, Margarida; Gano, Lurdes; Paulo, António; Santos, Isabel C.; Santos, Isabel","Rhenium and technetium tricarbonyl complexes anchored by pyrazole-based tripods: novel lead structures for the design of myocardial imaging agents.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3010","3019","10.1039/b705226j","","","0.71069","MoKα","","0.0413","0.0345","","","0.0902","0.0938","","","","","","1.07","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005780","11.376","0.005","20.119","0.005","23.566","0.005","90","0.005","90","0.005","90","0.005","5394","3","293","2","293","2","","","","","","","","7","P b n b","-P 2bc 2ab","56","[Re(CO)3{MeOCH2C(pz)3}]Br (2)","","","- C15 H14 Br Cl0 N6 O4 Re -","- C17 H11 Br N6 O5.67 Re -","- C136 H88 Br8 N48 O45.36 Re8 -","8","1","","Maria, Leonor; Cunha, Susana; Videira, Margarida; Gano, Lurdes; Paulo, António; Santos, Isabel C.; Santos, Isabel","Rhenium and technetium tricarbonyl complexes anchored by pyrazole-based tripods: novel lead structures for the design of myocardial imaging agents.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3010","3019","10.1039/b705226j","","","0.71069","MoKα","","0.2386","0.096","","","0.2431","0.2973","","","","","","0.874","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005781","8.4135","0.0002","18.9038","0.0005","12.3095","0.0003","90","","95.7293","0.0012","90","","1948.01","0.08","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 N6 Ni S2 -","- C20 H18 N6 Ni S2 -","- C80 H72 N24 Ni4 S8 -","4","1","","Pascu, Sofia I.; Waghorn, Philip A.; Conry, Timothy D.; Betts, Helen M.; Dilworth, Jonathan R.; Churchill, Grant C.; Pokrovska, Tzveta; Christlieb, Martin; Aigbirhio, Franklin I.; Warren, John E.","Designing Zn(II) and Cu(II) derivatives as probes for in vitro fluorescence imaging.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4988","4997","10.1039/b705227h","","","0.71073","MoKα","","0.0579","0.0306","","0.0567","0.0364","0.0364","","","","","","1.1304","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005782","13.752","0.001","15.1762","0.0011","15.7383","0.0011","82.309","0.001","74.408","0.001","68.634","0.001","2944","0.4","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C58 H72 N16 O1.5 S4 Zn2 -","- C58 H72 N16 O1.5 S4 Zn2 -","- C116 H144 N32 O3 S8 Zn4 -","2","1","","Pascu, Sofia I.; Waghorn, Philip A.; Conry, Timothy D.; Betts, Helen M.; Dilworth, Jonathan R.; Churchill, Grant C.; Pokrovska, Tzveta; Christlieb, Martin; Aigbirhio, Franklin I.; Warren, John E.","Designing Zn(II) and Cu(II) derivatives as probes for in vitro fluorescence imaging.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4988","4997","10.1039/b705227h","","","0.6709","synchrotron","","0.1018","0.0627","","0.0853","0.0714","0.0714","","","","","","1.0479","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005783","8.3511","0.0007","18.9737","0.0015","12.4187","0.001","90","","97.109","0.001","90","","1952.6","0.3","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 Cu N6 S2 -","- C20 H17.4 Cu N6 S2 -","- C80 H69.6 Cu4 N24 S8 -","4","1","","Pascu, Sofia I.; Waghorn, Philip A.; Conry, Timothy D.; Betts, Helen M.; Dilworth, Jonathan R.; Churchill, Grant C.; Pokrovska, Tzveta; Christlieb, Martin; Aigbirhio, Franklin I.; Warren, John E.","Designing Zn(II) and Cu(II) derivatives as probes for in vitro fluorescence imaging.","Dalton transactions (Cambridge, England : 2003)","2007","","43","4988","4997","10.1039/b705227h","","","0.6709","synchrotron","","0.0507","0.0392","","0.0527","0.0449","0.0449","","","","","","1.1023","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005784","13.3102","0.0007","13.3102","0.0007","19.1593","0.0019","90","","90","","120","","2939.5","0.4","100","2","100","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","","","- C34 H66 Cl2 P2 Pd -","- C34 H66 Cl2 P2 Pd -","- C102 H198 Cl6 P6 Pd3 -","3","0.5","","Muñoz, Bianca K; Godard, Cyril; Marinetti, Angela; Ruiz, Aurora; Benet-Buchholz, Jordi; Claver, Carmen","Pd-catalysed methoxycarbonylation of vinylarenes using chiral monodentate phosphetanes and phospholane as ligands. Effect of substrate substituents on enantioselectivity.","Dalton transactions (Cambridge, England : 2003)","2007","","47","5524","5530","10.1039/b705230h","","","0.71073","MoKα","","0.0809","0.0745","","","0.1582","0.1618","","","","","","1.169","","","","has coordinates,has disorder","179761","2020-10-21","18:00:00",""
"7005785","16.7477","0.0009","16.8248","0.0009","43.026","0.002","90","","90","","90","","12123.7","1.1","93","2","93","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C30 H47 N2 P3 -","- C30 H47 N2 P3 -","- C480 H752 N32 P48 -","16","2","","Kilian, Petr; Slawin, Alexandra M. Z.","1,8,9-Substituted anthracenes, intramolecular phosphine donor stabilized metaphosphonate and phosphenium.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3289","3296","10.1039/b705286c","","","0.71073","MoKα","","0.1082","0.0871","","","0.1643","0.1742","","","","","","1.179","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005786","14.671","0.011","12.549","0.008","13.131","0.01","90","","102.265","0.01","90","","2362","3","93","2","93","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C26 H36 P2 -","- C26 H36 P2 -","- C104 H144 P8 -","4","1","","Kilian, Petr; Slawin, Alexandra M. Z.","1,8,9-Substituted anthracenes, intramolecular phosphine donor stabilized metaphosphonate and phosphenium.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3289","3296","10.1039/b705286c","","","0.71073","MoKα","","0.0664","0.0508","","","0.1226","0.1336","","","","","","1.041","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005787","8.495","0.003","11.789","0.004","15.095","0.004","97.217","0.005","91.854","0.007","108.6","0.011","1417.2","0.8","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H37 Cl O P3 S2 -","- C27 H37 Cl O P3 S2 -","- C54 H74 Cl2 O2 P6 S4 -","2","1","","Kilian, Petr; Slawin, Alexandra M. Z.","1,8,9-Substituted anthracenes, intramolecular phosphine donor stabilized metaphosphonate and phosphenium.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3289","3296","10.1039/b705286c","","","0.71073","MoKα","","0.0356","0.0319","","","0.0853","0.0877","","","","","","1.067","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005788","8.8828","0.0014","21.658","0.003","14.892","0.002","90","","106.566","0.004","90","","2746.1","0.7","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H35 O P3 Se2 -","- C26 H35 O P3 Se2 -","- C104 H140 O4 P12 Se8 -","4","1","","Kilian, Petr; Slawin, Alexandra M. Z.","1,8,9-Substituted anthracenes, intramolecular phosphine donor stabilized metaphosphonate and phosphenium.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3289","3296","10.1039/b705286c","","","0.71073","MoKα","","0.0334","0.0301","","","0.0721","0.0741","","","","","","1.048","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005789","11.026","0.002","11.026","0.002","25.56","0.004","90","","90","","90","","3107.4","0.9","93","2","93","2","","","","","","","","5","P 43","P 4cw","78","","","","- C26 H35 Cl I3 P3 -","- C26 H35 Cl I3 P3 -","- C104 H140 Cl4 I12 P12 -","4","1","","Kilian, Petr; Slawin, Alexandra M. Z.","1,8,9-Substituted anthracenes, intramolecular phosphine donor stabilized metaphosphonate and phosphenium.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3289","3296","10.1039/b705286c","","","0.71073","MoKα","","0.0602","0.0573","","","0.1425","0.1439","","","","","","1.078","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005790","9.676","0.0011","14.2953","0.0019","27.072","0.004","88.847","0.009","86.999","0.009","84.992","0.007","3724.8","0.9","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H116 Eu2 N4 O5 -","- C72 H116 Eu2 N4 O5 -","- C144 H232 Eu4 N8 O10 -","2","1","","Guo, Huadong; Zhou, Hui; Yao, Yingming; Zhang, Yong; Shen, Qi","Synthesis and structural characterization of novel mixed-valent samarium and divalent ytterbium and europium complexes supported by amine bis(phenolate) ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3555","3561","10.1039/b705353c","","","0.7107","MoKα","","0.1171","0.0867","","","0.1894","0.2103","","","","","","1.106","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005791","14.9171","0.0004","20.2284","0.0003","30.2896","0.0006","108.104","0.009","95.546","0.01","104.692","0.013","8248.9","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C150.5 H232 N4 O9 Sm3 -","- C150.5 H231.5 N4 O9 Sm3 -","- C301 H463 N8 O18 Sm6 -","2","1","","Guo, Huadong; Zhou, Hui; Yao, Yingming; Zhang, Yong; Shen, Qi","Synthesis and structural characterization of novel mixed-valent samarium and divalent ytterbium and europium complexes supported by amine bis(phenolate) ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3555","3561","10.1039/b705353c","","","0.7107","MoKα","","0.1184","0.0904","","","0.2139","0.2294","","","","","","1.142","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005792","10.601","0.0007","16.5373","0.0011","29.2953","0.0019","90","","98.501","0.002","90","","5079.4","0.6","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H85 N O6 Yb -","- C50 H85 N O6 Yb -","- C200 H340 N4 O24 Yb4 -","4","1","","Guo, Huadong; Zhou, Hui; Yao, Yingming; Zhang, Yong; Shen, Qi","Synthesis and structural characterization of novel mixed-valent samarium and divalent ytterbium and europium complexes supported by amine bis(phenolate) ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3555","3561","10.1039/b705353c","","","0.7107","MoKα","","0.048","0.042","","","0.0974","0.1007","","","","","","1.091","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005793","15.223","0.006","20.797","0.008","14.135","0.006","90","","110.007","0.006","90","","4205","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H50 B20 Ir3 O Se4 -","- C24 H50 B20 Ir3 O Se4 -","- C96 H200 B80 Ir12 O4 Se16 -","4","1","","Liu, Shuang; Wang, Jian-Qiang; Weng, Lin-Hong; Jin, Guo-Xin","Construction of trinuclear iridium clusters through ancillary ortho-carborane-1,2-diselenolato ligands, with simultaneous iridium-induced B-H activation.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3792","3797","10.1039/b705366e","","","0.71073","MoKα","","0.105","0.065","","","0.1501","0.1596","","","","","","0.76","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005794","11.197","0.004","14.099","0.005","15.972","0.006","79.961","0.005","84.524","0.006","78.704","0.005","2429.8","1.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H57 B20 Ir3 O Se4 -","- C28.9 H54.6 B20 Ir3 O Se4 -","- C57.8 H109.2 B40 Ir6 O2 Se8 -","2","1","","Liu, Shuang; Wang, Jian-Qiang; Weng, Lin-Hong; Jin, Guo-Xin","Construction of trinuclear iridium clusters through ancillary ortho-carborane-1,2-diselenolato ligands, with simultaneous iridium-induced B-H activation.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3792","3797","10.1039/b705366e","","","0.71073","MoKα","","0.0932","0.0525","","","0.1162","0.1367","","","","","","1.007","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005795","13.017","0.004","14.016","0.004","20.129","0.006","96.771","0.004","105.979","0.004","100.469","0.004","3416.6","1.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H79 B30 Ir3 O Se6 -","- C37.8 H74.2 B30 Ir3 O Se6 -","- C75.6 H148.4 B60 Ir6 O2 Se12 -","2","1","","Liu, Shuang; Wang, Jian-Qiang; Weng, Lin-Hong; Jin, Guo-Xin","Construction of trinuclear iridium clusters through ancillary ortho-carborane-1,2-diselenolato ligands, with simultaneous iridium-induced B-H activation.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3792","3797","10.1039/b705366e","","","0.71073","MoKα","","0.0802","0.0464","","","0.1083","0.1218","","","","","","1.032","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005796","8.529","0.003","10.99","0.004","15.799","0.006","71.303","0.005","87.312","0.005","71.952","0.004","1331.5","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H33 B10 Ir O2 Se2 -","- C16 H33 B10 Ir O2 Se2 -","- C32 H66 B20 Ir2 O4 Se4 -","2","1","","Liu, Shuang; Wang, Jian-Qiang; Weng, Lin-Hong; Jin, Guo-Xin","Construction of trinuclear iridium clusters through ancillary ortho-carborane-1,2-diselenolato ligands, with simultaneous iridium-induced B-H activation.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3792","3797","10.1039/b705366e","","","0.71073","MoKα","","0.0601","0.0475","","","0.1182","0.1241","","","","","","1.003","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005797","13.067","0.003","13.95","0.004","20.077","0.005","96.226","0.004","107.169","0.004","100.926","0.004","3380.1","1.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H77 B30 Ir3 O Se6 -","- C41 H77 B30 Ir3 O Se6 -","- C82 H154 B60 Ir6 O2 Se12 -","2","1","","Liu, Shuang; Wang, Jian-Qiang; Weng, Lin-Hong; Jin, Guo-Xin","Construction of trinuclear iridium clusters through ancillary ortho-carborane-1,2-diselenolato ligands, with simultaneous iridium-induced B-H activation.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3792","3797","10.1039/b705366e","","","0.71073","MoKα","","0.0649","0.0401","","","0.0844","0.0941","","","","","","1.02","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005798","14.209","0.006","11.538","0.005","14.851","0.006","90","","96.042","0.007","90","","2421.2","1.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H29 B10 Ir O2 Se2 -","- C14 H29 B10 Ir O2 Se2 -","- C56 H116 B40 Ir4 O8 Se8 -","4","1","","Liu, Shuang; Wang, Jian-Qiang; Weng, Lin-Hong; Jin, Guo-Xin","Construction of trinuclear iridium clusters through ancillary ortho-carborane-1,2-diselenolato ligands, with simultaneous iridium-induced B-H activation.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3792","3797","10.1039/b705366e","","","0.71073","MoKα","","0.0755","0.0415","","","0.0753","0.0853","","","","","","0.922","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005799","13.8114","0.001","25.4872","0.0018","17.2934","0.0012","90","","107.304","0.001","90","","5812","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C62 H60 N4 O6 Zn2 -","- C62 H60 N4 O6 Zn2 -","- C248 H240 N16 O24 Zn8 -","4","0.5","","Chen, Chi-Tien; Chan, Chi-Yu; Huang, Chi-An; Chen, Ming-Tsz; Peng, Kuo-Fu","Zinc anilido-oxazolinate complexes as initiators for ring opening polymerization.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4073","4078","10.1039/b705398c","","","0.71073","MoKα","","0.0495","0.0358","","","0.1093","0.1176","","","","","","1.013","","","","has coordinates","179761","2020-10-21","18:00:00",""
"7005800","10.2184","0.0006","10.6669","0.0006","11.5997","0.0007","95.386","0.001","97.286","0.001","115.641","0.001","1114.89","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H52 N4 O6 Zn2 -","- C50 H52 N4 O6 Zn2 -","- C50 H52 N4 O6 Zn2 -","1","0.5","","Chen, Chi-Tien; Chan, Chi-Yu; Huang, Chi-An; Chen, Ming-Tsz; Peng, Kuo-Fu","Zinc anilido-oxazolinate complexes as initiators for ring opening polymerization.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4073","4078","10.1039/b705398c","","","0.71073","MoKα","","0.0376","0.0336","","","0.1005","0.1037","","","","","","1.041","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005801","14.5969","0.0004","17.5045","0.0003","27.8698","0.0006","90","","98.7409","0.0009","90","","7038.3","0.3","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C65 H105 Au3 N3 O4 P3 -","- C65 H105 Au3 N3 O4 P3 -","- C260 H420 Au12 N12 O16 P12 -","4","1","","Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Shardlow, Ellen J.","The Midas touch: a gold rich metallodendritic wedge.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2631","2633","10.1039/b705430k","","","0.71073","MoKα","","0.1538","0.0866","","0.1152","0.083","0.083","","","","","","1.0481","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005802","13.6698","0.001","14.4658","0.0009","17.1533","0.0006","90","","99.576","0.005","90","","3344.7","0.3","140","2","140","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C34 H41 B Cl F4 N3 P2 Ru -","- C34 H41 B Cl F4 N3 P2 Ru -","- C136 H164 B4 Cl4 F16 N12 P8 Ru4 -","4","1","","Scolaro, Claudine; Chaplin, Adrian B.; Hartinger, Christian G.; Bergamo, Alberta; Cocchietto, Moreno; Keppler, Bernhard K.; Sava, Gianni; Dyson, Paul J.","Tuning the hydrophobicity of ruthenium(II)-arene (RAPTA) drugs to modify uptake, biomolecular interactions and efficacy.","Dalton transactions (Cambridge, England : 2003)","2007","","43","5065","5072","10.1039/b705449a","","","0.71069","MoKα","","0.099","0.0384","","","0.0571","0.0668","","","","","","0.774","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005803","5.085","0.004","9.923","0.008","13.415","0.011","68.48","0.013","79.378","0.015","83.335","0.015","618.1","0.9","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H18 I2 N2 O6 Pd -","- C20 H18 I2 N2 O6 Pd -","- C20 H18 I2 N2 O6 Pd -","1","0.5","","Coco, Silverio; Espinet, Elisa; Espinet, Pablo; Palape, Inés","Functional isocyanide metal complexes as building blocks for supramolecular materials: hydrogen-bonded liquid crystals.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3267","3272","10.1039/b705478e","","","0.71073","MoKα","","0.0934","0.0783","","","0.2123","0.2187","","","","","","1.167","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005804","11.461","0.002","16.298","0.003","18.029","0.004","90","","90","","90","","3367.7","1.1","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","trihapto-allyl-bromide-allyldiphenylphosphine-nickel (ii)","trihapto-allyl-bromide-allyldiphenylphosphine-nickel (II)","","- C18 H20 Br Ni P -","- C18 H20 Br Ni P -","- C144 H160 Br8 Ni8 P8 -","8","1","","Hyder, Iqbal; Jiménez-Tenorio, Manuel; Puerta, M. Carmen; Valerga, Pedro","Oligomerization and regioselective hydrosilylation of styrenes catalyzed by cationic allyl nickel complexes bearing allylphosphine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3000","3009","10.1039/b705579j","","x-ray","0.71073","MoKα","","0.0468","0.0341","","","0.0732","0.0773","","","","","","1.04","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005805","12.436","0.003","7.4524","0.0016","15.775","0.004","90","","96.071","0.004","90","","1453.8","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","trihapto-allyl-allyldiisopropylphosphine-bromo-nickel (ii)","trihapto-allyl-allyldiisopropylphosphine-bromo-nickel (II)","","- C12 H24 Br Ni P -","- C12 H24 Br Ni P -","- C48 H96 Br4 Ni4 P4 -","4","1","","Hyder, Iqbal; Jiménez-Tenorio, Manuel; Puerta, M. Carmen; Valerga, Pedro","Oligomerization and regioselective hydrosilylation of styrenes catalyzed by cationic allyl nickel complexes bearing allylphosphine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3000","3009","10.1039/b705579j","","x-ray","0.71073","MoKα","","0.0403","0.0345","","","0.0783","0.0804","","","","","","0.932","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005806","8.2979","0.0017","15.238","0.003","9.339","0.0019","90","","104.4","0.03","90","","1143.8","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","dibromo-bis(allyldiisopropylphosphine)-nickel (ii)","dibromo-bis(allyldiisopropylphosphine)-nickel (II)","","- C18 H38 Br2 Ni P2 -","- C18 H38 Br2 Ni P2 -","- C36 H76 Br4 Ni2 P4 -","2","0.5","","Hyder, Iqbal; Jiménez-Tenorio, Manuel; Puerta, M. Carmen; Valerga, Pedro","Oligomerization and regioselective hydrosilylation of styrenes catalyzed by cationic allyl nickel complexes bearing allylphosphine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3000","3009","10.1039/b705579j","","x-ray","0.71073","MoKα","","0.0272","0.0265","","","0.0588","0.0592","","","","","","1.033","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005807","12.799","0.003","11.98","0.002","37.938","0.008","90","","99.13","0.03","90","","5743","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(Trihapto-2-methyl-allyl)-bis(diisopropyl-allyl-phosphino)- nickel (ii) tetrakis(3,5-bis(trifluoromethyl)phenyl)borate","(Trihapto-2-methyl-allyl)-bis(diisopropyl-allyl-phosphino)-nickel (II) tetrakis{3,5-bis(trifluoromethyl)phenyl}borate","","- C54 H57 B F24 Ni P2 -","- C54 H57 B F24 Ni P2 -","- C216 H228 B4 F96 Ni4 P8 -","4","1","","Hyder, Iqbal; Jiménez-Tenorio, Manuel; Puerta, M. Carmen; Valerga, Pedro","Oligomerization and regioselective hydrosilylation of styrenes catalyzed by cationic allyl nickel complexes bearing allylphosphine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3000","3009","10.1039/b705579j","","x-ray","0.71073","MoKα","","0.086","0.077","","","0.154","0.1594","","","","","","1.07","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005808","9.817","0.0006","16.6371","0.0012","15.0892","0.0016","90","","108.028","0.004","90","","2343.5","0.3","240","2","240","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H16 Cl4 F2 N2 Pt -","- C23 H16 Cl4 F2 N2 Pt -","- C92 H64 Cl16 F8 N8 Pt4 -","4","1","","Newman, Christopher P.; Casey-Green, Katherine; Clarkson, Guy J.; Cave, Gareth W. V.; Errington, W.; Rourke, Jonathan P.","Cyclometallated platinum(II) complexes: oxidation to, and C-H activation by, platinum(IV).","Dalton transactions (Cambridge, England : 2003)","2007","","29","3170","3182","10.1039/b705609e","","","0.71073","MoKα","","0.1913","0.0532","","","0.0697","0.0955","","","","","","0.885","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005809","11.1323","0.0012","7.0613","0.0019","17.8","0.003","90","","90","","90","","1399.2","0.5","220","2","220","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C13 H13 Cl F N O Pt S -","- C13 H13 Cl F N O Pt S -","- C52 H52 Cl4 F4 N4 O4 Pt4 S4 -","4","0.5","","Newman, Christopher P.; Casey-Green, Katherine; Clarkson, Guy J.; Cave, Gareth W. V.; Errington, W.; Rourke, Jonathan P.","Cyclometallated platinum(II) complexes: oxidation to, and C-H activation by, platinum(IV).","Dalton transactions (Cambridge, England : 2003)","2007","","29","3170","3182","10.1039/b705609e","","","0.71073","MoKα","","0.0353","0.0246","","","0.0522","0.0548","","","","","","0.938","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005810","6.724","0.0006","17.6254","0.0015","9.2172","0.0007","90","","90","","90","","1092.36","0.16","180","2","180","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C11 H10 Cl F N2 Pt -","- C11 H10 Cl F N2 Pt -","- C44 H40 Cl4 F4 N8 Pt4 -","4","1","","Newman, Christopher P.; Casey-Green, Katherine; Clarkson, Guy J.; Cave, Gareth W. V.; Errington, W.; Rourke, Jonathan P.","Cyclometallated platinum(II) complexes: oxidation to, and C-H activation by, platinum(IV).","Dalton transactions (Cambridge, England : 2003)","2007","","29","3170","3182","10.1039/b705609e","","","0.71073","MoKα","","0.0456","0.0304","","","0.0666","0.0697","","","","","","0.909","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005811","8.57","0.005","18.793","0.01","10.005","0.005","90","","114.085","0.014","90","","1471.1","1.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 Cl F N2 Pt -","- C16 H12 Cl F N2 Pt -","- C64 H48 Cl4 F4 N8 Pt4 -","4","1","","Newman, Christopher P.; Casey-Green, Katherine; Clarkson, Guy J.; Cave, Gareth W. V.; Errington, W.; Rourke, Jonathan P.","Cyclometallated platinum(II) complexes: oxidation to, and C-H activation by, platinum(IV).","Dalton transactions (Cambridge, England : 2003)","2007","","29","3170","3182","10.1039/b705609e","","","0.71073","MoKα","","0.0609","0.0425","","","0.0946","0.0975","","","","","","0.935","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005812","9.5988","0.0004","11.0181","0.0005","12.4407","0.0005","81.338","0.001","79.253","0.001","64.686","0.001","1164.81","0.09","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H17 Cl5 N2 Pt -","- C23 H17 Cl5 N2 Pt -","- C46 H34 Cl10 N4 Pt2 -","2","1","","Newman, Christopher P.; Casey-Green, Katherine; Clarkson, Guy J.; Cave, Gareth W. V.; Errington, W.; Rourke, Jonathan P.","Cyclometallated platinum(II) complexes: oxidation to, and C-H activation by, platinum(IV).","Dalton transactions (Cambridge, England : 2003)","2007","","29","3170","3182","10.1039/b705609e","","","0.71073","MoKα","","0.0427","0.0342","","","0.0731","0.0757","","","","","","0.982","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005813","22.143","0.0003","11.3439","0.0002","15.4143","0.0002","90","","133.187","0.001","90","","2823.09","0.09","180","2","180","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H16 Cl8 F2 N2 Pt -","- C24 H16 Cl8 F2 N2 Pt -","- C96 H64 Cl32 F8 N8 Pt4 -","4","0.5","","Newman, Christopher P.; Casey-Green, Katherine; Clarkson, Guy J.; Cave, Gareth W. V.; Errington, W.; Rourke, Jonathan P.","Cyclometallated platinum(II) complexes: oxidation to, and C-H activation by, platinum(IV).","Dalton transactions (Cambridge, England : 2003)","2007","","29","3170","3182","10.1039/b705609e","","","0.71073","MoKα","","0.0951","0.0523","","","0.0962","0.1101","","","","","","0.992","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005814","9.493","0.006","15.559","0.012","15.246","0.01","90","","106.83","0.04","90","","2155","3","180","2","180","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H15.5 Cl F2 N2 O1.25 Pt -","- C22 H15 Cl F2 N2 O1.25 Pt -","- C88 H60 Cl4 F8 N8 O5 Pt4 -","4","1","","Newman, Christopher P.; Casey-Green, Katherine; Clarkson, Guy J.; Cave, Gareth W. V.; Errington, W.; Rourke, Jonathan P.","Cyclometallated platinum(II) complexes: oxidation to, and C-H activation by, platinum(IV).","Dalton transactions (Cambridge, England : 2003)","2007","","29","3170","3182","10.1039/b705609e","","","0.71073","MoKα","","0.1995","0.084","","","0.1301","0.1651","","","","","","0.975","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005815","14.0028","0.001","14.0028","0.001","24.578","0.002","90","","90","","120","","4173.6","0.5","200","2","200","2","","","","","","","synthesis as described","5","P 3 c 1","P 3 -2""c","158","","","","- C6.333333 H18.5 I2 N3.166667 P -","- C6.33333 H18.5 I2 N3.16667 P -","- C76 H222 I24 N38 P12 -","12","2","","Barnes, Nicholas A.; Godfrey, Stephen M.; Halton, Ruth T. A.; Pritchard, Robin G.; Safi, Zaki; Sheffield, Joanne M.","Preference for a C3 conformation in tris-dimethylaminophosphonium cations: a comparison of the reactions of (Me2N)3P with I-X (X = Cl, Br, I, CN).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3252","3258","10.1039/b705651f","","x-ray","0.71073","MoKα","","0.0652","0.0552","","","0.1199","0.128","","","","","","1.178","","","","has coordinates","212870","2020-10-21","18:00:00",""
"7005816","8.2595","0.0004","8.2595","0.0004","16.5475","0.0008","90","0.002","90","0.002","120","0.002","977.62","0.08","150","2","150","2","","","","","","","synthesis as described","6","R 3 m :H","R 3 -2""","160","","","","- C6 H18 Cl I N3 P -","- C6 H18 Cl I N3 P -","- C18 H54 Cl3 I3 N9 P3 -","3","0.166667","","Barnes, Nicholas A.; Godfrey, Stephen M.; Halton, Ruth T. A.; Pritchard, Robin G.; Safi, Zaki; Sheffield, Joanne M.","Preference for a C3 conformation in tris-dimethylaminophosphonium cations: a comparison of the reactions of (Me2N)3P with I-X (X = Cl, Br, I, CN).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3252","3258","10.1039/b705651f","","x-ray","0.71073","MoKα","","0.0266","0.0231","","","0.0417","0.043","","","","","","1.117","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005817","23.2367","0.0004","8.2259","0.0001","13.8563","0.0002","90","","90","","90","","2648.53","0.07","150","2","150","2","","","","","","","synthesis as described","5","P c a 21","P 2c -2ac","29","","","","- C7 H18 I N4 P -","- C7 H18 I N4 P -","- C56 H144 I8 N32 P8 -","8","2","","Barnes, Nicholas A.; Godfrey, Stephen M.; Halton, Ruth T. A.; Pritchard, Robin G.; Safi, Zaki; Sheffield, Joanne M.","Preference for a C3 conformation in tris-dimethylaminophosphonium cations: a comparison of the reactions of (Me2N)3P with I-X (X = Cl, Br, I, CN).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3252","3258","10.1039/b705651f","","x-ray","0.71073","MoKα","","0.0536","0.037","","","0.0729","0.0802","","","","","","1.052","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005818","8.2719","0.0009","8.2719","0.0009","16.646","0.002","90","","90","","120","","986.4","0.19","183","2","183","2","","","","","","","synthesis as described","7","R 3 m :H","R 3 -2""","160","","","","- C6 H18 Br0.5 Cl0.5 I N3 P -","- C6 H18 Br0.51 Cl0.49 I N3 P -","- C18 H54 Br1.53 Cl1.47 I3 N9 P3 -","3","0.166667","","Barnes, Nicholas A.; Godfrey, Stephen M.; Halton, Ruth T. A.; Pritchard, Robin G.; Safi, Zaki; Sheffield, Joanne M.","Preference for a C3 conformation in tris-dimethylaminophosphonium cations: a comparison of the reactions of (Me2N)3P with I-X (X = Cl, Br, I, CN).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3252","3258","10.1039/b705651f","","x-ray","0.71069","MoKα","","0.0261","0.0261","","","0.0612","0.0612","","","","","","1.158","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005819","9.1111","0.0006","10.8627","0.0007","13.4127","0.0009","68.776","0.003","84.102","0.003","87.524","0.003","1230.85","0.14","93","2","93","2","","","","","","","","7","P -1","-P 1","2","Cu(PETAEA)CuCl, Compound 1","","","- C23 H27 Cl Cu2 N4 O2 S -","- C23 H27 Cl Cu2 N4 O2 S -","- C46 H54 Cl2 Cu4 N8 O4 S2 -","2","1","","Goodwin, Jocelyn M.; Chiang, Pin-Chieh; Brynda, Marcin; Penkina, Katerina; Olmstead, Marilyn M.; Patten, Timothy E.","Asymmetric dinuclear copper(I) complexes of bis-(2-(2-pyridyl)ethyl)-2-(N-toluenesulfonylamino)ethylamine with short copper-copper distances.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3086","3092","10.1039/b705684b","","","0.71073","MoKα","","0.0307","0.0241","","","0.0599","0.0646","","","","","","1.043","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005820","9.5617","0.0012","9.9875","0.001","13.472","0.0012","92.187","0.008","91.981","0.009","108.049","0.008","1220.9","0.2","133","2","133","2","","","","","","","","7","P -1","-P 1","2","Cu(PEMAEA)CuCl Compound 2","","","- C23 H27 Cl Cu2 N4 O3 S -","- C23 H27 Cl Cu2 N4 O3 S -","- C46 H54 Cl2 Cu4 N8 O6 S2 -","2","1","","Goodwin, Jocelyn M.; Chiang, Pin-Chieh; Brynda, Marcin; Penkina, Katerina; Olmstead, Marilyn M.; Patten, Timothy E.","Asymmetric dinuclear copper(I) complexes of bis-(2-(2-pyridyl)ethyl)-2-(N-toluenesulfonylamino)ethylamine with short copper-copper distances.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3086","3092","10.1039/b705684b","","","1.54178","CuKα","","0.0643","0.0628","","","0.1676","0.17","","","","","","1.108","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005821","8.9933","0.0009","10.8437","0.0011","26.491","0.003","94.085","0.003","98.63","0.004","92.039","0.003","2544.9","0.5","90","2","90","2","","","","","","","","7","P -1","-P 1","2","Cu(PENAEA)CuCl Compound 3","","","- C22 H24 Cl Cu2 N5 O4 S -","- C22 H24 Cl Cu2 N5 O4 S -","- C88 H96 Cl4 Cu8 N20 O16 S4 -","4","2","","Goodwin, Jocelyn M.; Chiang, Pin-Chieh; Brynda, Marcin; Penkina, Katerina; Olmstead, Marilyn M.; Patten, Timothy E.","Asymmetric dinuclear copper(I) complexes of bis-(2-(2-pyridyl)ethyl)-2-(N-toluenesulfonylamino)ethylamine with short copper-copper distances.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3086","3092","10.1039/b705684b","","","0.71073","MoKα","","0.0366","0.027","","","0.0657","0.0707","","","","","","1.002","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005822","8.2189","0.0016","12.76","0.003","8.6282","0.0017","90","","98.62","0.03","90","","894.6","0.3","150","0.2","150","0.2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","N,N,N',N'-Tetramethylethylenediammonium Uranylphosphatefluoride","N,N,N',N'-Tetramethylethylenediammonium Uranylphosphatefluoride","","- C3 H10 F N O6 P U -","- C3 H10 F N O6 P U -","- C12 H40 F4 N4 O24 P4 U4 -","4","1","","Min Ok, Kang; Doran, Michael B.; O'Hare, Dermot","[(CH3)2NH(CH2)2NH(CH3)2][(UO2)2F2(HPO4)2]: a new organically templated layered uranium phosphate fluoride‒synthesis, structure, characterization, and ion-exchange reactions.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3325","3329","10.1039/b705759h","","","0.71073","MoKα","","0.0289","0.0237","","","0.0529","0.0551","","","","","","1.063","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005823","10.7155","0.0008","11.8759","0.0008","19.7818","0.0015","90","","94.679","0.006","90","","2509","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19.5 H34 Cl2 Cu N4 O8.5 -","- C19.5 H32 Cl2 Cu N4 O8.5 -","- C78 H128 Cl8 Cu4 N16 O34 -","4","1","","McRobbie, Graeme; Valks, Gina C.; Empson, Christopher J.; Khan, Abid; Silversides, Jon D.; Pannecouque, Christophe; De Clercq, Erik; Fiddy, Steven G.; Bridgeman, Adam J.; Young, Nigel A.; Archibald, Stephen J.","Probing key coordination interactions: configurationally restricted metal activated CXCR4 antagonists.","Dalton transactions (Cambridge, England : 2003)","2007","","43","5008","5018","10.1039/b705800d","","","0.71073","MoKα","","0.0945","0.0593","","","0.1532","0.1795","","","","","","0.977","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005824","11.4067","0.0018","25.573","0.004","23.159","0.004","90","","99.558","0.003","90","","6661.8","1.9","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","03229-tricopper complex 15b","","","- C45 H90 Cl6 Cu6 N14 -","- C45 H90 Cl6 Cu6 N14 -","- C180 H360 Cl24 Cu24 N56 -","4","1","","Brown, Eric C.; Johnson, Brandon; Palavicini, Sara; Kucera, Benjamin E.; Casella, Luigi; Tolman, William B.","Modular syntheses of multidentate ligands with variable N-donors: applications to tri- and tetracopper(I) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3035","3042","10.1039/B705806C","","","0.71073","MoKα","","0.083","0.0471","","","0.1176","0.14","","","","","","1.029","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005825","13.5564","0.0005","13.5564","0.0005","13.5564","0.0005","90","","90","","90","","2491.34","0.16","173","2","173","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","04305-complex 19","","","- C18 H36 Cu F6 N4 P -","- C18 H36 Cu F5.99994 N4 P0.99999 -","- C72 H144 Cu4 F23.9998 N16 P3.99996 -","4","0.333333","","Brown, Eric C.; Johnson, Brandon; Palavicini, Sara; Kucera, Benjamin E.; Casella, Luigi; Tolman, William B.","Modular syntheses of multidentate ligands with variable N-donors: applications to tri- and tetracopper(I) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3035","3042","10.1039/B705806C","","","0.71073","MoKα","","0.0287","0.0256","","","0.0662","0.0686","","","","","","1.014","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005826","10.4705","0.0012","11.0935","0.0013","12.0139","0.0014","83.962","0.002","84.97","0.002","83.927","0.002","1375.8","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","05006-complex 21","","","- C27 H30 Cu F6 N4 P -","- C27 H30 Cu F6 N4 P -","- C54 H60 Cu2 F12 N8 P2 -","2","1","","Brown, Eric C.; Johnson, Brandon; Palavicini, Sara; Kucera, Benjamin E.; Casella, Luigi; Tolman, William B.","Modular syntheses of multidentate ligands with variable N-donors: applications to tri- and tetracopper(I) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","28","3035","3042","10.1039/B705806C","","","0.71073","MoKα","","0.0387","0.03","","","0.0734","0.0784","","","","","","1.029","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005827","13.108","0.012","10.539","0.009","10.636","0.01","100.09","0.04","110.7","0.03","95.96","0.03","1331","2","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C46 H52 Cu5 N6 O24 -","- C46 H44 Cu5 N6 O24 -","- C46 H44 Cu5 N6 O24 -","1","0.5","","Boudalis, Athanassios K.; Raptopoulou, Catherine P.; Psycharis, Vassilis; Sanakis, Yiannis; Abarca, Belén; Ballesteros, Rafael; Chadlaoui, Mimoun","An ""S""-shaped pentanuclear CuII cluster derived from the metal-assisted hydrolysis of pyCOpyCOpy: structural, magnetic and spectroscopic studies.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3582","3589","10.1039/b705962k","","","1.5418","CuKα","","0.082","0.0737","","","0.2059","0.2162","","","","","","1.082","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005828","11.077","0.004","13.608","0.004","19.195","0.003","103","0.03","100.75","0.03","97","0.02","2728.9","1.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H59 F6 Mn2 N3 O7 P4 -","- C48 H59 F6 Mn2 N3 O7 P4 -","- C96 H118 F12 Mn4 N6 O14 P8 -","2","1","","Adams, Christopher J.; Anderson, Kirsty M.; Connelly, Neil G.; Llamas-Rey, Estefania; Orpen, A. Guy; Paul, Rowena L.","The effect of micro-CN linkage isomerism and ancillary ligand set on directional metal-metal charge-transfer in cyanide-bridged dimanganese complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3609","3622","10.1039/b705975b","","","0.71073","MoKα","","0.0583","0.0486","","","0.123","0.1308","","","","","","1.026","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005829","11.0916","0.0015","13.638","0.002","19.076","0.004","102.981","0.002","100.441","0.002","97.525","0.0011","2720.5","0.8","173","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H59 F6 Mn2 N3 O7 P4 -","- C48 H59 F6 Mn2 N3 O7 P4 -","- C96 H118 F12 Mn4 N6 O14 P8 -","2","1","","Adams, Christopher J.; Anderson, Kirsty M.; Connelly, Neil G.; Llamas-Rey, Estefania; Orpen, A. Guy; Paul, Rowena L.","The effect of micro-CN linkage isomerism and ancillary ligand set on directional metal-metal charge-transfer in cyanide-bridged dimanganese complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3609","3622","10.1039/b705975b","","","0.71073","MoKα","","0.0911","0.0496","","","0.121","0.1348","","","","","","0.954","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005830","18.98","0.03","11.234","0.017","31.52","0.04","90","","94.01","0.15","90","","6704","17","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C70 H59 F6 Mn2 N2 O9 P5 -","- C70 H59 F6 Mn2 N2 O9 P5 -","- C280 H236 F24 Mn8 N8 O36 P20 -","4","1","","Adams, Christopher J.; Anderson, Kirsty M.; Connelly, Neil G.; Llamas-Rey, Estefania; Orpen, A. Guy; Paul, Rowena L.","The effect of micro-CN linkage isomerism and ancillary ligand set on directional metal-metal charge-transfer in cyanide-bridged dimanganese complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3609","3622","10.1039/b705975b","","","0.71073","MoKα","","0.4146","0.116","","","0.1801","0.2848","","","","","","0.877","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005831","9.9087","0.0006","12.8321","0.0008","22.7982","0.0014","86.824","0.001","86.597","0.001","79.134","0.001","2838.9","0.3","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C50.5 H56 Cl3 F6 Mn2 N3 O6 P4 -","- C50.5 H56 Cl3 F6 Mn2 N3 O6 P4 -","- C101 H112 Cl6 F12 Mn4 N6 O12 P8 -","2","1","","Adams, Christopher J.; Anderson, Kirsty M.; Connelly, Neil G.; Llamas-Rey, Estefania; Orpen, A. Guy; Paul, Rowena L.","The effect of micro-CN linkage isomerism and ancillary ligand set on directional metal-metal charge-transfer in cyanide-bridged dimanganese complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3609","3622","10.1039/b705975b","","","0.71073","MoKα","","0.1239","0.0571","","","0.1368","0.1649","","","","","","0.977","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005832","13.651","0.002","14.574","0.003","18.143","0.003","68.629","0.003","79.22","0.003","71.517","0.003","3177.5","1","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C62 H63 Cl2 F6 Mn2 N3 O6 P4 -","- C62 H63 Cl2 F6 Mn2 N3 O6 P4 -","- C124 H126 Cl4 F12 Mn4 N6 O12 P8 -","2","1","","Adams, Christopher J.; Anderson, Kirsty M.; Connelly, Neil G.; Llamas-Rey, Estefania; Orpen, A. Guy; Paul, Rowena L.","The effect of micro-CN linkage isomerism and ancillary ligand set on directional metal-metal charge-transfer in cyanide-bridged dimanganese complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3609","3622","10.1039/b705975b","","","0.71073","MoKα","","0.2068","0.082","","","0.1866","0.2493","","","","","","1.006","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005833","34.821","0.003","11.161","0.0011","37.628","0.003","90","","90","","90","","14624","2","173","2","173","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C70 H59 F6 Mn2 N2 O9 P5 -","- C70 H59 F6 Mn2 N2 O9 P5 -","- C560 H472 F48 Mn16 N16 O72 P40 -","8","2","","Adams, Christopher J.; Anderson, Kirsty M.; Connelly, Neil G.; Llamas-Rey, Estefania; Orpen, A. Guy; Paul, Rowena L.","The effect of micro-CN linkage isomerism and ancillary ligand set on directional metal-metal charge-transfer in cyanide-bridged dimanganese complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3609","3622","10.1039/b705975b","","","0.71073","MoKα","","0.1874","0.0707","","","0.1182","0.1437","","","","","","0.812","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005834","13.509","0.003","14.427","0.003","15.3","0.003","65.28","0.03","89.35","0.03","72.08","0.03","2553.4","1.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- Bi2 Co4 H96 Na14 O116 W18 -","- Bi2 Co4 Na14 O114 W18 -","- Bi2 Co4 Na14 O114 W18 -","1","0.5","","Liu, Ying; Liu, Bin; Xue, Ganglin; Hu, Huaiming; Fu, Feng; Wang, Jiwu","The novel sandwich-type heteropolyoxotungstates [M2Bi2(beta-B-MW9O34)2]14- (M = Co(II), Zn(II)): beta-type dimeric heteropolyanions with a transition metal as the central heteroatom and Bi(III) and M as linking atoms.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3634","3639","10.1039/b706018a","","","0.71073","MoKα","","0.1131","0.0656","","","0.1659","0.1992","","","","","","1.031","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005835","13.6266","0.0016","14.3963","0.0017","15.3377","0.0018","65.66","0.001","89.667","0.002","71.745","0.002","2576.9","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- Bi2 H102 Na14 O119 W18 Zn4 -","- Bi2 Na14 O114 W18 Zn4 -","- Bi2 Na14 O114 W18 Zn4 -","1","0.5","","Liu, Ying; Liu, Bin; Xue, Ganglin; Hu, Huaiming; Fu, Feng; Wang, Jiwu","The novel sandwich-type heteropolyoxotungstates [M2Bi2(beta-B-MW9O34)2]14- (M = Co(II), Zn(II)): beta-type dimeric heteropolyanions with a transition metal as the central heteroatom and Bi(III) and M as linking atoms.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3634","3639","10.1039/b706018a","","","0.71073","MoKα","","0.0936","0.0723","","","0.1897","0.2066","","","","","","1.049","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005836","15.418","0.001","8.4575","0.0005","26.0158","0.0017","90","","90.6985","0.0012","90","","3392.1","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H21 Eu N2 O11 -","- C12 H21 Eu N2 O11 -","- C96 H168 Eu8 N16 O88 -","8","1","","Puntus, Lada; Zhuravlev, Konstantin; Lyssenko, Konstantin; Antipin, Mikhail; Pekareva, Irina","Luminescence and structural properties of lanthanide complexes of Schiff bases derived from pyridoxal and amino acids.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4079","4088","10.1039/B706020C","","","0.71073","MoKα","","0.0336","0.0272","","","0.0566","0.0587","","","","","","1.064","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005837","7.2681","0.0019","20.816","0.005","23.403","0.006","90","","90","","90","","3540.7","1.6","100","2","100","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C28 H42 Cl Eu N8 O14 -","- C28 H42 Cl Eu N8 O14 -","- C112 H168 Cl4 Eu4 N32 O56 -","4","0.5","","Puntus, Lada; Zhuravlev, Konstantin; Lyssenko, Konstantin; Antipin, Mikhail; Pekareva, Irina","Luminescence and structural properties of lanthanide complexes of Schiff bases derived from pyridoxal and amino acids.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4079","4088","10.1039/B706020C","","","0.71073","MoKα","","0.1","0.0626","","","0.1148","0.1286","","","","","","1.041","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005838","10.9237","0.0003","12.3078","0.0003","13.8877","0.0004","67.987","0.001","86.014","0.001","69.563","0.002","1618.03","0.08","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H76 Cl6 N2 O14 -","- C64 H76 Cl6 N2 O14 -","- C64 H76 Cl6 N2 O14 -","1","0.5","","Pascu, Sofia I.; Naumann, Christoph; Kaiser, Guido; Bond, Andrew D.; Sanders, Jeremy K. M.; Jarrosson, Thibaut","Structures and solution dynamics of pseudorotaxanes mediated by alkali-metal cations.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3874","3884","10.1039/b706043b","","","0.71073","MoKα","","0.1039","0.0593","","","0.1167","0.1384","","","","","","1.035","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005839","12.135","0.0005","10.6602","0.0002","32.3295","0.0012","90","","93.692","0.001","90","","4173.5","0.2","180","2","180","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C68 H86 Cl12 I2 Li2 N2 O16 -","- C68 H86 Cl12 I2 Li2 N2 O16 -","- C136 H172 Cl24 I4 Li4 N4 O32 -","2","0.5","","Pascu, Sofia I.; Naumann, Christoph; Kaiser, Guido; Bond, Andrew D.; Sanders, Jeremy K. M.; Jarrosson, Thibaut","Structures and solution dynamics of pseudorotaxanes mediated by alkali-metal cations.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3874","3884","10.1039/b706043b","","","0.71073","MoKα","","0.1143","0.0716","","","0.1829","0.2072","","","","","","1.06","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005840","10.7604","0.0005","23.6245","0.0006","15.4728","0.0006","90","","107.281","0.001","90","","3755.8","0.2","180","2","180","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C64 H80 Cl6 I2 N2 Na2 O16 -","- C64 H80 Cl6 I2 N2 Na2 O16 -","- C128 H160 Cl12 I4 N4 Na4 O32 -","2","0.5","","Pascu, Sofia I.; Naumann, Christoph; Kaiser, Guido; Bond, Andrew D.; Sanders, Jeremy K. M.; Jarrosson, Thibaut","Structures and solution dynamics of pseudorotaxanes mediated by alkali-metal cations.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3874","3884","10.1039/b706043b","","","0.71073","MoKα","","0.1052","0.0667","","","0.16","0.1809","","","","","","1.021","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005841","10.057","0.0005","15.2801","0.0007","17.2223","0.0008","70.219","0.002","78.484","0.002","83.267","0.002","2436.7","0.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H86 Br2 Cl24 Li2 N2 O16 -","- C70 H86 Br2 Cl24 Li2 N2 O16 -","- C70 H86 Br2 Cl24 Li2 N2 O16 -","1","0.5","","Pascu, Sofia I.; Naumann, Christoph; Kaiser, Guido; Bond, Andrew D.; Sanders, Jeremy K. M.; Jarrosson, Thibaut","Structures and solution dynamics of pseudorotaxanes mediated by alkali-metal cations.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3874","3884","10.1039/b706043b","","","0.6923","synchrotron","","0.0691","0.0618","","","0.1664","0.1734","","","","","","1.079","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005842","11.413","0.006","12.236","0.005","16.274","0.005","98.19","0.03","105.66","0.02","99.55","0.04","2115.6","1.6","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C68 H76 Cl6 F12 Li4 N2 O26 S4 -","- C68 H76 Cl6 F12 Li4 N2 O26 S4 -","- C68 H76 Cl6 F12 Li4 N2 O26 S4 -","1","0.5","","Pascu, Sofia I.; Naumann, Christoph; Kaiser, Guido; Bond, Andrew D.; Sanders, Jeremy K. M.; Jarrosson, Thibaut","Structures and solution dynamics of pseudorotaxanes mediated by alkali-metal cations.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3874","3884","10.1039/b706043b","","","0.6904","synchrotron","","0.1229","0.1017","","","0.2691","0.2897","","","","","","1.074","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005843","11.0338","0.0003","13.4294","0.0003","17.6513","0.0004","68.066","0.001","81.761","0.001","86.115","0.001","2400.87","0.1","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H82 Cl24 I2 N2 Na2 O14 -","- C70 H82 Cl24 I2 N2 Na2 O14 -","- C70 H82 Cl24 I2 N2 Na2 O14 -","1","0.5","","Pascu, Sofia I.; Naumann, Christoph; Kaiser, Guido; Bond, Andrew D.; Sanders, Jeremy K. M.; Jarrosson, Thibaut","Structures and solution dynamics of pseudorotaxanes mediated by alkali-metal cations.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3874","3884","10.1039/b706043b","","","0.71073","MoKα","","0.0983","0.0741","","","0.1872","0.2044","","","","","","1.072","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005844","10.7936","0.0012","11.3413","0.0013","17.171","0.002","92.089","0.002","105.095","0.002","94.5","0.002","2019.6","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H46 Cl6 O10 -","- C38 H46 Cl6 O10 -","- C76 H92 Cl12 O20 -","2","1","","Pascu, Sofia I.; Naumann, Christoph; Kaiser, Guido; Bond, Andrew D.; Sanders, Jeremy K. M.; Jarrosson, Thibaut","Structures and solution dynamics of pseudorotaxanes mediated by alkali-metal cations.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3874","3884","10.1039/b706043b","","","0.6923","synchrotron","","0.0911","0.051","","","0.1281","0.1446","","","","","","1.033","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005845","13.383","0.005","14.935","0.006","31.025","0.012","90","","90","","90","","6201","4","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21.5 H44 Al2 Cl4 N6 -","- C21.5 H44 Al2 Cl4 N6 -","- C172 H352 Al16 Cl32 N48 -","8","1","","Brazeau, Allison L.; DiLabio, Gino A.; Kreisel, Kevin A.; Monillas, Wesley; Yap, Glenn P. A.; Barry, Seán T","Theoretical and experimental investigations of ligand exchange in guanidinate ligand systems for group 13 metals.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3297","3304","10.1039/b706044k","","","0.71073","MoKα","","0.09","0.0842","","","0.2462","0.2538","","","","","","1.992","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005846","18.821","0.003","8.0375","0.0013","15.06","0.003","90","","104.269","0.002","90","","2207.9","0.7","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H38 Al Cl N4 -","- C18 H38 Al Cl N4 -","- C72 H152 Al4 Cl4 N16 -","4","0.5","","Brazeau, Allison L.; DiLabio, Gino A.; Kreisel, Kevin A.; Monillas, Wesley; Yap, Glenn P. A.; Barry, Seán T","Theoretical and experimental investigations of ligand exchange in guanidinate ligand systems for group 13 metals.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3297","3304","10.1039/b706044k","","","0.71073","MoKα","","0.037","0.0338","","","0.0931","0.0959","","","","","","1.056","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005847","11.505","0.008","12.788","0.008","14.102","0.009","90","","108.13","0.009","90","","1972","2","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H34 Cl Ga N4 -","- C16 H34 Cl Ga N4 -","- C64 H136 Cl4 Ga4 N16 -","4","0.5","","Brazeau, Allison L.; DiLabio, Gino A.; Kreisel, Kevin A.; Monillas, Wesley; Yap, Glenn P. A.; Barry, Seán T","Theoretical and experimental investigations of ligand exchange in guanidinate ligand systems for group 13 metals.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3297","3304","10.1039/b706044k","","","0.71073","MoKα","","0.0305","0.0281","","","0.0825","0.0842","","","","","","1.05","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005848","11.7468","0.0007","12.3711","0.0008","28.598","0.002","90","","94.917","0.001","90","","4140.6","0.5","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C38 H73 B F4 N2 O P2 Pd -","- C38 H73 B F4 N2 O P2 Pd -","- C152 H292 B4 F16 N8 O4 P8 Pd4 -","4","1","","Magill, Alison M.; Yates, Brian F.; Cavell, Kingsley J.; Skelton, Brian W.; White, Allan H.","Synthesis of N-heterocyclic carbene palladium(II) bis-phosphine complexes and their decomposition in the presence of aryl halides.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3398","3406","10.1039/b706053j","","","0.71073","MoKα","","0.076","0.045","","0.073","","0.065","","","1.014","","","1.06","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005849","9.5737","0.0009","20.954","0.002","13.427","0.001","90","","103.622","0.002","90","","2617.8","0.4","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H26 I2 P2 Pd -","- C27 H26 I2 P2 Pd -","- C108 H104 I8 P8 Pd4 -","4","1","","Magill, Alison M.; Yates, Brian F.; Cavell, Kingsley J.; Skelton, Brian W.; White, Allan H.","Synthesis of N-heterocyclic carbene palladium(II) bis-phosphine complexes and their decomposition in the presence of aryl halides.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3398","3406","10.1039/b706053j","","","0.71073","MoKα","","0.054","0.034","","0.05","","0.046","","","1.027","","","1.071","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005850","11.157","0.003","6.4786","0.0015","12.087","0.003","90","","107.808","0.001","90","","831.8","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H5 Dy N2 O7 S -","- C4 H5 Dy N2 O7 S -","- C16 H20 Dy4 N8 O28 S4 -","4","1","","Sun, Yan-Qiong; Yang, Guo-Yu","Organic-inorganic hybrid materials constructed from inorganic lanthanide sulfate skeletons and organic 4,5-imidazoledicarboxylic acid.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3771","3781","10.1039/b706072f","","","0.71073","MoKα","","0.023","0.0204","","","0.0441","0.0456","","","","","","1.014","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005851","11.209","0.002","6.5406","0.0011","12.203","0.002","90","","107.922","0.002","90","","851.2","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H5 Eu N2 O7 S -","- C4 H5 Eu N2 O7 S -","- C16 H20 Eu4 N8 O28 S4 -","4","1","","Sun, Yan-Qiong; Yang, Guo-Yu","Organic-inorganic hybrid materials constructed from inorganic lanthanide sulfate skeletons and organic 4,5-imidazoledicarboxylic acid.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3771","3781","10.1039/b706072f","","","0.71073","MoKα","","0.0189","0.0174","","","0.0639","0.0646","","","","","","1.351","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005852","11.1805","0.0011","6.4982","0.0005","12.1319","0.0011","90","","107.818","0.005","90","","839.14","0.13","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 H5 N O7 S Tb -","- C4 H5 N2 O7 S Tb -","- C16 H20 N8 O28 S4 Tb4 -","4","1","","Sun, Yan-Qiong; Yang, Guo-Yu","Organic-inorganic hybrid materials constructed from inorganic lanthanide sulfate skeletons and organic 4,5-imidazoledicarboxylic acid.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3771","3781","10.1039/b706072f","","","0.71073","MoKα","","0.0299","0.0269","","","0.0667","0.0684","","","","","","1.113","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005853","11.2069","0.0003","6.5254","0.0002","12.1824","0.0004","90","","107.91","0.001","90","","847.72","0.04","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H5 Gd N2 O7 S -","- C4 H5 Gd N2 O7 S -","- C16 H20 Gd4 N8 O28 S4 -","4","1","","Sun, Yan-Qiong; Yang, Guo-Yu","Organic-inorganic hybrid materials constructed from inorganic lanthanide sulfate skeletons and organic 4,5-imidazoledicarboxylic acid.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3771","3781","10.1039/b706072f","","","0.71073","MoKα","","0.0377","0.0347","","","0.0869","0.0893","","","","","","1.146","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005854","11.1469","0.0003","6.447","","12.0387","0.0002","90","","107.771","0.001","90","","823.87","0.03","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H5 Er N2 O7 S -","- C4 H5 Er N2 O7 S -","- C16 H20 Er4 N8 O28 S4 -","4","1","","Sun, Yan-Qiong; Yang, Guo-Yu","Organic-inorganic hybrid materials constructed from inorganic lanthanide sulfate skeletons and organic 4,5-imidazoledicarboxylic acid.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3771","3781","10.1039/b706072f","","","0.71073","MoKα","","0.0358","0.0314","","","0.0777","0.0808","","","","","","1.208","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005855","6.879","0.002","14.067","0.005","33.802","0.011","90","","90","","90","","3270.9","1.8","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C10 H8 La2 N4 O14 S -","- C10 H8 La2 N4 O14 S -","- C80 H64 La16 N32 O112 S8 -","8","1","","Sun, Yan-Qiong; Yang, Guo-Yu","Organic-inorganic hybrid materials constructed from inorganic lanthanide sulfate skeletons and organic 4,5-imidazoledicarboxylic acid.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3771","3781","10.1039/b706072f","","","0.71073","MoKα","","0.0289","0.0263","","","0.0472","0.048","","","","","","1.197","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005856","9.4691","0.0006","13.4407","0.0007","12.7749","0.001","90","","105.155","0.003","90","","1569.33","0.18","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 H10 Gd2 N2 O16 S2 -","- C5 H10 Gd2 N2 O16 S2 -","- C20 H40 Gd8 N8 O64 S8 -","4","1","","Sun, Yan-Qiong; Yang, Guo-Yu","Organic-inorganic hybrid materials constructed from inorganic lanthanide sulfate skeletons and organic 4,5-imidazoledicarboxylic acid.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3771","3781","10.1039/b706072f","","","0.71073","MoKα","","0.0212","0.0191","","","0.0426","0.0434","","","","","","1.032","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005857","6.6363","0.0002","13.3817","0.0005","18.996","0.0007","90","","106.712","0.001","90","","1615.69","0.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 H10 Gd2 N2 O16 S2 -","- C5 H10 Gd2 N2 O16 S2 -","- C20 H40 Gd8 N8 O64 S8 -","4","1","","Sun, Yan-Qiong; Yang, Guo-Yu","Organic-inorganic hybrid materials constructed from inorganic lanthanide sulfate skeletons and organic 4,5-imidazoledicarboxylic acid.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3771","3781","10.1039/b706072f","","","0.71073","MoKα","","0.0347","0.0296","","","0.066","0.0686","","","","","","1.14","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005858","6.6022","0.0005","13.3235","0.0009","18.8797","0.0012","90","","106.618","0.003","90","","1591.38","0.19","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 H10 Eu2 N2 O16 S2 -","- C5 H10 Eu2 N2 O16 S2 -","- C20 H40 Eu8 N8 O64 S8 -","4","1","","Sun, Yan-Qiong; Yang, Guo-Yu","Organic-inorganic hybrid materials constructed from inorganic lanthanide sulfate skeletons and organic 4,5-imidazoledicarboxylic acid.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3771","3781","10.1039/b706072f","","","0.71073","MoKα","","0.0315","0.0288","","","0.0735","0.0755","","","","","","1.11","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005859","6.628","0.0005","9.4648","0.0007","21.5033","0.0015","96.778","0.002","94.307","0.004","97.886","0.004","1321.14","0.17","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H36 Cu Eu6 N8 O54 S6 -","- C20 H36 Cu Eu6 N8 O54 S6 -","- C20 H36 Cu Eu6 N8 O54 S6 -","1","0.5","","Sun, Yan-Qiong; Yang, Guo-Yu","Organic-inorganic hybrid materials constructed from inorganic lanthanide sulfate skeletons and organic 4,5-imidazoledicarboxylic acid.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3771","3781","10.1039/b706072f","","","0.71073","MoKα","","0.0354","0.0308","","","0.0745","0.079","","","","","","1.065","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005860","10.3556","0.0013","12.1406","0.0015","12.9298","0.0016","91.174","0.002","98.599","0.002","102.055","0.002","1569.6","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H28 Fe2 O4 P2 S2 -","- C32 H28 Fe2 O4 P2 S2 -","- C64 H56 Fe4 O8 P4 S4 -","2","1","","Adam, Fatima I.; Hogarth, Graeme; Richards, Idris; Sanchez, Benjamin E.","Models of the iron-only hydrogenase: structural studies of chelating diphosphine complexes [Fe2(CO)4(micro-pdt)(kappa2P,P'-diphosphine)].","Dalton transactions (Cambridge, England : 2003)","2007","","24","2495","2498","10.1039/b706123b","","","0.71073","MoKα","","0.0826","0.0543","","","0.1253","0.1387","","","","","","1.06","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005861","9.4439","0.0008","9.6258","0.0009","22.437","0.002","99.783","0.001","95.331","0.002","94.278","0.002","1992.8","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H41 Cl2 Fe2 O3 P3 S2 -","- C41 H41 Cl2 Fe2 O3 P3 S2 -","- C82 H82 Cl4 Fe4 O6 P6 S4 -","2","1","","Adam, Fatima I.; Hogarth, Graeme; Richards, Idris; Sanchez, Benjamin E.","Models of the iron-only hydrogenase: structural studies of chelating diphosphine complexes [Fe2(CO)4(micro-pdt)(kappa2P,P'-diphosphine)].","Dalton transactions (Cambridge, England : 2003)","2007","","24","2495","2498","10.1039/b706123b","","","0.71073","MoKα","","0.051","0.0405","","","0.095","0.0998","","","","","","1.046","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005862","9.7227","0.001","10.3859","0.0011","18.5263","0.0019","84.913","0.002","80.645","0.002","63.569","0.002","1652.7","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H33 Fe2 N O4 P2 S2 -","- C34 H33 Fe2 N O4 P2 S2 -","- C68 H66 Fe4 N2 O8 P4 S4 -","2","1","","Adam, Fatima I.; Hogarth, Graeme; Richards, Idris; Sanchez, Benjamin E.","Models of the iron-only hydrogenase: structural studies of chelating diphosphine complexes [Fe2(CO)4(micro-pdt)(kappa2P,P'-diphosphine)].","Dalton transactions (Cambridge, England : 2003)","2007","","24","2495","2498","10.1039/b706123b","","","0.71073","MoKα","","0.0453","0.0421","","","0.1095","0.1122","","","","","","1.03","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005863","10.1181","0.0013","10.9537","0.0014","17.301","0.002","90","","106.262","0.002","90","","1840.8","0.4","150","2","150","2","","","","","","","","7","P 1 c 1","P -2yc","7","","","","- C38 H32 Cl2 Fe2 O4 P2 S2 -","- C38 H32 Cl2 Fe2 O4 P2 S2 -","- C76 H64 Cl4 Fe4 O8 P4 S4 -","2","1","","Adam, Fatima I.; Hogarth, Graeme; Richards, Idris; Sanchez, Benjamin E.","Models of the iron-only hydrogenase: structural studies of chelating diphosphine complexes [Fe2(CO)4(micro-pdt)(kappa2P,P'-diphosphine)].","Dalton transactions (Cambridge, England : 2003)","2007","","24","2495","2498","10.1039/b706123b","","","0.71073","MoKα","","0.0422","0.0381","","","0.0856","0.0874","","","","","","1.013","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005864","10.4973","0.0008","11.105","0.0008","16.5294","0.0012","73.689","0.001","84.67","0.001","61.833","0.001","1628.5","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H32 Fe2 O4 P2 S2 -","- C34 H32 Fe2 O4 P2 S2 -","- C68 H64 Fe4 O8 P4 S4 -","2","1","","Adam, Fatima I.; Hogarth, Graeme; Richards, Idris; Sanchez, Benjamin E.","Models of the iron-only hydrogenase: structural studies of chelating diphosphine complexes [Fe2(CO)4(micro-pdt)(kappa2P,P'-diphosphine)].","Dalton transactions (Cambridge, England : 2003)","2007","","24","2495","2498","10.1039/b706123b","","","0.71073","MoKα","","0.0306","0.0273","","","0.0675","0.0694","","","","","","1.028","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005865","23.707","0.002","16.7698","0.0014","11.2147","0.001","90","","90","","90","","4458.5","0.7","150","2","150","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C48 H45 Fe2 O4 P3 S2 -","- C48 H45 Fe2 O4 P3 S2 -","- C192 H180 Fe8 O16 P12 S8 -","4","1","","Adam, Fatima I.; Hogarth, Graeme; Richards, Idris; Sanchez, Benjamin E.","Models of the iron-only hydrogenase: structural studies of chelating diphosphine complexes [Fe2(CO)4(micro-pdt)(kappa2P,P'-diphosphine)].","Dalton transactions (Cambridge, England : 2003)","2007","","24","2495","2498","10.1039/b706123b","","","0.71073","MoKα","","0.0726","0.0447","","","0.0716","0.0764","","","","","","0.937","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7005866","9.8036","0.0006","17.9672","0.0012","18.4965","0.0012","90","","100.919","0.001","90","","3199","0.4","423","2","423","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C34 H31 Fe2 N O4 P2 S2 -","- C34 H31 Fe2 N O4 P2 S2 -","- C136 H124 Fe8 N4 O16 P8 S8 -","4","1","","Adam, Fatima I.; Hogarth, Graeme; Richards, Idris; Sanchez, Benjamin E.","Models of the iron-only hydrogenase: structural studies of chelating diphosphine complexes [Fe2(CO)4(micro-pdt)(kappa2P,P'-diphosphine)].","Dalton transactions (Cambridge, England : 2003)","2007","","24","2495","2498","10.1039/b706123b","","","0.71073","MoKα","","0.0401","0.033","","","0.0813","0.0843","","","","","","1.057","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005867","20.2633","0.0008","10.2848","0.0004","13.4463","0.0005","90","","106.989","0.002","90","","2679.97","0.18","273","2","273","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C19 H28 Br Fe2 N O4 P2 S2 -","- C19 H28 Br Fe2 N O4 P2 S2 -","- C76 H112 Br4 Fe8 N4 O16 P8 S8 -","4","1","","Wang, Fujun; Wang, Mei; Liu, Xiaoyang; Jin, Kun; Dong, Weibing; Sun, Licheng","Protonation, electrochemical properties and molecular structures of halogen-functionalized diiron azadithiolate complexes related to the active site of iron-only hydrogenases.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3812","3819","10.1039/b706178a","","","0.71073","MoKα","","0.0496","0.0343","","","0.0813","0.0859","","","","","","1.05","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005868","11.621","0.002","12.59","0.003","13.505","0.003","80.32","0.03","65.34","0.03","76.92","0.03","1743","0.8","273","2","273","2","","","","","","","","10","P -1","-P 1","2","","","","- C20 H31 Br Cl2 F6 Fe2 N O4 P3 S2 -","- C20 H31 Br Cl2 F6 Fe2 N O4 P3 S2 -","- C40 H62 Br2 Cl4 F12 Fe4 N2 O8 P6 S4 -","2","1","","Wang, Fujun; Wang, Mei; Liu, Xiaoyang; Jin, Kun; Dong, Weibing; Sun, Licheng","Protonation, electrochemical properties and molecular structures of halogen-functionalized diiron azadithiolate complexes related to the active site of iron-only hydrogenases.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3812","3819","10.1039/b706178a","","","0.71073","MoKα","","0.0693","0.0456","","","0.1046","0.1163","","","","","","1.033","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005869","13.3549","0.0009","14.8313","0.001","19.7845","0.0011","90","","90","","90","","3918.7","0.4","273","2","273","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C15 H10 Br Fe2 N O6 S2 -","- C15 H10 Br Fe2 N O6 S2 -","- C120 H80 Br8 Fe16 N8 O48 S16 -","8","1","","Wang, Fujun; Wang, Mei; Liu, Xiaoyang; Jin, Kun; Dong, Weibing; Sun, Licheng","Protonation, electrochemical properties and molecular structures of halogen-functionalized diiron azadithiolate complexes related to the active site of iron-only hydrogenases.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3812","3819","10.1039/b706178a","","","0.71073","MoKα","","0.1522","0.0403","","","0.0607","0.0793","","","","","","0.786","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005870","22.953","0.01","6.611","0.003","15.033","0.006","90","","104.63","0.03","90","","2207.2","1.7","273","2","273","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C15 H11 Br Cl Fe2 N O10 S2 -","- C15 H11 Br Cl Fe2 N O10 S2 -","- C60 H44 Br4 Cl4 Fe8 N4 O40 S8 -","4","1","","Wang, Fujun; Wang, Mei; Liu, Xiaoyang; Jin, Kun; Dong, Weibing; Sun, Licheng","Protonation, electrochemical properties and molecular structures of halogen-functionalized diiron azadithiolate complexes related to the active site of iron-only hydrogenases.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3812","3819","10.1039/b706178a","","","0.71073","MoKα","","0.2075","0.0865","","","0.1479","0.1947","","","","","","0.961","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005871","24.211","0.0015","24.211","0.0015","23.327","0.002","90","","90","","90","","13673.6","1.7","293","2","293","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","","","","- C52 H44 Ag5.5 N21.5 O16.5 -","- C52 H44 Ag5.5 N21.5 O16.5 -","- C416 H352 Ag44 N172 O132 -","8","0.25","","Sun, Qiaozhen; Wei, Meilin; Bai, Yan; He, Cheng; Meng, Qingjin; Duan, Chunying","Entanglement of individual coordination polymers having helicates as building intermediates.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4089","4094","10.1039/b706183h","","","0.71073","MoKα","","0.1692","0.0721","","","0.1609","0.1792","","","","","","1.039","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005872","34.182","0.007","31.28","0.006","26.46","0.005","90","","94.703","0.005","90","","28196","10","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C104 H104 Ag6.5 B6.5 F26 N32 O8 -","- C104 H104 Ag6.5 B6.5 F26 N32 O8 -","- C832 H832 Ag52 B52 F208 N256 O64 -","8","1","","Sun, Qiaozhen; Wei, Meilin; Bai, Yan; He, Cheng; Meng, Qingjin; Duan, Chunying","Entanglement of individual coordination polymers having helicates as building intermediates.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4089","4094","10.1039/b706183h","","","0.71073","MoKα","","0.0714","0.0476","","","0.1012","0.1077","","","","","","1.073","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005873","9.2236","0.0009","16.9938","0.0016","21.688","0.002","104.782","0.0015","96.028","0.0018","100.117","0.002","3195.5","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H55 Ag3 Cl3 N17 O11 -","- C56 H51 Ag3 Cl3 N17 O10.99 -","- C112 H102 Ag6 Cl6 N34 O21.98 -","2","1","","Sun, Qiaozhen; Wei, Meilin; Bai, Yan; He, Cheng; Meng, Qingjin; Duan, Chunying","Entanglement of individual coordination polymers having helicates as building intermediates.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4089","4094","10.1039/b706183h","","","0.71073","MoKα","","0.0727","0.0558","","","0.1614","0.1718","","","","","","1.029","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005874","13.104","0.003","22.1","0.005","10.492","0.002","90","","92.155","0.004","90","","3036.3","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H25 Ag Cl N9 O4 -","- C28 H25 Ag Cl N9 O4 -","- C112 H100 Ag4 Cl4 N36 O16 -","4","1","","Sun, Qiaozhen; Wei, Meilin; Bai, Yan; He, Cheng; Meng, Qingjin; Duan, Chunying","Entanglement of individual coordination polymers having helicates as building intermediates.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4089","4094","10.1039/b706183h","","","0.71073","MoKα","","0.0791","0.0503","","","0.1132","0.1225","","","","","","0.987","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005875","10.378","0.0019","14.177","0.003","21.525","0.004","90","","95.71","0.003","90","","3151.2","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Lanthanum carboxylate","","","- C32 H22 La2 O18 -","- C32 H22 La2 O18 -","- C128 H88 La8 O72 -","4","1","","Mahata, Partha; Ramya, K. V.; Natarajan, Srinivasan","Synthesis, structure and optical properties of rare-earth benzene carboxylates.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4017","4026","10.1039/b706363f","","","0.71073","MoKα","","0.043","0.0309","","","0.0559","0.0591","","","","","","1.066","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005876","10.587","0.002","14.227","0.003","17.13","0.003","90","","97.998","0.004","90","","2555","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Yttrium Carboxylate","","","- C24 H16 O15 Y2 -","- C24 H16 O15 Y2 -","- C96 H64 O60 Y8 -","4","1","","Mahata, Partha; Ramya, K. V.; Natarajan, Srinivasan","Synthesis, structure and optical properties of rare-earth benzene carboxylates.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4017","4026","10.1039/b706363f","","","0.71073","MoKα","","0.1083","0.0529","","","0.0896","0.1054","","","","","","0.993","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005877","10.6293","0.0018","14.219","0.002","17.175","0.003","90","","97.915","0.003","90","","2571.1","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Gadolinium carboxylate","","","- C24 H16 Gd2 O15 -","- C24 H16 Gd2 O15 -","- C96 H64 Gd8 O60 -","4","1","","Mahata, Partha; Ramya, K. V.; Natarajan, Srinivasan","Synthesis, structure and optical properties of rare-earth benzene carboxylates.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4017","4026","10.1039/b706363f","","","0.71073","MoKα","","0.0387","0.0297","","","0.0537","0.0563","","","","","","1.074","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005878","20.5174","0.0007","30.0769","0.0008","31.1822","0.001","88.974","0.002","84.962","0.001","85.924","0.002","19118.4","1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C309 H478 O90 S12 Sn20 -","- C309 H478 O90 S12 Sn20 -","- C618 H956 O180 S24 Sn40 -","2","1","","Prabusankar, Ganesan; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan","Sn(3) and Sn(10) sulfonate-oxide-hydroxide clusters with two different sulfonate binding modes.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3121","3123","10.1039/b706377f","","","0.71073","MoKα","","0.1662","0.0808","","","0.1876","0.23","","","","","","1.029","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005879","14.5396","0.0001","17.6961","0.0001","18.8745","0.0001","94.1887","0.0003","99.7233","0.0003","109.313","0.0003","4473.59","0.05","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C87.5 H119.5 O16 S4 Sn3 -","- C87.5 H119.5 O16 S4 Sn3 -","- C175 H239 O32 S8 Sn6 -","2","1","","Prabusankar, Ganesan; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan","Sn(3) and Sn(10) sulfonate-oxide-hydroxide clusters with two different sulfonate binding modes.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3121","3123","10.1039/b706377f","","","0.71073","MoKα","","0.0371","0.0329","","","0.0829","0.087","","","","","","1.033","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005880","16.7988","0.0005","16.7988","0.0005","102.377","0.004","90","","90","","120","","25020.1","1.4","193","2","193","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","5,free ligand","","","- C74 H105 N9 O4 -","- C70 H97 N9 O3 -","- C840 H1164 N108 O36 -","12","0.333333","","Mitra, Ranjan; Peters, Matthew W.; Scott, Michael J.","Synthesis and reactivity of a C3-symmetric trinuclear zinc(II) hydroxide catalyst efficient at phosphate diester transesterification.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3924","3935","10.1039/b706386e","","","0.71073","MoKα","","0.1716","0.0805","","","0.2202","0.263","","","","","","0.974","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005881","16.7532","0.0016","16.7532","0.0016","23.629","0.003","90","","90","","120","","5743.4","1.1","193","2","193","2","","","","","","","","6","P -3","-P 3","147","6,Zn3OH35","","","- C79 H118 Cl3 N9 O21 Zn3 -","- C70 H100 Cl3.01 N9 O18.01 Zn3 -","- C140 H200 Cl6.02 N18 O36.02 Zn6 -","2","0.333333","","Mitra, Ranjan; Peters, Matthew W.; Scott, Michael J.","Synthesis and reactivity of a C3-symmetric trinuclear zinc(II) hydroxide catalyst efficient at phosphate diester transesterification.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3924","3935","10.1039/b706386e","","","0.71073","MoKα","","0.1436","0.0849","","","0.2357","0.2616","","","","","","0.945","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005882","11.608","0.002","13.803","0.003","17.997","0.004","88.49","0.03","81.17","0.03","86.69","0.03","2844.2","1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C57 H84 Ga N5 Zn -","- C57 H84 Ga N5 Zn -","- C114 H168 Ga2 N10 Zn2 -","2","1","","Jones, Cameron; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of zinc gallyl complexes: first structural elucidations of Zn-Ga bonds.","Dalton transactions (Cambridge, England : 2003)","2007","","28","2997","2999","10.1039/b706402k","","","0.71073","MoKα","","0.0604","0.0418","","","0.095","0.1036","","","","","","1.011","","","","has coordinates,has disorder","179762","2020-10-21","18:00:00",""
"7005883","13.953","0.003","21.07","0.004","46.243","0.009","90","","90","","90","","13595","5","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C60 H93 Ga2 N6 O0.5 Zn -","- C60 H93 Ga2 N6 O0.5 Zn -","- C480 H744 Ga16 N48 O4 Zn8 -","8","1","","Jones, Cameron; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of zinc gallyl complexes: first structural elucidations of Zn-Ga bonds.","Dalton transactions (Cambridge, England : 2003)","2007","","28","2997","2999","10.1039/b706402k","","","0.71073","MoKα","","0.1774","0.1271","","","0.3003","0.3198","","","","","","1.18","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005884","9.8818","0.0011","13.5064","0.0015","12.5856","0.0015","90","","91.8462","0.0004","90","","1678.9","0.3","173.1","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C28 H35 Cl2 Cu N3 O14 -","- C28 H35 Cl2 Cu N3 O14 -","- C56 H70 Cl4 Cu2 N6 O28 -","2","1","","Sugai, Yuko; Fujii, Shoko; Fujimoto, Tomomi; Yano, Shigenobu; Mikata, Yuji","Asymmetric sulfur atom coordination in a copper(II) dipicolylamine (DPA) complex with a thioglycoside ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3705","3709","10.1039/b706423c","","","0.7107","MoKα","","","0.0333","","","","0.088","","","","","","1.036","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005885","8.9194","0.0002","12.9185","0.0005","29.3079","0.0011","90","","90","","90","","3377","0.2","173.1","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C28 H35 Cl2 Cu N3 O13 S -","- C28 H35 Cl2 Cu N3 O13 S -","- C112 H140 Cl8 Cu4 N12 O52 S4 -","4","1","","Sugai, Yuko; Fujii, Shoko; Fujimoto, Tomomi; Yano, Shigenobu; Mikata, Yuji","Asymmetric sulfur atom coordination in a copper(II) dipicolylamine (DPA) complex with a thioglycoside ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3705","3709","10.1039/b706423c","","","0.7107","MoKα","","","0.0372","","","","0.1041","","","","","","1.049","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005886","12.9252","0.0003","10.8313","0.0003","16.0613","0.0004","90","","102.569","0.002","90","","2194.64","0.1","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H25 Br2 N3 O Pd -","- C20 H25 Br2 N3 O Pd -","- C80 H100 Br8 N12 O4 Pd4 -","4","1","","Ray, Lipika; Shaikh, Mobin M.; Ghosh, Prasenjit","Air-stable, convenient to handle Pd based PEPPSI (pyridine enhanced precatalyst preparation, stabilization and initiation) themed precatalysts of N/O-functionalized N-heterocyclic carbenes and its utility in Suzuki-Miyaura cross-coupling reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4546","4555","10.1039/b706607d","","","0.71073","MoKα","","0.0802","0.0682","","","0.219","0.2319","","","","","","1.169","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005887","6.0741","0.0003","10.996","0.003","12.313","0.004","82.75","0.02","83.452","0.014","81.642","0.013","803.3","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H22 Cl N3 O -","- C16 H22 Cl N3 O -","- C32 H44 Cl2 N6 O2 -","2","1","","Ray, Lipika; Shaikh, Mobin M.; Ghosh, Prasenjit","Air-stable, convenient to handle Pd based PEPPSI (pyridine enhanced precatalyst preparation, stabilization and initiation) themed precatalysts of N/O-functionalized N-heterocyclic carbenes and its utility in Suzuki-Miyaura cross-coupling reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4546","4555","10.1039/b706607d","","","0.71073","MoKα","","0.0566","0.0411","","","0.1049","0.1204","","","","","","1.207","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005888","8.9556","0.001","9.83","0.002","14.552","0.002","71.923","0.017","75.819","0.01","64.689","0.016","1091.5","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H25 Cl2 N3 O Pd -","- C21 H25 Cl2 N3 O Pd -","- C42 H50 Cl4 N6 O2 Pd2 -","2","1","","Ray, Lipika; Shaikh, Mobin M.; Ghosh, Prasenjit","Air-stable, convenient to handle Pd based PEPPSI (pyridine enhanced precatalyst preparation, stabilization and initiation) themed precatalysts of N/O-functionalized N-heterocyclic carbenes and its utility in Suzuki-Miyaura cross-coupling reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4546","4555","10.1039/b706607d","","","0.71073","MoKα","","0.0433","0.0365","","","0.0834","0.089","","","","","","1.088","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005889","10.829","0.002","11.2668","0.0015","11.429","0.002","107.068","0.014","111.852","0.019","100.997","0.014","1164.4","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H26 Cl2 N4 O Pd -","- C21 H26 Cl2 N4 O Pd -","- C42 H52 Cl4 N8 O2 Pd2 -","2","1","","Ray, Lipika; Shaikh, Mobin M.; Ghosh, Prasenjit","Air-stable, convenient to handle Pd based PEPPSI (pyridine enhanced precatalyst preparation, stabilization and initiation) themed precatalysts of N/O-functionalized N-heterocyclic carbenes and its utility in Suzuki-Miyaura cross-coupling reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4546","4555","10.1039/b706607d","","","0.71073","MoKα","","0.0454","0.0374","","","0.0963","0.1012","","","","","","1.009","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005890","7.617","0.005","9.23","0.006","7.05","0.005","90","","115.92","0.006","90","","445.8","0.5","93","2","93","2","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- N2 O S3 -","- N2 O S3 -","- N8 O4 S12 -","4","1","","Tersago, Karla; Matuska, Vit; Van Alsenoy, Christian; Slawin, Alexandra M. Z.; Woollins, J. Derek; Blockhuys, Frank","Structure, bonding, aromaticity and reactivity of Roesky's sulfoxide.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4529","4535","10.1039/b706659g","","","0.71073","MoKα","","0.0229","0.0215","","","0.0533","0.0537","","","","","","1.054","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005891","21.8742","0.0006","10.9039","0.0003","20.839","0.0005","90","","97.598","0.002","90","","4926.8","0.2","173","2","173","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C52 H74 N4 Sn -","- C52 H74 N4 Sn -","- C208 H296 N16 Sn4 -","4","1","","Nimitsiriwat, Nonsee; Gibson, Vernon C.; Marshall, Edward L.; White, Andrew J. P.; Dale, Sophie H.; Elsegood, Mark R. J.","Tert-butylamidinate tin(ii) complexes: high activity, single-site initiators for the controlled production of polylactide.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4464","4471","10.1039/b706663e","","","0.71073","MoKα","","0.0801","0.0758","","","0.1729","0.1758","","","","","","1.236","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005892","9.5201","0.0004","16.9282","0.0006","17.8114","0.0007","90","","90.911","0.002","90","","2870.09","0.19","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H43 Cl N2 Sn -","- C29 H43 Cl N2 Sn -","- C116 H172 Cl4 N8 Sn4 -","4","1","","Nimitsiriwat, Nonsee; Gibson, Vernon C.; Marshall, Edward L.; White, Andrew J. P.; Dale, Sophie H.; Elsegood, Mark R. J.","Tert-butylamidinate tin(ii) complexes: high activity, single-site initiators for the controlled production of polylactide.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4464","4471","10.1039/b706663e","","","0.71073","MoKα","","0.0303","0.0237","","","0.0541","0.0583","","","","","","1.044","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005893","18.3898","0.0005","17.9716","0.0004","19.1257","0.0005","90","","90","","90","","6320.9","0.3","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C32 H50 N2 O Sn -","- C32 H50 N2 O Sn -","- C256 H400 N16 O8 Sn8 -","8","1","","Nimitsiriwat, Nonsee; Gibson, Vernon C.; Marshall, Edward L.; White, Andrew J. P.; Dale, Sophie H.; Elsegood, Mark R. J.","Tert-butylamidinate tin(ii) complexes: high activity, single-site initiators for the controlled production of polylactide.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4464","4471","10.1039/b706663e","","","0.71073","MoKα","","0.038","0.0249","","","0.0562","0.0656","","","","","","1.092","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005894","10.0495","0.0009","11.0334","0.001","15.5989","0.0014","99.131","0.002","107.283","0.002","106.213","0.002","1529.8","0.2","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H49 N3 Sn -","- C31 H49 N3 Sn -","- C62 H98 N6 Sn2 -","2","1","","Nimitsiriwat, Nonsee; Gibson, Vernon C.; Marshall, Edward L.; White, Andrew J. P.; Dale, Sophie H.; Elsegood, Mark R. J.","Tert-butylamidinate tin(ii) complexes: high activity, single-site initiators for the controlled production of polylactide.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4464","4471","10.1039/b706663e","","","0.71073","MoKα","","0.0331","0.028","","","0.0679","0.0704","","","","","","1.064","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005895","12.5827","0.0005","18.3977","0.0007","11.7294","0.0004","90","","90","","90","","2715.27","0.18","173","2","173","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C11 H21 Cl O3 P Rh -","- C11 H21 Cl O3 P Rh -","- C88 H168 Cl8 O24 P8 Rh8 -","8","2","","Lorenzini, Fabio; Patrick, Brian O.; James, Brian R.","Synthesis and X-ray structures of water-soluble tris(hydroxymethyl)phosphine complexes of rhodium(I).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3224","3226","10.1039/b706691k","","","0.71073","MoKα","","0.0416","0.0318","","","0.068","0.0719","","","","","","1.018","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005896","6.1225","0.0007","7.656","0.001","15.582","0.002","90.676","0.005","91.539","0.005","98.235","0.005","722.51","0.16","173","2","173","2","","","","","","","","6","P 1","P 1","1","","","","- C7 H18 Cl O7 P2 Rh -","- C7 H18 Cl O7 P2 Rh -","- C14 H36 Cl2 O14 P4 Rh2 -","2","2","","Lorenzini, Fabio; Patrick, Brian O.; James, Brian R.","Synthesis and X-ray structures of water-soluble tris(hydroxymethyl)phosphine complexes of rhodium(I).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3224","3226","10.1039/b706691k","","","0.71073","MoKα","","0.0454","0.0408","","","0.1145","0.1222","","","","","","1.04","","","","has coordinates","179762","2020-10-21","18:00:00",""
"7005897","17.0076","0.001","17.0076","0.001","7.8591","0.0005","90","","90","","90","","2273.3","0.2","213","2","213","2","","","","","","","","6","P 42/m n m","-P 4n 2n","136","Silver(i) Perchlorate 4:5 Complex with Pyridazino(4,5- d)pyridazine","Silver(I) Perchlorate 4:5 Complex with Pyridazino[4,5-d]pyridazine","","- C30 H20 Ag4 Cl4 N20 O16 -","- C30 H20 Ag4 Cl3 N20 O12 -","- C60 H40 Ag8 Cl6 N40 O24 -","2","0.125","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.039","0.026","","","0.066","0.068","","","","","","0.973","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005898","17.0801","0.0011","17.0782","0.0011","7.592","0.0007","90","","90","","90","","2214.6","0.3","213","2","213","2","","","","","","","","8","P n n m","-P 2 2n","58","Silver(i) Hexaflurosilicate Tetrafluoroborate Complex with Pyridazino(4,5-d)pyridazine Hydrate","Silver(I) Hexaflurosilicate Tetrafluoroborate Complex with Pyridazino[4,5-d]pyridazine Hydrate","","- C30 H28 Ag4 B2 F14 N20 O4 Si -","- C30 H20 Ag4 B2 F14 N20 O4 Si -","- C60 H40 Ag8 B4 F28 N40 O8 Si2 -","2","0.25","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.0512","0.0419","","","0.1195","0.123","","","","","","1.057","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005899","15.6887","0.0009","15.6887","0.0009","24.4805","0.0018","90","","90","","120","","5218.2","0.6","213","2","213","2","","","","","","","","7","R 3 c :H","R 3 -2""c","161","Silver(i) Trifluorometanesulfonate Complex with Pyridazino(4,5-d)pyridazine, Solvate with 0.33 Water","Silver(I) Trifluorometanesulfonate Complex with Pyridazino[4,5-d]pyridazine, Solvate with 0.33 Water","","- C21 H14 Ag3 F9 N12 O10 S3 -","- C21 H12 Ag3 F9 N12 O10 S3 -","- C126 H72 Ag18 F54 N72 O60 S18 -","6","0.333333","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.0499","0.0315","","","0.0768","0.0806","","","","","","0.938","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005900","8.8507","0.0001","17.2093","0.0003","12.0859","0.0002","90","","100.785","0.001","90","","1808.34","0.05","273","2","273","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Silver(i) Hexafluorosilicate 2:3 Complex with Pyridazino(4,5- d)pyridazine, Decahydrate","Silver(I) Hexafluorosilicate 2:3 Complex with Pyridazino[4,5-d]pyridazine, Decahydrate","","- C18 H32 Ag4 F12 N12 O10 Si2 -","- C18 H12 Ag4 F12 N12 O10 Si2 -","- C36 H24 Ag8 F24 N24 O20 Si4 -","2","0.5","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.0547","0.046","","","0.1139","0.1178","","","","","","1.062","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005901","7.3514","0.0002","12.5897","0.0003","11.3054","0.0003","90","","90","","90","","1046.34","0.05","213","2","213","2","","","","","","","","6","P n m a","-P 2ac 2n","62","Silver(i) Trifluoroacetate Complex with Pyridazino(4,5- d)pyridazine","Silver(I) Trifluoroacetate Complex with Pyridazino[4,5-d]pyridazine","","- C8 H4 Ag F3 N4 O2 -","- C8 H4 Ag F3 N4 O2 -","- C32 H16 Ag4 F12 N16 O8 -","4","0.5","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.0347","0.0292","","","0.0703","0.0735","","","","","","1.054","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005902","25.281","0.001","25.281","0.001","7.4007","0.0004","90","","90","","120","","4096.3","0.3","213","2","213","2","","","","","","","","6","R -3 :H","-R 3","148","Silver(i) Pentafluoropropionate 2:1 Complex with Pyridazino(4,5-d)pyridazine","Silver(I) Pentafluoropropionate 2:1 Complex with Pyridazino[4,5-d]pyridazine","","- C12 H4 Ag2 F10 N4 O4 -","- C12 H4 Ag2 F10 N4 O4 -","- C108 H36 Ag18 F90 N36 O36 -","9","0.5","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.0325","0.0244","","","0.0624","0.0643","","","","","","1.038","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005903","10.6823","0.0008","12.1323","0.0007","14.6844","0.0009","90","","97.017","0.008","90","","1888.9","0.2","213","2","213","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Silver(i) Tetrafluoroborate 4:3 Complex with 4,4'- Bipyridazine Hydrate","Silver(I) Tetrafluoroborate 4:3 Complex with 4,4'-Bipyridazine Hydrate","","- C24 H20 Ag4 B4 F16 N12 O -","- C24 H18 Ag4 B4 F16 N12 O -","- C48 H36 Ag8 B8 F32 N24 O2 -","2","0.5","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.043","0.034","","","0.0903","0.0924","","","","","","0.946","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005904","7.7384","0.0002","38.169","0.0008","50.8067","0.001","90","","90","","90","","15006.6","0.6","273","2","273","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","Silver(i) Hexafluorosilicate 2:3 Complex with 4,4'- Bipyridazine, Trihydrate","Silver(I) Hexafluorosilicate 2:3 Complex with 4,4'-Bipyridazine, Trihydrate","","- C24 H24 Ag4 F12 N12 O3 Si2 -","- C24 H24 Ag4 F12 N12 O3 Si2 -","- C384 H384 Ag64 F192 N192 O48 Si32 -","16","0.5","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.0557","0.0483","","","0.1318","0.1364","","","","","","1.044","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005905","8.7652","0.0006","22.1004","0.0015","10.4417","0.0007","90","","91.874","0.001","90","","2021.6","0.2","213","2","213","2","","","","","","","","7","P 1 21 1","P 2yb","4","Silver(i) Trifluoromethylsulfonate Complex with 4,4'- Bipyridazine, Solvate with 2/3 Water","Silver(I) Trifluoromethylsulfonate Complex with 4,4'-Bipyridazine, Solvate with 2/3 Water","","- C27 H22 Ag3 F9 N12 O11 S3 -","- C27 H22 Ag3 F9 N12 O11 S3 -","- C54 H44 Ag6 F18 N24 O22 S6 -","2","1","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.0234","0.021","","","0.0495","0.05","","","","","","1.014","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005906","13.9023","0.0002","14.4405","0.0003","18.2666","0.0002","107.079","0.001","111.592","0.001","94.232","0.001","3190.47","0.1","273","2","273","2","","","","","","","","7","P -1","-P 1","2","Silver(i) Trifluoroacetate 2:1 Complex with 4,4'- Bipyridazine, Solvate with 2/7 Chloroform","Silver(I) Trifluoroacetate 2:1 Complex with 4,4'-Bipyridazine, Solvate with 2/7 Chloroform","","- C86 H44 Ag14 Cl6 F42 N28 O28 -","- C86 H44 Ag14 Cl6 F42 N28 O28 -","- C86 H44 Ag14 Cl6 F42 N28 O28 -","1","0.5","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.0471","0.0333","","","0.0736","0.0786","","","","","","1.053","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005907","26.9862","0.0012","26.9862","0.0012","7.6176","0.0004","90","","90","","120","","4804.3","0.4","213","2","213","2","","","","","","","","6","R -3 :H","-R 3","148","Silver(i) Pentafluoropropionate 2:1 Complex with 4,4'- Bipyridazine","Silver(I) Pentafluoropropionate 2:1 Complex with 4,4'-Bipyridazine","","- C14 H6 Ag2 F10 N4 O4 -","- C14 H6 Ag2 F10 N4 O4 -","- C126 H54 Ag18 F90 N36 O36 -","9","0.5","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.0488","0.0387","","","0.1121","0.1189","","","","","","1.081","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005908","28.4273","0.0011","28.4273","0.0011","7.5353","0.0003","90","","90","","120","","5273.5","0.4","273","2","273","2","","","","","","","","6","R -3 :H","-R 3","148","Silver(i) Heptafluorobutyrate 2:1 Complex with 4,4'- Bipyridazine","Silver(I) Heptafluorobutyrate 2:1 Complex with 4,4'-Bipyridazine","","- C16 H6 Ag2 F14 N4 O4 -","- C16 H6 Ag2 F14 N4 O4 -","- C144 H54 Ag18 F126 N36 O36 -","9","0.5","","Konstantin V. Domasevitch; Pavlo V. Solntsev; Il'ya A. Gural'skiy; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Judith A. K. Howard","Silver(I) ions bridged by pyridazine: doubling the ligand functionality for the design of unusual 3D coordination frameworks.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3893","3905","10.1039/b706731c","","","0.71073","MoKα","","0.0533","0.0461","","","0.1507","0.1575","","","","","","1.108","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7005909","14.6066","0.0004","15.1533","0.0004","15.1861","0.0005","88.126","0.004","86.558","0.004","62.572","0.004","2978","0.18","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C42 H72 Br2 Cl2 Cr2 Cu2 N15 O14.5 -","- C42 H71 Br2 Cl2 Cr2 Cu2 N15 O14.5 -","- C84 H142 Br4 Cl4 Cr4 Cu4 N30 O29 -","2","1","","Khanra, Sumit; Weyhermüller, Thomas; Chaudhuri, Phalguni","Rational synthesis of a heterotetranuclear CrIII2CuII2 species using a metaloximate as a building block. A magnetostructural study.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4675","4680","10.1039/b706753d","","","0.71073","MoKα","","0.0434","0.0345","","","0.0806","0.0852","","","","","","1.022","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005910","19.0968","0.0012","20.2604","0.0012","22.6082","0.001","101.977","0.003","109.431","0.003","100.737","0.003","7754.3","0.8","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C40 H248 K15 Li15 O282 P8 Ru4 W49 -","- C40 H56 K9 O240 P8 Ru4 W49 -","- C40 H56 K9 O240 P8 Ru4 W49 -","1","0.5","","Mal, Sib Sankar; Nsouli, Nadeen H.; Dickman, Michael H.; Kortz, Ulrich","Organoruthenium derivative of the cyclic [H7P8W48O184]33- anion: [{K(H2O)}3{Ru(p-cymene)(H2O)}4P8W49O186(H2O)2]27-.","Dalton transactions (Cambridge, England : 2003)","2007","","25","2627","2630","10.1039/b706762n","","","0.71073","MoKα","","0.1141","0.065","","","0.1742","0.2121","","","","","","1.061","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005911","7.0298","0.0007","10.7158","0.0011","14.6871","0.0015","69.514","0.002","82.715","0.002","71.202","0.002","981","0.17","299","2","299","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H14 B F9 N2 Pd -","- C16 H14 B F9 N2 Pd -","- C32 H28 B2 F18 N4 Pd2 -","2","1","","Albéniz, Ana C; Espinet, Pablo; Martín-Ruiz, Blanca","Pd-H elimination reactions in palladium(II) allylic complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3710","3714","10.1039/b706817d","","","0.71073","MoKα","","0.0463","0.0438","","","0.1249","0.1278","","","","","","1.051","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005912","7.1018","0.0018","21.654","0.005","12.22","0.003","90","","102.445","0.005","90","","1835.1","0.8","566","2","566","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 Br F5 P Pd -","- C15 H17 Br F5 P Pd -","- C60 H68 Br4 F20 P4 Pd4 -","4","1","","Albéniz, Ana C; Espinet, Pablo; Martín-Ruiz, Blanca","Pd-H elimination reactions in palladium(II) allylic complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3710","3714","10.1039/b706817d","","","0.71073","MoKα","","0.1052","0.0576","","","0.1385","0.1612","","","","","","0.951","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005913","12.401","0.0004","9.81","0.0004","14.257","0.0005","90","","122.615","0.0016","90","","1460.92","0.1","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H40 Cl4 Co2 N2 O2 P2 -","- C20 H40 Cl4 Co2 N2 O2 P2 -","- C40 H80 Cl8 Co4 N4 O4 P4 -","2","0.5","","Jie, Suyun; Agostinho, Magno; Kermagoret, Anthony; Cazin, Catherine S. J.; Braunstein, Pierre","Mono- and dinuclear cobalt complexes with chelating or bridging bidentate P,N phosphino- and phosphinito-oxazoline ligands: synthesis, structures and catalytic ethylene oligomerisation.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4472","4482","10.1039/b706818b","","","0.71073","MoKα","","0.0857","0.0456","","","0.0974","0.1135","","","","","","1.049","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005914","13.131","0.0004","10.075","0.0003","13.43","0.0005","90","","100.306","0.0011","90","","1748.05","0.1","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H32 Cl4 Co2 N2 O2 P2 -","- C32 H32 Cl4 Co2 N2 O2 P2 -","- C64 H64 Cl8 Co4 N4 O4 P4 -","2","0.5","","Jie, Suyun; Agostinho, Magno; Kermagoret, Anthony; Cazin, Catherine S. J.; Braunstein, Pierre","Mono- and dinuclear cobalt complexes with chelating or bridging bidentate P,N phosphino- and phosphinito-oxazoline ligands: synthesis, structures and catalytic ethylene oligomerisation.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4472","4482","10.1039/b706818b","","","0.71073","MoKα","","0.0795","0.0478","","","0.1126","0.1255","","","","","","1.052","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005915","7.069","0.0002","28.783","0.0006","10.856","0.0002","90","","120.501","0.0009","90","","1903.18","0.08","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 Cl2 Co N O P -","- C18 H20 Cl2 Co N O P -","- C72 H80 Cl8 Co4 N4 O4 P4 -","4","1","","Jie, Suyun; Agostinho, Magno; Kermagoret, Anthony; Cazin, Catherine S. J.; Braunstein, Pierre","Mono- and dinuclear cobalt complexes with chelating or bridging bidentate P,N phosphino- and phosphinito-oxazoline ligands: synthesis, structures and catalytic ethylene oligomerisation.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4472","4482","10.1039/b706818b","","","0.71073","MoKα","","0.0997","0.0446","","","0.0957","0.1162","","","","","","1.007","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005916","11.37","0.0003","18.188","0.0005","9.729","0.0004","90","","95.476","0.0011","90","","2002.75","0.11","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 Cl2 Co N O2 P -","- C18 H20 Cl2 Co N O2 P -","- C72 H80 Cl8 Co4 N4 O8 P4 -","4","1","","Jie, Suyun; Agostinho, Magno; Kermagoret, Anthony; Cazin, Catherine S. J.; Braunstein, Pierre","Mono- and dinuclear cobalt complexes with chelating or bridging bidentate P,N phosphino- and phosphinito-oxazoline ligands: synthesis, structures and catalytic ethylene oligomerisation.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4472","4482","10.1039/b706818b","","","0.71073","MoKα","","0.085","0.0401","","","0.0872","0.1036","","","","","","1.01","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005917","8.997","0.0002","14.514","0.0004","16.788","0.0004","90","","93.215","0.0015","90","","2188.77","0.09","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H24 Cl2 Co N O2 P -","- C20 H24 Cl2 Co N O2 P -","- C80 H96 Cl8 Co4 N4 O8 P4 -","4","1","","Jie, Suyun; Agostinho, Magno; Kermagoret, Anthony; Cazin, Catherine S. J.; Braunstein, Pierre","Mono- and dinuclear cobalt complexes with chelating or bridging bidentate P,N phosphino- and phosphinito-oxazoline ligands: synthesis, structures and catalytic ethylene oligomerisation.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4472","4482","10.1039/b706818b","","","0.71073","MoKα","","0.0881","0.045","","","0.1063","0.1234","","","","","","1.029","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005918","14.238","0.0006","12.896","0.0006","13.104","0.0009","90","","111.826","0.0016","90","","2233.6","0.2","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H23 Cl3 Co N O2 P -","- C18 H23 Cl3 Co N O2 P -","- C72 H92 Cl12 Co4 N4 O8 P4 -","4","1","","Jie, Suyun; Agostinho, Magno; Kermagoret, Anthony; Cazin, Catherine S. J.; Braunstein, Pierre","Mono- and dinuclear cobalt complexes with chelating or bridging bidentate P,N phosphino- and phosphinito-oxazoline ligands: synthesis, structures and catalytic ethylene oligomerisation.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4472","4482","10.1039/b706818b","","","0.71073","MoKα","","0.1905","0.0746","","","0.1186","0.149","","","","","","0.956","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005919","8.615","0.001","18.264","0.003","12.58","0.002","90","","104.325","0.005","90","","1917.8","0.5","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 Cl4 Co2 N2 O4 P2 -","- C36 H40 Cl4 Co2 N2 O4 P2 -","- C72 H80 Cl8 Co4 N4 O8 P4 -","2","0.5","","Jie, Suyun; Agostinho, Magno; Kermagoret, Anthony; Cazin, Catherine S. J.; Braunstein, Pierre","Mono- and dinuclear cobalt complexes with chelating or bridging bidentate P,N phosphino- and phosphinito-oxazoline ligands: synthesis, structures and catalytic ethylene oligomerisation.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4472","4482","10.1039/b706818b","","","0.71069","MoKα","","0.1192","0.0731","","","0.1594","0.1785","","","","","","1.016","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005920","11.716","0.002","13.693","0.003","13.8","0.003","90","","99.44","0.03","90","","2183.9","0.8","153","1","153","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C64 H88 Eu4 O40 -","- C64 H88 Eu4 O40 -","- C64 H88 Eu4 O40 -","1","0.25","","Yang, Xiao-Ping; Jones, Richard A.; Rivers, Joseph H.; Lai, Rachel Pen-jen","Syntheses, structures and luminescent properties of new lanthanide-based coordination polymers based on 1,4-benzenedicarboxylate (bdc).","Dalton transactions (Cambridge, England : 2003)","2007","","35","3936","3942","10.1039/b706823a","","","0.71073","MoKα","","0.0604","0.0377","","","0.0947","0.1031","","","","","","1.061","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005921","11.573","0.002","16.726","0.003","12.162","0.002","90","","110.55","0.03","90","","2204.4","0.8","153","1","193","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H24.5 Cl Eu O9.25 -","- C13 H24.5 Cl Eu O9.25 -","- C52 H98 Cl4 Eu4 O37 -","4","1","","Yang, Xiao-Ping; Jones, Richard A.; Rivers, Joseph H.; Lai, Rachel Pen-jen","Syntheses, structures and luminescent properties of new lanthanide-based coordination polymers based on 1,4-benzenedicarboxylate (bdc).","Dalton transactions (Cambridge, England : 2003)","2007","","35","3936","3942","10.1039/b706823a","","","0.71073","MoKα","","0.1201","0.0555","","","0.1483","0.1813","","","","","","1.025","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005922","11.518","0.002","16.889","0.003","12.161","0.002","90","","111.59","0.03","90","","2199.7","0.8","153","1","153","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H24.5 Cl Gd O9.25 -","- C13 H24.5 Cl Gd O9.25 -","- C52 H98 Cl4 Gd4 O37 -","4","1","","Yang, Xiao-Ping; Jones, Richard A.; Rivers, Joseph H.; Lai, Rachel Pen-jen","Syntheses, structures and luminescent properties of new lanthanide-based coordination polymers based on 1,4-benzenedicarboxylate (bdc).","Dalton transactions (Cambridge, England : 2003)","2007","","35","3936","3942","10.1039/b706823a","","","0.71073","MoKα","","0.0768","0.0467","","","0.1311","0.1449","","","","","","1.089","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005923","11.451","0.002","16.845","0.003","12.168","0.002","90","","111.12","0.03","90","","2189.5","0.8","153","1","153","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H24.5 Cl O9.25 Tb -","- C13 H24.5 Cl O9.25 Tb -","- C52 H98 Cl4 O37 Tb4 -","4","1","","Yang, Xiao-Ping; Jones, Richard A.; Rivers, Joseph H.; Lai, Rachel Pen-jen","Syntheses, structures and luminescent properties of new lanthanide-based coordination polymers based on 1,4-benzenedicarboxylate (bdc).","Dalton transactions (Cambridge, England : 2003)","2007","","35","3936","3942","10.1039/b706823a","","","0.71073","MoKα","","0.0943","0.052","","","0.1339","0.1495","","","","","","1.112","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005924","10.017","0.002","10.55","0.002","11.273","0.002","93.13","0.03","104.24","0.03","117.94","0.03","999.9","0.5","153","1","153","1","","","","","","","","5","P -1","-P 1","2","","","","- C12 H17 Eu N2 O10 -","- C12 H17 Eu N2 O10 -","- C24 H34 Eu2 N4 O20 -","2","1","","Yang, Xiao-Ping; Jones, Richard A.; Rivers, Joseph H.; Lai, Rachel Pen-jen","Syntheses, structures and luminescent properties of new lanthanide-based coordination polymers based on 1,4-benzenedicarboxylate (bdc).","Dalton transactions (Cambridge, England : 2003)","2007","","35","3936","3942","10.1039/b706823a","","","0.71073","MoKα","","0.0812","0.0576","","","0.1387","0.1478","","","","","","1.126","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005925","10.019","0.002","10.545","0.002","11.263","0.002","93.07","0.03","104.27","0.03","118.08","0.03","997.3","0.5","153","1","153","1","","","","","","","","5","P -1","-P 1","2","","","","- C12 H17 Gd N2 O10 -","- C12 H17 Gd N2 O10 -","- C24 H34 Gd2 N4 O20 -","2","1","","Yang, Xiao-Ping; Jones, Richard A.; Rivers, Joseph H.; Lai, Rachel Pen-jen","Syntheses, structures and luminescent properties of new lanthanide-based coordination polymers based on 1,4-benzenedicarboxylate (bdc).","Dalton transactions (Cambridge, England : 2003)","2007","","35","3936","3942","10.1039/b706823a","","","0.71073","MoKα","","0.0489","0.0383","","","0.1004","0.1067","","","","","","1.172","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005926","9.9655","0.0007","9.9655","0.0007","7.7523","0.0007","90","","90","","120","","666.74","0.09","120","2","120","2","","","","","","","","5","P 63/m m c","-P 6c 2c","194","catena-((tris(mu$3!-3-amino-1,2,4-triazolato-N$1!,N$2!,N$4!))- chloro dicobalt(ii))","catena-((tris(μ^3^-3-amino-1,2,4-triazolato-N^1^,N^2^,N^4^))- chloro dicobalt(II))","","- C6 H9 Cl Co2 N12 -","- C6 H9 Cl Co2 N12 -","- C12 H18 Cl2 Co4 N24 -","2","0.0833333","","Patel, Rina; Weller, Mark T.; Price, Daniel J.","Topological ferrimagnetism and superparamagnetic-like behaviour in a disordered homometallic coordination network.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4034","4039","10.1039/b706829h","","","0.71073","MoKα","","0.0904","0.0722","","","0.1357","0.141","","","","","","1.257","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005927","17.4122","0.0004","12.0231","0.0003","13.4818","0.0003","90","","94.558","0.001","90","","2813.47","0.11","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C79 H60 Fe2 N8 -","- C79 H60 Fe2 N8 -","- C158 H120 Fe4 N16 -","2","0.5","","Auger, Aurélien; Muller, Alfred J.; Swarts, Jannie C.","Remarkable isolation, structural characterisation and electrochemistry of unexpected scrambling analogues of 5-ferrocenyl-10,20-diphenylporphyrin.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3623","3633","10.1039/b706840a","","","0.71073","MoKα","","","0.0297","","","","0.0891","","","","","","1.057","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005928","7.487","0.002","7.7626","0.0012","9.0689","0.0018","95.528","0.016","108.55","0.02","107.759","0.016","464.84","0.19","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- Hg3 O5 Se4 -","- Hg3 O5 Se4 -","- Hg6 O10 Se8 -","2","1","","Zou, Jian-Ping; Guo, Guo-Cong; Guo, Sheng-Ping; Lu, Ying-Bing; Wu, Ke-Jun; Wang, Ming-Sheng; Huang, Jin-Shun","Synthesis, crystal and band structures, and optical properties of a new mixed-framework mercury selenide diselenite, (Hg3Se2)(Se2O5).","Dalton transactions (Cambridge, England : 2003)","2007","","42","4854","4858","10.1039/b706844a","","","0.71073","MoKα","","0.052","0.0362","","","0.0833","0.0905","","","","","","1.002","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005929","12.8331","0.0019","32.704","0.005","13.692","0.002","90","","111.703","0.002","90","","5339.1","1.4","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C61 H54 Cl6 Ir O P3 -","- C61 H54 Cl6 Ir O P3 -","- C244 H216 Cl24 Ir4 O4 P12 -","4","1","","Gong, Lei; Wu, Liqiong; Lin, Yumei; Zhang, Hong; Yang, Fangzu; Wen, Tingbin; Xia, Haiping","Synthesis and characterization of a bimetallic iridium complex with a ten sp2-carbon chain bridge","Dalton Transactions","2007","","37","4122","","10.1039/b706900f","","","0.71073","MoKα","","0.0939","0.0837","","","0.1924","0.1965","","","","","","1.043","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005930","21.421","0.004","14.267","0.003","18.226","0.003","90","","106.765","0.003","90","","5333.4","1.7","223","2","223","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C51 H82 Cl2 Ir O2 P3 -","- C51 H82 Cl2 Ir O2 P3 -","- C204 H328 Cl8 Ir4 O8 P12 -","4","1","","Gong, Lei; Wu, Liqiong; Lin, Yumei; Zhang, Hong; Yang, Fangzu; Wen, Tingbin; Xia, Haiping","Synthesis and characterization of a bimetallic iridium complex with a ten sp2-carbon chain bridge","Dalton Transactions","2007","","37","4122","","10.1039/b706900f","","","0.71073","MoKα","","0.0397","0.035","","","0.0897","0.0926","","","","","","1.07","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005931","14.197","0.002","19.24","0.003","23.412","0.004","90","","99.442","0.003","90","","6308.4","1.7","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C99 H147 Cl19 Ir2 O4 P6 -","- C99 H147 Cl19 Ir2 O4 P6 -","- C198 H294 Cl38 Ir4 O8 P12 -","2","0.5","","Gong, Lei; Wu, Liqiong; Lin, Yumei; Zhang, Hong; Yang, Fangzu; Wen, Tingbin; Xia, Haiping","Synthesis and characterization of a bimetallic iridium complex with a ten sp2-carbon chain bridge","Dalton Transactions","2007","","37","4122","","10.1039/b706900f","","","0.71073","MoKα","","0.051","0.045","","","0.1285","0.1321","","","","","","1.09","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005932","11.0177","0.0005","11.7122","0.0005","12.5018","0.0006","100.848","0.001","103.36","0.001","117.514","0.001","1308.22","0.11","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H25 Br2 N3 O Pd S2 -","- C23 H25 Br2 N3 O Pd S2 -","- C46 H50 Br4 N6 O2 Pd2 S4 -","2","1","","Yen, Swee Kuan; Koh, Lip Lin; Huynh, Han Vinh; Hor, T. S. Andy","Pd(II) complexes of N,S-heterocyclic carbenes with pendant and coordinated allyl function and their Suzuki coupling activities.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3952","3958","10.1039/b706968e","","","0.71073","MoKα","","0.0348","0.0275","","","0.0697","0.0722","","","","","","1.065","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005933","8.5895","0.0005","16.0336","0.0009","17.2939","0.0009","90","","90","","90","","2381.7","0.2","223","2","223","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C10 H9 Br2 N Pd S -","- C10 H9 Br2 N Pd S -","- C80 H72 Br16 N8 Pd8 S8 -","8","1","","Yen, Swee Kuan; Koh, Lip Lin; Huynh, Han Vinh; Hor, T. S. Andy","Pd(II) complexes of N,S-heterocyclic carbenes with pendant and coordinated allyl function and their Suzuki coupling activities.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3952","3958","10.1039/b706968e","","","0.71073","MoKα","","0.0324","0.0253","","","0.0595","0.0616","","","","","","1.028","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005934","8.541","0.0009","9.6467","0.001","12.0119","0.0013","88.974","0.003","82.492","0.003","75.166","0.002","948.38","0.17","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H14 Br2 N2 Pd S2 -","- C17 H14 Br2 N2 Pd S2 -","- C34 H28 Br4 N4 Pd2 S4 -","2","1","","Yen, Swee Kuan; Koh, Lip Lin; Huynh, Han Vinh; Hor, T. S. Andy","Pd(II) complexes of N,S-heterocyclic carbenes with pendant and coordinated allyl function and their Suzuki coupling activities.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3952","3958","10.1039/b706968e","","","0.71073","MoKα","","0.1314","0.0908","","","0.1861","0.2038","","","","","","1.156","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005935","14.9606","0.0008","12.3187","0.0007","21.1877","0.0011","90","","102.287","0.002","90","","3815.3","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36.5 H53 I2 N2 O Y -","- C33 H49 I2 N2 O Y -","- C132 H196 I8 N8 O4 Y4 -","4","1","","Liddle, Stephen T.; Arnold, Polly L.","Synthesis and characterisation of yttrium complexes supported by the beta-diketiminate ligand {ArNC(CH3)CHC(CH3)NAr}- (Ar = 2,6-Pr(i)2C6H3).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3305","3313","10.1039/b706971e","","","0.71073","MoKα","","0.0404","0.0311","","","0.0721","0.0748","","","","","","1.069","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005936","9.5924","0.0012","32.446","0.004","12.0506","0.0015","90","","106.91","0.002","90","","3588.4","0.8","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H51 I2 N2 O2 Y -","- C33 H51 I2 N2 O2 Y -","- C132 H204 I8 N8 O8 Y4 -","4","1","","Liddle, Stephen T.; Arnold, Polly L.","Synthesis and characterisation of yttrium complexes supported by the beta-diketiminate ligand {ArNC(CH3)CHC(CH3)NAr}- (Ar = 2,6-Pr(i)2C6H3).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3305","3313","10.1039/b706971e","","","0.71073","MoKα","","0.0562","0.0431","","","0.1039","0.1111","","","","","","1.045","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005937","13.2787","0.001","20.653","0.0015","15.3612","0.0012","90","","104.6","0.002","90","","4076.7","0.5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C81.5 H119.5 K2 O2 P2 -","- C80 H116 K2 O2 P2 -","- C160 H232 K4 O4 P4 -","2","0.5","","Liddle, Stephen T.; Arnold, Polly L.","Synthesis and characterisation of yttrium complexes supported by the beta-diketiminate ligand {ArNC(CH3)CHC(CH3)NAr}- (Ar = 2,6-Pr(i)2C6H3).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3305","3313","10.1039/b706971e","","","0.71073","MoKα","","0.0661","0.0545","","","0.157","0.1672","","","","","","1.078","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005938","10.1103","0.0006","12.5075","0.0007","29.0482","0.0016","95.484","0.002","91.431","0.002","102.875","0.002","3560.5","0.4","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C73 H107 I N2 O2 P Y -","- C73 H107 I N2 O2 P Y -","- C146 H214 I2 N4 O4 P2 Y2 -","2","1","","Liddle, Stephen T.; Arnold, Polly L.","Synthesis and characterisation of yttrium complexes supported by the beta-diketiminate ligand {ArNC(CH3)CHC(CH3)NAr}- (Ar = 2,6-Pr(i)2C6H3).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3305","3313","10.1039/b706971e","","","0.71073","MoKα","","0.0703","0.0472","","","0.1167","0.1294","","","","","","1.024","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005939","22.653","0.004","16.124","0.003","20.12","0.003","90","","107.668","0.002","90","","7002","2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C72 H106 K N4 O4 Y -","- C72 H106 K N4 O4 Y -","- C288 H424 K4 N16 O16 Y4 -","4","0.5","","Liddle, Stephen T.; Arnold, Polly L.","Synthesis and characterisation of yttrium complexes supported by the beta-diketiminate ligand {ArNC(CH3)CHC(CH3)NAr}- (Ar = 2,6-Pr(i)2C6H3).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3305","3313","10.1039/b706971e","","","0.71073","MoKα","","0.0653","0.0401","","","0.0935","0.1034","","","","","","0.989","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005940","13.7763","0.0008","21.4051","0.0012","12.5537","0.0007","90","","98.384","0.002","90","","3662.3","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C74 H104 I2 N4 O2 Y2 -","- C74 H104 I2 N4 O2 Y2 -","- C148 H208 I4 N8 O4 Y4 -","2","0.5","","Liddle, Stephen T.; Arnold, Polly L.","Synthesis and characterisation of yttrium complexes supported by the beta-diketiminate ligand {ArNC(CH3)CHC(CH3)NAr}- (Ar = 2,6-Pr(i)2C6H3).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3305","3313","10.1039/b706971e","","","0.71073","MoKα","","0.0479","0.0364","","","0.0909","0.0987","","","","","","1.029","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005941","10.38","0.003","12.439","0.003","12.842","0.004","90","","105.72","0.03","90","","1596.1","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","dimethylsulfoxide,S-(eta2-oxalate,O,O')-(1,4,7-tritiacyclononane,S,S',S'')- -ruthenium(II) hydrated","","- C10 H18 O5.5 Ru S4 -","- C10 H18 O5.5 Ru S4 -","- C40 H72 O22 Ru4 S16 -","4","1","","Bratsos, Ioannis; Birarda, Giovanni; Jedner, Stephanie; Zangrando, Ennio; Alessio, Enzo","Half-sandwich RuII-[9]aneS3 complexes with dicarboxylate ligands: synthesis, characterization and chemical behavior.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4048","4058","10.1039/b707011j","","","0.71073","MoKα","","0.0681","0.045","","","0.116","0.1241","","","","","","0.988","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005942","9.16","0.003","8.1","0.003","23.357","0.005","90","","104.8","0.02","90","","1675.5","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dimethylsulfoxide,S-malonate,O,O'-(1,4,7-tritiacyclononane,S,S',S'')- -ruthenium(II) hydrated","","- C11 H22 O6 Ru S4 -","- C11 H22 O6 Ru S4 -","- C44 H88 O24 Ru4 S16 -","4","1","","Bratsos, Ioannis; Birarda, Giovanni; Jedner, Stephanie; Zangrando, Ennio; Alessio, Enzo","Half-sandwich RuII-[9]aneS3 complexes with dicarboxylate ligands: synthesis, characterization and chemical behavior.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4048","4058","10.1039/b707011j","","","0.71073","MoKα","","0.0467","0.033","","","0.0764","0.0799","","","","","","0.924","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005943","10.247","0.003","10.176","0.003","12.723","0.004","108.11","0.02","103.24","0.03","101.69","0.03","1172.4","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","dimethylsulfoxide,S-methylmalonate,O,O'-(1,4,7-tritiacyclononane,S,S',S'')- -ruthenium(II) potassium triflate","","- C13 H22 F3 K O8 Ru S5 -","- C13 H22 F3 K O8 Ru S5 -","- C26 H44 F6 K2 O16 Ru2 S10 -","2","1","","Bratsos, Ioannis; Birarda, Giovanni; Jedner, Stephanie; Zangrando, Ennio; Alessio, Enzo","Half-sandwich RuII-[9]aneS3 complexes with dicarboxylate ligands: synthesis, characterization and chemical behavior.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4048","4058","10.1039/b707011j","","","0.71073","MoKα","","0.0619","0.0502","","","0.1427","0.1484","","","","","","0.982","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005944","8.386","0.003","10.893","0.004","12.009","0.004","66.32","0.03","76.37","0.03","87.55","0.03","974.7","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","bis[fac-(1,4,7-tritiacyclononane)-(dimethylsulfoxide,S)-ruthenium(II)] -(mu-oxalate) bis(triflate)","","- C20 H36 F6 O12 Ru2 S10 -","- C20 H36 F6 O12 Ru2 S10 -","- C20 H36 F6 O12 Ru2 S10 -","1","0.5","","Bratsos, Ioannis; Birarda, Giovanni; Jedner, Stephanie; Zangrando, Ennio; Alessio, Enzo","Half-sandwich RuII-[9]aneS3 complexes with dicarboxylate ligands: synthesis, characterization and chemical behavior.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4048","4058","10.1039/b707011j","","","0.71073","MoKα","","0.1509","0.0734","","","0.1813","0.1934","","","","","","1.162","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005945","16.558","0.004","41.174","0.007","12.341","0.003","90","","90","","90","","8414","3","293","2","293","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","fac-(1,4,7-tritiacyclononane)-(dimethylsulfoxide,S)-ruthenium(II)-(mu-oxalate)- fac-tris(dimethylsulfoxide,S)-(triflate,O)-ruthenium(II) triflate chloroform solvate","","- C18.5 H36.5 Cl1.5 F6 O14 Ru2 S9 -","- C18.5 H36.5 Cl1.5 F6 O14 Ru2 S9 -","- C148 H292 Cl12 F48 O112 Ru16 S72 -","8","1","","Bratsos, Ioannis; Birarda, Giovanni; Jedner, Stephanie; Zangrando, Ennio; Alessio, Enzo","Half-sandwich RuII-[9]aneS3 complexes with dicarboxylate ligands: synthesis, characterization and chemical behavior.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4048","4058","10.1039/b707011j","","","0.71073","MoKα","","0.1004","0.0596","","","0.1681","0.1805","","","","","","0.879","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005946","15.284","0.003","16.305","0.003","19.628","0.004","90","","91.22","0.02","90","","4890.3","1.7","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","fac-(1,4,7-tritiacyclononane)-(dimethylsulfoxide,S)-ruthenium(II)-(mu-oxalate)- fac-tris(dimethylsulfoxide,S)-(dimethylsulfoxide,O)-ruthenium(II) bis(triflate) bis(nitromethane) solvate","","- C22 H48 F6 N2 O19 Ru2 S10 -","- C22 H48 F6 N2 O19 Ru2 S10 -","- C88 H192 F24 N8 O76 Ru8 S40 -","4","1","","Bratsos, Ioannis; Birarda, Giovanni; Jedner, Stephanie; Zangrando, Ennio; Alessio, Enzo","Half-sandwich RuII-[9]aneS3 complexes with dicarboxylate ligands: synthesis, characterization and chemical behavior.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4048","4058","10.1039/b707011j","","","0.71073","MoKα","","0.0767","0.0631","","","0.1954","0.2053","","","","","","0.985","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005947","23.4483","0.0015","21.8764","0.0013","23.693","0.0014","90","","111.056","0.001","90","","11342.2","1.2","150","2","150","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C12 H130 As4 Ce4 K2 N4 Na10 O211 W44 -","- C12 H28 As4 Ce4 K2 N4 Na10 O196.3 W44 -","- C24 H56 As8 Ce8 K4 N8 Na20 O392.6 W88 -","2","0.5","","Chen, Weilin; Li, Yangguang; Wang, Yonghui; Wang, Enbo; Su, Zhongmin","Building block approach to nanostructures: step-by-step assembly of large lanthanide-containing polytungstoarsenate aggregates.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4293","4301","10.1039/b707150g","","","0.71073","MoKα","","0.1512","0.0843","","","0.2039","0.236","","","","","","1.108","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005948","12.314","0.003","17.953","0.004","22.355","0.005","90.18","0.03","101.97","0.03","91.08","0.03","4834","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- As4 Ce4 H120 K9 Na7 O196 W38 -","- As4 Ce4 K9 Na7 O183 W38 -","- As4 Ce4 K9 Na7 O183 W38 -","1","0.5","","Chen, Weilin; Li, Yangguang; Wang, Yonghui; Wang, Enbo; Su, Zhongmin","Building block approach to nanostructures: step-by-step assembly of large lanthanide-containing polytungstoarsenate aggregates.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4293","4301","10.1039/b707150g","","","0.71073","MoKα","","0.1403","0.0755","","","0.1485","0.177","","","","","","1.036","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005949","20.636","0.004","23","0.004","25.039","0.004","81.991","0.003","73.333","0.003","74.835","0.003","10962","3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- As4 Ce4 H100 K5 Mn0.5 Na18 O199 W41 -","- As4 Ce4 K5 Mn0.5 Na16.21 O168.53 W41 -","- As8 Ce8 K10 Mn Na32.42 O337.06 W82 -","2","1","","Chen, Weilin; Li, Yangguang; Wang, Yonghui; Wang, Enbo; Su, Zhongmin","Building block approach to nanostructures: step-by-step assembly of large lanthanide-containing polytungstoarsenate aggregates.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4293","4301","10.1039/b707150g","","","0.71073","MoKα","","0.2194","0.0972","","","0.2047","0.277","","","","","","1.035","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005950","10.9129","0.0011","15.0557","0.0015","16.4468","0.0017","90","","91.8","0.002","90","","2700.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","((Zn2(OA)(bipy)(H2O))-0.5(bipy))","","","- C31 H20 N3 O10 Zn2 -","- C31 H20 N3 O10 Zn2 -","- C124 H80 N12 O40 Zn8 -","4","1","","Chu, Qian; Liu, Guang-Xiang; Huang, Yong-Qing; Wang, Xiao-Feng; Sun, Wei-Yin","Syntheses, structures, and optical properties of novel zinc(ii) complexes with multicarboxylate and N-donor ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4302","4311","10.1039/b707159k","","","0.71073","MoKα","","0.0385","0.0334","","","0.0852","0.0874","","","","","","1.037","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005951","11.4425","0.0017","15.209","0.002","16.019","0.002","90","","107.143","0.003","90","","2663.9","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H20 N4 O11 Zn2 -","- C28 H18 N4 O11 Zn2 -","- C112 H72 N16 O44 Zn8 -","4","1","","Chu, Qian; Liu, Guang-Xiang; Huang, Yong-Qing; Wang, Xiao-Feng; Sun, Wei-Yin","Syntheses, structures, and optical properties of novel zinc(ii) complexes with multicarboxylate and N-donor ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4302","4311","10.1039/b707159k","","","0.71073","MoKα","","0.0734","0.0474","","","0.1035","0.1099","","","","","","0.937","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005952","10.8373","0.0014","24.482","0.003","14.661","0.0018","90","","95.565","0.002","90","","3871.5","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H40 N8 O12 Zn2 -","- C36 H34 N8 O12 Zn2 -","- C144 H136 N32 O48 Zn8 -","4","1","","Chu, Qian; Liu, Guang-Xiang; Huang, Yong-Qing; Wang, Xiao-Feng; Sun, Wei-Yin","Syntheses, structures, and optical properties of novel zinc(ii) complexes with multicarboxylate and N-donor ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4302","4311","10.1039/b707159k","","","0.71073","MoKα","","0.088","0.0599","","","0.1391","0.1533","","","","","","1.006","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7005953","14.3155","0.0016","13.1762","0.0015","17.355","0.002","90","","91.976","0.002","90","","3271.6","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Zn2(OA)(phen)2(H2O)","Zn2(OA)(phen)2(H2O)","","- C40 H24 N4 O10 Zn2 -","- C40 H24 N4 O10 Zn2 -","- C160 H96 N16 O40 Zn8 -","4","1","","Chu, Qian; Liu, Guang-Xiang; Huang, Yong-Qing; Wang, Xiao-Feng; Sun, Wei-Yin","Syntheses, structures, and optical properties of novel zinc(ii) complexes with multicarboxylate and N-donor ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4302","4311","10.1039/b707159k","","","0.71073","MoKα","","0.0687","0.0519","","","0.1089","0.1149","","","","","","1.065","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005954","14.3048","0.0014","23.8232","0.0014","14.5836","0.001","90","","100.253","0.002","90","","4890.5","0.7","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C52 H34 N4 O21 Zn4 -","- C52 H34 N4 O21 Zn4 -","- C208 H136 N16 O84 Zn16 -","4","1","","Chu, Qian; Liu, Guang-Xiang; Huang, Yong-Qing; Wang, Xiao-Feng; Sun, Wei-Yin","Syntheses, structures, and optical properties of novel zinc(ii) complexes with multicarboxylate and N-donor ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4302","4311","10.1039/b707159k","","","0.71073","MoKα","","0.0521","0.0505","","","0.1223","0.123","","","","","","0.949","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005955","9.186","0.003","19.876","0.005","11.545","0.003","90","","92.72","0.03","90","","2105.5","1","122","0.5","122","0.5","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H27 Cl3 Co N5 O14 -","- C9 H27 Cl3 Co N5 O14 -","- C36 H108 Cl12 Co4 N20 O56 -","4","1","","Gumm, Andreas; Hammershøi, Anders; Kofod-Hansen, Mikael; Mønsted, Ole; Osholm Sørensen, Henning","First aminoacetone chelate: [Co(tren){NH2CH2C(O)CH3}]3±a substrate binding and activation model for zinc(II)-dependent 5-aminolaevulinic acid dehydratase.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3227","3231","10.1039/b707186h","","","0.71073","MoKα","","0.0542","0.0362","","","0.0557","0.0587","","","","","","1.553","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005956","10.206","0.002","15.864","0.003","15.607","0.003","90","","105.716","0.003","90","","2432.4","0.8","213","2","213","2","","","","","","","","4","I 1 2/m 1","-I 2y","12","","","","- C44 H80 Mo2 N12 -","- C44 H80 Mo2 N12 -","- C88 H160 Mo4 N24 -","2","0.25","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.0464","0.0368","","","0.0835","0.0862","","","","","","1.006","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005957","12.015","0.002","14.213","0.002","27.98","0.005","88.823","0.003","88.47","0.003","65.487","0.003","4345.7","1.2","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C76 H92 B F24 Mo2 N12 -","- C76 H92 B F24 Mo2 N12 -","- C152 H184 B2 F48 Mo4 N24 -","2","1","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.1161","0.1048","","","0.2323","0.2378","","","","","","1.311","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005958","12.02","0.004","14.276","0.005","28.222","0.01","90.799","0.007","90.432","0.006","114.659","0.006","4400","3","213","2","213","2","","","","","","","","7","P -1","-P 1","2","","","","- C77 H94 B Cl2 F24 Mo2 N12 -","- C77 H94 B Cl2 F24 Mo2 N12 -","- C154 H188 B2 Cl4 F48 Mo4 N24 -","2","1","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.1237","0.105","","","0.266","0.279","","","","","","1.183","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005959","14.506","0.002","14.554","0.003","15.193","0.003","86.936","0.003","87.882","0.003","62.453","0.003","2839.6","0.9","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C108 H104 B2 F48 Mo2 N12 -","- C108 H104 B2 F48.006 Mo2 N12 -","- C108 H104 B2 F48.006 Mo2 N12 -","1","0.5","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.063","0.0534","","","0.139","0.1495","","","","","","1.056","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005960","11.2621","0.0019","14.365","0.002","20.885","0.004","97.18","0.003","100.508","0.003","103.563","0.003","3179.3","0.9","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C60 H112 Mo2 N12 -","- C60 H112 Mo2 N12 -","- C120 H224 Mo4 N24 -","2","1","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.0783","0.0438","","","0.0889","0.0984","","","","","","0.97","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005961","21.2869","0.001","21.2869","0.001","23.846","0.002","90","","90","","90","","10805.4","1.2","213","2","213","2","","","","","","","","8","P 4/n :2","-P 4a","85","","","","- C96 H136 B F24 Mo2 N12 O2 S2 -","- C96 H92 B F24 Mo2 N12 O2 S2 -","- C384 H368 B4 F96 Mo8 N48 O8 S8 -","4","0.5","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.1529","0.0732","","","0.1783","0.2447","","","","","","1.052","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005962","18.8345","0.0016","8.1735","0.0007","17.42","0.0015","90","","90","","90","","2681.7","0.4","213","2","213","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C10 H22 Cl N3 O2 -","- C10 H22 Cl N3 O2 -","- C80 H176 Cl8 N24 O16 -","8","","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.0569","0.038","","","0.0836","0.094","","","","","","1.042","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005963","19.4244","0.0018","19.4244","0.0018","6.8427","0.0013","90","","90","","90","","2581.8","0.6","213","2","213","2","","","","","","","","4","P 42/n :2","-P 4bc","86","","","","- C10 H21 N3 O2 -","- C10 H21 N3 O2 -","- C80 H168 N24 O16 -","8","1","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.1289","0.0595","","","0.1561","0.182","","","","","","0.987","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005964","14.8977","0.001","20.0088","0.0014","9.9762","0.0007","90","","97.611","0.001","90","","2947.6","0.4","213","2","213","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C20 H52 Cd N8 O7 -","- C20 H50 Cd N8 O7 -","- C80 H200 Cd4 N32 O28 -","4","1","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.0152","0.0148","","","0.0392","0.0396","","","","","","1.07","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005965","13.853","0.003","15.973","0.004","13.067","0.003","90","","99.038","0.004","90","","2855.5","1.2","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H23 N3 O3 -","- C12 H23 N3 O3 -","- C96 H184 N24 O24 -","8","2","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.1553","0.0604","","","0.1218","0.1533","","","","","","0.961","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005966","12.5762","0.0009","21.295","0.004","6.689","0.0007","90","","90","","90","","1791.4","0.4","213","2","213","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C14 H32 Cl N3 O3 -","- C14 H30 Cl N3 O3 -","- C56 H120 Cl4 N12 O12 -","4","0.5","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.0438","0.0406","","","0.1049","0.1085","","","","","","1.109","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005967","10.351","0.002","12.056","0.003","16.131","0.004","78.651","0.005","77.981","0.006","84.069","0.006","1926.3","0.8","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H72 Cd N8 O7 -","- C30 H72 Cd N8 O7 -","- C60 H144 Cd2 N16 O14 -","2","1","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.0341","0.0318","","","0.0885","0.0904","","","","","","1.111","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005968","5.8325","0.0016","10.569","0.003","12.505","0.004","93.964","0.005","96.108","0.005","97.355","0.005","757.5","0.4","213","2","213","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H29 N3 -","- C15 H29 N3 -","- C30 H58 N6 -","2","1","","Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.","Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3943","3951","10.1039/b707201e","","","0.71073","MoKα","","0.0663","0.0495","","","0.1493","0.1601","","","","","","1.153","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7005969","8.993","0.0018","9.1411","0.0018","16.002","0.003","90","","99.17","0.03","90","","1298.6","0.5","294","2","294","2","","","","","","","","7","P 1 n 1","P -2yac","7","","","","- C24 H20 F6 Mn N6 O2 P -","- C24 H20 F6 Mn N6 O2 P -","- C48 H40 F12 Mn2 N12 O4 P2 -","2","1","","Hazra, Sumita; Naskar, Subhendu; Mishra, Dipankar; Gorelsky, Serge I.; Figgie, Heike M.; Sheldrick, William S.; Chattopadhyay, Shyamal Kumar","Synthesis, X-ray crystal structure and DFT calculations of bis(N-(2-picolyl)picolinamido)Mn(iii) hexafluorophosphate","Dalton Transactions","2007","","37","4143","","10.1039/b707229e","","","0.71073","MoK\α","","0.1452","0.0752","","","0.1702","0.2","","","","","","0.947","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7005970","10.409","0.002","13.165","0.003","13.445","0.003","75.65","0.03","72.6","0.03","72.72","0.03","1653","0.7","200","2","200","2","","","","","","","","8","P -1","-P 1","2","","","","- C18.5 H28 B Cl7 N6 O S3 Ti -","- C18.5 H28 B Cl7 N6 O S3 Ti -","- C37 H56 B2 Cl14 N12 O2 S6 Ti2 -","2","1","","Hill, Anthony F.; Smith, Matthew K.","A homoleptic hydrotris(methimazolyl)borate complex of titanium.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3363","3364","10.1039/b707265a","","","0.71073","MoKα","","0.07","0.0432","","","0.1007","0.1145","","","","","","1.03","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005971","13.1226","0.0005","17.2989","0.0007","21.3799","0.0008","89.893","0.001","87.216","0.001","72.929","0.001","4633.7","0.3","183","2","183","2","","","","","","","","9","P -1","-P 1","2","","","","- C94.5 H87 Cl3 F12 N2 O P6 Pt2 S2 -","- C94.5 H87 Cl3 F12 N2 O P6 Pt2 S2 -","- C189 H174 Cl6 F24 N4 O2 P12 Pt4 S4 -","2","1","","Chong, Siew Huay; Henderson, William; Hor, T. S. Andy","Stable diplatinum complexes with functional thiolato bridges from dialkylation of [Pt2(mu-S)2(P-P)2] [P-P=2 x PPh3, Ph2P(CH2)3PPh2].","Dalton transactions (Cambridge, England : 2003)","2007","","36","4008","4016","10.1039/b707526j","","","0.71073","MoKα","","0.0564","0.044","","","0.1267","0.1332","","","","","","1.069","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7005972","23.038","0.003","12.9432","0.0017","23.952","0.003","90","","110.173","0.003","90","","6704","1.5","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C75 H64 F6 N P5 Pt2 S2 -","- C75 H64 F6 N P5 Pt2 S2 -","- C300 H256 F24 N4 P20 Pt8 S8 -","4","1","","Chong, Siew Huay; Henderson, William; Hor, T. S. Andy","Stable diplatinum complexes with functional thiolato bridges from dialkylation of [Pt2(mu-S)2(P-P)2] [P-P=2 x PPh3, Ph2P(CH2)3PPh2].","Dalton transactions (Cambridge, England : 2003)","2007","","36","4008","4016","10.1039/b707526j","","","0.71073","MoKα","","0.0883","0.0443","","","0.0959","0.1107","","","","","","0.962","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7005973","17.5679","0.0016","19.0008","0.0016","21.5327","0.0019","90","","90.508","0.003","90","","7187.4","1.1","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C77 H69 F6 O2 P5 Pt2 S2 -","- C77 H69 F6 O2 P5 Pt2 S2 -","- C308 H276 F24 O8 P20 Pt8 S8 -","4","0.5","","Chong, Siew Huay; Henderson, William; Hor, T. S. Andy","Stable diplatinum complexes with functional thiolato bridges from dialkylation of [Pt2(mu-S)2(P-P)2] [P-P=2 x PPh3, Ph2P(CH2)3PPh2].","Dalton transactions (Cambridge, England : 2003)","2007","","36","4008","4016","10.1039/b707526j","","","0.71073","MoKα","","0.0702","0.0435","","","0.1117","0.1243","","","","","","0.985","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7005974","13.537","0.0011","14.0622","0.0012","24.08","0.002","81.118","0.002","85.273","0.002","61.71","0.002","3987.7","0.6","223","2","223","2","","","","","","","","8","P -1","-P 1","2","","","","- C83 H79 Cl4 F6 O2.5 P5 Pt2 S2 -","- C83 H79 Cl4 F6 O2.5 P5 Pt2 S2 -","- C166 H158 Cl8 F12 O5 P10 Pt4 S4 -","2","1","","Chong, Siew Huay; Henderson, William; Hor, T. S. Andy","Stable diplatinum complexes with functional thiolato bridges from dialkylation of [Pt2(mu-S)2(P-P)2] [P-P=2 x PPh3, Ph2P(CH2)3PPh2].","Dalton transactions (Cambridge, England : 2003)","2007","","36","4008","4016","10.1039/b707526j","","","0.71073","MoKα","","0.0627","0.0475","","","0.1192","0.1265","","","","","","1.043","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005975","13.5578","0.0011","24.083","0.002","27.457","0.002","112.135","0.002","101.057","0.002","94.877","0.002","8027.3","1.1","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C72 H74 Cl8 F12 P6 Pt2 S2 -","- C72 H74 Cl8 F12 P6 Pt2 S2 -","- C288 H296 Cl32 F48 P24 Pt8 S8 -","4","2","","Chong, Siew Huay; Henderson, William; Hor, T. S. Andy","Stable diplatinum complexes with functional thiolato bridges from dialkylation of [Pt2(mu-S)2(P-P)2] [P-P=2 x PPh3, Ph2P(CH2)3PPh2].","Dalton transactions (Cambridge, England : 2003)","2007","","36","4008","4016","10.1039/b707526j","","","0.71073","MoKα","","0.135","0.0814","","","0.2158","0.2439","","","","","","1.046","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7005976","15.254","0.003","18.595","0.002","22.165","0.003","90","","90","","90","","6287.1","1.6","163","2","163","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H56 K N4 O4 Sm -","- C24 H56 K N4 O4 Sm -","- C192 H448 K8 N32 O32 Sm8 -","8","2","","Venugopal, Ajay; Willner, Alexander; Hepp, Alexander; Mitzel, Norbert W.","Hydroxylaminato yttrate and samarate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3124","3126","10.1039/b707575h","","","0.71073","MoKα","","0.1529","0.0743","","","0.1154","0.1403","","","","","","1.028","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005977","21.745","0.004","22.44","0.004","28.767","0.006","90","","90","","90","","14037","5","153","2","153","2","","","","","","","","6","P b c n","-P 2n 2ab","60","Potassium-tetrakis(N,N-diisopropylaminoxy)yttrate","Potassium-tetrakis(N,N-diisopropylaminoxy)yttrate","","- C54.5 H125 K2 N8 O9 Y2 -","- C27.25 H62.5 K N4 O4.5 Y -","- C436 H1000 K16 N64 O72 Y16 -","16","2","","Venugopal, Ajay; Willner, Alexander; Hepp, Alexander; Mitzel, Norbert W.","Hydroxylaminato yttrate and samarate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","29","3124","3126","10.1039/b707575h","","","0.71073","MoKα","","0.1954","0.0727","","","0.1473","0.1899","","","","","","0.96","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005978","9.4428","0.0003","14.853","0.0005","17.7593","0.0006","90","","100.595","0.001","90","","2448.35","0.14","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H33 O6 P Pd S -","- C25 H33 O6 P Pd S -","- C100 H132 O24 P4 Pd4 S4 -","4","1","","García Suárez, Eduardo J; Ruiz, Aurora; Castillón, Sergio; Oberhauser, Werner; Bianchini, Claudio; Claver, Carmen","New alkyl derivatives phosphine sulfonate (P-O) ligands. Catalytic activity in Pd-catalysed Suzuki-Miyaura reactions in water.","Dalton transactions (Cambridge, England : 2003)","2007","","27","2859","2861","10.1039/b707590c","","","0.71073","MoKα","","0.0494","0.0436","","","0.1199","0.1363","","","","","","1.154","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005979","10.0632","0.0005","12.1301","0.0007","12.6705","0.0007","90","","90","","90","","1546.66","0.15","173","2","173","2","","","","","","","","4","P m n n","-P 2n 2","58","heptasodium hexaniobate","","","- H62 Na14 Nb12 O68 -","- H48 Na14 Nb12 O68 -","- H48 Na14 Nb12 O68 -","1","0.125","","Anderson, Travis M.; Rodriguez, Mark A.; Bonhomme, François; Bixler, Joel N.; Alam, Todd M.; Nyman, May","An aqueous route to [Ta6O19]8- and solid-state studies of isostructural niobium and tantalum oxide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4517","4522","10.1039/b707636c","","","0.71069","MoKα","","0.0173","0.0165","","","0.0479","0.0483","","","","","","1.217","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7005980","10.0215","0.0016","12.007","0.002","12.761","0.002","90","","90","","90","","1535.5","0.4","173","2","173","2","","","","","","","","4","P m n n","-P 2n 2","58","octasodium hexatantalate","","","- H30 Na8 O34 Ta6 -","- H16 Na8 O34 Ta6 -","- H32 Na16 O68 Ta12 -","2","0.25","","Anderson, Travis M.; Rodriguez, Mark A.; Bonhomme, François; Bixler, Joel N.; Alam, Todd M.; Nyman, May","An aqueous route to [Ta6O19]8- and solid-state studies of isostructural niobium and tantalum oxide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4517","4522","10.1039/b707636c","","","0.71073","MoKα","","0.0198","0.0189","","","0.0499","0.0503","","","","","","1.142","","","","has coordinates","287753","2023-11-23","09:34:44",""
"7005981","12.2313","0.001","13.9015","0.0011","16.127","0.0013","93.132","0.002","95.39","0.002","94.7","0.002","2715.5","0.4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C56 H66 B N4 O4 P Ru Sn -","- C56 H66 B N4 O4 P Ru Sn -","- C112 H132 B2 N8 O8 P2 Ru2 Sn2 -","2","1","","Albertin, Gabriele; Antoniutti, Stefano; Castro, Jesús; García-Fontán, Soledad; Noé, Marco","Preparation of stannyl complexes of ruthenium and osmium stabilised by polypyridine and phosphite ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5441","5452","10.1039/b707736j","","","0.71073","MoKα","","0.1537","0.0575","","","0.11","0.1439","","","","","","0.82","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005982","10.196","0.003","18.758","0.005","19.849","0.005","90","","109.065","0.013","90","","3588","1.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 F6 N3 O2 P Pt -","- C36 H40 F6 N3 O2 P Pt -","- C144 H160 F24 N12 O8 P4 Pt4 -","4","1","","Fan, Yang; Zhu, Yue-Mei; Dai, Feng-Rong; Zhang, Li-Yi; Chen, Zhong-Ning","Photophysical and anion sensing properties of platinum(II) terpyridyl complexes with phenolic ethynyl ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3885","3892","10.1039/b707797a","","","0.71073","MoKα","","0.0849","0.0617","","","0.1683","0.2055","","","","","","1.086","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005983","12.4593","0.0018","12.9493","0.0018","13.503","0.002","75.167","0.011","68.358","0.011","63.88","0.01","1806.7","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H96 B4 Fe2 N12 O2 -","- C74 H96 B4 Fe2 N12 O2 -","- C74 H96 B4 Fe2 N12 O2 -","1","0.5","","Zhang, Fan; Morawitz, Thorsten; Bieller, Susanne; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Metallomacrocycles from ditopic chiral scorpionate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4594","4598","10.1039/b707807b","","","0.71073","MoKα","","0.0919","0.0457","","","0.0818","0.0917","","","","","","0.797","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005984","13.9069","0.0012","15.2037","0.0012","25.5526","0.0018","90","","90","","90","","5402.7","0.7","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C50 H72 B4 Co2 N12 O3 -","- C50 H72 B4 Co2 N12 O3 -","- C200 H288 B16 Co8 N48 O12 -","4","0.5","","Zhang, Fan; Morawitz, Thorsten; Bieller, Susanne; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Metallomacrocycles from ditopic chiral scorpionate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4594","4598","10.1039/b707807b","","","0.71073","MoKα","","0.1195","0.0731","","","0.1262","0.1403","","","","","","1.084","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005985","11.351","0.003","12.44","0.003","13.067","0.003","116.88","0.004","94.893","0.005","107.786","0.004","1511.9","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C26.5 H30.5 N8.5 O9.5 Pd2 -","- C26.5 H28.5 N8.5003 O9.5009 Pd2 -","- C53 H57 N17.0006 O19.0018 Pd4 -","2","1","","Adrian, Rafael A.; Zhu, Shourong; Powell, Douglas R.; Broker, Grant A.; Tiekink, Edward R. T.; Walmsley, Judith A.","Dinuclear palladium(ii) complexes with bridging amidate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4399","4404","10.1039/B707878A","","","0.71073","MoKα","","0.041","0.0361","","","0.0957","0.0996","","","","","","1.062","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7005986","13.099","0.002","22.755","0.004","22.203","0.004","90","","105.854","0.005","90","","6366.3","1.9","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 F6 N6 O8 Pd2 S2 -","- C26 H24 F6 N6 O8 Pd2 S2 -","- C208 H192 F48 N48 O64 Pd16 S16 -","8","2","","Adrian, Rafael A.; Zhu, Shourong; Powell, Douglas R.; Broker, Grant A.; Tiekink, Edward R. T.; Walmsley, Judith A.","Dinuclear palladium(ii) complexes with bridging amidate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4399","4404","10.1039/B707878A","","","0.71073","MoKα","","0.0652","0.0484","","","0.121","0.1322","","","","","","1.059","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005987","11.052","0.002","10.813","0.002","14.687","0.003","90","","105.7","0.03","90","","1689.7","0.6","103","2","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H23 N7 O9 Pd2 -","- C6 H23 N7 O9 Pd2 -","- C24 H92 N28 O36 Pd8 -","4","1","","Adrian, Rafael A.; Zhu, Shourong; Powell, Douglas R.; Broker, Grant A.; Tiekink, Edward R. T.; Walmsley, Judith A.","Dinuclear palladium(ii) complexes with bridging amidate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4399","4404","10.1039/B707878A","","","0.7107","MoKα","","0.043","0.039","","","0.077","0.079","","","","","","1.17","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005988","21.265","0.003","13.134","0.002","20.892","0.003","90","","119.338","0.005","90","","5086.6","1.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C10 H26 F6 N6 O9 Pd2 S2 -","- C10.0002 H26 F6.0006 N6 O9.0006 Pd2 S2.0002 -","- C80.0016 H208 F48.0048 N48 O72.0048 Pd16 S16.0016 -","8","2","","Adrian, Rafael A.; Zhu, Shourong; Powell, Douglas R.; Broker, Grant A.; Tiekink, Edward R. T.; Walmsley, Judith A.","Dinuclear palladium(ii) complexes with bridging amidate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4399","4404","10.1039/B707878A","","","0.71073","MoKα","","0.0272","0.0246","","","0.0661","0.0681","","","","","","1.014","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005989","12.6504","0.0007","25.8725","0.0014","10.1766","0.0005","90","","99.021","0.001","90","","3289.6","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H35 Cu3 N9 O5 S2 -","- C28 H35 Cu3 N9 O5 S2 -","- C112 H140 Cu12 N36 O20 S8 -","4","1","","Croucher, Paul D.; Klingele, Marco H.; Noble, Andy; Brooker, Sally","Tricopper(II) complexes of unsymmetrical macrocycles incorporating phenol and pyridine moieties: the development of two stepwise routes.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4000","4007","10.1039/b707905b","","","0.71073","MoKα","","0.0551","0.0401","","","0.1011","0.1109","","","","","","1.072","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005990","12.2848","0.0002","14.894","0.0004","17.3448","0.0004","99.34","0.001","102.769","0.001","105.893","0.001","2891.57","0.12","173","2","173","2","","","","","","","synthesis as described","8","P -1","-P 1","2","","","","- C124 H128 Cl2 D36 Li2 N4 O2 Pb2 -","- C124 H164 Cl2 Li2 N4 O2 Pb2 -","- C124 H164 Cl2 Li2 N4 O2 Pb2 -","1","0.5","","Fulton, J. Robin; Hitchcock, Peter B.; Johnstone, Nick C.; Tam, Eric C. Y.","The synthesis of monomeric terminal lead aryloxides: dependence on reagents and conditions.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3360","3362","10.1039/b707984b","","x-ray","0.71073","MoKα","","0.042","0.0348","","","0.0813","0.0845","","","","","","1.097","","","","has coordinates,has disorder","179763","2020-10-21","18:00:00",""
"7005991","34.4733","0.0012","12.0183","0.0004","26.7006","0.0008","90","","123.008","0.002","90","","9276.8","0.6","173","2","173","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H70 N2 O Pb -","- C50 H70 N2 O Pb -","- C400 H560 N16 O8 Pb8 -","8","1","","Fulton, J. Robin; Hitchcock, Peter B.; Johnstone, Nick C.; Tam, Eric C. Y.","The synthesis of monomeric terminal lead aryloxides: dependence on reagents and conditions.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3360","3362","10.1039/b707984b","","x-ray","0.71073","MoKα","","0.0509","0.0393","","","0.0871","0.0927","","","","","","1.142","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005992","12.3312","0.0002","12.5867","0.0002","15.1185","0.0003","105.315","0.001","100.911","0.001","108.965","0.001","2040.66","0.07","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C44 H64 N2 O Pb -","- C44 H64 N2 O Pb -","- C88 H128 N4 O2 Pb2 -","2","1","","Fulton, J. Robin; Hitchcock, Peter B.; Johnstone, Nick C.; Tam, Eric C. Y.","The synthesis of monomeric terminal lead aryloxides: dependence on reagents and conditions.","Dalton transactions (Cambridge, England : 2003)","2007","","31","3360","3362","10.1039/b707984b","","x-ray","0.71073","MoKα","","0.0272","0.0234","","","0.05","0.0513","","","","","","1.046","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005993","7.8979","0.0006","7.6099","0.0006","20.9804","0.0016","90","","90","","90","","1260.97","0.17","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C6 H20 N4 Ni O6 -","- C6 H20 N4 Ni O6 -","- C24 H80 N16 Ni4 O24 -","4","1","","Gavrish, Sergey P.; Lampeka, Yaroslaw D.; Lightfoot, Philip; Pritzkow, Hans","Crystal and molecular structures of related nickel(II) complexes of open-chain and macrocyclic oxamide-based ligands and the peculiarities of water aggregates in their crystal lattices.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4708","4714","10.1039/b708006a","","","0.71073","MoKα","","0.0238","0.0233","","","0.0607","0.0609","","","","","","1.062","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005994","9.28","0.004","10.809","0.003","7.634","0.002","95.95","0.02","100.49","0.03","72.66","0.02","717.7","0.4","293.2","","293.2","","","","","","","","","5","P -1","-P 1","2","","","","- C9 H23 N5 Ni O5 -","- C9 H23 N5 Ni O5 -","- C18 H46 N10 Ni2 O10 -","2","1","","Gavrish, Sergey P.; Lampeka, Yaroslaw D.; Lightfoot, Philip; Pritzkow, Hans","Crystal and molecular structures of related nickel(II) complexes of open-chain and macrocyclic oxamide-based ligands and the peculiarities of water aggregates in their crystal lattices.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4708","4714","10.1039/b708006a","","","0.7107","MoKalpha","","","0.0292","","","0.0289","","","","","2.43","2.43","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7005995","22.826","0.004","22.826","0.004","17.511","0.004","90","","90","","120","","7901","3","293","2","293","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C102 H96 N6 Ni3 O6 -","- C102 H96 N6 Ni3 O6 -","- C306 H288 N18 Ni9 O18 -","3","0.5","","Tang, Guangrong; Jin, Guo-Xin","Polymerization of methyl methacrylate catalyzed by nickel complexes with hydroxyindanone-imine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3840","3846","10.1039/b708048d","","","0.71073","MoKα","","0.1228","0.0522","","","0.1074","0.137","","","","","","0.818","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005996","9.878","0.004","11.226","0.005","19.901","0.009","79.86","0.007","78.497","0.007","72.554","0.006","2047","1.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H56 N2 Ni O2 -","- C46 H56 N2 Ni O2 -","- C92 H112 N4 Ni2 O4 -","2","1","","Tang, Guangrong; Jin, Guo-Xin","Polymerization of methyl methacrylate catalyzed by nickel complexes with hydroxyindanone-imine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3840","3846","10.1039/b708048d","","","0.71073","MoKα","","0.139","0.0692","","","0.1553","0.1783","","","","","","0.861","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005997","7.4196","0.0004","19.2216","0.0013","12.3604","0.0008","90","","90","","90","","1762.8","0.19","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C7 H5 Dy N O5 -","- C7 H4 Dy N O5 -","- C56 H32 Dy8 N8 O40 -","8","1","","Cheng, Jian-Wen; Zheng, Shou-Tian; Yang, Guo-Yu","Diversity of crystal structure with different lanthanide ions involving in situ oxidation-hydrolysis reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4059","4066","10.1039/b708165k","","","0.71073","MoKα","","0.0388","0.0358","","","0.0875","0.0898","","","","","","1.227","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005998","7.3785","0.0001","19.1406","0.0003","12.3183","0.0003","90","","90","","90","","1739.7","0.06","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C7 H5 Er N O5 -","- C7 H4 Er N O5 -","- C56 H32 Er8 N8 O40 -","8","1","","Cheng, Jian-Wen; Zheng, Shou-Tian; Yang, Guo-Yu","Diversity of crystal structure with different lanthanide ions involving in situ oxidation-hydrolysis reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4059","4066","10.1039/b708165k","","","0.71073","MoKα","","","0.0466","","","0.0989","0.101","","","","","","1.371","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7005999","17.825","0.014","9.979","0.006","12.985","0.009","90","","112.021","0.014","90","","2141","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H8 Eu N O8 -","- C8 H4 Eu N O8 -","- C64 H32 Eu8 N8 O64 -","8","1","","Cheng, Jian-Wen; Zheng, Shou-Tian; Yang, Guo-Yu","Diversity of crystal structure with different lanthanide ions involving in situ oxidation-hydrolysis reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4059","4066","10.1039/b708165k","","","0.71073","MoKα","","0.0367","0.0331","","","0.0669","0.0688","","","","","","1.169","","","","has coordinates","179763","2020-10-21","18:00:00",""
"7006000","17.811","0.002","9.9576","0.0012","12.9733","0.0016","90","","112.198","0.002","90","","2130.3","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H8 Gd N O8 -","- C8 H4 Gd N O8 -","- C64 H32 Gd8 N8 O64 -","8","1","","Cheng, Jian-Wen; Zheng, Shou-Tian; Yang, Guo-Yu","Diversity of crystal structure with different lanthanide ions involving in situ oxidation-hydrolysis reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4059","4066","10.1039/b708165k","","","0.71073","MoKα","","","0.0467","","","0.111","0.1175","","","","","","1.145","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006001","21.0349","0.0019","9.3939","0.0007","17.5535","0.0011","90","","106.785","0.003","90","","3320.8","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Cu La N2 O9 -","- C14 H8 Cu La N2 O9 -","- C112 H64 Cu8 La8 N16 O72 -","8","1","","Cheng, Jian-Wen; Zheng, Shou-Tian; Yang, Guo-Yu","Diversity of crystal structure with different lanthanide ions involving in situ oxidation-hydrolysis reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4059","4066","10.1039/b708165k","","","0.71073","MoKα","","0.0255","0.024","","","0.057","0.0578","","","","","","1.064","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006002","21.157","0.002","9.2761","0.0008","17.2671","0.0016","90","","106.225","0.005","90","","3253.8","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Cu N2 Nd O9 -","- C14 H8 Cu N2 Nd O9 -","- C112 H64 Cu8 N16 Nd8 O72 -","8","1","","Cheng, Jian-Wen; Zheng, Shou-Tian; Yang, Guo-Yu","Diversity of crystal structure with different lanthanide ions involving in situ oxidation-hydrolysis reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4059","4066","10.1039/b708165k","","","0.71073","MoKα","","0.0299","0.0273","","","0.0624","0.0642","","","","","","1.101","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006003","21.113","0.006","9.306","0.002","17.348","0.005","90","","106.375","0.003","90","","3270.2","1.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Cu N2 O9 Pr -","- C14 H8 Cu N2 O9 Pr -","- C112 H64 Cu8 N16 O72 Pr8 -","8","1","","Cheng, Jian-Wen; Zheng, Shou-Tian; Yang, Guo-Yu","Diversity of crystal structure with different lanthanide ions involving in situ oxidation-hydrolysis reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4059","4066","10.1039/b708165k","","","0.71073","MoKα","","0.0311","0.0275","","","0.0647","0.0669","","","","","","1.059","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006004","17.856","0.006","10.009","0.003","13.003","0.005","90","","111.87","0.005","90","","2156.7","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H8 N O8 Sm -","- C8 H4 N O8 Sm -","- C64 H32 N8 O64 Sm8 -","8","1","","Cheng, Jian-Wen; Zheng, Shou-Tian; Yang, Guo-Yu","Diversity of crystal structure with different lanthanide ions involving in situ oxidation-hydrolysis reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4059","4066","10.1039/b708165k","","","0.71073","MoKα","","0.023","0.0202","","","0.0546","0.0552","","","","","","1.099","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006005","7.4556","0.0019","19.274","0.005","12.401","0.003","90","","90","","90","","1782","0.8","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C7 H5 N O5 Tb -","- C7 H4 N O5 Tb -","- C56 H32 N8 O40 Tb8 -","8","1","","Cheng, Jian-Wen; Zheng, Shou-Tian; Yang, Guo-Yu","Diversity of crystal structure with different lanthanide ions involving in situ oxidation-hydrolysis reaction.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4059","4066","10.1039/b708165k","","","0.71073","MoKα","","0.0346","0.0313","","","0.0795","0.0818","","","","","","1.258","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006006","10.0881","0.0003","10.1529","0.0002","18.7271","0.0004","105.145","0.001","99.051","0.001","93.512","0.001","1817.85","0.08","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C71 H12 F4 -","- C71 H12 F4 -","- C142 H24 F8 -","2","1","","Pimenova, Anna S.; Kozlov, Andrey A.; Goryunkov, Alexey A.; Markov, Vitaliy Yu.; Khavrel, Pavel A.; Avdoshenko, Stanislav M.; Vorobiev, Vsevolod A.; Ioffe, Ilya N.; Sakharov, Sergey G.; Troyanov, Sergey I.; Sidorov, Lev N.","Preparation and structures of [6,6]-open difluoromethylene[60]fullerenes: C60(CF2) and C60(CF2)2","Dalton Transactions","2007","","45","5322","","10.1039/b708167g","","","0.905","synchrotron","","0.085","0.0803","","","0.2114","0.2153","","","","","","1.241","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006007","8.833","0.0003","14.95","0.0005","18.285","0.0008","67.191","0.0011","81.06","0.0013","78.565","0.002","2173.34","0.14","293","2","293","2","","","","","","","","8","P -1","-P 1","2","tpyimi","","","- C32 H46 Br Cu2 F6 N10 O10 S2 -","- C32 H49 Br Cu2 F6 N10 O10 S2 -","- C64 H98 Br2 Cu4 F12 N20 O20 S4 -","2","1","","Verdejo, Begoña; Blasco, Salvador; García-España, Enrique; Lloret, Francisco; Gaviña, Pablo; Soriano, Conxa; Tatay, Sergio; Jiménez, Hermas R; Doménech, Antonio; Latorre, Julio","Imidazolate bridged Cu(II)-Cu(II) and Cu(II)-Zn(II) complexes of a terpyridinophane azamacrocycle: a solution and solid state study.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4726","4737","10.1039/b708186c","","","0.71073","MoKα","","0.1454","0.083","","","0.2143","0.2642","","","","","","1.043","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006008","17.143","0.006","20.214","0.007","25.715","0.009","83.379","0.007","82.208","0.007","65.901","0.008","8041","5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C116 H148 Cl2 N56 Ni14 O42 -","- C96 H84 N56 Ni14 O22 -","- C192 H168 N112 Ni28 O44 -","2","1","","Stamatatos, Theocharis C.; Abboud, Khalil A.; Perlepes, Spyros P.; Christou, George","The highest nuclearity metal oxime clusters: Ni14 and Ni12Na2 complexes from the use of 2-pyridinealdoximate and azide ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3861","3863","10.1039/b708189h","","","0.71073","MoKα","","0.2199","0.0828","","","0.1813","0.2042","","","","","","0.603","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006009","13.7676","0.0012","16.2729","0.0014","17.5222","0.0014","102.327","0.002","108.53","0.002","107.775","0.002","3328.3","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C96 H144 N48 Na2 Ni12 O34 -","- C72 H86 N48 Na2 Ni12 O28 -","- C72 H86 N48 Na2 Ni12 O28 -","1","0.5","","Stamatatos, Theocharis C.; Abboud, Khalil A.; Perlepes, Spyros P.; Christou, George","The highest nuclearity metal oxime clusters: Ni14 and Ni12Na2 complexes from the use of 2-pyridinealdoximate and azide ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3861","3863","10.1039/b708189h","","","0.71073","MoKα","","0.0693","0.0352","","","0.0615","0.0645","","","","","","0.761","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006010","13.818","0.001","22.343","0.002","15.085","0.001","90","","104.46","0.01","90","","4509.7","0.6","123","2","123","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","Silver-bis(3-((diphenylphosphanyl)-methyl)-benzene-1,2-diol)- triflate","Silver-bis{3-[(diphenylphosphanyl)-methyl]-benzene-1,2-diol}-triflate","","- C43 H43 Ag Cl2 F3 N O8 P2 S -","- C43 H43 Ag Cl2 F3 N O8 P2 S -","- C172 H172 Ag4 Cl8 F12 N4 O32 P8 S4 -","4","1","","Chikkali, Samir H.; Gudat, Dietrich; Lissner, Falk; Nieger, Martin; Schleid, Thomas","Boron templated catechol phosphines as bidentate ligands in silver complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3906","3913","10.1039/b708252e","","","0.71073","MoKα","","0.1064","0.0592","","","0.1375","0.1603","","","","","","1.045","","","","has coordinates,has disorder","179764","2020-10-21","18:00:00",""
"7006011","14.3659","0.0003","16.1257","0.0004","19.8458","0.0006","90","","92.338","0.001","90","","4593.7","0.2","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Silver-bis(4-((diphenylphosphanyl)-methyl)-benzene-1,2-diol)- triflate","Silver-bis{4-[(diphenylphosphanyl)-methyl]-benzene-1,2-diol}-triflate","","- C47 H50 Ag F3 O9 P2 S -","- C47 H50 Ag F3 O9 P2 S -","- C188 H200 Ag4 F12 O36 P8 S4 -","4","1","","Chikkali, Samir H.; Gudat, Dietrich; Lissner, Falk; Nieger, Martin; Schleid, Thomas","Boron templated catechol phosphines as bidentate ligands in silver complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3906","3913","10.1039/b708252e","","","0.71073","MoKα","","0.0705","0.0324","","","0.0555","0.0612","","","","","","0.91","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006012","16.3386","0.0002","16.35","0.0002","16.7372","0.0002","84.929","0.001","88.028","0.001","89.833","0.001","4450.97","0.09","123","2","123","2","","","","","","","","6","P -1","-P 1","2","Triethylammonium Bisd-((diphenylphosphine(benzo-(1,3)-dioxa-4- methyl))-2-borate","Triethylammonium Bisd-[(diphenylphosphine{benzo-(1,3)-dioxa-4- methyl}]-2-borate","","- C48 H56 B N O6 P2 -","- C48 H56 B N O6 P2 -","- C192 H224 B4 N4 O24 P8 -","4","2","","Chikkali, Samir H.; Gudat, Dietrich; Lissner, Falk; Nieger, Martin; Schleid, Thomas","Boron templated catechol phosphines as bidentate ligands in silver complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3906","3913","10.1039/b708252e","","","0.71073","MoKα","","0.1036","0.0733","","","0.2187","0.2398","","","","","","1.102","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006013","18.8664","0.0008","15.1936","0.0005","15.0136","0.0005","90","","124.062","0.002","90","","3565.3","0.2","100","2","100","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C41 H37 Ag B N O5 P2 -","- C41 H37 Ag B N O5 P2 -","- C164 H148 Ag4 B4 N4 O20 P8 -","4","1","","Chikkali, Samir H.; Gudat, Dietrich; Lissner, Falk; Nieger, Martin; Schleid, Thomas","Boron templated catechol phosphines as bidentate ligands in silver complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3906","3913","10.1039/b708252e","","","0.71073","MoKα","","0.0715","0.0562","","","0.1217","0.1292","","","","","","1.032","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006014","8.1733","0.0002","43.277","0.001","11.0401","0.0003","90","","94.894","0.002","90","","3890.82","0.17","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C44 H46 B N O4 P2 -","- C44 H46 B N O4 P2 -","- C176 H184 B4 N4 O16 P8 -","4","1","","Chikkali, Samir H.; Gudat, Dietrich; Lissner, Falk; Nieger, Martin; Schleid, Thomas","Boron templated catechol phosphines as bidentate ligands in silver complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3906","3913","10.1039/b708252e","","","0.71073","MoKα","","0.0733","0.0561","","","0.1074","0.114","","","","","","1.048","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006015","12.614","0.002","13.3311","0.0011","14.5257","0.0016","115.522","0.006","113.77","0.011","93.432","0.008","1935","0.5","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H62 B2 K2 O P2 Si4 -","- C22 H62 B2 K2 O P2 Si4 -","- C44 H124 B4 K4 O2 P4 Si8 -","2","1","","Izod, Keith; Wills, Corinne; Clegg, William; Harrington, Ross W.","Alkali metal complexes of a phosphine-borane-stabilised carbanion: influence of co-ligands on structure.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3669","3675","10.1039/b708279g","","","0.71073","MoKα","","0.0582","0.0373","","","0.1042","0.1183","","","","","","1.132","","","","has coordinates,has disorder","179764","2020-10-21","18:00:00",""
"7006016","8.7353","0.0006","11.3832","0.0008","13.5668","0.001","79.174","0.001","79.418","0.001","71.435","0.001","1244.9","0.15","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H86 B2 K2 N4 P2 Si4 -","- C30 H86 B2 K2 N4 P2 Si4 -","- C30 H86 B2 K2 N4 P2 Si4 -","1","0.5","","Izod, Keith; Wills, Corinne; Clegg, William; Harrington, Ross W.","Alkali metal complexes of a phosphine-borane-stabilised carbanion: influence of co-ligands on structure.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3669","3675","10.1039/b708279g","","","0.71073","MoKα","","0.0551","0.0518","","","0.1167","0.1185","","","","","","1.152","","","","has coordinates,has disorder","179764","2020-10-21","18:00:00",""
"7006017","21.817","0.006","9.323","0.004","29.024","0.007","90","","102.034","0.016","90","","5774","3","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C36 H100 B2 K2 N6 P2 Si4 -","- C36 H100 B2 K2 N6 P2 Si4 -","- C144 H400 B8 K8 N24 P8 Si16 -","4","0.5","","Izod, Keith; Wills, Corinne; Clegg, William; Harrington, Ross W.","Alkali metal complexes of a phosphine-borane-stabilised carbanion: influence of co-ligands on structure.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3669","3675","10.1039/b708279g","","","0.71073","MoKα","","0.0607","0.05","","","0.1348","0.1425","","","","","","1.086","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006018","12.526","0.008","15.475","0.009","18.411","0.011","90","","90","","90","","3569","4","120","2","120","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C25 H59 B K O8 P Si2 -","- C25 H59 B K O8 P Si2 -","- C100 H236 B4 K4 O32 P4 Si8 -","4","1","","Izod, Keith; Wills, Corinne; Clegg, William; Harrington, Ross W.","Alkali metal complexes of a phosphine-borane-stabilised carbanion: influence of co-ligands on structure.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3669","3675","10.1039/b708279g","","","0.6905","synchrotron","","0.1193","0.1126","","","0.2661","0.2714","","","","","","1.078","","","","has coordinates,has disorder","179764","2020-10-21","18:00:00",""
"7006019","9.1995","0.001","15.3391","0.0017","20.149","0.002","90","","99.899","0.002","90","","2800.9","0.5","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H50 B N3 Na P Si2 -","- C18 H50 B N3 Na P Si2 -","- C72 H200 B4 N12 Na4 P4 Si8 -","4","1","","Izod, Keith; Wills, Corinne; Clegg, William; Harrington, Ross W.","Alkali metal complexes of a phosphine-borane-stabilised carbanion: influence of co-ligands on structure.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3669","3675","10.1039/b708279g","","","0.71073","MoKα","","0.0621","0.0423","","","0.0968","0.1072","","","","","","1.068","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006020","22.233","0.006","9.272","0.004","29.117","0.01","90","","102.86","0.03","90","","5852","4","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C36 H100 B2 N6 P2 Rb2 Si4 -","- C36 H100 B2 N6 P2 Rb2 Si4 -","- C144 H400 B8 N24 P8 Rb8 Si16 -","4","0.5","","Izod, Keith; Wills, Corinne; Clegg, William; Harrington, Ross W.","Alkali metal complexes of a phosphine-borane-stabilised carbanion: influence of co-ligands on structure.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3669","3675","10.1039/b708279g","","","0.71073","MoKα","","0.0585","0.046","","","0.126","0.1364","","","","","","1.101","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006021","13.1375","0.0002","6.6835","0.0001","21.3776","0.0004","90","","101.793","0.001","90","","1837.43","0.05","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C16 H22 Br3 N Ti -","- C16 H22 Br3 N Ti -","- C64 H88 Br12 N4 Ti4 -","4","1","","Allen, Olivia R.; Gott, Andrew L.; Hartley, John A.; Hartley, Janet M.; Knox, Richard J.; McGowan, Patrick C.","Functionalised cyclopentadienyl titanium compounds as potential anticancer drugs.","Dalton transactions (Cambridge, England : 2003)","2007","","43","5082","5090","10.1039/b708283p","","x-ray","0.71073","MoKα","","0.0533","0.0463","","","0.1307","0.1385","","","","","","1.052","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006022","10.3621","0.0002","14.6464","0.0002","18.202","0.0004","107.877","0.001","94.893","0.001","102.281","0.001","2535.02","0.08","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H37 Cl2 N Si2 Ti -","- C22 H37 Cl2 N Si2 Ti -","- C88 H148 Cl8 N4 Si8 Ti4 -","4","2","","Allen, Olivia R.; Gott, Andrew L.; Hartley, John A.; Hartley, Janet M.; Knox, Richard J.; McGowan, Patrick C.","Functionalised cyclopentadienyl titanium compounds as potential anticancer drugs.","Dalton transactions (Cambridge, England : 2003)","2007","","43","5082","5090","10.1039/b708283p","","x-ray","0.71073","MoKα","","0.0703","0.041","","","0.0921","0.1051","","","","","","1.01","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006023","6.648","0.001","12.313","0.003","16.448","0.003","90","","99.44","0.03","90","","1328.1","0.5","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C22 H38 Cl3 N Si2 Ti -","- C22 H38 Cl3 N Si2 Ti -","- C44 H76 Cl6 N2 Si4 Ti2 -","2","1","","Allen, Olivia R.; Gott, Andrew L.; Hartley, John A.; Hartley, Janet M.; Knox, Richard J.; McGowan, Patrick C.","Functionalised cyclopentadienyl titanium compounds as potential anticancer drugs.","Dalton transactions (Cambridge, England : 2003)","2007","","43","5082","5090","10.1039/b708283p","","x-ray","0.71073","MoKα","","0.034","0.03","","","0.0754","0.0778","","","","","","1.035","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006024","9.166","0.0008","14.806","0.0014","15.5049","0.0015","76.201","0.004","73.291","0.004","77.186","0.004","1930.5","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H34 N8 Ni O7 -","- C42 H30 N8 Ni O7 -","- C84 H60 N16 Ni2 O14 -","2","1","","Deiters, Emmanuel; Bulach, Véronique; Hosseini, Mir Wais","Heterobimetallic coordination networks based on metallaporphyrins bearing four pyridine N-oxide groups as coordinating sites","Dalton Transactions","2007","","37","4126","","10.1039/b708302e","","","0.71073","MoKα","","0.1128","0.0712","","","0.2113","0.2409","","","","","","1.027","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006025","15.2904","0.0004","15.2904","0.0004","16.7746","0.0006","90","","90","","90","","3921.8","0.2","173","2","173","2","","","","","","","","7","I -4 2 d","I -4 2bw","122","","","","- C40 H24 Br4 Hg2 N8 Ni O4 -","- C40 H24 Br4 Hg2 N8 Ni O4 -","- C160 H96 Br16 Hg8 N32 Ni4 O16 -","4","0.25","","Deiters, Emmanuel; Bulach, Véronique; Hosseini, Mir Wais","Heterobimetallic coordination networks based on metallaporphyrins bearing four pyridine N-oxide groups as coordinating sites","Dalton Transactions","2007","","37","4126","","10.1039/b708302e","","","0.71073","MoKα","","0.035","0.0315","","","0.0758","0.0772","","","","","","1.041","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006026","12.8976","0.0003","11.5397","0.0003","17.3986","0.0005","90","","110.138","0.001","90","","2431.2","0.11","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C42 H32 I4 N8 O6 Pb2 Zn -","- C42 H32 I4 N8 O6 Pb2 Zn -","- C84 H64 I8 N16 O12 Pb4 Zn2 -","2","0.5","","Deiters, Emmanuel; Bulach, Véronique; Hosseini, Mir Wais","Heterobimetallic coordination networks based on metallaporphyrins bearing four pyridine N-oxide groups as coordinating sites","Dalton Transactions","2007","","37","4126","","10.1039/b708302e","","","0.71073","MoKα","","0.0841","0.059","","","0.1593","0.1752","","","","","","1.041","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006027","7.688","0.005","11.928","0.007","25.54","0.008","90","","90","","90","","2342","2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H32 N4 O2 Pd2 -","- C24 H32 N4 O2 Pd2 -","- C96 H128 N16 O8 Pd8 -","4","0.5","","Solé, Daniel; Solans, Xavier; Font-Bardia, Mercé","N,N-Dialkyl-2-iodoanilines: a versatile source for the synthesis of Pd(ii) complexes. Synthesis of novel OCP- and CCN-pincer palladium complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4286","4292","10.1039/b708306h","","","0.71073","MoKα","","0.056","0.0539","","","0.1261","0.1407","","","","","","1.219","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006028","10.477","0.004","10.94","0.003","18.559","0.003","90","","106.32","0.02","90","","2041.5","1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C21 H19 I N O P Pd -","- C21 H19 I N O P Pd -","- C84 H76 I4 N4 O4 P4 Pd4 -","4","1","","Solé, Daniel; Solans, Xavier; Font-Bardia, Mercé","N,N-Dialkyl-2-iodoanilines: a versatile source for the synthesis of Pd(ii) complexes. Synthesis of novel OCP- and CCN-pincer palladium complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4286","4292","10.1039/b708306h","","","0.71073","MoKα","","0.0366","0.0338","","","0.0882","0.09","","","","","","1.239","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006029","14.493","0.004","14.905","0.002","33.266","0.007","90.8","0.02","96.83","0.02","91.37","0.02","7132","3","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C124 H120 Cl2 F12 N16 O20 P4 Pd4 S4 -","- C124 H112 Cl2 F12 N16 O20 P4 Pd4 S4 -","- C248 H224 Cl4 F24 N32 O40 P8 Pd8 S8 -","2","1","","Solé, Daniel; Solans, Xavier; Font-Bardia, Mercé","N,N-Dialkyl-2-iodoanilines: a versatile source for the synthesis of Pd(ii) complexes. Synthesis of novel OCP- and CCN-pincer palladium complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4286","4292","10.1039/b708306h","","","0.71073","MoKα","","0.0934","0.0777","","","0.2372","0.251","","","","","","1.028","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006030","17.797","0.004","18.017","0.004","10.999","0.004","102.13","0.03","101.35","0.03","108.22","0.017","3141.6","1.7","293.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C68 H75 N5 P2 Ru3 -","- C68 H75 N5 P2 Ru3 -","- C136 H150 N10 P4 Ru6 -","2","1","","Tanabe, Yoshiaki; Kajitani, Hidenobu; Iwasaki, Masakazu; Ishii, Youichi","Synthesis and reactivities of a bis(cyanamido)-capped triruthenium complex.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4701","4707","10.1039/b708328a","","","0.71069","MoKα","","","0.0372","","","","0.0398","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006031","10.706","0.003","15.137","0.005","15.986","0.005","102.402","0.002","101.621","0.002","107.735","0.004","2308.7","1.2","123.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C47 H62 Cl2 N4 Ru3 -","- C47 H62 Cl2 N4 Ru3 -","- C94 H124 Cl4 N8 Ru6 -","2","1","","Tanabe, Yoshiaki; Kajitani, Hidenobu; Iwasaki, Masakazu; Ishii, Youichi","Synthesis and reactivities of a bis(cyanamido)-capped triruthenium complex.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4701","4707","10.1039/b708328a","","","0.7107","MoKα","","","0.0482","","","","0.0505","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006032","10.842","0.004","17.058","0.006","18.305","0.005","88.78","0.018","88.233","0.018","86.027","0.017","3375","2","123.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C74 H90 B N5 P2 Ru3 -","- C74 H90 B N5 P2 Ru3 -","- C148 H180 B2 N10 P4 Ru6 -","2","1","","Tanabe, Yoshiaki; Kajitani, Hidenobu; Iwasaki, Masakazu; Ishii, Youichi","Synthesis and reactivities of a bis(cyanamido)-capped triruthenium complex.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4701","4707","10.1039/b708328a","","","0.7107","MoKα","","","0.0306","","","","0.035","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006033","10.95","0.005","16.413","0.007","29.531","0.014","90","","90","","90","","5307","4","108.1","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C56 H66 Au N4 P Ru3 -","- C56 H66 Au N4 P Ru3 -","- C224 H264 Au4 N16 P4 Ru12 -","4","1","","Tanabe, Yoshiaki; Kajitani, Hidenobu; Iwasaki, Masakazu; Ishii, Youichi","Synthesis and reactivities of a bis(cyanamido)-capped triruthenium complex.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4701","4707","10.1039/b708328a","","","0.71075","MoKα","","","0.0411","","","","0.0431","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006034","10.1191","0.0006","22.0684","0.0007","14.4059","0.0008","90","","103.726","0.003","90","","3125.1","0.3","133","2","133","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C25 H39 I2 P Se Te2 -","- C25 H39 I2 P Se Te2 -","- C100 H156 I8 P4 Se4 Te8 -","4","1","","Hrib, Cristian G.; Jeske, Jörg; Jones, Peter G.; du Mont, Wolf-W","Telluroselenophosphonium ions: their unusual soft-soft interactions with iodotellurate anions.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3483","3485","10.1039/b708370j","","","0.71073","MoKα","","0.0198","0.0182","","","0.0382","0.0385","","","","","","0.995","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006035","10.9947","0.0008","12.4377","0.001","16.7112","0.0014","90.47","0.003","92.61","0.003","92.474","0.003","2280.6","0.3","133","2","133","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H41 Cl2 I8 P2 Se2 Te3 -","- C19 H41 Cl2 I8 P2 Se2 Te3 -","- C38 H82 Cl4 I16 P4 Se4 Te6 -","2","1","","Hrib, Cristian G.; Jeske, Jörg; Jones, Peter G.; du Mont, Wolf-W","Telluroselenophosphonium ions: their unusual soft-soft interactions with iodotellurate anions.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3483","3485","10.1039/b708370j","","","0.71073","MoKα","","0.0644","0.037","","","0.0827","0.095","","","","","","1.031","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006036","14.8246","0.0015","14.8246","0.0015","16.8024","0.0015","90","","90","","120","","3197.9","0.5","173","2","173","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C36 H30 I6 Te3 -","- C9 H7.5 I1.5 Te0.75 -","- C108 H90 I18 Te9 -","12","0.666667","","Hrib, Cristian G.; Jeske, Jörg; Jones, Peter G.; du Mont, Wolf-W","Telluroselenophosphonium ions: their unusual soft-soft interactions with iodotellurate anions.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3483","3485","10.1039/b708370j","","","0.71073","MoKα","","0.024","0.0174","","","0.0351","0.0361","","","","","","1.024","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006037","14.158","0.0002","14.158","0.0002","26.393","0.0006","90","","90","","120","","4581.66","0.14","150","2","150","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C34 H42 B N O3 Ti -","- C34.5 H34 B N O3 Ti -","- C207 H204 B6 N6 O18 Ti6 -","6","0.333333","","Johnson, Andrew L.; Davidson, Matthew G.; Mahon, Mary F.","Reactivity of boranes with a titanium(IV) amine tris(phenolate) alkoxide complex; formation of a Ti(IV) tetrahydroborate complex, a Ti(III) dimer and a Ti(IV) hydroxide Lewis acid adduct.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5405","5411","10.1039/b708378e","","","0.71073","MoKα","","0.067","0.0481","","","0.1232","0.1343","","","","","","1.047","","","","has coordinates,has disorder","179764","2020-10-21","18:00:00",""
"7006038","10.134","0.0002","13.394","0.0002","13.767","0.0003","66.742","0.001","70.895","0.001","80.504","0.001","1620.87","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C75 H83 N2 O6 Ti2 -","- C75 H83 N2 O6 Ti2 -","- C75 H83 N2 O6 Ti2 -","1","0.5","","Johnson, Andrew L.; Davidson, Matthew G.; Mahon, Mary F.","Reactivity of boranes with a titanium(IV) amine tris(phenolate) alkoxide complex; formation of a Ti(IV) tetrahydroborate complex, a Ti(III) dimer and a Ti(IV) hydroxide Lewis acid adduct.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5405","5411","10.1039/b708378e","","","0.71073","MoKα","","0.07","0.0461","","","0.1102","0.1215","","","","","","1.018","","","","has coordinates,has disorder","179764","2020-10-21","18:00:00",""
"7006039","11.89","0.0005","14.543","0.0004","16.419","0.0007","108.388","0.001","100.737","0.001","99.759","0.003","2566.42","0.17","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C55.5 H43 B F15 N O4 Ti -","- C55.5 H43 B F15 N O4 Ti -","- C111 H86 B2 F30 N2 O8 Ti2 -","2","1","","Johnson, Andrew L.; Davidson, Matthew G.; Mahon, Mary F.","Reactivity of boranes with a titanium(IV) amine tris(phenolate) alkoxide complex; formation of a Ti(IV) tetrahydroborate complex, a Ti(III) dimer and a Ti(IV) hydroxide Lewis acid adduct.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5405","5411","10.1039/b708378e","","","0.71073","MoKα","","0.148","0.0733","","","0.1727","0.2095","","","","","","1.024","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006040","8.898","0.0003","16.817","0.0005","12.048","0.0005","90","","96.538","0.001","90","","1791.11","0.11","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H42 F10 O6 Ti2 -","- C30 H42 F10 O6 Ti2 -","- C60 H84 F20 O12 Ti4 -","2","0.5","","Johnson, Andrew L.; Davidson, Matthew G.; Mahon, Mary F.","Reactivity of boranes with a titanium(IV) amine tris(phenolate) alkoxide complex; formation of a Ti(IV) tetrahydroborate complex, a Ti(III) dimer and a Ti(IV) hydroxide Lewis acid adduct.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5405","5411","10.1039/b708378e","","","0.71073","MoKα","","0.0866","0.0446","","","0.0877","0.1035","","","","","","1.057","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006041","6.4667","0.0002","22.3304","0.0008","7.5362","0.0003","90","","90.073","0.001","90","","1088.26","0.07","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(H2B(3-(NO2)Pz)2)K","","","- C6 H6 B K N6 O4 -","- C6 H6 B K N6 O4 -","- C24 H24 B4 K4 N24 O16 -","4","1","","Pellei, Maura; Alidori, Simone; Papini, Grazia; Lobbia, Giancarlo Gioia; Gorden, John D.; Dias, H. V. Rasika; Santini, Carlo","Silver(I)-organophosphane complexes of electron withdrawing CF3- or NO2-substituted scorpionate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4845","4853","10.1039/b708436f","","","0.71073","MoKα","","0.0256","0.0251","","","0.0666","0.067","","","","","","1.063","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006042","11.28","0.003","5.983","0.002","19.165","0.004","90","","91.41","0.02","90","","1293","0.6","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(H2B(3-(CF3)Pz)2)K","","","- C8 H6 B F6 K N4 -","- C8 H6 B F6 K N4 -","- C32 H24 B4 F24 K4 N16 -","4","1","","Pellei, Maura; Alidori, Simone; Papini, Grazia; Lobbia, Giancarlo Gioia; Gorden, John D.; Dias, H. V. Rasika; Santini, Carlo","Silver(I)-organophosphane complexes of electron withdrawing CF3- or NO2-substituted scorpionate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4845","4853","10.1039/b708436f","","","0.71073","MoKα","","0.043","0.0352","","","0.0856","0.0906","","","","","","1.031","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006043","10.2087","0.0007","20.5503","0.0013","18.9869","0.0012","90","","98.871","0.001","90","","3935.6","0.4","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","(H2B(3-NO2Pz)2)Ag(PPh3)2","","","- C42 H36 Ag B N6 O4 P2 -","- C42 H36 Ag B N6 O4 P2 -","- C168 H144 Ag4 B4 N24 O16 P8 -","4","1","","Pellei, Maura; Alidori, Simone; Papini, Grazia; Lobbia, Giancarlo Gioia; Gorden, John D.; Dias, H. V. Rasika; Santini, Carlo","Silver(I)-organophosphane complexes of electron withdrawing CF3- or NO2-substituted scorpionate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4845","4853","10.1039/b708436f","","","0.71073","MoKα","","0.0374","0.0325","","","0.081","0.0861","","","","","","1.031","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006044","35.4543","0.0015","10.6701","0.0005","15.0076","0.0006","90","","94.616","0.001","90","","5659","0.4","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","(H2B(3-NO2Pz)2)AgPTol3","","","- C27 H27 Ag B N6 O4 P -","- C27 H27 Ag B N6 O4 P -","- C216 H216 Ag8 B8 N48 O32 P8 -","8","1","","Pellei, Maura; Alidori, Simone; Papini, Grazia; Lobbia, Giancarlo Gioia; Gorden, John D.; Dias, H. V. Rasika; Santini, Carlo","Silver(I)-organophosphane complexes of electron withdrawing CF3- or NO2-substituted scorpionate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4845","4853","10.1039/b708436f","","","0.71073","MoKα","","0.0268","0.0252","","","0.0664","0.0677","","","","","","1.055","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006045","10.8365","0.0006","15.3387","0.0009","18.2405","0.0011","68.022","0.001","82.255","0.001","70.454","0.001","2649.4","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","(H2B(3-(CF3)Pz)2)AgPPh3","","","- C26 H21 Ag B F6 N4 P -","- C26 H21 Ag B F6 N4 P -","- C104 H84 Ag4 B4 F24 N16 P4 -","4","2","","Pellei, Maura; Alidori, Simone; Papini, Grazia; Lobbia, Giancarlo Gioia; Gorden, John D.; Dias, H. V. Rasika; Santini, Carlo","Silver(I)-organophosphane complexes of electron withdrawing CF3- or NO2-substituted scorpionate ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4845","4853","10.1039/b708436f","","","0.71073","MoKα","","0.0416","0.0378","","","0.0971","0.1017","","","","","","1.048","","","","has coordinates,has disorder","179764","2020-10-21","18:00:00",""
"7006046","14.632","0.006","23.621","0.009","25.817","0.012","90","","98.836","0.004","90","","8817","6","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C61 H88 Cl N4 O29 Rh13 Sn -","- C61 H88 Cl N4 O29 Rh13 Sn -","- C244 H352 Cl4 N16 O116 Rh52 Sn4 -","4","0.5","","Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Tiozzo, Cristina; Zacchini, Stefano; Heaton, Brian T.; Iggo, Jonathan A.","Sn-centred icosahedral Rh carbonyl clusters: synthesis and structural characterization and 13C-{103Rh} HMQC NMR studies.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3914","3923","10.1039/b708469b","","","0.71073","MoKα","","0.409","0.1077","","","0.2356","0.4117","","","","","","0.94","","","","has coordinates,has disorder","179764","2020-10-21","18:00:00",""
"7006047","13.3914","0.0013","27.005","0.003","27.377","0.003","119.525","0.001","98.2","0.002","95.354","0.002","8371.5","1.5","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C63 H86 N6 O27 Rh12 Sn -","- C63 H86 N6 O27 Rh12 Sn -","- C252 H344 N24 O108 Rh48 Sn4 -","4","2","","Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Tiozzo, Cristina; Zacchini, Stefano; Heaton, Brian T.; Iggo, Jonathan A.","Sn-centred icosahedral Rh carbonyl clusters: synthesis and structural characterization and 13C-{103Rh} HMQC NMR studies.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3914","3923","10.1039/b708469b","","","0.71073","MoKα","","0.0859","0.0709","","","0.1858","0.1929","","","","","","1.155","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006048","20.589","0.009","20.33","0.009","12.847","0.005","90","","128.122","0.006","90","","4230","3","103","2","103","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C63 H97 Br2 N5 O24 Rh12 Sn -","- C63 H97 Br2 N5 O24 Rh12 Sn -","- C126 H194 Br4 N10 O48 Rh24 Sn2 -","2","0.5","","Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Tiozzo, Cristina; Zacchini, Stefano; Heaton, Brian T.; Iggo, Jonathan A.","Sn-centred icosahedral Rh carbonyl clusters: synthesis and structural characterization and 13C-{103Rh} HMQC NMR studies.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3914","3923","10.1039/b708469b","","","0.71073","MoKα","","0.1439","0.0791","","","0.1655","0.1824","","","","","","0.862","","","","has coordinates,has disorder","179764","2020-10-21","18:00:00",""
"7006049","20.705","0.007","20.386","0.004","12.87","0.003","90","","128.429","0.003","90","","4255.6","1.9","103","2","103","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C63 H97 Cl2 N5 O24 Rh12 Sn -","- C63 H97 Cl2 N5 O24 Rh12 Sn -","- C126 H194 Cl4 N10 O48 Rh24 Sn2 -","2","0.5","","Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Tiozzo, Cristina; Zacchini, Stefano; Heaton, Brian T.; Iggo, Jonathan A.","Sn-centred icosahedral Rh carbonyl clusters: synthesis and structural characterization and 13C-{103Rh} HMQC NMR studies.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3914","3923","10.1039/b708469b","","","0.71073","MoKα","","0.0686","0.0621","","","0.1508","0.1578","","","","","","1.008","","","","has coordinates,has disorder","179764","2020-10-21","18:00:00",""
"7006050","17.7298","0.0014","9.492","0.0007","13.3902","0.001","90","","130.888","0.005","90","","1703.6","0.3","100","0.2","100","0.2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H20 Fe N2 O6 Sn -","- C12 H20 Fe N2 O6 Sn -","- C48 H80 Fe4 N8 O24 Sn4 -","4","0.5","","Khrustalev, Victor N.; Portnyagin, Ivan A.; Nechaev, Mikhail S.; Bukalov, Sergey S.; Leites, Larissa A.","Can Sn(OCH2CH2NMe2)2 behave as a stannylene? Equatorial-axial isomerism in the tin(II)-iron(0) complex (Me2NCH2CH2O)2Sn-Fe(CO)4.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3489","3492","10.1039/b708513c","","","0.71073","MoKα","","0.0154","0.0141","","","0.0326","0.033","","","","","","1.005","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006051","16.5051","0.0014","9.7283","0.0008","21.4561","0.0019","90","","98.393","0.005","90","","3408.2","0.5","100","0.2","100","0.2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H20 Fe N2 O6 Sn -","- C12 H20 Fe N2 O6 Sn -","- C96 H160 Fe8 N16 O48 Sn8 -","8","1","","Khrustalev, Victor N.; Portnyagin, Ivan A.; Nechaev, Mikhail S.; Bukalov, Sergey S.; Leites, Larissa A.","Can Sn(OCH2CH2NMe2)2 behave as a stannylene? Equatorial-axial isomerism in the tin(II)-iron(0) complex (Me2NCH2CH2O)2Sn-Fe(CO)4.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3489","3492","10.1039/b708513c","","","0.71073","MoKα","","0.0443","0.029","","","0.0529","0.057","","","","","","1.002","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006052","6.7058","0.0012","15.462","0.003","12.189","0.002","90","","102.753","0.002","90","","1232.6","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H11 Cl4 O2 Ta -","- C6 H11 Cl4 O2 Ta -","- C24 H44 Cl16 O8 Ta4 -","4","1","","Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","Reactivity of niobium(v) and tantalum(v) halides with carbonyl compounds: synthesis of simple coordination adducts, C-H bond activation, C=O protonation, and halide transfer.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4343","4351","10.1039/b708531a","","","0.71073","MoKα","","0.0231","0.0221","","","0.0577","0.0583","","","","","","1.116","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006053","11.3387","0.0015","11.3387","0.0015","32.002","0.008","90","","90","","120","","3563.2","1.1","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C18 H27 F7 O6 Ta2 -","- C18 H27 F7 O6 Ta2 -","- C108 H162 F42 O36 Ta12 -","6","0.333333","","Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","Reactivity of niobium(v) and tantalum(v) halides with carbonyl compounds: synthesis of simple coordination adducts, C-H bond activation, C=O protonation, and halide transfer.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4343","4351","10.1039/b708531a","","","0.71073","MoKα","","0.0455","0.0343","","","0.0855","0.0931","","","","","","1.03","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006054","8.9858","0.0011","11.067","0.0014","11.0162","0.0014","90","","91.807","0.002","90","","1095","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 Cl6 O2 Ta -","- C16 H17 Cl6 O2 Ta -","- C32 H34 Cl12 O4 Ta2 -","2","0.5","","Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","Reactivity of niobium(v) and tantalum(v) halides with carbonyl compounds: synthesis of simple coordination adducts, C-H bond activation, C=O protonation, and halide transfer.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4343","4351","10.1039/b708531a","","","0.71073","MoKα","","0.0424","0.0241","","","0.0539","0.0633","","","","","","1.155","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006055","14.504","0.003","9.6665","0.0018","17.5","0.005","90","","107.741","0.002","90","","2336.9","0.9","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H21 F6 O2 Ta -","- C26 H21 F6 O2 Ta -","- C104 H84 F24 O8 Ta4 -","4","0.5","","Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","Reactivity of niobium(v) and tantalum(v) halides with carbonyl compounds: synthesis of simple coordination adducts, C-H bond activation, C=O protonation, and halide transfer.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4343","4351","10.1039/b708531a","","","0.71073","MoKα","","0.0172","0.0168","","","0.0439","0.0443","","","","","","1.079","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006056","29.442","0.003","8.8967","0.001","12.8833","0.0014","90","","103.032","0.002","90","","3287.7","0.6","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H10 Cl5 O Ta -","- C13 H10 Cl5 O Ta -","- C104 H80 Cl40 O8 Ta8 -","8","1","","Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","Reactivity of niobium(v) and tantalum(v) halides with carbonyl compounds: synthesis of simple coordination adducts, C-H bond activation, C=O protonation, and halide transfer.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4343","4351","10.1039/b708531a","","","0.71073","MoKα","","0.0181","0.0172","","","0.0388","0.0392","","","","","","1.179","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006057","9.2706","0.001","8.7918","0.0009","9.881","0.001","90","","102.466","0.002","90","","786.37","0.14","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H4 Cd N O5 P -","- C6 H4 Cd N O5 P -","- C24 H16 Cd4 N4 O20 P4 -","4","1","","Yang, Yi-Fan; Ma, Yun-Sheng; Bao, Song-Song; Zheng, Li-Min","Microwave-assisted hydrothermal syntheses of metal phosphonates with layered and framework structures","Dalton Transactions","2007","","37","4222","","10.1039/b708688a","","","0.71073","MoKα","","0.0232","0.0226","","","0.0582","0.0586","","","","","","1.139","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006058","8.137","0.002","6.5104","0.0016","9.101","0.002","90","","115.664","0.004","90","","434.56","0.18","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C6 H6 N O6 P Zn -","- C6 H6 N O6 P Zn -","- C12 H12 N2 O12 P2 Zn2 -","2","0.5","","Yang, Yi-Fan; Ma, Yun-Sheng; Bao, Song-Song; Zheng, Li-Min","Microwave-assisted hydrothermal syntheses of metal phosphonates with layered and framework structures","Dalton Transactions","2007","","37","4222","","10.1039/b708688a","","","0.71073","MoKα","","0.0343","0.0315","","","0.0819","0.0835","","","","","","1.089","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006059","21.5209","0.0009","21.5209","0.0009","72.662","0.004","90","","90","","120","","29145","2","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C12 H43.83 N8 O43.83 Sb6 V15 -","- C12 H42 N8 O43.8333 Sb6 V15 -","- C216 H756 N144 O789 Sb108 V270 -","18","1","","Kiebach, Ragnar; Näther, Christian; Kögerler, Paul; Bensch, Wolfgang","[V(IV)15Sb(III)6O42]6-: an antimony analogue of the molecular magnet [V15As6O42(H2O)]6-.","Dalton transactions (Cambridge, England : 2003)","2007","","30","3221","3223","10.1039/b708744f","","","0.71073","MoKα","","0.0871","0.06","","","0.1471","0.162","","","","","","1.023","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006060","8.085","0.005","30.75","0.02","15.438","0.009","90","","101","0.03","90","","3768","4","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H30 Cl2 Cu3 N6 O8 -","- C37 H30 Cl2 Cu3 N6 O8 -","- C148 H120 Cl8 Cu12 N24 O32 -","4","1","","Afrati, Tereza; Dendrinou-Samara, Catherine; Raptopoulou, Catherine; Terzis, Aris; Tangoulis, Vassilis; Kessissoglou, Dimitris P.","Copper inverse-9-metallacrown-3 compounds showing antisymmetric magnetic behaviour.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5156","5164","10.1039/b708767e","","","0.71073","MoKα","","0.0841","0.0501","","","0.1134","0.1326","","","","","","1.065","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006061","16.264","0.008","15.696","0.011","17.25","0.011","90","","96.59","0.03","90","","4374","5","298","","298","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H36 Cl2 Cu3 N6 O14 -","- C38 H33 Cl2 Cu3 N6 O14 -","- C152 H132 Cl8 Cu12 N24 O56 -","4","1","","Afrati, Tereza; Dendrinou-Samara, Catherine; Raptopoulou, Catherine; Terzis, Aris; Tangoulis, Vassilis; Kessissoglou, Dimitris P.","Copper inverse-9-metallacrown-3 compounds showing antisymmetric magnetic behaviour.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5156","5164","10.1039/b708767e","","","1.5418","CuKα","","0.0987","0.0793","","","0.2149","0.2385","","","","","","1.05","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006062","40.912","0.004","19.044","0.002","13.6246","0.0012","90","","107.287","0.008","90","","10135.8","1.8","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C55.06 H54.63 Cl0.63 F3 N2 O2 P2 Pt2 -","- C55.063 H54.626 Cl0.626 F3 N2 O2 P2 Pt2 -","- C440.504 H437.008 Cl5.008 F24 N16 O16 P16 Pt16 -","8","1","","Shafaatian, Bita; Akbari, Alireza; Nabavizadeh, S. Masoud; Heinemann, Frank W.; Rashidi, Mehdi","Aryl, methyl-diplatinum complexes each with a metal-metal donor-acceptor bond and bridging 2-diphenylphosphinopyridine (PN) ligands: general synthetic approach and mechanism of isomerization.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4715","4725","10.1039/b708769a","","","0.71073","MoKα","","0.0478","0.0294","","","0.0569","0.0625","","","","","","1.127","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7006063","17.636","0.002","11.141","0.001","22.748","0.002","90","","99.187","0.006","90","","4412.3","0.8","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C50 H45 F3 N2 O2 P2 Pt2 -","- C50 H45 F3 N2 O2 P2 Pt2 -","- C200 H180 F12 N8 O8 P8 Pt8 -","4","1","","Shafaatian, Bita; Akbari, Alireza; Nabavizadeh, S. Masoud; Heinemann, Frank W.; Rashidi, Mehdi","Aryl, methyl-diplatinum complexes each with a metal-metal donor-acceptor bond and bridging 2-diphenylphosphinopyridine (PN) ligands: general synthetic approach and mechanism of isomerization.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4715","4725","10.1039/b708769a","","","0.71073","MoKα","","0.0258","0.0169","","","0.0339","0.0365","","","","","","0.927","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006064","8.1814","0.0001","10.2364","0.0002","18.8554","0.0004","90","","94.176","0.001","90","","1574.91","0.05","123","2","123","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C26 H32 B2 F8 Fe N12 -","- C26 H32 B2 F8 Fe N12 -","- C52 H64 B4 F16 Fe2 N24 -","2","1","","Moubaraki, Boujemaa; Leita, Ben A.; Halder, Gregory J.; Batten, Stuart R.; Jensen, Paul; Smith, Jonathan P.; Cashion, John D.; Kepert, Cameron J.; Létard, Jean-François; Murray, Keith S.","Structure, magnetism and photomagnetism of mixed-ligand tris(pyrazolyl)methane iron(ii) spin crossover compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4413","4426","10.1039/b708773j","","","0.71073","MoKα","","0.0844","0.0532","","","0.1336","0.1521","","","","","","1.09","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006065","10.1222","0.0002","12.0992","0.0004","14.0078","0.0003","89.432","0.002","73.674","0.002","79.715","0.001","1618.44","0.07","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H32 B2 F8 Fe N12 -","- C26 H32 B2 F8 Fe N12 -","- C52 H64 B4 F16 Fe2 N24 -","2","1","","Moubaraki, Boujemaa; Leita, Ben A.; Halder, Gregory J.; Batten, Stuart R.; Jensen, Paul; Smith, Jonathan P.; Cashion, John D.; Kepert, Cameron J.; Létard, Jean-François; Murray, Keith S.","Structure, magnetism and photomagnetism of mixed-ligand tris(pyrazolyl)methane iron(ii) spin crossover compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4413","4426","10.1039/b708773j","","","0.71073","MoKα","","0.1015","0.0464","","","0.1057","0.1278","","","","","","1.074","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006066","10.1881","0.0002","12.0473","0.0003","14.3434","0.0003","94.755","0.001","72.77","0.002","87.116","0.001","1670.51","0.07","260","2","260","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H32 B2 F8 Fe N12 -","- C26 H32 B2 F8 Fe N12 -","- C52 H64 B4 F16 Fe2 N24 -","2","1","","Moubaraki, Boujemaa; Leita, Ben A.; Halder, Gregory J.; Batten, Stuart R.; Jensen, Paul; Smith, Jonathan P.; Cashion, John D.; Kepert, Cameron J.; Létard, Jean-François; Murray, Keith S.","Structure, magnetism and photomagnetism of mixed-ligand tris(pyrazolyl)methane iron(ii) spin crossover compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4413","4426","10.1039/b708773j","","","0.71073","MoKα","","0.1067","0.0539","","","0.1454","0.1687","","","","","","1.068","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006067","12.172","0.002","12.611","0.003","15.108","0.003","88.65","0.03","79.31","0.03","64.01","0.03","2044","0.9","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H42.5 B2 F8 Fe N13.5 -","- C32 H42.5 B2.005 F8 Fe N13.5 -","- C64 H85 B4.01 F16 Fe2 N27 -","2","1","","Moubaraki, Boujemaa; Leita, Ben A.; Halder, Gregory J.; Batten, Stuart R.; Jensen, Paul; Smith, Jonathan P.; Cashion, John D.; Kepert, Cameron J.; Létard, Jean-François; Murray, Keith S.","Structure, magnetism and photomagnetism of mixed-ligand tris(pyrazolyl)methane iron(ii) spin crossover compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4413","4426","10.1039/b708773j","","","0.71073","MoKα","","0.0964","0.0519","","","0.1309","0.1514","","","","","","1.03","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006068","11.931","0.01","12.37","0.011","15.07","0.013","88.648","0.013","78.824","0.013","64.001","0.012","1956","3","25","2","25","2","","","","","","","","6","P -1","-P 1","2","Fe(picpzpz)()(BF!4$)!2$.MeOH","","","- C32 H42.5 B2 F8 Fe N13.5 -","- C32 H42.5 B2 F8 Fe N13.5 -","- C64 H85 B4 F16 Fe2 N27 -","2","1","","Moubaraki, Boujemaa; Leita, Ben A.; Halder, Gregory J.; Batten, Stuart R.; Jensen, Paul; Smith, Jonathan P.; Cashion, John D.; Kepert, Cameron J.; Létard, Jean-François; Murray, Keith S.","Structure, magnetism and photomagnetism of mixed-ligand tris(pyrazolyl)methane iron(ii) spin crossover compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4413","4426","10.1039/b708773j","","","0.71073","MoKα","","0.0558","0.0497","","","0.1294","0.1364","","","","","","1.031","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006069","11.939","0.009","12.345","0.01","15.054","0.012","88.73","0.012","80.016","0.012","63.535","0.011","1952","3","25","2","25","2","","","","","","","","6","P -1","-P 1","2","(Fe(4-Metpm)(dmtpm))(BF!4$)!2$.3/2(MeCN)","","","- C32 H42.5 B2 F8 Fe N13.5 -","- C32 H42.5 B2 F8 Fe N13.5 -","- C64 H85 B4 F16 Fe2 N27 -","2","1","","Moubaraki, Boujemaa; Leita, Ben A.; Halder, Gregory J.; Batten, Stuart R.; Jensen, Paul; Smith, Jonathan P.; Cashion, John D.; Kepert, Cameron J.; Létard, Jean-François; Murray, Keith S.","Structure, magnetism and photomagnetism of mixed-ligand tris(pyrazolyl)methane iron(ii) spin crossover compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4413","4426","10.1039/b708773j","","","0.71073","MoKα","","0.0511","0.0447","","","0.1141","0.1204","","","","","","1.03","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006070","11.918","0.002","12.367","0.002","15.048","0.003","88.76","0.003","79.423","0.003","63.765","0.003","1951.2","0.6","96","2","96","2","","","","","","","","6","P -1","-P 1","2","(Fe(4-Metpm)(dmtpm))(BF!4$)!2$.3/2(MeCN)","","","- C32 H42.5 B2 F8 Fe N13.5 -","- C32 H42.5 B2 F8 Fe N13.5 -","- C64 H85 B4 F16 Fe2 N27 -","2","1","","Moubaraki, Boujemaa; Leita, Ben A.; Halder, Gregory J.; Batten, Stuart R.; Jensen, Paul; Smith, Jonathan P.; Cashion, John D.; Kepert, Cameron J.; Létard, Jean-François; Murray, Keith S.","Structure, magnetism and photomagnetism of mixed-ligand tris(pyrazolyl)methane iron(ii) spin crossover compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4413","4426","10.1039/b708773j","","","0.71073","MoKα","","0.0651","0.0556","","","0.148","0.1592","","","","","","1.034","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006071","12.064","0.005","12.53","0.006","15.084","0.007","88.711","0.007","78.965","0.007","63.981","0.007","2006.3","1.6","200","2","200","2","","","","","","","","6","P -1","-P 1","2","(Fe(4-Metpm)(dmtpm))(BF!4$)!2$.3/2(MeCN)","","","- C32 H42.5 B2 F8 Fe N13.5 -","- C32 H42.5 B2 F8 Fe N13.5 -","- C64 H85 B4 F16 Fe2 N27 -","2","1","","Moubaraki, Boujemaa; Leita, Ben A.; Halder, Gregory J.; Batten, Stuart R.; Jensen, Paul; Smith, Jonathan P.; Cashion, John D.; Kepert, Cameron J.; Létard, Jean-François; Murray, Keith S.","Structure, magnetism and photomagnetism of mixed-ligand tris(pyrazolyl)methane iron(ii) spin crossover compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4413","4426","10.1039/b708773j","","","0.71073","MoKα","","0.0686","0.0558","","","0.1524","0.1679","","","","","","1.036","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006072","10.668","0.002","17.794","0.004","19.935","0.004","90","","90","","90","","3784.2","1.3","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C31 H39 B2 F8 Fe N14 O -","- C31 H39 B2 F8 Fe N14 O -","- C124 H156 B8 F32 Fe4 N56 O4 -","4","1","","Moubaraki, Boujemaa; Leita, Ben A.; Halder, Gregory J.; Batten, Stuart R.; Jensen, Paul; Smith, Jonathan P.; Cashion, John D.; Kepert, Cameron J.; Létard, Jean-François; Murray, Keith S.","Structure, magnetism and photomagnetism of mixed-ligand tris(pyrazolyl)methane iron(ii) spin crossover compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4413","4426","10.1039/b708773j","","","0.71073","MoKα","","0.058","0.0439","","","0.1087","0.1164","","","","","","1.028","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006073","8.5079","0.0017","10.459","0.002","19.534","0.004","90","","96.72","0.03","90","","1726.3","0.6","123","2","123","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C32 H35 B2 F8 Fe N9 -","- C32 H35 B2 F8 Fe N9 -","- C64 H70 B4 F16 Fe2 N18 -","2","1","","Moubaraki, Boujemaa; Leita, Ben A.; Halder, Gregory J.; Batten, Stuart R.; Jensen, Paul; Smith, Jonathan P.; Cashion, John D.; Kepert, Cameron J.; Létard, Jean-François; Murray, Keith S.","Structure, magnetism and photomagnetism of mixed-ligand tris(pyrazolyl)methane iron(ii) spin crossover compounds.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4413","4426","10.1039/b708773j","","","0.71073","MoKα","","0.0317","0.0293","","","0.0747","0.076","","","","","","1.043","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006074","10.557","0.003","11.849","0.003","12.281","0.003","105.264","0.004","101.508","0.004","105.822","0.005","1363.6","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C6 H21 Cu4.5 N31 O0.5 -","- C6 H21 Cu4.5 N31 O0.5 -","- C12 H42 Cu9 N62 O -","2","1","","Gu, Zhi-Guo; Zuo, Jing-Lin; You, Xiao-Zeng","A three-dimensional ferromagnet based on linked copper-azido clusters.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4067","4072","10.1039/b708789f","","","0.71073","MoKα","","0.0721","0.0531","","","0.1389","0.1445","","","","","","1.091","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006075","8.6023","0.001","12.4861","0.0014","16.2429","0.0019","90","","99.411","0.002","90","","1721.2","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Cu3 N20 -","- C4 H12 Cu3 N20 -","- C16 H48 Cu12 N80 -","4","1","","Gu, Zhi-Guo; Zuo, Jing-Lin; You, Xiao-Zeng","A three-dimensional ferromagnet based on linked copper-azido clusters.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4067","4072","10.1039/b708789f","","","0.71073","MoKα","","0.0464","0.0426","","","0.1163","0.1187","","","","","","1.071","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006076","22.909","0.007","13.973","0.004","16.233","0.005","90","","119.901","0.005","90","","4505","2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H47 Ag O30 U3 Zn -","- C22 H47 Ag O30 U3 Zn -","- C88 H188 Ag4 O120 U12 Zn4 -","4","0.5","","Luo, Geng-Geng; Lin, Li-Rong; Huang, Rong-Bin; Zheng, Lan-Sun","Synthesis, crystal structure and optical properties of [Ag(UO2)3(OAc)9][Zn(H2O)4(CH3CH2OH)2]: a novel compound containing closed-shell 3d10, 4d10 and 5d10 metal ions.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3868","3870","10.1039/b708799c","","","0.71073","MoKα","","0.0712","0.0551","","","0.1205","0.1259","","","","","","0.96","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006077","14.1964","0.001","14.1964","0.001","14.1964","0.001","90","","90","","90","","2861.1","0.3","120","2","120","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","Bis(triethylselenonium) hexaiodozirconate(IV)","","- C12 H30 I6 Se2 Zr -","- C12 H30 I6 Se2 Zr -","- C48 H120 I24 Se8 Zr4 -","4","0.166667","","Reid, Stuart D.; Hector, Andrew L.; Levason, William; Reid, Gillian; Waller, Benjamin J.; Webster, Michael","Thio- and seleno-ether complexes with Group 4 tetrahalides and tin tetrachloride: preparation and use in CVD for metal chalcogenide films.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4769","4777","10.1039/b708809d","","","0.71073","MoKα","","0.0608","0.0435","","","0.1181","0.134","","","","","","1.082","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006078","9.0027","0.001","9.955","0.002","12.413","0.003","97.211","0.01","109.899","0.01","93.532","0.01","1031.3","0.4","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","Bis(6-methyl-5,7,12,13-tetrahydrodibenzo[c,g]selenoninium) hexachlorotitanate(IV) dichloromethane solvate","","- C36 H42 Cl10 Se2 Ti -","- C36 H42 Cl10 Se2 Ti -","- C36 H42 Cl10 Se2 Ti -","1","0.5","","Reid, Stuart D.; Hector, Andrew L.; Levason, William; Reid, Gillian; Waller, Benjamin J.; Webster, Michael","Thio- and seleno-ether complexes with Group 4 tetrahalides and tin tetrachloride: preparation and use in CVD for metal chalcogenide films.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4769","4777","10.1039/b708809d","","","0.71073","MoKα","","0.0436","0.031","","","0.0632","0.0675","","","","","","1.022","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006079","7.1244","0.001","11.5362","0.001","10.2435","0.001","90","","97.662","0.006","90","","834.38","0.16","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","trans-tetrachlorobis(diethylselenide)tin(IV)","","- C8 H20 Cl4 Se2 Sn -","- C8 H20 Cl4 Se2 Sn -","- C16 H40 Cl8 Se4 Sn2 -","2","0.5","","Reid, Stuart D.; Hector, Andrew L.; Levason, William; Reid, Gillian; Waller, Benjamin J.; Webster, Michael","Thio- and seleno-ether complexes with Group 4 tetrahalides and tin tetrachloride: preparation and use in CVD for metal chalcogenide films.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4769","4777","10.1039/b708809d","","","0.71073","MoKα","","0.0238","0.0229","","","0.0558","0.0563","","","","","","1.128","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006080","16.78","0.004","9.477","0.002","16.33","0.003","90","","119.486","0.01","90","","2260.5","0.9","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(diethylchloromethylselenonium) hexachlorohafnate(IV)","","- C10.74 H26.24 Cl7.26 Hf Se2 -","- C10.748 H26.244 Cl7.252 Hf Se2 -","- C42.992 H104.976 Cl29.008 Hf4 Se8 -","4","0.5","","Reid, Stuart D.; Hector, Andrew L.; Levason, William; Reid, Gillian; Waller, Benjamin J.; Webster, Michael","Thio- and seleno-ether complexes with Group 4 tetrahalides and tin tetrachloride: preparation and use in CVD for metal chalcogenide films.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4769","4777","10.1039/b708809d","","","0.71073","MoKα","","0.0526","0.0317","","","0.0534","0.0573","","","","","","1.042","","","","has coordinates,has disorder","179764","2020-10-21","18:00:00",""
"7006081","16.859","0.002","9.4791","0.001","16.388","0.002","90","","119.333","0.005","90","","2283.2","0.5","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(diethylchloromethylselenonium) hexachlorozirconate(IV)","","- C11.33 H27.99 Cl6.67 Se2 Zr -","- C11.328 H27.984 Cl6.672 Se2 Zr -","- C45.312 H111.936 Cl26.688 Se8 Zr4 -","4","0.5","","Reid, Stuart D.; Hector, Andrew L.; Levason, William; Reid, Gillian; Waller, Benjamin J.; Webster, Michael","Thio- and seleno-ether complexes with Group 4 tetrahalides and tin tetrachloride: preparation and use in CVD for metal chalcogenide films.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4769","4777","10.1039/b708809d","","","0.71073","MoKα","","0.0239","0.0224","","","0.0525","0.0534","","","","","","1.01","","","","has coordinates,has disorder","179764","2020-10-21","18:00:00",""
"7006082","17.1191","0.0014","13.0059","0.0011","19.0227","0.0016","90","","97.561","0.001","90","","4198.6","0.6","187","2","187","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C33 H56 Lu N O3 S Si -","- C33 H56 Lu N O3 S Si -","- C132 H224 Lu4 N4 O12 S4 Si4 -","4","1","","Wang, Dun; Cui, Dongmei; Miao, Wei; Li, Shihui; Huang, Baotong","Rare earth metal complexes bearing thiophene-amido ligand: synthesis and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4576","4581","10.1039/b708881g","","","0.71073","MoKα","","0.0364","0.0303","","","0.0784","0.0809","","","","","","0.988","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006083","15.151","0.0011","14.986","0.0011","19.3443","0.0014","90","","93.24","0.001","90","","4385.2","0.6","187","2","187","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H65 N2 O S2 Sc -","- C44 H65 N2 O S2 Sc -","- C176 H260 N8 O4 S8 Sc4 -","4","1","","Wang, Dun; Cui, Dongmei; Miao, Wei; Li, Shihui; Huang, Baotong","Rare earth metal complexes bearing thiophene-amido ligand: synthesis and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4576","4581","10.1039/b708881g","","","0.71073","MoKα","","0.095","0.0517","","","0.1127","0.1272","","","","","","0.939","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006084","10.1278","0.0007","18.1189","0.0012","19.4029","0.0013","90","","94.255","0.001","90","","3550.7","0.4","187","2","187","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C33 H56 N O3 S Si Y -","- C33 H56 N O3 S Si Y -","- C132 H224 N4 O12 S4 Si4 Y4 -","4","1","","Wang, Dun; Cui, Dongmei; Miao, Wei; Li, Shihui; Huang, Baotong","Rare earth metal complexes bearing thiophene-amido ligand: synthesis and structural characterization.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4576","4581","10.1039/b708881g","","","0.71073","MoKα","","0.0737","0.0433","","","0.093","0.1038","","","","","","0.983","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006085","6.891","0.002","8.406","0.002","12.706","0.004","77.569","0.01","84.464","0.013","75.446","0.011","695","0.3","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H40 F16 N6 O6 V4 -","- C12 H40 F16 N6 O6 V4 -","- C12 H40 F16 N6 O6 V4 -","1","0.5","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","The role of temperature in the solvothermal synthesis of hybrid vanadium oxyfluorides","Dalton Transactions","2007","","37","4207","","10.1039/b708889b","","","0.71073","MoKα","","0.05","0.0405","","","0.0998","0.1061","","","","","","1.034","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006086","12.873","0.0014","12.7838","0.0015","21.771","0.002","91.217","0.004","90.464","0.004","92.179","0.004","3579.2","0.7","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H56 F17 N8 O7 V4 -","- C16 H56 F17 N8 O7 V4 -","- C64 H224 F68 N32 O28 V16 -","4","2","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","The role of temperature in the solvothermal synthesis of hybrid vanadium oxyfluorides","Dalton Transactions","2007","","37","4207","","10.1039/b708889b","","","0.7107","MoKα","","0.0322","0.0298","","","0.0764","0.0787","","","","","","0.984","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006087","11.7781","0.0017","12.524","0.0018","13.3317","0.0019","86.675","0.002","84.838","0.002","67.417","0.002","1807.8","0.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H52 F20 N8 O5 V5 -","- C16 H48 F20 N8 O5 V5 -","- C32 H96 F40 N16 O10 V10 -","2","1","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","The role of temperature in the solvothermal synthesis of hybrid vanadium oxyfluorides","Dalton Transactions","2007","","37","4207","","10.1039/b708889b","","","0.846","synchrotron","","0.0776","0.0651","","","0.1668","0.1755","","","","","","1.019","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006088","5.7184","0.0008","8.2456","0.0012","9.8105","0.0014","97.444","0.003","101.073","0.003","104.34","0.003","432.13","0.11","125","2","125","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H14 F4 N2 O2 V -","- C4 H14 F4 N2 O2 V -","- C8 H28 F8 N4 O4 V2 -","2","1","","Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip","The role of temperature in the solvothermal synthesis of hybrid vanadium oxyfluorides","Dalton Transactions","2007","","37","4207","","10.1039/b708889b","","","0.71073","MoKα","","0.0493","0.0446","","","0.1107","0.1128","","","","","","1.111","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006089","16.108","0.003","12.84","0.002","16.159","0.003","90","","115.924","0.002","90","","3005.8","0.9","103","2","103","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C29 H23 Au Cl2 Cr N O5 P -","- C29 H23 Au Cl2 Cr N O5 P -","- C116 H92 Au4 Cl8 Cr4 N4 O20 P4 -","4","1","","Stander, Elzet; Esterhuysen, Catharine; McKenzie, Jean M.; Cronje, Stephanie; Raubenheimer, Helgard G.","Reaction and subsequent transformation of anionic acetylide-carbene complexes using the Ph3PAu+ fragment.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5684","5691","10.1039/b708915e","","","0.71073","MoKα","","0.02","0.018","","","0.045","0.045","","","","","","1.06","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006090","16.326","0.003","12.7472","0.0019","16.336","0.003","90","","116.163","0.002","90","","3051.4","0.9","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C29 H23 Au Cl2 N O5 P W -","- C29 H23 Au Cl2 N O5 P W -","- C116 H92 Au4 Cl8 N4 O20 P4 W4 -","4","1","","Stander, Elzet; Esterhuysen, Catharine; McKenzie, Jean M.; Cronje, Stephanie; Raubenheimer, Helgard G.","Reaction and subsequent transformation of anionic acetylide-carbene complexes using the Ph3PAu+ fragment.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5684","5691","10.1039/b708915e","","","0.71073","MoKα","","0.041","0.035","","","0.077","0.08","","","","","","1.05","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006091","10.364","0.003","11.566","0.003","12.463","0.004","74.216","0.014","69.976","0.005","82.605","0.008","1349.7","0.7","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H21 Au Cr N O5 P -","- C28 H21 Au Cr N O5 P -","- C56 H42 Au2 Cr2 N2 O10 P2 -","2","1","","Stander, Elzet; Esterhuysen, Catharine; McKenzie, Jean M.; Cronje, Stephanie; Raubenheimer, Helgard G.","Reaction and subsequent transformation of anionic acetylide-carbene complexes using the Ph3PAu+ fragment.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5684","5691","10.1039/b708915e","","","0.71073","MoKα","","0.1156","0.0788","","","0.1648","0.1808","","","","","","1.058","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006092","9.2552","0.0005","24.2452","0.0014","12.4647","0.0007","90","","103.429","0.001","90","","2720.5","0.3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H21 Au N O5 P W -","- C28 H21 Au N O5 P W -","- C112 H84 Au4 N4 O20 P4 W4 -","4","1","","Stander, Elzet; Esterhuysen, Catharine; McKenzie, Jean M.; Cronje, Stephanie; Raubenheimer, Helgard G.","Reaction and subsequent transformation of anionic acetylide-carbene complexes using the Ph3PAu+ fragment.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5684","5691","10.1039/b708915e","","","0.71073","MoKα","","0.036","0.031","","","0.076","0.079","","","","","","1.03","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006093","12.836","0.002","16.1552","0.001","17.537","0.002","69.378","0.006","89.134","0.009","75.192","0.008","3279.3","0.7","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C54 H47 F12 Ir N8 O12 Pt2 S6 -","- C54 H47 F12 Ir N8 O12 Pt2 S6 -","- C108 H94 F24 Ir2 N16 O24 Pt4 S12 -","2","1","","Moussa, Jamal; Man-Chung Wong, Keith; Chamoreau, Lise-Marie; Amouri, Hani; Wing-Wah Yam, Vivian","Luminescent 1D chain of platinum(II) terpyridyl units with p-dithiobenzoquinone organometallic linker: self-aggregation imparted from Pt...Pt/pi-pi interactions.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3526","3530","10.1039/b708922h","","","0.71073","MoKα","","0.142","0.0595","","","0.1421","0.1695","","","","","","1.029","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006094","14.89","0.01","20.9","0.02","30.87","0.04","90","","102.57","0.07","90","","9377","17","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C188 H250 Co2 N2 O16 -","- C188 H250 Co2 N2 O16 -","- C376 H500 Co4 N4 O32 -","2","0.5","","Petit, Sarah; Pilet, Guillaume; Luneau, Dominique; Chibotaru, Liviu F.; Ungur, Liviu","A dinuclear cobalt(II) complex of calix[8]arenes exibiting strong magnetic anisotropy.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4582","4588","10.1039/b708926k","","","0.71073","MoKα","","0.1642","0.1174","","0.1548","0.1127","0.1127","","","","","","1.0999","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006095","12.354","0.003","12.558","0.003","13.514","0.002","82.892","0.019","63.258","0.015","69.708","0.019","1754.8","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H29 Cl4 Co N5 O4 Re -","- C33 H29 Cl4 Co N5 O4 Re -","- C66 H58 Cl8 Co2 N10 O8 Re2 -","2","1","","Cuevas, Alicia; Kremer, Carlos; Suescun, Leopoldo; Russi, Silvia; Mombrú, Alvaro W.; Lloret, Francesc; Julve, Miguel; Faus, Juan","Synthesis, crystal structure and magnetic properties of novel heterobimetallic malonate-bridged MIIReIV complexes (M = Mn, Fe, Co and Ni)","Dalton Transactions","2007","","45","5305","","10.1039/b708927a","","","0.71069","MoKα","","0.0682","0.0584","","","0.1609","0.1736","","","","","","1.121","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006096","12.4923","0.0014","12.6021","0.0012","13.5093","0.0013","82.143","0.009","62.813","0.007","69.561","0.009","1772","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H29 Cl4 Fe N5 O4 Re -","- C33 H29 Cl4 Fe N5 O4 Re -","- C66 H58 Cl8 Fe2 N10 O8 Re2 -","2","1","","Cuevas, Alicia; Kremer, Carlos; Suescun, Leopoldo; Russi, Silvia; Mombrú, Alvaro W.; Lloret, Francesc; Julve, Miguel; Faus, Juan","Synthesis, crystal structure and magnetic properties of novel heterobimetallic malonate-bridged MIIReIV complexes (M = Mn, Fe, Co and Ni)","Dalton Transactions","2007","","45","5305","","10.1039/b708927a","","","0.71069","MoKα","","0.04","0.0285","","","0.0739","0.0779","","","","","","1.081","","","","has coordinates","179764","2020-10-21","18:00:00",""
"7006097","8.0455","0.0003","13.365","0.007","14.493","0.008","73.86","0.04","85.12","0.04","77.55","0.04","1461.3","1.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H24.5 Cl4 N4.5 Ni O5.5 Re -","- C22 H21.5 Cl4 N4.5 Ni O5.5 Re -","- C44 H43 Cl8 N9 Ni2 O11 Re2 -","2","1","","Cuevas, Alicia; Kremer, Carlos; Suescun, Leopoldo; Russi, Silvia; Mombrú, Alvaro W.; Lloret, Francesc; Julve, Miguel; Faus, Juan","Synthesis, crystal structure and magnetic properties of novel heterobimetallic malonate-bridged MIIReIV complexes (M = Mn, Fe, Co and Ni)","Dalton Transactions","2007","","45","5305","","10.1039/b708927a","","","0.71069","MoKα","","0.2427","0.097","","","0.2291","0.3007","","","","","","0.961","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006098","7.389","0.002","26.676","0.01","20.655","0.007","90","","97.74","0.03","90","","4034","2","293","2","293","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","","","","- C33 H35 Cl4 Mn N5 O7 Re -","- C33 H29 Cl4 Mn N5 O7 Re -","- C132 H116 Cl16 Mn4 N20 O28 Re4 -","4","1","","Cuevas, Alicia; Kremer, Carlos; Suescun, Leopoldo; Russi, Silvia; Mombrú, Alvaro W.; Lloret, Francesc; Julve, Miguel; Faus, Juan","Synthesis, crystal structure and magnetic properties of novel heterobimetallic malonate-bridged MIIReIV complexes (M = Mn, Fe, Co and Ni)","Dalton Transactions","2007","","45","5305","","10.1039/b708927a","","x-ray","0.71073","MoKα","","0.1362","0.1091","","","0.2523","0.2766","","","","","","1.091","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006099","9.382","0.005","11.292","0.005","12.643","0.005","81.91","0.005","68.73","0.005","66.01","0.005","1140.3","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H44 Au P S -","- C27 H22 Au P S -","- C54 H44 Au2 P2 S2 -","2","1","","Lardiés, Nora; Romeo, Inocencio; Cerrada, Elena; Laguna, Mariano; Skabara, Peter J.","Synthesis and properties of alkynethiolate gold(i) complexes","Dalton Transactions","2007","","45","5329","","10.1039/b708966j","","","0.71073","MoKα","","0.0248","0.0197","","","0.0465","0.0472","","","","","","1.034","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7006100","9.759","0.004","23.066","0.012","19.794","0.014","90","","100.25","0.05","90","","4385","4","100","2","273","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C51 H37 Au F5 N P2 S -","- C51 H37 Au F5 N P2 S -","- C204 H148 Au4 F20 N4 P8 S4 -","4","1","","Lardiés, Nora; Romeo, Inocencio; Cerrada, Elena; Laguna, Mariano; Skabara, Peter J.","Synthesis and properties of alkynethiolate gold(i) complexes","Dalton Transactions","2007","","45","5329","","10.1039/b708966j","","","0.71073","MoKα","","0.0558","0.0349","","","0.0864","0.1018","","","","","","1.089","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006101","10.0385","0.0009","12.8538","0.0012","18.5414","0.0017","72.878","0.002","79.661","0.002","68.013","0.002","2113.6","0.3","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H18 Au P S2 -","- C24 H18 Au P S2 -","- C96 H72 Au4 P4 S8 -","4","2","","Lardiés, Nora; Romeo, Inocencio; Cerrada, Elena; Laguna, Mariano; Skabara, Peter J.","Synthesis and properties of alkynethiolate gold(i) complexes","Dalton Transactions","2007","","45","5329","","10.1039/b708966j","","","0.71073","MoKα","","0.0669","0.0445","","","0.0898","0.0961","","","","","","0.704","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006102","9.3582","0.0001","22.4857","0.0003","12.6267","0.0002","90","","101.584","0.0005","90","","2602.86","0.06","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","(Tris-(4-(pyrazol-3-yl)-3-aza-3-butenyl)amine)iron(ii) ditetrafluoroborate monohydrate","[Tris-(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(II) ditetrafluoroborate monohydrate","","- C18 H26 B2 F8 Fe N10 O -","- C18 H26 B2 F8 Fe N10 O -","- C72 H104 B8 F32 Fe4 N40 O4 -","4","1","","Lazar, Hanane Z.; Forestier, Thibaut; Barrett, Simon A.; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Thermal and light-induced spin-crossover in salts of the heptadentate complex [tris(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(ii).","Dalton transactions (Cambridge, England : 2003)","2007","","38","4276","4285","10.1039/b708971f","","","0.71073","MoKα","","0.0765","0.0444","","","0.1103","0.1286","","","","","","1.044","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006103","11.6918","0.0012","12.9226","0.0014","17.923","0.002","90","","90","","90","","2708","0.5","300","2","300","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(Tris-(4-(pyrazol-3-yl)-3-aza-3-butenyl)amine)iron(ii) dinitrate mono-nitromethane solvate","[Tris-(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(II) dinitrate mono-nitromethane solvate","","- C19 H27 Fe N13 O8 -","- C19 H27 Fe N13 O8 -","- C76 H108 Fe4 N52 O32 -","4","1","","Lazar, Hanane Z.; Forestier, Thibaut; Barrett, Simon A.; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Thermal and light-induced spin-crossover in salts of the heptadentate complex [tris(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(ii).","Dalton transactions (Cambridge, England : 2003)","2007","","38","4276","4285","10.1039/b708971f","","","0.71073","MoKα","","0.0595","0.0481","","","0.1331","0.145","","","","","","1.092","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006104","11.7421","0.0012","12.8654","0.0011","17.818","0.0015","90","","90","","90","","2691.7","0.4","250","2","250","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(Tris-(4-(pyrazol-3-yl)-3-aza-3-butenyl)amine)iron(ii) dinitrate mono-nitromethane solvate","[Tris-(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(II) dinitrate mono-nitromethane solvate","","- C19 H27 Fe N13 O8 -","- C19 H27 Fe N13 O8 -","- C76 H108 Fe4 N52 O32 -","4","1","","Lazar, Hanane Z.; Forestier, Thibaut; Barrett, Simon A.; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Thermal and light-induced spin-crossover in salts of the heptadentate complex [tris(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(ii).","Dalton transactions (Cambridge, England : 2003)","2007","","38","4276","4285","10.1039/b708971f","","","0.71073","MoKα","","0.0685","0.0447","","","0.1075","0.1192","","","","","","1.016","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006105","11.7098","0.0011","12.8195","0.0013","17.7697","0.0016","90","","90","","90","","2667.5","0.4","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(Tris-(4-(pyrazol-3-yl)-3-aza-3-butenyl)amine)iron(ii) dinitrate mono-nitromethane solvate","[Tris-(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(II) dinitrate mono-nitromethane solvate","","- C19 H27 Fe N13 O8 -","- C19 H27 Fe N13 O8 -","- C76 H108 Fe4 N52 O32 -","4","1","","Lazar, Hanane Z.; Forestier, Thibaut; Barrett, Simon A.; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Thermal and light-induced spin-crossover in salts of the heptadentate complex [tris(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(ii).","Dalton transactions (Cambridge, England : 2003)","2007","","38","4276","4285","10.1039/b708971f","","","0.71073","MoKα","","0.0578","0.0429","","","0.1077","0.1154","","","","","","1.037","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006106","11.6229","0.001","12.6878","0.0012","17.5957","0.0019","90","","90","","90","","2594.8","0.4","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(Tris-(4-(pyrazol-3-yl)-3-aza-3-butenyl)amine)iron(ii) dinitrate mono-nitromethane solvate","[Tris-(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(II) dinitrate mono-nitromethane solvate","","- C19 H27 Fe N13 O8 -","- C19 H27 Fe N13 O8 -","- C76 H108 Fe4 N52 O32 -","4","1","","Lazar, Hanane Z.; Forestier, Thibaut; Barrett, Simon A.; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Thermal and light-induced spin-crossover in salts of the heptadentate complex [tris(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(ii).","Dalton transactions (Cambridge, England : 2003)","2007","","38","4276","4285","10.1039/b708971f","","","0.71073","MoKα","","0.0519","0.0435","","","0.1082","0.1137","","","","","","1.052","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006107","11.6168","0.001","12.6034","0.0014","17.484","0.0019","90","","90","","90","","2559.9","0.5","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(Tris-(4-(pyrazol-3-yl)-3-aza-3-butenyl)amine)iron(ii) dinitrate mono-nitromethane solvate","[Tris-(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(II) dinitrate mono-nitromethane solvate","","- C19 H27 Fe N13 O8 -","- C19 H27 Fe N13 O8 -","- C76 H108 Fe4 N52 O32 -","4","1","","Lazar, Hanane Z.; Forestier, Thibaut; Barrett, Simon A.; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Thermal and light-induced spin-crossover in salts of the heptadentate complex [tris(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(ii).","Dalton transactions (Cambridge, England : 2003)","2007","","38","4276","4285","10.1039/b708971f","","","0.71073","MoKα","","0.053","0.0458","","","0.1159","0.1204","","","","","","1.08","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006108","11.626","0.002","12.574","0.002","17.373","0.003","90","","90","","90","","2539.7","0.7","30","2","30","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(Tris-(4-(pyrazol-3-yl)-3-aza-3-butenyl)amine)iron(ii) dinitrate mono-nitromethane solvate","[Tris-(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(II) dinitrate mono-nitromethane solvate","","- C19 H27 Fe N13 O8 -","- C19 H27 Fe N13 O8 -","- C76 H108 Fe4 N52 O32 -","4","1","","Lazar, Hanane Z.; Forestier, Thibaut; Barrett, Simon A.; Kilner, Colin A.; Létard, Jean-François; Halcrow, Malcolm A.","Thermal and light-induced spin-crossover in salts of the heptadentate complex [tris(4-{pyrazol-3-yl}-3-aza-3-butenyl)amine]iron(ii).","Dalton transactions (Cambridge, England : 2003)","2007","","38","4276","4285","10.1039/b708971f","","","0.71073","MoKα","","0.1038","0.0923","","","0.2524","0.2631","","","","","","1.129","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006109","13.6292","0.0013","9.5466","0.0007","15.4193","0.0011","90","","90.817","0.007","90","","2006","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H34 B N2 P -","- C19 H34 B N2 P -","- C76 H136 B4 N8 P4 -","4","1","","Clarke, Deborah A.; Miller, Philip W.; Long, Nicholas J.; White, Andrew J. P.","Steric control over the formation of cis and trans bis-chelated palladium(II) complexes using a new series of flexible N,P pyridyl-phosphine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4556","4564","10.1039/b709032c","","","1.54248","CuKα","","0.0468","0.0393","","","0.1129","0.1173","","","","","","1.164","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006110","11.523","0.0013","15.8628","0.0019","13.3819","0.0012","90","","97.806","0.008","90","","2423.4","0.5","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H33 Cl4 N2 P Pd -","- C20 H33 Cl4 N2 P Pd -","- C80 H132 Cl16 N8 P4 Pd4 -","4","1","","Clarke, Deborah A.; Miller, Philip W.; Long, Nicholas J.; White, Andrew J. P.","Steric control over the formation of cis and trans bis-chelated palladium(II) complexes using a new series of flexible N,P pyridyl-phosphine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4556","4564","10.1039/b709032c","","","0.71073","MoKα","","0.0474","0.0344","","","0.0924","0.0963","","","","","","1.131","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006111","8.5961","0.0013","13.265","0.002","16.3961","0.0003","90","","105.141","0.005","90","","1804.7","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H27 Cl2 N2 P Pd -","- C15 H27 Cl2 N2 P Pd -","- C60 H108 Cl8 N8 P4 Pd4 -","4","1","","Clarke, Deborah A.; Miller, Philip W.; Long, Nicholas J.; White, Andrew J. P.","Steric control over the formation of cis and trans bis-chelated palladium(II) complexes using a new series of flexible N,P pyridyl-phosphine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4556","4564","10.1039/b709032c","","","0.71073","MoKα","","0.0228","0.0205","","","0.0505","0.0515","","","","","","1.107","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006112","21.171","0.004","20.345","0.004","9.4447","0.0008","90","","104.668","0.012","90","","3935.5","1.1","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H62 Cl2 N4 P2 Pd -","- C38 H62 Cl2 N4 P2 Pd -","- C152 H248 Cl8 N16 P8 Pd4 -","4","0.5","","Clarke, Deborah A.; Miller, Philip W.; Long, Nicholas J.; White, Andrew J. P.","Steric control over the formation of cis and trans bis-chelated palladium(II) complexes using a new series of flexible N,P pyridyl-phosphine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4556","4564","10.1039/b709032c","","","0.71073","MoKα","","0.0413","0.0293","","","0.0734","0.0756","","","","","","1.048","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006113","9.8852","0.0001","19.9719","0.0001","21.5616","0.0001","90","","98.528","0.001","90","","4209.76","0.05","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C39 H40 Cl4 N4 O8 P2 Pd -","- C39 H40 Cl4 N4 O8 P2 Pd -","- C156 H160 Cl16 N16 O32 P8 Pd4 -","4","1","","Clarke, Deborah A.; Miller, Philip W.; Long, Nicholas J.; White, Andrew J. P.","Steric control over the formation of cis and trans bis-chelated palladium(II) complexes using a new series of flexible N,P pyridyl-phosphine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4556","4564","10.1039/b709032c","","","1.54248","CuKα","","0.0372","0.0305","","","0.0814","0.0839","","","","","","1.085","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006114","11.9633","0.0006","9.9176","0.0005","13.4452","0.0006","90","","114.899","0.003","90","","1446.96","0.13","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C30 H32 B4 Fe2 O8 -","- C30 H32 B4 Fe2 O8 -","- C60 H64 B8 Fe4 O16 -","2","1","","Day, Joanna K.; Bresner, Chrisopher; Fallis, Ian A.; Ooi, Li-Ling; Watkin, David J.; Coles, Simon J.; Male, Louise; Hursthouse, Michael B.; Aldridge, Simon","Synthesis of polymeric and macrocyclic Lewis acids: influence of backbone on degree of aggregation.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3486","3488","10.1039/b709042k","","","0.71073","MoKα","","0.0474","0.0398","","0.0939","0.0882","0.0939","","","","","","0.9908","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006115","16.7826","0.0003","9.9148","0.0002","20.8325","0.0004","90","","108.339","0.001","90","","3290.39","0.11","150","2","150","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","sa0613","","","- C31 H33 B4 Cl3 Fe2 O8 -","- C31 H33 B4 Cl3 Fe2 O8 -","- C124 H132 B16 Cl12 Fe8 O32 -","4","1","","Day, Joanna K.; Bresner, Chrisopher; Fallis, Ian A.; Ooi, Li-Ling; Watkin, David J.; Coles, Simon J.; Male, Louise; Hursthouse, Michael B.; Aldridge, Simon","Synthesis of polymeric and macrocyclic Lewis acids: influence of backbone on degree of aggregation.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3486","3488","10.1039/b709042k","","","0.71073","MoKα","","0.0814","0.0649","","","0.1297","0.1358","","","","","","1.087","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006116","19.6222","0.0011","7.8609","0.0003","21.3982","0.0011","90","","90","","90","","3300.6","0.3","120","2","120","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C36 H40 B4 Fe2 O8 -","- C36 H40 B4 Fe2 O8 -","- C144 H160 B16 Fe8 O32 -","4","0.5","","Day, Joanna K.; Bresner, Chrisopher; Fallis, Ian A.; Ooi, Li-Ling; Watkin, David J.; Coles, Simon J.; Male, Louise; Hursthouse, Michael B.; Aldridge, Simon","Synthesis of polymeric and macrocyclic Lewis acids: influence of backbone on degree of aggregation.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3486","3488","10.1039/b709042k","","","0.71073","MoKα","","0.1451","0.0905","","","0.1459","0.1676","","","","","","1.219","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006117","29.8942","0.001","10.7482","0.0003","7.4301","0.0003","90","","90","","90","","2387.36","0.14","120","2","120","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C28 H30 B2 Fe2 O4 -","- C28 H30 B2 Fe2 O4 -","- C112 H120 B8 Fe8 O16 -","4","0.5","","Day, Joanna K.; Bresner, Chrisopher; Fallis, Ian A.; Ooi, Li-Ling; Watkin, David J.; Coles, Simon J.; Male, Louise; Hursthouse, Michael B.; Aldridge, Simon","Synthesis of polymeric and macrocyclic Lewis acids: influence of backbone on degree of aggregation.","Dalton transactions (Cambridge, England : 2003)","2007","","32","3486","3488","10.1039/b709042k","","","0.71073","MoKα","","0.1096","0.0724","","","0.1183","0.1277","","","","","","1.138","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006118","12.9205","0.001","13.4728","0.001","13.977","0.002","80.972","0.004","64.021","0.004","63.137","0.005","1948.6","0.4","150","2","150","2","","","","","","","synthesis as described","6","P -1","-P 1","2","Chisholm 1368","","","- C40 H38 B N2 Na O12 -","- C40 H38 B N2 Na O12 -","- C80 H76 B2 N4 Na2 O24 -","2","1","","Chisholm, Malcolm H.; Gallucci, Judith C.; Yin, Hongfeng","18-membered cyclic esters derived from glycolide and lactide: preparations, structures and coordination to sodium ions.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4811","4821","10.1039/b709081a","","x-ray","0.71073","MoKα","","0.0805","0.0502","","","0.1223","0.1388","","","","","","1.049","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006119","7.6685","0.001","5.9013","0.001","16.004","0.003","90","","102.408","0.009","90","","707.3","0.2","150","2","150","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","Chisholm 1371","","","- C12 H12 O12 -","- C12 H12 O12 -","- C24 H24 O24 -","2","0.5","","Chisholm, Malcolm H.; Gallucci, Judith C.; Yin, Hongfeng","18-membered cyclic esters derived from glycolide and lactide: preparations, structures and coordination to sodium ions.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4811","4821","10.1039/b709081a","","x-ray","0.71073","MoKα","","0.0514","0.041","","","0.1042","0.1097","","","","","","1.067","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006120","15.2297","0.0011","11.7129","0.0008","22.5154","0.0018","90","","90","","90","","4016.4","0.5","95","2","95","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C25 H25 B N2 -","- C25 H25 B N2 -","- C200 H200 B8 N16 -","8","1","","Chisholm, Malcolm H.; Gallucci, Judith C.; Yin, Hongfeng","18-membered cyclic esters derived from glycolide and lactide: preparations, structures and coordination to sodium ions.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4811","4821","10.1039/b709081a","","","0.49594","synchrotron","","0.0533","0.0442","","","0.1085","0.1131","","","","","","1.072","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006121","8.4322","0.001","16.513","0.002","14.964","0.002","90","","93.048","0.005","90","","2080.7","0.4","150","2","150","2","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","Chisholm 1498","","","- C18 H24 O12 -","- C18 H24 O12 -","- C72 H96 O48 -","4","1","","Chisholm, Malcolm H.; Gallucci, Judith C.; Yin, Hongfeng","18-membered cyclic esters derived from glycolide and lactide: preparations, structures and coordination to sodium ions.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4811","4821","10.1039/b709081a","","x-ray","0.71073","MoKα","","0.0573","0.0347","","","0.0829","0.0905","","","","","","1.058","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006122","10.663","0.002","11.967","0.003","16.489","0.004","90","","90","","90","","2104.1","0.8","150","2","150","2","","","","","","","synthesis as described","3","P 21 21 21","P 2ac 2ab","19","Chisholm 1477","","","- C18 H24 O12 -","- C18 H24 O12 -","- C72 H96 O48 -","4","1","","Chisholm, Malcolm H.; Gallucci, Judith C.; Yin, Hongfeng","18-membered cyclic esters derived from glycolide and lactide: preparations, structures and coordination to sodium ions.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4811","4821","10.1039/b709081a","","x-ray","0.71073","MoKα","","0.0387","0.0328","","","0.0846","0.0881","","","","","","1.052","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7006123","9.986","0.002","19.9","0.003","21.545","0.004","90","","90.376","0.006","90","","4281.4","1.3","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","Chisholm 1497","","","- C44 H47 B N Na O12 -","- C44 H47 B N Na O12 -","- C176 H188 B4 N4 Na4 O48 -","4","1","","Chisholm, Malcolm H.; Gallucci, Judith C.; Yin, Hongfeng","18-membered cyclic esters derived from glycolide and lactide: preparations, structures and coordination to sodium ions.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4811","4821","10.1039/b709081a","","x-ray","0.71073","MoKα","","0.0895","0.0418","","","0.081","0.0929","","","","","","1.019","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006124","13.03","0.006","6.715","0.003","16.385","0.008","90","","108.6","0.003","90","","1358.7","1.1","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H9 Eu O9 -","- C16 H9 Eu O9 -","- C64 H36 Eu4 O36 -","4","1","","Weng, Danfeng; Zheng, Xiangjun; Li, Licun; Yang, Wenwen; Jin, Linpei","Low pH hydrothermal synthesis and properties of lanthanide-organic frameworks with (4(10),6(5))(4(9),6(6)) topology constructed from Ln-Hbptc building blocks.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4822","4828","10.1039/b709199k","","","0.71073","MoKα","","0.052","0.0427","","","0.081","0.0858","","","","","","1.106","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006125","13.0362","0.001","6.7037","0.0004","16.415","0.0012","90","","108.589","0.003","90","","1359.68","0.17","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H9 Gd O9 -","- C16 H9 Gd O9 -","- C64 H36 Gd4 O36 -","4","1","","Weng, Danfeng; Zheng, Xiangjun; Li, Licun; Yang, Wenwen; Jin, Linpei","Low pH hydrothermal synthesis and properties of lanthanide-organic frameworks with (4(10),6(5))(4(9),6(6)) topology constructed from Ln-Hbptc building blocks.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4822","4828","10.1039/b709199k","","","0.71073","MoKα","","0.0257","0.0209","","","0.0463","0.048","","","","","","1.006","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006126","25.8","0.003","25.8","0.003","22.612","0.005","90","","90","","120","","13035","4","173","2","173","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C75 H66 Ag4 F24 N18 O9 P4 -","- C75 H63 Ag4 F24 N18 O9 P4 -","- C450 H378 Ag24 F144 N108 O54 P24 -","6","0.166667","","Niu, Cao-Yuan; Wu, Ben-Lai; Zheng, Xian-Fu; Zhang, Hong-Yun; Li, Zhong-Jun; Hou, Hong-Wei","The first 1D twofold interpenetrating metal-organic network generated by 1D triple helical chains with nanosized cages.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5710","5713","10.1039/b709204k","","","0.71073","MoKα","","0.0441","0.0372","","","0.1134","0.1206","","","","","","1.037","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006127","6.1798","0.0011","14.148","0.003","15.437","0.003","87.978","0.003","80.15","0.003","84.116","0.003","1322.6","0.4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H13 Fe N O -","- C17 H13 Fe N O -","- C68 H52 Fe4 N4 O4 -","4","2","","Feng, Ke; Wu, Li-Zhu; Zhang, Li-Ping; Tung, Chen-Ho","Cucurbit[7]uril-included neutral intramolecular charge-transfer ferrocene derivatives.","Dalton transactions (Cambridge, England : 2003)","2007","","36","3991","3994","10.1039/b709221k","","","0.71073","MoKα","","0.0623","0.0405","","","0.0981","0.1116","","","","","","1.025","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006128","7.4872","0.0014","23.624","0.005","7.7646","0.0016","90","","105.152","0.004","90","","1325.6","0.5","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C26 H11 Cu2 N13 O -","- C26 Cu2 N13 O -","- C52 Cu4 N26 O2 -","2","0.5","","Yuste, Consuelo; Bentama, Abdeslem; Stiriba, Salah-Eddine; Armentano, Donatella; De Munno, Giovanni; Lloret, Francesc; Julve, Miguel","Ligand effects on the structures and magnetic properties of tricyanomethanide-containing copper(II) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5190","5200","10.1039/b709233d","","","0.71073","MoKα","","0.1366","0.1304","","","0.4242","0.4253","","","","","","3.633","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006129","9.9667","0.0011","10.1084","0.0011","11.2802","0.0012","92.895","0.004","111.856","0.004","101.973","0.004","1021.6","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H10 Cu N10 -","- C22 H10 Cu N10 -","- C44 H20 Cu2 N20 -","2","1","","Yuste, Consuelo; Bentama, Abdeslem; Stiriba, Salah-Eddine; Armentano, Donatella; De Munno, Giovanni; Lloret, Francesc; Julve, Miguel","Ligand effects on the structures and magnetic properties of tricyanomethanide-containing copper(II) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5190","5200","10.1039/b709233d","","","0.71073","MoKα","","0.0482","0.0381","","","0.1003","0.1062","","","","","","1.071","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006130","9.7205","0.0005","18.3381","0.0012","24.4679","0.0016","90","","96.964","0.003","90","","4329.4","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H22 Cu2 N20 O -","- C44 H20 Cu2 N20 O -","- C176 H80 Cu8 N80 O4 -","4","1","","Yuste, Consuelo; Bentama, Abdeslem; Stiriba, Salah-Eddine; Armentano, Donatella; De Munno, Giovanni; Lloret, Francesc; Julve, Miguel","Ligand effects on the structures and magnetic properties of tricyanomethanide-containing copper(II) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5190","5200","10.1039/b709233d","","","0.71073","MoKα","","0.0595","0.0419","","","0.1205","0.1319","","","","","","1.158","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006131","29.974","0.003","7.446","0.0008","23.687","0.003","90","","118.658","0.008","90","","4639","1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H12 Cu N10 -","- C26 H12 Cu N10 -","- C208 H96 Cu8 N80 -","8","1","","Yuste, Consuelo; Bentama, Abdeslem; Stiriba, Salah-Eddine; Armentano, Donatella; De Munno, Giovanni; Lloret, Francesc; Julve, Miguel","Ligand effects on the structures and magnetic properties of tricyanomethanide-containing copper(II) complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5190","5200","10.1039/b709233d","","","0.71073","MoKα","","0.0395","0.031","","","0.0852","0.0899","","","","","","1.056","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006132","8.2751","0.0006","8.8048","0.0007","16.7033","0.0012","90","","93.804","0.009","90","","1214.33","0.16","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 Cl2 O4 Rh2 -","- C22 H30 Cl2 O4 Rh2 -","- C44 H60 Cl4 O8 Rh4 -","2","0.5","","Govindaswamy, Padavattan; Linder, David; Lacour, Jérôme; Süss-Fink, Georg; Therrien, Bruno","Chiral or not chiral? A case study of the hexanuclear metalloprisms [Cp(6)M(6)(micro(3)-tpt-kappaN)(2)(micro-C2O4-kappaO)(3)]6+ (M = Rh, Ir, tpt = 2,4,6-tri(pyridin-4-yl)-1,3,5-triazine).","Dalton transactions (Cambridge, England : 2003)","2007","","39","4457","4463","10.1039/b709247d","","","0.71073","MoKα","","0.0303","0.0228","","","0.0552","0.0789","","","","","","1.27","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006133","25.082","0.002","20.0295","0.0016","33.218","0.002","90","","110.095","0.006","90","","15672","2","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C144 H150 F18 N12 O30 Rh6 S6 -","- C144 H150 F18 N12 O30 Rh6 S6 -","- C576 H600 F72 N48 O120 Rh24 S24 -","4","0.5","","Govindaswamy, Padavattan; Linder, David; Lacour, Jérôme; Süss-Fink, Georg; Therrien, Bruno","Chiral or not chiral? A case study of the hexanuclear metalloprisms [Cp(6)M(6)(micro(3)-tpt-kappaN)(2)(micro-C2O4-kappaO)(3)]6+ (M = Rh, Ir, tpt = 2,4,6-tri(pyridin-4-yl)-1,3,5-triazine).","Dalton transactions (Cambridge, England : 2003)","2007","","39","4457","4463","10.1039/b709247d","","","0.71073","MoKα","","0.2556","0.1092","","","0.2626","0.3246","","","","","","0.854","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006134","50.159","0.006","50.159","0.006","50.159","0.006","90","","90","","90","","126196","3","173","2","173","2","","","","","","","","7","F d -3 c :2","-F 4ud 2vw 3","228","","","","- C108 H114 F18 Ir6 N12 O30 S6 -","- C102 H114 Ir6 N12 O12 -","- C3264 H3648 Ir192 N384 O384 -","32","0.166667","","Govindaswamy, Padavattan; Linder, David; Lacour, Jérôme; Süss-Fink, Georg; Therrien, Bruno","Chiral or not chiral? A case study of the hexanuclear metalloprisms [Cp(6)M(6)(micro(3)-tpt-kappaN)(2)(micro-C2O4-kappaO)(3)]6+ (M = Rh, Ir, tpt = 2,4,6-tri(pyridin-4-yl)-1,3,5-triazine).","Dalton transactions (Cambridge, England : 2003)","2007","","39","4457","4463","10.1039/b709247d","","","0.71073","MoKα","","0.1076","0.0536","","","0.1284","0.1435","","","","","","0.812","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006135","19.098","0.005","18.691","0.005","23.105","0.005","90","0.005","112.45","0.005","90","0.005","7623","3","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C67 H68 B2 F24 Fe N3 O2 -","- C64 H61 B2 F24 Fe N3 O2 -","- C256 H244 B8 F96 Fe4 N12 O8 -","4","1","","Pierce, Glesni A.; Coombs, Natalie D.; Willock, David J.; Day, Joanna K.; Stasch, Andreas; Aldridge, Simon","Insertion reactions of dicyclohexylcarbodiimide with aminoboranes, -boryls and -borylenes.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4405","4412","10.1039/b709249k","","","0.71069","MoKα","","0.1026","0.0687","","","0.1711","0.1858","","","","","","1.063","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006136","12.981","0.003","16.321","0.003","12.556","0.003","90","","103.5","0.03","90","","2586.7","1","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H44 B Cl2 N3 -","- C25 H44 B Cl2 N3 -","- C100 H176 B4 Cl8 N12 -","4","0.5","","Pierce, Glesni A.; Coombs, Natalie D.; Willock, David J.; Day, Joanna K.; Stasch, Andreas; Aldridge, Simon","Insertion reactions of dicyclohexylcarbodiimide with aminoboranes, -boryls and -borylenes.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4405","4412","10.1039/b709249k","","","0.71073","MoKα","","0.0619","0.0427","","","0.0951","0.1036","","","","","","1.038","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006137","13.087","0.003","9.2883","0.0019","17.99","0.004","90","","90","","90","","2186.8","0.8","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C19 H36 B Cl2 N3 -","- C19 H36 B Cl2 N3 -","- C76 H144 B4 Cl8 N12 -","4","1","","Pierce, Glesni A.; Coombs, Natalie D.; Willock, David J.; Day, Joanna K.; Stasch, Andreas; Aldridge, Simon","Insertion reactions of dicyclohexylcarbodiimide with aminoboranes, -boryls and -borylenes.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4405","4412","10.1039/b709249k","","","0.71073","MoKα","","0.0502","0.0415","","","0.0953","0.1","","","","","","1.026","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006138","7.7084","0.0015","15.878","0.003","14.297","0.003","90","","91.75","0.03","90","","1749.1","0.6","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H15 B Cl Fe N O2 -","- C19 H15 B Cl Fe N O2 -","- C76 H60 B4 Cl4 Fe4 N4 O8 -","4","1","","Pierce, Glesni A.; Coombs, Natalie D.; Willock, David J.; Day, Joanna K.; Stasch, Andreas; Aldridge, Simon","Insertion reactions of dicyclohexylcarbodiimide with aminoboranes, -boryls and -borylenes.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4405","4412","10.1039/b709249k","","","0.71073","MoKα","","0.0552","0.0363","","","0.0747","0.0816","","","","","","1.05","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006139","12.1425","0.0003","12.7613","0.0003","13.5593","0.0004","91.382","0.001","105.88","0.001","102.833","0.001","1962.32","0.09","293","2","293","2","","","","","","","","7","P -1","-P 1","2","sa0606","","","- C21 H19 B Cl Fe N O2 -","- C21 H19 B Cl Fe N O2 -","- C84 H76 B4 Cl4 Fe4 N4 O8 -","4","2","","Pierce, Glesni A.; Coombs, Natalie D.; Willock, David J.; Day, Joanna K.; Stasch, Andreas; Aldridge, Simon","Insertion reactions of dicyclohexylcarbodiimide with aminoboranes, -boryls and -borylenes.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4405","4412","10.1039/b709249k","","","0.71073","MoKα","","0.0901","0.0563","","","0.1108","0.1231","","","","","","1.024","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006140","14.971","0.003","18.145","0.004","24.787","0.005","90","","90.83","0.03","90","","6733","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36.75 H33.5 Cl1.5 N2 Pt S2 -","- C36.75 H33.5 Cl1.5 N2 Pt S2 -","- C294 H268 Cl12 N16 Pt8 S16 -","8","2","","Adams, Christopher J.; Fey, Natalie; Parfitt, Matthew; Pope, Simon J. A.; Weinstein, Julia A.","Synthesis, structures and properties of a new series of platinum-diimine-dithiolate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4446","4456","10.1039/b709252k","","","0.71073","MoKα","","0.082","0.0442","","","0.075","0.0819","","","","","","0.834","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006141","15.048","0.004","11.847","0.004","21.948","0.007","90","","94.33","0.02","90","","3902","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H30 Cl6 N2 Pt S5 -","- C35 H30 Cl6 N2 Pt S5 -","- C140 H120 Cl24 N8 Pt4 S20 -","4","1","","Adams, Christopher J.; Fey, Natalie; Parfitt, Matthew; Pope, Simon J. A.; Weinstein, Julia A.","Synthesis, structures and properties of a new series of platinum-diimine-dithiolate complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4446","4456","10.1039/b709252k","","","0.71073","MoKα","","0.0486","0.0377","","","0.0812","0.085","","","","","","1.019","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006142","13.8778","0.001","7.515","0.0006","18.8451","0.0013","90","","102.196","0.007","90","","1921","0.3","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","pdt-phen","pdt-phen","","- C19 H14 Fe2 N2 O4 S2 -","- C19 H14 Fe2 N2 O4 S2 -","- C76 H56 Fe8 N8 O16 S8 -","4","1","","Orain, Pierre-Yves; Capon, Jean-François; Kervarec, Nelly; Gloaguen, Frédéric; Pétillon, François; Pichon, Roger; Schollhammer, Philippe; Talarmin, Jean","Use of 1,10-phenanthroline in diiron dithiolate derivatives related to the [Fe-Fe] hydrogenase active site.","Dalton transactions (Cambridge, England : 2003)","2007","","34","3754","3756","10.1039/b709287c","","","0.71073","MoKα","","0.0657","0.0306","","","0.0648","0.0771","","","","","","1.016","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006143","22.667","0.005","11.552","0.005","24.952","0.005","90","","111.076","0.005","90","","6097","3","89","2","89","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H69 Cl Fe4 N6 O25 -","- C52 H59 Cl Fe4 N6 O25 -","- C208 H236 Cl4 Fe16 N24 O100 -","4","1","","Boudalis, Athanassios K.; Aston, Robyn E.; Smith, Sarah J.; Mirams, Ruth E.; Riley, Mark J.; Schenk, Gerhard; Blackman, Allan G.; Hanton, Lyall R.; Gahan, Lawrence R.","Synthesis and characterization of the tetranuclear iron(III) complex of a new asymmetric multidentate ligand. A structural model for purple acid phosphatases.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5132","5139","10.1039/b709293h","","","0.71069","MoKα","","0.084","0.0585","","","0.1447","0.1608","","","","","","1.117","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006144","17.806","0.002","18.419","0.003","29.29","0.005","80.666","0.008","72.924","0.008","66.204","0.007","8392","2","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C62.5 H115 N10 O0.75 Si8 Yb2 -","- C62.5 H104 N10 O0.75 Si8 Yb2 -","- C250 H416 N40 O3 Si32 Yb8 -","4","2","","Wang, Junfeng; Cai, Tao; Yao, Yingming; Zhang, Yong; Shen, Qi","Ytterbium amides of linked bis(amidinate): synthesis, molecular structures, and reactivity for the polymerization of l-lactide","Dalton Transactions","2007","","45","5275","","10.1039/b709310a","","","0.7107","MoKα","","0.1868","0.1024","","","0.1763","0.2198","","","","","","1.087","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006145","23.288","0.002","8.6725","0.0007","20.4441","0.0019","90","","111.162","0.002","90","","3850.6","0.6","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H54 N5 O2 Si2 Yb -","- C35 H48 N5 O2 Si2 Yb -","- C140 H192 N20 O8 Si8 Yb4 -","4","1","","Wang, Junfeng; Cai, Tao; Yao, Yingming; Zhang, Yong; Shen, Qi","Ytterbium amides of linked bis(amidinate): synthesis, molecular structures, and reactivity for the polymerization of l-lactide","Dalton Transactions","2007","","45","5275","","10.1039/b709310a","","","0.7107","MoKα","","0.0605","0.0477","","","0.0945","0.0997","","","","","","1.189","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006146","24.67","0.003","8.9342","0.0011","19.672","0.003","90","","104.525","0.003","90","","4197.3","1","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H62 N5 O2 Si2 Yb -","- C39 H56 N5 O2 Si2 Yb -","- C156 H224 N20 O8 Si8 Yb4 -","4","1","","Wang, Junfeng; Cai, Tao; Yao, Yingming; Zhang, Yong; Shen, Qi","Ytterbium amides of linked bis(amidinate): synthesis, molecular structures, and reactivity for the polymerization of l-lactide","Dalton Transactions","2007","","45","5275","","10.1039/b709310a","","","0.7107","MoKα","","0.044","0.0368","","","0.0746","0.0789","","","","","","1.154","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006147","15.005","0.003","16.307","0.003","22.415","0.004","79.668","0.003","85.727","0.003","66.039","0.003","4930.7","1.6","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C49 H57 B F4 N4.5 O5.25 Zn2 -","- C49 H56.5 B F4 N4.5 O5.25 Zn2 -","- C196 H226 B4 F16 N18 O21 Zn8 -","4","2","","Champouret, Yohan D. M.; Nodes, William J.; Scrimshire, Jason A.; Singh, Kuldip; Solan, Gregory A.; Young, Isla","Sterically variable dizinc complexes bearing bis(iminopyridyl)phenolate ligands: synthesis, structures and reactivity studies.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4565","4575","10.1039/b709385c","","","0.71073","MoKα","","0.0987","0.0601","","","0.1291","0.1426","","","","","","0.971","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7006148","12.406","0.01","13.866","0.011","14.11","0.012","81.701","0.015","76.356","0.015","75.449","0.016","2274","3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H51 Cl5 N4 O2 Zn2 -","- C44 H50 Cl2 N4 O2 Zn2 -","- C88 H100 Cl4 N8 O4 Zn4 -","2","1","","Champouret, Yohan D. M.; Nodes, William J.; Scrimshire, Jason A.; Singh, Kuldip; Solan, Gregory A.; Young, Isla","Sterically variable dizinc complexes bearing bis(iminopyridyl)phenolate ligands: synthesis, structures and reactivity studies.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4565","4575","10.1039/b709385c","","","0.71073","MoKα","","0.0812","0.0553","","","0.1132","0.1206","","","","","","0.938","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7006149","11.894","0.012","25.95","0.02","13.804","0.014","90","","102.102","0.018","90","","4166","7","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C42 H43 Cl3 N6 O Zn2 -","- C42 H43 Cl3 N6 O Zn2 -","- C168 H172 Cl12 N24 O4 Zn8 -","4","2","","Champouret, Yohan D. M.; Nodes, William J.; Scrimshire, Jason A.; Singh, Kuldip; Solan, Gregory A.; Young, Isla","Sterically variable dizinc complexes bearing bis(iminopyridyl)phenolate ligands: synthesis, structures and reactivity studies.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4565","4575","10.1039/b709385c","","","0.71073","MoKα","","0.092","0.0548","","","0.0815","0.0909","","","","","","0.865","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7006150","11.756","0.004","13.837","0.005","25.758","0.01","96.318","0.006","90.532","0.007","101.77","0.007","4075","3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H40.5 Cl3 N6.5 O Zn2 -","- C36 H33 Cl3 N4 O Zn2 -","- C144 H132 Cl12 N16 O4 Zn8 -","4","2","","Champouret, Yohan D. M.; Nodes, William J.; Scrimshire, Jason A.; Singh, Kuldip; Solan, Gregory A.; Young, Isla","Sterically variable dizinc complexes bearing bis(iminopyridyl)phenolate ligands: synthesis, structures and reactivity studies.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4565","4575","10.1039/b709385c","","","0.71073","MoKα","","0.0924","0.0661","","","0.153","0.1617","","","","","","0.932","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7006151","16.694","0.005","31.326","0.009","16.28","0.005","90","","99.124","0.007","90","","8406","4","150","2","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C39 H37.5 B0.5 Cl6 F2 N2 O2.5 Zn -","- C37 H35.5 B0.5 F2 N2 O2.5 Zn -","- C296 H284 B4 F16 N16 O20 Zn8 -","8","1","","Champouret, Yohan D. M.; Nodes, William J.; Scrimshire, Jason A.; Singh, Kuldip; Solan, Gregory A.; Young, Isla","Sterically variable dizinc complexes bearing bis(iminopyridyl)phenolate ligands: synthesis, structures and reactivity studies.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4565","4575","10.1039/b709385c","","","0.71073","MoKα","","0.1779","0.0778","","","0.1521","0.1823","","","","","","0.816","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7006152","14.552","0.005","15.446","0.005","16.558","0.006","114.106","0.005","94.58","0.006","102.681","0.005","3253.7","1.9","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H65 Cl11 N6 O3 Zn3 -","- C54 H57 Cl3 N6 O3 Zn3 -","- C108 H114 Cl6 N12 O6 Zn6 -","2","1","","Champouret, Yohan D. M.; Nodes, William J.; Scrimshire, Jason A.; Singh, Kuldip; Solan, Gregory A.; Young, Isla","Sterically variable dizinc complexes bearing bis(iminopyridyl)phenolate ligands: synthesis, structures and reactivity studies.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4565","4575","10.1039/b709385c","","","0.71073","MoKα","","0.172","0.0758","","","0.1565","0.181","","","","","","0.781","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7006153","11.3674","0.0008","11.834","0.0008","13.8385","0.0009","65.052","0.005","80.316","0.005","77.999","0.005","1644.2","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H44 N4 Ni -","- C38 H44 N4 Ni -","- C76 H88 N8 Ni2 -","2","1","","Muresan, Nicoleta; Weyhermüller, Thomas; Wieghardt, Karl","Neutral bis(1,4-diaza-1,3-butadiene)nickel complexes and their corresponding monocations: molecular and electronic structures. A combined experimental and density functional theoretical study.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4390","4398","10.1039/b709390j","","","0.71073","MoKα","","0.0626","0.0427","","","0.0926","0.1014","","","","","","1.022","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006154","13.1901","0.0006","13.892","0.0006","14.9786","0.0006","93.853","0.003","93.563","0.003","94.205","0.003","2724.8","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C60 H90 N4 Ni -","- C60 H90 N4 Ni -","- C120 H180 N8 Ni2 -","2","1","","Muresan, Nicoleta; Weyhermüller, Thomas; Wieghardt, Karl","Neutral bis(1,4-diaza-1,3-butadiene)nickel complexes and their corresponding monocations: molecular and electronic structures. A combined experimental and density functional theoretical study.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4390","4398","10.1039/b709390j","","","0.71073","MoKα","","0.0803","0.0607","","","0.1183","0.1262","","","","","","1.095","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006155","7.0556","0.0006","8.2305","0.0006","18.017","0.0012","94.37","0.004","98.977","0.004","98.2","0.004","1017.69","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H22 I2 N2 Ni -","- C19 H22 I2 N2 Ni -","- C38 H44 I4 N4 Ni2 -","2","1","","Muresan, Nicoleta; Weyhermüller, Thomas; Wieghardt, Karl","Neutral bis(1,4-diaza-1,3-butadiene)nickel complexes and their corresponding monocations: molecular and electronic structures. A combined experimental and density functional theoretical study.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4390","4398","10.1039/b709390j","","","0.71073","MoKα","","0.1178","0.0806","","","0.1688","0.1915","","","","","","1.083","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006156","13.5959","0.001","12.1317","0.001","14.2676","0.001","90","","104.341","0.009","90","","2280","0.3","173","","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H30 Cl3 Cu N5 O13 -","- C11 H30 Cl3 Cu N5 O13 -","- C44 H120 Cl12 Cu4 N20 O52 -","4","1","","Siegfried, Liselotte; McMahon, C. Niamh; Baumeister, Jan; Neuburger, Markus; Kaden, Thomas A.; Anandaram, Sreekanth; Palivan, Cornelia G.","Homo- and heteropolynuclear Ni2+ and Cu2+ complexes of polytopic ligands, consisting of a tren unit substituted with three 12-membered tetraazamacrocycles.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4797","4810","10.1039/b709422a","","","0.71073","MoKα","","0.0724","0.0332","","0.0575","0.0355","0.0355","","","","","","1.0995","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006157","8.9858","0.0001","7.9727","0.0001","12.3989","0.0002","90","","96.8678","0.0008","90","","881.9","0.02","173","","173","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C11 H27 Cl2 N5 Ni O4 -","- C11 H27 Cl2 N5 Ni O4 -","- C22 H54 Cl4 N10 Ni2 O8 -","2","1","","Siegfried, Liselotte; McMahon, C. Niamh; Baumeister, Jan; Neuburger, Markus; Kaden, Thomas A.; Anandaram, Sreekanth; Palivan, Cornelia G.","Homo- and heteropolynuclear Ni2+ and Cu2+ complexes of polytopic ligands, consisting of a tren unit substituted with three 12-membered tetraazamacrocycles.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4797","4810","10.1039/b709422a","","","0.71073","MoKα","","0.0344","0.0291","","0.0361","0.0353","0.0353","","","","","","1.0409","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006158","7.4691","0.001","19.748","0.003","6.9392","0.0011","90","","105.028","0.009","90","","988.5","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-formylbenzoquinoline","","- C14 H9 N O -","- C14 H9 N O -","- C56 H36 N4 O4 -","4","1","","Prema, Dipesh; Wiznycia, Alexander V.; Scott, Benjamin M. T.; Hilborn, Jessica; Desper, John; Levy, Christopher J.","Dinuclear zinc(II) complexes of symmetric Schiff-base ligands with extended quinoline sidearms.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4788","4796","10.1039/b709454j","","","0.71073","MoKα","","0.1114","0.0771","","","0.1858","0.2041","","","","","","1.084","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7006159","6.6519","0.0002","6.6519","0.0002","56.855","0.003","90","","90","","90","","2515.71","0.17","173","2","173","2","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","1,2-bis(benzoquinoline imine) cyclohexane","","- C34 H28 N4 -","- C34 H28 N4 -","- C136 H112 N16 -","4","0.5","","Prema, Dipesh; Wiznycia, Alexander V.; Scott, Benjamin M. T.; Hilborn, Jessica; Desper, John; Levy, Christopher J.","Dinuclear zinc(II) complexes of symmetric Schiff-base ligands with extended quinoline sidearms.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4788","4796","10.1039/b709454j","","","0.71073","MoKα","","0.0557","0.0487","","","0.113","0.1178","","","","","","1.127","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006160","15.0432","0.0014","17.1668","0.0017","15.9752","0.0014","90","","111.564","0.004","90","","3836.7","0.6","203","2","203","2","","","","","","","","5","P 1 21 1","P 2yb","4","","bis(benzoquinoline imine)cyclohexane ZnCl2 (dichloromethane)2","","- C36 H32 Cl8 N4 Zn2 -","- C36 H32 Cl8 N4 Zn2 -","- C144 H128 Cl32 N16 Zn8 -","4","2","","Prema, Dipesh; Wiznycia, Alexander V.; Scott, Benjamin M. T.; Hilborn, Jessica; Desper, John; Levy, Christopher J.","Dinuclear zinc(II) complexes of symmetric Schiff-base ligands with extended quinoline sidearms.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4788","4796","10.1039/b709454j","","","0.71073","MoKα","","0.1456","0.1044","","","0.2516","0.264","","","","","","1.467","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006161","17.5549","0.001","11.7013","0.0007","17.5582","0.0011","90","","116.636","0.003","90","","3223.9","0.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","AL-3-163","","- C74 H70 Cl4 N4 Zn2 -","- C74 H70 Cl4 N4 Zn2 -","- C148 H140 Cl8 N8 Zn4 -","2","1","","Prema, Dipesh; Wiznycia, Alexander V.; Scott, Benjamin M. T.; Hilborn, Jessica; Desper, John; Levy, Christopher J.","Dinuclear zinc(II) complexes of symmetric Schiff-base ligands with extended quinoline sidearms.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4788","4796","10.1039/b709454j","","","0.71073","MoKα","","0.0535","0.036","","","0.0761","0.0806","","","","","","0.903","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006162","13.045","0.003","13.45","0.003","14.109","0.003","116.747","0.014","91.053","0.012","115.182","0.015","1931.9","0.9","203","2","203","2","","","","","","","","5","P 1","P 1","1","","AL-3-190 cyclohexanediamine bis(8-iPr-quinoline-1-CHO imine)","","- C33 H38 Cl6 N4 Zn2 -","- C33 H38 Cl6 N4 Zn2 -","- C66 H76 Cl12 N8 Zn4 -","2","2","","Prema, Dipesh; Wiznycia, Alexander V.; Scott, Benjamin M. T.; Hilborn, Jessica; Desper, John; Levy, Christopher J.","Dinuclear zinc(II) complexes of symmetric Schiff-base ligands with extended quinoline sidearms.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4788","4796","10.1039/b709454j","","","0.71073","MoKα","","0.3086","0.0985","","","0.1988","0.2738","","","","","","0.917","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006163","8.307","0.001","9.2546","0.001","13.0534","0.0009","90","","119.423","0.005","90","","874.08","0.16","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C6 H10 N8 -","- C6 H10 N8 -","- C24 H40 N32 -","4","1","","Quesada, Manuel; Kooijman, Huub; Gamez, Patrick; Sánchez Costa, José; van Koningsbruggen, Petra J.; Weinberger, Peter; Reissner, Michael; Spek, Anthony L.; Haasnoot, Jaap G.; Reedijk, Jan","[Fe(mu-btzmp)2(btzmp)2](ClO4)2: a doubly-bridged 1D spin-transition bistetrazole-based polymer showing thermal hysteresis behaviour.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5434","5440","10.1039/b709460d","","","0.71073","MoKα","","0.0445","0.0348","","","0.0818","0.0873","","","","","","1.071","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7006164","8.5157","0.0015","11.1223","0.0018","12.432","0.002","79.24","0.02","78.96","0.02","74.62","0.04","1102.8","0.4","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H40 Cl2 Fe N32 O8 -","- C24 H40 Cl2 Fe N32 O8 -","- C24 H40 Cl2 Fe N32 O8 -","1","0.5","","Quesada, Manuel; Kooijman, Huub; Gamez, Patrick; Sánchez Costa, José; van Koningsbruggen, Petra J.; Weinberger, Peter; Reissner, Michael; Spek, Anthony L.; Haasnoot, Jaap G.; Reedijk, Jan","[Fe(mu-btzmp)2(btzmp)2](ClO4)2: a doubly-bridged 1D spin-transition bistetrazole-based polymer showing thermal hysteresis behaviour.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5434","5440","10.1039/b709460d","","","0.71073","MoKα","","0.1035","0.059","","","0.1373","0.1601","","","","","","1.024","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006165","8.3039","0.0015","10.9503","0.0018","12.311","0.002","79.38","0.02","83.69","0.03","73.65","0.04","1053.8","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H40 Cl2 Fe N32 O8 -","- C24 H40 Cl2 Fe N32 O8 -","- C24 H40 Cl2 Fe N32 O8 -","1","0.5","","Quesada, Manuel; Kooijman, Huub; Gamez, Patrick; Sánchez Costa, José; van Koningsbruggen, Petra J.; Weinberger, Peter; Reissner, Michael; Spek, Anthony L.; Haasnoot, Jaap G.; Reedijk, Jan","[Fe(mu-btzmp)2(btzmp)2](ClO4)2: a doubly-bridged 1D spin-transition bistetrazole-based polymer showing thermal hysteresis behaviour.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5434","5440","10.1039/b709460d","","","0.71073","MoKα","","0.085","0.0519","","","0.1169","0.132","","","","","","1.037","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006166","6.5514","0.0015","12.477","0.003","13.595","0.003","90","","98.029","0.004","90","","1100.4","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C7 H11 Co N O8 P2 -","- C7 H11 Co N O8 P2 -","- C28 H44 Co4 N4 O32 P8 -","4","1","","Zhang, Zai-Chao; Gao, Song; Zheng, Li-Min","Cobalt diphosphonate with a new double chain structure exhibiting field-induced magnetic transition.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4681","4684","10.1039/b709474d","","","0.71073","MoKα","","0.0415","0.0346","","","0.0786","0.0813","","","","","","1.084","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006167","13.3618","0.0008","11.6388","0.0007","23.6419","0.0015","90","","100.478","0.001","90","","3615.4","0.4","110","2","110","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C39.5 H36 B Cl F4 Mo N2 O2 P2 -","- C39.5 H36 B Cl F4 Mo N2 O2 P2 -","- C158 H144 B4 Cl4 F16 Mo4 N8 O8 P8 -","4","1","","Cowley, Michael J.; Lynam, Jason M.; Whitwood, Adrian C.","Transition metal vinylidene complexes as supramolecular building blocks: nucleobase-mediated self-assembly of crystals with hexagonal symmetry.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4427","4438","10.1039/b709483c","","","0.71073","MoKα","","0.0388","0.029","","","0.0711","0.0755","","","","","","1.032","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006168","28.3109","0.0011","28.3109","0.0011","24.9373","0.0019","90","","90","","120","","17309.6","1.6","100","2","100","2","","","","","","","","7","P 63/m","-P 6c","176","","","","- C47 H39 F6 N2 O2 P3 Ru -","- C47 H39 F6 N2 O2 P3 Ru -","- C564 H468 F72 N24 O24 P36 Ru12 -","12","1","","Cowley, Michael J.; Lynam, Jason M.; Whitwood, Adrian C.","Transition metal vinylidene complexes as supramolecular building blocks: nucleobase-mediated self-assembly of crystals with hexagonal symmetry.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4427","4438","10.1039/b709483c","","","0.71073","MoKα","","0.0767","0.0611","","","0.176","0.186","","","","","","1.056","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006169","6.6537","0.0001","22.479","0.0003","8.8645","0.0001","90","","109.717","0.0007","90","","1248.12","0.03","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H19 B9 S -","- C5 H19 B9 S -","- C20 H76 B36 S4 -","4","1","","Grüner, Bohumír; Holub, Josef; Plesek, Jaromír; Stíbr, Bohumil; Thornton-Pett, Mark; Kennedy, John D.","Dimethylsulfide-dicarbaborane chemistry. Isolation and characterisation of isomers [9-(SMe2)-nido-7,8-C2B9H10-X-Me] (where X = 1, 2, 3 and 4) and some related compounds. An unusual skeletal rearrangement.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4859","4865","10.1039/b709526k","","","0.71073","MoKα","","0.0278","0.0272","","","0.0735","0.074","","","","","","1.064","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006170","12.493","0.0002","12.1073","0.0004","16.4857","0.0005","90","","90","","90","","2493.57","0.12","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C5 H19 B9 S -","- C5 H19 B9 S -","- C40 H152 B72 S8 -","8","1","","Grüner, Bohumír; Holub, Josef; Plesek, Jaromír; Stíbr, Bohumil; Thornton-Pett, Mark; Kennedy, John D.","Dimethylsulfide-dicarbaborane chemistry. Isolation and characterisation of isomers [9-(SMe2)-nido-7,8-C2B9H10-X-Me] (where X = 1, 2, 3 and 4) and some related compounds. An unusual skeletal rearrangement.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4859","4865","10.1039/b709526k","","","0.71073","MoKα","","0.0312","0.0297","","","0.0815","0.0826","","","","","","1.081","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006171","10.4622","0.0005","12.3431","0.0005","21.1918","0.0009","88.634","0.003","81.852","0.003","75.398","0.003","2621.3","0.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H66 Cu3 N6 O9 P3 S6 -","- C33 H66 Cu3 N6 O9 P3 S6 -","- C66 H132 Cu6 N12 O18 P6 S12 -","2","1","","Sokolov, Felix D.; Babashkina, Maria G.; Safin, Damir A.; Rakhmatullin, Aydar I.; Fayon, Franck; Zabirov, Nail G.; Bolte, Michael; Brusko, Vasiliy V.; Galezowska, Joanna; Kozlowski, Henryk","Complexes of N-thiophosphorylthioureas (HL) with copper(I). Crystal structures of [Cu3L3] and [Cu(PPh3)2L] chelates.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4693","4700","10.1039/b709551a","","","0.71073","MoKα","","0.0342","0.0296","","","0.0744","0.0766","","","","","","1.018","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006172","12.9095","0.0007","21.2619","0.0008","17.5378","0.0009","90","","109.403","0.004","90","","4540.4","0.4","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H54 Cu N2 O2 P3 S2 -","- C48 H54 Cu N2 O2 P3 S2 -","- C192 H216 Cu4 N8 O8 P12 S8 -","4","1","","Sokolov, Felix D.; Babashkina, Maria G.; Safin, Damir A.; Rakhmatullin, Aydar I.; Fayon, Franck; Zabirov, Nail G.; Bolte, Michael; Brusko, Vasiliy V.; Galezowska, Joanna; Kozlowski, Henryk","Complexes of N-thiophosphorylthioureas (HL) with copper(I). Crystal structures of [Cu3L3] and [Cu(PPh3)2L] chelates.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4693","4700","10.1039/b709551a","","","0.71073","MoKα","","0.0482","0.0376","","","0.0776","0.0806","","","","","","1.095","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006173","8.6013","0.0004","8.6013","0.0004","40.0329","0.0016","90","","90","","90","","2961.7","0.2","173","","173","","","","","","","","","5","I -4 2 d","I -4 2bw","122","","","","- C32 H28 N6 O8 Ru -","- C32 H28 N6 O8 Ru -","- C128 H112 N24 O32 Ru4 -","4","0.25","","Constable, Edwin C.; Dunphy, Emma L.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Schaper, Frank; Batten, Stuart R.","Expanded ligands: bis(2,2':6',2''-terpyridine carboxylic acid)ruthenium(ii) complexes as metallosupramolecular analogues of dicarboxylic acids.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4323","4332","10.1039/b709557k","","","0.71073","MoKα","","0.0414","0.0208","","0.0297","0.0217","0.0217","","","","","","1.0798","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006174","39.775","0.004","8.8662","0.0013","25.857","0.003","90","","106.393","0.007","90","","8747.9","1.9","173","","173","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C92 H84 Cl4 N12 O16 Ru2 -","- C92 H82 Cl4 N12 O16 Ru2 -","- C368 H328 Cl16 N48 O64 Ru8 -","4","1","","Constable, Edwin C.; Dunphy, Emma L.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Schaper, Frank; Batten, Stuart R.","Expanded ligands: bis(2,2':6',2''-terpyridine carboxylic acid)ruthenium(ii) complexes as metallosupramolecular analogues of dicarboxylic acids.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4323","4332","10.1039/b709557k","","","0.71073","MoKα","","0.0784","0.0367","","0.0576","0.0388","0.0388","","","","","","1.0756","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006175","8.6945","0.0002","13.4822","0.0003","16.5345","0.0004","93.1178","0.0013","97.373","0.0014","90.9146","0.0015","1918.8","0.08","123","","123","","","","","","","","","5","P -1","-P 1","2","","","","- C44 H38 N6 O9 Ru -","- C44 H32 N6 O9 Ru -","- C88 H64 N12 O18 Ru2 -","2","1","","Constable, Edwin C.; Dunphy, Emma L.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Schaper, Frank; Batten, Stuart R.","Expanded ligands: bis(2,2':6',2''-terpyridine carboxylic acid)ruthenium(ii) complexes as metallosupramolecular analogues of dicarboxylic acids.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4323","4332","10.1039/b709557k","","","0.71073","MoKα","","0.073","0.0393","","0.1043","0.0364","0.0364","","","","","","1.1438","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006176","9.7193","0.0002","9.9429","0.0003","13.2018","0.0003","90.35","0.01","108.52","0.01","115.36","0.01","1078","0.14","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H72 Al4 La2 P2 -","- C32 H72 Al4 La2 P2 -","- C32 H72 Al4 La2 P2 -","1","0.5","","Le Roux, Erwan; Nief, François; Jaroschik, Florian; Törnroos, Karl W; Anwander, Reiner","Mono-phosphacyclopentadienyl bis(tetramethylaluminate) lanthanide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4866","4870","10.1039/b709633j","","","0.71073","MoKα","","0.0134","0.0127","","","0.0343","0.0346","","","","","","1.073","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006177","14.7933","0.0018","16.262","0.002","18.559","0.002","90","","103.493","0.002","90","","4341.5","0.9","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H36 Al2 Nd P -","- C16 H36 Al2 Nd P -","- C128 H288 Al16 Nd8 P8 -","8","2","","Le Roux, Erwan; Nief, François; Jaroschik, Florian; Törnroos, Karl W; Anwander, Reiner","Mono-phosphacyclopentadienyl bis(tetramethylaluminate) lanthanide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4866","4870","10.1039/b709633j","","","0.71073","MoKα","","0.0585","0.0411","","","0.1164","0.1284","","","","","","1.084","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006178","9.9507","0.0003","10.5055","0.0003","15.9152","0.0004","73.574","0.001","86.1","0.001","68.712","0.001","1485.82","0.07","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H48 Al2 Nd P Si2 -","- C20 H48 Al2 Nd P Si2 -","- C40 H96 Al4 Nd2 P2 Si4 -","2","1","","Le Roux, Erwan; Nief, François; Jaroschik, Florian; Törnroos, Karl W; Anwander, Reiner","Mono-phosphacyclopentadienyl bis(tetramethylaluminate) lanthanide complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4866","4870","10.1039/b709633j","","","0.71073","MoKα","","0.0152","0.0139","","","0.0365","0.0373","","","","","","1.091","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006179","12.0995","0.0002","9.8513","0.0002","13.4689","0.0002","90","","98.281","0.001","90","","1588.7","0.05","298","2","298","2","","","","","","","Synthesized","7","P 1 21 1","P 2yb","4","","","","- C32 H40 Cu Fe2 N2 O4 S2 -","- C32 H40 Cu Fe2 N2 O4 S2 -","- C64 H80 Cu2 Fe4 N4 O8 S4 -","2","1","","Sahoo, Subash Chandra; Ray, Manabendra","Ferrocene substitution in amino acids strengthens the axial binding in Cu(II) complexes and separates the hydrophobic and hydrophilic region in the crystals.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5148","5155","10.1039/b709662c","","","0.71073","MoKα","","0.0555","0.0295","","","0.0546","0.0587","","","","","","0.909","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006180","11.7307","0.0003","9.5491","0.0002","17.4332","0.0004","90","","106.12","0.002","90","","1876.05","0.08","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C30 H30 Cu Fe2 N4 O10 -","- C30 H30 Cu Fe2 N4 O10 -","- C60 H60 Cu2 Fe4 N8 O20 -","2","1","","Sahoo, Subash Chandra; Ray, Manabendra","Ferrocene substitution in amino acids strengthens the axial binding in Cu(II) complexes and separates the hydrophobic and hydrophilic region in the crystals.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5148","5155","10.1039/b709662c","","","0.71073","MoKα","","0.0841","0.0544","","","0.1375","0.1563","","","","","","0.967","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006181","7.8867","0.0002","11.1661","0.0003","32.3867","0.0008","90","","90","","90","","2852.09","0.13","298","2","298","2","","","","","","","Synthesized","6","P 21 21 21","P 2ac 2ab","19","","","","- C28 H34 Cu Fe2 N2 O7 -","- C28 H34 Cu Fe2 N2 O7 -","- C112 H136 Cu4 Fe8 N8 O28 -","4","1","","Sahoo, Subash Chandra; Ray, Manabendra","Ferrocene substitution in amino acids strengthens the axial binding in Cu(II) complexes and separates the hydrophobic and hydrophilic region in the crystals.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5148","5155","10.1039/b709662c","","","0.71073","MoKα","","0.0306","0.0244","","","0.0615","0.0699","","","","","","0.96","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006182","7.4664","0.0004","14.7857","0.0008","30.211","0.0017","90","","90","","90","","3335.2","0.3","298","2","298","2","","","","","","","Synthesized","6","P 21 21 21","P 2ac 2ab","19","Cu(S-fThr)2","","","- C30 H39 Cu Fe2 N2 O10 -","- C30 H39 Cu Fe2 N2 O10 -","- C120 H156 Cu4 Fe8 N8 O40 -","4","1","","Sahoo, Subash Chandra; Ray, Manabendra","Ferrocene substitution in amino acids strengthens the axial binding in Cu(II) complexes and separates the hydrophobic and hydrophilic region in the crystals.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5148","5155","10.1039/b709662c","","","0.71073","MoKα","","0.0468","0.0321","","","0.0678","0.072","","","","","","1.125","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006183","8.9999","0.0008","9.1123","0.0008","9.4932","0.0008","90.837","0.001","94.231","0.001","94.178","0.001","774.19","0.12","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C4.5 H10 Ga3 N O14 P3 -","- C4.5 Ga3 N O14 P3 -","- C9 Ga6 N2 O28 P6 -","2","1","","Tang, Ming-Feng; Liu, Yi-Hui; Chang, Pai-Ching; Liao, Yi-Chen; Kao, Hsien-Ming; Lii, Kwang-Hwa","Ionothermal synthesis, crystal structure and solid-state NMR spectroscopy of a new organically templated gallium oxalatophosphate: (H2TMPD)0.5[Ga3(C2O4)0.5(PO4)3] (TMPD=N,N,N',N'-tetramethyl-1,3-propanediamine).","Dalton transactions (Cambridge, England : 2003)","2007","","40","4523","4528","10.1039/b709673a","","","0.71073","MoKα","","0.0362","0.031","","","0.0752","0.0774","","","","","","1.073","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006184","10.8863","0.0002","11.0417","0.0003","24.5202","0.0007","90","","95.512","0.002","90","","2933.78","0.13","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 N18 O13 Pt -","- C18 H22 N18 O13 Pt -","- C72 H88 N72 O52 Pt4 -","4","1","","Klika, Karel D.; Kivelä, Henri; Ovcharenko, Vladimir V.; Nieminen, Ville; Sillanpää, Reijo; Arpalahti, Jorma","Synthesis and NMR characterization of the cis and trans isomers of [Pt(II)(N9-adeH)2(pz)2] and X-ray crystallography of the trans isomer.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3966","3970","10.1039/b709697f","","x-ray","0.71073","MoKα","","0.0457","0.0348","","","0.0643","0.0686","","","","","","1.07","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006185","18.276","0.002","16.24","0.003","23.808","0.004","90","","95.487","0.011","90","","7033.9","1.9","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C51 H115 N3 O19 Ti W5 -","- C51 H115 N3 O19 Ti W5 -","- C204 H460 N12 O76 Ti4 W20 -","4","1","","Errington, R. John; Petkar, Sagar S.; Middleton, Paul S.; McFarlane, William; Clegg, William; Coxall, Robert A.; Harrington, Ross W.","Non-aqueous synthetic methodology for TiW(5) polyoxometalates: protonolysis of [(MeO)TiW(5)O(18)](3-) with alcohols, water and phenols.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5211","5222","10.1039/b709732h","","","0.71073","MoKα","","0.1089","0.0594","","","0.1398","0.1762","","","","","","1.093","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006186","24.94","0.002","33.629","0.003","16.9514","0.0015","90","","90.555","0.002","90","","14217","2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C106 H237 N7 O38 Ti2 W10 -","- C106 H237 N7 O38 Ti2 W10 -","- C424 H948 N28 O152 Ti8 W40 -","4","1","","Errington, R. John; Petkar, Sagar S.; Middleton, Paul S.; McFarlane, William; Clegg, William; Coxall, Robert A.; Harrington, Ross W.","Non-aqueous synthetic methodology for TiW(5) polyoxometalates: protonolysis of [(MeO)TiW(5)O(18)](3-) with alcohols, water and phenols.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5211","5222","10.1039/b709732h","","","0.71073","MoKα","","0.1316","0.0627","","","0.123","0.1612","","","","","","1.115","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006187","16.1552","0.0003","16.1552","0.0003","50.7709","0.0018","90","","90","","90","","13250.7","0.6","160","2","160","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C100 H222 N8 O37 Ti2 W10 -","- C100 H222 N8 O37 Ti2 W10 -","- C400 H888 N32 O148 Ti8 W40 -","4","0.5","","Errington, R. John; Petkar, Sagar S.; Middleton, Paul S.; McFarlane, William; Clegg, William; Coxall, Robert A.; Harrington, Ross W.","Non-aqueous synthetic methodology for TiW(5) polyoxometalates: protonolysis of [(MeO)TiW(5)O(18)](3-) with alcohols, water and phenols.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5211","5222","10.1039/b709732h","","","0.71073","MoKα","","0.0481","0.0409","","","0.0826","0.0853","","","","","","1.243","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006188","16.5172","0.0011","17.7092","0.0012","23.8534","0.0016","90","","90","","90","","6977.3","0.8","160","2","160","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C54 H113 N3 O19 Ti W5 -","- C54 H113 N3 O19 Ti W5 -","- C216 H452 N12 O76 Ti4 W20 -","4","1","","Errington, R. John; Petkar, Sagar S.; Middleton, Paul S.; McFarlane, William; Clegg, William; Coxall, Robert A.; Harrington, Ross W.","Non-aqueous synthetic methodology for TiW(5) polyoxometalates: protonolysis of [(MeO)TiW(5)O(18)](3-) with alcohols, water and phenols.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5211","5222","10.1039/b709732h","","","0.71073","MoKα","","0.0423","0.035","","0.0894","0.0813","","","","1.137","1.082","1.082","","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006189","23.8205","0.001","17.0064","0.0007","17.3076","0.0007","90","","90","","90","","7011.3","0.5","160","2","160","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C55 H115 N3 O19 Ti W5 -","- C55 H116 N3 O19 Ti W5 -","- C220 H464 N12 O76 Ti4 W20 -","4","0.5","","Errington, R. John; Petkar, Sagar S.; Middleton, Paul S.; McFarlane, William; Clegg, William; Coxall, Robert A.; Harrington, Ross W.","Non-aqueous synthetic methodology for TiW(5) polyoxometalates: protonolysis of [(MeO)TiW(5)O(18)](3-) with alcohols, water and phenols.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5211","5222","10.1039/b709732h","","","0.71073","MoKα","","0.0584","0.0452","","","0.0954","0.1006","","","","","","1.23","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006190","16.5213","0.0008","24.6857","0.0012","18.3754","0.0008","90","","90.094","0.002","90","","7494.2","0.6","160","2","160","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C58 H121 N3 O19 Ti W5 -","- C58 H121 N3 O19 Ti W5 -","- C232 H484 N12 O76 Ti4 W20 -","4","2","","Errington, R. John; Petkar, Sagar S.; Middleton, Paul S.; McFarlane, William; Clegg, William; Coxall, Robert A.; Harrington, Ross W.","Non-aqueous synthetic methodology for TiW(5) polyoxometalates: protonolysis of [(MeO)TiW(5)O(18)](3-) with alcohols, water and phenols.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5211","5222","10.1039/b709732h","","","0.71073","MoKα","","0.0992","0.0888","","","0.2031","0.2073","","","","","","1.178","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006191","36.548","0.003","15.3847","0.0014","24.951","0.002","90","","91.196","0.002","90","","14026","2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H113 N3 O20 Ti W5 -","- C54 H112 N3 O20 Ti W5 -","- C432 H896 N24 O160 Ti8 W40 -","8","2","","Errington, R. John; Petkar, Sagar S.; Middleton, Paul S.; McFarlane, William; Clegg, William; Coxall, Robert A.; Harrington, Ross W.","Non-aqueous synthetic methodology for TiW(5) polyoxometalates: protonolysis of [(MeO)TiW(5)O(18)](3-) with alcohols, water and phenols.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5211","5222","10.1039/b709732h","","","0.6882","synchrotron","","0.0841","0.0584","","","0.1499","0.1648","","","","","","1.043","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006192","17.9753","0.0009","15.5694","0.0006","25.0259","0.0011","90","","90.403","0.002","90","","7003.7","0.5","150","2","150","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C54 H113 N3 O20 Ti W5 -","- C54 H112 N3 O20 Ti W5 -","- C216 H448 N12 O80 Ti4 W20 -","4","0.5","","Errington, R. John; Petkar, Sagar S.; Middleton, Paul S.; McFarlane, William; Clegg, William; Coxall, Robert A.; Harrington, Ross W.","Non-aqueous synthetic methodology for TiW(5) polyoxometalates: protonolysis of [(MeO)TiW(5)O(18)](3-) with alcohols, water and phenols.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5211","5222","10.1039/b709732h","","","0.6934","synchrotron","","0.0513","0.0426","","","0.123","0.1274","","","","","","1.034","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006193","23.533","0.003","17.1813","0.0019","17.4145","0.0019","90","","90","","90","","7041.2","1.4","150","2","150","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C55 H113 N3 O20 Ti W5 -","- C55 H113 N3 O20 Ti W5 -","- C220 H452 N12 O80 Ti4 W20 -","4","0.5","","Errington, R. John; Petkar, Sagar S.; Middleton, Paul S.; McFarlane, William; Clegg, William; Coxall, Robert A.; Harrington, Ross W.","Non-aqueous synthetic methodology for TiW(5) polyoxometalates: protonolysis of [(MeO)TiW(5)O(18)](3-) with alcohols, water and phenols.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5211","5222","10.1039/b709732h","","","0.6882","synchrotron","","0.0805","0.0517","","","0.129","0.1451","","","","","","1.047","","","","has coordinates,has disorder","179765","2020-10-21","18:00:00",""
"7006194","8.1404","0.0005","7.1357","0.0004","46.865","0.003","90","","90.824","0.001","90","","2722","0.3","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N-cetyl-pyridinium tetracarbonylcobaltate","","","- C25 H38 Co N O4 -","- C25 H38 Co N O4 -","- C100 H152 Co4 N4 O16 -","4","1","","Deng, Fan-Guo; Hu, Bin; Sun, Wei; Chen, Jing; Xia, Chun-Gu","Novel pyridinium based cobalt carbonyl ionic liquids: synthesis, full characterization, crystal structure and application in catalysis.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4262","4267","10.1039/b709800f","","","0.71073","MoKα","","0.0994","0.0441","","","0.1055","0.1303","","","","","","1.01","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006195","12.5598","0.0005","13.7954","0.0007","14.8535","0.0006","90","","102.909","0.003","90","","2508.58","0.19","210","2","213","2","","","","","","","Crystals were picked from the reaction mixture","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H27 Cl2 N5 O3 Pd Se -","- C20 H27 Cl2 N5 O3 Pd Se -","- C80 H108 Cl8 N20 O12 Pd4 Se4 -","4","1","","Lozan, Vasile; Kersting, Berthold","Synthesis, characterisation and crystal structure of a Pd(II) complex of a heterocyclic selenium(IV) imide.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4511","4513","10.1039/b709890a","","","0.71073","MoKα","","0.0281","0.0231","","","0.0563","0.0577","","","","","","1.047","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006196","10.0461","0.0002","17.0028","0.0003","12.8224","0.0003","90","","96.286","0.001","90","","2177.05","0.08","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H34 N4 Si Ti -","- C20 H34 N4 Si Ti -","- C80 H136 N16 Si4 Ti4 -","4","1","","Bertolasi, Valerio; Boaretto, Rita; Chierotti, Michele R.; Gobetto, Roberto; Sostero, Silvana","Synthesis, characterization and reactivity of new complexes of titanium and zirconium containing a potential tridentate amidinato-cyclopentadienyl ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5179","5189","10.1039/b709923a","","","0.71073","MoKα","","0.065","0.0406","","","0.0919","0.0992","","","","","","1.048","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006197","8.6755","0.0002","12.9384","0.0003","38.3224","0.0007","90","","93.049","0.002","90","","4295.49","0.16","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H33 N5 Si Ti -","- C19 H33 N5 Si Ti -","- C152 H264 N40 Si8 Ti8 -","8","2","","Bertolasi, Valerio; Boaretto, Rita; Chierotti, Michele R.; Gobetto, Roberto; Sostero, Silvana","Synthesis, characterization and reactivity of new complexes of titanium and zirconium containing a potential tridentate amidinato-cyclopentadienyl ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5179","5189","10.1039/b709923a","","","0.71073","MoKα","","0.086","0.053","","","0.1217","0.1339","","","","","","1.032","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006198","8.633","0.0002","12.8584","0.0002","19.4243","0.0005","90","","100.036","0.001","90","","2123.23","0.08","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H33 N5 Si Ti -","- C19 H33 N5 Si Ti -","- C76 H132 N20 Si4 Ti4 -","4","1","","Bertolasi, Valerio; Boaretto, Rita; Chierotti, Michele R.; Gobetto, Roberto; Sostero, Silvana","Synthesis, characterization and reactivity of new complexes of titanium and zirconium containing a potential tridentate amidinato-cyclopentadienyl ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5179","5189","10.1039/b709923a","","","0.71073","MoKα","","0.0715","0.0415","","","0.1041","0.1153","","","","","","1.031","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006199","9.8186","0.0002","17.3817","0.0004","12.8635","0.0003","90","","100.87","0.001","90","","2155.95","0.08","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H32 N4 S Si Ti -","- C18 H32 N4 S Si Ti -","- C72 H128 N16 S4 Si4 Ti4 -","4","1","","Bertolasi, Valerio; Boaretto, Rita; Chierotti, Michele R.; Gobetto, Roberto; Sostero, Silvana","Synthesis, characterization and reactivity of new complexes of titanium and zirconium containing a potential tridentate amidinato-cyclopentadienyl ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5179","5189","10.1039/b709923a","","","0.71073","MoKα","","0.0813","0.0428","","","0.0924","0.1028","","","","","","1.026","","","","has coordinates","179765","2020-10-21","18:00:00",""
"7006200","14.045","0.004","18.43","0.005","22.74","0.006","90","","98.606","0.003","90","","5820","3","193.1","","","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C26 H35 Ir N2 O4 S2 Si -","- C26 H35 Ir N2 O4 S2 Si -","- C208 H280 Ir8 N16 O32 S16 Si8 -","8","2","","Ishiwata, Koji; Kuwata, Shigeki; Ikariya, Takao","Silylenediamido [(CH3)2Si(NTs)2(2-); Ts = p-CH3C6H4SO2] complexes of iridium: synthesis, structures and facile Si-N bond cleavage.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3606","3608","10.1039/b709930b","","","0.7107","MoKα","","","0.0394","","","","0.1302","","","","","","1.008","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006201","10.474","0.004","19.55","0.007","20.356","0.007","90","","91.55","0.005","90","","4167","3","193.1","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C44 H50 Ir N2 O4 P S2 Si -","- C44 H50 Ir N2 O4 P S2 Si -","- C176 H200 Ir4 N8 O16 P4 S8 Si4 -","4","1","","Ishiwata, Koji; Kuwata, Shigeki; Ikariya, Takao","Silylenediamido [(CH3)2Si(NTs)2(2-); Ts = p-CH3C6H4SO2] complexes of iridium: synthesis, structures and facile Si-N bond cleavage.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3606","3608","10.1039/b709930b","","","0.7107","MoKα","","","0.0527","","","","0.1191","","","","","","1.009","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006202","11.945","0.003","18.337","0.004","17.387","0.004","90","","104.708","0.003","90","","3683.6","1.5","193.1","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C32 H50 Ir N2 O7 P S2 Si -","- C32 H50 Ir N2 O7 P S2 Si -","- C128 H200 Ir4 N8 O28 P4 S8 Si4 -","4","1","","Ishiwata, Koji; Kuwata, Shigeki; Ikariya, Takao","Silylenediamido [(CH3)2Si(NTs)2(2-); Ts = p-CH3C6H4SO2] complexes of iridium: synthesis, structures and facile Si-N bond cleavage.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3606","3608","10.1039/b709930b","","","0.7107","MoKα","","","0.037","","","","0.1053","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006203","12.605","0.003","14.305","0.004","18.654","0.005","90","","90","","90","","3363.6","1.5","193.1","","","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C28 H37 Cl2 Ir N2 O5 S2 Si -","- C28 H37 Cl2 Ir N2 O5 S2 Si -","- C112 H148 Cl8 Ir4 N8 O20 S8 Si4 -","4","1","","Ishiwata, Koji; Kuwata, Shigeki; Ikariya, Takao","Silylenediamido [(CH3)2Si(NTs)2(2-); Ts = p-CH3C6H4SO2] complexes of iridium: synthesis, structures and facile Si-N bond cleavage.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3606","3608","10.1039/b709930b","","","0.7107","MoKα","","","0.0284","","","","0.0924","","","","","","1.006","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006204","14.832","0.005","19.13","0.007","30.389","0.011","90","","90","","90","","8622","5","193.1","","","","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C43 H48 Cl2 Ir N2 O4 P S2 -","- C43 H46 Cl2 Ir N2 O4 P S2 -","- C344 H368 Cl16 Ir8 N16 O32 P8 S16 -","8","1","","Ishiwata, Koji; Kuwata, Shigeki; Ikariya, Takao","Silylenediamido [(CH3)2Si(NTs)2(2-); Ts = p-CH3C6H4SO2] complexes of iridium: synthesis, structures and facile Si-N bond cleavage.","Dalton transactions (Cambridge, England : 2003)","2007","","33","3606","3608","10.1039/b709930b","","","0.7107","MoKα","","","0.0382","","","","0.1386","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006205","9.3467","0.0005","15.5678","0.0009","12.3442","0.0007","90","","98.967","0.003","90","","1774.22","0.17","150","2","150","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C40 H35 N5 P2 Pt -","- C40 H35 N5 P2 Pt -","- C80 H70 N10 P4 Pt2 -","2","1","","Mukhopadhyay, Suman; Lasri, Jamal; Januário Charmier, M. Adília; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.","Microwave synthesis of mono- and bis-tetrazolato complexes via 1,3-dipolar cycloaddition of organonitriles with platinum(ii)-bound azides","Dalton Transactions","2007","","45","5297","","10.1039/b709959b","","","0.71069","MoKα","","0.0324","0.0271","","","0.0501","0.0515","","","","","","0.963","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006206","8.4538","0.0001","11.6212","0.0002","11.9546","0.0002","69.514","0.001","81.674","0.001","83.334","0.001","1085.87","0.03","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H40 N8 P2 Pt -","- C50 H40 N8 P2 Pt -","- C50 H40 N8 P2 Pt -","1","0.5","","Mukhopadhyay, Suman; Lasri, Jamal; Januário Charmier, M. Adília; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.","Microwave synthesis of mono- and bis-tetrazolato complexes via 1,3-dipolar cycloaddition of organonitriles with platinum(ii)-bound azides","Dalton Transactions","2007","","45","5297","","10.1039/b709959b","","","0.71069","MoKα","","0.0429","0.0224","","","0.0476","0.0512","","","","","","1.024","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006207","9.824","0.0013","10.448","0.0013","12.013","0.0016","66.379","0.006","83.021","0.007","79.276","0.007","1108.5","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H38 Cl2 N8 P2 Pt -","- C50 H38 Cl2 N8 P2 Pt -","- C50 H38 Cl2 N8 P2 Pt -","1","0.5","","Mukhopadhyay, Suman; Lasri, Jamal; Januário Charmier, M. Adília; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.","Microwave synthesis of mono- and bis-tetrazolato complexes via 1,3-dipolar cycloaddition of organonitriles with platinum(ii)-bound azides","Dalton Transactions","2007","","45","5297","","10.1039/b709959b","","","0.71073","MoKα","","0.0155","0.0155","","","0.0396","0.0396","","","","","","1.052","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006208","10.129","0.0007","7.4829","0.0005","35.429","0.002","90","","96.151","0.004","90","","2669.9","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H25 N11 O Pt -","- C27 H25 N11 O Pt -","- C108 H100 N44 O4 Pt4 -","4","1","","Mukhopadhyay, Suman; Lasri, Jamal; Januário Charmier, M. Adília; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.","Microwave synthesis of mono- and bis-tetrazolato complexes via 1,3-dipolar cycloaddition of organonitriles with platinum(ii)-bound azides","Dalton Transactions","2007","","45","5297","","10.1039/b709959b","","","0.71073","MoKα","","0.0886","0.0638","","","0.1517","0.1661","","","","","","1.065","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7006209","21.8319","0.0002","10.1722","0.0001","23.6935","0.0002","90","","112.536","0.0005","90","","4860.02","0.08","160","1","160","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H69 Cl2 N2 P Ru -","- C54 H69 Cl2 N2 P Ru -","- C216 H276 Cl8 N8 P4 Ru4 -","4","1","","Ledoux, Nele; Drozdzak, Renata; Allaert, Bart; Linden, Anthony; Van Der Voort, Pascal; Verpoort, Francis","Exploring new synthetic strategies in the development of a chemically activated Ru-based olefin metathesis catalyst.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5201","5210","10.1039/b709994k","","","0.71073","MoKα","","0.0874","0.0586","","","0.1413","0.159","","","","","","1.071","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006210","16.3423","0.0002","15.4543","0.0003","16.7195","0.0002","90","","93.733","0.001","90","","4213.7","0.11","160","1","160","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H39 Cl9 N2 Ru -","- C38 H39 Cl9 N2 Ru -","- C152 H156 Cl36 N8 Ru4 -","4","1","","Ledoux, Nele; Drozdzak, Renata; Allaert, Bart; Linden, Anthony; Van Der Voort, Pascal; Verpoort, Francis","Exploring new synthetic strategies in the development of a chemically activated Ru-based olefin metathesis catalyst.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5201","5210","10.1039/b709994k","","","0.71073","MoKα","","0.0569","0.0446","","","0.1085","0.116","","","","","","1.057","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006211","12.3965","0.0007","11.8196","0.0007","19.4218","0.0008","90","","93.877","0.003","90","","2839.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H27 Cl4 N Ti2 -","- C27 H27 Cl4 N Ti2 -","- C108 H108 Cl16 N4 Ti8 -","4","1","","Lee, Sang Hoon; Wu, Chun Ji; Joung, Ui Gab; Lee, Bun Yeoul; Park, Jinil","Bimetallic phenylene-bridged Cp/amide titanium complexes and their olefin polymerization.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4608","4614","10.1039/b710017e","","","0.71073","MoKα","","0.208","0.0692","","","0.1331","0.1691","","","","","","1.013","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006212","41.074","0.003","11.8955","0.001","19.6868","0.0016","90","","107.979","0.001","90","","9149.2","1.3","187","2","187","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C46 H60 Lu N O P Si2 -","- C46 H56 Lu N O P Si2 -","- C368 H448 Lu8 N8 O8 P8 Si16 -","8","1","","Liu, Bo; Yang, Yi; Cui, Dongmei; Tang, Tao; Chen, Xuesi; Jing, Xiabin","C-H activation motivated by N,N'-diisopropylcarbodiimide within a lutetium complex stabilized by an amino-phosphine ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4252","4254","10.1039/b710039f","","","0.71073","MoKα","","0.0886","0.0523","","","0.0987","0.1106","","","","","","0.997","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006213","11.4181","0.0011","12.6687","0.0012","19.722","0.002","106.954","0.002","102.899","0.002","91.243","0.002","2648.4","0.4","187","2","187","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H71 Lu N5 O P Si -","- C50 H71 Lu N5 O P Si -","- C100 H142 Lu2 N10 O2 P2 Si2 -","2","1","","Liu, Bo; Yang, Yi; Cui, Dongmei; Tang, Tao; Chen, Xuesi; Jing, Xiabin","C-H activation motivated by N,N'-diisopropylcarbodiimide within a lutetium complex stabilized by an amino-phosphine ligand.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4252","4254","10.1039/b710039f","","","0.71073","MoKα","","0.0864","0.0655","","","0.1726","0.1884","","","","","","1.059","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006214","16.702","0.013","17.316","0.013","18.926","0.014","90","","90","","90","","5474","7","293","2","298","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C46 H88 N5 O2 Si2 Sm -","- C46 H88 N5 O2 Si2 Sm -","- C184 H352 N20 O8 Si8 Sm4 -","4","0.5","","Binda, Pascal I.; Delbridge, Ewan E.","Synthesis and characterisation of lanthanide phenolate compounds and their catalytic activity towards ring-opening polymerisation of cyclic esters.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4685","4692","10.1039/b710070a","","x-ray","0.71073","MoKα","","0.0389","0.0321","","","0.05","0.0514","","","","","","1.374","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006215","7.6291","0.0006","12.4527","0.001","15.9134","0.0013","73.02","0.001","84.921","0.001","81.796","0.001","1429.4","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","[(PaPy2Q)FeNO](ClO4)2","","","- C26 H25 Cl2 Fe N7 O10 -","- C26 H25 Cl2 Fe N7 O10 -","- C52 H50 Cl4 Fe2 N14 O20 -","2","1","","Eroy-Reveles, Aura A.; Hoffman-Luca, C. Gianna; Mascharak, Pradip K.","Formation of a triply bridged µ-oxo diiron(iii) core stabilized by two deprotonated carboxamide groups upon photorelease of NO from a {Fe‒NO}6 iron nitrosyl","Dalton Transactions","2007","","45","5268","","10.1039/b710076k","","","0.71073","MoKα","","0.0369","0.0304","","","0.0756","0.0794","","","","","","1.036","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006216","19.6095","0.001","16.2853","0.0008","19.6444","0.001","90","","110.332","0.004","90","","5882.5","0.5","90","2","90","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[QPaPy2)FeOFe(QPaPy2)](ClO4)2.3CH3CN.Et2O","","","- C58 H63 Cl2 Fe2 N13 O12 -","- C58 H63 Cl2 Fe2 N13 O12 -","- C232 H252 Cl8 Fe8 N52 O48 -","4","0.5","","Eroy-Reveles, Aura A.; Hoffman-Luca, C. Gianna; Mascharak, Pradip K.","Formation of a triply bridged µ-oxo diiron(iii) core stabilized by two deprotonated carboxamide groups upon photorelease of NO from a {Fe‒NO}6 iron nitrosyl","Dalton Transactions","2007","","45","5268","","10.1039/b710076k","","","0.71073","MoKα","","0.0854","0.0513","","","0.1307","0.1523","","","","","","1.018","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006217","16.7492","0.0005","12.6147","0.0004","17.2441","0.0005","90","","110.022","0.001","90","","3423.23","0.18","296","2","296","2","","","","","","","Synthesis","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H39 Cu F12 N9 O4 P2 -","- C24 H39 Cu F12 N9 O4 P2 -","- C96 H156 Cu4 F48 N36 O16 P8 -","4","1","","Nunes, Rute M.; Delgado, Rita; Cabral, M Fátima; Costa, Judite; Brandão, Paula; Félix, Vítor; Goodfellow, Brian J.","Properties of a new 4-imidazolyl derivative of a 14-membered tetraazamacrocyclic chelating agent.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4536","4545","10.1039/B710122H","","","0.71073","MoKα","","0.0624","0.039","","","0.0972","0.1075","","","","","","1.054","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006218","12.651","0.005","12.999","0.005","13.437","0.005","90","","96.271","0.005","90","","2196.5","1.5","200","2","200","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 Mo N4 O4 -","- C22 H22 Mo N4 O4 -","- C88 H88 Mo4 N16 O16 -","4","1","","Sánchez-Méndez, Alberto; Ortiz, Alba M.; de Jesús, Ernesto; Flores, Juan C.; Gómez-Sal, Pilar","Dendronized scorpionate complexes of molybdenum in low and high oxidation states.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5658","5669","10.1039/b710125b","","x-ray","0.71069","MoKα","","0.054","0.0358","","","0.0814","0.0895","","","","","","1.131","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006219","12.28","0.005","12.284","0.005","19.122","0.005","83.47","0.005","89.97","0.005","89.76","0.005","2865.8","1.8","200","2","200","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C29 H31 Mo N5 O3 -","- C29 H31 Mo N5 O3 -","- C116 H124 Mo4 N20 O12 -","4","2","","Sánchez-Méndez, Alberto; Ortiz, Alba M.; de Jesús, Ernesto; Flores, Juan C.; Gómez-Sal, Pilar","Dendronized scorpionate complexes of molybdenum in low and high oxidation states.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5658","5669","10.1039/b710125b","","x-ray","0.71069","MoKα","","0.1869","0.0755","","","0.1729","0.224","","","","","","1.01","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006220","8.9836","0.001","11.384","0.0012","9.369","0.001","90","","94.408","0.001","90","","955.33","0.18","120","","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H26 Co N2 O2 P2 -","- C16 H26 Co N2 O2 P2 -","- C32 H52 Co2 N4 O4 P4 -","2","0.5","","Carabineiro, Sónia A; Gomes, Pedro T.; Veiros, Luís F; Freire, Cristina; Pereira, Laura C. J.; Henriques, Rui T.; Warren, John E.; Pascu, Sofia I.","Bis(ketopyrrolyl) complexes of Co(II) stabilised by trimethylphosphine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5460","5470","10.1039/b710162g","","","0.6814","synchrotron","","0.0392","0.0323","","0.0411","0.0389","0.0389","","","","","","1.0896","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006221","8.0704","0.0005","10.0296","0.0005","13.2877","0.0008","90","","92.07","0.003","90","","1074.84","0.11","180","","180","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H30 Co N2 O2 P2 -","- C18 H30 Co N2 O2 P2 -","- C36 H60 Co2 N4 O4 P4 -","2","0.5","","Carabineiro, Sónia A; Gomes, Pedro T.; Veiros, Luís F; Freire, Cristina; Pereira, Laura C. J.; Henriques, Rui T.; Warren, John E.; Pascu, Sofia I.","Bis(ketopyrrolyl) complexes of Co(II) stabilised by trimethylphosphine ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5460","5470","10.1039/b710162g","","","0.71073","MoKα","","0.0744","0.035","","0.0596","0.0382","0.0382","","","","","","1.1132","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006222","17.657","0.003","18.687","0.003","22.178","0.004","90","","90","","90","","7318","2","130","2","130","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Bis(tetrahydrofurane)-thiobis(6-tert-butyl-4-methylphenolato)- trimethylsilylmethyl-lutetium(iii)","Bis(tetrahydrofurane)-thiobis(6-tert-butyl-4-methylphenolato)- trimethylsilylmethyl-lutetium(III)","","- C34 H55 Lu O4 S Si -","- C34 H55 Lu O4 S Si -","- C272 H440 Lu8 O32 S8 Si8 -","8","1","","Konkol, Marcin; Spaniol, Thomas P.; Kondracka, Małgorzata; Okuda, Jun","Lutetium alkyl and hydride complexes in a non-cyclopentadienyl coordination environment.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4095","4102","10.1039/b710228n","","","0.71073","MoKα","","0.1013","0.0848","","","0.1504","0.1552","","","","","","1.57","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006223","10.82","0.003","23.858","0.006","16.458","0.004","90","","93.261","0.004","90","","4241.6","1.9","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Bis(tetrahydrofurane)-thiobis(4,6-di-tert-butylphenolato)- trimethylsilylmethyl-lutetium(iii)","Bis(tetrahydrofurane)-thiobis(4,6-di-tert-butylphenolato)- trimethylsilylmethyl-lutetium(III)","","- C40 H67 Lu O4 S Si -","- C40 H67 Lu O4 S Si -","- C160 H268 Lu4 O16 S4 Si4 -","4","1","","Konkol, Marcin; Spaniol, Thomas P.; Kondracka, Małgorzata; Okuda, Jun","Lutetium alkyl and hydride complexes in a non-cyclopentadienyl coordination environment.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4095","4102","10.1039/b710228n","","","0.71073","MoKα","","0.0448","0.0313","","","0.0697","0.0748","","","","","","1.014","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006224","8.7517","0.0017","12.703","0.002","16.986","0.003","75.023","0.004","82.049","0.005","75.436","0.004","1760.2","0.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","Tetrahydrofurane-1,4-dithiabutanediyl-bis(6-tert-butyl-4- methylphenolato)-trimethylsilylmethyl-lutetium(iii)","Tetrahydrofurane-1,4-dithiabutanediyl-bis(6-tert-butyl-4-methylphenolato)- trimethylsilylmethyl-lutetium(III)","","- C32 H51 Lu O3 S2 Si -","- C32 H51 Lu O3 S2 Si -","- C64 H102 Lu2 O6 S4 Si2 -","2","1","","Konkol, Marcin; Spaniol, Thomas P.; Kondracka, Małgorzata; Okuda, Jun","Lutetium alkyl and hydride complexes in a non-cyclopentadienyl coordination environment.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4095","4102","10.1039/b710228n","","","0.71073","MoKα","","0.0482","0.0413","","","0.0843","0.0873","","","","","","1.1","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006225","33.017","0.005","18.291","0.003","20.635","0.003","90","","108.832","0.003","90","","11795","3","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Bis(tetrahydrofurane)-thiobis(6-tert-butyl-4-methylphenolato)- triphenylmethoxy-lutetium(iii)","Bis(tetrahydrofurane)-thiobis(6-tert-butyl-4-methylphenolato)- triphenylmethoxy-lutetium(III)","","- C55.75 H74 Lu O5.75 S -","- C55.75 H74 Lu O5.75 S -","- C446 H592 Lu8 O46 S8 -","8","1","","Konkol, Marcin; Spaniol, Thomas P.; Kondracka, Małgorzata; Okuda, Jun","Lutetium alkyl and hydride complexes in a non-cyclopentadienyl coordination environment.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4095","4102","10.1039/b710228n","","","0.71073","MoKα","","0.0936","0.0501","","","0.1294","0.1488","","","","","","1.057","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006226","14.71","0.003","13.582","0.003","22.91","0.004","90","","108.29","0.004","90","","4346","1.5","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Tris(tetrahydrofurane)-thiobis(6-tert-butyl-4- methylphenolato)-diphenylmethoxy-lutetium(iii)","Tris(tetrahydrofurane)-thiobis(6-tert-butyl-4-methylphenolato)- diphenylmethoxy-lutetium(III)","","- C47 H63 Lu O6 S -","- C47 H63 Lu O6 S -","- C188 H252 Lu4 O24 S4 -","4","1","","Konkol, Marcin; Spaniol, Thomas P.; Kondracka, Małgorzata; Okuda, Jun","Lutetium alkyl and hydride complexes in a non-cyclopentadienyl coordination environment.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4095","4102","10.1039/b710228n","","","0.71073","MoKα","","0.07","0.042","","","0.0884","0.0973","","","","","","1.015","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006227","29.835","0.009","17.805","0.006","18.098","0.006","90","","121.466","0.005","90","","8200","5","140","2","140","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Bis(tetrahydrofurane)-mu-hydrido-thiobis(6-tert-butyl-4- methylphenolato)-lutetium(iii) dimer","Bis(tetrahydrofurane)-μ-hydrido-thiobis(6-tert-butyl-4-methylphenolato)- lutetium(III) dimer","","- C39 H65 Lu O5 S -","- C39 H65 Lu O5 S -","- C312 H520 Lu8 O40 S8 -","8","1","","Konkol, Marcin; Spaniol, Thomas P.; Kondracka, Małgorzata; Okuda, Jun","Lutetium alkyl and hydride complexes in a non-cyclopentadienyl coordination environment.","Dalton transactions (Cambridge, England : 2003)","2007","","36","4095","4102","10.1039/b710228n","","","0.71073","MoKα","","0.0332","0.0256","","","0.0633","0.0682","","","","","","0.987","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006228","13.4999","0.0018","12.9944","0.0016","17.35","0.002","90","","101.761","0.005","90","","2979.7","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C65 H90 Cl2 N4 O2 Ti2 -","- C65 H90 Cl2 N4 O2 Ti2 -","- C130 H180 Cl4 N8 O4 Ti4 -","2","0.5","","Nikiforov, Grigory B.; Roesky, Herbert W.; Jones, Peter G.; Oswald, Rainer B.; Noltemeyer, Mathias","A ligand influence on the stability of heterobimetallic complexes containing the Ti(µ-O)Al skeleton. Transformation of heterometallic systems to the homometallic Ti(iv) and Al(iii) complexes","Dalton Transactions","2007","","37","4149","","10.1039/b710470g","","","0.71073","MoKα","","0.045","0.0332","","","0.0814","0.0875","","","","","","1.033","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006229","18.708","0.0017","20.4316","0.0018","9.0082","0.0008","90","","110.296","0.004","90","","3229.5","0.5","133","2","133","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C74 H98 N4 O2 Ti2 -","- C74 H98 N4 O2 Ti2 -","- C148 H196 N8 O4 Ti4 -","2","0.25","","Nikiforov, Grigory B.; Roesky, Herbert W.; Jones, Peter G.; Oswald, Rainer B.; Noltemeyer, Mathias","A ligand influence on the stability of heterobimetallic complexes containing the Ti(µ-O)Al skeleton. Transformation of heterometallic systems to the homometallic Ti(iv) and Al(iii) complexes","Dalton Transactions","2007","","37","4149","","10.1039/b710470g","","","0.71073","MoKα","","0.1165","0.076","","","0.192","0.2132","","","","","","1.041","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006230","8.9759","0.0011","13.085","0.0016","13.5178","0.0016","88.349","0.004","79.207","0.004","80.387","0.004","1537.7","0.3","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H102 N4 O2 Ti2 -","- C66 H102 N4 O2 Ti2 -","- C66 H102 N4 O2 Ti2 -","1","0.5","","Nikiforov, Grigory B.; Roesky, Herbert W.; Jones, Peter G.; Oswald, Rainer B.; Noltemeyer, Mathias","A ligand influence on the stability of heterobimetallic complexes containing the Ti(µ-O)Al skeleton. Transformation of heterometallic systems to the homometallic Ti(iv) and Al(iii) complexes","Dalton Transactions","2007","","37","4149","","10.1039/b710470g","","","0.71073","MoKα","","0.0755","0.0543","","","0.1476","0.1659","","","","","","1.043","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006231","11.535","0.003","14.525","0.003","13.464","0.003","90","","108.28","0.01","90","","2142","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H32 N2 S2 Si -","- C19 H32 N2 S2 Si -","- C76 H128 N8 S8 Si4 -","4","1","","So, Cheuk-Wai; Roesky, Herbert W.; Oswald, Rainer B.; Pal, Aritra; Jones, Peter G.","Synthesis and characterization of [{PhC(NBut)2}Si(S)SBut]: a silicon thioester analogue with the Si(S)‒S-skeleton","Dalton Transactions","2007","","45","5241","","10.1039/b710485e","","","1.54178","CuKα","","0.0329","0.0308","","","0.078","0.0797","","","","","","1.046","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7006232","49.314","0.01","19.934","0.004","36.554","0.007","90","","127.1","0.03","90","","28660","15","90","2","90","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C252 H363 Ga16 N32 O81.5 -","- C252 H118 Ga16 N32 O81.5 -","- C1008 H472 Ga64 N128 O326 -","4","1","","Park, Mira; John, Rohith P.; Moon, Dohyun; Lee, Kyungjin; Kim, Ghyung Hwa; Lah, Myoung Soo","Two octanuclear gallium metallamacrocycles of topologically different connectivities.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5412","5418","10.1039/b710531b","","","0.7","synchrotron","","0.0732","0.055","","","0.1484","0.1607","","","","","","0.986","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006233","24.973","0.005","26.951","0.005","27.543","0.006","90","","90","","90","","18538","6","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C109.5 H146 Ga8 N31 O45 -","- C109.6 H120 Ga8 N31 O45 -","- C438.4 H480 Ga32 N124 O180 -","4","1","","Park, Mira; John, Rohith P.; Moon, Dohyun; Lee, Kyungjin; Kim, Ghyung Hwa; Lah, Myoung Soo","Two octanuclear gallium metallamacrocycles of topologically different connectivities.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5412","5418","10.1039/b710531b","","","0.7","synchrotron","","0.0653","0.0437","","","0.1036","0.1098","","","","","","0.936","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006234","73.383","0.015","37.028","0.007","40.988","0.008","90","","110.56","0.03","90","","104280","4","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C407 H612 Ga28 N112 O193 -","- C407 H419 Ga28 N112 O192 -","- C3256 H3352 Ga224 N896 O1536 -","8","1","","Park, Mira; John, Rohith P.; Moon, Dohyun; Lee, Kyungjin; Kim, Ghyung Hwa; Lah, Myoung Soo","Two octanuclear gallium metallamacrocycles of topologically different connectivities.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5412","5418","10.1039/b710531b","","","0.7","synchrotron","","0.1061","0.0614","","","0.1745","0.1984","","","","","","1.083","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006235","19.861","0.004","21.886","0.004","22","0.004","107.81","0.03","111.54","0.03","102.31","0.03","7876","5","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C358 H308 La12 O64 -","- C352 H276 La12 O64 -","- C352 H276 La12 O64 -","1","0.5","","Andrews, Philip C.; Beck, Tobias; Forsyth, Craig M.; Fraser, Benjamin H.; Junk, Peter C.; Massi, Massimiliano; Roesky, Peter W.","Templated assembly of a mu6-CO3 2- dodecanuclear lanthanum dibenzoylmethanide hydroxido cluster with concomitant formation of phenylglyoxylate.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5651","5654","10.1039/b710534g","","","0.71073","MoKα","","0.0681","0.0536","","","0.1135","0.1229","","","","","","1.098","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006236","10.004","0.0014","17.732","0.002","18.719","0.003","90","","101.49","0.004","90","","3254","0.8","223","2","223","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C70 H66 F6 N2 O6 P4 Pd2 S2 -","- C70 H66 F6 N2 O6 P4 Pd2 S2 -","- C140 H132 F12 N4 O12 P8 Pd4 S4 -","2","0.5","","Neo, Kian Eang; Huynh, Han Vinh; Koh, Lip Lin; Henderson, William; Hor, T. S. Andy","Dinuclear PCP pincer complexes from Lewis acidic [Pd(OTf)(PCP)] and basic [Pd(4-Spy)(PCP)] (OTf = triflate; 4-Spy = 4-pyridinethiolate; PCP = (-)CH(CH(2)CH(2)PPh(2))(2)).","Dalton transactions (Cambridge, England : 2003)","2007","","48","5701","5709","10.1039/b710752h","","","0.71073","MoKα","","0.1025","0.0637","","","0.1244","0.1382","","","","","","1.038","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006237","21.0633","0.0008","21.651","0.0008","39.0514","0.0015","90","","90","","90","","17809.1","1.2","223","2","223","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C94 H86 F6 Fe O6 P6 Pd2 S2 -","- C94 H86 F6 Fe O6 P6 Pd2 S2 -","- C752 H688 F48 Fe8 O48 P48 Pd16 S16 -","8","1","","Neo, Kian Eang; Huynh, Han Vinh; Koh, Lip Lin; Henderson, William; Hor, T. S. Andy","Dinuclear PCP pincer complexes from Lewis acidic [Pd(OTf)(PCP)] and basic [Pd(4-Spy)(PCP)] (OTf = triflate; 4-Spy = 4-pyridinethiolate; PCP = (-)CH(CH(2)CH(2)PPh(2))(2)).","Dalton transactions (Cambridge, England : 2003)","2007","","48","5701","5709","10.1039/b710752h","","","0.71073","MoKα","","0.1336","0.0675","","","0.1507","0.1768","","","","","","0.993","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006238","22.749","0.003","9.4172","0.0012","29.902","0.004","90","","97.231","0.003","90","","6355","1.4","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35.5 H36 N O0.5 P2 Pd S -","- C35.5 H36 N O0.5 P2 Pd S -","- C284 H288 N8 O4 P16 Pd8 S8 -","8","1","","Neo, Kian Eang; Huynh, Han Vinh; Koh, Lip Lin; Henderson, William; Hor, T. S. Andy","Dinuclear PCP pincer complexes from Lewis acidic [Pd(OTf)(PCP)] and basic [Pd(4-Spy)(PCP)] (OTf = triflate; 4-Spy = 4-pyridinethiolate; PCP = (-)CH(CH(2)CH(2)PPh(2))(2)).","Dalton transactions (Cambridge, England : 2003)","2007","","48","5701","5709","10.1039/b710752h","","","0.71073","MoKα","","0.0498","0.0418","","","0.0866","0.0897","","","","","","1.149","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006239","12.9468","0.0005","17.4888","0.0007","26.5948","0.0011","90","","91.388","0.001","90","","6019.9","0.4","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C63 H62 F6 N P5 Pd2 S -","- C63 H62 F6 N P5 Pd2 S -","- C252 H248 F24 N4 P20 Pd8 S4 -","4","1","","Neo, Kian Eang; Huynh, Han Vinh; Koh, Lip Lin; Henderson, William; Hor, T. S. Andy","Dinuclear PCP pincer complexes from Lewis acidic [Pd(OTf)(PCP)] and basic [Pd(4-Spy)(PCP)] (OTf = triflate; 4-Spy = 4-pyridinethiolate; PCP = (-)CH(CH(2)CH(2)PPh(2))(2)).","Dalton transactions (Cambridge, England : 2003)","2007","","48","5701","5709","10.1039/b710752h","","","0.71073","MoKα","","0.0573","0.0482","","","0.1021","0.1058","","","","","","1.182","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006240","9.427","0.0007","10.6781","0.0008","15.8613","0.0012","98.489","0.002","93.482","0.002","114.897","0.001","1418.89","0.19","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H29 F3 O3 P2 Pd S -","- C30 H29 F3 O3 P2 Pd S -","- C60 H58 F6 O6 P4 Pd2 S2 -","2","1","","Neo, Kian Eang; Huynh, Han Vinh; Koh, Lip Lin; Henderson, William; Hor, T. S. Andy","Dinuclear PCP pincer complexes from Lewis acidic [Pd(OTf)(PCP)] and basic [Pd(4-Spy)(PCP)] (OTf = triflate; 4-Spy = 4-pyridinethiolate; PCP = (-)CH(CH(2)CH(2)PPh(2))(2)).","Dalton transactions (Cambridge, England : 2003)","2007","","48","5701","5709","10.1039/b710752h","","","0.71073","MoKα","","0.0356","0.0313","","","0.0726","0.078","","","","","","1.066","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006241","30.736","0.002","30.736","0.002","8.7792","0.0013","90","","90","","120","","7182.6","1.3","200","2","200","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C15 H14 Cu K N O6 -","- C15 H14 Cu K N O6 -","- C270 H252 Cu18 K18 N18 O108 -","18","1","","Spina, Giuseppe La; Clérac, Rodolphe; Collins, Emily S.; McCabe, Thomas; Venkatesan, Munuswamy; Ichinose, Izumi; Schmitt, Wolfgang","Engineering coordination assemblies of dinuclear CuII complexes","Dalton Transactions","2007","","45","5248","","10.1039/b710828a","","","0.71073","MoKα","","0.0338","0.0276","","","0.081","0.091","","","","","","1.138","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006242","8.7578","0.0017","11.143","0.002","12.529","0.002","84.479","0.004","81.501","0.004","71.648","0.004","1146.1","0.4","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H19 Cu K2 N O11 -","- C18 H19 Cu K2 N O11 -","- C36 H38 Cu2 K4 N2 O22 -","2","1","","Spina, Giuseppe La; Clérac, Rodolphe; Collins, Emily S.; McCabe, Thomas; Venkatesan, Munuswamy; Ichinose, Izumi; Schmitt, Wolfgang","Engineering coordination assemblies of dinuclear CuII complexes","Dalton Transactions","2007","","45","5248","","10.1039/b710828a","","","0.71073","MoKα","","0.0477","0.0405","","","0.1085","0.1132","","","","","","0.999","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006243","10.9896","0.0007","32.351","0.002","19.9026","0.0014","90","","95.376","0.002","90","","7044.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C68 H108 Li4 N4 O4 -","- C68 H108 Li4 N4 O4 -","- C272 H432 Li16 N16 O16 -","4","1","","Huang, Chi-An; Chen, Chi-Tien","Lithium complexes supported by amine bis-phenolate ligands as efficient catalysts for ring-opening polymerization of L-lactide.","Dalton transactions (Cambridge, England : 2003)","2007","","47","5561","5566","10.1039/b711100b","","","0.71073","MoKα","","0.1639","0.0649","","","0.1635","0.2059","","","","","","0.916","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006244","31.642","0.003","17.4448","0.0018","20.959","0.002","90","","129.874","0.002","90","","8878.8","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39.5 H66.4 Li2 N O3 -","- C39.5 H66.4 Li2 N O3 -","- C316 H531.2 Li16 N8 O24 -","8","1","","Huang, Chi-An; Chen, Chi-Tien","Lithium complexes supported by amine bis-phenolate ligands as efficient catalysts for ring-opening polymerization of L-lactide.","Dalton transactions (Cambridge, England : 2003)","2007","","47","5561","5566","10.1039/b711100b","","","0.71073","MoKα","","0.1124","0.0672","","","0.2022","0.2422","","","","","","1.192","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006245","9.4797","0.0017","12.81","0.002","15.438","0.003","95.307","0.003","106.674","0.004","103.336","0.004","1722","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H102 Li2 N4 O4 -","- C72 H102 Li2 N4 O4 -","- C72 H102 Li2 N4 O4 -","1","0.5","","Huang, Chi-An; Chen, Chi-Tien","Lithium complexes supported by amine bis-phenolate ligands as efficient catalysts for ring-opening polymerization of L-lactide.","Dalton transactions (Cambridge, England : 2003)","2007","","47","5561","5566","10.1039/b711100b","","","0.71073","MoKα","","0.0875","0.0553","","","0.153","0.1721","","","","","","1.016","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006246","10.752","0.001","13.8559","0.0013","14.0999","0.0012","99.985","0.002","106.68","0.002","108.834","0.002","1820.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C70 H114 Li2 N2 O7 -","- C70 H114 Li2 N2 O7 -","- C70 H114 Li2 N2 O7 -","1","0.5","","Huang, Chi-An; Chen, Chi-Tien","Lithium complexes supported by amine bis-phenolate ligands as efficient catalysts for ring-opening polymerization of L-lactide.","Dalton transactions (Cambridge, England : 2003)","2007","","47","5561","5566","10.1039/b711100b","","","0.71073","MoKα","","0.1047","0.0642","","","0.1714","0.1939","","","","","","1.086","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006247","14.611","0.0003","19.0394","0.0003","19.8132","0.0004","62.012","0.002","73.056","0.002","85.878","0.002","4642.07","0.19","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C90 H73.5 B Cl10.5 N8 O4 P4 Tl -","- C90 H73.5 B Cl10.5 N8 O4 P4 Tl -","- C180 H147 B2 Cl21 N16 O8 P8 Tl2 -","2","1","","Kealey, Steven; Long, Nicholas J.; White, Andrew J. P.; Gee, Antony D.","A novel tetrakis(pyrazolyl)borate ligand bearing triphenylphosphine oxide substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4763","4765","10.1039/b711121e","","","0.71073","MoKα","","0.0764","0.043","","","0.0847","0.094","","","","","","0.962","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006248","25.0529","0.0002","13.1352","0.0001","26.4601","0.0002","90","","106.56","0.001","90","","8346.19","0.12","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C88 H80 B Eu N10 O14 P4 -","- C88 H80 B Eu N10 O14 P4 -","- C352 H320 B4 Eu4 N40 O56 P16 -","4","1","","Kealey, Steven; Long, Nicholas J.; White, Andrew J. P.; Gee, Antony D.","A novel tetrakis(pyrazolyl)borate ligand bearing triphenylphosphine oxide substituents.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4763","4765","10.1039/b711121e","","","1.54184","CuKα","","0.0419","0.0343","","","0.0918","0.0986","","","","","","1.057","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006249","14.759","0.014","17.125","0.019","24.16","0.03","90","","103.651","0.01","90","","5934","11","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C61 H56 Br N5 O4 P4 W -","- C61 H56 Br N5 O4 P4 W -","- C244 H224 Br4 N20 O16 P16 W4 -","4","1","","Colquhoun, Howard M.; Chan, Yun Fu; Cardin, Christine J.; Drew, Michael G. B.; Gan, Yu; Abd El Kader, Kareem; White, Terence M.","The oxadiazolyldiazenido(1-) ligand: a remarkably versatile platform for the synthesis of heteropolynuclear transition metal complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3864","3867","10.1039/b711166p","","","0.71073","MoKα","","0.0674","0.0533","","","0.1246","0.1367","","","","","","1.167","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006250","16.69","0.009","17.33","0.003","20.19","0.005","90","","90.54","0.04","90","","5839","4","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C61 H57 Br N4 O3 P4 W -","- C61 H53 Br N4 O3 P4 W -","- C244 H212 Br4 N16 O12 P16 W4 -","4","1","","Colquhoun, Howard M.; Chan, Yun Fu; Cardin, Christine J.; Drew, Michael G. B.; Gan, Yu; Abd El Kader, Kareem; White, Terence M.","The oxadiazolyldiazenido(1-) ligand: a remarkably versatile platform for the synthesis of heteropolynuclear transition metal complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3864","3867","10.1039/b711166p","","","1.5418","Cukα","","0.1218","0.0841","","","0.1804","0.1893","","","","","","0.841","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006251","17.84","0.02","14.861","0.017","27.18","0.03","90","","101.124","0.01","90","","7071","14","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C123 H114 Br2 Cl2 N10 O6 P8 Pd W2 -","- C123 H108 Br2 Cl2 N10 O6 P8 Pd W2 -","- C246 H216 Br4 Cl4 N20 O12 P16 Pd2 W4 -","2","0.5","","Colquhoun, Howard M.; Chan, Yun Fu; Cardin, Christine J.; Drew, Michael G. B.; Gan, Yu; Abd El Kader, Kareem; White, Terence M.","The oxadiazolyldiazenido(1-) ligand: a remarkably versatile platform for the synthesis of heteropolynuclear transition metal complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3864","3867","10.1039/b711166p","","","0.71073","MoKα","","0.2836","0.1381","","","0.2638","0.3051","","","","","","1.18","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006252","14.2326","0.0015","26.598","0.003","21.292","0.002","90","","108.357","0.01","90","","7650.1","1.5","120","2","120","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C132 H160 Br2 Cl4 N10 O26 P8 Rh2 W2 -","- C132 H136 Br2 Cl4 N10 O26 P8 Rh2 W2 -","- C264 H272 Br4 Cl8 N20 O52 P16 Rh4 W4 -","2","0.5","","Colquhoun, Howard M.; Chan, Yun Fu; Cardin, Christine J.; Drew, Michael G. B.; Gan, Yu; Abd El Kader, Kareem; White, Terence M.","The oxadiazolyldiazenido(1-) ligand: a remarkably versatile platform for the synthesis of heteropolynuclear transition metal complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3864","3867","10.1039/b711166p","","","0.71073","MoKα","","0.1625","0.0794","","","0.1939","0.233","","","","","","1.007","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006253","12.1773","0.0007","14.9382","0.001","20.6774","0.0012","72.028","0.006","87.447","0.005","74.688","0.005","3448","0.4","150","2","150","2","","","","","","","","9","P -1","-P 1","2","","","","- C75 H76 Br Fe N5 O4 P4 Pd W -","- C75 H75 Br Fe N5 O4 P4 Pd W -","- C150 H150 Br2 Fe2 N10 O8 P8 Pd2 W2 -","2","1","","Colquhoun, Howard M.; Chan, Yun Fu; Cardin, Christine J.; Drew, Michael G. B.; Gan, Yu; Abd El Kader, Kareem; White, Terence M.","The oxadiazolyldiazenido(1-) ligand: a remarkably versatile platform for the synthesis of heteropolynuclear transition metal complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3864","3867","10.1039/b711166p","","","0.71073","MoKα","","0.0814","0.0494","","","0.1164","0.1239","","","","","","0.958","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006254","9.75","0.0019","20.124","0.006","11.594","0.002","90","","90","","90","","2274.8","0.9","158","2","158","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C12 H30.5 Cd Cl2 N2 O14.25 -","- C12 H26 Cd Cl2 N2 O14.25 -","- C48 H104 Cd4 Cl8 N8 O57 -","4","0.5","","Janzen, Daron E.; Botros, Maikel E.; VanDerveer, Donald G.; Grant, Gregory J.","Fixation of atmospheric carbon dioxide by a cadmium(ii) macrocyclic complex","Dalton Transactions","2007","","45","5316","","10.1039/b711187h","","","0.71073","MoKα","","0.0597","0.053","","","0.1346","0.1428","","","","","","1.095","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7006255","12.627","0.003","13.415","0.003","21.981","0.004","92.93","0.03","96.77","0.03","117.74","0.03","3248.6","1.6","163","2","163","2","","","","","","","","6","P -1","-P 1","2","","","","- C82 H170 Cd6 Cl8 N16 O63 -","- C82 H170 Cd6 Cl8 N16 O63 -","- C82 H170 Cd6 Cl8 N16 O63 -","1","0.5","","Janzen, Daron E.; Botros, Maikel E.; VanDerveer, Donald G.; Grant, Gregory J.","Fixation of atmospheric carbon dioxide by a cadmium(ii) macrocyclic complex","Dalton Transactions","2007","","45","5316","","10.1039/b711187h","","","0.71073","MoKα","","0.0693","0.0498","","","0.1178","0.1262","","","","","","1.063","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006256","9.403","0.005","19.844","0.005","10.566","0.005","90","0.005","114.647","0.005","90","0.005","1791.9","1.4","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C32 H36 O10 P2 Pd S2 -","- C32 H36 O10 P2 Pd S2 -","- C64 H72 O20 P4 Pd2 S4 -","2","1","","Bettucci, Lorenzo; Bianchini, Claudio; Claver, Carmen; Suarez, Eduardo J Garcia; Ruiz, Aurora; Meli, Andrea; Oberhauser, Werner","Ligand effects in the non-alternating CO-ethylene copolymerization by palladium(II) catalysis.","Dalton transactions (Cambridge, England : 2003)","2007","","47","5590","5602","10.1039/b711280g","","","0.71069","MoKα","","0.0306","0.0299","","","0.0827","0.0832","","","","","","1.081","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006257","10.4583","0.0003","10.4583","0.0003","13.6296","0.0008","90","","90","","90","","1490.75","0.11","293","2","293","2","","","","","","","","5","P 42/n m c :2","-P 4ac 2a","137","","","","- C5 H3 Mn N5 O2.25 -","- C5 H3 Mn N5 O2.25 -","- C40 H24 Mn8 N40 O18 -","8","0.5","","Sengupta, Oindrila; Chakrabarty, Rajesh; Mukherjee, Partha Sarathi","Dual role of azide in the formation of a 3D coordination polymer containing bridging 5-pyrimidinecarboxylate.","Dalton transactions (Cambridge, England : 2003)","2007","","40","4514","4516","10.1039/b711346c","","","0.71073","MoKα","","0.0342","0.0273","","","0.0756","0.0802","","","","","","1.048","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006258","11.8044","0.0009","12.0886","0.001","20.6794","0.0017","92.677","0.007","98.768","0.006","97.127","0.006","2887.4","0.4","150","2","155","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H16 Br2 Ge6 Mn6 O32 -","- C38 H16 Br2 Ge6 Mn6 O32 -","- C76 H32 Br4 Ge12 Mn12 O64 -","2","1","","Schenk, Christian; Schnepf, Andreas","Ge4Br4[Mn(CO)5]4 and Ge6Br2[Mn(CO)5]6: first germanium cluster compounds containing Mn(CO)5 ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5400","5404","10.1039/b711404d","","","0.71073","MoKα","","0.0856","0.0563","","","0.1417","0.1567","","","","","","0.985","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006259","11.34","0.002","13.759","0.003","15.402","0.003","82.29","0.03","78.9","0.03","78.83","0.03","2301.8","0.9","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H16 Br4 Ge4 Mn4 O22 -","- C28 H16 Br4 Ge4 Mn4 O22 -","- C56 H32 Br8 Ge8 Mn8 O44 -","2","1","","Schenk, Christian; Schnepf, Andreas","Ge4Br4[Mn(CO)5]4 and Ge6Br2[Mn(CO)5]6: first germanium cluster compounds containing Mn(CO)5 ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5400","5404","10.1039/b711404d","","","0.71073","MoKα","","0.0887","0.052","","","0.1098","0.1229","","","","","","0.998","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006260","9.757","0.002","10.193","0.002","11.011","0.002","95.063","0.004","109.391","0.004","115.267","0.003","899.5","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H17 Au F5 N3 O -","- C16 H17 Au F5 N3 O -","- C32 H34 Au2 F10 N6 O2 -","2","1","","Bartolomé, Camino; Carrasco-Rando, Marta; Coco, Silverio; Cordovilla, Carlos; Espinet, Pablo; Martín-Alvarez, Jose M.","Gold(i)‒carbenes derived from 4-pyridylisocyanide complexes: supramolecular macrocycles supported by hydrogen bonds, and luminescent behavior","Dalton Transactions","2007","","45","5339","","10.1039/b711430c","","","0.71073","MoKα","","0.0308","0.0299","","","0.0857","0.0864","","","","","","1.08","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7006261","10.714","0.003","12.89","0.004","19.055","0.006","98.662","0.007","103.113","0.006","105.187","0.007","2410.9","1.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H17 Au F9 N3 -","- C19.02 H17.05 Au F9 N3 -","- C76.08 H68.2 Au4 F36 N12 -","4","2","","Bartolomé, Camino; Carrasco-Rando, Marta; Coco, Silverio; Cordovilla, Carlos; Espinet, Pablo; Martín-Alvarez, Jose M.","Gold(i)‒carbenes derived from 4-pyridylisocyanide complexes: supramolecular macrocycles supported by hydrogen bonds, and luminescent behavior","Dalton Transactions","2007","","45","5339","","10.1039/b711430c","","","0.71073","MoKα","","0.0618","0.0413","","","0.1189","0.1365","","","","","","1.071","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006262","9.457","0.0008","14.2139","0.0013","15.7496","0.0014","63.952","0.002","89.816","0.002","79.969","0.002","1866.5","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H11 Au F9 N3 -","- C16 H11 Au F9 N3 -","- C64 H44 Au4 F36 N12 -","4","2","","Bartolomé, Camino; Carrasco-Rando, Marta; Coco, Silverio; Cordovilla, Carlos; Espinet, Pablo; Martín-Alvarez, Jose M.","Gold(i)‒carbenes derived from 4-pyridylisocyanide complexes: supramolecular macrocycles supported by hydrogen bonds, and luminescent behavior","Dalton Transactions","2007","","45","5339","","10.1039/b711430c","","","0.71073","MoKα","","0.0668","0.039","","","0.0916","0.1072","","","","","","1.009","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006263","12.965","0.003","13.853","0.003","14.642","0.003","90","","90","","90","","2629.8","1","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H43 Cl P2 Pt -","- C24 H43 Cl P2 Pt -","- C96 H172 Cl4 P8 Pt4 -","4","1","","Vuzman, Dana; Poverenov, Elena; Diskin-Posner, Yael; Leitus, Gregory; Shimon, Linda J. W.; Milstein, David","Reactivity and stability of platinum(II) formyl complexes based on PCP-type ligands. The significance of sterics.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5692","5700","10.1039/b711444c","","","0.71073","MoKα","","0.0519","0.0363","","","0.0871","0.0918","","","","","","1.019","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006264","15.824","0.0002","11.375","0.0001","20.093","0.0002","90","","97.458","0.0008","90","","3586.1","0.07","120","2","120","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C31 H55 F3 O5 P2 Pt S -","- C31 H55 F3 O5 P2 Pt S -","- C124 H220 F12 O20 P8 Pt4 S4 -","4","1","","Vuzman, Dana; Poverenov, Elena; Diskin-Posner, Yael; Leitus, Gregory; Shimon, Linda J. W.; Milstein, David","Reactivity and stability of platinum(II) formyl complexes based on PCP-type ligands. The significance of sterics.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5692","5700","10.1039/b711444c","","","0.71073","MoKα","","0.0388","0.0271","","","0.0641","0.0678","","","","","","1.036","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006265","13.43","0.003","15.667","0.003","15.472","0.003","90","","112.73","0.03","90","","3002.6","1.2","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H38 F3 O4 P2 Pt S -","- C25 H38 F3 O4 P2 Pt S -","- C100 H152 F12 O16 P8 Pt4 S4 -","4","1","","Vuzman, Dana; Poverenov, Elena; Diskin-Posner, Yael; Leitus, Gregory; Shimon, Linda J. W.; Milstein, David","Reactivity and stability of platinum(II) formyl complexes based on PCP-type ligands. The significance of sterics.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5692","5700","10.1039/b711444c","","","0.71073","MoKα","","0.0362","0.026","","","0.0541","0.0565","","","","","","1.019","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006266","14.791","0.0002","26.9261","0.0004","21.0591","0.0004","90","","92.5884","0.0006","90","","8378.5","0.2","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H43 B F4 O P2 Pt -","- C25 H43 B F4 O P2 Pt -","- C300 H516 B12 F48 O12 P24 Pt12 -","12","3","","Vuzman, Dana; Poverenov, Elena; Diskin-Posner, Yael; Leitus, Gregory; Shimon, Linda J. W.; Milstein, David","Reactivity and stability of platinum(II) formyl complexes based on PCP-type ligands. The significance of sterics.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5692","5700","10.1039/b711444c","","","0.71073","MoKα","","0.1009","0.0567","","","0.1287","0.1491","","","","","","0.982","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006267","25.7857","0.0003","13.1635","0.0002","23.1199","0.0002","90","","100.846","0.001","90","","7707.4","0.16","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Compound 4b","","","- C25 H46 B11 Br6 F P Rh -","- C25 H45 B11 Br6 F P Rh -","- C200 H360 B88 Br48 F8 P8 Rh8 -","8","1","","Molinos, Eduardo; Brayshaw, Simon K.; Kociok-Köhn, Gabrielle; Weller, Andrew S.","Cationic rhodium mono-phosphine fragments partnered with carborane monoanions [closo-CB11H6X6]- (X = H, Br). Synthesis, structures and reactivity with alkenes.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4829","4844","10.1039/b711468k","","","0.71073","MoKα","","0.031","0.0264","","","0.0645","0.0666","","","","","","1.06","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006268","12.3443","0.0001","20.1083","0.0001","23.4143","0.0002","90","","93.35","","90","","5802.03","0.07","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Compound 5b","","","- C43 H102 B22 P2 Rh2 -","- C43 H102 B22 P2 Rh2 -","- C172 H408 B88 P8 Rh8 -","4","1","","Molinos, Eduardo; Brayshaw, Simon K.; Kociok-Köhn, Gabrielle; Weller, Andrew S.","Cationic rhodium mono-phosphine fragments partnered with carborane monoanions [closo-CB11H6X6]- (X = H, Br). Synthesis, structures and reactivity with alkenes.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4829","4844","10.1039/b711468k","","","0.71073","MoKα","","0.0633","0.0453","","","0.0951","0.1017","","","","","","1.057","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006269","16.6256","0.0001","19.1042","0.0001","13.7346","0.0001","90","","121.243","0.0003","90","","3729.7","0.04","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","Compound 6","","","- C21 H51 B11 Br6 P Rh -","- C16 H39 B11 Br6 P Rh -","- C64 H156 B44 Br24 P4 Rh4 -","4","1","","Molinos, Eduardo; Brayshaw, Simon K.; Kociok-Köhn, Gabrielle; Weller, Andrew S.","Cationic rhodium mono-phosphine fragments partnered with carborane monoanions [closo-CB11H6X6]- (X = H, Br). Synthesis, structures and reactivity with alkenes.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4829","4844","10.1039/b711468k","","","0.71073","MoKα","","0.038","0.033","","","0.0823","0.0845","","","","","","1.046","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006270","12.9014","0.0001","13.8202","0.0001","16.3616","0.0002","90","","90","","90","","2917.27","0.05","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Compound 9","","","- C16 H31 B11 Br6 P Rh -","- C16 H31 B11 Br6 P Rh -","- C64 H124 B44 Br24 P4 Rh4 -","4","1","","Molinos, Eduardo; Brayshaw, Simon K.; Kociok-Köhn, Gabrielle; Weller, Andrew S.","Cationic rhodium mono-phosphine fragments partnered with carborane monoanions [closo-CB11H6X6]- (X = H, Br). Synthesis, structures and reactivity with alkenes.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4829","4844","10.1039/b711468k","","","0.71073","MoKα","","0.039","0.0311","","","0.0649","0.068","","","","","","1.034","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006271","18.2102","0.0005","25.3646","0.0004","27.6197","0.0007","90","","105.149","0.002","90","","12314.1","0.5","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C117.75 H112.5 Cl3.5 Cu6 P10 S2 Se8 -","- C117 H111 Cl2 Cu6 P10 S2 Se8 -","- C468 H444 Cl8 Cu24 P40 S8 Se32 -","4","1","","Shi, Weifeng; Shafaei-Fallah, Maryam; Rothenberger, Alexander","Novel P-Se anions and their copper complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4255","4257","10.1039/b711549k","","","0.71073","MoKα","","0.0869","0.0596","","","0.1525","0.1667","","","","","","0.961","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006272","14.91","0.002","18.677","0.0016","19.789","0.003","90","","109.92","0.011","90","","5181","1.2","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C97.25 H82.5 Cl2.5 Cu4 P8 Se6 -","- C96 H80 Cu4 P8 Se6 -","- C192 H160 Cu8 P16 Se12 -","2","0.5","","Shi, Weifeng; Shafaei-Fallah, Maryam; Rothenberger, Alexander","Novel P-Se anions and their copper complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4255","4257","10.1039/b711549k","","","0.71073","MoKα","","0.2133","0.0955","","","0.1812","0.2021","","","","","","1.024","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006273","11.405","0.002","14.758","0.003","21.031","0.004","90","","93.39","0.03","90","","3533.6","1.2","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C68 H70 Cu4 O8 P6 Se6 -","- C68 H70 Cu4 O8 P6 Se6 -","- C136 H140 Cu8 O16 P12 Se12 -","2","0.5","","Shi, Weifeng; Shafaei-Fallah, Maryam; Rothenberger, Alexander","Novel P-Se anions and their copper complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","38","4255","4257","10.1039/b711549k","","","0.71073","MoKα","","0.0806","0.0543","","","0.1308","0.1413","","","","","","1","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006274","12.028","0.002","12.776","0.002","12.91","0.002","92.547","0.004","93.241","0.004","100.246","0.004","1946.1","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","mu2-(eta2-buckministerfullerene)-bis((bis-(3,5- bis(trifluoromethyl)benzoato-O,O')-penta(carbonyl)-diruthenium(I,I))","mu2-(eta2-buckministerfullerene)-bis((bis-(3,5-bis(trifluoromethyl)benzoato- O,O')-penta(carbonyl)-diruthenium(I,I))","","- C106 H12 F24 O18 Ru4 -","- C106 H12 F24 O18 Ru4 -","- C106 H12 F24 O18 Ru4 -","1","0.5","","Rogachev, Andrey Yu; Sevryugina, Yulia; Filatov, Alexander S.; Petrukhina, Marina A.","Corannulene vs. C60-fullerene in metal binding reactions: a direct DFT and X-ray structural comparison.","Dalton transactions (Cambridge, England : 2003)","2007","","35","3871","3873","10.1039/b711574a","","","0.71073","MoKα","","0.3325","0.1316","","","0.205","0.3107","","","","","","0.93","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006275","18.6263","0.001","15.3768","0.0009","22.9378","0.0013","90","","90","","90","","6569.7","0.6","213","2","213","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C30 H52 Ni P4 -","- C30 H52 Ni P4 -","- C240 H416 Ni8 P32 -","8","1","","Gómez-Ruiz, Santiago; Hey-Hawkins, Evamarie","Oxidative cleavage of tetraaryltetraphosphane-1,4-diides by nickel(II) and palladium(II): formation of unusual Ni(0) and Pd(0) diaryldiphosphene complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5678","5683","10.1039/b711616k","","","0.71073","MoKα","","0.0527","0.0337","","","0.0693","0.074","","","","","","1.017","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006276","11.209","0.003","12.402","0.003","15.808","0.003","85.182","0.019","72.99","0.02","66.42","0.03","1924.6","0.9","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H52 Ni P4 -","- C41 H52 Ni P4 -","- C82 H104 Ni2 P8 -","2","1","","Gómez-Ruiz, Santiago; Hey-Hawkins, Evamarie","Oxidative cleavage of tetraaryltetraphosphane-1,4-diides by nickel(II) and palladium(II): formation of unusual Ni(0) and Pd(0) diaryldiphosphene complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5678","5683","10.1039/b711616k","","","0.71073","MoKα","","0.0739","0.0399","","","0.0724","0.0841","","","","","","1","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006277","9.083","0.002","12.2987","0.0008","21.174","0.008","93.065","0.013","91.79","0.03","103.773","0.011","2291.7","1","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H76 P4 Pd -","- C42 H76 P4 Pd -","- C84 H152 P8 Pd2 -","2","1","","Gómez-Ruiz, Santiago; Hey-Hawkins, Evamarie","Oxidative cleavage of tetraaryltetraphosphane-1,4-diides by nickel(II) and palladium(II): formation of unusual Ni(0) and Pd(0) diaryldiphosphene complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5678","5683","10.1039/b711616k","","","0.71073","MoKα","","0.0719","0.0366","","","0.0558","0.0643","","","","","","0.966","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006278","11.3887","0.0016","12.423","0.002","15.829","0.003","84.327","0.017","72.773","0.018","66.212","0.016","1956.8","0.6","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H52 P4 Pd -","- C41 H52 P4 Pd -","- C82 H104 P8 Pd2 -","2","1","","Gómez-Ruiz, Santiago; Hey-Hawkins, Evamarie","Oxidative cleavage of tetraaryltetraphosphane-1,4-diides by nickel(II) and palladium(II): formation of unusual Ni(0) and Pd(0) diaryldiphosphene complexes.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5678","5683","10.1039/b711616k","","","0.71073","MoKα","","0.0469","0.0301","","","0.0656","0.0712","","","","","","1.023","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006279","13.92","0.003","30.035","0.006","13.924","0.003","90","","90","0.03","90","","5821","2","100","2","100","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C17 Al Br3 F36 I3 O4 P -","- C18 Al Br3 F36 I3 O4 P2 -","- C108 Al6 Br18 F216 I18 O24 P12 -","6","1.5","","Raabe, Ines; Röhr, Caroline; Krossing, Ingo","Exploring the chemistry of free CI3+: reactions with the weak Lewis bases PX3 (X = Cl-I), AsI3 and Et2O.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5376","5386","10.1039/b711639j","","","0.71073","MoKα","","0.1387","0.0697","","","0.1841","0.2294","","","","","","1.023","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006280","13.832","0.003","13.833","0.003","19.886","0.004","90","","90.01","0.03","90","","3804.9","1.4","108","2","108","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 Al Cl3 F36 I3 O4 P -","- C17 Al Cl3 F36 I3 O4 P -","- C68 Al4 Cl12 F144 I12 O16 P4 -","4","1","","Raabe, Ines; Röhr, Caroline; Krossing, Ingo","Exploring the chemistry of free CI3+: reactions with the weak Lewis bases PX3 (X = Cl-I), AsI3 and Et2O.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5376","5386","10.1039/b711639j","","","0.71073","MoKα","","0.0805","0.0443","","","0.1065","0.1267","","","","","","1.039","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006281","13.243","0.003","16.325","0.003","13.139","0.003","90","","94.75","0.03","90","","2830.8","1.1","150","2","150","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C5 Al2 F55 I6 O6 P -","- C25.6 Al2 F55 I6 O6 P0.82 -","- C51.2 Al4 F110 I12 O12 P1.64 -","2","0.25","","Raabe, Ines; Röhr, Caroline; Krossing, Ingo","Exploring the chemistry of free CI3+: reactions with the weak Lewis bases PX3 (X = Cl-I), AsI3 and Et2O.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5376","5386","10.1039/b711639j","","","0.71073","MoKα","","0.0752","0.0682","","","0.1871","0.1944","","","","","","1.043","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006282","14.466","0.003","38.944","0.008","14.623","0.003","90","","90.53","0.03","90","","8238","3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 Al F36 I6 O4 P -","- C17 Al F36 I6 O4 P -","- C136 Al8 F288 I48 O32 P8 -","8","2","","Raabe, Ines; Röhr, Caroline; Krossing, Ingo","Exploring the chemistry of free CI3+: reactions with the weak Lewis bases PX3 (X = Cl-I), AsI3 and Et2O.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5376","5386","10.1039/b711639j","","","0.71073","MoKα","","0.1101","0.0885","","","0.2176","0.2439","","","","","","1.082","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006283","13.789","0.003","19.471","0.004","14","0.003","90","","90.09","0.03","90","","3758.8","1.4","143","2","143","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 Al F36 I4 O4 P -","- C16 Al F36 I4 O4 P -","- C64 Al4 F144 I16 O16 P4 -","4","1","","Raabe, Ines; Röhr, Caroline; Krossing, Ingo","Exploring the chemistry of free CI3+: reactions with the weak Lewis bases PX3 (X = Cl-I), AsI3 and Et2O.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5376","5386","10.1039/b711639j","","","0.71073","MoKα","","0.1538","0.1037","","","0.2005","0.2218","","","","","","1.127","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006284","14.25","0.009","18.493","0.012","21.397","0.014","90","","99.3","0.02","90","","5565","6","153","2","153","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C40 H66.5 Cu4 N8 O27.5 P2.5 -","- C40 H32 Cu4 N8 O27.5 P2.5 -","- C160 H128 Cu16 N32 O110 P10 -","4","1","","Doyle, Robert P.; Bauer, Thomas; Julve, Miguel; Lloret, Francesc; Cano, Joan; Nieuwenhuyzen, Mark; Kruger, Paul E.","Metamorphosis of a butterfly: synthesis, structural, thermal, magnetic and DFT characterisation of a ferromagnetically coupled tetranuclear copper(II) complex.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5140","5147","10.1039/b711655a","","","0.71073","MoKα","","0.1743","0.0851","","","0.2132","0.2517","","","","","","0.979","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006285","10.713","0.001","13.768","0.001","23.554","0.001","90","","91.05","0.01","90","","3473.6","0.4","293","","293","","","","","","","","local","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H50 F6 N6 O6 S2 -","- C24 H49 F6 N6 O6 S2 -","- C96 H196 F24 N24 O24 S8 -","4","1","","Bygott, Alexia M. T.; Geue, Rodney J.; Ralph, Stephen F.; Sargeson, Alan M.; Willis, Anthony C.","Octahedral and trigonal prismatic structure preferences in a bicyclic hexaamine cage for zinc(II), cadmium(II) and mercury(II) ions.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4778","4787","10.1039/b711879a","","","1.5418","CuKα","","","0.092","","","0.131","0.131","","","","","","3.23","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006286","19.692","0.002","16.616","0.002","11.137","0.001","90","","90","","90","","3644.1","0.7","293","","293","","","","","","","","local","7","P n m a","-P 2ac 2n","62","","","","- C22 H54 Cd F12 N6 O3 P2 -","- C22 H48 Cd F12 N6 O3 P2 -","- C88 H192 Cd4 F48 N24 O12 P8 -","4","0.5","","Bygott, Alexia M. T.; Geue, Rodney J.; Ralph, Stephen F.; Sargeson, Alan M.; Willis, Anthony C.","Octahedral and trigonal prismatic structure preferences in a bicyclic hexaamine cage for zinc(II), cadmium(II) and mercury(II) ions.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4778","4787","10.1039/b711879a","","","1.5418","CuKα","","","0.071","","","0.101","0.101","","","","","","3.64","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006287","19.76","0.05","16.49","0.03","11.03","0.02","90","","90","","90","","3594","13","293","","293","","","","","","","","local","7","P n m a","-P 2ac 2n","62","","","","- C22 H53.64 F12 Hg N6 O2.82 P2 -","- C22 H48 F12 Hg N6 O2.82 P2 -","- C88 H192 F48 Hg4 N24 O11.28 P8 -","4","0.5","","Bygott, Alexia M. T.; Geue, Rodney J.; Ralph, Stephen F.; Sargeson, Alan M.; Willis, Anthony C.","Octahedral and trigonal prismatic structure preferences in a bicyclic hexaamine cage for zinc(II), cadmium(II) and mercury(II) ions.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4778","4787","10.1039/b711879a","","","1.5418","CuKα","","0.088","0.067","","0.098","0.09","0.09","","","1.955","","","2.061","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006288","7.8638","0.0007","9.6992","0.0009","11.268","0.001","84.012","0.002","88.758","0.002","78.403","0.002","837.3","0.13","566","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H12 Ag3 F9 N8 O9 S3 -","- C19 H12 Ag3 F9 N8 O9 S3 -","- C19 H12 Ag3 F9 N8 O9 S3 -","1","0.5","","Beauchamp, Derek A.; Loeb, Stephen J.","Coordination polymers with 4,4'-bipyrimidine. Using a combination of endo- and exodentate donors to build a one-dimensional Ag(I) ladder and a heterometallic Co(II)Ag(I)2 network.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4760","4762","10.1039/b711960g","","","0.71073","MoKα","","0.0771","0.0681","","","0.195","0.202","","","","","","0.999","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006289","15.001","0.007","14.016","0.007","20.654","0.01","90","","90","","90","","4343","4","173","2","173","2","","","","","","","","7","P b c m","-P 2c 2b","57","","","","- C26 H27 Ag2 Cl4 Co N13 O19 -","- C26 H25 Ag2 Cl4 Co N13 O19 -","- C104 H100 Ag8 Cl16 Co4 N52 O76 -","4","0.5","","Beauchamp, Derek A.; Loeb, Stephen J.","Coordination polymers with 4,4'-bipyrimidine. Using a combination of endo- and exodentate donors to build a one-dimensional Ag(I) ladder and a heterometallic Co(II)Ag(I)2 network.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4760","4762","10.1039/b711960g","","","0.71073","MoKα","","0.1049","0.1037","","","0.2461","0.2468","","","","","","1.299","","","","has coordinates,has disorder","179766","2020-10-21","18:00:00",""
"7006290","7.874","0.002","12.918","0.004","9.422","0.003","90","","107.298","0.004","90","","915","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(1) (UO2Cl2HTMG2)","","","- C10 H26 Cl2 N6 O2 U -","- C10 H26 Cl2 N6 O2 U -","- C20 H52 Cl4 N12 O4 U2 -","2","0.5","","Bertke, Jeffrey A.; Bunge, Scott D.","Stable analogs of the uranyl ion containing 1,1,3,3-tetramethylguanidine.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4647","4649","10.1039/b712054k","","","0.71073","MoKα","","0.0291","0.0192","","","0.0648","0.0857","","","","","","0.685","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006291","35.584","0.004","11.1983","0.0013","23.246","0.003","90","","115.825","0.002","90","","8338","1.7","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","(2) (UO2OC6H3-2,6-(C(CH3)3)2HTMG2)","","","- C38 H68 N6 O4 U -","- C38 H68 N6 O4 U -","- C304 H544 N48 O32 U8 -","8","1","","Bertke, Jeffrey A.; Bunge, Scott D.","Stable analogs of the uranyl ion containing 1,1,3,3-tetramethylguanidine.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4647","4649","10.1039/b712054k","","","0.71073","MoKα","","0.0333","0.0234","","","0.074","0.0906","","","","","","0.728","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006292","23.403","0.003","11.0272","0.0012","20.892","0.002","90","","103","0.002","90","","5253.4","1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(2a) (UO2OC6H3-2,6-(C(CH3)3)2HTMG2)*2TOL","","","- C52 H84 N6 O4 U -","- C52 H84 N6 O4 U -","- C208 H336 N24 O16 U4 -","4","1","","Bertke, Jeffrey A.; Bunge, Scott D.","Stable analogs of the uranyl ion containing 1,1,3,3-tetramethylguanidine.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4647","4649","10.1039/b712054k","","","0.71073","MoKα","","0.056","0.0312","","","0.0837","0.1113","","","","","","0.788","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006293","11.888","0.003","12.046","0.003","16.41","0.004","98.537","0.004","110.668","0.004","93.634","0.004","2157.3","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","(3) (UO2OC6H2-2,6-(C(CH3)3)2-4-CH3HTMG2)","","","- C40 H72 N6 O4 U -","- C40 H72 N6 O4 U -","- C80 H144 N12 O8 U2 -","2","1","","Bertke, Jeffrey A.; Bunge, Scott D.","Stable analogs of the uranyl ion containing 1,1,3,3-tetramethylguanidine.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4647","4649","10.1039/b712054k","","","0.71073","MoKα","","0.0409","0.0368","","","0.0989","0.1038","","","","","","0.718","","","","has coordinates","179766","2020-10-21","18:00:00",""
"7006294","11.167","0.001","17.764","0.002","16.792","0.002","90","","109.387","0.002","90","","3142.2","0.6","153","","153","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H39 Br Os P2 -","- C36 H39 Br Os P2 -","- C144 H156 Br4 Os4 P8 -","4","1","","Bruce, Michael I.; Costuas, Karine; Davin, Thomas; Halet, Jean-François; Kramarczuk, Kathy A.; Low, Paul J.; Nicholson, Brian K.; Perkins, Gary J.; Roberts, Rachel L.; Skelton, Brian W.; Smith, Mark E.; White, Allan H.","Syntheses, structures and redox properties of some complexes containing the Os(dppe)Cp* fragment, including [{Os(dppe)Cp*}2(mu-C triple bondCC triple bond C)].","Dalton transactions (Cambridge, England : 2003)","2007","","46","5387","5399","10.1039/b712104k","","","0.71073","MoKα","","0.062","0.03","","0.027","","0.024","","","0.929","","","1.023","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006295","11.4255","0.0006","17.3798","0.0008","19.1554","0.0009","90","","104.383","0.001","90","","3684.5","0.3","153","","153","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H42 F6 N Os P3 -","- C38 H42 F6 N Os P3 -","- C152 H168 F24 N4 Os4 P12 -","4","1","","Bruce, Michael I.; Costuas, Karine; Davin, Thomas; Halet, Jean-François; Kramarczuk, Kathy A.; Low, Paul J.; Nicholson, Brian K.; Perkins, Gary J.; Roberts, Rachel L.; Skelton, Brian W.; Smith, Mark E.; White, Allan H.","Syntheses, structures and redox properties of some complexes containing the Os(dppe)Cp* fragment, including [{Os(dppe)Cp*}2(mu-C triple bondCC triple bond C)].","Dalton transactions (Cambridge, England : 2003)","2007","","46","5387","5399","10.1039/b712104k","","","0.71073","MoKα","","0.054","0.027","","0.026","","0.024","","","0.962","","","1.044","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006296","11.9922","0.0006","17.8922","0.0008","19.8242","0.0009","114.764","0.001","90.682","0.001","103.145","0.001","3733.5","0.3","153","","153","","","","","","","","","4","P -1","-P 1","2","","","","- C45.5 H45.5 Os P2 -","- C45.5 H45.5 Os P2 -","- C182 H182 Os4 P8 -","4","2","","Bruce, Michael I.; Costuas, Karine; Davin, Thomas; Halet, Jean-François; Kramarczuk, Kathy A.; Low, Paul J.; Nicholson, Brian K.; Perkins, Gary J.; Roberts, Rachel L.; Skelton, Brian W.; Smith, Mark E.; White, Allan H.","Syntheses, structures and redox properties of some complexes containing the Os(dppe)Cp* fragment, including [{Os(dppe)Cp*}2(mu-C triple bondCC triple bond C)].","Dalton transactions (Cambridge, England : 2003)","2007","","46","5387","5399","10.1039/b712104k","","","0.71073","MoKα","","0.084","0.038","","0.026","","0.024","","","0.966","","","1.116","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006297","11.1341","0.0005","16.7364","0.0008","18.1183","0.0008","88.689","0.001","88.96","0.001","70.906","0.001","3189.5","0.3","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C38 H40 Os P2 -","- C38 H40 Os P2 -","- C152 H160 Os4 P8 -","4","2","","Bruce, Michael I.; Costuas, Karine; Davin, Thomas; Halet, Jean-François; Kramarczuk, Kathy A.; Low, Paul J.; Nicholson, Brian K.; Perkins, Gary J.; Roberts, Rachel L.; Skelton, Brian W.; Smith, Mark E.; White, Allan H.","Syntheses, structures and redox properties of some complexes containing the Os(dppe)Cp* fragment, including [{Os(dppe)Cp*}2(mu-C triple bondCC triple bond C)].","Dalton transactions (Cambridge, England : 2003)","2007","","46","5387","5399","10.1039/b712104k","","","0.71073","MoKα","","0.061","0.042","","0.063","","0.051","","","1.603","","","1.454","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006298","11.724","0.001","17.36","0.002","18.5","0.002","90","","103.3","0.002","90","","3664.3","0.7","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39 H45 F6 O Os P3 -","- C39 H41 F6 O Os P3 -","- C156 H164 F24 O4 Os4 P12 -","4","1","","Bruce, Michael I.; Costuas, Karine; Davin, Thomas; Halet, Jean-François; Kramarczuk, Kathy A.; Low, Paul J.; Nicholson, Brian K.; Perkins, Gary J.; Roberts, Rachel L.; Skelton, Brian W.; Smith, Mark E.; White, Allan H.","Syntheses, structures and redox properties of some complexes containing the Os(dppe)Cp* fragment, including [{Os(dppe)Cp*}2(mu-C triple bondCC triple bond C)].","Dalton transactions (Cambridge, England : 2003)","2007","","46","5387","5399","10.1039/b712104k","","","0.71073","MoKα","","0.069","0.035","","0.04","","0.035","","","0.98","","","1.036","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006299","10.971","0.002","17.958","0.003","17.855","0.003","88.677","0.004","85.69","0.004","87.946","0.004","3504.8","1","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C81 H90 Os2 P4 -","- C81 H90 Os2 P4 -","- C162 H180 Os4 P8 -","2","1","","Bruce, Michael I.; Costuas, Karine; Davin, Thomas; Halet, Jean-François; Kramarczuk, Kathy A.; Low, Paul J.; Nicholson, Brian K.; Perkins, Gary J.; Roberts, Rachel L.; Skelton, Brian W.; Smith, Mark E.; White, Allan H.","Syntheses, structures and redox properties of some complexes containing the Os(dppe)Cp* fragment, including [{Os(dppe)Cp*}2(mu-C triple bondCC triple bond C)].","Dalton transactions (Cambridge, England : 2003)","2007","","46","5387","5399","10.1039/b712104k","","","0.71073","MoKα","","0.075","0.036","","0.042","","0.038","","","0.987","","","1.088","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006300","19.1586","0.0006","19.5819","0.0005","6.1048","0.0002","90","","90","","90","","2290.29","0.12","150","2","150","2","","","","","","","Elaine Geary, Reaction EG25F","5","P n m a","-P 2ac 2n","62","","","","- C21 H18 N2 Ni S7 -","- C21 H18 N2 Ni S7 -","- C84 H72 N8 Ni4 S28 -","4","0.5","","Geary, Elaine A. M.; Yellowlees, Lesley J.; Parsons, Simon; Pilia, Luca; Serpe, Angela; Mercuri, M. Laura; Deplano, Paola; Clark, Stewart J.; Robertson, Neil","Influence of the R-substituents on the properties of [Ni(R2pipdt)(dmit)] complexes and crystal structure where R = CH2C6H5.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5453","5459","10.1039/b712243h","","","0.71073","MoKα","","0.0372","0.0298","","","0.0738","0.0758","","","","","","1.046","","","","has coordinates,has disorder","179767","2020-10-21","18:00:00",""
"7006301","7.506","0.001","20.254","0.002","10.733","0.001","90","","102.473","0.006","90","","1593.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 N2 O Pt -","- C20 H16 N2 O Pt -","- C80 H64 N8 O4 Pt4 -","4","1","","Vecchio, Vita M.; Benedetti, Michele; Migoni, Danilo; De Pascali, Sandra A.; Ciccarese, Antonella; Marsigliante, Santo; Capitelli, Francesco; Fanizzi, Francesco P.","Highly selective metal mediated ortho-alkylation of phenol. First platinum containing organometallic chromane analogues.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5720","5725","10.1039/b712248a","","","0.71073","MoKα","","0.08","0.0484","","","0.0848","0.0934","","","","","","1.122","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006302","18.591","0.0006","18.591","0.0006","11.7442","0.0007","90","","90","","120","","3515.3","0.3","173","2","173","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","","","- C48 H52 N4 O4 S4 -","- C48 H52 N4 O4 S4 -","- C144 H156 N12 O12 S12 -","3","0.5","","Kozlova, Marina N.; Ferlay, Sylvie; Solovieva, Svetlana E.; Antipin, Igor S.; Konovalov, Alexander I.; Kyritsakas, Nathalie; Hosseini, Mir Wais","Molecular tectonics: on the formation of 1-D silver coordination networks by thiacalixarenes bearing nitrile groups.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5126","5131","10.1039/b712351e","","","0.71073","MoKα","","0.1001","0.0815","","","0.2107","0.2258","","","","","","1.035","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7006303","16.484","0.0003","15.026","0.0004","28.944","0.0006","90","","94.169","0.002","90","","7150.1","0.3","173","2","173","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C232 H280 Ag4 Cl24 F24 N16 O16 S16 Sb4 -","- C232 H280 Ag4 Cl24 F24 N16 O16 S16 Sb4 -","- C232 H280 Ag4 Cl24 F24 N16 O16 S16 Sb4 -","1","0.25","","Kozlova, Marina N.; Ferlay, Sylvie; Solovieva, Svetlana E.; Antipin, Igor S.; Konovalov, Alexander I.; Kyritsakas, Nathalie; Hosseini, Mir Wais","Molecular tectonics: on the formation of 1-D silver coordination networks by thiacalixarenes bearing nitrile groups.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5126","5131","10.1039/b712351e","","","0.71073","MoKα","","0.1425","0.0952","","","0.2798","0.2959","","","","","","1.038","","","","has coordinates,has disorder","179767","2020-10-21","18:00:00",""
"7006304","14.8603","0.0008","15.2097","0.0008","25.1404","0.0015","90","","90","","90","","5682.3","0.5","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C57 H69 Cl3 N4 O4 S4 -","- C57 H69 Cl3 N4 O4 S4 -","- C228 H276 Cl12 N16 O16 S16 -","4","1","","Kozlova, Marina N.; Ferlay, Sylvie; Solovieva, Svetlana E.; Antipin, Igor S.; Konovalov, Alexander I.; Kyritsakas, Nathalie; Hosseini, Mir Wais","Molecular tectonics: on the formation of 1-D silver coordination networks by thiacalixarenes bearing nitrile groups.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5126","5131","10.1039/b712351e","","","0.71073","MoKα","","0.1526","0.0695","","","0.1422","0.1753","","","","","","1.039","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7006305","20.78","0.002","15.006","0.003","23.042","0.002","90","","96.081","0.004","90","","7144.6","1.7","173","2","173","2","","","","","","","","9","P 1 21 1","P 2yb","4","","","","- C241 H304 Ag4 B4 Cl24 F16 N16 O19 S16 -","- C241 H304 Ag4 B4 Cl24 F16 N16 O19 S16 -","- C241 H304 Ag4 B4 Cl24 F16 N16 O19 S16 -","1","0.5","","Kozlova, Marina N.; Ferlay, Sylvie; Solovieva, Svetlana E.; Antipin, Igor S.; Konovalov, Alexander I.; Kyritsakas, Nathalie; Hosseini, Mir Wais","Molecular tectonics: on the formation of 1-D silver coordination networks by thiacalixarenes bearing nitrile groups.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5126","5131","10.1039/b712351e","","","0.71073","MoKα","","0.1717","0.1057","","","0.283","0.3317","","","","","","1.102","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006306","13.7751","0.0004","15.2061","0.0006","16.6762","0.0004","90","","94.453","0.003","90","","3482.54","0.19","173","2","173","2","","","","","","","","9","P 1 21 1","P 2yb","4","","","","- C58 H72 Ag Cl4 F6 N4 O4 P S4 -","- C58 H72 Ag Cl4 F6 N4 O4 P S4 -","- C116 H144 Ag2 Cl8 F12 N8 O8 P2 S8 -","2","1","","Kozlova, Marina N.; Ferlay, Sylvie; Solovieva, Svetlana E.; Antipin, Igor S.; Konovalov, Alexander I.; Kyritsakas, Nathalie; Hosseini, Mir Wais","Molecular tectonics: on the formation of 1-D silver coordination networks by thiacalixarenes bearing nitrile groups.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5126","5131","10.1039/b712351e","","","0.71073","MoKα","","0.1003","0.0779","","","0.2174","0.2385","","","","","","1.002","","","","has coordinates,has disorder","179767","2020-10-21","18:00:00",""
"7006307","11.9011","0.0018","14.426","0.002","18.41","0.002","80.163","0.002","73.035","0.002","70.652","0.002","2842.8","0.7","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C55 H50 Cu8 N20 O -","- C55 H50 Cu8 N20 O -","- C110 H100 Cu16 N40 O2 -","2","1","","Zhou, Yongbo; Chen, Wanzhi","Novel neutral octanuclear copper(I) complexes stabilized by pyridine linked bis(pyrazolate) ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5123","5125","10.1039/b712411b","","","0.71073","MoKα","","0.1141","0.0484","","","0.1055","0.1451","","","","","","1.021","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006308","23.916","0.015","39.8","0.03","16.666","0.01","90","","90","","90","","15864","18","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C92 H60 Cu8 N20 -","- C92 H60 Cu8 N20 -","- C736 H480 Cu64 N160 -","8","0.5","","Zhou, Yongbo; Chen, Wanzhi","Novel neutral octanuclear copper(I) complexes stabilized by pyridine linked bis(pyrazolate) ligands.","Dalton transactions (Cambridge, England : 2003)","2007","","44","5123","5125","10.1039/b712411b","","","0.71073","MoKα","","0.1842","0.0769","","","0.1827","0.2268","","","","","","0.906","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006309","26.746","0.005","22.659","0.005","22.886","0.005","90","","92.19","0.03","90","","13860","5","253","2","253","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C127.5 H155 Cl3 F6 N6 O15 Pt2 S2 -","- C127.5 H153 Cl3 F6 N6 O15 Pt2 S2 -","- C510 H612 Cl12 F24 N24 O60 Pt8 S8 -","4","1","","Lo, Hiu-Suet; Yip, Sung-Kong; Zhu, Nianyong; Yam, Vivian Wing-Wah","The first example of a Pt...Pt interaction in platinum(ii) complexes bearing bulky tri-tert-butyl-2,2':6',2''-terpyridine pendants via conformational control of the calix[4]arene moiety.","Dalton transactions (Cambridge, England : 2003)","2007","","39","4386","4389","10.1039/b712645j","","","0.71073","MoKα","","0.1126","0.0553","","","0.1491","0.162","","","","","","0.91","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006310","12.8734","0.0008","14.8662","0.0009","24.0444","0.0013","90","","90","","90","","4601.6","0.5","150","3","150","3","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H38 Cl2 O2 P2 Pt -","- C18 H38 Cl2 O2 P2 Pt -","- C144 H304 Cl16 O16 P16 Pt8 -","8","1","","Olsson, Daniel; Arunachalampillai, Athimoolam; Wendt, Ola F.","Synthesis and characterisation of PC(sp3)P phosphine and phosphinite platinum(II) complexes. Cyclometallation and simple coordination.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5427","5433","10.1039/b712660c","","","0.71073","MoKα","","0.1444","0.0607","","","0.134","0.1481","","","","","","0.925","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006311","28.8263","0.0011","8.7302","0.0002","44.3883","0.001","90","","96.065","0.003","90","","11108.2","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C45 H96 Cl4 O5 P4 Pt2 -","- C45 H96 Cl4 O5 P4 Pt2 -","- C360 H768 Cl32 O40 P32 Pt16 -","8","1","","Olsson, Daniel; Arunachalampillai, Athimoolam; Wendt, Ola F.","Synthesis and characterisation of PC(sp3)P phosphine and phosphinite platinum(II) complexes. Cyclometallation and simple coordination.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5427","5433","10.1039/b712660c","","","0.71073","MoKα","","0.2152","0.0586","","","0.1423","0.1724","","","","","","0.735","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7006312","12.0176","0.0008","14.8027","0.0009","15.7279","0.0009","90","","100.786","0.005","90","","2748.5","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H49 Cl P2 Pt -","- C24 H49 Cl P2 Pt -","- C96 H196 Cl4 P8 Pt4 -","4","1","","Olsson, Daniel; Arunachalampillai, Athimoolam; Wendt, Ola F.","Synthesis and characterisation of PC(sp3)P phosphine and phosphinite platinum(II) complexes. Cyclometallation and simple coordination.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5427","5433","10.1039/b712660c","","","0.71073","MoKα","","0.1031","0.0347","","","0.0629","0.0878","","","","","","0.984","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006313","11.2909","0.0001","8.1047","0.0001","12.9838","0.0002","90","","107.434","0.0005","90","","1133.56","0.02","123","1","123","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 O3 W -","- C12 H12 O3 W -","- C48 H48 O12 W4 -","4","1","","Zhao, Jin; Jain, Kavita R.; Herdtweck, Eberhardt; Kühn, Fritz E","Ansa-bridged eta5-cyclopentadienyl molybdenum and tungsten complexes: synthesis, structure and application in olefin epoxidation.","Dalton transactions (Cambridge, England : 2003)","2007","","47","5567","5571","10.1039/b712673e","","","0.71073","MoKα","","0.0175","0.0164","","","0.0378","0.0382","","","","","","1.162","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006314","13.6695","0.0014","16.645","0.0017","17.5462","0.0019","90","","90","","90","","3992.3","0.7","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C36 H48 F6 Mn N4 O6 S2 -","- C36 H48 F6 Mn N4 O6 S2 -","- C144 H192 F24 Mn4 N16 O24 S8 -","4","1","","Gómez, Laura; Garcia-Bosch, Isaac; Company, Anna; Sala, Xavier; Fontrodona, Xavier; Ribas, Xavi; Costas, Miquel","Chiral manganese complexes with pinene appended tetradentate ligands as stereoselective epoxidation catalysts.","Dalton transactions (Cambridge, England : 2003)","2007","","47","5539","5545","10.1039/b712754e","","","0.71073","MoKα","","0.0673","0.0525","","","0.1349","0.1415","","","","","","1.047","","","","has coordinates,has disorder","179767","2020-10-21","18:00:00",""
"7006315","11.1576","0.0012","11.5084","0.0016","14.6153","0.0015","84.203","0.007","71.704","0.007","89.593","0.01","1772.1","0.4","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H32 I O P2 Rh -","- C45 H32 I O P2 Rh -","- C90 H64 I2 O2 P4 Rh2 -","2","1","","Lamb, Gareth; Clarke, Matthew; Slawin, Alexandra M. Z.; Williams, Bruce; Key, Lesley","Evaluation of C4 diphosphine ligands in rhodium catalysed methanol carbonylation under a syngas atmosphere: synthesis, structure, stability and reactivity of rhodium(I) carbonyl and rhodium(III) acetyl intermediates.","Dalton transactions (Cambridge, England : 2003)","2007","","47","5582","5589","10.1039/b712974b","","","0.71073","MoKα","","0.0645","0.0474","","","0.0781","0.0865","","","","","","1.002","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006316","21.54","0.004","8.1514","0.0014","18.908","0.004","90","","96.662","0.003","90","","3297.5","1.1","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31.5 H34 I2 O2 P2 Rh -","- C31.5 H34 I2 O2 P2 Rh -","- C126 H136 I8 O8 P8 Rh4 -","4","1","","Lamb, Gareth; Clarke, Matthew; Slawin, Alexandra M. Z.; Williams, Bruce; Key, Lesley","Evaluation of C4 diphosphine ligands in rhodium catalysed methanol carbonylation under a syngas atmosphere: synthesis, structure, stability and reactivity of rhodium(I) carbonyl and rhodium(III) acetyl intermediates.","Dalton transactions (Cambridge, England : 2003)","2007","","47","5582","5589","10.1039/b712974b","","","0.71073","MoKα","","0.0337","0.0258","","","0.0486","0.0519","","","","","","1.098","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7006317","24.241","0.004","18.209","0.003","8.1431","0.0014","90","","90","","90","","3594.4","1","93","2","93","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C35 H32 Cl3 I2 O P2 Rh -","- C35 H32 Cl3 I2 O P2 Rh -","- C140 H128 Cl12 I8 O4 P8 Rh4 -","4","0.5","","Lamb, Gareth; Clarke, Matthew; Slawin, Alexandra M. Z.; Williams, Bruce; Key, Lesley","Evaluation of C4 diphosphine ligands in rhodium catalysed methanol carbonylation under a syngas atmosphere: synthesis, structure, stability and reactivity of rhodium(I) carbonyl and rhodium(III) acetyl intermediates.","Dalton transactions (Cambridge, England : 2003)","2007","","47","5582","5589","10.1039/b712974b","","","0.71073","MoKα","","0.1037","0.0641","","","0.1177","0.1305","","","","","","1.045","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006318","7.6534","0.0002","15.3303","0.0004","9.987","0.0002","90","","101.066","0.004","90","","1149.98","0.05","90","2","90","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","C22 H20 Cu N4 O4, 4(F H), 2(F)","","","- C22 H24 Cu F6 N4 O4 -","- C22 H24 Cu F6 N4 O4 -","- C44 H48 Cu2 F12 N8 O8 -","2","0.5","","Manson, Jamie L.; Southerland, Heather I.; Twamley, Brendan; Rai, Ram; Musfeldt, Janice L.","Bis(di-2-pyridyl-methanediol)copper(II) dihydrogentrifluoride: a structural and spectroscopic study of the H2F3 - anion in a complex salt.","Dalton transactions (Cambridge, England : 2003)","2007","","48","5655","5657","10.1039/b713598j","","","0.71073","MoKα","","0.0288","0.0274","","","0.0764","0.0778","","","","","","1.091","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006319","11.8667","0.0012","13.9186","0.0012","18.843","0.002","75.996","0.011","76.08","0.011","74.991","0.013","2863.7","0.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C96 H96 Cl12 Ni6 S24 -","- C96 H96 Cl12 Ni6 S24 -","- C96 H96 Cl12 Ni6 S24 -","1","0.5","","Angamuthu, Raja; Kooijman, Huub; Lutz, Martin; Spek, Anthony L.; Bouwman, Elisabeth","Hexanuclear [Ni6L12] metallacrown framework consisting of NiS4 square-planar and NiS5 square-pyramidal building blocks.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4641","4643","10.1039/b713668b","","","0.71073","MoKα","","0.1311","0.0596","","","0.0863","0.1048","","","","","","1.049","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006320","16.4582","0.0005","15.0185","0.0006","9.8037","0.0002","90","","110.134","0.002","90","","2275.17","0.13","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H16 Cl2 I2 Ni2 S4 -","- C16 H16 Cl2 I2 Ni2 S4 -","- C64 H64 Cl8 I8 Ni8 S16 -","4","0.5","","Angamuthu, Raja; Kooijman, Huub; Lutz, Martin; Spek, Anthony L.; Bouwman, Elisabeth","Hexanuclear [Ni6L12] metallacrown framework consisting of NiS4 square-planar and NiS5 square-pyramidal building blocks.","Dalton transactions (Cambridge, England : 2003)","2007","","41","4641","4643","10.1039/b713668b","","","0.71073","MoKα","","0.0319","0.0203","","","0.0387","0.0413","","","","","","1.056","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006321","16.1016","0.0009","30.7177","0.0018","17.9732","0.001","90","","106.651","0.001","90","","8516.9","0.8","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C111 H226 Cl6 Fe5 N9 O66 Pr8 -","- C111 H226 Cl6 Fe5 N9 O66 Pr8 -","- C222 H452 Cl12 Fe10 N18 O132 Pr16 -","2","0.5","","Ako, Ayuk M.; Mereacre, Valeriu; Clérac, Rodolphe; Hewitt, Ian J.; Lan, Yanhua; Anson, Christopher E.; Powell, Annie K.","High-nuclearity 3d‒4f [FeIII5LnIII8] complexes: synthesis, structure and magnetic properties","Dalton Transactions","2007","","45","5245","","10.1039/b714620p","","","0.71073","MoKα","","0.0544","0.0381","","","0.0852","0.0924","","","","","","1.061","","","","has coordinates,has disorder","179767","2020-10-21","18:00:00",""
"7006322","16.2521","0.0007","18.3484","0.0008","29.9621","0.0013","92.295","0.001","92.288","0.001","106.969","0.001","8526.4","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C112 H228 Fe5 N11 Nd8 O67 -","- C112 H220 Fe5 N11 Nd8 O67 -","- C224 H440 Fe10 N22 Nd16 O134 -","2","1","","Ako, Ayuk M.; Mereacre, Valeriu; Clérac, Rodolphe; Hewitt, Ian J.; Lan, Yanhua; Anson, Christopher E.; Powell, Annie K.","High-nuclearity 3d‒4f [FeIII5LnIII8] complexes: synthesis, structure and magnetic properties","Dalton Transactions","2007","","45","5245","","10.1039/b714620p","","","0.71073","MoKα","","0.0504","0.0343","","","0.0801","0.0851","","","","","","0.98","","","","has coordinates,has disorder","179767","2020-10-21","18:00:00",""
"7006323","16.1198","0.0008","18.2678","0.0009","29.8436","0.0016","92.297","0.001","92.395","0.001","106.902","0.001","8388.6","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C112 H228 Fe5 Gd8 N11 O67 -","- C112 H220 Fe5 Gd8 N11 O67 -","- C224 H440 Fe10 Gd16 N22 O134 -","2","1","","Ako, Ayuk M.; Mereacre, Valeriu; Clérac, Rodolphe; Hewitt, Ian J.; Lan, Yanhua; Anson, Christopher E.; Powell, Annie K.","High-nuclearity 3d‒4f [FeIII5LnIII8] complexes: synthesis, structure and magnetic properties","Dalton Transactions","2007","","45","5245","","10.1039/b714620p","","","0.71073","MoKα","","0.0679","0.0372","","","0.0699","0.075","","","","","","0.985","","","","has coordinates,has disorder","179767","2020-10-21","18:00:00",""
"7006324","8.2131","0.0005","10.7095","0.0007","12.585","0.001","68.077","0.006","72.693","0.006","72.317","0.005","956.93","0.12","293","2","293","2","","","","","","","synthesized by the authors","4","P -1","-P 1","2","","","","- C5 H31 B18 N -","- C5 H31 B18 N -","- C10 H62 B36 N2 -","2","1","","Jelínek, Tomás; Císarová, Ivana; Stíbr, Bohumil; Kennedy, John D.","Macropolyhedral boron-containing cluster chemistry. Synthesis of the nineteen vertex monocarbaborane [9-(terBuNH2)-(anti)-9-CB18H20] by direct carbon-atom Aufbau.","Dalton transactions (Cambridge, England : 2003)","2007","","42","4766","4768","10.1039/b714631k","","","0.71069","MoKα","","0.0609","0.0446","","","0.1215","0.1324","","","","","","1.026","","","","has coordinates","179767","2020-10-21","18:00:00",""
"7006325","8.1446","0.0003","18.5721","0.0006","14.4284","0.0007","90","","107.742","0.003","90","","2078.67","0.15","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H23 Br O2 -","- C26 H23 Br O2 -","- C104 H92 Br4 O8 -","4","1","","Müller, Christian; Pidko, Evgeny A.; Totev, Daniel; Lutz, Martin; Spek, Anthony L.; van Santen, Rutger A.; Vogt, Dieter","Atropisomeric phosphinines: design and synthesis.","Dalton transactions (Cambridge, England : 2003)","2007","","46","5372","5375","10.1039/b715197g","","","0.71073","MoKα","","0.0545","0.0374","","","0.0871","0.0946","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052040","18.795","0.0009","18.795","0.0009","29.9286","0.0019","90","","90","","90","","10572.3","1","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C23 H45 Ce0.5 Cl N2 Na0.5 -","- C23 H45 Ce0.5 Cl N2 Na0.5 -","- C368 H720 Ce8 Cl16 N32 Na8 -","16","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0628","0.0333","","","0.0715","0.0798","","","","","","0.914","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052041","12.6251","0.0013","15.995","0.0013","24.079","0.004","90","","100.451","0.016","90","","4781.8","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H78 Cl2 Na O4 Sm -","- C42 H78 Cl2 Na O4 Sm -","- C168 H312 Cl8 Na4 O16 Sm4 -","4","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0787","0.0373","","","0.0656","0.0735","","","","","","0.82","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052042","12.6235","0.0007","18.0143","0.001","35.025","0.003","90","","90","","90","","7964.8","0.9","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C37 H67 Al Cl Nd -","- C37 H67 Al Cl Nd -","- C296 H536 Al8 Cl8 Nd8 -","8","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0686","0.0411","","","0.0955","0.1048","","","","","","1.041","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052043","13.2826","0.0008","11.7557","0.0005","34.576","0.003","90","","97.344","0.008","90","","5354.6","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H45 Cl2 O2 Yb -","- C25 H45 Cl2 O2 Yb -","- C200 H360 Cl16 O16 Yb8 -","8","2","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0536","0.04","","","0.0789","0.0825","","","","","","0.984","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052044","16.2836","0.0011","16.2836","0.0011","16.2836","0.0011","109.604","0.007","109.604","0.007","109.604","0.007","3307.3","0.6","293","2","293","2","","","","","","","","5","R -3 :R","-P 3*","148","","","","- C40 H72 Cl2 O4 Yb2 -","- C40 H72 Cl2 O4 Yb2 -","- C120 H216 Cl6 O12 Yb6 -","3","0.5","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0483","0.0422","","","0.0842","0.0871","","","","","","1.114","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052045","11.7891","0.0006","15.4829","0.0008","18.5865","0.001","90","","95.586","0.006","90","","3376.5","0.3","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H58 I Tm -","- C34 H58 I Tm -","- C136 H232 I4 Tm4 -","4","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.038","0.0244","","","0.0483","0.0502","","","","","","0.885","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052046","8.8947","0.0006","13.8338","0.0007","10.3037","0.0008","90","","105.603","0.008","90","","1221.12","0.15","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H39 Cl2 O2 Tm -","- C21 H39 Cl2 O2 Tm -","- C42 H78 Cl4 O4 Tm2 -","2","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0569","0.0367","","","0.0702","0.0745","","","","","","0.901","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052047","16.33","0.06","11.47","0.07","21.45","0.06","90","","103.8","0.2","90","","3902","3","298","2","298","2","","","","","","","Synthesis","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H28 Mo8 N4 O26 -","- C24 H28 Mo8 N4 O26 -","- C96 H112 Mo32 N16 O104 -","4","0.5","","Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson","Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane","New Journal of Chemistry","2007","31","1","33","","10.1039/b603996k","","","0.71073","MoKα","","0.0617","0.0452","","","0.1153","0.128","","","","","","1.138","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052048","10.716","0.002","11.128","0.002","11.666","0.002","68.08","0.03","85.5","0.03","76.19","0.03","1253.2","0.5","298","2","298","2","","","","","","","Synthesis","5","P -1","-P 1","2","","","","- C18 H20 Mo4 N3 O13 -","- C18 H20 Mo4 N3 O13 -","- C36 H40 Mo8 N6 O26 -","2","1","","Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson","Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane","New Journal of Chemistry","2007","31","1","33","","10.1039/b603996k","","","0.71073","MoKα","","0.0444","0.0351","","","0.0867","0.0918","","","","","","1.042","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052049","11.581","0.003","17.146","0.007","12.875","0.003","90","","101.447","0.016","90","","2505.7","1.4","298","2","298","2","","","","","","","Synthesis","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 Mo8 N6 O26 -","- C36 H40 Mo8 N6 O26 -","- C72 H80 Mo16 N12 O52 -","2","0.5","","Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson","Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane","New Journal of Chemistry","2007","31","1","33","","10.1039/b603996k","","","0.71073","MoKα","","0.082","0.0426","","","0.088","0.103","","","","","","1.041","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052050","9.6894","0.0017","13.447","0.003","15.341","0.002","90","","100.614","0.013","90","","1964.6","0.6","273","2","273","2","","","","","","","Synthesis","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 Mo4 N2 O13 -","- C12 H14 Mo4 N2 O13 -","- C48 H56 Mo16 N8 O52 -","4","1","","Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson","Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane","New Journal of Chemistry","2007","31","1","33","","10.1039/b603996k","","","0.71073","MoKα","","0.051","0.0382","","","0.0939","0.1009","","","","","","1.067","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052051","9.432","0.001","27.584","0.002","9.901","0.001","90","","114.26","0.01","90","","2348.5","0.4","208","2","208","2","","","","","","","","3","C 1 c 1","C -2yc","9","Cryptant-S6-Me2","Cryptant-S6-Me2","","- C19 H36 S6 -","- C19 H36 S6 -","- C76 H144 S24 -","4","1","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","1.54184","CuKα","","0.0957","0.0754","","","0.1989","0.2235","","","","","","0.931","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052052","10.396","0.001","15.421","0.002","18.421","0.005","90","","90","","90","","2953.2","0.9","208","2","208","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","S6-Ethylenecagesilver(i) trifluoromethylsulfonate","S6-Ethylenecagesilver(I) trifluoromethylsulfonate","","- C21 H38 Ag F3 O3 S7 -","- C21 H38 Ag F3 O3 S7 -","- C84 H152 Ag4 F12 O12 S28 -","4","1","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","0.71073","MoKα","","0.141","0.0675","","","0.1353","0.1668","","","","","","1.029","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052053","21.614","0.008","13.491","0.002","18.364","0.008","90","","109.7","0.02","90","","5041","3","208","2","208","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[Ag2(3-S6-cage-3-NO2)(triflat)2] x 2 AN","","","- C35 H60 Ag2 F6 N4 O10 S8 -","- C35 H60 Ag2 F6 N4 O10 S8 -","- C140 H240 Ag8 F24 N16 O40 S32 -","4","0.5","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","0.71073","MoKα","","0.1007","0.0476","","","0.1055","0.1235","","","","","","1.005","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052054","18.186","0.004","26.587","0.004","10.255","0.002","90","","101.16","0.01","90","","4864.6","1.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-S6-Hydroxy cage","","- C19 H36 O S6 -","- C19 H36 O S6 -","- C152 H288 O8 S48 -","8","2","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","1.54184","CuKα","","0.0899","0.0552","","","0.1378","0.1604","","","","","","0.997","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052055","10.707","0.004","17.737","0.004","19.081","0.008","90","","103.61","0.02","90","","3522","2","208","2","208","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[(S6-Cage-C4-OH-CH3)(tosylato)silver(I)] polymer","","- C29 H49 Ag O4 S7 -","- C29 H49 Ag O4 S7 -","- C116 H196 Ag4 O16 S28 -","4","1","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","0.71073","MoKα","","0.3303","0.0776","","","0.0755","0.1173","","","","","","0.956","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052056","19.785","0.001","11.7253","0.0004","19.6134","0.0007","90","","90","","90","","4550","0.3","120","2","120","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C38 H78 N4 O7 Ti2 -","- C38 H78 N4 O7 Ti2 -","- C152 H312 N16 O28 Ti8 -","4","1","","Day, Joanna K.; Baghurst, Rebecca E.; Strevens, Robert R.; Light, Mark E.; Hursthouse, Michael B.; Stengel, Bruno F.; Fallis, Ian A.; Aldridge, Simon","Influence of ligand backbone flexibility in group 4 metal complexes of tetradentate mixed tertiary amine/alkoxide ligands","New Journal of Chemistry","2007","31","1","135","","10.1039/b608680b","","","0.71073","MoKα","","0.1033","0.0607","","","0.1248","0.141","","","","","","1.008","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052057","10.762","0.002","12.115","0.002","15.963","0.003","76.68","0.03","72.59","0.03","68.58","0.03","1831.5","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H68 N4 O4 Zr -","- C32 H68 N4 O4 Zr -","- C64 H136 N8 O8 Zr2 -","2","1","","Day, Joanna K.; Baghurst, Rebecca E.; Strevens, Robert R.; Light, Mark E.; Hursthouse, Michael B.; Stengel, Bruno F.; Fallis, Ian A.; Aldridge, Simon","Influence of ligand backbone flexibility in group 4 metal complexes of tetradentate mixed tertiary amine/alkoxide ligands","New Journal of Chemistry","2007","31","1","135","","10.1039/b608680b","","","0.71073","MoKα","","0.0458","0.0373","","","0.0851","0.0886","","","","","","1.032","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052058","11.019","0.0005","14.3144","0.0006","15.7604","0.0008","70.24","0.003","88.145","0.002","71.787","0.002","2214.83","0.18","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H76 N2 O8 Ti2 -","- C35 H76 N2 O8 Ti2 -","- C70 H152 N4 O16 Ti4 -","2","1","","Day, Joanna K.; Baghurst, Rebecca E.; Strevens, Robert R.; Light, Mark E.; Hursthouse, Michael B.; Stengel, Bruno F.; Fallis, Ian A.; Aldridge, Simon","Influence of ligand backbone flexibility in group 4 metal complexes of tetradentate mixed tertiary amine/alkoxide ligands","New Journal of Chemistry","2007","31","1","135","","10.1039/b608680b","","","0.71073","MoKα","","0.1451","0.0684","","","0.1524","0.1758","","","","","","1.002","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052059","8.83","0.005","9.726","0.005","17.047","0.005","93.801","0.005","98.098","0.005","112.844","0.005","1323.9","1.1","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H48 N2 O4 Ti -","- C22 H48 N2 O4 Ti -","- C44 H96 N4 O8 Ti2 -","2","1","","Day, Joanna K.; Baghurst, Rebecca E.; Strevens, Robert R.; Light, Mark E.; Hursthouse, Michael B.; Stengel, Bruno F.; Fallis, Ian A.; Aldridge, Simon","Influence of ligand backbone flexibility in group 4 metal complexes of tetradentate mixed tertiary amine/alkoxide ligands","New Journal of Chemistry","2007","31","1","135","","10.1039/b608680b","","","0.71069","MoKα","","0.0538","0.0416","","","0.0881","0.0932","","","","","","1.03","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052060","15.2741","0.0008","23.8114","0.0011","21.7021","0.0014","90","","91.297","0.002","90","","7891","0.8","173","0.1","173","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C76 H107.5 Cl0.5 N O32 -","- C76 H107.5 Cl0.5 N O32 -","- C304 H430 Cl2 N4 O128 -","4","1","","Antti Åhman; Minna Luostarinen; Kari Rissanen; Maija Nissinen","Complexation of C-methyl pyrogallarene with small quaternary and tertiary alkyl ammonium cations","New Journal of Chemistry","2007","31","1","169","","10.1039/b609117b","","","0.71073","MoKα","","0.2813","0.1489","","","0.2742","0.3258","","","","","","1.036","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052061","13.9176","0.0007","15.1093","0.0009","18.6526","0.001","90","","109.008","0.003","90","","3708.5","0.4","173","0.1","173","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H50 Cl N O14 -","- C37 H50 Cl N O14 -","- C148 H200 Cl4 N4 O56 -","4","1","","Antti Åhman; Minna Luostarinen; Kari Rissanen; Maija Nissinen","Complexation of C-methyl pyrogallarene with small quaternary and tertiary alkyl ammonium cations","New Journal of Chemistry","2007","31","1","169","","10.1039/b609117b","","","0.71073","MoKα","","0.1739","0.0837","","","0.1243","0.1549","","","","","","1.095","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052062","21.2275","0.0011","25.3429","0.0013","17.9561","0.0005","90","","122.883","0.002","90","","8112.1","0.7","173","0.1","173","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H58 Cl N O14 -","- C41 H58 Cl N O14 -","- C328 H464 Cl8 N8 O112 -","8","1","","Antti Åhman; Minna Luostarinen; Kari Rissanen; Maija Nissinen","Complexation of C-methyl pyrogallarene with small quaternary and tertiary alkyl ammonium cations","New Journal of Chemistry","2007","31","1","169","","10.1039/b609117b","","","0.71073","MoKα","","0.153","0.1021","","","0.2296","0.2541","","","","","","1.111","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052063","28.6719","0.0006","14.5214","0.0005","20.4197","0.0006","90","","131.685","0.002","90","","6349.3","0.4","173","0.1","173","0.1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C70 H82 O27 -","- C70 H82 O27 -","- C280 H328 O108 -","4","0.5","","Antti Åhman; Minna Luostarinen; Kari Rissanen; Maija Nissinen","Complexation of C-methyl pyrogallarene with small quaternary and tertiary alkyl ammonium cations","New Journal of Chemistry","2007","31","1","169","","10.1039/b609117b","","","0.71073","MoKα","","0.1509","0.0942","","","0.2198","0.2677","","","","","","1.111","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052064","33.824","0.008","10.759","0.003","23.446","0.006","90","","100.613","0.004","90","","8386","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32.5 H33.5 Br2 Cl10.5 N4 Ni -","- C32.5 H33 Br2 Cl9.75 N4 Ni -","- C260 H264 Br16 Cl78 N32 Ni8 -","8","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.2232","0.1088","","","0.2653","0.325","","","","","","0.893","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7052065","10.3842","0.0007","16.8912","0.0011","17.4972","0.0012","90","","96.166","0.001","90","","3051.3","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H29 Cl5 N4 Zn -","- C29 H29 Cl5 N4 Zn -","- C116 H116 Cl20 N16 Zn4 -","4","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.0471","0.0367","","","0.0884","0.0919","","","","","","0.974","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7052066","10.0666","0.0012","17.26","0.002","16.987","0.002","90","","96.542","0.002","90","","2932.3","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H31 Cl2 Fe N5 -","- C30 H31 Cl2 Fe N5 -","- C120 H124 Cl8 Fe4 N20 -","4","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.0497","0.0408","","","0.1039","0.1089","","","","","","1.045","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7052067","10.089","0.003","17.124","0.005","16.991","0.005","90","","96.459","0.005","90","","2916.8","1.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H31 Cl2 Co N5 -","- C30 H31 Cl2 Co N5 -","- C120 H124 Cl8 Co4 N20 -","4","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.0409","0.0336","","","0.092","0.0947","","","","","","1.036","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7052068","10.2739","0.0019","10.5553","0.0019","12.623","0.002","94.301","0.003","101.922","0.003","96.325","0.003","1324.5","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H30 Cl2 N4 Zn -","- C29 H30 Cl2 N4 Zn -","- C58 H60 Cl4 N8 Zn2 -","2","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.0567","0.044","","","0.1004","0.1055","","","","","","1.003","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7052069","16.936","0.003","15.203","0.003","21.457","0.004","90","","90","","90","","5524.7","1.8","120","2","120","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C52 H58 Cl2 Fe4 N8 O18 -","- C52 H58 Cl2 Fe4 N8 O18 -","- C208 H232 Cl8 Fe16 N32 O72 -","4","0.5","","Sujit K. Dutta; Meenakshi Ghosh; Papu Biswas; Ulrich Flörke; Cristoph Saal; Wolfgang Haase; Kamalaksha Nag","Formation of oxo-bridged tetrairon(iii) complexes mediated by oxygen activation. Structure, spectroscopy, magnetism and electrochemistry","New Journal of Chemistry","2007","31","1","93","","10.1039/b610649h","","","0.71073","MoKα","","0.2755","0.0583","","","0.0876","0.1355","","","","","","0.733","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052070","21.958","0.004","15.182","0.003","19.591","0.004","90","","91.61","0.02","90","","6528","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C62 H62 Cl2 Fe4 N8 O18 -","- C62 H62 Cl2 Fe4 N8 O18 -","- C248 H248 Cl8 Fe16 N32 O72 -","4","0.5","","Sujit K. Dutta; Meenakshi Ghosh; Papu Biswas; Ulrich Flörke; Cristoph Saal; Wolfgang Haase; Kamalaksha Nag","Formation of oxo-bridged tetrairon(iii) complexes mediated by oxygen activation. Structure, spectroscopy, magnetism and electrochemistry","New Journal of Chemistry","2007","31","1","93","","10.1039/b610649h","","","0.71073","MoKα","","0.1307","0.0597","","","0.1212","0.1511","","","","","","1.012","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052071","7.8781","0.0002","12.7652","0.0003","12.8795","0.0003","91.972","0.005","102.869","0.005","92.2","0.005","1260.54","0.06","173","","173","","","","","","","","","3","P -1","-P 1","2","","","","- C31 H32 O5 -","- C31 H32 O5 -","- C62 H64 O10 -","2","1","","Sergio Andrés Pérez Guarìn; Derek Tsang; W. G. Skene","Spectroscopic studies of a fluorescent fluoresceinophane formed via a practical synthetic route","New Journal of Chemistry","2007","31","2","210","","10.1039/b611060f","","","0.71073","Mo-Kα","","0.12","0.047","","0.232","","0.064","","","3.963","","","1.083","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052072","7.2136","0.0009","7.6191","0.0008","8.101","0.0011","102.96","0.01","106.797","0.01","111.387","0.009","368.76","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","3-Fluoro-2-formyl-phenylboronic acid","3-Fluoro-2-formyl-phenylboronic acid","","- C7 H6 B F O3 -","- C7 H6 B F O3 -","- C14 H12 B2 F2 O6 -","2","1","","Sergiusz Luliński; Izabela Madura; Janusz Serwatowski; Halina Szatyłowicz; Janusz Zachara","A tautomeric equilibrium between functionalized 2-formylphenylboronic acids and corresponding 1,3-dihydro-1,3-dihydroxybenzo[c][2,1]oxaboroles","New Journal of Chemistry","2007","31","1","144","","10.1039/b611195e","","","0.71073","MoKα","","0.037","0.0327","","","0.0874","0.0907","","","","","","1.066","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052073","7.0559","0.0016","8.3747","0.0018","9.656","0.002","89.986","0.017","99.607","0.018","108.329","0.017","533.2","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","3,5-Dibromo-2-formyl-phenylboronic acid monohydrate","3,5-Dibromo-2-formyl-phenylboronic acid monohydrate","","- C7 H7 B Br2 O4 -","- C7 H7 B Br2 O4 -","- C14 H14 B2 Br4 O8 -","2","1","","Sergiusz Luliński; Izabela Madura; Janusz Serwatowski; Halina Szatyłowicz; Janusz Zachara","A tautomeric equilibrium between functionalized 2-formylphenylboronic acids and corresponding 1,3-dihydro-1,3-dihydroxybenzo[c][2,1]oxaboroles","New Journal of Chemistry","2007","31","1","144","","10.1039/b611195e","","","0.71073","MoKα","","0.0327","0.0253","","","0.0622","0.0652","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052074","11.159","0.003","11.116","0.002","29.383","0.007","90","","94.473","0.018","90","","3633.7","1.5","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","1,3-Dihydro-1,3-dihydroxy-4-bromo-2,1-benzoxaborole monohydrate","","- C7 H8 B Br O4 -","- C7 H6 B Br O4 -","- C112 H96 B16 Br16 O64 -","16","4","","Sergiusz Luliński; Izabela Madura; Janusz Serwatowski; Halina Szatyłowicz; Janusz Zachara","A tautomeric equilibrium between functionalized 2-formylphenylboronic acids and corresponding 1,3-dihydro-1,3-dihydroxybenzo[c][2,1]oxaboroles","New Journal of Chemistry","2007","31","1","144","","10.1039/b611195e","","","0.71073","MoKα","","0.0809","0.0593","","","0.1481","0.1617","","","","","","1.04","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052075","7.0108","0.0002","11.0338","0.0003","16.912","0.0004","93.637","0.001","95.736","0.001","95.729","0.001","1291.62","0.06","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H18 Ag F6 N3 O3 Sb -","- C24 H18 Ag F6 N3 O3 Sb -","- C48 H36 Ag2 F12 N6 O6 Sb2 -","2","1","","Bourlier, Julien; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 1-D interdigitated and 2-D interwoven helical silver coordination networks by oligoethylene glycol based tectons bearing two benzonitrile moieties","New Journal of Chemistry","2007","31","1","25","","10.1039/b611415f","","","0.71073","MoKα","","0.0286","0.022","","","0.0542","0.057","","","","","","1.041","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052076","9.123","0.0006","11.624","0.0006","12.477","0.0009","62.419","0.002","83.793","0.002","83.386","0.005","1162.71","0.13","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H20 Ag As F6 N2 O4 -","- C20 H12 Ag As F6 N2 O4 -","- C40 H24 Ag2 As2 F12 N4 O8 -","2","1","","Bourlier, Julien; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 1-D interdigitated and 2-D interwoven helical silver coordination networks by oligoethylene glycol based tectons bearing two benzonitrile moieties","New Journal of Chemistry","2007","31","1","25","","10.1039/b611415f","","","0.71073","MoKα","","0.1316","0.0658","","","0.1597","0.1903","","","","","","1.054","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052077","11.768","0.0002","25.757","0.0006","8.587","0.0004","90","","96.92","0.0009","90","","2583.83","0.14","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Ag As F6 N2 O5 -","- C22 H24 Ag As F6 N2 O5 -","- C88 H96 Ag4 As4 F24 N8 O20 -","4","1","","Bourlier, Julien; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 1-D interdigitated and 2-D interwoven helical silver coordination networks by oligoethylene glycol based tectons bearing two benzonitrile moieties","New Journal of Chemistry","2007","31","1","25","","10.1039/b611415f","","","0.71073","MoKα","","0.1806","0.0508","","","0.0709","0.092","","","","","","0.975","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052078","11.964","0.0001","25.717","0.0004","8.632","0.0002","90","","97.078","0.0006","90","","2635.64","0.08","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Ag F6 N2 O5 Sb -","- C22 H24 Ag F6 N2 O5 Sb -","- C88 H96 Ag4 F24 N8 O20 Sb4 -","4","1","","Bourlier, Julien; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 1-D interdigitated and 2-D interwoven helical silver coordination networks by oligoethylene glycol based tectons bearing two benzonitrile moieties","New Journal of Chemistry","2007","31","1","25","","10.1039/b611415f","","","0.71073","MoKα","","0.0874","0.0464","","","0.1151","0.1321","","","","","","1.035","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052079","6.6026","0.0001","12.932","0.0002","15.1197","0.0003","90","","102.109","0.0009","90","","1262.27","0.04","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H17 N3 O -","- C13 H17 N3 O -","- C52 H68 N12 O4 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0491","0.0421","","","0.1146","0.1211","","","","","","1.07","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052080","10.2904","0.0002","8.7167","0.0002","14.0155","0.0003","90","","100.932","0.0009","90","","1234.36","0.05","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 N4 O3 -","- C12 H14 N4 O3 -","- C48 H56 N16 O12 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0466","0.0396","","","0.1107","0.1169","","","","","","1.078","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052081","6.9786","0.0002","14.2655","0.0005","13.2947","0.0006","90","","101.364","0.001","90","","1297.58","0.08","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H17 N3 O2 -","- C13 H17 N3 O2 -","- C52 H68 N12 O8 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0625","0.0454","","","0.1151","0.1256","","","","","","1.028","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052082","8.1028","0.0002","10.4312","0.0002","10.4731","0.0002","67.932","0.001","76.578","0.001","71.72","0.001","772.36","0.03","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H19 N3 O -","- C18 H19 N3 O -","- C36 H38 N6 O2 -","2","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0555","0.0432","","","0.1144","0.1242","","","","","","1.052","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052083","7.7167","0.0001","10.8913","0.0001","18.8973","0.0003","90","","90","","90","","1588.22","0.04","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H19 N3 O -","- C18 H19 N3 O -","- C72 H76 N12 O4 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.7107","MoKα","","0.0421","0.0368","","","0.0894","0.0932","","","","","","1.022","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052084","8.0995","0.0001","9.5542","0.0002","20.4491","0.0004","90","","98.2804","0.0008","90","","1565.94","0.05","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 N4 O3 -","- C17 H16 N4 O3 -","- C68 H64 N16 O12 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.7107","MoKα","","0.0747","0.0493","","","0.1141","0.1316","","","","","","1.037","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052085","13.6403","0.0002","9.6489","0.0002","24.3685","0.0005","90","","90","","90","","3207.23","0.1","150","","150","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H19 N3 O2 -","- C18 H19 N3 O2 -","- C144 H152 N24 O16 -","8","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0533","0.0391","","","0.0952","0.1026","","","","","","1.038","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052086","8.6915","0.0002","17.1912","0.0004","13.2188","0.0003","90","","101.066","0.001","90","","1938.39","0.08","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H25 N3 O -","- C21 H25 N3 O -","- C84 H100 N12 O4 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0674","0.0519","","","0.1335","0.1487","","","","","","1.014","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052087","8.5205","0.0002","12.6244","0.0003","18.1441","0.0004","90","","90","","90","","1951.69","0.08","295","","295","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H25 N3 O -","- C21 H25 N3 O -","- C84 H100 N12 O4 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0605","0.044","","","0.1106","0.1213","","","","","","1.019","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052088","8.3729","0.0006","14.6999","0.001","9.1764","0.0006","90","","98.917","0.002","90","","1115.79","0.13","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N4 O2 -","- C12 H10 N4 O2 -","- C48 H40 N16 O8 -","4","1","","Tzeng, Biing-Chiau; Chen, Yen-Fei; Wu, Chia-Chin; Hu, Cho-Chun; Chang, Ya-Ting; Chen, Chang-Kai","Anion-recognition studies of a Re(i)-based square containing the dipyridyl-amide ligand","New Journal of Chemistry","2007","31","2","202","","10.1039/b613508k","","","0.71073","MoKα","","0.0618","0.0487","","","0.1121","0.1193","","","","","","1.068","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052089","6.2667","0.0009","8.5979","0.0012","19.959","0.003","83.907","0.002","89.471","0.002","77.551","0.002","1044.1","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C27 H26 O2 -","- C27 H26 O2 -","- C54 H52 O4 -","2","1","","Han, Jie; Li, Yan-Xia; Pang, Mei-Li; Cheng, Kai-Ge; Wang, Yan-Mei; Ma, Yu-Xin; Meng, Ji-Ben","A novel photochromic liquid crystal system based on biindenylidenedione derivatives","New Journal of Chemistry","2007","31","4","543","","10.1039/b613549h","","","0.71073","MoKα","","0.1149","0.0529","","","0.1342","0.1626","","","","","","1.019","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052090","32.142","0.006","6.2276","0.0012","11.413","0.002","90","","101.7","0.03","90","","2237","0.8","150","2","150","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C29 H26 O3 -","- C29 H26 O3 -","- C116 H104 O12 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.1474","0.0876","","","0.1387","0.1579","","","","","","1.068","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052091","6.001","0.0012","18.79","0.004","20.595","0.004","90","","90","","90","","2322.3","0.8","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H28 O3 -","- C30 H28 O3 -","- C120 H112 O12 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.0698","0.05","","","0.0901","0.096","","","","","","1.086","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052092","20.793","0.004","6.122","0.0012","20.961","0.004","90","","114.24","0.03","90","","2433","1","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C31 H30 O3 -","- C31 H30 O3 -","- C124 H120 O12 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.1077","0.0554","","","0.1081","0.1247","","","","","","1.014","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052093","5.7983","0.0012","9.0444","0.0018","15.82","0.003","94.69","0.03","100","0.03","106.81","0.03","774.4","0.3","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C21 H18 O -","- C21 H18 O -","- C42 H36 O2 -","2","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.0907","0.0594","","","0.128","0.1413","","","","","","1.068","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052094","9.0898","0.0018","19.066","0.004","20.516","0.004","90","","95.84","0.03","90","","3537.1","1.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H20 Ga3 I5 O4 -","- C28 H20 Ga3 I5 O4 -","- C112 H80 Ga12 I20 O16 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.0607","0.0399","","","0.0878","0.0955","","","","","","1.049","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052095","7.4458","0.0015","18.197","0.004","12.271","0.003","90","","94.13","0.03","90","","1658.3","0.6","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H12 Ga I3 O2 -","- C11 H12 Ga I3 O2 -","- C44 H48 Ga4 I12 O8 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.0852","0.0533","","","0.1217","0.1356","","","","","","1.021","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052096","12.2707","0.0013","13.5989","0.0015","15.4906","0.0017","71.1","0.002","73.3","0.002","72.169","0.002","2276.7","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C56 H46 N6 O6 -","- C56 H46 N6 O6 -","- C112 H92 N12 O12 -","2","1","","Anas, S.; Krishnan, K. Syam; Sajisha, V. Sanjayan; Anju, K. Sasidharan; Radhakrishnan, K. V.; Suresh, Eringathodi; Suresh, Cherumuttathu H.","Interplay of dual reactivity in the reaction of pentafulvenes with 1,2,4-triazoline-3,5-diones: experimental and theoretical investigations","New Journal of Chemistry","2007","31","2","237","","10.1039/b614533g","","","0.71073","MoKα","","0.1444","0.0738","","","0.1924","0.235","","","","","","1.025","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052097","9.75","0.002","10.216","0.002","11.647","0.002","64.72","0.03","84.92","0.03","76.29","0.03","1019","0.4","123","","123","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H30 La2 O30 S8 -","- C24 H30 La2 O30 S8 -","- C24 H30 La2 O30 S8 -","1","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.038","0.029","","0.035","","0.033","","","1.013","","","1.024","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052098","7.6971","0.0015","34.283","0.007","8.5201","0.0017","90","","111.43","0.03","90","","2092.8","0.8","123","","123","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 Ho2 O34 S6 -","- C18 H44 Ho2 O34 S6 -","- C36 H88 Ho4 O68 S12 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.031","0.023","","0.15","","0.035","","","1.451","","","1.056","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052099","7.6711","0.0005","34.174","0.002","8.5082","0.0005","90","","111.555","0.001","90","","2074.5","0.2","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 O34 S6 Yb2 -","- C18 H44 O34 S6 Yb2 -","- C36 H88 O68 S12 Yb4 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.038","0.036","","0.065","","0.065","","","0.987","","","1.009","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052100","7.256","0.0005","12.7526","0.0008","19.514","0.001","90","","90","","90","","1805.69","0.19","150","","150","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C6 H20 Cl La O14 S2 -","- C6 H20 Cl La O14 S2 -","- C24 H80 Cl4 La4 O56 S8 -","4","1","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.024","0.023","","0.03","","0.03","","","1.304","","","1.306","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052101","8.6666","0.0005","14.2258","0.0006","19.4202","0.0007","103.476","0.001","98.679","0.001","100.967","0.001","2237.55","0.18","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H48.5 O36.25 S6 Sm2 -","- C18 H38 O36.25 S6 Sm2 -","- C36 H76 O72.5 S12 Sm4 -","2","1","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.037","0.025","","0.037","","0.035","","","1.152","","","1.229","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052102","7.7426","0.0005","34.467","0.003","8.5532","0.0005","90","","111.174","0.001","90","","2128.4","0.3","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 Eu2 O34 S6 -","- C18 H44 Eu2 O34 S6 -","- C36 H88 Eu4 O68 S12 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.042","0.03","","0.103","","0.06","","","1.777","","","1.092","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052103","7.7246","0.0004","34.366","0.002","8.5388","0.0004","90","","111.327","0.001","90","","2111.51","0.19","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 O34 S6 Tb2 -","- C18 H44 O34 S6 Tb2 -","- C36 H88 O68 S12 Tb4 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.044","0.035","","0.054","","0.051","","","1.236","","","1.249","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052104","7.6984","0.0004","34.311","0.002","8.5293","0.0005","90","","111.463","0.001","90","","2096.7","0.2","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 O34 S6 Y2 -","- C18 H44 O34 S6 Y2 -","- C36 H88 O68 S12 Y4 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.052","0.039","","0.052","","0.05","","","1.203","","","1.249","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052105","7.664","0.0007","34.161","0.003","8.5009","0.0008","90","","111.641","0.001","90","","2068.7","0.3","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 Lu2 O34 S6 -","- C18 H44 Lu2 O34 S6 -","- C36 H88 Lu4 O68 S12 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.025","0.025","","0.023","","0.023","","","1.298","","","1.353","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052106","6.491","0.001","18.388","0.004","7.23","0.001","90","","112.18","0.03","90","","799.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","guanidinium hydrogen succinate","Guanidinium hydrogen butanedicarboxylate'","","- C5 H11 N3 O4 -","- C5 H11 N3 O4 -","- C20 H44 N12 O16 -","4","1","","Veneta Videnova-Adrabinska; Elżbieta Obara; Tadeusz Lis","Two-dimensional hydrogen-bonded networks in guanidinium hydrogen dicarboxylates","New Journal of Chemistry","2007","31","2","287","","10.1039/b614843c","","","0.71073","MoKα","","0.0669","0.06","","","0.1716","0.1796","","","","","","1.075","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052107","3.696","0.003","18.824","0.005","5.496","0.002","90","","94.76","0.04","90","","381.1","0.4","297","","297","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","guanidinium hydrogen fumarate","guanidinium hydrogen E-butenedicarboxylate","","- C5 H9 N3 O4 -","- C5 H9 N3 O4 -","- C10 H18 N6 O8 -","2","0.5","","Veneta Videnova-Adrabinska; Elżbieta Obara; Tadeusz Lis","Two-dimensional hydrogen-bonded networks in guanidinium hydrogen dicarboxylates","New Journal of Chemistry","2007","31","2","287","","10.1039/b614843c","","","0.71073","MoKα","","","0.053","","","","0.067","","","","","","2.17","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052108","5.284","0.002","8.501","0.003","10.466","0.004","69.1","0.03","77.91","0.03","89.42","0.03","428.4","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","guanidinium hydrogen adipate","Guanidinium hydrogen pentanedicarboxylate","","- C6 H13 N3 O4 -","- C6 H13 N3 O4 -","- C12 H26 N6 O8 -","2","1","","Veneta Videnova-Adrabinska; Elżbieta Obara; Tadeusz Lis","Two-dimensional hydrogen-bonded networks in guanidinium hydrogen dicarboxylates","New Journal of Chemistry","2007","31","2","287","","10.1039/b614843c","","","0.71073","MoKα","","0.0346","0.0305","","","0.0783","0.0809","","","","","","1.075","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052109","10.602","0.0003","10.9717","0.0003","12.6859","0.0004","90","","99.022","0.002","90","","1457.39","0.07","120","0.2","120","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H17 N O2 -","- C19 H17 N O2 -","- C76 H68 N4 O8 -","4","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.0538","0.0434","","","0.1209","0.1262","","","","","","1.043","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052110","10.702","0.0007","10.9624","0.0007","12.5151","0.0008","90","","98.443","0.003","90","","1452.35","0.16","120","0.2","120","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H34 N2 O4 -","- C38 H34 N2 O4 -","- C76 H68 N4 O8 -","2","0.5","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.0864","0.0648","","","0.1466","0.1558","","","","","","1.07","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052111","7.034","0.0005","21.0718","0.0014","14.6964","0.001","90","","94.305","0.001","90","","2172.1","0.3","120","0.2","120","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H25 Cl N O6 -","- C24 H25 Cl N O6 -","- C96 H100 Cl4 N4 O24 -","4","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.0662","0.0443","","","0.122","0.1311","","","","","","0.983","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052112","14.135","0.004","7.983","0.002","25.02","0.007","90","","100.855","0.01","90","","2772.7","1.3","120","0.2","120","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H35 Cl2 N O7 -","- C28 H34 Cl2 N O7 -","- C112 H136 Cl8 N4 O28 -","4","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.339","0.1576","","","0.4168","0.4553","","","","","","1.062","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052113","10.9855","0.0012","10.8828","0.0012","12.212","0.0013","90","","98.282","0.005","90","","1444.8","0.3","120","0.2","120","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H34 N2 O4 -","- C38 H34 N2 O4 -","- C76 H68 N4 O8 -","2","0.5","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.1123","0.069","","","0.1333","0.1472","","","","","","1.054","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052114","11.4976","0.0005","12.2916","0.0006","13.5348","0.0006","93.589","0.002","110.545","0.002","92.542","0.002","1783.11","0.14","120","0.2","120","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H36 Cl2 N2 O12 -","- C38 H36 Cl2 N2 O12 -","- C76 H72 Cl4 N4 O24 -","2","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.1263","0.0614","","","0.135","0.1547","","","","","","0.938","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052115","7.7053","0.0009","20.304","0.002","14.3081","0.0015","90","","99.737","0.005","90","","2206.2","0.4","120","0.2","120","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H50 Cl2 N2 O12 -","- C48 H50 Cl2 N2 O11.2 -","- C96 H100 Cl4 N4 O22.4 -","2","0.5","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.2886","0.1495","","","0.3078","0.3606","","","","","","1.065","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052116","11.023","0.0004","11.2484","0.0004","12.5132","0.0005","82.944","0.002","76.649","0.002","61.394","0.002","1325.18","0.09","120","0.2","120","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H62 Cl2 N2 O12 -","- C60 H62 Cl2 N2 O12 -","- C60 H62 Cl2 N2 O12 -","1","0.5","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.0977","0.0523","","","0.1156","0.1283","","","","","","0.959","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052117","8.3685","0.0002","9.1253","0.0002","9.7248","0.0003","69.2894","0.001","82.1053","0.001","77.1832","0.0014","675.92","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","mar147","","","- C12 H14 F3 N O5 -","- C12 H14 F3 N O5 -","- C24 H28 F6 N2 O10 -","2","1","","Alberto Avenoza; Jesús H. Busto; Noelia Canal; José I. García; Gonzalo Jiménez-Osés; Jesús M. Peregrina; Marta Pérez-Fernández","Mechanistic study of the ring-size modulation in Michael?Dieckmann type reactions of 2-acylaminoacrylates with ketene diethyl acetal","New Journal of Chemistry","2007","31","2","224","","10.1039/b615220a","","","0.71073","MoKα","","0.0542","0.0385","","","0.09","0.0979","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052118","13.6418","0.0016","16.7","0.002","20.05","0.002","85.446","0.008","83.877","0.007","70.685","0.007","4281.3","0.9","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C78 H105 F12 N5 O27 P4 -","- C78 H105 F12 N5 O27 P4 -","- C156 H210 F24 N10 O54 P8 -","2","1","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.1011","0.0627","","","0.153","0.1777","","","","","","0.994","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052119","14.3358","0.0019","16.055","0.002","20.135","0.003","90","","101.999","0.009","90","","4533","1.1","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C80 H102 F24 N6 O18 P4 -","- C80 H102 F24 N6 O18 P4 -","- C160 H204 F48 N12 O36 P8 -","2","0.5","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.0667","0.0436","","","0.1091","0.1192","","","","","","1.092","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052120","10.7969","0.0013","11.6598","0.0014","13.4326","0.0016","69.073","0.002","66.558","0.002","76","0.002","1439.2","0.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H66 F12 N2 O14 P2 -","- C54 H66 F12 N2 O14 P2 -","- C54 H66 F12 N2 O14 P2 -","1","0.5","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.0438","0.0355","","","0.0956","0.102","","","","","","1.041","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052121","10.405","0.002","11.148","0.002","14.021","0.003","69.539","0.003","81.494","0.003","74.025","0.003","1462.5","0.5","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H66 F12 N2 O14 P2 -","- C55 H66 F12 N2 O14 P2 -","- C55 H66 F12 N2 O14 P2 -","1","0.5","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.0748","0.0592","","","0.1653","0.1782","","","","","","1.02","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052122","11.7067","0.0011","12.1212","0.0011","13.9127","0.0013","94.769","0.006","110.295","0.006","109.052","0.006","1706.7","0.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C62 H78 F12 N6 O14 P2 -","- C62 H78 F12 N6 O14 P2 -","- C62 H78 F12 N6 O14 P2 -","1","0.5","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.0953","0.0508","","","0.1098","0.1261","","","","","","1.025","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052123","17.349","0.002","33.402","0.004","42.855","0.005","90","","93.069","0.002","90","","24798","5","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C212 H198 N20 O88 S16 -","- C212 H134 N20 O88 S16 -","- C848 H536 N80 O352 S64 -","4","0.5","","Smith, Christopher B.; Makha, Mohamed; Raston, Colin L.; Sobolev, Alexandre N.","Solution and solid state interplay of isomeric 4?-(pyridyl)-3,2?:6?,3?-terpyridines with p-sulfonatocalix[4]arene","New Journal of Chemistry","2007","31","4","535","","10.1039/b615508a","","","0.71073","MoKα","","0.3617","0.2234","","","0.4862","0.5783","","","","","","0.985","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052124","17.195","0.001","17.804","0.003","23.132","0.002","78.326","0.009","86.573","0.004","68.775","0.009","6464","1.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C116 H142 N12 O58 S8 -","- C116 H132 N12 O58 S8 -","- C232 H264 N24 O116 S16 -","2","1","","Smith, Christopher B.; Makha, Mohamed; Raston, Colin L.; Sobolev, Alexandre N.","Solution and solid state interplay of isomeric 4?-(pyridyl)-3,2?:6?,3?-terpyridines with p-sulfonatocalix[4]arene","New Journal of Chemistry","2007","31","4","535","","10.1039/b615508a","","","0.71073","MoKα","","0.2007","0.1382","","","0.3765","0.4013","","","","","","1.022","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052125","49.471","0.002","11.382","0.001","21.92","0.001","90","","115.321","0.004","90","","11156.9","1.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H53 N4 O24 S4 -","- C48 H37 N4 O23.97 S4 -","- C384 H296 N32 O191.76 S32 -","8","1","","Smith, Christopher B.; Makha, Mohamed; Raston, Colin L.; Sobolev, Alexandre N.","Solution and solid state interplay of isomeric 4?-(pyridyl)-3,2?:6?,3?-terpyridines with p-sulfonatocalix[4]arene","New Journal of Chemistry","2007","31","4","535","","10.1039/b615508a","","","0.71073","MoKα","","0.1444","0.1391","","","0.317","0.3218","","","","","","1.086","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052126","11.6399","0.0004","12.1551","0.0004","12.5581","0.0004","75.915","0.002","72.576","0.002","76.92","0.002","1621.52","0.1","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H31 Cl2 N5 O10 -","- C27 H29 N5 O10 -","- C54 H58 N10 O20 -","2","1","","Sessler, Jonathan L.; Barkey, Natalie M.; Pantos, G. Dan; Lynch, Vincent M.","Acyclic pyrrole-based anion receptors: design, synthesis, and anion-binding properties","New Journal of Chemistry","2007","31","5","646","","10.1039/b615673h","","","0.71073","MoKα","","0.1227","0.0735","","","0.1973","0.2147","","","","","","1.165","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052127","16.2474","0.0007","16.2674","0.0007","20.5931","0.0007","83.54","0.003","76.736","0.003","71.072","0.002","5006.9","0.4","173","0.1","173","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C90 H93.5 Cl3 N4.5 O16 S4 -","- C90 H93.5 Cl3 N4.5 O16 S4 -","- C180 H187 Cl6 N9 O32 S8 -","2","1","","Ngong Kodiah Beyeh; Jukka Aumanen; Antti Åhman; Minna Luostarinen; Heidi Mansikkamäki; Maija Nissinen; Jouko Korppi-Tommola; Kari Rissanen","Dansylated resorcinarenes","New Journal of Chemistry","2007","31","3","370","","10.1039/b615772f","","","0.71073","MoKα","","0.2545","0.1274","","","0.3377","0.3917","","","","","","1.024","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052128","29.3447","0.0009","22.6903","0.0005","22.2725","0.0007","90","","109.033","0.001","90","","14019.2","0.7","173","0.2","173","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C142 H147.5 N9.5 O25 S8 -","- C142 H147.5 N9.5 O25 S8 -","- C568 H590 N38 O100 S32 -","4","0.5","","Ngong Kodiah Beyeh; Jukka Aumanen; Antti Åhman; Minna Luostarinen; Heidi Mansikkamäki; Maija Nissinen; Jouko Korppi-Tommola; Kari Rissanen","Dansylated resorcinarenes","New Journal of Chemistry","2007","31","3","370","","10.1039/b615772f","","","0.71073","MoKα","","0.22","0.0913","","","0.2217","0.2794","","","","","","1.044","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052129","8.218","0.0004","11.3823","0.0004","17.5254","0.0009","90","","101.113","0.002","90","","1608.58","0.13","173","0.2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 N O3 S -","- C18 H17 N O3 S -","- C72 H68 N4 O12 S4 -","4","1","","Ngong Kodiah Beyeh; Jukka Aumanen; Antti Åhman; Minna Luostarinen; Heidi Mansikkamäki; Maija Nissinen; Jouko Korppi-Tommola; Kari Rissanen","Dansylated resorcinarenes","New Journal of Chemistry","2007","31","3","370","","10.1039/b615772f","","","0.71073","MoKα","","0.0654","0.0399","","","0.0831","0.0918","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052130","8.2722","0.0011","11.2447","0.0016","37.776","0.005","90","","90","","90","","3513.9","0.8","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1-[(1R,2S,5R)-(-)-menthoxymethyl]-3-methylimidazolium chloride hydrate","","- C15 H29 Cl N2 O2 -","- C15 H29 Cl N2 O2 -","- C120 H232 Cl8 N16 O16 -","8","2","","Juliusz Pernak; Joanna Feder-Kubis; Anna Cieniecka-Rosłonkiewicz; Cedric Fischmeister; Scott T. Griffin; Robin D. Rogers","Synthesis and properties of chiral imidazolium ionic liquids with a (1R,2S,5R)-(?)-menthoxymethyl substituent","New Journal of Chemistry","2007","31","6","879","","10.1039/b616215k","","","0.71073","MoKα","","0.0802","0.0486","","","0.0765","0.0838","","","","","","1.015","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052131","13.0143","0.0014","8.0671","0.0008","17.9287","0.0018","90","","103.636","0.002","90","","1829.2","0.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-[(1R,2S,5R)‒(‒)‒menthoxymethyl]-3-ethylimidazolium chloride hemihydrate","","- C16 H30 Cl N2 O1.5 -","- C16 H29 Cl N2 O1.5 -","- C64 H116 Cl4 N8 O6 -","4","2","","Juliusz Pernak; Joanna Feder-Kubis; Anna Cieniecka-Rosłonkiewicz; Cedric Fischmeister; Scott T. Griffin; Robin D. Rogers","Synthesis and properties of chiral imidazolium ionic liquids with a (1R,2S,5R)-(?)-menthoxymethyl substituent","New Journal of Chemistry","2007","31","6","879","","10.1039/b616215k","","","0.71073","MoKα","","0.0982","0.0569","","","0.1478","0.1668","","","","","","0.993","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052132","9.4408","0.001","34.119","0.004","12.1754","0.0013","90","","90.292","0.002","90","","3921.8","0.7","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-[(1R,2S,5R)‒(‒)‒menthoxymethyl]-3-propylimidazolium chloride hemihydrate","","- C17 H32 Cl N2 O1.5 -","- C17 H32 Cl N2 O1.5 -","- C136 H256 Cl8 N16 O12 -","8","4","","Juliusz Pernak; Joanna Feder-Kubis; Anna Cieniecka-Rosłonkiewicz; Cedric Fischmeister; Scott T. Griffin; Robin D. Rogers","Synthesis and properties of chiral imidazolium ionic liquids with a (1R,2S,5R)-(?)-menthoxymethyl substituent","New Journal of Chemistry","2007","31","6","879","","10.1039/b616215k","","","0.71073","MoKα","","0.1361","0.0651","","","0.1222","0.1471","","","","","","0.99","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052133","14.2033","0.0003","16.447","0.0004","20.4164","0.0005","90","","90","","90","","4769.31","0.19","100","2","100","2","","","","","","","synthesized","6","P b c a","-P 2ac 2ab","61","","","","- C46 H34 Cl6 I4 N2 O2 -","- C46 H34 Cl6 I4 N2 O2 -","- C184 H136 Cl24 I16 N8 O8 -","4","0.5","","Arunkumar, Easwaran; Sudeep, Pallikkara K.; Kamat, Prashant V.; Noll, Bruce C.; Smith, Bradley D.","Singlet oxygen generation using iodinated squaraine and squaraine-rotaxane dyes.","New journal of chemistry = Nouveau journal de chimie","2007","31","5","677","683","10.1039/b616224j","","x-ray","0.71073","MoKα","","0.0322","0.0213","","","0.0467","0.0512","","","","","","1.038","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052134","25.43","0.004","11.8649","0.0017","16.688","0.002","90","","90","","90","","5035.2","1.2","293","2","293","2","","","","","","","","5","P m c 21","P 2c -2","26","","","","- C40 H63 Cu2 N10 O16.5 -","- C40 H60 Cu2 N10 O16.5 -","- C160 H240 Cu8 N40 O66 -","4","1","","Boiocchi, Massimo; Bonizzoni, Marco; Moletti, Alberto; Pasini, Dario; Taglietti, Angelo","Linear recognition of dicarboxylates by ditopic macrocyclic complexes","New Journal of Chemistry","2007","31","3","352","","10.1039/b616492g","","","0.71073","MoKα","","0.0976","0.0574","","","0.1447","0.1708","","","","","","1.011","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052135","16.0948","0.0001","26.2675","0.0001","19.298","0.0001","90","","90","","90","","8158.62","0.07","173","1","173","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C42 H56 N4 O2 S4 -","- C42 H56 N4 O2 S4 -","- C336 H448 N32 O16 S32 -","8","1","","Martin Valik; Vladimir Král; Eberhardt Herdtweck; Franz P. Schmidtchen","Sulfoniumcalixpyrrole: the decoration of a calix[4]pyrrole host with positive charges boosts affinity and selectivity of anion binding in DMSO solvent","New Journal of Chemistry","2007","31","5","703","","10.1039/b617465e","","","0.71073","MoKα","","0.0432","0.0354","","","0.0859","0.0908","","","","","","1.016","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052136","9.014","0.0008","14.873","0.002","16.749","0.002","77.96","0.01","83.05","0.01","77.57","0.01","2137.8","0.4","293","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C52 H56 N2 O2 -","- C52 H56 N2 O2 -","- C104 H112 N4 O4 -","2","1","","Stéphanie Leroy-Lhez; Magali Allain; Jean Oberlé; Frédéric Fages","Synthesis and zinc(ii) complexation modulated fluorescence emission properties of two pyrene-oligo(phenylene vinylene)-2,2?-bipyridine conjugated molecular rods","New Journal of Chemistry","2007","31","6","1013","","10.1039/b617497c","","x-ray","0.71073","MoKα","","","0.0471","","","","0.1413","","","","","","0.794","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052137","37.1517","0.0005","37.1517","0.0005","19.4231","0.0003","90","","90","","120","","23217","0.6","150","2","150","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C54 H58 Br2 N2 O4 -","- C54 H58 Br2 N2 O4 -","- C972 H1044 Br36 N36 O72 -","18","1","","van de Coevering, Rob; Bruijnincx, Pieter C. A.; Lutz, Martin; Spek, Anthony L.; van Koten, Gerard; Klein Gebbink, Robertus J. M.","Ionic core‒shell dendrimers with a polycationic core: structural aspects and host‒guest binding properties","New Journal of Chemistry","2007","31","7","1337","","10.1039/b617669k","","","0.71073","MoKα","","0.0758","0.0586","","","0.1749","0.1881","","","","","","1.082","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052138","9.9322","0.0002","13.9718","0.0002","19.304","0.0004","100.327","0.001","92.3451","0.0008","103.829","0.0009","2549.18","0.08","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C59 H61 N4 O5 S -","- C59 H61 N4 O5 S -","- C118 H122 N8 O10 S2 -","2","1","","van de Coevering, Rob; Bruijnincx, Pieter C. A.; Lutz, Martin; Spek, Anthony L.; van Koten, Gerard; Klein Gebbink, Robertus J. M.","Ionic core‒shell dendrimers with a polycationic core: structural aspects and host‒guest binding properties","New Journal of Chemistry","2007","31","7","1337","","10.1039/b617669k","","","0.71073","MoKα","","0.0604","0.0433","","","0.1055","0.1142","","","","","","1.026","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052139","8.907","0.0009","5.6894","0.0008","13.0599","0.0013","90","","90.588","0.012","90","","661.78","0.13","180","","180","","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","","","","- C8 H8 N2 -","- C8 H8 N2 -","- C32 H32 N8 -","4","1","","Johannes Teichert; Pascal Oulié; Kane Jacob; Laure Vendier; Michel Etienne; Rosa M. Claramunt; Concepción López; Carlos Pérez Medina; Ibon Alkorta; José Elguero","The structure of fluorinated indazoles: the effect of the replacement of a H by a F atom on the supramolecular structure of NH-indazoles","New Journal of Chemistry","2007","31","6","936","","10.1039/b617988f","","","0.71073","MoKα","","0.042","0.0368","","","0.091","0.0943","","","","","","1.063","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052140","12.5397","0.0018","12.5397","0.0018","4.3463","0.0009","90","","90","","120","","591.87","0.17","180","","180","","","","","","","","synthesis as described","4","P 32","P 32","145","","","","- C8 H5 F3 N2 -","- C8 H5 F3 N2 -","- C24 H15 F9 N6 -","3","1","","Johannes Teichert; Pascal Oulié; Kane Jacob; Laure Vendier; Michel Etienne; Rosa M. Claramunt; Concepción López; Carlos Pérez Medina; Ibon Alkorta; José Elguero","The structure of fluorinated indazoles: the effect of the replacement of a H by a F atom on the supramolecular structure of NH-indazoles","New Journal of Chemistry","2007","31","6","936","","10.1039/b617988f","","","0.71073","MoKα","","0.1277","0.0885","","","0.1489","0.1687","","","","","","1.048","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052141","12.5382","0.0018","12.5382","0.0018","4.9499","0.001","90","","90","","120","","673.9","0.19","180","","180","","","","","","","","synthesis as described","4","P 32","P 32","145","","","","- C8 H F7 N2 -","- C8 H F7 N2 -","- C24 H3 F21 N6 -","3","1","","Johannes Teichert; Pascal Oulié; Kane Jacob; Laure Vendier; Michel Etienne; Rosa M. Claramunt; Concepción López; Carlos Pérez Medina; Ibon Alkorta; José Elguero","The structure of fluorinated indazoles: the effect of the replacement of a H by a F atom on the supramolecular structure of NH-indazoles","New Journal of Chemistry","2007","31","6","936","","10.1039/b617988f","","","0.71073","MoKα","","0.1385","0.0418","","","0.0713","0.0934","","","","","","0.92","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052142","9.3629","0.0013","10.7928","0.0009","12.9505","0.0016","68.589","0.008","83.856","0.009","85.975","0.007","1210.7","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C44.75 H53 B2 Cu3 F8 N6 O6.75 -","- C44.75 H53 B2 Cu3 F8 N6 O6.75 -","- C44.75 H53 B2 Cu3 F8 N6 O6.75 -","1","0.5","","Koval, Iryna A.; Akhideno, Hilda; Tanase, Stefania; Belle, Catherine; Duboc, Carole; Saint-Aman, Eric; Gamez, Patrick; Tooke, Duncan M.; Spek, Anthony L.; Pierre, Jean-Louis; Reedijk, Jan","Changes in magnetic properties from solid state to solution in a trinuclear linear copper(ii) complex","New Journal of Chemistry","2007","31","4","512","","10.1039/b618154f","","","0.71073","MoKα","","0.0378","0.0312","","","0.0826","0.0864","","","","","","1.048","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052143","6.5739","0.0013","11.597","0.002","12.604","0.003","90","","90.13","0.03","90","","960.9","0.3","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","piperazinediium bis(4-aminobenzoate) dihydrate","piperazinediium bis(4-aminobenzoate) dihydrate","","- C18 H28 N4 O6 -","- C18 H28 N4 O6 -","- C36 H56 N8 O12 -","2","0.5","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","","MoKα","","0.042","0.0373","","","0.1039","0.1073","","","","","","1.005","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052144","19.0506","0.0013","12.12","0.0009","14.4397","0.001","90","","107.72","0.001","90","","3175.8","0.4","90","2","90","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","meso-(5S,12S)-5,7,7,12,14,14-hexamethyl-4,11-diaza-1,8- diazoniacyclotetradecane bis(4-aminobenzoate) hydrate","meso-(5S,12S)-5,7,7,12,14,14-hexamethyl-4,11-diaza-1,8-diazoniacyclotetradecane bis(4-aminobenzoate) hydrate","","- C30 H52 N6 O5 -","- C30 H52 N6 O5 -","- C120 H208 N24 O20 -","4","0.5","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","0.71073","MoKα","","0.0619","0.0484","","","0.1211","0.1283","","","","","","1.006","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052145","9.6004","0.0019","11.35","0.002","12.088","0.002","90","","111.91","0.03","90","","1222","0.5","90","2","90","2","","","","","","","","4","P 1 21 1","P 2yb","4","4,10-diaza-1,7-diazoniacyclododecane bis(4-aminobenzoate) dihydrate","4,10-diaza-1,7-diazoniacyclododecane bis(4-aminobenzoate) dihydrate","","- C22 H38 N6 O6 -","- C22 H38 N6 O6 -","- C44 H76 N12 O12 -","2","1","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","","MoKα","","0.04","0.0366","","","0.0881","0.0906","","","","","","1.009","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052146","10.9044","0.0014","9.9475","0.0013","12.1429","0.0015","90","","114.267","0.002","90","","1200.8","0.3","90","2","90","2","","","","","","","","4","P 1 c 1","P -2yc","7","1,7-dioxa-4,10-diazoniacyclododecane bis(4-aminobenzoate) dihydrate","1,7-dioxa-4,10-diazoniacyclododecane bis(4-aminobenzoate) dihydrate","","- C22 H36 N4 O8 -","- C22 H36 N4 O8 -","- C44 H72 N8 O16 -","2","1","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","","MoKα","","0.0381","0.0349","","","0.08","0.0825","","","","","","1.004","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052147","24.784","0.004","9.6757","0.0017","10.0867","0.0018","90","","90","","90","","2418.8","0.7","90","2","90","2","","","","","","","","4","P c a 21","P 2c -2ac","29","1,4,7,10,13-pentaoxa-16-azoniacyclooctadecane 4-aminobenzoate trihydrate","1,4,7,10,13-pentaoxa-16-azoniacyclooctadecane 4-aminobenzoate trihydrate","","- C19 H38 N2 O10 -","- C19 H38 N2 O10 -","- C76 H152 N8 O40 -","4","1","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","","MoKα","","0.0575","0.0424","","","0.0848","0.0913","","","","","","0.996","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052148","14.2714","0.0009","12.8482","0.001","39.425","0.003","90","","104.958","0.007","90","","6984.1","0.9","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H12 Cl4 Fe O2 S16 -","- C22 H12 Cl4 Fe O2 S16 -","- C176 H96 Cl32 Fe8 O16 S128 -","8","2","","Jean-Philippe Savy; Dominique de Caro; Christophe Faulmann; Lydie Valade; Manuel Almeida; Tadahiro Koike; Hideki Fujiwara; Toyonari Sugimoto; Jordi Fraxedas; Thierry Ondarçuhu; Claude Pasquier","Nanowires of molecule-based charge-transfer salts","New Journal of Chemistry","2007","31","4","519","","10.1039/b618241k","","","0.71073","MoKα","","0.1466","0.1038","","","0.2551","0.2693","","","","","","1.063","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052149","20.562","0.004","8.4423","0.0017","14.824","0.003","90","","106.93","0.03","90","","2461.8","0.9","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H16 N2 O Se -","- C12 H16 N2 O Se -","- C96 H128 N16 O8 Se8 -","8","1","","Bruce, Jocelyn C.; Revaprasadu, Neerish; Koch, Klaus R.","Cadmium(ii) complexes of N,N-diethyl-N′-benzoylthio(seleno)urea as single-source precursors for the preparation of CdS and CdSe nanoparticles","New Journal of Chemistry","2007","31","9","1647","","10.1039/b618254b","","","0.71073","MoKα","","0.0247","0.0228","","","0.0585","0.0592","","","","","","1.095","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052150","8.73","0.0013","13.374","0.002","17.707","0.003","90","","95.956","0.003","90","","2056.2","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1","","","- C19 H24 Cl2 Cu N4 O -","- C19 H24 Cl2 Cu N4 O -","- C76 H96 Cl8 Cu4 N16 O4 -","4","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.072","0.0521","","","0.1197","0.1284","","","","","","1.027","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052151","8.59","0.002","12.854","0.003","18.163","0.004","90","","91.596","0.004","90","","2004.7","0.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3","","","- C18 H21 Cl2 Cu N5 -","- C18 H21 Cl2 Cu N5 -","- C72 H84 Cl8 Cu4 N20 -","4","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1973","0.1044","","","0.1959","0.231","","","","","","1.084","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052152","12.8579","0.0011","14.746","0.0013","13.8823","0.0012","90","","98.669","0.002","90","","2602","0.4","303","2","303","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","10","","","- C22 H32 Cl2 Cu N6 O2 -","- C22 H32 Cl2 Cu N6 O2 -","- C88 H128 Cl8 Cu4 N24 O8 -","4","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1436","0.0837","","","0.1932","0.2273","","","","","","1.015","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052153","8.598","0.003","13.177","0.004","18.105","0.006","90","","95.181","0.006","90","","2042.8","1.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3","","","- C34 H40 Cl8 Cu2 N8 -","- C34 H40 Cl8 Cu2 N8 -","- C68 H80 Cl16 Cu4 N16 -","2","0.5","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.12","0.062","","","0.1108","0.1307","","","","","","0.966","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052154","8.826","0.003","13.103","0.005","18.057","0.006","90","","95.838","0.007","90","","2077.4","1.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","4","","","- C40 H52 Cl4 Cu2 N8 O2 -","- C40 H52 Cl4 Cu2 N8 O2 -","- C80 H104 Cl8 Cu4 N16 O4 -","2","0.5","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1549","0.0908","","","0.1486","0.1706","","","","","","1.059","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052155","8.8822","0.0014","13.05","0.002","17.792","0.003","90","","95.486","0.003","90","","2052.9","0.6","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","5","","","- C36 H48 Cl4 Cu2 N8 O2 S2 -","- C36 H48 Cl4 Cu2 N8 O2 S2 -","- C72 H96 Cl8 Cu4 N16 O4 S4 -","2","0.5","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.0757","0.0516","","","0.1074","0.1161","","","","","","1.033","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052156","8.4038","0.0015","12.927","0.002","18.195","0.003","90","","91.267","0.003","90","","1976.1","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","6","","","- C36 H44 Cl4 Cu2 N8 O2 -","- C36 H44 Cl4 Cu2 N8 O2 -","- C72 H88 Cl8 Cu4 N16 O4 -","2","0.5","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1056","0.0721","","","0.1311","0.1414","","","","","","1.153","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7052157","15.7","0.013","21.205","0.018","8.132","0.007","90","","121.048","0.013","90","","2319","3","173","2","173","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","7","","","- C35 H39 Cl13 Cu2 N8 -","- C35 H39 Cl13 Cu2 N8 -","- C70 H78 Cl26 Cu4 N16 -","2","0.25","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1739","0.0824","","","0.1724","0.2169","","","","","","0.955","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052158","8.6006","0.0017","13.126","0.003","17.942","0.004","87.547","0.004","87.705","0.004","81.627","0.004","2000.9","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","8","","","- C38 H48 Cl4 Cu2 N8 O3 -","- C38 H48 Cl4 Cu2 N8 O3 -","- C76 H96 Cl8 Cu4 N16 O6 -","2","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1327","0.0879","","","0.1568","0.1733","","","","","","1.116","","","","has coordinates","212110","2020-10-21","18:00:00",""
"7052159","8.539","0.005","10.673","0.006","13.386","0.007","104.272","0.01","91.858","0.01","112.793","0.009","1078.7","1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","9","","","- C18 H22 Cl4 Cu N4 -","- C18 H22 Cl4 Cu N4 -","- C36 H44 Cl8 Cu2 N8 -","2","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1259","0.0731","","","0.142","0.1655","","","","","","0.959","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052160","8.5803","0.0012","11.9991","0.0015","12.9458","0.0018","90","","92.406","0.017","90","","1331.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H13 Ni S4 -","- C11 H13 Ni S4 -","- C44 H52 Ni4 S16 -","4","1","","Mitsushiro Nomura; Marc Fourmigué","The contrasted structural and magnetic behaviour of two single-component paramagnetic dithiolene complexes","New Journal of Chemistry","2007","31","4","528","","10.1039/b700278e","","","0.71073","MoKα","","0.1075","0.0454","","","0.0744","0.089","","","","","","0.842","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052161","8.769","0.001","9.318","0.0012","10.3604","0.0015","87.844","0.016","83.577","0.015","62.422","0.013","745.55","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H13 Ni S4 -","- C15 H13 Ni S4 -","- C30 H26 Ni2 S8 -","2","1","","Mitsushiro Nomura; Marc Fourmigué","The contrasted structural and magnetic behaviour of two single-component paramagnetic dithiolene complexes","New Journal of Chemistry","2007","31","4","528","","10.1039/b700278e","","","0.71073","MoKα","","0.1208","0.0752","","","0.2006","0.2299","","","","","","0.98","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052162","14.1796","0.0013","14.1796","0.0013","25.007","0.002","90","","90","","120","","4354.3","0.7","293","2","293","2","","","","","","","","6","P 31 2 1","P 31 2""","152","bis(mu2-R,R-N,N'-(2-methyl-8-methoxyquinoline)-1,2-trans-cyclohexanedi-imine) -di-copper(i) diperchlorate","","","- C56 H56 Cl2 Cu2 N8 O12 -","- C56 H56 Cl2 Cu2 N8 O12 -","- C168 H168 Cl6 Cu6 N24 O36 -","3","0.5","","Pallavicini, Piersandro; Boiocchi, Massimo; Dacarro, Giacomo; Mangano, Carlo","Enhanced kinetic inertness in the electrochemical interconversion of Cu(i) double helical to Cu(ii) monomeric complexes","New Journal of Chemistry","2007","31","6","927","","10.1039/b700488e","","","0.71073","MoKα","","0.1557","0.089","","","0.2429","0.2853","","","","","","0.974","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052163","13.8593","0.0016","12.171","0.0019","20.914","0.002","90","","90","","90","","3527.8","0.8","293","2","293","2","","","","","","","","6","I 2 2 2","I 2 2","23","bis(mu2-R,R-N,N'-(2-methyl-8-buthoxyquinoline)-1,2-trans-cyclohexanedi-imine) -di-copper(i) diperchlorate","","","- C68 H80 Cl2 Cu2 N8 O12 -","- C68 H80 Cl2 Cu2 N8 O12 -","- C136 H160 Cl4 Cu4 N16 O24 -","2","0.25","","Pallavicini, Piersandro; Boiocchi, Massimo; Dacarro, Giacomo; Mangano, Carlo","Enhanced kinetic inertness in the electrochemical interconversion of Cu(i) double helical to Cu(ii) monomeric complexes","New Journal of Chemistry","2007","31","6","927","","10.1039/b700488e","","","0.71073","MoKα","","0.1482","0.0638","","","0.1369","0.1776","","","","","","0.992","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052164","13.409","0.003","14.202","0.003","15.345","0.003","109.09","0.03","99.73","0.03","99.82","0.03","2640.6","1.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C61 H60 N4 O5 Zn2 -","- C61 H60 N4 O5 Zn2 -","- C122 H120 N8 O10 Zn4 -","2","1","","Dalla Cort, Antonella; Mandolini, Luigi; Pasquini, Chiara; Rissanen, Kari; Russo, Luca; Schiaffino, Luca","Zinc‒salophen complexes as selective receptors for tertiary amines","New Journal of Chemistry","2007","31","9","1633","","10.1039/b700723j","","","0.71073","MoKα","","0.127","0.0651","","","0.1263","0.1608","","","","","","1.032","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052165","21.55","0.004","11.749","0.002","30.5348","0.0006","90","","109.83","0.03","90","","7273","2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37.78 H41.78 Cl2.34 N3 O2 Zn -","- C37.7805 H41 Cl2.3415 N3 O2 Zn -","- C302.244 H328 Cl18.732 N24 O16 Zn8 -","8","2","","Dalla Cort, Antonella; Mandolini, Luigi; Pasquini, Chiara; Rissanen, Kari; Russo, Luca; Schiaffino, Luca","Zinc‒salophen complexes as selective receptors for tertiary amines","New Journal of Chemistry","2007","31","9","1633","","10.1039/b700723j","","","0.71073","MoKα","","0.2408","0.1953","","","0.4063","0.4311","","","","","","1.124","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052166","23.3924","0.0017","9.5829","0.0007","19.3455","0.0014","90","","126.649","0.001","90","","3479.3","0.4","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C26 H16 O2 -","- C26 H16 O2 -","- C208 H128 O16 -","8","1","","Gautrot, Julien E.; Hodge, Philip; Cupertino, Domenico; Helliwell, Madeleine","2,6-Diaryl-9,10-anthraquinones as models for electron-accepting polymers","New Journal of Chemistry","2007","31","9","1585","","10.1039/b701257h","","","0.71073","MoKα","","0.0439","0.0356","","","0.0917","0.0944","","","","","","1.024","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052167","5.686","0.0015","10.21","0.003","14.072","0.004","97.506","0.004","92.789","0.004","90.58","0.004","808.9","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H12 O2 S2 -","- C22 H12 O2 S2 -","- C44 H24 O4 S4 -","2","1","","Gautrot, Julien E.; Hodge, Philip; Cupertino, Domenico; Helliwell, Madeleine","2,6-Diaryl-9,10-anthraquinones as models for electron-accepting polymers","New Journal of Chemistry","2007","31","9","1585","","10.1039/b701257h","","","0.71073","MoKα","","0.0605","0.0428","","","0.0987","0.1085","","","","","","0.958","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052168","8.736","0.006","8.973","0.006","18.358","0.012","89.562","0.013","88.762","0.012","81.196","0.012","1421.7","1.7","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C72 H88 O2 -","- C72 H88 O2 -","- C72 H88 O2 -","1","0.5","","Gautrot, Julien E.; Hodge, Philip; Cupertino, Domenico; Helliwell, Madeleine","2,6-Diaryl-9,10-anthraquinones as models for electron-accepting polymers","New Journal of Chemistry","2007","31","9","1585","","10.1039/b701257h","","","0.71073","MoKα","","0.1054","0.0556","","","0.1114","0.1261","","","","","","0.879","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052169","9.563","","12.095","","13.129","","73.31","","69.31","","88.65","","1355.62","","293","2","293","2","","","","","","","","7","P -1","-P 1","2","((R/S)-EDT-TTF(SMe)-oxazoline)2(Mo6Cl14)","","","- C26 H26 Cl14 Mo6 N2 O2 S14 -","- C26 H26 Cl14 Mo6 N2 O2 S14 -","- C26 H26 Cl14 Mo6 N2 O2 S14 -","1","0.5","","Réthoré, Céline; Madalan, Augustin; Fourmigué, Marc; Canadell, Enric; Lopes, Elsa B.; Almeida, Manuel; Clérac, Rodolphe; Avarvari, Narcis","O⋯S vs. N⋯S intramolecular nonbonded interactions in neutral and radical cation salts of TTF-oxazoline derivatives: synthesis, theoretical investigations, crystalline structures, and physical properties","New Journal of Chemistry","2007","31","8","1468","","10.1039/b701617d","","","0.7107","MoKα","","0.162","0.06","","","0.0955","0.1181","","","","","","1.004","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052170","10.392","","13.868","","18.026","","91.19","","102.84","","107.28","","2408.03","","293","2","293","2","","","","","","","","7","P -1","-P 1","2","((R/S)-EDT-TTF(SMe)-oxazoline)4(Mo6Cl14)","","","- C52 H52 Cl14 Mo6 N4 O4 S28 -","- C52 H52 Cl14 Mo6 N4 O4 S28 -","- C52 H52 Cl14 Mo6 N4 O4 S28 -","1","0.5","","Réthoré, Céline; Madalan, Augustin; Fourmigué, Marc; Canadell, Enric; Lopes, Elsa B.; Almeida, Manuel; Clérac, Rodolphe; Avarvari, Narcis","O⋯S vs. N⋯S intramolecular nonbonded interactions in neutral and radical cation salts of TTF-oxazoline derivatives: synthesis, theoretical investigations, crystalline structures, and physical properties","New Journal of Chemistry","2007","31","8","1468","","10.1039/b701617d","","","0.71073","MoKα","","0.1425","0.0528","","","0.1095","0.1354","","","","","","1.012","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052171","10.3656","0.0004","14.7041","0.0006","11.0971","0.0004","90","","111.493","0.002","90","","1573.77","0.11","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H15 Ag Cl N6 O6 -","- C10 H13 Ag Cl N6 O6 -","- C40 H52 Ag4 Cl4 N24 O24 -","4","1","","Fabrice Pointillart; Cyrille Train; Patrick Herson; Jérôme Marrot; Michel Verdaguer","Verdazyl-based extended structures: synthesis, structures and magnetic properties of silver(i) one dimensional compounds","New Journal of Chemistry","2007","31","6","1001","","10.1039/b701686g","","","0.71073","MoKα","","0.0902","0.0523","","","0.131","0.1469","","","","","","1.04","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052172","12.2251","0.0007","15.406","0.009","19.7291","0.001","90","","90","","90","","3716","2","250","","250","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H19 Ag Cl N7 O5 -","- C12 H19 Ag Cl N7 O5 -","- C96 H152 Ag8 Cl8 N56 O40 -","8","1","","Fabrice Pointillart; Cyrille Train; Patrick Herson; Jérôme Marrot; Michel Verdaguer","Verdazyl-based extended structures: synthesis, structures and magnetic properties of silver(i) one dimensional compounds","New Journal of Chemistry","2007","31","6","1001","","10.1039/b701686g","","","0.71073","MoKα","","0.1999","0.1142","","0.1415","0.1095","0.1095","","","","","","1.0707","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052173","7.2707","0.0006","12.3313","0.001","28.699","0.002","90","","96.684","0.002","90","","2555.6","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H24 N2 Pt -","- C33 H24 N2 Pt -","- C132 H96 N8 Pt4 -","4","1","","Seneclauze, Julie Batcha; Retailleau, Pascal; Ziessel, Raymond","Design and preparation of neutral substituted fluorene- and carbazole-based platinum(ii)‒acetylide complexes","New Journal of Chemistry","2007","31","8","1412","","10.1039/b702374j","","","0.71073","MoKα","","0.0423","0.0399","","","0.1001","0.1008","","","","","","1.581","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052174","7.301","0.005","12.688","0.005","25.728","0.005","90","","90","","90","","2383.3","1.9","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H21 N3 Pt -","- C31 H21 N3 Pt -","- C124 H84 N12 Pt4 -","4","1","","Seneclauze, Julie Batcha; Retailleau, Pascal; Ziessel, Raymond","Design and preparation of neutral substituted fluorene- and carbazole-based platinum(ii)‒acetylide complexes","New Journal of Chemistry","2007","31","8","1412","","10.1039/b702374j","","","0.71069","MoKα","","0.0425","0.0307","","","0.0762","0.0901","","","","","","1.159","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052175","13.641","0.003","17.738","0.004","18.898","0.004","75.86","0.03","82.89","0.03","84.78","0.03","4391.2","1.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C78 H78 Cl4 N15 O28.5 S4 Zn2 -","- C78 H77 Cl4 N15 O28.5 S4 Zn2 -","- C156 H154 Cl8 N30 O57 S8 Zn4 -","2","1","","Baylies, Christian J.; Harding, Lindsay P.; Jeffery, John C.; Moon, Ryan; Rice, Craig R.; Riis-Johannessen, T.","Electrostatic control of the formation of heteroleptic transition metal helicates","New Journal of Chemistry","2007","31","8","1525","","10.1039/b702608k","","","0.71073","MoKα","","0.1106","0.056","","","0.1368","0.1612","","","","","","1.024","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052176","16.9511","0.0003","18.4571","0.0003","20.1644","0.0004","108.458","0.001","103.302","0.001","110.497","0.001","5176.27","0.18","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C79 H80.5 Ba2 Cl8 N15.5 O45 S4 Zn2 -","- C79 H78.5 Ba2 Cl8 N15.5 O45 S4 Zn2 -","- C158 H157 Ba4 Cl16 N31 O90 S8 Zn4 -","2","1","","Baylies, Christian J.; Harding, Lindsay P.; Jeffery, John C.; Moon, Ryan; Rice, Craig R.; Riis-Johannessen, T.","Electrostatic control of the formation of heteroleptic transition metal helicates","New Journal of Chemistry","2007","31","8","1525","","10.1039/b702608k","","x-ray","1.54178","CuKα","","0.0771","0.0525","","","0.1281","0.1419","","","","","","0.996","","","","has coordinates","288091","2023-12-06","15:51:23",""
"7052177","6.35","0.0013","10.747","0.002","13.239","0.003","90","","92.69","0.03","90","","902.5","0.3","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C16 H33 Al N2 O -","- C16 H33 Al N2 O -","- C32 H66 Al2 N4 O2 -","2","0.5","","Jones, Cameron; Rose, Richard P.","Synthesis and characterisation of tetramethylpiperidinyloxide (TEMPO) complexes of group 13 metal hydrides","New Journal of Chemistry","2007","31","8","1484","","10.1039/b702641b","","","0.71073","MoKα","","0.1041","0.0679","","","0.1507","0.1679","","","","","","1.072","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052178","6.35","0.0013","10.729","0.002","13.273","0.003","90","","92.61","0.03","90","","903.3","0.3","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C16 H33 Ga N2 O -","- C16 H33 Ga N2 O -","- C32 H66 Ga2 N4 O2 -","2","0.5","","Jones, Cameron; Rose, Richard P.","Synthesis and characterisation of tetramethylpiperidinyloxide (TEMPO) complexes of group 13 metal hydrides","New Journal of Chemistry","2007","31","8","1484","","10.1039/b702641b","","","0.71073","MoKα","","0.0962","0.0897","","","0.2239","0.2302","","","","","","1.134","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052179","12.707","0.003","11.963","0.002","17.66","0.004","90","","95.14","0.03","90","","2673.8","1","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H50 Al N3 O2 -","- C25 H50 Al N3 O2 -","- C100 H200 Al4 N12 O8 -","4","1","","Jones, Cameron; Rose, Richard P.","Synthesis and characterisation of tetramethylpiperidinyloxide (TEMPO) complexes of group 13 metal hydrides","New Journal of Chemistry","2007","31","8","1484","","10.1039/b702641b","","","0.71073","MoKα","","0.097","0.0599","","","0.1197","0.1356","","","","","","1.016","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052180","12.081","0.001","17.513","0.001","12.328","0.001","90","","118.022","0.001","90","","2302.5","0.3","150","0.1","150","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H29 P Si2 -","- C23 H29 P Si2 -","- C92 H116 P4 Si8 -","4","1","","Moores, Audrey; Cantat, Thibault; Ricard, Louis; Mézailles, Nicolas; Le Floch, Pascal","Experimental and theoretical study of phosphinine sulfides","New Journal of Chemistry","2007","31","8","1493","","10.1039/b702851b","","","0.71069","MoKα","","0.0573","0.041","","","0.1117","0.1197","","","","","","1.076","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052181","6.24","0.001","12.986","0.001","27.663","0.001","90","","90","","90","","2241.6","0.4","150","0.1","150","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H21 P S -","- C29 H21 P S -","- C116 H84 P4 S4 -","4","1","","Moores, Audrey; Cantat, Thibault; Ricard, Louis; Mézailles, Nicolas; Le Floch, Pascal","Experimental and theoretical study of phosphinine sulfides","New Journal of Chemistry","2007","31","8","1493","","10.1039/b702851b","","","0.71069","MoKα","","0.0511","0.0384","","","0.0933","0.099","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052182","17.932","0.001","12.292","0.001","20.981","0.001","90","","90","","90","","4624.6","0.5","150","0.1","150","0.1","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C23 H29 P S Si2 -","- C23 H29 P S Si2 -","- C184 H232 P8 S8 Si16 -","8","1","","Moores, Audrey; Cantat, Thibault; Ricard, Louis; Mézailles, Nicolas; Le Floch, Pascal","Experimental and theoretical study of phosphinine sulfides","New Journal of Chemistry","2007","31","8","1493","","10.1039/b702851b","","","0.71069","MoKα","","0.043","0.0332","","","0.094","0.0998","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052183","9.273","0.002","9.672","0.002","21.274","0.004","97.75","0.03","91.62","0.03","117.78","0.03","1663.6","0.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","Bis(n-tert-butyl-N'(diisopropoxyphosphoryl)-thiocaramido- N',S)nickel(ii)","Bis[n-tert-butyl-N'(diisopropoxyphosphoryl)- thiocaramido-N',S]nickel(II)","","- C22 H48 N4 Ni O6 P2 S2 -","- C22 H48 N4 Ni O6 P2 S2 -","- C44 H96 N8 Ni2 O12 P4 S4 -","2","1","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.0823","0.0483","","","0.1114","0.1233","","","","","","1.012","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052184","12.194","0.002","8.439","0.002","16.951","0.003","90","","91.55","0.03","90","","1743.7","0.6","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Bis(N-(diisopropoxyphosphoryl)-N'-(p-metoxyphenyl) thiocarbamido-N,S)nickel(ii)","Bis[N-(diisopropoxyphosphoryl)-N'-(p-metoxyphenyl) thiocarbamido-N,S]nickel(II)","","- C14 H44 N4 Ni O8 P2 S2 -","- C28 H44 N4 Ni O8 P2 S2 -","- C56 H88 N8 Ni2 O16 P4 S4 -","2","0.5","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.1451","0.061","","","0.0996","0.1148","","","","","","0.924","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052185","10.403","0.002","8.304","0.002","20.958","0.006","90","","105.78","0.03","90","","1742.3","0.8","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","Bis(N-(p-bromophenyl)-N'-(diisopropoxyphosphoryl) thiocarbamido-N',S)nickel(ii)","Bis[N-(p-bromophenyl)-N'-(diisopropoxyphosphoryl) thiocarbamido-N',S]nickel(II)","","- C26 H38 Br2 N4 Ni O6 P2 S2 -","- C26 H38 Br2 N4 Ni O6 P2 S2 -","- C52 H76 Br4 N8 Ni2 O12 P4 S4 -","2","0.5","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.126","0.0542","","","0.0894","0.1083","","","","","","0.997","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052186","18.981","0.004","9.764","0.002","16.498","0.003","90","","97.89","0.03","90","","3028.6","1.1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Bis(N-(diisopropoxyphosphoryl)-N'-isopropylthiocarbamido- N,S)palladium(ii)","Bis[N-(diisopropoxyphosphoryl)-N'- isopropylthiocarbamido-N,S]palladium(II)","","- C20 H44 N4 O6 P2 Pd S2 -","- C20 H44 N4 O6 P2 Pd S2 -","- C80 H176 N16 O24 P8 Pd4 S8 -","4","1","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.1088","0.0524","","","0.0693","0.0777","","","","","","1.006","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052187","18.747","0.004","17.566","0.004","19.95","0.004","90","","100.046","0.005","90","","6469","2","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Bis(morpholine-N-yl-N`- (diisopropoxyphosphinyl)thiocarboxamide-O,S)palladium(ii)","Bis[morpholine-N-yl-N`- (diisopropoxyphosphinyl)thiocarboxamide-O,S]palladium(II)","","- C22 H44 N4 O8 P2 Pd S2 -","- C22 H44 N4 O8 P2 Pd S2 -","- C176 H352 N32 O64 P16 Pd8 S16 -","8","2","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.0959","0.0555","","","0.0892","0.1","","","","","","1.036","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052188","9.6504","0.0007","11.4015","0.0008","9.651","0.0007","90","","100.871","0.001","90","","1042.83","0.13","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H8 N2 S2 -","- C10 H8 N2 S2 -","- C40 H32 N8 S8 -","4","1","","Ghazzali, Mohamed; Langer, Vratislav; Lopes, Cesar; Eriksson, Anders; Öhrström, Lars","Syntheses, crystal structures, optical limiting properties, and DFT calculations of three thiophene-2-aldazine Schiff base derivatives","New Journal of Chemistry","2007","31","10","1777","","10.1039/b704009a","","","0.71073","MoKα","","0.0418","0.0346","","","0.0912","0.0973","","","","","","0.994","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052189","4.5456","0.0002","26.9807","0.0013","10.0137","0.0005","90","","97.484","0.001","90","","1217.65","0.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H6 Br2 N2 S2 -","- C10 H6 Br2 N2 S2 -","- C40 H24 Br8 N8 S8 -","4","1","","Ghazzali, Mohamed; Langer, Vratislav; Lopes, Cesar; Eriksson, Anders; Öhrström, Lars","Syntheses, crystal structures, optical limiting properties, and DFT calculations of three thiophene-2-aldazine Schiff base derivatives","New Journal of Chemistry","2007","31","10","1777","","10.1039/b704009a","","","0.71073","MoKα","","0.0416","0.0304","","","0.073","0.0779","","","","","","0.988","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052190","10.6766","0.0006","11.5253","0.0006","10.2713","0.0006","90","","96.797","0.001","90","","1255.01","0.12","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H6 Br2 N2 S2 -","- C10 H6 Br2 N2 S2 -","- C40 H24 Br8 N8 S8 -","4","1","","Ghazzali, Mohamed; Langer, Vratislav; Lopes, Cesar; Eriksson, Anders; Öhrström, Lars","Syntheses, crystal structures, optical limiting properties, and DFT calculations of three thiophene-2-aldazine Schiff base derivatives","New Journal of Chemistry","2007","31","10","1777","","10.1039/b704009a","","","0.71073","MoKα","","0.0854","0.049","","","0.1112","0.1259","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052191","14.294","0.001","14.848","0.001","16.671","0.007","65.42","0.02","86.24","0.02","84.8","0.01","3202.8","1.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H81 Cl2 O20 V5 -","- C45 H81 Cl2 O20 V5 -","- C90 H162 Cl4 O40 V10 -","2","1","","Sañudo, E. Carolina; Ribas, Joan; Winpenny, Richard E. P.","Solid state synthesis of [V5O2(Me3CCO2)9Cl2]","New Journal of Chemistry","2007","31","8","1421","","10.1039/b704191h","","","0.6933","synchrotron","","0.075","0.0478","","","0.1195","0.1349","","","","","","1.041","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052192","13.184","0.003","5.7697","0.001","18.696","0.004","90","","100.833","0.016","90","","1396.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 N2 O2 S -","- C14 H16 N2 O2 S -","- C56 H64 N8 O8 S4 -","4","1","","Sanmartín, Jesús; Novio, Fernando; García-Deibe, Ana M.; Fondo, Matilde; Bermejo, Manuel R.","Trimorphism of an asymmetric disulfonamide Schiff base","New Journal of Chemistry","2007","31","9","1605","","10.1039/b704195k","","","1.5418","CuKα","","0.1395","0.0632","","","0.1731","0.2117","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052193","9.0457","0.0015","18.882","0.003","16.057","0.003","90","","105.144","0.003","90","","2647.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H27 N3 O4 S2 -","- C28 H27 N3 O4 S2 -","- C112 H108 N12 O16 S8 -","4","1","","Sanmartín, Jesús; Novio, Fernando; García-Deibe, Ana M.; Fondo, Matilde; Bermejo, Manuel R.","Trimorphism of an asymmetric disulfonamide Schiff base","New Journal of Chemistry","2007","31","9","1605","","10.1039/b704195k","","","0.71073","MoKα","","0.0832","0.0457","","","0.1168","0.1286","","","","","","1.033","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052194","8.797","0.005","10.788","0.004","14.713","0.008","100.53","0.05","101.7","0.05","100.23","0.06","1310.4","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H27 N3 O4 S2 -","- C28 H27 N3 O4 S2 -","- C56 H54 N6 O8 S4 -","2","1","","Sanmartín, Jesús; Novio, Fernando; García-Deibe, Ana M.; Fondo, Matilde; Bermejo, Manuel R.","Trimorphism of an asymmetric disulfonamide Schiff base","New Journal of Chemistry","2007","31","9","1605","","10.1039/b704195k","","","1.5418","CuKα","","0.0636","0.0522","","","0.1465","0.1561","","","","","","1.046","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052195","10.2059","0.0006","10.7345","0.0005","12.8784","0.0005","97.962","0.004","95.36","0.005","108.697","0.005","1309.19","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H27 N3 O4 S2 -","- C28 H27 N3 O4 S2 -","- C56 H54 N6 O8 S4 -","2","1","","Sanmartín, Jesús; Novio, Fernando; García-Deibe, Ana M.; Fondo, Matilde; Bermejo, Manuel R.","Trimorphism of an asymmetric disulfonamide Schiff base","New Journal of Chemistry","2007","31","9","1605","","10.1039/b704195k","","","1.54184","CuKα","","0.0581","0.0555","","","0.1596","0.1627","","","","","","1.059","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052196","8.25","0.001","8.25","0.001","7.15","0.001","90","","90","","120","","421.45","0.09","293","2","293","2","","","","","","","","4","P 3 c 1","P 3 -2""c","158","","","","- C6 H11 N3 O3 -","- C6 H11.02 N3.01 O3 -","- C12 H22.04 N6.02 O6 -","2","0.333333","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","0.71073","MoKα","","0.0503","0.0355","","","0.0926","0.1007","","","","","","1.103","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052197","8.42266","0.00014","6.97215","0.000061","8.06305","0.00013","90","","98.6845","0.0014","90","","468.066","0.012","298","","298","","","","","","","","","4","P 1 21 1","P 2yb","4","","1,3-dimethylbarbiturate methylammonium","","- C7 H13 N3 O3 -","- C7 H13 N3 O3 -","- C14 H26 N6 O6 -","2","1","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","1.5406","CuKα","","","","","","","","","","1.23","","","","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052198","8.5","0.002","10.56","0.003","11.412","0.002","65.843","0.017","88.118","0.018","71.467","0.019","880.6","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H23 N5 O9 -","- C13 H23 N5 O9 -","- C26 H46 N10 O18 -","2","1","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","0.71073","MoKα","","0.1382","0.0468","","","0.117","0.161","","","","","","0.918","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052199","11.29","0.005","19.761","0.006","8.3","0.003","90","","95.17","","90","","1844.2","1.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H24 N6 O6 -","- C14 H24 N6 O6 -","- C56 H96 N24 O24 -","4","0.5","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","0.71073","MoKα","","0.1389","0.0583","","","0.1588","0.2106","","","","","","0.957","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052200","8.495","0.001","12.416","0.002","12.697","0.002","110.082","0.002","95.887","0.002","95.181","0.002","1239.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H31 N7 O9 -","- C20 H31 N7 O9 -","- C40 H62 N14 O18 -","2","1","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","0.71073","MoKα","","0.0643","0.0457","","","0.1309","0.1453","","","","","","0.834","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052201","5.691","0.001","9.359","0.001","41.058","0.001","90","","90","","90","","2186.8","0.5","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H20 Br2 O6 -","- C23 H20 Br2 O6 -","- C92 H80 Br8 O24 -","4","1","","Albrecht, Markus; Schmid, Sören; Dehn, Sabrina; Wickleder, Claudia; Zhang, Shuang; Bassett, Andrew P.; Pikramenou, Zoe; Fröhlich, Roland","Diastereoselective formation of luminescent dinuclear lanthanide(iii) helicates with enantiomerically pure tartaric acid derived bis(β-diketonate) ligands","New Journal of Chemistry","2007","31","10","1755","","10.1039/b705090a","","","0.71073","MoKα","","0.0741","0.0424","","","0.0809","0.0913","","","","","","1.013","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052202","19.0372","0.0007","22.9422","0.0007","30.2456","0.0013","90","","90","","90","","13209.9","0.8","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C71 H101 N O9 -","- C71 H101 N O9 -","- C568 H808 N8 O72 -","8","1","","Marcos, Paula M.; Félix, Sandra; Ascenso, José R.; Segurado, Manuel A. P.; Thuéry, Pierre; Mellah, Besma; Michel, Sylvia; Hubscher-Bruder, Véronique; Arnaud-Neu, Françoise","Complexation and transport of transition and heavy metal cations by p-tert-butyldihomooxacalix[4]arene tetraketones and X-ray crystal structure of the tert-butyl ketone derivative","New Journal of Chemistry","2007","31","12","2111","","10.1039/b705879a","","","0.71073","MoKα","","0.1381","0.0776","","","0.196","0.2175","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052203","9.884","0.014","11.444","0.014","12.684","0.017","74.4","0.01","77.902","0.01","66.15","0.01","1256","3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H24 N6 -","- C28 H24 N6 -","- C56 H48 N12 -","2","1","","Drew, Michael G. B.; Parui, Debarati; De, Senjuti; Chowdhury, Shubhamoy; Datta, Dipankar","A monoaqua zinc complex. Unique acid dissociation behaviour","New Journal of Chemistry","2007","31","10","1763","","10.1039/b706230n","","","0.71073","MoKα","","0.1483","0.0695","","","0.1646","0.2038","","","","","","0.67","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052204","12.7999","0.0011","14.3093","0.0015","17.1281","0.0013","90","","103.118","0.007","90","","3055.3","0.5","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H27 F6 N6 O2 P Zn -","- C30 H27 F6 N6 O2 P Zn -","- C120 H108 F24 N24 O8 P4 Zn4 -","4","1","","Drew, Michael G. B.; Parui, Debarati; De, Senjuti; Chowdhury, Shubhamoy; Datta, Dipankar","A monoaqua zinc complex. Unique acid dissociation behaviour","New Journal of Chemistry","2007","31","10","1763","","10.1039/b706230n","","","0.71073","MoKα","","0.1559","0.0776","","","0.1984","0.212","","","","","","0.872","","","","has coordinates,has disorder","180076","2020-10-21","18:00:00",""
"7052205","10.263","0.011","15.745","0.017","21.37","0.02","90","","103.106","0.01","90","","3363","6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H28 Cl2 N6 O10 Zn -","- C28 H26 Cl2 N6 O9.99 Zn -","- C112 H104 Cl8 N24 O39.96 Zn4 -","4","1","","Drew, Michael G. B.; Parui, Debarati; De, Senjuti; Chowdhury, Shubhamoy; Datta, Dipankar","A monoaqua zinc complex. Unique acid dissociation behaviour","New Journal of Chemistry","2007","31","10","1763","","10.1039/b706230n","","","0.71073","MoKα","","0.1091","0.0875","","","0.1637","0.1719","","","","","","1.226","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052206","17.8554","0.0009","15.7085","0.0009","17.7912","0.0009","90","","96.224","0.003","90","","4960.7","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H50 Mn4 N4 O24 P2 -","- C38 H50 Mn4 N4 O24 P2 -","- C152 H200 Mn16 N16 O96 P8 -","4","0.5","","Wang, Mei; Ma, Chengbing; Yuan, Daqiang; Hu, Mingqiang; Chen, Changneng; Liu, Qiutian","Synthesis and characterization of a family of tetranuclear manganese(iii) phosphonate complexes","New Journal of Chemistry","2007","31","12","2103","","10.1039/b706514k","","","0.71073","MoKα","","","0.04","","","0.1101","0.1134","","","","","","1.004","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052207","10.08","0.003","11.084","0.003","11.559","0.003","64.798","0.005","81.789","0.007","82.715","0.006","1153.4","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H52 Mn4 N4 O23 P2 -","- C32 H50 Mn4 N4 O23 P2 -","- C32 H50 Mn4 N4 O23 P2 -","1","0.5","","Wang, Mei; Ma, Chengbing; Yuan, Daqiang; Hu, Mingqiang; Chen, Changneng; Liu, Qiutian","Synthesis and characterization of a family of tetranuclear manganese(iii) phosphonate complexes","New Journal of Chemistry","2007","31","12","2103","","10.1039/b706514k","","","0.71073","MoKα","","","0.0316","","","0.0855","0.0887","","","","","","0.997","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052208","11.4387","0.0014","11.485","0.0012","11.9747","0.0011","100.459","0.001","103.024","0.004","113.282","0.003","1342","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H54 Mn4 N4 O24 P2 -","- C38 H48 Mn4 N4 O24 P2 -","- C38 H48 Mn4 N4 O24 P2 -","1","0.5","","Wang, Mei; Ma, Chengbing; Yuan, Daqiang; Hu, Mingqiang; Chen, Changneng; Liu, Qiutian","Synthesis and characterization of a family of tetranuclear manganese(iii) phosphonate complexes","New Journal of Chemistry","2007","31","12","2103","","10.1039/b706514k","","","0.71073","MoKα","","","0.0558","","","0.1564","0.1726","","","","","","1.053","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052209","18.0431","0.0007","11.0649","0.0003","21.7461","0.0009","90","","91.002","0.002","90","","4340.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C86 H72 Mn4 N6 O24 P2 -","- C86 H66 Mn4 N6 O24 P2 -","- C172 H132 Mn8 N12 O48 P4 -","2","0.5","","Wang, Mei; Ma, Chengbing; Yuan, Daqiang; Hu, Mingqiang; Chen, Changneng; Liu, Qiutian","Synthesis and characterization of a family of tetranuclear manganese(iii) phosphonate complexes","New Journal of Chemistry","2007","31","12","2103","","10.1039/b706514k","","","0.71073","MoKα","","","0.0409","","","0.1143","0.1208","","","","","","1.005","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052210","27.766","0.0014","11.5247","0.0006","21.2342","0.001","90","","94.895","0.002","90","","6770.1","0.6","163.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H76 Na2 O50 S12 -","- C36 H18 Na2 O46.5 S12 -","- C144 H72 Na8 O186 S48 -","4","0.5","","Yamada, Manabu; Kondo, Yoshihiko; Akimoto, Kazuhiko; Kabuto, Chizuko; Hamada, Fumio","Supramolecular assembly based on p-sulfonatothiacalix[6]arene with sodium and water molecules","New Journal of Chemistry","2007","31","11","1874","","10.1039/b706891c","","","0.71069","MoKα","","","0.1034","","","","0.2714","","","","","","1.128","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052211","26.349","0.005","12.877","0.003","25.364","0.005","90","","111.33","0.05","90","","8016","4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C61 H79 Mn5 N15 Na2 O26 S4 -","- C61 H79 Mn5 N15 Na2 O26 S4 -","- C244 H316 Mn20 N60 Na8 O104 S16 -","4","1","","Beghidja, Chahrazed; Rogez, Guillaume; Welter, Richard","Synthesis, crystal structure and magnetic properties of a new mixed-valence [Mn4IIIMnII] pentanuclear complex","New Journal of Chemistry","2007","31","8","1403","","10.1039/b707170a","","","0.71069","MoKα","","0.153","0.0847","","","0.1264","0.1569","","","","","","1.114","","","","has coordinates,has disorder","180076","2020-10-21","18:00:00",""
"7052212","17.118","0.004","11.668","0.003","18.793","0.005","90","","99.925","0.006","90","","3697.4","1.6","298","2","298","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C36.5 H41 F6 Fe N2 Ni O2 P Ru -","- C33 H37 F6 Fe N2 Ni O2 P Ru -","- C132 H148 F24 Fe4 N8 Ni4 O8 P4 Ru4 -","4","1","","Fuentealba, Mauricio; Hamon, Jean-René; Carrillo, David; Manzur, Carolina","Trinuclear π-conjugated chromophores formed by a neutral ferrocenyl group and a cationic mixed ruthenium sandwich linked through an unsymmetrical Schiff-base complex spacer","New Journal of Chemistry","2007","31","10","1815","","10.1039/b707934f","","","0.71073","MoKα","","0.2755","0.0844","","","0.1926","0.2538","","","","","","0.801","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052213","11.0723","0.001","9.9509","0.0009","18.5611","0.0017","90","","106.637","0.001","90","","1959.4","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 Fe N2 Ni O2 -","- C23 H22 Fe N2 Ni O2 -","- C92 H88 Fe4 N8 Ni4 O8 -","4","1","","Fuentealba, Mauricio; Hamon, Jean-René; Carrillo, David; Manzur, Carolina","Trinuclear π-conjugated chromophores formed by a neutral ferrocenyl group and a cationic mixed ruthenium sandwich linked through an unsymmetrical Schiff-base complex spacer","New Journal of Chemistry","2007","31","10","1815","","10.1039/b707934f","","","0.71073","MoKα","","0.0573","0.0438","","","0.109","0.117","","","","","","1.043","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052214","7.4291","0.0004","9.8933","0.0006","11.8779","0.0007","73.116","0.003","78.757","0.003","86.088","0.004","819.28","0.08","100","2","100","2","","","","","","","synthesis as described","6","P -1","-P 1","2","Compound X","","","- C11 H11 Fe2 N O7 S2 -","- C11 H11 Fe2 N O7 S2 -","- C22 H22 Fe4 N2 O14 S4 -","2","1","","Capon, Jean-François; Ezzaher, Salah; Gloaguen, Frédéric; Pétillon, François Y.; Schollhammer, Philippe; Talarmin, Jean; Davin, Thomas J.; McGrady, John E.; Muir, Kenneth W.","Electrochemical and theoretical investigations of the reduction of [Fe2(CO)5L{µ-SCH2XCH2S}] complexes related to [FeFe] hydrogenase","New Journal of Chemistry","2007","31","12","2052","","10.1039/b709273c","","x-ray","0.71073","MoKα","","0.0386","0.0299","","","0.0747","0.0799","","","","","","1.091","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052215","44.988","0.018","9.206","0.004","16.552","0.006","90","","108.938","0.007","90","","6484","5","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C31 H45 Fe N O11 -","- C31 H45 Fe N O11 -","- C248 H360 Fe8 N8 O88 -","8","1","","McKeogh, Ian; Hill, Jonathan P.; Collins, Emily S.; McCabe, Thomas; Powell, Annie K.; Schmitt, Wolfgang","Self-assembly of FeIII complexes via hydrogen bonded water molecules into supramolecular coordination networks","New Journal of Chemistry","2007","31","11","1882","","10.1039/b711185a","","","0.71073","MoKα","","0.0518","0.0393","","","0.1042","0.1143","","","","","","1.097","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052216","9.25","0.002","12.011","0.003","14.326","0.004","90","","92.618","0.003","90","","1590","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H15.5 Cd1.5 N5 O5.75 -","- C11 H14 Cd1.5 N5 O5.75 -","- C44 H56 Cd6 N20 O23 -","4","1","","Yang, En-Cui; Zhao, Hong-Kun; Ding, Bin; Wang, Xiu-Guang; Zhao, Xiao-Jun","The first 2D trinuclear Cd(ii)-complex with adenine nucleobase: hydrothermal synthesis, crystal structure and fluorescent properties","New Journal of Chemistry","2007","31","11","1887","","10.1039/b712387f","","","0.71073","MoKα","","0.0511","0.0362","","","0.0836","0.0918","","","","","","1.034","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052217","21.66","0.004","4.7544","0.0009","9.9321","0.0019","90","","93.912","0.003","90","","1020.4","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-((1-pyrazolyl)methyl)benzamide","4-[(1-pyrazolyl)methyl]benzamide","","- C11 H11 N3 O -","- C11 H11 N3 O -","- C44 H44 N12 O4 -","4","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.1042","0.0522","","","0.1146","0.1342","","","","","","0.974","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052218","8.4005","0.0007","8.0671","0.0007","18.0477","0.0018","90","","102.621","0.006","90","","1193.5","0.19","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4-((3,5-dimethylpyrazol-1-yl)methyl)benzamide","4-[(3,5-dimethylpyrazol-1-yl)methyl]benzamide","","- C13 H15 N3 O -","- C13 H15 N3 O -","- C52 H60 N12 O4 -","4","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.0892","0.0491","","","0.1184","0.1309","","","","","","0.934","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052219","12.437","0.003","8.8195","0.0017","12.468","0.002","90","","114.488","0.006","90","","1244.6","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","BS-3-93-3G 3-((4-bromo-3,5-dimethylpyrazol-1- yl)methyl)benzamide, succinic acid","BS-3-93-3G 3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide, succinic acid","","- C13 H14 Br N3 O -","- C13 H14 Br N3 O -","- C52 H56 Br4 N12 O4 -","4","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.0319","0.0234","","","0.0588","0.0622","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052220","7.7873","0.0005","8.113","0.0006","8.84","0.0006","77.6614","0.0013","74.4604","0.0013","68.3976","0.0012","496.14","0.06","100","2","100","2","","","","","","","","4","P -1","-P 1","2","3-((1-pyrazolyl)methyl)benzamide","3-[(1-pyrazolyl)methyl]benzamide","","- C11 H11 N3 O -","- C11 H11 N3 O -","- C22 H22 N6 O2 -","2","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.0489","0.0449","","","0.1249","0.1292","","","","","","1.081","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052221","8.0162","0.0004","8.0603","0.0004","10.4542","0.0005","97.253","0.002","106.06","0.002","109.335","0.002","594.57","0.05","100","2","100","2","","","","","","","","4","P -1","-P 1","2","BS-3-92-4 3-((3,5-dimethylpyrazol-1-yl)methyl)benzamide","BS-3-92-4 3-[(3,5-dimethylpyrazol-1-yl)methyl]benzamide","","- C13 H15 N3 O -","- C13 H15 N3 O -","- C26 H30 N6 O2 -","2","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.0556","0.0434","","","0.1205","0.1299","","","","","","1.083","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052222","8.9062","0.0012","11.6933","0.0018","14.146","0.002","73.396","0.01","74.274","0.009","70.553","0.009","1305.8","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","BS-3-93-4f 3-((3-bromo-2,4-dimethylpyrazol-1- yl)methyl)benzamide","BS-3-93-4f 3-[(3-bromo-2,4-dimethylpyrazol-1-yl)methyl]benzamide","","- C13 H14 Br N3 O -","- C13 H14 Br N3 O -","- C52 H56 Br4 N12 O4 -","4","2","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.145","0.0704","","","0.1928","0.2376","","","","","","1.033","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7053692","7.4575","0.0012","11.6882","0.0012","12.8664","0.0015","114.651","0.01","94.767","0.011","101.729","0.01","980.1","0.2","150","","150","","","","","","","","see text","4","P -1","-P 1","2","","","","- C8 H11 N5 O3 -","- C8 H11 N5 O3 -","- C32 H44 N20 O12 -","4","2","","Corral, Eva; Kooijman, Huub; Spek, Anthony L.; Reedijk, Jan","Nucleic acids in two dimensions: layers of base pairs linked by carboxylate","New Journal of Chemistry","2007","31","1","21","","10.1039/b613845d","","x-ray","0.71073","MoKα","","0.0673","0.0515","","","0.1417","0.154","","","","","","1.085","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053693","9.7867","0.001","28.1721","0.0026","15.7764","0.0016","90","","94.616","0.004","90","","4335.6","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","cis- and trans-bis(benzoylacetonato)pyridinecopper(ii)","cis- and trans-bis(benzoylacetonato)pyridinecopper(II)","","- C25 H23 Cu N O4 -","- C25 H23 Cu N O4 -","- C200 H184 Cu8 N8 O32 -","8","2","","Lennartson, Anders; Håkansson, Mikael; Jagner, Susan","cis- and trans-Bis(benzoylacetonato)pyridinecopper(ii): co-crystallisation of isomers and reversible pyridine loss with retention of crystallinity","New Journal of Chemistry","2007","31","3","344","347","10.1039/b615579k","","","0.71073","MoKα","","0.0332","0.03","","","0.072","0.0739","","","","","","0.855","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053694","16.449","0.002","28.272","0.004","29.144","0.004","90","","90.614","0.003","90","","13553","3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C145 H147.5 N13.5 O26.5 Zn8 -","- C149.25 H135.5 N8.5 O26.5 Zn8 -","- C597 H542 N34 O106 Zn32 -","4","1","","Power, Nicholas P.; Dalgarno, Scott J.; Atwood, Jerry L.","Robust and stable pyrogallol[4]arene molecular capsules facilitated via an octanuclear zinc coordination belt","New Journal of Chemistry","2007","31","1","17","","10.1039/b615947h","","","0.71073","MoKα","","0.0932","0.0566","","","0.1555","0.1868","","","","","","1.02","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053695","9.2003","0.0004","16.578","0.0008","20.418","0.001","90","","101.307","0.001","90","","3053.8","0.2","150","1","150","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 F3 N2 O18 Re3 S4 -","- C18 F3 N2 O18 Re3 S4 -","- C72 F12 N8 O72 Re12 S16 -","4","1","","Tzeng, Biing-Chiau; Wu, Ya-Ling; Lee, Gene-Hsiang; Peng, Shie-Ming","A novel trinuclear Re(i) complex containing 1,3,4-thiadiazole-2,5-dithiolate: structural and spectroscopic properties","New Journal of Chemistry","2007","31","2","199","","10.1039/b616122g","","","0.71073","MoKα","","0.0509","0.0383","","","0.0692","0.0728","","","","","","1.053","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053696","9.1246","0.001","20.319","0.002","47.951","0.005","90","","90","","90","","8890.2","1.6","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H36 N8 O5.08 S2 -","- C27 H36 N8 O5.08333 S2 -","- C324 H432 N96 O61 S24 -","12","3","","Blondeau, Pascal; Benet-Buchholz, Jordi; de Mendoza, Javier","Enthalpy driven nitrate complexation by guanidinium-based macrocycles","New Journal of Chemistry","2007","31","5","736","","10.1039/b616409a","","","0.71073","MoKα","","0.105","0.0752","","","0.1644","0.1787","","","","","","1.091","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053697","10.857","0.0015","12.4706","0.0016","12.9263","0.0016","98.088","0.003","112.786","0.003","107.966","0.003","1465.8","0.3","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C28 H38 N8 O5 S2 -","- C28 H38 N8 O5 S2 -","- C56 H76 N16 O10 S4 -","2","2","","Blondeau, Pascal; Benet-Buchholz, Jordi; de Mendoza, Javier","Enthalpy driven nitrate complexation by guanidinium-based macrocycles","New Journal of Chemistry","2007","31","5","736","","10.1039/b616409a","","","0.71073","MoKα","","0.0863","0.0812","","","0.2163","0.2213","","","","","","1.026","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053698","12.8416","0.001","8.7033","0.0007","13.7476","0.0011","90","","96.649","0.002","90","","1526.2","0.2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C29 H40 N8 O5 S2 -","- C29 H40 N8 O5 S2 -","- C58 H80 N16 O10 S4 -","2","1","","Blondeau, Pascal; Benet-Buchholz, Jordi; de Mendoza, Javier","Enthalpy driven nitrate complexation by guanidinium-based macrocycles","New Journal of Chemistry","2007","31","5","736","","10.1039/b616409a","","","0.71073","MoKα","","0.0346","0.0329","","","0.0881","0.0897","","","","","","1.032","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053699","10.7122","0.0009","11.9131","0.001","12.4072","0.001","105.252","0.002","93.448","0.002","113.481","0.002","1376.5","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H46 Er2 N4 O12 -","- C66 H46 Er2 N4 O12 -","- C66 H46 Er2 N4 O12 -","1","0.5","","Song, Limei; Wang, Qi; Tang, Daihua; Liu, Xinhou; Zhen, Zhen","Crystal structure and near-infrared luminescence properties of novel binuclear erbium and erbium?ytterbium cocrystalline complexes","New Journal of Chemistry","2007","31","4","506","","10.1039/b616422f","","","0.71073","MoKα","","0.0281","0.0253","","","0.065","0.0666","","","","","","1.049","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053700","10.1714","0.0003","10.1756","0.0003","13.1069","0.0004","107.535","0.002","92.714","0.002","91.38","0.002","1291.03","0.07","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H37.8 N4 O1.9 -","- C29 H37.8 N4 O1.9 -","- C58 H75.6 N8 O3.8 -","2","1","","Dehaen, Wim; Gale, Philip A.; García-Garrido, Sergio E.; Kostermans, Maarten; Light, Mark E.","Anion recognition by N-confused calix[4]pyrrole-α-carbaldehyde and its Knoevenagel reaction derivatives","New Journal of Chemistry","2007","31","5","691","","10.1039/b616467f","","","0.71073","MoKα","","0.1112","0.0693","","","0.1779","0.2009","","","","","","0.967","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053701","19.7663","0.0015","11.8837","0.0008","15.7559","0.0014","90","","106.807","0.004","90","","3542.9","0.5","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C42 H41.5 N6.5 O -","- C42 H41.5 N6.5 O -","- C168 H166 N26 O4 -","4","1","","Dehaen, Wim; Gale, Philip A.; García-Garrido, Sergio E.; Kostermans, Maarten; Light, Mark E.","Anion recognition by N-confused calix[4]pyrrole-α-carbaldehyde and its Knoevenagel reaction derivatives","New Journal of Chemistry","2007","31","5","691","","10.1039/b616467f","","","0.71073","MoKα","","0.2209","0.0907","","","0.2159","0.2756","","","","","","1.011","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053702","10.146","0.0002","26.3142","0.0009","26.8959","0.0009","90","","98.04","0.002","90","","7110.2","0.4","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H48 N4 O5 S -","- C37 H48 N4 O5 S -","- C296 H384 N32 O40 S8 -","8","2","","Dehaen, Wim; Gale, Philip A.; García-Garrido, Sergio E.; Kostermans, Maarten; Light, Mark E.","Anion recognition by N-confused calix[4]pyrrole-α-carbaldehyde and its Knoevenagel reaction derivatives","New Journal of Chemistry","2007","31","5","691","","10.1039/b616467f","","","0.71073","MoKα","","0.195","0.1076","","","0.2649","0.3182","","","","","","0.905","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053703","10.3228","0.0004","11.9213","0.0004","15.8916","0.0006","71.948","0.002","88.95","0.002","74.63","0.002","1788.52","0.12","100","2","100","2","","","","","","","","3","P -1","-P 1","2","para-butylcalix(4)arene","","","- C44 H56 O4 -","- C44 H56 O4 -","- C88 H112 O8 -","2","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1102","0.0696","","","0.1891","0.2191","","","","","","1.069","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053704","11.0862","0.0015","14.413","0.002","14.802","0.002","78.182","0.002","74.463","0.002","88.892","0.002","2228.8","0.5","125","2","125","2","","","","","","","","3","P -1","-P 1","2","para-n-hexylcalix(4)arene","","","- C52 H72 O4 -","- C52 H72 O4 -","- C104 H144 O8 -","2","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.0628","0.0465","","","0.1263","0.141","","","","","","1.031","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053705","11.611","0.003","17.372","0.004","33.165","0.007","88.536","0.003","88.251","0.004","87.077","0.004","6676","3","125","2","125","2","","","","","","","","3","P -1","-P 1","2","para-hexanoylcalix(4)arene","","","- C52 H64 O8 -","- C52 H64 O8 -","- C312 H384 O48 -","6","3","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1089","0.0685","","","0.1869","0.2156","","","","","","0.989","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053706","12.053","0.003","12.441","0.003","16.015","0.003","91.504","0.003","99.841","0.003","95.036","0.003","2354.9","0.9","398","2","125","2","","","","","","","","3","P -1","-P 1","2","para-hexanoylcalix(4)arene","","","- C54 H70 O9 -","- C54 H70 O9 -","- C108 H140 O18 -","2","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1063","0.0742","","","0.2076","0.226","","","","","","1.058","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053707","9.0322","0.0007","13.6639","0.0011","15.2661","0.0012","86.472","0.001","76.962","0.001","86.25","0.001","1829.4","0.3","125","2","125","2","","","","","","","","3","P -1","-P 1","2","parabutanoylcalix(4)arene","","","- C44 H48 O8 -","- C44 H48 O8 -","- C88 H96 O16 -","2","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.0493","0.0436","","","0.1211","0.1273","","","","","","1.038","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053708","11.63","0.002","15.163","0.003","33.741","0.006","90","","99.117","0.003","90","","5874.9","1.9","125","2","125","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","para-decanoylcalix(4)arene","","","- C68 H96 O8 -","- C68 H96 O8 -","- C272 H384 O32 -","4","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1637","0.1234","","","0.278","0.29","","","","","","1.126","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053709","21.7615","0.0012","15.6647","0.0008","32.8323","0.0016","90","","107.905","0.003","90","","10650.1","1","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","para-octanoylcalix(4)arene","","","- C60 H80 O8 -","- C60 H80 O8 -","- C480 H640 O64 -","8","2","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1881","0.0839","","","0.2006","0.2921","","","","","","1.027","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053710","11.2883","0.0004","13.0045","0.0004","14.3048","0.0006","84.252","0.002","82.162","0.002","88.661","0.002","2069.75","0.13","120","2","120","2","","","","","","","","5","P -1","-P 1","2","bis(ethylenediamine)diaquacopper(ii) catena- bis(ethylenediamine) (aqua)copper(ii)(mu- aqua)bis((triaqua)tetrakis(malonomonohydroxate) pentacopper(ii)) hydrate","bis(ethylenediamine)diaquacopper(II) catena-bis(ethylenediamine) (aqua)copper(II)(mu-aqua)bis((triaqua)tetrakis(malonomonohydroxate) pentacopper(II)) hydrate","","- C16 H54 Cu6 N8 O31 -","- C16 H54 Cu6 N8 O31 -","- C32 H108 Cu12 N16 O62 -","2","1","","Gumienna-Kontecka, Elzbieta; Golenya, Irina A.; Dudarenko, Nikolay M.; Dobosz, Agnieszka; Haukka, Matti; Fritsky, Igor O.; Swiatek-Kozlowska, Jolanta","A new Cu(ii) [12]metallocrown-4 pentanuclear complex based on a Cu(ii)-malonomonohydroxamic acid unit","New Journal of Chemistry","2007","31","10","1798","","10.1039/b701600j","","","0.71073","MoKα","","0.0811","0.0434","","","0.0933","0.1063","","","","","","1.027","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053711","23.2509","0.0016","23.2509","0.0016","11.492","0.0016","90","","90","","90","","6212.6","1.1","130","2","130","2","","","","","","","","7","P -4 21 c","P -4 2n","114","","","","- C22 H53 N3 O2.5 Os P2 Si2 -","- C22 H53 N3 O2.5 Os P2 Si2 -","- C176 H424 N24 O20 Os8 P16 Si16 -","8","1","","Lee, Joo-Ho; Fan, Hongjun; Pink, Maren; Caulton, Kenneth G.","Reactivity of ?NO with an osmium polyhydride: Reductive elimination and reductive nitrosylation on the path from odd- to even-electron molecules","New Journal of Chemistry","2007","31","6","838","","10.1039/b702078c","","","0.71073","MoKα","","0.0331","0.0252","","","0.0593","0.0631","","","","","","1.066","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053713","12.921","0.002","8.1511","0.0015","16.069","0.003","90","","96.767","0.003","90","","1680.6","0.5","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 N5 -","- C20 H19 N5 -","- C80 H76 N20 -","4","1","","Chen, Yong; Fu, Wen-Fu; Li, Jun-Li; Zhao, Xi-Juan; Ou, Xue-Mei","Conformation impact on spectral properties of bis(5,7-dimethyl-1,8-naphthyridin-2-yl)amine and its ZnII complex","New Journal of Chemistry","2007","31","10","1785","","10.1039/b705149b","","","0.71073","MoKα","","0.0672","0.0431","","","0.1102","0.1291","","","","","","1.01","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053714","12.609","0.003","15.421","0.003","14.505","0.003","90","","110.09","0.03","90","","2648.8","1.1","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H27 Cl2 N5 O4 Zn -","- C25 H27 Cl2 N5 O4 Zn -","- C100 H108 Cl8 N20 O16 Zn4 -","4","1","","Chen, Yong; Fu, Wen-Fu; Li, Jun-Li; Zhao, Xi-Juan; Ou, Xue-Mei","Conformation impact on spectral properties of bis(5,7-dimethyl-1,8-naphthyridin-2-yl)amine and its ZnII complex","New Journal of Chemistry","2007","31","10","1785","","10.1039/b705149b","","","0.71073","MoKα","","0.0814","0.0627","","","0.1211","0.1278","","","","","","1.142","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053724","28.9049","0.0014","28.9049","0.0014","21.444","0.002","90","","90","","120","","15516","1.8","150","2","150","2","","","","","","","","4","P 6/m c c","-P 6 2c","192","","","","- C18.5 H14.5 N0.5 O12 -","- C10 H7 O3.5 -","- C240 H168 O84 -","24","1","","Dalgarno, Scott J.; Warren, John E.; Antesberger, Jochen; Glass, Timothy E.; Atwood, Jerry L.","Large diameter non-covalent nanotubes based on the self-assembly of para-carboxylatocalix[4]arene","New Journal of Chemistry","2007","31","","1891","1894","10.1039/B712800B","","x-ray","0.671","synchrotron","","0.3731","0.3692","","","0.75","0.7561","","","","","","8.178","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053725","28.9049","0.0014","28.9049","0.0014","21.444","0.002","90","","90","","120","","15516","1.8","296","2","150","2","","","","","","","","4","P 6/m c c","-P 6 2c","192","","","","- C18.5 H14.5 N0.5 O12 -","- C17.25 O5 -","- C414 O120 -","24","1","","Dalgarno, Scott J.; Warren, John E.; Antesberger, Jochen; Glass, Timothy E.; Atwood, Jerry L.","Large diameter non-covalent nanotubes based on the self-assembly of para-carboxylatocalix[4]arene","New Journal of Chemistry","2007","31","","1891","1894","10.1039/B712800B","","x-ray","0.671","synchrotron","","0.2663","0.2609","","","0.6108","0.6184","","","","","","5.895","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054165","12.261","0.005","13.887","0.006","20.738","0.008","89.996","0.007","88.163","0.007","85.016","0.007","3516","2","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H69 Cl2 N4 O21.5 Zn4 -","- C54 H69 Cl2 N4 O21.5 Zn4 -","- C108 H138 Cl4 N8 O43 Zn8 -","2","1","","Chen, Zhanfen; Wang, Xiaoyong; Chen, Jingwen; Yang, Xiaoliang; Li, Yizhi; Guo, Zijian","Selective sensing of dihydrogen phosphate anion by a fluorescent tetranuclear pentacoordinated zinc(ii) complex","New Journal of Chemistry","2007","31","3","357","","10.1039/b616451j","","","0.71073","MoKα","","0.0884","0.061","","","0.1207","0.1268","","","","","","1.047","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054166","8.7192","0.0007","26.3","0.001","15.251","0.002","90","0.005","91.521","0.006","90","0.004","3496.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","awc8040_KS","","","- C64 H56 Br8 O9 -","- C64 H56 Br8 O9 -","- C128 H112 Br16 O18 -","2","0.5","","Perret, Florent; Suwinska, Kinga; Bertino Ghera, Bernard; Parrot-Lopez, Hélène; Coleman, Anthony W.","Synthesis, solid state structures and interfacial properties of new para-phosphonato-O-alkoxy-calix[8]arene derivatives","New Journal of Chemistry","2007","31","6","893","900","10.1039/b616480n","","","0.71073","MoKα","","0.147","0.085","","","0.237","0.2693","","","","","","1.032","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054167","15.8507","0.0003","16.6896","0.0003","18.4507","0.0004","107.079","0.001","90.82","0.001","114.725","0.001","4184.8","0.15","100","2","100","2","","","","","","","","4","P -1","-P 1","2","awc8044","","","- C88 H104 Br8 O8 -","- C88 H104 Br8 O8 -","- C176 H208 Br16 O16 -","2","1","","Perret, Florent; Suwinska, Kinga; Bertino Ghera, Bernard; Parrot-Lopez, Hélène; Coleman, Anthony W.","Synthesis, solid state structures and interfacial properties of new para-phosphonato-O-alkoxy-calix[8]arene derivatives","New Journal of Chemistry","2007","31","6","893","900","10.1039/b616480n","","","0.71073","MoKα","","0.119","0.079","","","0.164","0.181","","","","","","1.07","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054168","14.752","0.001","5.7461","0.0002","17.339","0.001","90","","90.87","0.01","90","","1469.6","0.14","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,5-bis(phenylethynyl)thiophene","","- C20 H12 S -","- C20 H12 S -","- C80 H48 S4 -","4","1","","Siddle, Jamie S.; Ward, Richard M.; Collings, Jonathan C.; Rutter, Simon R.; Porrés, Laurent; Applegarth, Lucas; Beeby, Andrew; Batsanov, Andrei S.; Thompson, Amber L.; Howard, Judith A. K.; Boucekkine, Abdou; Costuas, Karine; Halet, Jean-François; Marder, Todd B.","Synthesis, photophysics and molecular structures of luminescent 2,5-bis(phenylethynyl)thiophenes (BPETs)","New Journal of Chemistry","2007","31","6","841","851","10.1039/b701172e","","","0.71073","MoKα","","0.1032","0.0497","","","0.1042","0.1272","","","","","","1.01","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054169","16.0717","0.0015","5.0902","0.0005","21.2336","0.0019","90","","112.217","0.01","90","","1608.1","0.3","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,5-bis(p-methylphenylethynyl)thiophene","","- C22 H16 S -","- C22 H16 S -","- C88 H64 S4 -","4","1","","Siddle, Jamie S.; Ward, Richard M.; Collings, Jonathan C.; Rutter, Simon R.; Porrés, Laurent; Applegarth, Lucas; Beeby, Andrew; Batsanov, Andrei S.; Thompson, Amber L.; Howard, Judith A. K.; Boucekkine, Abdou; Costuas, Karine; Halet, Jean-François; Marder, Todd B.","Synthesis, photophysics and molecular structures of luminescent 2,5-bis(phenylethynyl)thiophenes (BPETs)","New Journal of Chemistry","2007","31","6","841","851","10.1039/b701172e","","","0.71073","MoKα","","0.0688","0.0464","","","0.1001","0.1087","","","","","","1.022","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054170","7.1798","0.0008","45.453","0.004","5.8879","0.0004","90","","90","","90","","1921.5","0.3","120","2","120","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2,5-bis(p-carbomethoxyphenylethynyl)thiophene","","- C24 H16 O4 S -","- C24 H16 O4 S -","- C96 H64 O16 S4 -","4","1","","Siddle, Jamie S.; Ward, Richard M.; Collings, Jonathan C.; Rutter, Simon R.; Porrés, Laurent; Applegarth, Lucas; Beeby, Andrew; Batsanov, Andrei S.; Thompson, Amber L.; Howard, Judith A. K.; Boucekkine, Abdou; Costuas, Karine; Halet, Jean-François; Marder, Todd B.","Synthesis, photophysics and molecular structures of luminescent 2,5-bis(phenylethynyl)thiophenes (BPETs)","New Journal of Chemistry","2007","31","6","841","851","10.1039/b701172e","","","0.71073","MoKα","","0.0504","0.0463","","","0.1135","0.1159","","","","","","1.039","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054171","4.9212","0.0007","31.274","0.004","11.3413","0.0015","90","","101.83","0.01","90","","1708.4","0.4","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,5-bis(pentafluorophenylethynyl)thiophene","","- C20 H2 F10 S -","- C20 H2 F10 S -","- C80 H8 F40 S4 -","4","1","","Siddle, Jamie S.; Ward, Richard M.; Collings, Jonathan C.; Rutter, Simon R.; Porrés, Laurent; Applegarth, Lucas; Beeby, Andrew; Batsanov, Andrei S.; Thompson, Amber L.; Howard, Judith A. K.; Boucekkine, Abdou; Costuas, Karine; Halet, Jean-François; Marder, Todd B.","Synthesis, photophysics and molecular structures of luminescent 2,5-bis(phenylethynyl)thiophenes (BPETs)","New Journal of Chemistry","2007","31","6","841","851","10.1039/b701172e","","","0.71073","MoKα","","0.0652","0.0474","","","0.1028","0.11","","","","","","1.099","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054172","14.566","0.002","25.954","0.003","25.644","0.003","90","","99.295","0.002","90","","9567","2","153","2","153","2","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C76 H115 O44 P2 S4 Yb -","- C76 H59 O44.01 P2 S4 Yb -","- C304 H236 O176.04 P8 S16 Yb4 -","4","2","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Controlling the interplay of large organic ions: para-sulfonato-calix[4]arene and phosphonium cations","New Journal of Chemistry","2007","31","5","662","","10.1039/b615639h","","","0.71073","MoKα","","0.1869","0.1476","","","0.3611","0.3923","","","","","","1.113","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054173","32.032","0.005","11.43","0.002","50.944","0.007","90","","91.744","0.002","90","","18643","5","153","2","153","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C156 H180 Cl Gd2.67 Na2 O78 P3 S12 -","- C156 H120 Cl Gd2.66 Na2 O78 P3 S12 -","- C624 H480 Cl4 Gd10.64 Na8 O312 P12 S48 -","4","1","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Controlling the interplay of large organic ions: para-sulfonato-calix[4]arene and phosphonium cations","New Journal of Chemistry","2007","31","5","662","","10.1039/b615639h","","","0.71073","MoKα","","0.2607","0.1206","","","0.2897","0.3779","","","","","","1.063","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054174","14.624","0.001","19.987","0.002","25.192","0.002","67.801","0.001","74.982","0.001","89.74","0.001","6548.7","1","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C217 H314 Cl Gd5.33 O132 P4 S16 -","- C217 H188 Cl Gd5.34 O132 P4 S16 -","- C217 H188 Cl Gd5.34 O132 P4 S16 -","1","0.5","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Controlling the interplay of large organic ions: para-sulfonato-calix[4]arene and phosphonium cations","New Journal of Chemistry","2007","31","5","662","","10.1039/b615639h","","","0.71073","MoKα","","0.0874","0.0699","","","0.1794","0.195","","","","","","1.048","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054175","12.6687","0.0008","14.9526","0.0009","18.497","0.002","96.405","0.007","100.594","0.008","107.678","0.006","3228.7","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H59.5 O33.5 P S4 Yb -","- C53 H42 O33.5 P S4 Yb -","- C106 H84 O67 P2 S8 Yb2 -","2","1","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Controlling the interplay of large organic ions: para-sulfonato-calix[4]arene and phosphonium cations","New Journal of Chemistry","2007","31","5","662","","10.1039/b615639h","","","0.71073","MoKα","","0.0835","0.0556","","","0.1384","0.1498","","","","","","1.007","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054176","10.747","0.0002","13.1706","0.0002","18.122","0.0004","90","","90","","90","","2565.07","0.08","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Catena-[tris(5-tertbutylpyrazole)sulfatocobalt(II)]","","- C21 H36 Co N6 O4 S -","- C21 H36 Co N6 O4 S -","- C84 H144 Co4 N24 O16 S4 -","4","1","","Jones, Leigh F.; Kilner, Colin A.; Halcrow, Malcolm A.","A comparison of different methods for fitting susceptibility data of cobalt(ii) coordination polymers in a new cobalt(ii)/sulfate 1-D chain","New Journal of Chemistry","2007","31","8","1530","","10.1039/b700987a","","","0.71073","MoKα","","0.0363","0.0314","","","0.0743","0.077","","","","","","1.028","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054177","7.7471","0.0009","11.7596","0.0015","19.604","0.002","90","","90.778","0.005","90","","1785.8","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H13 Fe2 N O6 S2 -","- C13 H13 Fe2 N O6 S2 -","- C52 H52 Fe8 N4 O24 S8 -","4","1","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.048","","","0.0928","0.1028","","","","","","1.084","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054178","9.6577","0.0002","13.0873","0.0001","14.9696","0.0002","90","","92.793","0.001","90","","1889.81","0.05","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 Fe2 N O6 S2 -","- C14 H15 Fe2 N O6 S2 -","- C56 H60 Fe8 N4 O24 S8 -","4","1","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.0521","","","0.1259","0.1328","","","","","","1.024","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054179","10.604","0.003","12.035","0.004","15.428","0.004","90","","92.439","0.006","90","","1967.1","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 Fe2 N O6 S2 -","- C15 H17 Fe2 N O6 S2 -","- C60 H68 Fe8 N4 O24 S8 -","4","1","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.031","","","0.0894","0.1074","","","","","","1.097","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054180","12.4237","0.0005","14.1988","0.0006","14.6021","0.0006","98.333","0.001","91.911","0.001","94.471","0.001","2538.28","0.18","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H31 Fe2 N O4 P2 S2 -","- C17 H31 Fe2 N O4 P2 S2 -","- C68 H124 Fe8 N4 O16 P8 S8 -","4","2","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.0785","","","0.2815","0.3076","","","","","","0.992","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054181","22.819","0.005","10.912","0.002","23.588","0.005","90","","118.581","0.002","90","","5157.7","1.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H33 Fe2 N O4 P2 S2 -","- C18 H33 Fe2 N O4 P2 S2 -","- C144 H264 Fe16 N8 O32 P16 S16 -","8","2","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.0568","","","0.0973","0.1064","","","","","","1.108","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054182","11.0584","0.0006","22.4454","0.001","11.6423","0.0006","90","","113.615","0.002","90","","2647.7","0.2","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H35 Fe2 N O4 P2 S2 -","- C19 H35 Fe2 N O4 P2 S2 -","- C76 H140 Fe8 N4 O16 P8 S8 -","4","1","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.041","","","0.1335","0.1394","","","","","","1.071","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054183","9.9882","0.0004","14.1537","0.0005","14.7208","0.0008","64.158","0.002","86.751","0.003","70.732","0.003","1758.73","0.14","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H39 N9 O7 S2 -","- C33 H39 N9 O7 S2 -","- C66 H78 N18 O14 S4 -","2","1","","Fisher, Matthew G.; Gale, Philip A.; Light, Mark E.","A simple benzimidazole-based receptor for barbiturate and urea neutral guests that functions in polar solvent mixtures","New Journal of Chemistry","2007","31","9","1583","","10.1039/b705854c","","","0.71073","MoKα","","0.0976","0.0561","","","0.1274","0.1467","","","","","","1.023","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054184","19.3932","0.0004","5.8774","0.0001","19.4872","0.0004","90","","102.842","0.001","90","","2165.62","0.07","120","2","120","2","","","","","","","Matthew Fisher","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H21 N7 O3 S -","- C23 H21 N7 O3 S -","- C92 H84 N28 O12 S4 -","4","1","","Fisher, Matthew G.; Gale, Philip A.; Light, Mark E.","A simple benzimidazole-based receptor for barbiturate and urea neutral guests that functions in polar solvent mixtures","New Journal of Chemistry","2007","31","9","1583","","10.1039/b705854c","","","0.71073","MoKα","","0.0681","0.0505","","","0.1252","0.1377","","","","","","1.082","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054185","10.5481","0.0003","13.6951","0.0004","16.4507","0.0006","87.777","0.002","80.974","0.002","77.225","0.002","2288.88","0.13","120","2","120","2","","","","","","","Matthew Fisher","4","P -1","-P 1","2","","","","- C49 H49.67 N15 O7.34 -","- C49 H49.66 N15 O7.33 -","- C98 H99.32 N30 O14.66 -","2","1","","Fisher, Matthew G.; Gale, Philip A.; Light, Mark E.","A simple benzimidazole-based receptor for barbiturate and urea neutral guests that functions in polar solvent mixtures","New Journal of Chemistry","2007","31","9","1583","","10.1039/b705854c","","","0.71073","MoKα","","0.1353","0.097","","","0.2437","0.2727","","","","","","1.064","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7101608","10.7551","0.0014","6.1499","0.0005","13.849","0.003","90","","96.077","0.01","90","","910.8","0.2","159","2","159","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H29 N O7 -","- C16 H29 N O7 -","- C32 H58 N2 O14 -","2","1","","Enders, Dieter; Gasperi, Tecla","Proline organocatalysis as a new tool for the asymmetric synthesis of ulosonic acid precursors.","Chemical communications (Cambridge, England)","2007","","1","88","90","10.1039/b611265j","","","0.71073","MoKα","","0.0366","0.0314","","","0.0788","0.0829","","","","","","1.075","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101609","13.1408","0.0012","21.235","0.002","24.86","0.002","90","","97.467","0.002","90","","6878.1","1.1","91","2","91","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C80 H96 Ge2 N2 -","- C80 H96 Ge2 N2 -","- C320 H384 Ge8 N8 -","4","1","","Spikes, Geoffrey H; Power, Philip P","Lewis base induced tuning of the Ge-Ge bond order in a ""digermyne"".","Chemical communications (Cambridge, England)","2007","","1","85","87","10.1039/b612202g","","","0.71073","MoKα","","0.1429","0.0611","","","0.1261","0.1478","","","","","","0.909","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101610","13.8275","0.0007","9.9939","0.0005","19.6086","0.0009","90","","108.036","0.001","90","","2576.6","0.2","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C34 H26 Cl2 -","- C34 H22 Cl2 -","- C136 H88 Cl8 -","4","1","","Dong, Yongqiang; Lam, Jacky W Y; Qin, Anjun; Li, Zhen; Sun, Jingzhi; Sung, Herman H-Y; Williams, Ian D; Tang, Ben Zhong","Switching the light emission of (4-biphenylyl)phenyldibenzofulvene by morphological modulation: crystallization-induced emission enhancement.","Chemical communications (Cambridge, England)","2007","","1","40","42","10.1039/b613157c","","","0.71073","MoKα","","0.0572","0.0481","","","0.1093","0.1136","","","","","","1.036","","","","has coordinates,has disorder","180118","2020-10-21","18:00:00",""
"7101611","16.1648","0.0011","17.4547","0.0015","19.2761","0.0013","79.7","0.006","75.423","0.006","69.81","0.007","4914.9","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C106 H94.5 Mn4 N8 O13.5 P4 -","- C101.8 H75 Mn4 N6.51 O13.5 P4 -","- C203.6 H150 Mn8 N13.02 O27 P8 -","2","1","","Baskar, Viswanathan; Shanmugam, Muralidharan; Sañudo, E Carolina; Shanmugam, Maheswaran; Collison, David; McInnes, Eric J L; Wei, Qiang; Winpenny, Richard E P","Metal cages using a bulky phosphonate as a ligand.","Chemical communications (Cambridge, England)","2007","","1","37","39","10.1039/b613756c","","","0.71073","MoKα","","0.1938","0.1021","","","0.241","0.2774","","","","","","0.97","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101612","13.62","0.004","17.079","0.005","23.954","0.006","71.616","0.005","73.921","0.006","68.045","0.005","4823","2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C99 H90.5 Cl2 Cu4 N5 O15.25 P4 -","- C99 H85 Cl2 Cu4 N5 O15.25 P4 -","- C198 H170 Cl4 Cu8 N10 O30.5 P8 -","2","1","","Baskar, Viswanathan; Shanmugam, Muralidharan; Sañudo, E Carolina; Shanmugam, Maheswaran; Collison, David; McInnes, Eric J L; Wei, Qiang; Winpenny, Richard E P","Metal cages using a bulky phosphonate as a ligand.","Chemical communications (Cambridge, England)","2007","","1","37","39","10.1039/b613756c","","","0.71073","MoKα","","0.1084","0.0719","","","0.2107","0.2315","","","","","","1.016","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101613","14.8919","0.001","34.184","0.002","18.7673","0.0013","90","","100.746","0.001","90","","9386.3","1.1","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C98.75 H85.5 Cl5.5 Co4 N4 O12 P4 -","- C98.76 H80 Cl5.52 Co4 N4 O12 P4 -","- C395.04 H320 Cl22.08 Co16 N16 O48 P16 -","4","1","","Baskar, Viswanathan; Shanmugam, Muralidharan; Sañudo, E Carolina; Shanmugam, Maheswaran; Collison, David; McInnes, Eric J L; Wei, Qiang; Winpenny, Richard E P","Metal cages using a bulky phosphonate as a ligand.","Chemical communications (Cambridge, England)","2007","","1","37","39","10.1039/b613756c","","","0.71073","MoKα","","0.0709","0.0475","","","0.1213","0.1289","","","","","","0.941","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101614","14.765","0.005","7.271","0.003","7.363","0.003","90","","97.447","0.006","90","","783.8","0.5","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H28 Cd2 Cl8 N4 -","- C24 H28 Cd2 Cl8 N4 -","- C24 H28 Cd2 Cl8 N4 -","1","0.25","","Chen, Chun-Long; Beatty, Alicia M","From crystal engineering to cluster engineering: How to transform cadmium chloride from 2-D to 0-D.","Chemical communications (Cambridge, England)","2007","","1","76","78","10.1039/b613761j","","","0.71073","MoKα","","0.0228","0.0187","","","0.0473","0.0505","","","","","","1.045","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101615","17.079","0.003","7.3585","0.0015","7.2742","0.0014","90","","97.423","0.003","90","","906.5","0.3","300","2","300","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 Cd Cl4 N2 -","- C14 H16 Cd Cl4 N2 -","- C28 H32 Cd2 Cl8 N4 -","2","0.5","","Chen, Chun-Long; Beatty, Alicia M","From crystal engineering to cluster engineering: How to transform cadmium chloride from 2-D to 0-D.","Chemical communications (Cambridge, England)","2007","","1","76","78","10.1039/b613761j","","","0.71073","MoKα","","0.0449","0.0296","","","0.0805","0.1047","","","","","","1.195","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101616","8.094","0.002","48.185","0.011","8.239","0.002","90","","90","","90","","3213.1","1.3","299","2","299","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C28 H36 Cd Cl6 N4 -","- C28 H36 Cd Cl6 N4 -","- C112 H144 Cd4 Cl24 N16 -","4","0.5","","Chen, Chun-Long; Beatty, Alicia M","From crystal engineering to cluster engineering: How to transform cadmium chloride from 2-D to 0-D.","Chemical communications (Cambridge, England)","2007","","1","76","78","10.1039/b613761j","","","0.71073","MoKα","","0.0771","0.043","","","0.1051","0.1312","","","","","","1.167","","","","has coordinates","210357","2020-10-21","18:00:00",""
"7101617","12.546","0.003","12.546","0.003","32.74","0.009","90","","90","","90","","5154","2","301","2","301","2","","","","","","","","6","P 4/m n c","-P 4 2n","128","","","","- C128 H224 Cd12 Cl40 N16 O24 -","- C128 H224 Cd12 Cl40 N16 O24 -","- C128 H224 Cd12 Cl40 N16 O24 -","1","0.0625","","Chen, Chun-Long; Beatty, Alicia M","From crystal engineering to cluster engineering: How to transform cadmium chloride from 2-D to 0-D.","Chemical communications (Cambridge, England)","2007","","1","76","78","10.1039/b613761j","","","0.71073","MoKα","","0.0552","0.0333","","","0.0679","0.0769","","","","","","1.064","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101618","12.648","0.003","16.387","0.003","8.3423","0.0017","90","","102.936","0.004","90","","1685.2","0.6","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C64 H88 Cl8 N8 -","- C64 H88 Cl8 N8 -","- C64 H88 Cl8 N8 -","1","0.25","","Chen, Chun-Long; Beatty, Alicia M","From crystal engineering to cluster engineering: How to transform cadmium chloride from 2-D to 0-D.","Chemical communications (Cambridge, England)","2007","","1","76","78","10.1039/b613761j","","","0.71073","MoKα","","0.0662","0.0449","","","0.1216","0.137","","","","","","1.039","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101619","8.555","0.0004","8.827","0.0005","22.628","0.0009","82.744","0.004","83.051","0.004","86.432","0.0016","1680.7","0.14","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H19 Cl N O P Pd -","- C17 H19 Cl N O P Pd -","- C68 H76 Cl4 N4 O4 P4 Pd4 -","4","2","","Agostinho, Magno; Braunstein, Pierre","Structurally characterized intermediates in the stepwise insertion of CO-ethylene or CO-methyl acrylate into the metal-carbon bond of Pd(II) complexes stabilized by (phosphinomethyl)oxazoline ligands.","Chemical communications (Cambridge, England)","2007","","1","58","60","10.1039/b613865a","","","0.71073","MoKα","","0.1357","0.0956","","","0.2505","0.2694","","","","","","1.105","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101620","7.731","0.001","11.711","0.002","21.589","0.004","90","","90","","90","","1954.6","0.6","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C19 H23 Cl N O P Pd -","- C19 H23 Cl N O P Pd -","- C76 H92 Cl4 N4 O4 P4 Pd4 -","4","1","","Agostinho, Magno; Braunstein, Pierre","Structurally characterized intermediates in the stepwise insertion of CO-ethylene or CO-methyl acrylate into the metal-carbon bond of Pd(II) complexes stabilized by (phosphinomethyl)oxazoline ligands.","Chemical communications (Cambridge, England)","2007","","1","58","60","10.1039/b613865a","","","0.71073","MoKα","","0.0635","0.0397","","","0.103","0.1272","","","","","","0.863","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7101621","17.471","0.0002","13.178","0.0002","29.302","0.0003","90","","107.12","0.0006","90","","6447.36","0.14","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C18 H19 F3 N O4 P Pd S -","- C18 H19 F3 N O4 P Pd S -","- C216 H228 F36 N12 O48 P12 Pd12 S12 -","12","3","","Agostinho, Magno; Braunstein, Pierre","Structurally characterized intermediates in the stepwise insertion of CO-ethylene or CO-methyl acrylate into the metal-carbon bond of Pd(II) complexes stabilized by (phosphinomethyl)oxazoline ligands.","Chemical communications (Cambridge, England)","2007","","1","58","60","10.1039/b613865a","","","0.71073","MoKα","","0.1742","0.0548","","","0.1156","0.1518","","","","","","0.948","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7101622","8.333","0.001","9.827","0.002","14.261","0.003","92.55","0.05","100.18","0.05","98.93","0.05","1132.4","0.4","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C20 H23 F3 N O4 P Pd S -","- C20 H23 F3 N O4 P Pd S -","- C40 H46 F6 N2 O8 P2 Pd2 S2 -","2","1","","Agostinho, Magno; Braunstein, Pierre","Structurally characterized intermediates in the stepwise insertion of CO-ethylene or CO-methyl acrylate into the metal-carbon bond of Pd(II) complexes stabilized by (phosphinomethyl)oxazoline ligands.","Chemical communications (Cambridge, England)","2007","","1","58","60","10.1039/b613865a","","","0.71073","MoKα","","0.0388","0.0303","","","0.0676","0.0714","","","","","","1.054","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101623","8.962","0.005","10.1","0.005","12.534","0.005","82.414","0.005","80.486","0.005","64.312","0.005","1006","0.9","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H23 Cl N O2 P Pd -","- C20 H23 Cl N O2 P Pd -","- C40 H46 Cl2 N2 O4 P2 Pd2 -","2","1","","Agostinho, Magno; Braunstein, Pierre","Structurally characterized intermediates in the stepwise insertion of CO-ethylene or CO-methyl acrylate into the metal-carbon bond of Pd(II) complexes stabilized by (phosphinomethyl)oxazoline ligands.","Chemical communications (Cambridge, England)","2007","","1","58","60","10.1039/b613865a","","","0.71069","MoKα","","0.0246","0.0226","","","0.0626","0.0635","","","","","","1.046","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101624","11.474","0.0005","13.903","0.0007","18.081","0.001","92.486","0.0015","96.765","0.0015","112.951","0.003","2624.9","0.2","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C23 H27 F3 N O5 P Pd S -","- C23 H27 F3 N O5 P Pd S -","- C92 H108 F12 N4 O20 P4 Pd4 S4 -","4","2","","Agostinho, Magno; Braunstein, Pierre","Structurally characterized intermediates in the stepwise insertion of CO-ethylene or CO-methyl acrylate into the metal-carbon bond of Pd(II) complexes stabilized by (phosphinomethyl)oxazoline ligands.","Chemical communications (Cambridge, England)","2007","","1","58","60","10.1039/b613865a","","","0.71073","MoKα","","0.1399","0.0724","","","0.184","0.2146","","","","","","1.079","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101625","11.274","0.0005","14.827","0.0005","17.445","0.0009","73.431","0.0016","85.155","0.0015","73.249","0.0014","2676.4","0.2","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C46 H50 F6 N2 O14 P2 Pd2 S2 -","- C46 H50 F6 N2 O14 P2 Pd2 S2 -","- C92 H100 F12 N4 O28 P4 Pd4 S4 -","2","1","","Agostinho, Magno; Braunstein, Pierre","Structurally characterized intermediates in the stepwise insertion of CO-ethylene or CO-methyl acrylate into the metal-carbon bond of Pd(II) complexes stabilized by (phosphinomethyl)oxazoline ligands.","Chemical communications (Cambridge, England)","2007","","1","58","60","10.1039/b613865a","","","0.71073","MoKα","","0.1231","0.0511","","","0.111","0.1375","","","","","","0.961","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101626","8.927","0.005","12.268","0.005","13.682","0.005","76.667","0.005","87.664","0.005","75.302","0.005","1410.1","1.1","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C25 H29 F3 N O7 P Pd S -","- C25 H29 F3 N O7 P Pd S -","- C50 H58 F6 N2 O14 P2 Pd2 S2 -","2","1","","Agostinho, Magno; Braunstein, Pierre","Structurally characterized intermediates in the stepwise insertion of CO-ethylene or CO-methyl acrylate into the metal-carbon bond of Pd(II) complexes stabilized by (phosphinomethyl)oxazoline ligands.","Chemical communications (Cambridge, England)","2007","","1","58","60","10.1039/b613865a","","","0.71069","MoKα","","0.0664","0.0542","","","0.1571","0.1722","","","","","","1.075","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101627","20.276","0.004","21.24","0.004","21.313","0.004","81.06","0.03","62.88","0.03","66.62","0.03","7495","3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H60 N2 S4 Se2 -","- C72 H60 N2 S4 Se2 -","- C288 H240 N8 S16 Se8 -","4","2","","Kumar, Rajeev; Misra, Rajneesh; Chandrashekar, Tavarekere K; Suresh, Eringathodi","Near IR absorbing planar aromatic [34]octaphyrins(1.1.0.1.1.0.0.0) containing a quaterthiophene subunit.","Chemical communications (Cambridge, England)","2007","","1","43","45","10.1039/b614290g","","","0.71073","MoKα","","0.0978","0.0614","","","0.1411","0.1538","","","","","","0.92","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101639","13.423","0.003","14.363","0.003","18.7","0.004","103.421","0.017","93.755","0.018","99.332","0.017","3440.4","1.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Chloro-bis[(2,4,6,2'',4'',6''-hexa-iso-propyl-1,1':3',1''- terphen-2'-yl)selanido-κappa Se]neodymium","","- C72 H98 Cl Nd Se2 -","- C72 H98 Cl Nd Se2 -","- C144 H196 Cl2 Nd2 Se4 -","2","1","","Hauber, Sven-Oliver; Niemeyer, Mark","Pi-bonding encapsulation in aryl-substituted lanthanide selenolates: monomeric compounds with apparent low-coordinate metal atoms.","Chemical communications (Cambridge, England)","2007","","3","275","277","10.1039/b612182a","","","0.71073","MoKα","","0.122","0.0653","","","0.1045","0.1174","","","","","","1.203","","","","has coordinates,has disorder","180118","2020-10-21","18:00:00",""
"7101640","13.439","0.003","14.392","0.003","18.751","0.004","103.497","0.017","93.751","0.019","99.288","0.017","3460.2","1.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Chloro-bis[(2,4,6,2'',4'',6''-hexa-iso-propyl-1,1':3',1''- terphen-2'-yl)selanido-κappa Se]praseodymium","","- C72 H98 Cl Pr Se2 -","- C72 H98 Cl Pr Se2 -","- C144 H196 Cl2 Pr2 Se4 -","2","1","","Hauber, Sven-Oliver; Niemeyer, Mark","Pi-bonding encapsulation in aryl-substituted lanthanide selenolates: monomeric compounds with apparent low-coordinate metal atoms.","Chemical communications (Cambridge, England)","2007","","3","275","277","10.1039/b612182a","","","0.71073","MoKα","","0.1672","0.0794","","","0.1192","0.1374","","","","","","1.103","","","","has coordinates,has disorder","180118","2020-10-21","18:00:00",""
"7101641","17.236","0.0004","17.236","0.0004","24.429","0.0004","90","","90","","90","","7257.4","0.3","173","2","173","2","","","","","","","","7","P 42/n :2","-P 4bc","86","","","","- C102 H114 B8 Co4 F32 N46 O20 -","- C102 H114 B8 Co4 F32 N46 O20 -","- C204 H228 B16 Co8 F64 N92 O40 -","2","0.25","","Ramírez, Juan; Stadler, Adrian-Mihail; Kyritsakas, Nathalie; Lehn, Jean-Marie","Solvent-modulated reversible conversion of a [2 x 2]-grid into a pincer-like complex.","Chemical communications (Cambridge, England)","2007","","3","237","239","10.1039/b612222a","","","0.71073","MoKα","","0.178","0.1225","","","0.3639","0.4049","","","","","","1.158","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101642","15.542","0.004","16.699","0.004","13.539","0.003","90","","112.93","0.02","90","","3236.2","1.4","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C27 H27 Cl2 Co N11 O8 -","- C27 H27 Cl2 Co N11 O8 -","- C108 H108 Cl8 Co4 N44 O32 -","4","0.5","","Ramírez, Juan; Stadler, Adrian-Mihail; Kyritsakas, Nathalie; Lehn, Jean-Marie","Solvent-modulated reversible conversion of a [2 x 2]-grid into a pincer-like complex.","Chemical communications (Cambridge, England)","2007","","3","237","239","10.1039/b612222a","","","0.71073","MoKα","","0.0793","0.0488","","","0.1211","0.1357","","","","","","1.035","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101643","14.85","0.02","20.51","0.02","25.04","0.02","79.38","0.07","71.05","0.09","81.1","0.1","7054","13","113.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C88 H76 Cl N2 Rh -","- C88 H64 Cl N2 Rh -","- C352 H256 Cl4 N8 Rh4 -","4","2","","Sato, Hiromichi; Fujihara, Tetsuaki; Obora, Yasushi; Tokunaga, Makoto; Kiyosu, Junya; Tsuji, Yasushi","Rhodium(I) complexes with N-heterocyclic carbenes bearing a 2,3,4,5-tetraphenylphenyl and its higher dendritic frameworks.","Chemical communications (Cambridge, England)","2007","","3","269","271","10.1039/b612385f","","","0.7107","MoKα","","","0.056","","","","0.164","","","","","","1.005","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101644","13.3359","0.0007","8.6156","0.0005","14.4588","0.0007","90","","106.459","0.005","90","","1593.19","0.15","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H44 Cu2 Li2 -","- C36 H44 Cu2 Li2 -","- C72 H88 Cu4 Li4 -","2","0.5","","Davies, Robert P; Hornauer, Stefan; White, Andrew J P","Models for the reactive states of homocuprates: syntheses, structures and reactivities of [Cu2Li2Mes4] and [Cu3LiMes4].","Chemical communications (Cambridge, England)","2007","","3","304","306","10.1039/b612554a","","","0.71073","MoKα","","0.0772","0.0439","","","0.106","0.1193","","","","","","0.951","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101645","17.3561","0.0018","28.142","0.002","15.7048","0.0011","90","","111.095","0.008","90","","7156.6","1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C39 H51 Cu3 Li -","- C39 H51 Cu3 Li -","- C312 H408 Cu24 Li8 -","8","2","","Davies, Robert P; Hornauer, Stefan; White, Andrew J P","Models for the reactive states of homocuprates: syntheses, structures and reactivities of [Cu2Li2Mes4] and [Cu3LiMes4].","Chemical communications (Cambridge, England)","2007","","3","304","306","10.1039/b612554a","","","1.54248","CuKα","","0.149","0.0364","","","0.0501","0.058","","","","","","0.593","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101646","6.645","0.0013","27.561","0.006","7.6528","0.0015","90","","110.83","0.03","90","","1309.9","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C36 H24 N2 -","- C36 H24 N2 -","- C72 H48 N4 -","2","0.5","","Li, Yupeng; Li, Feng; Zhang, Houyu; Xie, Zengqi; Xie, Weijie; Xu, Hai; Li, Bao; Shen, Fangzhong; Ye, Ling; Hanif, Muddasir; Ma, Dongge; Ma, Yuguang","Tight intermolecular packing through supramolecular interactions in crystals of cyano substituted oligo(para-phenylene vinylene): a key factor for aggregation-induced emission.","Chemical communications (Cambridge, England)","2007","","3","231","233","10.1039/b612732k","","","0.71073","MoKα","","0.1663","0.0591","","","0.1057","0.1399","","","","","","0.951","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101647","10.7106","0.0005","11.7808","0.0007","15.0518","0.0011","94.946","0.002","105.939","0.002","90.94","0.004","1817.82","0.19","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H54 Co3 N4 O12 S8 -","- C72 H54 Co3 N4 O12 S8 -","- C72 H54 Co3 N4 O12 S8 -","1","0.5","","Gavrilenko, Konstantin S; Gal, Yann Le; Cador, Olivier; Golhen, Stéphane; Ouahab, Lahcène","First trinuclear paramagnetic transition metal complexes with redox active ligands derived from TTF: Co2M(PhCOO)6(TTF-CH=CH-py)2.2CH3CN, M = CoII, MnII.","Chemical communications (Cambridge, England)","2007","","3","280","282","10.1039/b613191c","","","0.71073","MoKα","","0.1172","0.0546","","","0.1227","0.1538","","","","","","1.019","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101648","10.6124","0.0003","11.726","0.0003","14.9724","0.0005","95.594","0.001","106.834","0.0011","90.295","0.0012","1773.76","0.09","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C72 H54 Co2 Mn N4 O12 S8 -","- C72 H54 Co2 Mn N4 O12 S8 -","- C72 H54 Co2 Mn N4 O12 S8 -","1","0.5","","Gavrilenko, Konstantin S; Gal, Yann Le; Cador, Olivier; Golhen, Stéphane; Ouahab, Lahcène","First trinuclear paramagnetic transition metal complexes with redox active ligands derived from TTF: Co2M(PhCOO)6(TTF-CH=CH-py)2.2CH3CN, M = CoII, MnII.","Chemical communications (Cambridge, England)","2007","","3","280","282","10.1039/b613191c","","","0.71073","MoKα","","0.0637","0.0436","","","0.1064","0.1185","","","","","","1.058","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101649","9.6437","0.00019","12.4445","0.0012","18.3737","0.0017","90","","102.099","0.003","90","","2156.1","0.3","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21.5 H21.5 Br Cl1.5 N2 O3 -","- C21.5 H21.5 Br Cl1.5 N2 O3 -","- C86 H86 Br4 Cl6 N8 O12 -","4","2","","Lachia, Mathilde; Poriel, Cyril; Slawin, Alexandra M Z; Moody, Christopher J","The remarkable effect of the 7-substituent in the diastereoselective oxidative rearrangement of indoles: asymmetric synthesis of 3,3-disubstituted oxindoles.","Chemical communications (Cambridge, England)","2007","","3","286","288","10.1039/b613716d","","","1.54178","CuKα","","0.1471","0.0858","","","0.133","0.1574","","","","","","1.072","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101650","8.9714","0.0007","14.1418","0.0011","15.1487","0.0012","90","","90","","90","","1921.9","0.3","93","2","93","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H21 Cl N2 O3 -","- C21 H21 Cl N2 O3 -","- C84 H84 Cl4 N8 O12 -","4","1","","Lachia, Mathilde; Poriel, Cyril; Slawin, Alexandra M Z; Moody, Christopher J","The remarkable effect of the 7-substituent in the diastereoselective oxidative rearrangement of indoles: asymmetric synthesis of 3,3-disubstituted oxindoles.","Chemical communications (Cambridge, England)","2007","","3","286","288","10.1039/b613716d","","","0.71073","MoKα","","0.0224","0.0221","","","0.0554","0.0555","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101651","9.797","0.002","12.303","0.002","14.883","0.003","90","","90","","90","","1793.9","0.6","93","2","93","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H21 F N2 O3 -","- C21 H21 F N2 O3 -","- C84 H84 F4 N8 O12 -","4","1","","Lachia, Mathilde; Poriel, Cyril; Slawin, Alexandra M Z; Moody, Christopher J","The remarkable effect of the 7-substituent in the diastereoselective oxidative rearrangement of indoles: asymmetric synthesis of 3,3-disubstituted oxindoles.","Chemical communications (Cambridge, England)","2007","","3","286","288","10.1039/b613716d","","","0.71073","MoKα","","0.0414","0.0369","","","0.0812","0.0837","","","","","","1.085","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101652","8.5669","0.0014","12.7503","0.0016","14.9","0.003","90","","90","","90","","1627.6","0.4","93","2","93","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H19 Br N2 O3 -","- C16 H19 Br N2 O3 -","- C64 H76 Br4 N8 O12 -","4","1","","Lachia, Mathilde; Poriel, Cyril; Slawin, Alexandra M Z; Moody, Christopher J","The remarkable effect of the 7-substituent in the diastereoselective oxidative rearrangement of indoles: asymmetric synthesis of 3,3-disubstituted oxindoles.","Chemical communications (Cambridge, England)","2007","","3","286","288","10.1039/b613716d","","","0.71073","MoKα","","0.023","0.0206","","","0.0468","0.0479","","","","","","0.776","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101653","12.846","0.002","16.061","0.003","14.566","0.004","90","","90.612","0.011","90","","3005.1","1.1","173.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H31 O6 P Ru -","- C34 H31 O6 P Ru -","- C136 H124 O24 P4 Ru4 -","4","1","","Kawatsura, Motoi; Ata, Fumio; Wada, Shohei; Hayase, Shuichi; Uno, Hidemitsu; Itoh, Toshiyuki","Ruthenium-catalysed linear-selective allylic alkylation of allyl acetates.","Chemical communications (Cambridge, England)","2007","","3","298","300","10.1039/b614015g","","","0.71075","MoKα","","0.1064","0.0747","","","0.1545","0.1735","","","","","","1.046","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101654","16.468","0.009","21.274","0.012","23.587","0.013","90.583","0.009","94.483","0.009","95.907","0.009","8193","8","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C157.5 H194 Cl N11 O10.25 Sn2 -","- C157.5 H194 Cl N11 O10.25 Sn2 -","- C315 H388 Cl2 N22 O20.5 Sn4 -","2","1","","Brotherhood, Peter R; Wu, Richard A-S; Turner, Peter; Crossley, Maxwell J","Cavity effect amplification in the recognition of dicarboxylic acids by initial ditopic H-bond formation followed by kinetic trapping.","Chemical communications (Cambridge, England)","2007","","3","225","227","10.1039/b614575b","","","0.71073","MoKα","","0.2135","0.1848","","","0.4389","0.4521","","","","","","1.668","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101655","31.236","0.005","27.384","0.007","21.366","0.005","90","","115.594","0.01","90","","16482","6","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C175.2 H200.4 N10 O11.4 Sn2 -","- C175.2 H200.4 N10 O11.4 Sn2 -","- C700.8 H801.6 N40 O45.6 Sn8 -","4","0.5","","Brotherhood, Peter R; Wu, Richard A-S; Turner, Peter; Crossley, Maxwell J","Cavity effect amplification in the recognition of dicarboxylic acids by initial ditopic H-bond formation followed by kinetic trapping.","Chemical communications (Cambridge, England)","2007","","3","225","227","10.1039/b614575b","","","0.56356","synchrotron","","0.0505","0.0415","","","0.1138","0.1177","","","","","","1.273","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101656","15.38","0.003","8.3331","0.0017","16.35","0.003","90","","106.807","0.004","90","","2005.9","0.7","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","monoaquabis(N,N-diethylethylenediamine)copper(ii) nitrate","monoaquabis(N,N-diethylethylenediamine)copper(II) nitrate","","- C12 H34 Cu N6 O7 -","- C12 H33 Cu N6 O7 -","- C48 H132 Cu4 N24 O28 -","4","0.5","","Naumov, Pance; Sakurai, Kenji; Nukui, Akihiko; Tanaka, Masahiko","Increased crystal porosity and enhanced gas adsorption by intracolumnar gliding for broadband gas detection.","Chemical communications (Cambridge, England)","2007","","4","347","349","10.1039/b610950k","","","0.71073","MoKα","","0.0717","0.0675","","","0.1939","0.1969","","","","","","1.167","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101657","15.41781","0.00056","8.33658","0.00026","16.40034","0.00059","90","","106.832","0.0021","90","","2017.6","0.2","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","CuNO blue","","","?","- C12 Cu N6 O7 -","- C48 Cu4 N24 O28 -","4","0.5","","Naumov, Pance; Sakurai, Kenji; Nukui, Akihiko; Tanaka, Masahiko","Increased crystal porosity and enhanced gas adsorption by intracolumnar gliding for broadband gas detection.","Chemical communications (Cambridge, England)","2007","","4","347","349","10.1039/b610950k","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101658","8.1864","0.001","12.6438","0.0016","9.6767","0.0012","90","","105.942","0.002","90","","963.1","0.2","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(N,N-diethylethylenediamine)copper(II) nitrate","","- C12 H32 Cu N6 O6 -","- C12 H32 Cu N6 O6 -","- C24 H64 Cu2 N12 O12 -","2","0.5","","Naumov, Pance; Sakurai, Kenji; Nukui, Akihiko; Tanaka, Masahiko","Increased crystal porosity and enhanced gas adsorption by intracolumnar gliding for broadband gas detection.","Chemical communications (Cambridge, England)","2007","","4","347","349","10.1039/b610950k","","","0.71073","MoKα","","0.0454","0.0297","","","0.0734","0.0805","","","","","","0.932","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101659","11.454","0.005","11.454","0.005","10.16","0.005","90","","90","","120","","1154.4","0.9","298","2","296","2","","","","","","","","5","P 63/m","-P 6c","176","tris-o-phenylenedioxyspirocyclotriphosphazene","","","- C18 H12 N3 O6 P3 -","- C18 H12 N3 O6 P3 -","- C36 H24 N6 O12 P6 -","2","0.166667","","Comotti, Angiolina; Bracco, Silvia; Ferretti, Lisa; Mauri, Michele; Simonutti, Roberto; Sozzani, Piero","A single-crystal imprints macroscopic orientation on xenon atoms.","Chemical communications (Cambridge, England)","2007","","4","350","352","10.1039/b612002d","","","0.71069","MoKα","","0.192","0.0856","","","0.1246","0.3027","","","","","","1.447","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101660","14.4494","0.0008","9.2234","0.0005","17.7795","0.001","90","","90","","90","","2369.5","0.2","100","2","100","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C22 H28 Li N2 O2 P S2 -","- C22 H28 Li N2 O2 P S2 -","- C88 H112 Li4 N8 O8 P4 S8 -","4","1","","Stey, Thomas; Henn, Julian; Stalke, Dietmar","The P(bth)2- anion as a Janus head staple between lithium and manganese (bth = benzothiazol-2-yl, C7H4NS).","Chemical communications (Cambridge, England)","2007","","4","413","415","10.1039/b612247g","","","0.71073","MoKα","","0.0314","0.0294","","","0.0695","0.0703","","","","","","1.049","","","","has coordinates,has disorder","180118","2020-10-21","18:00:00",""
"7101661","27.957","0.012","16.397","0.007","21.612","0.009","90","","120.372","0.008","90","","8547","6","193","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C45.5 H38 Li Mn N2 O4 P S2 -","- C30.3333 H25.3333 Li0.666667 Mn1.33333 N1.33333 O2.66667 P0.666667 S1.33333 -","- C364 H304 Li8 Mn16 N16 O32 P8 S16 -","12","1.5","","Stey, Thomas; Henn, Julian; Stalke, Dietmar","The P(bth)2- anion as a Janus head staple between lithium and manganese (bth = benzothiazol-2-yl, C7H4NS).","Chemical communications (Cambridge, England)","2007","","4","413","415","10.1039/b612247g","","","0.71073","MoKα","","0.0895","0.0616","","","0.1664","0.1752","","","","","","0.961","","","","has coordinates,has disorder","180118","2020-10-21","18:00:00",""
"7101662","8.901","0.005","10.995","0.006","21.876","0.012","90","","100.157","0.009","90","","2107.3","1.9","298","","","","","","","","","","","7","P 1 21 1","P 2yb","4","Not named","","","- C34 H53 Cl F2 N4 O10 P2 -","- C34 H53 Cl F2 N4 O10 P2 -","- C68 H106 Cl2 F4 N8 O20 P4 -","2","1","","Chen, Alex M; Ellison, Martha E; Peresypkin, Andrey; Wenslow, Robert M; Variankaval, Narayan; Savarin, Cecile G; Natishan, Theresa K; Mathre, David J; Dormer, Peter G; Euler, Danielle H; Ball, Richard G; Ye, Zhixiong; Wang, Yaling; Santos, Ivan","Development of a pharmaceutical cocrystal of a monophosphate salt with phosphoric acid.","Chemical communications (Cambridge, England)","2007","","4","419","421","10.1039/b612353h","","","0.71073","MoKα","","","0.098","","","0.224","0.238","","","","","","1.182","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101663","10.283","0.001","10.941","0.001","13.382","0.001","79.52","0.01","87.86","0.01","82.82","0.01","1468.7","0.2","198","2","198","2","","","","","","","","6","P -1","-P 1","2","","","","- C22.75 H36.25 Cl3.25 Cu3 N4 O4.75 -","- C22.782 H36.346 Cl3.218 Cu3 N4 O4.782 -","- C45.564 H72.692 Cl6.436 Cu6 N8 O9.564 -","2","1","","Glaser, Thorsten; Liratzis, Ioannis; Fröhlich, Roland; Weyhermüller, Thomas","A trinucleating ligand based on 1,8-naphthalenediol: synthesis, structural and magnetic properties of a linear Cu(II)Cu(II)Cu(II) complex.","Chemical communications (Cambridge, England)","2007","","4","356","358","10.1039/b612555g","","","0.71073","MoKα","","0.0395","0.0308","","","0.0753","0.0794","","","","","","1.045","","","","has coordinates,has disorder","180118","2020-10-21","18:00:00",""
"7101664","10.1794","0.0005","10.7731","0.0005","13.4671","0.0007","78.786","0.005","87.043","0.005","83.44","0.005","1438.52","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H34 Cl4 Cu3 N4 O4 -","- C22 H34 Cl4 Cu3 N4 O4 -","- C44 H68 Cl8 Cu6 N8 O8 -","2","1","","Glaser, Thorsten; Liratzis, Ioannis; Fröhlich, Roland; Weyhermüller, Thomas","A trinucleating ligand based on 1,8-naphthalenediol: synthesis, structural and magnetic properties of a linear Cu(II)Cu(II)Cu(II) complex.","Chemical communications (Cambridge, England)","2007","","4","356","358","10.1039/b612555g","","","0.71073","MoKα","","0.0352","0.0281","","","0.0658","0.0689","","","","","","1.032","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101665","16.0428","0.0008","16.0428","0.0008","20.4985","0.0008","90","","90","","90","","5275.7","0.4","293","2","293","2","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","","","","- C30 H24 N2 O5 S Zn -","- C30 H18 N2 O5 S Zn -","- C240 H144 N16 O40 S8 Zn8 -","8","0.5","","Cheng, Ai-Ling; Liu, Na; Yue, Yan-Feng; Jiang, Yong-Wen; Gao, En-Qing; Yan, Chun-Hua; He, Ming-Yuan","Unprecedented 3D entanglement of 1D zigzag coordination polymers leading to a robust microporous framework.","Chemical communications (Cambridge, England)","2007","","4","407","409","10.1039/b613295b","","","0.71073","MoKα","","0.1515","0.0514","","","0.1182","0.1482","","","","","","0.962","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101666","6.8348","0.0007","18.756","0.0014","17.8251","0.0018","90","","91.838","0.008","90","","2283.9","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H32 Cl3 Cu2 N4 -","- C19 H32 Cl3 Cu2 N4 -","- C76 H128 Cl12 Cu8 N16 -","4","1","","Khan, Abid; Silversides, Jon D; Madden, Leigh; Greenman, John; Archibald, Stephen J","Fluorescent CXCR4 chemokine receptor antagonists: metal activated binding.","Chemical communications (Cambridge, England)","2007","","4","416","418","10.1039/b614557d","","","0.71073","MoKα","","0.0719","0.0429","","","0.1027","0.113","","","","","","0.956","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101667","10.2001","0.0002","12.4004","0.0002","24.4161","0.0004","84.068","0.001","82.649","0.001","89.914","0.001","3046.28","0.09","233","2","233","2","","","","","","","","6","P -1","-P 1","2","","","","- C69.5 H68 Cl2 O P4 Pd -","- C69.5 H56 Cl2 O P4 Pd -","- C139 H112 Cl4 O2 P8 Pd2 -","2","1","","Stallinger, Silvia; Reitsamer, Christian; Schuh, Walter; Kopacka, Holger; Wurst, Klaus; Peringer, Paul","Novel route to carbodiphosphoranes producing a new P,C,P pincer carbene ligand.","Chemical communications (Cambridge, England)","2007","","5","510","512","10.1039/b609723e","","","0.71073","MoKα","","0.0511","0.0411","","","0.1042","0.1098","","","","","","1.036","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101668","9.2897","0.0003","13.5853","0.0006","19.9199","0.0007","86.39","0.002","89.649","0.002","72.822","0.002","2396.84","0.16","233","2","233","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H51 Cl3 O3 P4 Pd -","- C51 H49 Cl3 O3 P4 Pd -","- C102 H98 Cl6 O6 P8 Pd2 -","2","1","","Stallinger, Silvia; Reitsamer, Christian; Schuh, Walter; Kopacka, Holger; Wurst, Klaus; Peringer, Paul","Novel route to carbodiphosphoranes producing a new P,C,P pincer carbene ligand.","Chemical communications (Cambridge, England)","2007","","5","510","512","10.1039/b609723e","","","0.71073","MoKα","","0.0635","0.042","","","0.0755","0.0813","","","","","","1.039","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101669","15.2377","0.0006","20.5124","0.0007","8.7621","0.0004","90","","90","","90","","2738.7","0.19","233","2","233","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C56 H51.5 Cl6.5 P4 -","- C56 H51.5 Cl6.5 P4 -","- C112 H103 Cl13 P8 -","2","0.5","","Stallinger, Silvia; Reitsamer, Christian; Schuh, Walter; Kopacka, Holger; Wurst, Klaus; Peringer, Paul","Novel route to carbodiphosphoranes producing a new P,C,P pincer carbene ligand.","Chemical communications (Cambridge, England)","2007","","5","510","512","10.1039/b609723e","","","0.71073","MoKα","","0.0596","0.0498","","","0.1229","0.1283","","","","","","1.027","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101670","9.548","0.0016","9.5862","0.0016","9.6682","0.0016","82.705","0.003","87.649","0.003","67.236","0.002","809.4","0.2","193","2","193","2","","","","","","","","4","P -1","-P 1","2","(1,3,7-trimethyl-1H-purine-2,6(3H,7H)-dione).(1,4- butanedicarboxylic acid)","(1,3,7-trimethyl-1H-purine-2,6(3H,7H)-dione).(1,4-butanedicarboxylic acid)","","- C14 H20 N4 O6 -","- C14 H20 N4 O6 -","- C28 H40 N8 O12 -","2","1","","Bucar, Dejan-Kresimir; Henry, Rodger F; Lou, Xiaochun; Borchardt, Thomas B; Zhang, Geoff G Z","A ""hidden"" co-crystal of caffeine and adipic acid.","Chemical communications (Cambridge, England)","2007","","5","525","527","10.1039/b611749j","","","0.71073","MoKα","","0.0454","0.0418","","","0.1195","0.1223","","","","","","1.066","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101671","12.5674","0.0005","13.0776","0.0005","17.2042","0.0006","81.738","0.002","80.966","0.002","67.9","0.002","2576.21","0.17","273","2","273","2","","","","","","","","8","P -1","-P 1","2","","","","- C24 H90 Mn4 N6 Na4 O89 P2 W18 -","- C24 H44 Mn4 N6 Na4 O89 P2 W18 -","- C24 H44 Mn4 N6 Na4 O89 P2 W18 -","1","0.5","","Ritchie, Chris; Burkholder, Eric M; Long, De-Liang; Adam, David; Kögerler, Paul; Cronin, Leroy","Exploiting the multifunctionality of organocations in the assembly of hybrid polyoxometalate clusters and networks.","Chemical communications (Cambridge, England)","2007","","5","468","470","10.1039/b612741j","","","0.71073","MoKα","","0.0591","0.04","","","0.0896","0.099","","","","","","1.046","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101672","12.218","0.002","55.659","0.01","23.647","0.004","90","","93.382","0.006","90","","16053","5","100","2","100","2","","","","","","","","8","C 1 2/m 1","-C 2y","12","","","","- C48 H155 Mn2 N12 Na2 O112 P3 W22 -","- C48 H96 Mn2 N12 Na2 O106.9 P3 W22 -","- C192 H384 Mn8 N48 Na8 O427.6 P12 W88 -","4","0.5","","Ritchie, Chris; Burkholder, Eric M; Long, De-Liang; Adam, David; Kögerler, Paul; Cronin, Leroy","Exploiting the multifunctionality of organocations in the assembly of hybrid polyoxometalate clusters and networks.","Chemical communications (Cambridge, England)","2007","","5","468","470","10.1039/b612741j","","","0.71073","MoKα","","0.0993","0.0713","","","0.1717","0.1909","","","","","","1.095","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101673","11.6029","0.0002","23.2657","0.0004","16.655","0.0003","90","","108.035","0.001","90","","4275.11","0.13","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H36 Cl0 Cu2 N8 O6 -","- C40 H36 Cu2 N8 O6 -","- C160 H144 Cu8 N32 O24 -","4","1","","Liu, Hsueh-Ju; Hung, Yu-Hsin; Chou, Chang-Chuan; Su, Chan-Cheng","Proton-controllable fluorescent switch based on interconversion of polynuclear and dinuclear copper(II) complexes.","Chemical communications (Cambridge, England)","2007","","5","495","497","10.1039/b613583h","","","0.71073","MoKα","","0.0771","0.0597","","","0.1757","0.1953","","","","","","0.736","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101674","10.902","0.0007","17.764","0.002","15.503","0.0016","90","","110.58","","90","","2810.7","0.5","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H36 Cl4 Cu2 N8 O20 -","- C40 H36 Cl4 Cu2 N8 O20 -","- C80 H72 Cl8 Cu4 N16 O40 -","2","0.5","","Liu, Hsueh-Ju; Hung, Yu-Hsin; Chou, Chang-Chuan; Su, Chan-Cheng","Proton-controllable fluorescent switch based on interconversion of polynuclear and dinuclear copper(II) complexes.","Chemical communications (Cambridge, England)","2007","","5","495","497","10.1039/b613583h","","","0.71073","MoKα","","0.158","0.0814","","","0.2138","0.2676","","","","","","0.759","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101675","10.395","0.004","10.988","0.004","11.511","0.005","73.43","0.03","78.5","0.03","82.51","0.03","1231.1","0.8","100","","","","","","","","","","","4","P -1","-P 1","2","","","","- C44 H78 N14 O8 -","- C44 H78 N14 O8 -","- C44 H78 N14 O8 -","1","0.5","","Igarashi, Kazuki; Nogami, Takashi; Ishida, Takayuki","Magnetic exchange coupling tunable by means of selective cation binding into poly(radical-armed) azacrowns.","Chemical communications (Cambridge, England)","2007","","5","501","503","10.1039/b613637k","","","0.71069","MoKα","","","0.053","","","","0.0937","","","","","","1.05","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101676","13.927","0.013","18.118","0.016","15.6","0.012","90","","101.47","0.07","90","","3858","6","90","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H54 Cl Li N9 O10 -","- C30 H54 Cl Li N9 O10 -","- C120 H216 Cl4 Li4 N36 O40 -","4","1","","Igarashi, Kazuki; Nogami, Takashi; Ishida, Takayuki","Magnetic exchange coupling tunable by means of selective cation binding into poly(radical-armed) azacrowns.","Chemical communications (Cambridge, England)","2007","","5","501","503","10.1039/b613637k","","","0.71069","MoKα","","","0.0534","","","","0.0588","","","","","","1.213","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101677","20.047","0.0008","13.5737","0.0005","22.9917","0.0008","90","","109.223","0.0015","90","","5907.5","0.4","100","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C47 H90 K N13 O11 S -","- C47 H90 K N13 O11 S -","- C188 H360 K4 N52 O44 S4 -","4","1","","Igarashi, Kazuki; Nogami, Takashi; Ishida, Takayuki","Magnetic exchange coupling tunable by means of selective cation binding into poly(radical-armed) azacrowns.","Chemical communications (Cambridge, England)","2007","","5","501","503","10.1039/b613637k","","","0.71069","MoKα","","","0.0535","","","","0.0774","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101678","14.5405","0.0003","25.0846","0.0003","38.3524","0.0008","90","","90","","90","","13988.8","0.4","123","2","123","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C69 H153 Mo12 N8 Na O78 P8 -","- C69 H110 Mo12 N8 Na O77.2 P8 -","- C276 H440 Mo48 N32 Na4 O308.8 P32 -","4","1","","Streb, Carsten; Long, De-Liang; Cronin, Leroy","Engineering porosity in a chiral heteropolyoxometalate-based framework: the supramolecular effect of benzenetricarboxylic acid.","Chemical communications (Cambridge, England)","2007","","5","471","473","10.1039/b613808j","","","0.71073","MoKα","","0.0992","0.0649","","","0.1465","0.1652","","","","","","1.028","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101679","10.485","0.005","14.553","0.005","14.702","0.005","70.4","0.005","70.773","0.005","72.287","0.005","1947.6","1.3","180","","180","","","","","","","","","4","P -1","-P 1","2","","","","- C72 H96 O24 Sn6 -","- C72 H96 O24 Sn6 -","- C72 H96 O24 Sn6 -","1","0.5","","Hahn, Uwe; Gégout, Aline; Duhayon, Carine; Coppel, Yannick; Saquet, Alix; Nierengarten, Jean-François","Self-assembly of fullerene-rich nanostructures with a stannoxane core.","Chemical communications (Cambridge, England)","2007","","5","516","518","10.1039/b614009b","","","0.71073","MoKα","","0.0589","0.0419","","0.0577","0.0502","0.0502","","","","","","1.0786","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101680","15.4887","0.0009","10.9902","0.0007","19.1428","0.0007","90","","91.009","0.003","90","","3258.1","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H55 N5 O2 U -","- C29 H55 N5 O2 U -","- C116 H220 N20 O8 U4 -","4","1","","Maynadié, Jérôme; Berthet, Jean-Claude; Thuéry, Pierre; Ephritikhine, Michel","The first cyclopentadienyl complex of uranyl.","Chemical communications (Cambridge, England)","2007","","5","486","488","10.1039/b617700j","","","0.71073","MoKα","","0.033","0.023","","","0.0496","0.0517","","","","","","1.041","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101681","13.1699","0.0014","16.1972","0.0017","14.1817","0.0014","90","","103.16","0.002","90","","2945.7","0.5","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H31 Cl N2 O5 -","- C35 H31 Cl N2 O5 -","- C140 H124 Cl4 N8 O20 -","4","1","","Galliford, Chris V; Martenson, James S; Stern, Charlotte; Scheidt, Karl A","A highly diastereoselective, catalytic three-component assembly reaction for the synthesis of spiropyrrolidinyloxindoles.","Chemical communications (Cambridge, England)","2007","","6","631","633","10.1039/b609155e","","","0.71073","MoKα","","0.1613","0.0524","","","0.1","0.133","","","","","","0.929","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7101682","20.9769","0.0019","13.9008","0.0012","12.2335","0.0011","90","","123.831","0.001","90","","2963.2","0.5","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C28 H32 Cu N2 O4 S4 -","- C28 H32 Cu N2 O4 S4 -","- C112 H128 Cu4 N8 O16 S16 -","4","1","","Bandini, Marco; Piccinelli, Fabio; Tommasi, Simona; Umani-Ronchi, Achille; Ventrici, Caterina","Highly enantioselective nitroaldol reaction catalyzed by new chiral copper complexes.","Chemical communications (Cambridge, England)","2007","","6","616","618","10.1039/b613019d","","","0.71073","MoKα","","0.0773","0.0602","","","0.1887","0.2073","","","","","","1.043","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101683","15.6334","0.0002","18.3691","0.0003","23.607","0.0003","90","","90","","90","","6779.26","0.16","223","2","223","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","Compound X","","","- C30.5 H25 Au Bi Cl F10 N2 -","- C30.5 H25 Au Bi Cl F10 N2 -","- C244 H200 Au8 Bi8 Cl8 F80 N16 -","8","1","","Fernández, Eduardo J; Laguna, Antonio; López-de-Luzuriaga, José M; Monge, Miguel; Nema, Mihai; Olmos, M Elena; Pérez, Javier; Silvestru, Cristian","Experimental and theoretical evidence of the first Au(i)...Bi(iii) interaction.","Chemical communications (Cambridge, England)","2007","","6","571","573","10.1039/b613365g","","","0.71073","MoKα","","0.1023","0.0477","","","0.0933","0.1097","","","","","","1.034","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101684","9.7615","0.0001","9.7615","0.0001","17.2273","0.0003","90","","90","","90","","1641.54","0.04","300","2","300","2","","","","","","","","7","P -4 21 c","P -4 2n","114","Bis(2,6-di(4-bromopyrazol-1-yl)pyridine)iron(ii) ditetrafluoroborate","Bis[2,6-di(4-bromopyrazol-1-yl)pyridine]iron(II) ditetrafluoroborate","","- C22 H14 B2 Br4 F8 Fe N10 -","- C22 H14 B2 Br4 F8 Fe N10 -","- C44 H28 B4 Br8 F16 Fe2 N20 -","2","0.25","","Pritchard, Ruth; Kilner, Colin A; Halcrow, Malcolm A","Iron(II) complexes with a terpyridine embrace packing motif show remarkably consistent cooperative spin-transitions.","Chemical communications (Cambridge, England)","2007","","6","577","579","10.1039/b613402e","","","0.71073","MoKα","","0.0423","0.036","","","0.0878","0.0916","","","","","","1.065","","","","has coordinates,has disorder","180118","2020-10-21","18:00:00",""
"7101685","9.5613","0.0001","9.5613","0.0001","17.3177","0.0003","90","","90","","90","","1583.16","0.04","300","2","300","2","","","","","","","","7","P -4 21 c","P -4 2n","114","Bis(2,6-di(4-chloropyrazol-1-yl)pyridine)iron(ii) ditetrafluoroborate","Bis[2,6-di(4-chloropyrazol-1-yl)pyridine]iron(II) ditetrafluoroborate","","- C22 H14 B2 Cl4 F8 Fe N10 -","- C22 H14 B2 Cl4 F8 Fe N10 -","- C44 H28 B4 Cl8 F16 Fe2 N20 -","2","0.25","","Pritchard, Ruth; Kilner, Colin A; Halcrow, Malcolm A","Iron(II) complexes with a terpyridine embrace packing motif show remarkably consistent cooperative spin-transitions.","Chemical communications (Cambridge, England)","2007","","6","577","579","10.1039/b613402e","","","0.71073","MoKα","","0.0457","0.0424","","","0.1166","0.1209","","","","","","1.079","","","","has coordinates,has disorder","180118","2020-10-21","18:00:00",""
"7101686","9.541","0.0003","9.541","0.0003","17.1024","0.0006","90","","90","","90","","1556.84","0.09","220","2","220","2","","","","","","","","7","P -4 21 c","P -4 2n","114","Bis(2,6-di(4-chloropyrazol-1-yl)pyridine)iron(ii) ditetrafluoroborate","Bis[2,6-di(4-chloropyrazol-1-yl)pyridine]iron(II) ditetrafluoroborate","","- C22 H14 B2 Cl4 F8 Fe N10 -","- C22 H14 B2 Cl4 F8 Fe N10 -","- C44 H28 B4 Cl8 F16 Fe2 N20 -","2","0.25","","Pritchard, Ruth; Kilner, Colin A; Halcrow, Malcolm A","Iron(II) complexes with a terpyridine embrace packing motif show remarkably consistent cooperative spin-transitions.","Chemical communications (Cambridge, England)","2007","","6","577","579","10.1039/b613402e","","","0.71073","MoKα","","0.0691","0.0574","","","0.1545","0.1612","","","","","","1.187","","","","has coordinates,has disorder","180118","2020-10-21","18:00:00",""
"7101687","9.6268","0.0003","9.6508","0.0003","16.5051","0.0005","90","","90.7285","0.0012","90","","1533.3","0.08","202","2","202","2","","","","","","","","7","P 1 21 1","P 2yb","4","Bis(2,6-di(4-chloropyrazol-1-yl)pyridine)iron(ii) ditetrafluoroborate","Bis[2,6-di(4-chloropyrazol-1-yl)pyridine]iron(II) ditetrafluoroborate","","- C22 H14 B2 Cl4 F8 Fe N10 -","- C22 H14 B1.98 Cl4 F7.92 Fe N10 -","- C44 H28 B3.96 Cl8 F15.84 Fe2 N20 -","2","1","","Pritchard, Ruth; Kilner, Colin A; Halcrow, Malcolm A","Iron(II) complexes with a terpyridine embrace packing motif show remarkably consistent cooperative spin-transitions.","Chemical communications (Cambridge, England)","2007","","6","577","579","10.1039/b613402e","","","0.71073","MoKα","","0.0791","0.0742","","","0.2038","0.2069","","","","","","1.128","","","","has coordinates,has disorder","180118","2020-10-21","18:00:00",""
"7101688","8.3869","0.0017","21.158","0.004","14.333","0.003","90","","90.72","0.03","90","","2543.2","0.9","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H90 N6 Na2 Zn2 -","- C44 H90 N6 Na2 Zn2 -","- C88 H180 N12 Na4 Zn4 -","2","0.5","","Armstrong, David R; Clegg, William; Dale, Sophie H; Graham, David V; Hevia, Eva; Hogg, Lorna M; Honeyman, Gordon W; Kennedy, Alan R; Mulvey, Robert E","Dizincation and dimagnesiation of benzene using alkali-metal-mediated metallation.","Chemical communications (Cambridge, England)","2007","","6","598","600","10.1039/b613655a","","","0.71073","MoKα","","0.0738","0.0367","","","0.0628","0.0719","","","","","","1.021","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101689","8.3042","0.0003","21.9621","0.0008","16.3052","0.0006","90","","91.458","0.002","90","","2972.74","0.19","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H108 Mg2 N8 Na2 -","- C54 H108 Mg2 N8 Na2 -","- C108 H216 Mg4 N16 Na4 -","2","0.5","","Armstrong, David R; Clegg, William; Dale, Sophie H; Graham, David V; Hevia, Eva; Hogg, Lorna M; Honeyman, Gordon W; Kennedy, Alan R; Mulvey, Robert E","Dizincation and dimagnesiation of benzene using alkali-metal-mediated metallation.","Chemical communications (Cambridge, England)","2007","","6","598","600","10.1039/b613655a","","","0.71073","MoKα","","0.1944","0.0684","","","0.1115","0.1471","","","","","","1.008","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101690","14.016","0.003","16.479","0.003","14.743","0.003","90","","112.21","0.03","90","","3152.4","1.1","180","2","180","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H20 Ga2 N2 -","- C14 H20 Ga2 N2 -","- C112 H160 Ga16 N16 -","8","1","","García, Felipe; Hopkins, Alexander D; Kowenicki, Richard A; McPartlin, Mary; Silvia, Jared S; Rawson, Jeremy M; Rogers, Michael C; Wright, Dominic S","Pyridyl 'ring-flipping' in the dimers [Me2E(2-py)]2 (E=B, Al, Ga; 2-py=2-pyridyl).","Chemical communications (Cambridge, England)","2007","","6","586","588","10.1039/b613748b","","","0.71073","MoKα","","0.054","0.0462","","","0.1178","0.1226","","","","","","1.367","","","","has coordinates,has disorder","180118","2020-10-21","18:00:00",""
"7101691","14.027","0.003","16.564","0.003","14.656","0.003","90","","112.26","0.03","90","","3151.5","1.1","180","2","180","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H20 Al2 N2 -","- C14 H20 Al2 N2 -","- C112 H160 Al16 N16 -","8","1","","García, Felipe; Hopkins, Alexander D; Kowenicki, Richard A; McPartlin, Mary; Silvia, Jared S; Rawson, Jeremy M; Rogers, Michael C; Wright, Dominic S","Pyridyl 'ring-flipping' in the dimers [Me2E(2-py)]2 (E=B, Al, Ga; 2-py=2-pyridyl).","Chemical communications (Cambridge, England)","2007","","6","586","588","10.1039/b613748b","","","0.71073","MoKα","","0.0846","0.0492","","","0.1208","0.1404","","","","","","1.03","","","","has coordinates,has disorder","180118","2020-10-21","18:00:00",""
"7101692","10.387","0.0001","11.1","0.0001","19.225","0.0003","90","","90","","90","","2216.56","0.05","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H28 Cl2 N2 O Pd -","- C20 H26 Cl2 N2 O Pd -","- C80 H104 Cl8 N8 O4 Pd4 -","4","1","","Rafii, Esfandiar; Dassonneville, Benjamin; Heumann, Andreas","Highly selective R,S-coordination of non racemic (1R,2R)-(1,2-dialkyl)-1,2-diamine cyclohexane derivatives to palladium dichloride.","Chemical communications (Cambridge, England)","2007","","6","583","585","10.1039/b613961b","","","0.71073","MoKα","","0.0253","0.0249","","","0.0712","0.0715","","","","","","1.151","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101693","14.214","0.005","9.039","0.001","16.311","0.003","90","","100.552","0.008","90","","2060.2","0.9","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C20 H24 Cl2 F2 N2 Pd -","- C20 H24 Cl2 F2 N2 Pd -","- C80 H96 Cl8 F8 N8 Pd4 -","4","2","","Rafii, Esfandiar; Dassonneville, Benjamin; Heumann, Andreas","Highly selective R,S-coordination of non racemic (1R,2R)-(1,2-dialkyl)-1,2-diamine cyclohexane derivatives to palladium dichloride.","Chemical communications (Cambridge, England)","2007","","6","583","585","10.1039/b613961b","","","0.71073","MoKα","","0.0668","0.0482","","","0.0965","0.1094","","","","","","1.048","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101694","17.6146","0.0005","12.2593","0.0003","17.4331","0.0003","90","","109.945","0.0015","90","","3538.76","0.15","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H60 N8 O2 U -","- C29 H60 N8 O2 U -","- C116 H240 N32 O8 U4 -","4","1","","Berthet, Jean-Claude; Thuéry, Pierre; Ephritikhine, Michel","The first actinyl cyanide.","Chemical communications (Cambridge, England)","2007","","6","604","606","10.1039/b614226e","","","0.71073","MoKα","","0.0276","0.0232","","","0.0642","0.0668","","","","","","1.083","","","","has coordinates","180118","2020-10-21","18:00:00",""
"7101695","9.861","0.007","10.732","0.006","10.822","0.007","99.976","0.007","113.714","0.008","91.109","0.007","1027.7","1.1","120","2","120","2","","","","","","","","5","P -1","-P 1","2","Bis(2,3,4,5,6-pentafluorophenyl)(2-(phenylazo)phenyl)borane","Bis(2,3,4,5,6-pentafluorophenyl)[2-(phenylazo)phenyl]borane","","- C24 H9 B F10 N2 -","- C24 H9 B F10 N2 -","- C48 H18 B2 F20 N4 -","2","1","","Yoshino, Junro; Kano, Naokazu; Kawashima, Takayuki","Synthesis of the most intensely fluorescent azobenzene by utilizing the B-N interaction.","Chemical communications (Cambridge, England)","2007","","6","559","561","10.1039/b615966d","","","0.7107","MoKα","","0.0405","0.0371","","","0.1037","0.1068","","","","","","1.089","","","","has coordinates,has disorder","202017","2020-10-21","18:00:00",""
"7101696","5.6784","0.0008","8.4377","0.0011","31.313","0.005","87.186","0.006","87.102","0.005","79.417","0.008","1471.7","0.4","293","","293","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C36 H22 F7 N O3 -","- C36 H22 F7 N O3 -","- C72 H44 F14 N2 O6 -","2","1","","Benanti, Travis L; Saejueng, Pranorm; Venkataraman, D","Segregated assemblies in bridged electron-rich and electron-poor pi-conjugated moieties.","Chemical communications (Cambridge, England)","2007","","7","692","694","10.1039/b610565c","","x-ray","0.71073","MoKα","","0.1842","0.0924","","","0.1918","0.2428","","","","","","1.151","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101697","5.8313","0.0003","8.9482","0.0005","36.872","0.0019","90.655","0.002","91.406","0.002","104.355","0.002","1863.03","0.17","293","","293","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C42 H28 F13 N O3 -","- C42 H28 F13 N O3 -","- C84 H56 F26 N2 O6 -","2","1","","Benanti, Travis L; Saejueng, Pranorm; Venkataraman, D","Segregated assemblies in bridged electron-rich and electron-poor pi-conjugated moieties.","Chemical communications (Cambridge, England)","2007","","7","692","694","10.1039/b610565c","","x-ray","0.71073","MoKα","","0.1775","0.1008","","","0.2332","0.2773","","","","","","1.047","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101698","7.9502","0.0003","9.5259","0.0004","49.289","0.002","88.749","0.001","90.236","0.001","87.669","0.002","3728.8","0.3","293","","293","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C38 H32 F13 N O5 -","- C38 H32 F13 N O5 -","- C152 H128 F52 N4 O20 -","4","2","","Benanti, Travis L; Saejueng, Pranorm; Venkataraman, D","Segregated assemblies in bridged electron-rich and electron-poor pi-conjugated moieties.","Chemical communications (Cambridge, England)","2007","","7","692","694","10.1039/b610565c","","x-ray","0.71073","MoKα","","0.1479","0.1089","","","0.312","0.3541","","","","","","1.439","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101699","9.329","0.005","17.981","0.005","25.306","0.005","90","","90","","90","","4245","3","293","","293","","","","","","","","synthesis as described","4","P c a b","-P 2bc 2ac","61","ps04.178","","","- C30 H17 N O2 -","- C30 H17 N O2 -","- C240 H136 N8 O16 -","8","1","","Benanti, Travis L; Saejueng, Pranorm; Venkataraman, D","Segregated assemblies in bridged electron-rich and electron-poor pi-conjugated moieties.","Chemical communications (Cambridge, England)","2007","","7","692","694","10.1039/b610565c","","x-ray","0.71069","MoKα","","0.131","0.0554","","","0.1236","0.1538","","","","","","0.989","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101700","12.14","0.005","5.718","0.005","29.183","0.005","90","0.005","96.673","0.005","90","0.005","2012","2","293","","293","","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 N O4 -","- C26 H21 N O4 -","- C104 H84 N4 O16 -","4","1","","Benanti, Travis L; Saejueng, Pranorm; Venkataraman, D","Segregated assemblies in bridged electron-rich and electron-poor pi-conjugated moieties.","Chemical communications (Cambridge, England)","2007","","7","692","694","10.1039/b610565c","","x-ray","0.71069","MoKα","","0.0655","0.0429","","","0.1065","0.1211","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101701","24.866","0.0006","5.275","0.0002","21.614","0.0011","90","","101.028","0.001","90","","2782.72","0.19","293","","293","","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H29 N O3 -","- C36 H29 N O3 -","- C144 H116 N4 O12 -","4","1","","Benanti, Travis L; Saejueng, Pranorm; Venkataraman, D","Segregated assemblies in bridged electron-rich and electron-poor pi-conjugated moieties.","Chemical communications (Cambridge, England)","2007","","7","692","694","10.1039/b610565c","","x-ray","0.71073","MoKα","","0.1623","0.0646","","","0.1227","0.1642","","","","","","1.062","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101702","9.7738","0.0012","13.1358","0.0016","9.8656","0.0012","90","","109.146","0.002","90","","1196.5","0.3","273","2","273","2","","","","","","","","6","P 1 21 1","P 2yb","4","((1-(2-Benzyloxy-phenyl)-2-nitro-ethyl)-diphenyl-phosphine)- borane complex","","","- C27 H27 B N O3 P -","- C27 H27 B N O3 P -","- C54 H54 B2 N2 O6 P2 -","2","1","","Bartoli, Giuseppe; Bosco, Marcella; Carlone, Armando; Locatelli, Manuela; Mazzanti, Andrea; Sambri, Letizia; Melchiorre, Paolo","Organocatalytic asymmetric hydrophosphination of nitroalkenes.","Chemical communications (Cambridge, England)","2007","","7","722","724","10.1039/b613477g","","","0.71073","MoKα","","0.0275","0.0271","","","0.0775","0.0779","","","","","","1.418","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101703","15.4022","0.0012","15.4022","0.0012","22.825","0.004","90","","90","","90","","5414.7","1","125","2","125","2","","","","","","","","3","P 4/n n c :2","-P 4a 2bc","126","para-octanoylcalix(4)arene","","","- C60 H80 O8 -","- C60 H80 O8 -","- C240 H320 O32 -","4","0.25","","Ananchenko, Gennady S; Udachin, Konstantin A; Pojarova, Michaela; Jebors, Said; Coleman, Anthony W; Ripmeester, John A","A molecular turnstile in para-octanoyl calix[4]arene nanocapsules.","Chemical communications (Cambridge, England)","2007","","7","707","709","10.1039/b613972h","","","0.7107","MoKα","","0.1447","0.1164","","","0.3371","0.3963","","","","","","1.918","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101704","12.6317","0.0015","15.6209","0.0018","15.658","0.0018","90.081","0.002","104.117","0.002","96.904","0.002","2973.1","0.6","125","2","125","2","","","","","","","","3","P -1","-P 1","2","para-octanoylcalix(4)arene + acetone","","","- C66 H92 O10 -","- C66 H92 O10 -","- C132 H184 O20 -","2","1","","Ananchenko, Gennady S; Udachin, Konstantin A; Pojarova, Michaela; Jebors, Said; Coleman, Anthony W; Ripmeester, John A","A molecular turnstile in para-octanoyl calix[4]arene nanocapsules.","Chemical communications (Cambridge, England)","2007","","7","707","709","10.1039/b613972h","","","0.7107","MoKα","","0.1726","0.1122","","","0.3413","0.3959","","","","","","1.328","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101705","11.609","0.003","15.012","0.004","15.233","0.004","77.218","0.007","89.814","0.006","83.368","0.007","2570.9","1.1","125","2","125","2","","","","","","","","3","P -1","-P 1","2","para-octanoylcalix(4)arene","","","- C60 H80 O8 -","- C60 H80 O8 -","- C120 H160 O16 -","2","1","","Ananchenko, Gennady S; Udachin, Konstantin A; Pojarova, Michaela; Jebors, Said; Coleman, Anthony W; Ripmeester, John A","A molecular turnstile in para-octanoyl calix[4]arene nanocapsules.","Chemical communications (Cambridge, England)","2007","","7","707","709","10.1039/b613972h","","","0.7107","MoKα","","0.1346","0.081","","","0.1901","0.2256","","","","","","1.024","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101706","10.6887","0.0009","10.6887","0.0009","6.6917","0.0011","90","","90","","120","","662.09","0.13","293","2","293","2","","","","","","","","5","P -3","-P 3","147","","","","- F2 Na13 Nb3 O28 P6 -","- F1.98 Na13 Nb3 O28.02 P6 -","- F1.98 Na13 Nb3 O28.02 P6 -","1","0.166667","","Liu, Guang-Zhen; Zheng, Shou-Tian; Yang, Guo-Yu","A (4,2)-connected niobium phosphate Na13Nb3P6O28F2 with a unique 6.12-net layer: synthesis, structure and ion exchange properties.","Chemical communications (Cambridge, England)","2007","","7","751","753","10.1039/b614265f","","","0.71073","MoKα","","0.0683","0.0676","","","0.1308","0.1311","","","","","","1.047","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101707","24.932","0.006","8.345","0.003","10.856","0.003","90","","108.65","0.02","90","","2140.3","1","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C23 H24.5 N2 O2.25 S -","- C23 H24 N2 O2.25 S -","- C92 H96 N8 O9 S4 -","4","1","","Betson, Mark S; Bracegirdle, Ann; Clayden, Jonathan; Helliwell, Madeleine; Lund, Andrew; Pickworth, Mark; Snape, Timothy J; Worrall, Christopher P","Achieving conformational control over C-C, C-N and C-O bonds in biaryls, N,N'-diarylureas and diaryl ethers: advantages of a relay axis.","Chemical communications (Cambridge, England)","2007","","7","754","756","10.1039/b614618j","","","0.71073","MoKα","","0.0997","0.0425","","","0.0761","0.0955","","","","","","0.802","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101708","8.3358","0.0011","12.262","0.0017","20.222","0.003","90","","98.368","0.002","90","","2044.9","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 O3 S -","- C22 H30 O3 S -","- C88 H120 O12 S4 -","4","1","","Betson, Mark S; Bracegirdle, Ann; Clayden, Jonathan; Helliwell, Madeleine; Lund, Andrew; Pickworth, Mark; Snape, Timothy J; Worrall, Christopher P","Achieving conformational control over C-C, C-N and C-O bonds in biaryls, N,N'-diarylureas and diaryl ethers: advantages of a relay axis.","Chemical communications (Cambridge, England)","2007","","7","754","756","10.1039/b614618j","","","0.71073","MoKα","","0.056","0.0496","","","0.143","0.1477","","","","","","1.058","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101709","25.675","0.003","39.811","0.004","7.9886","0.0008","90","","90","","90","","8165.5","1.5","100","2","100","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C22 H29 N3 O2 -","- C22 H29 N3 O2 -","- C352 H464 N48 O32 -","16","1","","Betson, Mark S; Bracegirdle, Ann; Clayden, Jonathan; Helliwell, Madeleine; Lund, Andrew; Pickworth, Mark; Snape, Timothy J; Worrall, Christopher P","Achieving conformational control over C-C, C-N and C-O bonds in biaryls, N,N'-diarylureas and diaryl ethers: advantages of a relay axis.","Chemical communications (Cambridge, England)","2007","","7","754","756","10.1039/b614618j","","","0.71073","MoKα","","0.0355","0.0298","","","0.0656","0.0672","","","","","","0.985","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101710","9.528","0.0005","15.82","0.0008","20.141","0.001","90","","90","","90","","3035.9","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C33 H42 N4 O3 -","- C33 H42 N4 O3 -","- C132 H168 N16 O12 -","4","1","","Betson, Mark S; Bracegirdle, Ann; Clayden, Jonathan; Helliwell, Madeleine; Lund, Andrew; Pickworth, Mark; Snape, Timothy J; Worrall, Christopher P","Achieving conformational control over C-C, C-N and C-O bonds in biaryls, N,N'-diarylureas and diaryl ethers: advantages of a relay axis.","Chemical communications (Cambridge, England)","2007","","7","754","756","10.1039/b614618j","","","0.71073","MoKα","","0.0415","0.0355","","","0.0841","0.0861","","","","","","1.024","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101711","5.4015","0.0002","10.6598","0.0004","13.0093","0.0005","90","","99.248","0.004","90","","739.33","0.05","100","1","100","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H16 Br N O4 -","- C15 H16 Br N O4 -","- C30 H32 Br2 N2 O8 -","2","1","","Zhao, Gui-Ling; Xu, Yongmei; Sundén, Henrik; Eriksson, Lars; Sayah, Mahmoud; Córdova, Armando","Organocatalytic enantioselective conjugate addition of aldehydes to maleimides.","Chemical communications (Cambridge, England)","2007","","7","734","735","10.1039/b614962f","","","0.71073","MoKα","","0.0985","0.0363","","","0.0396","0.046","","","","","","0.669","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101712","11.1816","0.0005","21.107","0.001","18.277","0.001","90","","106.687","0.003","90","","4131.9","0.4","100","2","100","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C146 H16 F16 -","- C146 H14 F16 -","- C292 H28 F32 -","2","0.5","","Goryunkov, Alexey A; Ioffe, Ilya N; Khavrel, Pavel A; Avdoshenko, Stanislav M; Markov, Vitaly Yu; Mazej, Z; Sidorov, Lev N; Troyanov, Sergey I","The former ""C60F16"" is actually a double-caged adduct: (C60F16)(C60).","Chemical communications (Cambridge, England)","2007","","7","704","706","10.1039/b615457c","","","0.91","synchrotron","","0.1103","0.0756","","","0.1815","0.1944","","","","","","1.355","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101713","11.7","0.002","12.012","0.002","12.815","0.002","77.95","0.03","73.18","0.03","78.95","0.03","1669.3","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C36.5 H44 Mo N2 O5 -","- C36.5 H44 Mo N2 O5 -","- C73 H88 Mo2 N4 O10 -","2","1","","Lyashenko, Ganna; Saischek, Gerald; Pal, Aritra; Herbst-Irmer, Regine; Mösch-Zanetti, Nadia C","Molecular oxygen activation by a molybdenum(IV) monooxo bis(beta-ketiminato) complex.","Chemical communications (Cambridge, England)","2007","","7","701","703","10.1039/b617199k","","","1.54178","CuKα","","0.0291","0.0256","","","0.0649","0.0673","","","","","","1.069","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101714","9.6357","0.0016","14.869","0.003","10.9996","0.0017","90","","103.461","0.005","90","","1532.6","0.5","100","2","100","","","","","","","","","4","P 1 21 1","P 2yb","4","(7S,7aR)-3-Acetyl-4-benzyl-7-methyl-1,4,5,6,7,7a- hexahydropyrrolo(3,2-b)pyridin-2-one","","","- C17 H20 N2 O2 -","- C17 H20 N2 O2 -","- C68 H80 N8 O8 -","4","2","","Bower, John F; Riis-Johannessen, Thomas; Szeto, Peter; Whitehead, Andrew J; Gallagher, Timothy","Stereospecific construction of substituted piperidines. Synthesis of (-)-paroxetine and (+)-laccarin.","Chemical communications (Cambridge, England)","2007","","7","728","730","10.1039/b617260a","","x-ray","1.5418","CuKα","","0.0722","0.0647","","","0.1679","0.1783","","","","","","1.021","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101715","10.4165","0.0002","17.3501","0.0005","19.9124","0.0006","67.651","0.001","88.601","0.002","79.776","0.002","3271.88","0.15","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C66 H81 I4 N4 P -","- C66 H81 I4 N4 P -","- C132 H162 I8 N8 P2 -","2","1","","Hitchcock, Peter B; Lappert, Michael F; Li, Gang; Protchenko, Andrey V","beta-Diiminato ligand (L) transformations in reactions of KL with PI3 and I2 [L = {N(C6H3Pr(i)2-2,6)C(H)}2CPh].","Chemical communications (Cambridge, England)","2007","","8","846","848","10.1039/b611260a","","x-ray","0.71073","MoKα","","0.1014","0.0552","","","0.0958","0.1113","","","","","","1.02","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101716","21.8936","0.0005","13.9582","0.0003","12.3029","0.0003","90","","90","","90","","3759.71","0.15","173","2","173","2","","","","","","","synthesis as described","4","P n c 2","P 2 -2bc","30","","","","- C33 H41 I5 N2 -","- C33 H41 I5 N2 -","- C132 H164 I20 N8 -","4","1","","Hitchcock, Peter B; Lappert, Michael F; Li, Gang; Protchenko, Andrey V","beta-Diiminato ligand (L) transformations in reactions of KL with PI3 and I2 [L = {N(C6H3Pr(i)2-2,6)C(H)}2CPh].","Chemical communications (Cambridge, England)","2007","","8","846","848","10.1039/b611260a","","x-ray","0.71073","MoKα","","0.0554","0.0393","","","0.0796","0.0854","","","","","","1.02","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101717","10.2719","0.0003","12.4868","0.0003","14.3087","0.0005","109.992","0.002","99.77","0.001","100.197","0.002","1644.02","0.08","173","2","173","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C39 H47 B N6 -","- C39 H47 B N6 -","- C78 H94 B2 N12 -","2","1","","Aragón Sáez, Pedro J; Oakley, Sarah H; Coles, Martyn P; Hitchcock, Peter B","Poly{guanidinium} salts: application in the preparation of a coordinatively saturated aluminium cation.","Chemical communications (Cambridge, England)","2007","","8","816","818","10.1039/b611343e","","x-ray","0.71073","MoKα","","0.0621","0.0458","","","0.1063","0.1147","","","","","","1.034","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101718","13.8838","0.0003","16.026","0.0003","17.2417","0.0004","114.855","0.001","93.524","0.001","91.947","0.001","3466.8","0.13","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C39 H48 B Cl N6 -","- C39 H48 B Cl N6 -","- C156 H192 B4 Cl4 N24 -","4","2","","Aragón Sáez, Pedro J; Oakley, Sarah H; Coles, Martyn P; Hitchcock, Peter B","Poly{guanidinium} salts: application in the preparation of a coordinatively saturated aluminium cation.","Chemical communications (Cambridge, England)","2007","","8","816","818","10.1039/b611343e","","x-ray","0.71073","MoKα","","0.0905","0.0563","","","0.1235","0.1403","","","","","","1.015","","","","has coordinates,has disorder","202017","2020-10-21","18:00:00",""
"7101719","10.8106","0.0002","19.9865","0.0004","21.7023","0.0003","66.307","0.001","87.632","0.001","74.326","0.001","4122.18","0.13","173","2","173","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C45 H60 Al B N6 O -","- C45 H60 Al B N6 O -","- C180 H240 Al4 B4 N24 O4 -","4","2","","Aragón Sáez, Pedro J; Oakley, Sarah H; Coles, Martyn P; Hitchcock, Peter B","Poly{guanidinium} salts: application in the preparation of a coordinatively saturated aluminium cation.","Chemical communications (Cambridge, England)","2007","","8","816","818","10.1039/b611343e","","x-ray","0.71073","MoKα","","0.0949","0.0607","","","0.1455","0.167","","","","","","0.959","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101720","14.0485","0.0012","15.7647","0.0014","15.772","0.002","116.174","0.002","108.739","0.002","98.205","0.002","2797.4","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","(Cu7(M)(m3-OH)2(m-OCH3)(HOCH3)2(H2O)(NO3)(N3)2)2(NO3)4 9H2O","","","- C78 H120 Cu14 N30 O51 -","- C78 H90 Cu14 N26 O30 -","- C78 H90 Cu14 N26 O30 -","1","0.5","","Tandon, Santokh S; Bunge, Scott D; Thompson, Laurence K","A tetradecanuclear copper dimeric macrocyclic complex with a body-centred heptanuclear core-structure and magnetism.","Chemical communications (Cambridge, England)","2007","","8","798","800","10.1039/b612795a","","","0.71073","MoKα","","0.0746","0.0536","","","0.1428","0.1581","","","","","","0.744","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101721","9.6678","0.0014","11.1324","0.0017","16.858","0.003","90","","101.138","0.003","90","","1780.2","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H24 O6 -","- C19 H24 O6 -","- C76 H96 O24 -","4","1","","Muthusamy, Sengodagounder; Krishnamurthi, Janagiraman; Suresh, Eringathodi","Multicomponent reactions involving tricyclooxonium ylide intermediate: diastereoselective synthesis of mono- and bisalkoxyoctahydro-1,4-benzodioxocin-6(5H)-one frameworks.","Chemical communications (Cambridge, England)","2007","","8","861","863","10.1039/b613008a","","","0.71073","MoKα","","0.1063","0.0649","","","0.1588","0.1919","","","","","","1.126","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101722","42.363","0.003","19.886","0.0013","22.7939","0.0015","90","","102.349","0.003","90","","18758","2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C92 H111 Cl2 Cu N5 O14 -","- C92 H111 Cu N5 O6 -","- C736 H888 Cu8 N40 O48 -","8","1","","Izzet, Guillaume; Zeng, Xianshun; Akdas, Huriye; Marrot, Jérôme; Reinaud, Olivia","Drastic effects of the second coordination sphere on neutral vs. anionic guest binding to a biomimetic Cu(II) center embedded in a calix[6]aza-cryptand.","Chemical communications (Cambridge, England)","2007","","8","810","812","10.1039/b613564a","","","0.71073","MoKα","","0.1643","0.1578","","","0.3934","0.3976","","","","","","1.047","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101723","11.956","0.002","12.718","0.004","18.674","0.008","69.91","0.02","80.92","0.02","74.67","0.02","2564.8","1.4","150","2","150","2","","","","","","","","7","P -1","-P 1","2","Cyclopentadienyl-1,4,7-triphospha-1,4-bis(2-fluorophenyl)-7- phenyl (5,6),(8,9)dibenzocyclononane iron (ii) tetraphenylborate acetonitrile solvate","Cyclopentadienyl-1,4,7-triphospha-1,4-bis(2-fluorophenyl)-7-phenyl [5,6],[8,9]dibenzocyclononane iron (ii) tetraphenylborate acetonitrile solvate","","- C63 H53 B F2 Fe N P3 -","- C63 H53 B F2 Fe N P3 -","- C126 H106 B2 F4 Fe2 N2 P6 -","2","1","","Albers, Thomas; Edwards, Peter G","Template synthesis of benzannulated triphosphacyclononanes‒a new class of phosphacrowns via template assisted nucleophilic P-C bond formation.","Chemical communications (Cambridge, England)","2007","","8","858","860","10.1039/b613672a","","","0.71073","MoKα","","0.0649","0.0404","","","0.0958","0.1121","","","","","","1.024","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101724","16.4095","0.0012","16.4309","0.0012","26.131","0.002","73.942","0.005","73.998","0.005","75.933","0","6401.38","0.9","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C172 H320 Co2 F16 Ga14 N2 O64 -","- C86 H160 Co1.04 F8 Ga7.04 N O32 -","- C172 H320 Co2.08 F16 Ga14.08 N2 O64 -","2","1","","Sañudo, E Carolina; Muryn, Christopher A; Helliwell, Madeleine A; Timco, Grigore A; Wernsdorfer, Wolfgang; Winpenny, Richard E P","Al, Ga and In heterometallic wheels and their by-products.","Chemical communications (Cambridge, England)","2007","","8","801","803","10.1039/b613877b","","","0.71073","MoKα","","0.2973","0.0763","","","0.1794","0.2193","","","","","","0.72","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101725","25.041","0.002","16.621","0.003","31.514","0.004","90","","102.172","0.009","90","","12821","3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C93 H168 F8 Ga7 N Ni O32 -","- C93 H168 F8 Ga7 N Ni O32 -","- C372 H672 F32 Ga28 N4 Ni4 O128 -","4","1","","Sañudo, E Carolina; Muryn, Christopher A; Helliwell, Madeleine A; Timco, Grigore A; Wernsdorfer, Wolfgang; Winpenny, Richard E P","Al, Ga and In heterometallic wheels and their by-products.","Chemical communications (Cambridge, England)","2007","","8","801","803","10.1039/b613877b","","","0.7107","MoKα","","0.0942","0.0493","","","0.136","0.1491","","","","","","0.955","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101726","25.907","0.004","16.463","0.003","31.224","0.005","90","","110.983","0.015","90","","12435","4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C86 H160 F8 In7 N Ni O32 -","- C86 F8 In7 N Ni O32 -","- C344 F32 In28 N4 Ni4 O128 -","4","1","","Sañudo, E Carolina; Muryn, Christopher A; Helliwell, Madeleine A; Timco, Grigore A; Wernsdorfer, Wolfgang; Winpenny, Richard E P","Al, Ga and In heterometallic wheels and their by-products.","Chemical communications (Cambridge, England)","2007","","8","801","803","10.1039/b613877b","","","0.7107","MoKα","","0.2151","0.1241","","","0.3113","0.3898","","","","","","1.424","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101727","26.016","0.005","20.219","0.004","25.896","0.005","90","","111","0.03","90","","12717","4","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C344 H640 Al28 F32 N4 Ni4 O128 -","- C344 H640 Al28.08 F32 N4 Ni4 O128 -","- C344 H640 Al28.08 F32 N4 Ni4 O128 -","1","0.125","","Sañudo, E Carolina; Muryn, Christopher A; Helliwell, Madeleine A; Timco, Grigore A; Wernsdorfer, Wolfgang; Winpenny, Richard E P","Al, Ga and In heterometallic wheels and their by-products.","Chemical communications (Cambridge, England)","2007","","8","801","803","10.1039/b613877b","","","0.846","synchrotron","","0.1257","0.1184","","","0.3005","0.3047","","","","","","1.175","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101728","15.0221","0.0007","12.3977","0.0006","39.2275","0.0015","90","","94.561","0.003","90","","7282.6","0.6","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C57 H107 F0 In2 N Ni O23 -","- C57 H107 In2 N Ni O23 -","- C228 H428 In8 N4 Ni4 O92 -","4","1","","Sañudo, E Carolina; Muryn, Christopher A; Helliwell, Madeleine A; Timco, Grigore A; Wernsdorfer, Wolfgang; Winpenny, Richard E P","Al, Ga and In heterometallic wheels and their by-products.","Chemical communications (Cambridge, England)","2007","","8","801","803","10.1039/b613877b","","","0.7107","MoKα","","0.1272","0.0932","","","0.1715","0.183","","","","","","1.099","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101729","26.3713","0.0015","23.9207","0.0016","29.0728","0.0016","90","","90","","90","","18339.7","1.9","100","2","100","2","","","","","","","","6","A b a 2","A 2 -2ab","41","","","","- C64.5 H120 In2 N Ni2 O27 -","- C64.5 H122 In2 N Ni2 O27 -","- C516 H976 In16 N8 Ni16 O216 -","8","","","Sañudo, E Carolina; Muryn, Christopher A; Helliwell, Madeleine A; Timco, Grigore A; Wernsdorfer, Wolfgang; Winpenny, Richard E P","Al, Ga and In heterometallic wheels and their by-products.","Chemical communications (Cambridge, England)","2007","","8","801","803","10.1039/b613877b","","","0.71073","MoKα","","0.0916","0.0773","","","0.2077","0.2255","","","","","","1.056","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101730","13.6807","0.0005","14.616","0.0007","16.7701","0.0006","95.458","0.004","102.446","0.003","116.862","0.003","2849","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H80 In2 N2 Ni2 O18 -","- C44 H80 In2 N2 Ni2 O18 -","- C88 H160 In4 N4 Ni4 O36 -","2","1","","Sañudo, E Carolina; Muryn, Christopher A; Helliwell, Madeleine A; Timco, Grigore A; Wernsdorfer, Wolfgang; Winpenny, Richard E P","Al, Ga and In heterometallic wheels and their by-products.","Chemical communications (Cambridge, England)","2007","","8","801","803","10.1039/b613877b","","","0.7107","MoKα","","0.0342","0.0246","","","0.0637","0.0668","","","","","","1.105","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101731","13.7366","0.0004","14.6428","0.0004","16.7555","0.0007","95.802","0.008","102.151","0.003","116.952","0.002","2861.24","0.17","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H80 Co2 In2 N2 O18 -","- C44 H80 Co2 In2 N2 O18 -","- C88 H160 Co4 In4 N4 O36 -","2","1","","Sañudo, E Carolina; Muryn, Christopher A; Helliwell, Madeleine A; Timco, Grigore A; Wernsdorfer, Wolfgang; Winpenny, Richard E P","Al, Ga and In heterometallic wheels and their by-products.","Chemical communications (Cambridge, England)","2007","","8","801","803","10.1039/b613877b","","","0.7107","MoKα","","0.0382","0.0266","","","0.0667","0.069","","","","","","1.058","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101732","12.2414","0.0018","15.4122","0.0013","16.57","0.003","87.559","0.013","69.407","0.013","77.147","0.009","2851","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C84 H182 Al4 F14 N4 O24 -","- C84 H182 Al4 F14 N4 O24 -","- C84 H182 Al4 F14 N4 O24 -","1","0.5","","Sañudo, E Carolina; Muryn, Christopher A; Helliwell, Madeleine A; Timco, Grigore A; Wernsdorfer, Wolfgang; Winpenny, Richard E P","Al, Ga and In heterometallic wheels and their by-products.","Chemical communications (Cambridge, England)","2007","","8","801","803","10.1039/b613877b","","","0.7107","MoKα","","0.121","0.0958","","","0.2597","0.2977","","","","","","1.118","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101733","13.772","0.0014","13.592","0.0014","8.548","0.0008","90","","101.364","0.003","90","","1568.7","0.3","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","TACNCU3","","","- C18 H50 Cl4 Cu2 N6 O4 -","- C18 H42 Cl4 Cu2 N6 O4 -","- C36 H84 Cl8 Cu4 N12 O8 -","2","0.5","","Steed, Jonathan W; Goeta, Andrés E; Lipkowski, Janusz; Swierczynski, Dariusz; Panteleon, Vicky; Handa, Sheetal","Templated crystal nucleation: mixed crystals of very different copper(II) N,N',N''-trimethyltriazacyclononane complexes.","Chemical communications (Cambridge, England)","2007","","8","813","815","10.1039/b614043b","","","0.71073","MoKα","","0.0494","0.0444","","","0.1223","0.1283","","","","","","1.048","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101734","13.791","0.0003","14.531","0.0002","15.053","0.0004","90","","90","","90","","3016.58","0.11","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C9.5 H22 Cl3 Cu N3 -","- C9.5 H22 Cl3 Cu N3 -","- C76 H176 Cl24 Cu8 N24 -","8","1","","Steed, Jonathan W; Goeta, Andrés E; Lipkowski, Janusz; Swierczynski, Dariusz; Panteleon, Vicky; Handa, Sheetal","Templated crystal nucleation: mixed crystals of very different copper(II) N,N',N''-trimethyltriazacyclononane complexes.","Chemical communications (Cambridge, England)","2007","","8","813","815","10.1039/b614043b","","","0.7107","MoKα","","0.0403","0.0371","","","0.1008","0.1039","","","","","","1.031","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101735","15.05399","0.00005","15.05399","","3.96845","0.000015","90","","90","","120","","778.852","0.005","","","","","","","","","","","","2","P 6/m","-P 6","175","Na Ge3","","","- Ge12.31 Na2.85 -","- Ge12.3085 Na2.851 -","- Ge24.617 Na5.702 -","2","0.166667","","Beekman, Matt; Kaduk, James A; Huang, Qing; Wong-Ng, Winnie; Yang, Zhi; Wang, Dongli; Nolas, George S","Synthesis and crystal structure of Na1-xGe3+z: a novel zeolite-like framework phase in the Na-Ge system.","Chemical communications (Cambridge, England)","2007","","8","837","839","10.1039/b614048c","powder diffraction","","","","","","","","","","","","","1.47","","","","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101736","15.0052","0.0004","15.0052","","3.95456","0.00013","90","","90","","120","","771.1","0.04","","","","","","","","","","","","2","P 6/m","-P 6","175","Na1-xGe3, neutron,4K","","","- Ge3.25 Na -","- Ge3.25001 Na -","- Ge26 Na8 -","8","0.666667","","Beekman, Matt; Kaduk, James A; Huang, Qing; Wong-Ng, Winnie; Yang, Zhi; Wang, Dongli; Nolas, George S","Synthesis and crystal structure of Na1-xGe3+z: a novel zeolite-like framework phase in the Na-Ge system.","Chemical communications (Cambridge, England)","2007","","8","837","839","10.1039/b614048c","powder diffraction","","","","","","","","","","","","","1.21","","","","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101737","15.06406","0.00032","15.06406","","3.96727","0.00013","90","","90","","120","","779.662","0.026","","","","","","","","","","","","2","P 6/m","-P 6","175","Na1-xGe3, neutron, RT","","","- Ge3.24 Na -","- Ge3.2445 Na -","- Ge25.956 Na8 -","8","0.666667","","Beekman, Matt; Kaduk, James A; Huang, Qing; Wong-Ng, Winnie; Yang, Zhi; Wang, Dongli; Nolas, George S","Synthesis and crystal structure of Na1-xGe3+z: a novel zeolite-like framework phase in the Na-Ge system.","Chemical communications (Cambridge, England)","2007","","8","837","839","10.1039/b614048c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101738","5.6455","0.0022","5.6455","","5.6455","","90","","90","","90","","179.93","0.21","","","","","","","","","","","","1","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Ge -","- Ge -","- Ge16 -","16","0.0833333","","Beekman, Matt; Kaduk, James A; Huang, Qing; Wong-Ng, Winnie; Yang, Zhi; Wang, Dongli; Nolas, George S","Synthesis and crystal structure of Na1-xGe3+z: a novel zeolite-like framework phase in the Na-Ge system.","Chemical communications (Cambridge, England)","2007","","8","837","839","10.1039/b614048c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101739","5.6575","0.002","5.6575","","5.6575","","90","","90","","90","","181.08","0.19","","","","","","","","","","","","1","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Ge -","- Ge -","- Ge16 -","16","0.0833333","","Beekman, Matt; Kaduk, James A; Huang, Qing; Wong-Ng, Winnie; Yang, Zhi; Wang, Dongli; Nolas, George S","Synthesis and crystal structure of Na1-xGe3+z: a novel zeolite-like framework phase in the Na-Ge system.","Chemical communications (Cambridge, England)","2007","","8","837","839","10.1039/b614048c","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101740","18.9996","0.0016","18.9996","0.0016","45.997","0.008","90","","90","","120","","14380","7","150","2","150","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C71.4 H67.6 N7.8 Ni3 O17.8 -","- C57 H33 N3 Ni3 O13 -","- C342 H198 N18 Ni18 O78 -","6","0.166667","","Jia, Junhua; Lin, Xiang; Wilson, Claire; Blake, Alexander J; Champness, Neil R; Hubberstey, Peter; Walker, Gavin; Cussen, Edmund J; Schröder, Martin","Twelve-connected porous metal-organic frameworks with high H(2) adsorption.","Chemical communications (Cambridge, England)","2007","","8","840","842","10.1039/b614254k","","","0.71073","MoKα","","0.0491","0.0423","","","0.1265","0.1293","","","","","","1.089","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101741","19.2442","0.0014","19.2442","0.0014","45.613","0.007","90","","90","","120","","14629","2","150","2","150","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C69 H61 Fe3 N7 O17 -","- C57 H33 Fe3 N3 O13 -","- C342 H198 Fe18 N18 O78 -","6","0.166667","","Jia, Junhua; Lin, Xiang; Wilson, Claire; Blake, Alexander J; Champness, Neil R; Hubberstey, Peter; Walker, Gavin; Cussen, Edmund J; Schröder, Martin","Twelve-connected porous metal-organic frameworks with high H(2) adsorption.","Chemical communications (Cambridge, England)","2007","","8","840","842","10.1039/b614254k","","","0.6906","synchrotron","","0.0928","0.0623","","","0.1668","0.1772","","","","","","1.014","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101742","6.7769","0.0004","9.7641","0.0008","11.4462","0.0008","76.916","0.005","80.416","0.004","74.897","0.004","707.58","0.09","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H18 Cl N O2 S -","- C13 H18 Cl N O2 S -","- C26 H36 Cl2 N2 O4 S2 -","2","1","","Jaseer, E A; Naidu, Ajay B; Kumar, Sreehari S; Rao, R Koteshwar; Thakur, Krishna G; Sekar, G","Highly stereoselective chlorination of beta-substituted cyclic alcohols using PPh3-NCS: factors that control the stereoselectivity.","Chemical communications (Cambridge, England)","2007","","8","867","869","10.1039/b614512d","","","0.71073","MoKα","","0.0757","0.0626","","","0.1578","0.1733","","","","","","1.081","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101743","7.2564","0.0006","7.4017","0.0005","15.5988","0.0013","88.923","0.005","85.403","0.005","62.334","0.004","739.47","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H19 N O5 -","- C15 H19 N O5 -","- C30 H38 N2 O10 -","2","1","","Jaseer, E A; Naidu, Ajay B; Kumar, Sreehari S; Rao, R Koteshwar; Thakur, Krishna G; Sekar, G","Highly stereoselective chlorination of beta-substituted cyclic alcohols using PPh3-NCS: factors that control the stereoselectivity.","Chemical communications (Cambridge, England)","2007","","8","867","869","10.1039/b614512d","","","0.71073","MoKα","","0.0999","0.0826","","","0.2441","0.2637","","","","","","1.199","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101744","18.693","0.0018","9.9424","0.0008","14.9984","0.0016","90","","122.342","0.01","90","","2355.1","0.4","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H16 N2 O3 -","- C12 H16 N2 O3 -","- C96 H128 N16 O24 -","8","1","","Jaseer, E A; Naidu, Ajay B; Kumar, Sreehari S; Rao, R Koteshwar; Thakur, Krishna G; Sekar, G","Highly stereoselective chlorination of beta-substituted cyclic alcohols using PPh3-NCS: factors that control the stereoselectivity.","Chemical communications (Cambridge, England)","2007","","8","867","869","10.1039/b614512d","","","0.71073","MoKα","","0.0827","0.0526","","","0.1701","0.1973","","","","","","1.279","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101745","20.5816","0.0009","20.9291","0.0011","12.3807","0.0004","90","","94.419","0.003","90","","5317.2","0.4","173","2","173","2","","","","","","","synthesis as described","4","C 1 2/c 1","-C 2yc","15","","","","- C52 H92 Mn2 Si4 -","- C52 H92 Mn2 Si4 -","- C208 H368 Mn8 Si16 -","4","0.5","","Balazs, Gabor; Cloke, F Geoffrey N; Harrison, Andrew; Hitchcock, Peter B; Green, Jennifer; Summerscales, Owen T","Mn2 bis(pentalene): a mixed-spin bimetallic with two extremes of bonding within the same molecule.","Chemical communications (Cambridge, England)","2007","","8","873","875","10.1039/b614765h","","x-ray","0.71073","MoKα","","0.0977","0.0672","","","0.1534","0.1683","","","","","","1.09","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101746","11.1869","0.0009","24.34","0.002","11.6741","0.0011","90","","93.714","0.01","90","","3172.1","0.5","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C34 H51 N3 -","- C34 H51 N3 -","- C136 H204 N12 -","4","1","","Bröring, Martin; Prikhodovski, Serguei; Tejero, Esther Cónsul","Free-base tripyrrins.","Chemical communications (Cambridge, England)","2007","","8","876","877","10.1039/b615935d","","","0.71073","MoKα","","0.1263","0.0377","","","0.0554","0.0682","","","","","","0.69","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101747","8.7081","0.0001","13.9372","0.0002","17.1214","0.0002","90","","90","","90","","2077.97","0.05","100","2","100","2","","","","","","","Synthesized by the authors. See text","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H33 Br Ni O2 P2 -","- C15 H33 Br Ni O2 P2 -","- C60 H132 Br4 Ni4 O8 P8 -","4","1","","Pandarus, Valerica; Zargarian, Davit","New pincer-type diphosphinito (POCOP) complexes of NiII and NiIII.","Chemical communications (Cambridge, England)","2007","","9","978","980","10.1039/b613812h","","","1.54178","CuKα","","0.0322","0.0298","","","0.0698","0.0709","","","","","","0.986","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101748","12.984","0.0003","13.0363","0.0003","13.4366","0.0003","78.494","0.002","77.305","0.001","88.467","0.002","2173.79","0.09","100","2","100","2","","","","","","","Synthesized by the authors. See text","6","P -1","-P 1","2","","","","- C18 H31 Br Ni O2 P2 -","- C18 H31 Br Ni O2 P2 -","- C72 H124 Br4 Ni4 O8 P8 -","4","2","","Pandarus, Valerica; Zargarian, Davit","New pincer-type diphosphinito (POCOP) complexes of NiII and NiIII.","Chemical communications (Cambridge, England)","2007","","9","978","980","10.1039/b613812h","","","1.54178","CuKα","","0.0482","0.0358","","","0.084","0.0875","","","","","","0.976","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101749","34.4889","0.0008","7.0423","0.0002","22.1302","0.0005","90","","127.664","0.001","90","","4254.9","0.18","200","2","200","2","","","","","","","Synthesized by the authors. See text","6","C 1 2/c 1","-C 2yc","15","","","","- C15 H33 Br2 Ni O2 P2 -","- C15 H33 Br2 Ni O2 P2 -","- C120 H264 Br16 Ni8 O16 P16 -","8","1","","Pandarus, Valerica; Zargarian, Davit","New pincer-type diphosphinito (POCOP) complexes of NiII and NiIII.","Chemical communications (Cambridge, England)","2007","","9","978","980","10.1039/b613812h","","","1.54178","CuKα","","0.0546","0.052","","","0.1735","0.1758","","","","","","1.082","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101750","19.8688","0.0008","7.9486","0.0005","21.8773","0.0008","90","","111.266","0.003","90","","3219.8","0.3","133","2","133","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C33 H46 N6 O2 -","- C33 H46 N6 O2 -","- C132 H184 N24 O8 -","4","1","","Katsiaouni, Stamatia; Dechert, Sebastian; Brückner, Christian; Meyer, Franc","A versatile building block for pyrazole-pyrrole hybrid macrocycles.","Chemical communications (Cambridge, England)","2007","","9","951","953","10.1039/b614049a","","","0.71073","MoKα","","0.0825","0.0506","","","0.1142","0.1263","","","","","","1.006","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101751","8.8877","0.0007","11.7586","0.0009","14.9846","0.0012","111.537","0.006","91.417","0.006","94.439","0.006","1449.9","0.2","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H37 F3 N6 O3 -","- C31 H37 F3 N6 O3 -","- C62 H74 F6 N12 O6 -","2","1","","Katsiaouni, Stamatia; Dechert, Sebastian; Brückner, Christian; Meyer, Franc","A versatile building block for pyrazole-pyrrole hybrid macrocycles.","Chemical communications (Cambridge, England)","2007","","9","951","953","10.1039/b614049a","","","0.71073","MoKα","","0.0894","0.0533","","","0.1194","0.1339","","","","","","1.033","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101752","9.8754","0.0018","10.6943","0.0016","15.134","0.003","76.1","0.012","74.713","0.013","70.802","0.012","1435.2","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H45 Ca Ga -","- C30 H45 Ca Ga -","- C60 H90 Ca2 Ga2 -","2","1","","Wiecko, Michal; Roesky, Peter W; Nava, Paola; Ahlrichs, Reinhart; Konchenko, Sergey N","Gallium(I)-alkaline earth metal donor-acceptor bonds.","Chemical communications (Cambridge, England)","2007","","9","927","929","10.1039/b614165j","","","0.71073","MoKα","","0.1048","0.0907","","","0.2873","0.2924","","","","","","1.12","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101753","16.0817","0.0016","22.922","0.003","18.5487","0.0015","90","","90","","90","","6837.4","1.2","200","2","200","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C34 H53 Ga O Sr -","- C34 H53 Ga O Sr -","- C272 H424 Ga8 O8 Sr8 -","8","1","","Wiecko, Michal; Roesky, Peter W; Nava, Paola; Ahlrichs, Reinhart; Konchenko, Sergey N","Gallium(I)-alkaline earth metal donor-acceptor bonds.","Chemical communications (Cambridge, England)","2007","","9","927","929","10.1039/b614165j","","","0.71073","MoKα","","0.0754","0.0474","","","0.0952","0.1051","","","","","","1.006","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101754","15.6734","0.0007","15.8658","0.001","16.4646","0.0007","90","","99.145","0.004","90","","4042.2","0.4","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C40 H60 Ba Ga2 -","- C40 H60 Ba Ga2 -","- C160 H240 Ba4 Ga8 -","4","1","","Wiecko, Michal; Roesky, Peter W; Nava, Paola; Ahlrichs, Reinhart; Konchenko, Sergey N","Gallium(I)-alkaline earth metal donor-acceptor bonds.","Chemical communications (Cambridge, England)","2007","","9","927","929","10.1039/b614165j","","","0.71073","MoKα","","0.0734","0.0431","","","0.0912","0.0992","","","","","","0.969","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101755","12.227","0.002","11.707","0.002","16.475","0.003","90","","102.516","0.012","90","","2302.2","0.7","173","2","173","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","bis(chloro-1-kappa-Sn)-bis(3-(diphenyl-phosphinoylmethyl)- benzene-1,2-diolat o)-1-kappa$4!-O,2-kappa$2!-P-tin(IV)-palladium(ii)","bis(chloro-1-κ-Sn)-bis(3-(diphenyl-phosphinoylmethyl)-benzene-1,2-diolat o)-1-κ^4^-O,2-κ^2^-P-tin(IV)-palladium(II)","","- C38 H30 Cl2 O4 P2 Pd Sn -","- C38 H30 Cl2 O4 P2 Pd Sn -","- C76 H60 Cl4 O8 P4 Pd2 Sn2 -","2","0.5","","Chikkali, Samir; Gudat, Dietrich; Niemeyer, Mark","Template controlled self-assembly of bidentate phosphine complexes with hemilabile coordination behaviour.","Chemical communications (Cambridge, England)","2007","","9","981","983","10.1039/b616102b","","","0.71073","MoKα","","0.0557","0.0445","","","0.1191","0.1248","","","","","","1.036","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101756","12.653","0.006","16.148","0.007","11.478","0.005","90","","93.125","0.006","90","","2341.8","1.9","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H31 Cl3 O3 -","- C23 H31 Cl3 O3 -","- C92 H124 Cl12 O12 -","4","1","","Swamy, Nalivela Kumara; Tatini, Lakshmi Kumar; Babu, J Moses; Annamalai, Pazhanimuthu; Pal, Manojit","Pd-mediated synthesis of substituted benzenes fused with carbocycle/heterocycle.","Chemical communications (Cambridge, England)","2007","","10","1035","1037","10.1039/b612770c","","","0.7107","MoKα","","","0.09","","","","0.167","","","","","","0.921","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101757","19.3308","0.0006","26.0589","0.0008","36.1281","0.0012","90","","90","","90","","18199.1","1","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C108 H257 N15 Na2 Ni16 O89 -","- C108 H209 N15 Na2 Ni16 O89 -","- C432 H836 N60 Na8 Ni64 O356 -","4","1","","Biswas, Biplab; Khanra, Sumit; Weyhermüller, Thomas; Chaudhuri, Phalguni","A one-pot synthesis of a paramagnetic high-nuclearity nickel(II) cluster: an octadecanuclear Ni(II)16Na(I)2 metal aggregate.","Chemical communications (Cambridge, England)","2007","","10","1059","1061","10.1039/b613782b","","","0.71073","MoKα","","0.1061","0.0794","","","0.148","0.1592","","","","","","1.139","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101758","24.6845","0.0013","18.9028","0.001","20.7781","0.0011","90","","95.014","0.001","90","","9658.1","0.9","141","2","141","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C55 H64 F4 N4 Th -","- C50 H52 F4 N4 Th -","- C400 H416 F32 N32 Th8 -","8","1","","Schelter, Eric J; Morris, David E; Scott, Brian L; Kiplinger, Jaqueline L","Actinide-mediated coupling of 4-fluorobenzonitrile: synthesis of an eight-membered thorium(IV) tetraazametallacycle.","Chemical communications (Cambridge, England)","2007","","10","1029","1031","10.1039/b614050e","","","0.71073","MoKα","","0.0505","0.0363","","","0.0929","0.0985","","","","","","1.011","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101759","12.9201","0.0006","14.0054","0.0007","18.2113","0.0009","90","","98.677","0.001","90","","3257.6","0.3","141","2","141","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H44 F2 N2 Th -","- C36 H44 F2 N2 Th -","- C144 H176 F8 N8 Th4 -","4","0.5","","Schelter, Eric J; Morris, David E; Scott, Brian L; Kiplinger, Jaqueline L","Actinide-mediated coupling of 4-fluorobenzonitrile: synthesis of an eight-membered thorium(IV) tetraazametallacycle.","Chemical communications (Cambridge, England)","2007","","10","1029","1031","10.1039/b614050e","","","0.71073","MoKα","","0.0197","0.018","","","0.0484","0.0488","","","","","","1.323","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101760","6.122","0.003","15.768","0.002","17.431","0.002","90","","90","","90","","1682.7","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H25 N O2 -","- C18 H25 N O2 -","- C72 H100 N4 O8 -","4","1","","Craig, Donald; King, N Paul; Mountford, David M","Silyl-modified Bellus-Claisen rearrangement.","Chemical communications (Cambridge, England)","2007","","10","1077","1079","10.1039/b614535c","","","1.54178","CuKα","","0.0816","0.0552","","","0.1474","0.1679","","","","","","1.033","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101761","10.6659","0.0009","16.1506","0.0014","18.2407","0.0016","90","","90","","90","","3142.2","0.5","174","2","174","2","","","","","","","","5","P n n m","-P 2 2n","58","compound 3","","","- C32 H22 Cl4 N4 O4 -","- C32 H22 Cl4 N4 O4 -","- C128 H88 Cl16 N16 O16 -","4","0.5","","Katz, Jeffrey L; Geller, Bram J; Foster, Peter D","Oxacalixarenes and oxacyclophanes containing 1,8-naphthyridines: a new class of molecular tweezers with concave-surface functionality.","Chemical communications (Cambridge, England)","2007","","10","1026","1028","10.1039/b615336d","","","0.71073","MoKα","","0.0675","0.0567","","","0.1586","0.1685","","","","","","1.054","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101762","9.6887","0.0008","13.1957","0.001","13.4844","0.001","100.388","0.001","107.125","0.001","111.11","0.001","1455.5","0.2","180","2","180","2","","","","","","","","5","P -1","-P 1","2","compound 6","","","- C36.5 H20 Cl N4 O5 -","- C36.5 H20 Cl N4 O5 -","- C73 H40 Cl2 N8 O10 -","2","1","","Katz, Jeffrey L; Geller, Bram J; Foster, Peter D","Oxacalixarenes and oxacyclophanes containing 1,8-naphthyridines: a new class of molecular tweezers with concave-surface functionality.","Chemical communications (Cambridge, England)","2007","","10","1026","1028","10.1039/b615336d","","","0.71073","MoKα","","0.0661","0.0518","","","0.1457","0.1533","","","","","","1.069","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101763","19.4444","0.0015","9.3321","0.0007","20.5331","0.0016","90","","118.049","0.001","90","","3288.3","0.4","178","2","178","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","compound 7","","","- C40 H26 N6 O4 -","- C40 H26 N6 O4 -","- C160 H104 N24 O16 -","4","1","","Katz, Jeffrey L; Geller, Bram J; Foster, Peter D","Oxacalixarenes and oxacyclophanes containing 1,8-naphthyridines: a new class of molecular tweezers with concave-surface functionality.","Chemical communications (Cambridge, England)","2007","","10","1026","1028","10.1039/b615336d","","","0.71073","MoKα","","0.0957","0.0534","","","0.1343","0.1564","","","","","","0.924","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101764","9.3123","0.0004","16.8404","0.0007","21.6379","0.0009","90","","95.719","0.001","90","","3376.4","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34.5 H35 I2 N2 P Pd -","- C34.5 H35 I2 N2 P Pd -","- C138 H140 I8 N8 P4 Pd4 -","4","1","","Han, Yuan; Huynh, Han Vinh","Preparation and characterization of the first pyrazole-based remote N-heterocyclic carbene complexes of palladium(II).","Chemical communications (Cambridge, England)","2007","","10","1089","1091","10.1039/b615441g","","","0.71073","MoKα","","0.1018","0.0789","","","0.1464","0.1548","","","","","","1.253","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101765","9.3019","0.0005","16.8771","0.0009","18.9728","0.0009","90","","94.53","0.001","90","","2969.2","0.3","295","2","295","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26.5 H30 Cl I2 N2 P Pd -","- C26.5 H30 Cl I2 N2 P Pd -","- C106 H120 Cl4 I8 N8 P4 Pd4 -","4","1","","Han, Yuan; Huynh, Han Vinh","Preparation and characterization of the first pyrazole-based remote N-heterocyclic carbene complexes of palladium(II).","Chemical communications (Cambridge, England)","2007","","10","1089","1091","10.1039/b615441g","","","0.71073","MoKα","","0.0758","0.0638","","","0.1509","0.1573","","","","","","1.168","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101766","15.4229","0.0008","15.6844","0.0008","16.8056","0.0009","88.247","0.003","65.51","0.003","73.213","0.003","3523.3","0.3","123","2","123","2","","","","","","","","6","P 1","P 1","1","","","","- C114 H154 Cu10 Gd2 N26 O53 -","- C114 H116 Cu10 Gd2 N26 O53 -","- C114 H116 Cu10 Gd2 N26 O53 -","1","1","","Mezei, Gellert; Kampf, Jeff W; Pan, Shilie; Poeppelmeier, Kenneth R; Watkins, Byron; Pecoraro, Vincent L","Metallacrown-based compartments: selective encapsulation of three isonicotinate anions in non-centrosymmetric solids.","Chemical communications (Cambridge, England)","2007","","11","1148","1150","10.1039/b614024f","","","0.71073","MoKα","","0.0251","0.0224","","","0.0589","0.0602","","","","","","1.081","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101767","15.39","0.004","15.678","0.004","16.812","0.005","88.347","0.004","65.423","0.004","73.167","0.004","3511.3","1.6","123","2","123","2","","","","","","","","6","P 1","P 1","1","","","","- C114 H154 Cu10 Dy2 N26 O53 -","- C114 H116 Cu10 Dy2 N26 O53 -","- C114 H116 Cu10 Dy2 N26 O53 -","1","1","","Mezei, Gellert; Kampf, Jeff W; Pan, Shilie; Poeppelmeier, Kenneth R; Watkins, Byron; Pecoraro, Vincent L","Metallacrown-based compartments: selective encapsulation of three isonicotinate anions in non-centrosymmetric solids.","Chemical communications (Cambridge, England)","2007","","11","1148","1150","10.1039/b614024f","","","0.71073","MoKα","","0.0369","0.0293","","","0.0662","0.0695","","","","","","1.006","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101768","44.392","0.003","14.3963","0.001","18.6471","0.0012","90","","95.391","0.004","90","","11864.3","1.4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C124 H114 Cl2 Cr9 N40 O -","- C124 H114 Cl2 Cr9 N40 O -","- C496 H456 Cl8 Cr36 N160 O4 -","4","0.5","","Ismayilov, Rayyat H; Wang, Wen-Zhen; Wang, Rui-Ren; Yeh, Chen-Yu; Lee, Gene-Hsiang; Peng, Shie-Ming","Four quadruple metal-metal bonds lined up: linear nonachromium(II) metal string complexes.","Chemical communications (Cambridge, England)","2007","","11","1121","1123","10.1039/b614597c","","","0.71073","MoKα","","0.1884","0.0788","","","0.1929","0.2618","","","","","","1.043","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101769","43.5722","0.0013","14.439","0.0005","19.2834","0.0006","90","","98.1689","0.0017","90","","12008.8","0.7","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C111 H93 Cl3 Cr9 N42 S2 -","- C111 H93 Cl3 Cr9 N42 S2 -","- C444 H372 Cl12 Cr36 N168 S8 -","4","0.5","","Ismayilov, Rayyat H; Wang, Wen-Zhen; Wang, Rui-Ren; Yeh, Chen-Yu; Lee, Gene-Hsiang; Peng, Shie-Ming","Four quadruple metal-metal bonds lined up: linear nonachromium(II) metal string complexes.","Chemical communications (Cambridge, England)","2007","","11","1121","1123","10.1039/b614597c","","","0.71073","MoKα","","0.233","0.1077","","","0.2902","0.3432","","","","","","1.159","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101770","42.28","0.02","16.46","0.008","12.019","0.005","90","","90.39","0.02","90","","8364","6","213","","213","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C92 H88 Cl2 F6 Fe2 P4 S2 -","- C92 H88 Cl2 F6 Fe2 P4 S2 -","- C368 H352 Cl8 F24 Fe8 P16 S8 -","4","1","","Tanaka, Yuya; Inagaki, Akiko; Akita, Munetaka","A photoswitchable molecular wire with the dithienylethene (DTE) linker, (dppe)(eta(5)-C(5)Me(5))Fe-C[triple bond, length as m-dash]C-DTE-C[triple bond, length as m-dash]C-Fe(eta(5)-C(5)Me(5))(dppe).","Chemical communications (Cambridge, England)","2007","","11","1169","1171","10.1039/b614748h","","","0.7107","MoKα","","","0.0817","","","","0.1996","","","","","","1.091","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101771","14.3569","0.001","15.252","0.0011","6.0571","0.0004","90","","91.18","0.001","90","","1326.05","0.16","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H11 F3 N4 O2 -","- C13 H11 F3 N4 O2 -","- C52 H44 F12 N16 O8 -","4","1","","Maeda, Hiromitsu; Ito, Yoshihiro; Kusunose, Yukio; Nakanishi, Takashi","Di-pyrrolyl-pyrazoles: anion receptors in protonated form and efficient building blocks for organized structures.","Chemical communications (Cambridge, England)","2007","","11","1136","1138","10.1039/b615787d","","","0.71073","MoKα","","0.0486","0.0411","","","0.1095","0.1228","","","","","","1.133","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101772","8.307","0.005","9.278","0.006","10.96","0.008","85.9","0.03","87.73","0.03","65.63","0.02","767.5","0.9","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H15 F3 N4 O2 -","- C15 H15 F3 N4 O2 -","- C30 H30 F6 N8 O4 -","2","1","","Maeda, Hiromitsu; Ito, Yoshihiro; Kusunose, Yukio; Nakanishi, Takashi","Di-pyrrolyl-pyrazoles: anion receptors in protonated form and efficient building blocks for organized structures.","Chemical communications (Cambridge, England)","2007","","11","1136","1138","10.1039/b615787d","","","0.71075","MoKα","","0.0741","0.0624","","","0.1748","0.1866","","","","","","1.089","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101773","7.2","0.004","24.567","0.011","8.844","0.003","90","","111.441","0.019","90","","1456.1","1.2","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H7 F7 N4 O2 -","- C13 H7 F7 N4 O2 -","- C52 H28 F28 N16 O8 -","4","1","","Maeda, Hiromitsu; Ito, Yoshihiro; Kusunose, Yukio; Nakanishi, Takashi","Di-pyrrolyl-pyrazoles: anion receptors in protonated form and efficient building blocks for organized structures.","Chemical communications (Cambridge, England)","2007","","11","1136","1138","10.1039/b615787d","","","0.71075","MoKα","","0.0822","0.0663","","","0.1768","0.187","","","","","","1.085","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101774","16.129","0.005","16.45","0.004","36.383","0.009","90","","90.023","0.01","90","","9653","4","123","2","123","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C13 H14 N4 -","- C13 H14 N4 -","- C416 H448 N128 -","32","4","","Maeda, Hiromitsu; Ito, Yoshihiro; Kusunose, Yukio; Nakanishi, Takashi","Di-pyrrolyl-pyrazoles: anion receptors in protonated form and efficient building blocks for organized structures.","Chemical communications (Cambridge, England)","2007","","11","1136","1138","10.1039/b615787d","","","0.71075","MoKα","","0.1524","0.087","","","0.203","0.2387","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101775","10.1273","0.0001","15.3853","0.0002","27.6549","0.0003","90","","92.722","0.008","90","","4304.09","0.08","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H39 Cl Mn2 N6 O13 -","- C39 H39 Cl Mn2 N6 O13 -","- C156 H156 Cl4 Mn8 N24 O52 -","4","1","","Wang, Xin-Yi; Wang, Zhe-Ming; Gao, Song","A pillared layer MOF with anion-tunable magnetic properties and photochemical [2 + 2] cycloaddition.","Chemical communications (Cambridge, England)","2007","","11","1127","1129","10.1039/b616516h","","","0.71073","MoKα","","0.1292","0.0474","","","0.1134","0.129","","","","","","0.889","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101776","12.2069","0.0011","12.6236","0.0012","13.1483","0.0012","71.916","0.002","76.183","0.002","62.797","0.002","1701.7","0.3","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H40 B Cl3 F P -","- C38 H40 B Cl3 F P -","- C76 H80 B2 Cl6 F2 P2 -","2","1","","Lee, Min Hyung; Agou, Tomohiro; Kobayashi, Junji; Kawashima, Takayuki; Gabbaï, François P","Fluoride ion complexation by a cationic borane in aqueous solution.","Chemical communications (Cambridge, England)","2007","","11","1133","1135","10.1039/b616814k","","","0.71073","MoKα","","0.11","0.066","","","0.1342","0.163","","","","","","1.004","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101777","10.4152","0.0004","11.5802","0.0005","11.8762","0.0005","80.836","0.001","89.391","0.001","79.542","0.001","1390.37","0.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H17 N O2 Se -","- C14 H17 N O2 Se -","- C56 H68 N4 O8 Se4 -","4","2","","Gómez-Bujedo, Silvia; Alcarazo, Manuel; Pichon, Christophe; Alvarez, Eleuterio; Fernández, Rosario; Lassaletta, José M","Isoquinolin-1-ylidenes as electronically tuneable ligands.","Chemical communications (Cambridge, England)","2007","","11","1180","1182","10.1039/b617037d","","","0.71073","MoKα","","0.0279","0.0225","","","0.0584","0.0614","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101778","8.6805","0.0007","14.9418","0.0014","14.7924","0.0013","90","","103.803","0.003","90","","1863.2","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H25 I N Rh -","- C20 H25 I N Rh -","- C80 H100 I4 N4 Rh4 -","4","1","","Gómez-Bujedo, Silvia; Alcarazo, Manuel; Pichon, Christophe; Alvarez, Eleuterio; Fernández, Rosario; Lassaletta, José M","Isoquinolin-1-ylidenes as electronically tuneable ligands.","Chemical communications (Cambridge, England)","2007","","11","1180","1182","10.1039/b617037d","","","0.71073","MoKα","","0.0228","0.0208","","","0.0529","0.0538","","","","","","1.127","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101779","11.3168","0.0005","11.1197","0.0005","16.5538","0.0007","90","","108.178","0.002","90","","1979.16","0.15","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H27 Cl N O Rh -","- C21 H27 Cl N O Rh -","- C84 H108 Cl4 N4 O4 Rh4 -","4","1","","Gómez-Bujedo, Silvia; Alcarazo, Manuel; Pichon, Christophe; Alvarez, Eleuterio; Fernández, Rosario; Lassaletta, José M","Isoquinolin-1-ylidenes as electronically tuneable ligands.","Chemical communications (Cambridge, England)","2007","","11","1180","1182","10.1039/b617037d","","","0.71073","MoKα","","0.034","0.0306","","","0.0801","0.0824","","","","","","1.029","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101780","10.6791","0.0001","10.6791","0.0001","36.8984","0.0006","90","","90","","90","","4208.01","0.09","173","2","173","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C25 H27 Cl N Rh -","- C25 H27 Cl N Rh -","- C200 H216 Cl8 N8 Rh8 -","8","1","","Gómez-Bujedo, Silvia; Alcarazo, Manuel; Pichon, Christophe; Alvarez, Eleuterio; Fernández, Rosario; Lassaletta, José M","Isoquinolin-1-ylidenes as electronically tuneable ligands.","Chemical communications (Cambridge, England)","2007","","11","1180","1182","10.1039/b617037d","","","0.71073","MoKα","","0.0244","0.0216","","","0.0487","0.0493","","","","","","1.055","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101781","10.1562","0.0005","21.8969","0.0013","15.0635","0.0009","90","","107.051","0.002","90","","3202.7","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H8 B11 F2 I11 -","- C9 H8 B11 F2 I11 -","- C36 H32 B44 F8 I44 -","4","1","","Douvris, Christos; Stoyanov, Evgenii S; Tham, Fook S; Reed, Christopher A","Isolating fluorinated carbocations.","Chemical communications (Cambridge, England)","2007","","11","1145","1147","10.1039/b617606b","","","0.71073","MoKα","","0.0433","0.0275","","","0.0496","0.0534","","","","","","1.041","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101782","12.0604","0.0004","14.3581","0.0005","20.1013","0.0007","90","","90","","90","","3480.8","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H12 B11 Cl11 F6 -","- C21 H12 B11 Cl11 F6 -","- C84 H48 B44 Cl44 F24 -","4","1","","Douvris, Christos; Stoyanov, Evgenii S; Tham, Fook S; Reed, Christopher A","Isolating fluorinated carbocations.","Chemical communications (Cambridge, England)","2007","","11","1145","1147","10.1039/b617606b","","","0.71073","MoKα","","0.0606","0.0452","","","0.0817","0.0878","","","","","","1.029","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101783","10.0852","0.0005","20.8766","0.0009","22.2728","0.001","90","","96.2104","0.0007","90","","4661.9","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H20.5 B11 F4.5 I11 -","- C29 H20.5 B11 F4.5 I11 -","- C116 H82 B44 F18 I44 -","4","1","","Douvris, Christos; Stoyanov, Evgenii S; Tham, Fook S; Reed, Christopher A","Isolating fluorinated carbocations.","Chemical communications (Cambridge, England)","2007","","11","1145","1147","10.1039/b617606b","","","0.71073","MoKα","","0.0376","0.0276","","","0.0578","0.061","","","","","","1.045","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101784","9.9226","0.0002","14.4389","0.0002","14.8328","0.0002","81.532","0.0006","85.2332","0.0006","76.9732","0.0006","2045.1","0.06","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H14 B11 F4 I11 -","- C19.994 H13.995 B11 F3.999 I11 -","- C39.988 H27.99 B22 F7.998 I22 -","2","1","","Douvris, Christos; Stoyanov, Evgenii S; Tham, Fook S; Reed, Christopher A","Isolating fluorinated carbocations.","Chemical communications (Cambridge, England)","2007","","11","1145","1147","10.1039/b617606b","","","0.71073","MoKα","","0.0518","0.0417","","","0.0951","0.0993","","","","","","1.105","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101785","15.8094","0.0005","14.9432","0.0004","15.5776","0.0004","90","","103.219","0.001","90","","3582.59","0.17","113","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","9,9'(Biphenyl-4,4'-diyl)difluoren-9-ol.2(tetrahydrofuran) clathrate","9,9'(Biphenyl-4,4'-diyl)difluoren-9-ol.2(tetrahydrofuran) clathrate","","- C46 H42 O4 -","- C46 H42 O4 -","- C184 H168 O16 -","4","1","","le Roex, Tanya; Nassimbeni, Luigi R; Weber, Edwin","Clathrates with mixed guests.","Chemical communications (Cambridge, England)","2007","","11","1124","1126","10.1039/b618782j","","","0.71073","MoKα","","0.1244","0.0495","","","0.1047","0.1264","","","","","","0.938","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101786","7.5658","0.0002","32.1197","0.0008","15.3726","0.0005","90","","99.269","0.001","90","","3686.94","0.18","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","9,9'(Biphenyl-4,4'-diyl)difluoren-9-ol.2(diethyl ether) clathrate","9,9'(Biphenyl-4,4'-diyl)difluoren-9-ol.2(diethyl ether) clathrate","","- C46 H46 O4 -","- C46 H46 O4 -","- C184 H184 O16 -","4","1","","le Roex, Tanya; Nassimbeni, Luigi R; Weber, Edwin","Clathrates with mixed guests.","Chemical communications (Cambridge, England)","2007","","11","1124","1126","10.1039/b618782j","","","0.71073","MoKα","","0.2121","0.0646","","","0.1148","0.1581","","","","","","0.973","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101787","15.1601","0.0006","15.2878","0.0006","15.7069","0.0007","90","","101.288","0.002","90","","3569.9","0.3","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","9,9'-(Biphenyl-4,4'-diyl)difluoren-9-ol. 1.35(tetrahydrofuran). 0.65(diethyl ether) clathrate","9,9'-(Biphenyl-4,4'-diyl)difluoren-9-ol. 1.35(tetrahydrofuran). 0.65(diethyl ether) clathrate","","- C46 H44 O4 -","- C46 H34 O4 -","- C184 H136 O16 -","4","1","","le Roex, Tanya; Nassimbeni, Luigi R; Weber, Edwin","Clathrates with mixed guests.","Chemical communications (Cambridge, England)","2007","","11","1124","1126","10.1039/b618782j","","","0.71073","MoKα","","0.1397","0.069","","","0.1652","0.1959","","","","","","1.036","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101788","15.1157","0.0003","15.2709","0.0004","15.7497","0.0004","90","","100.986","0.001","90","","3568.88","0.15","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","9,9'-(Biphenyl-4,4'-diyl)difluoren-9-ol. 1.15(tetrahydrofuran). 0.85(diethyl ether) clathrate","9,9'-(Biphenyl-4,4'-diyl)difluoren-9-ol. 1.15(tetrahydrofuran). 0.85(diethyl ether) clathrate","","- C46 H44 O4 -","- C46 H42 O4 -","- C184 H168 O16 -","4","1","","le Roex, Tanya; Nassimbeni, Luigi R; Weber, Edwin","Clathrates with mixed guests.","Chemical communications (Cambridge, England)","2007","","11","1124","1126","10.1039/b618782j","","","0.71073","MoKα","","0.1218","0.0518","","","0.1269","0.1523","","","","","","0.987","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101789","15.0708","0.0005","15.2736","0.0005","15.8003","0.0006","90","","100.415","0.001","90","","3577.1","0.2","103","2","103","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","9,9'-(Biphenyl-4,4'-diyl)bis(fluoren-9-ol). 0.9(tetrahydrofuran). 1.1(diethyl ether) clathrate","9,9'-(Biphenyl-4,4'-diyl)bis(fluoren-9-ol). 0.9(tetrahydrofuran). 1.1(diethyl ether) clathrate","","- C46 H44 O4 -","- C46 H36 O4 -","- C184 H144 O16 -","4","1","","le Roex, Tanya; Nassimbeni, Luigi R; Weber, Edwin","Clathrates with mixed guests.","Chemical communications (Cambridge, England)","2007","","11","1124","1126","10.1039/b618782j","","","0.71073","MoKα","","0.1207","0.0654","","","0.1492","0.1743","","","","","","1.014","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101790","11.176","0.002","18.325","0.004","23.185","0.005","90","","97.89","0.03","90","","4703.6","1.6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","9,9'-(ethyne-1,2-diyl)difluoren-9-ol. (acetonitrile). (water) clathrate","9,9'-(ethyne-1,2-diyl)difluoren-9-ol. (acetonitrile). (water) clathrate","","- C30 H25 N O3 -","- C30 H22 N O3 -","- C240 H176 N8 O24 -","8","2","","le Roex, Tanya; Nassimbeni, Luigi R; Weber, Edwin","Clathrates with mixed guests.","Chemical communications (Cambridge, England)","2007","","11","1124","1126","10.1039/b618782j","","","0.71073","MoKα","","0.1125","0.0465","","","0.1067","0.1321","","","","","","0.833","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101791","9.5245","0.0019","11.534","0.002","16.275","0.003","99.2","0.03","91.61","0.03","90.19","0.03","1764.2","0.6","173","2","173","2","","","","","","","","3","P -1","-P 1","2","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 2(ethanol) clathrate","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 2(ethanol) clathrate","","- C46 H39 O5 -","- C46 H39 O5 -","- C92 H78 O10 -","2","1","","le Roex, Tanya; Nassimbeni, Luigi R; Weber, Edwin","Clathrates with mixed guests.","Chemical communications (Cambridge, England)","2007","","11","1124","1126","10.1039/b618782j","","","0.71073","MoKα","","0.063","0.041","","","0.0945","0.1025","","","","","","1.056","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101792","9.7084","0.0019","11.562","0.002","16.045","0.003","80.21","0.03","87.41","0.03","89.34","0.03","1772.9","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). (ethanol). (acetonitrile) clathrate","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). (ethanol). (acetonitrile) clathrate","","- C46 H36 N O4 -","- C46 H36 N O4 -","- C92 H72 N2 O8 -","2","1","","le Roex, Tanya; Nassimbeni, Luigi R; Weber, Edwin","Clathrates with mixed guests.","Chemical communications (Cambridge, England)","2007","","11","1124","1126","10.1039/b618782j","","","0.71073","MoKα","","0.0819","0.0415","","","0.0909","0.1017","","","","","","1.034","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101793","9.6894","0.0019","11.558","0.002","16.063","0.003","80.29","0.03","87.53","0.03","89.42","0.03","1771.4","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 1.07(ethanol). 0.93(acetonitrile) clathrate","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 1.07(ethanol). 0.93(acetonitrile) clathrate","","- C46 H36 N O4 -","- C46 H33 N O4 -","- C92 H66 N2 O8 -","2","1","","le Roex, Tanya; Nassimbeni, Luigi R; Weber, Edwin","Clathrates with mixed guests.","Chemical communications (Cambridge, England)","2007","","11","1124","1126","10.1039/b618782j","","","0.71073","MoKα","","0.097","0.0452","","","0.1071","0.1218","","","","","","1.019","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101794","9.631","0.0019","11.548","0.002","16.154","0.003","80.54","0.03","87.79","0.03","89.66","0.03","1770.8","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 1.41(ethanol). 0.59(acetonitrile) clathrate","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 1.41(ethanol). 0.59(acetonitrile) clathrate","","- C46 H36 N O4 -","- C46 H33 N0.59 O4.41 -","- C92 H66 N1.18 O8.82 -","2","1","","le Roex, Tanya; Nassimbeni, Luigi R; Weber, Edwin","Clathrates with mixed guests.","Chemical communications (Cambridge, England)","2007","","11","1124","1126","10.1039/b618782j","","","0.71073","MoKα","","0.0868","0.0468","","","0.1142","0.129","","","","","","1.058","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101795","11.154","0.0003","9.7982","0.0002","17.5999","0.0004","90","","107.56","0.001","90","","1833.85","0.07","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H62 Cl2 N4 Pd2 -","- C32 H62 Cl2 N4 Pd2 -","- C64 H124 Cl4 N8 Pd4 -","2","0.5","","Esposito, Oriana; Lewis, Alexandra K de K; Hitchcock, Peter B; Caddick, Stephen; Cloke, F Geoffrey N","Synthesis and reactivity of alkyl-palladium N-heterocyclic carbene complexes.","Chemical communications (Cambridge, England)","2007","","11","1157","1159","10.1039/b700671c","","x-ray","0.71073","MoKα","","0.0414","0.031","","","0.0606","0.0639","","","","","","1.075","","","","has coordinates","180119","2020-10-21","18:00:00",""
"7101796","22.4708","0.0006","17.984","0.0007","19.059","0.0005","90","","106.288","0.002","90","","7392.9","0.4","173","2","173","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C72 H114 Cl2 N4 O2 Pd2 -","- C72 H114 Cl2 N4 O2 Pd2 -","- C288 H456 Cl8 N16 O8 Pd8 -","4","0.5","","Esposito, Oriana; Lewis, Alexandra K de K; Hitchcock, Peter B; Caddick, Stephen; Cloke, F Geoffrey N","Synthesis and reactivity of alkyl-palladium N-heterocyclic carbene complexes.","Chemical communications (Cambridge, England)","2007","","11","1157","1159","10.1039/b700671c","","x-ray","0.71073","MoKα","","0.0681","0.043","","","0.1037","0.1241","","","","","","0.774","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101797","9.6642","0.0003","23.1895","0.0005","10.4673","0.0003","90","","95.324","0.001","90","","2335.69","0.11","173","2","173","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H40 Cl N3 O Pd -","- C20 H40 Cl N3 O Pd -","- C80 H160 Cl4 N12 O4 Pd4 -","4","1","","Esposito, Oriana; Lewis, Alexandra K de K; Hitchcock, Peter B; Caddick, Stephen; Cloke, F Geoffrey N","Synthesis and reactivity of alkyl-palladium N-heterocyclic carbene complexes.","Chemical communications (Cambridge, England)","2007","","11","1157","1159","10.1039/b700671c","","x-ray","0.7107","MoKα","","0.0774","0.0457","","","0.108","0.1287","","","","","","0.821","","","","has coordinates,has disorder","180119","2020-10-21","18:00:00",""
"7101798","8.959","0.0002","12.0504","0.0004","19.2674","0.0011","90","","96.661","0.004","90","","2066.06","0.14","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H21 I N2 O4 -","- C21 H21 I N2 O4 -","- C84 H84 I4 N8 O16 -","4","1","","Castellote, Isabel; Morón, María; Burgos, Carolina; Alvarez-Builla, Julio; Martin, Avelino; Gómez-Sal, Pilar; Vaquero, Juan J","Reaction of imines with N-iodosuccinimide (NIS): unexpected formation of stable 1 : 1 complexes.","Chemical communications (Cambridge, England)","2007","","12","1281","1283","10.1039/b615183c","","x-ray","0.71073","MoKα","","0.0238","0.0195","","","0.0587","0.0623","","","","","","0.843","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101799","5.5529","0.0006","14.4502","0.0016","22.426","0.003","90","","90","","90","","1799.5","0.4","153","2","153","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C18 H24 O7 -","- C18 H24 O7 -","- C72 H96 O28 -","4","1","","Wang, Yajun; Shen, Zongxuan; Li, Bin; Zhang, Yong; Zhang, Yawen","Dynamic kinetic resolution of 2-oxo-3-aryl-succinates by organocatalyzed aldolization.","Chemical communications (Cambridge, England)","2007","","12","1284","1286","10.1039/b616382c","","","0.7107","MoKα","","0.034","0.0335","","","0.0826","0.0831","","","","","","1.071","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101800","5.7585","0.0011","12.377","0.002","17.297","0.003","97.499","0.019","97.56","0.02","103.09","0.02","1173.8","0.4","213","2","213","2","","","","","","","","4","P 1","P 1","1","","","","- C27 H25 Cl O6 -","- C27 H25 Cl O6 -","- C54 H50 Cl2 O12 -","2","2","","Wang, Yajun; Shen, Zongxuan; Li, Bin; Zhang, Yong; Zhang, Yawen","Dynamic kinetic resolution of 2-oxo-3-aryl-succinates by organocatalyzed aldolization.","Chemical communications (Cambridge, England)","2007","","12","1284","1286","10.1039/b616382c","","","0.7107","MoKα","","0.0939","0.0685","","","0.1378","0.1555","","","","","","1.116","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101801","20.1904","0.0002","20.1904","0.0002","12.8455","0.0003","90","","90","","90","","5236.5","0.14","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C36 H60 N8 O12 P4 Zn4 -","- C36 H60 N8 O12 P4 Zn4 -","- C144 H240 N32 O48 P16 Zn16 -","4","0.25","","Murugavel, Ramaswamy; Shanmugan, Swaminathan","Seeking tetrameric transition metal phosphonate with a D4R core and organising it into a 3-D supramolecular assembly.","Chemical communications (Cambridge, England)","2007","","12","1257","1259","10.1039/b616439k","","","0.71073","MoKα","","0.0394","0.0305","","","0.0957","0.105","","","","","","1.135","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101802","9.9575","0.0007","51.425","0.004","10.1013","0.0007","90","","99.766","0.001","90","","5097.6","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C83 H14 N2 O2 S6 Se -","- C83 H14 N2 O2 S6 Se -","- C332 H56 N8 O8 S24 Se4 -","4","1","","Chuang, Shih-Ching; Murata, Yasujiro; Murata, Michihisa; Mori, Sadayuki; Maeda, Shuhei; Tanabe, Fumiyuki; Komatsu, Koichi","Fine tuning of the orifice size of an open-cage fullerene by placing selenium in the rim: insertion/release of molecular hydrogen.","Chemical communications (Cambridge, England)","2007","","12","1278","1280","10.1039/b616478a","","","0.71073","MoKα","","0.0888","0.0509","","","0.0846","0.0908","","","","","","1.012","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101803","25.0996","0.0001","25.0996","0.0001","38.1856","0.0002","90","","90","","90","","24056.6","0.2","113","2","113","2","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","octakis(2,3,6-tri-O-acetyl)-gamma-cyclodextrin sesqui(isopropanolate)monohydrate","octakis(2,3,6-tri-O-acetyl)-gamma-cyclodextrin sesqui(isopropanolate)monohydrate","","- C100.5 H142 O66.5 -","- C100.5 H142 O66.5 -","- C804 H1136 O532 -","8","1","","Caira, Mino R; Bettinetti, Giampiero; Sorrenti, Milena; Catenacci, Laura; Cruickshank, Dyanne; Davies, Kate","Effect of peracetylation on the conformation of gamma-cyclodextrin.","Chemical communications (Cambridge, England)","2007","","12","1221","1223","10.1039/b616681d","","","0.71073","MoKα","","0.0997","0.0872","","","0.23","0.2438","","","","","","1.035","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101804","25.0841","0.0001","25.0841","0.0001","38.276","0.0002","90","","90","","90","","24083.7","0.2","113","2","113","2","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","octakis(2,3,6-tri-O-acetyl)-gamma-cyclodextrin.2(ethanol).H2O","octakis(2,3,6-tri-O-acetyl)-gamma-cyclodextrin.2(ethanol).H2O","","- C100 H142 O67 -","- C100 H140 O67 -","- C800 H1120 O536 -","8","1","","Caira, Mino R; Bettinetti, Giampiero; Sorrenti, Milena; Catenacci, Laura; Cruickshank, Dyanne; Davies, Kate","Effect of peracetylation on the conformation of gamma-cyclodextrin.","Chemical communications (Cambridge, England)","2007","","12","1221","1223","10.1039/b616681d","","","0.71073","MoKα","","0.0806","0.0699","","","0.1939","0.2029","","","","","","1.036","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101805","13.1876","0.0006","18.687","0.0011","13.8546","0.0007","90","","115.039","0.0014","90","","3093.4","0.3","99.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H37 N2 O5 P -","- C34 H37 N2 O5 P -","- C136 H148 N8 O20 P4 -","4","1","","Saito, Susumu; Tsubogo, Tetsu; Kobayashi, Shū","Direct-type catalytic Mannich reactions of amides with imines.","Chemical communications (Cambridge, England)","2007","","12","1236","1237","10.1039/b618490a","","","0.71075","MoKα","","","0.0516","","","","0.1329","","","","","","1.413","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101806","24.505","0.002","24.505","0.002","36.17","0.003","90","","90","","90","","21721","3","93.1","","","","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C208 H282 N O61 Tb9 -","- C208 H272 N0.5 O59.5 Tb9 -","- C832 H1088 N2 O238 Tb36 -","4","0.5","","Manseki, Kazuhiro; Yanagida, Shozo","Effective and efficient photoluminescence of salicylate-ligating terbium(III) clusters stabilized by multiple phenyl-phenyl interactions.","Chemical communications (Cambridge, England)","2007","","12","1242","1244","10.1039/b616387d","","","0.71075","MoKα","","","0.0446","","","","0.1241","","","","","","1.032","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101807","11.193","0.002","11.258","0.002","16.324","0.003","76.275","0.003","87.493","0.003","60.506","0.003","1732.8","0.6","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H52 B Cr N10 O3 -","- C28 H37 B Cr N10 O2.9 -","- C56 H74 B2 Cr2 N20 O5.8 -","2","1","","Harris, T David; Long, Jeffrey R","Linkage isomerism in a face-centered cubic Cu6Cr8(CN)24 cluster with an S=15 ground state.","Chemical communications (Cambridge, England)","2007","","13","1360","1362","10.1039/b615141h","","","0.71073","MoKα","","0.0887","0.0622","","","0.1651","0.1821","","","","","","1.046","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101808","34.9941","0.0014","34.9941","0.0014","34.9941","0.0014","90","","90","","90","","42853","3","160","","160","","","","","","","","","8","F -4 3 c","F -4a 2 3","219","","","","- C148 H210 B8 Cl4 Cr8 Cu6 N72 O42 -","- C159 H80 B8 Cl3 Cr8 Cu6 N72 O28.5 -","- C1272 H640 B64 Cl24 Cr64 Cu48 N576 O228 -","8","0.0833333","","Harris, T David; Long, Jeffrey R","Linkage isomerism in a face-centered cubic Cu6Cr8(CN)24 cluster with an S=15 ground state.","Chemical communications (Cambridge, England)","2007","","13","1360","1362","10.1039/b615141h","","","0.71073","MoKα","","0.1254","0.0703","","","0.1897","0.2459","","","","","","1.055","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7101809","11.884","0.002","12.611","0.003","14.567","0.003","77.01","0.03","66.69","0.03","62.94","0.03","1783","0.6","293","2","293","2","","","","","","","","8","P -1","-P 1","2","Bis(2, 5-bis (4-fluorophenyl)-1, 3, 4-oxadiazolato- N,C2)iridium (O,O-diethyldithiophosphate)","Bis(2, 5-bis (4-fluorophenyl)-1, 3, 4-oxadiazolato-N,C2)iridium (O,O-diethyldithiophosphate)","","- C32 H24 F4 Ir N4 O4 P S2 -","- C32 H24 F4 Ir N4 O4 P S2 -","- C64 H48 F8 Ir2 N8 O8 P2 S4 -","2","1","","Chen, Lianqing; You, Han; Yang, Chuluo; Ma, Dongge; Qin, Jingui","Novel, highly efficient blue-emitting heteroleptic iridium(III) complexes based on fluorinated 1,3,4-oxadiazole: tuning to blue by dithiolate ancillary ligands.","Chemical communications (Cambridge, England)","2007","","13","1352","1354","10.1039/b616493e","","","0.71073","MoKα","","0.0561","0.0407","","","0.112","0.1212","","","","","","1.088","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7101810","13.179","0.001","12.282","0.001","12.063","0.001","90","","104.982","0.001","90","","1886.2","0.3","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H36 O2 -","- C20 H36 O2 -","- C80 H144 O8 -","4","1","","Cergol, Katie M; Jensen, Paul; Turner, Peter; Coster, Mark J","Reversibility in the boron-mediated ketone-ketone aldol reaction.","Chemical communications (Cambridge, England)","2007","","13","1363","1365","10.1039/b617094c","","","0.71073","MoKα","","0.0515","0.0411","","","0.1114","0.123","","","","","","1.041","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7101811","11.9035","0.0003","12.7978","0.0004","24.8807","0.0007","90","","96.953","0.001","90","","3762.4","0.2","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H36 O2 -","- C20 H36 O2 -","- C160 H288 O16 -","8","2","","Cergol, Katie M; Jensen, Paul; Turner, Peter; Coster, Mark J","Reversibility in the boron-mediated ketone-ketone aldol reaction.","Chemical communications (Cambridge, England)","2007","","13","1363","1365","10.1039/b617094c","","","0.71073","MoKα","","0.0819","0.0447","","","0.0825","0.0848","","","","","","1.242","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101812","9.354","0.0017","9.4771","0.0018","10.2788","0.0019","92.763","0.003","116.301","0.003","91.15","0.003","815.1","0.3","294","2","273","2","","","","","","","","3","P -1","-P 1","2","","","","- C23 H16 O -","- C23 H16 O -","- C46 H32 O2 -","2","1","","Lian, Jian-Jou; Liu, Rai-Shung","Gold-catalyzed cyclo-isomerization of 1,6-diyne-4-en-3-ols to form naphthyl ketone derivatives.","Chemical communications (Cambridge, England)","2007","","13","1337","1339","10.1039/b618291g","","","0.71073","MoKα","","0.093","0.049","","","0.1121","0.1294","","","","","","0.914","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101813","5.02","0.001","16.571","0.001","18.4","0.001","90","","93.37","0.002","90","","1528","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H49 N3 O4 -","- C29 H49 N3 O4 -","- C58 H98 N6 O8 -","2","1","","Cicchi, Stefano; Ghini, Giacomo; Lascialfari, Luisa; Brandi, Alberto; Betti, Francesca; Berti, Debora; Ferrati, Silvia; Baglioni, Piero","A new organogelator based on an enantiopure C2 symmetric pyrrolidine.","Chemical communications (Cambridge, England)","2007","","14","1424","1426","10.1039/b614311c","","","1.54178","CuKα","","0.0975","0.0568","","","0.1481","0.1739","","","","","","0.887","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101814","9.7976","0.0012","14.057","0.003","14.7122","0.0016","90","","104.18","0.016","90","","1964.5","0.5","300","2","300","2","","","","","","","","8","I 1 2/m 1","-I 2y","12","","","","- C26 H63.84 Cl2 Cu2 Fe K0.08 N14 O3.92 -","- C26 H48 Cl2 Cu2 Fe K0.32 N14 O3.68 -","- C52 H96 Cl4 Cu4 Fe2 K0.64 N28 O7.36 -","2","0.25","","Mukhopadhyay, Uday; Grunert, C Matthias; Kusz, Joachim; Reiman, Sergey; Gütlich, P; Bernal, Ivan","57Fe Mössbauer spectroscopy predicts superstructure for K0.08[Cu(II)(N,N'app)Cl]2[Fe(III)(CN)6].0.92H3O.3H2O.","Chemical communications (Cambridge, England)","2007","","14","1444","1446","10.1039/b615130b","","","0.71073","MoKα","","0.0871","0.0557","","","0.1262","0.1495","","","","","","1.226","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101815","9.791","0.002","14.033","0.005","14.675","0.002","90","","104.16","0.02","90","","1955","0.9","250","2","250","2","","","","","","","","8","I 1 2/m 1","-I 2y","12","","","","- C26 H63.84 Cl2 Cu2 Fe K0.08 N14 O3.92 -","- C26 H48 Cl2 Cu2 Fe K0.32 N14 O3.68 -","- C52 H96 Cl4 Cu4 Fe2 K0.64 N28 O7.36 -","2","0.25","","Mukhopadhyay, Uday; Grunert, C Matthias; Kusz, Joachim; Reiman, Sergey; Gütlich, P; Bernal, Ivan","57Fe Mössbauer spectroscopy predicts superstructure for K0.08[Cu(II)(N,N'app)Cl]2[Fe(III)(CN)6].0.92H3O.3H2O.","Chemical communications (Cambridge, England)","2007","","14","1444","1446","10.1039/b615130b","","","0.71073","MoKα","","0.088","0.0552","","","0.1265","0.1519","","","","","","1.209","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101816","9.786","0.002","13.998","0.005","14.643","0.002","90","","104.17","0.02","90","","1944.8","0.8","200","2","200","2","","","","","","","","8","I 1 2/m 1","-I 2y","12","","","","- C26 H63.84 Cl2 Cu2 Fe K0.08 N14 O3.92 -","- C26 H48 Cl2 Cu2 Fe K0.32 N14 O3.68 -","- C52 H96 Cl4 Cu4 Fe2 K0.64 N28 O7.36 -","2","0.25","","Mukhopadhyay, Uday; Grunert, C Matthias; Kusz, Joachim; Reiman, Sergey; Gütlich, P; Bernal, Ivan","57Fe Mössbauer spectroscopy predicts superstructure for K0.08[Cu(II)(N,N'app)Cl]2[Fe(III)(CN)6].0.92H3O.3H2O.","Chemical communications (Cambridge, England)","2007","","14","1444","1446","10.1039/b615130b","","","0.71073","MoKα","","0.0718","0.052","","","0.1247","0.1408","","","","","","1.187","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101817","9.7836","0.0018","13.967","0.005","14.6155","0.0016","90","","104.11","0.02","90","","1936.9","0.8","150","2","150","2","","","","","","","","8","I 1 2/m 1","-I 2y","12","","","","- C26 H63.84 Cl2 Cu2 Fe K0.08 N14 O3.92 -","- C26 H48 Cl2 Cu2 Fe K0.32 N14 O3.68 -","- C52 H96 Cl4 Cu4 Fe2 K0.64 N28 O7.36 -","2","0.25","","Mukhopadhyay, Uday; Grunert, C Matthias; Kusz, Joachim; Reiman, Sergey; Gütlich, P; Bernal, Ivan","57Fe Mössbauer spectroscopy predicts superstructure for K0.08[Cu(II)(N,N'app)Cl]2[Fe(III)(CN)6].0.92H3O.3H2O.","Chemical communications (Cambridge, England)","2007","","14","1444","1446","10.1039/b615130b","","","0.71073","MoKα","","0.0577","0.0463","","","0.1111","0.1195","","","","","","1.181","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101818","9.8104","0.0012","13.967","0.003","14.6291","0.0016","90","","103.93","0.016","90","","1945.6","0.5","90","2","90","2","","","","","","","","8","I 1 2/m 1","-I 2y","12","","","","- C26 H63.84 Cl2 Cu2 Fe K0.08 N14 O3.92 -","- C26 H48 Cl2 Cu2 Fe K0.32 N14 O3.68 -","- C52 H96 Cl4 Cu4 Fe2 K0.64 N28 O7.36 -","2","0.25","","Mukhopadhyay, Uday; Grunert, C Matthias; Kusz, Joachim; Reiman, Sergey; Gütlich, P; Bernal, Ivan","57Fe Mössbauer spectroscopy predicts superstructure for K0.08[Cu(II)(N,N'app)Cl]2[Fe(III)(CN)6].0.92H3O.3H2O.","Chemical communications (Cambridge, England)","2007","","14","1444","1446","10.1039/b615130b","","","0.71073","MoKα","","0.0636","0.0606","","","0.1758","0.179","","","","","","1.142","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101819","8.7234","0.0001","9.6897","0.0003","16.9513","0.0005","74.6602","0.0012","76.7586","0.0016","76.8878","0.0016","1323.8","0.06","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C26 H28 Ag N5 O7 -","- C26 H28 Ag N5 O7 -","- C52 H56 Ag2 N10 O14 -","2","1","","Mukherjee, Partha S; Lopez, Nazario; Arif, Atta M; Cervantes-Lee, Francisco; Noveron, Juan C","Single-crystal to single-crystal phase transitions of bis(N-phenylisonicotinamide)silver(I) nitrate reveal cooperativity properties in porous molecular materials.","Chemical communications (Cambridge, England)","2007","","14","1433","1435","10.1039/b616502h","","","0.71073","MoKα","","0.0348","0.0285","","","0.0621","0.0657","","","","","","1.061","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101820","12.7187","0.0006","8.433","0.0002","21.2767","0.0009","90","","98.274","0.002","90","","2258.32","0.15","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 Ag N5 O5 -","- C24 H20 Ag N5 O5 -","- C96 H80 Ag4 N20 O20 -","4","1","","Mukherjee, Partha S; Lopez, Nazario; Arif, Atta M; Cervantes-Lee, Francisco; Noveron, Juan C","Single-crystal to single-crystal phase transitions of bis(N-phenylisonicotinamide)silver(I) nitrate reveal cooperativity properties in porous molecular materials.","Chemical communications (Cambridge, England)","2007","","14","1433","1435","10.1039/b616502h","","","0.71073","MoKα","","0.066","0.0371","","","0.0703","0.0796","","","","","","1.075","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101821","8.8731","0.0001","36.1311","0.0005","13.9696","0.0002","90","","93.3705","0.0005","90","","4470.83","0.1","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 Ag N5 O5 -","- C24 H20 Ag N5 O5 -","- C192 H160 Ag8 N40 O40 -","8","2","","Mukherjee, Partha S; Lopez, Nazario; Arif, Atta M; Cervantes-Lee, Francisco; Noveron, Juan C","Single-crystal to single-crystal phase transitions of bis(N-phenylisonicotinamide)silver(I) nitrate reveal cooperativity properties in porous molecular materials.","Chemical communications (Cambridge, England)","2007","","14","1433","1435","10.1039/b616502h","","","0.71073","MoKα","","0.0774","0.0414","","","0.0747","0.0843","","","","","","1.023","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101822","13.3239","0.0015","13.9985","0.0016","17.2947","0.0019","90","","95.309","0.003","90","","3211.9","0.6","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H21 Cl3 P2 Se6 -","- C29 H21 Cl3 P2 Se6 -","- C116 H84 Cl12 P8 Se24 -","4","1","","Hua, Guoxiong; Li, Yang; Slawin, Alexandra M Z; Woollins, J Derek","Unexpected four- and eight-membered organo P-Se heterocycles.","Chemical communications (Cambridge, England)","2007","","14","1465","1467","10.1039/b617418c","","","0.71073","MoKα","","0.1188","0.0729","","","0.1181","0.1353","","","","","","1.09","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101823","8.1765","0.001","25.499","0.003","9.2946","0.0011","90","","92.984","0.003","90","","1935.2","0.4","93","2","93","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H23 P Se2 -","- C18 H23 P Se2 -","- C72 H92 P4 Se8 -","4","1","","Hua, Guoxiong; Li, Yang; Slawin, Alexandra M Z; Woollins, J Derek","Unexpected four- and eight-membered organo P-Se heterocycles.","Chemical communications (Cambridge, England)","2007","","14","1465","1467","10.1039/b617418c","","","0.71073","MoKα","","0.05","0.0375","","","0.0995","0.1048","","","","","","1.169","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101824","11.7069","0.0014","13.5616","0.0017","16.717","0.002","90","","106.424","0.003","90","","2545.8","0.5","93","2","93","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H28 P2 Se4 -","- C24 H28 P2 Se4 -","- C96 H112 P8 Se16 -","4","1","","Hua, Guoxiong; Li, Yang; Slawin, Alexandra M Z; Woollins, J Derek","Unexpected four- and eight-membered organo P-Se heterocycles.","Chemical communications (Cambridge, England)","2007","","14","1465","1467","10.1039/b617418c","","","0.71073","MoKα","","0.0619","0.0456","","","0.1033","0.1103","","","","","","1.044","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101825","6.176","0.006","9.17","0.01","20.01","0.03","99.68","0.05","89.06","0.05","105.91","0.04","1074","7","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H14 F6 N2 S2 -","- C26 H14 F6 N2 S2 -","- C52 H28 F12 N4 S4 -","2","1","","Kojima, Takahiro; Nishida, Jun-Ichi; Tokito, Shizuo; Tada, Hirokazu; Yamashita, Yoshiro","Organic field-effect transistors based on heterocyclic co-oligomers containing a pyrazine ring.","Chemical communications (Cambridge, England)","2007","","14","1430","1432","10.1039/b617573b","","","0.7107","MoKα","","","0.0444","","","","0.1478","","","","","","1.311","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101826","11.0115","0.0007","13.5609","0.0007","13.9492","0.0007","86.153","0.003","73.058","0.003","72.371","0.002","1898.49","0.18","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C43 H54 N4 O3 -","- C43 H54 N4 O3 -","- C86 H108 N8 O6 -","2","1","","García-Garrido, Sergio E; Caltagirone, Claudia; Light, Mark E; Gale, Philip A","Acridinone-based anion receptors and sensors.","Chemical communications (Cambridge, England)","2007","","14","1450","1452","10.1039/b618072h","","","0.71073","MoKα","","0.18","0.0695","","","0.1579","0.2056","","","","","","0.929","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101827","8.6137","0.0006","16.7161","0.0014","20.852","0.0016","104.273","0.004","93.257","0.004","93.788","0.004","2895.1","0.4","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C59 H93 Cl2 N7 O3 -","- C59 H93 Cl2 N7 O3 -","- C118 H186 Cl4 N14 O6 -","2","1","","García-Garrido, Sergio E; Caltagirone, Claudia; Light, Mark E; Gale, Philip A","Acridinone-based anion receptors and sensors.","Chemical communications (Cambridge, England)","2007","","14","1450","1452","10.1039/b618072h","","","0.71073","MoKα","","0.2402","0.108","","","0.1831","0.2258","","","","","","1.048","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101828","13.934","0.002","13.934","0.002","48.052","0.01","90","","90","","120","","8080","2","293","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C48 H34 N24 O9 Zn7 -","- C48 H31.98 N24 O9 Zn7 -","- C288 H191.88 N144 O54 Zn42 -","6","0.166667","","Li, Jian-Rong; Tao, Ying; Yu, Qun; Bu, Xian-He","A pcu-type metal-organic framework with spindle [Zn7(OH)8]6+ cluster as secondary building units.","Chemical communications (Cambridge, England)","2007","","15","1527","1529","10.1039/b615675d","","","0.71073","MoKα","","0.0785","0.0507","","","0.1109","0.1231","","","","","","1.044","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101829","3.7987","0.0009","8.398","0.002","9.104","0.002","72.177","0.004","78.528","0.005","89.785","0.005","270.45","0.11","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H8 N2 -","- C16 H8 N2 -","- C16 H8 N2 -","1","0.5","","Li, Jian-Rong; Tao, Ying; Yu, Qun; Bu, Xian-He","A pcu-type metal-organic framework with spindle [Zn7(OH)8]6+ cluster as secondary building units.","Chemical communications (Cambridge, England)","2007","","15","1527","1529","10.1039/b615675d","","","0.71073","MoKα","","0.0947","0.0551","","","0.0946","0.1092","","","","","","0.997","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101830","12.3754","0.0017","17.081","0.002","18.753","0.003","90","","96.698","0.002","90","","3937","0.9","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C39 H62 Cr2 N4 O -","- C39 H62 Cr2 N4 O -","- C156 H248 Cr8 N16 O4 -","4","1","","Kreisel, Kevin A; Yap, Glenn P A; Theopold, Klaus H","A bimetallic N-heterocyclic carbene complex featuring a short Cr-Cr distance.","Chemical communications (Cambridge, England)","2007","","15","1510","1511","10.1039/b616685g","","","0.71073","MoKα","","0.0421","0.0392","","","0.102","0.1043","","","","","","1.029","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7101831","13.237","0.003","13.908","0.003","23.358","0.005","90","","95.11","0.03","90","","4283","1.5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H46 N12 Ni O13 S -","- C30 H32 N12 Ni O13 S -","- C120 H128 N48 Ni4 O52 S4 -","4","1","","Custelcean, Radu; Sellin, Vincent; Moyer, Bruce A","Sulfate separation by selective crystallization of a urea-functionalized metal-organic framework.","Chemical communications (Cambridge, England)","2007","","15","1541","1543","10.1039/b616761f","","","0.71073","MoKα","","0.1153","0.0825","","","0.2213","0.2542","","","","","","1.068","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101832","31.215","0.004","31.215","0.004","31.215","0.004","90","","90","","90","","30417","6","100","2","100","2","","","","","","","","5","F 2 3","F 2 2 3","196","","","","- C255 H263 Ag24 P17 S33 -","- C251.88 H255.72 Ag24 P17 S32 -","- C1007.52 H1022.88 Ag96 P68 S128 -","4","0.0833333","","Rothenberger, Alexander; Shafaei-Fallah, Maryam; Shi, Weifeng","A recipe for new organometallic polymers and oligomers? Synthesis and structure of an oligo- and a polymeric arrangement of P-S anions.","Chemical communications (Cambridge, England)","2007","","15","1499","1501","10.1039/b617177j","","","0.71073","MoKα","","0.0403","0.036","","","0.1053","0.1068","","","","","","1.122","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101833","10.86","0.0006","11.8116","0.0007","13.6914","0.0007","89.67","0.004","82.78","0.004","83.45","0.005","1730.89","0.17","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H19 Na2 O2 P S4 -","- C8 H19 Na2 O2 P S4 -","- C32 H76 Na8 O8 P4 S16 -","4","2","","Rothenberger, Alexander; Shafaei-Fallah, Maryam; Shi, Weifeng","A recipe for new organometallic polymers and oligomers? Synthesis and structure of an oligo- and a polymeric arrangement of P-S anions.","Chemical communications (Cambridge, England)","2007","","15","1499","1501","10.1039/b617177j","","","0.71073","MoKα","","0.0343","0.0235","","","0.0527","0.0549","","","","","","0.95","","","","has coordinates","183806","2020-10-21","18:00:00",""
"7101834","47.3348","0.0005","47.3348","0.0005","47.3348","0.0005","90","","90","","90","","106058","1.9","150","2","150","2","","","","","","","","5","F d -3 c :2","-F 4ud 2vw 3","228","","","","- C12 H17 N3 O2 Pt -","- C12 H17 N3 O2 Pt -","- C2304 H3264 N576 O384 Pt192 -","192","1","","Zhang, Fenbao; Jennings, Michael C; Puddephatt, Richard J","Organometallic molecular materials: self-assembly through hydrogen bonding of an organoplatinum network structure with zeolite-like topology.","Chemical communications (Cambridge, England)","2007","","15","1496","1498","10.1039/b617341a","","","0.71073","MoKα","","0.0619","0.0451","","","0.1237","0.1386","","","","","","1.078","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7101835","14.933","0.0005","21.9706","0.0007","23.9595","0.001","90","","101.809","0.002","90","","7694.4","0.5","150","2","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C61.2 H42.4 B2 Cl2.4 F30 N6 O7 Pt2 -","- C61.2 H42.4 B2 Cl2.4 F30 N6 O7 Pt2 -","- C244.8 H169.6 B8 Cl9.6 F120 N24 O28 Pt8 -","4","0.5","","Zhang, Fenbao; Jennings, Michael C; Puddephatt, Richard J","Organometallic molecular materials: self-assembly through hydrogen bonding of an organoplatinum network structure with zeolite-like topology.","Chemical communications (Cambridge, England)","2007","","15","1496","1498","10.1039/b617341a","","","0.71073","MoKα","","0.1437","0.1006","","","0.2711","0.2951","","","","","","1.071","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101836","18.165","0.004","5.1771","0.0009","22.063","0.005","90","","108.12","0.03","90","","1972","0.7","93","2","93","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C21 H21.5 N2 O5.25 P -","- C21 H21 N2 O5.25 P -","- C84 H84 N8 O21 P4 -","4","1","","Ropartz, Loïc; Meeuwenoord, Nico J; van der Marel, Gijsbert A; van Leeuwen, Piet W N M; Slawin, Alexandra M Z; Kamer, Paul C J","Phosphine containing oligonucleotides for the development of metallodeoxyribozymes.","Chemical communications (Cambridge, England)","2007","","15","1556","1558","10.1039/b617871e","","","0.71073","MoKα","","0.0622","0.0527","","","0.1244","0.1352","","","","","","1.11","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101837","9.087","0.001","16.597","0.001","21.913","0.001","90","","110.18","0.001","90","","3102","0.4","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H31 Br2 N Ni P2 -","- C33 H31 Br2 N Ni P2 -","- C132 H124 Br8 N4 Ni4 P8 -","4","1","","Buchard, Antoine; Auffrant, Audrey; Klemps, Christian; Vu-Do, Laurence; Boubekeur, Leïla; Goff, Xavier F Le; Floch, Pascal Le","Highly efficient P-N nickel(II) complexes for the dimerisation of ethylene.","Chemical communications (Cambridge, England)","2007","","15","1502","1504","10.1039/b618401d","","","0.71069","MoKα","","0.059","0.0315","","","0.0589","0.0652","","","","","","0.988","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101838","9.1394","0.0002","18.5785","0.0005","22.8438","0.0007","90","","91.218","0.002","90","","3877.92","0.18","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C9 H11 B N7 O S6 Tl -","- C9 H11 B N7 O S6 Tl -","- C72 H88 B8 N56 O8 S48 Tl8 -","8","2","","Gardinier, James R; Silva, Rosalice M; Gwengo, Chengeto; Lindeman, Sergey V","A 'metallic tape' stabilized by an unprecedented (mu5-kappa2,kappa2,kappa2,kappa1,kappa1-) scorpionate binding mode.","Chemical communications (Cambridge, England)","2007","","15","1524","1526","10.1039/b618519c","","","1.54178","CuKα","","0.0303","0.0265","","","0.0534","0.0545","","","","","","1.148","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101839","7.6916","0.0015","8.5113","0.0017","9.827","0.002","68.56","0.03","79.47","0.03","86.62","0.03","588.7","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H26 O16 Zn2 -","- C20 H26 O16 Zn2 -","- C20 H26 O16 Zn2 -","1","0.5","","Hawxwell, Samuel M; Espallargas, Guillermo Mínguez; Bradshaw, Darren; Rosseinsky, Matthew J; Prior, Timothy J; Florence, Alastair J; van de Streek, Jacco; Brammer, Lee","Ligand flexibility and framework rearrangement in a new family of porous metal-organic frameworks.","Chemical communications (Cambridge, England)","2007","","15","1532","1534","10.1039/b618796j","","","0.846","synchrotron","","0.0497","0.046","","","0.1241","0.1268","","","","","","1.059","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101840","13.0757","0.0006","14.1157","0.0007","16.6631","0.0008","66.602","0.001","87.138","0.001","89.757","0.001","2818.7","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C49 H59 N3 O30 Zn4 -","- C49 H53 N3 O30 Zn4 -","- C98 H106 N6 O60 Zn8 -","2","1","","Hawxwell, Samuel M; Espallargas, Guillermo Mínguez; Bradshaw, Darren; Rosseinsky, Matthew J; Prior, Timothy J; Florence, Alastair J; van de Streek, Jacco; Brammer, Lee","Ligand flexibility and framework rearrangement in a new family of porous metal-organic frameworks.","Chemical communications (Cambridge, England)","2007","","15","1532","1534","10.1039/b618796j","","","0.846","synchrotron","","0.0566","0.0499","","","0.1322","0.1377","","","","","","1.116","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101841","9.5471","0.0007","7.852","0.0007","8.4756","0.0006","91.891","0.004","107.086","0.003","100.815","0.004","593.9","0.08","298","","298","","","","","","","","see text","4","P -1","-P 1","2","","","","- C20 H20 O14 Zn2 -","- C20 H12 O14 Zn2 -","- C20 H12 O14 Zn2 -","1","0.5","","Hawxwell, Samuel M; Espallargas, Guillermo Mínguez; Bradshaw, Darren; Rosseinsky, Matthew J; Prior, Timothy J; Florence, Alastair J; van de Streek, Jacco; Brammer, Lee","Ligand flexibility and framework rearrangement in a new family of porous metal-organic frameworks.","Chemical communications (Cambridge, England)","2007","","15","1532","1534","10.1039/b618796j","powder diffraction","x-ray","1.54056","CuKα~1~","","","","","","","","","1.585","3.853","","","","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101842","9.4931","0.0003","9.4931","0.0003","22.1762","0.0008","90","","90","","120","","1730.75","0.1","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled to 100K at a rate of 120 Khr^-1^ for single-crystal X-ray diffraction analysis.","","synthesis as described","3","R 3 2 :H","R 3 2""","155","","","","- C28 H36 Ce -","- C27.9972 H35.9964 Ce -","- C83.9916 H107.989 Ce3 -","3","0.166667","","Ashley, Andrew; Balazs, Gabor; Cowley, Andrew; Green, Jennifer; Booth, Corwin H; O'Hare, Dermot","Bis(permethylpentalene)cerium‒another ambiguity in lanthanide oxidation state.","Chemical communications (Cambridge, England)","2007","","15","1515","1517","10.1039/b700303j","","","0.71073","MoKα","","0.0267","0.0267","","0.0282","0.0282","0.0282","","","","","","0.9774","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101843","18.4417","0.0016","19.043","0.0016","25.447","0.002","69.789","0.002","78.549","0.002","73.792","0.002","8001.2","1.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C157 H141 Mn14 N14 O50 Sr -","- C133 H105 Mn14 N2 O50 Sr -","- C266 H210 Mn28 N4 O100 Sr2 -","2","1","","Mishra, Abhudaya; Yano, Junko; Pushkar, Yulia; Yachandra, Vittal K; Abboud, Khalil A; Christou, George","Heteronuclear Mn-Ca/Sr complexes, and Ca/Sr EXAFS spectral comparisons with the oxygen-evolving complex of photosystem II.","Chemical communications (Cambridge, England)","2007","","15","1538","1540","10.1039/b701355h","","","0.71073","MoKα","","0.2011","0.0896","","","0.2069","0.2247","","","","","","1.001","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101844","7.8927","0.0002","10.0097","0.0002","14.9792","0.0003","99.4761","0.0007","101.899","0.0007","102.847","0.0007","1101.18","0.04","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","3","P -1","-P 1","2","","","","- C20 H36 Sn2 -","- C20 H36 Sn2 -","- C40 H72 Sn4 -","2","1","","Ashley, Andrew E; Cowley, Andrew R; O'Hare, Dermot","The hexamethylpentalene dianion and other reagents for organometallic pentalene chemistry.","Chemical communications (Cambridge, England)","2007","","15","1512","1514","10.1039/b702150j","","","0.71073","MoKα","","0.0315","0.0246","","0.0349","0.029","0.029","","","","","","1.0405","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101845","10.8575","0.0002","9.3133","0.0002","14.1063","0.0003","90","","90.8093","0.0007","90","","1426.27","0.05","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H50 Li2 N4 -","- C26 H50 Li2 N4 -","- C52 H100 Li4 N8 -","2","0.5","","Ashley, Andrew E; Cowley, Andrew R; O'Hare, Dermot","The hexamethylpentalene dianion and other reagents for organometallic pentalene chemistry.","Chemical communications (Cambridge, England)","2007","","15","1512","1514","10.1039/b702150j","","","0.71073","MoKα","","0.0934","0.0709","","0.1117","0.0961","0.0961","","","","","","1.0173","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101846","11.0008","0.0007","11.0008","0.0007","7.7052","0.0007","90","","90","","90","","932.46","0.12","296","2","296","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C12 H20 Br O8 Ru2 -","- C12 H20 Br O8 Ru2 -","- C24 H40 Br2 O16 Ru4 -","2","0.125","","Olea, David; González-Prieto, Rodrigo; Priego, José L; Barral, M Carmen; de Pablo, Pedro J; Torres, M Rosario; Gómez-Herrero, Julio; Jiménez-Aparicio, Reyes; Zamora, Félix","MMX polymer chains on surfaces.","Chemical communications (Cambridge, England)","2007","","16","1591","1593","10.1039/b613836e","","","0.71073","MoKα","","0.0285","0.0265","","","0.0665","0.0677","","","","","","1.145","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101847","14.606","0.003","9.7332","0.0017","12.753","0.002","90","","90","","90","","1813","0.5","203","2","203","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C18 H26 N3 Sb -","- C18 H26 N3 Sb -","- C72 H104 N12 Sb4 -","4","1","","Spinney, Heather A; Korobkov, Ilia; Richeson, Darrin S","Diamidonaphthalene-supported pnictogenium cations: synthesis of an N-heterocyclic stibenium cation by a novel protonation route.","Chemical communications (Cambridge, England)","2007","","16","1647","1649","10.1039/b617434e","","","0.71073","MoKα","","0.0307","0.024","","","0.0599","0.0643","","","","","","1.039","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101848","15.669","0.004","11.931","0.003","21.118","0.005","90","","92.125","0.004","90","","3945.3","1.5","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C37.6 H46.4 Cl2 N4 Sb2 -","- C37.6 H46.4 Cl2 N4 Sb2 -","- C150.4 H185.6 Cl8 N16 Sb8 -","4","1","","Spinney, Heather A; Korobkov, Ilia; Richeson, Darrin S","Diamidonaphthalene-supported pnictogenium cations: synthesis of an N-heterocyclic stibenium cation by a novel protonation route.","Chemical communications (Cambridge, England)","2007","","16","1647","1649","10.1039/b617434e","","","0.71073","MoKα","","0.0687","0.0459","","","0.1221","0.1351","","","","","","1.065","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101849","8.8383","0.0019","16.434","0.003","11.551","0.002","90","","106.825","0.003","90","","1606","0.6","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 As Cl N2 -","- C16 H20 As Cl N2 -","- C64 H80 As4 Cl4 N8 -","4","1","","Spinney, Heather A; Korobkov, Ilia; Richeson, Darrin S","Diamidonaphthalene-supported pnictogenium cations: synthesis of an N-heterocyclic stibenium cation by a novel protonation route.","Chemical communications (Cambridge, England)","2007","","16","1647","1649","10.1039/b617434e","","","0.71073","MoKα","","0.0439","0.0309","","","0.0711","0.0763","","","","","","1.035","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101850","7.233","0.002","17.314","0.006","19.58","0.007","90","","99.501","0.006","90","","2418.3","1.4","198","2","198","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17.75 H22 As Cl4 Ga N2 -","- C17.75 H22 As Cl4 Ga N2 -","- C71 H88 As4 Cl16 Ga4 N8 -","4","1","","Spinney, Heather A; Korobkov, Ilia; Richeson, Darrin S","Diamidonaphthalene-supported pnictogenium cations: synthesis of an N-heterocyclic stibenium cation by a novel protonation route.","Chemical communications (Cambridge, England)","2007","","16","1647","1649","10.1039/b617434e","","","0.71073","MoKα","","0.1085","0.0605","","","0.1343","0.155","","","","","","1.028","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101851","8.5648","0.0013","9.7606","0.0015","27.018","0.004","81.973","0.002","89.58","0.002","81.727","0.002","2213","0.6","203","2","203","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H54 F6 N6 O6 S2 Sb2 -","- C38 H54 F6 N6 O6 S2 Sb2 -","- C76 H108 F12 N12 O12 S4 Sb4 -","2","1","","Spinney, Heather A; Korobkov, Ilia; Richeson, Darrin S","Diamidonaphthalene-supported pnictogenium cations: synthesis of an N-heterocyclic stibenium cation by a novel protonation route.","Chemical communications (Cambridge, England)","2007","","16","1647","1649","10.1039/b617434e","","","0.71073","MoKα","","0.0599","0.0379","","","0.0869","0.0963","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101852","13.3366","0.0003","19.2741","0.0005","22.5169","0.0006","86.81","0.002","88.954","0.002","85.636","0.002","5761.7","0.3","100","2","100","2","","","","","prepared at 500 degrees C","","","3","P -1","-P 1","2","1,3,6,11,13,18,26,32,35,41,44,57-dodecakis(trifluoromethyl)- 1,3,6,11,13,18,26,32,35,41,44,57-dodecahydro(C!60$-I!h$)(5,6)fullerene benzene 1.5-solvate.","1,3,6,11,13,18,26,32,35,41,44,57-dodecakis(trifluoromethyl)- 1,3,6,11,13,18,26,32,35,41,44,57-dodecahydro(C~60~-I~h~)[5,6]fullerene benzene 1.5-solvate.","","- C81 H9 F36 -","- C81 H9 F36 -","- C324 H36 F144 -","4","2","","Kareev, Ivan E; Shustova, Natalia B; Peryshkov, Dmitry V; Lebedkin, Sergey F; Miller, Susie M; Anderson, Oren P; Popov, Alexey A; Boltalina, Olga V; Strauss, Steven H","X-ray structure and DFT study of C1-C60(CF3)12. A high-energy, kinetically-stable isomer prepared at 500 degrees C.","Chemical communications (Cambridge, England)","2007","","16","1650","1652","10.1039/b617489b","","x-ray","0.71073","MoKα","","0.0897","0.0561","","","0.1394","0.157","","","","","","1.063","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101853","11.0267","0.0017","6.9804","0.0011","11.2114","0.0017","90","","116.392","0.002","90","","773","0.2","173","","173","","","","","","","","","4","P 1 21 1","P 2yb","4","(S,aR)-1a","(S,aR)-1a","","- C18 H19 N O4 -","- C18 H19 N O4 -","- C36 H38 N2 O8 -","2","1","","Sakamoto, Masami; Unosawa, Atsushi; Kobaru, Shuichiro; Hasegawa, Yasuhiro; Mino, Takashi; Kasashima, Yoshio; Fujita, Tsutomu","Diastereoselective photocycloaddition using memory effect of molecular chirality controlled by crystallization.","Chemical communications (Cambridge, England)","2007","","16","1632","1634","10.1039/b617888j","","","0.71073","MoKα","","0.0391","0.0352","","","0.0884","0.0914","","","","","","1.057","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101854","7.6654","0.0005","12.799","0.0008","9.0881","0.0006","90","","99.486","0.001","90","","879.44","0.1","298","","298","","","","","","","","","4","P 1 21 1","P 2yb","4","(S,aR)-1b","(S,aR)-1b","","- C19 H21 N O4 -","- C19 H21 N O4 -","- C38 H42 N2 O8 -","2","1","","Sakamoto, Masami; Unosawa, Atsushi; Kobaru, Shuichiro; Hasegawa, Yasuhiro; Mino, Takashi; Kasashima, Yoshio; Fujita, Tsutomu","Diastereoselective photocycloaddition using memory effect of molecular chirality controlled by crystallization.","Chemical communications (Cambridge, England)","2007","","16","1632","1634","10.1039/b617888j","","","0.71073","MoKα","","0.0493","0.0445","","","0.1048","0.1129","","","","","","0.496","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101855","10.1974","0.0005","12.5011","0.0006","21.8192","0.001","90","","90","","90","","2781.5","0.2","223","","223","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(S)-2b","(S)-2b","","- C34 H30 N2 O4 -","- C34 H30 N2 O4 -","- C136 H120 N8 O16 -","4","1","","Sakamoto, Masami; Unosawa, Atsushi; Kobaru, Shuichiro; Hasegawa, Yasuhiro; Mino, Takashi; Kasashima, Yoshio; Fujita, Tsutomu","Diastereoselective photocycloaddition using memory effect of molecular chirality controlled by crystallization.","Chemical communications (Cambridge, England)","2007","","16","1632","1634","10.1039/b617888j","","","0.71073","MoKα","","0.0678","0.0418","","","0.1095","0.1332","","","","","","0.768","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101856","7.063","0.003","9.72","0.003","10.189","0.004","78.691","0.004","79.847","0.004","81.777","0.003","670.9","0.5","141","2","141","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H16 Cl2 O4 Pu -","- C8 H16 Cl2 O4 Pu -","- C16 H32 Cl4 O8 Pu2 -","2","1","","Gaunt, Andrew J; Reilly, Sean D; Hayton, Trevor W; Scott, Brian L; Neu, Mary P","An entry route into non-aqueous plutonyl coordination chemistry.","Chemical communications (Cambridge, England)","2007","","16","1659","1661","10.1039/b618577k","","","0.71073","MoKα","","0.082","0.0543","","","0.1038","0.1132","","","","","","1.093","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101857","12.9334","0.0003","13.9081","0.0004","14.194","0.0004","65.832","0.001","85.235","0.002","65.586","0.001","2109.69","0.1","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C104 H82 Mg2 N8 Na2 -","- C104 H82 Mg2 N8 Na2 -","- C104 H82 Mg2 N8 Na2 -","1","0.5","","Clegg, William; Dale, Sophie H; Graham, David V; Harrington, Ross W; Hevia, Eva; Hogg, Lorna M; Kennedy, Alan R; Mulvey, Robert E","Structural variations in bimetallic sodium-magnesium and sodium-zinc ketimides, and a sodium-zinc alkide-alkoxide-amide: connections to ring-stacking, ring-laddering, and inverse crown concepts.","Chemical communications (Cambridge, England)","2007","","16","1641","1643","10.1039/b618609b","","","0.71073","MoKα","","0.0894","0.0457","","","0.0872","0.103","","","","","","1.02","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101858","13.2031","0.0012","27.339","0.003","20.0914","0.0018","90","","92.909","0.002","90","","7242.8","1.1","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C86 H80 N6 Na2 Zn2 -","- C86 H80 N6 Na2 Zn2 -","- C344 H320 N24 Na8 Zn8 -","4","1","","Clegg, William; Dale, Sophie H; Graham, David V; Harrington, Ross W; Hevia, Eva; Hogg, Lorna M; Kennedy, Alan R; Mulvey, Robert E","Structural variations in bimetallic sodium-magnesium and sodium-zinc ketimides, and a sodium-zinc alkide-alkoxide-amide: connections to ring-stacking, ring-laddering, and inverse crown concepts.","Chemical communications (Cambridge, England)","2007","","16","1641","1643","10.1039/b618609b","","","0.71073","MoKα","","0.0881","0.078","","","0.1809","0.185","","","","","","1.328","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101859","10.38","0.002","17.783","0.003","22.035","0.004","90","","90","","90","","4067.2","1.4","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C34 H74 N4 Na2 O2 Zn2 -","- C34 H74 N4 Na2 O2 Zn2 -","- C136 H296 N16 Na8 O8 Zn8 -","4","1","","Clegg, William; Dale, Sophie H; Graham, David V; Harrington, Ross W; Hevia, Eva; Hogg, Lorna M; Kennedy, Alan R; Mulvey, Robert E","Structural variations in bimetallic sodium-magnesium and sodium-zinc ketimides, and a sodium-zinc alkide-alkoxide-amide: connections to ring-stacking, ring-laddering, and inverse crown concepts.","Chemical communications (Cambridge, England)","2007","","16","1641","1643","10.1039/b618609b","","","0.71073","MoKα","","0.0588","0.0493","","","0.109","0.1134","","","","","","1.152","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101860","15.1205","0.0015","16.2501","0.0016","25.15","0.003","104.966","0.005","100.672","0.005","105.931","0.005","5518.3","1","190","1","190","1","","","","","","","","5","P -1","-P 1","2","tetra(rctt-1,2-bis(2-pyridyl)-3,4-bis(3-pyridyl)cyclobutane copper(ii) nitrate) hydrate acetonitrile 1/13.5/1","tetra[rctt-1,2-bis(2-pyridyl)-3,4-bis(3-pyridyl)cyclobutane copper(II) nitrate] hydrate acetonitrile 1/13.5/1","","- C98 H118 Cu4 N25 O41.5 -","- C98 H83 Cu4 N25 O41.5 -","- C196 H166 Cu8 N50 O83 -","2","1","","Hamilton, Tamara D; Bucar, Dejan-Kresimir; MacGillivray, Leonard R","Coding a coordination-driven self-assembly via a hydrogen bond-directed solid-state synthesis: an unexpected chiral tetrahedral capsule.","Chemical communications (Cambridge, England)","2007","","16","1603","1604","10.1039/b700748e","","","0.71073","MoKα","","0.1234","0.0778","","","0.214","0.2428","","","","","","1.069","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101861","10.894","0.002","9.1577","0.0018","14.177","0.003","90","","90.888","0.003","90","","1414.2","0.5","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 N4 -","- C16 H14 N4 -","- C64 H56 N16 -","4","1","","Wang, Yaobing; Fu, Hongbing; Peng, Aidong; Zhao, Yongsheng; Ma, Jinshi; Ma, Ying; Yao, Jiannian","Distinct nanostructures from isomeric molecules of bis(iminopyrrole) benzenes: effects of molecular structures on nanostructural morphologies.","Chemical communications (Cambridge, England)","2007","","16","1623","1625","10.1039/b701327b","","","0.71073","MoKα","","0.1153","0.0497","","","0.1404","0.1666","","","","","","1.018","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101862","10.2048","0.001","15.5662","0.0015","17.4159","0.0017","90","","90","","90","","2766.5","0.5","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C16 H14 N4 -","- C16 H14 N4 -","- C128 H112 N32 -","8","1","","Wang, Yaobing; Fu, Hongbing; Peng, Aidong; Zhao, Yongsheng; Ma, Jinshi; Ma, Ying; Yao, Jiannian","Distinct nanostructures from isomeric molecules of bis(iminopyrrole) benzenes: effects of molecular structures on nanostructural morphologies.","Chemical communications (Cambridge, England)","2007","","16","1623","1625","10.1039/b701327b","","","0.71073","MoKα","","0.0571","0.0369","","","0.0914","0.0999","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101863","34.919","0.007","17.106","0.003","14.362","0.003","90","","93.49","0.03","90","","8563","3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C16 H14 N4 -","- C16 H14 N4 -","- C384 H336 N96 -","24","3","","Wang, Yaobing; Fu, Hongbing; Peng, Aidong; Zhao, Yongsheng; Ma, Jinshi; Ma, Ying; Yao, Jiannian","Distinct nanostructures from isomeric molecules of bis(iminopyrrole) benzenes: effects of molecular structures on nanostructural morphologies.","Chemical communications (Cambridge, England)","2007","","16","1623","1625","10.1039/b701327b","","","0.71073","MoKα","","0.2855","0.1205","","","0.1771","0.2118","","","","","","0.98","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101864","5.4654","0.0002","10.5477","0.0003","11.0731","0.0003","73.134","0.001","89.326","0.001","78.226","0.002","597.26","0.03","100","2","100","2","","","","","","","synthesis as described","5","P 1","P 1","1","","","","- C26 H26 Br N3 O3 -","- C26 H26 Br N3 O3 -","- C26 H26 Br N3 O3 -","1","1","","Niess, Barbara; Jørgensen, Karl Anker","The asymmetric vinylogous Mannich reaction of dicyanoalkylidenes with alpha-amido sulfones under phase-transfer conditions.","Chemical communications (Cambridge, England)","2007","","16","1620","1622","10.1039/b702172k","","x-ray","0.71073","MoKα","","0.0371","0.0299","","","0.0662","0.0682","","","","","","1.012","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101865","25.042","0.005","8.248","0.003","20.208","0.003","90","","99.66","0.02","90","","4114.7","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H56 Cs2 O23 P2 -","- C24 H50 Cs2 O23 P2 -","- C96 H200 Cs8 O92 P8 -","4","0.5","","Braga, Dario; Polito, Marco; Dichiarante, Elena; Rubini, Katia; Grepioni, Fabrizia","Reversible solid-state reaction between 18-Crown[6] and M[H2PO4](M = K, Rb, Cs) and an investigation of the decomplexation process.","Chemical communications (Cambridge, England)","2007","","16","1594","1596","10.1039/b702301d","","","0.71073","MoKα","","0.0462","0.0354","","","0.0964","0.1032","","","","","","1.025","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101866","20.281","0.004","8.35","0.003","24.411","0.006","90","","92.69","0.02","90","","4129","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H30 K O12 P -","- C12 H28 K O12 P -","- C96 H224 K8 O96 P8 -","8","1","","Braga, Dario; Polito, Marco; Dichiarante, Elena; Rubini, Katia; Grepioni, Fabrizia","Reversible solid-state reaction between 18-Crown[6] and M[H2PO4](M = K, Rb, Cs) and an investigation of the decomplexation process.","Chemical communications (Cambridge, England)","2007","","16","1594","1596","10.1039/b702301d","","","0.71073","MoKα","","0.0617","0.0487","","","0.1327","0.1426","","","","","","1.03","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101867","25.266","0.006","8.59","0.005","19.394","0.006","90","","103.47","0.02","90","","4093","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H30 O12 P Rb -","- C12 H24 O12 P Rb -","- C96 H192 O96 P8 Rb8 -","8","1","","Braga, Dario; Polito, Marco; Dichiarante, Elena; Rubini, Katia; Grepioni, Fabrizia","Reversible solid-state reaction between 18-Crown[6] and M[H2PO4](M = K, Rb, Cs) and an investigation of the decomplexation process.","Chemical communications (Cambridge, England)","2007","","16","1594","1596","10.1039/b702301d","","","0.71073","MoKα","","0.0769","0.0433","","","0.1127","0.1283","","","","","","1.036","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101868","8.861","0.008","8.889","0.008","11.511","0.01","69.451","0.012","67.99","0.011","64.692","0.011","739.9","1.1","141","2","141","2","","","","","","","","5","P -1","-P 1","2","","","","- C6 H24 Na8 O34 Pu2 -","- C6 Na8 O34 Pu2 -","- C6 Na8 O34 Pu2 -","1","0.5","","Runde, Wolfgang; Brodnax, Lia F; Goff, George S; Peper, Shane M; Taw, Felicia L; Scott, Brian L","Synthesis and structural characterization of a molecular plutonium(IV) compound constructed from dimeric building blocks.","Chemical communications (Cambridge, England)","2007","","17","1728","1729","10.1039/b617878b","","","0.71073","MoKα","","0.0349","0.0311","","","0.0856","0.0872","","","","","","1.052","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101869","56.792","0.011","14.331","0.003","32.17","0.006","90","","90","","90","","26183","9","100","2","100","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","","","- C96 H72 Cu3 N30 O30 -","- C96 H72 Cu3 N26 O22 -","- C384 H288 Cu12 N104 O88 -","4","0.5","","Hong, Seunghee; Zou, Yang; Moon, Dohyun; Lah, Myoung Soo","An unprecedented twofold interpenetrating (3,4)-connected 3-D metal-organic framework.","Chemical communications (Cambridge, England)","2007","","17","1707","1709","10.1039/b702216f","","","0.7","synchrotron","","0.1664","0.0787","","","0.1739","0.193","","","","","","0.688","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7101870","15.7008","0.0009","16.1532","0.0009","19.0307","0.0011","90","","90","","90","","4826.5","0.5","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C82 H16 N2 O2 S5 -","- C82 H16 N2 O2 S5 -","- C328 H64 N8 O8 S20 -","4","1","","Chuang, Shih-Ching; Murata, Yasujiro; Murata, Michihisa; Komatsu, Koichi","The outside knows the difference inside: trapping helium by immediate reduction of the orifice size of an open-cage fullerene and the effect of encapsulated helium and hydrogen upon the NMR of a proton directly attached to the outside.","Chemical communications (Cambridge, England)","2007","","17","1751","1753","10.1039/b702589k","","","0.71073","MoKα","","0.0618","0.043","","","0.0666","0.0696","","","","","","1.036","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101871","7.3811","0.0003","12.132","0.0004","17.4317","0.0007","76","0.002","85.986","0.002","85.254","0.002","1507.39","0.1","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H34 Cl N5 O2 -","- C29 H34 Cl N5 O2 -","- C58 H68 Cl2 N10 O4 -","2","1","","Gale, Philip A; Garric, Joachim; Light, Mark E; McNally, Beth A; Smith, Bradley D","Conformational control of HCl co-transporter: imidazole functionalised isophthalamide vs. 2,6-dicarboxamidopyridine.","Chemical communications (Cambridge, England)","2007","","17","1736","1738","10.1039/b703259e","","","0.71073","MoKα","","0.0862","0.068","","","0.157","0.1678","","","","","","1.048","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101872","10.966","0.002","14.272","0.003","15.942","0.003","90","","91.88","0.03","90","","2493.8","0.9","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H20 F4 P2 -","- C30 H20 F4 P2 -","- C120 H80 F16 P8 -","4","1","","Kaufhold, Oliver; Stasch, Andreas; Edwards, Peter G; Hahn, F Ekkehardt","Template controlled synthesis of a coordinated [11]ane-P2C NHC macrocycle.","Chemical communications (Cambridge, England)","2007","","18","1822","1824","10.1039/b617033a","","","0.71073","MoKα","","0.0689","0.0457","","","0.095","0.1038","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101873","8.8522","0.0018","10.297","0.002","12.389","0.003","90","","107.84","0.03","90","","1075","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H6 Cl N2 O4 Re -","- C7 H6 Cl N2 O4 Re -","- C28 H24 Cl4 N8 O16 Re4 -","4","1","","Kaufhold, Oliver; Stasch, Andreas; Edwards, Peter G; Hahn, F Ekkehardt","Template controlled synthesis of a coordinated [11]ane-P2C NHC macrocycle.","Chemical communications (Cambridge, England)","2007","","18","1822","1824","10.1039/b617033a","","","0.71073","MoKα","","0.0312","0.0264","","","0.0596","0.0619","","","","","","1.039","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101874","11.201","0.005","11.8","0.005","20.504","0.005","92.239","0.005","100.058","0.005","117.123","0.005","2353.1","1.6","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C48 H50 Cl F4 N2 O6 P2 Re -","- C48 H42 Cl F4 N2 O6 P2 Re -","- C96 H84 Cl2 F8 N4 O12 P4 Re2 -","2","1","","Kaufhold, Oliver; Stasch, Andreas; Edwards, Peter G; Hahn, F Ekkehardt","Template controlled synthesis of a coordinated [11]ane-P2C NHC macrocycle.","Chemical communications (Cambridge, England)","2007","","18","1822","1824","10.1039/b617033a","","","0.71069","MoKα","","0.0448","0.0415","","","0.0987","0.1005","","","","","","1.095","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101875","9.03","0.005","10.898","0.005","19.929","0.005","75.388","0.005","82.356","0.005","68.013","0.005","1758.1","1.3","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C36 H30 Cl F2 N2 O6 P2 Re -","- C36 H24 Cl F2 N2 O6 P2 Re -","- C72 H48 Cl2 F4 N4 O12 P4 Re2 -","2","1","","Kaufhold, Oliver; Stasch, Andreas; Edwards, Peter G; Hahn, F Ekkehardt","Template controlled synthesis of a coordinated [11]ane-P2C NHC macrocycle.","Chemical communications (Cambridge, England)","2007","","18","1822","1824","10.1039/b617033a","","","0.71069","MoKα","","0.0368","0.0308","","","0.066","0.069","","","","","","1.045","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101876","13.9166","0.001","24.2125","0.001","18.0515","0.001","90","0.001","109.117","0.001","90","0.001","5747.1","0.6","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H118 N12 Ni13 O100 Si2 W18 -","- C18 H66 N12 Ni13 O100 Si2 W18 -","- C36 H132 N24 Ni26 O200 Si4 W36 -","2","0.5","","Zheng, Shou-Tian; Yuan, Da-Qiang; Jia, Hong-Peng; Zhang, Jie; Yang, Guo-Yu","Combination between lacunary polyoxometalates and high-nuclear transition metal clusters under hydrothermal conditions: I. from isolated cluster to 1-D chain.","Chemical communications (Cambridge, England)","2007","","18","1858","1860","10.1039/b617191e","","","0.71073","MoKα","","0.0507","0.0448","","","0.1109","0.1159","","","","","","1.058","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7101877","16.017","0.004","22.536","0.005","17.176","0.004","90","","103.655","0.004","90","","6025","2","294","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H130 N16 Ni13 O96 Si2 W18 -","- C24 H86 N16 Ni13 O96 Si2 W18 -","- C48 H172 N32 Ni26 O192 Si4 W36 -","2","0.5","","Zheng, Shou-Tian; Yuan, Da-Qiang; Jia, Hong-Peng; Zhang, Jie; Yang, Guo-Yu","Combination between lacunary polyoxometalates and high-nuclear transition metal clusters under hydrothermal conditions: I. from isolated cluster to 1-D chain.","Chemical communications (Cambridge, England)","2007","","18","1858","1860","10.1039/b617191e","","","0.71073","MoKα","","0.05","0.0434","","","0.1088","0.1145","","","","","","1.021","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7101878","15.503","0.003","23.24","0.005","18.428","0.004","90","","107.11","0.004","90","","6346","2","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H132 N16 Ni13 O98 P2 W18 -","- C28 H92 N16 Ni13 O98 P2 W18 -","- C56 H184 N32 Ni26 O196 P4 W36 -","2","0.5","","Zheng, Shou-Tian; Yuan, Da-Qiang; Jia, Hong-Peng; Zhang, Jie; Yang, Guo-Yu","Combination between lacunary polyoxometalates and high-nuclear transition metal clusters under hydrothermal conditions: I. from isolated cluster to 1-D chain.","Chemical communications (Cambridge, England)","2007","","18","1858","1860","10.1039/b617191e","","","0.71073","MoKα","","0.0566","0.0444","","","0.1253","0.1466","","","","","","1.095","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7101879","16.4477","0.0003","19.4046","0.0003","16.2221","0.0001","90","","90","","90","","5177.46","0.13","274","2","274","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C12 H54 N9 Ni6 O43 P W9 -","- C12 H42 N9 Ni6 O43 P W9 -","- C48 H168 N36 Ni24 O172 P4 W36 -","4","0.5","","Zheng, Shou-Tian; Yuan, Da-Qiang; Jia, Hong-Peng; Zhang, Jie; Yang, Guo-Yu","Combination between lacunary polyoxometalates and high-nuclear transition metal clusters under hydrothermal conditions: I. from isolated cluster to 1-D chain.","Chemical communications (Cambridge, England)","2007","","18","1858","1860","10.1039/b617191e","","","0.71073","MoKα","","","0.0409","","","0.0826","0.0864","","","","","","1.188","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7101880","21.5203","0.0006","10.2141","0.0003","16.785","0.0004","90","","98.044","0.001","90","","3653.22","0.17","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C46.5 H45 Cl O -","- C46.5 H45 Cl O -","- C186 H180 Cl4 O4 -","4","0.5","","Liao, Yuan-Li; Lin, Chi-Yen; Liu, Yi-Hung; Wong, Ken-Tsung; Hung, Wen-Yi; Chen, Wei-Jiun","An unprecedented ambipolar charge transport material exhibiting balanced electron and hole mobilities.","Chemical communications (Cambridge, England)","2007","","18","1831","1833","10.1039/b617821a","","","0.71073","MoKα","","0.1307","0.0678","","","0.16","0.1965","","","","","","1.032","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101881","11.0842","0.0009","30.12","0.003","10.5929","0.0009","90","","107.816","0.003","90","","3366.9","0.5","243","2","243","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4-Dimethyl-(1 RS, 7 SR)-2,6-Dioxa-3,3,5,5-tetrakis (trimethylsilyl)-3,4,5-trisila-cis-bicyclo[5.3.1]undecane","","- C20 H52 O2 Si7 -","- C20 H52 O2 Si7 -","- C80 H208 O8 Si28 -","4","1","","Krempner, Clemens; Ludwig, Ralf; Flemming, Anke; Miethchen, Ralf; Köckerling, Martin","Twisted oxygen-containing oligosilanes‒unprecedented examples of sigma-n mixed conjugated systems.","Chemical communications (Cambridge, England)","2007","","18","1810","1812","10.1039/b618438c","","","0.71073","MoKα","","0.0815","0.0574","","","0.1432","0.1557","","","","","","1.041","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101882","10.1051","0.0007","23.259","0.002","25.278","0.002","90","","90","","90","","5941.2","0.7","296","2","296","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","2,4-Dihydroxy-1,1,1,3,3,5,5,5-octamethyl-2,4-bis(trimethylsilyl)- pentasilane","","- C14 H44 O2 Si7 -","- C14 H44 O2 Si7 -","- C112 H352 O16 Si56 -","8","1","","Krempner, Clemens; Ludwig, Ralf; Flemming, Anke; Miethchen, Ralf; Köckerling, Martin","Twisted oxygen-containing oligosilanes‒unprecedented examples of sigma-n mixed conjugated systems.","Chemical communications (Cambridge, England)","2007","","18","1810","1812","10.1039/b618438c","","","0.71073","MoKα","","0.073","0.0427","","","0.1186","0.1355","","","","","","1.014","","","","has coordinates,has disorder","180120","2020-10-21","18:00:00",""
"7101883","23.624","0.002","14.0305","0.001","12.2973","0.0008","90","","90.572","0.006","90","","4075.8","0.5","140","2","140","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H66 Cl4 O2 Ru2 -","- C38 H66 Cl4 O2 Ru2 -","- C152 H264 Cl16 O8 Ru8 -","4","1","","Gauthier, Sébastien; Solari, Euro; Dutta, Barnali; Scopelliti, Rosario; Severin, Kay","A new coupling reaction for the synthesis of ruthenium half-sandwich complexes with sterically demanding cyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2007","","18","1837","1839","10.1039/b618712a","","","0.71073","MoKα","","0.0823","0.0586","","","0.1438","0.1557","","","","","","0.995","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101884","17.879","0.003","9.4034","0.0007","20.216","0.0016","90","","92.158","0.008","90","","3396.3","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H48 Cl O P Ru -","- C37 H48 Cl O P Ru -","- C148 H192 Cl4 O4 P4 Ru4 -","4","1","","Gauthier, Sébastien; Solari, Euro; Dutta, Barnali; Scopelliti, Rosario; Severin, Kay","A new coupling reaction for the synthesis of ruthenium half-sandwich complexes with sterically demanding cyclopentadienyl ligands.","Chemical communications (Cambridge, England)","2007","","18","1837","1839","10.1039/b618712a","","","0.71073","MoKα","","0.0534","0.0361","","","0.073","0.0814","","","","","","1.123","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101885","13.531","0.001","15.467","0.001","15.721","0.001","115.44","0.01","110.2","0.01","91.18","0.01","2732.4","0.3","223","2","223","2","","","","","","","","9","P -1","-P 1","2","","","","- C48 H56 Cl3 Er F3 K N6 O10 S -","- C48 H56 Cl3 Er F3 K N6 O10 S -","- C96 H112 Cl6 Er2 F6 K2 N12 O20 S2 -","2","1","","Albrecht, Markus; Osetska, Olga; Klankermayer, Jürgen; Fröhlich, Roland; Gumy, Frédéric; Bünzli, Jean-Claude G","Enhancement of near-IR emission by bromine substitution in lanthanide complexes with 2-carboxamide-8-hydroxyquinoline.","Chemical communications (Cambridge, England)","2007","","18","1834","1836","10.1039/b618918k","","","0.71073","MoKα","","0.0645","0.0461","","","0.1064","0.1146","","","","","","1.012","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101886","27.425","0.001","15.739","0.001","23.156","0.001","90","","90","","90","","9995.1","0.8","223","2","223","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C42 H39 Br6 N6 O6 Yb -","- C42 H39 Br6 N6 O6 Yb -","- C336 H312 Br48 N48 O48 Yb8 -","8","1","","Albrecht, Markus; Osetska, Olga; Klankermayer, Jürgen; Fröhlich, Roland; Gumy, Frédéric; Bünzli, Jean-Claude G","Enhancement of near-IR emission by bromine substitution in lanthanide complexes with 2-carboxamide-8-hydroxyquinoline.","Chemical communications (Cambridge, England)","2007","","18","1834","1836","10.1039/b618918k","","","0.71073","MoKα","","0.1343","0.0773","","","0.2013","0.2277","","","","","","1.07","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101887","10.828","0.0009","13.8006","0.0011","14.7237","0.0011","82.033","0.001","79.093","0.001","67.676","0.001","1993.1","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C47 H51 I Mn N4 -","- C47 H51 I Mn N4 -","- C94 H102 I2 Mn2 N8 -","2","1","","Bröring, Martin; Hell, Christian; Brandt, Carsten D","Iodomanganesecorrole - a stable Mn IV -I species.","Chemical communications (Cambridge, England)","2007","","18","1861","1862","10.1039/b700411g","","","0.71073","MoKα","","0.0355","0.0334","","","0.0842","0.0855","","","","","","1.094","","","","has coordinates","180120","2020-10-21","18:00:00",""
"7101888","23.78","0.01","4.56","0.003","11.134","0.007","90","","90","","90","","1207.3","1.2","298","","","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C14 H14 N2 O2 -","- C14 H14 N2 O2 -","- C56 H56 N8 O8 -","4","1","","Batchu, Venkateswara Rao; Barange, Deepak Kumar; Kumar, Dinesh; Sreekanth, Bukkapattanam R.; Vyas, K.; Reddy, E. Amarender; Pal, Manojit","Tandem C‒C coupling ‒ intramolecular acetylenic Schmidt reaction under Pd/C‒Cu catalysis","Chemical Communications (Cambridge, United Kingdom)","2007","","19","1966","1968","10.1039/b617823e","","","0.7107","MoKα","","","0.056","","","","0.065","","","","","","1.12","","","","has coordinates","210680","2020-10-21","18:00:00",""
"7101889","34.229","0.002","34.229","0.002","6.4878","0.0006","90","","90","","120","","6583.1","0.9","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C15 H17 Br O3 -","- C15 H17 Br O3 -","- C270 H306 Br18 O54 -","18","1","","Xu, Zheng-Hu; Zhu, Sha-Na; Sun, Xiu-Li; Tang, Yong; Dai, Li-Xin","Sidearm effects in the enantioselective cyclopropanation of alkenes with aryldiazoacetates catalyzed by trisoxazoline/Cu(I)","Chemical Communications (Cambridge, United Kingdom)","2007","","19","1960","1962","10.1039/b617967c","","","0.71073","MoKα","","0.0978","0.0782","","","0.1774","0.1826","","","","","","1.134","","","","has coordinates,has disorder","210458","2020-10-21","18:00:00",""
"7101890","12.3107","0.0008","13.0253","0.0008","21.6485","0.0014","90","","101.913","0.002","90","","3396.6","0.4","160","2","160","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H29.5 Cl3 Mo N2.5 P2 -","- C37 H29.5 Cl3 Mo N2.5 P2 -","- C148 H118 Cl12 Mo4 N10 P8 -","4","1","","Redshaw, Carl; Gibson, Vernon C.; Elsegood, Mark R. J.; Clegg, William","New coordination modes at molybdenum for 2-diphenylphosphinoaniline derived ligands","Chemical Communications (Cambridge, United Kingdom)","2007","","19","1951","1953","10.1039/b700158d","","","0.71073","MoKα","","0.0282","0.0247","","","0.0593","0.0614","","","","","","1.097","","","","has coordinates","210718","2020-10-21","18:00:00",""
"7101891","11.2101","0.0005","12.7462","0.0006","18.1549","0.0009","104.754","0.002","102.967","0.002","92.947","0.002","2428.3","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H52 Cl2 Mo2 N6 P2 -","- C48 H52 Cl2 Mo2 N6 P2 -","- C96 H104 Cl4 Mo4 N12 P4 -","2","1","","Redshaw, Carl; Gibson, Vernon C.; Elsegood, Mark R. J.; Clegg, William","New coordination modes at molybdenum for 2-diphenylphosphinoaniline derived ligands","Chemical Communications (Cambridge, United Kingdom)","2007","","19","1951","1953","10.1039/b700158d","","","0.71073","MoKα","","0.0482","0.0325","","","0.0699","0.0765","","","","","","1.047","","","","has coordinates","210718","2020-10-21","18:00:00",""
"7101892","9.535","0.0001","15.4639","0.0002","21.5139","0.0003","97.2304","0.0004","96.0597","0.0005","92.7702","0.0006","3123.27","0.07","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H52 F6 N13 O4 P Ru2 -","- C70 H52 F6 N13 O4 P Ru2 -","- C140 H104 F12 N26 O8 P2 Ru4 -","2","1","","Wadman, Sipke H.; Kroon, Jan M.; Bakker, Klaas; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard","Cyclometalated ruthenium complexes for sensitizing nanocrystalline TiO2 solar cells","Chemical Communications (Cambridge, United Kingdom)","2007","","19","1907","1909","10.1039/b703636a","","","0.71073","MoKα","","0.05","0.0362","","","0.0878","0.0955","","","","","","1.035","","","","has coordinates,has disorder","210736","2020-10-21","18:00:00",""
"7101893","4.6959","0.0007","14.281","0.002","15.472","0.002","93.424","0.004","92.917","0.004","94.217","0.004","1031.3","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","perylenemonoimide 1","","","- C28 H24 N2 O2 -","- C28 H24 N2 O2 -","- C56 H48 N4 O4 -","2","1","","Huang, Liming; Catalano, Vincent J.; Tam-Chang, Suk-Wah","Anisotropic fluorescent materials via self-organization of perylenedicarboximide","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2016","2018","10.1039/b615802a","","","0.71073","MoKα","","0.0792","0.0472","","","0.0963","0.1083","","","","","","1.011","","","","has coordinates","210582","2020-10-21","18:00:00",""
"7101894","8.7558","0.0001","16.6604","0.0003","21.5919","0.0004","90","","99.6544","0.0007","90","","3105.11","0.09","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H14 Cu4 N12 Na4 O23 -","- C16 Cu4 N12 Na4 O23 -","- C64 Cu16 N48 Na16 O92 -","4","0.5","","Yue, Yan-Feng; Wang, Bing-Wu; Gao, En-Qing; Fang, Chen-Jie; He, Cheng; Yan, Chun-Hua","A novel three-dimensional heterometallic compound: templated assembly of the unprecedented planar ""Na⊂[Cu4]"" metalloporphyrin-like subunits","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2034","2036","10.1039/b618296h","","","0.71073","MoKα","","0.0734","0.0347","","","0.097","0.1054","","","","","","0.996","","","","has coordinates","210633","2020-10-21","18:00:00",""
"7101895","8.9991","0.0006","12.2314","0.0005","27.8178","0.0018","90","","93.695","0.008","90","","3055.6","0.3","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Bis-(1,3-di(isopropyl)imidazol-2- ylidene)(methylsulfoxyl)(methyl)nickel(ii)","Bis-{1,3-di(isopropyl)imidazol-2-ylidene)(methylsulfoxyl)(methyl)nickel(II)","","- C27 H46 N4 Ni O S -","- C27 H46 N4 Ni O S -","- C108 H184 N16 Ni4 O4 S4 -","4","1","","Schaub, Thomas; Backes, Marc; Radius, Udo","Unusual nickel-mediated C‒S cleavage of alkyl and aryl sulfoxides","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2037","2039","10.1039/b618632g","","","0.71073","MoKα","","0.0632","0.04","","","0.0945","0.1047","","","","","","0.989","","","","has coordinates","210514","2020-10-21","18:00:00",""
"7101896","39.444","0.0018","10.166","0.0014","17.216","0.003","90","","100.999","0.018","90","","6776.5","1.4","203","2","203","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Bis-(1,3-di(isopropyl)imidazol-2- ylidene)(methylsulfoxyl)(phenyl)nickel(ii)","Bis-{1,3-di(isopropyl)imidazol-2-ylidene}(methylsulfoxyl)(phenyl)nickel(II)","","- C30.5 H47.5 N4 Ni O1.5 S -","- C30.5 H47.5 N4 Ni O1.5 S -","- C244 H380 N32 Ni8 O12 S8 -","8","1","","Schaub, Thomas; Backes, Marc; Radius, Udo","Unusual nickel-mediated C‒S cleavage of alkyl and aryl sulfoxides","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2037","2039","10.1039/b618632g","","","0.71073","MoKα","","0.0587","0.0486","","","0.142","0.152","","","","","","1.071","","","","has coordinates","210514","2020-10-21","18:00:00",""
"7101897","10.861","0.002","19.288","0.004","28.695","0.006","90","","90","","90","","6011","2","203","2","203","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Bis-(1,3-di(isopropyl)imidazol-2-ylidene- )(Phenylthiooxyl)(phenyl)nickel(ii)","Bis-{1,3-di(isopropyl)imidazol-2-ylidene-}(Phenylthiooxyl)(phenyl)nickel(II)","","- C30 H42 N4 Ni O S -","- C30 H42 N4 Ni O S -","- C240 H336 N32 Ni8 O8 S8 -","8","1","","Schaub, Thomas; Backes, Marc; Radius, Udo","Unusual nickel-mediated C‒S cleavage of alkyl and aryl sulfoxides","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2037","2039","10.1039/b618632g","","","0.71073","MoKα","","0.0816","0.0645","","","0.1696","0.2007","","","","","","1.255","","","","has coordinates","210514","2020-10-21","18:00:00",""
"7101898","13.313","0.002","10.946","0.002","15.148","0.003","90","","110.86","0.02","90","","2062.7","0.6","173","2","173","2","","","","","","","","7","C 1 c 1","C -2yc","9","060036","","","- C11 H23 F6 Fe N3 O6 S2 -","- C11 H23 F6 Fe N3 O6 S2 -","- C44 H92 F24 Fe4 N12 O24 S8 -","4","1","","Klotz, Katie L.; Slominski, Luke M.; Hull, Anthony V.; Gottsacker, Victoria M.; Mas-Ballesté, Rubén; Que, Jr., Lawrence; Halfen, Jason A.","Non-heme iron(II) complexes are efficient olefin aziridination catalysts","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2063","2065","10.1039/b700493a","","","0.71073","MoKα","","0.0435","0.042","","","0.1056","0.1075","","","","","","1.031","","","","has coordinates","209800","2020-10-21","18:00:00",""
"7101899","9.6421","0.0009","10.3865","0.001","10.1539","0.001","89.929","0.002","110.939","0.002","116.937","0.002","830.78","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","6-methoxy-2-((4-methoxy-3,5-dimethyl-2- pyridinyl)methylsulfinyl) -1H-benzimidazole","6-methoxy-2-{(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl} -1H-benzimidazole","","- C17 H19 N3 O3 S -","- C17 H19 N3 O3 S -","- C34 H38 N6 O6 S2 -","2","1","","Bhatt, Prashant M.; Desiraju, Gautam R.","Tautomeric polymorphism in omeprazole","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2057","2059","10.1039/b700506g","","","0.71073","MoKα","","0.069","0.0566","","","0.1209","0.1268","","","","","","1.106","","","","has coordinates","209796","2020-10-21","18:00:00",""
"7101900","9.667","0.007","10.337","0.008","10.292","0.008","90.044","0.012","111.552","0.012","116.451","0.011","839.6","1.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","5(6)-methoxy-2-((4-methoxy-3,5-dimethyl-2- pyridinyl)methylsulfinyl) -1H-benzimidazole","5(6)-methoxy-2-{(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl} -1H-benzimidazole","","- C17 H19 N3 O3 S -","- C17 H18.92 N3 O3 S -","- C34 H37.84 N6 O6 S2 -","2","1","","Bhatt, Prashant M.; Desiraju, Gautam R.","Tautomeric polymorphism in omeprazole","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2057","2059","10.1039/b700506g","","","0.71073","MoKα","","0.1093","0.0532","","","0.1196","0.1411","","","","","","0.981","","","","has coordinates,has disorder","209796","2020-10-21","18:00:00",""
"7101901","9.638","0.005","10.264","0.005","10.324","0.005","90.085","0.009","111.732","0.008","116.288","0.008","833.7","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","5(6)-methoxy-2-((4-methoxy-3,5-dimethyl-2- pyridinyl)methylsulfinyl) -1H-benzimidazole","5(6)-methoxy-2-{(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl} -1H-benzimidazole","","- C17 H19 N3 O3 S -","- C17 H18.9 N3 O3 S -","- C34 H37.8 N6 O6 S2 -","2","1","","Bhatt, Prashant M.; Desiraju, Gautam R.","Tautomeric polymorphism in omeprazole","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2057","2059","10.1039/b700506g","","","0.71073","MoKα","","0.1318","0.062","","","0.1449","0.1795","","","","","","0.988","","","","has coordinates,has disorder","209796","2020-10-21","18:00:00",""
"7101902","9.6439","0.0016","10.2621","0.0017","10.3322","0.0017","90.216","0.002","111.762","0.002","116.113","0.002","835.5","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","6-methoxy-2-((4-methoxy-3,5-dimethyl-2- pyridinyl)methylsulfinyl) -1H-benzimidazole","6-methoxy-2-{(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl} -1H-benzimidazole","","- C17 H19 N3 O3 S -","- C17 H18.88 N3 O3 S -","- C34 H37.76 N6 O6 S2 -","2","1","","Bhatt, Prashant M.; Desiraju, Gautam R.","Tautomeric polymorphism in omeprazole","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2057","2059","10.1039/b700506g","","","0.71073","MoKα","","0.0565","0.0504","","","0.1288","0.1329","","","","","","1.064","","","","has coordinates,has disorder","209796","2020-10-21","18:00:00",""
"7101903","9.701","0.003","10.259","0.003","10.694","0.003","91.72","0.004","112.117","0.004","115.642","0.004","864.8","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","5(6)-methoxy-2-((4-methoxy-3,5-dimethyl-2- pyridinyl)methylsulfinyl) -1H-benzimidazole","5(6)-methoxy-2-{(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl} -1H-benzimidazole","","- C17 H19 N3 O3 S -","- C17 H18.85 N3 O3 S -","- C34 H37.7 N6 O6 S2 -","2","1","","Bhatt, Prashant M.; Desiraju, Gautam R.","Tautomeric polymorphism in omeprazole","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2057","2059","10.1039/b700506g","","","0.71073","MoKα","","0.1301","0.0611","","","0.141","0.1666","","","","","","0.984","","","","has coordinates,has disorder","209796","2020-10-21","18:00:00",""
"7101904","10.9417","0.0007","17.3546","0.001","26.1713","0.0015","90","","97.901","0.002","90","","4922.5","0.5","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H48 Fe2 O2 P4 S2 -","- C56 H48 Fe2 O2 P4 S2 -","- C224 H192 Fe8 O8 P16 S8 -","4","1","","Justice, Aaron K.; Zampella, Giuseppe; Gioia, Luca De; Rauchfuss, Thomas B.","Lewis vs. Brønsted-basicities of diiron dithiolates: spectroscopic detection of the ""rotated structure"" and remarkable effects of ethane- vs. propanedithiolate","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2019","2021","10.1039/b700754j","","","0.71073","MoKα","","0.0797","0.0374","","","0.0506","0.0569","","","","","","0.808","","","","has coordinates","210636","2020-10-21","18:00:00",""
"7101905","11.7663","0.0015","7.794","0.002","21.802","0.004","90","","105.457","0.015","90","","1927.1","0.6","143","2","143","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C22 H54 Ag2 N2 O8 P2 S4 Te2 -","- C22 H54 Ag2 N2 O8 P2 S4 Te2 -","- C44 H108 Ag4 N4 O16 P4 S8 Te4 -","2","0.5","","Daniliuc, Constantin; Druckenbrodt, Christian; Hrib, Cristian G.; Ruthe, Frank; Blaschette, Armand; Jones, Peter G.; du Mont, Wolf-W.","The first trialkylphosphane telluride complexes of Ag(I): molecular, ionic and supramolecular structural alternatives","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2060","2062","10.1039/b700917h","","","0.71073","MoKα","","0.0359","0.0284","","","0.0557","0.0594","","","","","","1.056","","","","has coordinates","210389","2020-10-21","18:00:00",""
"7101906","11.476","0.0015","15.363","0.003","38.378","0.003","90","","93.962","0.01","90","","6749.9","1.5","143","2","143","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C42 H99 Ag2 N3 O8 P4 S4 Te4 -","- C42 H99 Ag2 N3 O8 P4 S4 Te4 -","- C168 H396 Ag8 N12 O32 P16 S16 Te16 -","4","1","","Daniliuc, Constantin; Druckenbrodt, Christian; Hrib, Cristian G.; Ruthe, Frank; Blaschette, Armand; Jones, Peter G.; du Mont, Wolf-W.","The first trialkylphosphane telluride complexes of Ag(I): molecular, ionic and supramolecular structural alternatives","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2060","2062","10.1039/b700917h","","","0.71073","MoKα","","0.0838","0.0517","","","0.092","0.1086","","","","","","1.061","","","","has coordinates,has disorder","210389","2020-10-21","18:00:00",""
"7101907","21.078","0.002","8.1839","0.0006","9.0746","0.0006","90","","90","","90","","1565.4","0.2","173","2","173","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C14 H10 Cl4 Te -","- C14 H10 Cl4 Te -","- C56 H40 Cl16 Te4 -","4","1","","Daniliuc, Constantin; Druckenbrodt, Christian; Hrib, Cristian G.; Ruthe, Frank; Blaschette, Armand; Jones, Peter G.; du Mont, Wolf-W.","The first trialkylphosphane telluride complexes of Ag(I): molecular, ionic and supramolecular structural alternatives","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2060","2062","10.1039/b700917h","","","0.71073","MoKα","","0.0191","0.0182","","","0.0438","0.0442","","","","","","1.05","","","","has coordinates","210389","2020-10-21","18:00:00",""
"7101908","28.5566","0.0015","8.4221","0.0005","28.2425","0.0015","90","","118.884","0.001","90","","5947.5","0.6","133","2","133","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Bis-(triisopropylphosphine telluride)-silver(I) hexafluoroantimonate","","","- C18 H42 Ag F6 P2 Sb Te2 -","- C18 H42 Ag F6 P2 Sb Te2 -","- C144 H336 Ag8 F48 P16 Sb8 Te16 -","8","2","","Daniliuc, Constantin; Druckenbrodt, Christian; Hrib, Cristian G.; Ruthe, Frank; Blaschette, Armand; Jones, Peter G.; du Mont, Wolf-W.","The first trialkylphosphane telluride complexes of Ag(I): molecular, ionic and supramolecular structural alternatives","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2060","2062","10.1039/b700917h","","","0.71073","MoKα","","0.091","0.0448","","","0.0812","0.0956","","","","","","1.025","","","","has coordinates","210389","2020-10-21","18:00:00",""
"7101909","8.6889","0.0006","23.6812","0.0016","13.6253","0.001","90","","92.965","0.003","90","","2799.8","0.3","133","2","133","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Bis-(triisopropylphosphine selenide)-silver(i) hexafluoroantimonate","","","- C18 H42 Ag F6 P2 Sb Se2 -","- C18 H42 Ag F6 P2 Sb Se2 -","- C72 H168 Ag4 F24 P8 Sb4 Se8 -","4","1","","Daniliuc, Constantin; Druckenbrodt, Christian; Hrib, Cristian G.; Ruthe, Frank; Blaschette, Armand; Jones, Peter G.; du Mont, Wolf-W.","The first trialkylphosphane telluride complexes of Ag(I): molecular, ionic and supramolecular structural alternatives","Chemical Communications (Cambridge, United Kingdom)","2007","","20","2060","2062","10.1039/b700917h","","","0.71073","MoKα","","0.0341","0.0272","","","0.0687","0.0709","","","","","","1.013","","","","has coordinates","210389","2020-10-21","18:00:00",""
"7101910","8.4537","0.0006","9.5906","0.0007","10.0814","0.0008","90","","104.847","0.006","90","","790.07","0.1","110","2","110","2","","","","","","","","6","P 1 21 1","P 2yb","4","N-(2-thiono-1,3,2-oxathiaphospholanyl)tryptophan methyl ester","N-(2-thiono-1,3,2-oxathiaphospholanyl)tryptophan methyl ester","","- C14 H17 N2 O3 P S2 -","- C14 H17 N2 O3 P S2 -","- C28 H34 N4 O6 P2 S4 -","2","1","","Krakowiak, Agnieszka; Kaczmarek, Renata; Baraniak, Janina; Wieczorek, Michał; Stec, Wojciech J","Stereochemistry of rHint1 hydrolase assisted cleavage of P-N bond in nucleoside 5'-O-phosphoramidothioates.","Chemical communications (Cambridge, England)","2007","","21","2163","2165","10.1039/b615160d","","","0.71073","MoKα","","0.0205","0.0201","","","0.0524","0.0527","","","","","","1.028","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101911","15.286","0.005","13.357","0.004","15.847","0.005","90","","100.134","0.004","90","","3185.2","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H41 N3 O2 Yb2 -","- C33 H41 N3 O2 Yb2 -","- C132 H164 N12 O8 Yb8 -","4","1","","Pi, Chengfu; Zhu, Zhenyu; Weng, Linhong; Chen, Zhenxia; Zhou, Xigeng","Synthesis and structural characterization of lanthanide complexes with the di- or tri-anionic diguanidinate ligand: new insight into the flexibility and distinct reactivity of the linked diguanidinate ligand.","Chemical communications (Cambridge, England)","2007","","21","2190","2192","10.1039/b618151a","","","0.71073","MoKα","","0.0599","0.0374","","","0.0732","0.0797","","","","","","0.889","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101912","18.734","0.007","9.805","0.004","26.843","0.01","90","","108.652","0.005","90","","4672","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H68 N7 O Yb2 -","- C46 H68 N7 O Yb2 -","- C184 H272 N28 O4 Yb8 -","4","1","","Pi, Chengfu; Zhu, Zhenyu; Weng, Linhong; Chen, Zhenxia; Zhou, Xigeng","Synthesis and structural characterization of lanthanide complexes with the di- or tri-anionic diguanidinate ligand: new insight into the flexibility and distinct reactivity of the linked diguanidinate ligand.","Chemical communications (Cambridge, England)","2007","","21","2190","2192","10.1039/b618151a","","","0.71073","MoKα","","0.0582","0.0383","","","0.078","0.0842","","","","","","0.98","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101913","13.906","0.005","16.461","0.005","15.924","0.005","90","","98.049","0.005","90","","3609","2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C68 H94 N14 Yb4 -","- C68 H94 N14 Yb4 -","- C136 H188 N28 Yb8 -","2","0.5","","Pi, Chengfu; Zhu, Zhenyu; Weng, Linhong; Chen, Zhenxia; Zhou, Xigeng","Synthesis and structural characterization of lanthanide complexes with the di- or tri-anionic diguanidinate ligand: new insight into the flexibility and distinct reactivity of the linked diguanidinate ligand.","Chemical communications (Cambridge, England)","2007","","21","2190","2192","10.1039/b618151a","","","0.71073","MoKα","","0.0549","0.0344","","","0.0757","0.0829","","","","","","0.955","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101914","26.666","0.008","10.629","0.003","26.163","0.008","90","","111.655","0.005","90","","6892","4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C58 H86 N14 O2 Yb4 -","- C58 H86 N14 O2 Yb4 -","- C232 H344 N56 O8 Yb16 -","4","1","","Pi, Chengfu; Zhu, Zhenyu; Weng, Linhong; Chen, Zhenxia; Zhou, Xigeng","Synthesis and structural characterization of lanthanide complexes with the di- or tri-anionic diguanidinate ligand: new insight into the flexibility and distinct reactivity of the linked diguanidinate ligand.","Chemical communications (Cambridge, England)","2007","","21","2190","2192","10.1039/b618151a","","","0.71073","MoKα","","0.1224","0.055","","","0.1274","0.1517","","","","","","0.859","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101915","10.8","0.002","16.235","0.003","18.666","0.004","90","","102.601","0.003","90","","3193.9","1","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H27 F6 N4 O10 Re S2 -","- C23 H27 F6 N4 O10 Re S2 -","- C92 H108 F24 N16 O40 Re4 S8 -","4","1","","Wong, Wing-Leung; Cheung, Kwong-Chak; Chan, Pak-Ho; Zhou, Zhong-Yuan; Lee, Kam-Han; Wong, Kwok-Yin","A tricarbonyl rhenium(I) complex with a pendant pyrrolidinium moiety as a robust and recyclable catalyst for chemical fixation of carbon dioxide in ionic liquid.","Chemical communications (Cambridge, England)","2007","","21","2175","2177","10.1039/b618423e","","","0.71073","MoKα","","0.0637","0.0415","","","0.1008","0.1143","","","","","","1.024","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101916","10.756","0.002","9.1086","0.0019","19.236","0.004","90","","94.476","0.004","90","","1878.9","0.7","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 I N4 -","- C18 H25 I N4 -","- C72 H100 I4 N16 -","4","1","","Wong, Wing-Leung; Cheung, Kwong-Chak; Chan, Pak-Ho; Zhou, Zhong-Yuan; Lee, Kam-Han; Wong, Kwok-Yin","A tricarbonyl rhenium(I) complex with a pendant pyrrolidinium moiety as a robust and recyclable catalyst for chemical fixation of carbon dioxide in ionic liquid.","Chemical communications (Cambridge, England)","2007","","21","2175","2177","10.1039/b618423e","","","0.71073","MoKα","","0.0425","0.0283","","","0.0685","0.075","","","","","","1.005","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101917","11.56","0.003","7.3833","0.0017","19.199","0.004","90","","93.339","0.012","90","","1635.9","0.7","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 B10 -","- C14 H20 B10 -","- C56 H80 B40 -","4","1","","Zlatogorsky, Sergey; Ellis, David; Rosair, Georgina M; Welch, Alan J","Unexpectedly facile isomerisation of [7,10-Ph2-7,10-nido-C2B10H10]2- to [7,9-Ph2-7,9-nido-C2B10H10]2-.","Chemical communications (Cambridge, England)","2007","","21","2178","2180","10.1039/b618556h","","","0.71073","MoKα","","0.1445","0.0957","","","0.2614","0.2973","","","","","","1.099","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101918","7.9865","0.0015","16.119","0.003","15.593","0.002","90","","96.559","0.007","90","","1994.3","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H25 B10 Co -","- C19 H25 B10 Co -","- C76 H100 B40 Co4 -","4","1","","Zlatogorsky, Sergey; Ellis, David; Rosair, Georgina M; Welch, Alan J","Unexpectedly facile isomerisation of [7,10-Ph2-7,10-nido-C2B10H10]2- to [7,9-Ph2-7,9-nido-C2B10H10]2-.","Chemical communications (Cambridge, England)","2007","","21","2178","2180","10.1039/b618556h","","","0.71073","MoKα","","0.0719","0.0388","","","0.0684","0.0787","","","","","","1.037","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101919","8.782","0.003","19.357","0.007","15.252","0.005","90","","101.266","0.016","90","","2543","1.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H32 B10 Co -","- C22 H25 B10 Co -","- C88 H100 B40 Co4 -","4","1","","Zlatogorsky, Sergey; Ellis, David; Rosair, Georgina M; Welch, Alan J","Unexpectedly facile isomerisation of [7,10-Ph2-7,10-nido-C2B10H10]2- to [7,9-Ph2-7,9-nido-C2B10H10]2-.","Chemical communications (Cambridge, England)","2007","","21","2178","2180","10.1039/b618556h","","","0.71073","MoKα","","0.1044","0.0829","","","0.2108","0.2278","","","","","","1.17","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101920","12.0447","0.0008","12.6676","0.0008","13.8241","0.0008","90","","104.129","0.004","90","","2045.4","0.2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H25 B10 Co -","- C19 H25 B10 Co -","- C76 H100 B40 Co4 -","4","1","","Zlatogorsky, Sergey; Ellis, David; Rosair, Georgina M; Welch, Alan J","Unexpectedly facile isomerisation of [7,10-Ph2-7,10-nido-C2B10H10]2- to [7,9-Ph2-7,9-nido-C2B10H10]2-.","Chemical communications (Cambridge, England)","2007","","21","2178","2180","10.1039/b618556h","","","0.71073","MoKα","","0.1208","0.0468","","","0.0985","0.1247","","","","","","0.972","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101921","9.3596","0.0008","8.767","0.0009","15.4785","0.0015","90","","96.803","0.005","90","","1261.2","0.2","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H34 B10 Ru -","- C24 H34 B10 Ru -","- C48 H68 B20 Ru2 -","2","1","","Zlatogorsky, Sergey; Ellis, David; Rosair, Georgina M; Welch, Alan J","Unexpectedly facile isomerisation of [7,10-Ph2-7,10-nido-C2B10H10]2- to [7,9-Ph2-7,9-nido-C2B10H10]2-.","Chemical communications (Cambridge, England)","2007","","21","2178","2180","10.1039/b618556h","","","0.71073","MoKα","","0.0563","0.0388","","","0.0895","0.0977","","","","","","1.058","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101922","21.144","0.004","13.209","0.002","18.065","0.003","90","","100.439","0.008","90","","4961.6","1.5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H34 B10 Ru -","- C24 H34 B10 Ru -","- C192 H272 B80 Ru8 -","8","1","","Zlatogorsky, Sergey; Ellis, David; Rosair, Georgina M; Welch, Alan J","Unexpectedly facile isomerisation of [7,10-Ph2-7,10-nido-C2B10H10]2- to [7,9-Ph2-7,9-nido-C2B10H10]2-.","Chemical communications (Cambridge, England)","2007","","21","2178","2180","10.1039/b618556h","","","0.71073","MoKα","","0.0935","0.0425","","","0.0924","0.1172","","","","","","0.963","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101923","6.7302","0.0004","9.0666","0.0006","9.8149","0.0004","90","","90","","90","","598.91","0.06","293","","","","","","","","","","Local laboratory","5","P 21 21 21","P 2ac 2ab","19","","","","- C4 H6 N2 O S -","- C4 H6 N2 O S -","- C16 H24 N8 O4 S4 -","4","1","","Seenivasaperumal, Muthu; Federsel, Hans-Jürgen; Ertan, Anne; Szabó, Kálmán J","Factors influencing the selectivity in asymmetric oxidation of sulfides attached to nitrogen containing heterocycles.","Chemical communications (Cambridge, England)","2007","","21","2187","2189","10.1039/b700860k","","","0.71073","MoKα","","0.0644","0.0368","","","0.0789","0.0844","","","","","","0.891","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101924","18.5711","0.0003","25.9704","0.0004","15.3244","0.0003","90","","100.053","0.001","90","","7277.5","0.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H28 B2 Cl6 F6 Fe2 P -","- C34 H28 B2 Cl6 F6 Fe2 P -","- C272 H224 B16 Cl48 F48 Fe16 P8 -","8","2","","Venkatasubbaiah, Krishnan; Nowik, Israel; Herber, Rolfe H; Jäkle, Frieder","Lewis acidity enhancement of organoboranes via oxidation of appended ferrocene moieties.","Chemical communications (Cambridge, England)","2007","","21","2154","2156","10.1039/b701807j","","","1.54178","CuKα","","0.0695","0.0513","","","0.122","0.1335","","","","","","1.012","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101925","11.7183","0.0009","8.9579","0.0007","21.3539","0.0015","90","","92.612","0.004","90","","2239.2","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H38 B2 Fe2 I6 N4 -","- C40 H38 B2 Fe2 I6 N4 -","- C80 H76 B4 Fe4 I12 N8 -","2","0.5","","Venkatasubbaiah, Krishnan; Nowik, Israel; Herber, Rolfe H; Jäkle, Frieder","Lewis acidity enhancement of organoboranes via oxidation of appended ferrocene moieties.","Chemical communications (Cambridge, England)","2007","","21","2154","2156","10.1039/b701807j","","","1.54178","CuKα","","0.0474","0.0455","","","0.1172","0.1193","","","","","","1.065","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101926","12.944","0.004","16.805","0.005","17.746","0.005","90","","100.17","0.03","90","","3800","2","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C146 H198 Co4 F24 N16 O13 P4 -","- C146 H188 Co4 F24 N16 O13 P4 -","- C146 H188 Co4 F24 N16 O13 P4 -","1","0.25","","Beni, Alessandra; Dei, Andrea; Rizzitano, Mario; Sorace, Lorenzo","Unprecedented optically induced long-lived intramolecular electron transfer in cobalt-dioxolene complexes.","Chemical communications (Cambridge, England)","2007","","21","2160","2162","10.1039/b702932b","","","0.71073","MoKα","","0.1352","0.0788","","","0.1906","0.2384","","","","","","1.029","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101927","16.1573","0.0003","15.368","0.0003","17.4031","0.0002","90","","109.859","0.001","90","","4064.3","0.12","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H61 Cl N6 O2 -","- C43 H61 Cl N6 O2 -","- C172 H244 Cl4 N24 O8 -","4","1","","Bates, Gareth W; Gale, Philip A; Light, Mark E","Isophthalamides and 2,6-dicarboxamidopyridines with pendant indole groups: a 'twisted' binding mode for selective fluoride recognition.","Chemical communications (Cambridge, England)","2007","","21","2121","2123","10.1039/b703905k","","","0.71073","MoKα","","0.0811","0.0491","","","0.1124","0.1258","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101928","9.8813","0.0004","18.1336","0.0007","11.4775","0.0005","90","","103.333","0.002","90","","2001.15","0.14","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C43 H61 F N6 O2 -","- C43 H61 F N6 O2 -","- C86 H122 F2 N12 O4 -","2","1","","Bates, Gareth W; Gale, Philip A; Light, Mark E","Isophthalamides and 2,6-dicarboxamidopyridines with pendant indole groups: a 'twisted' binding mode for selective fluoride recognition.","Chemical communications (Cambridge, England)","2007","","21","2121","2123","10.1039/b703905k","","","0.71073","MoKα","","0.1058","0.0754","","","0.1329","0.1484","","","","","","1.155","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101929","26.9646","0.001","9.8223","0.0003","27.2375","0.001","90","","119.586","0.003","90","","6273.4","0.4","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C31 H37 N5 O4 S2 -","- C31 H37 N5 O4 S2 -","- C248 H296 N40 O32 S16 -","8","1","","Bates, Gareth W; Gale, Philip A; Light, Mark E","Isophthalamides and 2,6-dicarboxamidopyridines with pendant indole groups: a 'twisted' binding mode for selective fluoride recognition.","Chemical communications (Cambridge, England)","2007","","21","2121","2123","10.1039/b703905k","","","0.71073","MoKα","","0.1403","0.0925","","","0.2375","0.2748","","","","","","1.05","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101930","11.6862","0.0003","13.0971","0.0003","14.2217","0.0003","98.811","0.001","94.723","0.001","101.283","0.001","2095.16","0.07","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H62 Cl N5 O2 -","- C44 H62 Cl N5 O2 -","- C88 H124 Cl2 N10 O4 -","2","1","","Bates, Gareth W; Gale, Philip A; Light, Mark E","Isophthalamides and 2,6-dicarboxamidopyridines with pendant indole groups: a 'twisted' binding mode for selective fluoride recognition.","Chemical communications (Cambridge, England)","2007","","21","2121","2123","10.1039/b703905k","","","0.71073","MoKα","","0.0881","0.0525","","","0.125","0.1413","","","","","","1.053","","","","has coordinates,has disorder","180121","2020-10-21","18:00:00",""
"7101931","9.783","0.0004","18.6247","0.0005","11.3671","0.0005","90","","102.697","0.002","90","","2020.5","0.13","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C44 H62 F N5 O2 -","- C44 H62 F N5 O2 -","- C88 H124 F2 N10 O4 -","2","1","","Bates, Gareth W; Gale, Philip A; Light, Mark E","Isophthalamides and 2,6-dicarboxamidopyridines with pendant indole groups: a 'twisted' binding mode for selective fluoride recognition.","Chemical communications (Cambridge, England)","2007","","21","2121","2123","10.1039/b703905k","","","0.71073","MoKα","","0.0915","0.0605","","","0.1233","0.1339","","","","","","1.198","","","","has coordinates,has disorder","180121","2020-10-21","18:00:00",""
"7101932","22.1838","0.0007","9.9174","0.0004","31.4826","0.0013","90","","103.73","0.004","90","","6728.4","0.5","175","","175","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C130 H132 Cl12 I2 N12 Ni2 Pd -","- C130 H132 Cl12 I2 N12 Ni2 Pd -","- C260 H264 Cl24 I4 N24 Ni4 Pd2 -","2","0.5","","Richeter, Sébastien; Hadj-Aïssa, Aurélie; Taffin, Céline; van der Lee, Arie; Leclercq, Dominique","Synthesis and structural characterisation of the first N-heterocyclic carbene ligand fused to a porphyrin.","Chemical communications (Cambridge, England)","2007","","21","2148","2150","10.1039/b704681b","","","0.71073","MoKα","","0.263","0.0764","","0.0887","0.0521","0.0521","","","","","","1.1092","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101933","19.0071","0.0004","19.0071","0.0004","123.338","0.005","90","","90","","120","","38588.6","1.9","223","2","223","2","","","","","","","","9","R -3 c :H","-R 3 2""c","167","","","","- C126 H100.5 Au6 F9 Fe3 N4.5 O17 P6 S3 -","- C124.5 H96 Au6 F4.5 Fe3 N4.5 O12.5 P6 S3 -","- C1494 H1152 Au72 F54 Fe36 N54 O150 P72 S36 -","12","0.333333","","Teo, Peili; Koh, L L; Hor, T S Andy","Assembly of gold rings and chains with pyridyl carboxylate as directional spacer.","Chemical communications (Cambridge, England)","2007","","22","2225","2227","10.1039/b618309c","","","0.71073","MoKα","","0.1198","0.0792","","","0.2079","0.2321","","","","","","1.021","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101934","15.9755","0.001","14.3238","0.0009","15.9882","0.001","90","","103.661","0.002","90","","3555.1","0.4","223","2","223","2","","","","","","","","10","P 1 21/c 1","-P 2ybc","14","","","","- C56 H46 Au2 Cl12 F6 Fe N2 O10 P2 S -","- C56 H46 Au2 Cl12 F6 Fe N2 O10 P2 S -","- C112 H92 Au4 Cl24 F12 Fe2 N4 O20 P4 S2 -","2","0.5","","Teo, Peili; Koh, L L; Hor, T S Andy","Assembly of gold rings and chains with pyridyl carboxylate as directional spacer.","Chemical communications (Cambridge, England)","2007","","22","2225","2227","10.1039/b618309c","","","0.71073","MoKα","","0.1447","0.0858","","","0.254","0.2974","","","","","","0.988","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101935","15.1716","0.0012","14.9383","0.0012","32.609","0.003","90","","100.997","0.002","90","","7254.8","1","223","2","223","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C71 H57 Au4 Cl3 F6 Fe2 O6 P4 S3 -","- C71 H57 Au4 Cl3 F6 Fe2 O6 P4 S3 -","- C284 H228 Au16 Cl12 F24 Fe8 O24 P16 S12 -","4","1","","Teo, Peili; Koh, L L; Hor, T S Andy","Assembly of gold rings and chains with pyridyl carboxylate as directional spacer.","Chemical communications (Cambridge, England)","2007","","22","2225","2227","10.1039/b618309c","","","0.71073","MoKα","","0.1042","0.0562","","","0.1208","0.1363","","","","","","1.004","","","","has coordinates,has disorder","180121","2020-10-21","18:00:00",""
"7101936","8.596","0.003","15.116","0.006","21.344","0.008","90","","91.555","0.01","90","","2772.4","1.7","243","2","243","2","","","","","","","","10","P 1 21/c 1","-P 2ybc","14","","","","- C49 H39 Au2 Cl3 F6 Fe N2 O10 P2 S2 -","- C49 H39 Au2 Cl3 F6 Fe N2 O10 P2 S2 -","- C98 H78 Au4 Cl6 F12 Fe2 N4 O20 P4 S4 -","2","0.5","","Teo, Peili; Koh, L L; Hor, T S Andy","Assembly of gold rings and chains with pyridyl carboxylate as directional spacer.","Chemical communications (Cambridge, England)","2007","","22","2225","2227","10.1039/b618309c","","","0.71073","MoKα","","0.1087","0.0593","","","0.1179","0.1347","","","","","","0.947","","","","has coordinates,has disorder","180121","2020-10-21","18:00:00",""
"7101937","10.3025","0.0007","17.9876","0.0013","23.1998","0.0017","90","","92.483","0.001","90","","4295.3","0.5","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C49 H58 Si3 -","- C49 H58 Si3 -","- C196 H232 Si12 -","4","1","","Yadav, Veejendra K; Kumar, Naganaboina Vijaya; Parvez, Masood","Lewis acid-catalyzed formation of indene derivatives via tandem reactions of arylacetylenes with the cations generated from 2-silylmethyl cyclopropyl carbinols.","Chemical communications (Cambridge, England)","2007","","22","2281","2283","10.1039/b700246g","","","0.71073","MoKα","","0.1048","0.0691","","","0.1455","0.1612","","","","","","1.014","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101938","7.1024","0.0014","7.0967","0.0014","13.38","0.003","90","","90.81","0.03","90","","674.3","0.2","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C8 H4 Co2 N4 O10 S2 -","- C8 H4 Co2 N4 O10 S2 -","- C16 H8 Co4 N8 O20 S4 -","2","1","","Li, Jian-Rong; Yu, Qun; Tao, Ying; Bu, Xian-He; Ribas, Joan; Batten, Stuart R","Magnetic canting or not? Two isomorphous 3D CoII and NiII coordination polymers with the rare non-interpenetrated (10,3)-d topological network, showing spin-canted antiferromagnetism only in the CoII system.","Chemical communications (Cambridge, England)","2007","","22","2290","2292","10.1039/b700569e","","","0.71073","MoKα","","0.0247","0.0226","","","0.0515","0.0523","","","","","","1.01","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101939","7.1244","0.0014","7.1131","0.0014","13.153","0.003","90","","90.85","0.03","90","","666.5","0.2","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C8 H4 N4 Ni2 O10 S2 -","- C8 H4 N4 Ni2 O10 S2 -","- C16 H8 N8 Ni4 O20 S4 -","2","1","","Li, Jian-Rong; Yu, Qun; Tao, Ying; Bu, Xian-He; Ribas, Joan; Batten, Stuart R","Magnetic canting or not? Two isomorphous 3D CoII and NiII coordination polymers with the rare non-interpenetrated (10,3)-d topological network, showing spin-canted antiferromagnetism only in the CoII system.","Chemical communications (Cambridge, England)","2007","","22","2290","2292","10.1039/b700569e","","","0.71073","MoKα","","0.0308","0.028","","","0.0617","0.0631","","","","","","1.04","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101940","12.5611","0.0004","12.5611","0.0004","62.471","0.003","90","","90","","120","","8536.2","0.6","291","2","291","2","","","","","","","","5","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C44 H66 N16 Ni2 O21 -","- C44 H66 N16 Ni2 O21 -","- C264 H396 N96 Ni12 O126 -","6","0.5","","Wang, Su-Na; Xing, Hang; Li, Yi-Zhi; Bai, Junfeng; Scheer, Manfred; Pan, Yi; You, Xiao-Zeng","Unprecedented interweaving of single-helical and unequal double-helical chains into chiral metal-organic open frameworks with multiwalled tubular structures.","Chemical communications (Cambridge, England)","2007","","22","2293","2295","10.1039/b701186e","","","0.71073","MoKα","","0.056","0.0517","","","0.1409","0.1437","","","","","","1.033","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7101941","12.5764","0.0006","12.5764","0.0006","62.941","0.004","90","","90","","120","","8621.3","0.8","291","2","291","2","","","","","","","","5","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C44 H66 Co2 N16 O21 -","- C44 H66 Co2 N16 O21 -","- C264 H396 Co12 N96 O126 -","6","0.5","","Wang, Su-Na; Xing, Hang; Li, Yi-Zhi; Bai, Junfeng; Scheer, Manfred; Pan, Yi; You, Xiao-Zeng","Unprecedented interweaving of single-helical and unequal double-helical chains into chiral metal-organic open frameworks with multiwalled tubular structures.","Chemical communications (Cambridge, England)","2007","","22","2293","2295","10.1039/b701186e","","","0.71073","MoKα","","0.0542","0.0473","","","0.1179","0.1205","","","","","","1.019","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7101942","17.213","0.004","8.458","0.002","10.468","0.002","90","","96.925","0.004","90","","1512.9","0.6","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H12 Cl F O3 -","- C17 H12 Cl F O3 -","- C68 H48 Cl4 F4 O12 -","4","1","","Cui, Han-Feng; Dong, Ke-Yan; Zhang, Guang-Wu; Wang, Lian; Ma, Jun-An","Stereoselective construction of fluorinated indanone derivatives via a triple cascade Lewis acid-catalyzed reaction.","Chemical communications (Cambridge, England)","2007","","22","2284","2286","10.1039/b702114c","","","0.71073","MoKα","","0.0833","0.0426","","","0.0909","0.1077","","","","","","1.003","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101943","16.228","0.004","8.599","0.002","10.594","0.003","90","","98.122","0.005","90","","1463.5","0.7","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H13 Cl O3 -","- C17 H13 Cl O3 -","- C68 H52 Cl4 O12 -","4","1","","Cui, Han-Feng; Dong, Ke-Yan; Zhang, Guang-Wu; Wang, Lian; Ma, Jun-An","Stereoselective construction of fluorinated indanone derivatives via a triple cascade Lewis acid-catalyzed reaction.","Chemical communications (Cambridge, England)","2007","","22","2284","2286","10.1039/b702114c","","","0.71073","MoKα","","0.0998","0.0438","","","0.0702","0.0818","","","","","","1.085","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101944","6.8841","0.0006","10.4063","0.001","16.199","0.0013","102.073","0.007","94.324","0.005","109.281","0.005","1057.95","0.16","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H30 Fe N4 O2 -","- C23 H30 Fe N4 O2 -","- C46 H60 Fe2 N8 O4 -","2","1","","Alexander, Anne-Marie; Bria, Marc; Brunklaus, Gunther; Caldwell, Stuart; Cooke, Graeme; Garety, James F; Hewage, Shanika G; Hocquel, Yann; McDonald, Niall; Rabani, Gouher; Rosair, Georgina; Smith, Brian O; Spiess, Hans Wolfgang; Rotello, Vincent M; Woisel, Patrice","Probing the solvent-induced tautomerism of a redox-active ureidopyrimidinone.","Chemical communications (Cambridge, England)","2007","","22","2246","2248","10.1039/b703070c","","","0.71073","MoKα","","0.0689","0.0408","","","0.0813","0.0912","","","","","","1.007","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101945","9.6764","0.0006","9.6037","0.0005","22.9526","0.0011","90","","101.127","0.003","90","","2092.9","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H26 B9 Cl3 Ru -","- C13 H26 B9 Cl3 Ru -","- C52 H104 B36 Cl12 Ru4 -","4","1","","Lopez, Maria Elena; Edie, Michael J; Ellis, David; Horneber, Anke; Macgregor, Stuart A; Rosair, Georgina M; Welch, Alan J","Symmetric and asymmetric 13-vertex bimetallacarboranes by polyhedral expansion.","Chemical communications (Cambridge, England)","2007","","22","2243","2245","10.1039/b703822d","","","0.71073","MoKα","","0.0797","0.0397","","","0.0686","0.0793","","","","","","1.013","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101946","17.658","0.0011","19.3688","0.0012","15.7105","0.001","90","","110.117","0.003","90","","5045.4","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H39 B9 Ru2 -","- C22 H39 B9 Ru2 -","- C176 H312 B72 Ru16 -","8","2","","Lopez, Maria Elena; Edie, Michael J; Ellis, David; Horneber, Anke; Macgregor, Stuart A; Rosair, Georgina M; Welch, Alan J","Symmetric and asymmetric 13-vertex bimetallacarboranes by polyhedral expansion.","Chemical communications (Cambridge, England)","2007","","22","2243","2245","10.1039/b703822d","","","0.71073","MoKα","","0.0903","0.0452","","","0.0828","0.0981","","","","","","1.011","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101947","32.4745","0.0017","7.8181","0.0004","13.5715","0.0007","90","","107.989","0.002","90","","3277.2","0.3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H21 B9 Co2 -","- C12 H21 B9 Co2 -","- C96 H168 B72 Co16 -","8","1","","Lopez, Maria Elena; Edie, Michael J; Ellis, David; Horneber, Anke; Macgregor, Stuart A; Rosair, Georgina M; Welch, Alan J","Symmetric and asymmetric 13-vertex bimetallacarboranes by polyhedral expansion.","Chemical communications (Cambridge, England)","2007","","22","2243","2245","10.1039/b703822d","","","0.71073","MoKα","","0.0718","0.0391","","","0.0778","0.0887","","","","","","1.014","","","","has coordinates,has disorder","180121","2020-10-21","18:00:00",""
"7101948","28.838","0.003","8.734","0.0008","13.2705","0.0012","90","","98.763","0.005","90","","3303.4","0.5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H21 B9 Co2 -","- C12 H21 B9 Co2 -","- C96 H168 B72 Co16 -","8","1","","Lopez, Maria Elena; Edie, Michael J; Ellis, David; Horneber, Anke; Macgregor, Stuart A; Rosair, Georgina M; Welch, Alan J","Symmetric and asymmetric 13-vertex bimetallacarboranes by polyhedral expansion.","Chemical communications (Cambridge, England)","2007","","22","2243","2245","10.1039/b703822d","","","0.71073","MoKα","","0.0551","0.0356","","","0.0816","0.0905","","","","","","1.044","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101949","17.2154","0.0014","20.7396","0.0017","15.0264","0.0012","90","","109.026","0.003","90","","5071.9","0.7","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H39 B9 Ru2 -","- C22 H39 B9 Ru2 -","- C176 H312 B72 Ru16 -","8","2","","Lopez, Maria Elena; Edie, Michael J; Ellis, David; Horneber, Anke; Macgregor, Stuart A; Rosair, Georgina M; Welch, Alan J","Symmetric and asymmetric 13-vertex bimetallacarboranes by polyhedral expansion.","Chemical communications (Cambridge, England)","2007","","22","2243","2245","10.1039/b703822d","","","0.71073","MoKα","","0.0542","0.0328","","","0.0625","0.0694","","","","","","1.003","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101950","6.7132","0.0006","12.1272","0.001","18.2031","0.0015","90","","90.153","0.004","90","","1482","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H20 B8 Co2 -","- C12 H20 B8 Co2 -","- C48 H80 B32 Co8 -","4","1","","Lopez, Maria Elena; Edie, Michael J; Ellis, David; Horneber, Anke; Macgregor, Stuart A; Rosair, Georgina M; Welch, Alan J","Symmetric and asymmetric 13-vertex bimetallacarboranes by polyhedral expansion.","Chemical communications (Cambridge, England)","2007","","22","2243","2245","10.1039/b703822d","","","0.71073","MoKα","","0.0356","0.0247","","","0.0599","0.0637","","","","","","1.076","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101951","26.934","0.003","9.8762","0.0012","47.994","0.006","90","","94.712","0.001","90","","12723","3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,8,14, Tri-n-propyl-2,8-14-triazatetracyclo[142,24,7,210,13] tetracosa-4,6,10,12,16,18,19,21,23-nonaene-3,9,15trione","","- C37 H41 N3 O3 -","- C37 H41 N3 O3 -","- C592 H656 N48 O48 -","16","4","","Campbell, Fred; Plante, Jeffrey; Carruthers, Christopher; Hardie, Michaele J; Prior, Timothy J; Wilson, Andrew J","Macrocyclic scaffolds derived from p-aminobenzoic acid.","Chemical communications (Cambridge, England)","2007","","22","2240","2242","10.1039/b704366j","","","0.7977","synchrotron","","0.0939","0.0674","","","0.1679","0.1831","","","","","","1.059","","","","has coordinates,has disorder","180121","2020-10-21","18:00:00",""
"7101952","10.383","0.0002","12.399","0.0003","12.845","0.0003","104.73","0.001","91.325","0.001","114.224","0.001","1443.15","0.057","150","2","150","2","","","","","","","","4","P -1","-P 1","2","propyl trimer","Methyl-4-[{N-(4-N_propylaminobenzoyl}-N- (4-N‒propylamido)benzoyl)-N‒propylamido]-benzoate","","- C31 H39 N3 O5 -","- C31 H39 N3 O5 -","- C62 H78 N6 O10 -","2","1","","Campbell, Fred; Plante, Jeffrey; Carruthers, Christopher; Hardie, Michaele J; Prior, Timothy J; Wilson, Andrew J","Macrocyclic scaffolds derived from p-aminobenzoic acid.","Chemical communications (Cambridge, England)","2007","","22","2240","2242","10.1039/b704366j","","","0.71073","MoKα","","0.0819","0.0512","","","0.1408","0.165","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101953","21.2112","0.0012","8.9839","0.0005","15.8267","0.0009","90","","111.097","0.002","90","","2813.8","0.3","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H18 N8 Zn -","- C34 H18 N8 Zn -","- C136 H72 N32 Zn4 -","4","0.5","","Salazar-Mendoza, Domingo; Baudron, Stéphane A; Hosseini, Mir Wais","Beyond classical coordination: silver-pi interactions in metal dipyrrin complexes.","Chemical communications (Cambridge, England)","2007","","22","2252","2254","10.1039/b704466f","","","0.71073","MoKα","","0.0639","0.0392","","","0.0888","0.0974","","","","","","1.026","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101954","17.9768","0.0004","10.3321","0.0002","28.9049","0.0007","90","","106.944","0.001","90","","5135.7","0.2","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C51 H33 Ag2 F6 N8 O6 S2 Zn -","- C51 H33 Ag2 F6 N8 O6 S2 Zn -","- C204 H132 Ag8 F24 N32 O24 S8 Zn4 -","4","1","","Salazar-Mendoza, Domingo; Baudron, Stéphane A; Hosseini, Mir Wais","Beyond classical coordination: silver-pi interactions in metal dipyrrin complexes.","Chemical communications (Cambridge, England)","2007","","22","2252","2254","10.1039/b704466f","","","0.71073","MoKα","","0.1022","0.0501","","","0.1268","0.1543","","","","","","1.023","","","","has coordinates,has disorder","180121","2020-10-21","18:00:00",""
"7101955","11.6021","0.0005","12.7762","0.0005","13.9264","0.0005","64.995","0.002","86.6","0.002","84.435","0.002","1861.63","0.13","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C34 H22 Ag2 Cu F6 N6 O7 S2 -","- C34 H20 Ag2 Cu F6 N6 O7 S2 -","- C68 H40 Ag4 Cu2 F12 N12 O14 S4 -","2","1","","Salazar-Mendoza, Domingo; Baudron, Stéphane A; Hosseini, Mir Wais","Beyond classical coordination: silver-pi interactions in metal dipyrrin complexes.","Chemical communications (Cambridge, England)","2007","","22","2252","2254","10.1039/b704466f","","","0.71073","MoKα","","0.1478","0.0833","","","0.2103","0.2666","","","","","","1.074","","","","has coordinates,has disorder","180121","2020-10-21","18:00:00",""
"7101956","17.5627","0.0006","12.7625","0.0004","15.5101","0.0005","90","","107.838","0.002","90","","3309.37","0.19","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C31 H20 Ag Cu F9 N3 O5 S -","- C31 H20 Ag Cu F9 N3 O5 S -","- C124 H80 Ag4 Cu4 F36 N12 O20 S4 -","4","1","","Salazar-Mendoza, Domingo; Baudron, Stéphane A; Hosseini, Mir Wais","Beyond classical coordination: silver-pi interactions in metal dipyrrin complexes.","Chemical communications (Cambridge, England)","2007","","22","2252","2254","10.1039/b704466f","","","0.71073","MoKα","","0.095","0.0525","","","0.1484","0.179","","","","","","1.029","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101957","10.09","0.002","10.883","0.002","20.027","0.004","90","","101.95","0.02","90","","2151.5","0.7","290","2","290","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C23 H19 N O5 S2 -","- C23 H19 N O5 S2 -","- C92 H76 N4 O20 S8 -","4","2","","Liu, Tian-Yu; Cui, Hai-Lei; Chai, Qian; Long, Jun; Li, Bang-Jing; Wu, Yong; Ding, Li-Sheng; Chen, Ying-Chun","Organocatalytic asymmetric Friedel-Crafts alkylation/cascade reactions of naphthols and nitroolefins.","Chemical communications (Cambridge, England)","2007","","22","2228","2230","10.1039/b704925k","","","0.71073","MoKα","","0.0856","0.0439","","","0.0786","0.0868","","","","","","0.886","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101958","30.038","0.004","9.53","0.001","24.662","0.004","90","","124.57","0.01","90","","5813.3","1.4","289","2","289","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C37 H31.5 N O4 -","- C37 H31.5 N O4 -","- C296 H252 N8 O32 -","8","1","","Liu, Tian-Yu; Cui, Hai-Lei; Chai, Qian; Long, Jun; Li, Bang-Jing; Wu, Yong; Ding, Li-Sheng; Chen, Ying-Chun","Organocatalytic asymmetric Friedel-Crafts alkylation/cascade reactions of naphthols and nitroolefins.","Chemical communications (Cambridge, England)","2007","","22","2228","2230","10.1039/b704925k","","","0.71073","MoKα","","0.1273","0.0439","","","0.0515","0.0599","","","","","","0.864","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7101959","18.373","0.003","14.349","0.003","19.252","0.004","90","","116.763","0.011","90","","4531.8","1.5","110","","110","","","","","","","","local laboratory","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H55 Cl5 N4 O4 -","- C38 H53 Cl3 N4 O4 -","- C152 H212 Cl12 N16 O16 -","4","1","","Mwakwari, Celinah; Fronczek, Frank R; Smith, Kevin M","b-Bilene to a,c-biladiene transformation during syntheses of isoporphyrins and porphyrins.","Chemical communications (Cambridge, England)","2007","","22","2258","2260","10.1039/b705182d","","","0.71073","MoKα","","0.093","0.052","","","0.13","0.143","","","","","","1.024","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101960","12.393","0.003","14.837","0.003","16.417","0.004","79.587","0.008","75.834","0.008","76.55","0.009","2822","1.1","90","","90","","","","","","","","local laboratory","5","P -1","-P 1","2","","","","- C62 H72 N8 O4 Zn2 -","- C62 H72 N8 O4 Zn2 -","- C124 H144 N16 O8 Zn4 -","2","1","","Mwakwari, Celinah; Fronczek, Frank R; Smith, Kevin M","b-Bilene to a,c-biladiene transformation during syntheses of isoporphyrins and porphyrins.","Chemical communications (Cambridge, England)","2007","","22","2258","2260","10.1039/b705182d","","","0.71073","MoKα","","0.113","0.087","","","0.205","0.217","","","","","","1.118","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101961","27.32","0.006","8.204","0.0016","15.373","0.003","90","","90","","90","","3445.7","1.2","173","2","173","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C8 H11 I3 N7 Rh -","- C8 H11 I3 N7 Rh -","- C64 H88 I24 N56 Rh8 -","8","1","","Poyatos, Macarena; McNamara, William; Incarvito, Chris; Peris, Eduardo; Crabtree, Robert H","A planar chelating bitriazole N-heterocyclic carbene ligand and its rhodium(III) and dirhodium(II) complexes.","Chemical communications (Cambridge, England)","2007","","22","2267","2269","10.1039/b705246d","","","0.71073","MoKα","","0.0632","0.0345","","","0.0738","0.0805","","","","","","1.001","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101962","11.691","0.002","9.883","0.002","26.375","0.005","90","","97.77","0.03","90","","3019.4","1","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H29 I3 N13 O Rh -","- C18 H29 I3 N13 O Rh -","- C72 H116 I12 N52 O4 Rh4 -","4","1","","Poyatos, Macarena; McNamara, William; Incarvito, Chris; Peris, Eduardo; Crabtree, Robert H","A planar chelating bitriazole N-heterocyclic carbene ligand and its rhodium(III) and dirhodium(II) complexes.","Chemical communications (Cambridge, England)","2007","","22","2267","2269","10.1039/b705246d","","","0.71073","MoKα","","0.0861","0.0496","","","0.1279","0.1427","","","","","","1.037","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101963","20.137","0.004","11.2","0.002","19.736","0.004","90","","99.01","0.03","90","","4396.3","1.5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H37 B4 F16 N19 Rh2 -","- C26 H37 B4 F16 N19 Rh2 -","- C104 H148 B16 F64 N76 Rh8 -","4","1","","Poyatos, Macarena; McNamara, William; Incarvito, Chris; Peris, Eduardo; Crabtree, Robert H","A planar chelating bitriazole N-heterocyclic carbene ligand and its rhodium(III) and dirhodium(II) complexes.","Chemical communications (Cambridge, England)","2007","","22","2267","2269","10.1039/b705246d","","","0.71073","MoKα","","0.0814","0.0445","","","0.0968","0.1084","","","","","","0.996","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101964","8.632","0.002","10.071","0.003","12.195","0.002","90","","95.043","0.001","90","","1056.2","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H27 N O8 -","- C20 H27 N O8 -","- C40 H54 N2 O16 -","2","1","","Hajra, Saumen; Giri, Aswini Kumar; Karmakar, Ananta; Khatua, Snehadrinarayan","Asymmetric aldol reactions under normal and inverse addition modes of the reagents","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2408","2410","10.1039/b618699h","","","0.71073","MoKα","","0.0931","0.0496","","","0.11","0.1271","","","","","","1.024","","","","has coordinates","210621","2020-10-21","18:00:00",""
"7101965","10.0719","0.0002","11.2639","0.0002","14.2688","0.0003","90","","98.771","0.001","90","","1599.85","0.05","90","2","90","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2, 2, 4, 4-Tetramethyl -1,3 di(4-hydroxylphenyl)acetone","","","- C19 H22 O3 -","- C19 H22 O3 -","- C76 H88 O12 -","4","1","","Zhang, Jing; Gembicky, Milan; Messerschmidt, Marc; Coppens, Philip","Hydrogen-bond quenching of photodecarbonylation in the solid state and recovery of reactivity by co-crystallization","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2399","2401","10.1039/b700073a","","","0.71073","MoKα","","0.0419","0.0354","","","0.0897","0.0944","","","","","","1.035","","","","has coordinates","209758","2020-10-21","18:00:00",""
"7101966","12.517","0.003","6.3855","0.0013","21.558","0.004","90","","90.98","0.03","90","","1722.7","0.6","90","2","90","2","","","","","","","","3","P 1 21 1","P 2yb","4","2, 2, 4, 4-tetramethyl -1-(4-hydroxyphenyl)-3-(4- methoxyphenyl)acetone","","","- C40 H50 O7 -","- C40 H50 O7 -","- C80 H100 O14 -","2","1","","Zhang, Jing; Gembicky, Milan; Messerschmidt, Marc; Coppens, Philip","Hydrogen-bond quenching of photodecarbonylation in the solid state and recovery of reactivity by co-crystallization","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2399","2401","10.1039/b700073a","","","0.71073","MoKα","","0.0376","0.0354","","","0.0969","0.0991","","","","","","1.035","","","","has coordinates","209758","2020-10-21","18:00:00",""
"7101967","6.2893","0.0002","7.9701","0.0002","43.7044","0.0011","90","","92.947","0.001","90","","2187.84","0.1","90","2","90","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","MonoHOTMK, 4,4'-biscyclohexanone","","","- C26 H33 O4 -","- C26 H33 O4 -","- C104 H132 O16 -","4","1","","Zhang, Jing; Gembicky, Milan; Messerschmidt, Marc; Coppens, Philip","Hydrogen-bond quenching of photodecarbonylation in the solid state and recovery of reactivity by co-crystallization","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2399","2401","10.1039/b700073a","","","0.71073","MoKα","","0.0443","0.0409","","","0.1053","0.1077","","","","","","1.037","","","","has coordinates","209758","2020-10-21","18:00:00",""
"7101968","7.7459","0.0001","11.0192","0.0002","16.6519","0.0003","109.259","0.001","92.645","0.001","90.754","0.001","1339.72","0.04","90","2","90","2","","","","","","","","3","P -1","-P 1","2","HOTMK-biscyclohexanone","","","- C31 H40 O5 -","- C31 H40 O5 -","- C62 H80 O10 -","2","1","","Zhang, Jing; Gembicky, Milan; Messerschmidt, Marc; Coppens, Philip","Hydrogen-bond quenching of photodecarbonylation in the solid state and recovery of reactivity by co-crystallization","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2399","2401","10.1039/b700073a","","","0.71073","MoKα","","0.0527","0.0376","","","0.0867","0.0942","","","","","","1.012","","","","has coordinates","209758","2020-10-21","18:00:00",""
"7101969","13.039","0.007","7.401","0.004","22.56","0.012","90","","102.44","0.005","90","","2125.8","1.9","298","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H24 N2 O6 -","- C22 H24 N2 O6 -","- C88 H96 N8 O24 -","4","2","","Sreekanth, B. R.; Vishweshwar, Peddy; Vyas, K.","Supramolecular synthon polymorphism in 2 : 1 co-crystal of 4-hydroxybenzoic acid and 2,3,5,6-tetramethylpyrazine","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2375","2377","10.1039/b700082k","","","0.7107","MoKα","","","0.054","","","","0.121","","","","","","0.886","","","","has coordinates","210482","2020-10-21","18:00:00",""
"7101970","10.5495","0.0011","10.3154","0.0009","10.2205","0.0011","90","","109.904","0.004","90","","1045.8","0.2","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 N2 O6 -","- C22 H24 N2 O6 -","- C44 H48 N4 O12 -","2","0.5","","Sreekanth, B. R.; Vishweshwar, Peddy; Vyas, K.","Supramolecular synthon polymorphism in 2 : 1 co-crystal of 4-hydroxybenzoic acid and 2,3,5,6-tetramethylpyrazine","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2375","2377","10.1039/b700082k","","","0.7107","MoKα","","","0.05","","","","0.074","","","","","","1.07","","","","has coordinates","210482","2020-10-21","18:00:00",""
"7101971","8.5631","0.0002","18.641","0.0005","10.6743","0.0003","90","","105.995","0.002","90","","1637.92","0.07","200","2","200","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C30 H64 Al Li N2 -","- C30 H64 Al Li N2 -","- C60 H128 Al2 Li2 N4 -","2","1","","García-Álvarez, Joaquín; Hevia, Eva; Kennedy, Alan R.; Klett, Jan; Mulvey, Robert E.","Lewis base stabilized lithium TMP-aluminates: an unexpected fragmentation and capture reaction involving cyclic ether 1,4-dioxane","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2402","2404","10.1039/b700785j","","","0.71073","MoKα","","0.0912","0.0559","","","0.1144","0.1321","","","","","","1.041","","","","has coordinates","209745","2020-10-21","18:00:00",""
"7101972","10.5683","0.0007","11.0648","0.0007","14.9605","0.0007","96.822","0.004","105.87","0.003","113.03","0.003","1497.42","0.15","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H60 Al Li N2 -","- C27 H60 Al Li N2 -","- C54 H120 Al2 Li2 N4 -","2","1","","García-Álvarez, Joaquín; Hevia, Eva; Kennedy, Alan R.; Klett, Jan; Mulvey, Robert E.","Lewis base stabilized lithium TMP-aluminates: an unexpected fragmentation and capture reaction involving cyclic ether 1,4-dioxane","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2402","2404","10.1039/b700785j","","","0.71073","MoKα","","0.1211","0.0582","","","0.0962","0.1165","","","","","","1.01","","","","has coordinates","209745","2020-10-21","18:00:00",""
"7101973","18.9601","0.0005","16.2475","0.0004","11.5036","0.0003","90","","90","","90","","3543.73","0.16","123","2","123","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C34 H64 Al Li N2 O -","- C34 H64 Al Li N2 O -","- C136 H256 Al4 Li4 N8 O4 -","4","1","","García-Álvarez, Joaquín; Hevia, Eva; Kennedy, Alan R.; Klett, Jan; Mulvey, Robert E.","Lewis base stabilized lithium TMP-aluminates: an unexpected fragmentation and capture reaction involving cyclic ether 1,4-dioxane","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2402","2404","10.1039/b700785j","","","0.71073","MoKα","","0.0757","0.0427","","","0.0744","0.0843","","","","","","1.015","","","","has coordinates","209745","2020-10-21","18:00:00",""
"7101974","11.8338","0.0004","11.8351","0.0003","13.8446","0.0004","111.793","0.002","95.568","0.002","101.398","0.002","1733.71","0.09","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C62 H114 Al2 Li2 N2 O8 -","- C62 H114 Al2 Li2 N2 O8 -","- C62 H114 Al2 Li2 N2 O8 -","1","0.5","","García-Álvarez, Joaquín; Hevia, Eva; Kennedy, Alan R.; Klett, Jan; Mulvey, Robert E.","Lewis base stabilized lithium TMP-aluminates: an unexpected fragmentation and capture reaction involving cyclic ether 1,4-dioxane","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2402","2404","10.1039/b700785j","","","0.71073","MoKα","","0.1045","0.0566","","","0.1259","0.1489","","","","","","1.016","","","","has coordinates,has disorder","209745","2020-10-21","18:00:00",""
"7101975","19.1742","0.001","19.4623","0.0009","19.9819","0.0012","90","","90","","90","","7456.7","0.7","123","2","123","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C32 H68 Al Li O8 -","- C32 H68 Al Li O8 -","- C256 H544 Al8 Li8 O64 -","8","1","","García-Álvarez, Joaquín; Hevia, Eva; Kennedy, Alan R.; Klett, Jan; Mulvey, Robert E.","Lewis base stabilized lithium TMP-aluminates: an unexpected fragmentation and capture reaction involving cyclic ether 1,4-dioxane","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2402","2404","10.1039/b700785j","","","0.71073","MoKα","","0.1021","0.0666","","","0.1311","0.1501","","","","","","1.177","","","","has coordinates","209745","2020-10-21","18:00:00",""
"7101976","13.252","0.003","15.578","0.003","15.739","0.003","62.67","0.03","81.12","0.03","66.97","0.03","2655.2","0.9","123","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H44 Ga6 O13 -","- C42 H42 Ga6 O13 -","- C84 H84 Ga12 O26 -","2","1","","McKinlay, Robert M.; Dalgarno, Scott J.; Nichols, Peter J.; Papadopoulos, Stavroula; Atwood, Jerry L.; Raston, Colin L.","Icosahedral galloxane clusters","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2393","2395","10.1039/b700984d","","","0.71073","MoKα","","0.1412","0.0585","","","0.1231","0.1436","","","","","","0.891","","","","has coordinates","210410","2020-10-21","18:00:00",""
"7101977","19.044","0.003","19.044","0.002","19.044","0.002","90","","90","","90","","6906.2","1.4","123","2","150","2","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","Isopropylgalloxane","","","- C6 H15 Ga2 O3 -","- C6 H11.8 Ga2 O3.32333 -","- C144 H283.2 Ga48 O79.76 -","24","1","","McKinlay, Robert M.; Dalgarno, Scott J.; Nichols, Peter J.; Papadopoulos, Stavroula; Atwood, Jerry L.; Raston, Colin L.","Icosahedral galloxane clusters","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2393","2395","10.1039/b700984d","","","0.71073","MoKα","","0.1027","0.0661","","","0.1856","0.2064","","","","","","1.08","","","","has coordinates,has disorder","210410","2020-10-21","18:00:00",""
"7101978","16.011","0.003","16.203","0.003","16.717","0.003","77.42","0.03","61.6","0.03","74.52","0.03","3655.1","1.3","123","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C67.67 H78 Br2.34 Ga7 O10.5 -","- C67.69 H78.02 Br2.33 Ga7 O10.5 -","- C135.38 H156.04 Br4.66 Ga14 O21 -","2","1","","McKinlay, Robert M.; Dalgarno, Scott J.; Nichols, Peter J.; Papadopoulos, Stavroula; Atwood, Jerry L.; Raston, Colin L.","Icosahedral galloxane clusters","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2393","2395","10.1039/b700984d","","","0.71073","MoKα","","0.1434","0.0697","","","0.1487","0.1805","","","","","","1.017","","","","has coordinates,has disorder","210410","2020-10-21","18:00:00",""
"7101979","11.4928","0.0016","18.165","0.003","21.418","0.003","90","","91.217","0.003","90","","4470.5","1.1","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C48 H70 N4 O4 -","- C48 H70 N4 O4 -","- C192 H280 N16 O16 -","4","1","","Clayden, Jonathan; Vallverdú, Lluís; Helliwell, Madeleine","Transmitting information along oligo-para-phenylenes: 1,12-stereochemical control in a terphenyl tetracarboxamide","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2357","2359","10.1039/b701682d","","","0.71073","MoKα","","0.0901","0.0388","","","0.0583","0.0659","","","","","","0.744","","","","has coordinates","209677","2020-10-21","18:00:00",""
"7101980","9.3992","0.0018","9.5847","0.0018","19.157","0.004","98.68","0.003","98.408","0.003","94.569","0.003","1678.5","0.5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H39 N Ni P2 -","- C38 H39 N Ni P2 -","- C76 H78 N2 Ni2 P4 -","2","1","","Wang, Zhong-Xia; Wang, Li","Amido pincer complex of nickel-catalysed Kumada cross-coupling reactions","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2423","2425","10.1039/b702027a","","","0.71073","MoKα","","0.0407","0.03","","","0.0759","0.0866","","","","","","1.077","","","","has coordinates","210496","2020-10-21","18:00:00",""
"7101981","9.7247","0.0004","12.857","0.0005","17.4756","0.0007","79.579","0.013","79.548","0.014","77.064","0.011","2071.64","0.2","294.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H52 Cl N2 Ni P2 -","- C44 H52 Cl N2 Ni P2 -","- C88 H104 Cl2 N4 Ni2 P4 -","2","1","","Wang, Zhong-Xia; Wang, Li","Amido pincer complex of nickel-catalysed Kumada cross-coupling reactions","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2423","2425","10.1039/b702027a","","","0.7107","MoKα","","","0.061","","","","0.164","","","","","","1.051","","","","has coordinates","210496","2020-10-21","18:00:00",""
"7101982","11.861","0.002","12.509","0.003","14.959","0.003","84.58","0.03","77.35","0.03","64.29","0.03","1951.3","0.7","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H51 Cl N2 Ni P2 -","- C44 H51 Cl N2 Ni P2 -","- C88 H102 Cl2 N4 Ni2 P4 -","2","1","","Wang, Zhong-Xia; Wang, Li","Amido pincer complex of nickel-catalysed Kumada cross-coupling reactions","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2423","2425","10.1039/b702027a","","","0.71073","MoKα","","0.0418","0.0347","","","0.0881","0.0932","","","","","","1.076","","","","has coordinates","210496","2020-10-21","18:00:00",""
"7101983","9.949","0.0016","10.3142","0.0017","20.637","0.004","81.768","0.005","87.185","0.007","81.643","0.006","2072.8","0.6","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H53 N3 Ni P2 -","- C48 H53 N3 Ni P2 -","- C96 H106 N6 Ni2 P4 -","2","1","","Wang, Zhong-Xia; Wang, Li","Amido pincer complex of nickel-catalysed Kumada cross-coupling reactions","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2423","2425","10.1039/b702027a","","","0.7107","MoKα","","0.0415","0.0343","","","0.0854","0.0895","","","","","","1.071","","","","has coordinates","210496","2020-10-21","18:00:00",""
"7101984","13.0184","0.0002","20.3636","0.0004","13.8961","0.0003","90","","90.332","0.001","90","","3683.81","0.12","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C72 H112 N4 Na2 O4 Zn2 -","- C72 H112 N4 Na2 O4 Zn2 -","- C144 H224 N8 Na4 O8 Zn4 -","2","0.5","","Yang, Xiao-Juan; Yu, Jie; Liu, Yanyan; Xie, Yaoming; Schaefer, Henry F.; Liang, Yongmin; Wu, Biao","A new zinc‒zinc-bonded compound with a dianionic α-diimine ligand: synthesis and structure of [Na(THF)~2~]~2~·[LZn‒ZnL] (L = [(2,6-^i^Pr~2~C~6~H~3~)N(Me)C]~2~^2-^)","Chemical Communications (Cambridge, United Kingdom)","2007","","23","2363","2365","10.1039/b703200e","","","0.71073","MoKα","","0.0843","0.0515","","","0.1392","0.1612","","","","","","1.023","","","","has coordinates","210756","2020-10-21","18:00:00",""
"7101985","25.102","0.003","14.1911","0.0014","22.067","0.003","90","","113.084","0.005","90","","7231.5","1.5","93.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C27 H19 F18 Mn1.5 N3 O8 -","- C27 H19 F18 Mn1.5 N3 O8 -","- C216 H152 F144 Mn12 N24 O64 -","8","1","","Okada, Keiji; Beppu, Shiori; Tanaka, Koichiro; Kuratsu, Masato; Furuichi, Kimiaki; Kozaki, Masatoshi; Suzuki, Shuichi; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Kitagawa, Yasutaka; Yamaguchi, Kizashi","Preparation, structure, and magnetic interaction of a Mn(hfac)2-bridged [2-(3-pyridyl)(nitronyl nitroxide)-Mn(hfac)2]2 chain complex.","Chemical communications (Cambridge, England)","2007","","24","2485","2487","10.1039/b618682c","","","0.7107","MoKα","","","0.0549","","","","0.0691","","","","","","1.064","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7101986","24.483","0.005","7.7834","0.0016","10.488","0.002","90","","90.73","0.03","90","","1998.4","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H6 F6 O8 Zn2 -","- C19 H6 F6 O8 Zn2 -","- C76 H24 F24 O32 Zn8 -","4","0.5","","Zou, Ru-Qiang; Zhong, Rui-Qin; Du, Miao; Kiyobayashi, Tetsu; Xu, Qiang","Highly-thermostable metal-organic frameworks (MOFs) of zinc and cadmium 4,4'-(hexafluoroisopropylidene)diphthalates with a unique fluorite topology.","Chemical communications (Cambridge, England)","2007","","24","2467","2469","10.1039/b701200d","","","0.71073","MoKα","","0.0675","0.0625","","","0.1893","0.1953","","","","","","1.17","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101987","24.483","0.005","7.7834","0.0016","10.488","0.002","90","","90.73","0.03","90","","1998.4","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H10 Cd2 F6 O10 -","- C19 H10 Cd2 F6 O10 -","- C76 H40 Cd8 F24 O40 -","4","0.5","","Zou, Ru-Qiang; Zhong, Rui-Qin; Du, Miao; Kiyobayashi, Tetsu; Xu, Qiang","Highly-thermostable metal-organic frameworks (MOFs) of zinc and cadmium 4,4'-(hexafluoroisopropylidene)diphthalates with a unique fluorite topology.","Chemical communications (Cambridge, England)","2007","","24","2467","2469","10.1039/b701200d","","","0.71073","MoKα","","0.0368","0.036","","","0.0901","0.0909","","","","","","1.051","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101988","11.783","0.0008","15.3349","0.0011","31.054","0.002","91.283","0.002","91.879","0.002","102.979","0.002","5462.3","0.6","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C112 H144 O40 -","- C112 H144 O40 -","- C224 H288 O80 -","2","1","","Foster, Simon R; Pearce, Alice; Blake, Alexander J; Welham, Melanie J; Dowden, James","Novel octavalent cross-linker displays efficient trapping of protein-protein interactions.","Chemical communications (Cambridge, England)","2007","","24","2512","2514","10.1039/b701542a","","","0.71073","MoKα","","0.109","0.0758","","","0.203","0.235","","","","","","1.04","","","","has coordinates,has disorder","180121","2020-10-21","18:00:00",""
"7101989","6.2521","0.0003","9.3237","0.0017","20.809","0.004","90","","90","","90","","1213","0.3","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C14 H16 O3 -","- C14 H16 O3 -","- C56 H64 O12 -","4","1","","Marson, Charles M; Edaan, Esra; Morrell, James M; Coles, Simon J; Hursthouse, Michael B; Davies, David T","A catalytic asymmetric protocol for the enantioselective synthesis of 3(2H)-furanones.","Chemical communications (Cambridge, England)","2007","","24","2494","2496","10.1039/b701548h","","","0.71073","MoKα","","0.0318","0.0306","","","0.1038","0.1059","","","","","","0.984","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101990","14.355","0.003","14.355","0.003","13.705","0.005","90","","90","","120","","2445.7","1.2","293","2","293","2","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","","","- C12 H30 F2 Mn7 N54 O12 -","- C12 H30 F2 Mn7 N54 O12 -","- C24 H60 F4 Mn14 N108 O24 -","2","0.166667","","Gao, En-Qing; Liu, Na; Cheng, Ai-Ling; Gao, Song","Novel frustrated magnetic lattice based on triangular [Mn3(micro3-F)] clusters with tetrazole ligands.","Chemical communications (Cambridge, England)","2007","","24","2470","2472","10.1039/b701840a","","","0.71073","MoKα","","0.0301","0.0277","","","0.0656","0.0669","","","","","","1.091","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101991","14.289","0.003","14.289","0.003","13.738","0.004","90","","90","","120","","2429.1","1.1","293","2","293","2","","","","","","","","5","P -3 c 1","-P 3 2""c","165","","","","- C12 H32 Mn7 N54 O14 -","- C12 H32 Mn7 N54 O14 -","- C24 H64 Mn14 N108 O28 -","2","0.166667","","Gao, En-Qing; Liu, Na; Cheng, Ai-Ling; Gao, Song","Novel frustrated magnetic lattice based on triangular [Mn3(micro3-F)] clusters with tetrazole ligands.","Chemical communications (Cambridge, England)","2007","","24","2470","2472","10.1039/b701840a","","","0.71073","MoKα","","0.0573","0.0304","","","0.0413","0.0438","","","","","","0.801","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101992","9.7061","0.001","10.1783","0.001","11.4792","0.0011","96.318","0.004","107.261","0.004","100.935","0.004","1046.44","0.18","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H26 N2 O2 S -","- C25 H26 N2 O2 S -","- C50 H52 N4 O4 S2 -","2","1","","Alex, Audrey; Larmanjat, Bénédicte; Marrot, Jérôme; Couty, François; David, Olivier","Strained azetidinium ylides: new reagents for epoxidation.","Chemical communications (Cambridge, England)","2007","","24","2500","2502","10.1039/b701848g","","","0.71073","MoKα","","0.0393","0.0339","","","0.1016","0.1172","","","","","","1.171","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101993","23.784","0.003","14.529","0.0016","16.258","0.002","90","","90","","90","","5618.1","1.2","183","2","183","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C62 H39 F15 N4 O3 -","- C62 H39 F15 N4 O3 -","- C248 H156 F60 N16 O12 -","4","1","","Rosenthal, Joel; Chng, Leng Leng; Fried, Stephen D; Nocera, Daniel G","Stereochemical control of H2O2 dismutation by Hangman porphyrins.","Chemical communications (Cambridge, England)","2007","","25","2642","2644","10.1039/b616884a","","","0.71073","MoKα","","0.0955","0.0708","","","0.1712","0.1842","","","","","","1.067","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101994","34.826","0.007","35.777","0.007","16.575","0.003","90","","90","","90","","20652","7","293","2","293","2","","","","","","","","7","A b a 2","A 2 -2ab","41","","","","- C135 H117 Mn Mo36 N27 O118 P2 -","- C135 H104 Mn Mo36 N27 O118 P2 -","- C540 H416 Mn4 Mo144 N108 O472 P8 -","4","","","Li, Yang-Guang; Dai, Li-Mei; Wang, Yong-Hui; Wang, Xin-Long; Wang, En-Bo; Su, Zhong-Min; Xu, Lin","A new molybdenum-oxide-based organic-inorganic hybrid framework templated by double-Keggin anions.","Chemical communications (Cambridge, England)","2007","","25","2593","2595","10.1039/b700511c","","","0.71073","MoKα","","0.0691","0.0465","","","0.0869","0.0943","","","","","","0.872","","","","has coordinates,has disorder","180121","2020-10-21","18:00:00",""
"7101995","9.8175","0.0008","22.0718","0.0017","19.6526","0.0016","90","","91.192","0.001","90","","4257.6","0.6","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","05242","","","- C46 H40 N2 O4 P2 S2 Ti -","- C46 H40 N2 O4 P2 S2 Ti -","- C184 H160 N8 O16 P8 S8 Ti4 -","4","1","","Jilek, Robert E; Tripepi, Giovanna; Urnezius, Eugenijus; Brennessel, William W; Young, Jr, Victor G; Ellis, John E","Zerovalent titanium-sulfur complexes. Novel dithiocarbamato derivatives of Ti(CO)6: [Ti(CO)4(S2CNR2)]-.","Chemical communications (Cambridge, England)","2007","","25","2639","2641","10.1039/b700808b","","","0.71073","MoKα","","0.0574","0.0413","","","0.0869","0.0928","","","","","","1.023","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101996","33.882","0.012","8.511","0.003","19.052","0.007","90","","90","","90","","5494","3","173","2","173","2","","","","","","","","7","P b c n","-P 2n 2ab","60","99185","","","- C19 H30 K N O10 S2 Ti -","- C19 H30 K N O10 S2 Ti -","- C152 H240 K8 N8 O80 S16 Ti8 -","8","1","","Jilek, Robert E; Tripepi, Giovanna; Urnezius, Eugenijus; Brennessel, William W; Young, Jr, Victor G; Ellis, John E","Zerovalent titanium-sulfur complexes. Novel dithiocarbamato derivatives of Ti(CO)6: [Ti(CO)4(S2CNR2)]-.","Chemical communications (Cambridge, England)","2007","","25","2639","2641","10.1039/b700808b","","","0.71073","MoKα","","0.0621","0.0388","","","0.0865","0.0931","","","","","","0.982","","","","has coordinates","180121","2020-10-21","18:00:00",""
"7101997","9.3026","0.0019","9.4892","0.0019","26.467","0.005","90","","90","","90","","2336.4","0.8","200","2","200","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C28 H20 N10 -","- C28 H20 N10 -","- C112 H80 N40 -","4","1","","Rajadurai, Chandrasekar; Fuhr, Olaf; Kruk, Robert; Ghafari, Mohammed; Hahn, Horst; Ruben, Mario","Above room temperature spin transition in a metallo-supramolecular coordination oligomer/polymer.","Chemical communications (Cambridge, England)","2007","","25","2636","2638","10.1039/b702468a","","","0.71073","MoKα","","0.101","0.0527","","","0.1095","0.1261","","","","","","0.926","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7101998","6.7054","0.0013","9.0818","0.0018","8.1187","0.0016","90","","90","","90","","494.41","0.17","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C2 H2 Cu N6 -","- C2 H2 Cu N6 -","- C8 H8 Cu4 N24 -","4","1","","Li, Jian-Rong; Yu, Qun; Sañudo, E Carolina; Tao, Ying; Bu, Xian-He","An azido-Cu(II)-triazolate complex with utp-type topological network, showing spin-canted antiferromagnetism.","Chemical communications (Cambridge, England)","2007","","25","2602","2604","10.1039/b702988h","","","0.71073","MoKα","","0.0266","0.0234","","","0.0537","0.056","","","","","","1.041","","","","has coordinates,has disorder","180121","2020-10-21","18:00:00",""
"7101999","12.7414","0.0009","14.6499","0.0011","16.8512","0.0013","71.086","0.001","80.282","0.001","79.009","0.001","2901.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H58 Cl4 Hg2 N8 O9 -","- C54 H56 Cl4 Hg2 N8 O9 -","- C108 H112 Cl8 Hg4 N16 O18 -","2","1","","Yin, Zhenming; Zhang, Yanhua; He, Jiaqi; Cheng, Jin-Pei","Hydrogen bond assisted helical self-assembly into [n]catenane.","Chemical communications (Cambridge, England)","2007","","25","2599","2601","10.1039/b703591h","","","0.71073","MoKα","","0.0739","0.0487","","","0.106","0.1168","","","","","","1.035","","","","has coordinates,has disorder","180121","2020-10-21","18:00:00",""
"7102000","19.579","0.002","11.268","0.0008","29.077","0.003","90","","90","","90","","6414.9","1","100","2","100","2","","","","","","","","2","P c a 21","P 2c -2ac","29","","","","- C120 Cl10 -","- C120 Cl10 -","- C480 Cl40 -","4","1","","Troyanov, Sergey I; Kemnitz, Erhard","Singly-bonded fullerene dimers: neutral (C(60)Cl(5))(2) and cationic (C(70))(2)(2+).","Chemical communications (Cambridge, England)","2007","","26","2707","2709","10.1039/b702665j","","","0.91","synchrotron","","0.1722","0.1129","","","0.2336","0.2594","","","","","","1.191","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102001","10.1848","0.0002","13.7803","0.0003","16.7018","0.0004","86.242","0.001","89.054","0.001","79.491","0.001","2299.79","0.09","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C140 Cl26 Ti6 -","- C140 Cl26 Ti6 -","- C140 Cl26 Ti6 -","1","0.5","","Troyanov, Sergey I; Kemnitz, Erhard","Singly-bonded fullerene dimers: neutral (C(60)Cl(5))(2) and cationic (C(70))(2)(2+).","Chemical communications (Cambridge, England)","2007","","26","2707","2709","10.1039/b702665j","","","0.91","synchrotron","","0.0378","0.0369","","","0.1007","0.1016","","","","","","1.183","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102002","11.959","0.004","12.039","0.004","13.082","0.005","110.973","0.014","95.71","0.02","99.735","0.018","1707","1.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C34.5 H26.5 Cl6.5 P Pd -","- C34.5 H26.5 Cl6.5 P Pd -","- C69 H53 Cl13 P2 Pd2 -","2","1","","Wass, Duncan F; Haddow, Mairi F; Hey, Thomas W; Orpen, A Guy; Russell, Christopher A; Wingad, Richard L; Green, Michael","Cyclopropenylidene carbene ligands in palladium C-C coupling catalysis.","Chemical communications (Cambridge, England)","2007","","26","2704","2706","10.1039/b702827j","","x-ray","0.71073","MoKα","","0.0589","0.0395","","","0.0959","0.1083","","","","","","0.978","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102003","13.8273","0.0003","15.3275","0.0003","15.5166","0.0004","111.658","0.001","109.892","0.001","102.612","0.001","2642.14","0.1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H114 Mn8 N24 O32 -","- C84 H114 Mn8 N24 O32 -","- C84 H114 Mn8 N24 O32 -","1","0.5","","Milios, Constantinos J; Inglis, Ross; Vinslava, Alina; Prescimone, Alessandro; Wernsdorfer, Wolfgang; Parsons, Simon; Perlepes, Spyros P; Christou, George; Brechin, Euan K","Turning up the spin, turning on single-molecule magnetism: from S = 1 to S = 7 in a [Mn(8)] cluster via ligand induced structural distortion.","Chemical communications (Cambridge, England)","2007","","26","2738","2740","10.1039/b703089d","","","0.71073","MoKα","","0.0664","0.0492","","","0.1106","0.1174","","","","","","1.057","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7102004","11.698","0.002","12.608","0.003","17.019","0.003","76.05","0.03","82.03","0.03","75.41","0.03","2349.4","0.9","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C66 H114 Mn8 N24 O32 -","- C56 H74 Mn8 N24 O22 -","- C56 H74 Mn8 N24 O22 -","1","0.5","","Milios, Constantinos J; Inglis, Ross; Vinslava, Alina; Prescimone, Alessandro; Wernsdorfer, Wolfgang; Parsons, Simon; Perlepes, Spyros P; Christou, George; Brechin, Euan K","Turning up the spin, turning on single-molecule magnetism: from S = 1 to S = 7 in a [Mn(8)] cluster via ligand induced structural distortion.","Chemical communications (Cambridge, England)","2007","","26","2738","2740","10.1039/b703089d","","","0.71073","MoKα","","0.1203","0.0698","","0.0662","0.0574","0.0574","","","","","","1.2266","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102005","7.213","0.005","18.508","0.012","24.891","0.016","90","","94.735","0.009","90","","3311","4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H30 N6 Pt Si -","- C39 H30 N6 Pt Si -","- C156 H120 N24 Pt4 Si4 -","4","1","","Xu, Hai-Bing; Zhang, Li-Yi; Xie, Zai-Lai; Ma, En; Chen, Zhong-Ning","Heterododecanuclear Pt(6)Ln(6) (Ln = Nd, Yb) arrays of 4-ethynyl-2,2'-bipyridine with sensitized near-IR lanthanide luminescence by Pt ‒> Ln energy transfer.","Chemical communications (Cambridge, England)","2007","","26","2744","2746","10.1039/b703135a","","","0.71073","MoKα","","0.1162","0.0747","","","0.1502","0.1734","","","","","","1.075","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102006","19.5811","0.0003","21.87","0.0001","22.8393","0.0004","72.372","0.003","87.759","0.004","77.873","0.004","9110.2","0.2","293","2","133.15","","","","","","","","","9","P -1","-P 1","2","","","","- C305 H206 Cl18 F108 N24 O43 P4 Pt6 Yb6 -","- C305 H180 Cl18 F108 N24 O43 P4 Pt6 Yb6 -","- C305 H180 Cl18 F108 N24 O43 P4 Pt6 Yb6 -","1","0.5","","Xu, Hai-Bing; Zhang, Li-Yi; Xie, Zai-Lai; Ma, En; Chen, Zhong-Ning","Heterododecanuclear Pt(6)Ln(6) (Ln = Nd, Yb) arrays of 4-ethynyl-2,2'-bipyridine with sensitized near-IR lanthanide luminescence by Pt ‒> Ln energy transfer.","Chemical communications (Cambridge, England)","2007","","26","2744","2746","10.1039/b703135a","","","0.71073","MoKα","","0.07","0.0558","","","0.1392","0.1574","","","","","","1.077","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102007","9.51","0.004","10.572","0.006","12.645","0.005","90","","109.048","0.014","90","","1201.8","1","123","2","123","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 N3 -","- C15 H15 N3 -","- C60 H60 N12 -","4","1","","Maeda, Hiromitsu; Hasegawa, Masahiro; Ueda, Atsushi","Hydrogen bonding self-assemblies with 1-D linear, dimeric and hexagonal nanostructures of meso-pyridyl-substituted dipyrromethanes.","Chemical communications (Cambridge, England)","2007","","26","2726","2728","10.1039/b703236f","","","0.71075","MoKα","","0.0476","0.041","","","0.0979","0.1023","","","","","","1.066","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102008","27.092","0.007","14.512","0.006","6.141","0.0018","90","","90","","90","","2414.3","1.3","123","2","123","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","","","- C15 H15 N3 -","- C15 H15 N3 -","- C120 H120 N24 -","8","1","","Maeda, Hiromitsu; Hasegawa, Masahiro; Ueda, Atsushi","Hydrogen bonding self-assemblies with 1-D linear, dimeric and hexagonal nanostructures of meso-pyridyl-substituted dipyrromethanes.","Chemical communications (Cambridge, England)","2007","","26","2726","2728","10.1039/b703236f","","","0.71075","MoKα","","0.0595","0.0525","","","0.1434","0.1487","","","","","","1.043","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102009","27.653","0.008","27.653","0.008","8.536","0.003","90","","90","","120","","5653","3","123","2","123","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C15 H15 N3 -","- C15 H15 N3 -","- C270 H270 N54 -","18","1","","Maeda, Hiromitsu; Hasegawa, Masahiro; Ueda, Atsushi","Hydrogen bonding self-assemblies with 1-D linear, dimeric and hexagonal nanostructures of meso-pyridyl-substituted dipyrromethanes.","Chemical communications (Cambridge, England)","2007","","26","2726","2728","10.1039/b703236f","","","0.71075","MoKα","","0.1214","0.0597","","","0.12","0.144","","","","","","1.036","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102010","9.1012","0.0012","9.7702","0.0013","13.9971","0.0019","90.305","0.002","105.415","0.002","107.982","0.002","1136.1","0.3","90","2","90","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H13 N3 -","- C14 H13 N3 -","- C56 H52 N12 -","4","2","","Maeda, Hiromitsu; Hasegawa, Masahiro; Ueda, Atsushi","Hydrogen bonding self-assemblies with 1-D linear, dimeric and hexagonal nanostructures of meso-pyridyl-substituted dipyrromethanes.","Chemical communications (Cambridge, England)","2007","","26","2726","2728","10.1039/b703236f","","","0.71073","MoKα","","0.0522","0.0427","","","0.1027","0.1087","","","","","","1.036","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102011","19.2068","0.0017","28.499","0.003","24.321","0.002","90","","90","","90","","13313","2","135","2","135","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C51 H71 Cl3 Eu N21 O13 -","- C51 H69 Cl3 Eu N21 O13.369 -","- C408 H552 Cl24 Eu8 N168 O106.952 -","8","1","","Li, Yongjun; Huffman, John C; Flood, Amar H","Can terdentate 2,6-bis(1,2,3-triazol-4-yl)pyridines form stable coordination compounds?","Chemical communications (Cambridge, England)","2007","","26","2692","2694","10.1039/b703301j","","","0.71073","MoKα","","0.126","0.0638","","","0.1577","0.1915","","","","","","1.021","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102012","11.156","0.003","26.836","0.006","14.153","0.003","90","","104.726","0.005","90","","4097.9","1.6","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H40 F12 Fe N14 O5 P2 -","- C30 H38 F12.018 Fe N14 O5 P2 -","- C120 H152 F48.072 Fe4 N56 O20 P8 -","4","0.5","","Li, Yongjun; Huffman, John C; Flood, Amar H","Can terdentate 2,6-bis(1,2,3-triazol-4-yl)pyridines form stable coordination compounds?","Chemical communications (Cambridge, England)","2007","","26","2692","2694","10.1039/b703301j","","","0.71073","MoKα","","0.0813","0.0418","","","0.0887","0.1016","","","","","","0.882","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102013","12.2491","0.0008","23.2119","0.0015","14.9526","0.001","90","","108.375","0.002","90","","4034.6","0.5","125","2","125","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H38 F12 N14 O4 P2 Ru -","- C30 H38 F12 N14 O4 P2 Ru -","- C120 H152 F48 N56 O16 P8 Ru4 -","4","1","","Li, Yongjun; Huffman, John C; Flood, Amar H","Can terdentate 2,6-bis(1,2,3-triazol-4-yl)pyridines form stable coordination compounds?","Chemical communications (Cambridge, England)","2007","","26","2692","2694","10.1039/b703301j","","","0.71073","MoKα","","0.0512","0.0299","","","0.0658","0.0729","","","","","","0.943","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102014","11.3821","0.0005","13.272","0.0005","14.5631","0.0006","99.002","0.0012","108.761","0.0011","95.1928","0.0012","2033.94","0.14","90","2","90","2","","","","","","","","4","P -1","-P 1","2","CECR-E-HClA-2MeOH-1.5H2O@90k","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.0575","0.0491","","","0.1351","0.1422","","","","","","1.061","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102015","11.4557","0.0009","13.3257","0.0011","14.6792","0.0012","98.972","0.002","109.09","0.002","95.411","0.002","2066.2","0.3","200","2","200","2","","","","","","","","4","P -1","-P 1","2","CECR-E-HClA-2MeOH-1.5H2O@200k","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.0826","0.0603","","","0.1706","0.1897","","","","","","1.028","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102016","11.3771","0.0005","13.3223","0.0007","14.6324","0.0006","99.0998","0.0015","109.273","0.0013","95.2633","0.0015","2042.38","0.16","90","2","90","2","","","","","","","","4","P -1","-P 1","2","CECR-E-HClA-2MeOH-1.5H2O@90k-1h","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.0822","0.062","","","0.1589","0.173","","","","","","1.15","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102017","11.3717","0.0004","13.3231","0.0005","14.6367","0.0005","99.089","0.0011","109.344","0.001","95.248","0.0011","2041.34","0.13","90","2","90","2","","","","","","","","4","P -1","-P 1","2","CECR-E-HClA-2MeOH-1.5H2O@90k-2h","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.0792","0.0621","","","0.1638","0.1753","","","","","","1.181","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102018","11.3799","0.0005","13.3742","0.0006","14.6526","0.0006","99.0913","0.0014","109.779","0.0013","95.1761","0.0014","2047.22","0.15","90","2","90","2","","","","","","","","4","P -1","-P 1","2","CECR-E-HClA-2MeOH-1.5H2O@90k-6h","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.0932","0.0676","","","0.1715","0.1882","","","","","","1.2","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102019","11.3847","0.0005","13.386","0.0007","14.6572","0.0006","99.1048","0.0016","109.842","0.0013","95.1665","0.0015","2049.61","0.16","90","2","90","2","","","","","","","","4","P -1","-P 1","2","CECR-E-HClA-2MeOH-1.5H2O@90k-10h","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.0966","0.0685","","","0.1732","0.1911","","","","","","1.212","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102020","11.2946","0.0004","13.466","0.0005","14.6284","0.0005","98.6809","0.001","111.101","0.0009","94.8602","0.001","2028.45","0.13","90","2","90","2","","","","","","","","4","P -1","-P 1","2","CECR-Z-HClA-2MeOH-1.5H2O@90k","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.0512","0.0455","","","0.1228","0.1279","","","","","","1.023","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102021","11.3681","0.0004","13.4995","0.0005","14.7379","0.0006","98.6833","0.0011","111","0.001","95.1494","0.0011","2061.79","0.13","200","2","200","2","","","","","","","","4","P -1","-P 1","2","CECR-Z-HClA-2MeOH-1.5H2O@90k","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.0647","0.0529","","","0.1383","0.1502","","","","","","1.017","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102022","11.3657","0.0003","13.3996","0.0003","14.6514","0.0004","98.9111","0.0008","110.22","0.0008","95.1864","0.0008","2043.48","0.09","90","2","90","2","","","","","","","","4","P -1","-P 1","2","CECR-Z-HClA-2MeOH-1.5H2O@90k-1h","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.0775","0.0631","","","0.1605","0.1695","","","","","","1.169","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102023","11.3736","0.0004","13.3966","0.0004","14.6486","0.0005","98.9479","0.001","110.192","0.001","95.1444","0.001","2044.42","0.12","90","2","90","2","","","","","","","","4","P -1","-P 1","2","CECR-Z-HClA-2MeOH-1.5H2O@90k-2h","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.0839","0.0657","","","0.1693","0.18","","","","","","1.209","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102024","11.3794","0.0004","13.3976","0.0005","14.6461","0.0005","99.0222","0.001","110.209","0.001","95.0382","0.0011","2045.08","0.13","90","2","90","2","","","","","","","","4","P -1","-P 1","2","CECR-Z-HClA-2MeOH-1.5H2O@90k-4h","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.0874","0.0675","","","0.1704","0.1825","","","","","","1.217","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102025","11.3833","0.0004","13.4042","0.0005","14.6333","0.0005","99.0088","0.0011","110.246","0.0011","94.9955","0.0011","2044.83","0.13","90","2","90","2","","","","","","","","4","P -1","-P 1","2","CECR-Z-HClA-2MeOH-1.5H2O@90k-8h","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.0902","0.0662","","","0.1675","0.1814","","","","","","1.197","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102026","11.3796","0.0007","13.4055","0.0008","14.6244","0.0008","98.984","0.0017","110.277","0.0016","94.988","0.0018","2042.9","0.2","90","2","90","2","","","","","","","","4","P -1","-P 1","2","CECR-Z-HClA-2MeOH-1.5H2O@90k","","","- C41 H54 Cl O13.5 -","- C41 H54 Cl O13.5 -","- C82 H108 Cl2 O27 -","2","1","","Zheng, Shao-Liang; Messerschmidt, Marc; Coppens, Philip","Single-crystal-to-single-crystal E‒>Z and Z‒>E isomerizations of 3-chloroacrylic acid within the nanocavities of a supramolecular framework.","Chemical communications (Cambridge, England)","2007","","26","2735","2737","10.1039/b703378h","","","0.71073","MoKα","","0.1159","0.0652","","","0.1608","0.1852","","","","","","1.141","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102027","18.234","0.002","19.326","0.003","20.834","0.003","90","","90.445","0.002","90","","7341.48","","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","La2@C80(Dep2Si)2CH2","","","- C122 H54 La2 S2 Si2 -","- C122 H54 La2 S2 Si2 -","- C488 H216 La8 S8 Si8 -","4","1","","Wakahara, Takatsugu; Yamada, Michio; Takahashi, Satomi; Nakahodo, Tsukasa; Tsuchiya, Takahiro; Maeda, Yutaka; Akasaka, Takeshi; Kako, Masahiro; Yoza, Kenji; Horn, Ernst; Mizorogi, Naomi; Nagase, Shigeru","Two-dimensional hopping motion of encapsulated La atoms in silylated La(2)@C(80).","Chemical communications (Cambridge, England)","2007","","26","2680","2682","10.1039/b703473c","","","0.71073","MoKα","","0.1368","0.1165","","","0.2903","0.3006","","","","","","1.176","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102028","8.3069","0.0003","17.0302","0.0006","23.6466","0.0009","90","","90","","90","","3345.2","0.2","180","2","180","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H46 Br3 In N2 O8 -","- C24 H38 Br3 In N2 O7.65 -","- C96 H152 Br12 In4 N8 O30.6 -","4","1","","Nandakumar, Mecheril Valsan; Tschöp, Andreas; Krautscheid, Harald; Schneider, Christoph","Indium-bipyridine-catalyzed, enantioselective thiolysis of meso-epoxides.","Chemical communications (Cambridge, England)","2007","","26","2756","2758","10.1039/b703625f","","","0.71073","MoKα","","0.0407","0.0365","","","0.0877","0.0892","","","","","","1.109","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102029","73.34019","","73.34019","","73.34019","","90","","90","","90","","394481","","80","","80","","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","MIL100(Fe)","","","- C18 H35 F Fe3 O27.5 -","- C4896 Fe816 O7936 -","- C4896 Fe816 O7936 -","","","","Horcajada, Patricia; Surblé, Suzy; Serre, Christian; Hong, Do-Young; Seo, You-Kyong; Chang, Jong-San; Grenèche, Jean-Marc; Margiolaki, Irene; Férey, Gérard","Synthesis and catalytic properties of MIL-100(Fe), an iron(III) carboxylate with large pores.","Chemical communications (Cambridge, England)","2007","","27","2820","2822","10.1039/b704325b","powder diffraction","","0.80098","X-ray","","","","","","","","","12.9275","","","","","","","","has coordinates","277886","2022-09-15","14:38:18",""
"7102030","15.1574","0.0016","17.4268","0.0019","12.5035","0.0009","90","","126.373","0.006","90","","2659.3","0.5","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C26 H48 N6 -","- C26 H48 N6 -","- C104 H192 N24 -","4","0.5","","Villiers, Claude; Thuéry, Pierre; Ephritikhine, Michel","The first urea azine molecule and its coordination to uranium in the first actinide guanidinate complexes.","Chemical communications (Cambridge, England)","2007","","27","2832","2834","10.1039/b705224c","","","0.71073","MoKα","","0.0473","0.0397","","","0.0999","0.104","","","","","","1.048","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102031","16.2729","0.0006","21.7473","0.0006","22.4638","0.0007","90","","90","","90","","7949.8","0.4","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C68 H124 Cl6 Li2 N12 O4 U2 -","- C68 H124 Cl6 Li2 N12 O4 U2 -","- C272 H496 Cl24 Li8 N48 O16 U8 -","4","0.5","","Villiers, Claude; Thuéry, Pierre; Ephritikhine, Michel","The first urea azine molecule and its coordination to uranium in the first actinide guanidinate complexes.","Chemical communications (Cambridge, England)","2007","","27","2832","2834","10.1039/b705224c","","","0.71073","MoKα","","0.0541","0.0307","","","0.0558","0.0601","","","","","","1.019","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102032","13.649","0.0018","15.66","0.002","25.593","0.004","78.538","0.007","83.988","0.008","65.304","0.008","4869.4","1.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C156 H276 Cl12 N36 U6 -","- C156 H276 Cl12 N36 U6 -","- C156 H276 Cl12 N36 U6 -","1","0.5","","Villiers, Claude; Thuéry, Pierre; Ephritikhine, Michel","The first urea azine molecule and its coordination to uranium in the first actinide guanidinate complexes.","Chemical communications (Cambridge, England)","2007","","27","2832","2834","10.1039/b705224c","","","0.71073","MoKα","","0.1619","0.0712","","","0.1547","0.1774","","","","","","0.873","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102033","9.4428","0.0002","9.4428","0.0002","24.7664","0.0007","90","","90","","120","","1912.47","0.08","150","1","150","1","","","","","","","","7","P 31 2 1","P 31 2""","152","","","","- C14 H32 Cu F6 N6 O7 S2 -","- C14 H32 Cu F6 N6 O7 S2 -","- C42 H96 Cu3 F18 N18 O21 S6 -","3","0.5","","Cruz-Campa, Itzia; Arzola, Alejandro; Santiago, Lynn; Parsons, Jason G; Varela-Ramirez, Armando; Aguilera, Renato J; Noveron, Juan C","A novel class of metal-directed supramolecular DNA-delivery systems.","Chemical communications (Cambridge, England)","2007","","28","2944","2946","10.1039/b703201c","","","0.71073","MoKα","","0.037","0.0324","","","0.0739","0.0765","","","","","","1.049","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102034","11.6024","0.0018","11.6193","0.0011","14.7433","0.0018","109.264","0.009","111.742","0.012","95.191","0.009","1690.8","0.4","200","2","200","2","","","","","","","synthesis as described","8","P -1","-P 1","2","","","","- C61 H96 Ag F3 N8 O3 S Ti6 -","- C60 H96 Ag N8 Ti6 -","- C60 H96 Ag N8 Ti6 -","1","0.5","","Martín, Avelino; Martínez-Espada, Noelia; Mena, Miguel; Yélamos, Carlos","Encapsulation of a trinuclear silver(I) cluster by two imido-nitrido metalloligands [{Ti(eta5-C5Me5)(micro-NH)}3(micro3-N)].","Chemical communications (Cambridge, England)","2007","","28","2983","2985","10.1039/b704180b","","x-ray","0.71073","MoKα","","0.1055","0.0691","","","0.2039","0.2514","","","","","","1.066","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102035","16.058","0.003","20.694","0.006","37.507","0.011","90","","93.956","0.019","90","","12434","5","200","2","200","2","","","","","","","synthesis as described","8","P 1 21/c 1","-P 2ybc","14","","","","- C70 H104 Ag3 F9 N8 O9 S3 Ti6 -","- C63 H96 Ag3 F9 N8 O9 S3 Ti6 -","- C252 H384 Ag12 F36 N32 O36 S12 Ti24 -","4","1","","Martín, Avelino; Martínez-Espada, Noelia; Mena, Miguel; Yélamos, Carlos","Encapsulation of a trinuclear silver(I) cluster by two imido-nitrido metalloligands [{Ti(eta5-C5Me5)(micro-NH)}3(micro3-N)].","Chemical communications (Cambridge, England)","2007","","28","2983","2985","10.1039/b704180b","","x-ray","0.71073","MoKα","","0.0982","0.0515","","","0.1353","0.1458","","","","","","0.949","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102036","9.5417","0.0003","26.6042","0.001","12.3888","0.0004","90","","107.772","0.0007","90","","2994.81","0.18","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H38 B2 F8 Fe2 -","- C32 H38 B2 F8 Fe2 -","- C128 H152 B8 F32 Fe8 -","4","1","","Fletcher, Andrew E D; Moss, James; Cowley, Andrew R; O'Hare, Dermot","Novel catalysts for dechlorination of polychlorinated biphenyls (PCBs) and other chlorinated aromatics.","Chemical communications (Cambridge, England)","2007","","28","2971","2973","10.1039/b705756c","","","0.71073","MoKα","","0.1272","0.0785","","0.0983","0.0713","0.0713","","","","","","1.0102","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102037","10.653","0.0006","14.5219","0.0009","22.1502","0.0013","74.79","0.009","80.042","0.008","70.823","0.009","3109","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H66 N6 O10 Sn -","- C74 H47 N6 O10 Sn -","- C148 H94 N12 O20 Sn2 -","2","1","","Guenet, Aurélie; Graf, Ernest; Kyritsakas, Nathalie; Allouche, Lionel; Hosseini, Mir Wais","A molecular gate based on a porphyrin and a silver lock.","Chemical communications (Cambridge, England)","2007","","28","2935","2937","10.1039/b706527b","","","0.71073","MoKα","","0.1391","0.08","","","0.1998","0.2446","","","","","","1.034","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102038","15.823","0.003","12.328","0.004","18.763","0.004","90","","112.961","0.007","90","","3370","1.4","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","bis[(5,10-diphenyl-15-(4-(trans-2- carboxystyryl)phenyl)subporphyrinato)boron(III)]","","","- C86 H56 B2 Cl4 N6 O4 -","- C86 H56 B2 Cl4 N6 O4 -","- C172 H112 B4 Cl8 N12 O8 -","2","0.5","","Inokuma, Yasuhide; Osuka, Atsuhiro","Complementary face-to-face dimer formation from meso-aryl subporphyrins bearing a 2-carboxyphenyl group.","Chemical communications (Cambridge, England)","2007","","28","2938","2940","10.1039/b706573f","","","0.71075","MoKα","","0.0962","0.0643","","","0.1577","0.1773","","","","","","1.043","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102039","19.432","0.002","14.2363","0.0017","21.763","0.002","90","","103.096","0.005","90","","5863.9","1.1","120","1","120","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H51 Cl9 N4 O14 Pt4 -","- C46 H51 Cl9 N4 O14 Pt4 -","- C184 H204 Cl36 N16 O56 Pt16 -","4","1","","Ohashi, Masato; Yagyu, Akihiro; Yamagata, Tsuneaki; Mashima, Kazushi","Tetraplatinum precursors for supramolecular assemblies: syntheses, crystal structures, and stereoselective self-assemblies of [Pt4(micro-OCOCH3)6(kappa4-N4-DArBp)] (DArBp = 1,3-bis(arylbenzamidinate)propane).","Chemical communications (Cambridge, England)","2007","","29","3103","3105","10.1039/b703730a","","","0.71075","MoKα","","0.0352","0.0294","","","0.0653","0.0676","","","","","","1.032","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102040","14.6652","0.0018","14.8635","0.0018","18.169","0.003","94.64","0.007","105.681","0.006","117.743","0.005","3273.9","0.7","120","1","120","1","","","","","","","","6","P -1","-P 1","2","","","","- C52 H63 Cl9 N4 O12 Pt4 -","- C52 H63 Cl9 N4 O12 Pt4 -","- C104 H126 Cl18 N8 O24 Pt8 -","2","1","","Ohashi, Masato; Yagyu, Akihiro; Yamagata, Tsuneaki; Mashima, Kazushi","Tetraplatinum precursors for supramolecular assemblies: syntheses, crystal structures, and stereoselective self-assemblies of [Pt4(micro-OCOCH3)6(kappa4-N4-DArBp)] (DArBp = 1,3-bis(arylbenzamidinate)propane).","Chemical communications (Cambridge, England)","2007","","29","3103","3105","10.1039/b703730a","","","0.71075","MoKα","","0.0463","0.0411","","","0.0948","0.0972","","","","","","1.055","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102041","9.4165","0.0016","13.373","0.002","28.421","0.009","89.728","0.005","81.797","0.007","77.707","0.006","3459.9","1.3","120","1","120","1","","","","","","","","6","P -1","-P 1","2","","","","- C60 H63 Cl9 N4 O14 Pt4 -","- C60 H63 Cl9 N4 O14 Pt4 -","- C120 H126 Cl18 N8 O28 Pt8 -","2","1","","Ohashi, Masato; Yagyu, Akihiro; Yamagata, Tsuneaki; Mashima, Kazushi","Tetraplatinum precursors for supramolecular assemblies: syntheses, crystal structures, and stereoselective self-assemblies of [Pt4(micro-OCOCH3)6(kappa4-N4-DArBp)] (DArBp = 1,3-bis(arylbenzamidinate)propane).","Chemical communications (Cambridge, England)","2007","","29","3103","3105","10.1039/b703730a","","","0.71075","MoKα","","0.0581","0.0435","","","0.1108","0.1299","","","","","","1.045","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102042","15.8027","0.0014","62.629","0.006","76.415","0.007","90","","90","","90","","75628","12","120","1","120","1","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C228 H256 Fe4 N16 O52 Pt16 -","- C228 H248 Fe4 N16 O52 Pt16 -","- C1824 H1984 Fe32 N128 O416 Pt128 -","8","0.25","","Ohashi, Masato; Yagyu, Akihiro; Yamagata, Tsuneaki; Mashima, Kazushi","Tetraplatinum precursors for supramolecular assemblies: syntheses, crystal structures, and stereoselective self-assemblies of [Pt4(micro-OCOCH3)6(kappa4-N4-DArBp)] (DArBp = 1,3-bis(arylbenzamidinate)propane).","Chemical communications (Cambridge, England)","2007","","29","3103","3105","10.1039/b703730a","","","0.71075","MoKα","","0.2413","0.0808","","","0.2284","0.3098","","","","","","0.95","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102043","8.6066","0.0005","17.1177","0.001","15.1724","0.0009","90","","99.248","0.002","90","","2206.2","0.2","103","2","103","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H43 B6 N -","- C16 H43 B6 N -","- C64 H172 B24 N4 -","4","1","","Hofmann, Kathrin; Prosenc, Marc H; Albert, Barbara R","A new 4c-2e bond in B6H7-.","Chemical communications (Cambridge, England)","2007","","29","3097","3099","10.1039/b704944g","","","0.71073","MoKα","","0.184","0.0602","","","0.1094","0.1362","","","","","","0.858","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102044","11.3839","0.0005","7.4365","0.0003","12.1179","0.0005","90","","116.057","0.001","90","","921.59","0.07","150","2","150","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C15 H19 B F5 N3 O3 Zn -","- C15 H19 B F5 N3 O3 Zn -","- C30 H38 B2 F10 N6 O6 Zn2 -","2","1","","Ingleson, Michael J; Bacsa, John; Rosseinsky, Matthew J","Homochiral H-bonded proline based metal organic frameworks.","Chemical communications (Cambridge, England)","2007","","29","3036","3038","10.1039/b706557d","","","0.6911","synchrotron","","0.0728","0.0676","","","0.1852","0.1935","","","","","","1.086","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102045","9.5774","0.0012","11.8132","0.0015","14.7182","0.0018","90","","90","","90","","1665.2","0.4","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H16 Cd N4 O5 -","- C15 H16 Cd N4 O5 -","- C60 H64 Cd4 N16 O20 -","4","1","","Ingleson, Michael J; Bacsa, John; Rosseinsky, Matthew J","Homochiral H-bonded proline based metal organic frameworks.","Chemical communications (Cambridge, England)","2007","","29","3036","3038","10.1039/b706557d","","","0.7848","synchrotron","","0.0505","0.0464","","","0.0872","0.0899","","","","","","0.984","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102046","14.608","0.0014","19.213","0.002","21.0316","0.0017","80.126","0.011","80.686","0.011","89.676","0.012","5737.2","1","180","","180","","","","","","","","","8","P -1","-P 1","2","","","","- C61.75 H51.5 B Cl1.5 Cu F4 O P4 -","- C61.75 H51.5 B Cl1.5 Cu F4 O P4 -","- C247 H206 B4 Cl6 Cu4 F16 O4 P16 -","4","2","","Moudam, Omar; Kaeser, Adrien; Delavaux-Nicot, Béatrice; Duhayon, Carine; Holler, Michel; Accorsi, Gianluca; Armaroli, Nicola; Séguy, Isabelle; Navarro, Jose; Destruel, Pierre; Nierengarten, Jean-François","Electrophosphorescent homo- and heteroleptic copper(I) complexes prepared from various bis-phosphine ligands.","Chemical communications (Cambridge, England)","2007","","29","3077","3079","10.1039/b707398d","","","0.71073","MoKα","","0.198","0.0714","","0.2368","0.0789","0.0789","","","","","","1.174","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102047","13.5721","0.0009","12.5841","0.0008","14.9692","0.0012","90","","100.516","0.006","90","","2513.7","0.3","180","","180","","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C60 H48 B Cu F4 P4 -","- C60 H48 B Cu F4 P4 -","- C120 H96 B2 Cu2 F8 P8 -","2","0.5","","Moudam, Omar; Kaeser, Adrien; Delavaux-Nicot, Béatrice; Duhayon, Carine; Holler, Michel; Accorsi, Gianluca; Armaroli, Nicola; Séguy, Isabelle; Navarro, Jose; Destruel, Pierre; Nierengarten, Jean-François","Electrophosphorescent homo- and heteroleptic copper(I) complexes prepared from various bis-phosphine ligands.","Chemical communications (Cambridge, England)","2007","","29","3077","3079","10.1039/b707398d","","","0.71073","MoKα","","0.0798","0.0509","","0.063","0.0579","0.0579","","","","","","1.1501","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102048","11.2846","0.0014","14.2595","0.0017","17.271","0.002","74.752","0.003","89.924","0.005","78.084","0.005","2619.4","0.6","93","2","93","2","","","","","","","","8","P -1","-P 1","2","","","","- C16 H22 Br2 Cl2 N2 P2 Pt2 Se2 -","- C16 H22 Br2 Cl2 N2 P2 Pt2 Se2 -","- C64 H88 Br8 Cl8 N8 P8 Pt8 Se8 -","4","2","","Aucott, Stephen M; Drennan, Dennis; James, Sarah L M; Kelly, Paul F; Slawin, Alexandra M Z","The reaction of [Bu4N]2[Pd2Br6(Se2N2)] with [14]aneS4; an effective source of the diselenium dinitride unit.","Chemical communications (Cambridge, England)","2007","","29","3054","3056","10.1039/b707450f","","","0.71073","MoKα","","0.0585","0.0554","","","0.1405","0.1443","","","","","","1.063","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102049","19.356","0.004","19.767","0.004","20.455","0.004","73.244","0.003","89.939","0.004","74.387","0.003","7193","3","89","2","89","2","","","","","","","","6","P -1","-P 1","2","(EtS)n-(PPh3)3-CuIn cluster","","","- C103 H158 Cu9 In10 P3 S30 -","- C103 H158 Cu9 In10 P3 S30 -","- C206 H316 Cu18 In20 P6 S60 -","2","1","","Williams, Mark; Okasha, Rawda M; Nairn, Justin; Twamley, Brendan; Afifi, Tarek H; Shapiro, Pamela J","A photochemical route to discrete, ternary metal chalcogenide clusters.","Chemical communications (Cambridge, England)","2007","","30","3177","3179","10.1039/b702541f","","","0.71073","MoKα","","0.0971","0.0675","","","0.1505","0.1646","","","","","","1.043","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102050","25.295","0.005","19.684","0.004","23.29","0.005","90","","100.149","0.004","90","","11415","4","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Cu11In6S22 cluster + 1.5 toluene","","","- C70.5 H147 Cu11 In6 S22 -","- C70.5 H147 Cu11 In6 S22 -","- C282 H588 Cu44 In24 S88 -","4","1","","Williams, Mark; Okasha, Rawda M; Nairn, Justin; Twamley, Brendan; Afifi, Tarek H; Shapiro, Pamela J","A photochemical route to discrete, ternary metal chalcogenide clusters.","Chemical communications (Cambridge, England)","2007","","30","3177","3179","10.1039/b702541f","","","0.71073","MoKα","","0.0743","0.0425","","","0.093","0.108","","","","","","1.014","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102051","11.6792","0.0013","13.139","0.002","17.137","0.0019","72.608","0.012","70.347","0.009","85.839","0.012","2362.2","0.6","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C100 H122 Cl4 Li2 O7 Sn2 V6 -","- C100 H122 Cl4 Li2 O7 Sn2 V6 -","- C100 H122 Cl4 Li2 O7 Sn2 V6 -","1","0.5","","Elschenbroich, Christoph; Lu, Feng; Burghaus, Olav; Pietzonka, Clemens; Harms, Klaus","Trans-dichloro-tris([5]trovacenyl)stannate(iv), electro- and magneto-communication across a Cl-Sn-Cl backbone.","Chemical communications (Cambridge, England)","2007","","30","3201","3203","10.1039/b703349d","","","0.71073","MoKα","","0.03","0.0247","","","0.0631","0.0644","","","","","","1.013","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102052","7.608","0.005","8.883","0.005","9.914","0.005","90","","90","","90","","670","0.7","88","2","88","2","","","","","","","","7","P 21 21 2","P 2 2ab","18","Compound 1 cbaf","","","- C10 H10 Ag B F4 N4 S -","- C10 H10 Ag B F4 N4 S -","- C20 H20 Ag2 B2 F8 N8 S2 -","2","0.5","","Black, Cory A; Hanton, Lyall R; Spicer, Mark D","A coordination polymer strategy for anion encapsulation: anion-pi interactions in (4,4) nets formed from Ag(I) salts and a flexible pyrimidine ligand.","Chemical communications (Cambridge, England)","2007","","30","3171","3173","10.1039/b703522e","","","0.71069","MoKα","","0.0229","0.0207","","","0.0502","0.0517","","","","","","1.068","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102053","7.7198","0.0003","9.1284","0.0003","9.7867","0.0004","90","","90","","90","","689.66","0.05","123","2","123","2","","","","","","","","7","P 21 21 2","P 2 2ab","18","Compound 2 cbf","","","- C10 H10 Ag Cl N4 O4 S -","- C10 H10 Ag Cl N4 O4 S -","- C20 H20 Ag2 Cl2 N8 O8 S2 -","2","0.5","","Black, Cory A; Hanton, Lyall R; Spicer, Mark D","A coordination polymer strategy for anion encapsulation: anion-pi interactions in (4,4) nets formed from Ag(I) salts and a flexible pyrimidine ligand.","Chemical communications (Cambridge, England)","2007","","30","3171","3173","10.1039/b703522e","","","0.71073","MoKα","","0.0381","0.0335","","","0.0871","0.0897","","","","","","1.101","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102054","7.8018","0.0016","9.0824","0.0017","9.902","0.0019","90","","90","","90","","701.6","0.2","93","2","93","2","","","","","","","","7","P 21 21 2","P 2 2ab","18","Compound 3 cbm","","","- C10 H10 Ag F6 N4 P S -","- C10 H10 Ag F6 N4 P S -","- C20 H20 Ag2 F12 N8 P2 S2 -","2","0.5","","Black, Cory A; Hanton, Lyall R; Spicer, Mark D","A coordination polymer strategy for anion encapsulation: anion-pi interactions in (4,4) nets formed from Ag(I) salts and a flexible pyrimidine ligand.","Chemical communications (Cambridge, England)","2007","","30","3171","3173","10.1039/b703522e","","","0.71073","MoKα","","0.0314","0.029","","","0.069","0.0703","","","","","","1.037","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102055","9.9182","0.0003","4.8503","0.0002","18.8708","0.0007","90","","91.382","0.003","90","","907.54","0.06","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2-amino-4,6-dimethyl-triazine * 1 guanidine","2-amino-4,6-dimethyl-triazine * 1 guanidine","","- C6 H13 N7 -","- C6 H13 N7 -","- C24 H52 N28 -","4","1","","Göbel, Michael; Klapötke, Thomas M","First structural characterization of guanidine, HN=C(NH(2))(2).","Chemical communications (Cambridge, England)","2007","","30","3180","3182","10.1039/b705100j","","","0.71073","MoKα","","0.0499","0.0327","","","0.077","0.0837","","","","","","0.969","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102056","6.5743","0.0002","23.7968","0.0007","7.8931","0.0002","90","","96.373","0.002","90","","1227.22","0.06","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2-amino-4,6-dimethyl-triazine * 2 guanidine","2-amino-4,6-dimethyl-triazine * 2 guanidine","","- C7 H18 N10 -","- C7 H18 N10 -","- C28 H72 N40 -","4","1","","Göbel, Michael; Klapötke, Thomas M","First structural characterization of guanidine, HN=C(NH(2))(2).","Chemical communications (Cambridge, England)","2007","","30","3180","3182","10.1039/b705100j","","","0.71073","MoKα","","0.069","0.0412","","","0.0986","0.1136","","","","","","1.028","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102057","9.5089","0.0006","13.8437","0.0009","20.3971","0.0014","86.879","0.003","84.876","0.004","81.32","0.004","2641.4","0.3","153","2","153","2","","","","","","","Synthesized by the authors. See text","5","P 1","P 1","1","","","","- C117 H92 Co2 N12 O13 -","- C117 H90 Co2 N12 O13 -","- C117 H90 Co2 N12 O13 -","1","1","","Telfer, Shane G; Wuest, James D","Metallotectons: using enantiopure tris(dipyrrinato)cobalt(III) complexes to build chiral molecular materials.","Chemical communications (Cambridge, England)","2007","","30","3166","3168","10.1039/b705212j","","","1.54178","CuKα","","0.0587","0.0476","","","0.1155","0.1212","","","","","","0.968","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102058","9.6927","0.0004","14.9297","0.0007","22.8858","0.001","91.044","0.002","101.393","0.002","101.736","0.002","3172.8","0.2","150","2","150","2","","","","","","","Synthesized by the authors. See text","6","P 1","P 1","1","","","","- C115 H112 Co2 N42 O7 S3.5 -","- C115 H105 Co2 N42 O7 S3.5 -","- C115 H105 Co2 N42 O7 S3.5 -","1","1","","Telfer, Shane G; Wuest, James D","Metallotectons: using enantiopure tris(dipyrrinato)cobalt(III) complexes to build chiral molecular materials.","Chemical communications (Cambridge, England)","2007","","30","3166","3168","10.1039/b705212j","","","1.54178","CuKα","","0.1111","0.0739","","","0.1941","0.2207","","","","","","0.996","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102059","8.7903","0.0012","12.7736","0.0017","9.6066","0.0013","90","","113.6","0.02","90","","988.4","0.2","108","2","108","2","","","","","","","","4","P 1 21 1","P 2yb","4","2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl methanethiosulfonate","2,3,4,6-Tetra-O-acetyl-β-D-glucopyranosyl methanethiosulfonate","","- C15 H22 O11 S2 -","- C15 H22 O11 S2 -","- C30 H44 O22 S4 -","2","1","","Bernardes, Gonçalo J L; Marston, Justin P; Batsanov, Andrei S; Howard, Judith A K; Davis, Benjamin G","A trisulfide-linked glycoprotein.","Chemical communications (Cambridge, England)","2007","","30","3145","3147","10.1039/b706682a","","","0.71073","MoKα","","0.0273","0.0264","","","0.068","0.0688","","","","","","1.052","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102060","5.6609","0.0006","20.85","0.002","9.2785","0.001","90","","105.45","0.03","90","","1055.6","0.2","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H22 O11 S3 -","- C15 H22 O11 S3 -","- C30 H44 O22 S6 -","2","1","","Bernardes, Gonçalo J L; Marston, Justin P; Batsanov, Andrei S; Howard, Judith A K; Davis, Benjamin G","A trisulfide-linked glycoprotein.","Chemical communications (Cambridge, England)","2007","","30","3145","3147","10.1039/b706682a","","","0.71073","MoKα","","0.0287","0.0275","","","0.0693","0.0701","","","","","","1.046","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102061","15.348","0.0011","15.348","0.0011","18.938","0.003","90","","90","","90","","4461.1","0.9","150","2","150","2","","","","","","","","5","I 4/m c m","-I 4 2c","140","","","","- C19 H14 N O4 Zn -","- C19 H14 N O4 Zn -","- C152 H112 N8 O32 Zn8 -","8","0.25","","Tanaka, Daisuke; Horike, Satoshi; Kitagawa, Susumu; Ohba, Masaaki; Hasegawa, Miki; Ozawa, Yoshiki; Toriumi, Koshiro","Anthracene array-type porous coordination polymer with host-guest charge transfer interactions in excited states.","Chemical communications (Cambridge, England)","2007","","30","3142","3144","10.1039/b707947h","","","0.56076","synchrotron","","0.0762","0.0636","","","0.1995","0.2128","","","","","","1.193","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102062","23.6648","0.0009","23.6648","0.0009","16.5051","0.0013","90","","90","","90","","9243.2","0.9","120","2","120","2","","","","","","","synthesis as described","5","I 4","I 4","79","","","","- C60 H96 Cl8 N8 O16 -","- C60 H96 Cl8 N8 O16 -","- C240 H384 Cl32 N32 O64 -","4","0.5","","Brea, Roberto J; Castedo, Luis; Granja, Juan R","Large-diameter self-assembled dimers of alpha,gamma-cyclic peptides, with the nanotubular solid-state structure of cyclo-[(l-Leu-D-(Me)N-gamma-Acp)(4)-].4CHCl(2)COOH.","Chemical communications (Cambridge, England)","2007","","31","3267","3269","10.1039/b703659k","","x-ray","0.71073","MoKα","","0.0901","0.0736","","","0.2042","0.2194","","","","","","1.072","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102063","8.0588","0.0004","14.0376","0.0008","14.1642","0.0008","84.861","0.004","85.869","0.004","74.662","0.004","1537.11","0.15","100","2","100","2","","","","","","","","7","P -1","-P 1","2","Pd cyclohexanedicarbene dichloride","","","- C26 H34 Cl2 F6 N4 O2 Pd -","- C26 H34 Cl2 F6 N4 O2 Pd -","- C52 H68 Cl4 F12 N8 O4 Pd2 -","2","1","","Wanniarachchi, Yoshitha A; Slaughter, LeGrande M","One-step assembly of a chiral palladium bis(acyclic diaminocarbene) complex and its unexpected oxidation to a bis(amidine) complex.","Chemical communications (Cambridge, England)","2007","","31","3294","3296","10.1039/b703769d","","x-ray","0.71073","MoKα","","0.0758","0.051","","","0.1073","0.1141","","","","","","1.033","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102064","12.8242","0.0006","24.6468","0.0013","8.0601","0.0004","90","","90","","90","","2547.6","0.2","100","2","100","2","","","","","","","","6","P n m a","-P 2ac 2n","62","Bis(amidine)PdCl2 cyclohexane backbone","","","- C24 H24 Cl2 F6 N4 Pd -","- C24 H24 Cl2 F6 N4 Pd -","- C96 H96 Cl8 F24 N16 Pd4 -","4","0.5","","Wanniarachchi, Yoshitha A; Slaughter, LeGrande M","One-step assembly of a chiral palladium bis(acyclic diaminocarbene) complex and its unexpected oxidation to a bis(amidine) complex.","Chemical communications (Cambridge, England)","2007","","31","3294","3296","10.1039/b703769d","","x-ray","0.71073","MoKα","","0.0431","0.0342","","","0.0782","0.0825","","","","","","1.022","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102065","7.1121","0.0003","11.995","0.0005","26.9486","0.0011","90","","90.481","0.003","90","","2298.89","0.17","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,2-diaminocyclohexane p-CF3 phenyl bis(amidine)","","","- C24 H24 F6 N4 -","- C24 H24 F6 N4 -","- C96 H96 F24 N16 -","4","1","","Wanniarachchi, Yoshitha A; Slaughter, LeGrande M","One-step assembly of a chiral palladium bis(acyclic diaminocarbene) complex and its unexpected oxidation to a bis(amidine) complex.","Chemical communications (Cambridge, England)","2007","","31","3294","3296","10.1039/b703769d","","x-ray","0.71073","MoKα","","0.0769","0.048","","","0.1175","0.1363","","","","","","1.019","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102066","6.5446","0.0001","25.6151","0.0005","26.3379","0.0006","90","","90","","90","","4415.3","0.15","90","2","90","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","Compound 5","","","- C20 H22 Cl2 Cu N4 O7 -","- C20 H22 Cl2 Cu N4 O7 -","- C160 H176 Cl16 Cu8 N32 O56 -","8","2","","White, Kimberly N; Sen, Indranil; Szundi, Istvan; Landaverry, Yakira R; Bria, Lauren E; Konopelski, Joseph P; Olmstead, Marilyn M; Einarsdóttir, Olöf","Synthesis and structural characterization of cross-linked histidine-phenol Cu(ii) complexes as cytochrome c oxidase active site models.","Chemical communications (Cambridge, England)","2007","","31","3252","3254","10.1039/b703835f","","","0.71073","MoKα","","0.0258","0.0241","","","0.0628","0.064","","","","","","1.01","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102067","6.6563","0.0011","16.198","0.003","20.176","0.003","90","","90","","90","","2175.4","0.6","90","2","90","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","(CuL)(ClO4) , L = 2-(S )-((2-pyridylmethyl)methylamino) -3-(1- (hydroxy)phenyl)-imidazol-4(5)-yl)- propyl methyl ether","","","- C20 H24 Cl2 Cu N4 O6 -","- C20 H24 Cl2 Cu N4 O6 -","- C80 H96 Cl8 Cu4 N16 O24 -","4","1","","White, Kimberly N; Sen, Indranil; Szundi, Istvan; Landaverry, Yakira R; Bria, Lauren E; Konopelski, Joseph P; Olmstead, Marilyn M; Einarsdóttir, Olöf","Synthesis and structural characterization of cross-linked histidine-phenol Cu(ii) complexes as cytochrome c oxidase active site models.","Chemical communications (Cambridge, England)","2007","","31","3252","3254","10.1039/b703835f","","","0.71073","MoKα","","0.0492","0.0352","","","0.0804","0.0895","","","","","","1.028","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102068","15.4885","0.001","26.9605","0.0017","35.32","0.002","90","","90","","90","","14748.9","1.6","100","","100","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C42 H36 Ga10 N6 S16 -","- C41.9996 H36 Ga10 N6.0004 S16 -","- C335.997 H288 Ga80 N48.0032 S128 -","8","0.25","","Vaqueiro, Paz; Romero, M Lucia","[Ga10S16(NC7H9)(4)](2-): a hybrid supertetrahedral nanocluster.","Chemical communications (Cambridge, England)","2007","","31","3282","3284","10.1039/b704724j","","","0.71073","MoKα","","0.1251","0.0451","","0.0832","0.0535","0.0535","","","","","","1.0385","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102069","19.641","0.01","16.858","0.009","9.925","0.005","90","","92.159","0.011","90","","3284","3","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C46 H38 O -","- C46 H30 O -","- C184 H120 O4 -","4","0.5","","Dong, Yongqiang; Lam, Jacky W Y; Qin, Anjun; Sun, Jiaxin; Liu, Jianzhao; Li, Zhen; Sun, Jingzhi; Sung, Herman H Y; Williams, Ian D; Kwok, Hoi Sing; Tang, Ben Zhong","Aggregation-induced and crystallization-enhanced emissions of 1,2-diphenyl-3,4-bis(diphenylmethylene)-1-cyclobutene.","Chemical communications (Cambridge, England)","2007","","31","3255","3257","10.1039/b704794k","","","0.71073","MoKα","","0.075","0.056","","","0.1302","0.1393","","","","","","1.022","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102070","9.226","0.003","19.364","0.004","15.896","0.004","90","","99.197","0.009","90","","2803.4","1.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H47 B Zr -","- C30 H47 B Zr -","- C120 H188 B4 Zr4 -","4","1","","Pun, Doris; Lobkovsky, Emil; Chirik, Paul J","Amineborane dehydrogenation promoted by isolable zirconium sandwich, titanium sandwich and N(2) complexes.","Chemical communications (Cambridge, England)","2007","","31","3297","3299","10.1039/b704941b","","","0.71073","MoKα","","0.0873","0.0495","","","0.1132","0.1295","","","","","","1.025","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102071","12.695","0.002","7.0754","0.0011","14","0.002","90","","99.352","0.003","90","","1240.8","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H10 O3 -","- C17 H10 O3 -","- C68 H40 O12 -","4","1","","Cheng, Gang; Hu, Youhong","One-pot synthesis of furocoumarins through cascade addition-cyclization-oxidation.","Chemical communications (Cambridge, England)","2007","","31","3285","3287","10.1039/b705315k","","","0.71073","MoKα","","0.105","0.0583","","","0.1379","0.1726","","","","","","0.873","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102072","34.7","0.002","14.7258","0.0009","28.107","0.002","90","","103.85","0.003","90","","13944.7","1.5","180","2","180","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19.88 H19 Cl N -","- C19.875 H19 Cl N -","- C636 H608 Cl32 N32 -","32","4","","Bond, Andrew D; Jørgensen, Wendie H; Pløger, Jane M","Hydrogen-bonded cubanes and ladder fragments by analogy with the inorganic solid state.","Chemical communications (Cambridge, England)","2007","","31","3273","3275","10.1039/b706422e","","","0.71073","MoKα","","0.1236","0.0662","","","0.1692","0.1999","","","","","","1.032","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102073","14.3387","0.0003","14.3387","0.0003","20.4479","0.0008","90","","90","","120","","3640.82","0.18","180","2","180","2","","","","","","","","5","P 3","P 3","143","","","","- C19.25 H18.25 Br Cl0.75 N -","- C19.25 H18.25 Br Cl0.75 N -","- C154 H146 Br8 Cl6 N8 -","8","2.66667","","Bond, Andrew D; Jørgensen, Wendie H; Pløger, Jane M","Hydrogen-bonded cubanes and ladder fragments by analogy with the inorganic solid state.","Chemical communications (Cambridge, England)","2007","","31","3273","3275","10.1039/b706422e","","","0.71073","MoKα","","0.0734","0.063","","","0.1778","0.1833","","","","","","1.036","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102074","11.7438","0.0004","11.9457","0.0004","14.9678","0.0005","71.057","0.002","69.997","0.002","85.534","0.002","1864.97","0.11","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C19.5 H18.5 Cl1.5 I N -","- C19.5 H18.5 Cl1.5 I N -","- C78 H74 Cl6 I4 N4 -","4","2","","Bond, Andrew D; Jørgensen, Wendie H; Pløger, Jane M","Hydrogen-bonded cubanes and ladder fragments by analogy with the inorganic solid state.","Chemical communications (Cambridge, England)","2007","","31","3273","3275","10.1039/b706422e","","","0.71073","MoKα","","0.0771","0.0647","","","0.2038","0.2075","","","","","","1.205","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102075","9.4159","0.0007","16.0171","0.0011","12.8196","0.001","90","","103.049","0.003","90","","1883.5","0.2","180","2","180","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C38 H46 Cl2 N2 O5 -","- C38 H46 Cl2 N2 O5 -","- C76 H92 Cl4 N4 O10 -","2","1","","Bond, Andrew D; Jørgensen, Wendie H; Pløger, Jane M","Hydrogen-bonded cubanes and ladder fragments by analogy with the inorganic solid state.","Chemical communications (Cambridge, England)","2007","","31","3273","3275","10.1039/b706422e","","","0.71073","MoKα","","0.0499","0.0372","","","0.0851","0.0891","","","","","","1.042","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102076","9.4738","0.0005","9.5682","0.0005","11.7799","0.0005","76.637","0.002","71.428","0.002","84.858","0.002","984.65","0.09","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H26 Cl N O -","- C23 H26 Cl N O -","- C46 H52 Cl2 N2 O2 -","2","1","","Bond, Andrew D; Jørgensen, Wendie H; Pløger, Jane M","Hydrogen-bonded cubanes and ladder fragments by analogy with the inorganic solid state.","Chemical communications (Cambridge, England)","2007","","31","3273","3275","10.1039/b706422e","","","0.71073","MoKα","","0.0526","0.0432","","","0.1172","0.1225","","","","","","1.071","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102077","10.082","0.005","11.384","0.005","15.744","0.008","90","","103.917","0.008","90","","1753.9","1.4","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C39 H31 N5 O9 Zn2 -","- C36 H24 N4 O8 Zn2 -","- C72 H48 N8 O16 Zn4 -","2","0.5","","Horike, Satoshi; Tanaka, Daisuke; Nakagawa, Keiji; Kitagawa, Susumu","Selective guest sorption in an interdigitated porous framework with hydrophobic pore surfaces","Chemical Communications (Cambridge, United Kingdom)","2007","","32","3395","3397","10.1039/b703502k","","","0.7107","MoKα","","0.077","0.06","","","0.1368","0.1449","","","","","","1.068","","","","has coordinates,has disorder","210637","2020-10-21","18:00:00",""
"7102078","8.298","0.014","10.536","0.016","13.75","0.03","92.04","0.06","103.73","0.07","97.26","0.05","1156","3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H28 Br6 Cu N -","- C13 H28 Br6 Cu N -","- C26 H56 Br12 Cu2 N2 -","2","1","","Rosokha, Sergiy V.; Lu, Jianjiang; Rosokha, Tetyana Y.; Kochi, Jay K.","Halogen-bonded assembly of hybrid inorganic/organic 3D-networks from dibromocuprate salts and tetrabromomethane","Chemical Communications (Cambridge, United Kingdom)","2007","","32","3383","3385","10.1039/b705882a","","","0.71073","MoKα","","0.0676","0.0429","","","0.107","0.1162","","","","","","1.07","","","","has coordinates,has disorder","210402","2020-10-21","18:00:00",""
"7102079","12.022","0.004","12.703","0.004","19.99","0.007","90","","102.994","0.008","90","","2974.7","1.7","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C7 H14 Br5 Cu0.5 N0.5 -","- C7 H14 Br5 Cu0.5 N0.5 -","- C56 H112 Br40 Cu4 N4 -","8","1","","Rosokha, Sergiy V.; Lu, Jianjiang; Rosokha, Tetyana Y.; Kochi, Jay K.","Halogen-bonded assembly of hybrid inorganic/organic 3D-networks from dibromocuprate salts and tetrabromomethane","Chemical Communications (Cambridge, United Kingdom)","2007","","32","3383","3385","10.1039/b705882a","","","0.71073","MoKα","","0.1078","0.0424","","","0.0873","0.1096","","","","","","1.001","","","","has coordinates,has disorder","210402","2020-10-21","18:00:00",""
"7102080","16.535","0.005","6.558","0.002","9.621","0.003","90","","90","","90","","1043.2","0.5","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C4 H12 Br3 Cu2 N -","- C4 H12 Br3 Cu2 N -","- C16 H48 Br12 Cu8 N4 -","4","0.5","","Rosokha, Sergiy V.; Lu, Jianjiang; Rosokha, Tetyana Y.; Kochi, Jay K.","Halogen-bonded assembly of hybrid inorganic/organic 3D-networks from dibromocuprate salts and tetrabromomethane","Chemical Communications (Cambridge, United Kingdom)","2007","","32","3383","3385","10.1039/b705882a","","","0.71073","MoKα","","0.0302","0.0246","","","0.0577","0.0599","","","","","","1.1","","","","has coordinates","210402","2020-10-21","18:00:00",""
"7102081","22.506","0.005","22.564","0.005","22.614","0.005","65.145","0.005","85.503","0.005","80.707","0.005","10283","4","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C230 H299 N24 O3.5 -","- C230 H264 N24 O3.5 -","- C460 H528 N48 O7 -","2","1","","Kim, Nam-Kyun; Chang, Kyoung-Jin; Moon, Dohyun; Lah, Myoung Soo; Jeong, Kyu-Sung","Two distinct anion-binding modes and their relative stabilities","Chemical Communications (Cambridge, United Kingdom)","2007","","32","3401","3403","10.1039/b707032b","","","0.7","synchrotron","","0.0941","0.0633","","","0.1764","0.1967","","","","","","1.024","","","","has coordinates,has disorder","209672","2020-10-21","18:00:00",""
"7102082","18.459","0.004","17.029","0.003","12.014","0.002","90","","103.43","0.03","90","","3673.2","1.3","90","2","90","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C82 H102 N8 -","- C82 H84 N8 -","- C164 H168 N16 -","2","0.5","","Kim, Nam-Kyun; Chang, Kyoung-Jin; Moon, Dohyun; Lah, Myoung Soo; Jeong, Kyu-Sung","Two distinct anion-binding modes and their relative stabilities","Chemical Communications (Cambridge, United Kingdom)","2007","","32","3401","3403","10.1039/b707032b","","","0.7","synchrotron","","0.1135","0.0946","","","0.2671","0.2885","","","","","","1.07","","","","has coordinates,has disorder","209672","2020-10-21","18:00:00",""
"7102083","34.218","0.006","11.2574","0.0019","8.8953","0.0015","90","","90","","90","","3426.5","1","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C42 H32 O4 S4 -","- C42 H32 O4 S4 -","- C168 H128 O16 S16 -","4","0.5","","Colquhoun, Howard M.; Paoloni, Francois P. V.; Drew, Michael G. B.; Hodge, Philip","Dithioacetalisation of PEEK: a general technique for the solubilisation and characterisation of semi-crystalline aromatic polyketones","Chemical Communications (Cambridge, United Kingdom)","2007","","32","3365","3367","10.1039/b708116b","","","0.71073","MoKα","","0.2002","0.0931","","","0.2383","0.2881","","","","","","0.792","","","","has coordinates","210652","2020-10-21","18:00:00",""
"7102084","4.9965","0.0004","15.1932","0.0011","13.863","0.0011","90","","100.148","0.001","90","","1035.92","0.14","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","HBPSSEt","","","- C7 H6 N3 Se4 -","- C7 H6 N3 Se4 -","- C28 H24 N12 Se16 -","4","1","","Leitch, Alicea A.; Brusso, Jaclyn L.; Cvrkalj, Kristina; Reed, Robert W.; Robertson, Craig M.; Dube, Paul A.; Oakley, Richard T.","Spin-canting in heavy atom heterocyclic radicals","Chemical Communications (Cambridge, United Kingdom)","2007","","32","3368","3370","10.1039/b708756j","","","0.71073","MoKα","","0.0409","0.0284","","","0.071","0.0763","","","","","","1.071","","","","has coordinates","209769","2020-10-21","18:00:00",""
"7102085","4.9799","0.0002","14.9351","0.0007","13.8244","0.0006","90","","99.935","0.001","90","","1012.78","0.08","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H6 N3 S2 Se2 -","- C7 H6 N3 S2 Se2 -","- C28 H24 N12 S8 Se8 -","4","1","","Leitch, Alicea A.; Brusso, Jaclyn L.; Cvrkalj, Kristina; Reed, Robert W.; Robertson, Craig M.; Dube, Paul A.; Oakley, Richard T.","Spin-canting in heavy atom heterocyclic radicals","Chemical Communications (Cambridge, United Kingdom)","2007","","32","3368","3370","10.1039/b708756j","","","0.71073","MoKα","","0.0527","0.0318","","","0.0903","0.1095","","","","","","1.104","","","","has coordinates","209769","2020-10-21","18:00:00",""
"7102086","11.7319","0.0008","13.5034","0.0009","13.8033","0.001","113.332","0.001","92.028","0.001","99.13","0.001","1970.8","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C63 H97 Cl2 Fe6 N8 O31.5 -","- C63 H94 Cl2 Fe6 N8 O31.506 -","- C63 H94 Cl2 Fe6 N8 O31.506 -","1","0.5","","Bagai, Rashmi; Abboud, Khalil A.; Christou, George","A discrete Fe~18~ 'molecular chain'","Chemical Communications (Cambridge, United Kingdom)","2007","","32","3359","3361","10.1039/b708783g","","","0.71073","MoKα","","0.097","0.0622","","","0.1551","0.1839","","","","","","1.007","","","","has coordinates,has disorder","209688","2020-10-21","18:00:00",""
"7102087","15.7923","0.0012","17.9984","0.0013","24.8805","0.0019","106.938","0.002","104.711","0.002","90.867","0.002","6513","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C188 H364 Cl8 Fe18 N8 O74 -","- C164 H308 Fe18 N8 O74 -","- C164 H308 Fe18 N8 O74 -","1","0.5","","Bagai, Rashmi; Abboud, Khalil A.; Christou, George","A discrete Fe~18~ 'molecular chain'","Chemical Communications (Cambridge, United Kingdom)","2007","","32","3359","3361","10.1039/b708783g","","","0.71073","MoKα","","0.0851","0.0467","","","0.1252","0.1305","","","","","","0.938","","","","has coordinates,has disorder","209688","2020-10-21","18:00:00",""
"7102088","12.6159","0.0003","13.0159","0.0002","14.585","0.0003","105.679","0.001","92.625","0.001","105.169","0.001","2207.95","0.08","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C82 H108 Mn6 N6 O26 -","- C82 H108 Mn6 N6 O26 -","- C82 H108 Mn6 N6 O26 -","1","0.5","","Milios, Constantinos J; Inglis, Ross; Bagai, Rashmi; Wernsdorfer, Wolfgang; Collins, Anna; Moggach, Stephen; Parsons, Simon; Perlepes, Spyros P; Christou, George; Brechin, Euan K","Enhancing SMM properties in a family of [Mn6] clusters.","Chemical communications (Cambridge, England)","2007","","33","3476","3478","10.1039/b705170k","","","0.71073","MoKα","","0.0557","0.0373","","0.0903","0.0867","0.0903","","","","","","0.8854","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102089","12.7121","0.0004","13.198","0.0004","15.2785","0.0005","75.593","0.002","78.672","0.002","68.389","0.002","2292.53","0.13","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C88 H104 Mn6 N6 O24 -","- C88 H104 Mn6 N6 O24 -","- C88 H104 Mn6 N6 O24 -","1","0.5","","Milios, Constantinos J; Inglis, Ross; Bagai, Rashmi; Wernsdorfer, Wolfgang; Collins, Anna; Moggach, Stephen; Parsons, Simon; Perlepes, Spyros P; Christou, George; Brechin, Euan K","Enhancing SMM properties in a family of [Mn6] clusters.","Chemical communications (Cambridge, England)","2007","","33","3476","3478","10.1039/b705170k","","","0.71073","MoKα","","0.0701","0.0431","","0.1025","0.0957","0.1025","","","","","","0.8978","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102090","18.9056","0.0017","18.9056","0.0017","18.9056","0.0017","90","","90","","90","","6757.3","1.1","93","2","93","2","","","","","","","","7","P n -3 n :2","-P 4a 2bc 3","222","","","","- C66 H246 Al38 Mg10 N10 O238 P48 -","- C48 Al48 N8 O196 P48 -","- C48 Al48 N8 O196 P48 -","1","0.0208333","","Castro, Maria; Garcia, Raquel; Warrender, Stewart J; Slawin, Alexandra M Z; Wright, Paul A; Cox, Paul A; Fecant, Antoine; Mellot-Draznieks, Caroline; Bats, Nicolas","Co-templating and modelling in the rational synthesis of zeolitic solids.","Chemical communications (Cambridge, England)","2007","","33","3470","3472","10.1039/b705377k","","","0.71073","MoKα","","0.1386","0.132","","","0.2986","0.303","","","","","","1.288","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102091","18.656","0.015","18.656","0.015","9.378","0.007","90","","90","","90","","3264","4","93","2","93","2","","","","","","","","7","P 4/n :2","-P 4a","85","","","","- C32.4 H97.6 Al24 N9 O107 P18.5 Si5.5 -","- C14.4 Al24 N1.8 O101.6 P24 -","- C14.4 Al24 N1.8 O101.6 P24 -","1","0.125","","Castro, Maria; Garcia, Raquel; Warrender, Stewart J; Slawin, Alexandra M Z; Wright, Paul A; Cox, Paul A; Fecant, Antoine; Mellot-Draznieks, Caroline; Bats, Nicolas","Co-templating and modelling in the rational synthesis of zeolitic solids.","Chemical communications (Cambridge, England)","2007","","33","3470","3472","10.1039/b705377k","","","0.71073","MoKα","","0.1581","0.1027","","","0.194","0.218","","","","","","1.18","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102092","7.7099","0.0011","14.665","0.002","10.2423","0.0015","90","","109.166","0.003","90","","1093.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 N4 O -","- C12 H10 N4 O -","- C48 H40 N16 O4 -","4","1","","Ni, Wen-Xiu; Li, Mian; Zhou, Xiao-Ping; Li, Zhen; Huang, Xiao-Chun; Li, Dan","pH-Induced formation of metalloligand: increasing structure dimensionality by tuning number of ligand functional sites.","Chemical communications (Cambridge, England)","2007","","33","3479","3481","10.1039/b705603f","","","0.71073","MoKα","","0.0769","0.0512","","","0.1282","0.1419","","","","","","1.028","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102093","9.4337","0.0006","32.49","0.002","10.2061","0.0007","90","","105.393","0.001","90","","3015.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H20 Cu4 N12 O2 -","- C28 H20 Cu4 N12 O2 -","- C112 H80 Cu16 N48 O8 -","4","1","","Ni, Wen-Xiu; Li, Mian; Zhou, Xiao-Ping; Li, Zhen; Huang, Xiao-Chun; Li, Dan","pH-Induced formation of metalloligand: increasing structure dimensionality by tuning number of ligand functional sites.","Chemical communications (Cambridge, England)","2007","","33","3479","3481","10.1039/b705603f","","","0.71073","MoKα","","0.0815","0.0575","","","0.124","0.1392","","","","","","1.187","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102094","21.9969","0.0015","7.3578","0.0005","20.3447","0.0014","90","","90","","90","","3292.8","0.4","293","2","293","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C27 H23 Cu4 N11 O4.5 -","- C27 H23 Cu4 N11 O4.5 -","- C108 H92 Cu16 N44 O18 -","4","0.5","","Ni, Wen-Xiu; Li, Mian; Zhou, Xiao-Ping; Li, Zhen; Huang, Xiao-Chun; Li, Dan","pH-Induced formation of metalloligand: increasing structure dimensionality by tuning number of ligand functional sites.","Chemical communications (Cambridge, England)","2007","","33","3479","3481","10.1039/b705603f","","","0.71073","MoKα","","0.0673","0.0475","","","0.1248","0.1353","","","","","","1.074","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102095","19.341","0.0003","19.341","0.0003","11.5145","0.0004","90","","90","","120","","3730.21","0.15","100","","100","","","","","","","","","5","P -3","-P 3","147","","","","- C33 H105 Co7 N11 O49.5 -","- C27 H72 Co7 N10 O36 -","- C54 H144 Co14 N20 O72 -","2","0.333333","","Ferguson, Alan; Parkin, Andrew; Sanchez-Benitez, Javier; Kamenev, Konstantin; Wernsdorfer, Wolfgang; Murrie, Mark","A mixed-valence Co7 single-molecule magnet with C3 symmetry.","Chemical communications (Cambridge, England)","2007","","33","3473","3475","10.1039/b706238a","","","0.71073","MoKα","","0.0526","0.0343","","0.0976","0.0779","0.0976","","","","","","0.9203","","","","has coordinates,has disorder","180122","2020-10-21","18:00:00",""
"7102096","21.015","0.01","13.189","0.006","18.318","0.009","90","","101.325","0.008","90","","4978","4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H61 Cl5 Cs N O15 -","- C46 H61 Cl5 Cs N O15 -","- C184 H244 Cl20 Cs4 N4 O60 -","4","1","","Dalgarno, Scott J; Power, Nicholas P; Atwood, Jerry L","Ionic dimeric pyrogallol[4]arene capsules.","Chemical communications (Cambridge, England)","2007","","33","3447","3449","10.1039/b707009h","","","0.71073","MoKα","","0.1164","0.0618","","","0.1366","0.1579","","","","","","1.004","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102097","11.035","0.006","12.678","0.007","21.853","0.012","105.604","0.009","98.632","0.01","95.176","0.009","2884","3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H75 Cl Cs N O12 -","- C54 H75 Cl Cs N O12 -","- C108 H150 Cl2 Cs2 N2 O24 -","2","1","","Dalgarno, Scott J; Power, Nicholas P; Atwood, Jerry L","Ionic dimeric pyrogallol[4]arene capsules.","Chemical communications (Cambridge, England)","2007","","33","3447","3449","10.1039/b707009h","","","0.71073","MoKα","","0.163","0.0775","","","0.175","0.2185","","","","","","1.019","","","","has coordinates","180122","2020-10-21","18:00:00",""
"7102098","8.414","0.002","10.307","0.003","13.192","0.003","90","","90","","90","","1144","0.5","293","2","293","2","","","","","","","","5","P n n m","-P 2 2n","58","","","","- C20 H30 F6 Fe Sb -","- C20 H30 F6 Fe Sb -","- C40 H60 F12 Fe2 Sb2 -","2","0.25","","Choi, Doo Seong; Kim, Dong Hyun; Shin, Ueon Sang; Deshmukh, Ravindra R; Lee, Sang-gi; Song, Choong Eui","The dramatic acceleration effect of imidazolium ionic liquids on electron transfer reactions.","Chemical communications (Cambridge, England)","2007","","33","3467","3469","10.1039/b708044a","","","0.71073","MoKα","","0.0785","0.0449","","","0.1197","0.1624","","","","","","1.124","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102099","12.319","0.005","14.294","0.005","16.91","0.005","70.589","0.005","82.726","0.005","69.084","0.005","2623.2","1.6","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C64 H74 N2 Sm -","- C50 H58 N2 Sm -","- C100 H116 N4 Sm2 -","2","1","","Vasudevan, Kalyan; Cowley, Alan H","Synthesis and structures of 1,2-bis(imino)acenaphthene (BIAN) lanthanide complexes that involve the transfer of zero, one, or two electrons.","Chemical communications (Cambridge, England)","2007","","33","3464","3466","10.1039/b708758f","","","0.71073","MoKα","","0.0857","0.0491","","","0.1107","0.1216","","","","","","0.961","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102100","10.25","0.005","18.436","0.005","23.258","0.005","90","0.005","94.739","0.005","90","0.005","4380","3","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C53 H76 Eu N2 -","- C47 H62 Eu N2 -","- C188 H248 Eu4 N8 -","4","1","","Vasudevan, Kalyan; Cowley, Alan H","Synthesis and structures of 1,2-bis(imino)acenaphthene (BIAN) lanthanide complexes that involve the transfer of zero, one, or two electrons.","Chemical communications (Cambridge, England)","2007","","33","3464","3466","10.1039/b708758f","","","0.71073","MoKα","","0.0712","0.0444","","","0.1194","0.1319","","","","","","1.062","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102101","9.5567","0.0019","10.286","0.002","20.283","0.004","101.15","0.03","94.09","0.03","104.01","0.03","1883.4","0.7","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H50 Eu N2 O2 -","- C46 H50 Eu N2 O2 -","- C92 H100 Eu2 N4 O4 -","2","1","","Vasudevan, Kalyan; Cowley, Alan H","Synthesis and structures of 1,2-bis(imino)acenaphthene (BIAN) lanthanide complexes that involve the transfer of zero, one, or two electrons.","Chemical communications (Cambridge, England)","2007","","33","3464","3466","10.1039/b708758f","","","0.71073","MoKα","","0.0872","0.0476","","","0.099","0.1361","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102102","10.856","0.005","20.426","0.005","20.153","0.005","90","","103.851","0.005","90","","4339","3","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H63 N2 O Sm -","- C50 H63 N2 O Sm -","- C200 H252 N8 O4 Sm4 -","4","1","","Vasudevan, Kalyan; Cowley, Alan H","Synthesis and structures of 1,2-bis(imino)acenaphthene (BIAN) lanthanide complexes that involve the transfer of zero, one, or two electrons.","Chemical communications (Cambridge, England)","2007","","33","3464","3466","10.1039/b708758f","","","0.71073","MoKα","","0.0898","0.0416","","","0.0863","0.1189","","","","","","1.053","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102103","7.6281","0.0015","11.856","0.002","14.408","0.003","90","","90","","90","","1303","0.4","173","","173","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C64 H68 N4 O8 -","4","1","","Sakamoto, Masami; Unosawa, Atsushi; Kobaru, Shuichiro; Fujita, Kazuyuki; Mino, Takashi; Fujita, Tsutomu","An asymmetric SNAr reaction using the molecular chirality in a crystal","Chemical Communications (Cambridge, United Kingdom)","2007","","34","3586","3588","10.1039/b706426h","","","0.71073","MoKα","","0.0351","0.0339","","","0.0937","0.0955","","","","","","0.735","","","","has coordinates","210567","2020-10-21","18:00:00",""
"7102104","5.865","0.0002","19.1247","0.0007","29.468","0.0011","90","","90","","90","","3305.3","0.2","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C37 H47 N O4 -","- C37 H47 N O4 -","- C148 H188 N4 O16 -","4","1","","Koutsaplis, Magdaline; Andrews, Philip C.; Bull, Steven D.; Duggan, Peter J.; Fraser, Benjamin H.; Jensen, Paul","A new diastereoselective aza-allyl conjugate addition‒Michael addition‒ring closure reaction sequence and its application in the construction of six contiguous stereogenic centres","Chemical Communications (Cambridge, United Kingdom)","2007","","34","3580","3582","10.1039/b707707f","","","0.71073","MoKα","","0.0525","0.0363","","","0.0752","0.082","","","","","","1.028","","","","has coordinates","210643","2020-10-21","18:00:00",""
"7102105","5.3351","0.0001","15.8068","0.0004","9.3759","0.0003","90","","97.597","0.002","90","","783.74","0.04","123","1","123","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","di(3-amino-3-methoxy- 2nitrosoacrylonitrilate)dimethanolcopper(ii)","di(3-amino-3-methoxy-2nitrosoacrylonitrilate)dimethanolcopper(II)","","- C10 H16 Cu N6 O6 -","- C10 H16 Cu N6 O6 -","- C20 H32 Cu2 N12 O12 -","2","0.5","","Chesman, Anthony S. R.; Turner, David R.; Price, David J.; Moubaraki, Boujemaa; Murray, Keith S.; Deacon, Glen B.; Batten, Stuart R.","Solvothermal vs. bench-top reactions: Control over the formation of discrete complexes and coordination polymers","Chemical Communications (Cambridge, United Kingdom)","2007","","34","3541","3543","10.1039/b707709b","","","0.71073","MoKα","","0.029","0.0273","","","0.0646","0.0656","","","","","","1.122","","","","has coordinates","210519","2020-10-21","18:00:00",""
"7102106","5.2198","0.0001","15.9545","0.0003","9.3351","0.0002","90","","98.222","0.001","90","","769.43","0.03","123","1","123","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","di(3-amino-3-methoxy- 2nitrosoacrylonitrilate)dimethanolnickel(ii)","di(3-amino-3-methoxy-2nitrosoacrylonitrilate)dimethanolnickel(II)","","- C10 H16 N6 Ni O6 -","- C10 H16 N6 Ni O6 -","- C20 H32 N12 Ni2 O12 -","2","0.5","","Chesman, Anthony S. R.; Turner, David R.; Price, David J.; Moubaraki, Boujemaa; Murray, Keith S.; Deacon, Glen B.; Batten, Stuart R.","Solvothermal vs. bench-top reactions: Control over the formation of discrete complexes and coordination polymers","Chemical Communications (Cambridge, United Kingdom)","2007","","34","3541","3543","10.1039/b707709b","","","0.71073","MoKα","","0.0198","0.0187","","","0.0464","0.0469","","","","","","1.051","","","","has coordinates","210519","2020-10-21","18:00:00",""
"7102107","5.1369","0.001","6.771","0.0014","10.113","0.002","74.96","0.03","83.83","0.03","79.17","0.03","333.01","0.12","123","1","123","1","","","","","","","","5","P -1","-P 1","2","AC578","","","- C8 H12 Cu N6 O6 -","- C8 H12 Cu N6 O6 -","- C8 H12 Cu N6 O6 -","1","0.5","","Chesman, Anthony S. R.; Turner, David R.; Price, David J.; Moubaraki, Boujemaa; Murray, Keith S.; Deacon, Glen B.; Batten, Stuart R.","Solvothermal vs. bench-top reactions: Control over the formation of discrete complexes and coordination polymers","Chemical Communications (Cambridge, United Kingdom)","2007","","34","3541","3543","10.1039/b707709b","","","0.71073","MoKα","","0.0287","0.0257","","","0.0627","0.0644","","","","","","1.105","","","","has coordinates","210519","2020-10-21","18:00:00",""
"7102108","11.6289","0.0008","6.7788","0.0008","7.3868","0.0013","90","","104.975","0.004","90","","562.53","0.13","123","1","93","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","AC693 2","","","- C8 H8 Cu N6 O4 -","- C8 H8 Cu N6 O4 -","- C16 H16 Cu2 N12 O8 -","2","0.5","","Chesman, Anthony S. R.; Turner, David R.; Price, David J.; Moubaraki, Boujemaa; Murray, Keith S.; Deacon, Glen B.; Batten, Stuart R.","Solvothermal vs. bench-top reactions: Control over the formation of discrete complexes and coordination polymers","Chemical Communications (Cambridge, United Kingdom)","2007","","34","3541","3543","10.1039/b707709b","","","0.71073","MoKα","","0.1084","0.0467","","","0.075","0.0917","","","","","","1.049","","","","has coordinates","210519","2020-10-21","18:00:00",""
"7102109","8.8255","0.0005","9.9185","0.0006","17.9003","0.001","89.867","0.001","79.475","0.001","68.194","0.001","1426.63","0.14","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H44.83 B11 Cl0.17 Rh2 -","- C20 H44.83 B11 Cl0.17 Rh2 -","- C40 H89.66 B22 Cl0.34 Rh4 -","2","1","","Carr, Michael J.; Perera, Sarath D.; Jelínek, Tomáš; Štíbr, Bohumil; Clegg, William; Kilner, Colin A.; Kennedy, John D.","Macropolyhedral boron-containing cluster chemistry. The unique nido-five-vertex-〈B2〉-nido-ten-vertex conjuncto structure of [(η5-C5Me5)2Rh2B11H15] via an unexpected cluster-dismantling","Chemical Communications (Cambridge, United Kingdom)","2007","","34","3559","3561","10.1039/b709470a","","","0.6932","synchrotron","","0.043","0.0353","","","0.0921","0.097","","","","","","1.047","","","","has coordinates,has disorder","210407","2020-10-21","18:00:00",""
"7102110","11.4055","0.0002","10.4608","0.0002","14.3232","0.0003","90","","109.545","0.001","90","","1610.44","0.05","150","2","150","2","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C20 H49 B16 Cl Rh2 -","- C20 H49 B16 Cl Rh2 -","- C40 H98 B32 Cl2 Rh4 -","2","1","","Carr, Michael J.; Perera, Sarath D.; Jelínek, Tomáš; Štíbr, Bohumil; Clegg, William; Kilner, Colin A.; Kennedy, John D.","Macropolyhedral boron-containing cluster chemistry. The unique nido-five-vertex-〈B2〉-nido-ten-vertex conjuncto structure of [(η5-C5Me5)2Rh2B11H15] via an unexpected cluster-dismantling","Chemical Communications (Cambridge, United Kingdom)","2007","","34","3559","3561","10.1039/b709470a","","","0.7107","MoKα","","0.0319","0.0315","","","0.0802","0.0804","","","","","","1.121","","","","has coordinates,has disorder","210407","2020-10-21","18:00:00",""
"7102111","11.0218","0.0005","11.5559","0.0005","13.4953","0.0007","90","","90","","90","","1718.85","0.14","150","2","150","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C10 H28 B9 Rh -","- C10 H15 B9 Rh -","- C40 H60 B36 Rh4 -","4","0.5","","Carr, Michael J.; Perera, Sarath D.; Jelínek, Tomáš; Štíbr, Bohumil; Clegg, William; Kilner, Colin A.; Kennedy, John D.","Macropolyhedral boron-containing cluster chemistry. The unique nido-five-vertex-〈B2〉-nido-ten-vertex conjuncto structure of [(η5-C5Me5)2Rh2B11H15] via an unexpected cluster-dismantling","Chemical Communications (Cambridge, United Kingdom)","2007","","34","3559","3561","10.1039/b709470a","","","0.71073","MoKα","","0.0579","0.0464","","","0.1056","0.1104","","","","","","1.168","","","","has coordinates","210407","2020-10-21","18:00:00",""
"7102112","8.0754","0.0008","8.4767","0.0007","16.3824","0.0016","101.647","0.003","96.033","0.004","96.27","0.004","1082.41","0.18","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H25 Fe P -","- C26 H25 Fe P -","- C52 H50 Fe2 P2 -","2","1","","Noonan, Kevin J T; Patrick, Brian O; Gates, Derek P","Redox-active iron-containing polymers: synthesis and anionic polymerization of a C-ferrocenyl-substituted phosphaalkene.","Chemical communications (Cambridge, England)","2007","","35","3658","3660","10.1039/b704967f","","","0.71073","MoKα","","0.049","0.034","","","0.0907","0.0946","","","","","","1.072","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102113","12.9931","0.0015","12.4406","0.0014","9.528","0.0011","90","","109.248","0.007","90","","1454","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 Cl N5 -","- C16 H14 Cl N5 -","- C64 H56 Cl4 N20 -","4","1","","Wang, Jian; Onions, Stuart; Pilkington, Melanie; Stoeckli-Evans, Helen; Halfpenny, Joan C; Wallis, John D","Metal catalyzed rearrangement of a 2,2'-bipyridine Schiff-base ligand to a quaterpyridine-type complex.","Chemical communications (Cambridge, England)","2007","","35","3628","3630","10.1039/b705555b","","","0.71073","MoKα","","0.048","0.0385","","","0.0991","0.1059","","","","","","1.031","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102114","14.311","0.002","13.4071","0.0016","14.598","0.002","90","","103.464","0.017","90","","2723.9","0.7","173","2","173","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C24 H19 Cl2 Co N7 O9 -","- C24 H19 Cl2 Co N7 O9 -","- C96 H76 Cl8 Co4 N28 O36 -","4","1","","Wang, Jian; Onions, Stuart; Pilkington, Melanie; Stoeckli-Evans, Helen; Halfpenny, Joan C; Wallis, John D","Metal catalyzed rearrangement of a 2,2'-bipyridine Schiff-base ligand to a quaterpyridine-type complex.","Chemical communications (Cambridge, England)","2007","","35","3628","3630","10.1039/b705555b","","","0.71073","MoKα","","0.1222","0.0552","","","0.1157","0.1351","","","","","","0.851","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102115","23.491","0.002","6.4678","0.0006","30.258","0.003","90","","112.384","0.003","90","","4250.7","0.7","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2,4,6-tris(4-(4-ethynylbenzonitrile)phenyl)-1,3,5-triazine","","","- C54 H29 Cl N6 -","- C54 H29 Cl N6 -","- C216 H116 Cl4 N24 -","4","1","","Ranganathan, Anupama; Heisen, Burkhard Clemens; Dix, Ina; Meyer, Franc","A triazine-based three-directional rigid-rod tecton forms a novel 1D channel structure.","Chemical communications (Cambridge, England)","2007","","35","3637","3639","10.1039/b706627a","","","1.54184","CuKα","","0.0578","0.0476","","","0.1217","0.1291","","","","","","1.091","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102116","8.969","0.0005","16.1071","0.0009","21.0597","0.0011","90","","90","","90","","3042.4","0.3","133","2","133","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C35 H37 Cl N2 O4 -","- C35 H37 Cl N2 O4 -","- C140 H148 Cl4 N8 O16 -","4","1","","Holschumacher, Dirk; Hrib, Cristian G; Jones, Peter G; Tamm, Matthias","A stable chiral diaminocyclopropenylidene.","Chemical communications (Cambridge, England)","2007","","35","3661","3663","10.1039/b706708a","","","0.71073","MoKα","","0.0891","0.0437","","","0.0851","0.0981","","","","","","0.96","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102117","8.6057","0.0009","15.5239","0.0016","10.5267","0.0011","90","","95.728","0.002","90","","1399.3","0.3","133","2","133","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C35 H36 N2 -","- C35 H36 N2 -","- C70 H72 N4 -","2","1","","Holschumacher, Dirk; Hrib, Cristian G; Jones, Peter G; Tamm, Matthias","A stable chiral diaminocyclopropenylidene.","Chemical communications (Cambridge, England)","2007","","35","3661","3663","10.1039/b706708a","","","0.71073","MoKα","","0.0775","0.0428","","","0.0715","0.079","","","","","","0.974","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102118","13.4636","0.001","32.293","0.002","14.1429","0.0011","90","","90.649","0.002","90","","6148.6","0.8","133","2","133","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C70.5 H73 Ag B Cl F4 N4 -","- C70.5 H73 Ag B Cl F4 N4 -","- C282 H292 Ag4 B4 Cl4 F16 N16 -","4","2","","Holschumacher, Dirk; Hrib, Cristian G; Jones, Peter G; Tamm, Matthias","A stable chiral diaminocyclopropenylidene.","Chemical communications (Cambridge, England)","2007","","35","3661","3663","10.1039/b706708a","","","0.71073","MoKα","","0.1172","0.056","","","0.0977","0.1207","","","","","","1.022","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102119","20.388","0.004","20.161","0.004","17.384","0.003","90","","105.69","0.003","90","","6880","2","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H36 Ag2 Mn2 N8 O4 -","- C28 H36 Ag2 Mn2 N8 O4 -","- C224 H288 Ag16 Mn16 N64 O32 -","8","1","","Feng, Yuhua; Guo, Yang; OuYang, Yan; Liu, Zhanquan; Liao, Daizheng; Cheng, Peng; Yan, Shiping; Jiang, Zonghui","2D warp-and-woof interwoven networks constructed by helical chains with different chirality.","Chemical communications (Cambridge, England)","2007","","35","3643","3645","10.1039/b707356a","","","0.71073","MoKα","","0.0881","0.0346","","","0.0661","0.0857","","","","","","1.029","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102120","13.382","0.005","14.081","0.005","20.242","0.008","94.217","0.003","107.932","0.004","90.853","0.006","3616","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H58 Au4 Mn4 N16 O9 -","- C72 H58 Au4 Mn4 N16 O9 -","- C144 H116 Au8 Mn8 N32 O18 -","2","1","","Feng, Yuhua; Guo, Yang; OuYang, Yan; Liu, Zhanquan; Liao, Daizheng; Cheng, Peng; Yan, Shiping; Jiang, Zonghui","2D warp-and-woof interwoven networks constructed by helical chains with different chirality.","Chemical communications (Cambridge, England)","2007","","35","3643","3645","10.1039/b707356a","","","0.7107","MoKα","","0.084","0.0492","","","0.1009","0.1172","","","","","","0.965","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102121","12.1172","0.0006","9.2891","0.0005","18.3352","0.0009","90","","102.801","0.001","90","","2012.48","0.18","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H27 F4 N P3 Rh -","- C14 H27 F4 N P3 Rh -","- C56 H108 F16 N4 P12 Rh4 -","4","1","","Lindup, Richard J; Marder, Todd B; Perutz, Robin N; Whitwood, Adrian C","Sequential C-F activation and borylation of fluoropyridines via intermediate Rh(I) fluoropyridyl complexes: a multinuclear NMR investigation.","Chemical communications (Cambridge, England)","2007","","35","3664","3666","10.1039/b707840d","","","0.71073","MoKα","","0.0239","0.0207","","","0.0527","0.054","","","","","","1.035","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102122","16.6032","0.0007","16.6032","0.0007","16.6032","0.0007","90","","90","","90","","4576.9","0.3","120","2","120","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","","","","- C39 H51 Br Cl8 Fe2 N6 -","- C39 H51 Br Cl8 Fe2 N6 -","- C156 H204 Br4 Cl32 Fe8 N24 -","4","0.333333","","Willans, Charlotte E; Anderson, Kirsty M; Junk, Peter C; Barbour, Leonard J; Steed, Jonathan W","A small tris(imidazolium) cage forms an N-heterocyclic carbene complex with silver(I).","Chemical communications (Cambridge, England)","2007","","35","3634","3636","10.1039/b708692j","","","0.71073","MoKα","","0.1057","0.0467","","","0.091","0.1027","","","","","","0.896","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102123","12.4533","0.0012","15.5863","0.0015","22.8102","0.0018","90","","112.441","0.004","90","","4092.2","0.6","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H49 Ag F12 N6 P2 -","- C39 H49 Ag F12 N6 P2 -","- C156 H196 Ag4 F48 N24 P8 -","4","1","","Willans, Charlotte E; Anderson, Kirsty M; Junk, Peter C; Barbour, Leonard J; Steed, Jonathan W","A small tris(imidazolium) cage forms an N-heterocyclic carbene complex with silver(I).","Chemical communications (Cambridge, England)","2007","","35","3634","3636","10.1039/b708692j","","","0.71073","MoKα","","0.2866","0.1216","","","0.172","0.2215","","","","","","1.01","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102124","10.358","0.003","10.563","0.003","17.222","0.007","106.775","0.01","93.233","0.01","114.97","0.02","1600.6","1","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C68 H84 O14 W2 -","- C68 H84 O14 W2 -","- C68 H84 O14 W2 -","1","0.5","","Barybin, Mikhail V; Chisholm, Malcolm H; Patmore, Nathan J; Robinson, Randall E; Singh, Namrata","Concerning the molecular and electronic structure of a tungsten-tungsten quadruply bonded complex supported by two 6-carboethoxy-2-carboxylatoazulene ligands.","Chemical communications (Cambridge, England)","2007","","35","3652","3654","10.1039/b708746b","","","0.71073","MoKα","","0.084","0.0475","","","0.0883","0.1002","","","","","","0.994","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102125","11.9746","0.0007","18.4624","0.0011","10.3004","0.0006","90","","90","","90","","2277.2","0.2","193","2","193","2","","","","","","","","4","C m c 21","C 2c -2","36","","1,3,5-tris(1H-tetrazol-5-yl)methyl-2,4,6-triethyl benzene","","- C19 H30 N12 O2 -","- C19 H30 N12 O2 -","- C76 H120 N48 O8 -","4","0.5","","Mahnke, Devin J; McDonald, Robert; Hof, Fraser","A shape-dependent hydrophobic effect for tetrazoles.","Chemical communications (Cambridge, England)","2007","","36","3738","3740","10.1039/b705256a","","","0.71073","MoKα","","0.0268","0.0262","","","0.0696","0.0709","","","","","","1.063","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102126","18.604","0.003","18.604","0.003","19.756","0.004","90","","90","","120","","5921.7","1.7","298","2","298","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C72 H48 Cu3 N12 O23 -","- C72 H48 Cu3 N12 O23 -","- C216 H144 Cu9 N36 O69 -","3","0.166667","","Luo, Feng; Zheng, Ji-min; Batten, Stuart R","Unprecedented (3,4)-connected metal-organic frameworks (MOFs) with 3-fold interpenetration and considerable solvent-accessible void space.","Chemical communications (Cambridge, England)","2007","","36","3744","3746","10.1039/b706177c","","x-ray","0.71073","MoKα","","0.0737","0.054","","","0.1616","0.1745","","","","","","1.059","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102127","18.5943","0.0016","18.5943","0.0016","19.761","0.003","90","","90","","120","","5916.9","1.2","294","2","294","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C24 H16 Cu N4 O6 -","- C24 H16 Cu N4 O6 -","- C216 H144 Cu9 N36 O54 -","9","0.5","","Luo, Feng; Zheng, Ji-min; Batten, Stuart R","Unprecedented (3,4)-connected metal-organic frameworks (MOFs) with 3-fold interpenetration and considerable solvent-accessible void space.","Chemical communications (Cambridge, England)","2007","","36","3744","3746","10.1039/b706177c","","x-ray","0.71073","MoKα","","0.1136","0.0617","","","0.1714","0.2007","","","","","","1.097","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102128","14.1227","0.0006","21.6227","0.001","23.5476","0.001","107.818","0.001","92.452","0.001","102.207","0.001","6646.3","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C75 H88.5 N1.5 O6.13 -","- C74.98 H88.465 N1.5 O6.128 -","- C299.92 H353.86 N6 O24.512 -","4","2","","Shukla, Ruchi; Lindeman, Sergey V; Rathore, Rajendra","Binding of an acetonitrile molecule inside the ethereal cavity of a hexaarylbenzene-based receptor via a synergy of C-H...O/C-H...pi interactions.","Chemical communications (Cambridge, England)","2007","","36","3717","3719","10.1039/b707237f","","","0.71073","MoKα","","0.0719","0.0584","","","0.1561","0.1641","","","","","","1.071","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102129","11.1865","0.0006","40.7401","0.0019","42.484","0.002","90","","95.967","0.001","90","","19256.5","1.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C75.76 H89.68 Cl0.16 N1.84 O6 -","- C75.76 H89.68 Cl0.16 N1.84 O6 -","- C909.12 H1076.16 Cl1.92 N22.08 O72 -","12","3","","Shukla, Ruchi; Lindeman, Sergey V; Rathore, Rajendra","Binding of an acetonitrile molecule inside the ethereal cavity of a hexaarylbenzene-based receptor via a synergy of C-H...O/C-H...pi interactions.","Chemical communications (Cambridge, England)","2007","","36","3717","3719","10.1039/b707237f","","","0.71073","MoKα","","0.1134","0.0635","","","0.1415","0.1588","","","","","","1.04","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102130","8.721","0.004","10.414","0.004","13.992","0.005","90","","90","","90","","1270.8","0.9","93.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H17 N3 O6 -","- C12 H17 N3 O6 -","- C48 H68 N12 O24 -","4","1","","Miyashita, Kazuyuki; Rahman, S M Abdur; Seki, Sayori; Obika, Satoshi; Imanishi, Takeshi","N-Methyl substituted 2',4'- BNANC: a highly nuclease-resistant nucleic acid analogue with high-affinity RNA selective hybridization.","Chemical communications (Cambridge, England)","2007","","36","3765","3767","10.1039/b707352f","","","0.71075","MoKα","","","0.0291","","","","0.0699","","","","","","1.005","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102131","8.4553","0.0002","15.72","0.0003","27.6308","0.0006","91.99","0.001","93.966","0.001","97.283","0.001","3630.75","0.14","296","2","296","2","","","","","","","","4","P -1","-P 1","2","catena-poly(!mu-piperadinedi-!mu-cyano-)dicopper(i))-catena- poly(!mu-piperadineocta-!mu-cyano-)octacopper(i))(6/1)","catena-poly[!mu-piperadinedi-!mu-cyano-)dicopper(I)]- catena-poly[!mu-piperadineocta-!mu-cyano-)octacopper(I)](6/1)","","- C48 H70 Cu20 N34 -","- C48 H70 Cu20 N34 -","- C96 H140 Cu40 N68 -","2","1","","Pike, Robert D; deKrafft, Kathryn E; Ley, Amanda N; Tronic, Tristan A","Threaded structure and blue luminescence of (CuCN)20(Piperazine)7.","Chemical communications (Cambridge, England)","2007","","36","3732","3734","10.1039/b707582k","","","1.54178","CuKα","","0.0596","0.0485","","","0.1312","0.1398","","","","","","1.081","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102132","10.6243","0.0004","11.9157","0.0004","14.6759","0.0005","90","0.005","105.082","0.005","90","0.005","1793.91","0.11","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H23 Fe N5 O3 -","- C17 H23 Fe N5 O3 -","- C68 H92 Fe4 N20 O12 -","4","1","","Guionneau, Philippe; Le Gac, Frédéric; Kaiba, Abdellah; Costa, José Sánchez; Chasseau, Daniel; Létard, Jean-François","A reversible metal-ligand bond break associated to a spin-crossover.","Chemical communications (Cambridge, England)","2007","","36","3723","3725","10.1039/b707836f","","","0.71069","MoKα","","0.0426","0.0329","","","0.0838","0.0929","","","","","","1.175","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102133","10.3806","0.0004","23.213","0.001","13.4673","0.0006","90","","94.869","0.002","90","","3233.4","0.2","150","1","150","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C37 H40 N2 O5 -","- C37 H40 N2 O5 -","- C148 H160 N8 O20 -","4","1","","Li, Sze-Wan; Batey, Robert A","Mild lanthanide(III) catalyzed formation of 4,5-diaminocyclopent-2-enones from 2-furaldehyde and secondary amines: a domino condensation/ring-opening/electrocyclization process.","Chemical communications (Cambridge, England)","2007","","36","3759","3761","10.1039/b709337n","","","0.71073","MoKα","","0.121","0.0603","","","0.1485","0.1773","","","","","","1.033","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102134","17.1305","0.0011","12.4187","0.0005","14.0272","0.0002","90","","113.46","0.03","90","","2737.5","0.2","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H30 N10 -","- C30 H30 N10 -","- C120 H120 N40 -","4","1","","Liu, Shi-Qiang; Wang, De-Xian; Zheng, Qi-Yu; Wang, Mei-Xiang","Synthesis and structure of nitrogen bridged calix[5]- and -[10]-pyridines and their complexation with fullerenes","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3856","3858","10.1039/b705595a","","","0.71069","MoKα","","0.1131","0.0823","","","0.1731","0.1877","","","","","","1.17","","","","has coordinates","210726","2020-10-21","18:00:00",""
"7102135","17.92","0.004","8.3524","0.0017","27.638","0.009","90","","124.47","0.02","90","","3410.4","1.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C66 H72 N20 O2 -","- C66 H72 N20 O2 -","- C132 H144 N40 O4 -","2","0.5","","Liu, Shi-Qiang; Wang, De-Xian; Zheng, Qi-Yu; Wang, Mei-Xiang","Synthesis and structure of nitrogen bridged calix[5]- and -[10]-pyridines and their complexation with fullerenes","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3856","3858","10.1039/b705595a","","","0.71073","MoKα","","0.1594","0.1221","","","0.3262","0.3614","","","","","","1.295","","","","has coordinates,has disorder","210726","2020-10-21","18:00:00",""
"7102136","12.8464","0.0005","16.2732","0.0007","18.0701","0.0008","77.186","0.001","73.546","0.001","82.648","0.001","3524.1","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H74 Cl20 N2 O2 Pt2 -","- C56 H72 Cl20 N2 O2 Pt2 -","- C112 H144 Cl40 N4 O4 Pt4 -","2","1","","Falvello, Larry R.; Forniés, Juan; Lalinde, Elena; Menjón, Babil; García-Monforte, M. Angeles; Moreno, M. Teresa; Tomás, Milagros","Unusual luminescent octanuclear stellate platinacycle self-assembled by Pt‒Ag bonds","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3838","3840","10.1039/b706439j","","","0.71073","MoKα","","0.0618","0.0454","","","0.1028","0.1102","","","","","","1.028","","","","has coordinates,has disorder","210748","2020-10-21","18:00:00",""
"7102137","17.179","0.003","17.179","0.003","16.451","0.007","90","","90","","90","","4855","2","150","1","150","1","","","","","","","","6","I -4","I -4","82","","","","- C72 H24 Ag4 Cl40 O6 Pt4 -","- C72 H24 Ag4 Cl40 O6 Pt4 -","- C144 H48 Ag8 Cl80 O12 Pt8 -","2","0.25","","Falvello, Larry R.; Forniés, Juan; Lalinde, Elena; Menjón, Babil; García-Monforte, M. Angeles; Moreno, M. Teresa; Tomás, Milagros","Unusual luminescent octanuclear stellate platinacycle self-assembled by Pt‒Ag bonds","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3838","3840","10.1039/b706439j","","","0.71073","MoKα","","0.0661","0.0465","","","0.1037","0.1114","","","","","","1.032","","","","has coordinates,has disorder","210748","2020-10-21","18:00:00",""
"7102138","12.4021","0.0007","15.2809","0.0009","18.0755","0.001","79.27","0.005","88.365","0.004","79.061","0.005","3304.4","0.3","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C37 H38 Cl2 N6 O3 -","- C37 H38 Cl2 N6 O3 -","- C148 H152 Cl8 N24 O12 -","4","2","","Valík, Martin; Čejka, Jan; Havlík, Martin; Král, Vladimír; Dolenský, Bohumil","calix-Tris-Tröger's bases ‒ a new cavitand family","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3835","3837","10.1039/b706791g","","","1.5418","CuKα","","0.0799","0.0656","","0.0735","0.0689","0.0689","","","","","","1.1407","","","","has coordinates","210749","2020-10-21","18:00:00",""
"7102139","28.251","0.003","10.5471","0.0011","22.207","0.002","90","","95.946","0.008","90","","6581.2","1.1","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C38.7 H42 N6 O3.9 -","- C38.7 H42 N6 O3.9 -","- C309.6 H336 N48 O31.2 -","8","1","","Valík, Martin; Čejka, Jan; Havlík, Martin; Král, Vladimír; Dolenský, Bohumil","calix-Tris-Tröger's bases ‒ a new cavitand family","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3835","3837","10.1039/b706791g","","","1.5418","CuKα","","0.0898","0.0529","","0.0579","0.0519","0.0519","","","","","","1.1691","","","","has coordinates","210749","2020-10-21","18:00:00",""
"7102140","17.1591","0.0018","16.0078","0.0016","12.3894","0.0013","90","","129.578","0.001","90","","2623","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","tetra-(3-fluorobenzoato-O,O')-tetracopper(I,I,I,I)","tetra-(3-fluorobenzoato-O,O')-tetracopper(I,I,I,I)","","- C28 H16 Cu4 F4 O8 -","- C28 H16 Cu4 F4 O8 -","- C112 H64 Cu16 F16 O32 -","4","0.5","","Sevryugina, Yulia; Hietsoi, Oleksandr; Petrukhina, Marina A.","Tetranuclear copper(I) clusters: impact of bridging carboxylate ligands on solid state structure and photoluminescence","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3853","3855","10.1039/b707957e","","","0.71073","MoKα","","0.0933","0.0538","","","0.1162","0.1321","","","","","","1.061","","","","has coordinates","210725","2020-10-21","18:00:00",""
"7102141","15.7443","0.0019","16.574","0.002","21.682","0.003","90","","90","","90","","5658.1","1.2","173","2","173","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","tetra-(2,3,4-trifluorobenzoato-O,O')-tetracopper(I,I,I,I)","tetra-(2,3,4-trifluorobenzoato-O,O')-tetracopper(I,I,I,I)","","- C28 H8 Cu4 F12 O8 -","- C28 H8 Cu4 F12 O8 -","- C224 H64 Cu32 F96 O64 -","8","0.25","","Sevryugina, Yulia; Hietsoi, Oleksandr; Petrukhina, Marina A.","Tetranuclear copper(I) clusters: impact of bridging carboxylate ligands on solid state structure and photoluminescence","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3853","3855","10.1039/b707957e","","","0.71073","MoKα","","0.0542","0.039","","","0.0967","0.1074","","","","","","1.015","","","","has coordinates","210725","2020-10-21","18:00:00",""
"7102142","11.4301","0.0008","14.4443","0.0011","16.7589","0.0012","71.969","0.001","74.374","0.001","70.565","0.001","2438","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","bis-(pentafluorobenzoato-O,O')-bis-(trifluoroacetato-O,O')- tetracopper(I,I,I,I)","bis-(pentafluorobenzoato-O,O')-bis-(trifluoroacetato-O,O')- tetracopper(I,I,I,I)","","- C18 Cu4 F16 O8 -","- C18 Cu4 F16 O8 -","- C72 Cu16 F64 O32 -","4","2","","Sevryugina, Yulia; Hietsoi, Oleksandr; Petrukhina, Marina A.","Tetranuclear copper(I) clusters: impact of bridging carboxylate ligands on solid state structure and photoluminescence","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3853","3855","10.1039/b707957e","","","0.71073","MoKα","","0.0992","0.0538","","","0.1062","0.1241","","","","","","0.961","","","","has coordinates,has disorder","210725","2020-10-21","18:00:00",""
"7102143","11.9616","0.0006","22.3804","0.001","24.1793","0.0012","90","","102.583","0.001","90","","6317.5","0.5","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C54 H108 I Li N9 O4 P3 -","- C54 H108 I Li N9 O4 P3 -","- C216 H432 I4 Li4 N36 O16 P12 -","4","1","","Benson, Mark A.; Ledger, Joanne; Steiner, Alexander","Zwitterionic phosphazenium phosphazenate ligands","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3823","3825","10.1039/b708993g","","","0.71073","MoKα","","0.0724","0.0568","","","0.1414","0.1505","","","","","","1.035","","","","has coordinates,has disorder","210750","2020-10-21","18:00:00",""
"7102144","13.1903","0.0016","14.2766","0.0017","17.645","0.002","100.961","0.002","100.643","0.002","113.484","0.002","2864","0.6","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C49 H96 I Li N9 O3 P3 -","- C49 H96 I Li N9 O3 P3 -","- C98 H192 I2 Li2 N18 O6 P6 -","2","1","","Benson, Mark A.; Ledger, Joanne; Steiner, Alexander","Zwitterionic phosphazenium phosphazenate ligands","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3823","3825","10.1039/b708993g","","","0.71073","MoKα","","0.0805","0.0683","","","0.1766","0.1854","","","","","","1.059","","","","has coordinates","210750","2020-10-21","18:00:00",""
"7102145","16.1072","0.0012","15.3466","0.0012","11.0231","0.0008","90","","98.079","0.002","90","","2697.8","0.4","110","2","110","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C35 H31 N3 O2 -","- C35 H31 N3 O2 -","- C140 H124 N12 O8 -","4","0.5","","Kozhevnikov, Valery N.; Whitwood, Adrian C.; Bruce, Duncan W.","Liquid-crystalline terpyridines","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3826","3828","10.1039/b709730a","","","0.71073","MoKα","","0.06","0.0456","","","0.1221","0.1311","","","","","","1.052","","","","has coordinates,has disorder","210800","2020-10-21","18:00:00",""
"7102146","19.6849","0.0006","10.9636","0.0004","36.7625","0.0012","90","","91.304","0.001","90","","7931.9","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C86 H124 N4 O2 Pb2 -","- C86 H124 N4 O2 Pb2 -","- C344 H496 N16 O8 Pb8 -","4","1","","Yao, Shenglai; Block, Stefan; Brym, Markus; Driess, Matthias","A new type of heteroleptic complex of divalent lead and synthesis of the P-plumbyleniophosphasilene, R2Si=P‒Pb(L): (L = β-diketiminate)","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3844","3846","10.1039/b710888e","","x-ray","0.71073","MoKα","","0.0672","0.0445","","","0.1029","0.1122","","","","","","1.035","","","","has coordinates","209731","2020-10-21","18:00:00",""
"7102147","11.9877","0.0007","12.6789","0.0008","15.152","0.001","76.037","0.002","89.319","0.002","65.115","0.002","2016.9","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H66 N3 Pb Si2 -","- C38 H66 N3 Pb Si2 -","- C76 H132 N6 Pb2 Si4 -","2","1","","Yao, Shenglai; Block, Stefan; Brym, Markus; Driess, Matthias","A new type of heteroleptic complex of divalent lead and synthesis of the P-plumbyleniophosphasilene, R2Si=P‒Pb(L): (L = β-diketiminate)","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3844","3846","10.1039/b710888e","","x-ray","0.71073","MoKα","","0.0713","0.0586","","","0.1674","0.1809","","","","","","1.045","","","","has coordinates","209731","2020-10-21","18:00:00",""
"7102148","9.5295","0.0003","10.2387","0.0003","21.1917","0.0006","90.128","0.001","90.455","0.001","109.589","0.001","1947.91","0.1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H59 N2 P Pb Si2 -","- C35 H59 N2 P Pb Si2 -","- C70 H118 N4 P2 Pb2 Si4 -","2","1","","Yao, Shenglai; Block, Stefan; Brym, Markus; Driess, Matthias","A new type of heteroleptic complex of divalent lead and synthesis of the P-plumbyleniophosphasilene, R2Si=P‒Pb(L): (L = β-diketiminate)","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3844","3846","10.1039/b710888e","","x-ray","0.71073","MoKα","","0.0509","0.0414","","","0.1274","0.1361","","","","","","1.054","","","","has coordinates","209731","2020-10-21","18:00:00",""
"7102149","12.4953","0.0002","18.9054","0.0003","14.3412","0.0002","90","","109.26","0.0017","90","","3198.18","0.08","150","2","150","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C63 H99 N2 P Pb Si2 -","- C63 H99 N2 P Pb Si2 -","- C126 H198 N4 P2 Pb2 Si4 -","2","0.5","","Yao, Shenglai; Block, Stefan; Brym, Markus; Driess, Matthias","A new type of heteroleptic complex of divalent lead and synthesis of the P-plumbyleniophosphasilene, R2Si=P‒Pb(L): (L = β-diketiminate)","Chemical Communications (Cambridge, United Kingdom)","2007","","37","3844","3846","10.1039/b710888e","","","0.71073","MoKα","","0.0301","0.0219","","","0.0558","0.0616","","","","","","1.191","","","","has coordinates,has disorder","209731","2020-10-21","18:00:00",""
"7102150","10.1258","0.0015","13.0812","0.0017","22.454","0.01","73.8","0.03","77.93","0.03","81.742","0.011","2781.5","1.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C82 H148 Co2 Mo4 N4 O44 -","- C82 H120 Co2 Mo4 N4 O44 -","- C82 H120 Co2 Mo4 N4 O44 -","1","0.5","","Khatua, Snehadrinarayan; Harada, Takunori; Kuroda, Reiko; Bhattacharjee, Manish","Solvent dependent assembly and disassembly of a hydrogen bonded helical structure in a Co-Mo bimetallic complex.","Chemical communications (Cambridge, England)","2007","","38","3927","3929","10.1039/b705891h","","","0.71073","MoKα","","0.0961","0.056","","","0.1624","0.1807","","","","","","1.09","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102151","13.792","0.002","11.692","0.002","16.692","0.005","90","","96.428","0.008","90","","2674.8","1","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C40 H72 Co Mo2 N2 O22 -","- C40 H55 Co Mo2 N2 O22 -","- C80 H110 Co2 Mo4 N4 O44 -","2","1","","Khatua, Snehadrinarayan; Harada, Takunori; Kuroda, Reiko; Bhattacharjee, Manish","Solvent dependent assembly and disassembly of a hydrogen bonded helical structure in a Co-Mo bimetallic complex.","Chemical communications (Cambridge, England)","2007","","38","3927","3929","10.1039/b705891h","","","0.71073","MoKα","","0.1252","0.0525","","","0.1084","0.1282","","","","","","1.065","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102152","13.735","0.003","11.7385","0.0011","16.8051","0.0011","90","","96.542","0.009","90","","2691.9","0.6","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C40 H72 Co Mo2 N2 O22 -","- C40 H59 Co Mo2 N2 O22 -","- C80 H118 Co2 Mo4 N4 O44 -","2","1","","Khatua, Snehadrinarayan; Harada, Takunori; Kuroda, Reiko; Bhattacharjee, Manish","Solvent dependent assembly and disassembly of a hydrogen bonded helical structure in a Co-Mo bimetallic complex.","Chemical communications (Cambridge, England)","2007","","38","3927","3929","10.1039/b705891h","","","0.71073","MoKα","","0.0528","0.0421","","","0.1082","0.1124","","","","","","1.085","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102153","12.156","0.009","9.139","0.007","23.765","0.012","90","","95","0.09","90","","2630","3","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C38 H70 Co Mo2 N2 O23 -","- C38 H34 Co Mo2 N2 O23 -","- C76 H68 Co2 Mo4 N4 O46 -","2","0.5","","Khatua, Snehadrinarayan; Harada, Takunori; Kuroda, Reiko; Bhattacharjee, Manish","Solvent dependent assembly and disassembly of a hydrogen bonded helical structure in a Co-Mo bimetallic complex.","Chemical communications (Cambridge, England)","2007","","38","3927","3929","10.1039/b705891h","","","0.71073","MoKα","","0.1855","0.1036","","","0.2681","0.3244","","","","","","1.097","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102154","9.821","0.002","10.751","0.002","12.742","0.003","80.17","0.01","78.99","0.01","89.31","0.02","1300.7","0.4","293","2","293","2","","","","","","","Synthesis","6","P -1","-P 1","2","","","","- C48 H52 Cl2 Mn N8 O14 -","- C48 H52 Cl2 Mn N8 O14 -","- C48 H52 Cl2 Mn N8 O14 -","1","0.5","","Hill, Yennifer; Briceño, Alexander","Exploiting the use of hydrogen bonding and metal-coordination in the self-assembly of photoreactive multicomponent networks.","Chemical communications (Cambridge, England)","2007","","38","3930","3932","10.1039/b706936g","","","0.71073","MoKα","","0.0869","0.069","","","0.1936","0.2126","","","","","","1.046","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7102155","7.8749","0.0009","10.3195","0.0011","17.814","0.002","78.178","0.008","82.985","0.009","78.844","0.007","1385.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H24 Mn N6 O2 S2 -","- C26 H24 Mn N6 O2 S2 -","- C52 H48 Mn2 N12 O4 S4 -","2","1","","Hill, Yennifer; Briceño, Alexander","Exploiting the use of hydrogen bonding and metal-coordination in the self-assembly of photoreactive multicomponent networks.","Chemical communications (Cambridge, England)","2007","","38","3930","3932","10.1039/b706936g","","","0.7107","MoKα","","0.1118","0.0714","","","0.1766","0.1998","","","","","","1.087","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7102156","16.307","0.003","5.7271","0.0007","24.026","0.003","90","","118.525","0.003","90","","1971.5","0.5","295","2","295","2","","","","","","","Synthesis","3","P 1 2/c 1","-P 2yc","13","","","","- C24 H20 N4 -","- C24 H20 N4 -","- C96 H80 N16 -","4","1","","Hill, Yennifer; Briceño, Alexander","Exploiting the use of hydrogen bonding and metal-coordination in the self-assembly of photoreactive multicomponent networks.","Chemical communications (Cambridge, England)","2007","","38","3930","3932","10.1039/b706936g","","","0.71073","MoKα","","0.117","0.0692","","","0.1514","0.1733","","","","","","1.138","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102157","21.104","0.003","14.04","0.0016","17.205","0.002","90","","111.244","0.002","90","","4751.4","1","293","2","293","2","","","","","","","Synthesis","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H40 Mn N10 S2 -","- C50 H40 Mn N10 S2 -","- C200 H160 Mn4 N40 S8 -","4","0.5","","Hill, Yennifer; Briceño, Alexander","Exploiting the use of hydrogen bonding and metal-coordination in the self-assembly of photoreactive multicomponent networks.","Chemical communications (Cambridge, England)","2007","","38","3930","3932","10.1039/b706936g","","","0.7107","MoKα","","0.1332","0.0711","","","0.1834","0.2175","","","","","","1.043","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7102158","11.0553","0.0013","7.3121","0.0009","13.2662","0.0017","90","","94.693","0.007","90","","1068.8","0.2","173","2","173","2","","","","","","","","4","P 1 c 1","P -2yc","7","621 4-carboxy-PhC(CN)=NOH, 1-((4-pyridyl)methyl)-5,6-Me2- benzimidazole","621 4-carboxy-PhC(CN)=NOH, 1-[(4-pyridyl)methyl]-5,6-Me2-benzimidazole","","- C24 H21 N5 O3 -","- C24 H21 N5 O3 -","- C48 H42 N10 O6 -","2","1","","Aakeröy, Christer B; Desper, John; Smith, Michelle M","Constructing, deconstructing, and reconstructing ternary supermolecules.","Chemical communications (Cambridge, England)","2007","","38","3936","3938","10.1039/b707518a","","","0.71073","MoKα","","0.0563","0.0527","","","0.1298","0.1346","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102159","5.7988","0.001","31.336","0.005","8.4715","0.0013","90","","106.377","0.007","90","","1476.9","0.4","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","1-((4-pyridyl)methyl)-2-methylbenzimidazole, PhC(CN)(=NOH) Me5-PhCOOH","1-[(4-pyridyl)methyl]-2-methylbenzimidazole, PhC(CN)(=NOH) Me5-PhCOOH","","- C34 H35 N5 O3 -","- C34 H35 N5 O3 -","- C68 H70 N10 O6 -","2","1","","Aakeröy, Christer B; Desper, John; Smith, Michelle M","Constructing, deconstructing, and reconstructing ternary supermolecules.","Chemical communications (Cambridge, England)","2007","","38","3936","3938","10.1039/b707518a","","","0.71073","MoKα","","0.0467","0.0416","","","0.1098","0.1137","","","","","","1.105","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102160","8.0137","0.0008","9.8024","0.0009","12.0784","0.0013","82.364","0.006","86.045","0.007","75.888","0.006","911.35","0.16","173","2","173","2","","","","","","","","4","P -1","-P 1","2","1-((4-pyridyl)methyl)-2-phenylimidazole, 4-hydroxybenzoic acid","1-[(4-pyridyl)methyl]-2-phenylimidazole, 4-hydroxybenzoic acid","","- C22 H19 N3 O3 -","- C22 H19 N3 O3 -","- C44 H38 N6 O6 -","2","1","","Aakeröy, Christer B; Desper, John; Smith, Michelle M","Constructing, deconstructing, and reconstructing ternary supermolecules.","Chemical communications (Cambridge, England)","2007","","38","3936","3938","10.1039/b707518a","","","0.71073","MoKα","","0.0975","0.0689","","","0.1795","0.1993","","","","","","1.136","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102161","15.951","0.0015","5.9914","0.0006","23.071","0.002","90","","103.494","0.004","90","","2144","0.3","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","442 1-((4-pyridyl)methyl)-5,6-dimethylbenzimidazole, 4- bromoPhC(CN)(=NOH)","442 1-[(4-pyridyl)methyl]-5,6-dimethylbenzimidazole, 4-bromoPhC(CN)(=NOH)","","- C23 H20 Br N5 O -","- C23 H20 Br N5 O -","- C92 H80 Br4 N20 O4 -","4","1","","Aakeröy, Christer B; Desper, John; Smith, Michelle M","Constructing, deconstructing, and reconstructing ternary supermolecules.","Chemical communications (Cambridge, England)","2007","","38","3936","3938","10.1039/b707518a","","","0.71073","MoKα","","0.0573","0.0363","","","0.0916","0.1001","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102162","8.7684","0.0007","12.4703","0.0007","12.8511","0.001","90","","97.577","0.006","90","","1392.93","0.17","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H14 Fe K N2 O8 -","- C11 H14 Fe K N2 O8 -","- C44 H56 Fe4 K4 N8 O32 -","4","1","","Meier, Roland; Maigut, Joachim; Kallies, Bernd; Lehnert, Nicolai; Paulat, Florian; Heinemann, Frank W; Zahn, Gernot; Feth, Martin P; Krautscheid, Harald; van Eldik, Rudi","[FeIII(tmdta)]‒twist-boat/half-chair conformer ratio reliably deduced from DFT-calculated Raman spectra.","Chemical communications (Cambridge, England)","2007","","38","3960","3962","10.1039/b708437d","","","0.71073","MoKα","","0.0238","0.0215","","","0.0574","0.0584","","","","","","1.054","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102163","8.8188","0.0004","10.6119","0.0006","19.6967","0.0012","90","","93.06","0.003","90","","1840.67","0.17","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","guanidinium trimethyldiaminetetracetatoferrate(iii) dihydrate","guanidinium trimethyldiaminetetracetatoferrate(III) dihydrate","","- C12 H24 Fe N5 O10 -","- C12 H24 Fe N5 O10 -","- C48 H96 Fe4 N20 O40 -","4","1","","Meier, Roland; Maigut, Joachim; Kallies, Bernd; Lehnert, Nicolai; Paulat, Florian; Heinemann, Frank W; Zahn, Gernot; Feth, Martin P; Krautscheid, Harald; van Eldik, Rudi","[FeIII(tmdta)]‒twist-boat/half-chair conformer ratio reliably deduced from DFT-calculated Raman spectra.","Chemical communications (Cambridge, England)","2007","","38","3960","3962","10.1039/b708437d","","","0.71073","MoKα","","0.0363","0.0332","","","0.0943","0.0974","","","","","","1.12","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102164","8.888","0.002","10.284","0.003","17.782","0.005","90","","95.87","0.02","90","","1616.8","0.7","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H20 Fe Li N2 O11 -","- C11 H20 Fe Li N2 O11 -","- C44 H80 Fe4 Li4 N8 O44 -","4","1","","Meier, Roland; Maigut, Joachim; Kallies, Bernd; Lehnert, Nicolai; Paulat, Florian; Heinemann, Frank W; Zahn, Gernot; Feth, Martin P; Krautscheid, Harald; van Eldik, Rudi","[FeIII(tmdta)]‒twist-boat/half-chair conformer ratio reliably deduced from DFT-calculated Raman spectra.","Chemical communications (Cambridge, England)","2007","","38","3960","3962","10.1039/b708437d","","","0.71073","MoKα","","0.0608","0.0399","","","0.0978","0.1037","","","","","","0.992","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102165","8.6446","0.0013","11.0545","0.001","16.837","0.003","90","","103.859","0.009","90","","1562.1","0.4","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H19 Fe N3 O8.5 -","- C11 H19 Fe N3 O8.5 -","- C44 H76 Fe4 N12 O34 -","4","1","","Meier, Roland; Maigut, Joachim; Kallies, Bernd; Lehnert, Nicolai; Paulat, Florian; Heinemann, Frank W; Zahn, Gernot; Feth, Martin P; Krautscheid, Harald; van Eldik, Rudi","[FeIII(tmdta)]‒twist-boat/half-chair conformer ratio reliably deduced from DFT-calculated Raman spectra.","Chemical communications (Cambridge, England)","2007","","38","3960","3962","10.1039/b708437d","","x-ray","0.71073","MoKα","","0.1084","0.0468","","","0.0996","0.1163","","","","","","1.013","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102166","15.63","0.005","6.649","0.005","15.862","0.005","90","","117.866","0.005","90","","1457.3","1.3","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","(1S,2R,3S,5Z,7S,9R,10R,11Z,14S)-3-(Benzyloxy)-7- dimethyl(phenyl)silyl-cladiella-5(6),11(12)-diene-(E)-semicarbazide","(1S,2R,3S,5Z,7S,9R,10R,11Z,14S)-3-(Benzyloxy)-7-dimethyl(phenyl)silyl- cladiella-5(6),11(12)-diene-(E)-semicarbazide","","- C32 H41 N3 O3 Si -","- C32 H41 N3 O3 Si -","- C64 H82 N6 O6 Si2 -","2","1","","Gilmour, Ryan; Prior, Timothy J; Burton, Jonathan W; Holmes, Andrew B","An organocatalytic approach to the core of eunicellin.","Chemical communications (Cambridge, England)","2007","","38","3954","3956","10.1039/b709322e","","","0.8464","synchrotron","","0.1224","0.0902","","","0.237","0.2507","","","","","","1.024","","","","has coordinates,has disorder","202017","2020-10-21","18:00:00",""
"7102167","19.0896","0.0016","11.1892","0.001","19.3721","0.0016","90","","115.559","0.008","90","","3732.9","0.6","180","","100","","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H44 P2 Ru Si2 -","- C42 H44 P2 Ru Si2 -","- C168 H176 P8 Ru4 Si8 -","4","1","","Montiel-Palma, Virginia; Muñoz-Hernández, Miguel A; Ayed, Tahra; Barthelat, Jean-Claude; Grellier, Mary; Vendier, Laure; Sabo-Etienne, Sylviane","Agostic Si-H bond coordination assists C-H bond activation at ruthenium in bis(phosphinobenzylsilane) complexes.","Chemical communications (Cambridge, England)","2007","","38","3963","3965","10.1039/b709408f","","","0.71073","MoKα","","0.0998","0.0457","","","0.0716","0.0844","","","","","","0.835","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102168","19.24","0.003","19.413","0.003","19.787","0.003","99.23","0.003","94.512","0.003","109.734","0.003","6795.7","1.8","301","1","","","","","","","","","","8","P -1","-P 1","2","","","","- C85 H36 Ag9 Cl2 N O50 Os13 P2 -","- C85 H32 Ag9 Cl2 N O50 Os13 P2 -","- C170 H64 Ag18 Cl4 N2 O100 Os26 P4 -","2","1","","Lee, Yui-Bing; Wong, Wing-Tak","Synthesis and characterisation of high-nuclearity osmium-silver mixed-metal clusters.","Chemical communications (Cambridge, England)","2007","","38","3924","3926","10.1039/b709860j","","","0.71073","MoKα","","","0.052","","","","0.0594","","","","","","1.027","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102169","14.587","0.002","18.744","0.003","19.042","0.003","63.828","0.003","69.54","0.003","85.295","0.003","4361.8","1.2","301","1","","","","","","","","","","8","P -1","-P 1","2","","","","- C67 H32 Ag9 Cl2 N O32 Os9 P2 -","- C67 H32 Ag9 Cl2 N O32 Os9 P2 -","- C134 H64 Ag18 Cl4 N2 O64 Os18 P4 -","2","1","","Lee, Yui-Bing; Wong, Wing-Tak","Synthesis and characterisation of high-nuclearity osmium-silver mixed-metal clusters.","Chemical communications (Cambridge, England)","2007","","38","3924","3926","10.1039/b709860j","","","0.71073","MoKα","","","0.0664","","","","0.1019","","","","","","1.017","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102170","9.7904","0.0013","9.944","0.0013","17.248","0.002","96.101","0.002","91.039","0.002","93.565","0.002","1666","0.4","301","1","","","","","","","","","","6","P -1","-P 1","2","","","","- C37 H30 Cl Ir O3 P2 -","- C37 H30 Cl Ir O3 P2 -","- C74 H60 Cl2 Ir2 O6 P4 -","2","1","","Lee, Yui-Bing; Wong, Wing-Tak","Synthesis and characterisation of high-nuclearity osmium-silver mixed-metal clusters.","Chemical communications (Cambridge, England)","2007","","38","3924","3926","10.1039/b709860j","","","0.7107","MoKα","","","0.032","","","","0.036","","","","","","1.085","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102171","11.161","0.0003","15.051","0.0004","15.221","0.0003","98.929","0.0017","94.35","0.0016","90.985","0.0011","2517.54","0.11","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C18.5 H23.5 Cl6.5 N3 Pt -","- C18.5 H23.5 Cl6.5 N3 Pt -","- C74 H94 Cl26 N12 Pt4 -","4","2","","Branytska, Olena; Shimon, Linda J W; Neumann, Ronny","Tandem pinacol coupling-rearrangement of aromatic aldehydes with hydrogen catalyzed by a combination of a platinum complex and a polyoxometalate.","Chemical communications (Cambridge, England)","2007","","38","3957","3959","10.1039/b710100g","","","0.71073","MoKα","","0.0366","0.028","","","0.066","0.0697","","","","","","1.076","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102172","6.2084","0.0002","10.3461","0.0003","12.6475","0.0003","90","","97.319","0.002","90","","805.76","0.04","150","2","150","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C18 H19 N O3 -","- C18 H19 N O3 -","- C36 H38 N2 O6 -","2","1","","Alemán, José; Reyes, Efraím; Richter, Bo; Overgaard, Jacob; Jørgensen, Karl Anker","Organocatalytic asymmetric ""anti-Michael"" reaction of beta-ketoesters.","Chemical communications (Cambridge, England)","2007","","38","3921","3923","10.1039/b710393j","","x-ray","1.54178","CuKα","","0.0313","0.0308","","","0.0773","0.0778","","","","","","1.096","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102173","18.4212","0.0011","37.5328","0.0017","17.8126","0.0011","90","","118.897","0.002","90","","10782.2","1","123.1","","","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C184 H122 Mo2 N8 O42 Si W12 -","- C184 H120 Mo2 N8 O42 Si W12 -","- C368 H240 Mo4 N16 O84 Si2 W24 -","2","0.25","","Yokoyama, Atsutoshi; Kojima, Takahiko; Ohkubo, Kei; Fukuzumi, Shunichi","A discrete conglomerate of a distorted Mo(v)-porphyrin with a directly coordinated Keggin-type polyoxometalate.","Chemical communications (Cambridge, England)","2007","","39","3997","3999","10.1039/b704994c","","","0.7107","MoKα","","","0.0778","","","","0.1817","","","","","","1.2","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102174","11.05","0.007","25.24","0.02","12.334","0.008","90","","104.751","0.002","90","","3326","3","150.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H21 F4 N8 O S6 -","- C31 H21 F4 N8 O S6 -","- C124 H84 F16 N32 O4 S24 -","4","1","","Murata, Tsuyoshi; Morita, Yasushi; Yakiyama, Yumi; Nishimura, Yoshie; Ise, Tomoaki; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Nakasuji, Kazuhiro","Zwitterionic pi-radical involving EDT-TTF-imidazole and F4TCNQ: redox properties and self-assembled structure by hydrogen-bonds and multiple S...S interactions.","Chemical communications (Cambridge, England)","2007","","39","4009","4011","10.1039/b707113b","","","0.7107","MoKα","","","0.0735","","","","0.2017","","","","","","1.522","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102175","8.5766","0.0003","7.0349","0.0003","10.6494","0.0005","90","","109.919","0.0015","90","","604.1","0.04","190","","190","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C15 H15 N O2 -","- C15 H15 N O2 -","- C30 H30 N2 O4 -","2","0.5","","Davies, Stephen G; Ling, Kenneth B; Roberts, Paul M; Russell, Angela J; Thomson, James E","Diastereoselective Simmons-Smith cyclopropanations of allylic amines and carbamates.","Chemical communications (Cambridge, England)","2007","","39","4029","4031","10.1039/b711358g","","","0.71073","MoKα","","0.1211","0.1044","","0.2144","0.2057","0.2144","","","","","","1.0452","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102176","16.2163","0.0017","18.3321","0.0019","22.563","0.005","101.528","0.011","93.817","0.011","115.455","0.01","5845.3","1.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H162.5 N12 O51.25 Ru6 -","- C84 H84 N12 O51.25 Ru6 -","- C168 H168 N24 O102.5 Ru12 -","2","1","","Olivier, Céline; Grote, Zacharias; Solari, Euro; Scopelliti, Rosario; Severin, Kay","A self-assembled receptor for the recognition of phosphate and acetate anions in neutral aqueous solution.","Chemical communications (Cambridge, England)","2007","","39","4000","4002","10.1039/b711425g","","","0.71073","MoKα","","0.089","0.0581","","","0.1358","0.158","","","","","","1.063","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102177","11.797","0.003","9.784","0.002","24.594","0.005","90","","94.811","0.004","90","","2828.7","1.1","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H30 N4 O10 U2 -","- C23 H30 N4 O10 U2 -","- C92 H120 N16 O40 U8 -","4","1","","Bharara, Mohan S; Tonks, Stephen A; Gorden, Anne E V","Uranyl stabilized Schiff base complex.","Chemical communications (Cambridge, England)","2007","","39","4006","4008","10.1039/b712322a","","","0.71073","MoKα","","0.0364","0.0272","","","0.0539","0.0557","","","","","","0.858","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102178","18.427","0.002","9.0712","0.0012","11.8143","0.0015","90","","90","","90","","1974.8","0.4","193","2","193","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C21 H19 N3 O4 U -","- C21 H19 N3 O4 U -","- C84 H76 N12 O16 U4 -","4","1","","Bharara, Mohan S; Tonks, Stephen A; Gorden, Anne E V","Uranyl stabilized Schiff base complex.","Chemical communications (Cambridge, England)","2007","","39","4006","4008","10.1039/b712322a","","","0.71073","MoKα","","0.0286","0.0254","","","0.0574","0.0589","","","","","","0.968","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102179","6.0089","0.0009","7.4921","0.0011","30.372","0.005","90","0.003","93.286","0.003","90","0.003","1365.1","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H32 N4 O4 -","- C32 H32 N4 O4 -","- C64 H64 N8 O8 -","2","1","","Bharara, Mohan S; Tonks, Stephen A; Gorden, Anne E V","Uranyl stabilized Schiff base complex.","Chemical communications (Cambridge, England)","2007","","39","4006","4008","10.1039/b712322a","","","0.71073","MoKα","","0.0741","0.0446","","","0.1029","0.1137","","","","","","0.867","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102180","20.72","0.003","20.72","0.003","9.729","0.002","90","","90","","120","","3617.3","0.2","20","2","","","","","","","","","","2","R -3 :H","-R 3","148","","","","- C72 F36 -","- C72 F36 -","- C216 F108 -","3","0.166667","","Checińska, Lilianna; Troyanov, Sergey I; Mebs, Stefan; Hübschle, Christian B; Luger, Peter","Examination of intermolecular electronic interactions in the crystal structure of C60(CF3)12 by experimental electron density determination.","Chemical communications (Cambridge, England)","2007","","39","4003","4005","10.1039/b712694h","","","0.71068","MoKα","","0.0305","0.0237","","","","0.0221","","","","","","2.0539","","","","has coordinates","192337","2020-10-21","18:00:00",""
"7102181","10.2597","0.0002","14.8941","0.0002","26.3207","0.0004","86.374","0.001","82.008","0.001","77.48","0.001","3885.98","0.11","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C74.5 H78 F18 N3 Na O7 P5 -","- C74.5 H78 F18 N3 Na O7 P5 -","- C149 H156 F36 N6 Na2 O14 P10 -","2","1","","Chen, Nai-Chia; Huang, Po-Yi; Lai, Chien-Chen; Liu, Yi-Hung; Wang, Yu; Peng, Shie-Ming; Chiu, Sheng-Hsien","A [2]rotaxane-based (1)H NMR spectroscopic probe for the simultaneous identification of physiologically important metal ions in solution.","Chemical communications (Cambridge, England)","2007","","40","4122","4124","10.1039/b706461f","","","0.71073","MoKα","","0.1548","0.1196","","","0.3203","0.3381","","","","","","1.751","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102182","7.256","0.002","7.399","0.002","9.699","0.003","67.888","0.006","87.284","0.007","67.771","0.005","443.8","0.2","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H16 Na3 Np O16 -","- C8 H16 Na3 Np O16 -","- C8 H16 Na3 Np O16 -","1","0.5","","Tian, Guoxin; Rao, Linfeng; Oliver, Allen","Symmetry and optical spectra: a ""silent"" 1 : 2 Np(V)-oxydiacetate complex.","Chemical communications (Cambridge, England)","2007","","40","4119","4121","10.1039/b706825e","","","0.775","synchrotron","","0.0302","0.0302","","","0.0779","0.0779","","","","","","1.091","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102183","13.1906","0.0002","20.2619","0.0004","21.1216","0.0004","86.141","0.001","76.328","0.001","85.518","0.001","5461.42","0.17","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H88 N4 O Si2 Zn2 -","- C52 H80 N4 Si2 Zn2 -","- C208 H320 N16 Si8 Zn8 -","4","2","","Tsai, Yi-Chou; Lu, Duan-Yen; Lin, Yang-Miin; Hwang, Jenn-Kang; Yu, Jen-Shiang K","Structural transformations in dinuclear zinc complexes involving Zn-Zn bonds.","Chemical communications (Cambridge, England)","2007","","40","4125","4127","10.1039/b707396h","","","0.71073","MoKα","","0.0979","0.0604","","","0.1695","0.1856","","","","","","1.04","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102184","23.753","0.0007","23.753","0.0007","20.838","0.0009","90","","90","","90","","11756.9","0.7","200","2","200","2","","","","","","","","6","I -4","I -4","82","","","","- C52 H80 K2 N4 Si2 Zn2 -","- C52 H79.1 K2 N4 Si2 Zn2 -","- C416 H632.8 K16 N32 Si16 Zn16 -","8","1","","Tsai, Yi-Chou; Lu, Duan-Yen; Lin, Yang-Miin; Hwang, Jenn-Kang; Yu, Jen-Shiang K","Structural transformations in dinuclear zinc complexes involving Zn-Zn bonds.","Chemical communications (Cambridge, England)","2007","","40","4125","4127","10.1039/b707396h","","","0.71073","MoKα","","0.1458","0.082","","","0.1866","0.2404","","","","","","1.095","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102185","13.9744","0.0003","14.9998","0.0003","29.4819","0.0008","97.428","0.001","94.287","0.001","98.875","0.001","6026.2","0.2","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C100 H176 K2 N8 O15 Si2 Zn2 -","- C88 H152 K2 N8 O12 Si2 Zn2 -","- C176 H304 K4 N16 O24 Si4 Zn4 -","2","1","","Tsai, Yi-Chou; Lu, Duan-Yen; Lin, Yang-Miin; Hwang, Jenn-Kang; Yu, Jen-Shiang K","Structural transformations in dinuclear zinc complexes involving Zn-Zn bonds.","Chemical communications (Cambridge, England)","2007","","40","4125","4127","10.1039/b707396h","","","0.71073","MoKα","","0.2256","0.0963","","","0.2257","0.2711","","","","","","0.917","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102186","17.563","0.0009","8.02","0.0004","17.9855","0.0009","90","","94.597","0.002","90","","2525.2","0.2","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H25 Br2 N S6 -","- C19 H25 Br2 N S6 -","- C76 H100 Br8 N4 S24 -","4","1","","Gopee, Hemant; Petersen, Bo M; Bond, Andrew D; Jeppesen, Jan O","A bromine catalysed dimerisation of alpha,alpha'-dihalomonopyrrolo-TTF.","Chemical communications (Cambridge, England)","2007","","40","4110","4112","10.1039/b708191j","","","0.71073","MoKα","","0.0943","0.0414","","","0.0824","0.0984","","","","","","1.001","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102187","17.7967","0.0006","7.9872","0.0003","18.2265","0.0006","90","","93.503","0.001","90","","2585.98","0.16","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H25 I2 N S6 -","- C19 H25 I2 N S6 -","- C76 H100 I8 N4 S24 -","4","1","","Gopee, Hemant; Petersen, Bo M; Bond, Andrew D; Jeppesen, Jan O","A bromine catalysed dimerisation of alpha,alpha'-dihalomonopyrrolo-TTF.","Chemical communications (Cambridge, England)","2007","","40","4110","4112","10.1039/b708191j","","","0.71073","MoKα","","0.064","0.0338","","","0.0687","0.0768","","","","","","0.974","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102188","11.6042","0.0006","14.935","0.0008","16.0311","0.0009","112.535","0.002","90.49","0.002","106.707","0.002","2435.6","0.2","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H50 Br4 N2 S12 -","- C38 H50 Br4 N2 S12 -","- C76 H100 Br8 N4 S24 -","2","1","","Gopee, Hemant; Petersen, Bo M; Bond, Andrew D; Jeppesen, Jan O","A bromine catalysed dimerisation of alpha,alpha'-dihalomonopyrrolo-TTF.","Chemical communications (Cambridge, England)","2007","","40","4110","4112","10.1039/b708191j","","","0.71073","MoKα","","0.1229","0.0498","","","0.093","0.1128","","","","","","0.974","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102189","11.6853","0.0003","14.9902","0.0004","16.1737","0.0004","112.847","0.001","90.668","0.001","105.679","0.001","2491.85","0.11","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H50 I4 N2 S12 -","- C38 H50 I4 N2 S12 -","- C76 H100 I8 N4 S24 -","2","1","","Gopee, Hemant; Petersen, Bo M; Bond, Andrew D; Jeppesen, Jan O","A bromine catalysed dimerisation of alpha,alpha'-dihalomonopyrrolo-TTF.","Chemical communications (Cambridge, England)","2007","","40","4110","4112","10.1039/b708191j","","","0.71073","MoKα","","0.0712","0.0382","","","0.0736","0.0803","","","","","","0.954","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102190","33.039","0.003","10.8738","0.0011","17.1736","0.0017","90","","115.321","0.002","90","","5577","1","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C54 H94 Ge2 P2 -","- C54 H94 Ge2 P2 -","- C216 H376 Ge8 P8 -","4","0.5","","Petrar, Petronela Maria; Nemes, Gabriela; Silaghi-Dumitrescu, Ioan; Ranaivonjatovo, Henri; Gornitzka, Heinz; Escudié, Jean","1,3-Digermacyclobutanes with exocyclic C=P and C=P=S double bonds.","Chemical communications (Cambridge, England)","2007","","40","4149","4151","10.1039/b708308d","","","0.71073","MoKα","","0.0435","0.0343","","","0.0945","0.0997","","","","","","1.036","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102191","35.416","0.002","10.6099","0.0007","16.2868","0.0011","90","","101.109","0.001","90","","6005.3","0.7","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C58 H104 Ge2 O P2 -","- C58 H104 Ge2 O P2 -","- C232 H416 Ge8 O4 P8 -","4","0.5","","Petrar, Petronela Maria; Nemes, Gabriela; Silaghi-Dumitrescu, Ioan; Ranaivonjatovo, Henri; Gornitzka, Heinz; Escudié, Jean","1,3-Digermacyclobutanes with exocyclic C=P and C=P=S double bonds.","Chemical communications (Cambridge, England)","2007","","40","4149","4151","10.1039/b708308d","","","0.71073","MoKα","","0.0726","0.0386","","","0.0748","0.0847","","","","","","0.997","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102192","33.16","0.003","11.3364","0.001","17.1891","0.0015","90","","118.224","0.002","90","","5693.4","0.9","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C54 H94 Ge2 P2 S2 -","- C54 H94 Ge2 P2 S2 -","- C216 H376 Ge8 P8 S8 -","4","0.5","","Petrar, Petronela Maria; Nemes, Gabriela; Silaghi-Dumitrescu, Ioan; Ranaivonjatovo, Henri; Gornitzka, Heinz; Escudié, Jean","1,3-Digermacyclobutanes with exocyclic C=P and C=P=S double bonds.","Chemical communications (Cambridge, England)","2007","","40","4149","4151","10.1039/b708308d","","","0.71073","MoKα","","0.0394","0.029","","","0.0715","0.0768","","","","","","1.035","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102193","20.44","0.003","16.67","0.002","19.133","0.003","90","","90","","90","","6519.2","1.5","173","2","173","2","","","","","","","","6","I b a m","-I 2 2c","72","","","","- C62 H110 Ge2 O2 P2 S2 -","- C62 H110 Ge2 O2 P2 S2 -","- C248 H440 Ge8 O8 P8 S8 -","4","0.25","","Petrar, Petronela Maria; Nemes, Gabriela; Silaghi-Dumitrescu, Ioan; Ranaivonjatovo, Henri; Gornitzka, Heinz; Escudié, Jean","1,3-Digermacyclobutanes with exocyclic C=P and C=P=S double bonds.","Chemical communications (Cambridge, England)","2007","","40","4149","4151","10.1039/b708308d","","","0.71073","MoKα","","0.094","0.0504","","","0.1037","0.1217","","","","","","1.049","","","","has coordinates,has disorder","180123","2020-10-21","18:00:00",""
"7102194","13.298","0.002","13.298","0.002","29.544","0.005","90","","90","","120","","4524.5","1.2","293","2","293","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","","","- C28 H16 N0 O10 Zn2 -","- C28 H16 O10 Zn2 -","- C168 H96 O60 Zn12 -","6","1","","Ma, Yi; Han, Zhengbo; He, Yongke; Yang, Liguo","A 3D chiral Zn(II) coordination polymer with triple Zn-oba-Zn helical chains (oba = 4,4'-oxybis(benzoate)).","Chemical communications (Cambridge, England)","2007","","40","4107","4109","10.1039/b708479j","","","0.71073","MoKα","","0.1153","0.0738","","","0.1936","0.2357","","","","","","1.041","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102195","10.299","0.002","10.594","0.002","13.624","0.003","91.641","0.003","95.407","0.002","106.911","0.002","1413.3","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Cp'ScBz2","","","- C30 H45 N2 Sc Si -","- C30 H45 N2 Sc Si -","- C60 H90 N4 Sc2 Si2 -","2","1","","Li, Xiaofang; Nishiura, Masayoshi; Mori, Kyouichi; Mashiko, Tomohiro; Hou, Zhaomin","Cationic scandium aminobenzyl complexes. Synthesis, structure and unprecedented catalysis of copolymerization of 1-hexene and dicyclopentadiene.","Chemical communications (Cambridge, England)","2007","","40","4137","4139","10.1039/b708534f","","","0.71073","MoKα","","0.0559","0.0399","","","0.0879","0.0928","","","","","","1","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102196","13.67","0.003","11.343","0.002","16.507","0.004","90","","99.449","0.003","90","","2524.9","0.9","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Cp*ScBz2","","","- C28 H39 N2 Sc -","- C28 H39 N2 Sc -","- C112 H156 N8 Sc4 -","4","1","","Li, Xiaofang; Nishiura, Masayoshi; Mori, Kyouichi; Mashiko, Tomohiro; Hou, Zhaomin","Cationic scandium aminobenzyl complexes. Synthesis, structure and unprecedented catalysis of copolymerization of 1-hexene and dicyclopentadiene.","Chemical communications (Cambridge, England)","2007","","40","4137","4139","10.1039/b708534f","","","0.71073","MoKα","","0.0522","0.038","","","0.1018","0.1084","","","","","","1.038","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102197","9.493","0.011","17.612","0.019","14.571","0.017","90","","91.82","0.02","90","","2435","5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","C5Me4HScBz2","","","- C27 H37 N2 Sc -","- C27 H37 N2 Sc -","- C108 H148 N8 Sc4 -","4","1","","Li, Xiaofang; Nishiura, Masayoshi; Mori, Kyouichi; Mashiko, Tomohiro; Hou, Zhaomin","Cationic scandium aminobenzyl complexes. Synthesis, structure and unprecedented catalysis of copolymerization of 1-hexene and dicyclopentadiene.","Chemical communications (Cambridge, England)","2007","","40","4137","4139","10.1039/b708534f","","","0.71073","MoKα","","0.1526","0.0497","","","0.0666","0.082","","","","","","0.694","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102198","17.823","0.004","10.479","0.003","23.866","0.006","90","","90","","90","","4457.2","1.9","173","2","173","2","","","","","","","","7","P n a 21","P 2c -2n","33","(Cp'ScBz)(B(C6F5)4)","","","- C45 H33 B F20 N Sc Si -","- C45 H33 B F20 N Sc Si -","- C180 H132 B4 F80 N4 Sc4 Si4 -","4","1","","Li, Xiaofang; Nishiura, Masayoshi; Mori, Kyouichi; Mashiko, Tomohiro; Hou, Zhaomin","Cationic scandium aminobenzyl complexes. Synthesis, structure and unprecedented catalysis of copolymerization of 1-hexene and dicyclopentadiene.","Chemical communications (Cambridge, England)","2007","","40","4137","4139","10.1039/b708534f","","","0.71073","MoKα","","0.0696","0.0345","","","0.0366","0.0402","","","","","","0.979","","","","has coordinates","180123","2020-10-21","18:00:00",""
"7102199","5.2434","0.0005","9.32","0.0009","28.332","0.003","90","","90","","90","","1384.5","0.2","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H24 O2 -","- C16 H24 O2 -","- C64 H96 O8 -","4","1","","Clark, J Stephen; Guérot, Carine; Wilson, Claire; Blake, Alexander J","Rapid synthesis of medium-ring fused polycarbocyclic systems by rearrangement of carbenoid-derived oxonium ylides.","Chemical communications (Cambridge, England)","2007","","40","4134","4136","10.1039/b709064a","","","0.71073","MoKα","","0.0457","0.0406","","","0.0997","0.1021","","","","","","1.016","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102200","5.4027","0.0006","11.2344","0.0013","13.4933","0.0016","97.311","0.002","95.227","0.002","91.841","0.002","808.16","0.16","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C19 H24 O3 -","- C19 H24 O3 -","- C38 H48 O6 -","2","1","","Clark, J Stephen; Guérot, Carine; Wilson, Claire; Blake, Alexander J","Rapid synthesis of medium-ring fused polycarbocyclic systems by rearrangement of carbenoid-derived oxonium ylides.","Chemical communications (Cambridge, England)","2007","","40","4134","4136","10.1039/b709064a","","","0.71073","MoKα","","0.0704","0.0419","","","0.087","0.0933","","","","","","0.938","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102201","31.128","0.011","33.904","0.012","5.139","0.002","90","","90","","90","","5424","5","150","2","150","2","","","","","","","","3","F d d 2","F 2 -2d","43","","","","- C16 H24 O2 -","- C16 H24 O2 -","- C256 H384 O32 -","16","1","","Clark, J Stephen; Guérot, Carine; Wilson, Claire; Blake, Alexander J","Rapid synthesis of medium-ring fused polycarbocyclic systems by rearrangement of carbenoid-derived oxonium ylides.","Chemical communications (Cambridge, England)","2007","","40","4134","4136","10.1039/b709064a","","","0.71073","MoKα","","0.0559","0.0395","","","0.0876","0.0936","","","","","","0.94","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102202","16.5616","0.0008","10.9871","0.0005","21.1696","0.001","90","","110.889","0.001","90","","3598.9","0.3","125","2","125","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H52 N5 P Si3 Zr -","- C29 H52 N5 P Si3 Zr -","- C116 H208 N20 P4 Si12 Zr4 -","4","1","","MacMillan, Samantha N; Tanski, Joseph M; Waterman, Rory","Insertion of benzyl isocyanide into a Zr-P bond and rearrangement. Atom-economical synthesis of a phosphaalkene.","Chemical communications (Cambridge, England)","2007","","40","4172","4174","10.1039/b709506f","","","0.71073","MoKα","","0.0394","0.0289","","","0.0678","0.0724","","","","","","1.033","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102203","28.043","0.005","28.463","0.005","37.746","0.006","81.553","0.002","70.715","0.002","72.193","0.002","27040","8","80","2","80","2","","","","","","","","6","P -1","-P 1","2","","","","- C120 H281 N31 O91.5 Ru6 S24 -","- C120 H144 N31 O91.5 Ru6 S24.0015 -","- C480 H576 N124 O366 Ru24 S96.006 -","4","2","","Yamashita, Ken-Ichi; Kawano, Masaki; Fujita, Makoto","Ru(ii)-cornered coordination cage that senses guest inclusion by color change.","Chemical communications (Cambridge, England)","2007","","40","4102","4103","10.1039/b712529a","","","0.71073","MoKα","","0.2492","0.1217","","","0.3486","0.4245","","","","","","1.218","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102204","37.576","0.005","44.413","0.006","35.8","0.005","90","","90","","90","","59747","14","80","2","80","2","","","","","","","","6","C c c 2","C 2 -2c","37","","","","- C178 H334.5 N37 O85.25 Ru6 S24 -","- C178 H216 N37 O85.25 Ru6 S24 -","- C1424 H1728 N296 O682 Ru48 S192 -","8","1","","Yamashita, Ken-Ichi; Kawano, Masaki; Fujita, Makoto","Ru(ii)-cornered coordination cage that senses guest inclusion by color change.","Chemical communications (Cambridge, England)","2007","","40","4102","4103","10.1039/b712529a","","","0.71073","MoKα","","0.147","0.0774","","","0.1919","0.244","","","","","","1.068","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102205","15.4472","0.0015","18.5201","0.0018","16.768","0.0017","90","","116.181","0.002","90","","4304.9","0.7","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C48 H39 Co N10 -","- C45 H32 Co N10 -","- C180 H128 Co4 N40 -","4","1","","Çetin, Anıl; Sripothongnak, Saovalak; Kawa, Michael; Durfee, William S.; Ziegler, Christopher J.","Co(II) and Co(III) complexes of m-benziphthalocyanine","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4289","4290","10.1039/b704815g","","","0.71073","MoKα","","0.0474","0.0387","","","0.0992","0.1033","","","","","","1.039","","","","has coordinates","209778","2020-10-21","18:00:00",""
"7102206","9.9002","0.0016","10.0469","0.0016","44.85","0.007","90","","93.7","0.003","90","","4451.8","1.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C55 H41 Co N12 -","- C50 H36 Co N11 -","- C200 H144 Co4 N44 -","4","1","","Çetin, Anıl; Sripothongnak, Saovalak; Kawa, Michael; Durfee, William S.; Ziegler, Christopher J.","Co(II) and Co(III) complexes of m-benziphthalocyanine","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4289","4290","10.1039/b704815g","","","0.71073","MoKα","","0.1369","0.076","","","0.1626","0.1835","","","","","","0.978","","","","has coordinates","209778","2020-10-21","18:00:00",""
"7102207","12.5789","0.0011","13.309","0.0012","15.3136","0.0013","75.725","0.001","76.522","0.001","69.353","0.001","2294.6","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H46 Co N9 O -","- C56 H46 Co N9 O -","- C112 H92 Co2 N18 O2 -","2","1","","Çetin, Anıl; Sripothongnak, Saovalak; Kawa, Michael; Durfee, William S.; Ziegler, Christopher J.","Co(II) and Co(III) complexes of m-benziphthalocyanine","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4289","4290","10.1039/b704815g","","","0.71073","MoKα","","0.1158","0.0946","","","0.2567","0.2722","","","","","","1.11","","","","has coordinates","209778","2020-10-21","18:00:00",""
"7102208","12.1773","0.0004","7.8453","0.0003","16.2028","0.0005","90","","107.044","0.0017","90","","1479.94","0.09","98.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C31 H57 N O5 -","- C29.39 H53.32 N O4.77 -","- C58.78 H106.64 N2 O9.54 -","2","1","","Aburaya, Kazuaki; Hisaki, Ichiro; Tohnai, Norimitsu; Miyata, Mikiji","Dependence of the enantioselectivity on reversion of layer directions in cholamide inclusion compounds","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4257","4259","10.1039/b705822e","","","1.54187","CuKα","","","0.169","","","","0.4679","","","","","","1.476","","","","has coordinates","210747","2020-10-21","18:00:00",""
"7102209","9.165","0.002","16.668","0.003","20.548","0.004","90","","90","","90","","3138.9","1","93.2","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H59 N O5 -","- C32 H59 N O5 -","- C128 H236 N4 O20 -","4","1","","Aburaya, Kazuaki; Hisaki, Ichiro; Tohnai, Norimitsu; Miyata, Mikiji","Dependence of the enantioselectivity on reversion of layer directions in cholamide inclusion compounds","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4257","4259","10.1039/b705822e","","","1.5419","CuKα","","","0.0493","","","","0.1347","","","","","","0.564","","","","has coordinates","210747","2020-10-21","18:00:00",""
"7102210","47.8099","0.0015","30.624","0.0015","29.8033","0.0011","90","","122.929","0.002","90","","36626","3","293","2","293","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- Fe12 H158 K22 Na8 O312 P8 W60 -","- Fe12 K22 Na8 O312 P8 W60 -","- Fe48 K88 Na32 O1248 P32 W240 -","4","0.5","","Pradeep, Chullikkattil P.; Long, De-Liang; Kögerler, Paul; Cronin, Leroy","Controlled assembly and solution observation of a 2.6 nm polyoxometalate ""super"" tetrahedron cluster: [KFe12(OH)18(α-1,2,3-P2W15O56)4]29‒","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4254","4256","10.1039/b707202c","","","0.71073","MoKα","","0.088","0.0477","","","0.1041","0.1245","","","","","","1.049","","","","has coordinates,has disorder","210766","2020-10-21","18:00:00",""
"7102211","14.3332","0.0009","16.8136","0.001","22.5538","0.0013","82.969","0.001","79.373","0.001","85.157","0.002","5291.2","0.5","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C105 H87.5 Ag6 Cl9.5 F3 Fe3 O3 P6 S -","- C105 H87.5 Ag6 Cl9.5 F3 Fe3 O3 P6 S -","- C210 H175 Ag12 Cl19 F6 Fe6 O6 P12 S2 -","2","1","","Teo, Peili; Koh, Lip Lin; Hor, T. S. Andy","General formation of trigonal-prismatic [Ag~6~X~5~(dppf)~3~]^+^ (X = Cl, Br, I) through an unusual ligand migration from NiX2(dppf) to AgOTf","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4221","4223","10.1039/b707218j","","","0.71073","MoKα","","0.0681","0.0502","","","0.1104","0.1182","","","","","","1.049","","","","has coordinates,has disorder","209690","2020-10-21","18:00:00",""
"7102212","14.886","0.002","20.303","0.003","20.947","0.003","84.359","0.004","82.48","0.005","70.901","0.004","5920.8","1.5","223","2","223","2","","","","","","","","10","P -1","-P 1","2","","","","- C105 H86 Ag6 Br5 Cl10.5 F3 Fe3 O3 P6 S -","- C105 H86 Ag6 Br5 Cl10.5 F3 Fe3 O3 P6 S -","- C210 H172 Ag12 Br10 Cl21 F6 Fe6 O6 P12 S2 -","2","1","","Teo, Peili; Koh, Lip Lin; Hor, T. S. Andy","General formation of trigonal-prismatic [Ag~6~X~5~(dppf)~3~]^+^ (X = Cl, Br, I) through an unusual ligand migration from NiX2(dppf) to AgOTf","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4221","4223","10.1039/b707218j","","","0.71073","MoKα","","0.1883","0.0753","","","0.1432","0.1809","","","","","","0.911","","","","has coordinates,has disorder","209690","2020-10-21","18:00:00",""
"7102213","14.0043","0.0014","14.5664","0.0015","28.009","0.003","80.22","0.002","89.298","0.002","78.533","0.002","5516.8","1","223","2","223","2","","","","","","","","9","P -1","-P 1","2","","","","- C104.5 H87 Ag6 Cl7 F1.5 Fe3 I5 O0.5 P6.5 -","- C104.5 H87 Ag6 Cl7 F1.5 Fe3 I5 O0.5 P6.25 -","- C209 H174 Ag12 Cl14 F3 Fe6 I10 O P12.5 -","2","1","","Teo, Peili; Koh, Lip Lin; Hor, T. S. Andy","General formation of trigonal-prismatic [Ag~6~X~5~(dppf)~3~]^+^ (X = Cl, Br, I) through an unusual ligand migration from NiX2(dppf) to AgOTf","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4221","4223","10.1039/b707218j","","","0.71073","MoKα","","0.1684","0.1484","","","0.3204","0.3292","","","","","","1.201","","","","has coordinates,has disorder","209690","2020-10-21","18:00:00",""
"7102214","12.92","0.003","24.327","0.006","25.854","0.007","90","","96.581","0.006","90","","8072","4","223","2","223","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C40.5 H37 Ag Cl F3 O3 P3 S -","- C40.5 H37 Ag Cl F3 O3 P3 S -","- C324 H296 Ag8 Cl8 F24 O24 P24 S8 -","8","1","","Teo, Peili; Koh, Lip Lin; Hor, T. S. Andy","General formation of trigonal-prismatic [Ag~6~X~5~(dppf)~3~]^+^ (X = Cl, Br, I) through an unusual ligand migration from NiX2(dppf) to AgOTf","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4221","4223","10.1039/b707218j","","","0.71073","MoKα","","0.2038","0.1548","","","0.2765","0.2993","","","","","","1.169","","","","has coordinates","209690","2020-10-21","18:00:00",""
"7102215","13.5327","0.0013","15.8115","0.0014","18.3558","0.0017","95.741","0.003","90.455","0.003","91.385","0.003","3906.6","0.6","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C80 H72 Ag2 F6 O6 P6 S2 -","- C80 H72 Ag2 F6 O6 P6 S2 -","- C160 H144 Ag4 F12 O12 P12 S4 -","2","1","","Teo, Peili; Koh, Lip Lin; Hor, T. S. Andy","General formation of trigonal-prismatic [Ag~6~X~5~(dppf)~3~]^+^ (X = Cl, Br, I) through an unusual ligand migration from NiX2(dppf) to AgOTf","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4221","4223","10.1039/b707218j","","","0.71073","MoKα","","0.177","0.0926","","","0.1613","0.1958","","","","","","1.002","","","","has coordinates","209690","2020-10-21","18:00:00",""
"7102216","14.6609","0.0012","17.102","0.0014","19.2916","0.0015","100.8","0.002","92.932","0.002","93.317","0.002","4733.9","0.7","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C94 H90 Ag3 Cl9 P7 -","- C94 H90 Ag3 Cl9 P7 -","- C188 H180 Ag6 Cl18 P14 -","2","1","","Teo, Peili; Koh, Lip Lin; Hor, T. S. Andy","General formation of trigonal-prismatic [Ag~6~X~5~(dppf)~3~]^+^ (X = Cl, Br, I) through an unusual ligand migration from NiX2(dppf) to AgOTf","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4221","4223","10.1039/b707218j","","","0.71073","MoKα","","0.1972","0.1148","","","0.2202","0.2556","","","","","","1.093","","","","has coordinates","209690","2020-10-21","18:00:00",""
"7102219","8.9742","0.0008","17.9301","0.0016","10.6917","0.001","90","","106.031","0.002","90","","1653.5","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H22 Br2 O5 -","- C16 H22 Br2 O5 -","- C64 H88 Br8 O20 -","4","1","","Khan, Faiz Ahmed; Sudheer, Ch.; Soma, Laxminarayana","Lead(IV) acetate: intriguing reactivity profile","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4239","4241","10.1039/b708268a","","","0.71073","MoKα","","0.0791","0.0485","","","0.098","0.1532","","","","","","1.156","","","","has coordinates","209674","2020-10-21","18:00:00",""
"7102220","11.5727","0.0009","11.7784","0.001","25.579","0.002","90","","90","","90","","3486.6","0.5","100","2","100","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C17 H24 Cl2 O5 -","- C17 H24 Cl2 O5 -","- C136 H192 Cl16 O40 -","8","2","","Khan, Faiz Ahmed; Sudheer, Ch.; Soma, Laxminarayana","Lead(IV) acetate: intriguing reactivity profile","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4239","4241","10.1039/b708268a","","","0.71073","MoKα","","0.0608","0.0494","","","0.1069","0.1284","","","","","","1.072","","","","has coordinates","209674","2020-10-21","18:00:00",""
"7102221","8.2163","0.0007","8.1296","0.0007","26.697","0.002","90","","94.502","0.002","90","","1777.7","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 Cl2 O7 -","- C16 H22 Cl2 O7 -","- C64 H88 Cl8 O28 -","4","1","","Khan, Faiz Ahmed; Sudheer, Ch.; Soma, Laxminarayana","Lead(IV) acetate: intriguing reactivity profile","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4239","4241","10.1039/b708268a","","","0.71073","MoKα","","0.087","0.0595","","","0.15","0.2155","","","","","","1.168","","","","has coordinates","209674","2020-10-21","18:00:00",""
"7102222","34.375","0.002","34.375","0.002","7.2354","0.0006","90","","90","","120","","7404","0.9","100","2","100","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C15 H22 Cl2 O6 -","- C15 H22 Cl2 O6 -","- C270 H396 Cl36 O108 -","18","1","","Khan, Faiz Ahmed; Sudheer, Ch.; Soma, Laxminarayana","Lead(IV) acetate: intriguing reactivity profile","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4239","4241","10.1039/b708268a","","","0.71073","MoKα","","0.0664","0.0475","","","0.1242","0.1817","","","","","","1.124","","","","has coordinates","209674","2020-10-21","18:00:00",""
"7102223","7.3266","0.0006","21.58","0.0017","11.0281","0.0009","90","","101.995","0.001","90","","1705.6","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H20 Cl2 O7 -","- C15 H20 Cl2 O7 -","- C60 H80 Cl8 O28 -","4","1","","Khan, Faiz Ahmed; Sudheer, Ch.; Soma, Laxminarayana","Lead(IV) acetate: intriguing reactivity profile","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4239","4241","10.1039/b708268a","","","0.71073","MoKα","","0.0668","0.0502","","","0.1117","0.1571","","","","","","1.178","","","","has coordinates","209674","2020-10-21","18:00:00",""
"7102224","24.4838","0.0008","8.0709","0.0003","12.1166","0.0004","90","","104.469","0.002","90","","2318.38","0.14","100","","100","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C13 H12 I N O -","- C13 H12 I N O -","- C104 H96 I8 N8 O8 -","8","2","","Fürstner, Alois; Schlecker, Andreas; Lehmann, Christian W.","Facile formation of iodocyclobutenes by a ruthenium-catalyzed enyne cycloisomerization","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4277","4279","10.1039/b708903a","","","1.54178","CuKα","","0.0382","0.0321","","","0.0776","0.0811","","","","","","1.057","","","","has coordinates","210767","2020-10-21","18:00:00",""
"7102225","13.6125","0.0018","19.243","0.003","23.262","0.003","110.426","0.01","104.403","0.01","108.902","0.01","4932","1.5","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C110 H82 Au6 Cl4 Fe9 N6 -","- C110 H82 Au6 Cl4 Fe9 N6 -","- C220 H164 Au12 Cl8 Fe18 N12 -","2","1","","Siemeling, Ulrich; Rother, Dag; Bruhn, Clemens","""Schizoid"" reactivity of 1,1'-diisocyanoferrocene","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4227","4229","10.1039/b709063c","","","0.71073","MoKα","","0.1451","0.0715","","","0.1567","0.1795","","","","","","0.859","","","","has coordinates","210768","2020-10-21","18:00:00",""
"7102226","17.791","0.004","17.791","0.004","37.231","0.015","90","","90","","120","","10206","5","173","2","173","2","","","","","","","","8","P 63 2 2","P 6c 2c","182","","","","- C194 H160 Ag5 Cl6 F30 N36 O Sb5 -","- C194.01 H156 Ag5 Cl6.03 F29.96 N36 O Sb4.99 -","- C388.02 H312 Ag10 Cl12.06 F59.92 N72 O2 Sb9.98 -","2","0.166667","","Zhang, Xue-Li; Guo, Cui-Ping; Yang, Qing-Yuan; Wang, Wei; Liu, Wei-Sheng; Kang, Bei-Sheng; Su, Cheng-Yong","Formation of two (6,3) networks showing structural diversity, Borromean topology and conformational chirality in the same crystal","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4242","4244","10.1039/b709118d","","","0.71073","MoKα","","0.1193","0.0721","","","0.1818","0.2111","","","","","","1.034","","","","has coordinates,has disorder","210751","2020-10-21","18:00:00",""
"7102227","17.9271","0.0006","17.9271","0.0006","37.53","0.003","90","","90","","120","","10445.5","0.9","150","2","150","2","","","","","","","","7","P 63 2 2","P 6c 2c","182","","","","- C204 H171 Ag5 F30 N24 O1.5 Sb5 -","- C204 H168 Ag5 F29.96 N24 O1.5 Sb4.99 -","- C408 H336 Ag10 F59.92 N48 O3 Sb9.98 -","2","0.166667","","Zhang, Xue-Li; Guo, Cui-Ping; Yang, Qing-Yuan; Wang, Wei; Liu, Wei-Sheng; Kang, Bei-Sheng; Su, Cheng-Yong","Formation of two (6,3) networks showing structural diversity, Borromean topology and conformational chirality in the same crystal","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4242","4244","10.1039/b709118d","","","0.71073","MoKα","","0.0984","0.0811","","","0.1836","0.1924","","","","","","1.011","","","","has coordinates,has disorder","210751","2020-10-21","18:00:00",""
"7102228","18.443","0.003","18.443","0.003","15.166","0.003","90","","90","","90","","5158.5","1.4","293","2","293","2","","","","","","","","7","P -4 n 2","P -4 -2n","118","","","","- C72 H68 Cu3 Mo12 N24 O42 P -","- C72 H64 Cu3 Mo12 N24 O42 P -","- C144 H128 Cu6 Mo24 N48 O84 P2 -","2","0.25","","Wang, Xin-Long; Qin, Chao; Wang, En-Bo; Su, Zhong-Min","An unusual polyoxometalate-encapsulating 3D polyrotaxane framework formed by molecular squares threading on a twofold interpenetrated diamondoid skeleton","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4245","4247","10.1039/b709563e","","","0.71073","MoKα","","0.0445","0.0337","","","0.0853","0.0894","","","","","","1.07","","","","has coordinates","210769","2020-10-21","18:00:00",""
"7102229","11.882","0.018","13.44","0.02","18.78","0.03","70.93","0.03","79.53","0.03","74.98","0.03","2722","7","300","2","300","2","","","","","","","","7","P -1","-P 1","2","","","","- C110 H158 Cu4 F12 N18 O26 S4 -","- C104 H144 Cu4 F12 N16 O24 S4 -","- C104 H144 Cu4 F12 N16 O24 S4 -","1","0.5","","Gómez, Laura; Company, Anna; Fontrodona, Xavier; Ribas, Xavi; Costas, Miquel","Self-assembling of nanoscopic molecular rectangles, extended helicates and porous-like materials based on macrocyclic dicopper building blocks under fine supramolecular control.","Chemical communications (Cambridge, England)","2007","","42","4410","4412","10.1039/b707508a","","","0.71073","MoKα","","0.1908","0.0836","","","0.1931","0.2266","","","","","","0.896","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102230","14.585","0.004","19.674","0.006","22.666","0.007","74.847","0.005","71.428","0.005","69.732","0.005","5699","3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C100 H131 Cl4 Cu4 N18 O27 -","- C88 H115 Cl4 Cu4 N12 O26 -","- C176 H230 Cl8 Cu8 N24 O52 -","2","1","","Gómez, Laura; Company, Anna; Fontrodona, Xavier; Ribas, Xavi; Costas, Miquel","Self-assembling of nanoscopic molecular rectangles, extended helicates and porous-like materials based on macrocyclic dicopper building blocks under fine supramolecular control.","Chemical communications (Cambridge, England)","2007","","42","4410","4412","10.1039/b707508a","","","0.71073","MoKα","","0.1653","0.091","","","0.2471","0.279","","","","","","1.012","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102231","47.459","0.006","10.841","0.0013","25.399","0.003","90","","108.066","0.002","90","","12424","3","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C106 H154 Cu4 F12 N18 O26 S4 -","- C100 H140 Cu4 F12 N16 O24 S4 -","- C400 H560 Cu16 F48 N64 O96 S16 -","4","0.5","","Gómez, Laura; Company, Anna; Fontrodona, Xavier; Ribas, Xavi; Costas, Miquel","Self-assembling of nanoscopic molecular rectangles, extended helicates and porous-like materials based on macrocyclic dicopper building blocks under fine supramolecular control.","Chemical communications (Cambridge, England)","2007","","42","4410","4412","10.1039/b707508a","","","0.71073","MoKα","","0.141","0.0748","","","0.1865","0.2078","","","","","","1.004","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102232","18.427","0.003","19.209","0.003","19.274","0.003","88.204","0.003","72.32","0.002","76.923","0.002","6326.4","1.7","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C230 H202 B4 Cl4 F96 Fe4 N12 O12 -","- C212 H158 B4 F96 Fe4 N12 O8 -","- C212 H158 B4 F96 Fe4 N12 O8 -","1","0.5","","Gómez, Laura; Company, Anna; Fontrodona, Xavier; Ribas, Xavi; Costas, Miquel","Self-assembling of nanoscopic molecular rectangles, extended helicates and porous-like materials based on macrocyclic dicopper building blocks under fine supramolecular control.","Chemical communications (Cambridge, England)","2007","","42","4410","4412","10.1039/b707508a","","","0.71073","MoKα","","0.093","0.0644","","","0.1799","0.1927","","","","","","1.081","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102233","36.414","0.011","11.889","0.004","25.772","0.008","90","","90","","90","","11158","6","100","2","100","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C88 H125 Cu4 F12 N12 O26.5 S4 -","- C88 H116 Cu4 F12 N12 O26.5 S4 -","- C352 H464 Cu16 F48 N48 O106 S16 -","4","1","","Gómez, Laura; Company, Anna; Fontrodona, Xavier; Ribas, Xavi; Costas, Miquel","Self-assembling of nanoscopic molecular rectangles, extended helicates and porous-like materials based on macrocyclic dicopper building blocks under fine supramolecular control.","Chemical communications (Cambridge, England)","2007","","42","4410","4412","10.1039/b707508a","","","0.71073","MoKα","","0.1837","0.0964","","","0.245","0.2962","","","","","","1.04","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102234","9.687","0.0003","11.477","0.0004","12.562","0.0005","108.25","0.05","93.06","0.05","93.8","0.05","1319.4","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H28 Fe2 O4 -","- C32 H28 Fe2 O4 -","- C64 H56 Fe4 O8 -","2","1","","Figueira-Duarte, Teresa M; Lloveras, Vega; Vidal-Gancedo, José; Gégout, Aline; Delavaux-Nicot, Béatrice; Welter, Richard; Veciana, Jaume; Rovira, Concepció; Nierengarten, Jean-François","Changes in electronic couplings of mixed-valence systems due to through-space intramolecular interactions.","Chemical communications (Cambridge, England)","2007","","42","4345","4347","10.1039/b707522g","","","0.71073","MoKα","","0.1234","0.0534","","","0.1263","0.1594","","","","","","0.99","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102235","7.022","0.007","7.332","0.008","38.75","0.04","90","","90","","90","","1995","4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H24 Br N3 O3 S2 -","- C16 H24 Br N3 O3 S2 -","- C64 H96 Br4 N12 O12 S8 -","4","1","","Xu, Dan Qian; Luo, Shu Ping; Wang, Yi Feng; Xia, Ai Bao; Yue, Hua Dong; Wang, Li Ping; Xu, Zhen Yuan","Organocatalysts wrapped around by poly(ethylene glycol)s (PEGs): a unique host-guest system for asymmetric Michael addition reactions.","Chemical communications (Cambridge, England)","2007","","42","4393","4395","10.1039/b708525g","","","0.71073","MoKα","","0.0869","0.0648","","","0.1477","0.1581","","","","","","0.918","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102236","7.715","0.0015","13.208","0.003","14.116","0.003","92.43","0.03","100.95","0.03","92.84","0.03","1408.5","0.5","253","2","253","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H56 Bi N5 O17 -","- C56 H52 Bi N5 O17 -","- C56 H52 Bi N5 O17 -","1","0.5","","Yang, Nan; Tanner, Julian A; Wang, Zai; Huang, Jian-Dong; Zheng, Bo-Jian; Zhu, Nianyong; Sun, Hongzhe","Inhibition of SARS coronavirus helicase by bismuth complexes.","Chemical communications (Cambridge, England)","2007","","42","4413","4415","10.1039/b709515e","","","0.71073","MoKα","","0.1113","0.0765","","","0.2175","0.2509","","","","","","1.073","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102237","10.3905","0.0012","12.33","0.002","12.5115","0.0015","81.871","0.007","89.204","0.007","81.639","0.007","1569.9","0.4","90","","90","","","","","","","","local laboratory","4","P -1","-P 1","2","","","","- C10 H16 B10 S2 -","- C10 H16 B10 S2 -","- C40 H64 B40 S8 -","4","2","","Hao, Erhong; Fabre, Bruno; Fronczek, Frank R; Vicente, M Graça H","Poly[di(2-thiophenyl)carborane]s: conducting polymers with high electrochemical and thermal resistance.","Chemical communications (Cambridge, England)","2007","","42","4387","4389","10.1039/b710375a","","","0.71073","MoKα","","0.074","0.047","","","0.112","0.124","","","","","","1.03","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102238","19.019","0.004","7.3765","0.001","13.17","0.003","90","","122.216","0.007","90","","1563.2","0.5","90","","90","","","","","","","","local laboratory","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H16 B10 S2 -","- C10 H16 B10 S2 -","- C40 H64 B40 S8 -","4","0.5","","Hao, Erhong; Fabre, Bruno; Fronczek, Frank R; Vicente, M Graça H","Poly[di(2-thiophenyl)carborane]s: conducting polymers with high electrochemical and thermal resistance.","Chemical communications (Cambridge, England)","2007","","42","4387","4389","10.1039/b710375a","","","0.71073","MoKα","","0.048","0.038","","","0.0973","0.103","","","","","","1.026","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102239","7.1753","0.001","7.3908","0.001","15.103","0.002","90","","102.266","0.006","90","","782.65","0.18","90","","90","","","","","","","","local laboratory","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H16 B10 S2 -","- C10 H16 B10 S2 -","- C20 H32 B20 S4 -","2","0.5","","Hao, Erhong; Fabre, Bruno; Fronczek, Frank R; Vicente, M Graça H","Poly[di(2-thiophenyl)carborane]s: conducting polymers with high electrochemical and thermal resistance.","Chemical communications (Cambridge, England)","2007","","42","4387","4389","10.1039/b710375a","","","0.71073","MoKα","","0.045","0.039","","","0.099","0.104","","","","","","1.051","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102240","28.071","0.005","17.472","0.005","6.2294","0.0013","90","","97.557","0.005","90","","3028.7","1.2","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H30 Ca O18 -","- C20 H30 Ca O18 -","- C80 H120 Ca4 O72 -","4","0.5","","Wang, Su-Na; Yang, Yong; Bai, Junfeng; Li, Yi-Zhi; Scheer, Manfred; Pan, Yi; You, Xiao-Zeng","An unprecedented nanoporous and fluorescent supramolecular framework with an SrAl2 topology controllably synthesized from a flexible ditopic acid.","Chemical communications (Cambridge, England)","2007","","42","4416","4418","10.1039/b710389a","","","0.71073","MoKα","","0.0834","0.0597","","","0.1375","0.1452","","","","","","1.069","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102241","17.0511","0.001","13.4111","0.0008","17.9625","0.0011","90","","104.289","0.001","90","","3980.5","0.4","130","0.2","130","0.2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H48 Fe4 N2 O10 S4 -","- C30 H28 Fe4 N2 O10 S4 -","- C120 H112 Fe16 N8 O40 S16 -","4","1","","Best, Stephen P; Borg, Stacey J; White, Jonathan M; Razavet, Mathieu; Pickett, Christopher J","On the structure of a proposed mixed-valent analogue of the diiron subsite of [FeFe]-hydrogenase.","Chemical communications (Cambridge, England)","2007","","42","4348","4350","10.1039/b712758h","","","0.71073","MoKα","","0.0369","0.0331","","","0.0989","0.1029","","","","","","1.07","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102242","9.6205","0.0003","13.8569","0.0005","16.7988","0.0006","90","","90","","90","","2239.45","0.13","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C26 H34 O2 -","- C26 H34 O2 -","- C104 H136 O8 -","4","0.5","","Spikes, Geoffrey H; Bill, Eckhard; Weyhermüller, Thomas; Wieghardt, Karl","Unusual mixed valent FeIIIFeII complex (St = 3/2) stabilised by a reduced bulky 1,2-diketone.","Chemical communications (Cambridge, England)","2007","","42","4339","4341","10.1039/b713062g","","","0.71073","MoKα","","0.0579","0.0426","","","0.101","0.1065","","","","","","1.037","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102243","38.156","0.002","50.415","0.003","15.8144","0.0008","90","","90","","90","","30421","3","100","2","100","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C70.5 H114 Br2 Fe2 Na O12 -","- C70.5 H114 Br2 Fe2 Na O12 -","- C1128 H1824 Br32 Fe32 Na16 O192 -","16","1","","Spikes, Geoffrey H; Bill, Eckhard; Weyhermüller, Thomas; Wieghardt, Karl","Unusual mixed valent FeIIIFeII complex (St = 3/2) stabilised by a reduced bulky 1,2-diketone.","Chemical communications (Cambridge, England)","2007","","42","4339","4341","10.1039/b713062g","","","0.71073","MoKα","","0.0882","0.0494","","","0.0872","0.099","","","","","","1.012","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102244","15.903","0.003","17.905","0.004","23.331","0.004","104.038","0.015","91.163","0.013","100.135","0.015","6330.5","1.9","150","2","150","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C63 H49 B F24 N2 O Pd -","- C63 H49 B F24 N2 O Pd -","- C252 H196 B4 F96 N8 O4 Pd4 -","4","2","","Carfagna, Carla; Gatti, Giuseppe; Mosca, Luca; Passeri, Alessandra; Paoli, Paola; Guerri, Annalisa","Stereocontrol mechanism in CO/p-methylstyrene copolymerisation catalysed by aryl-alpha-diimine Pd(II) complexes.","Chemical communications (Cambridge, England)","2007","","43","4540","4542","10.1039/b707107h","","","1.5414","CuKα","","0.0637","0.0521","","","0.1339","0.1438","","","","","","1.023","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102245","31.536","0.005","31.536","0.005","22.246","0.004","90","","90","","120","","19160","6","173","2","173","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C39 H65.67 Al N2 O4 S Si -","- C38.9998 H65.6662 Al N2 O4 S Si -","- C701.996 H1181.99 Al18 N36 O72 S18 Si18 -","18","1","","Jancik, Vojtech; Rascón-Cruz, Fernando; Cea-Olivares, Raymundo; Toscano, Rubén A","Soluble, reactive and stable - unique aluminosilicate ligands and a heterobimetallic derivative [LAl(SLi)(micro-O)Si(OLi.2thf)(OtBu)2]2.","Chemical communications (Cambridge, England)","2007","","43","4528","4530","10.1039/b707895a","","","0.71073","MoKα","","0.0853","0.0575","","","0.1251","0.1388","","","","","","1.016","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7102246","9.504","0.001","22.74","0.002","20.13","0.002","90","","90.87","0.02","90","","4350","0.7","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H69 Al N2 O6 Si -","- C41 H69 Al N2 O6 Si -","- C164 H276 Al4 N8 O24 Si4 -","4","1","","Jancik, Vojtech; Rascón-Cruz, Fernando; Cea-Olivares, Raymundo; Toscano, Rubén A","Soluble, reactive and stable - unique aluminosilicate ligands and a heterobimetallic derivative [LAl(SLi)(micro-O)Si(OLi.2thf)(OtBu)2]2.","Chemical communications (Cambridge, England)","2007","","43","4528","4530","10.1039/b707895a","","","0.71073","MoKα","","0.0852","0.0651","","","0.17","0.1846","","","","","","1.038","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102247","13.248","0.002","23.568","0.004","16.509","0.002","90","","100.91","0.03","90","","5061.4","1.3","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C94 H158 Al2 Li4 N4 O13 S2 Si2 -","- C94 H158 Al2 Li4 N4 O13 S2 Si2 -","- C188 H316 Al4 Li8 N8 O26 S4 Si4 -","2","0.5","","Jancik, Vojtech; Rascón-Cruz, Fernando; Cea-Olivares, Raymundo; Toscano, Rubén A","Soluble, reactive and stable - unique aluminosilicate ligands and a heterobimetallic derivative [LAl(SLi)(micro-O)Si(OLi.2thf)(OtBu)2]2.","Chemical communications (Cambridge, England)","2007","","43","4528","4530","10.1039/b707895a","","","0.71073","MoKα","","0.0882","0.0539","","","0.1162","0.1304","","","","","","1.013","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7102248","29.135","0.008","7.461","0.002","6.1111","0.0017","90","","90","","90","","1328.4","0.6","293","2","293","2","","","","","","","","5","P n c a","-P 2a 2n","60","Manganese carboxylate","","","- C14 H10 Mn2 N0 O7 -","- C14 H10 Mn2 O7 -","- C56 H40 Mn8 O28 -","4","0.5","","Mahata, Partha; Sundaresan, A; Natarajan, Srinivasan","The role of temperature on the structure and dimensionality of MOFs: an illustrative study of the formation of manganese oxy-bis(benzoate) structures.","Chemical communications (Cambridge, England)","2007","","43","4471","4473","10.1039/b708060c","","","0.71073","MoKα","","0.0893","0.0665","","","0.1183","0.1243","","","","","","1.292","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102249","16.902","0.006","10.506","0.004","9.062","0.003","90","","94.524","0.005","90","","1604.2","0.9","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Manganese carboxylate","","","- C14 H14 Mn N0 O9 -","- C14 H14 Mn O9 -","- C56 H56 Mn4 O36 -","4","1","","Mahata, Partha; Sundaresan, A; Natarajan, Srinivasan","The role of temperature on the structure and dimensionality of MOFs: an illustrative study of the formation of manganese oxy-bis(benzoate) structures.","Chemical communications (Cambridge, England)","2007","","43","4471","4473","10.1039/b708060c","","","0.71073","MoKα","","0.0511","0.0444","","","0.1133","0.118","","","","","","1.031","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102250","14.399","0.003","6.3626","0.0015","7.3555","0.0018","90","","102.867","0.004","90","","657","0.3","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","Manganese carboxylate","","","- C14 H10 Mn N0 O6 -","- C14 H10 Mn O6 -","- C28 H20 Mn2 O12 -","2","0.5","","Mahata, Partha; Sundaresan, A; Natarajan, Srinivasan","The role of temperature on the structure and dimensionality of MOFs: an illustrative study of the formation of manganese oxy-bis(benzoate) structures.","Chemical communications (Cambridge, England)","2007","","43","4471","4473","10.1039/b708060c","","","0.71073","MoKα","","0.0524","0.0384","","","0.0814","0.0868","","","","","","1.068","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102251","6.9647","0.0009","7.2634","0.001","23.219","0.003","90","","90","","90","","1174.6","0.3","296.1","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H20 O2 -","- C12 H20 O2 -","- C48 H80 O8 -","4","1","","Kimura, Masanari; Mori, Masahiko; Tamaru, Yoshinao","Palladium-catalyzed 1,3-diol fragmentation: synthesis of omega-dienyl aldehydes.","Chemical communications (Cambridge, England)","2007","","43","4504","4506","10.1039/b708526e","","","0.7107","MoKα","","","0.0491","","","","0.1066","","","","","","0.815","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102252","11.4552","0.0009","9.839","0.0007","11.7723","0.001","90","","107.632","0.001","90","","1264.5","0.17","296.1","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C13 H22 O2 -","- C13 H22 O2 -","- C52 H88 O8 -","4","2","","Kimura, Masanari; Mori, Masahiko; Tamaru, Yoshinao","Palladium-catalyzed 1,3-diol fragmentation: synthesis of omega-dienyl aldehydes.","Chemical communications (Cambridge, England)","2007","","43","4504","4506","10.1039/b708526e","","","0.7107","MoKα","","","0.0578","","","","0.138","","","","","","0.942","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102253","13.149","0.005","9.299","0.004","16.145","0.006","90","","100.17","0.03","90","","1943.1","1.3","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H54 B4 Li2 N8 O2 -","- C38 H54 B4 Li2 N8 O2 -","- C76 H108 B8 Li4 N16 O4 -","2","0.5","","Ly, Hanh V; Tuononen, Heikki M; Parvez, Masood; Roesler, Roland","Assembly of a planar, tricyclic B4N8 framework with s-indacene structure.","Chemical communications (Cambridge, England)","2007","","43","4522","4524","10.1039/b709270a","","","0.71073","MoKα","","0.0727","0.0469","","","0.1072","0.1255","","","","","","1.018","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102254","7.24","0.003","9.157","0.006","16.983","0.012","75.88","0.03","83.19","0.04","76.55","0.04","1059.7","1.1","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H28 B4 N8 -","- C18 H28 B4 N8 -","- C36 H56 B8 N16 -","2","1","","Ly, Hanh V; Tuononen, Heikki M; Parvez, Masood; Roesler, Roland","Assembly of a planar, tricyclic B4N8 framework with s-indacene structure.","Chemical communications (Cambridge, England)","2007","","43","4522","4524","10.1039/b709270a","","","0.71073","MoKα","","0.069","0.0459","","","0.127","0.1464","","","","","","1.013","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102255","16.565","0.01","12.021","0.008","9.812","0.006","90","","91.81","0.02","90","","1953","2","100","2","100","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C20 H19 Cl N2 O4 -","- C20 H19 Cl N2 O4 -","- C80 H76 Cl4 N8 O16 -","4","1","","Liang, Yuxue; Rowland, Emily B; Rowland, Gerald B; Perman, Jason A; Antilla, Jon C","VAPOL phosphoric acid catalysis: the highly enantioselective addition of imides to imines.","Chemical communications (Cambridge, England)","2007","","43","4477","4479","10.1039/b709276h","","","0.71073","MoKα","","0.0818","0.0764","","","0.1869","0.193","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102256","16.534","0.006","12.015","0.004","9.785","0.004","90","","91.86","0.006","90","","1942.7","1.2","100","2","100","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C20 H19 Cl N2 O4 -","- C20 H19 Cl N2 O4 -","- C80 H76 Cl4 N8 O16 -","4","1","","Liang, Yuxue; Rowland, Emily B; Rowland, Gerald B; Perman, Jason A; Antilla, Jon C","VAPOL phosphoric acid catalysis: the highly enantioselective addition of imides to imines.","Chemical communications (Cambridge, England)","2007","","43","4477","4479","10.1039/b709276h","","","0.71073","MoKα","","0.0792","0.0644","","","0.1554","0.1688","","","","","","0.848","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102257","22.7195","0.0017","16.3813","0.0009","18.0772","0.001","90","","127.92","0.006","90","","5307.4","0.7","294","","294","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C48 H68 F4 N2 P4 Pd2 Zn -","- C48 H68 F4 N2 P4 Pd2 Zn -","- C192 H272 F16 N8 P16 Pd8 Zn4 -","4","0.5","","Fafard, Claudia M; Chen, Chun-Hsing; Foxman, Bruce M; Ozerov, Oleg V","Covalent palladium-zinc bonds and their reactivity.","Chemical communications (Cambridge, England)","2007","","43","4465","4467","10.1039/b709364k","","","0.71073","MoKα","","0.1036","0.0395","","0.0666","0.034","0.034","","","","","","1.1387","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102258","9.6521","0.0007","12.1376","0.0009","15.95","0.0011","94.662","0.002","91.022","0.002","100.029","0.002","1833","0.2","132","2","132","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H54 B N Ni O3 P2 -","- C36 H54 B N Ni O3 P2 -","- C72 H108 B2 N2 Ni2 O6 P4 -","2","1","","Adhikari, Debashis; Huffman, John C; Mindiola, Daniel J","Structural elucidation of a nickel boryl complex. A recyclable borylation Ni(II) reagent of bromobenzene.","Chemical communications (Cambridge, England)","2007","","43","4489","4491","10.1039/b709832d","","","0.71073","MoKα","","0.0473","0.0304","","","0.0765","0.0842","","","","","","0.975","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102259","10.934","0.001","20.635","0.002","18.842","0.002","90","","100.24","0.02","90","","4183.5","0.8","293","","293","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C33.81 H45.81 Cl7.43 N4 Ni O3 -","- C33.81 H45.81 Cl7.43 N4 Ni O3 -","- C135.24 H183.24 Cl29.72 N16 Ni4 O12 -","4","1","","Rotthaus, Olaf; Jarjayes, Olivier; Perez Del Valle, Carlos; Philouze, Christian; Thomas, Fabrice","A versatile electronic hole in one-electron oxidized NiIIbis-salicylidene phenylenediamine complexes.","Chemical communications (Cambridge, England)","2007","","43","4462","4464","10.1039/b710027b","","","0.71073","MoKα","","0.0619","0.0619","","0.0754","","0.0754","","","1.943","","","1.943","","","","has coordinates","193994","2020-10-21","18:00:00",""
"7102260","28.712","0.003","28.712","0.003","26.128","0.003","90","","90","","120","","18654","4","173","2","173","2","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","","- C87 H121 Cd7 N13 O35 -","- C66 H72 Cd7 N6 O28 -","- C396 H432 Cd42 N36 O168 -","6","0.166667","","Frischmann, Peter D; MacLachlan, Mark J","Capsule formation in novel cadmium cluster metallocavitands.","Chemical communications (Cambridge, England)","2007","","43","4480","4482","10.1039/b710809e","","","0.71069","MoKα","","0.102","0.0665","","","0.1706","0.1847","","","","","","1.003","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102261","9.2494","0.0004","11.4145","0.0005","13.6288","0.0006","77.744","0.001","80.155","0.001","68.041","0.001","1297.41","0.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H34 N O2 P Sn2 -","- C22 H34 N O2 P Sn2 -","- C44 H68 N2 O4 P2 Sn4 -","2","1","","López, Jesús García; Fernández, Ignacio; Ruiz, Manuel Serrano; Ortiz, Fernando López","C(alpha),C(ortho)-Dimetalated phosphazene complexes.","Chemical communications (Cambridge, England)","2007","","44","4674","4676","10.1039/b707320h","","","0.71069","MoKα","","0.0373","0.0337","","","0.0869","0.0893","","","","","","1.081","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102262","10.5943","0.0018","13.159","0.002","15.941","0.003","67.929","0.002","86.02","0.002","76.438","0.002","2001.6","0.6","198","1","198","1","","","","","","","","7","P -1","-P 1","2","","","","- C30 H53 F6 N O6 P4 S2 -","- C30 H53 F6 N O6 P4 S2 -","- C60 H106 F12 N2 O12 P8 S4 -","2","1","","Riegel, Susanne D; Burford, Neil; Lumsden, Michael D; Decken, Andreas","Synthesis and characterization of elusive cyclo-di- and -tri-phosphino-1,3-diphosphonium salts: fundamental frameworks in catena-organophosphorus chemistry.","Chemical communications (Cambridge, England)","2007","","44","4668","4670","10.1039/b707741f","","x-ray","0.71073","MoKα","","0.0564","0.0414","","","0.1035","0.118","","","","","","1.033","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102263","7.925","0.006","11.951","0.01","16.193","0.015","72.451","0.016","78.848","0.011","84.629","0.012","1434","2","173","1","173","1","","","","","","","","6","P -1","-P 1","2","","","","- C19 H25 F6 O6 P5 S2 -","- C19 H25 F6 O6 P5 S2 -","- C38 H50 F12 O12 P10 S4 -","2","1","","Riegel, Susanne D; Burford, Neil; Lumsden, Michael D; Decken, Andreas","Synthesis and characterization of elusive cyclo-di- and -tri-phosphino-1,3-diphosphonium salts: fundamental frameworks in catena-organophosphorus chemistry.","Chemical communications (Cambridge, England)","2007","","44","4668","4670","10.1039/b707741f","","x-ray","0.71073","MoKα","","0.0968","0.0646","","","0.1926","0.2079","","","","","","1.068","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102264","11.716","0.007","9.356","0.006","18.017","0.011","90","","92.307","0.009","90","","1973","2","173","1","173","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C29 H53 F6 O6 P5 S2 -","- C29 H53 F6 O6 P5 S2 -","- C58 H106 F12 O12 P10 S4 -","2","1","","Riegel, Susanne D; Burford, Neil; Lumsden, Michael D; Decken, Andreas","Synthesis and characterization of elusive cyclo-di- and -tri-phosphino-1,3-diphosphonium salts: fundamental frameworks in catena-organophosphorus chemistry.","Chemical communications (Cambridge, England)","2007","","44","4668","4670","10.1039/b707741f","","x-ray","0.71073","MoKα","","0.0835","0.0637","","","0.1538","0.1729","","","","","","1.076","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102265","15.7625","0.0011","16.9028","0.0011","24.0359","0.0016","90","","100.974","0.001","90","","6286.8","0.7","293","2","293","2","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H82 Cl5 N4 P5 Re6 Se8 -","- C34 H75 Cl5 N4 P5 Re6 Se8 -","- C136 H300 Cl20 N16 P20 Re24 Se32 -","4","1","","Szczepura, Lisa F; Oh, Meghan K; Knott, Stanley A","Synthesis and electrochemical study of the first tetrazolate hexanuclear rhenium cluster complex.","Chemical communications (Cambridge, England)","2007","","44","4617","4619","10.1039/b708390d","","x-ray","0.71073","MoKα","","0.0683","0.037","","","0.1031","0.1195","","","","","","1.054","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102266","9.677","0.006","13.617","0.01","21.66","0.015","90","","90","","90","","2854","3","170","2","170","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C24 H22 F6 Mn N4 O6 S2 -","- C24 H22 F6 Mn N4 O6 S2 -","- C96 H88 F24 Mn4 N16 O24 S8 -","4","1","","Nehru, Kasi; Kim, Soo Jeong; Kim, In Young; Seo, Mi Sook; Kim, Youngmee; Kim, Sung-Jin; Kim, Jinheung; Nam, Wonwoo","A highly efficient non-heme manganese complex in oxygenation reactions.","Chemical communications (Cambridge, England)","2007","","44","4623","4625","10.1039/b708976g","","","0.71073","MoKα","","0.1472","0.0483","","","0.0737","0.0966","","","","","","0.807","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102267","13.0888","0.0008","4.5837","0.0003","15.0058","0.001","90","","99.515","0.004","90","","887.89","0.1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H24 Cl2 N4 O4 -","- C14 H24 Cl2 N4 O4 -","- C28 H48 Cl4 N8 O8 -","2","0.5","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Kyritsakas, Nathalie","Molecular tectonics: polymorphism and enhancement of network dimensionality by a combination of primary and secondary hydrogen bond sites.","Chemical communications (Cambridge, England)","2007","","44","4626","4628","10.1039/b708997j","","","0.71073","MoKα","","0.0541","0.0344","","","0.0813","0.0879","","","","","","1.026","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102268","4.6008","0.0004","10.3677","0.001","10.6835","0.001","110.61","0.002","99.751","0.002","90.156","0.002","469.02","0.08","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H20 N8 Ni O2 -","- C18 H20 N8 Ni O2 -","- C18 H20 N8 Ni O2 -","1","0.5","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Kyritsakas, Nathalie","Molecular tectonics: polymorphism and enhancement of network dimensionality by a combination of primary and secondary hydrogen bond sites.","Chemical communications (Cambridge, England)","2007","","44","4626","4628","10.1039/b708997j","","","0.71073","MoKα","","0.0476","0.0358","","","0.0854","0.106","","","","","","1.113","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102269","4.6215","0.0002","10.527","0.0004","10.8108","0.0004","111.288","0.002","99.763","0.002","89.328","0.002","482.25","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H20 N8 O2 Pd -","- C18 H20 N8 O2 Pd -","- C18 H20 N8 O2 Pd -","1","0.5","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Kyritsakas, Nathalie","Molecular tectonics: polymorphism and enhancement of network dimensionality by a combination of primary and secondary hydrogen bond sites.","Chemical communications (Cambridge, England)","2007","","44","4626","4628","10.1039/b708997j","","","0.71073","MoKα","","0.0258","0.0247","","","0.0678","0.0695","","","","","","1.064","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102270","4.6482","0.0002","10.4381","0.0005","10.8458","0.0004","111.019","0.001","99.3081","0.001","88.85","0.002","484.32","0.04","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H20 N8 O2 Pt -","- C18 H20 N8 O2 Pt -","- C18 H20 N8 O2 Pt -","1","0.5","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Kyritsakas, Nathalie","Molecular tectonics: polymorphism and enhancement of network dimensionality by a combination of primary and secondary hydrogen bond sites.","Chemical communications (Cambridge, England)","2007","","44","4626","4628","10.1039/b708997j","","","0.71073","MoKα","","0.0176","0.0176","","","0.0385","0.0385","","","","","","1.054","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102271","10.0141","0.0003","10.7311","0.0004","10.7497","0.0004","67.893","0.002","69.08","0.002","69.861","0.002","969.85","0.06","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H20 N8 O2 Pt -","- C18 H20 N8 O2 Pt -","- C36 H40 N16 O4 Pt2 -","2","1","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Kyritsakas, Nathalie","Molecular tectonics: polymorphism and enhancement of network dimensionality by a combination of primary and secondary hydrogen bond sites.","Chemical communications (Cambridge, England)","2007","","44","4626","4628","10.1039/b708997j","","","0.71073","MoKα","","0.0797","0.0356","","","0.0711","0.0784","","","","","","1.071","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102272","9.5275","0.0019","14.801","0.003","19.63","0.004","89.906","0.004","77.076","0.004","88.648","0.004","2697.2","0.9","163","2","163","2","","","","","","","","4","P -1","-P 1","2","","","","- C59 H94 B2 Y2 -","- C59 H94 B2 Y2 -","- C118 H188 B4 Y4 -","2","1","","Evans, William J; Lorenz, Sara E; Ziller, Joseph W","Yttrium metallocene borane chemistry: isolation of 9-BBN substitution and coordination complexes in a single crystal, {(C(5)Me(5))(2)Y[eta(3)-C(3)H(4)(BC(8)H(14))]} and {(C(5)Me(5))(2)Y(micro-H)(2)BC(8)H(14)}.","Chemical communications (Cambridge, England)","2007","","44","4662","4664","10.1039/b709841c","","","0.71073","MoKα","","0.0866","0.061","","","0.1465","0.156","","","","","","1.113","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7102273","9.5382","0.0017","14.957","0.003","23.021","0.004","90","","91.399","0.003","90","","3283.2","1","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Manganese(ii) 2,3,5,6-Tetrafluoro-7,7,8,8- Tetracyanoquinodimethane","","","- C51 H61 F12 Mn2 N12 O15.5 -","- C50.994 H61 F12 Mn2 N12 O15.5 -","- C101.988 H122 F24 Mn4 N24 O31 -","2","0.5","","Lopez, Nazario; Zhao, Hanhua; Prosvirin, Andrey V; Chouai, Abdellatif; Shatruk, Michael; Dunbar, Kim R","Conversion of a porous material based on a Mn(II)-TCNQF(4) honeycomb net to a molecular magnet upon desolvation.","Chemical communications (Cambridge, England)","2007","","44","4611","4613","10.1039/b710149j","","","0.71073","MoKα","","0.1269","0.0768","","","0.1605","0.1827","","","","","","1.057","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102274","10.872","0.004","12.643","0.005","18.914","0.008","99.381","0.005","101.844","0.006","97.875","0.006","2471.1","1.7","173","1","173","1","","","","","","","","8","P -1","-P 1","2","","","","- C35 H44 Cl6 F6 N6 O6 P2 S2 -","- C35 H44 Cl6 F6 N6 O6 P2 S2 -","- C70 H88 Cl12 F12 N12 O12 P4 S4 -","2","1","","Davidson, Reagan J; Weigand, Jan J; Burford, Neil; Cameron, T Stanley; Decken, Andreas; Werner-Zwanziger, Ulrike","Bifunctional diphosphorus Lewis acids from cyclodiphosphadiazanes.","Chemical communications (Cambridge, England)","2007","","44","4671","4673","10.1039/b710853b","","x-ray","0.71073","MoKα","","0.1179","0.0672","","","0.1744","0.2139","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102275","12.985","0.004","10.925","0.003","18.101","0.006","90","","93.012","0.004","90","","2564.2","1.4","173","1","173","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 F6 N2 O6 P2 S2 -","- C18 H18 F6 N2 O6 P2 S2 -","- C72 H72 F24 N8 O24 P8 S8 -","4","1","","Davidson, Reagan J; Weigand, Jan J; Burford, Neil; Cameron, T Stanley; Decken, Andreas; Werner-Zwanziger, Ulrike","Bifunctional diphosphorus Lewis acids from cyclodiphosphadiazanes.","Chemical communications (Cambridge, England)","2007","","44","4671","4673","10.1039/b710853b","","x-ray","0.71073","MoKα","","0.0613","0.0452","","","0.1121","0.1288","","","","","","1.043","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102276","8.871","0.003","11.269","0.004","16.513","0.006","75.406","0.005","81.369","0.005","86.308","0.005","1578.9","0.9","173","1","173","1","","","","","","","","7","P -1","-P 1","2","","","","- C25 H28 F6 N4 O6 P2 S2 -","- C25 H28 F6 N4 O6 P2 S2 -","- C50 H56 F12 N8 O12 P4 S4 -","2","1","","Davidson, Reagan J; Weigand, Jan J; Burford, Neil; Cameron, T Stanley; Decken, Andreas; Werner-Zwanziger, Ulrike","Bifunctional diphosphorus Lewis acids from cyclodiphosphadiazanes.","Chemical communications (Cambridge, England)","2007","","44","4671","4673","10.1039/b710853b","","x-ray","0.71073","MoKα","","0.0713","0.0446","","","0.1096","0.1283","","","","","","1.043","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102277","10.3471","0.0006","14.3075","0.0006","11.377","0.0006","90","","103.427","0.003","90","","1638.23","0.15","123.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H36 F6 N2 O6 P4 S2 -","- C24 H36 F6 N2 O6 P4 S2 -","- C48 H72 F12 N4 O12 P8 S4 -","2","0.5","","Davidson, Reagan J; Weigand, Jan J; Burford, Neil; Cameron, T Stanley; Decken, Andreas; Werner-Zwanziger, Ulrike","Bifunctional diphosphorus Lewis acids from cyclodiphosphadiazanes.","Chemical communications (Cambridge, England)","2007","","44","4671","4673","10.1039/b710853b","","","0.7107","MoKα","","","0.0334","","","","0.0419","","","","","","0.962","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102278","26.712","0.004","26.712","0.004","15.919","0.003","90","","90","","120","","9837","3","133","2","133","2","","","","","","","","5","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C31 H38 Cd N3 O8 -","- C21 H12 Cd O6 -","- C252 H144 Cd12 O72 -","12","1","","Hao, Xiang-Rong; Wang, Xin-Long; Qin, Chao; Su, Zhong-Min; Wang, En-Bo; Lan, Ya-Qian; Shao, Kui-Zhan","A 3D chiral nanoporous coordination framework consisting of homochiral nanotubes assembled from octuple helices.","Chemical communications (Cambridge, England)","2007","","44","4620","4622","10.1039/b711405b","","","0.71073","MoKα","","0.0783","0.0384","","","0.0798","0.0848","","","","","","1.047","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102279","22.22","0.004","28.467","0.006","9.5966","0.0019","90","","90","","90","","6070","2","100","2","100","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C16 H52 B8 N12 -","- C16 H52 B8 N12 -","- C128 H416 B64 N96 -","8","0.5","","Bramham, George; Charmant, Jonathan P H; Cook, Alistair J R; Norman, Nicholas C; Russell, Christopher A; Saithong, Saowanit","A new cyclic borazine species B(8)(NH)(4)(NMe(2))(8) containing a twelve-membered B(8)N(4) ring.","Chemical communications (Cambridge, England)","2007","","44","4605","4607","10.1039/b711487g","","x-ray","0.71074","MoKα","","0.0547","0.0527","","","0.1246","0.1256","","","","","","1.18","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102280","11.219","0.0002","13.882","0.0002","35.5411","0.0005","90","","90.544","0.001","90","","5535","0.15","100","2","100","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C74 F42 -","- C74 F42 -","- C296 F168 -","4","1","","Omelyanyuk, Nadezhda A; Goryunkov, Alexey A; Tamm, Nadezhda B; Avdoshenko, Stanislav M; Ioffe, Ilya N; Sidorov, Lev N; Kemnitz, Erhard; Troyanov, Sergey I","New trifluoromethylated derivatives of [60]fullerene, C60(CF3)n with n = 12 and 14.","Chemical communications (Cambridge, England)","2007","","45","4794","4796","10.1039/b709684d","","","0.91","synchrotron","","0.1761","0.1517","","","0.3491","0.3577","","","","","","1.209","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102281","11.118","0.0003","11.1525","0.0003","12.2892","0.0003","69.872","0.001","70.133","0.001","76.892","0.001","1335.12","0.06","100","2","100","2","","","","","","","","2","P 1","P 1","1","","","","- C74 F42 -","- C74 F42 -","- C74 F42 -","1","1","","Omelyanyuk, Nadezhda A; Goryunkov, Alexey A; Tamm, Nadezhda B; Avdoshenko, Stanislav M; Ioffe, Ilya N; Sidorov, Lev N; Kemnitz, Erhard; Troyanov, Sergey I","New trifluoromethylated derivatives of [60]fullerene, C60(CF3)n with n = 12 and 14.","Chemical communications (Cambridge, England)","2007","","45","4794","4796","10.1039/b709684d","","","0.905","synchrotron","","0.0735","0.072","","","0.1806","0.1871","","","","","","1.067","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102282","17.2319","0.0005","16.5102","0.0003","17.688","0.0005","90","","90","","90","","5032.3","0.2","100","2","100","2","","","","","","","","2","P b c a","-P 2ac 2ab","61","","","","- C72 F36 -","- C72 F35.982 -","- C288 F143.928 -","4","0.5","","Omelyanyuk, Nadezhda A; Goryunkov, Alexey A; Tamm, Nadezhda B; Avdoshenko, Stanislav M; Ioffe, Ilya N; Sidorov, Lev N; Kemnitz, Erhard; Troyanov, Sergey I","New trifluoromethylated derivatives of [60]fullerene, C60(CF3)n with n = 12 and 14.","Chemical communications (Cambridge, England)","2007","","45","4794","4796","10.1039/b709684d","","","0.905","synchrotron","","0.1047","0.0952","","","0.2133","0.2316","","","","","","1.238","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102283","19.224","0.004","18.899","0.004","23.297","0.005","90","","109.599","0.002","90","","7974","3","148","2","148","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C59.5 H142 N6 P4 Si4 Ti2 -","- C59.5 H124 N6 P4 Si4 Ti2 -","- C238 H496 N24 P16 Si16 Ti8 -","4","1","","Chomitz, Wayne A; Arnold, John","Transition metal dinitrogen complexes supported by a versatile monoanionic [N2P2] ligand.","Chemical communications (Cambridge, England)","2007","","45","4797","4799","10.1039/b709763h","","","0.71073","MoKα","","0.1506","0.0578","","","0.1176","0.1431","","","","","","0.981","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102284","11.6476","0.0011","18.0559","0.0018","13.3821","0.0013","90","","102.055","0.001","90","","2752.3","0.5","154","2","154","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H51 Fe N3 P2 Si -","- C22 H51 Fe N3 P2 Si -","- C88 H204 Fe4 N12 P8 Si4 -","4","1","","Chomitz, Wayne A; Arnold, John","Transition metal dinitrogen complexes supported by a versatile monoanionic [N2P2] ligand.","Chemical communications (Cambridge, England)","2007","","45","4797","4799","10.1039/b709763h","","","0.71073","MoKα","","0.0417","0.0331","","","0.0909","0.0936","","","","","","1.576","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102285","11.956","0.002","12.07","0.003","12.438","0.002","111.752","0.004","110.138","0.003","100.111","0.003","1467.6","0.5","151","2","151","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H51 Cl N3 P2 Si Zr -","- C22 H51 Cl N3 P2 Si Zr -","- C44 H102 Cl2 N6 P4 Si2 Zr2 -","2","1","","Chomitz, Wayne A; Arnold, John","Transition metal dinitrogen complexes supported by a versatile monoanionic [N2P2] ligand.","Chemical communications (Cambridge, England)","2007","","45","4797","4799","10.1039/b709763h","","","0.71073","MoKα","","0.1144","0.0651","","","0.1336","0.1487","","","","","","1.081","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102286","18.381","0.002","15.4611","0.0017","19.772","0.002","90","","90","","90","","5619","1.1","151","2","151","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C22 H51 Mn N3 P2 Si -","- C22 H44 Mn N3 P2 Si -","- C176 H352 Mn8 N24 P16 Si8 -","8","1","","Chomitz, Wayne A; Arnold, John","Transition metal dinitrogen complexes supported by a versatile monoanionic [N2P2] ligand.","Chemical communications (Cambridge, England)","2007","","45","4797","4799","10.1039/b709763h","","","0.71073","MoKα","","0.0907","0.0534","","","0.1263","0.1382","","","","","","1.19","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102287","21.3675","0.001","21.3675","0.001","27.279","0.003","90","","90","","120","","10786.1","1.3","100","2","100","2","","","","","","","","7","P 31 2 1","P 31 2""","152","","","","- C156 H112 Ag4 F24 N4 O8 Sb4 -","- C156 H112 Ag4 F24 N4 O8 Sb4 -","- C468 H336 Ag12 F72 N12 O24 Sb12 -","3","0.5","","Sun, Yan-Qiong; He, Jun; Xu, Zhengtao; Huang, Guo; Zhou, Xiao-Ping; Zeller, Matthias; Hunter, Allen D","Centripetal molecules as multifunctional building blocks for coordination networks.","Chemical communications (Cambridge, England)","2007","","45","4779","4781","10.1039/b709942h","","","0.71073","MoKα","","0.0685","0.0654","","","0.1626","0.1662","","","","","","1.233","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102288","21.4042","0.0008","21.4042","0.0008","21.408","0.0016","90","","90","","90","","9807.9","0.9","100","2","100","2","","","","","","","","7","I -4 2 d","I -4 2bw","122","","","","- C54 H32 Ag F6 N2 S4 Sb -","- C54 H32 Ag F6 N2 S4 Sb -","- C432 H256 Ag8 F48 N16 S32 Sb8 -","8","0.5","","Sun, Yan-Qiong; He, Jun; Xu, Zhengtao; Huang, Guo; Zhou, Xiao-Ping; Zeller, Matthias; Hunter, Allen D","Centripetal molecules as multifunctional building blocks for coordination networks.","Chemical communications (Cambridge, England)","2007","","45","4779","4781","10.1039/b709942h","","","0.71073","MoKα","","0.07","0.0497","","","0.1116","0.1193","","","","","","1.065","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102289","20.2125","0.0013","19.3904","0.0013","23.8068","0.0016","90","","114.518","0.001","90","","8489.2","1","115","2","115","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C63 H96 N4 O28 Pd8 -","- C63 H96 N4 O28 Pd8 -","- C252 H384 N16 O112 Pd32 -","4","1","","Stromnova, Tatiana A; Shishilov, Oleg N; Churakov, Andrei V; Kuz'mina, Lyudmila G; Howard, Judith A K","NO-disproportionation, promoted by Pd-cluster: formation and X-ray structure of Pd8(micro-CO)4(micro-OOCCMe3)8[micro-N(=O)O-]4.","Chemical communications (Cambridge, England)","2007","","45","4800","4802","10.1039/b710230e","","","0.71073","MoKα","","0.0814","0.0513","","","0.127","0.1394","","","","","","1.01","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102290","23.985","0.01","15.436","0.006","17.782","0.007","90","","102.815","0.008","90","","6420","4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C55 H65 F12 N3 O16 S2 -","- C55 H59 F12 N3 O16 S2 -","- C220 H236 F48 N12 O64 S8 -","4","1","","Vella, Sarah J; Tiburcio, Jorge; Loeb, Stephen J","Optically sensed, molecular shuttles driven by acid-base chemistry.","Chemical communications (Cambridge, England)","2007","","45","4752","4754","10.1039/b710708k","","","0.71073","MoKα","","0.2993","0.1189","","","0.3152","0.4122","","","","","","0.969","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102291","14.48037","0.00028","14.48037","","9.24483","0.0003","90","","90","","120","","1678.76","0.08","298","","298","","","","","","","","","4","R -3 :H","-R 3","148","","Dilithium borohydride amide","","- B H6 Li2 N -","- B H6 Li2 N -","- B18 H108 Li36 N18 -","18","1","","Chater, Philip A; David, William I F; Anderson, Paul A","Synthesis and structure of the new complex hydride Li2BH4NH2.","Chemical communications (Cambridge, England)","2007","","45","4770","4772","10.1039/b711111h","powder diffraction","","0.80162","Synchrotron","","","","","","","","","","","","","","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102292","17.5364","0.0003","17.7901","0.0003","21.6203","0.0005","90","","103.958","0.0008","90","","6545.8","0.2","90","0.2","90","0.2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C40 H46 O4 -","- C40 H46 O4 -","- C320 H368 O32 -","8","2","","Anthony, John E; Gierschner, Johannes; Landis, Chad A; Parkin, Sean R; Sherman, Jes B; Bakus Ii, Ronald C","A new functionalization strategy for pentacene.","Chemical communications (Cambridge, England)","2007","","45","4746","4748","10.1039/b711296c","","","0.71073","MoKα","","0.1993","0.0609","","","0.1152","0.1585","","","","","","0.927","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102293","16.8238","0.0005","6.9549","0.0002","42.3258","0.0014","90","","90","","90","","4952.5","0.3","90","0.2","90","0.2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C34 H30 O4 -","- C34 H30 O4 -","- C272 H240 O32 -","8","1","","Anthony, John E; Gierschner, Johannes; Landis, Chad A; Parkin, Sean R; Sherman, Jes B; Bakus Ii, Ronald C","A new functionalization strategy for pentacene.","Chemical communications (Cambridge, England)","2007","","45","4746","4748","10.1039/b711296c","","","1.54178","CuKα","","0.0824","0.0648","","","0.1514","0.1639","","","","","","1.044","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102294","13.0667","0.0008","26.6002","0.0017","29.0855","0.0018","90","","104.976","0.003","90","","9766.1","1.1","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C96 H74 Cl4 N24 Ni2 O10 Zn3 -","- C96 H74 Cl4 N24 Ni2 O10 Zn3 -","- C384 H296 Cl16 N96 Ni8 O40 Zn12 -","4","1","","Feng, Sisi; Zhu, Miaoli; Lu, Liping; Guo, Maolin","Single-crystal metal‒organic microtubes self-assembled from designed D3 symmetrical nanoclusters with a capped triple-helix pentanuclear M5O6 core.","Chemical communications (Cambridge, England)","2007","","45","4785","4787","10.1039/b711695k","","","0.71073","MoKα","","0.207","0.0888","","","0.2209","0.2724","","","","","","0.929","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102295","13.259","0.005","26.875","0.01","28.993","0.009","90","","105.483","0.014","90","","9956","6","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C96 H74 Cl4 Cu1.43 N24 Ni4.57 O10.5 -","- C96 H74 Cl4 Cu1.43 N24 Ni4.57 O10.5 -","- C384 H296 Cl16 Cu5.72 N96 Ni18.28 O42 -","4","1","","Feng, Sisi; Zhu, Miaoli; Lu, Liping; Guo, Maolin","Single-crystal metal‒organic microtubes self-assembled from designed D3 symmetrical nanoclusters with a capped triple-helix pentanuclear M5O6 core.","Chemical communications (Cambridge, England)","2007","","45","4785","4787","10.1039/b711695k","","","0.71073","MoKα","","0.2948","0.0783","","","0.1851","0.218","","","","","","0.67","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102296","13.1351","0.0011","26.668","0.002","29.0984","0.0019","90","","105.009","0.003","90","","9845.1","1.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C96 H74 Cl4 N24 Ni5 O10 -","- C96 H74 Cl4 N24 Ni5 O10 -","- C384 H296 Cl16 N96 Ni20 O40 -","4","1","","Feng, Sisi; Zhu, Miaoli; Lu, Liping; Guo, Maolin","Single-crystal metal‒organic microtubes self-assembled from designed D3 symmetrical nanoclusters with a capped triple-helix pentanuclear M5O6 core.","Chemical communications (Cambridge, England)","2007","","45","4785","4787","10.1039/b711695k","","","0.71073","MoKα","","0.0518","0.0518","","","0.1996","0.1996","","","","","","1.042","","","","has coordinates,has disorder","180124","2020-10-21","18:00:00",""
"7102297","8.868","0.0013","9.2552","0.0014","11.7022","0.0014","101.406","0.002","93.315","0.012","94.983","0.002","935.2","0.2","220","2","220","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H15 N5 -","- C22 H15 N5 -","- C44 H30 N10 -","2","1","","Kivala, Milan; Boudon, Corinne; Gisselbrecht, Jean-Paul; Seiler, Paul; Gross, Maurice; Diederich, François","A novel reaction of 7,7,8,8-tetracyanoquinodimethane (TCNQ): charge-transfer chromophores by [2 + 2] cycloaddition with alkynes.","Chemical communications (Cambridge, England)","2007","","45","4731","4733","10.1039/b713683h","","","0.7107","MoKα","","0.0567","0.0452","","","0.1192","0.1282","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102298","11.1429","0.0014","16.3191","0.0015","22.211","0.0017","82.97","0.011","85.747","0.012","81.416","0.011","3957.2","0.7","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C87 H60 Cl6 N15 -","- C87 H60 Cl6 N15 -","- C174 H120 Cl12 N30 -","2","1","","Kivala, Milan; Boudon, Corinne; Gisselbrecht, Jean-Paul; Seiler, Paul; Gross, Maurice; Diederich, François","A novel reaction of 7,7,8,8-tetracyanoquinodimethane (TCNQ): charge-transfer chromophores by [2 + 2] cycloaddition with alkynes.","Chemical communications (Cambridge, England)","2007","","45","4731","4733","10.1039/b713683h","","","0.7107","MoKα","","0.1514","0.1106","","","0.2882","0.3257","","","","","","0.951","","","","has coordinates","180124","2020-10-21","18:00:00",""
"7102299","15.6747","0.0005","17.1734","0.0005","24.6446","0.0007","90","","99.012","0.001","90","","6552.1","0.3","90","2","90","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1","","","- C66 H88 Sn7 -","- C66 H88 Sn7 -","- C264 H352 Sn28 -","4","1","","Rivard, Eric; Steiner, Jochen; Fettinger, James C.; Giuliani, Jason R.; Augustine, Matthew P.; Power, Philip P.","Convergent syntheses of [Sn7{C6H3-2,6-(C6H3-2,6-iPr2)2}2]: a cluster with a rare pentagonal bipyramidal motif","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4919","4921","10.1039/b709446a","","","0.71073","MoKα","","0.0433","0.034","","","0.0856","0.0892","","","","","","1.081","","","","has coordinates,has disorder","210746","2020-10-21","18:00:00",""
"7102300","9.2996","0.0016","12.814","0.002","12.938","0.002","110.141","0.003","98.399","0.003","110.94","0.003","1286.6","0.4","90","2","90","2","","","","","","","","3","P -1","-P 1","2","5","","","- C60 H76 Sn2 -","- C60 H76 Sn2 -","- C60 H76 Sn2 -","1","0.5","","Rivard, Eric; Steiner, Jochen; Fettinger, James C.; Giuliani, Jason R.; Augustine, Matthew P.; Power, Philip P.","Convergent syntheses of [Sn7{C6H3-2,6-(C6H3-2,6-iPr2)2}2]: a cluster with a rare pentagonal bipyramidal motif","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4919","4921","10.1039/b709446a","","","0.71073","MoKα","","0.0789","0.0554","","","0.1576","0.1658","","","","","","1.081","","","","has coordinates","210746","2020-10-21","18:00:00",""
"7102301","6.2143","0.0007","10.8663","0.0012","14.9797","0.0016","69.407","0.002","81.976","0.002","75.468","0.002","915.13","0.17","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H10 N4 O4 S4 -","- C18 H10 N4 O4 S4 -","- C36 H20 N8 O8 S8 -","2","1","","Steckler, Timothy T.; Abboud, Khalil A.; Craps, Matt; Rinzler, Andrew G.; Reynolds, John R.","Low band gap EDOT‒benzobis(thiadiazole) hybrid polymer characterized on near-IR transmissive single walled carbon nanotube electrodes","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4904","4906","10.1039/b709672k","","","0.71073","MoKα","","0.0518","0.0374","","","0.0923","0.098","","","","","","1.031","","","","has coordinates,has disorder","210770","2020-10-21","18:00:00",""
"7102302","16.984","0.0018","16.342","0.0019","15.648","0.002","90","","103.23","0.002","90","","4227.9","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H32 N2 O13 Zn2.5 -","- C44 H30 N2 O13 Zn2.5 -","- C176 H120 N8 O52 Zn10 -","4","1","","Lan, Ya-Qian; Wang, Xin-Long; Li, Shun-Li; Su, Zhong-Min; Shao, Kui-Zhan; Wang, En-Bo","An unprecedented (6,8)-connected self-penetrating network based on two distinct zinc clusters","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4863","4865","10.1039/b709835a","","","0.71069","MoKα","","0.1128","0.0654","","","0.1609","0.1852","","","","","","1.103","","","","has coordinates","210771","2020-10-21","18:00:00",""
"7102303","17.2216","0.0015","27.92","0.002","13.7457","0.0012","90","","98.733","0.004","90","","6532.7","1","220","2","220","2","","","","","","","Synthesized by the authors. See text","7","P 1 21/c 1","-P 2ybc","14","","","","- C58 H36 Br2 Cu2 F12 N14 P2 -","- C58 H36 Br2 Cu2 F12 N14 P2 -","- C232 H144 Br8 Cu8 F48 N56 P8 -","4","1","","Medlycott, Elaine A.; Hanan, Garry S.","Minimal structural reorganisation in the electrochemical oxidation of a dinuclear, double helical Cu(I) complex of a triazine-based pentadentate ligand","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4884","4886","10.1039/b711765e","","","1.54178","CuKα","","0.1386","0.1034","","","0.3117","0.33","","","","","","1.062","","","","has coordinates,has disorder","210772","2020-10-21","18:00:00",""
"7102304","11.458","0.0012","11.838","0.0012","21.346","0.002","96.286","0.004","103.165","0.004","110.023","0.004","2592.6","0.4","100","2","100","2","","","","","","","Synthesized by the authors. See text","7","P -1","-P 1","2","","","","- C50 H40 Cu2 F12 N12 O5 P2 -","- C50 H40 Cu2 F12 N12 O5 P2 -","- C100 H80 Cu4 F24 N24 O10 P4 -","2","1","","Medlycott, Elaine A.; Hanan, Garry S.","Minimal structural reorganisation in the electrochemical oxidation of a dinuclear, double helical Cu(I) complex of a triazine-based pentadentate ligand","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4884","4886","10.1039/b711765e","","","1.54178","CuKα","","0.0721","0.0543","","","0.146","0.1582","","","","","","0.988","","","","has coordinates","210772","2020-10-21","18:00:00",""
"7102305","10.1794","0.0005","11.18","0.0007","13.8952","0.0008","89.726","0.003","77.178","0.002","85.912","0.003","1537.9","0.15","150","","150","","","","","","","","","5","P -1","-P 1","2","Ti(MeN(CH2CH2SiMe3)2)(NNNPh2)(py)","Ti{MeN(CH2CH2SiMe3)2}(NNNPh2)(py)","","- C28 H44 N6 Si2 Ti -","- C28 H44 N6 Si2 Ti -","- C56 H88 N12 Si4 Ti2 -","2","1","","Selby, Jonathan D.; Manley, Catherine D.; Feliz, Marta; Schwarz, Andrew D.; Clot, Eric; Mountford, Philip","New ligand platforms for developing the chemistry of the Ti=N‒NR2 functional group and the insertion of alkynes into the N‒N bond of a Ti=N‒NPh2 ligand","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4937","4939","10.1039/b711941k","","","0.71073","MoKα","","0.1286","0.0728","","0.1097","0.08","0.08","","","","","","1.2067","","","","has coordinates","210723","2020-10-21","18:00:00",""
"7102306","10.191","0.0001","19.6879","0.0002","38.0089","0.0004","90","","92.0565","0.0004","90","","7621.17","0.13","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Ti(MeN(CH2CH2SiMe3)2)(NC(Ph)C(Me)NPh2)(py)","Ti{MeN(CH2CH2SiMe3)2}{NC(Ph)C(Me)NPh2}(py)","","- C37 H52 N6 Si2 Ti -","- C37 H52 N6 Si2 Ti -","- C296 H416 N48 Si16 Ti8 -","8","2","","Selby, Jonathan D.; Manley, Catherine D.; Feliz, Marta; Schwarz, Andrew D.; Clot, Eric; Mountford, Philip","New ligand platforms for developing the chemistry of the Ti=N‒NR2 functional group and the insertion of alkynes into the N‒N bond of a Ti=N‒NPh2 ligand","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4937","4939","10.1039/b711941k","","","0.71073","MoKα","","0.1262","0.0397","","0.1081","0.0443","0.0443","","","","","","1.14","","","","has coordinates","210723","2020-10-21","18:00:00",""
"7102307","9.3311","0.0002","14.7945","0.0004","16.4429","0.0004","90","","90","","90","","2269.93","0.1","150","","150","","","","","","","","","4","P b n m","-P 2c 2ab","62","Cp*Ti(MeC(NiPr)2)(NNMe2)","Cp*Ti{MeC(NiPr)2}{NNMe2)","","- C20 H38 N4 Ti -","- C20 H35.5 N4 Ti -","- C80 H142 N16 Ti4 -","4","0.5","","Selby, Jonathan D.; Manley, Catherine D.; Feliz, Marta; Schwarz, Andrew D.; Clot, Eric; Mountford, Philip","New ligand platforms for developing the chemistry of the Ti=N‒NR2 functional group and the insertion of alkynes into the N‒N bond of a Ti=N‒NPh2 ligand","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4937","4939","10.1039/b711941k","","","0.71073","MoKα","","0.0472","0.0383","","0.0492","0.0459","0.0459","","","","","","0.9446","","","","has coordinates","210723","2020-10-21","18:00:00",""
"7102308","15.229","0.004","8.796","0.002","38.65","0.011","90","","89.977","0.005","90","","5177","2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","MOF-Co/Zn-5a","","","- C53 H41.5 Co N7 O9.5 Zn2 -","- C53 H41.5 Co N7 O9.5 Zn2 -","- C212 H166 Co4 N28 O38 Zn8 -","4","1","","Garibay, Sergio J.; Stork, Jay R.; Wang, Zhenqiang; Cohen, Seth M.; Telfer, Shane G.","Enantiopure vs. racemic metalloligands: impact on metal‒organic framework structure and synthesis","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4881","4883","10.1039/b712118k","","","0.71073","MoKα","","0.1109","0.0787","","","0.2051","0.2285","","","","","","1.042","","","","has coordinates,has disorder","210773","2020-10-21","18:00:00",""
"7102309","13.626","0.003","14.766","0.003","17.357","0.004","81.062","0.004","81.66","0.004","75.534","0.004","3319.8","1.2","203","2","100","2","","","","","","","","6","P -1","-P 1","2","MOF-Co/Zn-5b","","","- C65.5 H68.5 Co N9.5 O9.5 Zn1.5 -","- C55.5 H46 Co N7.5 O7.5 Zn1.5 -","- C111 H92 Co2 N15 O15 Zn3 -","2","1","","Garibay, Sergio J.; Stork, Jay R.; Wang, Zhenqiang; Cohen, Seth M.; Telfer, Shane G.","Enantiopure vs. racemic metalloligands: impact on metal‒organic framework structure and synthesis","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4881","4883","10.1039/b712118k","","","0.71073","MoKα","","0.0905","0.0605","","","0.1507","0.1642","","","","","","0.906","","","","has coordinates,has disorder","210773","2020-10-21","18:00:00",""
"7102310","15.847","0.002","15.847","0.002","21.396","0.004","90","","90","","120","","4653.3","1.2","100","2","100","2","","","","","","","","6","P 63","P 6c","173","","","","- C96 H146 Al3 Li3 N6 O3 -","- C96.012 H146.028 Al3 Li3 N6 O3 -","- C192.024 H292.056 Al6 Li6 N12 O6 -","2","0.333333","","Singh, Sanjay; Chai, Jianfang; Pal, Aritra; Jancik, Vojtech; Roesky, Herbert W.; Herbst-Irmer, Regine","Base free lithium-organoaluminate and the gallium congener: potential precursors to heterometallic assemblies","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4934","4936","10.1039/b712240c","","","1.54178","CuKα","","0.0258","0.0249","","","0.0661","0.0667","","","","","","1.069","","","","has coordinates,has disorder","210774","2020-10-21","18:00:00",""
"7102311","15.902","0.002","15.902","0.002","21.419","0.003","90","","90","","120","","4690.7","1.1","100","2","100","2","","","","","","","","6","P 63","P 6c","173","","","","- C96 H146 Ga3 Li3 N6 O3 -","- C95.94 H145.86 Ga3 Li3 N6 O3 -","- C191.88 H291.72 Ga6 Li6 N12 O6 -","2","0.333333","","Singh, Sanjay; Chai, Jianfang; Pal, Aritra; Jancik, Vojtech; Roesky, Herbert W.; Herbst-Irmer, Regine","Base free lithium-organoaluminate and the gallium congener: potential precursors to heterometallic assemblies","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4934","4936","10.1039/b712240c","","","1.54178","CuKα","","0.0224","0.0218","","","0.0601","0.0606","","","","","","1.05","","","","has coordinates,has disorder","210774","2020-10-21","18:00:00",""
"7102312","10.346","0.004","5.0294","0.0017","13.478","0.005","90","","112.21","0.02","90","","649.3","0.4","273","","273","","","","","","","","R. Forgan","4","P 1 21/n 1","-P 2yn","14","salicylaldoxime","2-hydroxybenzaldehyde oxime","","- C7 H7 N O2 -","- C7 H7 N O2 -","- C28 H28 N4 O8 -","4","1","","Forgan, Ross S.; Wood, Peter A.; Campbell, John; Henderson, David K.; McAllister, Fiona E.; Parsons, Simon; Pidcock, Elna; Swart, Ronald M.; Tasker, Peter A.","Supramolecular chemistry in metal recovery; H-bond buttressing to tune extractant strength","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4940","4942","10.1039/b712278k","","","0.71073","MoKα","","0.1042","0.0564","","0.1745","0.1419","0.1745","","","","","","0.9148","","","","has coordinates","209675","2020-10-21","18:00:00",""
"7102313","13.249","0.004","3.9513","0.0011","14.402","0.004","90","","90.324","0.004","90","","754","0.4","298","","298","","","","","","","","R. Forgan","4","P 1 21/c 1","-P 2ybc","14","3-Methylsalicylaldoxime","3-Methylsalicylaldoxime","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C32 H36 N4 O8 -","4","1","","Forgan, Ross S.; Wood, Peter A.; Campbell, John; Henderson, David K.; McAllister, Fiona E.; Parsons, Simon; Pidcock, Elna; Swart, Ronald M.; Tasker, Peter A.","Supramolecular chemistry in metal recovery; H-bond buttressing to tune extractant strength","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4940","4942","10.1039/b712278k","","","0.71073","MoKα","","0.1516","0.0491","","0.131","0.1042","0.131","","","","","","0.6877","","","","has coordinates","209675","2020-10-21","18:00:00",""
"7102314","6.6132","0.0003","13.1087","0.0006","13.6382","0.0006","68.762","0.003","76.739","0.003","79.733","0.003","1066.71","0.09","298","","298","","","","","","","","R. Forgan","4","P -1","-P 1","2","3-tButylsalicylaldoxime","3-tButylsalicylaldoxime","","- C11 H15 N O2 -","- C11 H15 N O2 -","- C44 H60 N4 O8 -","4","2","","Forgan, Ross S.; Wood, Peter A.; Campbell, John; Henderson, David K.; McAllister, Fiona E.; Parsons, Simon; Pidcock, Elna; Swart, Ronald M.; Tasker, Peter A.","Supramolecular chemistry in metal recovery; H-bond buttressing to tune extractant strength","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4940","4942","10.1039/b712278k","","","0.71073","MoKα","","0.1206","0.0535","","0.1344","0.1093","0.1344","","","","","","0.8468","","","","has coordinates","209675","2020-10-21","18:00:00",""
"7102315","13.9108","0.0005","7.1936","0.0003","15.6965","0.0006","90","","90","","90","","1570.73","0.11","298","","298","","","","","","","","R. Forgan","4","P b c a","-P 2ac 2ab","61","3-Methoxysalicylaldoxime","3-Methoxysalicylaldoxime","","- C8 H9 N O3 -","- C8 H9 N O3 -","- C64 H72 N8 O24 -","8","1","","Forgan, Ross S.; Wood, Peter A.; Campbell, John; Henderson, David K.; McAllister, Fiona E.; Parsons, Simon; Pidcock, Elna; Swart, Ronald M.; Tasker, Peter A.","Supramolecular chemistry in metal recovery; H-bond buttressing to tune extractant strength","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4940","4942","10.1039/b712278k","","","0.71073","MoKα","","0.081","0.0296","","0.1256","0.0746","0.1256","","","","","","1.1328","","","","has coordinates","209675","2020-10-21","18:00:00",""
"7102316","13.1506","0.0018","3.8859","0.0006","14.3115","0.0019","90","","91.548","0.01","90","","731.08","0.18","298","","298","","","","","","","","R. Forgan","5","P 1 21/c 1","-P 2ybc","14","3-chlorosalicylaldoxime","3-chlorosalicylaldoxime","","- C7 H6 Cl N O2 -","- C7 H6 Cl N O2 -","- C28 H24 Cl4 N4 O8 -","4","1","","Forgan, Ross S.; Wood, Peter A.; Campbell, John; Henderson, David K.; McAllister, Fiona E.; Parsons, Simon; Pidcock, Elna; Swart, Ronald M.; Tasker, Peter A.","Supramolecular chemistry in metal recovery; H-bond buttressing to tune extractant strength","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4940","4942","10.1039/b712278k","","","0.71073","MoKα","","0.0618","0.0331","","0.0831","0.0786","0.0831","","","","","","0.8005","","","","has coordinates","209675","2020-10-21","18:00:00",""
"7102317","4.7324","0.0014","11.924","0.004","22.876","0.007","90.517","0.004","92.792","0.004","94.965","0.004","1284.4","0.7","296","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C35 H30 O5 -","- C35 H30 O5 -","- C70 H60 O10 -","2","1","","Dalgarno, Scott J.; Tian, Jian; Warren, John E.; Clark, Thomas E.; Makha, Mohamed; Raston, Colin L.; Atwood, Jerry L.","Calix[5]arene: a versatile sublimate that displays gas sorption properties","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4848","4850","10.1039/b712621b","","","0.6907","Synchrotron","","0.1395","0.1257","","","0.3232","0.3297","","","","","","1.139","","","","has coordinates","210775","2020-10-21","18:00:00",""
"7102318","24.2871","0.0009","24.2871","0.0009","12.1358","0.0006","90","","90","","120","","6199.4","0.4","173","2","150","2","","","","","","","","3","P 31","P 31","144","","","","- C105 H90 O15 -","- C105 H90 O15 -","- C315 H270 O45 -","3","1","","Dalgarno, Scott J.; Tian, Jian; Warren, John E.; Clark, Thomas E.; Makha, Mohamed; Raston, Colin L.; Atwood, Jerry L.","Calix[5]arene: a versatile sublimate that displays gas sorption properties","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4848","4850","10.1039/b712621b","","","0.6907","Synchrotron","","0.1354","0.1225","","","0.3215","0.3309","","","","","","1.044","","","","has coordinates","210775","2020-10-21","18:00:00",""
"7102319","9.2102","0.0003","7.9958","0.0003","22.4459","0.0008","90","","98.992","0.002","90","","1632.67","0.1","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 Cl2 N2 Ru -","- C16 H22 Cl2 N2 Ru -","- C64 H88 Cl8 N8 Ru4 -","4","1","","Dickson, Sara Jane; Biagini, Stefano C. G.; Steed, Jonathan W.","Anion binding in (arene)ruthenium(II)-based hosts","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4955","4957","10.1039/b712699a","","","0.7107","MoKα","","0.0316","0.0245","","","0.055","0.0575","","","","","","1.03","","","","has coordinates","210776","2020-10-21","18:00:00",""
"7102320","12.36","0.002","13.691","0.003","19.796","0.004","103.132","0.012","92.301","0.011","101.094","0.011","3189","1.1","110","","110","","","","","","","","local laboratory","3","P -1","-P 1","2","Tetramethyltetraphenyltetraallyloxy) Calix(4) Resorcinarene","","","- C80 H80 O8 -","- C80 H80 O8 -","- C160 H160 O16 -","2","1","","Parulekar, Sumedh N.; Muppalla, Kirankirti; Fronczek, Frank R.; Bisht, Kirpal S.","Synthesis of resorcin[4]arene cavitands by ring-closing metathesis","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4901","4903","10.1039/b712981e","","","0.71073","MoKα","","0.111","0.071","","","0.152","0.171","","","","","","1.047","","","","has coordinates,has disorder","209779","2020-10-21","18:00:00",""
"7102321","17.333","0.002","34.347","0.004","23.388","0.002","90","","110.583","0.006","90","","13035","2","115","","115","","","","","","","","local laboratory","3","P 1 21/c 1","-P 2ybc","14","Tetramethyl tetrahexyl Beta-Butylene dioxy Calix(4)Resorcinarene","","","- C74 H100 O9 -","- C74 H100 O9 -","- C592 H800 O72 -","8","2","","Parulekar, Sumedh N.; Muppalla, Kirankirti; Fronczek, Frank R.; Bisht, Kirpal S.","Synthesis of resorcin[4]arene cavitands by ring-closing metathesis","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4901","4903","10.1039/b712981e","","","0.71073","MoKα","","0.139","0.067","","","0.152","0.183","","","","","","1.02","","","","has coordinates","209779","2020-10-21","18:00:00",""
"7102322","26.966","0.003","18.963","0.002","16.2325","0.0015","90","","91.015","0.005","90","","8299.3","1.5","90","","90","","","","","","","","local laboratory","4","P 1 21/c 1","-P 2ybc","14","Tetrabromo tetranonyl tetra-allyloxy Calix(4)resorcinarene","","","- C88 H124 Br4 O8 -","- C88 H124 Br4 O8 -","- C352 H496 Br16 O32 -","4","1","","Parulekar, Sumedh N.; Muppalla, Kirankirti; Fronczek, Frank R.; Bisht, Kirpal S.","Synthesis of resorcin[4]arene cavitands by ring-closing metathesis","Chemical Communications (Cambridge, United Kingdom)","2007","","46","4901","4903","10.1039/b712981e","","","0.71073","MoKα","","0.13","0.068","","","0.136","0.158","","","","","","1.015","","","","has coordinates,has disorder","209779","2020-10-21","18:00:00",""
"7102323","12.368","0.0003","18.5413","0.0005","13.1716","0.0003","90","","96.361","0.002","90","","3001.9","0.13","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H28 B F10 P -","- C32 H28 B F10 P -","- C128 H112 B4 F40 P4 -","4","1","","Spies, Patrick; Erker, Gerhard; Kehr, Gerald; Bergander, Klaus; Fröhlich, Roland; Grimme, Stefan; Stephan, Douglas W","Rapid intramolecular heterolytic dihydrogen activation by a four-membered heterocyclic phosphane-borane adduct.","Chemical communications (Cambridge, England)","2007","","47","5072","5074","10.1039/b710475h","","","1.54178","CuKα","","0.0584","0.0499","","","0.1355","0.1436","","","","","","1.015","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102324","12.1089","0.0008","12.7662","0.001","12.8752","0.0008","104.669","0.003","100.577","0.005","100.279","0.003","1839","0.2","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H34 B F10 O P -","- C39 H34 B F10 O P -","- C78 H68 B2 F20 O2 P2 -","2","1","","Spies, Patrick; Erker, Gerhard; Kehr, Gerald; Bergander, Klaus; Fröhlich, Roland; Grimme, Stefan; Stephan, Douglas W","Rapid intramolecular heterolytic dihydrogen activation by a four-membered heterocyclic phosphane-borane adduct.","Chemical communications (Cambridge, England)","2007","","47","5072","5074","10.1039/b710475h","","","1.54178","CuKα","","0.1207","0.0774","","","0.1923","0.2265","","","","","","1.054","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102325","8.8341","0.0018","14.938","0.003","24.781","0.005","90","","94.72","0.03","90","","3259.1","1.1","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 N4 S4 Zn -","- C12 H14 N4 S4 Zn -","- C96 H112 N32 S32 Zn8 -","8","2","","Li, Hong-Xi; Wu, Hua-Zhou; Zhang, Wen-Hua; Ren, Zhi-Gang; Zhang, Yong; Lang, Jian-Ping","Unique formation of two high-nuclearity metallamacrocycles from a mononuclear complex [Zn(dmpzdtc)2] (dmpzdtc=3,5-dimethylpyrazole-1-dithiocarboxylate) via CS2 elimination.","Chemical communications (Cambridge, England)","2007","","47","5052","5054","10.1039/b710787k","","","0.71073","MoKα","","0.0473","0.0422","","","0.0912","0.0933","","","","","","1.278","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102326","12.1532","0.0013","13.5228","0.0012","14.3299","0.0018","81.603","0.008","86.174","0.008","63.81","0.005","2090.6","0.4","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H44 Cl2 N12 S4 Zn3 -","- C33 H44 Cl2 N12 S4 Zn3 -","- C66 H88 Cl4 N24 S8 Zn6 -","2","1","","Li, Hong-Xi; Wu, Hua-Zhou; Zhang, Wen-Hua; Ren, Zhi-Gang; Zhang, Yong; Lang, Jian-Ping","Unique formation of two high-nuclearity metallamacrocycles from a mononuclear complex [Zn(dmpzdtc)2] (dmpzdtc=3,5-dimethylpyrazole-1-dithiocarboxylate) via CS2 elimination.","Chemical communications (Cambridge, England)","2007","","47","5052","5054","10.1039/b710787k","","","0.7107","MoKα","","0.0663","0.0511","","","0.1039","0.1107","","","","","","1.094","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102327","10.577","0.002","14.267","0.003","16.194","0.003","64.53","0.03","81.38","0.03","68.43","0.03","2051.6","1","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H96 Br4 N24 O4 Zn8 -","- C64 H96 Br4 N24 O4 Zn8 -","- C64 H96 Br4 N24 O4 Zn8 -","1","0.5","","Li, Hong-Xi; Wu, Hua-Zhou; Zhang, Wen-Hua; Ren, Zhi-Gang; Zhang, Yong; Lang, Jian-Ping","Unique formation of two high-nuclearity metallamacrocycles from a mononuclear complex [Zn(dmpzdtc)2] (dmpzdtc=3,5-dimethylpyrazole-1-dithiocarboxylate) via CS2 elimination.","Chemical communications (Cambridge, England)","2007","","47","5052","5054","10.1039/b710787k","","","0.71073","MoKα","","0.1215","0.083","","","0.1828","0.2042","","","","","","1.116","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102328","27.083","0.004","27.083","0.004","14.675","0.003","90","","90","","90","","10764","3","193","2","193","2","","","","","","","","5","P 4 n c","P 4 -2n","104","","","","- C132 H204 N52 O12 Zn16 -","- C132 H204 N52 O12 Zn16 -","- C264 H408 N104 O24 Zn32 -","2","0.25","","Li, Hong-Xi; Wu, Hua-Zhou; Zhang, Wen-Hua; Ren, Zhi-Gang; Zhang, Yong; Lang, Jian-Ping","Unique formation of two high-nuclearity metallamacrocycles from a mononuclear complex [Zn(dmpzdtc)2] (dmpzdtc=3,5-dimethylpyrazole-1-dithiocarboxylate) via CS2 elimination.","Chemical communications (Cambridge, England)","2007","","47","5052","5054","10.1039/b710787k","","","0.71073","MoKα","","0.0707","0.0624","","","0.1615","0.1666","","","","","","1.11","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102329","11.614","0.002","17.324","0.004","38.299","0.008","90","","90","","90","","7706","3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 Ag Al F36 O4 P8 -","- C16 Ag Al F36 O4 P8 -","- C128 Ag8 Al8 F288 O32 P64 -","8","2","","Santiso-Quiñones, Gustavo; Reisinger, Andreas; Slattery, John; Krossing, Ingo","Homoleptic Cu-phosphorus and Cu-ethene complexes.","Chemical communications (Cambridge, England)","2007","","47","5046","5048","10.1039/b710899k","","","0.71073","MoKα","","0.0784","0.0649","","","0.1302","0.1369","","","","","","1.222","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102330","12.8455","0.0006","44.862","0.002","18.9555","0.0009","90","","102.506","0.003","90","","10664.4","0.9","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C66 H36 Al3 Cu3 F108 O12 -","- C66 H36 Al3 Cu3 F108 O12 -","- C264 H144 Al12 Cu12 F432 O48 -","4","1","","Santiso-Quiñones, Gustavo; Reisinger, Andreas; Slattery, John; Krossing, Ingo","Homoleptic Cu-phosphorus and Cu-ethene complexes.","Chemical communications (Cambridge, England)","2007","","47","5046","5048","10.1039/b710899k","","","0.71073","MoKα","","0.1529","0.0755","","","0.1431","0.1832","","","","","","1.044","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102331","11.7609","0.0018","16.9425","0.0015","38.266","0.004","90","","90","","90","","7624.8","1.6","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 Al Cu F36 O4 P8 -","- C16 Al Cu F36 O4 P8 -","- C128 Al8 Cu8 F288 O32 P64 -","8","2","","Santiso-Quiñones, Gustavo; Reisinger, Andreas; Slattery, John; Krossing, Ingo","Homoleptic Cu-phosphorus and Cu-ethene complexes.","Chemical communications (Cambridge, England)","2007","","47","5046","5048","10.1039/b710899k","","","0.71073","MoKα","","0.0671","0.0506","","","0.106","0.1152","","","","","","1.187","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102332","18.1126","0.001","12.3042","0.0007","19.9567","0.0011","90","","96.113","0.001","90","","4422.3","0.4","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H68 Cl2 Lu N3 O4 -","- C43 H68 Cl2 Lu N3 O4 -","- C172 H272 Cl8 Lu4 N12 O16 -","4","1","","Panda, Tarun K; Randoll, Sören; Hrib, Cristian G; Jones, Peter G; Bannenberg, Thomas; Tamm, Matthias","Syntheses and structures of mononuclear lutetium imido complexes with very short Lu-N bonds.","Chemical communications (Cambridge, England)","2007","","47","5007","5009","10.1039/b711669a","","","0.71073","MoKα","","0.0699","0.0357","","","0.0713","0.084","","","","","","1.029","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102333","12.2567","0.001","12.505","0.001","31.988","0.003","90","","90","","90","","4902.8","0.7","133","2","133","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C47 H68 Lu N3 O3 -","- C47 H68 Lu N3 O3 -","- C188 H272 Lu4 N12 O12 -","4","1","","Panda, Tarun K; Randoll, Sören; Hrib, Cristian G; Jones, Peter G; Bannenberg, Thomas; Tamm, Matthias","Syntheses and structures of mononuclear lutetium imido complexes with very short Lu-N bonds.","Chemical communications (Cambridge, England)","2007","","47","5007","5009","10.1039/b711669a","","","0.71073","MoKα","","0.0354","0.0308","","","0.0731","0.0748","","","","","","1.04","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102334","10.7721","0.0004","13.7551","0.0005","20.785","0.0007","90.619","0.002","90.784","0.002","104.14","0.002","2985.83","0.18","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H84 B40 N4 O2 Pt -","- C28 H84 B40 N4 O2 Pt -","- C56 H168 B80 N8 O4 Pt2 -","2","1","","Bould, Jonathan; Kennedy, John D","Macropolyhedral boron-containing cluster chemistry. Novel intercluster linkages from the reaction of [Pt(cod)Cl2] and [PtMe2(PMe2Ph)2] with 6,6'-(B10H13)2O.","Chemical communications (Cambridge, England)","2007","","47","5084","5086","10.1039/b712084b","","","0.71073","MoKα","","0.079","0.0505","","","0.0952","0.1052","","","","","","1.02","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102335","10.6336","0.0002","14.8948","0.0002","15.7371","0.0002","66.761","0.001","83.475","0.002","86.483","0.002","2275.09","0.06","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H56 B20 Cl3 O P3 Pt2 -","- C25 H56 B20 Cl3 O P3 Pt2 -","- C50 H112 B40 Cl6 O2 P6 Pt4 -","2","1","","Bould, Jonathan; Kennedy, John D","Macropolyhedral boron-containing cluster chemistry. Novel intercluster linkages from the reaction of [Pt(cod)Cl2] and [PtMe2(PMe2Ph)2] with 6,6'-(B10H13)2O.","Chemical communications (Cambridge, England)","2007","","47","5084","5086","10.1039/b712084b","","","0.71073","MoKα","","0.0601","0.052","","","0.1355","0.1428","","","","","","1.027","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102336","15.1455","0.0012","12.53","0.001","15.4095","0.0012","90","","92.18","0.005","90","","2922.2","0.4","113","2","113","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H29 N3 O10 S2 -","- C27 H29 N3 O10 S2 -","- C108 H116 N12 O40 S8 -","4","1","","Ma, Yang Guang; Cheng, Ying","The unprecedented ring transformation from thiazoline-spiro-thiophene to thieno[2,3-b]pyrazine involved in the reaction of 2-thiocarbamoyl thiazolium salts with dimethyl acetylenedicarboxylate.","Chemical communications (Cambridge, England)","2007","","47","5087","5089","10.1039/b712098b","","","0.7107","MoKα","","0.0675","0.0496","","","0.102","0.11","","","","","","1.121","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102337","11.693","0.002","12.8918","0.0016","13.172","0.003","89.985","0.013","64.793","0.018","77.478","0.012","1744.2","0.6","103","1","103","1","","","","","","","see text","6","P -1","-P 1","2","","","","- C22 H40 Cu3 I3 N P5 -","- C22 H40 Cu3 I3 N P5 -","- C44 H80 Cu6 I6 N2 P10 -","2","1","","Vogel, Ulf; Nixon, John F; Scheer, Manfred","Copper(I) mediated oligomerisation of a phosphaalkyne.","Chemical communications (Cambridge, England)","2007","","47","5055","5057","10.1039/b712161j","","x-ray","1.54178","cukα","","0.0749","0.0368","","","0.0628","0.0655","","","","","","0.811","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102338","15.505","0.003","11.6415","0.0018","18.001","0.003","90","","111.426","0.018","90","","3024.7","1","104","1","104","1","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H78 Cu4 I4 N2 P8 -","- C44 H78 Cu4 I4 N2 P8 -","- C88 H156 Cu8 I8 N4 P16 -","2","0.5","","Vogel, Ulf; Nixon, John F; Scheer, Manfred","Copper(I) mediated oligomerisation of a phosphaalkyne.","Chemical communications (Cambridge, England)","2007","","47","5055","5057","10.1039/b712161j","","x-ray","1.54178","CuKα","","0.0536","0.0391","","","0.0963","0.1","","","","","","0.937","","","","has coordinates","210357","2020-10-21","18:00:00",""
"7102339","23.7888","0.0003","11.2636","0.0002","10.3868","0.0001","90","","108.202","0.001","90","","2643.85","0.06","123","2","123","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- C23.5 H41 P5 -","- C23.5 H41 P5 -","- C94 H164 P20 -","4","0.5","","Vogel, Ulf; Nixon, John F; Scheer, Manfred","Copper(I) mediated oligomerisation of a phosphaalkyne.","Chemical communications (Cambridge, England)","2007","","47","5055","5057","10.1039/b712161j","","","1.54178","CuKα","","0.085","0.081","","","0.2302","0.2363","","","","","","1.098","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102340","17.4815","0.0009","17.4815","0.0009","27.596","0.002","90","","90","","120","","7303.5","0.8","180","2","180","2","","","","","","","","6","R 3 c :H","R 3 -2""c","161","","","","- C31 H63 K O Si6 Sn -","- C31.02 H63 K O Si6 Sn -","- C186.12 H378 K6 O6 Si36 Sn6 -","6","0.333333","","Layfield, Richard A; García, Felipe; Hannauer, Julien; Humphrey, Simon M","Ansa-tris(allyl) complexes of alkali metals: tripodal analogues of cyclopentadienyl and ansa-metallocene ligands.","Chemical communications (Cambridge, England)","2007","","47","5081","5083","10.1039/b712285c","","","0.71073","MoKα","","0.0482","0.0312","","","0.0685","0.0773","","","","","","1.06","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102341","33.6787","0.0003","33.6787","0.0003","11.173","0.0001","90","","90","","90","","12673","0.2","180","2","180","2","","","","","","","","5","P 42/n m c :2","-P 4ac 2a","137","","","","- C37 H87 Li3 N6 Si4 -","- C37 H81 Li3 N6 Si4 -","- C296 H648 Li24 N48 Si32 -","8","0.5","","Layfield, Richard A; García, Felipe; Hannauer, Julien; Humphrey, Simon M","Ansa-tris(allyl) complexes of alkali metals: tripodal analogues of cyclopentadienyl and ansa-metallocene ligands.","Chemical communications (Cambridge, England)","2007","","47","5081","5083","10.1039/b712285c","","","0.71073","MoKα","","0.1126","0.0901","","","0.2287","0.2419","","","","","","1.103","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102342","14.0049","0.0014","14.1051","0.0014","20.955","0.002","76.598","0.002","88.601","0.002","89.842","0.002","4025.6","0.7","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H18 Br2 N2 Pd -","- C20 H18 Br2 N2 Pd -","- C160 H144 Br16 N16 Pd8 -","8","4","","Davies, Mark W; Clarke, Adam J; Clarkson, Guy J; Shipman, Michael; Tucker, James H R","Umbrella motion in aziridines: use of simple chemical inputs to reversibly control the rate of pyramidal inversion.","Chemical communications (Cambridge, England)","2007","","47","5078","5080","10.1039/b712447c","","","0.71073","MoKα","","0.1402","0.0645","","","0.1505","0.1788","","","","","","1.013","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102343","25.47","0.004","25.47","0.004","13.028","0.003","90","","90","","120","","7319","2","93","2","93","2","","","","","","","","7","R 3 :H","R 3","146","","","","- C99 H81 Ag6 F9 N12 O18 S3 -","- C99 H81 Ag6 F9 N12 O18 S3 -","- C297 H243 Ag18 F27 N36 O54 S9 -","3","0.333333","","Lee, Ho Yong; Park, Jaejoon; Lah, Myoung Soo; Hong, Jong-In","A hamburger-shaped helical stacking of disk-shaped ligands mediated by silver(II) ions.","Chemical communications (Cambridge, England)","2007","","47","5013","5015","10.1039/b712717k","","","0.7","synchrotron","","0.0432","0.0421","","","0.1099","0.1112","","","","","","1.059","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102344","21.858","0.005","12.108","0.003","24.59","0.004","90","","90","","90","","6508","2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C32 H37 N3 O4 S Sn -","- C32 H37 N3 O4 S Sn -","- C256 H296 N24 O32 S8 Sn8 -","8","1","","Kim, Sang-Hoon; Oh, Seung-Ju; Kim, Yurim; Yu, Chan-Mo","A diastereoselective carbocyclisation of allene-hydrazones through the intramolecular allylic transfer reaction.","Chemical communications (Cambridge, England)","2007","","47","5025","5027","10.1039/b712856h","","","0.71073","MoKα","","0.2761","0.0916","","","0.1749","0.2509","","","","","","0.959","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102345","21.1129","0.0007","21.1129","0.0007","11.1505","0.0007","90","","90","","90","","4970.4","0.4","103","2","103","0.1","","","100","","","","Synthesis via corner capping","5","I 41/a :2","-I 4ad","88","Octa(3,3,3-trifluropropyl)-T8-Silsesquioxane","Octa(3,3,3-trifluropropyl)-T8-Silsesquioxane","","- C28 H40 F24 O13 Si8 -","- C28 H40 F24 O13 Si8 -","- C112 H160 F96 O52 Si32 -","4","0.25","","Iacono, Scott T; Vij, Ashwani; Grabow, Wade; Smith, Jr, Dennis W; Mabry, Joseph M","Facile synthesis of hydrophobic fluoroalkyl functionalized silsesquioxane nanostructures.","Chemical communications (Cambridge, England)","2007","","47","4992","4994","10.1039/b712976a","","x-ray","0.71073","MoKα","","0.0306","0.0286","","","0.0857","0.088","","","","","","1.09","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102346","13.3164","0.0016","17.129","0.002","20.726","0.003","90","","105.007","0.002","90","","4566.2","1","193","2","193","2","","","100","","","","Chemical synthesis via corner capping technique","5","C 1 c 1","C -2yc","9","Methylhepta(3,3,3-trifluropropyl)-T8-Silsesquioxane","Methylhepta(3,3,3-trifluropropyl)-T8-Silsesquioxane","","- C22 H31 F21 O12 Si8 -","- C22 H31 F21 O12 Si8 -","- C88 H124 F84 O48 Si32 -","4","1","","Iacono, Scott T; Vij, Ashwani; Grabow, Wade; Smith, Jr, Dennis W; Mabry, Joseph M","Facile synthesis of hydrophobic fluoroalkyl functionalized silsesquioxane nanostructures.","Chemical communications (Cambridge, England)","2007","","47","4992","4994","10.1039/b712976a","","x-ray","0.71073","MoKα","","0.0514","0.048","","","0.1332","0.1395","","","","","","1.022","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102347","23.188","0.003","11.1458","0.0014","24.392","0.003","90","","99.709","0.002","90","","6213.8","1.4","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C52 H92 Ce N8 O7 -","- C50 H88 Ce N8 O6.5 -","- C200 H352 Ce4 N32 O26 -","4","1","","Casely, Ian J; Liddle, Stephen T; Blake, Alexander J; Wilson, Claire; Arnold, Polly L","Tetravalent cerium carbene complexes.","Chemical communications (Cambridge, England)","2007","","47","5037","5039","10.1039/b713041d","","","0.71073","MoKα","","0.1176","0.0673","","","0.1616","0.1822","","","","","","0.963","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102348","13.6344","0.0005","15.6439","0.0006","19.9007","0.0007","78.468","0.002","74.11","0.002","66.66","0.002","3728.3","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H116 B2 Ce N8 O4 -","- C74 H116 B2 Ce N8 O4 -","- C148 H232 B4 Ce2 N16 O8 -","2","1","","Casely, Ian J; Liddle, Stephen T; Blake, Alexander J; Wilson, Claire; Arnold, Polly L","Tetravalent cerium carbene complexes.","Chemical communications (Cambridge, England)","2007","","47","5037","5039","10.1039/b713041d","","","0.71073","MoKα","","0.0349","0.0323","","","0.0848","0.0863","","","","","","1.065","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102349","11.371","0.002","16.609","0.003","19.615","0.003","70.25","0.003","74.282","0.003","74.021","0.003","3286.5","1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C61 H91 Ce I N8 O4 -","- C61 H91 Ce I N8 O4 -","- C122 H182 Ce2 I2 N16 O8 -","2","1","","Casely, Ian J; Liddle, Stephen T; Blake, Alexander J; Wilson, Claire; Arnold, Polly L","Tetravalent cerium carbene complexes.","Chemical communications (Cambridge, England)","2007","","47","5037","5039","10.1039/b713041d","","","0.71073","MoKα","","0.0422","0.0299","","","0.0688","0.0746","","","","","","1.023","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102350","8.8819","0.0009","7.7118","0.0008","17.3991","0.0018","90","","98.307","0.002","90","","1179.3","0.2","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C28 H21 Cl N O3 P -","- C28 H21 Cl N O3 P -","- C56 H42 Cl2 N2 O6 P2 -","2","1","","Fu, Xiao; Jiang, Zhiyong; Tan, Choon-Hong","Bicyclic guanidine-catalyzed enantioselective phospha-Michael reaction: synthesis of chiral beta-aminophosphine oxides and beta-aminophosphines.","Chemical communications (Cambridge, England)","2007","","47","5058","5060","10.1039/b713151h","","","0.71073","MoKα","","0.0484","0.0466","","","0.1149","0.1161","","","","","","1.106","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7102351","13.9677","0.0013","13.9677","0.0013","7.5462","0.0014","90","","90","","90","","1472.2","0.3","292","2","292","2","","","","","","","","3","P -4","P -4","81","Cesium selenophosphate","Cesium selenophosphate","","- Cs5 P5 Se12 -","- Cs5 P5 Se12 -","- Cs10 P10 Se24 -","2","0.5","","Chung, In; Jang, Joon I; Gave, Matthew A; Weliky, David P; Kanatzidis, Mercouri G","Low valent phosphorus in the molecular anions [P5Se12]5- and beta-[P6Se12]4-: phase change behavior and near infrared second harmonic generation.","Chemical communications (Cambridge, England)","2007","","47","4998","5000","10.1039/b714301j","","","0.71073","MoKα","","0.037","0.03","","","0.0727","0.0855","","","","","","1.159","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102352","10.8363","0.0011","10.5437","0.0008","12.2731","0.0012","90","","98.661","0.008","90","","1386.3","0.2","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- Cs4 P6 Se12 -","- Cs4 P6 Se12 -","- Cs8 P12 Se24 -","2","0.5","","Chung, In; Jang, Joon I; Gave, Matthew A; Weliky, David P; Kanatzidis, Mercouri G","Low valent phosphorus in the molecular anions [P5Se12]5- and beta-[P6Se12]4-: phase change behavior and near infrared second harmonic generation.","Chemical communications (Cambridge, England)","2007","","47","4998","5000","10.1039/b714301j","","","0.71073","MoKα","","0.0752","0.0429","","","0.1036","0.1403","","","","","","1.077","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102353","14.4394","0.0005","20.0945","0.0007","22.9242","0.0008","90","","96.395","0.003","90","","6610.1","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C116 H168 Cl6 N26 O16 V8 -","- C116 H168 Cl6 N26 O16 V8 -","- C232 H336 Cl12 N52 O32 V16 -","2","0.5","","Shaw, Rachel; Tuna, Floriana; Wernsdorfer, Wolfgang; Barra, Anne-Laure; Collison, David; McInnes, Eric J L","Large spin, magnetically anisotropic, octametallic vanadium(iii) clusters with strong ferromagnetic coupling.","Chemical communications (Cambridge, England)","2007","","48","5161","5163","10.1039/b710732c","","","0.71073","MoKα","","0.0828","0.0531","","","0.1513","0.1637","","","","","","0.996","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102354","13.2856","0.0008","14.7996","0.0007","18.4967","0.0009","66.701","0.005","77.315","0.005","80.523","0.005","3246.4","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C116 H134 Cl6 N26 O14 V8 -","- C116 H134 Cl6 N26 O14 V8 -","- C116 H134 Cl6 N26 O14 V8 -","1","0.5","","Shaw, Rachel; Tuna, Floriana; Wernsdorfer, Wolfgang; Barra, Anne-Laure; Collison, David; McInnes, Eric J L","Large spin, magnetically anisotropic, octametallic vanadium(iii) clusters with strong ferromagnetic coupling.","Chemical communications (Cambridge, England)","2007","","48","5161","5163","10.1039/b710732c","","","0.71073","MoKα","","0.1141","0.0778","","","0.2254","0.2469","","","","","","0.999","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102355","9.3641","0.0013","17.591","0.002","28.103","0.003","90","","108.48","0.01","90","","4390.5","0.9","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H48 Fe2 N16 O S4 -","- C35 H48 Fe2 N16 O S4 -","- C140 H192 Fe8 N64 O4 S16 -","4","1","","Bréfuel, Nicolas; Duhayon, Carine; Shova, Sergiu; Tuchagues, Jean-Pierre","An unprecedented co-crystal including a cis-high-spin and a trans-low-spin FeII complex molecule.","Chemical communications (Cambridge, England)","2007","","48","5223","5225","10.1039/b710734j","","","0.71069","MoKα","","0.1447","0.059","","","0.0672","0.0834","","","","","","0.909","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102356","13.5675","0.0003","15.3805","0.0002","12.3987","0.0003","90","","90","","90","","2587.3","0.09","173","2","173","2","","","","","","","synthesis as described","5","P n a 21","P 2c -2n","33","","","","- C22 H33 Cl4 N6 P -","- C22 H33 Cl4 N6 P -","- C88 H132 Cl16 N24 P4 -","4","1","","Coles, Martyn P; Hitchcock, Peter B","A Lewis-basic, dionio-substituted phosphane.","Chemical communications (Cambridge, England)","2007","","48","5229","5231","10.1039/b710923g","","x-ray","0.71073","MoKα","","0.0299","0.028","","","0.0801","0.0819","","","","","","0.974","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102357","14.018","0.0005","14.4145","0.0004","15.2158","0.0005","90","","113.878","0.002","90","","2811.39","0.16","173","2","173","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H34 Cl4 N7 P Pt -","- C23 H34 Cl4 N7 P Pt -","- C92 H136 Cl16 N28 P4 Pt4 -","4","1","","Coles, Martyn P; Hitchcock, Peter B","A Lewis-basic, dionio-substituted phosphane.","Chemical communications (Cambridge, England)","2007","","48","5229","5231","10.1039/b710923g","","x-ray","0.7107","MoKα","","0.0552","0.0442","","","0.1064","0.1122","","","","","","1.101","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102358","21.512","0.005","16.983","0.003","34.416","0.006","90","","91.234","0.017","90","","12571","4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C92.5 H167 N Ni8 O41.2 P2 -","- C92.5 H144.8 N Ni8 O41.2 P2 -","- C370 H579.2 N4 Ni32 O164.8 P8 -","4","1","","Breeze, Barbara A; Shanmugam, Muralidharan; Tuna, Floriana; Winpenny, Richard E P","A series of nickel phosphonate-carboxylate cages.","Chemical communications (Cambridge, England)","2007","","48","5185","5187","10.1039/b711650k","","","0.71073","MoKα","","0.1238","0.0682","","","0.1879","0.2088","","","","","","0.972","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102359","15.1594","0.0005","22.9262","0.0005","34.2611","0.0009","90","","97.16","0.003","90","","11814.5","0.6","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C87.2 H133 Cl3.6 N6.2 Ni9 O36 P2 -","- C87.2 H122.6 Cl3.6 N6.2 Ni9 O36 P2 -","- C348.8 H490.4 Cl14.4 N24.8 Ni36 O144 P8 -","4","1","","Breeze, Barbara A; Shanmugam, Muralidharan; Tuna, Floriana; Winpenny, Richard E P","A series of nickel phosphonate-carboxylate cages.","Chemical communications (Cambridge, England)","2007","","48","5185","5187","10.1039/b711650k","","","0.71073","MoKα","","0.119","0.0699","","","0.1499","0.1874","","","","","","1.189","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102360","28.765","0.006","19.213","0.004","28.414","0.006","90","","90","0.03","90","","15703","6","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C104.35 H171.9 N3.2 Ni12 O47.8 P4 -","- C104.35 H166.2 N3.2 Ni12 O47.8 P4 -","- C417.4 H664.8 N12.8 Ni48 O191.2 P16 -","4","1","","Breeze, Barbara A; Shanmugam, Muralidharan; Tuna, Floriana; Winpenny, Richard E P","A series of nickel phosphonate-carboxylate cages.","Chemical communications (Cambridge, England)","2007","","48","5185","5187","10.1039/b711650k","","","0.6709","synchrotron","","0.0933","0.0696","","","0.2108","0.2326","","","","","","1.069","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7102361","10.9385","0.0003","19.5849","0.0005","32.2466","0.0008","90","","90","","90","","6908.2","0.3","100","2","100","2","","","","","","","synthesized","5","P b c a","-P 2ac 2ab","61","Potassium 4-Cl-2,6-Dimethylphenoxide Dioxane","","","- C15 H22 Cl K O4.5 -","- C15 H22 Cl K O4.5 -","- C240 H352 Cl16 K16 O72 -","16","2","","Morris, J Jacob; Noll, Bruce C; Henderson, Kenneth W","High-connectivity networks: characterization of the first uninodal 9-connected net and two topologically novel 7-connected nets.","Chemical communications (Cambridge, England)","2007","","48","5191","5193","10.1039/b711668c","","x-ray","0.71073","MoKα","","0.0555","0.0479","","","0.1086","0.1123","","","","","","1.151","","","","has coordinates","187017","2020-10-21","18:00:00",""
"7102362","18.38","0.004","21.55","0.004","17.74","0.004","90","","91.3","0.03","90","","7025","3","100","2","100","2","","","","","","","synthesized","4","P 1 21/c 1","-P 2ybc","14","Potassium 2,4,6-Trimethylphenoxide Dioxane","","","- C65 H95 K5 O15 -","- C65 H95 K5 O15 -","- C260 H380 K20 O60 -","4","1","","Morris, J Jacob; Noll, Bruce C; Henderson, Kenneth W","High-connectivity networks: characterization of the first uninodal 9-connected net and two topologically novel 7-connected nets.","Chemical communications (Cambridge, England)","2007","","48","5191","5193","10.1039/b711668c","","x-ray","0.71073","MoKα","","0.0531","0.0438","","","0.1011","0.1076","","","","","","1.069","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102363","11.324","0.002","19.659","0.004","32.308","0.007","90","","90","","90","","7192","2","100","2","100","2","","","","","","","synthesized","5","P b c a","-P 2ac 2ab","61","Rubidium 4-Cl-2,6-Dimethylphenoxide Dioxane","","","- C30 H44 Cl2 O9 Rb2 -","- C30 H44 Cl2 O9 Rb2 -","- C240 H352 Cl16 O72 Rb16 -","8","1","","Morris, J Jacob; Noll, Bruce C; Henderson, Kenneth W","High-connectivity networks: characterization of the first uninodal 9-connected net and two topologically novel 7-connected nets.","Chemical communications (Cambridge, England)","2007","","48","5191","5193","10.1039/b711668c","","x-ray","0.71073","MoKα","","0.0765","0.0561","","","0.1269","0.1356","","","","","","1.129","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102364","19.047","0.0004","20.6118","0.0005","20.0105","0.0005","90","","91.713","0.001","90","","7852.5","0.3","100","2","100","2","","","","","","","synthesized","4","P 1 21/n 1","-P 2yn","14","Rubidium 2-iPropylphenoxide Dioxane","","","- C72 H102 O15 Rb6 -","- C72 H102 O15 Rb6 -","- C288 H408 O60 Rb24 -","4","1","","Morris, J Jacob; Noll, Bruce C; Henderson, Kenneth W","High-connectivity networks: characterization of the first uninodal 9-connected net and two topologically novel 7-connected nets.","Chemical communications (Cambridge, England)","2007","","48","5191","5193","10.1039/b711668c","","x-ray","0.71073","MoKα","","0.0511","0.0285","","","0.0561","0.0624","","","","","","1.029","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102365","15.488","0.0005","15.488","0.0005","19.997","0.0005","90","","90","","120","","4154.2","0.2","293","2","293","2","","","","","","","","4","P 3 1 c","P 3 -2c","159","","","","- C48 H33 Fe O12 -","- C48 H33 Fe2 O12 -","- C192 H132 Fe8 O48 -","4","0.666667","","Kaizer, József; Baráth, Gábor; Pap, József; Speier, Gábor; Giorgi, Michel; Réglier, Marius","Manganese and iron flavonolates as flavonol 2,4-dioxygenase mimics.","Chemical communications (Cambridge, England)","2007","","48","5235","5237","10.1039/b711864c","","","0.71073","MoKα","","0.0834","0.0725","","","0.1901","0.1992","","","","","","1.097","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102366","8.31","0.0006","10.095","0.0006","11.167","0.0005","113.361","0.004","97.542","0.004","106.255","0.004","793.82","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H28 Mn N2 O6 -","- C40 H28 Mn N2 O6 -","- C40 H28 Mn N2 O6 -","1","0.5","","Kaizer, József; Baráth, Gábor; Pap, József; Speier, Gábor; Giorgi, Michel; Réglier, Marius","Manganese and iron flavonolates as flavonol 2,4-dioxygenase mimics.","Chemical communications (Cambridge, England)","2007","","48","5235","5237","10.1039/b711864c","","","0.71073","MoKα","","0.0527","0.0444","","","0.1354","0.1567","","","","","","1.164","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102367","8.214","0.003","5.6315","0.0017","15.202","0.005","90","","90.539","0.005","90","","703.2","0.4","273","2","273","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C7 H7 N5 -","- C7 H7 N5 -","- C28 H28 N20 -","4","1","","Zou, Yang; Hong, Seunghee; Park, Mira; Chun, Hyungphil; Lah, Myoung Soo","Selective gas sorption property of an interdigitated 3-D metal-organic framework with 1-D channels.","Chemical communications (Cambridge, England)","2007","","48","5182","5184","10.1039/b712485f","","","0.71073","MoKα","","0.0961","0.0838","","","0.1922","0.1976","","","","","","1.295","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102368","7.0163","0.0006","12.0948","0.0011","12.7661","0.0013","90.833","0.002","105.945","0.001","97.704","0.002","1030.76","0.17","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H39 Cd3 N21 O6 -","- C31 H30 Cd3 N21 O6 -","- C31 H30 Cd3 N21 O6 -","1","0.5","","Zou, Yang; Hong, Seunghee; Park, Mira; Chun, Hyungphil; Lah, Myoung Soo","Selective gas sorption property of an interdigitated 3-D metal-organic framework with 1-D channels.","Chemical communications (Cambridge, England)","2007","","48","5182","5184","10.1039/b712485f","","","0.71073","MoKα","","0.0242","0.0231","","","0.0592","0.0599","","","","","","1.073","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102369","6.9889","0.0008","12.0763","0.0013","12.8137","0.0014","87.184","0.002","105.317","0.002","97.988","0.002","1032.9","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H30 Cd3 N20 O4 -","- C28 H30 Cd3 N20 O4 -","- C28 H30 Cd3 N20 O4 -","1","0.5","","Zou, Yang; Hong, Seunghee; Park, Mira; Chun, Hyungphil; Lah, Myoung Soo","Selective gas sorption property of an interdigitated 3-D metal-organic framework with 1-D channels.","Chemical communications (Cambridge, England)","2007","","48","5182","5184","10.1039/b712485f","","","0.71073","MoKα","","0.0293","0.0251","","","0.0618","0.0638","","","","","","1.073","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102370","14.669","0.007","16.833","0.008","24.743","0.011","90","","90","","90","","6109","5","298","2","298","2","","","","","","","","5","I b a m","-I 2 2c","72","","","","- C21 H30 Cu2 N3 O15.5 -","- C21 H17 Cu2 N3 O15.5 -","- C168 H136 Cu16 N24 O124 -","8","0.5","","McManus, Gregory J; Wang, Zhenqiang; Beauchamp, Derek A; Zaworotko, Michael J","A novel metal-organic ternary topology constructed from triangular, square and tetrahedral molecular building blocks.","Chemical communications (Cambridge, England)","2007","","48","5212","5213","10.1039/b712905j","","","0.71073","MoKα","","0.1534","0.0671","","","0.1612","0.1883","","","","","","0.882","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102371","12.721","0.0018","7.7387","0.0011","14.005","0.002","90","","108.106","0.002","90","","1310.4","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 Cu N2 O4 -","- C14 H12 Cu N2 O4 -","- C56 H48 Cu4 N8 O16 -","4","1","","McManus, Gregory J; Wang, Zhenqiang; Beauchamp, Derek A; Zaworotko, Michael J","A novel metal-organic ternary topology constructed from triangular, square and tetrahedral molecular building blocks.","Chemical communications (Cambridge, England)","2007","","48","5212","5213","10.1039/b712905j","","","0.71073","MoKα","","0.0641","0.0447","","","0.1049","0.1139","","","","","","1.041","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102372","14.9614","0.0009","14.0008","0.0009","18.179","0.0011","90","","95.073","0.001","90","","3793.1","0.4","273","2","273","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C74 H96 Cl2 Cu2 N6 O9 -","- C74 H94 Cl2 Cu2 N6 O9 -","- C148 H188 Cl4 Cu4 N12 O18 -","2","1","","Yeung, Chi-Tung; Yeung, Ho-Lun; Tsang, Chui-Shan; Wong, Wai-Yeung; Kwong, Hoi-Lun","Supramolecular double helical Cu(I) complexes for asymmetric cyclopropanation.","Chemical communications (Cambridge, England)","2007","","48","5203","5205","10.1039/b713010d","","","0.71073","MoKα","","0.1456","0.0654","","","0.1432","0.176","","","","","","0.928","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102373","15.5877","0.0008","13.2827","0.0007","19.0425","0.001","90","","101.654","0.001","90","","3861.4","0.3","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C82 H82 Cu2 F12 N10 P2 -","- C82 H82 Cu2 F12 N10 P2 -","- C164 H164 Cu4 F24 N20 P4 -","2","1","","Yeung, Chi-Tung; Yeung, Ho-Lun; Tsang, Chui-Shan; Wong, Wai-Yeung; Kwong, Hoi-Lun","Supramolecular double helical Cu(I) complexes for asymmetric cyclopropanation.","Chemical communications (Cambridge, England)","2007","","48","5203","5205","10.1039/b713010d","","","0.71073","MoKα","","0.0819","0.0535","","","0.1354","0.1535","","","","","","1.016","","","","has coordinates","180125","2020-10-21","18:00:00",""
"7102374","9.2984","0.001","13.354","0.0014","13.7161","0.0014","118.317","0.002","90.295","0.002","96.329","0.002","1487","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H18 F15 N7 O3 -","- C27 H18 F15 N7 O3 -","- C54 H36 F30 N14 O6 -","2","1","","Lakshminarayanan, P S; Ravikumar, I; Suresh, E; Ghosh, Pradyut","Trapped inorganic phosphate dimer.","Chemical communications (Cambridge, England)","2007","","48","5214","5216","10.1039/b713365k","","","0.71073","MoKα","","0.0769","0.0582","","","0.1215","0.1297","","","","","","1.081","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102375","13.3363","0.0011","14.0385","0.0011","15.5942","0.0013","99.391","0.002","95.841","0.002","108.885","0.002","2687.8","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H63 F15 N9 O8 P -","- C46 H63 F15 N9 O8 P -","- C92 H126 F30 N18 O16 P2 -","2","1","","Lakshminarayanan, P S; Ravikumar, I; Suresh, E; Ghosh, Pradyut","Trapped inorganic phosphate dimer.","Chemical communications (Cambridge, England)","2007","","48","5214","5216","10.1039/b713365k","","","0.71073","MoKα","","0.0882","0.064","","","0.1252","0.1343","","","","","","1.117","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7102376","8.52","0.001","17.573","0.002","9.483","0.002","90","","102.185","0.009","90","","1387.9","0.4","293.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H11 Cu F6 N3 P -","- C11 H11 Cu F6 N3 P -","- C44 H44 Cu4 F24 N12 P4 -","4","1","","Maekawa, Masahiko; Konaka, Hisashi; Minematsu, Toshie; Kuroda-Sowa, Takayoshi; Munakata, Megumu; Kitagawa, Susumu","Bowl-shaped Cu(I) metallamacrocyclic ethylene and carbonyl adducts as structural analogues of organic calixarenes.","Chemical communications (Cambridge, England)","2007","","48","5179","5181","10.1039/b713618h","","","0.7107","MoKα","","","0.0766","","","","0.1958","","","","","","1.149","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102377","14.6057","0.0009","28.37","0.002","14.0685","0.0009","90","","90","","90","","5829","1","150.2","","","","","","","","","","","6","I b a 2","I 2 -2c","45","","","","- C44 H44 Cu4 F24 N12 P4 -","- C44 H44 Cu4 F24 N12 P4 -","- C176 H176 Cu16 F96 N48 P16 -","4","0.5","","Maekawa, Masahiko; Konaka, Hisashi; Minematsu, Toshie; Kuroda-Sowa, Takayoshi; Munakata, Megumu; Kitagawa, Susumu","Bowl-shaped Cu(I) metallamacrocyclic ethylene and carbonyl adducts as structural analogues of organic calixarenes.","Chemical communications (Cambridge, England)","2007","","48","5179","5181","10.1039/b713618h","","","0.7107","MoKα","","","0.0428","","","","0.0964","","","","","","1.078","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102378","14.8455","0.0008","14.8455","0.0008","12.2984","0.0009","90","","90","","90","","2710.4","0.3","150.2","","","","","","","","","","","7","P 4/n :2","-P 4a","85","","","","- C40 H28 Cu4 F24 N12 O4 P4 -","- C40 H28 Cu4 F24 N12 O4 P4 -","- C80 H56 Cu8 F48 N24 O8 P8 -","2","0.25","","Maekawa, Masahiko; Konaka, Hisashi; Minematsu, Toshie; Kuroda-Sowa, Takayoshi; Munakata, Megumu; Kitagawa, Susumu","Bowl-shaped Cu(I) metallamacrocyclic ethylene and carbonyl adducts as structural analogues of organic calixarenes.","Chemical communications (Cambridge, England)","2007","","48","5179","5181","10.1039/b713618h","","","0.7107","MoKα","","","0.0511","","","","0.0928","","","","","","1.19","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102379","14.4419","0.0007","38.607","0.002","21.448","0.001","90","","90","","90","","11958","1","150.2","","","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C33 H33 Cl3 Cu3 N9 O12 -","- C33 H33 Cl3 Cu3 N9 O12 -","- C396 H396 Cl36 Cu36 N108 O144 -","12","3","","Maekawa, Masahiko; Konaka, Hisashi; Minematsu, Toshie; Kuroda-Sowa, Takayoshi; Munakata, Megumu; Kitagawa, Susumu","Bowl-shaped Cu(I) metallamacrocyclic ethylene and carbonyl adducts as structural analogues of organic calixarenes.","Chemical communications (Cambridge, England)","2007","","48","5179","5181","10.1039/b713618h","","","0.7107","MoKα","","","0.0583","","","","0.1168","","","","","","1.093","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7102380","20.056","0.008","26.748","0.01","25.94","0.01","90","","92.836","0.006","90","","13899","9","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C61 H79 Cl63 N15 P3 -","- C61 H79 Cl63 N15 P3 -","- C244 H316 Cl252 N60 P12 -","4","1","","Boomishankar, Ramamoorthy; Ledger, Joanne; Guilbaud, Jean-Baptiste; Campbell, Neil L; Bacsa, John; Bonar-Law, Richard; Khimyak, Yaroslav Z; Steiner, Alexander","The N-donor stabilised cyclotriphosphazene hexacation [P3N3(DMAP)6]6+.","Chemical communications (Cambridge, England)","2007","","48","5152","5154","10.1039/b713847d","","","0.71073","MoKα","","0.1374","0.0958","","","0.2093","0.2304","","","","","","1.037","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102381","9.888","0.0006","10.5709","0.0008","10.8837","0.0008","108.652","0.003","107.329","0.004","99.374","0.004","986.15","0.12","123","2","123","2","","","","","","","","6","P 1","P 1","1","","","","- C37 H69 Al Li N O4 -","- C37 H69 Al Li N O4 -","- C37 H69 Al Li N O4 -","1","1","","Conway, Ben; Hevia, Eva; García-Alvarez, Joaquín; Graham, David V; Kennedy, Alan R; Mulvey, Robert E","Isolation and structural elucidation of a key aluminoaromatic intermediate and evidence for dismutation phenomena in TMP-alumination chemistry.","Chemical communications (Cambridge, England)","2007","","48","5241","5243","10.1039/b713913f","","","0.71073","MoKα","","0.0913","0.0494","","","0.0939","0.1087","","","","","","1.017","","","","has coordinates,has disorder","180125","2020-10-21","18:00:00",""
"7102382","11.04","0.003","7.235","0.002","28.628","0.007","90","","91.016","0.012","90","","2286.3","1.1","298.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H29 N O6 -","- C25 H29 N O6 -","- C100 H116 N4 O24 -","4","1","","Hashimoto, Takuya; Naganawa, Yuki; Kano, Taichi; Maruoka, Keiji","Construction of stereodefined 1,1,2,2-tetrasubstituted cyclopropanes by acid catalyzed reaction of aryldiazoacetates and alpha-substituted acroleins.","Chemical communications (Cambridge, England)","2007","","48","5143","5145","10.1039/b715803c","","","0.71075","MoKα","","","0.0506","","","","0.1576","","","","","","1.07","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7102383","8.2352","0.0004","14.0673","0.0005","17.2845","0.0008","90","","90","","90","","2002.36","0.15","91","1","91","1","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H18 F3 N3 O5 -","- C20 H18 F3 N3 O5 -","- C80 H72 F12 N12 O20 -","4","1","","Santoro, Stefano; Poulsen, Thomas B; Jørgensen, Karl Anker","Enantioselective organocatalytic substitution of alpha-cyanoacetates on imidoyl chlorides‒synthesis of optically active ketimines.","Chemical communications (Cambridge, England)","2007","","48","5155","5157","10.1039/b715810f","","x-ray","1.54178","CuKα","","0.0331","0.031","","","0.0769","0.0778","","","","","","1.062","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7111513","10.5378","0.0002","38.4153","0.0007","19.0976","0.0004","90","","91.6501","0.0008","90","","7727.7","0.3","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C48 H50 Mn -","- C48 H50 Mn -","- C384 H400 Mn8 -","8","2","","Kays (née Coombs), Deborah L.; Cowley, Andrew R.","Monomeric, two-coordinate Mn, Fe and Co(ii) complexes featuring 2,6-(2,4,6-trimethylphenyl)phenyl ligands","Chemical Communications","2007","","10","1053","1055","10.1039/b616584b","","","0.71073","MoKα","","0.1344","0.0575","","0.1076","0.0641","0.0641","","","","","","1.1057","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111514","10.4641","0.0002","38.4046","0.0003","19.1887","0.0002","90","","92.1247","0.0003","90","","7706.05","0.18","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C48 H50 Fe -","- C48 H50 Fe -","- C384 H400 Fe8 -","8","2","","Kays (née Coombs), Deborah L.; Cowley, Andrew R.","Monomeric, two-coordinate Mn, Fe and Co(ii) complexes featuring 2,6-(2,4,6-trimethylphenyl)phenyl ligands","Chemical Communications","2007","","10","1053","1055","10.1039/b616584b","","","0.71073","MoKα","","0.118","0.0463","","0.1005","0.0512","0.0512","","","","","","1.1098","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111515","10.4123","0.0002","38.5032","0.0006","19.1871","0.0003","90","","92.4695","0.0006","90","","7685.1","0.2","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","?","3","P 1 21/c 1","-P 2ybc","14","","","","- C48 H50 Co -","- C48 H50 Co -","- C384 H400 Co8 -","8","2","","Kays (née Coombs), Deborah L.; Cowley, Andrew R.","Monomeric, two-coordinate Mn, Fe and Co(ii) complexes featuring 2,6-(2,4,6-trimethylphenyl)phenyl ligands","Chemical Communications","2007","","10","1053","1055","10.1039/b616584b","","","0.71073","MoKα","","0.095","0.0452","","0.0831","0.051","0.051","","","","","","1.1009","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7111516","13.465","0.003","16.024","0.003","3.81","0.0008","90","","90","","90","","822.1","0.3","100","2","100","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","","","- C9 H11 O3.5 -","- C9 H11 O3.5 -","- C36 H44 O14 -","4","1","","Bailey, Andrew M.; Cox, Russell J.; Harley, Kate; Lazarus, Colin M.; Simpson, Thomas J.; Skellam, Elizabeth","Characterisation of 3-methylorcinaldehyde synthase (MOS) in Acremonium strictum: first observation of a reductive release mechanism during polyketide biosynthesis","Chemical Communications","2007","","39","4053","4055","10.1039/b708614h","","","0.71073","MoKα","","0.0535","0.0478","","","0.1267","0.1422","","","","","","1.233","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7113194","6.748","0.005","10.465","0.005","19.186","0.005","90","0.005","90","0.005","90","0.005","1354.9","1.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H17 Cl O2 -","- C14 H17 Cl O2 -","- C56 H68 Cl4 O8 -","4","1","","Jiang, Jun; He, Long; Luo, Shi-Wei; Cun, Lin-Feng; Gong, Liu-Zhu","Enantioselective desymmetrization of prochiral cyclohexanone derivatives via the organocatalytic direct Aldol reaction.","Chemical communications (Cambridge, England)","2007","","7","736","738","10.1039/b615043h","","","1.54184","CuKα","","0.0387","0.0381","","","0.0924","0.0928","","","","","","1","","","","has coordinates","180245","2020-10-21","18:00:00",""
"7113195","13.224","0.003","17.378","0.003","21.09","0.003","69.703","0.009","71.092","0.009","85.79","0.01","4296.2","1.4","123.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C48 H55 Cl Hg N4 Ni -","- C48 H50.5 Cl Hg N4 Ni -","- C192 H202 Cl4 Hg4 N16 Ni4 -","4","2","","Sugiura, Ken-ichi; Kato, Aiko; Iwasaki, Kentaro; Miyasaka, Hitoshi; Yamashita, Masahiro; Hino, Shojun; Arnold, Dennis P.","Unusual regioselective mercuration of metalloporphyrins and its potential applications","Chemical Communications","2007","","20","2046","","10.1039/b618464b","","","0.7107","MoKα","","","0.0743","","","","0.1852","","","","","","1.337","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7113213","7.6928","0.001","7.7411","0.001","8.1841","0.0011","80.734","0.002","72.131","0.002","85.702","0.002","457.64","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","isonicotinamide, I2","isonicotinamide, I2","","- C6 H6 I2 N2 O -","- C6 H6 I2 N2 O -","- C12 H12 I4 N4 O2 -","2","1","","Aakeröy, Christer B.; Desper, John; Helfrich, Brian A.; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Stevenazzi, Andrea","Combining halogen bonds and hydrogen bonds in the modular assembly of heteromeric infinite 1-D chains","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4236","4238","10.1039/b707458a","","","0.71073","MoKα","","0.0361","0.028","","","0.0677","0.0723","","","","","","1.041","","","","has coordinates","209686","2020-10-21","18:00:00",""
"7113214","20.247","0.003","5.071","0.0009","21.279","0.003","90","","106.911","0.006","90","","2090.3","0.6","297","2","297","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H12 F4 I2 N4 O2 -","- C18 H12 F4 I2 N4 O2 -","- C72 H48 F16 I8 N16 O8 -","4","1","","Aakeröy, Christer B.; Desper, John; Helfrich, Brian A.; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Stevenazzi, Andrea","Combining halogen bonds and hydrogen bonds in the modular assembly of heteromeric infinite 1-D chains","Chemical Communications (Cambridge, United Kingdom)","2007","","41","4236","4238","10.1039/b707458a","","","0.71073","MoKα","","0.0435","0.032","","","0.0813","0.0866","","","","","","1.028","","","","has coordinates","209686","2020-10-21","18:00:00",""
"7125583","15.83","0.0003","16.8625","0.0003","17.9095","0.0004","90","","91.237","0.001","90","","4779.53","0.16","123","2","123","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C48 H64 Mg N8 Na2 -","- C48 H64 Mg N8 Na2 -","- C192 H256 Mg4 N32 Na8 -","4","1","","Conway, Ben; Hevia, Eva; Kennedy, Alan R.; Mulvey, Robert E.","Structurally-defined direct C-magnesiation and C-zincation of N-heterocyclic aromatic compounds using alkali-metal-mediated metallation.","Chemical communications (Cambridge, England)","2007","","27","2864","2866","10.1039/b704362g","","","0.71073","MoKα","","0.0964","0.0496","","","0.0989","0.1161","","","","","","1.015","","","","has coordinates","244079","2020-10-21","18:00:00",""
"7125584","12.2666","0.0002","13.1709","0.0002","14.3918","0.0002","90","","90","","90","","2325.17","0.06","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H32 N4 Zn -","- C24 H32 N4 Zn -","- C96 H128 N16 Zn4 -","4","1","","Conway, Ben; Hevia, Eva; Kennedy, Alan R.; Mulvey, Robert E.","Structurally-defined direct C-magnesiation and C-zincation of N-heterocyclic aromatic compounds using alkali-metal-mediated metallation.","Chemical communications (Cambridge, England)","2007","","27","2864","2866","10.1039/b704362g","","","0.71073","MoKα","","0.0444","0.0309","","","0.0557","0.0601","","","","","","1.024","","","","has coordinates,has disorder","244079","2020-10-21","18:00:00",""
"7125585","10.9318","0.0003","14.4362","0.0004","17.5664","0.0005","90","","90","","90","","2772.22","0.13","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H49 N4 Na Zn -","- C24 H49 N4 Na Zn -","- C96 H196 N16 Na4 Zn4 -","4","1","","Conway, Ben; Hevia, Eva; Kennedy, Alan R.; Mulvey, Robert E.","Structurally-defined direct C-magnesiation and C-zincation of N-heterocyclic aromatic compounds using alkali-metal-mediated metallation.","Chemical communications (Cambridge, England)","2007","","27","2864","2866","10.1039/b704362g","","","0.71073","MoKα","","0.0361","0.0271","","","0.0523","0.056","","","","","","1.057","","","","has coordinates","244079","2020-10-21","18:00:00",""
"7151038","7.2761","0.0003","19.4524","0.0008","36.24","0.001","90","","90","","90","","5129.3","0.3","100","1","100","1","","","","","","","see text","2","P b c a","-P 2ac 2ab","61","","","","- C34 H36 -","- C34 H36 -","- C272 H288 -","8","1","","Ter Wiel, Matthijs K. J.; Kwit, Marcin G.; Meetsma, Auke; Feringa, Ben L.","Synthesis, stereochemistry, and photochemical and thermal behaviour of bis-tert-butyl substituted overcrowded alkenes.","Organic & biomolecular chemistry","2007","5","1","87","96","10.1039/b611070c","","","0.71073","MoKα","","0.0675","0.0475","","","0.1124","0.123","","","","","","1.03","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151039","9.7582","0.0006","14.4454","0.0008","17.915","0.001","90","","90","","90","","2525.3","0.3","100","1","100","1","","","","","","","see text","2","P 21 21 21","P 2ac 2ab","19","","","","- C34 H36 -","- C34 H36 -","- C136 H144 -","4","1","","Ter Wiel, Matthijs K. J.; Kwit, Marcin G.; Meetsma, Auke; Feringa, Ben L.","Synthesis, stereochemistry, and photochemical and thermal behaviour of bis-tert-butyl substituted overcrowded alkenes.","Organic & biomolecular chemistry","2007","5","1","87","96","10.1039/b611070c","","","0.71073","MoKα","","0.0396","0.0341","","","0.0818","0.0838","","","","","","1.049","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151040","25.345","0.017","6.038","0.004","12.627","0.01","90","","104.129","0.018","90","","1874","2","295","2","295","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","(1R*,3S*,6R*)-methyl-2,2-dimethyl-5-oxo-4,7- dioxabicyclo(4.1.0) heptane-3-carboxylate","(1R*,3S*,6R*)-methyl-2,2-dimethyl-5-oxo-4,7-dioxabicyclo[4.1.0] heptane-3-carboxylate","","- C9 H12 O5 -","- C9 H12 O5 -","- C72 H96 O40 -","8","1","","Waller, David L.; Stephenson, Corey R. J.; Wipf, Peter","Spiroketals via oxidative rearrangement of enol ethers.","Organic & biomolecular chemistry","2007","5","1","58","60","10.1039/b612992g","","","0.71073","MoKα","","0.1859","0.1225","","","0.2742","0.3053","","","","","","1.132","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151041","8.849","0.002","15.512","0.003","8.0902","0.0017","90","","101.154","0.019","90","","1089.5","0.4","208","2","208","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(1R*,3S*,5S*,6R*)-methyl-5-hydroxy-2,2,5-trimethyl-4,7- dioxabicyclo(4.1.0)heptane-3-carboxylate","(1R*,3S*,5S*,6R*)-methyl-5-hydroxy-2,2,5-trimethyl-4,7- dioxabicyclo[4.1.0]heptane-3-carboxylate","","- C10 H16 O5 -","- C10 H16 O5 -","- C40 H64 O20 -","4","1","","Waller, David L.; Stephenson, Corey R. J.; Wipf, Peter","Spiroketals via oxidative rearrangement of enol ethers.","Organic & biomolecular chemistry","2007","5","1","58","60","10.1039/b612992g","","","0.71073","MoKα","","0.0959","0.0567","","","0.1245","0.1445","","","","","","1.032","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151042","11.581","0.0004","14.4762","0.0005","17.7027","0.0007","90","","90","","90","","2967.84","0.19","150","2","150","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H33 N7 O6 -","- C31 H33 N7 O6 -","- C124 H132 N28 O24 -","4","1","","Tan, T. H. Samuel; Worthington, Roberta J.; Pritchard, Robin G.; Morral, Jordi; Micklefield, Jason","Homopolymeric pyrrolidine-amide oligonucleotide mimics: Fmoc-synthesis and DNA/RNA binding properties.","Organic & biomolecular chemistry","2007","5","2","239","248","10.1039/b613384n","","x-ray","0.71073","MoKα","","0.0891","0.045","","","0.0771","0.0903","","","","","","1.013","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151043","5.1589","0.0002","10.5387","0.0005","7.4162","0.0004","90","","93.901","0.003","90","","402.27","0.03","150","2","150","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","","","- C5 H11 Cl N4 O -","- C5 H11 Cl N4 O -","- C10 H22 Cl2 N8 O2 -","2","1","","Tan, T. H. Samuel; Worthington, Roberta J.; Pritchard, Robin G.; Morral, Jordi; Micklefield, Jason","Homopolymeric pyrrolidine-amide oligonucleotide mimics: Fmoc-synthesis and DNA/RNA binding properties.","Organic & biomolecular chemistry","2007","5","2","239","248","10.1039/b613384n","","x-ray","0.71073","MoKα","","0.0502","0.0372","","","0.0657","0.0692","","","","","","1.009","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151044","7.7564","0.0009","13.3948","0.0009","25.589","0.003","90","","90","","90","","2658.6","0.5","150","2","150","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H35 N7 O6 -","- C24 H35 N7 O6 -","- C96 H140 N28 O24 -","4","1","","Worthington, Roberta J.; O'Rourke, Adam P; Morral, Jordi; Tan, T. H. Samuel; Micklefield, Jason","Mixed-sequence pyrrolidine-amide oligonucleotide mimics: Boc(Z) synthesis and DNA/RNA binding properties.","Organic & biomolecular chemistry","2007","5","2","249","259","10.1039/b613386j","","x-ray","0.71073","MoKα","","0.2379","0.0956","","","0.2102","0.3014","","","","","","1.02","","","","has coordinates,has disorder","180296","2020-10-21","18:00:00",""
"7151045","4.9735","0.0007","10.531","0.002","17.521","0.003","90","","90","","90","","917.7","0.3","100","1","100","1","","","","","","","see text","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H11 Cl O -","- C10 H11 Cl O -","- C40 H44 Cl4 O4 -","4","1","","Haak, Robert M.; Tarabiono, Chiara; Janssen, Dick B.; Minnaard, Adriaan J.; de Vries, Johannes G.; Feringa, Ben L.","Synthesis of enantiopure chloroalcohols by enzymatic kinetic resolution.","Organic & biomolecular chemistry","2007","5","2","318","323","10.1039/b613937j","","","0.71073","MoKα","","0.0337","0.0311","","","0.0687","0.0698","","","","","","1.078","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151046","4.6405","0.0007","25.329","0.004","12.191","0.0017","90","","97.047","0.002","90","","1422.1","0.4","150","2","150","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C16 H14 N2 O S -","- C16 H14 N2 O S -","- C64 H56 N8 O4 S4 -","4","1","","Bowman, W. Russell; Elsegood, Mark R. J.; Stein, Tobias; Weaver, George W.","Radical reactions with 3H-quinazolin-4-ones: synthesis of deoxyvasicinone, mackinazolinone, luotonin A, rutaecarpine and tryptanthrin.","Organic & biomolecular chemistry","2007","5","1","103","113","10.1039/b614075k","","","0.71073","MoKα","","0.0837","0.0602","","","0.1444","0.159","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151047","6.6511","0.0003","8.6274","0.0003","14.5395","0.0007","90.123","0.002","94.525","0.003","99.594","0.003","819.97","0.06","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H11 Cl3 N2 O3 -","- C17 H11 Cl3 N2 O3 -","- C34 H22 Cl6 N4 O6 -","2","1","","Bowman, W. Russell; Elsegood, Mark R. J.; Stein, Tobias; Weaver, George W.","Radical reactions with 3H-quinazolin-4-ones: synthesis of deoxyvasicinone, mackinazolinone, luotonin A, rutaecarpine and tryptanthrin.","Organic & biomolecular chemistry","2007","5","1","103","113","10.1039/b614075k","","","0.71073","MoKα","","0.055","0.0353","","","0.0851","0.0939","","","","","","1.028","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151048","22.77","0.003","7.5283","0.0011","19.57","0.003","90","","111.923","0.012","90","","3112.1","0.8","158","2","158","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H25 Cl3 Fe2 N2 -","- C37 H25 Cl3 Fe2 N2 -","- C148 H100 Cl12 Fe8 N8 -","4","1","","Schmittel, Michael; Kishore, Ravuri S. K.; Bats, Jan W.","Synthesis of supramolecular fullerene-porphyrin-Cu(phen)(2)-ferrocene architectures. A heteroleptic approach towards tetrads.","Organic & biomolecular chemistry","2007","5","1","78","86","10.1039/b614111k","","","0.71073","MoKα","","0.0947","0.0517","","","0.1221","0.1434","","","","","","1.024","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151049","8.6316","0.0002","14.8772","0.0003","14.4589","0.0003","90","","95.3308","0.0011","90","","1848.7","0.07","93.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H15 Cl2 N O5 -","- C21 H15 Cl2 N O5 -","- C84 H60 Cl8 N4 O20 -","4","1","","Ando, Kumiko; Akai, Yukiko; Kunitomo, Jun-Ichi; Yokomizo, Takehiko; Nakajima, Hidemitsu; Takeuchi, Tadayoshi; Yamashita, Masayuki; Ohta, Shunsaku; Ohishi, Takahiro; Ohishi, Yoshitaka","Synthesis and biological activities of novel furo[2,3,4-jk][2]benzazepin-4(3H)-one derivatives.","Organic & biomolecular chemistry","2007","5","4","655","663","10.1039/b614510h","","","1.54187","CuKα","","","0.058","","","","0.1675","","","","","","0.977","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151050","9.576","0.002","20.504","0.005","10.143","0.003","90","","112.421","0.011","90","","1841","0.8","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(2R,5R,6S)-N-(2',3',4'-Tri-O-pivaloyl-a-d-arabinopyranosyl)-5,6-diallyl- 2-isopropyl-piperidin-4-one","","- C34 H55 N O8 -","- C34 H55 N O8 -","- C68 H110 N2 O16 -","2","1","","Kranke, Birgit; Kunz, Horst","Stereoselective syntheses of piperidinones and their modification by organometallic coupling reactions.","Organic & biomolecular chemistry","2007","5","2","349","354","10.1039/b615113b","","","1.54178","CuKα","","0.0604","0.0562","","","0.1633","0.1696","","","","","","1.029","","","","has coordinates,has disorder","180296","2020-10-21","18:00:00",""
"7151051","8.8832","0.0012","10.3813","0.0015","12.0879","0.0017","81.631","0.002","81.67","0.002","78.225","0.002","1072","0.3","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H33 N O4 -","- C24 H33 N O4 -","- C48 H66 N2 O8 -","2","1","","McErlean, Christopher S. P.; Proisy, Nicolas; Davis, Christopher J.; Boland, Nicola A.; Sharp, Swee Y.; Boxall, Kathy; Slawin, Alexandra M. Z.; Workman, Paul; Moody, Christopher J.","Synthetic ansamycins prepared by a ring-expanding Claisen rearrangement. Synthesis and biological evaluation of ring and conformational analogues of the Hsp90 molecular chaperone inhibitor geldanamycin.","Organic & biomolecular chemistry","2007","5","3","531","546","10.1039/b615378j","","","0.71073","MoKα","","0.0834","0.0681","","","0.1683","0.1813","","","","","","1.032","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151052","8.4729","0.0001","8.9346","0.0001","15.8498","0.0003","88.5376","0.0006","80.8585","0.0006","83.8057","0.0006","1177.66","0.03","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H33 N3 Si -","- C24 H33 N3 Si -","- C48 H66 N6 Si2 -","2","1","","Tamm, Matthias; Petrovic, Dejan; Randoll, Sören; Beer, Stephan; Bannenberg, Thomas; Jones, Peter G.; Grunenberg, Jörg","Structural and theoretical investigation of 2-iminoimidazolines‒carbene analogues of iminophosphoranes.","Organic & biomolecular chemistry","2007","5","3","523","530","10.1039/b615418b","","","0.71073","MoKα","","0.0426","0.0374","","","0.1003","0.1039","","","","","","1.029","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151053","9.617","0.0008","12.462","0.001","25.214","0.002","88.322","0.002","84.261","0.002","79.785","0.002","2958.8","0.4","133","","133","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H45 N3 Si -","- C30 H45 N3 Si -","- C120 H180 N12 Si4 -","4","2","","Tamm, Matthias; Petrovic, Dejan; Randoll, Sören; Beer, Stephan; Bannenberg, Thomas; Jones, Peter G.; Grunenberg, Jörg","Structural and theoretical investigation of 2-iminoimidazolines‒carbene analogues of iminophosphoranes.","Organic & biomolecular chemistry","2007","5","3","523","530","10.1039/b615418b","","","0.71073","MoKα","","0.1118","0.0552","","","0.1109","0.1269","","","","","","0.895","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151054","9.8042","0.0001","11.0624","0.0002","11.6724","0.0002","90","","112.329","0.0007","90","","1171.04","0.03","173","","133","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H21 N3 -","- C11 H21 N3 -","- C44 H84 N12 -","4","1","","Tamm, Matthias; Petrovic, Dejan; Randoll, Sören; Beer, Stephan; Bannenberg, Thomas; Jones, Peter G.; Grunenberg, Jörg","Structural and theoretical investigation of 2-iminoimidazolines‒carbene analogues of iminophosphoranes.","Organic & biomolecular chemistry","2007","5","3","523","530","10.1039/b615418b","","","0.71073","MoKα","","0.0462","0.0378","","","0.0936","0.0981","","","","","","1.043","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151055","7.5606","0.0002","16.9628","0.0004","9.1745","0.0002","90","","92.2557","0.0008","90","","1175.71","0.05","173","","123","2","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C11 H21 N3 -","- C11 H21 N3 -","- C44 H84 N12 -","4","1","","Tamm, Matthias; Petrovic, Dejan; Randoll, Sören; Beer, Stephan; Bannenberg, Thomas; Jones, Peter G.; Grunenberg, Jörg","Structural and theoretical investigation of 2-iminoimidazolines‒carbene analogues of iminophosphoranes.","Organic & biomolecular chemistry","2007","5","3","523","530","10.1039/b615418b","","","0.71073","MoKα","","0.0326","0.0296","","","0.0657","0.0673","","","","","","1.104","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151056","10.3194","0.0011","8.4799","0.0009","12.1497","0.0013","90","","106.293","0.002","90","","1020.49","0.19","133","2","133","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C9 H17 N3 -","- C9 H17 N3 -","- C36 H68 N12 -","4","1","","Tamm, Matthias; Petrovic, Dejan; Randoll, Sören; Beer, Stephan; Bannenberg, Thomas; Jones, Peter G.; Grunenberg, Jörg","Structural and theoretical investigation of 2-iminoimidazolines‒carbene analogues of iminophosphoranes.","Organic & biomolecular chemistry","2007","5","3","523","530","10.1039/b615418b","","","0.71073","MoKα","","0.0693","0.0496","","","0.1191","0.1279","","","","","","1.028","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151057","11.259","0.002","9.8467","0.0018","18.752","0.003","90","","103.035","0.006","90","","2025.4","0.6","133","","133","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H33 N3 Si2 -","- C15 H33 N3 Si2 -","- C60 H132 N12 Si8 -","4","1","","Tamm, Matthias; Petrovic, Dejan; Randoll, Sören; Beer, Stephan; Bannenberg, Thomas; Jones, Peter G.; Grunenberg, Jörg","Structural and theoretical investigation of 2-iminoimidazolines‒carbene analogues of iminophosphoranes.","Organic & biomolecular chemistry","2007","5","3","523","530","10.1039/b615418b","","","0.71073","MoKα","","0.0807","0.0633","","","0.1509","0.1581","","","","","","1.127","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151058","14.995","0.002","15.949","0.002","17.6433","0.0004","68.348","0.01","71.33","0.01","88.86","0.01","3692.2","0.8","113.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C69 H100 N22 O6 -","- C69 H100 N22 O6 -","- C138 H200 N44 O12 -","2","1","","Kondo, Shin-Ichi; Hayashi, Tomohiro; Sakuno, Yuichi; Takezawa, Yoko; Yokoyama, Takashi; Unno, Masafumi; Yano, Yumihiko","Synthesis of cyclic bis- and trismelamine derivatives and their complexation properties with barbiturates.","Organic & biomolecular chemistry","2007","5","6","907","916","10.1039/b615537e","","","0.7107","MoKα","","0.1391","0.0836","","","0.2003","0.2368","","","","","","0.83","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151059","8.578","0.0009","9.477","0.0009","9.818","0.001","88.558","0.004","89.264","0.004","73.154","0.004","763.64","0.13","273.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C16 H24 O3 -","- C16 H24 O3 -","- C32 H48 O6 -","2","1","","Takagi, Ryukichi; Miwa, Yukiko; Nerio, Takashi; Inoue, Yuta; Matsumura, Shuji; Ohkata, Katsuo","Stereochemical investigation on the construction of poly-functionalized bicyclo[3.3.1]nonenones by successive Michael reactions of 2-cyclohexenones.","Organic & biomolecular chemistry","2007","5","2","286","300","10.1039/b615702e","","","0.7107","MoKα","","","0.1188","","","","0.4316","","","","","","1.936","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151060","12.301","0.0004","11.053","0.0003","13.202","0.0004","90","","112.715","0.001","90","","1655.76","0.09","273.2","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C17 H26 O3 -","- C17 H26 O3 -","- C68 H104 O12 -","4","1","","Takagi, Ryukichi; Miwa, Yukiko; Nerio, Takashi; Inoue, Yuta; Matsumura, Shuji; Ohkata, Katsuo","Stereochemical investigation on the construction of poly-functionalized bicyclo[3.3.1]nonenones by successive Michael reactions of 2-cyclohexenones.","Organic & biomolecular chemistry","2007","5","2","286","300","10.1039/b615702e","","","0.7107","MoKα","","","0.0741","","","","0.2924","","","","","","1.465","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151061","9.893","0.0003","11.174","0.0002","19.187","0.0007","85.225","0.001","77.416","0.001","68.107","0.001","1920.77","0.1","273.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C19 H28 O6 -","- C19 H28 O6 -","- C76 H112 O24 -","4","2","","Takagi, Ryukichi; Miwa, Yukiko; Nerio, Takashi; Inoue, Yuta; Matsumura, Shuji; Ohkata, Katsuo","Stereochemical investigation on the construction of poly-functionalized bicyclo[3.3.1]nonenones by successive Michael reactions of 2-cyclohexenones.","Organic & biomolecular chemistry","2007","5","2","286","300","10.1039/b615702e","","","0.7107","MoKα","","","0.1225","","","","0.4492","","","","","","2.132","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151062","18.967","0.003","12.7861","0.0018","19.491","0.003","90","","96.878","0.002","90","","4692.8","1.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","05263","","","- C22 H35 N O4 Si -","- C22 H35 N O4 Si -","- C176 H280 N8 O32 Si8 -","8","2","","Ko, Changhong; Hsung, Richard P.","An unusual stereoselectivity in the anomeric substitution with carbamates promoted by HNTf2.","Organic & biomolecular chemistry","2007","5","3","431","434","10.1039/b615725d","","","0.71073","MoKα","","0.1338","0.0697","","","0.1745","0.2237","","","","","","1.022","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151063","19.5903","0.0005","16.057","0.0002","6.075","0.0002","90","","90","","90","","1910.96","0.08","180","2","180","2","","","","","","","","4","P n a 21","P 2c -2n","33","","t-Butyl [3-hydroxy-3-(p-tolyl)-1-phenylpropyl)carbamate","","- C21 H27 N O3 -","- C21 H27 N O3 -","- C84 H108 N4 O12 -","4","1","","Tillman, A. Louise; Dixon, Darren J.","An enantioselective Brønsted acid catalyzed enamine Mannich reaction.","Organic & biomolecular chemistry","2007","5","4","606","609","10.1039/b616143j","","","0.71073","MoKα","","0.0489","0.0424","","","0.1099","0.1149","","","","","","1.185","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151064","5.148","0.0001","15.808","0.0003","21.3073","0.0005","90","","90","","90","","1733.98","0.06","153","2","153","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H20 Cl N O2 -","- C20 H20 Cl N O2 -","- C80 H80 Cl4 N4 O8 -","4","1","","Chen, Wei; Du, Wei; Yue, Lei; Li, Rui; Wu, Yong; Ding, Li-Sheng; Chen, Ying-Chun","Organocatalytic enantioselective indole alkylations of alpha,beta-unsaturated ketones.","Organic & biomolecular chemistry","2007","5","5","816","821","10.1039/b616504d","","","0.71073","MoKα","","0.0302","0.0296","","","0.0778","0.0782","","","","","","1.008","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151065","8.8615","0.0012","24.322","0.003","11.2807","0.0016","90","","111.633","0.002","90","","2260.1","0.5","87","2","87","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","(R2PdCl2)(NTf)2","","","- C30 H36 Cl2 F12 N8 O8 Pd S4 -","- C30 H36 Cl2 F12 N8 O8 Pd S4 -","- C60 H72 Cl4 F24 N16 O16 Pd2 S8 -","2","0.5","","Ruihu Wang; Ji-Chang Xiao; Brendan Twamley; Jean'ne M. Shreeve","Efficient Heck reactions catalyzed by a highly recyclable palladium(II) complex of a pyridyl-functionalized imidazolium-based ionic liquid.","Organic & biomolecular chemistry","2007","5","4","671","678","10.1039/b616529j","","","0.71073","MoKα","","0.0412","0.0382","","","0.0849","0.0864","","","","","","1.081","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151066","8.2761","0.0017","10.042","0.002","15.189","0.003","74.44","0.03","81.7","0.03","82.47","0.03","1197.7","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H15 N O3 -","- C13 H15 N O3 -","- C52 H60 N4 O12 -","4","2","","Cox, Russell J.; Evitt, Andrew S.","Acyl palladium species in synthesis: single-step synthesis of alpha,beta-unsaturated ketones from acid chlorides.","Organic & biomolecular chemistry","2007","5","2","229","232","10.1039/b616582f","","","0.71073","MoKα","","0.1605","0.1222","","","0.2105","0.2285","","","","","","1.482","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151067","7.6506","0.0008","18.5206","0.0018","8.4687","0.0008","90","","110.451","0.005","90","","1124.3","0.2","190","2","190","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5-Methyl-2-dimethylamino-4-methylcarbonyl- 1-thia-6-oxa-6aλ4-seleno-3-azapentalene","","- C9 H12 N2 O2 S Se -","- C9 H12 N2 O2 S Se -","- C36 H48 N8 O8 S4 Se4 -","4","1","","Koketsu, Mamoru; Otsuka, Toshihiro; Swenson, Dale; Ishihara, Hideharu","The synthesis of 1-thia-6-oxa-6alambda(4)-seleno-3-azapentalene and a 3H-1,2,4-dithiazole.","Organic & biomolecular chemistry","2007","5","4","613","616","10.1039/b617097h","","","0.71073","MoKα","","0.0267","0.0224","","","0.056","0.0582","","","","","","1.078","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151068","7.6627","0.0008","18.4638","0.0018","8.3775","0.0008","90","","110.288","0.005","90","","1111.74","0.19","190","2","190","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Diacetylmethylidene-5-dimethylamino-3H-1,2,4-dithiazole","","- C9 H12 N2 O2 S2 -","- C9 H12 N2 O2 S2 -","- C36 H48 N8 O8 S8 -","4","1","","Koketsu, Mamoru; Otsuka, Toshihiro; Swenson, Dale; Ishihara, Hideharu","The synthesis of 1-thia-6-oxa-6alambda(4)-seleno-3-azapentalene and a 3H-1,2,4-dithiazole.","Organic & biomolecular chemistry","2007","5","4","613","616","10.1039/b617097h","","","0.71069","MoKα","","0.0412","0.032","","","0.0802","0.0845","","","","","","1.031","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151069","10.1624","0.001","7.4766","0.0007","14.124","0.0014","90","","111.027","0.005","90","","1001.69","0.17","190","2","190","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Thiocarbamate thioanhydride","","","- C6 H12 N2 S1.97 Se1.03 -","- C6 H12 N2 S1.971 Se1.029 -","- C24 H48 N8 S7.884 Se4.116 -","4","1","","Koketsu, Mamoru; Otsuka, Toshihiro; Swenson, Dale; Ishihara, Hideharu","The synthesis of 1-thia-6-oxa-6alambda(4)-seleno-3-azapentalene and a 3H-1,2,4-dithiazole.","Organic & biomolecular chemistry","2007","5","4","613","616","10.1039/b617097h","","","0.71073","MoKα","","0.0277","0.0236","","","0.0475","0.0486","","","","","","1.143","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7151070","18.383","0.002","9.9133","0.0012","23.371","0.003","90","","106.34","0.02","90","","4087","0.9","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21.75 H18.5 N3 O4.25 -","- C21.75 H18.5 N3 O4.25 -","- C174 H148 N24 O34 -","8","1","","Tu, Shujiang; Zhang, Junyong; Jia, Runhong; Jiang, Bo; Zhang, Yan; Jiang, Hong","An efficient route for the synthesis of a new class of pyrido[2,3-d]pyrimidine derivatives.","Organic & biomolecular chemistry","2007","5","9","1450","1453","10.1039/b617201f","","","0.71073","MoKα","","0.1575","0.0641","","","0.1565","0.2072","","","","","","0.998","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151071","10.024","0.0017","10.7729","0.0018","11.1615","0.0019","81.47","0.002","89.328","0.002","69.72","0.002","1117.1","0.3","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","","","- C30 H27 N -","- C30 H27 N -","- C60 H54 N2 -","2","1","","Yan, Chao-Guo; Cai, Xi-Mei; Wang, Qi-Fang; Wang, Ting-Yu; Zheng, Ming","Microwave-assisted four-component, one-pot condensation reaction: an efficient synthesis of annulated pyridines.","Organic & biomolecular chemistry","2007","5","6","945","951","10.1039/b617256c","","","0.71073","MoKα","","0.0761","0.0487","","","0.1207","0.1358","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151072","10.7313","0.0014","10.8332","0.0014","17.189","0.002","91.122","0.002","101.774","0.002","99.739","0.002","1925","0.4","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","","","- C52 H42 N2 -","- C52 H42 N2 -","- C104 H84 N4 -","2","1","","Yan, Chao-Guo; Cai, Xi-Mei; Wang, Qi-Fang; Wang, Ting-Yu; Zheng, Ming","Microwave-assisted four-component, one-pot condensation reaction: an efficient synthesis of annulated pyridines.","Organic & biomolecular chemistry","2007","5","6","945","951","10.1039/b617256c","","","0.71073","MoKα","","0.111","0.0619","","","0.1548","0.1796","","","","","","1.001","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151073","4.6327","0.0011","24.041","0.006","12.808","0.003","90","","91.977","0.005","90","","1425.6","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 F2 N O2 -","- C16 H15 F2 N O2 -","- C64 H60 F8 N4 O8 -","4","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.1162","0.0527","","","0.1144","0.1373","","","","","","0.807","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151074","8.9925","0.0009","16.8092","0.0018","18.0165","0.0019","75.543","0.002","89.972","0.002","83.735","0.002","2620.3","0.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H13 F2 N O -","- C15 H13 F2 N O -","- C120 H104 F16 N8 O8 -","8","4","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.1375","0.0535","","","0.1086","0.1374","","","","","","0.851","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151075","19.88","0.003","9.8369","0.0016","15.11","0.002","90","","90","","90","","2954.9","0.8","150","2","150","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C17 H18 F2 N2 O -","- C17 H18 F2 N2 O -","- C136 H144 F16 N16 O8 -","8","2","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.1157","0.0547","","","0.1219","0.1632","","","","","","0.916","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151076","4.6438","0.0013","13.421","0.004","23.018","0.007","90","","92.683","0.006","90","","1433","0.7","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 F2 N2 O3 -","- C15 H12 F2 N2 O3 -","- C60 H48 F8 N8 O12 -","4","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.0598","0.0407","","","0.1011","0.1108","","","","","","0.981","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151077","4.7498","0.001","10.856","0.002","26.289","0.006","90","","92.256","0.004","90","","1354.5","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H10 F5 N O -","- C15 H10 F5 N O -","- C60 H40 F20 N4 O4 -","4","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.0861","0.0435","","","0.1098","0.1338","","","","","","0.889","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151078","12.822","0.004","11.499","0.003","9.804","0.002","90","","103.84","0.02","90","","1403.5","0.6","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C15 H10 F5 N O -","- C15 H10 F5 N O -","- C60 H40 F20 N4 O4 -","4","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.0633","0.0474","","","0.1119","0.1284","","","","","","0.908","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151079","4.7538","0.0019","10.885","0.007","30.402","0.012","90","","91.1","0.04","90","","1572.9","1.3","571","2","571","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H15 F5 N2 O -","- C17 H15 F5 N2 O -","- C68 H60 F20 N8 O4 -","4","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.3101","0.0588","","","0.1071","0.1584","","","","","","0.69","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151080","4.6658","0.0008","13.056","0.002","13.473","0.002","63.577","0.003","85.102","0.003","84.119","0.003","730.4","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H9 F5 N2 O3 -","- C15 H9 F5 N2 O3 -","- C30 H18 F10 N4 O6 -","2","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.0631","0.0429","","","0.1124","0.1266","","","","","","0.888","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151081","4.7637","0.0011","10.695","0.003","14.616","0.004","90","","96.579","0.005","90","","739.7","0.3","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H12 F5 N O2 -","- C16 H12 F5 N O2 -","- C32 H24 F10 N2 O4 -","2","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.0723","0.0463","","","0.1058","0.1181","","","","","","0.917","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151082","9.181","0.009","19.2","0.02","19.68","0.02","90","","90","","90","","3469","6","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C19 H24 N2 O -","- C19 H24 N2 O -","- C152 H192 N16 O8 -","8","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.1752","0.0727","","","0.1497","0.1921","","","","","","1.001","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151083","22.145","0.003","4.8085","0.0006","14.617","0.0018","90","","95.725","0.003","90","","1548.7","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H18 N2 O3 -","- C17 H18 N2 O3 -","- C68 H72 N8 O12 -","4","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.2274","0.059","","","0.1152","0.191","","","","","","0.794","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151084","15.067","0.0017","12.8503","0.0014","15.5065","0.0017","90","","105.241","0.002","90","","2896.7","0.6","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22 N4 O6 -","- C24 H22 N4 O6 -","- C96 H88 N16 O24 -","4","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.0759","0.0507","","","0.1335","0.1419","","","","","","1.102","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151085","4.634","0.003","12.208","0.006","29.098","0.016","90","","92.433","0.011","90","","1644.6","1.6","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H17 N3 O5 -","- C17 H17 N3 O5 -","- C68 H68 N12 O20 -","4","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.3382","0.0754","","","0.1585","0.2433","","","","","","0.766","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151086","16.939","0.003","12.274","0.002","8.5993","0.0015","90","","90","","90","","1787.9","0.5","423","2","423","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C23 H18 N2 O3 -","- C23 H18 N2 O3 -","- C92 H72 N8 O12 -","4","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.0906","0.0579","","","0.1256","0.1411","","","","","","0.816","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151087","11.1542","0.001","8.497","0.0007","31.528","0.003","90","","95.122","0.002","90","","2976.2","0.5","150","2","150","2","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C16 H12 F5 N O -","- C16 H12 F5 N O -","- C128 H96 F40 N8 O8 -","8","4","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.0919","0.0502","","","0.1172","0.1371","","","","","","1.023","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151088","15.436","0.008","11.833","0.006","16.617","0.009","90","","111.728","0.009","90","","2820","3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H34 Cl2 N2 O4 -","- C28 H34 Cl2 N2 O4 -","- C112 H136 Cl8 N8 O16 -","4","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.2092","0.095","","","0.2357","0.2908","","","","","","0.866","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151089","7.123","0.003","16.792","0.008","13.785","0.007","90","","102.881","0.009","90","","1607.3","1.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 N2 O3 -","- C18 H20 N2 O3 -","- C72 H80 N8 O12 -","4","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.3108","0.0758","","","0.1534","0.2135","","","","","","0.74","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151090","7.984","0.008","16.218","0.014","8.171","0.008","90","","112.95","0.15","90","","974.3","1.9","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H13 N O -","- C10 H13 N O -","- C40 H52 N4 O4 -","4","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.2053","0.093","","","0.2273","0.3073","","","","","","1.001","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151091","7.403","0.014","13.41","0.03","18.84","0.03","76.34","0.14","80.3","0.2","88.66","0.16","1791","6","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","- C88 H80 N8 O8 -","4","2","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71073","MoKα","","0.2151","0.0686","","","0.1436","0.2235","","","","","","0.809","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151092","11.261","0.004","9.225","0.004","32.382","0.011","90","","95.503","0.011","90","","3348","2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 F4 N2 O2 -","- C20 H12 F4 N2 O2 -","- C160 H96 F32 N16 O16 -","8","1","","Cockroft, Scott L.; Perkins, Julie; Zonta, Cristiano; Adams, Harry; Spey, Sharon E.; Low, Caroline M. R.; Vinter, Jeremy G.; Lawson, Kevin R.; Urch, Christopher J.; Hunter, Christopher A.","Substituent effects on aromatic stacking interactions.","Organic & biomolecular chemistry","2007","5","7","1062","1080","10.1039/b617576g","","","0.71069","MoKα","","0.0668","0.0461","","","0.1057","0.1202","","","","","","1.016","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151093","25.403","0.009","17.845","0.004","17.218","0.004","90","","132.09","0.02","90","","5792","3","293","2","293","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C75 H16 Cl6 N2 O6 -","- C83 H36 Cl6 N2 O6 -","- C332 H144 Cl24 N8 O24 -","4","0.5","","Gubskaya, Valentina P.; Berezhnaya, Lucia Sh; Gubaidullin, Aidar T.; Faingold, Irina I.; Kotelnikova, Raisa A.; Konovalova, Nina P.; Morozov, Vladimir I.; Litvinov, Igor A.; Nuretdinov, Ildus A.","Synthesis, structure and biological activity of nitroxide malonate methanofullerenes.","Organic & biomolecular chemistry","2007","5","6","976","981","10.1039/b617892h","","","1.54184","CuKα","","0.4209","0.0579","","","0.1031","0.1923","","","","","","0.829","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151094","8.1168","0.0011","18.618","0.005","10.168","0.002","90","","90","","90","","1536.6","0.6","294","2","294","1","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C17 H19 N O S -","- C17 H19 N O S -","- C68 H76 N4 O4 S4 -","4","1","","Murphy, Maureen; Lynch, Denis; Schaeffer, Marcel; Kissane, Marie; Chopra, Jay; O'brien, Elisabeth; Ford, Alan; Ferguson, George; Maguire, Anita R.","Investigation of the synthetic and mechanistic aspects of the highly stereoselective transformation of alpha-thioamides to alpha-thio-beta-chloroacrylamides.","Organic & biomolecular chemistry","2007","5","8","1228","1241","10.1039/b618540a","","","0.71073","MolybdenumKα","","0.1086","0.0827","","","0.2049","0.2278","","","","","","1.009","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151095","12.949","0.003","13.3462","0.0013","18.932","0.004","90","","103.939","0.023","90","","3175.5","1.1","294","","294","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C17 H19 N O S -","- C17 H19 N O S -","- C136 H152 N8 O8 S8 -","8","2","","Murphy, Maureen; Lynch, Denis; Schaeffer, Marcel; Kissane, Marie; Chopra, Jay; O'brien, Elisabeth; Ford, Alan; Ferguson, George; Maguire, Anita R.","Investigation of the synthetic and mechanistic aspects of the highly stereoselective transformation of alpha-thioamides to alpha-thio-beta-chloroacrylamides.","Organic & biomolecular chemistry","2007","5","8","1228","1241","10.1039/b618540a","","","0.71073","MolybdenumKα","","0.1202","0.0399","","","0.0731","0.0891","","","","","","1.004","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151096","5.7926","0.0003","10.0685","0.0006","12.2947","0.0007","65.873","0.001","76.452","0.001","85.507","0.001","636.09","0.06","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H16 N6 O -","- C13 H16 N6 O -","- C26 H32 N12 O2 -","2","1","","Huang, Weiqiang; Miller, Marvin J.; De Clercq, Erik; Balzarini, Jan","Syntheses and anti-HIV activities of (+/-)-norcarbovir and (+/-)-norabacavir.","Organic & biomolecular chemistry","2007","5","8","1164","1166","10.1039/b700321h","","","0.71073","MoKα","","0.056","0.0529","","","0.1457","0.1491","","","","","","1.058","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151097","8.4065","0.0012","9.6892","0.0014","26.482","0.004","90","","90","","90","","2157","0.5","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H29 N O2 -","- C26 H29 N O2 -","- C104 H116 N4 O8 -","4","1","","McGhee, Andrea M.; Kizirian, Jean-Claude; Procter, David J.","Synthesis and evaluation of a new polymer-supported pseudoephedrine auxiliary for asymmetric alkylations on solid phase.","Organic & biomolecular chemistry","2007","5","7","1021","1024","10.1039/b700477j","","","0.71073","MoKα","","0.0487","0.0456","","","0.1124","0.1144","","","","","","1.177","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151098","8.0161","0.0009","10.6336","0.0013","18.746","0.002","90","","93.498","0.002","90","","1594.9","0.3","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H19 N O3 Se -","- C18 H19 N O3 Se -","- C72 H76 N4 O12 Se4 -","4","1","","Aumann, Kylee M.; Scammells, Peter J.; White, Jonathan M.; Schiesser, Carl H.","On the stability of 2-aminoselenophene-3-carboxylates: potential dual-acting selenium-containing allosteric enhancers of A1 adenosine receptor binding.","Organic & biomolecular chemistry","2007","5","8","1276","1281","10.1039/B700812K","","","0.71073","MoKα","","0.0357","0.0304","","","0.0803","0.0831","","","","","","1.057","","","","has coordinates,has disorder","180296","2020-10-21","18:00:00",""
"7151099","9.6394","0.001","10.0481","0.0011","10.1555","0.0011","93.933","0.002","101.874","0.002","117.258","0.002","840.58","0.16","123","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H18 N2 O5 Se -","- C18 H18 N2 O5 Se -","- C36 H36 N4 O10 Se2 -","2","1","","Aumann, Kylee M.; Scammells, Peter J.; White, Jonathan M.; Schiesser, Carl H.","On the stability of 2-aminoselenophene-3-carboxylates: potential dual-acting selenium-containing allosteric enhancers of A1 adenosine receptor binding.","Organic & biomolecular chemistry","2007","5","8","1276","1281","10.1039/B700812K","","","0.71073","MoKα","","0.0387","0.034","","","0.0865","0.0897","","","","","","1.075","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151100","11.264","0.0002","16.634","0.0003","17.048","0.0002","90","","90","","90","","3194.2","0.09","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C38 H43 N O4 -","- C38 H43 N O4 -","- C152 H172 N4 O16 -","4","1","","Davies, Stephen G.; Roberts, Paul M.; Smith, Andrew D.","Asymmetric three- and [2 + 1]-component conjugate addition reactions for the stereoselective synthesis of polysubstituted piperidinones.","Organic & biomolecular chemistry","2007","5","9","1405","1415","10.1039/b701226h","","","0.71069","MoKα","","","0.0253","","","","0.031","","","","","","0.9146","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151101","9.416","0.002","13.56","0.003","15.727","0.003","90","","90","","90","","2008","0.7","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Dimethyl 2-(N-benzyl-N'-isopropylimidazolin-2-ylidene)-3- thioxobutanedioate","","","- C19 H22 N2 O4 S -","- C19 H22 N2 O4 S -","- C76 H88 N8 O16 S4 -","4","1","","Zhu, Qing; Liu, Mei-Fang; Wang, Bo; Cheng, Ying","An unprecedented tandem 1,3-dipolar cycloaddition-cheletropic elimination: a facial approach to novel push-pull olefins.","Organic & biomolecular chemistry","2007","5","8","1282","1286","10.1039/b701326d","","","0.71073","MoKα","","0.0586","0.0358","","","0.078","0.0875","","","","","","1.024","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151102","23.3843","0.0006","23.3843","0.0006","8.2561","0.0002","90","","90","","90","","4514.6","0.2","173","2","173","2","","","","","","","","4","I 4","I 4","79","","","","- C94.69 H126.1 N8.65 O13.38 -","- C94.69 H126.106 N8.655 O13.38 -","- C189.38 H252.211 N17.31 O26.76 -","2","0.25","","Szumna, Agnieszka","Cyclochiral conformers of resorcin[4]arenes stabilized by hydrogen bonds.","Organic & biomolecular chemistry","2007","5","9","1358","1368","10.1039/b701451a","","","0.71073","MoKα","","0.125","0.0468","","","0.1182","0.1313","","","","","","0.776","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7151103","10.052","0.002","15.052","0.003","42.205","0.008","90","","90","","90","","6386","2","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C27 H21 N3 O2 -","- C27 H21 N3 O2 -","- C324 H252 N36 O24 -","12","3","","Bouet, Alexis; Deguest, Geoffrey; Heller, Barbara; Papamicaël, Cyril; Dupas, Georges; Oudeyer, Sylvain; Marsais, Francis; Levacher, Vincent","Preparation of new axially chiral bridged 2,2'-bipyridines and pyridyl monooxazolines (pymox). Evaluation in copper(I)-catalyzed enantioselective cyclopropanation.","Organic & biomolecular chemistry","2007","5","9","1397","1404","10.1039/b701549f","","","0.71073","MoKα","","0.0859","0.0684","","","0.182","0.1931","","","","","","1.023","","","","has coordinates,has disorder","180297","2020-10-21","18:00:00",""
"7151104","16.463","0.009","18.19","0.011","13.501","0.01","90","","111.93","0.04","90","","3750","4","198.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H32 Br F5 P2 -","- C43 H32 Br F5 P2 -","- C172 H128 Br4 F20 P8 -","4","1","","Yamada, Shigeyuki; Ishii, Emi; Konno, Tsutomu; Ishihara, Takashi","Reaction of perfluorocyclopentene with various carbon nucleophiles‒heteroaromatic lithium reagents, enolate and phosphonium ylide.","Organic & biomolecular chemistry","2007","5","9","1442","1449","10.1039/b701702b","","","1.54178","CuKα","","","0.0789","","","","0.2354","","","","","","1.011","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151105","17.266","0.007","17.317","0.007","13.791","0.004","90","","90","","90","","4123","3","198.1","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H16 F5 O P -","- C24 H16 F5 O P -","- C192 H128 F40 O8 P8 -","8","1","","Yamada, Shigeyuki; Ishii, Emi; Konno, Tsutomu; Ishihara, Takashi","Reaction of perfluorocyclopentene with various carbon nucleophiles‒heteroaromatic lithium reagents, enolate and phosphonium ylide.","Organic & biomolecular chemistry","2007","5","9","1442","1449","10.1039/b701702b","","","1.54178","CuKα","","","0.0485","","","","0.117","","","","","","1.106","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151106","10.9131","0.0002","13.5228","0.0002","20.2901","0.0003","90","","90","","90","","2994.33","0.08","105","2","105","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","(Sp)-8-(2-Furyl)adenosine-2'-O-(tert-butyldimethylsilyl)- 3',5'-cyclic N-phenylphosphoramidate","(Sp)-8-(2-Furyl)adenosine-2'-O-(tert-butyldimethylsilyl)-3',5'-cyclic N- phenylphosphoramidate","","- C26 H33 N6 O6 P Si -","- C26 H33 N6 O6 P Si -","- C104 H132 N24 O24 P4 Si4 -","4","1","","Andrei, Mioara; Bjørnstad, Vidar; Langli, Geir; Rømming, Christian; Klaveness, Jo; Taskén, Kjetil; Undheim, Kjell","Stereoselective preparation of (RP)-8-hetaryladenosine-3',5'-cyclic phosphorothioic acids.","Organic & biomolecular chemistry","2007","5","13","2070","2080","10.1039/b702403g","","","0.71073","MoKα","","0.0252","0.0244","","","0.065","0.066","","","","","","1.073","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151107","10.8533","0.0005","13.3879","0.0006","20.9242","0.0009","90","","90","","90","","3040.3","0.2","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","(Sp)-8-(2-Furyrl)adenosine-2'-O-(tert-butylmethylsilyl)-3',5'- cyclic N-benzylphosphoramidate","(Sp)-8-(2-Furyrl)adenosine-2'-O-(tert-butylmethylsilyl)-3',5'-cyclic N- benzylphosphoramidate","","- C27 H35 N6 O6 P Si -","- C27 H35 N6 O6 P Si -","- C108 H140 N24 O24 P4 Si4 -","4","1","","Andrei, Mioara; Bjørnstad, Vidar; Langli, Geir; Rømming, Christian; Klaveness, Jo; Taskén, Kjetil; Undheim, Kjell","Stereoselective preparation of (RP)-8-hetaryladenosine-3',5'-cyclic phosphorothioic acids.","Organic & biomolecular chemistry","2007","5","13","2070","2080","10.1039/b702403g","","","0.71073","MoKα","","0.0416","0.032","","","0.0802","0.0857","","","","","","1.027","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151108","8.38","0.007","10.583","0.008","29.23","0.03","90","","99.424","0.01","90","","2557","4","183.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","2-Amino-9-(2-(4-(1-oxyl-3-oxido-4,4,5,5-tetramethyl- imidazolidin-2-yl)-phenoxy)-ethyl)-1,9-dihydro-purin-6-one","2-Amino-9-{2-[4-(1-oxyl-3-oxido-4,4,5,5-tetramethyl- imidazolidin-2-yl)-phenoxy]-ethyl}-1,9-dihydro-purin-6-one","","- C21 H25 Cl3 N7 O4 -","- C21 H25 Cl3 N7 O4 -","- C84 H100 Cl12 N28 O16 -","4","1","","Maekawa, Kensuke; Shiomi, Daisuke; Ise, Tomoaki; Sato, Kazunobu; Takui, Takeji","A guanine-substituted nitronyl nitroxide radical forming a one-dimensional ferromagnetic chain.","Organic & biomolecular chemistry","2007","5","10","1641","1645","10.1039/b702606d","","","0.7107","MoKα","","","0.0819","","","","0.1968","","","","","","1.002","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151109","21.9143","0.001","10.1032","0.0005","8.7088","0.0004","90","","98.099","0.001","90","","1908.94","0.16","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H19 Cl2 N3 O2 -","- C20 H19 Cl2 N3 O2 -","- C80 H76 Cl8 N12 O8 -","4","1","","Marchetti, Francesco; Sayle, Kerry L.; Bentley, Johanne; Clegg, William; Curtin, Nicola J.; Endicott, Jane A.; Golding, Bernard T.; Griffin, Roger J.; Haggerty, Karen; Harrington, Ross W.; Mesguiche, Veronique; Newell, David R.; Noble, Martin E. M.; Parsons, Rachel J.; Pratt, David J.; Wang, Lan Z.; Hardcastle, Ian R.","Structure-based design of 2-arylamino-4-cyclohexylmethoxy-5-nitroso-6-aminopyrimidine inhibitors of cyclin-dependent kinase 2.","Organic & biomolecular chemistry","2007","5","10","1577","1585","10.1039/b703241b","","","0.8462","synchrotron","","0.0449","0.0375","","","0.0931","0.0978","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151110","16.962","0.0014","10.7877","0.0009","27.228","0.002","90","","98.375","0.001","90","","4929.1","0.7","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H27 Cl N4 O3 -","- C27 H27 Cl N4 O3 -","- C216 H216 Cl8 N32 O24 -","8","1","","Marchetti, Francesco; Sayle, Kerry L.; Bentley, Johanne; Clegg, William; Curtin, Nicola J.; Endicott, Jane A.; Golding, Bernard T.; Griffin, Roger J.; Haggerty, Karen; Harrington, Ross W.; Mesguiche, Veronique; Newell, David R.; Noble, Martin E. M.; Parsons, Rachel J.; Pratt, David J.; Wang, Lan Z.; Hardcastle, Ian R.","Structure-based design of 2-arylamino-4-cyclohexylmethoxy-5-nitroso-6-aminopyrimidine inhibitors of cyclin-dependent kinase 2.","Organic & biomolecular chemistry","2007","5","10","1577","1585","10.1039/b703241b","","","0.8462","synchrotron","","0.0518","0.0449","","","0.1102","0.1165","","","","","","1.063","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151111","8.5254","0.0016","8.6886","0.0016","10.3659","0.0019","97.728","0.003","94.587","0.002","117.361","0.003","666.9","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H16 N2 O4 -","- C14 H16 N2 O4 -","- C28 H32 N4 O8 -","2","1","","Newsome, Jeffery J.; Swann, Elizabeth; Hassani, Mary; Bray, Kurtis C.; Slawin, Alexandra M. Z.; Beall, Howard D.; Moody, Christopher J.","Indolequinone antitumour agents: correlation between quinone structure and rate of metabolism by recombinant human NAD(P)H:quinone oxidoreductase.","Organic & biomolecular chemistry","2007","5","10","1629","1640","10.1039/b703370b","","","0.71073","MoKα","","0.0726","0.0403","","","0.0911","0.1036","","","","","","0.892","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151112","11.8185","0.0004","11.0156","0.0004","18.8659","0.0008","90","","95.528","0.003","90","","2444.69","0.16","","","","","","","","","","","","4","C 1 2 1","C 2y","5","","","","?","- C76 H88 N24 O44 -","- C76 H88 N24 O44 -","","","","Xia, Yi; Li, Wei; Qu, Fanqi; Fan, Zhijin; Liu, Xiufeng; Berro, Charles; Rauzy, Evelyne; Peng, Ling","Synthesis of bitriazolyl nucleosides and unexpectedly different reactivity of azidotriazole nucleoside isomers in the Huisgen reaction.","Organic & biomolecular chemistry","2007","5","11","1695","1701","10.1039/b703420b","","","","","","","","","","","","","","","","","","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151113","7.5396","0.0001","7.9351","0.0002","43.1982","0.0006","90","","90","","90","","2584.44","0.08","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","3-(4-(4-Methoxyphenyl)-1H-1,2,3-triazol-1-yl)-1-(2,3,5-tri-O- acetyl-beta-D-ribofuranosyl)-1,2,4-triazole-5-carboxylic acid methyl ester","3-[4-(4-Methoxyphenyl)-1H-1,2,3-triazol-1-yl]-1-(2,3,5-tri-O-acetyl-beta- D-ribofuranosyl)-1,2,4-triazole-5-carboxylic acid methyl ester","","- C24 H26 N6 O10 -","- C24 H26 N6 O10 -","- C96 H104 N24 O40 -","4","1","","Xia, Yi; Li, Wei; Qu, Fanqi; Fan, Zhijin; Liu, Xiufeng; Berro, Charles; Rauzy, Evelyne; Peng, Ling","Synthesis of bitriazolyl nucleosides and unexpectedly different reactivity of azidotriazole nucleoside isomers in the Huisgen reaction.","Organic & biomolecular chemistry","2007","5","11","1695","1701","10.1039/b703420b","","","0.71073","MoKα","","0.0859","0.0613","","","0.1449","0.1791","","","","","","1.317","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151114","11.407","0.002","9.859","0.002","10.146","0.002","90","","96.153","0.006","90","","1134.5","0.4","100","2","100","2","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- C15 H11 Br -","- C15 H11 Br -","- C60 H44 Br4 -","4","2","","Nikitin, Kirill; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","Joining the rings: the preparation of 2- and 3-indenyl-triptycenes, and curious related processes.","Organic & biomolecular chemistry","2007","5","12","1952","1960","10.1039/b703437g","","","0.71073","MoKα","","0.089","0.0597","","","0.1477","0.1998","","","","","","1.098","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151115","11.2911","0.0008","8.3652","0.0006","20.6135","0.0015","90","","100.741","0.002","90","","1912.9","0.2","100","2","100","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C29 H20 -","- C29 H20 -","- C116 H80 -","4","1","","Nikitin, Kirill; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","Joining the rings: the preparation of 2- and 3-indenyl-triptycenes, and curious related processes.","Organic & biomolecular chemistry","2007","5","12","1952","1960","10.1039/b703437g","","","0.71073","MoKα","","0.0584","0.0524","","","0.1317","0.1379","","","","","","1.046","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151116","14.876","0.002","10.0507","0.0014","12.6706","0.0018","90","","90","","90","","1894.4","0.5","100","2","100","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- C29 H20 -","- C29 H20 -","- C116 H80 -","4","0.5","","Nikitin, Kirill; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","Joining the rings: the preparation of 2- and 3-indenyl-triptycenes, and curious related processes.","Organic & biomolecular chemistry","2007","5","12","1952","1960","10.1039/b703437g","","","0.71073","MoKα","","0.0587","0.053","","","0.1137","0.1164","","","","","","1.23","","","","has coordinates,has disorder","180297","2020-10-21","18:00:00",""
"7151117","23.6218","0.0016","23.6218","0.0016","4.7492","0.0007","90","","90","","120","","2295","0.4","100","2","100","2","","","","","","","","2","P 61","P 61","169","","","","- C23 H16 -","- C23 H16 -","- C138 H96 -","6","1","","Nikitin, Kirill; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","Joining the rings: the preparation of 2- and 3-indenyl-triptycenes, and curious related processes.","Organic & biomolecular chemistry","2007","5","12","1952","1960","10.1039/b703437g","","","0.71073","MoKα","","0.0686","0.0623","","","0.1986","0.2088","","","","","","1.376","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151118","22.789","0.007","13.891","0.004","13.212","0.003","90","","101.325","0.011","90","","4101","2","170","2","170","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C100 H94 Fe2 N4 O2 -","- C100 H94 Fe2 N4 O2 -","- C200 H188 Fe4 N8 O4 -","2","0.5","","Schmittel, Michael; He, Bice; Kalsani, Venkateshwarlu; Bats, Jan W.","Supramolecular effects on the potential of redox units-nanoscaffolds internally functionalised with ferrocene units.","Organic & biomolecular chemistry","2007","5","15","2395","2403","10.1039/b703633g","","","0.71073","MoKα","","0.3733","0.1149","","","0.2201","0.3013","","","","","","0.877","","","","has coordinates,has disorder","180297","2020-10-21","18:00:00",""
"7151119","8.2824","0.0006","13.7389","0.001","12.711","0.001","90","","91.284","0.001","90","","1446.04","0.19","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H46 O7 Si -","- C29 H46 O7 Si -","- C58 H92 O14 Si2 -","2","1","","Ahmad, Nadia M.; Rodeschini, Vincent; Simpkins, Nigel S.; Ward, Simon E.; Wilson, Claire","Synthetic studies towards garsubellin A: synthesis of model systems and potential mimics by regioselective lithiation of bicyclo[3.3.1]nonane-2,4,9-trione derivatives from catechinic acid.","Organic & biomolecular chemistry","2007","5","12","1924","1934","10.1039/b704311b","","","0.71073","MoKα","","0.039","0.0376","","","0.0991","0.1004","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151120","13.7696","0.0005","8.3551","0.0002","20.4951","0.0006","90","","90","","90","","2357.89","0.12","298","","","","","","","","","","Local laboratory","4","P b c n","-P 2n 2ab","60","","","","- C24 H28 F2 O9 -","- C24 H28 F2 O9 -","- C96 H112 F8 O36 -","4","0.5","","Wallner, Fredrik K.; Spjut, Sara; Boström, Dan; Elofsson, Mikael","Synthesis and evaluation of 2-(2-fluoro-4-hydroxymethyl-5-methoxy-phenoxy)acetic acid as a linker in solid-phase synthesis monitored by gel-phase (19)F NMR spectroscopy.","Organic & biomolecular chemistry","2007","5","15","2464","2471","10.1039/b704472k","","","0.71073","MoKα","","0.1021","0.0595","","","0.1217","0.1389","","","","","","1.083","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7151121","4.7854","0.0006","11.316","0.002","22.705","0.003","80.348","0.008","86.525","0.01","86.318","0.007","1208.1","0.3","100","","","","","","","","","","Local laboratory","4","P -1","-P 1","2","","","","- C12 H15 F O5 -","- C12 H15 F O5 -","- C48 H60 F4 O20 -","4","2","","Wallner, Fredrik K.; Spjut, Sara; Boström, Dan; Elofsson, Mikael","Synthesis and evaluation of 2-(2-fluoro-4-hydroxymethyl-5-methoxy-phenoxy)acetic acid as a linker in solid-phase synthesis monitored by gel-phase (19)F NMR spectroscopy.","Organic & biomolecular chemistry","2007","5","15","2464","2471","10.1039/b704472k","","","0.71074","MoKα","","0.1016","0.0669","","","0.1526","0.1734","","","","","","1.246","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151122","9.3443","0.0003","9.8498","0.0003","15.9297","0.0006","90","","103.866","0.0015","90","","1423.43","0.08","190","","190","","","","","","","","?","4","P 1 21 1","P 2yb","4","","","","- C30 H37 N3 O5 -","- C30 H37 N3 O5 -","- C60 H74 N6 O10 -","2","1","","Davies, Stephen G.; Garner, A. Christopher; Ouzman, Jaqueline V. A.; Roberts, Paul M.; Smith, Andrew D.; Snow, Emma J.; Thomson, James E.; Tamayo, Juan A.; Vickers, Richard J.","Diastereoselective synthesis of quaternary alpha-amino acids from diketopiperazine templates.","Organic & biomolecular chemistry","2007","5","13","2138","2147","10.1039/b704475e","","","0.71073","MoKα","","0.0651","0.0518","","0.0633","0.0566","0.0566","","","","","","1.0935","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151123","9.415","0.0001","33.845","0.0004","9.568","0.0002","90","","90","","90","","3048.85","0.08","190","","190","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H43 N3 O7 -","- C31 H43 N3 O7 -","- C124 H172 N12 O28 -","4","1","","Davies, Stephen G.; Garner, A. Christopher; Ouzman, Jaqueline V. A.; Roberts, Paul M.; Smith, Andrew D.; Snow, Emma J.; Thomson, James E.; Tamayo, Juan A.; Vickers, Richard J.","Diastereoselective synthesis of quaternary alpha-amino acids from diketopiperazine templates.","Organic & biomolecular chemistry","2007","5","13","2138","2147","10.1039/b704475e","","","0.71073","MoKα","","0.0839","0.0718","","0.0845","0.0722","0.0722","","","","","","0.96","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151124","14.181","0.002","6.9634","0.001","17.674","0.003","90","","106.362","0.009","90","","1674.6","0.4","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 Br2 N3 O4 -","- C15 H17 Br2 N3 O4 -","- C60 H68 Br8 N12 O16 -","4","1","","Evans, Kathryn M.; Haraldsen, Jeralyn D.; Pearson, Russell J.; Slawin, Alexandra M. Z.; Ward, Gary E.; Westwood, Nicholas J.","Synthesis and chemical characterisation of target identification reagents based on an inhibitor of human cell invasion by the parasite Toxoplasma gondii.","Organic & biomolecular chemistry","2007","5","13","2063","2069","10.1039/b704685e","","","0.71073","MoKα","","0.0928","0.0739","","","0.1515","0.1615","","","","","","1.074","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151125","6.0186","0.0002","14.441","0.0004","26.8635","0.0008","90","","91.465","0.002","90","","2334.07","0.12","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 O3 -","- C13 H18 O3 -","- C104 H144 O24 -","8","2","","McGowan, Craig A.; Schmieder, Ann-Kathrin; Roberts, Lee; Greaney, Michael F.","Synthesis of the guanacastepene A-B hydrazulene ring system through photochemical ring transposition.","Organic & biomolecular chemistry","2007","5","10","1522","1524","10.1039/b704865c","","","0.71073","MoKα","","0.0928","0.0553","","0.106","0.0911","0.106","","","","","","0.8325","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151126","7.2231","0.0003","9.3503","0.0004","17.2474","0.0006","90","","90","","90","","1164.86","0.08","150","","150","","","","","","","","?","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H18 O4 -","- C13 H18 O4 -","- C52 H72 O16 -","4","1","","McGowan, Craig A.; Schmieder, Ann-Kathrin; Roberts, Lee; Greaney, Michael F.","Synthesis of the guanacastepene A-B hydrazulene ring system through photochemical ring transposition.","Organic & biomolecular chemistry","2007","5","10","1522","1524","10.1039/b704865c","","","0.71073","MoKα","","0.0664","0.0501","","0.1074","0.1","0.1074","","","","","","0.8705","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151127","6.8884","0.0002","8.7287","0.0003","10.4626","0.0003","90","","103.724","0.002","90","","611.12","0.03","150","","150","","","","","","","","C. McGowan","3","P 1 c 1","P -2yc","7","","","","- C14 H22 O2 -","- C14 H22 O2 -","- C28 H44 O4 -","2","1","","McGowan, Craig A.; Schmieder, Ann-Kathrin; Roberts, Lee; Greaney, Michael F.","Synthesis of the guanacastepene A-B hydrazulene ring system through photochemical ring transposition.","Organic & biomolecular chemistry","2007","5","10","1522","1524","10.1039/b704865c","","","0.71073","MoKα","","0.0348","0.0335","","0.0801","0.0795","0.0801","","","","","","0.9682","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151128","9.5595","0.0002","17.1047","0.0005","13.6097","0.0003","90","","98.2945","0.0016","90","","2202.08","0.09","190","","190","","","","","","","","?","4","P 1 21 1","P 2yb","4","","","","- C26 H28 N2 O -","- C26 H28 N2 O -","- C104 H112 N8 O4 -","4","2","","Davies, Stephen G.; Garner, A. Christopher; Goddard, Euan C.; Kruchinin, Dennis; Roberts, Paul M.; Smith, Andrew D.; Rodriguez-Solla, Humberto; Thomson, James E.; Toms, Steven M.","Asymmetric synthesis of 3,4-anti- and 3,4-syn-substituted aminopyrrolidines via lithium amide conjugate addition.","Organic & biomolecular chemistry","2007","5","12","1961","1969","10.1039/b704932c","","","0.71073","MoKα","","0.0583","0.0469","","0.0748","0.058","0.058","","","","","","1.0904","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151129","12.9386","0.0008","12.9386","0.0008","8.5628","0.0007","90","","90","","90","","1433.48","0.17","120","2","120","2","","","","","","","","4","P 42","P 4c","77","","","","- C12 H24 N3 O3.5 -","- C12 H24 N3 O3.5 -","- C48 H96 N12 O14 -","4","1","","Hosseini, Masood; Grau, Jakob S.; Sørensen, Kasper K; Søtofte, Inger; Tanner, David; Murray, Anthony; Tønder, Janne E","Short and efficient diastereoselective synthesis of pyrrolidinone-containing dipeptide analogues.","Organic & biomolecular chemistry","2007","5","14","2207","2210","10.1039/b705093c","","","0.71073","MoKα","","0.1077","0.1025","","","0.2067","0.2087","","","","","","1.23","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151130","7.8129","0.0004","28.2692","0.0013","7.6955","0.0003","90","","99.413","0.001","90","","1676.78","0.13","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 Br N3 O3 -","- C17 H22 Br N3 O3 -","- C68 H88 Br4 N12 O12 -","4","1","","Barbeau, Olivier R.; Cano-Soumillac, Celine; Griffin, Roger J.; Hardcastle, Ian R.; Smith, Graeme C. M.; Richardson, Caroline; Clegg, William; Harrington, Ross W.; Golding, Bernard T.","Quinolinone and pyridopyrimidinone inhibitors of DNA-dependent protein kinase","Organic & Biomolecular Chemistry","2007","5","16","2670","","10.1039/b705095j","","","0.71073","MoKα","","0.0412","0.0331","","","0.0796","0.0827","","","","","","1.051","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151131","20.22","0.009","16.889","0.007","23.103","0.01","90","","110.821","0.007","90","","7374","6","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 F3 N3 O5 S -","- C13 H12 F3 N3 O5 S -","- C260 H240 F60 N60 O100 S20 -","20","5","","Barbeau, Olivier R.; Cano-Soumillac, Celine; Griffin, Roger J.; Hardcastle, Ian R.; Smith, Graeme C. M.; Richardson, Caroline; Clegg, William; Harrington, Ross W.; Golding, Bernard T.","Quinolinone and pyridopyrimidinone inhibitors of DNA-dependent protein kinase","Organic & Biomolecular Chemistry","2007","5","16","2670","","10.1039/b705095j","","","0.6898","synchrotron","","0.0834","0.0471","","","0.1104","0.1275","","","","","","1.023","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151132","11.237","0.002","11.608","0.002","13.253","0.003","68.38","0.03","84.74","0.03","66.43","0.03","1469.9","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H31 Cl3 O Si2 -","- C29 H31 Cl3 O Si2 -","- C58 H62 Cl6 O2 Si4 -","2","1","","Hu, Qiaoshu; Wang, Chao; Li, Dongzhen; Xi, Zhenfeng","Formation of stable enols from 1,4-dilithio-1,3-dienes and acid chlorides by a de-aromatization/Michael addition/re-aromatization domino process.","Organic & biomolecular chemistry","2007","5","13","2114","2118","10.1039/b705110g","","","0.71073","MoKα","","0.079","0.0491","","","0.1193","0.128","","","","","","1.002","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151133","8.615","0.006","12.829","0.004","14.996","0.005","88.06","0.03","78.28","0.04","75.7","0.04","1572.3","1.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H40 N6 O6 P2 -","- C29 H40 N6 O6 P2 -","- C58 H80 N12 O12 P4 -","2","1","","Skarpos, Hanna; Osipov, Sergey N.; Vorob'eva, Daria V.; Odinets, Irina L.; Lork, Enno; Röschenthaler, Gerd-Volker","Synthesis of functionalized bisphosphonates via click chemistry.","Organic & biomolecular chemistry","2007","5","15","2361","2367","10.1039/b705510b","","","0.71073","MoKα","","0.1135","0.0702","","","0.1681","0.194","","","","","","1.024","","","","has coordinates,has disorder","180297","2020-10-21","18:00:00",""
"7151134","6.052","0.0001","23.756","0.0005","23.944","0.0005","90","","90","","90","","3442.46","0.12","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C39 H46 O6 -","- C39 H46 O6 -","- C156 H184 O24 -","4","1","","Risseeuw, Martijn D. P.; Mazurek, Jaroslaw; van Langenvelde, Arjan; van der Marel, Gijsbert A.; Overkleeft, Herman S.; Overhand, Mark","Synthesis of alkylated sugar amino acids: conformationally restricted L-Xaa-L-Ser/Thr mimics.","Organic & biomolecular chemistry","2007","5","14","2311","2314","10.1039/b705750d","","","0.71073","MoKα","","0.0747","0.0465","","","0.0858","0.0965","","","","","","1.025","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151135","10.978","0.0015","4.7347","0.0006","16.96","0.002","90","","108.412","0.002","90","","836.41","0.18","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 F8 I2 O2 -","- C20 F8 I2 O2 -","- C40 F16 I4 O4 -","2","0.5","","Miyata, Yasuo; Minari, Takeo; Nemoto, Takashi; Isoda, Seiji; Komatsu, Koichi","Synthesis of fluorinated anti-fluorenacenedione and the structural, electronic, and field-effect properties","Organic & Biomolecular Chemistry","2007","5","16","2592","","10.1039/b706621j","","","0.71073","MoKα","","0.029","0.0244","","","0.06","0.0625","","","","","","1.002","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151136","11.3312","0.0012","11.4371","0.0012","14.5628","0.0016","90","","111.863","0.002","90","","1751.5","0.3","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","6,19-cyclopregn-4-ene-3,20-dione","6,19-cyclopregn-4-ene-3,20-dione","","- C21 H28 O2 -","- C21 H28 O2 -","- C84 H112 O8 -","4","2","","Di Chenna, Pablo H.; Veleiro, Adriana S.; Sonego, Juan M.; Ceballos, Nora R.; Garland, M. Teresa; Baggio, Ricardo F.; Burton, Gerardo","Synthesis of 6,19-cyclopregnanes. Constrained analogues of steroid hormones.","Organic & biomolecular chemistry","2007","5","15","2453","2457","10.1039/b706828j","","","0.71073","MoKα","","0.0852","0.057","","","0.0832","0.0901","","","","","","1.091","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7151137","11.5985","0.0004","14.1871","0.0005","14.5743","0.0006","90","","100.842","0.002","90","","2355.38","0.15","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(2)Pseudorotaxane_CH3CN","","","- C44 H54 B2 F8 N6 O8 -","- C44 H54 B2 F8 N6 O8 -","- C88 H108 B4 F16 N12 O16 -","2","0.5","","Castillo, Dolores; Astudillo, Pablo; Mares, Jennifer; González, Felipe J; Vela, Alberto; Tiburcio, Jorge","Chemically controlled self-assembly of [2]pseudorotaxanes based on 1,2-bis(benzimidazolium)ethane cations and 24-crown-8 macrocycles.","Organic & biomolecular chemistry","2007","5","14","2252","2256","10.1039/b707211b","","","0.71073","MoKα","","0.1453","0.0991","","","0.2662","0.3129","","","","","","1.038","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151138","8.9189","0.0003","11.0803","0.0004","12.0622","0.0004","81.66","0.002","79.928","0.001","77.557","0.002","1138.93","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(2)Pseudorotaxane_CH3NO2","","","- C42 H54 B2 F8 N6 O12 -","- C42 H54 B2 F8 N6 O12 -","- C42 H54 B2 F8 N6 O12 -","1","0.5","","Castillo, Dolores; Astudillo, Pablo; Mares, Jennifer; González, Felipe J; Vela, Alberto; Tiburcio, Jorge","Chemically controlled self-assembly of [2]pseudorotaxanes based on 1,2-bis(benzimidazolium)ethane cations and 24-crown-8 macrocycles.","Organic & biomolecular chemistry","2007","5","14","2252","2256","10.1039/b707211b","","","0.71073","MoKα","","0.097","0.0608","","","0.1327","0.1575","","","","","","1.017","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151139","14.913","0.003","15.95","0.003","14.25","0.003","90","","90","","90","","3389.5","1.2","153","2","153","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C19 H21 N O6 -","- C19 H21 N O6 -","- C152 H168 N8 O48 -","8","1","","Boyd, Derek R.; Sharma, Narain D.; Loke, Pui L.; Malone, John F.; McRoberts, W. Colin; Hamilton, John T. G.","Synthesis, structure and stereochemistry of quinoline alkaloids from Choisya ternata.","Organic & biomolecular chemistry","2007","5","18","2983","2991","10.1039/b707576f","","","0.71073","MoKα","","0.18","0.0701","","","0.1614","0.2289","","","","","","0.961","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151140","7.3052","0.0009","13.9881","0.0018","17.435","0.002","70.603","0.002","87.747","0.002","84.239","0.002","1672","0.4","153","2","153","2","","","","","","","","5","P 1","P 1","1","","","","- C18 H20 Cl N O5 -","- C18 H20 Cl N O5 -","- C72 H80 Cl4 N4 O20 -","4","4","","Boyd, Derek R.; Sharma, Narain D.; Loke, Pui L.; Malone, John F.; McRoberts, W. Colin; Hamilton, John T. G.","Synthesis, structure and stereochemistry of quinoline alkaloids from Choisya ternata.","Organic & biomolecular chemistry","2007","5","18","2983","2991","10.1039/b707576f","","","0.71073","MoKα","","0.1222","0.0977","","","0.2467","0.2706","","","","","","1.047","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151141","6.9224","0.0007","13.7063","0.0014","10.2746","0.001","90","","99.149","0.002","90","","962.46","0.17","130","2","130","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H12 O4 -","- C11 H12 O4 -","- C44 H48 O16 -","4","1","","Goh, Yit Wooi; White, Jonathan M.","Structures of oxygenated cyclohexa-1,3-diene-maleic anyhydride cycloadducts. Structural evidence suggests a stepwise retro-Diels-Alder reaction.","Organic & biomolecular chemistry","2007","5","15","2354","2356","10.1039/b707643f","","","0.71073","MoKα","","0.0449","0.0364","","","0.0905","0.0936","","","","","","0.984","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151142","7.6323","0.0008","8.5174","0.0009","17.502","0.0019","90","","97.041","0.002","90","","1129.2","0.2","130","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 O5 -","- C12 H14 O5 -","- C48 H56 O20 -","4","1","","Goh, Yit Wooi; White, Jonathan M.","Structures of oxygenated cyclohexa-1,3-diene-maleic anyhydride cycloadducts. Structural evidence suggests a stepwise retro-Diels-Alder reaction.","Organic & biomolecular chemistry","2007","5","15","2354","2356","10.1039/b707643f","","","0.71073","MoKα","","0.0725","0.0484","","","0.0965","0.1051","","","","","","0.959","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151143","9.304","0.0008","8.6876","0.0007","12.6963","0.0011","90","","90","","90","","1026.23","0.15","130","2","130","2","","","","","","","","4","C m c 21","C 2c -2","36","","","","- C11 H17 N O3 -","- C11 H17 N O3 -","- C44 H68 N4 O12 -","4","0.5","","Goh, Yit Wooi; White, Jonathan M.","Structures of oxygenated cyclohexa-1,3-diene-maleic anyhydride cycloadducts. Structural evidence suggests a stepwise retro-Diels-Alder reaction.","Organic & biomolecular chemistry","2007","5","15","2354","2356","10.1039/b707643f","","","0.71073","MoKα","","0.0288","0.0284","","","0.0744","0.0747","","","","","","1.078","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151144","14.118","0.0003","6.1198","0.0002","14.4072","0.0004","90","","108.441","0.0011","90","","1180.85","0.06","190","","190","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H34 N2 O3 -","- C26 H34 N2 O3 -","- C52 H68 N4 O6 -","2","1","","Beddow, James E.; Davies, Stephen G.; Ling, Kenneth B.; Roberts, Paul M.; Russell, Angela J.; Smith, Andrew D.; Thomson, James E.","Asymmetric synthesis of beta2-amino acids: 2-substituted-3-aminopropanoic acids from N-acryloyl SuperQuat derivatives.","Organic & biomolecular chemistry","2007","5","17","2812","2825","10.1039/b707689d","","","0.71073","MoKα","","0.036","0.0335","","0.037","0.0354","0.0354","","","","","","1.1739","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151145","8.6876","0.0002","14.8422","0.0003","22.3552","0.0004","90","","90","","90","","2882.55","0.1","190","","190","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H38 N2 O4 -","- C32 H38 N2 O4 -","- C128 H152 N8 O16 -","4","1","","Beddow, James E.; Davies, Stephen G.; Ling, Kenneth B.; Roberts, Paul M.; Russell, Angela J.; Smith, Andrew D.; Thomson, James E.","Asymmetric synthesis of beta2-amino acids: 2-substituted-3-aminopropanoic acids from N-acryloyl SuperQuat derivatives.","Organic & biomolecular chemistry","2007","5","17","2812","2825","10.1039/b707689d","","","0.71073","MoKα","","0.0528","0.0375","","0.056","0.0433","0.0433","","","","","","1.0991","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151146","11.5661","0.0002","12.049","0.0002","20.5677","0.0004","90","","90","","90","","2866.31","0.09","190","","190","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H40 N2 O4 -","- C29 H40 N2 O4 -","- C116 H160 N8 O16 -","4","1","","Beddow, James E.; Davies, Stephen G.; Ling, Kenneth B.; Roberts, Paul M.; Russell, Angela J.; Smith, Andrew D.; Thomson, James E.","Asymmetric synthesis of beta2-amino acids: 2-substituted-3-aminopropanoic acids from N-acryloyl SuperQuat derivatives.","Organic & biomolecular chemistry","2007","5","17","2812","2825","10.1039/b707689d","","","0.71073","MoKα","","0.0676","0.0426","","0.0661","0.0502","0.0502","","","","","","1.0963","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151147","10.2895","0.0006","10.2232","0.0005","22.4956","0.0011","90","","94.284","0.002","90","","2359.7","0.2","296","2","296","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C22 H31 N O6 S -","- C22 H31 N O6 S -","- C88 H124 N4 O24 S4 -","4","1","","Walker, Stephen M.; Williams, Jodi T.; Russell, Alexander G.; Kariuki, Benson M.; Snaith, John S.","Stereoselective synthesis of 3,4-disubstituted and 3,4,5-trisubstituted piperidines by Lewis acid-catalysed ene cyclisation of 4-aza-1,7-dienes.","Organic & biomolecular chemistry","2007","5","18","2925","2931","10.1039/b708139a","","","1.54178","CuKα","","0.0671","0.0476","","","0.1293","0.1469","","","","","","1.015","","","","has coordinates,has disorder","180297","2020-10-21","18:00:00",""
"7151148","11.0618","0.0002","17.0577","0.0002","16.0387","0.0002","90","","105.509","0.001","90","","2916.13","0.07","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H35 N O10 S -","- C27 H35 N O10 S -","- C108 H140 N4 O40 S4 -","4","1","","Walker, Stephen M.; Williams, Jodi T.; Russell, Alexander G.; Kariuki, Benson M.; Snaith, John S.","Stereoselective synthesis of 3,4-disubstituted and 3,4,5-trisubstituted piperidines by Lewis acid-catalysed ene cyclisation of 4-aza-1,7-dienes.","Organic & biomolecular chemistry","2007","5","18","2925","2931","10.1039/b708139a","","","1.54178","CuKα","","0.1213","0.0885","","","0.2425","0.2724","","","","","","0.945","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151149","6.1394","0.0008","21.563","0.003","13.0265","0.0014","90","","102.48","0.008","90","","1683.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C17 H23 N O4 S -","- C17 H23 N O4 S -","- C68 H92 N4 O16 S4 -","4","1","","Walker, Stephen M.; Williams, Jodi T.; Russell, Alexander G.; Kariuki, Benson M.; Snaith, John S.","Stereoselective synthesis of 3,4-disubstituted and 3,4,5-trisubstituted piperidines by Lewis acid-catalysed ene cyclisation of 4-aza-1,7-dienes.","Organic & biomolecular chemistry","2007","5","18","2925","2931","10.1039/b708139a","","","1.54178","CuKα","","0.1303","0.0894","","","0.2196","0.2425","","","","","","1.074","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151150","7.6072","0.0003","12.0948","0.0004","17.8368","0.0006","90","","96.33","0.002","90","","1631.12","0.1","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H21 N O4 S -","- C16 H21 N O4 S -","- C64 H84 N4 O16 S4 -","4","1","","Walker, Stephen M.; Williams, Jodi T.; Russell, Alexander G.; Kariuki, Benson M.; Snaith, John S.","Stereoselective synthesis of 3,4-disubstituted and 3,4,5-trisubstituted piperidines by Lewis acid-catalysed ene cyclisation of 4-aza-1,7-dienes.","Organic & biomolecular chemistry","2007","5","18","2925","2931","10.1039/b708139a","","","1.54178","CuKα","","0.0486","0.0396","","","0.1066","0.1129","","","","","","1.034","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151151","6.0833","0.0005","9.5865","0.0007","22.1903","0.0017","81.993","0.005","86.709","0.005","78.059","0.004","1253.19","0.17","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H27 Cl3 N2 O5 S -","- C21 H27 Cl3 N2 O5 S -","- C42 H54 Cl6 N4 O10 S2 -","2","1","","Walker, Stephen M.; Williams, Jodi T.; Russell, Alexander G.; Kariuki, Benson M.; Snaith, John S.","Stereoselective synthesis of 3,4-disubstituted and 3,4,5-trisubstituted piperidines by Lewis acid-catalysed ene cyclisation of 4-aza-1,7-dienes.","Organic & biomolecular chemistry","2007","5","18","2925","2931","10.1039/b708139a","","","1.54178","CuKα","","0.1168","0.0596","","","0.1385","0.1692","","","","","","0.94","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151152","13.9345","0.0002","8.792","0.0002","16.3108","0.0003","90","","96.0142","0.0011","90","","1987.27","0.06","200","","200","","","","","","","","?","3","P 1 21/a 1","-P 2yab","14","","","","- C25 H24 O4 -","- C25 H24 O4 -","- C100 H96 O16 -","4","1","","Tripoli, Regis; Cayzer, Tory N.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.","Stereocontrol of intramolecular Diels‒Alder reactions by an allylic diphenylcyclopropyl group","Organic & Biomolecular Chemistry","2007","5","16","2606","","10.1039/b708324f","","","0.71073","MoKα","","0.0485","0.0325","","0.0427","0.0351","0.0351","","","","","","1.1283","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151153","15.0402","0.0003","15.3235","0.0003","19.7863","0.0005","90","","90","","90","","4560.12","0.17","200","","200","","","","","","","","?","3","P b c a","-P 2ac 2ab","61","","","","- C27 H26 O6 -","- C27 H26 O6 -","- C216 H208 O48 -","8","1","","Tripoli, Regis; Cayzer, Tory N.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.","Stereocontrol of intramolecular Diels‒Alder reactions by an allylic diphenylcyclopropyl group","Organic & Biomolecular Chemistry","2007","5","16","2606","","10.1039/b708324f","","","0.71073","MoKα","","0.0402","0.0325","","0.041","0.0361","0.0361","","","","","","1.0664","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151154","11.019","0.0004","7.6264","0.0003","12.1306","0.0005","90","","91.3965","0.0017","90","","1019.1","0.07","200","","200","","","","","","","","?","3","P 1 21 1","P 2yb","4","","","","- C25 H24 O4 -","- C25 H24 O4 -","- C50 H48 O8 -","2","1","","Tripoli, Regis; Cayzer, Tory N.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.","Stereocontrol of intramolecular Diels‒Alder reactions by an allylic diphenylcyclopropyl group","Organic & Biomolecular Chemistry","2007","5","16","2606","","10.1039/b708324f","","","0.71073","MoKα","","0.0353","0.0353","","0.0391","0.0391","0.0391","","","","","","1.0875","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151155","7.3431","0.0003","6.158","0.0003","14.2504","0.0006","90","","90.828","0.001","90","","644.32","0.05","200","2","200","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C11 H15 Cl2 N O2 -","- C11 H15 Cl2 N O2 -","- C22 H30 Cl4 N2 O4 -","2","1","","Spiess, Stephanie; Berthold, Carola; Weihofen, Robert; Helmchen, Günter","Synthesis of alpha,beta-unsaturated gamma-lactams via asymmetric iridium-catalysed allylic substitution.","Organic & biomolecular chemistry","2007","5","15","2357","2360","10.1039/b708571k","","","0.71073","MoKα","","0.0677","0.0456","","","0.087","0.0957","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151156","12.996","0.002","9.9631","0.0015","17.8565","0.0018","90","","116.763","0.008","90","","2064.4","0.5","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H17 Cu N5 O6 -","- C22 H17 Cu N5 O6 -","- C88 H68 Cu4 N20 O24 -","4","1","","Bertrand, Hélène; Monchaud, David; De Cian, Anne; Guillot, Régis; Mergny, Jean-Louis; Teulade-Fichou, Marie-Paule","The importance of metal geometry in the recognition of G-quadruplex-DNA by metal-terpyridine complexes","Organic & Biomolecular Chemistry","2007","5","16","2555","","10.1039/b708635k","","x-ray","0.71073","MoKα","","0.085","0.0733","","","0.207","0.2111","","","","","","1.088","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7151157","7.6411","0.0003","8.4172","0.0003","12.521","0.0005","71.402","0.001","85.487","0.002","63.189","0.002","679.18","0.05","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H17 N3 O2 -","- C15 H17 N3 O2 -","- C30 H34 N6 O4 -","2","1","","Kumarn, Sirirat; Oelke, Alexander J.; Shaw, David M.; Longbottom, Deborah A.; Ley, Steven V.","A sequential enantioselective, organocatalytic route to chiral 1,2-oxazines and chiral pyridazines","Organic & Biomolecular Chemistry","2007","5","16","2678","","10.1039/b708646f","","","0.71073","MoKα","","0.0649","0.0448","","","0.1016","0.1124","","","","","","1.034","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151158","10.716","0.001","20.066","0.002","10.835","0.001","90","","91.767","0.009","90","","2328.7","0.4","296.2","","296.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H24 Cl3 N O5 S -","- C20 H24 Cl3 N O5 S -","- C80 H96 Cl12 N4 O20 S4 -","4","1","","Baylis, Alison M.; Davies, Michael P. H.; Thomas, Eric J.","Synthetic approaches to the polycyclic alkaloid stemofoline.","Organic & biomolecular chemistry","2007","5","19","3139","3155","10.1039/b708910d","","","1.5418","CuKα","","","0.0774","","","0.0956","","","","","3.081","3.081","","","","","has coordinates","209484","2020-10-21","18:00:00",""
"7151159","16.5525","0.0003","10.1393","0.0002","14.0826","0.0003","90","","90","","90","","2363.49","0.08","120","2","120","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","3-bromo-4,5,6,7-tetrahydroazepinobenzisothiazole-1,1-dioxide","","- C12 H12 Br N O2 S -","- C12 H12 Br N O2 S -","- C96 H96 Br8 N8 O16 S8 -","8","1","","Harling, John D.; Steel, Patrick G.; Woods, Tom M.; Yufit, Dmitry S.","One-pot synthesis of benzothiazolines and napthathiazolines via cascade ortho-lithiation, cyclisation and elimination of N-arylsulfonyl lactams.","Organic & biomolecular chemistry","2007","5","21","3472","3476","10.1039/b708967h","","","0.71073","Mo-Kα","","0.0345","0.0285","","","0.0695","0.0724","","","","","","1.145","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7151160","10.79","0.004","10.8","0.003","13.163","0.004","96.79","0.03","106","0.03","105.9","0.03","1386.6","0.9","150","","150","","","","","","","","","4","P 1","P 1","1","8-((1'',10'''-phenantroline-2''-yl)phenyl)-2'-deoxyadenosine","8-[(1'',10'''-phenantroline-2''-yl]phenyl]-2'-deoxyadenosine","","- C28 H23 N7 O3 -","- C28 H22.5 N7 O3 -","- C56 H45 N14 O6 -","2","2","","Vrábel, Milan; Pohl, Radek; Klepetárová, Blanka; Votruba, Ivan; Hocek, Michal","Synthesis of 2'-deoxyadenosine nucleosides bearing bipyridine-type ligands and their Ru-complexes in position 8 through cross-coupling reactions.","Organic & biomolecular chemistry","2007","5","17","2849","2857","10.1039/b709245h","","x-ray","1.54184","CuKα","","0.0894","0.0576","","0.092","0.0712","0.0712","","","","","","0.987","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151161","13.291","0.005","13.669","0.005","16.242","0.005","89.02","0.03","71.32","0.03","89.82","0.04","2794.9","1.8","150","","150","","","","","","","","","7","P 1","P 1","1","8((1'',10'''-phenantroline-2''-yl)phenyl-(bis (2,2')- bipyridine)ruthenium)-2'-deoxyadenosine-dihexafluorophosphate","8{(1'',10'''-phenantroline-2''-yl)phenyl-(bis [2,2']-bipyridine)ruthenium}-2'-deoxyadenosine- dihexafluorophosphate","","- C48 H38 F12 N11 O3 P2 Ru2 -","- C48 H37.5 F12 N11 O3 P2 Ru -","- C96 H75 F24 N22 O6 P4 Ru2 -","2","2","","Vrábel, Milan; Pohl, Radek; Klepetárová, Blanka; Votruba, Ivan; Hocek, Michal","Synthesis of 2'-deoxyadenosine nucleosides bearing bipyridine-type ligands and their Ru-complexes in position 8 through cross-coupling reactions.","Organic & biomolecular chemistry","2007","5","17","2849","2857","10.1039/b709245h","","x-ray","1.54184","CuKα","","0.0727","0.0585","","0.0778","0.0689","0.0689","","","","","","1.1081","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151162","16.9623","0.0004","9.9591","0.0002","11.0721","0.0003","90","","96.287","0.001","90","","1859.15","0.08","120","","120","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(1S*,2S*,3R*,4R*)-4-Cyclohexyl-3-ethenyl-4-methoxy-2-methyl-1- phenylbutan-1-ol","(1S*,2S*,3R*,4R*)-4-Cyclohexyl-3-ethenyl-4-methoxy-2-methyl-1-phenylbutan-1-ol","","- C20 H30 O2 -","- C20 H30 O2 -","- C80 H120 O8 -","4","1","","Hughes, Nicholas J.; Pullin, Robert D. C.; Sanganee, Mahesh J.; Sellars, Jonathan D.; Steel, Patrick G.; Turner, Michael J.","Hosomi-Sakurai reactions of silacyclohexenes.","Organic & biomolecular chemistry","2007","5","17","2841","2848","10.1039/b709318g","","","0.71073","MoKα","","0.0781","0.0385","","0.1426","0.0891","0.0891","","","","","","1.0325","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151163","9.3614","0.0007","10.3321","0.0004","20.0889","0.0015","90","","90","","90","","1943.1","0.2","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","5S,6S-5,6-bis((4'R)-2',2'-dimethyl-1,3-dioxolan-4'-yl)-5,6- dihydro-1,3-dithiolo(4,5-b)1,4-dithiin-2-thione","5S,6S-5,6-bis((4'R)-2',2'-dimethyl-1,3-dioxolan-4'-yl)-5,6-dihydro-1,3- dithiolo[4,5-b]1,4-dithiin-2-thione","","- C15 H20 O4 S5 -","- C15 H20 O4 S5 -","- C60 H80 O16 S20 -","4","1","","Brown, R. James; Brooks, Andrew C.; Griffiths, Jon-Paul; Vital, Betrand; Day, Peter; Wallis, John D.","Synthesis of bis(ethylenedithio)tetrathiafulvalene (BEDT-TTF) derivatives functionalised with two, four or eight hydroxyl groups.","Organic & biomolecular chemistry","2007","5","19","3172","3182","10.1039/b709823e","","","0.71073","MoKα","","0.1543","0.0607","","","0.0985","0.1153","","","","","","0.87","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151164","9.243","0.005","5.497","0.003","12.258","0.007","90","","95.177","0.009","90","","620.3","0.6","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H13 N O3 S -","- C12 H13 N O3 S -","- C24 H26 N2 O6 S2 -","2","1","","Evans, Lyndsay Ann; Adams, Harry; Barber, Christopher G.; Caggiano, Lorenzo; Jackson, Richard F. W.","Stereoselective synthesis of 2,3-difunctionalised thioesters using nucleophilic epoxidation of 1-arylthio-1-nitroalkenes.","Organic & biomolecular chemistry","2007","5","19","3156","3163","10.1039/b710237b","","","0.71073","MoKα","","0.1055","0.0664","","","0.1539","0.1731","","","","","","1.137","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151165","7.5636","0.0011","10.4554","0.0016","15.375","0.002","90","","90","","90","","1215.9","0.3","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H12 O4 S -","- C12 H12 O4 S -","- C48 H48 O16 S4 -","4","1","","Evans, Lyndsay Ann; Adams, Harry; Barber, Christopher G.; Caggiano, Lorenzo; Jackson, Richard F. W.","Stereoselective synthesis of 2,3-difunctionalised thioesters using nucleophilic epoxidation of 1-arylthio-1-nitroalkenes.","Organic & biomolecular chemistry","2007","5","19","3156","3163","10.1039/b710237b","","","0.71073","MoKα","","0.0398","0.0315","","","0.077","0.0803","","","","","","1.06","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151166","8.587","0.003","5.2659","0.0018","19.647","0.007","90","","95.641","0.006","90","","884.1","0.5","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C16 H22 Br N O3 S -","- C16 H22 Br N O3 S -","- C32 H44 Br2 N2 O6 S2 -","2","1","","Evans, Lyndsay Ann; Adams, Harry; Barber, Christopher G.; Caggiano, Lorenzo; Jackson, Richard F. W.","Stereoselective synthesis of 2,3-difunctionalised thioesters using nucleophilic epoxidation of 1-arylthio-1-nitroalkenes.","Organic & biomolecular chemistry","2007","5","19","3156","3163","10.1039/b710237b","","","0.71073","MoKα","","0.0577","0.0433","","","0.0914","0.0971","","","","","","0.976","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151167","5.249","0.003","5.794","0.003","20.357","0.012","90","","94.212","0.01","90","","617.4","0.6","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H13 N O3 S -","- C12 H13 N O3 S -","- C24 H26 N2 O6 S2 -","2","1","","Evans, Lyndsay Ann; Adams, Harry; Barber, Christopher G.; Caggiano, Lorenzo; Jackson, Richard F. W.","Stereoselective synthesis of 2,3-difunctionalised thioesters using nucleophilic epoxidation of 1-arylthio-1-nitroalkenes.","Organic & biomolecular chemistry","2007","5","19","3156","3163","10.1039/b710237b","","","0.71073","MoKα","","0.075","0.0568","","","0.13","0.1356","","","","","","1.058","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151168","7.4415","0.0013","21.445","0.004","8.9163","0.0015","90","","104.154","0.002","90","","1379.7","0.4","110","2","110","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H15 I N4 O -","- C13 H15 I N4 O -","- C52 H60 I4 N16 O4 -","4","1","","Pérez-Castro, Isabel; Caamaño, Olga; Fernández, Franco; García, Marcos D; López, Carmen; De Clercq, Erik","Synthesis of 4-substituted-1,2,3-triazole carbanucleoside analogues of ribavirin via click chemistry.","Organic & biomolecular chemistry","2007","5","23","3805","3813","10.1039/b710348d","","x-ray","0.7107","MoKα","","0.0389","0.0265","","","0.0613","0.0649","","","","","","1.066","","","","has coordinates,has disorder","180297","2020-10-21","18:00:00",""
"7151169","11.0274","0.0005","8.9869","0.0005","21.255","0.0008","90","","91.304","0.003","90","","2105.87","0.17","150","2","150","2","","","","","","","synthesis as described","4","P 1 21/a 1","-P 2yab","14","","","","- C44 H56 N8 O8 -","- C44 H56 N8 O8 -","- C88 H112 N16 O16 -","2","0.5","","Wilson, Jennifer M.; Giordani, Federica; Farrugia, Louis J.; Barrett, Michael P.; Robins, David J.; Sutherland, Andrew","Synthesis, characterisation and anti-protozoal activity of carbamate-derived polyazamacrocycles.","Organic & biomolecular chemistry","2007","5","22","3651","3656","10.1039/b710487a","","x-ray","0.71073","MoKα","","0.1194","0.0589","","","0.1213","0.1376","","","","","","1.056","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151170","11.1024","0.0004","13.8168","0.0005","26.9261","0.0009","90","","90","","90","","4130.5","0.3","295","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C42 H34 Cl2 N2 O6 P2 Pt -","- C42 H30 Cl2 N2 O6 P2 Pt -","- C168 H120 Cl8 N8 O24 P8 Pt4 -","4","1","","Eberhardt, Luc; Armspach, Dominique; Matt, Dominique; Oswald, Benoît; Toupet, Loic","Efficient asymmetric hydrogenation of olefins with hydrazine-derived diphosphoramidites.","Organic & biomolecular chemistry","2007","5","20","3340","3346","10.1039/b710576b","","","0.71069","MoKα","","0.051","0.0422","","","0.1143","0.1181","","","","","","1.03","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151171","7.944","0.003","9.7","0.004","11.001","0.003","81.649","0.003","74.131","0.003","67.241","0.002","751.2","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H12 Cl N2 O2.5 Se -","- C14 H11 Cl N2 O2.5 Se -","- C28 H22 Cl2 N4 O5 Se2 -","2","1","","Kuzma, Dusan; Parvez, Masood; Back, Thomas George","Formation of a spirodiazaselenurane and its corresponding azaselenonium derivatives from the oxidation of 2,2'-selenobis(benzamide). Structure, properties and glutathione peroxidase activity.","Organic & biomolecular chemistry","2007","5","19","3213","3217","10.1039/b710685h","","","0.71073","MoKα","","0.05","0.035","","","0.076","0.081","","","","","","1.04","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151172","4.554","0.002","18.386","0.004","9.912","0.007","90","","102.57","0.02","90","","810","0.7","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H18 N2 O6 Se -","- C14 H18 N2 O6 Se -","- C28 H36 N4 O12 Se2 -","2","1","","Kuzma, Dusan; Parvez, Masood; Back, Thomas George","Formation of a spirodiazaselenurane and its corresponding azaselenonium derivatives from the oxidation of 2,2'-selenobis(benzamide). Structure, properties and glutathione peroxidase activity.","Organic & biomolecular chemistry","2007","5","19","3213","3217","10.1039/b710685h","","","0.71073","MoKα","","0.12","0.075","","","0.137","0.159","","","","","","1.21","","","","has coordinates,has disorder","180297","2020-10-21","18:00:00",""
"7151173","12.3636","0.001","5.2242","0.0004","13.3704","0.0011","90","","97.482","0.002","90","","856.24","0.12","173.1","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H24 N2 O -","- C21 H24 N2 O -","- C42 H48 N4 O2 -","2","1","","Mikata, Yuji; Aida, Shiho; Inaba, Yoko; Yano, Shigenobu","Consideration of molecular arrangements in regio- and enantioselective reduction of an NAD model compound controlled by carbonyl oxygen orientation.","Organic & biomolecular chemistry","2007","5","23","3834","3841","10.1039/b710780c","","","0.7107","MoKα","","","0.051","","","","0.102","","","","","","1.133","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151174","5.3478","0.001","13.519","0.003","23.99","0.005","90","","90","","90","","1734.4","0.6","173.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H24 N2 O -","- C21 H24 N2 O -","- C84 H96 N8 O4 -","4","1","","Mikata, Yuji; Aida, Shiho; Inaba, Yoko; Yano, Shigenobu","Consideration of molecular arrangements in regio- and enantioselective reduction of an NAD model compound controlled by carbonyl oxygen orientation.","Organic & biomolecular chemistry","2007","5","23","3834","3841","10.1039/b710780c","","","0.7107","MoKα","","","0.039","","","","0.115","","","","","","1.155","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151175","11.3721","0.0014","9.835","0.0013","20.671","0.002","90","","90","","90","","2311.9","0.5","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H11 Fe N O4 -","- C10 H11 Fe N O4 -","- C80 H88 Fe8 N8 O32 -","8","1","","Williams, Iwan; Reeves, Keith; Kariuki, Benson M.; Cox, Liam R.","Stereoselective synthesis of 2-dienyl-substituted piperidines using an eta4-dienetricarbonyliron complex as the stereocontrolling element in a double reductive amination cascade.","Organic & biomolecular chemistry","2007","5","20","3325","3329","10.1039/b710898b","","","1.54178","CuKα","","0.1026","0.0559","","","0.1264","0.1444","","","","","","1.029","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151176","7.6829","0.0003","10.9941","0.0004","12.0958","0.0004","69.757","0.002","78.689","0.002","89.592","0.002","937.92","0.06","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H22 Br Fe N O3 -","- C17 H22 Br Fe N O3 -","- C34 H44 Br2 Fe2 N2 O6 -","2","1","","Williams, Iwan; Reeves, Keith; Kariuki, Benson M.; Cox, Liam R.","Stereoselective synthesis of 2-dienyl-substituted piperidines using an eta4-dienetricarbonyliron complex as the stereocontrolling element in a double reductive amination cascade.","Organic & biomolecular chemistry","2007","5","20","3325","3329","10.1039/b710898b","","","1.54178","CuKα","","0.0567","0.0433","","","0.1091","0.1167","","","","","","1.049","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151177","9.905","0.001","9.905","0.001","39.488","0.001","90","","90","","90","","3874.1","0.6","293","2","293","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C15 H22 F3 N O6 S2 -","- C15 H22 F3 N O6 S2 -","- C120 H176 F24 N8 O48 S16 -","8","1","","Chen, Yue-Lei; Redlich, Hartmut; Bergander, Klaus; Fröhlich, Roland","D-glucosamine trimethylene dithioacetal derivatives: formation of six- and seven-membered ring amino carbasugars. Synthesis of (-)-calystegine B3.","Organic & biomolecular chemistry","2007","5","20","3330","3339","10.1039/b711112f","","","1.54178","CuKα","","0.0499","0.0476","","","0.137","0.1405","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151178","7.119","0.0002","10.6793","0.0003","12.0216","0.0004","90","","90","","90","","913.95","0.05","190","","190","","","","","","","","","3","P 21 c n","P -2n 2a","33","","","","- C10 H14 O3 -","- C10 H14 O3 -","- C40 H56 O12 -","4","1","","Davies, Stephen G.; Russell, Angela J.; Sheppard, Ruth L.; Smith, Andrew D.; Thomson, James E.","Evaluating beta-amino acids as enantioselective organocatalysts of the Hajos-Parrish-Eder-Sauer-Wiechert reaction.","Organic & biomolecular chemistry","2007","5","19","3190","3200","10.1039/b711171a","","","0.71073","MoKα","","0.0326","0.0289","","0.0383","0.0346","0.0346","","","","","","1.1066","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151179","6.9811","0.0002","7.5933","0.0002","19.5994","0.0006","90","","94.874","0.001","90","","1035.2","0.05","190","","190","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H16 O3 -","- C11 H16 O3 -","- C44 H64 O12 -","4","1","","Davies, Stephen G.; Russell, Angela J.; Sheppard, Ruth L.; Smith, Andrew D.; Thomson, James E.","Evaluating beta-amino acids as enantioselective organocatalysts of the Hajos-Parrish-Eder-Sauer-Wiechert reaction.","Organic & biomolecular chemistry","2007","5","19","3190","3200","10.1039/b711171a","","","0.71073","MoKα","","0.0591","0.0391","","0.0665","0.048","0.048","","","","","","1.0967","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151180","11.412","0.0005","5.887","0.0003","12.379","0.0007","90","","93.337","0.002","90","","830.24","0.07","30","2","30","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H9 Br O5 -","- C6 H9 Br O5 -","- C24 H36 Br4 O20 -","4","1","","Pirinççioğlu, Necmettin; Robinson, James J.; Mahon, Mary F.; Buchanan, J. Grant; Williams, Ian H.","Experimental and computational evidence for alpha-lactone intermediates in the addition of aqueous bromine to disodium dimethyl-maleate and -fumarate.","Organic & biomolecular chemistry","2007","5","24","4001","4009","10.1039/b711538e","","","0.71073","MoKα","","0.0626","0.0381","","","0.0761","0.0832","","","","","","1.021","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151181","6.239","0.0003","7.228","0.0004","11.171","0.0008","85.342","0.002","82.801","0.002","69.105","0.003","466.56","0.05","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H10 Br O6 -","- C6 H11 Br O6 -","- C12 H22 Br2 O12 -","2","1","","Pirinççioğlu, Necmettin; Robinson, James J.; Mahon, Mary F.; Buchanan, J. Grant; Williams, Ian H.","Experimental and computational evidence for alpha-lactone intermediates in the addition of aqueous bromine to disodium dimethyl-maleate and -fumarate.","Organic & biomolecular chemistry","2007","5","24","4001","4009","10.1039/b711538e","","","0.71073","MoKα","","0.0614","0.0379","","","0.0785","0.0877","","","","","","0.96","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151182","7.7577","0.0008","17.7377","0.0019","20.872","0.002","90","","90","","90","","2872.1","0.5","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(2R,3R,4S)-1-(Toluene-4-sulfonyl)-2-(carbamoyloxymethyl) -3,4- epoxypyrrolidine","(2R,3R,4S)-1-(Toluene-4-sulfonyl)-2-(carbamoyloxymethyl) -3,4-epoxypyrrolidine","","- C13 H16 N2 O5 S -","- C13 H16 N2 O5 S -","- C104 H128 N16 O40 S8 -","8","2","","Curtis, Kim L.; Evinson, Emma L.; Handa, Sandeep; Singh, Kuldip","Asymmetric synthesis of 3-amino-4-hydroxy-2-(hydroxymethyl)pyrrolidines as potential glycosidase inhibitors.","Organic & biomolecular chemistry","2007","5","21","3544","3553","10.1039/b711994a","","","0.71073","MoKα","","0.0482","0.0384","","","0.0673","0.0699","","","","","","0.914","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151183","11.501","0.003","6.2268","0.0017","19.785","0.006","90","","91.192","0.005","90","","1416.6","0.7","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","(2S,3S,4S)-1-(Toluene-4-sulfonyl)-4-hydroxy-2,3-(oxazin-2- one)-pyrrolidine","(2S,3S,4S)-1-(Toluene-4-sulfonyl)-4-hydroxy-2,3-(oxazin-2-one)-pyrrolidine","","- C13 H16 N2 O5 S -","- C13 H16 N2 O5 S -","- C52 H64 N8 O20 S4 -","4","2","","Curtis, Kim L.; Evinson, Emma L.; Handa, Sandeep; Singh, Kuldip","Asymmetric synthesis of 3-amino-4-hydroxy-2-(hydroxymethyl)pyrrolidines as potential glycosidase inhibitors.","Organic & biomolecular chemistry","2007","5","21","3544","3553","10.1039/b711994a","","","0.71073","MoKα","","0.149","0.1123","","","0.2547","0.2799","","","","","","1.002","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7151184","7.5443","0.0006","10.6588","0.0009","17.4366","0.0015","90","","90","","90","","1402.1","0.2","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","(2R,3R,4R)-1-(Toluene-4-sulfonyl)-2-hydroxymethyl-3-bromo-4- hydroxypyrrolidine","(2R,3R,4R)-1-(Toluene-4-sulfonyl)-2-hydroxymethyl-3-bromo-4-hydroxypyrrolidine","","- C12 H16 Br N O4 S -","- C12 H16 Br N O4 S -","- C48 H64 Br4 N4 O16 S4 -","4","1","","Curtis, Kim L.; Evinson, Emma L.; Handa, Sandeep; Singh, Kuldip","Asymmetric synthesis of 3-amino-4-hydroxy-2-(hydroxymethyl)pyrrolidines as potential glycosidase inhibitors.","Organic & biomolecular chemistry","2007","5","21","3544","3553","10.1039/b711994a","","","0.71073","MoKα","","0.0273","0.0255","","","0.0657","0.0661","","","","","","1.063","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151185","7.539","0.004","17.643","0.009","11.223","0.005","90","","100.446","0.008","90","","1468","1.3","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","(2S,3R,4R)-1-(Toluene-4-sulfonyl)-2-hydroxymethyl-3-azido-4- hydroxypyrrolidine","(2S,3R,4R)-1-(Toluene-4-sulfonyl)-2-hydroxymethyl-3-azido-4-hydroxypyrrolidine","","- C12 H16 N4 O4 S -","- C12 H16 N4 O4 S -","- C48 H64 N16 O16 S4 -","4","2","","Curtis, Kim L.; Evinson, Emma L.; Handa, Sandeep; Singh, Kuldip","Asymmetric synthesis of 3-amino-4-hydroxy-2-(hydroxymethyl)pyrrolidines as potential glycosidase inhibitors.","Organic & biomolecular chemistry","2007","5","21","3544","3553","10.1039/b711994a","","","0.71073","MoKα","","0.1458","0.0797","","","0.1331","0.1542","","","","","","0.961","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151186","5.6923","0.0007","15.7807","0.0017","33.089","0.004","90","","90","","90","","2972.3","0.6","290","2","290","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H15 N2 O5 S -","- C6.5 H7.5 N O2.5 S0.5 -","- C52 H60 N8 O20 S4 -","8","2","","Curtis, Kim L.; Evinson, Emma L.; Handa, Sandeep; Singh, Kuldip","Asymmetric synthesis of 3-amino-4-hydroxy-2-(hydroxymethyl)pyrrolidines as potential glycosidase inhibitors.","Organic & biomolecular chemistry","2007","5","21","3544","3553","10.1039/b711994a","","","0.71073","MoKα","","0.0833","0.0582","","","0.1165","0.1274","","","","","","0.986","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151187","5.098","0.001","14.076","0.002","20.831","0.007","90","","92.82","0.02","90","","1493","0.6","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 O6 S2 -","- C14 H14 O6 S2 -","- C56 H56 O24 S8 -","4","1","","Hergué, Noémie; Frère, Pierre","Synthesis of 3,4-alkoxythieno[2,3-b]thiophene derivatives. The first block copolymer associating the 3,4-ethylenedioxythieno[2,3-b]thiophene (EDOThT) unit with 3,4-ethylenedioxythiophene (EDOT) moieties.","Organic & biomolecular chemistry","2007","5","21","3442","3449","10.1039/b712052d","","x-ray","0.71073","MoKα","","","0.0851","","","","0.1718","","","","","","1.064","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151188","7.7573","0.0006","6.5351","0.0005","20.5605","0.0015","90","","93.341","0.002","90","","1040.54","0.14","115","2","115","2","","","","","","","","4","P 1 21 1","P 2yb","4","(2S)-3-phenyl-2-((2S)-1-((1S)-1-phenylethyl)piperidin-2- yl)propionate","","","- C24 H31 N O2 -","- C24 H31 N O2 -","- C48 H62 N2 O4 -","2","1","","Hermet, Jean-Paul R; Viterisi, Aurélien; Wright, Jonathan M.; McGrath, Matthew J.; O'Brien, Peter; Whitwood, Adrian C.; Gilday, John","Stereocontrolled synthesis and alkylation of cyclic beta-amino esters: asymmetric synthesis of a (-)-sparteine surrogate.","Organic & biomolecular chemistry","2007","5","22","3614","3622","10.1039/b712503h","","","0.71073","MoKα","","0.0431","0.0373","","","0.0846","0.0889","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151189","8.8675","0.0012","12.5714","0.0017","16.873","0.002","77.372","0.003","85.404","0.003","69.451","0.002","1718.7","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H28 B Cl3 N6 O4 -","- C36 H24 B Cl3 N6 O4 -","- C72 H48 B2 Cl6 N12 O8 -","2","1","","Xu, Hu; Jiang, Xiong-Jie; Chan, Elaine Y. M.; Fong, Wing-Ping; Ng, Dennis K. P.","Synthesis, photophysical properties and in vitro photodynamic activity of axially substituted subphthalocyanines.","Organic & biomolecular chemistry","2007","5","24","3987","3992","10.1039/b712788j","","","0.71073","MoKα","","0.0875","0.068","","","0.187","0.2073","","","","","","1.02","","","","has coordinates,has disorder","180297","2020-10-21","18:00:00",""
"7151190","11.4449","0.0002","11.8","0.0002","14.6478","0.0002","71.901","0.0006","67.6483","0.0007","76.207","0.0008","1722.68","0.05","190","","190","","","","","","","","","5","P 1","P 1","1","","","","- C36 H51 N O3 Si -","- C36 H51 N O3 Si -","- C72 H102 N2 O6 Si2 -","2","2","","Cailleau, Thaïs; Cooke, Jason W. B.; Davies, Stephen G.; Ling, Kenneth B.; Naylor, Alan; Nicholson, Rebecca L.; Price, Paul D.; Roberts, Paul M.; Russell, Angela J.; Smith, Andrew D.; Thomson, James E.","Asymmetric synthesis of beta-amino-gamma-substituted-gamma-butyrolactones: double diastereoselective conjugate addition of homochiral lithium amides to homochiral alpha,beta-unsaturated esters.","Organic & biomolecular chemistry","2007","5","24","3922","3931","10.1039/b712937h","","","0.71073","MoKα","","0.0847","0.0668","","0.103","0.0822","0.0822","","","","","","1.1046","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151191","9.593","0.0011","10.5494","0.0013","13.618","0.002","76.415","0.002","85.266","0.002","81.798","0.002","1324.2","0.3","301","1","","","","","","","","","","6","P 1","P 1","1","","","","- C27 H28 Br N2 O3 Re -","- C27 H28 Br N2 O3 Re -","- C54 H56 Br2 N4 O6 Re2 -","2","2","","Yeung, Chi-Tung; Teng, Pang-Fei; Yeung, Ho-Lun; Wong, Wing-Tak; Kwong, Hoi-Lun","Catalytic and asymmetric cyclopropanation of alkenes catalysed by rhenium(I) bipyridine and terpyridine tricarbonyl complexes.","Organic & biomolecular chemistry","2007","5","23","3859","3864","10.1039/b712995e","","","0.71073","MoKα","","","0.028","","","","0.031","","","","","","1.026","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151192","7.893","0.002","14.212","0.003","28.551","0.006","90","","90","","90","","3202.7","1.3","301","1","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C34 H35 Br N3 O3 Re -","- C34 H35 Br N3 O3 Re -","- C136 H140 Br4 N12 O12 Re4 -","4","1","","Yeung, Chi-Tung; Teng, Pang-Fei; Yeung, Ho-Lun; Wong, Wing-Tak; Kwong, Hoi-Lun","Catalytic and asymmetric cyclopropanation of alkenes catalysed by rhenium(I) bipyridine and terpyridine tricarbonyl complexes.","Organic & biomolecular chemistry","2007","5","23","3859","3864","10.1039/b712995e","","","0.71073","MoKα","","","0.029","","","","0.029","","","","","","1.018","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151193","9.516","0.01","16.66","0.02","6.226","0.004","98.72","0.09","105.35","0.07","98.72","0.11","921.6","1.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H21 Cl O10 -","- C16 H21 Cl O10 -","- C32 H42 Cl2 O20 -","2","1","","Yamada, Takeshi; Iritani, Masashi; Ohishi, Hirohumi; Tanaka, Kayo; Minoura, Katsuhiko; Doi, Mitsunobu; Numata, Atsushi","Pericosines, antitumour metabolites from the sea hare-derived fungus Periconia byssoides. Structures and biological activities.","Organic & biomolecular chemistry","2007","5","24","3979","3986","10.1039/b713060k","","","1.54178","CuKα","","0.1701","0.103","","","0.2516","0.2954","","","","","","1.101","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151194","11.3871","0.0016","18.131","0.003","19.855","0.003","90","","90","","90","","4099.3","1.1","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C26 H17 N3 O3 -","- C26 H17 N3 O3 -","- C208 H136 N24 O24 -","8","1","","Manpadi, Madhuri; Uglinskii, Pavel Y.; Rastogi, Shiva K.; Cotter, Karen M.; Wong, Yin-Shan C; Anderson, Lisa A.; Ortega, Amber J.; Van Slambrouck, Severine; Steelant, Wim F. A.; Rogelj, Snezna; Tongwa, Paul; Antipin, Mikhail Yu; Magedov, Igor V.; Kornienko, Alexander","Three-component synthesis and anticancer evaluation of polycyclic indenopyridines lead to the discovery of a novel indenoheterocycle with potent apoptosis inducing properties.","Organic & biomolecular chemistry","2007","5","23","3865","3872","10.1039/b713820b","","","0.71073","MoKα","","0.0849","0.0448","","","0.0893","0.1028","","","","","","0.998","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151195","8.401","0.002","10.368","0.003","15.647","0.004","95.41","0.004","95.198","0.006","102.676","0.005","1315","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H30 N2 O4 -","- C30 H30 N2 O4 -","- C60 H60 N4 O8 -","2","1","","Anas, S.; John, Jubi; Sajisha, V. S.; John, Joshni; Rajan, Rani; Suresh, E.; Radhakrishnan, K. V.","Iodine assisted palladium catalyzed ring opening of bicyclic hydrazines with organoboronic acids: stereoselective synthesis of functionalized cyclopentenes and alkylidene cyclopentenes.","Organic & biomolecular chemistry","2007","5","24","4010","4019","10.1039/b714921b","","","0.71073","MoKα","","0.193","0.0724","","","0.1485","0.2136","","","","","","1.001","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151196","18.3557","0.0005","10.5375","0.0003","13.167","0.0003","90","","103.55","0.001","90","","2475.91","0.11","173","2","173","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H26 Cl6 D6 N6 -","- C18 H32 Cl6 N6 -","- C72 H128 Cl24 N24 -","4","0.5","","Coles, Martyn P.; Lee, Steven F.; Oakley, Sarah H.; Estiu, Guillermina; Hitchcock, Peter B.","Nucleophilic activity of a linked bis{guanidine} leading to formation of a dicationic C4N4-heterocycle.","Organic & biomolecular chemistry","2007","5","24","3909","3911","10.1039/b715209d","","x-ray","0.71073","MoKα","","0.0452","0.0414","","","0.115","0.1186","","","","","","1.031","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7151197","11.1882","0.0002","14.384","0.0003","16.3407","0.0003","90","","104.766","0.001","90","","2542.88","0.08","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C64 H68 B2 N6 -","- C64 H68 B2 N6 -","- C128 H136 B4 N12 -","2","0.5","","Coles, Martyn P.; Lee, Steven F.; Oakley, Sarah H.; Estiu, Guillermina; Hitchcock, Peter B.","Nucleophilic activity of a linked bis{guanidine} leading to formation of a dicationic C4N4-heterocycle.","Organic & biomolecular chemistry","2007","5","24","3909","3911","10.1039/b715209d","","x-ray","0.71073","MoKα","","0.0721","0.0578","","","0.1451","0.1547","","","","","","1.027","","","","has coordinates,has disorder","180297","2020-10-21","18:00:00",""
"7151198","18.824","0.0006","13.0677","0.0002","26.2401","0.0007","90","","105.854","0.001","90","","6209.2","0.3","173","2","173","2","","","","","","","synthesis as described","4","C 1 c 1","C -2yc","9","","","","- C77 H80 B2 N6 -","- C77 H80 B2 N6 -","- C308 H320 B8 N24 -","4","1","","Coles, Martyn P.; Lee, Steven F.; Oakley, Sarah H.; Estiu, Guillermina; Hitchcock, Peter B.","Nucleophilic activity of a linked bis{guanidine} leading to formation of a dicationic C4N4-heterocycle.","Organic & biomolecular chemistry","2007","5","24","3909","3911","10.1039/b715209d","","x-ray","0.71073","MoKα","","0.0732","0.0564","","","0.1352","0.1483","","","","","","1.005","","","","has coordinates,has disorder","202017","2020-10-21","18:00:00",""
"7151199","8.689","0.0005","8.689","0.0005","17.1794","0.0007","90","","90","","120","","1123.25","0.1","173","2","173","2","","","","","","","synthesis as described","3","P 31 2 1","P 31 2""","152","","","","- C15 H26 N6 -","- C15 H26 N6 -","- C45 H78 N18 -","3","0.5","","Coles, Martyn P.; Lee, Steven F.; Oakley, Sarah H.; Estiu, Guillermina; Hitchcock, Peter B.","Nucleophilic activity of a linked bis{guanidine} leading to formation of a dicationic C4N4-heterocycle.","Organic & biomolecular chemistry","2007","5","24","3909","3911","10.1039/b715209d","","x-ray","0.71073","MoKα","","0.0401","0.0339","","","0.0821","0.0856","","","","","","1.081","","","","has coordinates","180297","2020-10-21","18:00:00",""
"7202466","7.2297","0.0005","7.5933","0.0005","14.498","0.0009","90","","99.15","0.03","90","","785.77","0.11","105","2","105","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Tetrathiafulvalene-p-chloranil","Tetrathiafulvalene-p-chloranil","","- C12 H4 Cl4 O2 S4 -","- C12 H4 Cl4 O2 S4 -","- C24 H8 Cl8 O4 S8 -","2","0.5","","Pilar García; Slimane Dahaoui; Claudine Katan; Mohamed Souhassou; Claude Lecomte","On the accurate estimation of intermolecular interactions and charge transfer: the case of TTF-CA","Faraday Discussions","2007","135","","217","","10.1039/b606642a","","","0.71073","MoKα","","0.0286","0.0141","","","0.0187","0.0257","","","","","","0.87","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202467","7.1999","0.001","7.5556","0.0009","14.4798","0.001","90","","98.511","0.01","90","","779.02","0.15","15","2","15","2","","","","","","","","5","P 1 n 1 (a,b+1/4,c)","P -2yabc","7","tetrathiafulvalene-p-chloranil","tetrathiafulvalene-p-chloranil","","- C12 H4 Cl4 O2 S4 -","- C12 H4 Cl4 O2 S4 -","- C24 H8 Cl8 O4 S8 -","2","","","Pilar García; Slimane Dahaoui; Claudine Katan; Mohamed Souhassou; Claude Lecomte","On the accurate estimation of intermolecular interactions and charge transfer: the case of TTF-CA","Faraday Discussions","2007","135","","217","","10.1039/b606642a","","","0.71073","MoKα","","0.0235","0.0152","","","0.0138","0.0201","","","","","","0.75","","","","has coordinates","208204","2020-10-21","18:00:00",""
"7202468","8.3101","0.0003","12.78","0.0003","7.9582","0.0001","99.627","0.003","95.906","0.003","101.083","0.003","809.74","0.04","100","2","100","2","","","","","","","","3","P -1","-P 1","2","Tetrathiafulvalene","Tetrathiafulvalene","","- C6 H4 S4 -","- C6 H4 S4 -","- C24 H16 S16 -","4","2","","Pilar García; Slimane Dahaoui; Claudine Katan; Mohamed Souhassou; Claude Lecomte","On the accurate estimation of intermolecular interactions and charge transfer: the case of TTF-CA","Faraday Discussions","2007","135","","217","","10.1039/b606642a","","","0.71073","MoKα","","0.074","0.0142","","","0.0112","0.019","","","","","","0.9","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202469","8.5745","0.0008","5.6898","0.0005","8.7004","0.0008","90","","105.952","0.008","90","","408.12","0.07","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","chloranil","chloranil","","- C6 Cl4 O2 -","- C6 Cl4 O2 -","- C12 Cl8 O4 -","2","0.5","","Pilar García; Slimane Dahaoui; Claudine Katan; Mohamed Souhassou; Claude Lecomte","On the accurate estimation of intermolecular interactions and charge transfer: the case of TTF-CA","Faraday Discussions","2007","135","","217","","10.1039/b606642a","","","0.71073","MoKα","","0.0395","0.0167","","","0.0137","0.0162","","","","","","0.77","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202470","20.45","0.004","7.329","0.002","10.31","0.003","90","","99.28","0.02","90","","1525","0.7","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H52 N6 O16 P4 -","- C18 H52 N6 O16 P4 -","- C36 H104 N12 O32 P8 -","2","0.5","","Shastri, Kirtida; Cheng, Eileen W. C.; Motevalli, Majid; Schofield, John; Wilkinson, Jennifer S.; Watkinson, Michael","Investigations into the efficacy of methyhlphosphonic acid functionalised 1,4,7-triazacyclononane ligands in bleaching catalysis","Green Chemistry","2007","9","9","996","","10.1039/b609710c","","","0.71073","MoKα","","0.0928","0.0402","","","0.0944","0.1099","","","","","","1.016","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202471","7.603","0.0007","9.1105","0.0009","13.0353","0.0015","89.455","0.004","75.731","0.004","86.145","0.006","873.06","0.16","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H28 Br2 N3 O5 P -","- C9 H28 Br2 N3 O5 P -","- C18 H56 Br4 N6 O10 P2 -","2","1","","Shastri, Kirtida; Cheng, Eileen W. C.; Motevalli, Majid; Schofield, John; Wilkinson, Jennifer S.; Watkinson, Michael","Investigations into the efficacy of methyhlphosphonic acid functionalised 1,4,7-triazacyclononane ligands in bleaching catalysis","Green Chemistry","2007","9","9","996","","10.1039/b609710c","","","0.71073","MoKα","","0.157","0.1243","","","0.3384","0.3619","","","","","","1.087","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202472","17.432","0.006","18.687","0.006","21.199","0.007","83.439","0.007","66.224","0.007","89.876","0.006","6271","4","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","","","- C70 H88 S3 -","- C70 H88 S3 -","- C280 H352 S12 -","4","2","","Mathieu Surin; Prashant Sonar; Andrew C. Grimsdale; Klaus Müllen; Steven De Feyter; Satoshi Habuchi; Stefano Sarzi; Els Braeken; An Ver Heyen; Mark Van der Auweraer; Frans C. De Schryver; Massimiliano Cavallini; Jean-François Moulin; Fabio Biscarini; Cristina Femoni; Roberto Lazzaroni; Philippe Leclère","Solid-state assemblies and optical properties of conjugated oligomers combining fluorene and thiophene units","Journal of Materials Chemistry","2007","17","8","728","","10.1039/b610132a","","","0.71073","MoKα","","0.2555","0.0858","","","0.1723","0.2265","","","","","","0.918","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202473","11.0586","0.0006","25.0054","0.0011","9.3633","0.0007","90","","108.299","0.002","90","","2458.3","0.3","296","2","","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C31 H30 N O -","- C31 H30 N O -","- C124 H120 N4 O4 -","4","1","","Oka, Hiroyuki; Kouno, Hiroshi; Tanaka, Hitoshi","Synthesis and through-bond spin interaction of stable 1,3-phenylene-linked polyradical carrying aminoxyls in the ?-conjugated main chain","Journal of Materials Chemistry","2007","17","12","1209","","10.1039/b610365k","","","1.54178","CuKα","","0.0494","0.0451","","","0.1087","0.1142","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202474","6.43","0.004","6.715","0.004","11.544","0.007","87.486","0.012","80.11","0.012","80.82","0.01","484.7","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","2-carboxy-1,3-dimethylimidazolium NO3 H2O","","","- C6 H11 N3 O6 -","- C6 H11 N3 O6 -","- C12 H22 N6 O12 -","2","1","","Smiglak, Marcin; Holbrey, John D.; Griffin, Scott T.; Reichert, W. Matthew; Swatloski, Richard P.; Katritzky, Alan R.; Yang, Hongfang; Zhang, Dazhi; Kirichenko, Kostyantyn; Rogers, Robin D.","Ionic liquids via reaction of the zwitterionic 1,3-dimethylimidazolium-2-carboxylate with protic acids. Overcoming synthetic limitations and establishing new halide free protocols for the formation of ILs","Green Chemistry","2007","9","1","90","","10.1039/b610421e","","","0.71073","MoKα","","0.0928","0.0539","","","0.1394","0.1792","","","","","","1.152","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202475","6.628","0.002","11.91","0.004","11.538","0.004","90","","104.508","0.007","90","","881.8","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4-carboxy-1,3-dimethylimidazolium nitrate","","","- C6 H9 N3 O5 -","- C6 H9 N3 O5 -","- C24 H36 N12 O20 -","4","1","","Smiglak, Marcin; Holbrey, John D.; Griffin, Scott T.; Reichert, W. Matthew; Swatloski, Richard P.; Katritzky, Alan R.; Yang, Hongfang; Zhang, Dazhi; Kirichenko, Kostyantyn; Rogers, Robin D.","Ionic liquids via reaction of the zwitterionic 1,3-dimethylimidazolium-2-carboxylate with protic acids. Overcoming synthetic limitations and establishing new halide free protocols for the formation of ILs","Green Chemistry","2007","9","1","90","","10.1039/b610421e","","","0.71073","MoKα","","0.0625","0.0448","","","0.1004","0.1067","","","","","","1.074","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202476","27.5164","0.0019","27.5164","0.0019","14.685","0.002","90","","90","","120","","9629.1","1.6","173","2","173","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- C60 H96 N12 O18 -","- C60.03 H96 N12 O18 -","- C360.18 H576 N72 O108 -","6","0.166667","","Lee, Ho Yong; Kim, Hae-Jo; Lee, Kyoung Jae; Lah, Myoung Soo; Hong, Jong-In","Formation of a discrete helical assembly and packing pattern through charged hydrogen bonds and van der Waals interactions","CrystEngComm","2007","9","1","78","","10.1039/b610512b","","","0.71073","MoKα","","0.1472","0.0729","","","0.2045","0.2573","","","","","","1.016","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202477","17.365","0.0017","9.9287","0.001","20.981","0.002","90","","113.4","0.002","90","","3319.9","0.6","297","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-phenyl-4-p-toluoyl-3H-benzo-[b]-1,5-diazepine-4- (4-methyl phenyl-3H-benzo-[b]-1,5-diazepine","","- C22 H18 N2 -","- C22 H18 N2 -","- C176 H144 N16 -","8","2","","Palimkar, Sanjay S.; Lahoti, Rajgopal J.; Srinivasan, Kumar V.","A novel one-pot three-component synthesis of 2,4-disubstituted-3 H-benzo[ b][1,4]diazepines in water","Green Chemistry","2007","9","2","146","","10.1039/b610523h","","","0.71073","MoKα","","0.1434","0.0771","","","0.172","0.2059","","","","","","1.042","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7202478","3.9826","0.0004","10.6","0.001","18.559","0.002","90","","91.327","0.005","90","","783.27","0.14","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 N2 O2 S2 -","- C18 H14 N2 O2 S2 -","- C36 H28 N4 O4 S4 -","2","0.5","","Ando, Shinji; Kumaki, Daisuke; Nishida, Jun-ichi; Tada, Hirokazu; Inoue, Youji; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, physical properties and field-effect transistors of novel thiazolothiazole?phenylene co-oligomers","Journal of Materials Chemistry","2007","17","6","553","","10.1039/b611814c","","","0.7107","MoKα","","","0.0567","","","","0.1601","","","","","","1.832","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202479","3.744","0.004","6.07","0.007","15.84","0.02","91.8","0.05","96.94","0.05","84.68","0.04","355.7","0.7","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H4 F6 N2 S2 -","- C16 H4 F6 N2 S2 -","- C16 H4 F6 N2 S2 -","1","0.5","","Ando, Shinji; Kumaki, Daisuke; Nishida, Jun-ichi; Tada, Hirokazu; Inoue, Youji; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, physical properties and field-effect transistors of novel thiazolothiazole?phenylene co-oligomers","Journal of Materials Chemistry","2007","17","6","553","","10.1039/b611814c","","","0.7107","MoKα","","","0.0306","","","","0.0794","","","","","","0.904","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202480","5.92","0.01","7.46","0.01","39.81","0.07","90","","91.24","0.08","90","","1758","5","93.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H14 N2 S2 -","- C24 H14 N2 S2 -","- C96 H56 N8 S8 -","4","1","","Ando, Shinji; Kumaki, Daisuke; Nishida, Jun-ichi; Tada, Hirokazu; Inoue, Youji; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, physical properties and field-effect transistors of novel thiazolothiazole?phenylene co-oligomers","Journal of Materials Chemistry","2007","17","6","553","","10.1039/b611814c","","","0.7107","MoKα","","","0.1572","","","","0.4359","","","","","","1.58","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202481","38.84","0.03","7.001","0.005","13.023","0.009","90","","105.84","0.03","90","","3407","4","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H6 Cl2 Fe0.5 O S6 -","- C13 H6 Cl2 Fe0.5 O S6 -","- C104 H48 Cl16 Fe4 O8 S48 -","8","1","","Hiraoka, Takashi; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Kuribayashi, Akihiro; Ishida, Takekazu; Yokogawa, Keiichi; Murata, Keizo; Mori, Takehiko; Aruga-Katori, Hiroko; Kimura, Shojiro; Hagiwara, Masayuki","Metal?semiconductor structural phase transitions and antiferromagnetic orderings in (Benzo-TTFVO)2?MX4 (M = Fe, Ga; X = Cl, Br) salts","Journal of Materials Chemistry","2007","17","17","1664","","10.1039/b612053a","","","0.7107","MoKα","","","0.06","","","","0.064","","","","","","1.14","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202482","38.916","0.009","6.9981","0.0013","13.017","0.003","90","","105.893","0.002","90","","3409.5","1.3","293.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H6 Cl2 Ga0.5 O S6 -","- C13 H6 Cl2 Ga0.5 O S6 -","- C104 H48 Cl16 Ga4 O8 S48 -","8","1","","Hiraoka, Takashi; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Kuribayashi, Akihiro; Ishida, Takekazu; Yokogawa, Keiichi; Murata, Keizo; Mori, Takehiko; Aruga-Katori, Hiroko; Kimura, Shojiro; Hagiwara, Masayuki","Metal?semiconductor structural phase transitions and antiferromagnetic orderings in (Benzo-TTFVO)2?MX4 (M = Fe, Ga; X = Cl, Br) salts","Journal of Materials Chemistry","2007","17","17","1664","","10.1039/b612053a","","","0.7107","MoKα","","","0.056","","","","0.046","","","","","","1.156","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202483","39.69","0.04","7.01","0.01","13.14","0.02","90","","105.27","0.04","90","","3527","8","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H6 Br2 Fe0.5 O S6 -","- C13 H6 Br2 Fe0.5 O S6 -","- C104 H48 Br16 Fe4 O8 S48 -","8","1","","Hiraoka, Takashi; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Kuribayashi, Akihiro; Ishida, Takekazu; Yokogawa, Keiichi; Murata, Keizo; Mori, Takehiko; Aruga-Katori, Hiroko; Kimura, Shojiro; Hagiwara, Masayuki","Metal?semiconductor structural phase transitions and antiferromagnetic orderings in (Benzo-TTFVO)2?MX4 (M = Fe, Ga; X = Cl, Br) salts","Journal of Materials Chemistry","2007","17","17","1664","","10.1039/b612053a","","","0.7107","MoKα","","","0.045","","","","0.05","","","","","","0.804","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202484","39.48","0.002","6.9985","0.0003","13.1181","0.0008","90","","105.114","0.003","90","","3499.2","0.3","293.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H6 Br2 Ga0.5 O S6 -","- C13 H6 Br2 Ga0.5 O S6 -","- C104 H48 Br16 Ga4 O8 S48 -","8","1","","Hiraoka, Takashi; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Kuribayashi, Akihiro; Ishida, Takekazu; Yokogawa, Keiichi; Murata, Keizo; Mori, Takehiko; Aruga-Katori, Hiroko; Kimura, Shojiro; Hagiwara, Masayuki","Metal?semiconductor structural phase transitions and antiferromagnetic orderings in (Benzo-TTFVO)2?MX4 (M = Fe, Ga; X = Cl, Br) salts","Journal of Materials Chemistry","2007","17","17","1664","","10.1039/b612053a","","","0.7107","MoKα","","","0.076","","","","0.073","","","","","","1.079","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202485","13","0.02","6.908","0.008","20.11","0.03","99.86","0.05","105.13","0.03","89.97","0.06","1716","4","90","","","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H12 Br4 Fe O2 S12 -","- C26 H12 Br4 Fe O2 S12 -","- C52 H24 Br8 Fe2 O4 S24 -","2","1","","Hiraoka, Takashi; Fujiwara, Hideki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Kuribayashi, Akihiro; Ishida, Takekazu; Yokogawa, Keiichi; Murata, Keizo; Mori, Takehiko; Aruga-Katori, Hiroko; Kimura, Shojiro; Hagiwara, Masayuki","Metal?semiconductor structural phase transitions and antiferromagnetic orderings in (Benzo-TTFVO)2?MX4 (M = Fe, Ga; X = Cl, Br) salts","Journal of Materials Chemistry","2007","17","17","1664","","10.1039/b612053a","","","0.7107","MoKα","","","0.048","","","","0.061","","","","","","1.033","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202486","21.5093","0.0005","29.6734","0.0008","36.0736","0.0009","90","","90","","90","","23024.1","1","290","2","290","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0573","0.0363","","","0.0979","0.1181","","","","","","1.055","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202487","21.4775","0.0005","29.6112","0.0007","36.0527","0.0009","90","","90","","90","","22928.6","1","270","2","270","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0527","0.0344","","","0.0924","0.1104","","","","","","1.067","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202488","21.4468","0.0005","29.5529","0.0007","36.0359","0.0009","90","","90","","90","","22840.1","0.9","250","2","250","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0492","0.0327","","","0.0878","0.1045","","","","","","1.076","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202489","21.4191","0.0005","29.4937","0.0007","36.0191","0.0009","90","","90","","90","","22754.3","0.9","230","2","230","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0456","0.0318","","","0.0848","0.0996","","","","","","1.075","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202490","21.3887","0.0006","29.4302","0.0008","35.989","0.001","90","","90","","90","","22654.1","1.1","210","2","210","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0418","0.0302","","","0.0809","0.0938","","","","","","1.067","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202491","21.3664","0.0007","29.3735","0.0009","35.975","0.0012","90","","90","","90","","22578.1","1.3","190","2","190","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0396","0.0296","","","0.0787","0.0902","","","","","","1.077","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202492","21.3434","0.0006","29.3178","0.0009","35.9441","0.0011","90","","90","","90","","22491.7","1.2","170","2","170","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C640 H960 Cr64 F192 P160 Sb32 -","32","1","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0379","0.0292","","","0.073","0.0786","","","","","","1.074","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202493","23.1539","0.0007","21.3296","0.0007","23.1371","0.0008","90","","101.546","0.001","90","","11195.3","0.6","150","2","150","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0369","0.0309","","","0.0791","0.0879","","","","","","1.063","","","","has coordinates,has disorder","180355","2020-10-21","18:00:00",""
"7202494","23.0935","0.0008","21.3176","0.0007","23.0731","0.0008","90","","101.442","0.001","90","","11133.1","0.7","130","2","130","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0382","0.0335","","","0.0863","0.0925","","","","","","1.041","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202495","23.0402","0.0008","21.3055","0.0007","23.011","0.0008","90","","101.31","0.001","90","","11076.4","0.7","110","2","110","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0324","0.029","","","0.0751","0.081","","","","","","1.044","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202496","22.9943","0.001","21.2963","0.0009","22.9549","0.0011","90","","101.218","0.002","90","","11026.1","0.9","90","2","90","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0298","0.027","","","0.071","0.0772","","","","","","1.043","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202497","22.9383","0.0011","21.2836","0.001","22.9242","0.0012","90","","101.227","0.002","90","","10977.6","0.9","70","2","70","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0448","0.0406","","","0.1082","0.1132","","","","","","1.042","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202498","22.9096","0.0011","21.2711","0.001","22.8969","0.0012","90","","101.206","0.002","90","","10945.2","0.9","50","2","50","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0439","0.0403","","","0.1077","0.1122","","","","","","1.053","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202499","22.8945","0.0011","21.2571","0.001","22.8707","0.0012","90","","101.148","0.002","90","","10920.5","0.9","30","2","30","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0437","0.0408","","","0.1096","0.1122","","","","","","1.041","","","","has coordinates","180355","2020-10-21","18:00:00",""
"7202500","22.845","0.008","21.263","0.007","22.907","0.008","90","","101.04","0.02","90","","10921","7","25","1","25","1","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0431","0.0424","","","0.1124","0.1135","","","","","","1.035","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202501","22.797","0.014","21.216","0.012","22.754","0.013","90","","100.51","0.03","90","","10821","11","12","1","12","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","μ~2~-η^5^,η^5^-cyclopentaphosphole)-bis ((η^5^-pentamethyl-cyclopentadienyl)-chromium) hexafluoroantimonate","","- C20 H30 Cr2 F6 P5 Sb -","- C20 H30 Cr2 F6 P5 Sb -","- C320 H480 Cr32 F96 P80 Sb16 -","16","2","","Andrés E. Goeta; Judith A. K. Howard; Andrew K. Hughes; Dermot O'Hare; Royston C. B. Copley","Structural?magnetic correlations on the first dinuclear spin crossover d4 system","Journal of Materials Chemistry","2007","17","5","485","","10.1039/b612121g","","","0.71073","MoKα","","0.0384","0.0381","","","0.0988","0.0992","","","","","","1.131","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202502","11.91","0.02","13.05","0.02","18.42","0.04","94.85","0.06","97.12","0.06","94.57","0.06","2819","9","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C35 H31 Ir N2 O2 -","- C35 H31 Ir N2 O2 -","- C140 H124 Ir4 N8 O8 -","4","2","","Takizawa, Shin-ya; Sasaki, Yuka; Akhtaruzzaman, Md.; Echizen, Hidenori; Nishida, Jun-ichi; Iwata, Takeshi; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, characterization and electroluminescence properties of new iridium complexes based on cyclic phenylvinylpyridine derivatives: tuning of emission colour and efficiency by structural control","Journal of Materials Chemistry","2007","17","9","841","","10.1039/b612633b","","","0.7107","MoKα","","","0.0273","","","","0.0899","","","","","","0.893","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202503","13.73","0.02","14","0.02","16.84","0.03","101.66","0.06","101.76","0.06","103.76","0.06","2969","8","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C37 H35 Ir N2 O2 -","- C37 H35 Ir N2 O2 -","- C148 H140 Ir4 N8 O8 -","4","2","","Takizawa, Shin-ya; Sasaki, Yuka; Akhtaruzzaman, Md.; Echizen, Hidenori; Nishida, Jun-ichi; Iwata, Takeshi; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, characterization and electroluminescence properties of new iridium complexes based on cyclic phenylvinylpyridine derivatives: tuning of emission colour and efficiency by structural control","Journal of Materials Chemistry","2007","17","9","841","","10.1039/b612633b","","","0.7107","MoKα","","","0.0324","","","","0.1167","","","","","","1.107","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202504","14.04","0.02","14.11","0.02","17.34","0.02","101.53","0.06","103.15","0.06","102.54","0.05","3151","7","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C39 H39 Ir N2 O2 -","- C39 H39 Ir N2 O2 -","- C156 H156 Ir4 N8 O8 -","4","2","","Takizawa, Shin-ya; Sasaki, Yuka; Akhtaruzzaman, Md.; Echizen, Hidenori; Nishida, Jun-ichi; Iwata, Takeshi; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, characterization and electroluminescence properties of new iridium complexes based on cyclic phenylvinylpyridine derivatives: tuning of emission colour and efficiency by structural control","Journal of Materials Chemistry","2007","17","9","841","","10.1039/b612633b","","","0.7107","MoKα","","","0.0227","","","","0.0761","","","","","","0.914","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202505","9.89","0.01","11.24","0.01","11.79","0.01","68.15","0.03","87.5","0.04","70.81","0.03","1144.2","1.9","93.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H31 Ir N2 O2 -","- C27 H31 Ir N2 O2 -","- C54 H62 Ir2 N4 O4 -","2","1","","Takizawa, Shin-ya; Sasaki, Yuka; Akhtaruzzaman, Md.; Echizen, Hidenori; Nishida, Jun-ichi; Iwata, Takeshi; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, characterization and electroluminescence properties of new iridium complexes based on cyclic phenylvinylpyridine derivatives: tuning of emission colour and efficiency by structural control","Journal of Materials Chemistry","2007","17","9","841","","10.1039/b612633b","","","0.7107","MoKα","","","0.0205","","","","0.0513","","","","","","0.804","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202506","15.87","0.02","20.7","0.02","24.37","0.03","90","","90","","90","","8006","16","93.2","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C49 H43 Cl3 Ir N3 -","- C49 H43 Cl3 Ir N3 -","- C392 H344 Cl24 Ir8 N24 -","8","1","","Takizawa, Shin-ya; Sasaki, Yuka; Akhtaruzzaman, Md.; Echizen, Hidenori; Nishida, Jun-ichi; Iwata, Takeshi; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, characterization and electroluminescence properties of new iridium complexes based on cyclic phenylvinylpyridine derivatives: tuning of emission colour and efficiency by structural control","Journal of Materials Chemistry","2007","17","9","841","","10.1039/b612633b","","","0.7107","MoKα","","","0.0218","","","","0.0479","","","","","","0.8","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202507","11.09","0.01","12.19","0.02","13.86","0.02","82.93","0.05","78.73","0.04","88.53","0.05","1824","4","93.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C48 H42 Ir N3 -","- C48 H36 Ir N3 -","- C96 H72 Ir2 N6 -","2","1","","Takizawa, Shin-ya; Sasaki, Yuka; Akhtaruzzaman, Md.; Echizen, Hidenori; Nishida, Jun-ichi; Iwata, Takeshi; Tokito, Shizuo; Yamashita, Yoshiro","Synthesis, characterization and electroluminescence properties of new iridium complexes based on cyclic phenylvinylpyridine derivatives: tuning of emission colour and efficiency by structural control","Journal of Materials Chemistry","2007","17","9","841","","10.1039/b612633b","","","0.7107","MoKα","","","0.0255","","","","0.0747","","","","","","0.918","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202508","9.541","0.001","9.541","0.001","5.266","0.001","90","","90","","120","","415.14","0.1","293","2","293","2","","","","","","","synthesis as described","3","P 63","P 6c","173","alpha indium iodate","","","- I3 In O9 -","- I3 In O9 -","- I6 In2 O18 -","2","0.333333","","Phanon, Delphine; Mosset, Alain; Gautier-Luneau, Isabelle","New materials for infrared non-linear optics. Syntheses, structural characterisations, second harmonic generation and optical transparency of M(IO3)3 metallic iodates","Journal of Materials Chemistry","2007","17","11","1123","","10.1039/b612677d","","x-ray","0.56085","AgKa","","0.0275","0.0226","","","0.038","0.0391","","","","","","1.129","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202509","9.753","0.001","9.753","0.001","14.174","0.001","90","","90","","120","","1167.61","0.19","293","2","293","2","","","","","","","synthesis as described","3","R -3 :H","-R 3","148","beta indium iodate","","","- I3 In O9 -","- I3 In O9 -","- I18 In6 O54 -","6","0.333333","","Phanon, Delphine; Mosset, Alain; Gautier-Luneau, Isabelle","New materials for infrared non-linear optics. Syntheses, structural characterisations, second harmonic generation and optical transparency of M(IO3)3 metallic iodates","Journal of Materials Chemistry","2007","17","11","1123","","10.1039/b612677d","","x-ray","0.56085","AgKa","","0.0271","0.0229","","","0.0455","0.0468","","","","","","1.216","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202510","25.531","0.005","25.531","0.005","14.907","0.005","90","0.005","90","0.005","120","0.005","8415","4","193","2","193","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C100 H126 N4 Ni2 O9 -","- C100 H126 N4 Ni2 O9 -","- C300 H378 N12 Ni6 O27 -","3","0.5","","Chen, Zhen-Feng; Zhang, Shu-Feng; Luo, Hai-Sheng; Abrahams, Brendan F.; Liang, Hong","Ni2(R*COO)4(H2O)(4,4?-bipy)2?a robust homochiral quartz-like network with large chiral channels","CrystEngComm","2007","9","1","27","","10.1039/b613047j","","","0.71073","MoKα","","0.0912","0.0769","","","0.1818","0.1892","","","","","","1.165","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202511","3.8017","0.0015","6.6115","0.0032","14.485","0.006","100.68","0.08","94.4","0.06","102.11","0.05","347.3","0.3","","","","","","","","","","","Industrial, different phase than CCDC QNACRD03","4","P -1","-P 1","2","5,12-dihydro-quino(2,3-b)acridine-7,14-dione","5,12-dihydro-quino[2,3-b]acridine-7,14-dione","","- C20 H12 N2 O2 -","- C20 H12 N2 O2 -","- C20 H12 N2 O2 -","1","0.5","","Paulus, Erich F.; Leusen, Frank J. J.; Schmidt, Martin U.","Crystal structures of quinacridones","CrystEngComm","2007","9","2","131","","10.1039/b613059c","powder diffraction","","","","","","","","","","","","","4.18","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202512","5.692","0.001","3.975","0.001","30.02","0.04","90","","96.76","0.06","90","","674.5","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","beta-quinacridone (Pigment Violet 19, beta phase)","7,14-dioxo-5,7,12,14-tetrahydro-chinolino-[2,3-b]-acridin","","- C20 H12 N2 O2 -","- C20 H12 N2 O2 -","- C40 H24 N4 O4 -","2","0.5","","Paulus, Erich F.; Leusen, Frank J. J.; Schmidt, Martin U.","Crystal structures of quinacridones","CrystEngComm","2007","9","2","131","","10.1039/b613059c","","","0.7107","MoKα","","0.1997","0.0898","","","0.2057","0.2728","","","","","","0.908","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202513","13.697","0.009","3.881","0.003","13.402","0.001","90","","100.44","0.01","90","","700.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","gamma-quinacridone (Pigment Violet 19, gamma phase)","7,14-dioxo-5,7,12,14-tetrahydro-chinolino-[2,3-b]-acridin","","- C20 H12 N2 O2 -","- C20 H12 N2 O2 -","- C40 H24 N4 O4 -","2","0.5","","Paulus, Erich F.; Leusen, Frank J. J.; Schmidt, Martin U.","Crystal structures of quinacridones","CrystEngComm","2007","9","2","131","","10.1039/b613059c","","","0.7107","MoKα","","0.2742","0.209","","","0.425","0.4555","","","","","","1.289","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202514","10.10786","0.00005","10.10786","","10.10786","","90","","90","","90","","1032.71","0.005","2","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","from C:/Gsas/Bob/pyro/Osmates/D2B/2K/2K.EXP","","","- O6 Os2 Rb -","- O6 Os2 Rb -","- O48 Os16 Rb8 -","8","0.0416667","","Galati, Rosa; Hughes, Robert W.; Knee, Christopher S.; Henry, Paul F.; Weller, Mark T.","The structure of superconducting RbOs2O6 between 2 K and 300 K","Journal of Materials Chemistry","2007","17","2","160","","10.1039/b613083f","powder diffraction","","","","","","","","","","","","","1","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202515","10.11393","0.00005","10.11393","","10.11393","","90","","90","","90","","1034.57","0.005","300","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","300K Fd3M","","","- O6 Os2 Rb -","- O6 Os2 Rb -","- O48 Os16 Rb8 -","8","0.0416667","","Galati, Rosa; Hughes, Robert W.; Knee, Christopher S.; Henry, Paul F.; Weller, Mark T.","The structure of superconducting RbOs2O6 between 2 K and 300 K","Journal of Materials Chemistry","2007","17","2","160","","10.1039/b613083f","powder diffraction","","","","","","","","","","","","","1.09","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202516","9.4031","0.0005","9.3855","0.0005","11.006","0.0006","78.01","0.003","84.307","0.003","82.744","0.003","939.84","0.09","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H26 N2 O3 -","- C21 H26 N2 O3 -","- C42 H52 N4 O6 -","2","1","","Iván Kanizsai; Szilvia Gyónfalvi; Zsolt Szakonyi; Reijo Sillanpää; Ferenc Fülöp","Synthesis of bi- and tricyclic ?-lactam libraries in aqueous medium","Green Chemistry","2007","9","4","357","","10.1039/b613117d","","x-ray","0.71073","MoKα","","0.1134","0.0655","","","0.111","0.1304","","","","","","1.058","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202517","9.565","0.009","9.897","0.004","13.201","0.004","99.77","0.03","94.17","0.04","115.74","0.07","1094.2","1.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H23 Fe N3 O2 -","- C27 H23 Fe N3 O2 -","- C54 H46 Fe2 N6 O4 -","2","1","","Braga, Dario; Giaffreda, Stefano Luca; Rubini, Katia; Grepioni, Fabrizia; Chierotti, Michele R.; Gobetto, Roberto","Making crystals from crystals: three solvent-free routes to the hydrogen bonded co-crystal between 1,1?-di-pyridyl-ferrocene and anthranilic acid","CrystEngComm","2007","9","1","39","","10.1039/b613569b","","","0.71073","MoKα","","0.1127","0.0843","","","0.2221","0.2491","","","","","","1.027","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202518","10.902","0.002","20.356","0.005","17.467","0.004","90","","90.41","0.003","90","","3876.2","1.5","168","2","168","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Complex 5","","","- C41 H32 Ag2 N6 O11 -","- C41 H32 Ag2 N6 O11 -","- C164 H128 Ag8 N24 O44 -","4","1","","O'Keefe, Brendan J.; Steel, Peter J.","Rings, chains and helicates: dependence of metallosupramolecular topology on positional substitution within silver(i) complexes of six isomeric bis(2-pyridyloxy)naphthalenes","CrystEngComm","2007","9","3","222","","10.1039/b613689c","","","0.71073","MoKα","","0.0866","0.0627","","","0.1227","0.1347","","","","","","1.049","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202519","8.93","0.002","17.71","0.003","11.524","0.002","90","","97.52","0.02","90","","1806.8","0.6","163","2","163","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Complex 7","","","- C20 H14 Ag N3 O5 -","- C20 H14 Ag N3 O5 -","- C80 H56 Ag4 N12 O20 -","4","1","","O'Keefe, Brendan J.; Steel, Peter J.","Rings, chains and helicates: dependence of metallosupramolecular topology on positional substitution within silver(i) complexes of six isomeric bis(2-pyridyloxy)naphthalenes","CrystEngComm","2007","9","3","222","","10.1039/b613689c","","","0.71073","MoKα","","0.0827","0.0413","","","0.0804","0.0873","","","","","","0.828","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202520","7.9","0.003","14.352","0.005","19.379","0.007","73.447","0.005","84.509","0.004","78.025","0.004","2058.7","1.3","168","2","168","2","","","","","","","","5","P -1","-P 1","2","Complex 9","","","- C41.5 H36 Ag2 N6 O12.5 -","- C41.5 H36 Ag2 N6 O12.5 -","- C83 H72 Ag4 N12 O25 -","2","1","","O'Keefe, Brendan J.; Steel, Peter J.","Rings, chains and helicates: dependence of metallosupramolecular topology on positional substitution within silver(i) complexes of six isomeric bis(2-pyridyloxy)naphthalenes","CrystEngComm","2007","9","3","222","","10.1039/b613689c","","","0.71073","MoKα","","0.1273","0.0835","","","0.1867","0.2074","","","","","","1.095","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202521","17.6095","0.0004","18.6243","0.0004","5.4636","0.0001","90","","90","","90","","1791.87","0.06","148","2","148","2","","","","","","","","5","P n a 21","P 2c -2n","33","Complex 10","","","- C20 H14 Ag N3 O5 -","- C20 H14 Ag N3 O5 -","- C80 H56 Ag4 N12 O20 -","4","1","","O'Keefe, Brendan J.; Steel, Peter J.","Rings, chains and helicates: dependence of metallosupramolecular topology on positional substitution within silver(i) complexes of six isomeric bis(2-pyridyloxy)naphthalenes","CrystEngComm","2007","9","3","222","","10.1039/b613689c","","","0.71073","MoKα","","0.0338","0.0278","","","0.0673","0.0696","","","","","","1.072","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202522","10.239","0.003","12.349","0.003","13.888","0.003","96.859","0.004","93.214","0.004","99.553","0.004","1714.1","0.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H34 Cl3 N3 O4 -","- C37 H34 Cl3 N3 O4 -","- C74 H68 Cl6 N6 O8 -","2","1","","Chawla, Har Mohindra; Hundal, Geeta; Singh, Suneel Pratap; Upreti, Shailesh","Conformational morphosis in azocalix[4]arenes","CrystEngComm","2007","9","2","119","","10.1039/b613841a","","","0.71073","MoKα","","0.0807","0.0647","","","0.1737","0.1859","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202523","10.142","0.006","11.04","0.007","16.001","0.01","96.551","0.01","106.222","0.01","104.465","0.01","1632.8","1.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","5-(pyridylazo)-trimethoxycalix(4)arene","","","- C37 H34 Cl3 N3 O4 -","- C37 H34 Cl3 N3 O4 -","- C74 H68 Cl6 N6 O8 -","2","1","","Chawla, Har Mohindra; Hundal, Geeta; Singh, Suneel Pratap; Upreti, Shailesh","Conformational morphosis in azocalix[4]arenes","CrystEngComm","2007","9","2","119","","10.1039/b613841a","","","0.71073","MoKα","","0.1147","0.091","","","0.2331","0.2529","","","","","","1.07","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202524","3.8496","0.0011","41.04","0.011","11.262","0.003","90","","95.59","0.004","90","","1770.8","0.8","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H10 N2 S5 -","- C20 H10 N2 S5 -","- C80 H40 N8 S20 -","4","1","","Berridge, Rory; Wright, Shaun P.; Skabara, Peter J.; Dyer, Aubrey; Steckler, Tim; Argun, Avni A.; Reynolds, John R.; Harrington, Ross W.; Clegg, William","Electrochromic properties of a fast switching, dual colour polythiophene bearing non-planar dithiinoquinoxaline units","Journal of Materials Chemistry","2007","17","3","225","","10.1039/b613879a","","","0.6896","synchrotron","","0.1155","0.09","","","0.1606","0.1683","","","","","","1.261","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202525","6.663","0.002","9.045","0.003","10.707","0.003","72.385","0.005","81.655","0.005","69.238","0.005","574.6","0.3","296","2","296","2","","","","","","","see text","3","P -1","-P 1","2","all trans-perhydro-2,3,4a,6,7,8a-naphthalenehexaol monohydrate","all trans-perhydro-2,3,4a,6,7,8a-naphthalenehexaol monohydrate","","- C10 H20 O7 -","- C10 H20 O7 -","- C20 H40 O14 -","2","1","","Mehta, Goverdhan; Sen, Saikat; Venkatesan, Kailasam","Additive induced polymorphous behavior of a conformationally locked hexol","CrystEngComm","2007","9","2","144","","10.1039/b613949c","","","0.71073","MoKa","","0.0439","0.0389","","","0.1034","0.1066","","","","","","1.034","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202526","6.5273","0.0014","5.9589","0.0012","13.166","0.003","90","","90.163","0.003","90","","512.1","0.19","296","2","296","2","","","","","","","see text","3","P 1 21/n 1","-P 2yn","14","all trans-perhydro-2,3,4a,6,7,8a-naphthalenehexaol","all trans-perhydro-2,3,4a,6,7,8a-naphthalenehexaol","","- C10 H18 O6 -","- C10 H18 O6 -","- C20 H36 O12 -","2","0.5","","Mehta, Goverdhan; Sen, Saikat; Venkatesan, Kailasam","Additive induced polymorphous behavior of a conformationally locked hexol","CrystEngComm","2007","9","2","144","","10.1039/b613949c","","","0.71073","MoKa","","0.0443","0.0358","","","0.0759","0.0796","","","","","","1.089","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202527","5.428","0.0019","5.4261","0.0018","16.6564","0.0017","90","","90","","90","","490.6","0.2","295","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Bi2NbO5F","","- Bi2 Nb O6 -","- Bi2 Nb O6 -","- Bi8 Nb4 O24 -","4","0.5","","McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C.","Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride","Journal of Materials Chemistry","2007","17","12","1193","","10.1039/b613970a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202528","5.6059","0.0022","5.6059","","5.6059","","90","","90","","90","","176.17","0.07","295","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Bi2O3","","- Bi O1.5 -","- Bi O1.5 -","- Bi4 O6 -","4","0.0208333","","McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C.","Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride","Journal of Materials Chemistry","2007","17","12","1193","","10.1039/b613970a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202529","5.7853","0.0023","5.7853","","5.7853","","90","","90","","90","","193.63","0.08","295","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","BiF3","","- Bi F3 -","- Bi F3 -","- Bi4 F12 -","4","0.0208333","","McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C.","Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride","Journal of Materials Chemistry","2007","17","12","1193","","10.1039/b613970a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202530","5.427","0.0018","16.6584","0.0017","5.4282","0.0017","90","","90","","90","","490.7","0.2","295","","","","","","","","","","","3","P c a 21","P 2c -2ac","29","","Bi2NbO5F","","- Bi2 Nb O6 -","- Bi2 Nb O6 -","- Bi8 Nb4 O24 -","4","1","","McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C.","Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride","Journal of Materials Chemistry","2007","17","12","1193","","10.1039/b613970a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202531","5.604","0.0021","5.604","","5.604","","90","","90","","90","","175.99","0.07","295","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Bi2O3","","- Bi O1.5 -","- Bi O1.5 -","- Bi4 O6 -","4","0.0208333","","McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C.","Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride","Journal of Materials Chemistry","2007","17","12","1193","","10.1039/b613970a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202532","5.7832","0.0023","5.7832","","5.7832","","90","","90","","90","","193.42","0.08","295","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","BiF3","","- Bi F3 -","- Bi F3 -","- Bi4 F12 -","4","0.0208333","","McCabe, E. E.; Jones, I. P.; Zhang, D.; Hyatt, N. C.; Greaves, C.","Crystal structure and electrical characterisation of Bi2NbO5F: an Aurivillius oxide fluoride","Journal of Materials Chemistry","2007","17","12","1193","","10.1039/b613970a","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202533","5.4358","0.0001","15.623","0.0004","5.6075","0.0001","90","","90","","90","","476.209","0.017","","","293","","","","","","","","","4","I m m a","-I 2b 2","74","","","","- Al1.07 Mn0.93 O5 Sr2 -","- Al1.07 Mn0.93 O5 Sr2 -","- Al4.28 Mn3.72 O20 Sr8 -","4","0.25","","Joke Hadermann; Artem M. Abakumov; Hans D'Hondt; Anna S. Kalyuzhnaya; Marina G. Rozova; Maria M. Markina; Mikhail G. Mikheev; Natalia Tristan; Rüdiger Klingeler; Bernd Büchner; Evgeny V. Antipov","Synthesis and crystal structure of the Sr2Al1.07Mn0.93O5 brownmillerite","Journal of Materials Chemistry","2007","17","7","692","","10.1039/b614168d","powder diffraction","","1.5406","X-ray","","0.037","0.0356","","","0.0213","0.0213","","","","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202534","6.0627","0.0008","10.7122","0.0015","10.3872","0.0014","90","","97.956","0.002","90","","668.1","0.16","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Manganese oxalate-phosphite","","","- C3 H7 Mn N O5 P -","- C3 H7 Mn N O5 P -","- C12 H28 Mn4 N4 O20 P4 -","4","1","","Mandal, Sukhendu; Green, Mark A.; Pati, Swapan K.; Natarajan, Srinivasan","Synthesis, structure and magnetic properties of an inorganic?organic hybrid compound","Journal of Materials Chemistry","2007","17","10","980","","10.1039/b614186b","","","0.71073","MoKα","","0.0259","0.0247","","","0.0693","0.0699","","","","","","1.073","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202535","8.09","0.02","18.71","0.02","10.16","0.08","90","","90.091","0.019","90","","1538","13","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H17 N -","- C20 H17 N -","- C80 H68 N4 -","4","1","","McKeown, Neil B.; Badriya, Samer; Helliwell, Madeleine; Shkunov, Maxim","The synthesis of robust, polymeric hole-transport materials from oligoarylamine substituted styrenes","Journal of Materials Chemistry","2007","17","20","2088","","10.1039/b614235d","","","0.71069","MoKα","","0.0717","0.0469","","","0.1133","0.1256","","","","","","1.094","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202536","14.178","0.006","14.05","0.03","15.909","0.005","90","","93.62","0.03","90","","3163","7","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C20 H15 N S -","- C20 H15 N S -","- C160 H120 N8 S8 -","8","2","","McKeown, Neil B.; Badriya, Samer; Helliwell, Madeleine; Shkunov, Maxim","The synthesis of robust, polymeric hole-transport materials from oligoarylamine substituted styrenes","Journal of Materials Chemistry","2007","17","20","2088","","10.1039/b614235d","","","0.71069","MoKα","","0.0687","0.0568","","","0.1631","0.1734","","","","","","1.061","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202537","16.19","0.04","7.739","0.01","23.46","0.03","90","","90","","90","","2939","9","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C20 H15 N -","- C20 H15 N -","- C160 H120 N8 -","8","1","","McKeown, Neil B.; Badriya, Samer; Helliwell, Madeleine; Shkunov, Maxim","The synthesis of robust, polymeric hole-transport materials from oligoarylamine substituted styrenes","Journal of Materials Chemistry","2007","17","20","2088","","10.1039/b614235d","","","0.71069","MoKα","","0.0562","0.0372","","","0.0919","0.1001","","","","","","1.082","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202538","8.616","0.01","9.832","0.01","38.95","0.07","90","","90","","90","","3300","8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C44 H31 N3 -","- C44 H31 N3 -","- C176 H124 N12 -","4","1","","McKeown, Neil B.; Badriya, Samer; Helliwell, Madeleine; Shkunov, Maxim","The synthesis of robust, polymeric hole-transport materials from oligoarylamine substituted styrenes","Journal of Materials Chemistry","2007","17","20","2088","","10.1039/b614235d","","","0.71069","MoKα","","0.046","0.0378","","","0.0928","0.0989","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202539","10.985","0.004","24.813","0.008","13.194","0.004","90","","110.149","0.007","90","","3376.2","1.9","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H31 N3 S2 -","- C44 H31 N3 S2 -","- C176 H124 N12 S8 -","4","1","","McKeown, Neil B.; Badriya, Samer; Helliwell, Madeleine; Shkunov, Maxim","The synthesis of robust, polymeric hole-transport materials from oligoarylamine substituted styrenes","Journal of Materials Chemistry","2007","17","20","2088","","10.1039/b614235d","","","0.71073","MoKα","","0.3273","0.0609","","","0.111","0.1842","","","","","","0.611","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202540","3.89827","0.00002","3.89827","0.00002","7.8002","0.0001","90","","90","","90","","118.536","0.0017","973","","973","","","","","","","","","4","P 4/m m m","-P 4 2","123","LLTO","lithium lanthanum titanate","","- La0.567 Li0.3 O3 Ti -","- La0.5665 O3 Ti -","- La1.133 O6 Ti2 -","2","0.125","","Catti, Michele; Sommariva, Marco; Ibberson, Richard M.","Tetragonal superstructure and thermal history of Li0.3La0.567TiO3 (LLTO) solid electrolyte by neutron diffraction","Journal of Materials Chemistry","2007","17","13","1300","","10.1039/b614345h","powder diffraction","neutron","","Time-of-flightneutronbeam","","","","","","","","","8.8179","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202541","5.48162","0.00001","5.48162","0.00001","7.74646","0.00001","90","","90","","90","","232.767","0.0007","295","","295","","","","","","","","","4","P 4/n b m","-P 4a 2b","125","LLTO","lithium lanthanum titanate","","- La0.567 Li0.3 O3 Ti -","- La0.5675 Li0.3 O3 Ti -","- La2.27 Li1.2 O12 Ti4 -","4","","","Catti, Michele; Sommariva, Marco; Ibberson, Richard M.","Tetragonal superstructure and thermal history of Li0.3La0.567TiO3 (LLTO) solid electrolyte by neutron diffraction","Journal of Materials Chemistry","2007","17","13","1300","","10.1039/b614345h","powder diffraction","neutron","","Time-of-flight","","","","","","","","","2.6501","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202542","5.49921","0.00001","5.49921","0.00001","7.77237","0.00001","90","","90","","90","","235.047","0.0007","673","","673","","","","","","","","","4","P 4/n b m","-P 4a 2b","125","LLTO","lithium lanthanum titanate","","- La0.567 Li0.3 O3 Ti -","- La0.567 Li0.3 O3 Ti -","- La2.268 Li1.2 O12 Ti4 -","4","","","Catti, Michele; Sommariva, Marco; Ibberson, Richard M.","Tetragonal superstructure and thermal history of Li0.3La0.567TiO3 (LLTO) solid electrolyte by neutron diffraction","Journal of Materials Chemistry","2007","17","13","1300","","10.1039/b614345h","powder diffraction","neutron","","Time-of-flightneutronbeam","","","","","","","","","8.0825","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202543","5.50511","0.00001","5.50511","0.00001","7.78545","0.00001","90","","90","","90","","235.948","0.0007","823","","823","","","","","","","","","4","P 4/n b m","-P 4a 2b","125","LLTO","lithium lanthanum titanate","","- La0.567 Li0.3 O3 Ti -","- La0.567 Li0.3 O3 Ti -","- La2.268 Li1.2 O12 Ti4 -","4","","","Catti, Michele; Sommariva, Marco; Ibberson, Richard M.","Tetragonal superstructure and thermal history of Li0.3La0.567TiO3 (LLTO) solid electrolyte by neutron diffraction","Journal of Materials Chemistry","2007","17","13","1300","","10.1039/b614345h","powder diffraction","neutron","","Time-of-flightneutronbeam","","","","","","","","","3.8606","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202544","10.8325","0.0006","15.4222","0.0006","15.6315","0.0007","109.225","0.003","105.122","0.003","105.674","0.003","2191.3","0.2","150","1","150","1","","","","","","","","6","P -1","-P 1","2","((GD(iii)(btp)(NO3)2(H2O)3(MeOH))2btp MeOH NO3) (btp=2,6- bis(N1-1,2,4-triazolyl)pyridine)","","","- C29 H35 Cl Gd N23 O15 -","- C29 H35 Cl Gd N23 O15 -","- C58 H70 Cl2 Gd2 N46 O30 -","2","1","","Youm, Kyoung-Tae; Woo, Hyun Kyung; Ko, Jaejung; Jun, Moo-Jin","Multiple-decked Gd(iii) complexes induced by hydrogen bonds depending on anions","CrystEngComm","2007","9","1","30","","10.1039/b614511f","","","0.71073","MoKα","","0.1073","0.061","","","0.1323","0.156","","","","","","1.008","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202545","10.3789","0.0018","15.428","0.003","16.034","0.003","61.427","0.002","80.926","0.003","72.591","0.003","2151.2","0.7","233","2","233","2","","","","","","","","5","P -1","-P 1","2","((GD(iii)(btp)(NO3)2(H2O)4)2btp H2O MeOH NO3) (btp=2,6-bis(N1- 1,2,4-triazolyl)pyridine)","","","- C29 H33 Gd N24 O14 -","- C28 H33 Gd N24 O14.5 -","- C56 H66 Gd2 N48 O29 -","2","1","","Youm, Kyoung-Tae; Woo, Hyun Kyung; Ko, Jaejung; Jun, Moo-Jin","Multiple-decked Gd(iii) complexes induced by hydrogen bonds depending on anions","CrystEngComm","2007","9","1","30","","10.1039/b614511f","","","0.71073","MoKα","","0.0596","0.0461","","","0.0938","0.0993","","","","","","1.074","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202546","10.085","0.001","9.811","0.001","17.915","0.001","90","","101.639","0.001","90","","1736.1","0.3","103","2","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H24 Cl2 N2 O2 -","- C14 H24 Cl2 N2 O2 -","- C56 H96 Cl8 N8 O8 -","4","1","","Lukasz Dobrzycki; Maksymilian Chruszcz; Wladek Minor; Krzysztof Woźniak","Stacks of DMANH+? scaffolding for ribbon shaped Cl? bridged oxonium ions","CrystEngComm","2007","9","2","152","","10.1039/b614785b","","","0.71073","MoKα","","0.0362","0.03","","","0.0895","0.0936","","","","","","1.041","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202547","9.646","0.001","9.901","0.001","10.148","0.001","70.539","0.001","74.132","0.001","80.887","0.001","876.57","0.15","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H24 Cl2 N2 O2 -","- C14 H24 Cl2 N2 O2 -","- C28 H48 Cl4 N4 O4 -","2","1","","Lukasz Dobrzycki; Maksymilian Chruszcz; Wladek Minor; Krzysztof Woźniak","Stacks of DMANH+? scaffolding for ribbon shaped Cl? bridged oxonium ions","CrystEngComm","2007","9","2","152","","10.1039/b614785b","","","0.71073","MoKα","","0.0308","0.0279","","","0.086","0.0882","","","","","","1.036","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202548","23.2912","0.0009","11.9028","0.0004","13.1852","0.0005","90","","105.417","0.003","90","","3523.8","0.2","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H51 Cl3 N4 O6 -","- C28 H51 Cl3 N4 O6 -","- C112 H204 Cl12 N16 O24 -","4","1","","Lukasz Dobrzycki; Maksymilian Chruszcz; Wladek Minor; Krzysztof Woźniak","Stacks of DMANH+? scaffolding for ribbon shaped Cl? bridged oxonium ions","CrystEngComm","2007","9","2","152","","10.1039/b614785b","","","0.71073","MoKα","","0.1086","0.0381","","","0.0872","0.0936","","","","","","0.806","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202549","13.1816","0.0003","11.8826","0.0003","22.35","0.0005","90","","90","","90","","3500.72","0.14","103","2","103","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C28 H38 Cl3 N4 O6 -","- C28 H38 Cl3 N4 O6 -","- C112 H152 Cl12 N16 O24 -","4","1","","Lukasz Dobrzycki; Maksymilian Chruszcz; Wladek Minor; Krzysztof Woźniak","Stacks of DMANH+? scaffolding for ribbon shaped Cl? bridged oxonium ions","CrystEngComm","2007","9","2","152","","10.1039/b614785b","","","0.71073","MoKα","","0.0684","0.0615","","","0.1687","0.1746","","","","","","1.062","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202550","15.214","0.002","25.819","0.002","19.042","0.002","90","","95.003","0.002","90","","7451.4","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H12 Cd N10 S2 -","- C14 H12 Cd N10 S2 -","- C224 H192 Cd16 N160 S32 -","16","2","","Jana, Atish Dipankar; Ghosh, Ananta Kumar; Ghoshal, Debajyoti; Mostafa, Golam; Chaudhuri, Nirmalendu Ray","Towards rational design of supramolecular helices using linear pseudohalides in Cd(ii) - 2,2?-biimidazole system","CrystEngComm","2007","9","4","304","","10.1039/b614979k","","","0.7107","MoKα","","0.0944","0.0596","","","0.1002","0.1124","","","","","","1.215","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202551","7.6958","0.0002","7.6958","0.0002","28.592","0.002","90","","90","","120","","1466.5","0.12","293","2","293","2","","","","","","","","5","P 32 1 2","P 32 2 (0 0 2)","153","","","","- C14 H12 Cd N10 Se2 -","- C14 H12 Cd N10 Se2 -","- C42 H36 Cd3 N30 Se6 -","3","0.5","","Jana, Atish Dipankar; Ghosh, Ananta Kumar; Ghoshal, Debajyoti; Mostafa, Golam; Chaudhuri, Nirmalendu Ray","Towards rational design of supramolecular helices using linear pseudohalides in Cd(ii) - 2,2?-biimidazole system","CrystEngComm","2007","9","4","304","","10.1039/b614979k","","","0.7107","MoKα","","0.0657","0.0648","","","0.1719","0.1734","","","","","","1.105","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202552","13.3982","0.0004","7.7207","0.0002","19.1997","0.0005","90","","90","","90","","1986.08","0.09","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C16 H12 Cd N14 -","- C16 H12 Cd N14 -","- C64 H48 Cd4 N56 -","4","0.5","","Jana, Atish Dipankar; Ghosh, Ananta Kumar; Ghoshal, Debajyoti; Mostafa, Golam; Chaudhuri, Nirmalendu Ray","Towards rational design of supramolecular helices using linear pseudohalides in Cd(ii) - 2,2?-biimidazole system","CrystEngComm","2007","9","4","304","","10.1039/b614979k","","","0.71073","MoKα","","0.0555","0.0544","","","0.146","0.147","","","","","","1.142","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202553","17.93","0.004","3.938","0.001","25.723","0.006","90","","90","","90","","1816.3","0.7","100","2","100","2","","","","","","","","4","P c a 21","P 2c -2ac","29","bis(N-(3-pyridyl)acetamide) fumaric acid","bis[N-(3-pyridyl)acetamide] fumaric acid","","- C18 H20 N4 O6 -","- C18 H20 N4 O6 -","- C72 H80 N16 O24 -","4","1","","Christer B. Aakeröy; Izhar Hussain; Safiyyah Forbes; John Desper","Exploring the hydrogen-bond preference of N?H moieties in co-crystals assembled via O?H(acid)?N(py) intermolecular interactions","CrystEngComm","2007","9","1","46","","10.1039/b614984g","","","0.71073","MoKα","","0.114","0.0861","","","0.2101","0.2264","","","","","","1.11","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202554","4.9718","0.001","7.0047","0.0011","15.101","0.002","77.032","0.01","89.414","0.012","82.324","0.012","507.8","0.15","173","2","173","2","","","","","","","","4","P -1","-P 1","2","(N-((4-pyridyl)methyl)acetamide)2, fumaric acid","{N-[(4-pyridyl)methyl]acetamide}2, fumaric acid","","- C20 H24 N4 O6 -","- C20 H24 N4 O6 -","- C20 H24 N4 O6 -","1","0.5","","Christer B. Aakeröy; Izhar Hussain; Safiyyah Forbes; John Desper","Exploring the hydrogen-bond preference of N?H moieties in co-crystals assembled via O?H(acid)?N(py) intermolecular interactions","CrystEngComm","2007","9","1","46","","10.1039/b614984g","","","0.71073","MoKα","","0.1513","0.0883","","","0.2423","0.292","","","","","","0.941","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202555","28.532","0.003","8.2965","0.0008","10.612","0.001","90","","101.987","0.002","90","","2457.3","0.4","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","N-(4-pyridyl)acetamide, sebacic acid","N-(4-pyridyl)acetamide, sebacic acid","","- C24 H34 N4 O6 -","- C24 H34 N4 O6 -","- C96 H136 N16 O24 -","4","0.5","","Christer B. Aakeröy; Izhar Hussain; Safiyyah Forbes; John Desper","Exploring the hydrogen-bond preference of N?H moieties in co-crystals assembled via O?H(acid)?N(py) intermolecular interactions","CrystEngComm","2007","9","1","46","","10.1039/b614984g","","","0.71073","MoKα","","0.0661","0.0555","","","0.1544","0.16","","","","","","1.066","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202556","4.7523","0.0007","24.295","0.003","10.0355","0.0012","90","","97.944","0.01","90","","1147.6","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-(acetamidomethyl)pyridine, adipic acid","4-(acetamidomethyl)pyridine, adipic acid","","- C22 H30 N4 O6 -","- C22 H30 N4 O6 -","- C44 H60 N8 O12 -","2","0.5","","Christer B. Aakeröy; Izhar Hussain; Safiyyah Forbes; John Desper","Exploring the hydrogen-bond preference of N?H moieties in co-crystals assembled via O?H(acid)?N(py) intermolecular interactions","CrystEngComm","2007","9","1","46","","10.1039/b614984g","","","0.71073","MoKα","","0.099","0.062","","","0.1318","0.1486","","","","","","0.965","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202557","34.784","0.006","57.476","0.012","4.7674","0.0009","90","","90","","90","","9531","3","153","2","153","2","","","","","","","","4","F d d 2","F 2 -2d","43","(4-(aminomethyl)pyridine acetate)2, isophthalic acid","[4-(aminomethyl)pyridine acetate]2, isophthalic acid","","- C24 H26 N4 O6 -","- C24 H26 N4 O6 -","- C384 H416 N64 O96 -","16","1","","Christer B. Aakeröy; Izhar Hussain; Safiyyah Forbes; John Desper","Exploring the hydrogen-bond preference of N?H moieties in co-crystals assembled via O?H(acid)?N(py) intermolecular interactions","CrystEngComm","2007","9","1","46","","10.1039/b614984g","","","0.71073","MoKα","","0.1642","0.0699","","","0.1559","0.1904","","","","","","0.824","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202558","18.5868","0.0012","6.8213","0.0005","14.0335","0.001","90","","103.406","0.004","90","","1730.8","0.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(4-pyridylmethyl)acetamide, 5-nitroisophthalic acid hydrate","N-(4-pyridylmethyl)acetamide, 5-nitroisophthalic acid hydrate","","- C16 H17 N3 O8 -","- C16 H17 N3 O8 -","- C64 H68 N12 O32 -","4","1","","Christer B. Aakeröy; Izhar Hussain; Safiyyah Forbes; John Desper","Exploring the hydrogen-bond preference of N?H moieties in co-crystals assembled via O?H(acid)?N(py) intermolecular interactions","CrystEngComm","2007","9","1","46","","10.1039/b614984g","","","0.71073","MoKα","","0.1282","0.0683","","","0.1736","0.2112","","","","","","1.032","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202559","7.173","0.0008","7.6117","0.0008","11.9194","0.0013","80.462","0.007","75.807","0.007","87.896","0.007","622.19","0.12","173","2","173","2","","","","","","","","4","P -1","-P 1","2","N-(4-pyridyl)acetamide, glutaric acid","N-(4-pyridyl)acetamide, glutaric acid","","- C12 H16 N2 O5 -","- C12 H16 N2 O5 -","- C24 H32 N4 O10 -","2","1","","Christer B. Aakeröy; Izhar Hussain; Safiyyah Forbes; John Desper","Exploring the hydrogen-bond preference of N?H moieties in co-crystals assembled via O?H(acid)?N(py) intermolecular interactions","CrystEngComm","2007","9","1","46","","10.1039/b614984g","","","0.71073","MoKα","","0.0664","0.0542","","","0.1396","0.1483","","","","","","1","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202560","6.862","0.0003","10.228","0.0005","12.58","0.0006","97.06","0.003","92.723","0.0019","102.455","0.005","853.11","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","1,1,6,6-tetraphenyl-2,4-hexadiyne-1,6-diol 3,7- Diazatricyclo(4.2.2.22,5)dodeca-9,11-diene-4,8-dione,2,6-dimethyl clathrate","1,1,6,6-tetraphenyl-2,4-hexadiyne-1,6-diol 3,7-Diazatricyclo[4.2.2.22,5]dodeca-9,11-diene- 4,8-dione,2,6-dimethyl clathrate","","- C21 H18 N O2 -","- C21 H18 N O2 -","- C42 H36 N2 O4 -","2","1","","Lavy, Tali; Kaftory, Menahem","Channels formation through photodimerization of guest molecules within solid inclusion compounds","CrystEngComm","2007","9","2","123","","10.1039/b615032b","","","0.71073","MoKα","","0.2706","0.0763","","","0.1555","0.2193","","","","","","0.931","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202561","10.864","0.003","11.536","0.003","16.32","0.006","95.128","0.011","108.375","0.014","112.176","0.015","1746.2","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","1,1,6,6-tetraphenyl-2,4- hexadiyne-1,6-diol 3,7- Diazatricyclo(4.2.2.22,5)dodeca-9,11-diene-4,8-dione,2,6-dimethyl clathrate monohydrate","1,1,6,6-tetraphenyl-2,4- hexadiyne-1,6-diol 3,7-Diazatricyclo[4.2.2.22,5]dodeca-9,11-diene- 4,8-dione,2,6-dimethyl clathrate monohydrate","","- C42 H38 N2 O5 -","- C42 H38 N2 O5 -","- C84 H76 N4 O10 -","2","1","","Lavy, Tali; Kaftory, Menahem","Channels formation through photodimerization of guest molecules within solid inclusion compounds","CrystEngComm","2007","9","2","123","","10.1039/b615032b","","","0.71073","MoKα","","0.1765","0.0387","","","0.0814","0.1202","","","","","","0.608","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202562","8.4564","0.0004","10.8394","0.0004","11.3593","0.0006","64.012","0.003","79.957","0.002","68.499","0.002","870.69","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","1,1,6,6-tetraphenyl-2,4- hexadiyne-1,6-diol bis(6-methyl-2- (1H)-pyridone) clathrate","1,1,6,6-tetraphenyl-2,4- hexadiyne-1,6-diol bis(6-methyl-2-(1H)-pyridone) clathrate","","- C21 H18 N O2 -","- C21 H17.16 N O2 -","- C42 H34.32 N2 O4 -","2","1","","Lavy, Tali; Kaftory, Menahem","Channels formation through photodimerization of guest molecules within solid inclusion compounds","CrystEngComm","2007","9","2","123","","10.1039/b615032b","","","0.71073","MoKα","","0.0756","0.0516","","","0.1578","0.1663","","","","","","1.064","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202563","7.7433","0.0009","7.7868","0.0008","13.5188","0.0017","88.115","0.004","76.675","0.004","86.03","0.008","791.16","0.16","293","2","293","2","","","","","","","","4","P -1","-P 1","2","1,1,6,6-tetraphenyl-2,4- hexadiyne-1,6-diol (3,7- Diazatricyclo(4.2.2.22,5)dodeca-9,11-diene-4,8-dione) clathrate","1,1,6,6-tetraphenyl-2,4- hexadiyne-1,6-diol (3,7-Diazatricyclo[4.2.2.22,5]dodeca-9,11-diene-4,8-dione) clathrate","","- C20 H16 N O2 -","- C20 H16 N O2 -","- C40 H32 N2 O4 -","2","1","","Lavy, Tali; Kaftory, Menahem","Channels formation through photodimerization of guest molecules within solid inclusion compounds","CrystEngComm","2007","9","2","123","","10.1039/b615032b","","","0.71073","MoKα","","0.1293","0.1001","","","0.2983","0.3199","","","","","","1.093","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202564","6.151","0.006","9.114","0.011","13.112","0.002","95.93","0.05","93.28","0.05","100.18","0.06","717.5","1.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","1,1,6,6-tetraphenyl-2,4- hexadiyne-1,6-diol (3,7- Diazatricyclo(4.2.2.22,5)dodeca-9,11-diene-4,8-dione) clathrate","1,1,6,6-tetraphenyl-2,4- hexadiyne-1,6-diol (3,7-Diazatricyclo[4.2.2.22,5]dodeca-9,11-diene-4,8-dione) clathrate","","- C20 H16 N O2 -","- C20 H16 N O2 -","- C40 H32 N2 O4 -","2","1","","Lavy, Tali; Kaftory, Menahem","Channels formation through photodimerization of guest molecules within solid inclusion compounds","CrystEngComm","2007","9","2","123","","10.1039/b615032b","","","0.71073","MoKα","","0.2102","0.1324","","","0.3794","0.4203","","","","","","1.485","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202565","10.555","0.002","13.574","0.003","17.197","0.003","81.04","0.02","80.96","0.02","81.74","0.02","2385.6","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","1,1,6,6-tetraphenyl-2,4- hexadiyne-1,6-diol(3,7- Diazatricyclo(4.2.2.22,5) dodeca-9,11-diene-4,8-dione)water clathrate","","","- C60 H50 N3 O7 -","- C60 H48 N3 O6.394 -","- C120 H96 N6 O12.788 -","2","1","","Lavy, Tali; Kaftory, Menahem","Channels formation through photodimerization of guest molecules within solid inclusion compounds","CrystEngComm","2007","9","2","123","","10.1039/b615032b","","","0.71073","MoKα","","0.2164","0.1003","","","0.2628","0.2969","","","","","","0.87","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202566","7.7919","0.0002","8.0674","0.0003","13.4552","0.0006","85.0897","0.0014","75.6634","0.0013","81.16","0.002","808.73","0.05","293","2","293","2","","","","","","","","4","P -1","-P 1","2","1,1,6,6-tetraphenyl-2,4- hexadiyne-1,6-diol bis(2-(1H)- pyridone) clathrate","1,1,6,6-tetraphenyl-2,4- hexadiyne-1,6-diol bis(2-(1H)-pyridone) clathrate","","- C20 H16 N O2 -","- C20 H16 N O2 -","- C40 H32 N2 O4 -","2","1","","Lavy, Tali; Kaftory, Menahem","Channels formation through photodimerization of guest molecules within solid inclusion compounds","CrystEngComm","2007","9","2","123","","10.1039/b615032b","","","0.71073","MoKα","","0.0594","0.0369","","","0.0947","0.1002","","","","","","0.912","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202567","11.5","0.005","17.654","0.008","12.048","0.005","90","","95.909","0.01","90","","2433","1.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H48 N6 O20 Zn3 -","- C40 H46 N6 O20 Zn3 -","- C80 H92 N12 O40 Zn6 -","2","0.5","","Wang, Chuan-Feng; Zhu, Zhen-Yu; Zhang, Zheng-Xing; Chen, Zhen-Xia; Zhou, Xi-Geng","Crystal engineering of zinc(ii) and copper(ii) complexes containing 3,5-dimethylisoxazole-4-carboxylate ligand via O?H?N, C?H?A (A = N, O and ?) and bifurcated C?H?N/O interactions","CrystEngComm","2007","9","1","35","","10.1039/b615091h","","","0.71073","MoKα","","0.1273","0.0794","","","0.1876","0.2013","","","","","","0.842","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202568","10.122","0.007","10.124","0.007","11.446","0.008","88.961","0.009","69.655","0.009","89.692","0.009","1099.6","1.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H40 N6 O20 Zn3 -","- C36 H40 N6 O20 Zn3 -","- C36 H40 N6 O20 Zn3 -","1","0.5","","Wang, Chuan-Feng; Zhu, Zhen-Yu; Zhang, Zheng-Xing; Chen, Zhen-Xia; Zhou, Xi-Geng","Crystal engineering of zinc(ii) and copper(ii) complexes containing 3,5-dimethylisoxazole-4-carboxylate ligand via O?H?N, C?H?A (A = N, O and ?) and bifurcated C?H?N/O interactions","CrystEngComm","2007","9","1","35","","10.1039/b615091h","","","0.71073","MoKα","","0.0327","0.0297","","","0.0847","0.0864","","","","","","1.05","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202569","11.377","0.007","20.36","0.012","11.665","0.007","90","","103.981","0.008","90","","2622","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H44 N8 O18 Zn3 -","- C46 H44 N8 O18 Zn3 -","- C92 H88 N16 O36 Zn6 -","2","0.5","","Wang, Chuan-Feng; Zhu, Zhen-Yu; Zhang, Zheng-Xing; Chen, Zhen-Xia; Zhou, Xi-Geng","Crystal engineering of zinc(ii) and copper(ii) complexes containing 3,5-dimethylisoxazole-4-carboxylate ligand via O?H?N, C?H?A (A = N, O and ?) and bifurcated C?H?N/O interactions","CrystEngComm","2007","9","1","35","","10.1039/b615091h","","","0.71073","MoKα","","0.0951","0.0548","","","0.1317","0.1454","","","","","","0.904","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202570","5.738","0.003","9.471","0.005","10.852","0.007","64.246","0.007","80.464","0.012","89.857","0.009","522.2","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H10 Cu0.5 N2 O3 -","- C11 H10 Cu0.5 N2 O3 -","- C22 H20 Cu N4 O6 -","2","1","","Wang, Chuan-Feng; Zhu, Zhen-Yu; Zhang, Zheng-Xing; Chen, Zhen-Xia; Zhou, Xi-Geng","Crystal engineering of zinc(ii) and copper(ii) complexes containing 3,5-dimethylisoxazole-4-carboxylate ligand via O?H?N, C?H?A (A = N, O and ?) and bifurcated C?H?N/O interactions","CrystEngComm","2007","9","1","35","","10.1039/b615091h","","","0.71073","MoKα","","0.0958","0.0508","","","0.0854","0.0932","","","","","","0.777","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202571","10.028","0.004","12.693","0.005","11.881","0.005","90","","97.236","0.006","90","","1500.2","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 Cu N2 O6 -","- C12 H12 Cu N2 O6 -","- C48 H48 Cu4 N8 O24 -","4","1","","Wang, Chuan-Feng; Zhu, Zhen-Yu; Zhang, Zheng-Xing; Chen, Zhen-Xia; Zhou, Xi-Geng","Crystal engineering of zinc(ii) and copper(ii) complexes containing 3,5-dimethylisoxazole-4-carboxylate ligand via O?H?N, C?H?A (A = N, O and ?) and bifurcated C?H?N/O interactions","CrystEngComm","2007","9","1","35","","10.1039/b615091h","","","0.71073","MoKα","","0.1022","0.0405","","","0.0741","0.0853","","","","","","0.642","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202572","9.725","","9.725","","7.189","","90","","90","","120","","588.814","","","","300","","","","","","","","","3","P 63","P 6c","173","apatite","","","- La8.898 O25.96 Si6 -","- La8.898 O25.9602 Si6 -","- La8.898 O25.9602 Si6 -","1","0.166667","","Beaudet-Savignat, S.; Vincent, A.; Lambert, S.; Gervais, F.","Oxide ion conduction in Ba, Ca and Sr doped apatite-type lanthanum silicates","Journal of Materials Chemistry","2007","17","20","2078","","10.1039/b615104c","powder diffraction","neutron","1.2244","neutron","","0.0179","0.0281","","","0.0283","0.0228","","","","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202573","9.74","","9.74","","7.267","","90","","90","","120","","597.04","","","","","","","","","","","","","4","P 63","P 6c","173","Ba doped apatite","","","- Ba1.076 La8.924 O25.869 Si6 -","- La10 O25.87 Si6 -","- La10 O25.87 Si6 -","1","0.166667","","Beaudet-Savignat, S.; Vincent, A.; Lambert, S.; Gervais, F.","Oxide ion conduction in Ba, Ca and Sr doped apatite-type lanthanum silicates","Journal of Materials Chemistry","2007","17","20","2078","","10.1039/b615104c","powder diffraction","neutron","1.2244","neutron","","0.0173","0.0161","","","0.0138","0.0225","","","","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202574","9.705","","9.705","","7.215","","90","","90","","120","","588.516","","","","","","","","","","","","","4","P 63","P 6c","173","Sr doped apatite","","","- La8.898 O25.886 Si6 Sr -","- La9.9 O25.886 Si6 -","- La9.9 O25.886 Si6 -","1","0.166667","","Beaudet-Savignat, S.; Vincent, A.; Lambert, S.; Gervais, F.","Oxide ion conduction in Ba, Ca and Sr doped apatite-type lanthanum silicates","Journal of Materials Chemistry","2007","17","20","2078","","10.1039/b615104c","powder diffraction","neutron","1.2244","neutron","","0.0173","0.0182","","","0.017","0.0218","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202575","9.68","","9.68","","7.161","","90","","90","","120","","581.106","","","","","","","","","","","","","4","P 63","P 6c","173","Ca doped apatite","","","- Ca1.258 La8.742 O25.879 Si6 -","- La10 O25.878 Si6 -","- La10 O25.878 Si6 -","1","0.166667","","Beaudet-Savignat, S.; Vincent, A.; Lambert, S.; Gervais, F.","Oxide ion conduction in Ba, Ca and Sr doped apatite-type lanthanum silicates","Journal of Materials Chemistry","2007","17","20","2078","","10.1039/b615104c","powder diffraction","neutron","1.2244","neutron","","0.0175","0.0133","","","0.0141","0.0226","","","","","","","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202576","17.039","0.005","18.642","0.008","13.69","0.004","90","","90","","90","","4349","3","293","2","293","2","","","","","","","Synthesized by the authors. See text","5","P b c n","-P 2n 2ab","60","","","","- C20 H18 N2 O4 S3 -","- C20 H18 N2 O4 S3 -","- C160 H144 N16 O32 S24 -","8","1","","Marie Bourgeaux; Sergio Andrés Pérez Guarìn; W. G. Skene","Photophysical, crystallographic, and electrochemical characterization of novel conjugated thiopheno azomethines","Journal of Materials Chemistry","2007","17","10","972","","10.1039/b615325a","","","1.54178","CuKα","","0.1033","0.0397","","","0.0866","0.1019","","","","","","0.705","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202577","15.888","0.005","16.518","0.005","33.306","0.005","90","","90","","90","","8741","4","293","2","293","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","","","- C43 H49 O16 P2 -","- C43 H46 O16 P2 -","- C344 H368 O128 P16 -","8","1","","Daly, Susan M.; Grassi, Michele; Shenoy, Devanand K.; Ugozzoli, Franco; Dalcanale, Enrico","Supramolecular surface plasmon resonance (SPR) sensors for organophosphorus vapor detection","Journal of Materials Chemistry","2007","17","18","1809","","10.1039/b615516b","","","0.71069","MoKα","","0.1029","0.0971","","","0.3308","0.3328","","","","","","1.525","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202578","16.509","0.003","24.993","0.005","15.729","0.004","95.057","0.003","90.314","0.004","81.317","0.004","6390","2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C126 H182 O33 P4 -","- C126 H159 O33 P4 -","- C252 H318 O66 P8 -","2","1","","Daly, Susan M.; Grassi, Michele; Shenoy, Devanand K.; Ugozzoli, Franco; Dalcanale, Enrico","Supramolecular surface plasmon resonance (SPR) sensors for organophosphorus vapor detection","Journal of Materials Chemistry","2007","17","18","1809","","10.1039/b615516b","","","1.54184","CuKα","","0.1332","0.1066","","","0.3195","0.3598","","","","","","1.072","","","","has coordinates,has disorder","180356","2020-10-21","18:00:00",""
"7202579","10.20109","0.00009","10.20109","0.00009","10.20109","0.00009","90","","90","","90","","1061.55","0.016","293","2","293","2","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","Dimercury(ii) Heptaoxodiruthenate(V)","Dimercury(II) Heptaoxodiruthenate(V)","","- Hg2 O7 Ru2 -","- Hg2 O7 Ru2 -","- Hg16 O56 Ru16 -","8","0.0416667","","Klein, Wilhelm; Kremer, Reinhard K.; Jansen, Martin","Hg2Ru2O7, a new pyrochlore showing a metal?insulator transition","Journal of Materials Chemistry","2007","17","14","1356","","10.1039/b615653c","","","0.71073","MoKα","","0.0283","0.0213","","","0.0483","0.0506","","","","","","1.429","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202580","7.768","0.003","14.344","0.006","16.125","0.007","92.98","0.007","95.605","0.007","99.593","0.007","1758.8","1.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H38 N2 Nd2 O14 -","- C31 H38 N2 Nd2 O14 -","- C62 H76 N4 Nd4 O28 -","2","1","","Cahill, Christopher L.; de Lill, Daniel T.; Frisch, Mark","Homo- and heterometallic coordination polymers from the f elements","CrystEngComm","2007","9","1","15","","10.1039/b615696g","","","0.71073","MoKα","","0.0653","0.036","","","0.0651","0.0711","","","","","","0.858","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202581","7.7447","0.0012","10.1935","0.0016","12.1464","0.0019","80.751","0.003","80.287","0.003","82.818","0.003","928.1","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H24 N O7 Pr -","- C17 H24 N O7 Pr -","- C34 H48 N2 O14 Pr2 -","2","1","","Cahill, Christopher L.; de Lill, Daniel T.; Frisch, Mark","Homo- and heterometallic coordination polymers from the f elements","CrystEngComm","2007","9","1","15","","10.1039/b615696g","","","0.71073","MoKα","","0.0854","0.0498","","","0.0916","0.104","","","","","","0.937","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202582","20.433","0.015","6.762","0.005","13.529","0.012","90","","122.77","0.02","90","","1572","2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C5 H2 N2 O6 U -","- C5 H2 N2 O6 U -","- C40 H16 N16 O48 U8 -","8","1","","Cahill, Christopher L.; de Lill, Daniel T.; Frisch, Mark","Homo- and heterometallic coordination polymers from the f elements","CrystEngComm","2007","9","1","15","","10.1039/b615696g","","","0.71073","MoKα","","0.0333","0.0226","","","0.0397","0.0429","","","","","","1.032","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202583","5.3964","0.0003","13.7766","0.0007","20.9426","0.0011","90","","94.216","0.001","90","","1552.74","0.14","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H6 Cu3 N8 O24 U2 -","- C20 H6 Cu3 N8 O24 U2 -","- C40 H12 Cu6 N16 O48 U4 -","2","0.5","","Cahill, Christopher L.; de Lill, Daniel T.; Frisch, Mark","Homo- and heterometallic coordination polymers from the f elements","CrystEngComm","2007","9","1","15","","10.1039/b615696g","","","0.71073","MoKα","","0.0452","0.0288","","","0.0521","0.0563","","","","","","1.038","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202584","15.529","0.003","9.4144","0.0015","14.66","0.002","90","","116.848","0.003","90","","1912.2","0.5","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H4 Cu N4 O16 U2 -","- C10 H4 Cu N4 O16 U2 -","- C40 H16 Cu4 N16 O64 U8 -","4","0.5","","Cahill, Christopher L.; de Lill, Daniel T.; Frisch, Mark","Homo- and heterometallic coordination polymers from the f elements","CrystEngComm","2007","9","1","15","","10.1039/b615696g","","","0.71073","MoKα","","0.0498","0.038","","","0.0803","0.0846","","","","","","1.091","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202585","7.1563","0.001","13.1156","0.0015","27.469","0.003","90","","90","","90","","2578.2","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(1R,2R)-1,3-dihydroxy-N,N-dimethyl-1-(4- (methylthio)phenyl)propan-2-aminium (1R,3R)-2,2-dimethyl-3-(2- methylprop-1-enyl)-cyclopropanecarboxylate, methanol solvated","(1R,2R)-1,3-dihydroxy-N,N-dimethyl-1-[4-(methylthio)phenyl]propan- 2-aminium (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)- cyclopropanecarboxylate, methanol solvated","","- C23 H39 N O5 S -","- C23 H39 N O5 S -","- C92 H156 N4 O20 S4 -","4","1","","Rosini, Goffredo; Ayoub, Claudia; Borzatta, Valerio; Marotta, Emanuela; Mazzanti, Andrea; Righi, Paolo","The same and not the same. Similarities and differences in the resolution of trans-chrysanthemic acid of industrial origin by the enantiomers of some threo-1-aryl-2-dimethylamino-1,3-propanediols","Green Chemistry","2007","9","5","441","","10.1039/b615785h","","","0.71073","MoKα","","0.056","0.047","","","0.1345","0.1434","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202586","9.994","0.0005","7.8004","0.0004","15.8597","0.0008","90","","106.301","0.001","90","","1186.68","0.1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","(1R,2R)-1,3-dihydroxy-N,N-dimethyl-1-(4- (methylthio)phenyl)propan-2-aminium (1R,3R)-2,2-dimethyl-3-(2- methylprop-1-enyl)-cyclopropanecarboxylate","(1R,2R)-1,3-dihydroxy-N,N-dimethyl-1-[4-(methylthio)phenyl]propan- 2-aminium (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)- cyclopropanecarboxylate","","- C22 H35 N O4 S -","- C22 H35 N O4 S -","- C44 H70 N2 O8 S2 -","2","1","","Rosini, Goffredo; Ayoub, Claudia; Borzatta, Valerio; Marotta, Emanuela; Mazzanti, Andrea; Righi, Paolo","The same and not the same. Similarities and differences in the resolution of trans-chrysanthemic acid of industrial origin by the enantiomers of some threo-1-aryl-2-dimethylamino-1,3-propanediols","Green Chemistry","2007","9","5","441","","10.1039/b615785h","","","0.71073","MoKα","","0.0567","0.0528","","","0.1548","0.1599","","","","","","1.089","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202587","10.0361","0.0001","11.1106","0.0001","14.0054","0.0001","96.0383","0.0007","90.759","0.0006","107.019","0.0005","1483.43","0.02","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C33.5 H18 Cl F10 Ir N4 -","- C33.5 H18 Cl F10 Ir N4 -","- C67 H36 Cl2 F20 Ir2 N8 -","2","1","","Shih, Ping-I; Chien, Chen-Han; Chuang, Chu-Ying; Shu, Ching-Fong; Yang, Cheng-Han; Chen, Jian-Hong; Chi, Yun","Novel host material for highly efficient blue phosphorescent OLEDs","Journal of Materials Chemistry","2007","17","17","1692","","10.1039/b616043c","","","0.71073","MoKα","","0.0314","0.0275","","","0.0653","0.0696","","","","","","1.063","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202588","8.615","0.0001","16.1796","0.0002","18.0133","0.0002","66.868","0.001","82.44","0.001","81.925","0.001","2278.01","0.05","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H98 Cl12 Cu6 N6 O40 P12 -","- C42 H98 Cl12 Cu6 N6 O40 P12 -","- C42 H98 Cl12 Cu6 N6 O40 P12 -","1","0.5","","Jonna Jokiniemi; Eija Vuokila-Laine; Sirpa Peräniemi; Jouko J. Vepsäläinen; Markku Ahlgrén","Structural study of metal complexes of bisphosphonate amide ester: copper, magnesium, zinc and cadmium complexes of (dichloromethylene)bisphosphonic acid P-piperidinium-P?-methyl ester","CrystEngComm","2007","9","2","158","","10.1039/b616077h","","","0.71073","MoKα","","0.0521","0.041","","","0.0922","0.097","","","","","","1.06","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202589","28.3302","0.0003","7.5044","0.0001","17.4238","0.0003","90","","120.66","0.0005","90","","3186.48","0.08","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C7 H19 Cl2 Mg N O8 P2 -","- C7 H19 Cl2 Mg N O8 P2 -","- C56 H152 Cl16 Mg8 N8 O64 P16 -","8","1","","Jonna Jokiniemi; Eija Vuokila-Laine; Sirpa Peräniemi; Jouko J. Vepsäläinen; Markku Ahlgrén","Structural study of metal complexes of bisphosphonate amide ester: copper, magnesium, zinc and cadmium complexes of (dichloromethylene)bisphosphonic acid P-piperidinium-P?-methyl ester","CrystEngComm","2007","9","2","158","","10.1039/b616077h","","","0.71073","MoKα","","0.0346","0.0277","","","0.0667","0.0702","","","","","","1.043","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202590","9.8138","0.0001","11.2658","0.0001","15.1752","0.0002","100.624","0.001","105.179","0.001","105.465","0.001","1501.22","0.03","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C28 H64 Cl8 N4 Na2 O26 P8 Zn3 -","- C28 H64 Cl8 N4 Na2 O26 P8 Zn3 -","- C28 H64 Cl8 N4 Na2 O26 P8 Zn3 -","1","0.5","","Jonna Jokiniemi; Eija Vuokila-Laine; Sirpa Peräniemi; Jouko J. Vepsäläinen; Markku Ahlgrén","Structural study of metal complexes of bisphosphonate amide ester: copper, magnesium, zinc and cadmium complexes of (dichloromethylene)bisphosphonic acid P-piperidinium-P?-methyl ester","CrystEngComm","2007","9","2","158","","10.1039/b616077h","","","0.71073","MoKα","","0.0387","0.0279","","","0.0671","0.071","","","","","","1.033","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202591","9.1901","0.0002","5.9097","0.0001","16.013","0.0003","90","","103.107","0.001","90","","847.02","0.03","150","2","150","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C7 H21 Cd Cl2 N O9 P2 -","- C7 H21 Cd Cl2 N O9 P2 -","- C14 H42 Cd2 Cl4 N2 O18 P4 -","2","1","","Jonna Jokiniemi; Eija Vuokila-Laine; Sirpa Peräniemi; Jouko J. Vepsäläinen; Markku Ahlgrén","Structural study of metal complexes of bisphosphonate amide ester: copper, magnesium, zinc and cadmium complexes of (dichloromethylene)bisphosphonic acid P-piperidinium-P?-methyl ester","CrystEngComm","2007","9","2","158","","10.1039/b616077h","","","0.71073","MoKα","","0.0247","0.0224","","","0.0479","0.0487","","","","","","1.055","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202592","7.622","0.004","10.286","0.005","24.546","0.013","95.575","0.009","91.129","0.01","95.722","0.01","1904.9","1.7","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H34 Ag2 N8 O12 S2 -","- C34 H30 Ag2 N8 O12 S2 -","- C68 H60 Ag4 N16 O24 S4 -","2","1","","Lian, Zhao-Xun; Cai, Jiwen; Chen, Cai-Hong; Luo, Hai-Bin","Linear silver isonicotinamide complex extended by arenedisulfonate via hydrogen bonds and weak Ag?O interactions","CrystEngComm","2007","9","4","319","","10.1039/b616289d","","","0.71073","MoKα","","0.06","0.0463","","","0.1267","0.1388","","","","","","1.037","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202593","8.281","0.004","10.145","0.005","12.334","0.007","78.948","0.009","80.966","0.01","82.189","0.009","998.4","0.9","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H19 Ag N4 O7 S -","- C17 H19 Ag N4 O7 S -","- C34 H38 Ag2 N8 O14 S2 -","2","1","","Lian, Zhao-Xun; Cai, Jiwen; Chen, Cai-Hong; Luo, Hai-Bin","Linear silver isonicotinamide complex extended by arenedisulfonate via hydrogen bonds and weak Ag?O interactions","CrystEngComm","2007","9","4","319","","10.1039/b616289d","","","0.71073","MoKα","","0.0356","0.0289","","","0.0733","0.0771","","","","","","1.087","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202594","9.601","0.005","10.292","0.006","11.721","0.007","78.733","0.01","87.057","0.01","65.7","0.009","1034.7","1","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H20 Ag N4 O7 S -","- C18 H20 Ag N4 O7 S -","- C36 H40 Ag2 N8 O14 S2 -","2","1","","Lian, Zhao-Xun; Cai, Jiwen; Chen, Cai-Hong; Luo, Hai-Bin","Linear silver isonicotinamide complex extended by arenedisulfonate via hydrogen bonds and weak Ag?O interactions","CrystEngComm","2007","9","4","319","","10.1039/b616289d","","","0.71073","MoKα","","0.0368","0.029","","","0.0745","0.0805","","","","","","1.029","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202595","9.464","0.0019","12.346","0.003","18.082","0.004","100.51","0.03","103.36","0.03","102.01","0.03","1950.7","0.9","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H64 Ag4 N16 O22 S4 -","- C72 H64 Ag4 N16 O22 S4 -","- C72 H64 Ag4 N16 O22 S4 -","1","0.5","","Lian, Zhao-Xun; Cai, Jiwen; Chen, Cai-Hong; Luo, Hai-Bin","Linear silver isonicotinamide complex extended by arenedisulfonate via hydrogen bonds and weak Ag?O interactions","CrystEngComm","2007","9","4","319","","10.1039/b616289d","","","0.71073","MoKα","","0.0836","0.0512","","","0.1326","0.1495","","","","","","1.056","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202596","16.7531","0.0013","16.7531","0.0013","10.8111","0.0012","90","","90","","120","","2627.8","0.4","298","2","298","2","","","","","","","","5","P 6/m","-P 6","175","","","","- C26 H39.33 Cu2 N2 O20.66 -","- C26 H39.3208 Cu2 N2 O20.66 -","- C78 H117.962 Cu6 N6 O61.98 -","3","0.25","","Wang, Su-Na; Bai, Junfeng; Li, Yi-Zhi; Scheer, Manfred; You, Xiao-Zeng","Metal disordering Cu(ii) supramolecular polymers constructed from a tripodal ligand possessing two different functional groups","CrystEngComm","2007","9","3","228","","10.1039/b616315g","","","0.71073","MoKα","","0.0925","0.0599","","","0.1223","0.1322","","","","","","1.163","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202597","28.937","0.003","28.937","0.003","10.6939","0.0014","90","","90","","120","","7754.9","1.5","153","2","153","2","","","","","","","","5","P -3","-P 3","147","","","","- C252 H368 Cu18 N24 O178 -","- C252 H368.018 Cu18 N24 O178 -","- C252 H368.018 Cu18 N24 O178 -","1","0.166667","","Wang, Su-Na; Bai, Junfeng; Li, Yi-Zhi; Scheer, Manfred; You, Xiao-Zeng","Metal disordering Cu(ii) supramolecular polymers constructed from a tripodal ligand possessing two different functional groups","CrystEngComm","2007","9","3","228","","10.1039/b616315g","","","0.71073","MoKα","","0.0925","0.0619","","","0.1439","0.1525","","","","","","1.022","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202598","10.875","0.0001","11.4418","0.0001","14.8044","0.0002","107.154","0.001","98.373","0.001","108.36","0.001","1611.74","0.04","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H33 Cl2 N O4 P2 Pd -","- C34 H33 Cl2 N O4 P2 Pd -","- C68 H66 Cl4 N2 O8 P4 Pd2 -","2","1","","Smith, Martin B.; Dale, Sophie H.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Horton, Peter N.","Hydrogen bonded supramolecular assemblies based on neutral square-planar palladium(ii) complexes","CrystEngComm","2007","9","2","165","","10.1039/b616337h","","","0.71073","MoKα","","0.0349","0.0288","","","0.0671","0.0705","","","","","","1.022","","","","has coordinates","180356","2020-10-21","18:00:00",""
"7202599","28.5307","0.0004","31.9677","0.0006","12.612","0.0002","90","","90","","90","","11502.9","0.3","120","2","120","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C35.66667 H35.66667 Cl2 N O3.66667 P2 Pd -","- C35.6667 H35.6667 Cl2 N O3.66667 P2 Pd -","- C428 H428 Cl24 N12 O44 P24 Pd12 -","12","1.5","","Smith, Martin B.; Dale, Sophie H.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Horton, Peter N.","Hydrogen bonded supramolecular assemblies based on neutral square-planar palladium(ii) complexes","CrystEngComm","2007","9","2","165","","10.1039/b616337h","","","0.71073","MoKα","","0.0805","0.0455","","","0.1022","0.1114","","","","","","0.98","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7202600","12.4716","0.0003","16.8605","0.0004","16.8411","0.0004","90","","108.148","0.001","90","","3365.14","0.14","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H33 Cl2 N O4 P2 Pd -","- C34 H33 Cl2 N O4 P2 Pd -","- C136 H132 Cl8 N4 O16 P8 Pd4 -","4","1","","Smith, Martin B.; Dale, Sophie H.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Horton, Peter N.","Hydrogen bonded supramolecular assemblies based on neutral square-planar palladium(ii) complexes","CrystEngComm","2007","9","2","165","","10.1039/b616337h","","","0.71073","MoKα","","0.055","0.0408","","","0.1067","0.1139","","","","","","1.013","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202601","9.064","0.0005","24.7367","0.0017","15.9091","0.001","90","","97.144","0.002","90","","3539.3","0.4","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C34 H30 Cl5 N O3 P2 Pd -","- C34 H30 Cl5 N O3 P2 Pd -","- C136 H120 Cl20 N4 O12 P8 Pd4 -","4","1","","Smith, Martin B.; Dale, Sophie H.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Horton, Peter N.","Hydrogen bonded supramolecular assemblies based on neutral square-planar palladium(ii) complexes","CrystEngComm","2007","9","2","165","","10.1039/b616337h","","","0.71073","MoKα","","0.1674","0.0665","","","0.1227","0.1531","","","","","","0.993","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202602","9.657","0.005","9.83","0.005","21.63","0.005","86.346","0.005","82.333","0.005","69.59","0.005","1906.9","1.5","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H30 Cl5 N O3 P2 Pd -","- C34 H30 Cl5 N O3 P2 Pd -","- C68 H60 Cl10 N2 O6 P4 Pd2 -","2","1","","Smith, Martin B.; Dale, Sophie H.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Horton, Peter N.","Hydrogen bonded supramolecular assemblies based on neutral square-planar palladium(ii) complexes","CrystEngComm","2007","9","2","165","","10.1039/b616337h","","","0.71073","MoKα","","0.0777","0.0456","","","0.1025","0.1106","","","","","","0.991","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202603","10.4008","0.0002","10.906","0.0002","17.6929","0.0005","91.922","0.001","102.16","0.001","117.036","0.001","1728.13","0.07","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H30 Cl5 N O3 P2 Pd -","- C34 H30 Cl5 N O3 P2 Pd -","- C68 H60 Cl10 N2 O6 P4 Pd2 -","2","1","","Smith, Martin B.; Dale, Sophie H.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Horton, Peter N.","Hydrogen bonded supramolecular assemblies based on neutral square-planar palladium(ii) complexes","CrystEngComm","2007","9","2","165","","10.1039/b616337h","","","0.71073","MoKα","","0.0359","0.0301","","","0.0687","0.0714","","","","","","1.038","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202604","25.1097","0.001","8.0163","0.0002","19.7326","0.0006","90","","99.948","0.001","90","","3912.2","0.2","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36.5 H39 Cl2 N O6.5 P2 Pd -","- C36.5 H37 Cl2 N O6.5 P2 Pd -","- C146 H148 Cl8 N4 O26 P8 Pd4 -","4","1","","Smith, Martin B.; Dale, Sophie H.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Horton, Peter N.","Hydrogen bonded supramolecular assemblies based on neutral square-planar palladium(ii) complexes","CrystEngComm","2007","9","2","165","","10.1039/b616337h","","","0.71073","MoKα","","0.0774","0.0478","","","0.11","0.121","","","","","","1.031","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202605","12.3355","0.0002","13.5157","0.0003","14.6704","0.0002","67.561","0.001","86.733","0.001","80.258","0.001","2228.03","0.07","120","2","120","2","","","","","","","","8","P -1","-P 1","2","","","","- C40 H47 Cl2 N O7 P2 Pd S3 -","- C40 H47 Cl2 N O7 P2 Pd S3 -","- C80 H94 Cl4 N2 O14 P4 Pd2 S6 -","2","1","","Smith, Martin B.; Dale, Sophie H.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Horton, Peter N.","Hydrogen bonded supramolecular assemblies based on neutral square-planar palladium(ii) complexes","CrystEngComm","2007","9","2","165","","10.1039/b616337h","","","0.71073","MoKα","","0.0568","0.0428","","","0.1064","0.1137","","","","","","1.035","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202606","12.6157","0.0004","31.5085","0.0008","9.9021","0.0002","90","","93.629","0.001","90","","3928.21","0.18","120","2","120","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C37 H41 Cl2 N O5 P2 Pd S2 -","- C37 H41 Cl2 N O5 P2 Pd S2 -","- C148 H164 Cl8 N4 O20 P8 Pd4 S8 -","4","1","","Smith, Martin B.; Dale, Sophie H.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Horton, Peter N.","Hydrogen bonded supramolecular assemblies based on neutral square-planar palladium(ii) complexes","CrystEngComm","2007","9","2","165","","10.1039/b616337h","","","0.71073","MoKα","","0.0894","0.0437","","","0.076","0.0877","","","","","","0.954","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202607","19.631","0.004","17.047","0.003","10.506","0.002","90","","90","","90","","3515.8","1.2","150","2","150","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C35 H35 Cl2 N O4 P2 Pd S -","- C35 H35 Cl2 N O4 P2 Pd S -","- C140 H140 Cl8 N4 O16 P8 Pd4 S4 -","4","0.5","","Smith, Martin B.; Dale, Sophie H.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Horton, Peter N.","Hydrogen bonded supramolecular assemblies based on neutral square-planar palladium(ii) complexes","CrystEngComm","2007","9","2","165","","10.1039/b616337h","","","0.71073","MoKα","","0.1096","0.0784","","","0.2041","0.2292","","","","","","1.028","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202608","10.5863","0.0004","10.9741","0.0004","14.5969","0.0005","96.217","0.002","97.195","0.002","111.441","0.002","1544.06","0.1","100","2","100","2","","","","","","","Synthesized by the authors. See text","5","P -1","-P 1","2","","","","- C28 H36 N4 O4 S3 -","- C28 H36 N4 O4 S3 -","- C56 H72 N8 O8 S6 -","2","1","","Stéphane Dufresne; Marie Bourgeaux; W. G. Skene","Tunable spectroscopic and electrochemical properties of conjugated push?push, push?pull and pull?pull thiopheno azomethines","Journal of Materials Chemistry","2007","17","12","1166","","10.1039/b616379c","","","1.54178","CuKα","","0.1354","0.1054","","","0.2912","0.3097","","","","","","1.192","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202609","32.6557","0.0009","5.4751","0.001","14.9264","0.0005","90","","99.4","0.001","90","","2632.9","0.5","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","1a","nicotinamide-D-mandelic acid (1/1)","","- C14 H14 N2 O4 -","- C14 H14 N2 O4 -","- C112 H112 N16 O32 -","8","2","","Friščić, Tomislav; Jones, William","Cocrystal architecture and properties: design and building of chiral and racemic structures by solid‒solid reactions","Faraday Discussions","2007","136","","167","","10.1039/b616399h","","","0.71073","MoKα","","0.0703","0.055","","","0.1278","0.1374","","","","","","1.122","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202610","12.6899","0.0013","18.2468","0.0018","18.7138","0.0018","68.885","0.001","88.916","0.002","71.552","0.001","3812.3","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","(MeB(3-(Mes)Pz)3)CuCl.CH2Cl2","","","- C38 H44 B Cl3 Cu N6 -","- C38 H44 B Cl3 Cu N6 -","- C152 H176 B4 Cl12 Cu4 N24 -","4","2","","Rasika Dias, H. V.; Gamini Rajapakse, R. M.; Milan Krishantha, D. M.; Fianchini, Mauro; Wang, Xiaoyu; Elsenbaumer, Ronald L.","Eco-friendly synthesis of high-quality polyaniline using a copper(ii) scorpionate catalyst","Journal of Materials Chemistry","2007","17","18","1762","","10.1039/b616816g","","","0.71073","MoKα","","0.1098","0.061","","","0.1289","0.1529","","","","","","0.993","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202611","31.232","0.002","35.725","0.002","20.2073","0.001","90","","121.196","0.002","90","","19286.3","1.9","93.1","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C192 H288 Ce N16 S16 -","- C192 H288 Ce N16 S16 -","- C768 H1152 Ce4 N64 S64 -","4","1","","Nekelson, Fabien; Monobe, Hirosato; Shiro, Motoo; Shimizu, Yo","Liquid crystalline and charge transport properties of double-decker cerium phthalocyanine complexes","Journal of Materials Chemistry","2007","17","25","2607","","10.1039/b616848p","","","0.71075","MoKα","","","0.0731","","","","0.2033","","","","","","1.057","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202612","7.7901","0.0003","10.8098","0.0004","23.0523","0.0009","90","","90","","90","","1941.22","0.13","123","2","123","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(R)-4-(2,3-dihydroxypropoxy) benzoic acid","","- C10 H12 O5 -","- C10 H12 O5 -","- C80 H96 O40 -","8","2","","Andrews, Philip C.; Forsyth, Craig M.; Fraser, Benjamin H.; Junk, Peter C.; Massi, Massimiliano; Silberstein, Morry","Diol-functionalised benzoates as novel linkers for the formation of coordination polymers","CrystEngComm","2007","9","4","282","","10.1039/b616939b","","","0.71073","MoKα","","0.0422","0.0409","","","0.113","0.1151","","","","","","1.11","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202613","11.2283","0.0003","12.835","0.0003","13.7238","0.0004","66.37","0.001","88.669","0.001","65.326","0.001","1621.68","0.08","123","2","123","2","","","","","","","","4","P 1","P 1","1","","Lanthanum (R)-4-(2,3-dihydroxypropoxy) benzoate","","- C60 H80 La2 O37 -","- C60 H80 La2 O37 -","- C60 H80 La2 O37 -","1","1","","Andrews, Philip C.; Forsyth, Craig M.; Fraser, Benjamin H.; Junk, Peter C.; Massi, Massimiliano; Silberstein, Morry","Diol-functionalised benzoates as novel linkers for the formation of coordination polymers","CrystEngComm","2007","9","4","282","","10.1039/b616939b","","","0.71073","MoKα","","0.0167","0.0163","","","0.0401","0.0403","","","","","","1.048","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202614","15.748","0.003","15.748","0.003","12.706","0.003","90","","90","","90","","3151.1","1.1","293","2","293","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C36 H30 Cl2 N2 O2 Zn -","- C36 H30 Cl2 N2 O2 Zn -","- C144 H120 Cl8 N8 O8 Zn4 -","4","0.5","","Bacchi, Alessia; Bosetti, Elsa; Carcelli, Mauro","Unusual hydrogen bonded (OH)4 tetrahedral nests organize zinc(ii) coordination complexes in a non covalent diamondoid network","CrystEngComm","2007","9","4","313","","10.1039/b616955d","","","0.71073","MoKα","","0.1184","0.0518","","","0.1017","0.1235","","","","","","0.862","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202615","15.94","0.001","15.94","0.001","12.604","0.008","90","","90","","90","","3202","2","293","2","293","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C36 H30 Br2 N2 O2 Zn -","- C36 H30 Br2 N2 O2 Zn -","- C144 H120 Br8 N8 O8 Zn4 -","4","0.5","","Bacchi, Alessia; Bosetti, Elsa; Carcelli, Mauro","Unusual hydrogen bonded (OH)4 tetrahedral nests organize zinc(ii) coordination complexes in a non covalent diamondoid network","CrystEngComm","2007","9","4","313","","10.1039/b616955d","","","0.71073","MoKα","","0.0237","0.0194","","","0.0404","0.0415","","","","","","0.924","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202616","21.923","0.001","21.923","0.001","14.7289","0.0008","90","","90","","90","","7079","0.6","293","2","293","2","","","","","","","","6","I -4 2 d","I -4 2bw","122","","","","- C36 H30 I2 N2 O2 Zn -","- C36 H30 I2 N2 O2 Zn -","- C288 H240 I16 N16 O16 Zn8 -","8","0.5","","Bacchi, Alessia; Bosetti, Elsa; Carcelli, Mauro","Unusual hydrogen bonded (OH)4 tetrahedral nests organize zinc(ii) coordination complexes in a non covalent diamondoid network","CrystEngComm","2007","9","4","313","","10.1039/b616955d","","","0.71073","MoKα","","0.1051","0.0989","","","0.2787","0.2922","","","","","","1.403","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202617","10.3597","0.0004","15.645","0.0005","16.562","0.0007","99.984","0.002","103.52","0.0019","101.54","0.002","2487.96","0.17","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C53 H85 N O6 -","- C53 H85 N O6 -","- C106 H170 N2 O12 -","2","1","","Edwin C. Constable; Marc Häusler; B. A. Hermann; Catherine E. Housecroft; Markus Neuburger; Silvia Schaffner; Lukas J. Scherer","Self-assembled monolayers as two-dimensional crystals: relationship to three-dimensional crystals","CrystEngComm","2007","9","2","176","","10.1039/b616968f","","","0.71073","MoKα","","0.1549","0.0766","","0.1172","0.0761","0.0761","","","","","","1.122","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202618","10.4631","0.0002","15.6769","0.0004","16.462","0.0005","100.759","0.0014","104.014","0.0014","101.721","0.0016","2484.93","0.11","173","","173","","","","","","","","","3","P -1","-P 1","2","","","","- C53 H82 O7 -","- C53 H82 O7 -","- C106 H164 O14 -","2","1","","Edwin C. Constable; Marc Häusler; B. A. Hermann; Catherine E. Housecroft; Markus Neuburger; Silvia Schaffner; Lukas J. Scherer","Self-assembled monolayers as two-dimensional crystals: relationship to three-dimensional crystals","CrystEngComm","2007","9","2","176","","10.1039/b616968f","","","0.71073","MoKα","","0.0729","0.0687","","0.0795","0.0763","0.0763","","","","","","1.0842","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202619","3.6579","0.0001","11.0577","0.0004","21.5478","0.001","90","","93.02","0.001","90","","870.35","0.06","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H9 N O6 -","- C7 H9 N O6 -","- C28 H36 N4 O24 -","4","1","","Grossel, Martin C.; Dwyer, Andrew N.; Hursthouse, Michael B.; Orton, James B.","Solid-state assemblies from pyridine-2,6-dicarboxylates: ?changing the instruction set through hydration?","CrystEngComm","2007","9","3","207","","10.1039/b617051j","","","0.71073","MoKα","","0.0929","0.0466","","","0.0927","0.1119","","","","","","1.013","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202620","5.1793","0.0002","9.476","0.0003","8.5004","0.0003","90","","94.289","0.002","90","","416.02","0.03","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C7 H6 Cl N O5 -","- C7 H6 Cl N O5 -","- C14 H12 Cl2 N2 O10 -","2","1","","Grossel, Martin C.; Dwyer, Andrew N.; Hursthouse, Michael B.; Orton, James B.","Solid-state assemblies from pyridine-2,6-dicarboxylates: ?changing the instruction set through hydration?","CrystEngComm","2007","9","3","207","","10.1039/b617051j","","","0.71073","MoKα","","0.0316","0.0294","","","0.0717","0.0735","","","","","","1.063","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202621","11.954","0.002","12.521","0.002","11.888","0.002","90","","95.68","0.01","90","","1770.6","0.5","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C8 H28 Bi I9 N4 S4 -","- C8 H28 Bi I9 N4 S4 -","- C16 H56 Bi2 I18 N8 S8 -","2","0.25","","Wenhua Bi; Nicolas Louvain; Nicolas Mercier; Jerôme Luc; Bouchta Sahraoui","Type structure, which is composed of organic diammonium, triiodide and hexaiodobismuthate, varies according to different structures of incorporated cations","CrystEngComm","2007","9","4","298","","10.1039/b617178h","","x-ray","0.71073","MoKα","","","0.0409","","","","0.1085","","","","","","1.125","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202622","23.45","0.005","12.724","0.003","12.401","0.003","90","","108.45","0.03","90","","3510","1.5","293","2","293","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C8 H29 Bi I9 N4 O0.5 S4 -","- C8 H28 Bi I9 N4 O0.5 S4 -","- C32 H112 Bi4 I36 N16 O2 S16 -","4","1","","Wenhua Bi; Nicolas Louvain; Nicolas Mercier; Jerôme Luc; Bouchta Sahraoui","Type structure, which is composed of organic diammonium, triiodide and hexaiodobismuthate, varies according to different structures of incorporated cations","CrystEngComm","2007","9","4","298","","10.1039/b617178h","","x-ray","0.71073","MoKα","","","0.0485","","","","0.1198","","","","","","1.073","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7202623","8.5276","0.0017","10.405","0.002","17.504","0.004","77.92","0.03","87.39","0.03","85.29","0.03","1513","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H30 Bi I8 N4 O -","- C8 H27.97 Bi I8 N4 O -","- C16 H55.94 Bi2 I16 N8 O2 -","2","1","","Wenhua Bi; Nicolas Louvain; Nicolas Mercier; Jerôme Luc; Bouchta Sahraoui","Type structure, which is composed of organic diammonium, triiodide and hexaiodobismuthate, varies according to different structures of incorporated cations","CrystEngComm","2007","9","4","298","","10.1039/b617178h","","x-ray","0.71073","MoKα","","","0.0434","","","","0.0943","","","","","","1.026","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202624","11.792","0.002","12.737","0.002","21.908","0.003","90","","94.29","0.01","90","","3281.2","0.9","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C32 H67 Bi I12 N4 O9 -","- C32 H60 Bi I12 N4 O9 -","- C64 H120 Bi2 I24 N8 O18 -","2","0.25","","Wenhua Bi; Nicolas Louvain; Nicolas Mercier; Jerôme Luc; Bouchta Sahraoui","Type structure, which is composed of organic diammonium, triiodide and hexaiodobismuthate, varies according to different structures of incorporated cations","CrystEngComm","2007","9","4","298","","10.1039/b617178h","","x-ray","0.71073","MoKα","","0.0593","0.0385","","","0.0833","0.0892","","","","","","1.095","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202625","18.459","0.013","10.458","0.007","13.063","0.01","90","","102.552","0.011","90","","2461","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","terephthalato-bisaquo-1,2-bis(4-pirydyl)ethane-cobalt(ii) hydrated","terephthalato-bisaquo-1,2-bis(4-pirydyl)ethane-cobalt(II) hydrated","","- C20 H25 Co N2 O8.5 -","- C20 H20 Co N2 O8.5 -","- C80 H80 Co4 N8 O34 -","4","1","","Manna, Subal Chandra; Okamoto, Ken-ichi; Zangrando, Ennio; Chaudhuri, Nirmalendu Ray","Stabilization of the 2D inclined interpenetrated net of {[Co(bpe)(tp)(H2O)2]n by replacement of lattice water molecules with appropriate solvent","CrystEngComm","2007","9","3","199","","10.1039/b617277f","","","0.71073","MoKα","","0.0558","0.0468","","","0.1414","0.1632","","","","","","1.016","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202626","19.887","0.004","10.574","0.004","11.876","0.003","90","","110.79","0.02","90","","2334.7","1.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","terephthalato-bisaquo-1,2-bis(4-pyridyl)ethane-cobalt(ii) glycolethylene solvated","terephthalato-bisaquo-1,2-bis(4-pyridyl)ethane-cobalt(II) glycolethylene solvated","","- C22 H26 Co N2 O8 -","- C22 H26 Co N2 O8 -","- C88 H104 Co4 N8 O32 -","4","0.5","","Manna, Subal Chandra; Okamoto, Ken-ichi; Zangrando, Ennio; Chaudhuri, Nirmalendu Ray","Stabilization of the 2D inclined interpenetrated net of {[Co(bpe)(tp)(H2O)2]n by replacement of lattice water molecules with appropriate solvent","CrystEngComm","2007","9","3","199","","10.1039/b617277f","","","0.71073","Mokα","","0.0659","0.0417","","","0.1133","0.1228","","","","","","0.983","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202627","18.337","0.008","37.6","0.02","14.259","0.008","90","","91.11","0.02","90","","9829","9","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C103.75 H105.25 N3 O14 -","- C94.704 H80.408 N3 O12.852 -","- C378.816 H321.632 N12 O51.408 -","4","0.5","","Lim, Young-Kwan; Jiang, Xuan; Bollinger, John C.; Lee, Dongwhan","Molecular engineering of two-dimensional ?-conjugation: expected and unexpected photophysical consequences of a simple particle-in-a-box approach","Journal of Materials Chemistry","2007","17","19","1969","","10.1039/b617353e","","","0.71073","MoKα","","0.1678","0.0968","","","0.2174","0.2539","","","","","","0.971","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202628","10.785","0.004","18.741","0.007","19.655","0.007","79.619","0.008","89.361","0.008","76.27","0.008","3794","2","129","2","129","2","","","","","","","","5","P -1","-P 1","2","","","","- C88.5 H80.25 Cl2.25 N3 O9 -","- C88.458 H80.215 Cl2.243 N3 O9 -","- C176.916 H160.43 Cl4.486 N6 O18 -","2","1","","Lim, Young-Kwan; Jiang, Xuan; Bollinger, John C.; Lee, Dongwhan","Molecular engineering of two-dimensional ?-conjugation: expected and unexpected photophysical consequences of a simple particle-in-a-box approach","Journal of Materials Chemistry","2007","17","19","1969","","10.1039/b617353e","","","0.71073","MoKα","","0.1586","0.0776","","","0.1701","0.2099","","","","","","1.081","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202629","21.019","0.006","11.483","0.003","19.949","0.006","90","","119.92","0.003","90","","4173","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H42 N4 O11 Zn2 -","- C42 H42 N4 O11 Zn2 -","- C168 H168 N16 O44 Zn8 -","4","0.5","","Chen, Shu-Mei; Zhang, Jian; Lu, Can-Zhong","One-pot synthesis of two isomeric zinc complexes with unusual polycatenation motifs","CrystEngComm","2007","9","5","390","","10.1039/b617362d","","","0.71073","MoKα","","","0.0448","","","0.1208","0.1254","","","","","","1.015","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202630","10.497","0.003","14.594","0.004","19.106","0.005","89.927","0.008","83.212","0.007","73.564","0.004","2786","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H44 N4 O16 Zn4 -","- C58 H44 N4 O16 Zn4 -","- C116 H88 N8 O32 Zn8 -","2","1","","Chen, Shu-Mei; Zhang, Jian; Lu, Can-Zhong","One-pot synthesis of two isomeric zinc complexes with unusual polycatenation motifs","CrystEngComm","2007","9","5","390","","10.1039/b617362d","","","0.71073","MoKα","","0.1112","0.0575","","","0.1326","0.1627","","","","","","0.993","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202631","21.761","0.01","15.819","0.007","17.876","0.008","90","","97.911","0.005","90","","6095","5","93.1","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C60 H66 Cl2 Mn2 N12 Ni O14 -","- C60 H66 Cl2 Mn2 N12 Ni O14 -","- C240 H264 Cl8 Mn8 N48 Ni4 O56 -","4","0.5","","Ayumi Saitoh; Hitoshi Miyasaka; Masahiro Yamashita; Rodolphe Clérac","Direct evidence of exchange interaction dependence of magnetization relaxation in a family of ferromagnetic-type single-chain magnets","Journal of Materials Chemistry","2007","17","19","2002","","10.1039/b617493k","","","0.7107","MoKα","","","0.0709","","","","0.1725","","","","","","1.1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202632","21.848","0.006","16.041","0.004","18.444","0.005","90","","98.856","0.005","90","","6387","3","93.1","","","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C60 H66 F12 Mn2 N12 Ni O6 P2 -","- C60 H66 F12 Mn2 N12 Ni O6 P2 -","- C240 H264 F48 Mn8 N48 Ni4 O24 P8 -","4","0.5","","Ayumi Saitoh; Hitoshi Miyasaka; Masahiro Yamashita; Rodolphe Clérac","Direct evidence of exchange interaction dependence of magnetization relaxation in a family of ferromagnetic-type single-chain magnets","Journal of Materials Chemistry","2007","17","19","2002","","10.1039/b617493k","","","0.7107","MoKα","","","0.0507","","","","0.1066","","","","","","1.007","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202633","21.992","0.01","16.141","0.007","17.831","0.008","90","","98.103","0.005","90","","6266","5","93.1","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C62 H70 Cl2 Mn2 N12 Ni O14 -","- C62 H70 Cl2 Mn2 N12 Ni O14 -","- C248 H280 Cl8 Mn8 N48 Ni4 O56 -","4","0.5","","Ayumi Saitoh; Hitoshi Miyasaka; Masahiro Yamashita; Rodolphe Clérac","Direct evidence of exchange interaction dependence of magnetization relaxation in a family of ferromagnetic-type single-chain magnets","Journal of Materials Chemistry","2007","17","19","2002","","10.1039/b617493k","","","0.7107","MoKα","","","0.0601","","","","0.1296","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202634","16.96","0.017","10.715","0.011","16.298","0.017","90","","107.737","0.013","90","","2821","5","93.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24.64 H28.64 Cl1.92 N8 Ni O4 -","- C25.22 H22 Cl1.94 N8 Ni O4 -","- C100.88 H88 Cl7.76 N32 Ni4 O16 -","4","0.5","","Ayumi Saitoh; Hitoshi Miyasaka; Masahiro Yamashita; Rodolphe Clérac","Direct evidence of exchange interaction dependence of magnetization relaxation in a family of ferromagnetic-type single-chain magnets","Journal of Materials Chemistry","2007","17","19","2002","","10.1039/b617493k","","","0.7107","MoKα","","","0.0625","","","","0.121","","","","","","1.018","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202635","14.0604","0.0005","10.7206","0.0019","27.612","0.003","90","","90","","90","","4162.1","0.9","193","2","193","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C46 H42 N4 O12 -","- C46 H42 N4 O12 -","- C184 H168 N16 O48 -","4","1","","Seyler, Helga; Berger-Nicoletti, Elena; Kilbinger, Andreas F. M.","Rod?coil copolymers from oligo(p-benzamide) foldamers","Journal of Materials Chemistry","2007","17","19","1954","","10.1039/b617598h","","","1.54178","CuKα","","0.2332","0.0878","","","0.193","0.2513","","","","","","0.983","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202636","10.0092","0.0006","11.2895","0.0007","15.5109","0.0008","98.9","0.04","102.04","0.05","104","0.05","1623.9","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H52 N2 O4 -","- C34 H52 N2 O4 -","- C68 H104 N4 O8 -","2","1","","Jiménez, Claudio A.; Belmar, Julio B.; Delgado, Fernando S.; Julve, Miguel; Ruiz-Pérez, Catalina","Structural changes in the crystal packing of highly hindered symmetrical vicinal bis-amides","CrystEngComm","2007","9","9","746","","10.1039/b617605d","","","0.71073","MoKα","","0.132","0.0645","","","0.147","0.1752","","","","","","1.033","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202637","23.029","0.004","25.201","0.005","12.087","0.003","90","","90","","90","","7015","3","293","2","293","2","","","","","","","","4","I b a 2","I 2 -2c","45","","","","- C35 H54 N2 O4 -","- C35 H54 N2 O4 -","- C280 H432 N16 O32 -","8","1","","Jiménez, Claudio A.; Belmar, Julio B.; Delgado, Fernando S.; Julve, Miguel; Ruiz-Pérez, Catalina","Structural changes in the crystal packing of highly hindered symmetrical vicinal bis-amides","CrystEngComm","2007","9","9","746","","10.1039/b617605d","","","0.71073","MoKα","","0.087","0.0463","","","0.0854","0.0979","","","","","","1.04","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202638","16.31134","0.00085","16.31134","0.00085","16.31134","0.00085","90","","90","","90","","4339.8","0.4","298","","298","","","","","","","","","6","P n -3 m :2","-P 4bc 2bc 3","224","catena-bis(5-fluoro-pyrimidin-2-olate)-pd(ii) bisaquo","catena-bis(5-fluoro-pyrimidin-2-olate)-pd(ii) bisaquo","","- C8 H8 F2 N4 O4 Pd -","- C12 H8 F2 N8 O6 Pd -","- C144 H96 F24 N96 O72 Pd12 -","12","0.25","","Jorge A. R. Navarro; Elisa Barea; Juan M. Salas; Norberto Masciocchi; Simona Galli; Angelo Sironi; Conchi O. Ania; José B. Parra","Borderline microporous?ultramicroporous palladium(ii) coordination polymer networks. Effect of pore functionalisation on gas adsorption properties","Journal of Materials Chemistry","2007","17","19","1939","","10.1039/b617698d","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","","1.712","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202639","16.29569","0.00084","16.29569","0.00084","16.29569","0.00084","90","","90","","90","","4327.3","0.4","400","","400","","","","","","","","","6","P n -3 m :2","-P 4bc 2bc 3","224","catena-bis(5-fluoro-pyrimidin-2-olate)-pd(ii)","catena-bis(5-fluoro-pyrimidin-2-olate)-pd(ii)","","- C8 H4 F2 N4 O2 Pd -","- C12 H8 F2 N8 O2 Pd -","- C144 H96 F24 N96 O24 Pd12 -","12","0.25","","Jorge A. R. Navarro; Elisa Barea; Juan M. Salas; Norberto Masciocchi; Simona Galli; Angelo Sironi; Conchi O. Ania; José B. Parra","Borderline microporous?ultramicroporous palladium(ii) coordination polymer networks. Effect of pore functionalisation on gas adsorption properties","Journal of Materials Chemistry","2007","17","19","1939","","10.1039/b617698d","powder diffraction","","1.54056","CuKα~1~","","","","","","","","","","5.025","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202640","27.098","0.004","47.336","0.008","6.933","0.007","90","","90","","90","","8893","9","296","2","296","2","","","","","","","","5","F d d 2","F 2 -2d","43","Bis(bis(pentafluorobenzoyl)methane)copper(ii)","Bis[bis(pentafluorobenzoyl)methane]copper(II)","","- C48 H20 Cu F20 O4 -","- C48 H20 Cu F20 O4 -","- C384 H160 Cu8 F160 O32 -","8","0.5","","Hori, Akiko; Arii, Tadashi","Cation?? and arene?perfluoroarene interactions between Cu(ii) fluorine-substituted ?-diketonate complex and benzenes","CrystEngComm","2007","9","3","215","","10.1039/b617808a","","","0.71069","MoKα","","0.0472","0.0318","","","0.0865","0.0945","","","","","","1.017","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202641","32.777","0.002","24.737","0.002","23.235","0.002","90","","111.181","0.003","90","","17566","2","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C48 H147 Ag3 N12 O110 P2 W24 -","- C48 H101.4 Ag3 N12 O108.2 P2 W23.4 -","- C192 H405.6 Ag12 N48 O432.8 P8 W93.6 -","4","0.5","","Song, Yu-Fei; Abbas, Hamera; Ritchie, Chris; McMillian, Nicola; Long, De-Liang; Gadegaard, Nikolaj; Cronin, Leroy","From polyoxometalate building blocks to polymers and materials: the silver connection","Journal of Materials Chemistry","2007","17","19","1903","","10.1039/b617830h","","","0.71073","MoKα","","0.1121","0.058","","","0.1402","0.1787","","","","","","1.014","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202642","10.8053","0.0003","11.1381","0.0003","13.3396","0.0003","97.2","0.002","113.487","0.001","108.774","0.001","1333.3","0.06","150","2","150","2","","","","","","","","6","P -1","-P 1","2","Compound ha003","","","- C16 H48 Ag4 Mo8 O34 S8 -","- C16 H48 Ag4 Mo8 O34 S8 -","- C16 H48 Ag4 Mo8 O34 S8 -","1","0.5","","Song, Yu-Fei; Abbas, Hamera; Ritchie, Chris; McMillian, Nicola; Long, De-Liang; Gadegaard, Nikolaj; Cronin, Leroy","From polyoxometalate building blocks to polymers and materials: the silver connection","Journal of Materials Chemistry","2007","17","19","1903","","10.1039/b617830h","","","0.71073","MoKα","","0.0307","0.0249","","","0.0575","0.06","","","","","","1.068","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202643","11.9401","0.0003","38.3746","0.001","12.8124","0.0003","90","","94.095","0.002","90","","5855.6","0.3","120","2","120","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","Compound ys16401d","","","- C24 H64 Ag3 Mn Mo6 N2 O32 S8 -","- C24 H64 Ag3 Mn Mo6 N2 O32 S8 -","- C96 H256 Ag12 Mn4 Mo24 N8 O128 S32 -","4","1","","Song, Yu-Fei; Abbas, Hamera; Ritchie, Chris; McMillian, Nicola; Long, De-Liang; Gadegaard, Nikolaj; Cronin, Leroy","From polyoxometalate building blocks to polymers and materials: the silver connection","Journal of Materials Chemistry","2007","17","19","1903","","10.1039/b617830h","","","0.71073","MoKα","","0.0759","0.0444","","","0.0843","0.0948","","","","","","1.029","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202644","11.984","0.004","37.696","0.01","13.122","0.004","90","","97.158","0.015","90","","5882","3","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C26 H64 Ag3 Mn Mo6 N4 O31 S7 -","- C25.5 H46 Ag3 Mn Mo6 N4 O31 S6.65 -","- C102 H184 Ag12 Mn4 Mo24 N16 O124 S26.6 -","4","1","","Song, Yu-Fei; Abbas, Hamera; Ritchie, Chris; McMillian, Nicola; Long, De-Liang; Gadegaard, Nikolaj; Cronin, Leroy","From polyoxometalate building blocks to polymers and materials: the silver connection","Journal of Materials Chemistry","2007","17","19","1903","","10.1039/b617830h","","","0.71073","MoKα","","0.1297","0.0664","","","0.127","0.1531","","","","","","1.042","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202645","12.4391","0.0006","12.72","0.0005","13.2986","0.0006","90","","114.955","0.001","90","","1907.73","0.15","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Trans dihydroxy (5,10,15,20-tetrakis(4-pyridyl)porphrynato) tin(IV) tetra hydrate","Trans dihydroxy (5,10,15,20-tetrakis(4-pyridyl)porphrynato) tin(IV) tetra hydrate","","- C40 H42 N8 O10 Sn -","- C40 H42 N8 O10 Sn -","- C80 H84 N16 O20 Sn2 -","2","0.5","","Langford, Steven J.; Woodward, Clint P.","Supramolecular self-assembly of dihydroxy tin(iv) porphyrin stabilized helical water chains","CrystEngComm","2007","9","3","218","","10.1039/b617911h","","","0.71073","MoKα","","0.0532","0.048","","","0.0963","0.0985","","","","","","1.248","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202646","7.5677","0.0004","16.7343","0.0006","11.6003","0.0003","90","","90","","90","","1469.06","0.1","130","2","130","2","","","","","","","","5","P b c n","-P 2n 2ab","60","2,4,6-trimethylpyridine pentafluoroiodobenzene","2,4,6-trimethylpyridine pentafluoroiodobenzene","","- C14 H11 F5 I N -","- C14 H11 F5 I N -","- C56 H44 F20 I4 N4 -","4","0.5","","Aleksandra Wasilewska; Maria Gdaniec; Tadeusz Połoński","Co-crystals of iodopentafluorobenzene with nitrogen donors: 2-D molecular assemblies through halogen bonding and aryl?perfluoroaryl interactions","CrystEngComm","2007","9","3","203","","10.1039/b617929k","","","0.71073","MoKα","","0.0268","0.0193","","","0.049","0.0514","","","","","","1.116","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202647","7.3936","0.0009","15.4467","0.0019","12.0105","0.0013","90","","90.881","0.01","90","","1371.5","0.3","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","2,6-dimethylpyridine pentafluoroiodobenzene 1/1 adduct","2,6-dimethylpyridine pentafluoroiodobenzene 1/1 adduct","","- C13 H9 F5 I N -","- C13 H9 F5 I N -","- C52 H36 F20 I4 N4 -","4","0.5","","Aleksandra Wasilewska; Maria Gdaniec; Tadeusz Połoński","Co-crystals of iodopentafluorobenzene with nitrogen donors: 2-D molecular assemblies through halogen bonding and aryl?perfluoroaryl interactions","CrystEngComm","2007","9","3","203","","10.1039/b617929k","","","0.71073","MoKα","","0.0212","0.0189","","","0.0447","0.0454","","","","","","1.051","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202648","7.2401","0.0008","15.1648","0.0014","12.9908","0.0012","90","","91.574","0.008","90","","1425.8","0.2","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","3,5-dimethlpyridine pentafluoroiodobenzene","3,5-dimethlpyridine pentafluoroiodobenzene","","- C13 H9 F5 I N -","- C13 H9 F5 I N -","- C52 H36 F20 I4 N4 -","4","0.5","","Aleksandra Wasilewska; Maria Gdaniec; Tadeusz Połoński","Co-crystals of iodopentafluorobenzene with nitrogen donors: 2-D molecular assemblies through halogen bonding and aryl?perfluoroaryl interactions","CrystEngComm","2007","9","3","203","","10.1039/b617929k","","","0.71073","MoKα","","0.0285","0.0264","","","0.0645","0.066","","","","","","1.079","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202649","7.2792","0.0005","12.9453","0.0007","15.2214","0.0011","90","","95.479","0.006","90","","1427.78","0.16","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","3,5-dimethylpyridine pentafluoroiodobenzene","3,5-dimethylpyridine pentafluoroiodobenzene","","- C13 H9 F5 I N -","- C13 H9 F5 I N -","- C52 H36 F20 I4 N4 -","4","1","","Aleksandra Wasilewska; Maria Gdaniec; Tadeusz Połoński","Co-crystals of iodopentafluorobenzene with nitrogen donors: 2-D molecular assemblies through halogen bonding and aryl?perfluoroaryl interactions","CrystEngComm","2007","9","3","203","","10.1039/b617929k","","","0.71073","MoKα","","0.0689","0.0667","","","0.1865","0.1881","","","","","","1.19","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202650","7.2888","0.0006","14.1251","0.0011","12.6561","0.0011","90","","95.502","0.007","90","","1297.01","0.19","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-methylpyridine pentafluoroiodobenzene","4-methylpyridine pentafluoroiodobenzene","","- C12 H7 F5 I N -","- C12 H7 F5 I N -","- C48 H28 F20 I4 N4 -","4","1","","Aleksandra Wasilewska; Maria Gdaniec; Tadeusz Połoński","Co-crystals of iodopentafluorobenzene with nitrogen donors: 2-D molecular assemblies through halogen bonding and aryl?perfluoroaryl interactions","CrystEngComm","2007","9","3","203","","10.1039/b617929k","","","0.71073","MoKα","","0.0307","0.0249","","","0.0601","0.0627","","","","","","1.064","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202651","22.877","0.01","8.045","0.003","10.222","0.004","90","","90","","90","","1881.3","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 Cu I N6 -","- C20 H16 Cu I N6 -","- C80 H64 Cu4 I4 N24 -","4","0.5","","Wang, Duo-Zhi; Liu, Chun-Sen; Li, Jian-Rong; Li, Lei; Zeng, Yong-Fei; Bu, Xian-He","New d10 metal?organic coordination polymers with 9,10-bis(triazol-1-ylmethyl)anthracene (L): Syntheses, crystal structures, and luminescent properties","CrystEngComm","2007","9","4","289","","10.1039/b618015a","","","0.71073","MoKα","","0.0984","0.0794","","","0.2102","0.2246","","","","","","1.049","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202652","23.858","0.005","5.2642","0.001","15.317","0.003","90","","90","","90","","1923.7","0.7","293","2","293","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C20 H16 Ag B F4 N6 O0 -","- C20 H16 Ag B F4 N6 -","- C80 H64 Ag4 B4 F16 N24 -","4","0.5","","Wang, Duo-Zhi; Liu, Chun-Sen; Li, Jian-Rong; Li, Lei; Zeng, Yong-Fei; Bu, Xian-He","New d10 metal?organic coordination polymers with 9,10-bis(triazol-1-ylmethyl)anthracene (L): Syntheses, crystal structures, and luminescent properties","CrystEngComm","2007","9","4","289","","10.1039/b618015a","","","0.71073","MoKα","","0.0805","0.0382","","","0.0861","0.1059","","","","","","0.98","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202653","25.142","0.005","5.1544","0.001","15.608","0.003","90","","97.98","0.03","90","","2003.1","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 N8 O6 Zn -","- C20 H16 N8 O6 Zn -","- C80 H64 N32 O24 Zn4 -","4","0.5","","Wang, Duo-Zhi; Liu, Chun-Sen; Li, Jian-Rong; Li, Lei; Zeng, Yong-Fei; Bu, Xian-He","New d10 metal?organic coordination polymers with 9,10-bis(triazol-1-ylmethyl)anthracene (L): Syntheses, crystal structures, and luminescent properties","CrystEngComm","2007","9","4","289","","10.1039/b618015a","","","0.71073","MoKα","","0.04","0.036","","","0.0761","0.0783","","","","","","1.089","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202654","13.678","0.002","34.456","0.005","10.243","0.0015","90","","110.382","0.002","90","","4525.2","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H42 Cl2 N12 O11 Zn -","- C42 H42 Cl2 N12 O11 Zn -","- C168 H168 Cl8 N48 O44 Zn4 -","4","1","","Wang, Duo-Zhi; Liu, Chun-Sen; Li, Jian-Rong; Li, Lei; Zeng, Yong-Fei; Bu, Xian-He","New d10 metal?organic coordination polymers with 9,10-bis(triazol-1-ylmethyl)anthracene (L): Syntheses, crystal structures, and luminescent properties","CrystEngComm","2007","9","4","289","","10.1039/b618015a","","","0.71073","MoKα","","0.1298","0.0683","","","0.1597","0.1748","","","","","","1.067","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202655","13.675","0.003","33.935","0.007","10.178","0.002","90","","110.05","0.03","90","","4437","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H42 Cd Cl2 N12 O11 -","- C42 H42 Cd Cl2 N12 O11 -","- C168 H168 Cd4 Cl8 N48 O44 -","4","1","","Wang, Duo-Zhi; Liu, Chun-Sen; Li, Jian-Rong; Li, Lei; Zeng, Yong-Fei; Bu, Xian-He","New d10 metal?organic coordination polymers with 9,10-bis(triazol-1-ylmethyl)anthracene (L): Syntheses, crystal structures, and luminescent properties","CrystEngComm","2007","9","4","289","","10.1039/b618015a","","","0.71073","MoKα","","0.1085","0.0952","","","0.2696","0.2874","","","","","","1.084","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202656","24.236","0.005","5.1343","0.001","15.771","0.003","90","","94.68","0.03","90","","1955.9","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 Br2 Hg N6 -","- C20 H16 Br2 Hg N6 -","- C80 H64 Br8 Hg4 N24 -","4","0.5","","Wang, Duo-Zhi; Liu, Chun-Sen; Li, Jian-Rong; Li, Lei; Zeng, Yong-Fei; Bu, Xian-He","New d10 metal?organic coordination polymers with 9,10-bis(triazol-1-ylmethyl)anthracene (L): Syntheses, crystal structures, and luminescent properties","CrystEngComm","2007","9","4","289","","10.1039/b618015a","","","0.71073","MoKα","","0.0266","0.0252","","","0.065","0.0659","","","","","","1.145","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202657","13.568","0.0009","14.907","0.001","24.0773","0.0018","76.898","0.003","74.505","0.002","77.736","0.002","4510.4","0.5","","","","","","","","","","","","3","P -1","-P 1","2","","","","?","- C114 H156 N4 -","- C114 H156 N4 -","","","","Sergio Andrés Pérez Guarìn; Stéphane Dufresne; Derek Tsang; Assa Sylla; W. G. Skene","Photophysical, electrochemical, and crystallographic investigation of conjugated fluoreno azomethines and their precursors","Journal of Materials Chemistry","2007","17","27","2801","","10.1039/b618098a","","","","","","","","","","","","","","","","","","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202658","8.5576","0.0006","9.1964","0.0007","10.2811","0.0007","79.739","0.001","74.878","0.001","65.164","0.001","706.68","0.09","293","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H15 N7 -","- C15 H15 N7 -","- C30 H30 N14 -","2","1","","Butler, Roslyn S.; Myers, Andrea K.; Bellarmine, Prabhu; Abboud, Khalil A.; Castellano, Ronald K.","Highly fluorescent donor?acceptor purines","Journal of Materials Chemistry","2007","17","19","1863","","10.1039/b618171f","","","0.71073","MoKα","","0.045","0.0383","","","0.1027","0.1065","","","","","","1.032","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202659","10.0863","0.0008","8.6914","0.0007","16.9812","0.0014","90","","98.137","0.002","90","","1473.7","0.2","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H15 N7 -","- C15 H15 N7 -","- C60 H60 N28 -","4","1","","Butler, Roslyn S.; Myers, Andrea K.; Bellarmine, Prabhu; Abboud, Khalil A.; Castellano, Ronald K.","Highly fluorescent donor?acceptor purines","Journal of Materials Chemistry","2007","17","19","1863","","10.1039/b618171f","","","0.71073","MoKα","","0.0569","0.0475","","","0.12","0.1269","","","","","","1.048","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202660","7.3178","0.0014","10.551","0.002","20.587","0.004","90","","90","","90","","1589.5","0.5","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H21 B N2 O2 -","- C15 H21 B N2 O2 -","- C60 H84 B4 N8 O8 -","4","1","","Tan, Wei; Zhang, Deqing; Wang, Zhuo; Liu, Caiming; Zhu, Daoben","4-(N,N-Dimethylamine)benzonitrile (DMABN) derivatives with boronic acid and boronate groups: new fluorescent sensors for saccharides and fluoride ion","Journal of Materials Chemistry","2007","17","19","1964","","10.1039/b618183j","","","0.71073","MoKα","","0.09","0.0701","","","0.157","0.1682","","","","","","1.094","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202661","12.475","0.005","8.656","0.005","8.75","0.005","90","","110.275","0.005","90","","886.3","0.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","bis(cyclopropylammonium)tetraiodoplumbate(ii)","bis(cyclopropylammonium)tetraiodoplumbate(II)","","- C6 H16 I4 N2 Pb -","- C6 H16 I4 N2 Pb -","- C12 H32 I8 N4 Pb2 -","2","0.5","","Billing, David G.; Lemmerer, Andreas","Inorganic?organic hybrid materials incorporating primary cyclic ammonium cations: The lead iodide series","CrystEngComm","2007","9","3","236","","10.1039/b618196a","","","0.71069","MoKα","","0.0652","0.0386","","","0.094","0.1034","","","","","","1.042","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202662","13.355","0.003","8.356","0.0017","9.0583","0.0018","90","","107.747","0.004","90","","962.8","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","bis(cyclobutylammonium)tetraiodoplumbate(ii)","bis(cyclobutylammonium)tetraiodoplumbate(II)","","- C8 H20 I4 N2 Pb -","- C8 H20 I4 N2 Pb -","- C16 H40 I8 N4 Pb2 -","2","0.5","","Billing, David G.; Lemmerer, Andreas","Inorganic?organic hybrid materials incorporating primary cyclic ammonium cations: The lead iodide series","CrystEngComm","2007","9","3","236","","10.1039/b618196a","","","0.71073","MoKα","","0.0347","0.0264","","","0.0554","0.0573","","","","","","0.985","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202663","14","0.02","8.928","0.014","8.949","0.015","90","","108.57","0.04","90","","1060","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","bis(cyclopentylammonium)tetraiodoplumbate(ii)","bis(cyclopentylammonium)tetraiodoplumbate(II)","","- C10 H24 I4 N2 Pb -","- C10 H24 I4 N2 Pb -","- C20 H48 I8 N4 Pb2 -","2","0.5","","Billing, David G.; Lemmerer, Andreas","Inorganic?organic hybrid materials incorporating primary cyclic ammonium cations: The lead iodide series","CrystEngComm","2007","9","3","236","","10.1039/b618196a","","","0.71073","MoKα","","0.1012","0.093","","","0.2339","0.261","","","","","","1.045","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202664","9.1677","0.0015","8.7335","0.0014","27.276","0.005","90","","90","","90","","2183.9","0.6","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","bis(cyclohexylammonium)tetraiodoplumbate(ii)","bis(cyclohexylammonium)tetraiodoplumbate(II)","","- C12 H28 I4 N2 Pb -","- C12 H28 I4 N2 Pb -","- C48 H112 I16 N8 Pb4 -","4","0.5","","Billing, David G.; Lemmerer, Andreas","Inorganic?organic hybrid materials incorporating primary cyclic ammonium cations: The lead iodide series","CrystEngComm","2007","9","3","236","","10.1039/b618196a","","","0.71073","MoKα","","0.0511","0.0315","","","0.069","0.0749","","","","","","1.052","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202665","34.587","0.005","8.7821","0.0012","26.662","0.003","90","","124.255","0.002","90","","6693.7","1.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","tris(cycloheptylammonium)pentaiodoplumbate(ii)","tris(cycloheptylammonium)pentaiodoplumbate(II)","","- C21 H48 I5 N3 Pb -","- C21 H48 I5 N3 Pb -","- C168 H384 I40 N24 Pb8 -","8","1","","Billing, David G.; Lemmerer, Andreas","Inorganic?organic hybrid materials incorporating primary cyclic ammonium cations: The lead iodide series","CrystEngComm","2007","9","3","236","","10.1039/b618196a","","","0.71073","MoKα","","0.0452","0.0351","","","0.0828","0.087","","","","","","1.063","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202666","7.9889","0.0012","8.6291","0.0013","22.455","0.003","90","","90","","90","","1548","0.4","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(cyclooctylammonium)triiodoplumbate(ii)","(cyclooctylammonium)triiodoplumbate(II)","","- C8 H18 I3 N Pb -","- C8 H18 I3 N Pb -","- C32 H72 I12 N4 Pb4 -","4","1","","Billing, David G.; Lemmerer, Andreas","Inorganic?organic hybrid materials incorporating primary cyclic ammonium cations: The lead iodide series","CrystEngComm","2007","9","3","236","","10.1039/b618196a","","","0.71073","MoKα","","0.049","0.0423","","","0.0995","0.1019","","","","","","1.064","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202667","8.2675","0.0016","11.014","0.002","11.281","0.002","77.077","0.003","84.154","0.003","70.74","0.003","944.7","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H14 N O8 Zn -","- C22 H14 N O8 Zn -","- C44 H28 N2 O16 Zn2 -","2","1","","Duan, Xianying; Li, Yizhi; Su, Yang; Zang, Shuangquan; Zhu, Chengjian; Meng, Qingjin","Syntheses and solid state structures of hybrid d10 metal‒organic frameworks based on methylenediisophthalic acid (H4MDIP)","CrystEngComm","2007","9","9","758","","10.1039/b618613k","","","0.71073","MoKα","","0.0517","0.0396","","","0.0908","0.0957","","","","","","0.967","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202668","18.694","0.004","12.899","0.004","12.535","0.003","90","","108.991","0.007","90","","2858.1","1.3","278","2","278","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C62 H48 N8 O18 Zn4 -","- C62 H48 N8 O18 Zn4 -","- C124 H96 N16 O36 Zn8 -","2","0.25","","Duan, Xianying; Li, Yizhi; Su, Yang; Zang, Shuangquan; Zhu, Chengjian; Meng, Qingjin","Syntheses and solid state structures of hybrid d10 metal‒organic frameworks based on methylenediisophthalic acid (H4MDIP)","CrystEngComm","2007","9","9","758","","10.1039/b618613k","","","0.71073","MoKα","","0.0708","0.0542","","","0.1295","0.1359","","","","","","1.062","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202669","7.3409","0.0016","10.135","0.002","11.966","0.003","75.521","0.003","75.762","0.004","74.716","0.003","815.9","0.3","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H26 Cd2 O19 -","- C34 H26 Cd2 O19 -","- C34 H26 Cd2 O19 -","1","0.5","","Duan, Xianying; Li, Yizhi; Su, Yang; Zang, Shuangquan; Zhu, Chengjian; Meng, Qingjin","Syntheses and solid state structures of hybrid d10 metal‒organic frameworks based on methylenediisophthalic acid (H4MDIP)","CrystEngComm","2007","9","9","758","","10.1039/b618613k","","","0.71073","MoKα","","0.0774","0.0598","","","0.1178","0.1209","","","","","","1.072","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202670","18.277","0.003","9.8838","0.0018","15.724","0.003","90","","102.463","0.001","90","","2773.5","0.9","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H36 Cd2 N4 O14 -","- C21 H36 Cd2 N4 O14 -","- C84 H144 Cd8 N16 O56 -","4","0.5","","Duan, Xianying; Li, Yizhi; Su, Yang; Zang, Shuangquan; Zhu, Chengjian; Meng, Qingjin","Syntheses and solid state structures of hybrid d10 metal‒organic frameworks based on methylenediisophthalic acid (H4MDIP)","CrystEngComm","2007","9","9","758","","10.1039/b618613k","","","0.71073","MoKα","","0.0679","0.0481","","","0.108","0.114","","","","","","0.994","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202671","8.6677","0.0007","13.1873","0.0011","12.1442","0.001","90","","93.983","0.002","90","","1384.8","0.2","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H32 Br4 N2 O4 Pd -","- C22 H32 Br4 N2 O4 Pd -","- C44 H64 Br8 N4 O8 Pd2 -","2","0.5","","Neve, Francesco; Crispini, Alessandra","Competitive interactions in carboxy-functionalized pyridinium salts: crossover from O‒H⋯O to O‒H⋯X‒M contacts","CrystEngComm","2007","9","8","698","","10.1039/b618696c","","","0.71073","MoKα","","0.0251","0.0211","","","0.0491","0.0509","","","","","","1.051","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202672","7.7977","0.0009","8.3354","0.001","19.246","0.002","97.599","0.002","92.545","0.002","104.395","0.002","1197.1","0.2","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H72 Br4 N2 O4 Pd -","- C42 H72 Br4 N2 O4 Pd -","- C42 H72 Br4 N2 O4 Pd -","1","0.5","","Neve, Francesco; Crispini, Alessandra","Competitive interactions in carboxy-functionalized pyridinium salts: crossover from O‒H⋯O to O‒H⋯X‒M contacts","CrystEngComm","2007","9","8","698","","10.1039/b618696c","","","0.71073","MoKα","","0.0484","0.0348","","","0.083","0.0868","","","","","","0.957","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202673","14.636","0.003","17.062","0.003","25.079","0.004","76.787","0.01","85.972","0.012","64.566","0.009","5503.2","1.8","143","2","143","2","","","","","","","","4","P -1","-P 1","2","3S (aminopyridyl)ethynylcavitand, NO22PhCOOH","3S (aminopyridyl)ethynylcavitand, NO22PhCOOH","","- C114 H106.1 N18.45 O32.55 -","- C114 H106.1 N18.45 O32.55 -","- C228 H212.2 N36.9 O65.1 -","2","1","","Christer Aakeröy; Nate Schultheiss; John Desper","Synthesis and hydrogen-bond capabilities of an amino-pyridine functionalized cavitand","CrystEngComm","2007","9","3","211","","10.1039/b618728e","","","0.71073","MoKα","","0.3967","0.1084","","","0.2468","0.3484","","","","","","0.762","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202674","12.7783","0.0009","24.5634","0.0018","29.317","0.002","90","","90","","90","","9202","1.1","85","2","85","2","","","","","","","","4","P n m a","-P 2ac 2n","62","NS6S (6-amino-3-pyridyl)ethynyl cavitand, glutaric acid","NS6S (6-amino-3-pyridyl)ethynyl cavitand, glutaric acid","","- C101.6 H111 N9 O16 -","- C102.1 H111.598 N9 O16 -","- C408.4 H446.392 N36 O64 -","4","0.5","","Christer Aakeröy; Nate Schultheiss; John Desper","Synthesis and hydrogen-bond capabilities of an amino-pyridine functionalized cavitand","CrystEngComm","2007","9","3","211","","10.1039/b618728e","","","0.71073","MoKα","","0.1589","0.0945","","","0.2654","0.3114","","","","","","1.02","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202675","10.3021","0.0004","20.0384","0.0011","35.1923","0.0009","90","","92.693","0.0007","90","","7257","0.5","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51.43 H40 Fe N O13 S32 -","- C51.44 H37 Fe N O13 S32 -","- C205.76 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0851","","","","0.0613","","","","","","1.099","","","","has coordinates","275107","2022-05-06","15:04:04",""
"7202676","10.3031","0.001","20.0498","0.0007","35.1933","0.0007","90","","92.6869","0.0004","90","","7262.1","0.8","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51.45 H40 Fe N O13 S32 -","- C51.46 H37 Fe N O13 S32 -","- C205.84 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0698","","","","0.0587","","","","","","1.073","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202677","10.3012","0.0003","20.08","0.0011","35.2191","0.0008","90","","92.6379","0.0004","90","","7277.3","0.5","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51.67 H40 Fe N O13 S32 -","- C51.68 H37 Fe N O13 S32 -","- C206.72 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0726","","","","0.0612","","","","","","1.122","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202678","10.296","0.0008","20.064","0.003","35.1951","0.0008","90","","92.696","0.0005","90","","7262.5","1.2","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51.76 H40 Fe N O13 S32 -","- C51.76 H37 Fe N O13 S32 -","- C207.04 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0788","","","","0.0731","","","","","","1.113","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202679","10.291","0.003","20.073","0.017","35.242","0.017","90","","92.641","0.016","90","","7272","7","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51.86 H40 Fe N O13 S32 -","- C51.86 H37 Fe N O13 S32 -","- C207.44 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0518","","","","0.0608","","","","","","1.031","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202680","10.2904","0.001","20.09","0.003","35.207","0.003","90","","92.663","0.003","90","","7270.6","1.4","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52.08 H40 Fe N O13 S32 -","- C52.08 H37 Fe N O13 S32 -","- C208.32 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0798","","","","0.0606","","","","","","1.134","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202681","10.2911","0.0016","20.1062","0.0016","35.2174","0.0009","90","","92.6683","0.0006","90","","7279.1","1.3","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52.21 H40 Fe N O13 S32 -","- C52.22 H37 Fe N O13 S32 -","- C208.88 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0659","","","","0.0629","","","","","","1.056","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202682","10.2747","0.0009","20.1509","0.0013","35.2218","0.0008","90","","92.6684","0.0005","90","","7284.6","0.8","296.1","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52.81 H45 Fe N O12 S32 -","- C52.808 H37 Fe N O13 S32 -","- C211.232 H148 Fe4 N4 O52 S128 -","4","0.5","","Akutsu-Sato, Akane; Akutsu, Hiroki; Yamada, J.; Nakatsuji, S.; Turner, Scott S.; Day, Peter","Suppression of superconductivity in a molecular charge transfer salt by changing guest molecule: β''-(BEDT-TTF)~4~[(H~3~O)Fe(C~2~O~4~)~3~](C~6~H~5~CN)x(C~5~H~5~N)~1-x~","Journal of Materials Chemistry","2007","17","24","2497","2499","10.1039/b618832j","","","0.71069","MoKα","","","0.0467","","","","0.0552","","","","","","1.059","","","","has coordinates","275107","2022-05-06","15:04:05",""
"7202683","7.475","0.002","11.848","0.003","12.856","0.003","90","","103.12","0.03","90","","1108.9","0.5","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","brucinium bromide dihydrate","","- C23 H31 Br N2 O6 -","- C23 H31 Br N2 O6 -","- C46 H62 Br2 N4 O12 -","2","1","","Agata Białońska; Zbigniew Ciunik","Intermolecular hinge?a new function of the C?H?? hydrogen bond","CrystEngComm","2007","9","7","570","","10.1039/b700211d","","","0.71073","MoKα","","0.078","0.0409","","","0.0703","0.0774","","","","","","0.847","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202684","21.1635","0.0016","5.6554","0.0004","16.5577","0.0013","90","","114.797","0.007","90","","1799","0.3","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","2,3,4,5,6-pentafluorophenol 2,3,4,5,6-pentafluoroaniline 2:1 adduct","","- C18 H4 F15 N O2 -","- C18 H4 F15 N O2 -","- C72 H16 F60 N4 O8 -","4","1","","Gdaniec, Maria","On the polymorphs of pentafluorophenol and its 2?:?1 co-crystal with pentafluoroaniline","CrystEngComm","2007","9","4","286","","10.1039/b700245a","","","0.71073","MoKα","","0.0431","0.0313","","","0.0573","0.0608","","","","","","0.95","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202685","5.1398","0.0009","19.0901","0.0016","19.152","0.0015","90","","90","","90","","1879.2","0.4","130","2","130","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,3,4,5,6-pentafluorophenol","","- C6 H F5 O -","- C6 H F5 O -","- C72 H12 F60 O12 -","12","3","","Gdaniec, Maria","On the polymorphs of pentafluorophenol and its 2?:?1 co-crystal with pentafluoroaniline","CrystEngComm","2007","9","4","286","","10.1039/b700245a","","","0.71073","MoKα","","0.0695","0.049","","","0.0929","0.1012","","","","","","1.035","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202686","12.938","0.003","4.8572","0.0013","10.01","0.002","90","","106.55","0.02","90","","603","0.3","130","1","130","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3,4,5,6-pentafluorophenol","","- C6 H F5 O -","- C6 H F5 O -","- C24 H4 F20 O4 -","4","1","","Gdaniec, Maria","On the polymorphs of pentafluorophenol and its 2?:?1 co-crystal with pentafluoroaniline","CrystEngComm","2007","9","4","286","","10.1039/b700245a","","","0.71073","MoKα","","0.0667","0.0505","","","0.1359","0.1505","","","","","","1.104","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202687","12.0266","0.0005","10.2443","0.0004","4.9988","0.0002","90","","90","","90","","615.87","0.04","100","2","100","2","","","","","","","","5","P m n 21","P 2ac -2","31","1-(4-pyridyl)-2-(2,3,5,6-F4-4-I-phenyl)ethene","1-(4-pyridyl)-2-(2,3,5,6-F4-4-I-phenyl)ethene","","- C13 H6 F4 I N -","- C13 H6 F4 I N1.434 -","- C26 H12 F8 I2 N2.868 -","2","0.5","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Attempted assembly of discrete coordination complexes into 1-D chains using halogen bonding or halogen?halogen interactions","CrystEngComm","2007","9","5","421","","10.1039/b700286f","","","0.71073","MoKα","","0.0505","0.038","","","0.0695","0.0737","","","","","","0.997","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202688","8.9889","0.0003","9.0836","0.0003","12.9622","0.0005","88.061","0.002","86.489","0.002","67.894","0.002","978.67","0.06","100","2","100","2","","","","","","","","7","P -1","-P 1","2","N7 Cu(F6-acac)2 (1-(4-pyridyl)-2-(2,3,5,6-F4-4-Br- phenyl)ethene)2","N7 Cu(F6-acac)2 [1-(4-pyridyl)-2-(2,3,5,6-F4-4-Br-phenyl)ethene]2","","- C36 H14 Br2 Cu F20 N2 O4 -","- C36 H14 Br2 Cu F20 N2 O4 -","- C36 H14 Br2 Cu F20 N2 O4 -","1","0.5","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Attempted assembly of discrete coordination complexes into 1-D chains using halogen bonding or halogen?halogen interactions","CrystEngComm","2007","9","5","421","","10.1039/b700286f","","","0.71073","MoKα","","0.0535","0.0332","","","0.0793","0.0886","","","","","","1.019","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202689","8.9245","0.0004","9.0077","0.0003","13.0921","0.0005","86.37","0.002","86.442","0.002","70.214","0.002","987.42","0.07","100","2","100","2","","","","","","","","7","P -1","-P 1","2","NSBrCo Co(F6-acac)2 (1-(4-pyridyl)-2-(2,3,5,6-F4-4-Br- phenyl)ethene)2","NSBrCo Co(F6-acac)2 [1-(4-pyridyl)-2-(2,3,5,6-F4-4-Br-phenyl)ethene]2","","- C36 H14 Br2 Co F20 N2 O4 -","- C36.004 H14 Br2 Co F20.012 N2 O4 -","- C36.004 H14 Br2 Co F20.012 N2 O4 -","1","0.5","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Attempted assembly of discrete coordination complexes into 1-D chains using halogen bonding or halogen?halogen interactions","CrystEngComm","2007","9","5","421","","10.1039/b700286f","","","0.71073","MoKα","","0.0562","0.0354","","","0.0795","0.0874","","","","","","1.027","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202690","9.0352","0.0004","9.0357","0.0004","13.2174","0.0006","87.447","0.002","88.53","0.002","69.506","0.002","1009.7","0.08","100","2","100","2","","","","","","","","7","P -1","-P 1","2","N3 Cu(F6-acac)2 (1-(4-pyridyl)-2-(2,3,5,6-F4-4-I- phenyl)ethene)2","N3 Cu(F6-acac)2 [1-(4-pyridyl)-2-(2,3,5,6-F4-4-I-phenyl)ethene]2","","- C36 H14 Cu F20 I2 N2 O4 -","- C36 H14 Cu F20 I2 N2 O4 -","- C36 H14 Cu F20 I2 N2 O4 -","1","0.5","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Attempted assembly of discrete coordination complexes into 1-D chains using halogen bonding or halogen?halogen interactions","CrystEngComm","2007","9","5","421","","10.1039/b700286f","","","0.71073","MoKα","","0.047","0.0327","","","0.0716","0.0784","","","","","","1.031","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202691","9.9628","0.0006","10.6131","0.0007","12.7053","0.0008","114.135","0.001","98.032","0.001","92.76","0.001","1205.68","0.13","223","2","223","2","","","","","","","","8","P -1","-P 1","2","","","","- C46 H48 Au2 Cl4 N2 O2 P2 S2 -","- C46 H48 Au2 Cl4 N2 O2 P2 S2 -","- C46 H48 Au2 Cl4 N2 O2 P2 S2 -","1","0.5","","Ho, Soo Yei; Tiekink, Edward R. T.","Supramolecular aggregation patterns in the crystal structures of the dinuclear phosphinegold(i) thiolates, [(Ph2P(CH2)4PPh2){AuSC(OR)?NC6H4Y-4}2] for R = Me, Et or iPr and Y = H, NO2 or Me: the influence on intermolecular interactions exerted by R and Y","CrystEngComm","2007","9","5","368","","10.1039/b700295e","","","0.71069","MoKα","","0.031","0.027","","","0.057","0.059","","","","","","1","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202692","8.4818","0.0006","11.9828","0.0008","12.1684","0.0008","105.973","0.001","99.485","0.001","106.821","0.001","1097.24","0.13","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H48 Au2 N2 O2 P2 S2 -","- C46 H48 Au2 N2 O2 P2 S2 -","- C46 H48 Au2 N2 O2 P2 S2 -","1","0.5","","Ho, Soo Yei; Tiekink, Edward R. T.","Supramolecular aggregation patterns in the crystal structures of the dinuclear phosphinegold(i) thiolates, [(Ph2P(CH2)4PPh2){AuSC(OR)?NC6H4Y-4}2] for R = Me, Et or iPr and Y = H, NO2 or Me: the influence on intermolecular interactions exerted by R and Y","CrystEngComm","2007","9","5","368","","10.1039/b700295e","","","0.71069","MoKα","","0.038","0.035","","","0.089","0.09","","","","","","1.16","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202693","8.9734","0.0012","10.5472","0.0014","25.098","0.003","90","","92.957","0.003","90","","2372.2","0.5","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48 H52 Au2 N2 O2 P2 S2 -","- C48 H52 Au2 N2 O2 P2 S2 -","- C96 H104 Au4 N4 O4 P4 S4 -","2","0.5","","Ho, Soo Yei; Tiekink, Edward R. T.","Supramolecular aggregation patterns in the crystal structures of the dinuclear phosphinegold(i) thiolates, [(Ph2P(CH2)4PPh2){AuSC(OR)?NC6H4Y-4}2] for R = Me, Et or iPr and Y = H, NO2 or Me: the influence on intermolecular interactions exerted by R and Y","CrystEngComm","2007","9","5","368","","10.1039/b700295e","","","0.71069","MoKα","","0.048","0.033","","","0.071","0.077","","","","","","1.02","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202694","9.2907","0.0005","11.4082","0.0006","12.0751","0.0006","115.352","0.001","91.155","0.001","90.652","0.001","1156.07","0.1","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H46 Au2 N4 O6 P2 S2 -","- C46 H46 Au2 N4 O6 P2 S2 -","- C46 H46 Au2 N4 O6 P2 S2 -","1","0.5","","Ho, Soo Yei; Tiekink, Edward R. T.","Supramolecular aggregation patterns in the crystal structures of the dinuclear phosphinegold(i) thiolates, [(Ph2P(CH2)4PPh2){AuSC(OR)?NC6H4Y-4}2] for R = Me, Et or iPr and Y = H, NO2 or Me: the influence on intermolecular interactions exerted by R and Y","CrystEngComm","2007","9","5","368","","10.1039/b700295e","","","0.71069","MoKα","","0.03","0.027","","","0.063","0.064","","","","","","1","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202695","8.872","0.002","12.31","0.003","12.717","0.003","104.028","0.005","90.272","0.005","107.186","0.005","1282.9","0.5","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C49 H54 Au2 N4 O7 P2 S2 -","- C49 H50 Au2 N4 O7 P2 S2 -","- C49 H50 Au2 N4 O7 P2 S2 -","1","0.5","","Ho, Soo Yei; Tiekink, Edward R. T.","Supramolecular aggregation patterns in the crystal structures of the dinuclear phosphinegold(i) thiolates, [(Ph2P(CH2)4PPh2){AuSC(OR)?NC6H4Y-4}2] for R = Me, Et or iPr and Y = H, NO2 or Me: the influence on intermolecular interactions exerted by R and Y","CrystEngComm","2007","9","5","368","","10.1039/b700295e","","","0.71069","MoKα","","0.096","0.048","","","0.113","0.136","","","","","","1.01","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202696","13.8791","0.001","13.3279","0.001","26.1381","0.0019","90","","104.601","0.002","90","","4678.9","0.6","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C46 H52 Au2 N2 O4 P2 S2 -","- C46 H48 Au2 N2 O4 P2 S2 -","- C184 H192 Au8 N8 O16 P8 S8 -","4","0.5","","Ho, Soo Yei; Tiekink, Edward R. T.","Supramolecular aggregation patterns in the crystal structures of the dinuclear phosphinegold(i) thiolates, [(Ph2P(CH2)4PPh2){AuSC(OR)?NC6H4Y-4}2] for R = Me, Et or iPr and Y = H, NO2 or Me: the influence on intermolecular interactions exerted by R and Y","CrystEngComm","2007","9","5","368","","10.1039/b700295e","","","0.71069","MoKα","","0.062","0.042","","","0.118","0.125","","","","","","1.07","","","","has coordinates,has disorder","180357","2020-10-21","18:00:00",""
"7202697","9.2316","0.0019","10.341","0.002","24.703","0.005","90","","99.062","0.005","90","","2328.8","0.8","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48 H52 Au2 N2 O2 P2 S2 -","- C48 H52 Au2 N2 O2 P2 S2 -","- C96 H104 Au4 N4 O4 P4 S4 -","2","0.5","","Ho, Soo Yei; Tiekink, Edward R. T.","Supramolecular aggregation patterns in the crystal structures of the dinuclear phosphinegold(i) thiolates, [(Ph2P(CH2)4PPh2){AuSC(OR)?NC6H4Y-4}2] for R = Me, Et or iPr and Y = H, NO2 or Me: the influence on intermolecular interactions exerted by R and Y","CrystEngComm","2007","9","5","368","","10.1039/b700295e","","","0.71069","MoKα","","0.054","0.037","","","0.082","0.097","","","","","","1.04","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202698","9.3315","0.0011","10.3035","0.0012","24.665","0.003","90","","95.074","0.003","90","","2362.2","0.5","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C50 H56 Au2 N2 O2 P2 S2 -","- C50 H56 Au2 N2 O2 P2 S2 -","- C100 H112 Au4 N4 O4 P4 S4 -","2","0.5","","Ho, Soo Yei; Tiekink, Edward R. T.","Supramolecular aggregation patterns in the crystal structures of the dinuclear phosphinegold(i) thiolates, [(Ph2P(CH2)4PPh2){AuSC(OR)?NC6H4Y-4}2] for R = Me, Et or iPr and Y = H, NO2 or Me: the influence on intermolecular interactions exerted by R and Y","CrystEngComm","2007","9","5","368","","10.1039/b700295e","","","0.71069","MoKα","","0.054","0.039","","","0.087","0.092","","","","","","1.03","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202699","11.6255","0.0013","15.2552","0.0017","15.2882","0.0018","90","","92.341","0.002","90","","2709.1","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetra-(n-butylpyridinium) Octamolybdate","","- C36 H56 Mo8 N4 O26 -","- C36 H56 Mo8 N4 O26 -","- C72 H112 Mo16 N8 O52 -","2","0.5","","Ming-Lin, Guo; Hui-Zhen, Li","Selective oxidation of benzyl alcohol to benzaldehyde with hydrogen peroxide over tetra-alkylpyridinium octamolybdate catalysts","Green Chemistry","2007","9","5","421","","10.1039/b700534b","","","0.71073","MoKα","","0.0527","0.0446","","","0.1247","0.1319","","","","","","1.088","","","","has coordinates","180357","2020-10-21","18:00:00",""
"7202700","7.8386","0.001","12.791","0.003","13.187","0.002","90","","99.17","0.011","90","","1305.3","0.4","295","","295","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 O6 -","- C14 H14 O6 -","- C56 H56 O24 -","4","1","","Marcel Bouvet; Bernard Malézieux; Patrick Herson; Françoise Villain","Self-organization of the 2-methoxyquinhydrone charge transfer complex in polar planes","CrystEngComm","2007","9","4","270","","10.1039/b700652g","","","0.71073","MoKα","","0.2296","0.0675","","0.1282","0.057","0.057","","","","","","1.0526","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202701","4.9678","0.0007","10.533","0.004","13.094","0.002","90","","91.194","0.013","90","","685","0.3","295","","295","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C7 H8 O3 -","- C7 H8 O3 -","- C28 H32 O12 -","4","1","","Marcel Bouvet; Bernard Malézieux; Patrick Herson; Françoise Villain","Self-organization of the 2-methoxyquinhydrone charge transfer complex in polar planes","CrystEngComm","2007","9","4","270","","10.1039/b700652g","","","0.71073","MoKα","","0.0706","0.0473","","0.0756","0.0595","0.0595","","","","","","1.0549","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202702","12.2204","0.0002","12.5113","0.0002","13.5098","0.0002","69.946","0.001","87.21","0.001","68.896","0.001","1803.58","0.05","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H50 N4 O9 -","- C34 H50 N4 O9 -","- C68 H100 N8 O18 -","2","1","","Karmakar, Anirban; Sarma, Rupam J.; Baruah, Jubaraj B.","Structural aspects and properties of salt and inclusion compounds of 8-hydroxyquinoline based amides","CrystEngComm","2007","9","5","379","","10.1039/b700701a","","","0.71073","MoKα","","0.1046","0.069","","","0.2015","0.2305","","","","","","1.064","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202703","20.7294","0.0019","7.8139","0.0007","22.774","0.002","90","","104.081","0.002","90","","3578","0.6","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 N3 O5 -","- C19 H19 N3 O5 -","- C152 H152 N24 O40 -","8","2","","Karmakar, Anirban; Sarma, Rupam J.; Baruah, Jubaraj B.","Structural aspects and properties of salt and inclusion compounds of 8-hydroxyquinoline based amides","CrystEngComm","2007","9","5","379","","10.1039/b700701a","","","0.71073","MoKα","","0.1887","0.0958","","","0.1779","0.2165","","","","","","1.041","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202704","11.19","0.0002","11.3769","0.0002","17.1563","0.0004","80.895","0.001","76.141","0.001","65.615","0.001","1927.02","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H40 N4 O13 S2 -","- C38 H40 N4 O13 S2 -","- C76 H80 N8 O26 S4 -","2","1","","Karmakar, Anirban; Sarma, Rupam J.; Baruah, Jubaraj B.","Structural aspects and properties of salt and inclusion compounds of 8-hydroxyquinoline based amides","CrystEngComm","2007","9","5","379","","10.1039/b700701a","","","0.71073","MoKα","","0.0812","0.0634","","","0.1673","0.1846","","","","","","1.042","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202705","11.4032","0.0005","11.4631","0.0005","15.0226","0.0007","80.782","0.003","72.286","0.003","68.221","0.003","1734.59","0.14","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H38 N4 O5 -","- C38 H38 N4 O5 -","- C76 H76 N8 O10 -","2","1","","Karmakar, Anirban; Sarma, Rupam J.; Baruah, Jubaraj B.","Structural aspects and properties of salt and inclusion compounds of 8-hydroxyquinoline based amides","CrystEngComm","2007","9","5","379","","10.1039/b700701a","","","0.71073","MoKα","","0.1814","0.0688","","","0.1241","0.1641","","","","","","0.984","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202706","7.528","0.002","11.516","0.003","12.334","0.003","114.29","0.004","99.137","0.004","96.136","0.004","944.5","0.4","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H42 N4 O6 -","- C44 H42 N4 O6 -","- C44 H42 N4 O6 -","1","0.5","","Karmakar, Anirban; Sarma, Rupam J.; Baruah, Jubaraj B.","Structural aspects and properties of salt and inclusion compounds of 8-hydroxyquinoline based amides","CrystEngComm","2007","9","5","379","","10.1039/b700701a","","","0.71073","MoKα","","0.0768","0.0456","","","0.136","0.1604","","","","","","0.99","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202707","8.1869","0.0002","10.402","0.0002","13.6322","0.0003","111.239","0.002","93.668","0.002","105.441","0.002","1026.25","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H22 N2 O3 -","- C24 H22 N2 O3 -","- C48 H44 N4 O6 -","2","1","","Karmakar, Anirban; Sarma, Rupam J.; Baruah, Jubaraj B.","Structural aspects and properties of salt and inclusion compounds of 8-hydroxyquinoline based amides","CrystEngComm","2007","9","5","379","","10.1039/b700701a","","","0.71073","MoKα","","0.0581","0.0437","","","0.1082","0.12","","","","","","1.021","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202708","5.1139","0.0001","13.4807","0.0003","24.8362","0.0005","90","","90","","90","","1712.18","0.06","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H20 N2 O3 -","- C20 H20 N2 O3 -","- C80 H80 N8 O12 -","4","1","","Karmakar, Anirban; Sarma, Rupam J.; Baruah, Jubaraj B.","Structural aspects and properties of salt and inclusion compounds of 8-hydroxyquinoline based amides","CrystEngComm","2007","9","5","379","","10.1039/b700701a","","","0.71073","MoKα","","0.1171","0.0501","","","0.0852","0.1036","","","","","","0.989","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202709","9.4877","0.0015","12.6863","0.0019","14.832","0.002","90","","90","","90","","1785.2","0.5","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H20 N2 O3 -","- C19 H20 N2 O3 -","- C76 H80 N8 O12 -","4","1","","Karmakar, Anirban; Sarma, Rupam J.; Baruah, Jubaraj B.","Structural aspects and properties of salt and inclusion compounds of 8-hydroxyquinoline based amides","CrystEngComm","2007","9","5","379","","10.1039/b700701a","","","0.71073","MoKα","","0.1017","0.0481","","","0.1248","0.1545","","","","","","0.931","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202710","25.39","0.006","5.557","0.002","13.342","0.001","90","","93.826","0.014","90","","1878.3","0.8","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C23 H20 N3 O0.5 -","- C23 H19 N3 O0.5 -","- C92 H76 N12 O2 -","4","1","","Smith, Nicole M.; Raston, Colin L.; Smith, Christopher B.; Sobolev, Alexandre N.","PEG mediated synthesis of amino-functionalised 2,4,6-triarylpyridines","Green Chemistry","2007","9","11","1185","","10.1039/b700893g","","","0.71073","MoKα","","0.1599","0.0905","","","0.2019","0.2378","","","","","","1.005","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202711","8.8927","0.0006","22.5574","0.0015","22.7642","0.0015","90","","95.59","0.002","90","","4544.7","0.5","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(La(BA)3(DMSO))n","","","- C23 H21 La O7 S -","- C23.0005 H21 La O7 S -","- C184.004 H168 La8 O56 S8 -","8","2","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.1096","0.1055","","","0.2212","0.2228","","","","","","1.437","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202712","13.537","0.0003","15.4019","0.0004","17.2256","0.0004","69.58","0.001","73.354","0.001","71.91","0.001","3134.8","0.13","123","2","123","2","","","","","","","","5","P -1","-P 1","2","poly(tris(dimethylformamide)hexakis(3-nitrobenzoato)bis- lanthanum (iii)) DMF/H2O solvate","poly[tris(dimethylformamide)hexakis(3-nitrobenzoato)bis-lanthanum (III)] DMF/H2O solvate","","- C54 H58 La2 N10 O29 -","- C54 H58 La2 N10 O29 -","- C108 H116 La4 N20 O58 -","2","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.0333","0.0294","","","0.0654","0.0671","","","","","","1.135","","","","has coordinates,has disorder","180358","2020-10-21","18:00:00",""
"7202713","16.4013","0.001","9.6954","0.0005","20.2097","0.0011","90","","108.461","0.002","90","","3048.3","0.3","123","1","123","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","poly((aqua)(dimethylsulphoxide)tris(4- nitrobenzoato)lanthanum(iii)) DMSO solvate","poly[(aqua)(dimethylsulphoxide)tris(4-nitrobenzoato)lanthanum(III)] DMSO solvate","","- C25 H26 La N3 O15 S2 -","- C25 H26 La N3 O15 S2 -","- C100 H104 La4 N12 O60 S8 -","4","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.0859","0.0511","","","0.0812","0.0988","","","","","","0.989","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202714","9.6514","0.0004","21.4458","0.0005","15.9922","0.0003","90","","95.028","0.001","90","","3297.36","0.17","123","1","123","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","poly((aqua)(dimethylsulphoxide)tris(3- methoxybenzoato)lanthanum (iii)), DMSO solvate.","poly[(aqua)(dimethylsulphoxide)tris(3-methoxybenzoato)lanthanum (III)], DMSO solvate.","","- C28 H35 La O12 S2 -","- C28 H35 La O12 S2 -","- C112 H140 La4 O48 S8 -","4","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.0632","0.0365","","","0.0785","0.0881","","","","","","1.018","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202715","9.6002","0.0002","11.3814","0.0002","14.8606","0.0003","95.295","0.001","101.131","0.001","95.719","0.001","1574.87","0.05","123","1","123","1","","","","","","","","5","P -1","-P 1","2","HB18DMSO","","","- C29 H35 La O14 S -","- C29 H35 La O14 S -","- C58 H70 La2 O28 S2 -","2","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.023","0.0218","","","0.0516","0.0525","","","","","","1.031","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202716","9.633","0.0003","10.038","0.0003","32.5121","0.0008","86.171","0.001","89.509","0.001","75.716","0.001","3039.7","0.15","123","2","123","2","","","","","","","","5","P -1","-P 1","2","poly((bis(aqua)bis(dimethylsulphoxide)hexa(4-methoxybenzoato) dilanthanum).DMSO.H2O)","poly{[bis(aqua)bis(dimethylsulphoxide)hexa(4-methoxybenzoato) dilanthanum].DMSO.H2O}","","- C54 H66 La2 O24 S3 -","- C54 H64 La2 O24 S3 -","- C108 H128 La4 O48 S6 -","2","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.0834","0.0465","","","0.1022","0.1172","","","","","","1.023","","","","has coordinates,has disorder","180358","2020-10-21","18:00:00",""
"7202717","11.5323","0.0002","33.7471","0.0006","9.5791","0.0003","90","","104.326","0.001","90","","3612.08","0.15","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","((aqua)(dimethylformamide)tris(4- ethoxybenzoato)lanthanum(iii))","[(aqua)(dimethylformamide)tris(4-ethoxybenzoato)lanthanum(III)]","","- C33 H43 La N2 O12 -","- C33 H43 La N2 O12 -","- C132 H172 La4 N8 O48 -","4","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.083","0.0371","","","0.0798","0.0939","","","","","","0.959","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202718","20.0604","0.0003","17.4169","0.0002","23.1887","0.0003","90","","114.945","0.001","90","","7346.1","0.18","123","1","123","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","((La3(BA)9(DMF)3).DMF)n","","","- C75 H73 La3 N4 O22 -","- C75 H73 La3 N4 O22 -","- C300 H292 La12 N16 O88 -","4","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.0663","0.0396","","","0.0788","0.0863","","","","","","1.024","","","","has coordinates,has disorder","180358","2020-10-21","18:00:00",""
"7202719","15.4745","0.0001","21.8201","0.0002","22.9482","0.0002","90","","106.962","0.001","90","","7411.5","0.11","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(La3(2-MeBA)9(DMF)2)n","","","- C78 H74 La3 N2 O20 -","- C78 H77 La3 N2 O20 -","- C312 H308 La12 N8 O80 -","4","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.0621","0.0458","","","0.0838","0.0881","","","","","","1.167","","","","has coordinates,has disorder","180358","2020-10-21","18:00:00",""
"7202720","9.6022","0.0002","9.9801","0.0002","16.1375","0.0003","106.171","0.001","94.743","0.001","101.49","0.001","1439.75","0.05","123","1","123","1","","","","","","","","5","P -1","-P 1","2","poly((aqua)(dimethylsulphoxide)tris(3- methylbenzoato)lanthanum(iii)) water solvate","poly[(aqua)(dimethylsulphoxide)tris(3-methylbenzoato)lanthanum(III)] water solvate","","- C26 H31 La O9 S -","- C26 H31 La O9 S -","- C52 H62 La2 O18 S2 -","2","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.0464","0.0345","","","0.0736","0.0774","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202721","8.2424","0.0003","12.3545","0.0006","16.3741","0.0009","79.625","0.003","87.983","0.003","82.373","0.003","1625.51","0.13","123","1","123","1","","","","","","","","4","P -1","-P 1","2","poly(tris(3-methylbenzoato)(3-methylbenzoic acid)lanthanum(iii)) 3-methylbenzoic acid solvate","poly[tris(3-methylbenzoato)(3-methylbenzoic acid)lanthanum(III)] 3- methylbenzoic acid solvate","","- C36 H33 La O9 -","- C36 H32.5 La O9 -","- C72 H65 La2 O18 -","2","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.1288","0.0959","","","0.2267","0.2566","","","","","","1.056","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202722","25.5545","0.0002","19.5508","0.0002","16.9228","0.0002","90","","118.495","0.001","90","","7430.59","0.15","123","1","123","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","bis(bis(dimethylsulphoxide)tris(2,4,6- trimethylbenzoato)lanthanum (iii))","bis[bis(dimethylsulphoxide)tris(2,4,6-trimethylbenzoato)lanthanum (III)]","","- C68 H90 La2 O16 S4 -","- C68 H90 La2 O16 S4 -","- C272 H360 La8 O64 S16 -","4","0.5","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.087","0.045","","","0.1004","0.1136","","","","","","1.039","","","","has coordinates,has disorder","180358","2020-10-21","18:00:00",""
"7202723","22.1543","0.0018","16.1425","0.0013","9.6019","0.0007","90","","93.077","0.003","90","","3428.9","0.5","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","poly((dimethylsulphoxide)tris(4-tert- butylbenzoato)lanthanum(iii))","poly[(dimethylsulphoxide)tris(4-tert-butylbenzoato)lanthanum(III)]","","- C35 H45 La O7 S -","- C35 H45 La O7 S -","- C140 H180 La4 O28 S4 -","4","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.1913","0.1868","","","0.4019","0.404","","","","","","1.272","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202724","24.9553","0.0011","8.0474","0.0003","30.679","0.0013","90","","90","","90","","6161.1","0.4","123","2","123","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","poly((dimethylformamide)tris(2- aminomethylbenzoato)lanthanum(iii)) DMF solvate","poly[(dimethylformamide)tris(2-aminomethylbenzoato)lanthanum(III)] DMF solvate","","- C30 H38 La N5 O8 -","- C30 H38 La N5 O8 -","- C240 H304 La8 N40 O64 -","8","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.149","0.1324","","","0.2328","0.2389","","","","","","1.468","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202725","9.9777","0.0001","13.9145","0.0002","13.9532","0.0002","70.295","0.001","82.314","0.001","75.908","0.001","1766.03","0.04","123","1","123","1","","","","","","","","6","P -1","-P 1","2","poly((aqua)(dimethylsulphoxide)tris(3- nitrobenzoato)lanthanum(iii)) bis DMSO solvate","poly[(aqua)(dimethylsulphoxide)tris(3-nitrobenzoato)lanthanum(III)] bis DMSO solvate","","- C27 H32 La N3 O16 S3 -","- C26.996 H32 La N3 O16 S3 -","- C53.992 H64 La2 N6 O32 S6 -","2","1","","Hendrik Bußkamp; Glen B. Deacon; Matthias Hilder; Peter C. Junk; Ulrich H. Kynast; Winnie W. Lee; David R. Turner","Structural variations in rare earth benzoate complexes : Part I. Lanthanum","CrystEngComm","2007","9","5","394","","10.1039/b700980a","","","0.71073","MoKα","","0.037","0.0277","","","0.0593","0.0626","","","","","","1.029","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202726","9.242","0.004","5.718","0.0011","18.205","0.006","90","","100.06","0.03","90","","947.3","0.6","300","","300","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","5,5'-bis(4-ethylphenyl)-2,2'-bithiophene","5,5'-bis(4-ethylphenyl)-2,2'-bithiophene","","- C24 H22 S2 -","- C24 H22 S2 -","- C48 H44 S4 -","2","0.5","","Stokes, Melissa A.; Kortan, Refik; Amy, Sandrine Rivillon; Katz, Howard E.; Chabal, Yves J.; Kloc, Christian; Siegrist, Theo","Molecular ordering in bis(phenylenyl)bithiophenes","Journal of Materials Chemistry","2007","17","32","3427","","10.1039/b701035d","","","0.71073","MoKα","","0.1888","0.0418","","0.1943","0.0826","0.1943","","","","","","0.9467","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202727","5.558","0.003","7.665","0.004","37.188","0.025","90","","90","","90","","1584.3","1.6","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","5,5'-bis(4-hydroxyphenyl)-2,2'-bithiophene","5,5'-bis(4-hydroxyphenyl)-2,2'-bithiophene","","- C20 H14 O2 S2 -","- C80 H56 O8 S8 -","- C80 H56 O8 S8 -","","","","Stokes, Melissa A.; Kortan, Refik; Amy, Sandrine Rivillon; Katz, Howard E.; Chabal, Yves J.; Kloc, Christian; Siegrist, Theo","Molecular ordering in bis(phenylenyl)bithiophenes","Journal of Materials Chemistry","2007","17","32","3427","","10.1039/b701035d","","","1.2084","synchrotron","","","","","","","","","","","","","","","","","has coordinates","277887","2022-09-15","15:15:13",""
"7202728","33.056","0.022","7.485","0.004","5.876","0.003","90","","96.16","0.03","90","","1445.5","1.4","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","5,5'-bis-4-(6-hydroxyhexyloxy)-phenyl-2,2'-bithiophene","5,5'-bis-4-(6-hydroxyhexyloxy)-phenyl-2,2'-bithiophene","","- C32 H38 O4 S2 -","- C64 H76 O8 S4 -","- C64 H76 O8 S4 -","","","","Stokes, Melissa A.; Kortan, Refik; Amy, Sandrine Rivillon; Katz, Howard E.; Chabal, Yves J.; Kloc, Christian; Siegrist, Theo","Molecular ordering in bis(phenylenyl)bithiophenes","Journal of Materials Chemistry","2007","17","32","3427","","10.1039/b701035d","","","1.2084","synchrotron","","","","","","","","","","","","","","","","","has coordinates","277887","2022-09-15","15:15:13",""
"7202729","9.109","0.002","5.7272","0.0007","18.159","0.004","90","","101.54","0.02","90","","928.2","0.3","120","","120","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","5,5'-bis(4-ethylphenyl)-2,2'-bithiophene","5,5'-bis(4-ethylphenyl)-2,2'-bithiophene","","- C24 H22 S2 -","- C24 H22 S2 -","- C48 H44 S4 -","2","0.5","","Stokes, Melissa A.; Kortan, Refik; Amy, Sandrine Rivillon; Katz, Howard E.; Chabal, Yves J.; Kloc, Christian; Siegrist, Theo","Molecular ordering in bis(phenylenyl)bithiophenes","Journal of Materials Chemistry","2007","17","32","3427","","10.1039/b701035d","","","0.71073","MoKα","","0.171","0.0824","","0.342","0.0505","0.0505","","","","","","1.0829","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202730","17.028","0.004","16.175","0.004","33.771","0.007","90","","100.799","0.004","90","","9137","4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C80 H84 Cl4 Co2 N24 O24 -","- C80 H84 Cl4 Co2 N24 O24 -","- C320 H336 Cl16 Co8 N96 O96 -","4","1","","Krishnan, Subhashree Mallika; Patel, Niral M.; Knapp, Warren R.; Supkowski, Ronald M.; LaDuca, Robert L.","Oxoanion and cation effects on the structural morphology of coordination polymers incorporating a kinked organodiimine tethering ligand","CrystEngComm","2007","9","6","503","","10.1039/b701102d","","","0.71073","MoKα","","0.1027","0.0617","","","0.1545","0.1828","","","","","","1.033","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202731","16.992","0.003","15.164","0.003","17.489","0.003","90","","90","","90","","4506.3","1.4","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C20 H20 Co N6 O7 S -","- C20 H20 Co N6 O7 S -","- C160 H160 Co8 N48 O56 S8 -","8","1","","Krishnan, Subhashree Mallika; Patel, Niral M.; Knapp, Warren R.; Supkowski, Ronald M.; LaDuca, Robert L.","Oxoanion and cation effects on the structural morphology of coordination polymers incorporating a kinked organodiimine tethering ligand","CrystEngComm","2007","9","6","503","","10.1039/b701102d","","","0.71073","MoKα","","0.1085","0.0692","","","0.1518","0.1715","","","","","","1.113","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202732","24","0.02","15.522","0.016","16.523","0.017","90","","133.517","0.003","90","","4464","7","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C40 H40 Co2 N16 O14 -","- C40 H40 Co2 N16 O14 -","- C160 H160 Co8 N64 O56 -","4","1","","Krishnan, Subhashree Mallika; Patel, Niral M.; Knapp, Warren R.; Supkowski, Ronald M.; LaDuca, Robert L.","Oxoanion and cation effects on the structural morphology of coordination polymers incorporating a kinked organodiimine tethering ligand","CrystEngComm","2007","9","6","503","","10.1039/b701102d","","","0.71073","MoKα","","0.0659","0.0545","","","0.1183","0.1229","","","","","","1.094","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202733","10.5491","0.0016","14.136","0.002","16.082","0.003","87.483","0.003","86.253","0.003","89.096","0.003","2390.5","0.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H42 Cd Cl2 N12 O12 -","- C40 H42 Cd Cl2 N12 O12 -","- C80 H84 Cd2 Cl4 N24 O24 -","2","1","","Krishnan, Subhashree Mallika; Patel, Niral M.; Knapp, Warren R.; Supkowski, Ronald M.; LaDuca, Robert L.","Oxoanion and cation effects on the structural morphology of coordination polymers incorporating a kinked organodiimine tethering ligand","CrystEngComm","2007","9","6","503","","10.1039/b701102d","","","0.71073","MoKα","","0.1581","0.0543","","","0.0996","0.1366","","","","","","1.002","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202734","25.284","0.0003","25.284","0.0003","12.1961","0.0003","90","","90","","120","","6752.2","0.2","173","2","173","2","","","","","","","","5","R 3 :H","R 3","146","","","","- C93 H97 Cu3 N9 O26 -","- C93 H87 Cu3 N9 O21 -","- C279 H261 Cu9 N27 O63 -","3","0.333333","","Jeong, Kyung Seok; Kim, Sun Young; Oh, Youjin; Min, Dong Won; Kim, Jaheon; Jeong, Nakcheol","A chiral trianglular coordination complex derived from (S,S)-1,2-dimethoxy-di-4-(2?-carboxyl-5?-pyridyl)phenyl ethane and Cu(ii) by self-assembly","CrystEngComm","2007","9","4","273","","10.1039/b701121k","","","0.71073","MoKα","","0.0984","0.059","","","0.1464","0.1598","","","","","","1.039","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202735","20.8688","0.0006","18.5411","0.0005","9.8944","0.0003","90","","94.905","0.001","90","","3814.42","0.19","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H30 Cd2 N10 S6 -","- C34 H30 Cd2 N10 S6 -","- C136 H120 Cd8 N40 S24 -","4","1","","Lai, Long-Li; Wu, Chun-Han; Lu, Kuang-Lieh; Wen, Yu-Shen; Liu, Yi-Hung; Wang, Yu; Cheng, Kung-Lung; Soldatov, Dmitriy V.; Yu, Zhi; Yu, Kui","Polypseudorotaxane architecture of poly-bis[4-(N-benzyl- pyridinium)]piperazine-hexa-thiocyanato-di-cadmium(ii) with 2-D honeycomb-like [Cd(SCN)3]nn? anionic polymeric framework","CrystEngComm","2007","9","5","345","","10.1039/b701229b","","","0.71073","MoKα","","0.0219","0.0169","","","0.0419","0.0429","","","","","","1.139","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202736","41.046","0.0008","4.5649","0.0005","7.978","0.004","90","","90","0.002","90","","1494.8","0.8","295","2","295","2","","","","","","","","5","P n n m","-P 2 2n","58","","","","- C30 H34 N6 O2 S2 -","- C30 H34 N6 O2 S2 -","- C60 H68 N12 O4 S4 -","2","0.25","","Lai, Long-Li; Wu, Chun-Han; Lu, Kuang-Lieh; Wen, Yu-Shen; Liu, Yi-Hung; Wang, Yu; Cheng, Kung-Lung; Soldatov, Dmitriy V.; Yu, Zhi; Yu, Kui","Polypseudorotaxane architecture of poly-bis[4-(N-benzyl- pyridinium)]piperazine-hexa-thiocyanato-di-cadmium(ii) with 2-D honeycomb-like [Cd(SCN)3]nn? anionic polymeric framework","CrystEngComm","2007","9","5","345","","10.1039/b701229b","","","0.71073","MoKα","","0.1038","0.0764","","","0.2074","0.2333","","","","","","1.115","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202737","6.7781","0.0009","13.5566","0.0018","26.631","0.004","90","","90","","90","","2447.1","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","1-methyl-4-(2-(9-ethyl carbazol-3-yl)vinyl)pyridinium tosylate","1-methyl-4-[2-(9-ethyl carbazol-3-yl)vinyl]pyridinium tosylate","","- C29 H28 N2 O3 S -","- C29 H28 N2 O3 S -","- C116 H112 N8 O12 S4 -","4","1","","Gu, Jie; Chen, Wei-Qiang; Wada, Tatsuo; Hashizume, Daisuke; Duan, Xuan-Ming","From supermolecular sheet to helix by breaking molecular symmetry: the case of 4-[2-(carbazol-3-yl)vinyl] pyridium tosylate","CrystEngComm","2007","9","7","541","","10.1039/b701377a","","","0.71073","MoKα","","0.0731","0.0419","","","0.0942","0.1066","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202738","14.569","0.004","25.121","0.007","6.7399","0.0019","90","","96.743","0.005","90","","2449.7","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N-methyl-4-(2-(9-methyl carbazol-3-yl)vinyl)pyridinium 2- methyl-5-nitro benzenesulfonate","N-methyl-4-[2-(9-methyl carbazol-3-yl)vinyl]pyridinium 2-methyl-5-nitro benzenesulfonate","","- C28 H25 N3 O5 S -","- C28 H25 N3 O5 S -","- C112 H100 N12 O20 S4 -","4","1","","Gu, Jie; Chen, Wei-Qiang; Wada, Tatsuo; Hashizume, Daisuke; Duan, Xuan-Ming","From supermolecular sheet to helix by breaking molecular symmetry: the case of 4-[2-(carbazol-3-yl)vinyl] pyridium tosylate","CrystEngComm","2007","9","7","541","","10.1039/b701377a","","","0.71073","MoKα","","0.1072","0.0506","","","0.1049","0.1262","","","","","","1.008","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202739","6.6773","0.0006","14.0015","0.0015","24.593","0.002","90","","90","","90","","2299.3","0.4","110","","110","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","1-methyl-4-(2-(9-methyl carbazol-3-yl)vinyl)pyridinium tosylate","1-methyl-4-[2-(9-methyl carbazol-3-yl)vinyl]pyridinium tosylate","","- C28 H26 N2 O3 S -","- C28 H26 N2 O3 S -","- C112 H104 N8 O12 S4 -","4","1","","Gu, Jie; Chen, Wei-Qiang; Wada, Tatsuo; Hashizume, Daisuke; Duan, Xuan-Ming","From supermolecular sheet to helix by breaking molecular symmetry: the case of 4-[2-(carbazol-3-yl)vinyl] pyridium tosylate","CrystEngComm","2007","9","7","541","","10.1039/b701377a","","","0.71073","MoKα","","0.119","0.0628","","","0.0929","0.1077","","","","","","1.032","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202740","5.8976","0.0005","5.8184","0.0005","23.7875","0.0019","90","","90.573","0.001","90","","816.22","0.12","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H5 N O6 Zn -","- C7 H5 N O6 Zn -","- C28 H20 N4 O24 Zn4 -","4","1","","Wu, Wei-Ping; Wang, Yao-Yu; Wu, Ya-Pan; Liu, Jian-Qiang; Zeng, Xi-Rui; Shi, Qi-Zhen; Peng, Shie-Ming","Hydro(solvo)thermal synthesis, structures, luminescence of 2-D zinc(ii) and 1-D copper(ii) complexes constructed from pyridine-2,6-dicarboxylic acid N-oxide and decarboxylation of the ligand","CrystEngComm","2007","9","9","753","","10.1039/b701384a","","","0.71073","MoKα","","0.0524","0.0358","","","0.091","0.0958","","","","","","1.038","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202741","3.39","0.0007","12.59","0.003","12.17","0.002","90","","94.18","0.03","90","","518.04","0.19","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 Cu N2 O6 -","- C12 H8 Cu N2 O6 -","- C24 H16 Cu2 N4 O12 -","2","0.5","","Wu, Wei-Ping; Wang, Yao-Yu; Wu, Ya-Pan; Liu, Jian-Qiang; Zeng, Xi-Rui; Shi, Qi-Zhen; Peng, Shie-Ming","Hydro(solvo)thermal synthesis, structures, luminescence of 2-D zinc(ii) and 1-D copper(ii) complexes constructed from pyridine-2,6-dicarboxylic acid N-oxide and decarboxylation of the ligand","CrystEngComm","2007","9","9","753","","10.1039/b701384a","","","0.71073","MoKα","","0.0257","0.0238","","","0.073","0.0738","","","","","","1.045","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202742","3.7587","0.0014","3.759","0.002","13.007","0.004","90","","90","0.05","90","","183.78","0.13","","","293","","","","","","","","","4","I 4/m m m","","","","","","- Cu La1.111 O3.506 Sr0.889 -","- Cu La1.1576 O3.4776 Sr0.8422 -","- Cu2 La2.3152 O6.9552 Sr1.6844 -","2","0.0625","","Joke Hadermann; Olivier Pérez; Nicolas Créon; Claude Michel; Maryvonne Hervieu","The (3 + 2)D structure of oxygen deficient LaSrCuO3.52","Journal of Materials Chemistry","2007","17","22","2344","","10.1039/b701449j","powder diffraction","neutron","1.225","neutron","","0.0368","0.0329","","","0.0355","0.0362","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202743","24.016","0.003","7.4363","0.0006","11.1585","0.001","90","","97.587","0.012","90","","1975.4","0.3","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","Me4N+, [Ni(tfadt)2]-","","","- C12 H12 F6 N3 Ni S4 -","- C12 H12 F6 N3 Ni S4 -","- C48 H48 F24 N12 Ni4 S16 -","4","0.5","","Olivier Jeannin; Rodolphe Clérac; Marc Fourmigué","Trifluoromethyl order?disorder transition in nickel dithiolene uniform spin chains","CrystEngComm","2007","9","6","488","","10.1039/b701480e","","","0.71073","MoKα","","0.1059","0.0648","","","0.1766","0.1992","","","","","","0.993","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202744","7.6741","0.0006","18.8293","0.0019","16.2154","0.0019","90","","97.86","0.01","90","","2321.1","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Et4N+, [Ni(tfadt)2]-","","","- C16 H20 F6 N3 Ni S4 -","- C16 H8 F6 N3 Ni S4 -","- C64 H32 F24 N12 Ni4 S16 -","4","1","","Olivier Jeannin; Rodolphe Clérac; Marc Fourmigué","Trifluoromethyl order?disorder transition in nickel dithiolene uniform spin chains","CrystEngComm","2007","9","6","488","","10.1039/b701480e","","","0.71073","MoKα","","0.1336","0.0472","","","0.0999","0.1231","","","","","","0.795","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202745","16.384","0.003","7.7447","0.0015","19.192","0.004","90","","90","","90","","2435.3","0.8","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","Et4N+, Ni(tfadt)2-","","","- C16 H20 F6 N3 Ni S4 -","- C16 F6 N3 Ni S4 -","- C64 F24 N12 Ni4 S16 -","4","0.5","","Olivier Jeannin; Rodolphe Clérac; Marc Fourmigué","Trifluoromethyl order?disorder transition in nickel dithiolene uniform spin chains","CrystEngComm","2007","9","6","488","","10.1039/b701480e","","","0.71073","MoKα","","0.1686","0.0806","","","0.2238","0.2721","","","","","","0.793","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202746","8.141","0.0005","14.8045","0.001","9.7157","0.0006","90","","101.931","0.001","90","","1145.67","0.13","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H15 N O S -","- C11 H15 N O S -","- C44 H60 N4 O4 S4 -","4","1","","Kuan, Fong Sheen; Mohr, Fabian; Tadbuppa, Primjira P.; Tiekink, Edward R. T.","Principles of crystal packing in O-isopropyl-N-aryl-thiocarbamides: iPrOC(?S)N(H)C6H4-4-Y: Y = H, Cl, and Me","CrystEngComm","2007","9","7","574","","10.1039/b701489a","","","0.71069","MoKα","","0.087","0.064","","","0.153","0.166","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202747","8.105","0.0008","10.9411","0.001","11.9874","0.0012","90","","90.821","0.002","90","","1062.9","0.18","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H13 N O S -","- C10 H13 N O S -","- C40 H52 N4 O4 S4 -","4","1","","Kuan, Fong Sheen; Mohr, Fabian; Tadbuppa, Primjira P.; Tiekink, Edward R. T.","Principles of crystal packing in O-isopropyl-N-aryl-thiocarbamides: iPrOC(?S)N(H)C6H4-4-Y: Y = H, Cl, and Me","CrystEngComm","2007","9","7","574","","10.1039/b701489a","","","0.71069","MoKα","","0.067","0.052","","","0.13","0.139","","","","","","1.04","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202748","7.1307","0.0006","19.8847","0.0017","8.2842","0.0006","90","","99.827","0.001","90","","1157.4","0.16","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H12 Cl N O S -","- C10 H12 Cl N O S -","- C40 H48 Cl4 N4 O4 S4 -","4","1","","Kuan, Fong Sheen; Mohr, Fabian; Tadbuppa, Primjira P.; Tiekink, Edward R. T.","Principles of crystal packing in O-isopropyl-N-aryl-thiocarbamides: iPrOC(?S)N(H)C6H4-4-Y: Y = H, Cl, and Me","CrystEngComm","2007","9","7","574","","10.1039/b701489a","","","0.71069","MoKα","","0.059","0.044","","","0.113","0.121","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202749","16.017","0.004","10.324","0.003","12.342","0.003","90","","104.048","0.005","90","","1979.8","0.9","293","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H18 N4 -","- C28 H18 N4 -","- C112 H72 N16 -","4","1","","Li, Lei; Hu, Tong-Liang; Li, Jian-Rong; Wang, Duo-Zhi; Zeng, Yong-Fei; Bu, Xian-He","Metal?organic coordination architectures of 9,10-bis(N-benzimidazolyl)anthracene: syntheses, structures and emission properties","CrystEngComm","2007","9","5","412","","10.1039/b701551h","","","0.71073","MoKα","","0.1249","0.0476","","","0.0933","0.1214","","","","","","0.979","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202750","10.177","0.002","11.855","0.002","13.009","0.003","100.42","0.03","100.3","0.03","115.33","0.03","1336","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H20 Cl3 Cu I N4 O0.5 -","- C29 H18 Cl3 Cu I N4 O0.5 -","- C58 H36 Cl6 Cu2 I2 N8 O -","2","1","","Li, Lei; Hu, Tong-Liang; Li, Jian-Rong; Wang, Duo-Zhi; Zeng, Yong-Fei; Bu, Xian-He","Metal?organic coordination architectures of 9,10-bis(N-benzimidazolyl)anthracene: syntheses, structures and emission properties","CrystEngComm","2007","9","5","412","","10.1039/b701551h","","","0.71073","MoKα","","0.0835","0.0646","","","0.1598","0.1783","","","","","","1.058","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202751","17.163","0.01","15.442","0.009","12.133","0.007","90","","113.534","0.008","90","","2948","3","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C64 H56 Cd N10 O10 -","- C64 H56 Cd N10 O10 -","- C128 H112 Cd2 N20 O20 -","2","0.25","","Li, Lei; Hu, Tong-Liang; Li, Jian-Rong; Wang, Duo-Zhi; Zeng, Yong-Fei; Bu, Xian-He","Metal?organic coordination architectures of 9,10-bis(N-benzimidazolyl)anthracene: syntheses, structures and emission properties","CrystEngComm","2007","9","5","412","","10.1039/b701551h","","","0.71073","MoKα","","0.0562","0.0471","","","0.132","0.1423","","","","","","1.033","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202752","8.302","0.002","25.713","0.007","9.153","0.003","90","","102.842","0.005","90","","1905","0.9","294","2","294","2","","","","","","","","8","P 1 21/m 1","-P 2yb","11","","","","- C31 H21 Ag B Cl9 F4 N4 O0 -","- C31 H21 Ag B Cl9 F4 N4 -","- C62 H42 Ag2 B2 Cl18 F8 N8 -","2","0.5","","Li, Lei; Hu, Tong-Liang; Li, Jian-Rong; Wang, Duo-Zhi; Zeng, Yong-Fei; Bu, Xian-He","Metal?organic coordination architectures of 9,10-bis(N-benzimidazolyl)anthracene: syntheses, structures and emission properties","CrystEngComm","2007","9","5","412","","10.1039/b701551h","","","0.71073","MoKα","","0.1659","0.0938","","","0.2454","0.2899","","","","","","1.05","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202753","23.438","0.005","16.481","0.003","7.9237","0.0016","90","","93.64","0.03","90","","3054.6","1.1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H20 Ag Cl6 N5 O3 -","- C30 H20 Ag Cl6 N5 O3 -","- C120 H80 Ag4 Cl24 N20 O12 -","4","0.5","","Li, Lei; Hu, Tong-Liang; Li, Jian-Rong; Wang, Duo-Zhi; Zeng, Yong-Fei; Bu, Xian-He","Metal?organic coordination architectures of 9,10-bis(N-benzimidazolyl)anthracene: syntheses, structures and emission properties","CrystEngComm","2007","9","5","412","","10.1039/b701551h","","","0.71073","MoKα","","0.0778","0.0709","","","0.2012","0.2095","","","","","","1.074","","","","has coordinates,has disorder","180358","2020-10-21","18:00:00",""
"7202754","9.0079","0.0016","12.129","0.002","14.031","0.002","110.672","0.002","100.713","0.003","98.948","0.003","1367.9","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H38 Cl8 Mn N8 -","- C58 H36 Cl8 Mn N8 -","- C58 H36 Cl8 Mn N8 -","1","0.5","","Li, Lei; Hu, Tong-Liang; Li, Jian-Rong; Wang, Duo-Zhi; Zeng, Yong-Fei; Bu, Xian-He","Metal?organic coordination architectures of 9,10-bis(N-benzimidazolyl)anthracene: syntheses, structures and emission properties","CrystEngComm","2007","9","5","412","","10.1039/b701551h","","","0.71073","MoKα","","0.0979","0.0594","","","0.1451","0.1704","","","","","","1.025","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202755","12.586","0.005","16.546","0.007","26.9","0.012","90","","99.338","0.01","90","","5528","4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H40 N4 S2 -","- C22 H40 N4 S2 -","- C176 H320 N32 S16 -","8","2","","Custelcean, Radu; Engle, Nancy L.; Bonnesen, Peter V.","Crystalline hydrogen-bonded nanocolumns of cyclic thiourea octamers","CrystEngComm","2007","9","6","452","","10.1039/b701570d","","","0.71073","MoKα","","0.1558","0.0696","","","0.1388","0.163","","","","","","0.864","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202759","13.8208","0.0014","6.8015","0.0006","16.8268","0.0016","90","","103.653","0.002","90","","1537.1","0.3","571","2","571","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H10 N6 O4 Zn -","- C12 H10 N6 O4 Zn -","- C48 H40 N24 O16 Zn4 -","4","0.5","","Ghoreishi Amiri, Maryam; Mahmoudi, Ghodrat; Morsali, Ali; Hunter, Allen D.; Zeller, Matthias","Zinc(ii) nitrite coordination polymers based on rigid and flexible organic nitrogen donor ligands","CrystEngComm","2007","9","8","686","","10.1039/b701711a","","","0.71073","MoKα","","0.0321","0.03","","","0.0879","0.0895","","","","","","1.077","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202760","16.202","0.004","12.591","0.003","11.488","0.003","90","","90.283","0.004","90","","2343.5","1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 N8 O8 Zn2 -","- C20 H16 N8 O8 Zn2 -","- C80 H64 N32 O32 Zn8 -","4","1","","Ghoreishi Amiri, Maryam; Mahmoudi, Ghodrat; Morsali, Ali; Hunter, Allen D.; Zeller, Matthias","Zinc(ii) nitrite coordination polymers based on rigid and flexible organic nitrogen donor ligands","CrystEngComm","2007","9","8","686","","10.1039/b701711a","","","0.71073","MoKα","","0.0488","0.0428","","","0.123","0.1374","","","","","","1.109","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202761","10.3273","0.0008","15.0682","0.0012","19.0674","0.0015","90","","90","","90","","2967.2","0.4","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H14 N4 O4 Zn -","- C13 H14 N4 O4 Zn -","- C104 H112 N32 O32 Zn8 -","8","2","","Ghoreishi Amiri, Maryam; Mahmoudi, Ghodrat; Morsali, Ali; Hunter, Allen D.; Zeller, Matthias","Zinc(ii) nitrite coordination polymers based on rigid and flexible organic nitrogen donor ligands","CrystEngComm","2007","9","8","686","","10.1039/b701711a","","","0.71073","MoKα","","0.0261","0.0246","","","0.0613","0.0622","","","","","","1.056","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202762","6.7562","0.0003","13.1951","0.0007","33.5642","0.0017","90","","94.263","0.001","90","","2983.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22 N12 O9 Zn2 -","- C24 H22 N12 O9 Zn2 -","- C96 H88 N48 O36 Zn8 -","4","1","","Ghoreishi Amiri, Maryam; Mahmoudi, Ghodrat; Morsali, Ali; Hunter, Allen D.; Zeller, Matthias","Zinc(ii) nitrite coordination polymers based on rigid and flexible organic nitrogen donor ligands","CrystEngComm","2007","9","8","686","","10.1039/b701711a","","","0.71073","MoKα","","0.0548","0.0478","","","0.1117","0.116","","","","","","1.078","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202763","6.8528","0.0004","7.1459","0.0004","14.3017","0.0008","100.991","0.001","91.827","0.001","94.104","0.001","685","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H12 N4 O4 Zn -","- C12 H12 N4 O4 Zn -","- C24 H24 N8 O8 Zn2 -","2","1","","Ghoreishi Amiri, Maryam; Mahmoudi, Ghodrat; Morsali, Ali; Hunter, Allen D.; Zeller, Matthias","Zinc(ii) nitrite coordination polymers based on rigid and flexible organic nitrogen donor ligands","CrystEngComm","2007","9","8","686","","10.1039/b701711a","","","0.71073","MoKα","","0.022","0.0215","","","0.0571","0.0574","","","","","","1.044","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202764","18.91","0.0016","5.9777","0.0006","17.2465","0.0017","90","","96.236","0.004","90","","1938","0.3","90","1","90","1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C25 H20 N2 O3 -","- C25 H20 N2 O3 -","- C100 H80 N8 O12 -","4","1","","Wang, Jing; Ding, Liyu; Yang, Caiqin","Three concomitant polymorphs of 1?:?1 4,4?-dihydroxybenzophenone/1,2-bis(4-pyridyl)-ethylene: applications of hydrothermal method in searching polymorphs","CrystEngComm","2007","9","7","591","","10.1039/b701746d","","","0.71073","MoKα","","0.0743","0.0495","","","0.1178","0.1337","","","","","","1.002","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202765","43.6174","0.0015","5.9652","0.0002","7.4612","0.0003","90","","90","","90","","1941.3","0.12","90","1","90","1","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C25 H20 N2 O3 -","- C25 H20 N2 O3 -","- C100 H80 N8 O12 -","4","1","","Wang, Jing; Ding, Liyu; Yang, Caiqin","Three concomitant polymorphs of 1?:?1 4,4?-dihydroxybenzophenone/1,2-bis(4-pyridyl)-ethylene: applications of hydrothermal method in searching polymorphs","CrystEngComm","2007","9","7","591","","10.1039/b701746d","","","0.71073","MoKα","","0.1055","0.0508","","","0.0946","0.1136","","","","","","0.955","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202766","23.76","0.002","6.0368","0.0005","13.6085","0.0012","90","","101.123","0.003","90","","1915.3","0.3","90","1","90","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C25 H20 N2 O3 -","- C25 H20 N2 O3 -","- C100 H80 N8 O12 -","4","0.5","","Wang, Jing; Ding, Liyu; Yang, Caiqin","Three concomitant polymorphs of 1?:?1 4,4?-dihydroxybenzophenone/1,2-bis(4-pyridyl)-ethylene: applications of hydrothermal method in searching polymorphs","CrystEngComm","2007","9","7","591","","10.1039/b701746d","","","0.71073","MoKα","","0.0522","0.0416","","","0.1078","0.1177","","","","","","1.046","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202767","6.86","0.002","13.404","0.005","22.474","0.009","90","","90","","90","","2066.5","1.3","299","2","299","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C19 H13 N5 O12 -","- C19 H13 N5 O12 -","- C76 H52 N20 O48 -","4","1","","Balevicius, Vytautas; Bariseviciute, Ruta; Aidas, Kestutis; Svoboda, Ingrid; Ehrenberg, Helmut; Fuess, Hartmut","Proton transfer in hydrogen-bonded pyridine/acid systems: the role of higher aggregation.","Physical chemistry chemical physics : PCCP","2007","9","24","3181","3189","10.1039/b701775h","","","0.71073","MoKα","","0.0729","0.042","","","0.0913","0.1078","","","","","","0.952","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202768","7.9642","0.001","9.1534","0.0012","10.9628","0.0014","84.746","0.002","79.247","0.002","79.584","0.002","770.83","0.17","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H15 N3 O5 Zn -","- C15 H15 N3 O5 Zn -","- C30 H30 N6 O10 Zn2 -","2","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Supramolecular structural diversities in the metal?organic frameworks derived from pyridylamide ligands: studying the effects of ligating topologies, hydrogen bonding backbone of the ligands and counter anions","CrystEngComm","2007","9","7","548","","10.1039/b701782k","","","0.71073","MoKα","","0.0575","0.0471","","","0.124","0.138","","","","","","1.101","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202769","8.486","0.004","9.551","0.004","16.351","0.006","90","","97.79","0.02","90","","1313","1","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C11 H11 B F4.17 N3 O2 Zn0.5 -","- C11 H11 B F4.18 N3 O2 Zn0.5 -","- C44 H44 B4 F16.72 N12 O8 Zn2 -","4","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Supramolecular structural diversities in the metal?organic frameworks derived from pyridylamide ligands: studying the effects of ligating topologies, hydrogen bonding backbone of the ligands and counter anions","CrystEngComm","2007","9","7","548","","10.1039/b701782k","","","0.71073","MoKα","","0.1225","0.0667","","","0.1511","0.1757","","","","","","1.008","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202770","7.805","0.003","13.773","0.006","13.362","0.004","90","","119.81","0.017","90","","1246.3","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H9 Cl2 N3 O Zn -","- C11 H9 Cl2 N3 O Zn -","- C44 H36 Cl8 N12 O4 Zn4 -","4","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Supramolecular structural diversities in the metal?organic frameworks derived from pyridylamide ligands: studying the effects of ligating topologies, hydrogen bonding backbone of the ligands and counter anions","CrystEngComm","2007","9","7","548","","10.1039/b701782k","","","0.71073","MoKα","","0.1586","0.1014","","","0.1876","0.204","","","","","","1.174","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202771","7.8782","0.001","8.2339","0.001","9.8945","0.0012","93.223","0.002","98.037","0.002","112.535","0.002","582.76","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H9 Cd0.5 N4 O4 -","- C11 H9 Cd0.5 N4 O4 -","- C22 H18 Cd N8 O8 -","2","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Supramolecular structural diversities in the metal?organic frameworks derived from pyridylamide ligands: studying the effects of ligating topologies, hydrogen bonding backbone of the ligands and counter anions","CrystEngComm","2007","9","7","548","","10.1039/b701782k","","","0.71073","MoKα","","0.0306","0.0304","","","0.0807","0.081","","","","","","1.151","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202772","10.2806","0.001","22.399","0.002","15.2443","0.0011","90","","124.862","0.004","90","","2880.4","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H18 Cd N8 O8 -","- C22 H18 Cd N8 O8 -","- C88 H72 Cd4 N32 O32 -","4","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Supramolecular structural diversities in the metal?organic frameworks derived from pyridylamide ligands: studying the effects of ligating topologies, hydrogen bonding backbone of the ligands and counter anions","CrystEngComm","2007","9","7","548","","10.1039/b701782k","","","0.71073","MoKα","","0.0982","0.0871","","","0.1957","0.1996","","","","","","1.289","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202773","8.738","0.004","9.491","0.004","15.969","0.007","90","","92.922","0.007","90","","1322.6","1","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H9 Cl2 N3 O Zn -","- C11 H9 Cl2 N3 O Zn -","- C44 H36 Cl8 N12 O4 Zn4 -","4","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Supramolecular structural diversities in the metal?organic frameworks derived from pyridylamide ligands: studying the effects of ligating topologies, hydrogen bonding backbone of the ligands and counter anions","CrystEngComm","2007","9","7","548","","10.1039/b701782k","","","0.71073","MoKα","","0.0438","0.0341","","","0.083","0.0884","","","","","","0.894","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202774","6.203","0.003","6.7961","0.0012","6.998","0.002","90","0.017","90","0.03","90","0.03","295.01","0.17","293","2","293","2","","","","","","","","4","P n 21 m","P -2 -2bc","31","","","","- C4 H6 Cu O5 -","- C4 H6 Cu O5 -","- C8 H12 Cu2 O10 -","2","0.5","","Jorge Pasán; Joaquín Sanchiz; Francesc Lloret; Miguel Julve; Catalina Ruiz-Pérez","Crystal engineering of 3-D coordination polymers by pillaring ferromagnetic copper(ii)-methylmalonate layers","CrystEngComm","2007","9","6","478","","10.1039/b701788j","","x-ray","0.71073","MoKα","","0.0385","0.0352","","","0.0862","0.0872","","","","","","1.09","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202775","6.2854","0.0002","16.4373","0.0006","7.0129","0.0002","90","","92.594","0.002","90","","723.8","0.04","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H6 Cu N O4 -","- C6 H6 Cu N O4 -","- C24 H24 Cu4 N4 O16 -","4","1","","Jorge Pasán; Joaquín Sanchiz; Francesc Lloret; Miguel Julve; Catalina Ruiz-Pérez","Crystal engineering of 3-D coordination polymers by pillaring ferromagnetic copper(ii)-methylmalonate layers","CrystEngComm","2007","9","6","478","","10.1039/b701788j","","x-ray","0.71073","MoKα","","0.0382","0.03","","","0.0704","0.0738","","","","","","0.906","","","","has coordinates,has disorder","180358","2020-10-21","18:00:00",""
"7202776","7.2395","0.0004","19.4035","0.0014","7.3889","0.0003","90","0.005","91.844","0.005","90","0.005","1037.39","0.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 Cu N O5 -","- C9 H10 Cu N O5 -","- C36 H40 Cu4 N4 O20 -","4","1","","Jorge Pasán; Joaquín Sanchiz; Francesc Lloret; Miguel Julve; Catalina Ruiz-Pérez","Crystal engineering of 3-D coordination polymers by pillaring ferromagnetic copper(ii)-methylmalonate layers","CrystEngComm","2007","9","6","478","","10.1039/b701788j","","x-ray","0.71073","MoKα","","0.0921","0.0597","","","0.1035","0.1145","","","","","","1.052","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202777","14.144","0.003","14.144","0.003","3.8148","0.0007","90","","90","","90","","763.2","0.3","293","2","293","2","","","","","","","","5","P -4 b 2","P -4 -2ab","117","Compound 1","","","- C10 H6 Cl6 Hg N2 -","- C10 H6 Cl6 Hg N2 -","- C20 H12 Cl12 Hg2 N4 -","2","0.25","","Hu, Chunhua; Kalf, Irmgard; Englert, Ulli","Pyridine complexes of mercury(ii)halides: Implications of a soft metal center for crystal engineering.","CrystEngComm","2007","9","7","603","","10.1039/b701907f","","","0.71073","MoKα","","0.0397","0.03","","","0.0735","0.0798","","","","","","1.018","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202778","14.147","0.002","14.147","0.002","3.8871","0.0008","90","","90","","90","","778","0.2","293","2","293","2","","","","","","","","6","P -4 b 2","P -4 -2ab","117","Compound 2","","","- C10 H6 Br4 Cl2 Hg N2 -","- C10 H6 Br4 Cl2 Hg N2 -","- C20 H12 Br8 Cl4 Hg2 N4 -","2","0.25","","Hu, Chunhua; Kalf, Irmgard; Englert, Ulli","Pyridine complexes of mercury(ii)halides: Implications of a soft metal center for crystal engineering.","CrystEngComm","2007","9","7","603","","10.1039/b701907f","","","0.71073","MoKα","","0.0268","0.0233","","","0.0507","0.0516","","","","","","0.99","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202779","14.1357","0.0007","14.1357","0.0007","3.9721","0.0003","90","","90","","90","","793.7","0.08","293","2","293","2","","","","","","","","5","P -4 b 2","P -4 -2ab","117","Compound 3a","","","- C14 H18 Cl2 Hg N2 -","- C14 H18 Cl2 Hg N2 -","- C28 H36 Cl4 Hg2 N4 -","2","0.25","","Hu, Chunhua; Kalf, Irmgard; Englert, Ulli","Pyridine complexes of mercury(ii)halides: Implications of a soft metal center for crystal engineering.","CrystEngComm","2007","9","7","603","","10.1039/b701907f","","","0.71073","MoKα","","0.0236","0.0197","","","0.0487","0.0497","","","","","","1.172","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202780","3.996","0.0009","20.203","0.004","16.572","0.004","90","","95.292","0.005","90","","1332.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Compound 3b","","","- C14 H18 Cl8 Hg4 N2 -","- C14 H18 Cl8 Hg4 N2 -","- C28 H36 Cl16 Hg8 N4 -","2","0.5","","Hu, Chunhua; Kalf, Irmgard; Englert, Ulli","Pyridine complexes of mercury(ii)halides: Implications of a soft metal center for crystal engineering.","CrystEngComm","2007","9","7","603","","10.1039/b701907f","","","0.71073","MoKα","","0.07","0.0411","","","0.0896","0.0994","","","","","","1.025","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202781","4.0533","0.0009","17.987","0.004","13.77","0.003","90","","90.315","0.005","90","","1003.9","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Compound 4","","","- C5 H3 Br2 Cl2 Hg N -","- C5 H3 Br2 Cl2 Hg N -","- C20 H12 Br8 Cl8 Hg4 N4 -","4","1","","Hu, Chunhua; Kalf, Irmgard; Englert, Ulli","Pyridine complexes of mercury(ii)halides: Implications of a soft metal center for crystal engineering.","CrystEngComm","2007","9","7","603","","10.1039/b701907f","","","0.71073","MoKα","","0.0709","0.0412","","","0.0893","0.0996","","","","","","1.009","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202782","4.0004","0.0011","14.637","0.004","14.682","0.004","86.845","0.005","84.25","0.005","82.925","0.005","848.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Compound 5","","","- C10 H6 Br6 Hg N2 -","- C10 H6 Br6 Hg N2 -","- C20 H12 Br12 Hg2 N4 -","2","1","","Hu, Chunhua; Kalf, Irmgard; Englert, Ulli","Pyridine complexes of mercury(ii)halides: Implications of a soft metal center for crystal engineering.","CrystEngComm","2007","9","7","603","","10.1039/b701907f","","","0.71073","MoKα","","0.1286","0.057","","","0.1063","0.129","","","","","","0.958","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202783","8.0661","0.0008","8.8122","0.0008","12.985","0.0012","79.354","0.002","86.643","0.002","74.281","0.003","873.13","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Compound 6","","","- C14 H18 Br2 Hg N2 -","- C14 H18 Br2 Hg N2 -","- C28 H36 Br4 Hg2 N4 -","2","1","","Hu, Chunhua; Kalf, Irmgard; Englert, Ulli","Pyridine complexes of mercury(ii)halides: Implications of a soft metal center for crystal engineering.","CrystEngComm","2007","9","7","603","","10.1039/b701907f","","","0.71073","MoKα","","0.0955","0.0521","","","0.1049","0.1221","","","","","","1.017","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202784","30.27","0.007","4.2661","0.001","18.671","0.004","90","","115.47","0.004","90","","2176.7","0.9","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Compound 7","","","- C5 H3 Cl2 Hg I2 N -","- C5 H3 Cl2 Hg I2 N -","- C40 H24 Cl16 Hg8 I16 N8 -","8","1","","Hu, Chunhua; Kalf, Irmgard; Englert, Ulli","Pyridine complexes of mercury(ii)halides: Implications of a soft metal center for crystal engineering.","CrystEngComm","2007","9","7","603","","10.1039/b701907f","","","0.71073","MoKα","","0.0433","0.0341","","","0.0689","0.0716","","","","","","1.037","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202785","31.509","0.004","4.3075","0.0005","19.009","0.002","90","","115.703","0.002","90","","2324.7","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Compound 8","","","- C5 H3 Br2 Hg I2 N -","- C5 H3 Br2 Hg I2 N -","- C40 H24 Br16 Hg8 I16 N8 -","8","1","","Hu, Chunhua; Kalf, Irmgard; Englert, Ulli","Pyridine complexes of mercury(ii)halides: Implications of a soft metal center for crystal engineering.","CrystEngComm","2007","9","7","603","","10.1039/b701907f","","","0.71073","MoKα","","0.0583","0.0386","","","0.0767","0.0824","","","","","","1.03","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202786","31.055","0.003","4.3117","0.0004","19.1185","0.0018","90","","115.52","0.002","90","","2310.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Compound 9a","","","- C7 H9 Hg I2 N -","- C7 H9 Hg I2 N -","- C56 H72 Hg8 I16 N8 -","8","1","","Hu, Chunhua; Kalf, Irmgard; Englert, Ulli","Pyridine complexes of mercury(ii)halides: Implications of a soft metal center for crystal engineering.","CrystEngComm","2007","9","7","603","","10.1039/b701907f","","","0.71073","MoKα","","0.0724","0.0418","","","0.0919","0.1025","","","","","","0.987","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202787","8.2309","0.0006","9.1784","0.0007","13.092","0.001","79.229","0.003","88.173","0.003","74.877","0.003","937.83","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Compound 9b","","","- C14 H18 Hg I2 N2 -","- C14 H18 Hg I2 N2 -","- C28 H36 Hg2 I4 N4 -","2","1","","Hu, Chunhua; Kalf, Irmgard; Englert, Ulli","Pyridine complexes of mercury(ii)halides: Implications of a soft metal center for crystal engineering.","CrystEngComm","2007","9","7","603","","10.1039/b701907f","","","0.71073","MoKα","","0.0944","0.0456","","","0.0886","0.1042","","","","","","0.968","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202788","4.7566","0.0012","6.225","0.002","10.116","0.017","72.97","0.06","85.49","0.08","80.83","0.03","282.6","0.5","298","2","298","2","","","","","","","","4","P 1","P 1","1","","","","- C10 H12 N2 O3 -","- C10 H12 N2 O3 -","- C10 H12 N2 O3 -","1","1","","Erik Schwartz; Heather J. Kitto; René de Gelder; Roeland J. M. Nolte; Alan E. Rowan; Jeroen J. L. M. Cornelissen","Synthesis, characterisation and chiroptical properties of ?click?able polyisocyanopeptides","Journal of Materials Chemistry","2007","17","19","1876","","10.1039/b701922j","","","0.71073","MoKα","","0.1154","0.0698","","0.1591","0.1399","0.1591","","","1.026","","","1.026","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202789","9.1435","0.0016","11.0699","0.0019","15.513","0.003","80.882","0.003","80.403","0.003","86.436","0.003","1527.6","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H21 F12 Hg N11 O2 P2 -","- C20 H21 F12 Hg N11 O2 P2 -","- C40 H42 F24 Hg2 N22 O4 P4 -","2","1","","Lee, Kwang-Ming; Chen, Jack C. C.; Huang, Chao-June; Lin, Ivan J. B.","Rectangular architectures formed by acyclic diamido-metal-N-heterocyclic carbenes with skewed conformation","CrystEngComm","2007","9","4","278","","10.1039/b702032p","","","0.71073","MoKα","","0.0367","0.0304","","","0.0747","0.0768","","","","","","1.05","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202790","8.6944","0.0006","13.1067","0.0011","13.2853","0.0009","77.141","0.006","87.457","0.007","77.036","0.006","1438.31","0.19","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H18 F12 Hg N10 O2 P2 -","- C18 H18 F12 Hg N10 O2 P2 -","- C36 H36 F24 Hg2 N20 O4 P4 -","2","1","","Lee, Kwang-Ming; Chen, Jack C. C.; Huang, Chao-June; Lin, Ivan J. B.","Rectangular architectures formed by acyclic diamido-metal-N-heterocyclic carbenes with skewed conformation","CrystEngComm","2007","9","4","278","","10.1039/b702032p","","","0.71073","MoKα","","0.0617","0.0529","","","0.122","0.125","","","","","","1.212","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202791","8.6505","0.0004","12.0994","0.0005","12.9051","0.0006","81.206","0.001","77.8","0.001","87.34","0.001","1304.56","0.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H18 B2 F8 Hg N10 O2 -","- C18 H18 B2 F8 Hg N10 O2 -","- C36 H36 B4 F16 Hg2 N20 O4 -","2","1","","Lee, Kwang-Ming; Chen, Jack C. C.; Huang, Chao-June; Lin, Ivan J. B.","Rectangular architectures formed by acyclic diamido-metal-N-heterocyclic carbenes with skewed conformation","CrystEngComm","2007","9","4","278","","10.1039/b702032p","","","0.71073","MoKα","","0.0291","0.0271","","","0.0803","0.0816","","","","","","1.046","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202792","18.305","0.002","11.4053","0.0013","7.8859","0.0009","90","","91.556","0.002","90","","1645.8","0.3","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C22 H34 Ag F6 N10 O4 P S2 -","- C22 H34 Ag F6 N10 O4 P S2 -","- C44 H68 Ag2 F12 N20 O8 P2 S4 -","2","0.5","","Lee, Kwang-Ming; Chen, Jack C. C.; Huang, Chao-June; Lin, Ivan J. B.","Rectangular architectures formed by acyclic diamido-metal-N-heterocyclic carbenes with skewed conformation","CrystEngComm","2007","9","4","278","","10.1039/b702032p","","","0.71073","MoKα","","0.0893","0.0468","","","0.1364","0.1675","","","","","","1.065","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202793","5.3605","0.0003","8.1395","0.0004","8.8621","0.0005","84.19","0.004","73.687","0.005","88.389","0.005","369.2","0.04","104","2","104","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H18 Cl2 N2 O2 -","- C14 H18 Cl2 N2 O2 -","- C14 H18 Cl2 N2 O2 -","1","0.5","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Structural consequences of benzidine dihydrochloride substitution in the solid state","CrystEngComm","2007","9","11","1029","","10.1039/b702072d","","","0.71073","MoKα","","0.0228","0.0205","","","0.0591","0.0597","","","","","","1.113","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202794","7.5615","0.0006","9.542","0.0008","19.8392","0.0016","90","","90","","90","","1431.4","0.2","100","2","100","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C12 H12 Cl4 N2 -","- C12 H12 Cl4 N2 -","- C48 H48 Cl16 N8 -","4","1","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Structural consequences of benzidine dihydrochloride substitution in the solid state","CrystEngComm","2007","9","11","1029","","10.1039/b702072d","","","0.71073","MoKα","","0.0684","0.0344","","","0.0643","0.0935","","","","","","0.892","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202795","7.5938","0.0002","9.5918","0.0003","20.0837","0.0007","90","","90","","90","","1462.86","0.08","103","2","103","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C14 H18 Cl2 N2 -","- C14 H18 Cl2 N2 -","- C56 H72 Cl8 N8 -","4","1","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Structural consequences of benzidine dihydrochloride substitution in the solid state","CrystEngComm","2007","9","11","1029","","10.1039/b702072d","","","0.71073","MoKα","","0.0243","0.0209","","","0.05","0.0505","","","","","","1.001","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202796","8.1288","0.0006","8.0393","0.0005","45.532","0.003","90","","90","","90","","2975.5","0.3","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H18 Cl2 N2 -","- C14 H18 Cl2 N2 -","- C112 H144 Cl16 N16 -","8","1","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Structural consequences of benzidine dihydrochloride substitution in the solid state","CrystEngComm","2007","9","11","1029","","10.1039/b702072d","","","0.71073","MoKα","","0.0774","0.0434","","","0.0992","0.1254","","","","","","1.046","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202797","16.221","0.002","16.221","0.002","6.7461","0.0012","90","","90","","90","","1775","0.4","100","2","100","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C16 H22 Cl2 N2 O2 -","- C16 H22 Cl2 N2 O2 -","- C64 H88 Cl8 N8 O8 -","4","0.5","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Structural consequences of benzidine dihydrochloride substitution in the solid state","CrystEngComm","2007","9","11","1029","","10.1039/b702072d","","","0.71073","MoKα","","0.1268","0.0739","","","0.1799","0.2093","","","","","","1.004","","","","has coordinates,has disorder","180358","2020-10-21","18:00:00",""
"7202798","14.938","0.002","5.2272","0.0008","13.1403","0.0016","90","","109.792","0.013","90","","965.4","0.2","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C12 H16 Cl6 N2 O3 -","- C12 H16 Cl6 N2 O3 -","- C24 H32 Cl12 N4 O6 -","2","0.5","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Structural consequences of benzidine dihydrochloride substitution in the solid state","CrystEngComm","2007","9","11","1029","","10.1039/b702072d","","","0.71073","MoKα","","0.0673","0.0284","","","0.0504","0.0541","","","","","","0.789","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202799","21.716","0.0018","21.6971","0.0016","7.6449","0.0006","90","","93.524","0.006","90","","3595.3","0.5","170","2","170","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H42 Cl8 N8 O4 -","- C24 H42 Cl8 N8 O4 -","- C96 H168 Cl32 N32 O16 -","4","1","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Structural consequences of benzidine dihydrochloride substitution in the solid state","CrystEngComm","2007","9","11","1029","","10.1039/b702072d","","","0.71073","MoKα","","0.0982","0.0345","","","0.0689","0.0834","","","","","","0.769","","","","has coordinates","180358","2020-10-21","18:00:00",""
"7202800","29.02","0.003","7.2098","0.0007","7.345","0.0007","90","","94.869","0.008","90","","1531.2","0.3","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 Cl2 F8 N2 O2 -","- C12 H10 Cl2 F8 N2 O2 -","- C48 H40 Cl8 F32 N8 O8 -","4","1","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Structural consequences of benzidine dihydrochloride substitution in the solid state","CrystEngComm","2007","9","11","1029","","10.1039/b702072d","","","0.71073","MoKα","","0.0421","0.0265","","","0.0664","0.0747","","","","","","1.014","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202801","12.8813","0.0006","7.2351","0.0002","15.5983","0.0008","90","","101.215","0.004","90","","1425.96","0.11","104","2","104","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H9 Cl F8 N2 O -","- C13 H9 Cl F8 N2 O -","- C52 H36 Cl4 F32 N8 O4 -","4","1","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Structural consequences of benzidine dihydrochloride substitution in the solid state","CrystEngComm","2007","9","11","1029","","10.1039/b702072d","","","0.71073","MoKα","","0.0301","0.0241","","","0.0709","0.0721","","","","","","1.051","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202802","10.7907","0.0004","8.9839","0.0004","23.175","0.0008","90","","90","","90","","2246.64","0.15","104","2","104","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C12 H4 F8 N2 -","- C12 H4 F8 N2 -","- C96 H32 F64 N16 -","8","1","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Structural consequences of benzidine dihydrochloride substitution in the solid state","CrystEngComm","2007","9","11","1029","","10.1039/b702072d","","","0.71073","MoKα","","0.04","0.0273","","","0.0802","0.0823","","","","","","1.002","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202803","23.811","0.006","6.1672","0.0014","4.9037","0.0013","90","","100.84","0.02","90","","707.2","0.3","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C14 H18 Cl2 N2 -","- C14 H18 Cl2 N2 -","- C28 H36 Cl4 N4 -","2","0.5","","Dobrzycki, Lukasz; Woźniak, Krzysztof","Structural consequences of benzidine dihydrochloride substitution in the solid state","CrystEngComm","2007","9","11","1029","","10.1039/b702072d","","","0.71073","MoKα","","0.034","0.0284","","","0.0732","0.0747","","","","","","1.073","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202804","12.336","0.003","13.411","0.003","22.475","0.005","76.27","0.03","75.26","0.03","67.95","0.03","3290.9","1.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H34 La4 N8 O40 -","- C58 H26 La4 N8 O40 -","- C116 H52 La8 N16 O80 -","2","1","","Ye, Jun-Wei; Wang, Jia; Zhang, Jing-Ying; Zhang, Ping; Wang, Yue","Construction of 2-D lanthanide coordination frameworks: syntheses, structures and luminescent property","CrystEngComm","2007","9","6","515","","10.1039/b702106b","","","0.71073","MoKα","","0.0446","0.0278","","","0.0735","0.0889","","","","","","1.038","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202805","12.275","0.003","13.386","0.003","22.313","0.005","76.23","0.03","75.33","0.03","68.03","0.03","3247","1.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H34 N8 O40 Pr4 -","- C58 H26 N8 O40 Pr4 -","- C116 H52 N16 O80 Pr8 -","2","1","","Ye, Jun-Wei; Wang, Jia; Zhang, Jing-Ying; Zhang, Ping; Wang, Yue","Construction of 2-D lanthanide coordination frameworks: syntheses, structures and luminescent property","CrystEngComm","2007","9","6","515","","10.1039/b702106b","","","0.71073","MoKα","","0.0454","0.0346","","","0.0985","0.1064","","","","","","1.096","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202806","9.798","0.002","10.729","0.002","13.238","0.003","94.33","0.03","102.05","0.03","115.42","0.03","1207.5","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H15 La N3 O14 -","- C21 H11 La N3 O14 -","- C42 H22 La2 N6 O28 -","2","1","","Ye, Jun-Wei; Wang, Jia; Zhang, Jing-Ying; Zhang, Ping; Wang, Yue","Construction of 2-D lanthanide coordination frameworks: syntheses, structures and luminescent property","CrystEngComm","2007","9","6","515","","10.1039/b702106b","","","0.71073","MoKα","","0.0587","0.0474","","","0.1305","0.1353","","","","","","0.999","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202807","9.978","0.002","10.9","0.002","13.237","0.003","74.72","0.03","78.43","0.03","62.9","0.03","1230.9","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H19 N3 O16 Pr -","- C21 H11 N3 O16 Pr -","- C42 H22 N6 O32 Pr2 -","2","1","","Ye, Jun-Wei; Wang, Jia; Zhang, Jing-Ying; Zhang, Ping; Wang, Yue","Construction of 2-D lanthanide coordination frameworks: syntheses, structures and luminescent property","CrystEngComm","2007","9","6","515","","10.1039/b702106b","","","0.71073","MoKα","","0.0458","0.0425","","","0.1145","0.1171","","","","","","1.114","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202808","9.885","0.002","10.786","0.002","13.178","0.003","94.95","0.03","101.36","0.03","116.45","0.03","1208.8","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H19 N3 Nd O16 -","- C21 H11 N3 Nd O16 -","- C42 H22 N6 Nd2 O32 -","2","1","","Ye, Jun-Wei; Wang, Jia; Zhang, Jing-Ying; Zhang, Ping; Wang, Yue","Construction of 2-D lanthanide coordination frameworks: syntheses, structures and luminescent property","CrystEngComm","2007","9","6","515","","10.1039/b702106b","","","0.71073","MoKα","","0.0424","0.0383","","","0.1067","0.1128","","","","","","0.937","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202809","8.6638","0.0017","9.3886","0.0019","13.781","0.003","85.33","0.03","78.1","0.03","74.43","0.03","1056.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H11 N3 O12 Sm -","- C21 H11 N3 O12 Sm -","- C42 H22 N6 O24 Sm2 -","2","1","","Ye, Jun-Wei; Wang, Jia; Zhang, Jing-Ying; Zhang, Ping; Wang, Yue","Construction of 2-D lanthanide coordination frameworks: syntheses, structures and luminescent property","CrystEngComm","2007","9","6","515","","10.1039/b702106b","","","0.71073","MoKα","","0.0472","0.0363","","","0.0946","0.109","","","","","","1.065","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202810","8.6559","0.0017","9.3993","0.0019","13.812","0.003","85.16","0.03","78.16","0.03","74.51","0.03","1059.4","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H11 Eu N3 O12 -","- C21 H11 Eu N3 O12 -","- C42 H22 Eu2 N6 O24 -","2","1","","Ye, Jun-Wei; Wang, Jia; Zhang, Jing-Ying; Zhang, Ping; Wang, Yue","Construction of 2-D lanthanide coordination frameworks: syntheses, structures and luminescent property","CrystEngComm","2007","9","6","515","","10.1039/b702106b","","","0.71073","MoKα","","0.0238","0.0219","","","0.0639","0.0808","","","","","","1.082","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202811","8.6598","0.0017","9.3878","0.0019","13.796","0.003","85.1","0.03","78.24","0.03","74.21","0.03","1056.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H11 N3 O12 Tb -","- C21 H11 N3 O12 Tb -","- C42 H22 N6 O24 Tb2 -","2","1","","Ye, Jun-Wei; Wang, Jia; Zhang, Jing-Ying; Zhang, Ping; Wang, Yue","Construction of 2-D lanthanide coordination frameworks: syntheses, structures and luminescent property","CrystEngComm","2007","9","6","515","","10.1039/b702106b","","","0.71073","MoKα","","0.0318","0.0293","","","0.1037","0.1074","","","","","","1.078","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202812","8.6712","0.0017","9.3753","0.0019","13.804","0.003","84.93","0.03","77.99","0.03","73.92","0.03","1054.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H11 Ho N3 O12 -","- C21 H11 Ho N3 O12 -","- C42 H22 Ho2 N6 O24 -","2","1","","Ye, Jun-Wei; Wang, Jia; Zhang, Jing-Ying; Zhang, Ping; Wang, Yue","Construction of 2-D lanthanide coordination frameworks: syntheses, structures and luminescent property","CrystEngComm","2007","9","6","515","","10.1039/b702106b","","","0.71073","MoKα","","0.0253","0.0228","","","0.0737","0.0794","","","","","","1.042","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202813","8.6721","0.0017","9.3671","0.0019","13.849","0.003","84.74","0.03","77.93","0.03","73.63","0.03","1054.9","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H11 N3 O12 Yb -","- C21 H11 N3 O12 Yb -","- C42 H22 N6 O24 Yb2 -","2","1","","Ye, Jun-Wei; Wang, Jia; Zhang, Jing-Ying; Zhang, Ping; Wang, Yue","Construction of 2-D lanthanide coordination frameworks: syntheses, structures and luminescent property","CrystEngComm","2007","9","6","515","","10.1039/b702106b","","","0.71073","MoKα","","0.0504","0.0392","","","0.1123","0.1346","","","","","","1.066","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202814","12.277","0.002","16.356","0.002","23.341","0.004","90","","90","","90","","4686.9","1.2","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H25 Cl O3 P2 -","- C24 H25 Cl O3 P2 -","- C192 H200 Cl8 O24 P16 -","8","1","","Mátyás Czugler; Tamás Körtvélyesi; László Fábián; Melinda Sipos; György Keglevich","Intra- and intermolecular interactions and water pincer in the crystal structure of a 3-P(O)Ph2 substituted 1,2,3,6-tetrahydrophosphinine oxide hydrate","CrystEngComm","2007","9","7","561","","10.1039/b702137b","","","0.7107","MoKα","","0.0466","0.0368","","","0.0979","0.1021","","","","","","1.066","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202815","13.941","0.003","15.075","0.003","15.075","0.003","82.15","0.03","87.23","0.03","87.23","0.03","3132","1.1","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H24 Cu2 N2 O8 -","- C38 H24 Cu2 N2 O8 -","- C76 H48 Cu4 N4 O16 -","2","1","","Pichon, Anne; Fierro, Claudio Mendicute; Nieuwenhuyzen, Mark; James, Stuart L.","A pillared-grid MOF with large pores based on the Cu2(O2CR)4 paddle-wheel","CrystEngComm","2007","9","6","449","","10.1039/b702176c","","","0.71073","MoKα","","0.2103","0.1425","","","0.3683","0.4106","","","","","","1.088","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202816","8.6425","0.0017","13.656","0.003","11.778","0.002","90","","109.65","0.03","90","","1309.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 N3 O -","- C14 H15 N3 O -","- C56 H60 N12 O4 -","4","1","","Wu, Biao; Huang, Xiaojuan; Xia, Yazhao; Yang, Xiao-Juan; Janiak, Christoph","Oxo-anion binding by protonated (dimethylphenyl)(pyridyl)ureas","CrystEngComm","2007","9","8","676","","10.1039/b702278f","","","0.71073","MoKα","","0.1191","0.0597","","","0.1321","0.1508","","","","","","0.947","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202817","13.241","0.003","7.9263","0.0016","13.576","0.003","90","","110.66","0.03","90","","1333.2","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H17 N3 O2 -","- C14 H17 N3 O2 -","- C56 H68 N12 O8 -","4","1","","Wu, Biao; Huang, Xiaojuan; Xia, Yazhao; Yang, Xiao-Juan; Janiak, Christoph","Oxo-anion binding by protonated (dimethylphenyl)(pyridyl)ureas","CrystEngComm","2007","9","8","676","","10.1039/b702278f","","","0.71073","MoKα","","0.0722","0.0482","","","0.1292","0.1378","","","","","","1.064","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202818","7.6682","0.0006","12.761","0.001","16.8947","0.0012","90","","90","","90","","1653.2","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H18 Cl N3 O6 -","- C14 H18 Cl N3 O6 -","- C56 H72 Cl4 N12 O24 -","4","1","","Wu, Biao; Huang, Xiaojuan; Xia, Yazhao; Yang, Xiao-Juan; Janiak, Christoph","Oxo-anion binding by protonated (dimethylphenyl)(pyridyl)ureas","CrystEngComm","2007","9","8","676","","10.1039/b702278f","","","0.71073","MoKα","","0.088","0.0675","","","0.1912","0.2157","","","","","","1.062","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202819","10.0234","0.0017","10.8158","0.0018","14.61","0.002","90","","99.832","0.003","90","","1560.6","0.4","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C14 H18 N4 O5 -","- C14 H18 N4 O5 -","- C56 H72 N16 O20 -","4","1","","Wu, Biao; Huang, Xiaojuan; Xia, Yazhao; Yang, Xiao-Juan; Janiak, Christoph","Oxo-anion binding by protonated (dimethylphenyl)(pyridyl)ureas","CrystEngComm","2007","9","8","676","","10.1039/b702278f","","","0.71073","MoKα","","0.0441","0.0354","","","0.0977","0.1021","","","","","","1.051","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202820","14.118","0.003","16.665","0.003","25.163","0.005","90","","90","","90","","5920","2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C28 H32 N6 O6 S -","- C28 H32 N6 O6 S -","- C224 H256 N48 O48 S8 -","8","1","","Wu, Biao; Huang, Xiaojuan; Xia, Yazhao; Yang, Xiao-Juan; Janiak, Christoph","Oxo-anion binding by protonated (dimethylphenyl)(pyridyl)ureas","CrystEngComm","2007","9","8","676","","10.1039/b702278f","","","0.71073","MoKα","","0.1799","0.0532","","","0.1272","0.1567","","","","","","0.797","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202821","11.659","0.002","12.283","0.003","21.669","0.004","90","","90","","90","","3103.2","1.1","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H16 Cl N3 O5 -","- C14 H16 Cl N3 O5 -","- C112 H128 Cl8 N24 O40 -","8","1","","Wu, Biao; Huang, Xiaojuan; Xia, Yazhao; Yang, Xiao-Juan; Janiak, Christoph","Oxo-anion binding by protonated (dimethylphenyl)(pyridyl)ureas","CrystEngComm","2007","9","8","676","","10.1039/b702278f","","","0.71073","MoKα","","0.1432","0.0567","","","0.1642","0.1922","","","","","","0.85","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202822","12.6196","0.0018","17.378","0.002","26.551","0.004","90.019","0.01","98.764","0.011","92.938","0.01","5747","1.4","120","2","120","2","","","","","","","","6","P -1","-P 1","2","Dr. S. G. Carling/Dr. L. Martin","","","- C138 H120 Fe8 Na18 O120 S72 -","- C138 H120 Fe8 Na18 O120 S72 -","- C138 H120 Fe8 Na18 O120 S72 -","1","0.5","","Martin, Lee; Day, Peter; Clegg, William; Harrington, Ross W.; Horton, Peter N.; Bingham, Ann; Hursthouse, Michael B.; McMillan, Paul; Firth, Steven","Multi-layered molecular charge-transfer salts containing alkali metal ions","Journal of Materials Chemistry","2007","17","31","3324","","10.1039/b702442h","","","0.71073","MoKα","","0.2117","0.1026","","","0.1685","0.2079","","","","","","1.063","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202823","32.9933","0.0011","11.0441","0.0004","20.7262","0.0007","90","","104.622","0.001","90","","7307.6","0.4","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H68 Fe K1.5 O27 S20 -","- C49 H56 Fe K1.5 O27 S20 -","- C196 H224 Fe4 K6 O108 S80 -","4","1","","Martin, Lee; Day, Peter; Clegg, William; Harrington, Ross W.; Horton, Peter N.; Bingham, Ann; Hursthouse, Michael B.; McMillan, Paul; Firth, Steven","Multi-layered molecular charge-transfer salts containing alkali metal ions","Journal of Materials Chemistry","2007","17","31","3324","","10.1039/b702442h","","","0.6712","synchrotron","","0.0596","0.0424","","","0.1037","0.1126","","","","","","1.031","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7202824","14.2158","0.0004","14.2158","0.0004","9.4244","0.0002","90","","90","","120","","1649.4","0.07","150","2","150","2","","","","","","","","5","P -3 1 c","-P 3 2c","163","tris(2,2'-bipyridine-3,3-diol-H)cobalt(iii) hydrate","","","- C30 H23 Co N6 O7 -","- C30 H22.98 Co N6 O6.99 -","- C60 H45.96 Co2 N12 O13.98 -","2","0.166667","","Stephenson, Maria D.; Hardie, Michaele J.","Network structures with 2,2?-bipyridine-3,3?diol: a discrete Co(III) complex that forms a porous 3-D hydrogen bonded network, and Cu(ii) coordination chains","CrystEngComm","2007","9","6","496","","10.1039/b702509m","","","0.71073","MoKα","","0.06","0.0575","","","0.2134","0.2173","","","","","","1.257","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202825","14.311","0.002","14.311","0.002","9.5165","0.0019","90","","90","","120","","1687.9","0.5","150","2","150","2","","","","","","","","5","P -3 1 c","-P 3 2c","163","tris(2,2'-bipyridine-3,3'-diol-H)cobalt(iii)","","","- C30 H21 Co N6 O6 -","- C30 H21 Co N6 O6 -","- C60 H42 Co2 N12 O12 -","2","0.166667","","Stephenson, Maria D.; Hardie, Michaele J.","Network structures with 2,2?-bipyridine-3,3?diol: a discrete Co(III) complex that forms a porous 3-D hydrogen bonded network, and Cu(ii) coordination chains","CrystEngComm","2007","9","6","496","","10.1039/b702509m","","","0.71073","MoKα","","0.1372","0.1321","","","0.454","0.4634","","","","","","2.358","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202826","14.1281","0.0003","14.1281","0.0003","9.4484","0.0002","90","","90","","120","","1633.26","0.06","30","2","30","2","","","","","","","","5","P -3 1 c","-P 3 2c","163","tris(2,2'-bipyridine-3,3-diol-H)cobalt(iii) hydrate","","","- C30 H23 Co N6 O7 -","- C30 H22.98 Co N6 O6.99 -","- C60 H45.96 Co2 N12 O13.98 -","2","0.166667","","Stephenson, Maria D.; Hardie, Michaele J.","Network structures with 2,2?-bipyridine-3,3?diol: a discrete Co(III) complex that forms a porous 3-D hydrogen bonded network, and Cu(ii) coordination chains","CrystEngComm","2007","9","6","496","","10.1039/b702509m","","","0.71073","MoKα","","0.0798","0.0628","","","0.1927","0.2086","","","","","","1.102","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202827","14.2706","0.0005","14.2706","0.0005","9.4516","0.0004","90","","90","","120","","1666.94","0.11","150","2","150","2","","","","","","","","6","P -3 1 c","-P 3 2c","163","tris(2,2'-bipyridine-3,3-diol-H)cobalt(iii) 1,2- dibromobenzene clathrate","","","- C36 H25 Br2 Co N6 O6 -","- C36 H21 Br2.04 Co N6 O6 -","- C72 H42 Br4.08 Co2 N12 O12 -","2","0.166667","","Stephenson, Maria D.; Hardie, Michaele J.","Network structures with 2,2?-bipyridine-3,3?diol: a discrete Co(III) complex that forms a porous 3-D hydrogen bonded network, and Cu(ii) coordination chains","CrystEngComm","2007","9","6","496","","10.1039/b702509m","","","0.71073","MoKα","","0.0694","0.0495","","","0.125","0.1378","","","","","","1.054","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202828","13.1259","0.0003","13.1259","0.0003","22.2808","0.0006","90","","90","","90","","3838.74","0.16","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","(2,2'-bipyridine-3,3'-diol -H)chlorocopper(ii)","","","- C10 H7 Cl Cu N2 O2 -","- C10 H7 Cl Cu N2 O2 -","- C160 H112 Cl16 Cu16 N32 O32 -","16","1","","Stephenson, Maria D.; Hardie, Michaele J.","Network structures with 2,2?-bipyridine-3,3?diol: a discrete Co(III) complex that forms a porous 3-D hydrogen bonded network, and Cu(ii) coordination chains","CrystEngComm","2007","9","6","496","","10.1039/b702509m","","","0.71073","MoKα","","0.0467","0.0364","","","0.0887","0.0949","","","","","","1.074","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202829","13.2775","0.0001","13.2775","0.0001","22.4184","0.0003","90","","90","","90","","3952.18","0.07","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","(2,2'-bipyridine-3,3'-diol-H)bromocopper(ii)","","","- C10 H7 Br Cu N2 O2 -","- C10 H7 Br Cu N2 O2 -","- C160 H112 Br16 Cu16 N32 O32 -","16","1","","Stephenson, Maria D.; Hardie, Michaele J.","Network structures with 2,2?-bipyridine-3,3?diol: a discrete Co(III) complex that forms a porous 3-D hydrogen bonded network, and Cu(ii) coordination chains","CrystEngComm","2007","9","6","496","","10.1039/b702509m","","","0.71073","MoKα","","0.0562","0.0539","","","0.1403","0.1413","","","","","","1.287","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202830","9.196","0.0002","10.6603","0.0003","11.4383","0.0003","90","","103.196","0.001","90","","1091.71","0.05","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(2,2'-bipyridine-3,3'-diol-H)nitrocopper(ii)","","","- C10 H7 Cu N3 O5 -","- C10 H7 Cu N3 O5 -","- C40 H28 Cu4 N12 O20 -","4","1","","Stephenson, Maria D.; Hardie, Michaele J.","Network structures with 2,2?-bipyridine-3,3?diol: a discrete Co(III) complex that forms a porous 3-D hydrogen bonded network, and Cu(ii) coordination chains","CrystEngComm","2007","9","6","496","","10.1039/b702509m","","","0.71073","MoKα","","0.0376","0.0342","","","0.0944","0.0973","","","","","","1.035","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202831","6.4055","0.0013","9.589","0.002","13.479","0.005","78.22","0.03","86.37","0.03","73.407","0.015","776.7","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H7 F4 I2 N O2 -","- C13 H7 F4 I2 N O2 -","- C26 H14 F8 I4 N2 O4 -","2","1","","Russo, Luca; Biella, Serena; Lahtinen, Manu; Liantonio, Rosalba; Metrangolo, Pierangelo; Resnati, Giuseppe; Rissanen, Kari","Solution stoichiometry determines crystal stoichiometry in halogen-bonded supramolecular complexes","CrystEngComm","2007","9","5","341","","10.1039/b702512m","","","0.71073","MoKα","","0.0385","0.027","","","0.0415","0.0459","","","","","","1.118","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202832","4.1581","0.0004","10.7974","0.0008","12.7958","0.0019","91.102","0.011","97.913","0.012","90.912","0.008","568.81","0.11","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H14 F4 I2 N2 O4 -","- C20 H14 F4 I2 N2 O4 -","- C20 H14 F4 I2 N2 O4 -","1","0.5","","Russo, Luca; Biella, Serena; Lahtinen, Manu; Liantonio, Rosalba; Metrangolo, Pierangelo; Resnati, Giuseppe; Rissanen, Kari","Solution stoichiometry determines crystal stoichiometry in halogen-bonded supramolecular complexes","CrystEngComm","2007","9","5","341","","10.1039/b702512m","","","0.71073","MoKα","","0.022","0.0163","","","0.0365","0.0404","","","","","","1.179","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202833","14.3627","0.0014","7.0254","0.0007","16.8441","0.0016","90","","98.104","0.002","90","","1682.7","0.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Hg N6 S2 -","- C14 H10 Hg N6 S2 -","- C56 H40 Hg4 N24 S8 -","4","0.5","","Mahmoudi, Ghodrat; Morsali, Ali; Hunter, Allen D.; Zeller, Matthias","Mercury(ii) coordination polymers generated from 1,4-bis(2 or 3 or 4-pyridyl)-2,3-diaza-1,3-butadiene ligands","CrystEngComm","2007","9","8","704","","10.1039/b702569f","","","0.71073","MoKα","","0.0174","0.0172","","","0.0425","0.0425","","","","","","1.102","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202834","16.1971","0.0007","12.6635","0.0005","7.7778","0.0003","90","","95.58","0.001","90","","1587.76","0.11","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 Hg N6 S2 -","- C14 H10 Hg N6 S2 -","- C56 H40 Hg4 N24 S8 -","4","1","","Mahmoudi, Ghodrat; Morsali, Ali; Hunter, Allen D.; Zeller, Matthias","Mercury(ii) coordination polymers generated from 1,4-bis(2 or 3 or 4-pyridyl)-2,3-diaza-1,3-butadiene ligands","CrystEngComm","2007","9","8","704","","10.1039/b702569f","","","0.71073","MoKα","","0.0241","0.022","","","0.0481","0.0553","","","","","","1.139","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202835","4.9173","0.0004","23.3133","0.0017","12.9459","0.0009","90","","93.332","0.001","90","","1481.59","0.19","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 Br2 Hg N4 -","- C12 H10 Br2 Hg N4 -","- C48 H40 Br8 Hg4 N16 -","4","1","","Mahmoudi, Ghodrat; Morsali, Ali; Hunter, Allen D.; Zeller, Matthias","Mercury(ii) coordination polymers generated from 1,4-bis(2 or 3 or 4-pyridyl)-2,3-diaza-1,3-butadiene ligands","CrystEngComm","2007","9","8","704","","10.1039/b702569f","","","0.71073","MoKα","","0.0295","0.0241","","","0.0532","0.0548","","","","","","1.041","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202836","8.3698","0.0011","14.932","0.002","11.9038","0.0016","90","","90","","90","","1487.7","0.3","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C12 H10 Br2 Hg N4 -","- C12 H10 Br2 Hg N4 -","- C48 H40 Br8 Hg4 N16 -","4","0.5","","Mahmoudi, Ghodrat; Morsali, Ali; Hunter, Allen D.; Zeller, Matthias","Mercury(ii) coordination polymers generated from 1,4-bis(2 or 3 or 4-pyridyl)-2,3-diaza-1,3-butadiene ligands","CrystEngComm","2007","9","8","704","","10.1039/b702569f","","","0.71073","MoKα","","0.0323","0.0292","","","0.0761","0.0777","","","","","","1.059","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202837","4.0783","0.0008","9.1943","0.0017","11.753","0.002","87.235","0.003","88.002","0.003","85.696","0.003","438.73","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C6 H5 Br2 Hg N2 -","- C6 H5 Br2 Hg N2 -","- C12 H10 Br4 Hg2 N4 -","2","1","","Mahmoudi, Ghodrat; Morsali, Ali; Hunter, Allen D.; Zeller, Matthias","Mercury(ii) coordination polymers generated from 1,4-bis(2 or 3 or 4-pyridyl)-2,3-diaza-1,3-butadiene ligands","CrystEngComm","2007","9","8","704","","10.1039/b702569f","","","0.71073","MoKα","","0.0428","0.0408","","","0.1015","0.1026","","","","","","1.112","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202838","15.5151","0.001","26.5664","0.0015","21.5476","0.001","90","","94.433","0.001","90","","8854.9","0.9","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C84 H152 O72 S28 Zr12 -","- C84 H112 O72 S28 Zr12 -","- C168 H224 O144 S56 Zr24 -","2","0.5","","Faccini, Francesco; Fric, Helmut; Schubert, Ulrich; Wendel, Eric; Tsetsgee, Otgontuul; Müller, Klaus; Bertagnolli, Helmut; Venzo, Alfonso; Gross, Silvia","ω-Mercapto-functionalized hafnium- and zirconium-oxoclusters as nanosized building blocks for inorganic‒organic hybrid materials: synthesis, characterization and photothiol-ene polymerization","Journal of Materials Chemistry","2007","17","31","3297","","10.1039/b702714a","","","0.71073","MoKα","","0.1759","0.1451","","","0.4083","0.4349","","","","","","1.737","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202839","27.422","0.0012","26.4804","0.0011","25.5136","0.0011","90","","108.486","0.001","90","","17570.6","1.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C87 H158 Hf12 O74 S29 -","- C87 H116 Hf12 O74 S29 -","- C348 H464 Hf48 O296 S116 -","4","1","","Faccini, Francesco; Fric, Helmut; Schubert, Ulrich; Wendel, Eric; Tsetsgee, Otgontuul; Müller, Klaus; Bertagnolli, Helmut; Venzo, Alfonso; Gross, Silvia","ω-Mercapto-functionalized hafnium- and zirconium-oxoclusters as nanosized building blocks for inorganic‒organic hybrid materials: synthesis, characterization and photothiol-ene polymerization","Journal of Materials Chemistry","2007","17","31","3297","","10.1039/b702714a","","","0.71073","MoKα","","0.0798","0.0647","","","0.1719","0.1803","","","","","","1.024","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202840","6.7478","0.0003","10.4917","0.0003","11.4993","0.0005","64.737","0.001","87.555","0.002","73.999","0.002","705.08","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H8 Ag2 N7 O6 -","- C11 H8 Ag2 N7 O6 -","- C22 H16 Ag4 N14 O12 -","2","1","","Zhang, Jian; Shen, Yi-Cheng; Qin, Ye-Yan; Li, Zhao-Ji; Yao, Yuan-Gen","Polycatenated 3-connected hydrogen-bonding bilayer stabilized by argentophilic interactions","CrystEngComm","2007","9","8","636","","10.1039/b702972a","","","0.71073","MoKα","","","0.0246","","","0.06","0.0633","","","","","","1.108","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202841","5.2737","0.001","11.658","0.002","7.7995","0.0015","90","","94.07","0.015","90","","478.31","0.15","120","0.2","120","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2-aminoethane sulfonic acid","2-aminoethane sulfonic acid","","- C2 H7 N O3 S -","- C2 H7 N O3 S -","- C8 H28 N4 O12 S4 -","4","1","","Beukes, J. A.; Mo, F.; van Beek, W.","X-Ray induced radiation damage in taurine: a combined X-ray diffraction and Raman study.","Physical chemistry chemical physics : PCCP","2007","9","33","4709","4720","10.1039/b703000b","","x-ray","0.71","Synchrotron","","0.0353","0.0326","","","0.0905","0.0921","","","","","","1.101","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202842","5.2815","0.0011","11.644","0.002","7.9276","0.0016","90","","94.09","0.03","90","","486.29","0.16","296","1","296","1","","","100","","","","Commercial","5","P 1 21/c 1","-P 2ybc","14","2-aminoethane sulfonic acid","2-aminoethane sulfonic acid","","- C2 H7 N O3 S -","- C2 H7 N O3 S -","- C8 H28 N4 O12 S4 -","4","1","","Beukes, J. A.; Mo, F.; van Beek, W.","X-Ray induced radiation damage in taurine: a combined X-ray diffraction and Raman study.","Physical chemistry chemical physics : PCCP","2007","9","33","4709","4720","10.1039/b703000b","","x-ray","0.7256","Synchrotron","","0.0445","0.0324","","","0.0897","0.1017","","","","","","1.042","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202843","8.5166","0.0014","10.879","0.0018","16.006","0.003","90","","103","0.003","90","","1445","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","3-methyl-1-(tetrahydro-2H-pyran-2-ylmethyl)-1H-imidazol-3-ium trifluoromethanesulfonate","","","- C11 H17 F3 N2 O4 S -","- C11 H17 F3 N2 O4 S -","- C44 H68 F12 N8 O16 S4 -","4","1","","Leclercq, Loïc; Suisse, Isabelle; Nowogrocki, Guy; Agbossou-Niedercorn, Francine","Halide-free highly-pure imidazolium triflate ionic liquids: Preparation and use in palladium-catalysed allylic alkylation","Green Chemistry","2007","9","10","1097","","10.1039/b703096g","","","0.71073","MoKα","","0.0394","0.035","","","0.0933","0.0968","","","","","","1.07","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202844","8.6516","0.0015","10.1699","0.0017","12.195","0.002","87.354","0.003","85.474","0.003","83.36","0.003","1061.7","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","3-methyl-1-(4-(1-methyl-1H-imidazol-3-ium-3-yl)butyl)-1H- imidazol-3-ium bis(trifluoromethanesulfonate)","","","- C14 H20 F6 N4 O6 S2 -","- C14 H20 F6 N4 O6 S2 -","- C28 H40 F12 N8 O12 S4 -","2","1","","Leclercq, Loïc; Suisse, Isabelle; Nowogrocki, Guy; Agbossou-Niedercorn, Francine","Halide-free highly-pure imidazolium triflate ionic liquids: Preparation and use in palladium-catalysed allylic alkylation","Green Chemistry","2007","9","10","1097","","10.1039/b703096g","","","0.71073","MoKα","","0.0394","0.0341","","","0.089","0.0927","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202845","9.5883","0.0013","9.7729","0.0013","19.198","0.003","85.627","0.002","88.693","0.002","88.563","0.002","1792.8","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","1-methyl-3-(tetrahydrofuran-3-ylmethyl)-1H-imidazol-3-ium trifluoromethanesulfonate / tetrabuthylammonium trifluoromethanesulfonate","","","- C27 H51 F6 N3 O7 S2 -","- C27 H51 F6 N3 O7 S2 -","- C54 H102 F12 N6 O14 S4 -","2","1","","Leclercq, Loïc; Suisse, Isabelle; Nowogrocki, Guy; Agbossou-Niedercorn, Francine","Halide-free highly-pure imidazolium triflate ionic liquids: Preparation and use in palladium-catalysed allylic alkylation","Green Chemistry","2007","9","10","1097","","10.1039/b703096g","","","0.71073","MoKα","","0.0786","0.0578","","","0.157","0.1722","","","","","","1.124","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202846","12.148","0.001","12.386","0.002","22.901","0.004","87.67","0.01","87.14","0.01","83.88","0.01","3419.7","0.9","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C150 H252 O6 -","- C150 H252 O6 -","- C150 H252 O6 -","1","0.5","","Clark, Thomas E.; Makha, Mohamed; McKinnon, Joshua J.; Sobolev, Alexandre N.; Spackman, Mark A.; Raston, Colin L.","Variable temperature Hirshfeld surface analysis of interdigitated calix[6]arene bearing O-alkyl C18 linear chains","CrystEngComm","2007","9","7","566","","10.1039/b703166c","","","0.71073","MoKα","","0.2866","0.07","","","0.0608","0.0936","","","","","","0.82","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202847","12.257","0.001","12.423","0.001","23.024","0.004","87.52","0.01","86.01","0.01","83.46","0.01","3472.4","0.7","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","","","- C150 H252 O6 -","- C150 H252 O6 -","- C150 H252 O6 -","1","0.5","","Clark, Thomas E.; Makha, Mohamed; McKinnon, Joshua J.; Sobolev, Alexandre N.; Spackman, Mark A.; Raston, Colin L.","Variable temperature Hirshfeld surface analysis of interdigitated calix[6]arene bearing O-alkyl C18 linear chains","CrystEngComm","2007","9","7","566","","10.1039/b703166c","","","0.71073","MoKα","","0.2128","0.0729","","","0.1585","0.1931","","","","","","1.117","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202848","12.401","0.002","12.239","0.004","23.312","0.006","87.29","0.02","83.32","0.02","82.89","0.02","3485.2","1.6","300","2","300","2","","","","","","","","3","P -1","-P 1","2","","","","- C150 H252 O6 -","- C150 H252 O6 -","- C150 H252 O6 -","1","0.5","","Clark, Thomas E.; Makha, Mohamed; McKinnon, Joshua J.; Sobolev, Alexandre N.; Spackman, Mark A.; Raston, Colin L.","Variable temperature Hirshfeld surface analysis of interdigitated calix[6]arene bearing O-alkyl C18 linear chains","CrystEngComm","2007","9","7","566","","10.1039/b703166c","","","0.71073","MoKα","","0.3251","0.0604","","","0.0877","0.1174","","","","","","1","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202849","25.512","0.0005","25.512","0.0005","12.9978","0.0004","90","","90","","90","","8459.8","0.4","100","2","100","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C69 H103 Ba Cl9 O20 U -","- C69 H98 Ba Cl9 O20 U -","- C276 H392 Ba4 Cl36 O80 U4 -","4","0.5","","Bernardo Masci; Pierre Thuéry","Versatility of {M(30-crown-10)} (M = K+, Ba2+) as a guest in UO22+ complexes of [3.1.3.1]- and [3.3.3]homooxacalixarenes","CrystEngComm","2007","9","7","582","","10.1039/b703172f","","","0.71073","MoKα","","0.0543","0.0456","","","0.1198","0.1238","","","","","","0.982","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202850","25.358","0.001","12.341","0.0009","23.866","0.0015","90","","114.062","0.004","90","","6819.7","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C74 H80 Ba O18 U -","- C74 H80 Ba O18 U -","- C296 H320 Ba4 O72 U4 -","4","1","","Bernardo Masci; Pierre Thuéry","Versatility of {M(30-crown-10)} (M = K+, Ba2+) as a guest in UO22+ complexes of [3.1.3.1]- and [3.3.3]homooxacalixarenes","CrystEngComm","2007","9","7","582","","10.1039/b703172f","","","0.71073","MoKα","","0.0765","0.0599","","","0.1524","0.1601","","","","","","1.031","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202851","13.4804","0.0006","29.3642","0.0017","21.7965","0.0012","90","","92.601","0.003","90","","8619.1","0.8","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C70 H78 Ba Br6 Cl6 O26 U2 -","- C70 H78 Ba Br6 Cl6 O26 U2 -","- C280 H312 Ba4 Br24 Cl24 O104 U8 -","4","1","","Bernardo Masci; Pierre Thuéry","Versatility of {M(30-crown-10)} (M = K+, Ba2+) as a guest in UO22+ complexes of [3.1.3.1]- and [3.3.3]homooxacalixarenes","CrystEngComm","2007","9","7","582","","10.1039/b703172f","","","0.71073","MoKα","","0.1189","0.0772","","","0.2277","0.2441","","","","","","1.081","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202852","15.223","0.003","18.754","0.003","16.684","0.003","90","","106.362","0.009","90","","4570.2","1.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C78 H96 Ba2 O22 S4 U2 -","- C78 H96 Ba2 O22 S4 U2 -","- C156 H192 Ba4 O44 S8 U4 -","2","0.5","","Bernardo Masci; Pierre Thuéry","Versatility of {M(30-crown-10)} (M = K+, Ba2+) as a guest in UO22+ complexes of [3.1.3.1]- and [3.3.3]homooxacalixarenes","CrystEngComm","2007","9","7","582","","10.1039/b703172f","","","0.71073","MoKα","","0.0954","0.0661","","","0.1727","0.1852","","","","","","0.939","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202853","12.0923","0.0007","24.6602","0.0009","25.5672","0.0016","90","","103.061","0.003","90","","7426.9","0.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C132 H216 K4 O48 U2 -","- C132 H216 K4 O48 U2 -","- C264 H432 K8 O96 U4 -","2","0.5","","Bernardo Masci; Pierre Thuéry","Versatility of {M(30-crown-10)} (M = K+, Ba2+) as a guest in UO22+ complexes of [3.1.3.1]- and [3.3.3]homooxacalixarenes","CrystEngComm","2007","9","7","582","","10.1039/b703172f","","","0.71073","MoKα","","0.0785","0.0505","","","0.1124","0.1208","","","","","","1.057","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202854","11.508","0.0014","19.262","0.002","20.466","0.002","108.102","0.002","104.842","0.002","91.297","0.002","4142.3","0.8","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H42 Cl2 N7 O16 Zn -","- C35 H42 Cl2 N7 O16 Zn -","- C140 H168 Cl8 N28 O64 Zn4 -","4","2","","Song, Hui-Hua; Ma, Bao-Qing","A well-resolved discrete dodecameric water cluster in a metal‒organic complex","CrystEngComm","2007","9","8","625","","10.1039/b703185h","","","0.71073","MoKα","","0.1147","0.0528","","","0.1174","0.1405","","","","","","0.942","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202855","16.5938","0.0007","15.1034","0.0006","18.0112","0.0004","90","","90","","90","","4514","0.3","110","2","110","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C32 H44 Cu N4 O27 U2 -","- C32 H36 Cu N4 O27 U2 -","- C128 H144 Cu4 N16 O108 U8 -","4","1","","Pierre Thuéry","Uranyl citrate dimers as guests in a copper?bipyridine framework: a novel heterometallic inorganic?organic hybrid compound","CrystEngComm","2007","9","5","358","","10.1039/b703227g","","","0.71073","MoKα","","0.0537","0.0472","","","0.1201","0.1232","","","","","","1.086","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202856","12.7819","0.0006","12.7819","0.0006","85.294","0.004","90","","90","","120","","12068.1","1","100","2","100","2","","","","","","","","5","P 61 2 2","P 61 2 (0 0 5)","178","","","","- C42 H72 N Nd7 O61 -","- C42 H40 N Nd7 O60 -","- C252 H240 N6 Nd42 O360 -","6","0.5","","Pierre Thuéry","Neodymium(iii) d(?)-citramalate: a chiral three-dimensional framework with water-filled channels","CrystEngComm","2007","9","6","460","","10.1039/b703230g","","","0.71073","MoKα","","0.081","0.0516","","","0.1146","0.1266","","","","","","0.993","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202857","6.7431","0.0005","8.0503","0.0006","13.8001","0.001","77.722","0.003","88.476","0.002","66.354","0.002","669.09","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","5-Chloro-2(3H)-benzoxazolone 2,4-dihydroxybenzoic acid","5-Chloro-2(3H)-benzoxazolone 2,4-dihydroxybenzoic acid","","- C14 H10 Cl N O6 -","- C14 H10 Cl N O6 -","- C28 H20 Cl2 N2 O12 -","2","1","","Childs, Scott L.; Hardcastle, Kenneth I.","Cocrystals of chlorzoxazone with carboxylic acids","CrystEngComm","2007","9","5","364","","10.1039/b703292g","","","1.54178","CuKα","","0.0465","0.0413","","","0.0991","0.1023","","","","","","1.067","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202858","7.53","0.0015","12.173","0.002","40.996","0.008","90","","90","","90","","3757.8","1.2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","4-3, 4-dicyanophenoxy-4'-dimethylaminoazobenzene(CPMAB)","4-3, 4-dicyanophenoxy-4'-dimethylaminoazobenzene(CPMAB)","","- C22 H17 N5 O -","- C22 H17 N5 O -","- C176 H136 N40 O8 -","8","1","","Hu, Junping; Li, Yingfeng; Ji, Zhuoyu; Jiang, Guiyuan; Yang, Lianming; Hu, Wenping; Gao, Hongjun; Jiang, Lei; Wen, Yongqiang; Song, Yanlin; Zhu, Daoben","A non-planar organic molecule with non-volatile electrical bistability for nano-scale data storage","Journal of Materials Chemistry","2007","17","33","3530","","10.1039/b703332j","","","0.71073","MoKα","","0.0939","0.0476","","","0.1148","0.1331","","","","","","0.96","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202859","41.574","0.008","5.7944","0.0011","16.876","0.003","90","","109.095","0.003","90","","3841.7","1.2","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H42 Co N4 O12 -","- C42 H42 Co N4 O12 -","- C168 H168 Co4 N16 O48 -","4","0.5","","Zhuang, Wenjuan; Zheng, Xiangjun; Li, Licun; Liao, Daizheng; Ma, Hui; Jin, Linpei","Structural diversity and properties of M(ii) 4-carboxyl phenoxyacetate complexes with 0D-, 1D-, 2D- and 3D M-cpoa framework","CrystEngComm","2007","9","8","653","","10.1039/b703429f","","","0.71073","MoKα","","0.1319","0.0634","","","0.1524","0.1945","","","","","","1.008","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202860","13.931","0.002","21.777","0.002","35.14","0.006","90","","90","","90","","10661","3","294","2","294","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C27 H28 Co N3 O7 -","- C27 H28 Co N3 O7 -","- C432 H448 Co16 N48 O112 -","16","0.5","","Zhuang, Wenjuan; Zheng, Xiangjun; Li, Licun; Liao, Daizheng; Ma, Hui; Jin, Linpei","Structural diversity and properties of M(ii) 4-carboxyl phenoxyacetate complexes with 0D-, 1D-, 2D- and 3D M-cpoa framework","CrystEngComm","2007","9","8","653","","10.1039/b703429f","","","0.7107","MoKα","","0.0764","0.0721","","","0.137","0.1386","","","","","","1.307","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202861","4.7808","0.0016","9.229","0.003","18.829","0.007","91.954","0.006","95.509","0.006","99.022","0.005","815.7","0.5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H30 Co N4 O10 -","- C38 H30 Co N4 O10 -","- C38 H30 Co N4 O10 -","1","0.5","","Zhuang, Wenjuan; Zheng, Xiangjun; Li, Licun; Liao, Daizheng; Ma, Hui; Jin, Linpei","Structural diversity and properties of M(ii) 4-carboxyl phenoxyacetate complexes with 0D-, 1D-, 2D- and 3D M-cpoa framework","CrystEngComm","2007","9","8","653","","10.1039/b703429f","","","0.71073","MoKα","","0.0757","0.0544","","","0.1299","0.145","","","","","","1.104","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202862","7.6417","0.0019","10.106","0.003","10.638","0.003","93.557","0.004","101.146","0.004","101.551","0.004","785.4","0.4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H36 Co2 N2 O18 -","- C28 H36 Co2 N2 O18 -","- C28 H36 Co2 N2 O18 -","1","0.5","","Zhuang, Wenjuan; Zheng, Xiangjun; Li, Licun; Liao, Daizheng; Ma, Hui; Jin, Linpei","Structural diversity and properties of M(ii) 4-carboxyl phenoxyacetate complexes with 0D-, 1D-, 2D- and 3D M-cpoa framework","CrystEngComm","2007","9","8","653","","10.1039/b703429f","","","0.71073","MoKα","","0.0686","0.0384","","","0.083","0.0958","","","","","","1.025","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202863","11.2742","0.0008","11.2742","0.0008","13.5885","0.0019","90","","90","","120","","1495.8","0.3","294","2","294","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C19 H18 N2 Ni O7 -","- C19 H18 N2 Ni O7 -","- C57 H54 N6 Ni3 O21 -","3","0.5","","Zhuang, Wenjuan; Zheng, Xiangjun; Li, Licun; Liao, Daizheng; Ma, Hui; Jin, Linpei","Structural diversity and properties of M(ii) 4-carboxyl phenoxyacetate complexes with 0D-, 1D-, 2D- and 3D M-cpoa framework","CrystEngComm","2007","9","8","653","","10.1039/b703429f","","","0.71073","MoKα","","0.0367","0.0303","","","0.0697","0.0718","","","","","","1.044","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202864","13.8794","0.0018","21.611","0.004","35.005","0.005","90","","90","","90","","10500","3","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C27 H28 N3 Ni O7 -","- C27 H28 N3 Ni O7 -","- C432 H448 N48 Ni16 O112 -","16","0.5","","Zhuang, Wenjuan; Zheng, Xiangjun; Li, Licun; Liao, Daizheng; Ma, Hui; Jin, Linpei","Structural diversity and properties of M(ii) 4-carboxyl phenoxyacetate complexes with 0D-, 1D-, 2D- and 3D M-cpoa framework","CrystEngComm","2007","9","8","653","","10.1039/b703429f","","","0.71073","MoKα","","0.0809","0.0622","","","0.1363","0.1447","","","","","","1.169","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202865","8.116","0.002","12.279","0.003","16.009","0.004","69.271","0.004","86.078","0.004","79.166","0.004","1465.5","0.6","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H26 N2 O11 Zn2 -","- C30 H26 N2 O11 Zn2 -","- C60 H52 N4 O22 Zn4 -","2","1","","Zhuang, Wenjuan; Zheng, Xiangjun; Li, Licun; Liao, Daizheng; Ma, Hui; Jin, Linpei","Structural diversity and properties of M(ii) 4-carboxyl phenoxyacetate complexes with 0D-, 1D-, 2D- and 3D M-cpoa framework","CrystEngComm","2007","9","8","653","","10.1039/b703429f","","","0.71073","MoKα","","0.1307","0.0533","","","0.0911","0.1223","","","","","","1.031","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202866","30.931","0.008","9.8752","0.0013","20.37","0.003","90","","149.31","0.006","90","","3175.7","1.2","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16.5 H16 N O5.5 Zn -","- C16.5 H16 N O5.5 Zn -","- C132 H128 N8 O44 Zn8 -","8","1","","Zhuang, Wenjuan; Zheng, Xiangjun; Li, Licun; Liao, Daizheng; Ma, Hui; Jin, Linpei","Structural diversity and properties of M(ii) 4-carboxyl phenoxyacetate complexes with 0D-, 1D-, 2D- and 3D M-cpoa framework","CrystEngComm","2007","9","8","653","","10.1039/b703429f","","","0.7107","MoKα","","0.0549","0.0464","","","0.1222","0.1296","","","","","","1.085","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202867","20.595","0.004","15.012","0.003","10.363","0.002","90","","93.967","0.004","90","","3196.3","1.1","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16.5 H16 N O5.5 Zn -","- C16.5 H16 N O5.5 Zn -","- C132 H128 N8 O44 Zn8 -","8","1","","Zhuang, Wenjuan; Zheng, Xiangjun; Li, Licun; Liao, Daizheng; Ma, Hui; Jin, Linpei","Structural diversity and properties of M(ii) 4-carboxyl phenoxyacetate complexes with 0D-, 1D-, 2D- and 3D M-cpoa framework","CrystEngComm","2007","9","8","653","","10.1039/b703429f","","","0.71073","MoKα","","0.1035","0.0432","","","0.0763","0.0948","","","","","","0.97","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202868","12.8373","0.0014","11.8355","0.0013","16.975","0.002","90","","90","","90","","2579.1","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H13 N3 O2 -","- C14 H13 N3 O2 -","- C112 H104 N24 O16 -","8","1","","Barbazán, Paula; Carballo, Rosa; Vázquez-López, Ezequiel M.","Synthesis and structure of 2-acetylpyridine-salicyloylhydrazone and its copper(ii) and zinc(ii) complexes. The effect of the metal coordination on the weak intermolecular interactions","CrystEngComm","2007","9","8","668","","10.1039/b703442c","","","0.71073","MoKα","","0.2955","0.0523","","","0.0918","0.1452","","","","","","0.799","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202869","6.7539","0.0009","9.3441","0.0012","11.4902","0.0015","89.773","0.003","81.497","0.003","88.363","0.003","716.87","0.16","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H12 Br Cu N3 O2 -","- C14 H12 Br Cu N3 O2 -","- C28 H24 Br2 Cu2 N6 O4 -","2","1","","Barbazán, Paula; Carballo, Rosa; Vázquez-López, Ezequiel M.","Synthesis and structure of 2-acetylpyridine-salicyloylhydrazone and its copper(ii) and zinc(ii) complexes. The effect of the metal coordination on the weak intermolecular interactions","CrystEngComm","2007","9","8","668","","10.1039/b703442c","","","0.71073","MoKα","","0.1337","0.0491","","","0.0835","0.1028","","","","","","0.752","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202870","12.598","0.004","18.483","0.006","10.818","0.004","90","","90","","90","","2519","1.5","293","2","293","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C28 H24 N6 O4 Zn -","- C28 H24 N6 O4 Zn -","- C112 H96 N24 O16 Zn4 -","4","","","Barbazán, Paula; Carballo, Rosa; Vázquez-López, Ezequiel M.","Synthesis and structure of 2-acetylpyridine-salicyloylhydrazone and its copper(ii) and zinc(ii) complexes. The effect of the metal coordination on the weak intermolecular interactions","CrystEngComm","2007","9","8","668","","10.1039/b703442c","","","0.71073","MoKα","","0.1166","0.0512","","","0.0691","0.0788","","","","","","0.889","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202871","10.215","0.001","10.697","0.001","10.722","0.001","67.49","0.01","89.98","0.01","68.65","0.01","994.8","0.2","293","2","293","2","","","","","","","synthesis as described","6","P -1","-P 1","2","(NH3(CH2)4NH3)La(hedpH)(hedpH2)","","","- C8 H25 La N2 O14 P4 -","- C8 H25 La N2 O14 P4 -","- C16 H50 La2 N4 O28 P8 -","2","1","","Liu, Feng-Yi; Roces, Laura; Sa Ferreira, Rute A.; García-Granda, Santiago; García, José R.; Carlos, Luis D.; Rocha, João","Crystal structure and photoluminescence properties of lanthanide diphosphonates","Journal of Materials Chemistry","2007","17","35","3696","","10.1039/b703487c","","x-ray","1.54184","CuKα","","0.0501","0.0498","","","0.1358","0.1363","","","","","","1.068","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202872","28.817","0.005","14.767","0.002","29.597","0.005","90","","103.763","0.004","90","","12233","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H73 Mo3 N8 O0.5 S16 -","- C38 H72 Mo3 N8 O0.5 S16 -","- C304 H576 Mo24 N64 O4 S128 -","8","1","","Alberola, Antonio; Llusar, Rosa; Triguero, Sonia; Vicent, Cristian; Sokolov, Maxim N.; Gómez-García, Carlos","Structural diversity in charge transfer salts based on Mo3S7 and Mo3S4Se3 clusters complexes and bis(ethylenedithio)tetrathiafulvalene (ET)","Journal of Materials Chemistry","2007","17","32","3440","","10.1039/b703551a","","","0.71073","MoKα","","0.1309","0.0573","","","0.1265","0.1599","","","","","","1.029","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202873","14.4374","0.0006","21.6924","0.0009","17.2853","0.0007","90","","103.744","0.001","90","","5258.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H16 Mo3 N6 S32 -","- C26 H16 Mo3 N6 S32 -","- C104 H64 Mo12 N24 S128 -","4","1","","Alberola, Antonio; Llusar, Rosa; Triguero, Sonia; Vicent, Cristian; Sokolov, Maxim N.; Gómez-García, Carlos","Structural diversity in charge transfer salts based on Mo3S7 and Mo3S4Se3 clusters complexes and bis(ethylenedithio)tetrathiafulvalene (ET)","Journal of Materials Chemistry","2007","17","32","3440","","10.1039/b703551a","","","0.71073","MoKα","","0.0469","0.027","","","0.0748","0.0859","","","","","","0.988","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202874","12.903","0.007","13.733","0.008","17.658","0.011","92.982","0.015","109.882","0.014","117.707","0.013","2521","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H44 Br6 Mo3 N S12 Se3 -","- C26 H8 Br6 Mo3 N S12 Se3 -","- C52 H16 Br12 Mo6 N2 S24 Se6 -","2","1","","Alberola, Antonio; Llusar, Rosa; Triguero, Sonia; Vicent, Cristian; Sokolov, Maxim N.; Gómez-García, Carlos","Structural diversity in charge transfer salts based on Mo3S7 and Mo3S4Se3 clusters complexes and bis(ethylenedithio)tetrathiafulvalene (ET)","Journal of Materials Chemistry","2007","17","32","3440","","10.1039/b703551a","","","0.71073","MoKα","","0.1883","0.0751","","","0.1686","0.236","","","","","","1.005","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202875","10.0467","0.001","11.3217","0.0012","14.8607","0.0015","105.133","0.002","92.035","0.002","99.297","0.003","1604.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H11 Cl6 Mo3 N S15 -","- C12 H8 Cl6 Mo3 N S15 -","- C24 H16 Cl12 Mo6 N2 S30 -","2","1","","Alberola, Antonio; Llusar, Rosa; Triguero, Sonia; Vicent, Cristian; Sokolov, Maxim N.; Gómez-García, Carlos","Structural diversity in charge transfer salts based on Mo3S7 and Mo3S4Se3 clusters complexes and bis(ethylenedithio)tetrathiafulvalene (ET)","Journal of Materials Chemistry","2007","17","32","3440","","10.1039/b703551a","","","0.71073","MoKα","","0.1135","0.0589","","","0.1058","0.1147","","","","","","0.948","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202876","11.8603","0.0009","17.3577","0.0013","20.8821","0.0015","69.39","0.002","88.139","0.002","73.734","0.002","3852.3","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H35 Cl6.5 Mo3 N S39 -","- C42 H32 Cl6.5 Mo3 N S39 -","- C84 H64 Cl13 Mo6 N2 S78 -","2","1","","Alberola, Antonio; Llusar, Rosa; Triguero, Sonia; Vicent, Cristian; Sokolov, Maxim N.; Gómez-García, Carlos","Structural diversity in charge transfer salts based on Mo3S7 and Mo3S4Se3 clusters complexes and bis(ethylenedithio)tetrathiafulvalene (ET)","Journal of Materials Chemistry","2007","17","32","3440","","10.1039/b703551a","","","0.71073","MoKα","","0.1759","0.0655","","","0.1124","0.1549","","","","","","0.992","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202877","8.827","0.003","11.675","0.004","21.16","0.007","96.847","0.006","100.776","0.006","102.133","0.006","2065.6","1.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","[Ru(tpypy)2Ag(NO3)(MeCN)](NO3)2.H2O.MeCN","","","- C44 H36 Ag N13 O10 Ru -","- C46 H31 Ag N12 O10 Ru -","- C92 H62 Ag2 N24 O20 Ru2 -","2","1","","Beves, Jonathon E.; Constable, Edwin C.; Housecroft, Catherine E.; Kepert, Cameron J.; Price, David J.","The first example of a coordination polymer from the expanded 4,4'-bipyridine ligand [Ru(pytpy)~2~]^2+^(pytpy = 4'-(4-pyridyl)-2,2':6',2''-terpyridine)","CrystEngComm","2007","9","6","456","459","10.1039/b703622a","","","0.71073","MoKα","","0.0622","0.0465","","","0.1289","0.1399","","","","","","1.041","","","","has coordinates","275106","2022-05-06","14:46:46",""
"7202878","7.2695","0.0009","7.2695","0.0009","28.268","0.005","90","","90","","90","","1493.8","0.4","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","","","- C32 H10 Cu6.44 N32 O5 W4 -","- C16 Cu3.22 N16 O2.5 W2 -","- C32 Cu6.44 N32 O5 W4 -","2","0.0625","","Podgajny, Robert; Chmel, Nikola Paul; Bałanda, Maria; Tracz, Piotr; Gaweł, Bartłomiej; Zając, Dariusz; Sikora, Marcin; Kapusta, Czesław; Łasocha, Wiesław; Wasiutyński, Tadeusz; Sieklucka, Barbara","Exploring the formation of 3D ferromagnetic cyano-bridged CuII2+x{CuII4[WV(CN)8]4‒2x[WIV(CN)8]2x}·yH2O networks","Journal of Materials Chemistry","2007","17","31","3308","","10.1039/b703640j","powder diffraction","","1.54178","CuKα","","0.0251","0.0251","","","0.0249","0.0249","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202879","7.2858","0.0009","7.2858","0.0009","28.282","0.005","90","","90","","90","","1501.3","0.4","","","273","","","","","","","","","6","I 4/m m m","-I 4 2","139","","","","- C32 H8 Cu6.94 N32 O4 W4 -","- C16 Cu3.468 N16 O2 W2 -","- C32 Cu6.936 N32 O4 W4 -","2","0.0625","","Podgajny, Robert; Chmel, Nikola Paul; Bałanda, Maria; Tracz, Piotr; Gaweł, Bartłomiej; Zając, Dariusz; Sikora, Marcin; Kapusta, Czesław; Łasocha, Wiesław; Wasiutyński, Tadeusz; Sieklucka, Barbara","Exploring the formation of 3D ferromagnetic cyano-bridged CuII2+x{CuII4[WV(CN)8]4‒2x[WIV(CN)8]2x}·yH2O networks","Journal of Materials Chemistry","2007","17","31","3308","","10.1039/b703640j","powder diffraction","x-ray","1.54178","CuKα","","0.0525","0.0525","","","0.0436","0.0436","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202880","15.244","0.005","15.244","0.005","16.059","0.005","90","0.005","90","0.005","120","0.005","3231.8","1.8","293","2","293","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C27 H18 N4 -","- C27 H18 N4 -","- C162 H108 N24 -","6","0.333333","","Tian, Yu-Peng; Li, Lin; Zhang, Ju-Zhou; Yang, Jia-Xiang; Zhou, Hong-ping; Wu, Jie-ying; Sun, Ping-ping; Tao, Li-min; Guo, Ya-hui; Wang, Chuan-Kui; Xing, Hui; Huang, Wen-hao; Tao, Xu-Tang; Jiang, Min-Hua","Investigations and facile synthesis of a series of novel multi-functional two-photon absorption materials","Journal of Materials Chemistry","2007","17","34","3646","","10.1039/b703853d","","","0.71069","MoKα","","0.1803","0.0757","","","0.183","0.2335","","","","","","0.939","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202881","9.2018","0.0018","12.148","0.002","24.678","0.005","84.98","0.03","84.63","0.03","70.99","0.03","2591.9","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H56 Cl2 Cu2 N10 O15 -","- C44 H56 Cl2 Cu2 N10 O15 -","- C88 H112 Cl4 Cu4 N20 O30 -","2","1","","Zhang, Jian-Ying; Liu, Cai-Ming; Zhang, De-Qing; Gao, Song; Zhu, Dao-Ben","Magnetic properties tuned by oxamido bridging ligand derivatives in two new hybrid organic inorganic nitronyl nitroxide copper(ii) complexes","CrystEngComm","2007","9","9","799","","10.1039/b704127f","","","0.71073","MoKα","","0.092","0.0607","","","0.1502","0.1633","","","","","","0.942","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202882","16.254","0.003","13.211","0.003","11.776","0.002","90","","108.4","0.03","90","","2399.4","0.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H52 Cl2 Cu2 N10 O14 -","- C42 H52 Cl2 Cu2 N10 O14 -","- C84 H104 Cl4 Cu4 N20 O28 -","2","0.5","","Zhang, Jian-Ying; Liu, Cai-Ming; Zhang, De-Qing; Gao, Song; Zhu, Dao-Ben","Magnetic properties tuned by oxamido bridging ligand derivatives in two new hybrid organic inorganic nitronyl nitroxide copper(ii) complexes","CrystEngComm","2007","9","9","799","","10.1039/b704127f","","","0.71073","MoKα","","0.0924","0.0615","","","0.1604","0.1805","","","","","","1.032","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202883","13.0204","0.001","20.3203","0.0014","15.8814","0.0011","90","","90","","90","","4201.9","0.5","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C44 H34 N4 O17 Zn2 -","- C44 H32 N4 O17 Zn2 -","- C176 H128 N16 O68 Zn8 -","4","0.5","","Cao, Xin-Yi; Zhang, Jian; Li, Zhao-Ji; Cheng, Jian-Kai; Yao, Yuan-Gen","Scorpion-shaped carboxylate ligand tailored molecular square, bilayer, self-threading and (3,6)-connected nets","CrystEngComm","2007","9","9","806","","10.1039/b704294a","","","0.71073","MoKα","","","0.0894","","","0.2378","0.2753","","","","","","1.099","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202884","13.017","0.002","12.495","0.0014","14.208","0.002","90","","108.619","0.007","90","","2189.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18.66 N2 O10.33 Zn2 -","- C20 H18 N2 O10.33 Zn2 -","- C80 H72 N8 O41.32 Zn8 -","4","1","","Cao, Xin-Yi; Zhang, Jian; Li, Zhao-Ji; Cheng, Jian-Kai; Yao, Yuan-Gen","Scorpion-shaped carboxylate ligand tailored molecular square, bilayer, self-threading and (3,6)-connected nets","CrystEngComm","2007","9","9","806","","10.1039/b704294a","","","0.71073","MoKα","","","0.0513","","","0.1292","0.1376","","","","","","1.026","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202885","8.3945","0.0007","10.2207","0.0009","18.3523","0.0017","104.241","0.002","101.498","0.002","92.684","0.002","1487.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H54 Cd3 N8 O20 -","- C60 H50 Cd3 N8 O20 -","- C60 H50 Cd3 N8 O20 -","1","0.5","","Cao, Xin-Yi; Zhang, Jian; Li, Zhao-Ji; Cheng, Jian-Kai; Yao, Yuan-Gen","Scorpion-shaped carboxylate ligand tailored molecular square, bilayer, self-threading and (3,6)-connected nets","CrystEngComm","2007","9","9","806","","10.1039/b704294a","","","0.71073","MoKα","","","0.1039","","","0.2013","0.2315","","","","","","1.111","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202886","11.5513","0.0004","12.2888","0.0004","13.3152","0.0005","64.541","0.001","72.497","0.001","62.539","0.001","1501.83","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H22.67 Cd2 N4 O8.34 -","- C34 H22 Cd2 N4 O8.33 -","- C68 H44 Cd4 N8 O16.66 -","2","1","","Cao, Xin-Yi; Zhang, Jian; Li, Zhao-Ji; Cheng, Jian-Kai; Yao, Yuan-Gen","Scorpion-shaped carboxylate ligand tailored molecular square, bilayer, self-threading and (3,6)-connected nets","CrystEngComm","2007","9","9","806","","10.1039/b704294a","","","0.71073","MoKα","","","0.047","","","0.1415","0.1586","","","","","","1.006","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202887","9.424","0.018","14.37","0.03","15.4","0.03","90","","104.87","0.06","90","","2016","7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C80 H60 N8 O34 Zn8 -","- C80 H52 N8 O34 Zn8 -","- C80 H52 N8 O34 Zn8 -","1","0.25","","Cao, Xin-Yi; Zhang, Jian; Li, Zhao-Ji; Cheng, Jian-Kai; Yao, Yuan-Gen","Scorpion-shaped carboxylate ligand tailored molecular square, bilayer, self-threading and (3,6)-connected nets","CrystEngComm","2007","9","9","806","","10.1039/b704294a","","","0.71073","MoKα","","","0.0482","","","0.1286","0.1374","","","","","","1.097","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202888","5.9566","0.00013","7.0989","0.00015","7.1164","0.00015","109.5","0.017","98.39","0.017","114.69","0.017","243","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- H4 I Na O2 -","- H4 I Na O2 -","- H8 I2 Na2 O4 -","2","1","","Nelyubina, Yulia V.; Antipin, Mikhail Yu.; Lyssenko, Konstantin A.","Energy aspect of the chemical bonding peculiarities in the crystal of sodium iodide dihydrate","CrystEngComm","2007","9","8","632","","10.1039/b704326k","","","0.71073","MoKα","","0.0173","0.0166","","","0.0425","0.043","","","","","","0.993","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202889","17.505","0.0007","19.432","0.0015","24.759","0.0018","90","","90","","90","","8422","1","295","2","295","2","","","","","","","","4","P n 21 a","P -2ac -2n","33","","","","- C144 H38 N4 S8 -","- C144 H38 N4 S8 -","- C576 H152 N16 S32 -","4","1","","Konarev, Dmitri V.; Khasanov, Salavat S.; Saito, Gunzi; Otsuka, Akihiro; Lyubovskaya, Rimma N.","Dimerization of C60˙‒ in multi-component ionic complexes with bis(ethylenedithio)tetrathiafulvalene: (cation+)2·ET·(C60˙‒)2","Journal of Materials Chemistry","2007","17","39","4171","","10.1039/b704371f","","","0.71073","MoKα","","0.1132","0.0706","","","0.1776","0.205","","","","","","0.972","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202890","17.218","0.0004","19.362","0.0009","24.373","0.0012","90","","90","","90","","8125.3","0.6","100","2","100","2","","","","","","","","4","P n 21 a","P -2ac -2n","33","","","","- C144 H38 N4 S8 -","- C144 H38 N4 S8 -","- C576 H152 N16 S32 -","4","1","","Konarev, Dmitri V.; Khasanov, Salavat S.; Saito, Gunzi; Otsuka, Akihiro; Lyubovskaya, Rimma N.","Dimerization of C60˙‒ in multi-component ionic complexes with bis(ethylenedithio)tetrathiafulvalene: (cation+)2·ET·(C60˙‒)2","Journal of Materials Chemistry","2007","17","39","4171","","10.1039/b704371f","","","0.71073","MoKα","","0.1417","0.1142","","","0.3194","0.3478","","","","","","1.393","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202891","16.634","0.002","16.634","0.002","11.234","0.002","90","","90","","120","","2691.9","0.7","293","2","293","2","","","","","","","","5","P -6 2 m","P -6 -2","189","","","","- C84 H99 N15 Ni3 O27 -","- C57.012 H33.012 N6 Ni3 O18 -","- C57.012 H33.012 N6 Ni3 O18 -","1","0.0833333","","Gao, Chaoying; Liu, Shuxia; Xie, Linhua; Ren, Yuanhang; Cao, Jianfang; Sun, Chunyan","Design and construction of a microporous metal?organic framework based on the pillared-layer motif","CrystEngComm","2007","9","7","545","","10.1039/b704433j","","","0.71073","MoKα","","0.0505","0.0472","","","0.1188","0.1206","","","","","","1.086","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202892","16.609","0.002","16.609","0.002","14.325","0.003","90","","90","","120","","3422.3","0.9","293","2","293","2","","","","","","","","5","P 63/m c m","-P 6c 2","193","","","","- C15 H17 N2 Ni O8 -","- C15 H17 N2 Ni O8 -","- C90 H102 N12 Ni6 O48 -","6","0.25","","Gao, Chaoying; Liu, Shuxia; Xie, Linhua; Ren, Yuanhang; Cao, Jianfang; Sun, Chunyan","Design and construction of a microporous metal?organic framework based on the pillared-layer motif","CrystEngComm","2007","9","7","545","","10.1039/b704433j","","","0.71073","MoKα","","0.0586","0.0511","","","0.1416","0.1469","","","","","","1.193","","","","has coordinates","180359","2020-10-21","18:00:00",""
"7202893","7.2636","0.0018","10.409","0.003","11.639","0.003","100.486","0.003","101.062","0.003","95.619","0.003","841.1","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H9.5 Ag Eu N2.5 O9 -","- C17 H6 Ag Eu N2.5 O9 -","- C34 H12 Ag2 Eu2 N5 O18 -","2","1","","Gu, Xiaojun; Xue, Dongfeng","Self-assembly of 3-D 4d?4f coordination frameworks based on 1-D inorganic heterometallic chains and linear organic linkers","CrystEngComm","2007","9","6","471","","10.1039/b704544a","","","0.71073","MoKα","","0.0319","0.0308","","","0.0787","0.0794","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202894","7.35","0.003","10.453","0.004","11.652","0.004","100.265","0.005","101.038","0.004","96.057","0.005","855.5","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H9.5 Ag N2.5 Nd O9 -","- C17 H6 Ag N2.5 Nd O9 -","- C34 H12 Ag2 N5 Nd2 O18 -","2","1","","Gu, Xiaojun; Xue, Dongfeng","Self-assembly of 3-D 4d?4f coordination frameworks based on 1-D inorganic heterometallic chains and linear organic linkers","CrystEngComm","2007","9","6","471","","10.1039/b704544a","","","0.71073","MoKα","","0.0708","0.0515","","","0.1171","0.1282","","","","","","1.051","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202895","20.07","0.004","8.8346","0.0019","22.339","0.005","90","","90","","90","","3960.9","1.5","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H12 Ag N3 Nd O7.5 -","- C18 H11 Ag N3 Nd O7.5 -","- C144 H88 Ag8 N24 Nd8 O60 -","8","1","","Gu, Xiaojun; Xue, Dongfeng","Self-assembly of 3-D 4d?4f coordination frameworks based on 1-D inorganic heterometallic chains and linear organic linkers","CrystEngComm","2007","9","6","471","","10.1039/b704544a","","","0.71073","MoKα","","0.0599","0.0338","","","0.0721","0.0818","","","","","","1.008","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202896","19.954","0.002","8.8187","0.0009","22.344","0.002","90","","90","","90","","3931.8","0.7","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H12 Ag Eu N3 O7.5 -","- C18 H11 Ag Eu N3 O7.5 -","- C144 H88 Ag8 Eu8 N24 O60 -","8","1","","Gu, Xiaojun; Xue, Dongfeng","Self-assembly of 3-D 4d?4f coordination frameworks based on 1-D inorganic heterometallic chains and linear organic linkers","CrystEngComm","2007","9","6","471","","10.1039/b704544a","","","0.71073","MoKα","","0.0303","0.0231","","","0.0553","0.0584","","","","","","1.018","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202897","4.229","0.0008","14.112","0.003","23.312","0.005","90","","90","","90","","1391.3","0.5","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H6 F3 I2 N -","- C13 H6 F3 I2 N -","- C52 H24 F12 I8 N4 -","4","1","","André C. B. Lucassen; Tatiana Zubkov; Linda J. W. Shimon; Milko E. van der Boom","Design, synthesis and crystal structure of a multiple donor?acceptor halogen bonded stilbazole: assembly of unimolecular interconnected helices","CrystEngComm","2007","9","7","538","","10.1039/b704569g","","","0.71073","MoKα","","0.0382","0.0294","","","0.0588","0.0613","","","","","","1.077","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202898","24.2053","0.0005","3.7445","0.0001","20.9542","0.0007","90","","121.315","0.0011","90","","1622.55","0.08","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-(4-Pyridyl)malondialdehyde Sesquihydrate","","- C8 H10 N O3.5 -","- C8 H10 N O3.5 -","- C64 H80 N8 O28 -","8","1","","Tovee, Clare A.; Kilner, Colin A.; Thomas, Jim A.; Halcrow, Malcolm A.","Zwitterionic 2-(4-pyridyl)malondialdehyde sesquihydrate forms a helical, 3-D hydrogen-bonded lattice","CrystEngComm","2007","9","5","361","","10.1039/b704626j","","","0.71073","MoKα","","0.0753","0.0534","","","0.136","0.1556","","","","","","1.043","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202899","9.6313","0.0009","10.9526","0.001","11.6996","0.0012","66.761","0.009","79.294","0.008","68.581","0.009","1054.5","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H21 F6 N2 P -","- C21 H21 F6 N2 P -","- C42 H42 F12 N4 P2 -","2","1","","Ruiz, Blanca; Coe, Benjamin J.; Gianotti, Reto; Gramlich, Volker; Jazbinsek, Mojca; Günter, Peter","Polymorphism, crystal growth and characterization of an organic nonlinear optical material: DAPSH","CrystEngComm","2007","9","9","772","","10.1039/b704737a","","","0.71073","MoKα","","0.108","0.0861","","","0.2592","0.2887","","","","","","1.106","","","","has coordinates,has disorder","180359","2020-10-21","18:00:00",""
"7202900","23.264","0.002","7.6256","0.001","35.89","0.004","90","","105.85","0.009","90","","6124.9","1.2","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H21 F6 N2 O0 P -","- C21 H21 F6 N2 P -","- C252 H252 F72 N24 P12 -","12","3","","Ruiz, Blanca; Coe, Benjamin J.; Gianotti, Reto; Gramlich, Volker; Jazbinsek, Mojca; Günter, Peter","Polymorphism, crystal growth and characterization of an organic nonlinear optical material: DAPSH","CrystEngComm","2007","9","9","772","","10.1039/b704737a","","","0.71073","MoKα","","0.3874","0.1553","","","0.3409","0.4715","","","","","","0.969","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202901","8.956","0.0006","12.0233","0.0009","19.2448","0.0014","83.695","0.002","87.711","0.002","73.878","0.002","1978.7","0.2","100","1","100","1","","","","","","","","7","P -1","-P 1","2","Mn (1-(5-ethoxy-2-(4-nitrophenyl)thiazoyl)-2-(4-methyl-2-(2- pyridyl)thiazoyl) perfluorocyclopentene) (hfac)2","Mn [1-[5-ethoxy-2-(4-nitrophenyl)thiazoyl]-2-[4-methyl-2-(2-pyridyl)thiazoyl] perfluorocyclopentene] (hfac)2","","- C35 H18 F18 Mn N4 O7 S2 -","- C35 H18 F18 Mn N4 O7 S2 -","- C70 H36 F36 Mn2 N8 O14 S4 -","2","1","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Lacroix, Pascal G.; Nakatani, Keitaro; Pansu, Robert; Maurel, François","Dithiazolylethene-based molecular switches for nonlinear optical properties and fluorescence: synthesis, crystal structure and ligating properties","Journal of Materials Chemistry","2007","17","41","4414","","10.1039/b704806h","","x-ray","0.71073","MoKα","","0.0845","0.0467","","","0.1054","0.118","","","","","","1.045","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202902","7.9782","0.0007","12.8551","0.001","23.714","0.002","90","","92.789","0.004","90","","2429.2","0.4","100","1","100","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1-(5-ethoxy-2-(4-nitrophenyl)thiazoyl)-2-(4-methyl-2-(2- pyridyl)thiazoyl) perfluorocyclopentene","1-[5-ethoxy-2-(4-nitrophenyl)thiazoyl]-2-[4-methyl-2-(2-pyridyl)thiazoyl] perfluorocyclopentene","","- C25 H16 F6 N4 O3 S2 -","- C25 H16 F6 N4 O3 S2 -","- C100 H64 F24 N16 O12 S8 -","4","1","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Lacroix, Pascal G.; Nakatani, Keitaro; Pansu, Robert; Maurel, François","Dithiazolylethene-based molecular switches for nonlinear optical properties and fluorescence: synthesis, crystal structure and ligating properties","Journal of Materials Chemistry","2007","17","41","4414","","10.1039/b704806h","","x-ray","0.71073","MoKα","","0.0558","0.0431","","","0.1071","0.1144","","","","","","1.071","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202903","8.946","0.005","11.774","0.005","19.493","0.005","92.804","0.005","91.091","0.005","105.202","0.005","1977.9","1.5","100","1","100","1","","","","","","","","7","P -1","-P 1","2","Cu (1-(5-ethoxy-2-(4-nitrophenyl)thiazoyl)-2-(4-methyl-2-(2- pyridyl)thiazoyl) perfluorocyclopentene) (hfac)2","Cu [1-[5-ethoxy-2-(4-nitrophenyl)thiazoyl]-2-[4-methyl-2-(2-pyridyl)thiazoyl] perfluorocyclopentene] (hfac)2","","- C35 H18 Cu F18 N4 O7 S2 -","- C35 H18 Cu F18 N4 O7 S2 -","- C70 H36 Cu2 F36 N8 O14 S4 -","2","1","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Lacroix, Pascal G.; Nakatani, Keitaro; Pansu, Robert; Maurel, François","Dithiazolylethene-based molecular switches for nonlinear optical properties and fluorescence: synthesis, crystal structure and ligating properties","Journal of Materials Chemistry","2007","17","41","4414","","10.1039/b704806h","","x-ray","0.71069","MoKα","","0.0636","0.0387","","","0.0927","0.1033","","","","","","0.995","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202904","25.685","0.005","14.069","0.005","16.562","0.005","90","","114.662","0.005","90","","5439","3","100","1","100","1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Ag (1-(5-ethoxy-2-(4-nitrophenyl)thiazoyl)-2-(4-methyl-2-(2- pyridyl)thiazoyl) perfluorocyclopentene)2 (CF3SO3)2","Ag [1-[5-ethoxy-2-(4-nitrophenyl)thiazoyl]-2-[4-methyl-2-(2-pyridyl)thiazoyl] perfluorocyclopentene]2 (CF3SO3)2","","- C51 H32 Ag F15 N8 O9 S5 -","- C51 H32 Ag F15 N8 O9 S5 -","- C204 H128 Ag4 F60 N32 O36 S20 -","4","0.5","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Lacroix, Pascal G.; Nakatani, Keitaro; Pansu, Robert; Maurel, François","Dithiazolylethene-based molecular switches for nonlinear optical properties and fluorescence: synthesis, crystal structure and ligating properties","Journal of Materials Chemistry","2007","17","41","4414","","10.1039/b704806h","","x-ray","0.71069","MoKα","","0.0569","0.0363","","","0.0813","0.095","","","","","","1.004","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202905","16.5004","0.0007","11.8425","0.0005","14.132","0.0007","90","","98.387","0.002","90","","2731.9","0.2","100","1","100","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1,2-bis(5-ethoxy-2-(4-nitro- phenyl)thiazoyl)perfluorocyclopentene","1,2-bis[5-ethoxy-2-(4-nitro-phenyl)thiazoyl]perfluorocyclopentene","","- C27 H18 F6 N4 O6 S2 -","- C27 H18 F6 N4 O6 S2 -","- C108 H72 F24 N16 O24 S8 -","4","1","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Lacroix, Pascal G.; Nakatani, Keitaro; Pansu, Robert; Maurel, François","Dithiazolylethene-based molecular switches for nonlinear optical properties and fluorescence: synthesis, crystal structure and ligating properties","Journal of Materials Chemistry","2007","17","41","4414","","10.1039/b704806h","","x-ray","0.71073","MoKα","","0.0925","0.0717","","","0.1873","0.2089","","","","","","1.025","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202906","7.0693","0.0002","9.4904","0.0003","17.7697","0.0004","90","","90.844","0.002","90","","1192.05","0.06","120","2","120","2","","","","","","","Pepe","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H16 B9 Co -","- C7 H16 B9 Co -","- C28 H64 B36 Co4 -","4","1","","Planas, José Giner; Viñas, Clara; Teixidor, Francesc; Light, Mark E.; Hursthouse, Michael B.","Polymorphism and phase transformations in cobaltacarborane molecular crystals","CrystEngComm","2007","9","10","888","","10.1039/b704833e","","","0.71073","MoKα","","0.038","0.0318","","","0.0942","0.1005","","","","","","1.017","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202907","9.9866","0.0011","9.9866","0.0011","9.9866","0.0011","90","","90","","90","","995.99","0.19","50","2","50","2","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Ga Nb4 S8 -","- Ga Nb4 S8 -","- Ga4 Nb16 S32 -","4","0.0416667","","Jakob, Stefanie; Müller, Helen; Johrendt, Dirk; Altmannshofer, Sandra; Scherer, Wolfgang; Rayaprol, Sudhindra; Pöttgen, Rainer","Structural and magnetic transitions in the Mott insulator GaNb4S8","Journal of Materials Chemistry","2007","17","36","3833","","10.1039/b704943a","","","0.71073","MoKα","","0.0358","0.0127","","","0.0478","0.0485","","","","","","1.351","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202908","9.9917","0.0014","9.9917","0.0014","9.978","0.002","90","","90","","90","","996.1","0.3","20","2","20","0.1","","","","","","","","3","P -4 21 m","P -4 2ab","113","","","","- Ga Nb4 S8 -","- Ga Nb4 S8 -","- Ga4 Nb16 S32 -","4","0.5","","Jakob, Stefanie; Müller, Helen; Johrendt, Dirk; Altmannshofer, Sandra; Scherer, Wolfgang; Rayaprol, Sudhindra; Pöttgen, Rainer","Structural and magnetic transitions in the Mott insulator GaNb4S8","Journal of Materials Chemistry","2007","17","36","3833","","10.1039/b704943a","","","0.71073","MoKα","","0.0273","0.0265","","","0.0778","0.079","","","","","","1.145","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202909","11.5009","0.0008","9.8934","0.0005","14.9322","0.0011","90","","112.168","0.001","90","","1573.44","0.18","173","2","173","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C20 H24 O2 -","- C20 H24 O2 -","- C80 H96 O8 -","4","1","","Yoshizawa, Kazuhiro; Toyota, Shinji; Toda, Fumio; Kato, Masako; Csöregh, Ingeborg","A new organic zeolite created by molecular aggregation of 1,1-bis(3,4-dihydroxyphenyl)cyclohexane in the solid state","CrystEngComm","2007","9","9","786","","10.1039/b705163h","","","0.7107","MoKα","","0.0425","0.0389","","","0.091","0.0939","","","","","","1.074","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202910","10.146","0.002","17.455","0.002","12.088","0.002","90","","110.9","0.02","90","","1999.9","0.6","298","2","298","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","1,1-bis(cathecolyl)cyclohexane.benzene (1:1) complex","1,1-bis(cathecolyl)cyclohexane.benzene (1:1) complex","","- C24 H26 O4 -","- C24 H25.364 O4 -","- C96 H101.456 O16 -","4","1","","Yoshizawa, Kazuhiro; Toyota, Shinji; Toda, Fumio; Kato, Masako; Csöregh, Ingeborg","A new organic zeolite created by molecular aggregation of 1,1-bis(3,4-dihydroxyphenyl)cyclohexane in the solid state","CrystEngComm","2007","9","9","786","","10.1039/b705163h","","","0.71073","MoKα","","0.0915","0.0532","","","0.1282","0.1452","","","","","","0.937","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202911","10.263","0.004","12.628","0.004","17.701","0.006","93.276","0.004","96.005","0.003","107.958","0.005","2160.6","1.3","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C26 H30 O4 -","- C26 H30 O4 -","- C104 H120 O16 -","4","2","","Yoshizawa, Kazuhiro; Toyota, Shinji; Toda, Fumio; Kato, Masako; Csöregh, Ingeborg","A new organic zeolite created by molecular aggregation of 1,1-bis(3,4-dihydroxyphenyl)cyclohexane in the solid state","CrystEngComm","2007","9","9","786","","10.1039/b705163h","","","0.7107","MoKα","","0.066","0.048","","","0.1308","0.1392","","","","","","1.102","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202912","9.405","0.003","10.934","0.004","17.343","0.006","84.339","0.005","86.416","0.006","70.879","0.005","1676","1","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H30 N2 O -","- C44 H30 N2 O -","- C88 H60 N4 O2 -","2","1","","Chen, Shiyan; Xu, Xinjun; Liu, Yunqi; Qiu, Wenfeng; Yu, Gui; Sun, Xiaobo; Zhang, Hengjun; Qi, Ting; Lu, Kun; Gao, Xike; Liu, Ying; Zhu, Daoben","Highly efficient blue electrophosphorescent devices with a new series of host materials: polyphenylene-dendronized oxadiazole derivatives","Journal of Materials Chemistry","2007","17","36","3788","","10.1039/b705515c","","","0.71073","MoKα","","0.1364","0.0551","","","0.1184","0.1667","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202913","16.035","0.005","19.797","0.005","24.936","0.005","90","0.005","104.979","0.005","90","0.005","7647","3","110","2","110","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C79 H122 Na2 O7 -","- C79 H122 Na2 O7 -","- C316 H488 Na8 O28 -","4","1","","Chen, Hsuan-Ying; Zhang, Jubo; Lin, Chu-Chieh; Reibenspies, Joseph H.; Miller, Stephen A.","Efficient and controlled polymerization of lactide under mild conditions with a sodium-based catalyst","Green Chemistry","2007","9","10","1038","","10.1039/b705622b","","","0.71073","MoKα","","0.0806","0.0631","","","0.1693","0.1963","","","","","","1.099","","","","has coordinates,has disorder","180360","2020-10-21","18:00:00",""
"7202914","5.9129","0.0007","13.4826","0.0016","15.6657","0.0018","72.973","0.002","79.228","0.002","83.562","0.002","1170.9","0.2","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H30 N2 O3 -","- C28 H30 N2 O3 -","- C56 H60 N4 O6 -","2","1","","Imai, Yoshitane; Kawaguchi, Kakuhiro; Asai, Katuzo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio","Chiral channel-like cavity which is tunable via changes in 21-column packing structure","CrystEngComm","2007","9","6","467","","10.1039/b705641a","","","0.71073","MoKα","","0.0972","0.0607","","","0.138","0.1688","","","","","","1.049","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202915","36.231","0.003","5.5605","0.0005","12.3394","0.0011","90","","92.661","0.002","90","","2483.2","0.4","120","2","120","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C29 H32 N2 O3 -","- C29 H32 N2 O3 -","- C116 H128 N8 O12 -","4","1","","Imai, Yoshitane; Kawaguchi, Kakuhiro; Asai, Katuzo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio","Chiral channel-like cavity which is tunable via changes in 21-column packing structure","CrystEngComm","2007","9","6","467","","10.1039/b705641a","","","0.71073","MoKα","","0.0453","0.0417","","","0.1031","0.1057","","","","","","1.039","","","","has coordinates,has disorder","180360","2020-10-21","18:00:00",""
"7202916","36.599","0.006","5.6822","0.0009","12.545","0.002","90","","90.891","0.003","90","","2608.6","0.7","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C30 H34 N2 O3 -","- C30 H33 N2 O3 -","- C120 H132 N8 O12 -","4","1","","Imai, Yoshitane; Kawaguchi, Kakuhiro; Asai, Katuzo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio","Chiral channel-like cavity which is tunable via changes in 21-column packing structure","CrystEngComm","2007","9","6","467","","10.1039/b705641a","","","0.71073","MoKα","","0.1499","0.0779","","","0.1861","0.2262","","","","","","1.043","","","","has coordinates,has disorder","180360","2020-10-21","18:00:00",""
"7202917","36.751","0.008","5.6734","0.0012","12.304","0.003","90","","90.865","0.007","90","","2565.1","1","120","2","120","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C31 H29 N2 O3 -","- C31 H35 N2 O3 -","- C124 H140 N8 O12 -","4","1","","Imai, Yoshitane; Kawaguchi, Kakuhiro; Asai, Katuzo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio","Chiral channel-like cavity which is tunable via changes in 21-column packing structure","CrystEngComm","2007","9","6","467","","10.1039/b705641a","","","0.71073","MoKα","","0.115","0.0874","","","0.229","0.2541","","","","","","1.024","","","","has coordinates,has disorder","180360","2020-10-21","18:00:00",""
"7202918","12.2472","0.0013","5.6733","0.0006","20.771","0.002","90","","105.388","0.002","90","","1391.5","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C32 H38 N2 O3 -","- C32 H38 N2 O3 -","- C64 H76 N4 O6 -","2","1","","Imai, Yoshitane; Kawaguchi, Kakuhiro; Asai, Katuzo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio","Chiral channel-like cavity which is tunable via changes in 21-column packing structure","CrystEngComm","2007","9","6","467","","10.1039/b705641a","","","0.71073","MoKα","","0.0649","0.0547","","","0.1117","0.117","","","","","","1.036","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202919","7.7477","0.0008","18.698","0.002","5.7744","0.0006","90","","90","","90","","836.52","0.15","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C7 H5 N O6 Zn2 -","- C7 H5 N O6 Zn2 -","- C28 H20 N4 O24 Zn8 -","4","1","","Li, Zhi-Gang; Wang, Guan-Hua; Jia, Heng-Qing; Hu, Ning-Hai; Xu, Jing-Wei","Supramolecular isomerism in zinc hydroxide coordination polymers with pyridine-2,4-dicarboxylic acid: Two polymorphs with centrosymmetric two-dimensional and acentric three-dimensional coordination networks","CrystEngComm","2007","9","10","882","","10.1039/b705735k","","","0.71073","MoKα","","0.0259","0.0244","","","0.0614","0.062","","","","","","1.044","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202920","9.3424","0.0011","6.7836","0.0008","13.9741","0.0017","90","","100.688","0.002","90","","870.25","0.18","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H5 N O6 Zn2 -","- C7 H5 N O6 Zn2 -","- C28 H20 N4 O24 Zn8 -","4","1","","Li, Zhi-Gang; Wang, Guan-Hua; Jia, Heng-Qing; Hu, Ning-Hai; Xu, Jing-Wei","Supramolecular isomerism in zinc hydroxide coordination polymers with pyridine-2,4-dicarboxylic acid: Two polymorphs with centrosymmetric two-dimensional and acentric three-dimensional coordination networks","CrystEngComm","2007","9","10","882","","10.1039/b705735k","","","0.71073","MoKα","","0.0359","0.0279","","","0.0712","0.076","","","","","","1.098","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202921","9.3365","0.0011","6.7815","0.0008","13.9607","0.0016","90","","100.704","0.002","90","","868.55","0.18","153","1","153","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H5 N O6 Zn2 -","- C7 H5 N O6 Zn2 -","- C28 H20 N4 O24 Zn8 -","4","1","","Li, Zhi-Gang; Wang, Guan-Hua; Jia, Heng-Qing; Hu, Ning-Hai; Xu, Jing-Wei","Supramolecular isomerism in zinc hydroxide coordination polymers with pyridine-2,4-dicarboxylic acid: Two polymorphs with centrosymmetric two-dimensional and acentric three-dimensional coordination networks","CrystEngComm","2007","9","10","882","","10.1039/b705735k","","","0.71073","MoKα","","0.0323","0.0256","","","0.0639","0.0675","","","","","","1.008","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202922","7.6827","0.0006","18.7212","0.0014","5.7833","0.0004","90","","90","","90","","831.81","0.11","153","1","153","1","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C7 H5 N O6 Zn2 -","- C7 H5 N O6 Zn2 -","- C28 H20 N4 O24 Zn8 -","4","1","","Li, Zhi-Gang; Wang, Guan-Hua; Jia, Heng-Qing; Hu, Ning-Hai; Xu, Jing-Wei","Supramolecular isomerism in zinc hydroxide coordination polymers with pyridine-2,4-dicarboxylic acid: Two polymorphs with centrosymmetric two-dimensional and acentric three-dimensional coordination networks","CrystEngComm","2007","9","10","882","","10.1039/b705735k","","","0.71073","MoKα","","0.0213","0.0207","","","0.0554","0.0556","","","","","","1.089","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202923","8.3945","0.0008","15.806","0.0016","14.8833","0.0015","90","","100.332","0.002","90","","1942.7","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H22 Co N3 O11 -","- C15 H22 Co N3 O11 -","- C60 H88 Co4 N12 O44 -","4","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Conformation dependent network structures in the coordination polymers derived from pyridylisonicotinamides, carboxylates and Co(ii): Entrapment of (H2O)14 water cluster of an unprecedented topology","CrystEngComm","2007","9","10","895","","10.1039/b705851a","","","0.71073","MoKα","","0.0778","0.0531","","","0.1179","0.1298","","","","","","1.006","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202924","8.8363","0.0013","10.4211","0.0016","10.8556","0.0016","78.769","0.003","75.255","0.003","68.71","0.003","894.9","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H20 Co N3 O10 -","- C15 H20 Co N3 O10 -","- C30 H40 Co2 N6 O20 -","2","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Conformation dependent network structures in the coordination polymers derived from pyridylisonicotinamides, carboxylates and Co(ii): Entrapment of (H2O)14 water cluster of an unprecedented topology","CrystEngComm","2007","9","10","895","","10.1039/b705851a","","","0.71073","MoKα","","0.1037","0.065","","","0.1573","0.1989","","","","","","1.067","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202925","14.887","0.0013","11.8596","0.001","13.9457","0.0012","90","","115.344","0.001","90","","2225.2","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H26 Co N3 O12 -","- C19 H26 Co N3 O12 -","- C76 H104 Co4 N12 O48 -","4","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Conformation dependent network structures in the coordination polymers derived from pyridylisonicotinamides, carboxylates and Co(ii): Entrapment of (H2O)14 water cluster of an unprecedented topology","CrystEngComm","2007","9","10","895","","10.1039/b705851a","","","0.71073","MoKα","","0.0564","0.0451","","","0.102","0.1067","","","","","","1.087","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202926","14.228","0.002","14.831","0.003","14.954","0.003","61.237","0.003","79.335","0.003","66.117","0.003","2529.1","0.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H37 Co2 N6 O28 -","- C38 H37 Co2 N6 O28 -","- C76 H74 Co4 N12 O56 -","2","1","","Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi","Conformation dependent network structures in the coordination polymers derived from pyridylisonicotinamides, carboxylates and Co(ii): Entrapment of (H2O)14 water cluster of an unprecedented topology","CrystEngComm","2007","9","10","895","","10.1039/b705851a","","","0.71073","MoKα","","0.1492","0.0913","","","0.2158","0.2563","","","","","","1.05","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202927","7.4425","0.0011","14.654","0.002","14.796","0.003","114.311","0.01","102.45","0.011","95.86","0.014","1402.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H32 Co N2 O20 -","- C20 H32 Co N2 O20 -","- C40 H64 Co2 N4 O40 -","2","1","","Fabelo, Oscar; Pasán, Jorge; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Structural versatility in cobalt(ii) complexes with 1,2,4,5-benzenetetracarboxylic acid (H4bta) and 4,4′-bipyridine-N,N′-dioxide (dpo)","CrystEngComm","2007","9","9","815","","10.1039/b706035c","","x-ray","0.71073","MoKα","","0.0923","0.0615","","","0.1331","0.1532","","","","","","1.217","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202928","8.4119","0.0014","8.5298","0.0009","13.321","0.003","85.328","0.011","76.027","0.014","80.489","0.013","913.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H21 Co N2 O12 -","- C15 H21 Co N2 O12 -","- C30 H42 Co2 N4 O24 -","2","1","","Fabelo, Oscar; Pasán, Jorge; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Structural versatility in cobalt(ii) complexes with 1,2,4,5-benzenetetracarboxylic acid (H4bta) and 4,4′-bipyridine-N,N′-dioxide (dpo)","CrystEngComm","2007","9","9","815","","10.1039/b706035c","","x-ray","0.71073","MoKα","","0.0692","0.0368","","","0.0665","0.0738","","","","","","1.007","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202929","7.6523","0.0008","9.522","0.001","10.7629","0.0008","112.019","0.006","92.828","0.007","100.95","0.009","707.51","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H24 Co N4 O14 -","- C30 H24 Co N4 O14 -","- C30 H24 Co N4 O14 -","1","0.5","","Fabelo, Oscar; Pasán, Jorge; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Structural versatility in cobalt(ii) complexes with 1,2,4,5-benzenetetracarboxylic acid (H4bta) and 4,4′-bipyridine-N,N′-dioxide (dpo)","CrystEngComm","2007","9","9","815","","10.1039/b706035c","","x-ray","0.71073","MoKα","","0.0319","0.0257","","","0.0607","0.0635","","","","","","1.133","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202930","10.9277","0.0009","11.1926","0.0006","12.7187","0.0009","90","","97.006","0.006","90","","1544","0.19","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 Co N2 O9 -","- C15 H15 Co N2 O9 -","- C60 H60 Co4 N8 O36 -","4","1","","Fabelo, Oscar; Pasán, Jorge; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Structural versatility in cobalt(ii) complexes with 1,2,4,5-benzenetetracarboxylic acid (H4bta) and 4,4′-bipyridine-N,N′-dioxide (dpo)","CrystEngComm","2007","9","9","815","","10.1039/b706035c","","x-ray","0.71073","MoKα","","0.1257","0.0594","","","0.0785","0.0923","","","","","","1.104","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202931","21.8492","0.0012","21.8492","0.0012","7.3635","0.0009","90","","90","","90","","3515.2","0.5","100","2","100","2","","","","","","","","4","I 41/a :2","-I 4ad","88","Tetrakis-(4-sulfonatophenyl)methane","Tetrakis-(4-sulfonatophenyl)methane","","- C50 H32 O44 S8 -","- C50 H32 O44 S8 -","- C100 H64 O88 S16 -","2","0.125","","Sarma, Bipul; Nangia, Ashwini","Tetrakis(4-sulfophenyl)methane dodecahydrate. Reversible and selective water inclusion and release in an organic host","CrystEngComm","2007","9","8","628","","10.1039/b706194c","","","0.71073","MoKα","","0.1272","0.0818","","","0.1821","0.2067","","","","","","1.084","","","","has coordinates,has disorder","180360","2020-10-21","18:00:00",""
"7202932","29.62","0.015","8.458","0.004","13.838","0.007","90","","90","","90","","3467","3","218","2","218","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C20 H40 N4 O8 S8 Zn2 -","- C20 H40 N4 O8 S8 Zn2 -","- C80 H160 N16 O32 S32 Zn8 -","4","0.5","","Benson, Ronald E.; Ellis, Carol A.; Lewis, Clairissa E.; Tiekink, Edward R.T.","3D-, 2D- and 1D-supramolecular structures of {Zn[S2CN(CH2CH2OH)R]2}2 and their {Zn[S2CN(CH2CH2OH)R]2}2(4,4′-bipyridine) adducts for R = CH2CH2OH, Me or Et: polymorphism and pseudo-polymorphism","CrystEngComm","2007","9","10","930","","10.1039/b706442j","","","0.71069","MoKα","","0.041","0.036","","","0.086","0.089","","","","","","1.17","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202933","8.3821","0.0015","11.6432","0.0018","16.978","0.004","90","","102.926","0.005","90","","1615","0.5","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H40 N4 O4 S8 Zn2 -","- C20 H39.14 N4 O4 S8 Zn2 -","- C40 H78.28 N8 O8 S16 Zn4 -","2","0.5","","Benson, Ronald E.; Ellis, Carol A.; Lewis, Clairissa E.; Tiekink, Edward R.T.","3D-, 2D- and 1D-supramolecular structures of {Zn[S2CN(CH2CH2OH)R]2}2 and their {Zn[S2CN(CH2CH2OH)R]2}2(4,4′-bipyridine) adducts for R = CH2CH2OH, Me or Et: polymorphism and pseudo-polymorphism","CrystEngComm","2007","9","10","930","","10.1039/b706442j","","","0.7107","MoKα","","0.049","0.048","","","0.123","0.123","","","","","","1.08","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7202934","10.47","0.004","12.345","0.006","12.615","0.006","95.483","0.013","96.282","0.01","100.576","0.011","1582","1.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H36 N4 O5 S8 Zn2 -","- C17 H36 N4 O5 S8 Zn2 -","- C34 H72 N8 O10 S16 Zn4 -","2","1","","Benson, Ronald E.; Ellis, Carol A.; Lewis, Clairissa E.; Tiekink, Edward R.T.","3D-, 2D- and 1D-supramolecular structures of {Zn[S2CN(CH2CH2OH)R]2}2 and their {Zn[S2CN(CH2CH2OH)R]2}2(4,4′-bipyridine) adducts for R = CH2CH2OH, Me or Et: polymorphism and pseudo-polymorphism","CrystEngComm","2007","9","10","930","","10.1039/b706442j","","","0.7107","MoKα","","0.087","0.069","","","0.151","0.163","","","","","","1.14","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202935","11.249","0.004","13.214","0.005","15.581","0.006","105.335","0.003","105.092","0.004","93.881","0.005","2133.2","1.4","218","2","218","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H48 N6 O8 S8 Zn2 -","- C30 H47.64 N6 O8 S8 Zn2 -","- C60 H95.28 N12 O16 S16 Zn4 -","2","1","","Benson, Ronald E.; Ellis, Carol A.; Lewis, Clairissa E.; Tiekink, Edward R.T.","3D-, 2D- and 1D-supramolecular structures of {Zn[S2CN(CH2CH2OH)R]2}2 and their {Zn[S2CN(CH2CH2OH)R]2}2(4,4′-bipyridine) adducts for R = CH2CH2OH, Me or Et: polymorphism and pseudo-polymorphism","CrystEngComm","2007","9","10","930","","10.1039/b706442j","","","0.71069","MoKα","","0.07","0.05","","","0.106","0.118","","","","","","1.06","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7202936","11.074","0.006","13.249","0.005","15.35","0.006","104.546","0.007","107.095","0.015","92.74","0.008","2065.6","1.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H48 N6 O4 S8 Zn2 -","- C30 H48 N6 O4 S8 Zn2 -","- C60 H96 N12 O8 S16 Zn4 -","2","1","","Benson, Ronald E.; Ellis, Carol A.; Lewis, Clairissa E.; Tiekink, Edward R.T.","3D-, 2D- and 1D-supramolecular structures of {Zn[S2CN(CH2CH2OH)R]2}2 and their {Zn[S2CN(CH2CH2OH)R]2}2(4,4′-bipyridine) adducts for R = CH2CH2OH, Me or Et: polymorphism and pseudo-polymorphism","CrystEngComm","2007","9","10","930","","10.1039/b706442j","","","0.7107","MoKα","","0.064","0.059","","","0.162","0.168","","","","","","1.1","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202937","9.5416","0.0018","11.309","0.002","11.418","0.002","75.64","0.004","73.016","0.004","85.238","0.004","1141.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H56 N6 O6 S8 Zn2 -","- C32 H56 N6 O6 S8 Zn2 -","- C32 H56 N6 O6 S8 Zn2 -","1","0.5","","Benson, Ronald E.; Ellis, Carol A.; Lewis, Clairissa E.; Tiekink, Edward R.T.","3D-, 2D- and 1D-supramolecular structures of {Zn[S2CN(CH2CH2OH)R]2}2 and their {Zn[S2CN(CH2CH2OH)R]2}2(4,4′-bipyridine) adducts for R = CH2CH2OH, Me or Et: polymorphism and pseudo-polymorphism","CrystEngComm","2007","9","10","930","","10.1039/b706442j","","","0.71069","MoKα","","0.05","0.041","","","0.103","0.111","","","","","","1.03","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7202938","8.6591","0.0007","14.0066","0.0011","15.5984","0.0013","90","","97.409","0.002","90","","1876","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H40 N6 O4 S8 Zn2 -","- C26 H40 N6 O4 S8 Zn2 -","- C52 H80 N12 O8 S16 Zn4 -","2","0.5","","Benson, Ronald E.; Ellis, Carol A.; Lewis, Clairissa E.; Tiekink, Edward R.T.","3D-, 2D- and 1D-supramolecular structures of {Zn[S2CN(CH2CH2OH)R]2}2 and their {Zn[S2CN(CH2CH2OH)R]2}2(4,4′-bipyridine) adducts for R = CH2CH2OH, Me or Et: polymorphism and pseudo-polymorphism","CrystEngComm","2007","9","10","930","","10.1039/b706442j","","","0.71069","MoKα","","0.04","0.032","","","0.068","0.071","","","","","","1.05","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7202939","5.4669","0.0013","9.497","0.002","11.694","0.003","83.366","0.003","89.406","0.004","77.092","0.004","587.8","0.2","293","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H30 N4 O14 P4 -","- C14 H30 N4 O14 P4 -","- C14 H30 N4 O14 P4 -","1","0.5","","Wu, Simin; Chen, Shuoping; Li, Ming; Xiang, Jiangfeng; Xiao, Yong; Yuan, Liangjie","Self-assembly of organic acid‒base compounds from 2-D layered network to 3-D supramolecular framework: synthesis, structure and photoluminescence","CrystEngComm","2007","9","10","907","","10.1039/b706485c","","","0.71073","MoKα","","0.0579","0.0545","","","0.1569","0.1579","","","","","","1.172","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202940","7.0561","0.0006","9.9086","0.0008","13.0837","0.001","83.777","0.001","79.444","0.001","85.213","0.001","892.09","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H21 N3 O8 P2 -","- C14 H19 N3 O8 P2 -","- C28 H38 N6 O16 P4 -","2","1","","Wu, Simin; Chen, Shuoping; Li, Ming; Xiang, Jiangfeng; Xiao, Yong; Yuan, Liangjie","Self-assembly of organic acid‒base compounds from 2-D layered network to 3-D supramolecular framework: synthesis, structure and photoluminescence","CrystEngComm","2007","9","10","907","","10.1039/b706485c","","","0.71073","MoKα","","0.0539","0.0482","","","0.1295","0.1356","","","","","","1.024","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202941","7.4045","0.0005","11.7344","0.0008","12.485","0.0008","74.149","0.001","85.389","0.001","72.903","0.001","997.42","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H24 N3 O11 P3 -","- C13 H24 N3 O11 P3 -","- C26 H48 N6 O22 P6 -","2","1","","Wu, Simin; Chen, Shuoping; Li, Ming; Xiang, Jiangfeng; Xiao, Yong; Yuan, Liangjie","Self-assembly of organic acid‒base compounds from 2-D layered network to 3-D supramolecular framework: synthesis, structure and photoluminescence","CrystEngComm","2007","9","10","907","","10.1039/b706485c","","","0.71073","MoKα","","0.0388","0.035","","","0.0969","0.1004","","","","","","1.063","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202942","7.2243","0.0005","12.3575","0.0008","13.2057","0.0009","80.957","0.001","89.559","0.001","78.953","0.001","1142.4","0.13","293","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H28 N3 O13 P3 -","- C15 H26 N3 O13 P3 -","- C30 H52 N6 O26 P6 -","2","1","","Wu, Simin; Chen, Shuoping; Li, Ming; Xiang, Jiangfeng; Xiao, Yong; Yuan, Liangjie","Self-assembly of organic acid‒base compounds from 2-D layered network to 3-D supramolecular framework: synthesis, structure and photoluminescence","CrystEngComm","2007","9","10","907","","10.1039/b706485c","","","0.71073","MoKα","","0.0398","0.0373","","","0.1062","0.1083","","","","","","1.058","","","","has coordinates,has disorder","180360","2020-10-21","18:00:00",""
"7202943","7.596","0.006","12.988","0.011","20.897","0.017","100.891","0.011","95.406","0.01","95.522","0.01","2002","3","143.1","","","","","","","","","","","4","P -1","-P 1","2","4-Amino-1-(3,5-bis-(1-oxyl-3-oxido-4,4,5,5-tetramethyl- imidazolidin-2-yl)-benzyl)-1H-pyrimidin-2-one 2-amino-9-butyl-1,9- dihydro-purin-6-one","","","- C36 H52 N12 O7 -","- C36 H51 N12 O7 -","- C72 H102 N24 O14 -","2","1","","Tanaka, Hiroyuki; Shiomi, Daisuke; Ise, Tomoaki; Sato, Kazunobu; Takui, Takeji","Cytosine‒guanine base pairing in a hydrogen-bonded complex of stable open-shell molecules with S = 1 spins","CrystEngComm","2007","9","9","767","","10.1039/b706521n","","","0.7107","MoKα","","","0.0999","","","","0.2666","","","","","","1.001","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202944","20.268","0.003","10.0519","0.0013","22.389","0.003","90","","90","","90","","4561.4","1.1","293","2","293","2","","","","","","","","2","P b c a","-P 2ac 2ab","61","","","","- C62 H52 -","- C62 H52 -","- C248 H208 -","4","0.5","","Kim, Soo-Kang; Park, Young-Il; Kang, In-Nam; Park, Jong-Wook","New deep-blue emitting materials based on fully substituted ethylene derivatives","Journal of Materials Chemistry","2007","17","44","4670","","10.1039/b706606f","","","0.71073","MoKα","","0.3411","0.1204","","","0.2709","0.4222","","","","","","0.972","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202945","8.7001","0.0002","10.0485","0.0002","14.2342","0.0003","105.956","0.0012","94.3267","0.0012","107.717","0.0012","1122.38","0.04","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H22 Ag Cl N2 O6 -","- C22 H22 Ag Cl N2 O6 -","- C44 H44 Ag2 Cl2 N4 O12 -","2","1","","Patra, Goutam K.; Goldberg, Israel; De, Senjuti; Datta, Dipankar","Effect of the size of discrete anions on the nuclearity of a complex cation","CrystEngComm","2007","9","9","828","","10.1039/b706781j","","","0.71073","MoKα","","0.0574","0.0355","","","0.0801","0.0892","","","","","","1.033","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202946","11.2181","0.0002","11.614","0.0001","13.7958","0.0002","77.7882","0.0005","81.4908","0.0005","76.7651","0.0005","1700.7","0.04","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H28 Ag F3 N4 O3 S -","- C41 H28 Ag F3 N4 O3 S -","- C82 H56 Ag2 F6 N8 O6 S2 -","2","1","","Patra, Goutam K.; Goldberg, Israel; De, Senjuti; Datta, Dipankar","Effect of the size of discrete anions on the nuclearity of a complex cation","CrystEngComm","2007","9","9","828","","10.1039/b706781j","","","0.71073","MoKα","","0.036","0.0287","","","0.0686","0.0724","","","","","","1.003","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202947","13.729","0.0002","17.3654","0.0002","8.5825","0.0004","90","","90","","90","","2046.15","0.1","110","2","110","2","","","","","","","","7","P 21 21 2","P 2 2ab","18","","","","- C42 H32 Ag2 B2 F8 N4 O3 -","- C42 H32 Ag2 B2 F8 N4 O3 -","- C84 H64 Ag4 B4 F16 N8 O6 -","2","0.5","","Patra, Goutam K.; Goldberg, Israel; De, Senjuti; Datta, Dipankar","Effect of the size of discrete anions on the nuclearity of a complex cation","CrystEngComm","2007","9","9","828","","10.1039/b706781j","","","0.71073","MoKα","","0.0331","0.0307","","","0.0773","0.0794","","","","","","1.075","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202948","11.1133","0.0003","12.2933","0.0002","13.1444","0.0003","74.591","0.0014","83.1028","0.0011","74.0146","0.0012","1662.15","0.07","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H28 Ag F3 N4 O2 -","- C42 H28 Ag F3 N4 O2 -","- C84 H56 Ag2 F6 N8 O4 -","2","1","","Patra, Goutam K.; Goldberg, Israel; De, Senjuti; Datta, Dipankar","Effect of the size of discrete anions on the nuclearity of a complex cation","CrystEngComm","2007","9","9","828","","10.1039/b706781j","","","0.71073","MoKα","","0.038","0.0317","","","0.0705","0.074","","","","","","1.039","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202949","13.3039","0.0002","7.0004","0.0001","21.1996","0.0004","90","","96.5097","0.0007","90","","1961.64","0.06","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H14 Ag2 N4 O6 -","- C20 H14 Ag2 N4 O6 -","- C80 H56 Ag8 N16 O24 -","4","1","","Patra, Goutam K.; Goldberg, Israel; De, Senjuti; Datta, Dipankar","Effect of the size of discrete anions on the nuclearity of a complex cation","CrystEngComm","2007","9","9","828","","10.1039/b706781j","","","0.71073","MoKα","","0.0469","0.0357","","","0.0849","0.0908","","","","","","1.085","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202950","10.6509","0.0005","15.9095","0.0008","7.248","0.0004","90","","93.044","0.005","90","","1226.44","0.11","100","0.2","100","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H16 Hg N14 O2 -","- C24 H16 Hg N14 O2 -","- C48 H32 Hg2 N28 O4 -","2","0.5","","Mahmoudi, Ghodrat; Morsali, Ali","Counter-ion influence on the coordination mode of the 2,5-bis(4-pyridyl)-1,3,4-oxadiazole (bpo) ligand in mercury(ii) coordination polymers, [Hg(bpo)nX2]: X = I‒, Br‒, SCN‒, N3‒ and NO2‒; spectroscopic, thermal, fluorescence and structural studies","CrystEngComm","2007","9","11","1062","","10.1039/b707228g","","","0.71073","MoKα","","0.0351","0.0303","","","0.0744","0.079","","","","","","1.033","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202951","34.493","0.004","5.921","0.0007","18.57","0.002","90","","121.566","0.001","90","","3231.4","0.6","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H8 Hg N6 O S2 -","- C14 H8 Hg N6 O S2 -","- C112 H64 Hg8 N48 O8 S16 -","8","1","","Mahmoudi, Ghodrat; Morsali, Ali","Counter-ion influence on the coordination mode of the 2,5-bis(4-pyridyl)-1,3,4-oxadiazole (bpo) ligand in mercury(ii) coordination polymers, [Hg(bpo)nX2]: X = I‒, Br‒, SCN‒, N3‒ and NO2‒; spectroscopic, thermal, fluorescence and structural studies","CrystEngComm","2007","9","11","1062","","10.1039/b707228g","","","0.71073","MoKα","","0.0402","0.0312","","","0.0744","0.078","","","","","","1.008","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202952","11.4448","0.001","22.0985","0.0019","8.4069","0.0007","90","","100.226","0.002","90","","2092.4","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 Hg2 I4 N4 O -","- C12 H8 Hg2 I4 N4 O -","- C48 H32 Hg8 I16 N16 O4 -","4","1","","Mahmoudi, Ghodrat; Morsali, Ali","Counter-ion influence on the coordination mode of the 2,5-bis(4-pyridyl)-1,3,4-oxadiazole (bpo) ligand in mercury(ii) coordination polymers, [Hg(bpo)nX2]: X = I‒, Br‒, SCN‒, N3‒ and NO2‒; spectroscopic, thermal, fluorescence and structural studies","CrystEngComm","2007","9","11","1062","","10.1039/b707228g","","","0.71073","MoKα","","0.0623","0.0505","","","0.1091","0.1137","","","","","","1.108","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202953","5.2468","0.0006","21.221","0.002","13.2169","0.0014","90","","96.837","0.002","90","","1461.1","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 Br2 Hg N4 O -","- C12 H8 Br2 Hg N4 O -","- C48 H32 Br8 Hg4 N16 O4 -","4","1","","Mahmoudi, Ghodrat; Morsali, Ali","Counter-ion influence on the coordination mode of the 2,5-bis(4-pyridyl)-1,3,4-oxadiazole (bpo) ligand in mercury(ii) coordination polymers, [Hg(bpo)nX2]: X = I‒, Br‒, SCN‒, N3‒ and NO2‒; spectroscopic, thermal, fluorescence and structural studies","CrystEngComm","2007","9","11","1062","","10.1039/b707228g","","","0.71073","MoKα","","0.0406","0.0362","","","0.0887","0.091","","","","","","1.056","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202954","5.9134","0.0008","18.776","0.002","13.2924","0.0017","90","","101.608","0.002","90","","1445.7","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 Hg N6 O5 -","- C12 H8 Hg N6 O5 -","- C48 H32 Hg4 N24 O20 -","4","1","","Mahmoudi, Ghodrat; Morsali, Ali","Counter-ion influence on the coordination mode of the 2,5-bis(4-pyridyl)-1,3,4-oxadiazole (bpo) ligand in mercury(ii) coordination polymers, [Hg(bpo)nX2]: X = I‒, Br‒, SCN‒, N3‒ and NO2‒; spectroscopic, thermal, fluorescence and structural studies","CrystEngComm","2007","9","11","1062","","10.1039/b707228g","","","0.71073","MoKα","","0.0262","0.024","","","0.0585","0.0595","","","","","","1.101","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202955","15.3004","0.0005","15.3004","0.0005","43.667","0.003","90","","90","","120","","8853","0.7","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- H5 Mn43 Na17 O144 P36 -","- Mn43 Na17 O144 P36 -","- Mn129 Na51 O432 P108 -","3","0.166667","","Wang, Jingping; Bi, Dongqin; Niu, Jingyang","A three-dimensional heterocluster containing manganese clusters and hexanuclear sodium wheels","CrystEngComm","2007","9","9","740","","10.1039/b707476j","","","0.71073","MoKα","","0.0353","0.0307","","","0.0709","0.0731","","","","","","1.047","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202956","12.143","0.004","12.325","0.004","13.869","0.004","99.008","0.012","96.572","0.012","95.481","0.013","2022.9","1.1","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H28 Au2 Cl4 F6 O4 P2 -","- C36 H28 Au2 Cl4 F6 O4 P2 -","- C72 H56 Au4 Cl8 F12 O8 P4 -","2","1","","Deák, Andrea; Tunyogi, Tünde; Tárkányi, Gábor; Király, Péter; Pálinkás, Gábor","Self-assembly of gold(i) with diphosphine and bitopic nitrogen donor linkers in the presence of trifluoroacetate anion: formation of coordination polymer versus discrete macrocycle","CrystEngComm","2007","9","8","640","","10.1039/b707579k","","","0.71073","MoKα","","0.0629","0.0558","","","0.1372","0.1424","","","","","","1.059","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202957","19.827","0.002","19.827","0.002","22.206","0.003","90","","90","","90","","8729.4","1.7","103","2","103","2","","","","","","","","8","I -4 2 d","I -4 2bw","122","","","","- C45 H34 Au2 Cl2 F6 N2 O4 P2 -","- C45 H34 Au2 Cl2 F6 N2 O4 P2 -","- C360 H272 Au16 Cl16 F48 N16 O32 P16 -","8","0.5","","Deák, Andrea; Tunyogi, Tünde; Tárkányi, Gábor; Király, Péter; Pálinkás, Gábor","Self-assembly of gold(i) with diphosphine and bitopic nitrogen donor linkers in the presence of trifluoroacetate anion: formation of coordination polymer versus discrete macrocycle","CrystEngComm","2007","9","8","640","","10.1039/b707579k","","","0.71073","MoKα","","0.0655","0.0634","","","0.136","0.1371","","","","","","1.207","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202958","10.0634","0.0014","21.126","0.003","22.728","0.004","90","","100.424","0.006","90","","4752.2","1.3","123","2","123","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C94 H80 Au4 Cl4 F12 N4 O12 P4 -","- C94 H80 Au4 Cl4 F12 N4 O12 P4 -","- C188 H160 Au8 Cl8 F24 N8 O24 P8 -","2","0.5","","Deák, Andrea; Tunyogi, Tünde; Tárkányi, Gábor; Király, Péter; Pálinkás, Gábor","Self-assembly of gold(i) with diphosphine and bitopic nitrogen donor linkers in the presence of trifluoroacetate anion: formation of coordination polymer versus discrete macrocycle","CrystEngComm","2007","9","8","640","","10.1039/b707579k","","","0.71073","MoKα","","0.0486","0.0386","","","0.0801","0.0841","","","","","","1.037","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202959","6.7981","0.0008","7.1085","0.0009","9.5555","0.001","71.489","0.011","84.54","0.009","69.982","0.012","411.37","0.09","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H9 N O2 -","- C10 H9 N O2 -","- C20 H18 N2 O4 -","2","1","","Niedziałek, Dorota; Urbanczyk-Lipkowska, Zofia","New crystalline form of 7-amino-4-methylcoumarin (coumarin 120)—a polymorph with 1 ∶ 1 valence tautomers","CrystEngComm","2007","9","9","735","","10.1039/b707581b","","","0.71073","MoKα","","0.0701","0.0306","","","0.0546","0.0592","","","","","","0.74","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202960","9.7381","0.001","25.655","0.003","13.6416","0.0014","90","","105.04","0.009","90","","3291.3","0.6","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","7-amino-4-methylcoumarin","7-amino-4-methylcoumarin","","- C10 H9 N O2 -","- C10 H9 N O2 -","- C160 H144 N16 O32 -","16","2","","Niedziałek, Dorota; Urbanczyk-Lipkowska, Zofia","New crystalline form of 7-amino-4-methylcoumarin (coumarin 120)—a polymorph with 1 ∶ 1 valence tautomers","CrystEngComm","2007","9","9","735","","10.1039/b707581b","","","0.71073","MoKα","","0.1079","0.0513","","","0.114","0.133","","","","","","0.96","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202961","11.9869","0.001","12.7263","0.001","13.6184","0.0011","88.244","0.001","75.796","0.001","77.068","0.001","1962.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H35 Eu N4 O14 S3 -","- C39 H25 Eu N4 O14 S3 -","- C78 H50 Eu2 N8 O28 S6 -","2","1","","Zhao, Jiong-Peng; Hu, Bo-Wen; Liu, Fu-Chen; Hu, Xin; Zeng, Yong-Fei; Bu, Xian-He","Arenedisulfonate‒lanthanide supramolecular architectures with phenanthroline as a co-ligand: syntheses and structures","CrystEngComm","2007","9","10","902","","10.1039/b707622c","","","0.71073","MoKα","","0.0354","0.031","","","0.0782","0.0799","","","","","","0.992","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202962","11.9725","0.001","12.7153","0.001","13.5923","0.0011","88.299","0.001","75.855","0.001","77.128","0.001","1955.4","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H35 Gd N4 O14 S3 -","- C39 H25 Gd N4 O14 S3 -","- C78 H50 Gd2 N8 O28 S6 -","2","1","","Zhao, Jiong-Peng; Hu, Bo-Wen; Liu, Fu-Chen; Hu, Xin; Zeng, Yong-Fei; Bu, Xian-He","Arenedisulfonate‒lanthanide supramolecular architectures with phenanthroline as a co-ligand: syntheses and structures","CrystEngComm","2007","9","10","902","","10.1039/b707622c","","","0.71073","MoKα","","0.034","0.0297","","","0.0741","0.0755","","","","","","1.007","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202963","12.048","0.001","12.767","0.001","13.6822","0.0011","88.259","0.001","75.781","0.001","77.032","0.001","1987.4","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H35 N4 Nd O14 S3 -","- C39 H25 N4 Nd O14 S3 -","- C78 H50 N8 Nd2 O28 S6 -","2","1","","Zhao, Jiong-Peng; Hu, Bo-Wen; Liu, Fu-Chen; Hu, Xin; Zeng, Yong-Fei; Bu, Xian-He","Arenedisulfonate‒lanthanide supramolecular architectures with phenanthroline as a co-ligand: syntheses and structures","CrystEngComm","2007","9","10","902","","10.1039/b707622c","","","0.71073","MoKα","","0.0603","0.0374","","","0.0823","0.0918","","","","","","1.158","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202964","12.175","0.003","12.937","0.003","13.847","0.003","88.391","0.003","76.116","0.003","77.176","0.003","2063.7","0.8","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H35 N4 O14 S3 Tb -","- C39 H25 N4 O14 S3 Tb -","- C78 H50 N8 O28 S6 Tb2 -","2","1","","Zhao, Jiong-Peng; Hu, Bo-Wen; Liu, Fu-Chen; Hu, Xin; Zeng, Yong-Fei; Bu, Xian-He","Arenedisulfonate‒lanthanide supramolecular architectures with phenanthroline as a co-ligand: syntheses and structures","CrystEngComm","2007","9","10","902","","10.1039/b707622c","","","0.71073","MoKα","","0.0431","0.0319","","","0.0773","0.0833","","","","","","1.045","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202965","10.7529","0.0013","12.5987","0.0015","13.7199","0.0016","83.876","0.002","68.643","0.002","75.372","0.002","1674.7","0.3","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H58 Eu2 N8 O20 S4 -","- C68 H54 Eu2 N8 O20 S4 -","- C68 H54 Eu2 N8 O20 S4 -","1","0.5","","Zhao, Jiong-Peng; Hu, Bo-Wen; Liu, Fu-Chen; Hu, Xin; Zeng, Yong-Fei; Bu, Xian-He","Arenedisulfonate‒lanthanide supramolecular architectures with phenanthroline as a co-ligand: syntheses and structures","CrystEngComm","2007","9","10","902","","10.1039/b707622c","","","0.71073","MoKα","","0.0497","0.0404","","","0.1084","0.1167","","","","","","1.045","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202966","10.6498","0.0013","12.6501","0.0016","13.682","0.002","84.05","0.003","68.256","0.002","75.975","0.002","1660.9","0.4","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H58 Gd2 N8 O20 S4 -","- C68 H54 Gd2 N8 O20 S4 -","- C68 H54 Gd2 N8 O20 S4 -","1","0.5","","Zhao, Jiong-Peng; Hu, Bo-Wen; Liu, Fu-Chen; Hu, Xin; Zeng, Yong-Fei; Bu, Xian-He","Arenedisulfonate‒lanthanide supramolecular architectures with phenanthroline as a co-ligand: syntheses and structures","CrystEngComm","2007","9","10","902","","10.1039/b707622c","","","0.71073","MoKα","","0.0538","0.0405","","","0.1054","0.1154","","","","","","1.046","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202967","10.685","0.003","12.699","0.004","13.698","0.004","84.405","0.004","68.237","0.004","75.866","0.004","1673.9","0.9","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H58 N8 O20 S4 Tb2 -","- C68 H58 N8 O20 S4 Tb2 -","- C68 H58 N8 O20 S4 Tb2 -","1","0.5","","Zhao, Jiong-Peng; Hu, Bo-Wen; Liu, Fu-Chen; Hu, Xin; Zeng, Yong-Fei; Bu, Xian-He","Arenedisulfonate‒lanthanide supramolecular architectures with phenanthroline as a co-ligand: syntheses and structures","CrystEngComm","2007","9","10","902","","10.1039/b707622c","","","0.71073","MoKα","","0.057","0.0432","","","0.1132","0.1223","","","","","","1.062","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202968","33.27","0.04","4.739","0.004","21.54","0.02","90","","127.46","0.01","90","","2696","5","223.2","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","1,4,7,10-tetra(n-butyl)tetracene, form A","","","- C34 H44 -","- C34 H44 -","- C136 H176 -","4","0.5","","Kitamura, Chitoshi; Ohara, Takuya; Kawatsuki, Nobuhiro; Yoneda, Akio; Kobayashi, Takashi; Naito, Hiroyoshi; Komatsu, Toshiki; Kitamura, Teruo","Conformational polymorphism and optical properties in the solid state of 1,4,7,10-tetra(n-butyl)tetracene","CrystEngComm","2007","9","8","644","","10.1039/b707685c","","","0.7107","MoKα","","","0.0864","","","","0.1852","","","","","","1.196","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202969","5.392","0.006","8.66","0.01","15.19","0.02","101.41","0.03","98.8","0.04","99.35","0.06","673.4","1.4","223.2","","","","","","","","","","","2","P -1","-P 1","2","1,4,7,10-tetra(n-butyl)tetracene, form B","","","- C34 H44 -","- C34 H44 -","- C34 H44 -","1","0.5","","Kitamura, Chitoshi; Ohara, Takuya; Kawatsuki, Nobuhiro; Yoneda, Akio; Kobayashi, Takashi; Naito, Hiroyoshi; Komatsu, Toshiki; Kitamura, Teruo","Conformational polymorphism and optical properties in the solid state of 1,4,7,10-tetra(n-butyl)tetracene","CrystEngComm","2007","9","8","644","","10.1039/b707685c","","","0.7107","MoKα","","","0.0845","","","","0.2089","","","","","","1.797","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7202970","9.1441","0.0018","13.157","0.003","17.564","0.004","90","","95.04","0.03","90","","2104.9","0.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18 N2 O4 S2 -","- C24 H18 N2 O4 S2 -","- C96 H72 N8 O16 S8 -","4","1","","Broker, Grant A.; Tiekink, Edward R. T.","Co-crystal formation between 2,2′-dithiodibenzoic acid and each of 4,4′-bipyridine, trans-1,2-bis(4-pyridyl)ethene and 1,2-bis(4-pyridyl)ethane","CrystEngComm","2007","9","11","1096","","10.1039/b707690h","","","0.7107","MoKα","","0.05","0.045","","","0.094","0.097","","","","","","1.13","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202971","10.607","0.0002","12.3972","0.0002","17.3834","0.0004","90","","90.323","0.001","90","","2285.83","0.08","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 N2 O4 S2 -","- C26 H20 N2 O4 S2 -","- C104 H80 N8 O16 S8 -","4","1","","Broker, Grant A.; Tiekink, Edward R. T.","Co-crystal formation between 2,2′-dithiodibenzoic acid and each of 4,4′-bipyridine, trans-1,2-bis(4-pyridyl)ethene and 1,2-bis(4-pyridyl)ethane","CrystEngComm","2007","9","11","1096","","10.1039/b707690h","","","0.71069","MoKα","","0.056","0.037","","","0.097","0.115","","","","","","1.09","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202972","28.8615","0.0009","10.188","0.0004","19.9562","0.0008","90","","125.715","0.002","90","","4764.4","0.3","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H22 N2 O4 S2 -","- C26 H22 N2 O4 S2 -","- C208 H176 N16 O32 S16 -","8","1","","Broker, Grant A.; Tiekink, Edward R. T.","Co-crystal formation between 2,2′-dithiodibenzoic acid and each of 4,4′-bipyridine, trans-1,2-bis(4-pyridyl)ethene and 1,2-bis(4-pyridyl)ethane","CrystEngComm","2007","9","11","1096","","10.1039/b707690h","","","0.71069","MoKα","","0.096","0.053","","","0.13","0.153","","","","","","1.06","","","","has coordinates,has disorder","180360","2020-10-21","18:00:00",""
"7202973","7.5501","0.0015","9.0077","0.0018","18.787","0.004","88.56","0.03","81.33","0.03","74.86","0.03","1219.1","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H26 N2 O6 S2 -","- C26 H26 N2 O6 S2 -","- C52 H52 N4 O12 S4 -","2","1","","Broker, Grant A.; Tiekink, Edward R. T.","Co-crystal formation between 2,2′-dithiodibenzoic acid and each of 4,4′-bipyridine, trans-1,2-bis(4-pyridyl)ethene and 1,2-bis(4-pyridyl)ethane","CrystEngComm","2007","9","11","1096","","10.1039/b707690h","","","0.7107","MoKα","","0.036","0.034","","","0.086","0.087","","","","","","1.08","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202974","7.8072","0.0016","11.128","0.002","11.413","0.002","64.69","0.03","82.89","0.03","77.7","0.03","875.2","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H16 N O5 S2 -","- C19 H16 N O5 S2 -","- C38 H32 N2 O10 S4 -","2","1","","Broker, Grant A.; Tiekink, Edward R. T.","Co-crystal formation between 2,2′-dithiodibenzoic acid and each of 4,4′-bipyridine, trans-1,2-bis(4-pyridyl)ethene and 1,2-bis(4-pyridyl)ethane","CrystEngComm","2007","9","11","1096","","10.1039/b707690h","","","0.7107","MoKα","","0.069","0.061","","","0.109","0.112","","","","","","1.2","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202975","19.512","0.003","7.8294","0.0013","23.312","0.004","90","","102.726","0.004","90","","3473.8","1","103","2","103","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C40 H30 N2 O8 S4 -","- C40 H30 N2 O8 S4 -","- C160 H120 N8 O32 S16 -","4","0.5","","Broker, Grant A.; Tiekink, Edward R. T.","Co-crystal formation between 2,2′-dithiodibenzoic acid and each of 4,4′-bipyridine, trans-1,2-bis(4-pyridyl)ethene and 1,2-bis(4-pyridyl)ethane","CrystEngComm","2007","9","11","1096","","10.1039/b707690h","","","0.7107","MoKα","","0.048","0.042","","","0.092","0.095","","","","","","1.12","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202976","19.734","0.004","7.8916","0.0016","23.226","0.005","90","","100.8","0.03","90","","3553","1.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 N O4 S2 -","- C20 H16 N O4 S2 -","- C160 H128 N8 O32 S16 -","8","1","","Broker, Grant A.; Tiekink, Edward R. T.","Co-crystal formation between 2,2′-dithiodibenzoic acid and each of 4,4′-bipyridine, trans-1,2-bis(4-pyridyl)ethene and 1,2-bis(4-pyridyl)ethane","CrystEngComm","2007","9","11","1096","","10.1039/b707690h","","","0.7107","MoKα","","0.041","0.04","","","0.093","0.094","","","","","","1.09","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202977","8.9817","0.0003","9.135","0.0002","12.9172","0.0005","93.469","0.002","90.466","0.002","97.325","0.002","1049.12","0.06","173","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 N O5 S2 -","- C22 H22 N O5 S2 -","- C44 H44 N2 O10 S4 -","2","1","","Broker, Grant A.; Tiekink, Edward R. T.","Co-crystal formation between 2,2′-dithiodibenzoic acid and each of 4,4′-bipyridine, trans-1,2-bis(4-pyridyl)ethene and 1,2-bis(4-pyridyl)ethane","CrystEngComm","2007","9","11","1096","","10.1039/b707690h","","","0.71069","MoKα","","0.08","0.055","","","0.157","0.178","","","","","","1.1","","","","has coordinates,has disorder","180360","2020-10-21","18:00:00",""
"7202978","9.873","0.002","10.671","0.002","10.578","0.002","90","","104.58","0.03","90","","1078.6","0.4","150","2","150","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","3,3'-dinitro-2,2'-bipyridine-1-oxide","3,3'-dinitro-2,2'-bipyridine-1-oxide","","- C10 H6 N4 O5 -","- C10 H6 N4 O5 -","- C40 H24 N16 O20 -","4","1","","O'Leary, Jane; Wallis, John D.","A competition between O⋯N and O⋯C through space interactions in the crystal structures of 3,3′-dinitro-2,2′-bipyridine N-oxides and N,N′-dioxides","CrystEngComm","2007","9","10","941","","10.1039/b707822f","","","0.71073","MoKα","","0.0677","0.0462","","","0.1145","0.1228","","","","","","1.015","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202979","6.1226","0.0003","7.4847","0.0004","13.52","0.0008","102.825","0.0002","90.226","0.002","111.154","0.003","560.99","0.05","150","2","150","2","","","","","","","","4","P -1","-P 1","2","3,3-Dinitro-2,2-bipyridine-1,1-dioxide","3,3-Dinitro-2,2-bipyridine-1,1-dioxide","","- C10 H6 N4 O6 -","- C10 H6 N4 O6 -","- C20 H12 N8 O12 -","2","1","","O'Leary, Jane; Wallis, John D.","A competition between O⋯N and O⋯C through space interactions in the crystal structures of 3,3′-dinitro-2,2′-bipyridine N-oxides and N,N′-dioxides","CrystEngComm","2007","9","10","941","","10.1039/b707822f","","","0.71073","MoKα","","0.097","0.057","","","0.1398","0.1578","","","","","","1.104","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202980","8.167","0.0003","13.4699","0.0006","11.3597","0.0006","90","","94.7505","0.0016","90","","1245.37","0.1","120","2","120","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","5,5'-dimethyl-2,2'-bipyridine-1-oxide","5,5'-dimethyl-2,2'-bipyridine-1-oxide","","- C12 H10 N4 O5 -","- C12 H10 N4 O5 -","- C48 H40 N16 O20 -","4","1","","O'Leary, Jane; Wallis, John D.","A competition between O⋯N and O⋯C through space interactions in the crystal structures of 3,3′-dinitro-2,2′-bipyridine N-oxides and N,N′-dioxides","CrystEngComm","2007","9","10","941","","10.1039/b707822f","","","0.71073","MoKα","","0.082","0.0507","","","0.1352","0.1478","","","","","","0.943","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202981","12.044","0.004","7.544","0.003","15.093","0.005","90","","108.48","0.003","90","","1300.6","0.8","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","5,5-Dimethyl-3,3-dinitro-2,2-bipyridine-1,1-dioxide","5,5-Dimethyl-3,3-dinitro-2,2-bipyridine-1,1-dioxide","","- C12 H10 N4 O6 -","- C12 H10 N4 O6 -","- C48 H40 N16 O24 -","4","0.5","","O'Leary, Jane; Wallis, John D.","A competition between O⋯N and O⋯C through space interactions in the crystal structures of 3,3′-dinitro-2,2′-bipyridine N-oxides and N,N′-dioxides","CrystEngComm","2007","9","10","941","","10.1039/b707822f","","","0.71073","MoKα","","0.064","0.0566","","","0.1499","0.1537","","","","","","1.09","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202982","7.8557","0.0006","8.813","0.0006","11.4793","0.001","90","","93.78","0.004","90","","793.01","0.11","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","8-nitroquinoline-1-oxide","8-nitroquinoline-1-oxide","","- C9 H6 N2 O3 -","- C9 H6 N2 O3 -","- C36 H24 N8 O12 -","4","1","","O'Leary, Jane; Wallis, John D.","A competition between O⋯N and O⋯C through space interactions in the crystal structures of 3,3′-dinitro-2,2′-bipyridine N-oxides and N,N′-dioxides","CrystEngComm","2007","9","10","941","","10.1039/b707822f","","","0.71073","MoKα","","0.0559","0.0431","","","0.1067","0.1142","","","","","","1.09","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7202983","16.32","0.002","23.887","0.003","14.326","0.002","90","","106.433","0.002","90","","5356.7","1.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H30 N2 O8 -","- C29 H30 N2 O8 -","- C232 H240 N16 O64 -","8","2","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0973","0.0483","","","0.1195","0.1467","","","","","","1.017","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202984","9.087","0.002","13.014","0.003","13.168","0.003","87.749","0.003","89.854","0.003","80.647","0.003","1535.3","0.6","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H36 Mn N2 O12 -","- C29 H36 Mn N2 O12 -","- C58 H72 Mn2 N4 O24 -","2","1","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0491","0.0399","","","0.1113","0.1162","","","","","","1.085","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202985","10.1125","0.0007","11.695","0.0008","27.4427","0.0018","90","","94.882","0.001","90","","3233.8","0.4","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H37 Cu N3 O10 -","- C32 H37 Cu N3 O10 -","- C128 H148 Cu4 N12 O40 -","4","1","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0421","0.0317","","","0.0841","0.0882","","","","","","1.062","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202986","28.323","0.002","11.0466","0.0008","20.5022","0.0016","90","","120.905","0.001","90","","5503.8","0.7","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C59 H65 Cd N5 O15 -","- C50 H44 Cd N2 O12 -","- C200 H176 Cd4 N8 O48 -","4","0.5","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0538","0.0452","","","0.141","0.1472","","","","","","1.147","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202987","12.4015","0.0012","9.7313","0.0009","26.458","0.003","90","","96.289","0.001","90","","3173.8","0.6","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C36 H29 N3 O7 Zn -","- C36 H29 N3 O7 Zn -","- C144 H116 N12 O28 Zn4 -","4","1","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0699","0.042","","","0.0999","0.1123","","","","","","1.05","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202988","15.742","0.0009","9.389","0.0005","22.7454","0.0013","90","","94.819","0.001","90","","3349.9","0.3","295","2","295","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C36 H30 Cd N3 O7.5 -","- C36 H29 Cd N3 O7.5 -","- C144 H116 Cd4 N12 O30 -","4","1","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0367","0.028","","","0.072","0.0752","","","","","","1.03","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202989","15.649","0.002","22.963","0.004","11.545","0.003","90","","115.738","0.001","90","","3737.1","1.3","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C47 H36 Mn N4 O9 -","- C47 H36 Mn N4 O9 -","- C188 H144 Mn4 N16 O36 -","4","0.5","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0452","0.0312","","","0.0746","0.0795","","","","","","1.037","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202990","16.08","0.007","10.678","0.005","22.186","0.01","90","","101.95","0.007","90","","3727","3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H38 Cu N4 O9 -","- C41 H38 Cu N4 O9 -","- C164 H152 Cu4 N16 O36 -","4","1","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.116","0.0613","","","0.1643","0.1983","","","","","","1.044","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202991","15.913","0.002","10.4978","0.0016","22.979","0.003","90","","102.159","0.002","90","","3752.6","0.9","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39.5 H34.5 N3.5 O8.5 Zn -","- C39.5 H34.5 N3.5 O8.5 Zn -","- C158 H138 N14 O34 Zn4 -","4","1","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0977","0.065","","","0.1935","0.2192","","","","","","1.067","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202992","11.8834","0.0019","15.273","0.002","19.365","0.003","90","","110.135","0.008","90","","3299.9","0.9","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C38 H29 Cd N3 O7 -","- C38 H29 Cd N3 O7 -","- C152 H116 Cd4 N12 O28 -","4","1","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0437","0.0313","","","0.0822","0.0877","","","","","","1.039","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202993","14.6316","0.001","11.0803","0.0008","11.7201","0.0008","90","","108.242","0.001","90","","1804.6","0.2","295","2","295","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C39 H36 Cu N4 O8 -","- C39 H36 Cu N4 O8 -","- C78 H72 Cu2 N8 O16 -","2","0.5","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0378","0.0321","","","0.0933","0.0969","","","","","","1.011","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202994","13.6265","0.0013","16.8941","0.0016","19.4796","0.0018","90","","107.239","0.001","90","","4282.9","0.7","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C43 H32 Cd N4 O7 -","- C43 H32 Cd N4 O7 -","- C172 H128 Cd4 N16 O28 -","4","1","","Du, Miao; Li, Cheng-Peng; Zhao, Xiao-Jun; Yu, Qian","Interplay of coordinative and supramolecular interactions in engineering unusual crystalline architectures of low-dimensional metal‒pamoate complexes under co-ligand intervention","CrystEngComm","2007","9","11","1011","","10.1039/b707853f","","","0.71073","MoKα","","0.0881","0.0555","","","0.1772","0.2012","","","","","","1.057","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202995","22.745","0.003","13.9148","0.0018","12.2573","0.0016","90","","119.369","0.002","90","","3380.8","0.8","292","2","292","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C38 H47 N5 -","- C38 H47 N5 -","- C152 H188 N20 -","4","0.5","","Liu, Zijun; Chen, Tao; Liu, Bo; Huang, Zhen-Li; Huang, Ting; Li, Suyue; Xu, Yuxi; Qin, Jingui","Two-photon absorption of a series of V-shape molecules: the influence of acceptor's strength on two-photon absorption in a noncentrosymmetric D‒π‒A‒π‒D system","Journal of Materials Chemistry","2007","17","44","4685","","10.1039/b707909e","","","0.71073","MoKα","","0.1235","0.0694","","","0.1725","0.2053","","","","","","0.977","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7202996","7.9565","0.0011","13.906","0.002","22.415","0.004","90","","90","","90","","2480.1","0.7","113","","113","","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C H5 F7 N Yb2 -","- C H5 F7 N Yb2 -","- C16 H80 F112 N16 Yb32 -","16","0.5","","Jayasundera, Anil C. A.; Finch, Adrian A.; Townsend, P. D.; Lightfoot, Philip","Hydrothermal synthesis and luminescent properties of a new family of organically templated lanthanide fluorides","Journal of Materials Chemistry","2007","17","39","4178","","10.1039/b707993a","","","0.71073","MoKα","","0.0246","0.0194","","","0.0435","0.0458","","","","","","1.042","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202997","11.9753","0.0008","23.2559","0.0016","6.8413","0.0005","90","","110.384","0.001","90","","1786","0.2","90","2","90","2","","","","","","","","4","C 1 c 1","C -2yc","9","C2HN6O4, C2H5N4, 2(C2H4N4), H2O","","","- C8 H16 N18 O5 -","- C8 H16 N18 O5 -","- C32 H64 N72 O20 -","4","1","","Zhuo Zeng; Haixiang Gao; Brendan Twamley; Jean'ne M. Shreeve","Energetic mono and dibasic 5-dinitromethyltetrazolates: synthesis, properties, and particle processing","Journal of Materials Chemistry","2007","17","36","3819","","10.1039/b708041g","","","0.71073","MoKα","","0.0382","0.0336","","","0.0752","0.0774","","","","","","1.035","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202998","15.7214","0.001","12.7935","0.0008","8.1458","0.0005","90","","121.096","0.001","90","","1402.95","0.15","90","2","90","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","(C4H7N2)2(C2N6O4)","","","- C10 H14 N10 O4 -","- C10 H14 N10 O4 -","- C40 H56 N40 O16 -","4","0.5","","Zhuo Zeng; Haixiang Gao; Brendan Twamley; Jean'ne M. Shreeve","Energetic mono and dibasic 5-dinitromethyltetrazolates: synthesis, properties, and particle processing","Journal of Materials Chemistry","2007","17","36","3819","","10.1039/b708041g","","","0.71073","MoKα","","0.0424","0.0337","","","0.0819","0.0877","","","","","","1.019","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7202999","8.952","0.002","10.126","0.003","14.757","0.004","70.511","0.01","79.526","0.01","76.96","0.01","1220.2","0.6","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H20 N2 -","- C14 H20 N2 -","- C56 H80 N8 -","4","2","","Waldemar M. Czaplik; Jörg-M. Neudörfl; Axel Jacobi von Wangelin","On the quantitative recycling of Raney‒Nickel catalysts on a lab-scale","Green Chemistry","2007","9","11","1163","","10.1039/b708057c","","","0.71073","MoKα","","0.2461","0.0879","","","0.2204","0.2937","","","","","","0.978","","","","has coordinates","180360","2020-10-21","18:00:00",""
"7203000","8.8638","0.0008","14.5474","0.0014","15.4248","0.0012","90","","121.174","0.004","90","","1701.7","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H14 Ce N3 O10 S3 -","- C9 H14 Ce N3 O10 S3 -","- C36 H56 Ce4 N12 O40 S12 -","4","1","","Wang, Su-Na; Sun, Ran; Wang, Xiao-Shi; Li, Yi-Zhi; Pan, Yi; Bai, Junfeng; Scheer, Manfred; You, Xiao-Zeng","Versatile lanthanide coordination assemblies due to the synergistic effect of lanthanide contraction and flexibility of a flexible tricarboxylate ligand","CrystEngComm","2007","9","11","1051","","10.1039/b708104a","","","0.71073","MoKα","","0.0642","0.0442","","","0.123","0.1333","","","","","","1.074","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203001","8.8231","0.0003","14.5403","0.0006","15.3938","0.0006","90","","121.052","0.001","90","","1691.88","0.11","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H14 N3 O10 Pr S3 -","- C9 H14 N3 O10 Pr S3 -","- C36 H56 N12 O40 Pr4 S12 -","4","1","","Wang, Su-Na; Sun, Ran; Wang, Xiao-Shi; Li, Yi-Zhi; Pan, Yi; Bai, Junfeng; Scheer, Manfred; You, Xiao-Zeng","Versatile lanthanide coordination assemblies due to the synergistic effect of lanthanide contraction and flexibility of a flexible tricarboxylate ligand","CrystEngComm","2007","9","11","1051","","10.1039/b708104a","","","0.71073","MoKα","","0.0605","0.0489","","","0.154","0.1671","","","","","","1.035","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203002","8.8368","0.0018","14.529","0.003","15.467","0.003","90","","121.3","0.03","90","","1696.8","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H14 N3 Nd O10 S3 -","- C9 H14 N3 Nd O10 S3 -","- C36 H56 N12 Nd4 O40 S12 -","4","1","","Wang, Su-Na; Sun, Ran; Wang, Xiao-Shi; Li, Yi-Zhi; Pan, Yi; Bai, Junfeng; Scheer, Manfred; You, Xiao-Zeng","Versatile lanthanide coordination assemblies due to the synergistic effect of lanthanide contraction and flexibility of a flexible tricarboxylate ligand","CrystEngComm","2007","9","11","1051","","10.1039/b708104a","","","0.71073","MoKα","","0.0842","0.0462","","","0.1549","0.172","","","","","","1.094","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203003","8.4178","0.0012","9.0262","0.0013","11.6753","0.0017","99.299","0.002","99.648","0.003","96.047","0.002","855","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H14 N3 O10 S3 Sm -","- C9 H14 N3 O10 S3 Sm -","- C18 H28 N6 O20 S6 Sm2 -","2","1","","Wang, Su-Na; Sun, Ran; Wang, Xiao-Shi; Li, Yi-Zhi; Pan, Yi; Bai, Junfeng; Scheer, Manfred; You, Xiao-Zeng","Versatile lanthanide coordination assemblies due to the synergistic effect of lanthanide contraction and flexibility of a flexible tricarboxylate ligand","CrystEngComm","2007","9","11","1051","","10.1039/b708104a","","","0.71073","MoKα","","0.0361","0.0324","","","0.0858","0.0885","","","","","","1.051","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203004","8.403","0.004","9.008","0.005","11.651","0.006","99.135","0.007","99.531","0.005","96.161","0.006","850.6","0.8","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H14 Eu N3 O10 S3 -","- C9 H14 Eu N3 O10 S3 -","- C18 H28 Eu2 N6 O20 S6 -","2","1","","Wang, Su-Na; Sun, Ran; Wang, Xiao-Shi; Li, Yi-Zhi; Pan, Yi; Bai, Junfeng; Scheer, Manfred; You, Xiao-Zeng","Versatile lanthanide coordination assemblies due to the synergistic effect of lanthanide contraction and flexibility of a flexible tricarboxylate ligand","CrystEngComm","2007","9","11","1051","","10.1039/b708104a","","","0.71073","MoKα","","0.0496","0.0393","","","0.0908","0.096","","","","","","1.066","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203005","8.442","0.003","8.996","0.003","11.7","0.004","98.85","0.004","99.386","0.005","96.468","0.004","857.5","0.5","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H14 N3 O10 S3 Tb -","- C9 H14 N3 O10 S3 Tb -","- C18 H28 N6 O20 S6 Tb2 -","2","1","","Wang, Su-Na; Sun, Ran; Wang, Xiao-Shi; Li, Yi-Zhi; Pan, Yi; Bai, Junfeng; Scheer, Manfred; You, Xiao-Zeng","Versatile lanthanide coordination assemblies due to the synergistic effect of lanthanide contraction and flexibility of a flexible tricarboxylate ligand","CrystEngComm","2007","9","11","1051","","10.1039/b708104a","","","0.71073","MoKα","","0.0448","0.038","","","0.0944","0.0973","","","","","","1.012","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203006","8.575","0.003","10.879","0.004","10.988","0.004","70.103","0.004","86.18","0.005","79.849","0.005","948.7","0.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H36 Dy2 N6 O24 S6 -","- C18 H36 Dy2 N6 O24 S6 -","- C18 H36 Dy2 N6 O24 S6 -","1","0.5","","Wang, Su-Na; Sun, Ran; Wang, Xiao-Shi; Li, Yi-Zhi; Pan, Yi; Bai, Junfeng; Scheer, Manfred; You, Xiao-Zeng","Versatile lanthanide coordination assemblies due to the synergistic effect of lanthanide contraction and flexibility of a flexible tricarboxylate ligand","CrystEngComm","2007","9","11","1051","","10.1039/b708104a","","","0.71073","MoKα","","0.0429","0.0361","","","0.092","0.0947","","","","","","1.087","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203007","8.5663","0.0011","10.8794","0.0015","10.9674","0.0015","70.289","0.002","86.198","0.002","79.714","0.002","946.7","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H36 Er2 N6 O24 S6 -","- C18 H36 Er2 N6 O24 S6 -","- C18 H36 Er2 N6 O24 S6 -","1","0.5","","Wang, Su-Na; Sun, Ran; Wang, Xiao-Shi; Li, Yi-Zhi; Pan, Yi; Bai, Junfeng; Scheer, Manfred; You, Xiao-Zeng","Versatile lanthanide coordination assemblies due to the synergistic effect of lanthanide contraction and flexibility of a flexible tricarboxylate ligand","CrystEngComm","2007","9","11","1051","","10.1039/b708104a","","","0.71073","MoKα","","0.0322","0.0294","","","0.076","0.078","","","","","","1.032","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203008","8.535","0.005","10.872","0.006","10.939","0.006","70.189","0.008","86.112","0.01","79.489","0.008","938.9","0.9","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H36 N6 O24 S6 Yb2 -","- C18 H36 N6 O24 S6 Yb2 -","- C18 H36 N6 O24 S6 Yb2 -","1","0.5","","Wang, Su-Na; Sun, Ran; Wang, Xiao-Shi; Li, Yi-Zhi; Pan, Yi; Bai, Junfeng; Scheer, Manfred; You, Xiao-Zeng","Versatile lanthanide coordination assemblies due to the synergistic effect of lanthanide contraction and flexibility of a flexible tricarboxylate ligand","CrystEngComm","2007","9","11","1051","","10.1039/b708104a","","","0.71073","MoKα","","0.0594","0.0479","","","0.0858","0.0871","","","","","","1.043","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203009","35.243","0.005","35.243","0.005","5.1853","0.001","90","","90","","120","","5577.6","1.6","100","","100","","","","","","","","","4","R -3 :H","-R 3","148","","","","- C15.4 H12 N2 O1.1 -","- C15.4 H12 N2 O1.1 -","- C277.2 H216 N36 O19.8 -","18","1","","Fabbiani, Francesca P. A.; Byrne, Lindsay T.; McKinnon, Joshua J.; Spackman, Mark A.","Solvent inclusion in the structural voids of form II carbamazepine: single-crystal X-ray diffraction, NMR spectroscopy and Hirshfeld surface analysis","CrystEngComm","2007","9","9","728","","10.1039/b708303n","","","0.71073","MoKα","","0.0688","0.0512","","0.1554","0.1482","0.1554","","","","","","0.9762","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203010","8.2799","0.0017","8.8747","0.0018","28.103","0.006","90","","95.03","0.03","90","","2057.1","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 B N O3 -","- C26 H22 B N O3 -","- C104 H88 B4 N4 O12 -","4","1","","Zhang, Hongyu; Zhang, Zuolun; Zhang, Jingying; Ye, Kaiqi; Gao, Hongze; Wang, Yue","Polymorphs and a pseudo-polymorphs based on a luminescent boron-containing compound: structural diversity arising from conformational isomers and noncovalent interactions","CrystEngComm","2007","9","10","951","","10.1039/b708384j","","","0.71073","MoKα","","0.0689","0.0412","","","0.1047","0.1202","","","","","","0.903","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203011","13.1","0.003","8.6206","0.0017","18.923","0.004","90","","106.7","0.03","90","","2046.8","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 B N O3 -","- C26 H22 B N O3 -","- C104 H88 B4 N4 O12 -","4","1","","Zhang, Hongyu; Zhang, Zuolun; Zhang, Jingying; Ye, Kaiqi; Gao, Hongze; Wang, Yue","Polymorphs and a pseudo-polymorphs based on a luminescent boron-containing compound: structural diversity arising from conformational isomers and noncovalent interactions","CrystEngComm","2007","9","10","951","","10.1039/b708384j","","","0.71073","MoKα","","0.1195","0.0453","","","0.1029","0.1175","","","","","","0.812","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203012","9.802","0.002","22.74","0.005","11.474","0.002","90","","92.32","0.03","90","","2555.4","0.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H23 B Cl3 N O3 -","- C27 H23 B Cl3 N O3 -","- C108 H92 B4 Cl12 N4 O12 -","4","1","","Zhang, Hongyu; Zhang, Zuolun; Zhang, Jingying; Ye, Kaiqi; Gao, Hongze; Wang, Yue","Polymorphs and a pseudo-polymorphs based on a luminescent boron-containing compound: structural diversity arising from conformational isomers and noncovalent interactions","CrystEngComm","2007","9","10","951","","10.1039/b708384j","","","0.71073","MoKα","","0.1889","0.0648","","","0.161","0.2107","","","","","","0.79","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203013","9.848","0.003","9.927","0.003","11.596","0.003","70.257","0.005","65.314","0.004","71.302","0.004","947.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H19 Mn N2 O6 -","- C20 H19 Mn N2 O6 -","- C40 H38 Mn2 N4 O12 -","2","1","","Lin, Jian-Guo; Zang, Shuang-Quan; Tian, Zhen-Fang; Li, Yi-Zhi; Xu, Yan-Yan; Zhu, Hui-Zhen; Meng, Qing-Jin","Metal‒organic frameworks constructed from mixed-ligand 1,2,3,4-tetra-(4-pyridyl)-butane and benzene-polycarboxylate acids: syntheses, structures and physical properties","CrystEngComm","2007","9","10","915","","10.1039/b708389k","","","0.71073","MoKα","","0.0417","0.0392","","","0.1039","0.1061","","","","","","0.973","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203014","25.896","0.002","11.0511","0.0009","17.3434","0.0015","90","","118.826","0.002","90","","4348.3","0.6","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H36 N4 O16 Zn3 -","- C42 H36 N4 O16 Zn3 -","- C168 H144 N16 O64 Zn12 -","4","0.5","","Lin, Jian-Guo; Zang, Shuang-Quan; Tian, Zhen-Fang; Li, Yi-Zhi; Xu, Yan-Yan; Zhu, Hui-Zhen; Meng, Qing-Jin","Metal‒organic frameworks constructed from mixed-ligand 1,2,3,4-tetra-(4-pyridyl)-butane and benzene-polycarboxylate acids: syntheses, structures and physical properties","CrystEngComm","2007","9","10","915","","10.1039/b708389k","","","0.71073","MoKα","","0.0874","0.055","","","0.1284","0.1367","","","","","","1.083","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203015","8.6864","0.001","14.2414","0.0018","16.885","0.002","90","","100.046","0.003","90","","2056.8","0.4","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H18 Co N2 O7 -","- C17 H18 Co N2 O7 -","- C68 H72 Co4 N8 O28 -","4","1","","Lin, Jian-Guo; Zang, Shuang-Quan; Tian, Zhen-Fang; Li, Yi-Zhi; Xu, Yan-Yan; Zhu, Hui-Zhen; Meng, Qing-Jin","Metal‒organic frameworks constructed from mixed-ligand 1,2,3,4-tetra-(4-pyridyl)-butane and benzene-polycarboxylate acids: syntheses, structures and physical properties","CrystEngComm","2007","9","10","915","","10.1039/b708389k","","","0.71073","MoKα","","0.0904","0.0562","","","0.0968","0.1022","","","","","","1.062","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203016","9.4861","0.0019","6.0392","0.0012","32.99","0.007","90","","95.82","0.03","90","","1880.2","0.7","123","2","123","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","N,N,4-tris(pyridin-2-ylmethyl)aniline","N,N,4-tris(pyridin-2-ylmethyl)aniline","","- C24 H22 N4 -","- C24 H22 N4 -","- C96 H88 N16 -","4","1","","Almesåker, Ann; Bourne, Susan A.; Ramon, Gaëlle; Scott, Janet L.; Strauss, Christopher R.","Coordination chemistry of N,N,4-tris(pyridin-2-ylmethyl)aniline: a novel flexible, multimodal ligand","CrystEngComm","2007","9","11","997","","10.1039/b708465j","","","0.71073","MoKα","","0.0653","0.0535","","","0.1125","0.1187","","","","","","1.104","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203017","8.7284","0.0002","17.3023","0.0003","15.7446","0.0004","90","","102.236","0.001","90","","2323.76","0.09","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","none","","","- C24 H22 Cl2 Mn N4 -","- C24 H22 Cl2 Mn N4 -","- C96 H88 Cl8 Mn4 N16 -","4","1","","Almesåker, Ann; Bourne, Susan A.; Ramon, Gaëlle; Scott, Janet L.; Strauss, Christopher R.","Coordination chemistry of N,N,4-tris(pyridin-2-ylmethyl)aniline: a novel flexible, multimodal ligand","CrystEngComm","2007","9","11","997","","10.1039/b708465j","","","0.71073","MoKα","","0.0764","0.0396","","","0.1032","0.1251","","","","","","0.782","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203018","9.4866","0.0003","12.7984","0.0005","13.0868","0.0005","98.379","0.002","104.084","0.002","91.693","0.002","1521.2","0.1","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H22 Cl2.03 Cu N4 O2.79 -","- C24 H22 Cl2 Cu N4 O2.71 -","- C48 H44 Cl4 Cu2 N8 O5.42 -","2","1","","Almesåker, Ann; Bourne, Susan A.; Ramon, Gaëlle; Scott, Janet L.; Strauss, Christopher R.","Coordination chemistry of N,N,4-tris(pyridin-2-ylmethyl)aniline: a novel flexible, multimodal ligand","CrystEngComm","2007","9","11","997","","10.1039/b708465j","","","0.71073","MoKα","","0.1681","0.1534","","","0.3578","0.3674","","","","","","1.208","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203019","9.3562","0.0002","10.2179","0.0002","13.8837","0.0004","101.079","0.001","96.15","0.001","110.015","0.001","1202.18","0.05","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 Co N6 O6 -","- C24 H22 Co N6 O6 -","- C48 H44 Co2 N12 O12 -","2","1","","Almesåker, Ann; Bourne, Susan A.; Ramon, Gaëlle; Scott, Janet L.; Strauss, Christopher R.","Coordination chemistry of N,N,4-tris(pyridin-2-ylmethyl)aniline: a novel flexible, multimodal ligand","CrystEngComm","2007","9","11","997","","10.1039/b708465j","","","0.71073","MoKα","","0.0725","0.0377","","","0.0803","0.0889","","","","","","1.044","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203020","8.0308","0.0016","8.6296","0.0017","20.091","0.004","93.94","0.03","92.29","0.03","116.16","0.03","1242.9","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H23 Cu N7 O9 -","- C24 H23 Cu N7 O9 -","- C48 H46 Cu2 N14 O18 -","2","1","","Almesåker, Ann; Bourne, Susan A.; Ramon, Gaëlle; Scott, Janet L.; Strauss, Christopher R.","Coordination chemistry of N,N,4-tris(pyridin-2-ylmethyl)aniline: a novel flexible, multimodal ligand","CrystEngComm","2007","9","11","997","","10.1039/b708465j","","","0.71073","MoKα","","0.0692","0.0648","","","0.1884","0.192","","","","","","1.411","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203021","10.6604","0.0002","10.7821","0.0002","11.5302","0.0002","80.902","0.001","84.283","0.001","79.048","0.001","1281.48","0.04","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H30 Co N4 O6 S -","- C26 H30 Co N4 O6 S -","- C52 H60 Co2 N8 O12 S2 -","2","1","","Almesåker, Ann; Bourne, Susan A.; Ramon, Gaëlle; Scott, Janet L.; Strauss, Christopher R.","Coordination chemistry of N,N,4-tris(pyridin-2-ylmethyl)aniline: a novel flexible, multimodal ligand","CrystEngComm","2007","9","11","997","","10.1039/b708465j","","","0.71073","MoKα","","0.0748","0.043","","","0.0947","0.105","","","","","","1.033","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203022","9.4677","0.0002","10.179","0.0002","16.2431","0.0004","79.789","0.001","75.907","0.001","71.378","0.001","1430.31","0.06","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H29 Cu N4 O8.25 S1.25 -","- C24 H22.5 Cu N4 O8.26 S1.25 -","- C48 H45 Cu2 N8 O16.52 S2.5 -","2","1","","Almesåker, Ann; Bourne, Susan A.; Ramon, Gaëlle; Scott, Janet L.; Strauss, Christopher R.","Coordination chemistry of N,N,4-tris(pyridin-2-ylmethyl)aniline: a novel flexible, multimodal ligand","CrystEngComm","2007","9","11","997","","10.1039/b708465j","","","0.71073","MoKα","","0.0552","0.0488","","","0.1478","0.1542","","","","","","1.062","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203023","8.4675","0.0001","12.8704","0.0002","24.3518","0.0004","90","","90","","90","","2653.86","0.07","113","2","113","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H22 Cl4 Cu2 N4 O2 -","- C24 H22 Cl4 Cu2 N4 O2 -","- C96 H88 Cl16 Cu8 N16 O8 -","4","1","","Almesåker, Ann; Bourne, Susan A.; Ramon, Gaëlle; Scott, Janet L.; Strauss, Christopher R.","Coordination chemistry of N,N,4-tris(pyridin-2-ylmethyl)aniline: a novel flexible, multimodal ligand","CrystEngComm","2007","9","11","997","","10.1039/b708465j","","","0.71073","MoKα","","0.0823","0.0433","","","0.1026","0.1263","","","","","","0.765","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203024","8.5212","0.0002","12.8596","0.0003","24.1208","0.0005","90","","90","","90","","2643.14","0.1","113","2","113","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24.2 H22 Cl4 Cu2 N4 O0.2 -","- C24.2 H22 Cl4 Cu2 N4 O0.2 -","- C96.8 H88 Cl16 Cu8 N16 O0.8 -","4","1","","Almesåker, Ann; Bourne, Susan A.; Ramon, Gaëlle; Scott, Janet L.; Strauss, Christopher R.","Coordination chemistry of N,N,4-tris(pyridin-2-ylmethyl)aniline: a novel flexible, multimodal ligand","CrystEngComm","2007","9","11","997","","10.1039/b708465j","","","0.71073","MoKα","","0.0786","0.0431","","","0.077","0.0853","","","","","","0.977","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203025","22.2733","0.0012","22.2733","0.0012","8.9917","0.0003","90","","90","","90","","4460.8","0.4","123","2","123","2","","","","","","","","5","P 42/n :2","-P 4bc","86","[Y(BA)3(DMSO)]n","poly[tris(benzoato)(dimethylsulphoxide)yttrium(III)]","","- C23 H21 O7 S Y -","- C23 H21 O7 S Y -","- C184 H168 O56 S8 Y8 -","8","1","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0917","0.0456","","","0.0661","0.0741","","","","","","0.998","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203026","22.2964","0.0003","22.2964","0.0003","8.9633","0.0002","90","","90","","90","","4455.92","0.13","123","2","123","2","","","","","","","","5","P 42/n :2","-P 4bc","86","[Tb(BA)3(DMSO)]n","poly[tris(benzoato)(dimethylsulphoxide)terbium(III)]","","- C23 H21 O7 S Tb -","- C23 H21 O7 S Tb -","- C184 H168 O56 S8 Tb8 -","8","1","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0193","0.017","","","0.0353","0.0363","","","","","","1.037","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203027","11.5806","0.0006","8.3012","0.0012","24.9731","0.0007","90","","101.617","0.006","90","","2351.6","0.4","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Y(BA)3(H2O)(DMF)]2","bis[(aqua)tris(benzoato)(dimethylformamide)yttrium(III)]","","- C48 H48 N2 O16 Y2 -","- C48 H48 N2 O16 Y2 -","- C96 H96 N4 O32 Y4 -","2","0.5","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0922","0.0502","","","0.1128","0.123","","","","","","0.88","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203028","8.0308","0.0003","13.9735","0.0006","19.0422","0.0008","90","","90","","90","","2136.88","0.15","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","[Y(2-MeBA)3]n","poly[tri(2-methylbenzoato)yttrium]","","- C24 H21 O6 Y -","- C24 H21 O6 Y -","- C96 H84 O24 Y4 -","4","1","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.036","0.0279","","","0.0565","0.0594","","","","","","0.803","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203029","27.125","0.005","8.6116","0.0017","23.062","0.005","90","","105.1","0.03","90","","5201","1.9","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","SH7DMF","bis[tris(3-methylbenzoato)(dimethylformamide)yttrium(III)]","","- C54 H60 N2 O16 Y2 -","- C54 H60 N2 O16 Y2 -","- C216 H240 N8 O64 Y8 -","4","0.5","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0821","0.052","","","0.1168","0.1323","","","","","","1.039","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203030","8.5731","0.0017","12.059","0.002","16.072","0.003","106.75","0.03","96.04","0.02","102.04","0.03","1531.6","0.6","123","2","123","2","","","","","","","","5","P -1","-P 1","2","[Y(3-MeBA)3(DMSO)(H2O)]2.2DMSO","bis[(aqua)(dimethylsulphoxide)tris(3-methylbenzoate)yttrium (III)].dmso solvate","","- C56 H70 O18 S4 Y2 -","- C56 H70 O18 S4 Y2 -","- C56 H70 O18 S4 Y2 -","1","0.5","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0543","0.0439","","","0.1074","0.1127","","","","","","1.023","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203031","8.5475","0.0004","13.4364","0.0008","14.1992","0.0008","99.577","0.002","106.649","0.003","102.216","0.002","1481.45","0.14","123","2","123","2","","","","","","","","5","P -1","-P 1","2","{[Y(4-MeBA)3(DMSO)(H2O)].DMSO}2","","","- C56 H70 O18 S4 Y2 -","- C56 H70 O18 S4 Y2 -","- C56 H70 O18 S4 Y2 -","1","0.5","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0807","0.052","","","0.0978","0.1091","","","","","","1.016","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203032","8.2242","0.0004","13.0741","0.0008","13.1527","0.0008","90.801","0.004","105.04","0.003","106.894","0.003","1300.72","0.13","123","2","123","2","","","","","","","","5","P -1","-P 1","2","poly[(dmf)tris(3-nitrobenzoato)yttrium(III)]","poly[tris(3-nitrobenzoate)yttrium(III)(DMF)]","","- C24 H19 N4 O13 Y -","- C24 H19 N4 O13 Y -","- C48 H38 N8 O26 Y2 -","2","1","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0779","0.0444","","","0.0913","0.1034","","","","","","1.019","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203033","8.2095","0.0002","13.1346","0.0003","13.1596","0.0004","91.09","0.001","106.536","0.001","104.418","0.002","1311.26","0.06","123","2","123","2","","","","","","","","5","P -1","-P 1","2","[Tb(3-NO2BA)3(DMF)]n","","","- C24 H19 N4 O13 Tb -","- C24 H19 N4 O13 Tb -","- C48 H38 N8 O26 Tb2 -","2","1","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0766","0.0507","","","0.1006","0.1109","","","","","","1.045","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203034","10.4247","0.0005","16.1016","0.0008","18.7135","0.0006","93.351","0.002","101.038","0.002","106.429","0.003","2935.9","0.2","123","1","123","2","","","","","","","","6","P -1","-P 1","2","SH5DMSO","poly[hexa(3-nitrobenzoato)(dimethylsulphoxide)bis(aqua)bisyttrium (III)].DMSO solvate","","- C48 H46 N6 O29 S3 Y2 -","- C48 H46 N6 O29 S3 Y2 -","- C96 H92 N12 O58 S6 Y4 -","2","1","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0852","0.0445","","","0.0902","0.1037","","","","","","0.987","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203035","9.6946","0.0001","26.4487","0.0004","14.4156","0.0002","90","","105.594","0.001","90","","3560.24","0.08","123","1","123","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Tb(4-NO2BA)3(DMF)]2.4DMF","bis[(dimethylformamide)tris(4-nitrobenzoato)terbium (III)].4dimethylformamide","","- C60 H70 N12 O32 Tb2 -","- C60 H70 N12 O32 Tb2 -","- C120 H140 N24 O64 Tb4 -","2","0.5","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0314","0.027","","","0.0587","0.0606","","","","","","1.059","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7203036","9.9516","0.0003","10.5178","0.0003","15.9228","0.0005","98.84","0.001","96.54","0.001","107.148","0.002","1551.09","0.08","123","1","123","1","","","","","","","","6","P -1","-P 1","2","{[(H2O)2(DMSO)(4-NO2BA)3Y]DMSO}n","poly{[bis(aqua)(dimethylsulphoxide)tris(4-nitrobenzoate)yttrium(III)] dimethylsulphoxide}","","- C25 H28 N3 O16 S2 Y -","- C25 H28 N3 O16 S2 Y -","- C50 H56 N6 O32 S4 Y2 -","2","1","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0338","0.027","","","0.065","0.0679","","","","","","1.023","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203037","9.9572","0.0003","10.5317","0.0004","15.9559","0.0006","98.894","0.002","96.585","0.001","107.184","0.002","1556.36","0.1","123","2","123","2","","","","","","","","6","P -1","-P 1","2","{[Tb(4-NO2BA)3(DMSO)(H2O)2].DMSO}n","poly{[bis(aqua)(dimethylsulphoxide)tris(4-nitrobenzoato)terbium (III)].dimethylsulphoxide}","","- C25 H28 N3 O16 S2 Tb -","- C25 H28 N3 O16 S2 Tb -","- C50 H56 N6 O32 S4 Tb2 -","2","1","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0498","0.0381","","","0.0715","0.0758","","","","","","1.038","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203038","8.3522","0.0013","24.8189","0.003","14.2312","0.0021","90","","106.889","0.006","90","","2822.8","0.7","123","1","123","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Y(4-MeOBA)3(H2O)(DMF)]2","di[(aqua)(dimethylformamide)tris(4-methoxybenzoato)yttrium(III)]","","- C54 H60 N2 O22 Y2 -","- C54 H60 N2 O22 Y2 -","- C108 H120 N4 O44 Y4 -","2","0.5","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.1054","0.0418","","","0.0818","0.1037","","","","","","0.968","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203039","8.3594","0.0003","24.7689","0.0008","14.2505","0.0005","90","","106.805","0.001","90","","2824.6","0.17","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[(dmf/dsmo)(4-MeOBA)3Tb]2","bis[(dimethylformamide)tri(4-methoxybenzoato)terbium(III)]","","- C53.91 H59.91 N1.91 O22 S0.09 Tb2 -","- C53.906 H59.906 N1.906 O22 S0.094 Tb2 -","- C107.812 H119.812 N3.812 O44 S0.188 Tb4 -","2","0.5","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.0242","0.0206","","","0.0457","0.0475","","","","","","1.075","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203040","8.3013","0.0002","24.635","0.0005","14.0564","0.0003","90","","105.388","0.001","90","","2771.52","0.11","123","1","123","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Tb(4-MeOBA)3(DMSO)(H2O)]2","","","- C52 H58 O22 S2 Tb2 -","- C52 H58 O22 S2 Tb2 -","- C104 H116 O44 S4 Tb4 -","2","0.5","","Deacon, Glen B.; Hein, Stefanie; Junk, Peter C.; Jüstel, Thomas; Lee, Winnie; Turner, David R.","Structural variations in rare earth benzoate complexes : Part II. Yttrium and terbium","CrystEngComm","2007","9","11","1110","","10.1039/b708589c","","","0.71073","MoKα","","0.034","0.0258","","","0.0532","0.0571","","","","","","1.036","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203041","9.5399","0.0009","12.0328","0.0011","12.2882","0.0012","101.156","0.004","100.498","0.004","99.211","0.004","1332.6","0.2","100","2","100","2","","","","","","","","4","P 1","P 1","1","L-leucyl-L-leucyl-L-leucine - pyridine clathrate (1:1)","","","- C23 H40 N4 O4 -","- C23 H40 N4 O4 -","- C46 H80 N8 O8 -","2","2","","Burchell, Tara J.; Soldatov, Dmitriy V.; Enright, Gary D.; Ripmeester, John A.","The ability of lower peptides to form co-crystals: inclusion compounds of Leu-Leu-Leu tripeptide with pyridine and picolines","CrystEngComm","2007","9","10","922","","10.1039/b708695d","","","0.71073","MoKα","","0.0959","0.0757","","","0.1945","0.2169","","","","","","1.038","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203042","9.5544","0.0005","12.1536","0.0007","12.369","0.0007","102.81","0.003","105.373","0.002","97.475","0.002","1322.91","0.13","100","2","100","2","","","","","","","","4","P 1","P 1","1","L-leucyl-L-leucyl-L-leucine - 2-methylpyridine clathrate (1:1:0.12)","","","- C24 H42.24 N4 O4.12 -","- C24 H42 N4 O4.125 -","- C48 H84 N8 O8.25 -","2","2","","Burchell, Tara J.; Soldatov, Dmitriy V.; Enright, Gary D.; Ripmeester, John A.","The ability of lower peptides to form co-crystals: inclusion compounds of Leu-Leu-Leu tripeptide with pyridine and picolines","CrystEngComm","2007","9","10","922","","10.1039/b708695d","","","0.71073","MoKα","","0.0573","0.0534","","","0.1418","0.1456","","","","","","1.038","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203043","9.5671","0.0014","12.091","0.002","12.44","0.002","102.069","0.008","101.335","0.007","99.598","0.007","1346.9","0.4","100","2","100","2","","","","","","","","4","P 1","P 1","1","L-leucyl-L-leucyl-L-leucine - 3-methylpyridine clathrate (1:1)","","","- C24 H42 N4 O4 -","- C24 H42 N4 O4 -","- C48 H84 N8 O8 -","2","2","","Burchell, Tara J.; Soldatov, Dmitriy V.; Enright, Gary D.; Ripmeester, John A.","The ability of lower peptides to form co-crystals: inclusion compounds of Leu-Leu-Leu tripeptide with pyridine and picolines","CrystEngComm","2007","9","10","922","","10.1039/b708695d","","","0.71073","MoKα","","0.1744","0.1291","","","0.3111","0.3669","","","","","","1.114","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203044","9.5358","0.0006","23.642","0.0017","12.0899","0.0008","90","","98.904","0.003","90","","2692.8","0.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","L-leucyl-L-leucyl-L-leucine - 4-methylpyridine clathrate (1:1:0.14)","","","- C24 H42.28 N4 O4.14 -","- C24 H42 N4 O4.14 -","- C96 H168 N16 O16.56 -","4","2","","Burchell, Tara J.; Soldatov, Dmitriy V.; Enright, Gary D.; Ripmeester, John A.","The ability of lower peptides to form co-crystals: inclusion compounds of Leu-Leu-Leu tripeptide with pyridine and picolines","CrystEngComm","2007","9","10","922","","10.1039/b708695d","","","0.71073","MoKα","","0.0691","0.0436","","","0.0985","0.1129","","","","","","1.032","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203045","10.514","0.002","11.309","0.003","16.393","0.005","83.502","0.014","78.733","0.016","69.532","0.013","1788.8","0.8","113","2","113","2","","","","","","","","3","P -1","-P 1","2","","","","- C48 H46 N2 -","- C48 H46 N2 -","- C96 H92 N4 -","2","1","","Song, Yabin; Di, Chong-an; Xu, Wei; Liu, Yunqi; Zhang, Deqing; Zhu, Daoben","New semiconductors based on triphenylamine with macrocyclic architecture: synthesis, properties and applications in OFETs","Journal of Materials Chemistry","2007","17","42","4483","","10.1039/b708887f","","","0.7107","MoKα","","0.0963","0.0578","","","0.1248","0.1452","","","","","","1.015","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203046","14.3232","0.0008","18.5768","0.0012","12.4832","0.0008","90","","111.061","0.004","90","","3099.6","0.3","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 N2 Ni O4 P2 S6 -","- C26 H28 N2 Ni O4 P2 S6 -","- C104 H112 N8 Ni4 O16 P8 S24 -","4","1","","Aragoni, M. Carla; Arca, Massimiliano; Crespo, Miriam; Devillanova, Francesco A.; Hursthouse, Michael B.; Huth, Susanne L.; Isaia, Francesco; Lippolis, Vito; Verani, Gaetano","Predictable and unpredictable reactions between 4,4′-dipyridyldisulfide and phosphonodithioato/dithiophosphato NiII complexes: novel coordination polymers and the unique example of 4,4′-dipyridyltrisulfide","CrystEngComm","2007","9","10","873","","10.1039/b708972d","","","0.71073","MoKα","","0.0321","0.028","","","0.0679","0.0703","","","","","","1.03","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203047","17.618","0.003","8.0323","0.0016","25.068","0.005","90","","100.63","0.03","90","","3486.6","1.2","120","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28 H32 N2 Ni O4 P2 S7 -","- C28 H32 N2 Ni O4 P2 S7 -","- C112 H128 N8 Ni4 O16 P8 S28 -","4","0.5","","Aragoni, M. Carla; Arca, Massimiliano; Crespo, Miriam; Devillanova, Francesco A.; Hursthouse, Michael B.; Huth, Susanne L.; Isaia, Francesco; Lippolis, Vito; Verani, Gaetano","Predictable and unpredictable reactions between 4,4′-dipyridyldisulfide and phosphonodithioato/dithiophosphato NiII complexes: novel coordination polymers and the unique example of 4,4′-dipyridyltrisulfide","CrystEngComm","2007","9","10","873","","10.1039/b708972d","","","0.71073","MoKα","","0.0725","0.0709","","","0.1914","0.1941","","","","","","1.485","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203048","8.1601","0.0004","9.4126","0.0011","17.9991","0.0009","99.453","0.007","99.986","0.005","94.511","0.009","1334.85","0.19","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H28 N2 Ni O4 P2 S5 -","- C18 H28 N2 Ni O4 P2 S5 -","- C36 H56 N4 Ni2 O8 P4 S10 -","2","1","","Aragoni, M. Carla; Arca, Massimiliano; Crespo, Miriam; Devillanova, Francesco A.; Hursthouse, Michael B.; Huth, Susanne L.; Isaia, Francesco; Lippolis, Vito; Verani, Gaetano","Predictable and unpredictable reactions between 4,4′-dipyridyldisulfide and phosphonodithioato/dithiophosphato NiII complexes: novel coordination polymers and the unique example of 4,4′-dipyridyltrisulfide","CrystEngComm","2007","9","10","873","","10.1039/b708972d","","","0.71073","MoKα","","0.0402","0.0393","","","0.1251","0.1264","","","","","","1.212","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203049","11.6911","0.0012","9.9945","0.001","12.1366","0.0012","90","","102.743","0.005","90","","1383.2","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H14 N4 O6 -","- C14 H14 N4 O6 -","- C56 H56 N16 O24 -","4","0.5","","Schmidtmann, Marc; Gutmann, Matthias J.; Middlemiss, Derek S.; Wilson, Chick C.","Towards proton transfer in hydrogen bonded molecular complexes: joint experimental and theoretical modelling and an energy scale for polymorphism","CrystEngComm","2007","9","9","743","","10.1039/b709136m","","","0.71073","MoKα","","0.0383","0.0356","","","0.1085","0.111","","","","","","1.088","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203050","3.6811","0.0007","7.5912","0.0014","12.455","0.002","85.638","0.009","87.856","0.01","84.221","0.01","345.11","0.11","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H14 N4 O6 -","- C14 H14 N4 O6 -","- C14 H14 N4 O6 -","1","0.5","","Schmidtmann, Marc; Gutmann, Matthias J.; Middlemiss, Derek S.; Wilson, Chick C.","Towards proton transfer in hydrogen bonded molecular complexes: joint experimental and theoretical modelling and an energy scale for polymorphism","CrystEngComm","2007","9","9","743","","10.1039/b709136m","","","0.71073","MoKα","","0.0476","0.0405","","","0.1153","0.1212","","","","","","1.046","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203051","15.067","0.01","15.478","0.007","23.36","0.02","101.02","0.06","99.84","0.08","105.1","0.04","5021","6","100","2","100","2","","","","","","","","4","P 1","P 1","1","cyclomaltoheptaose + N,N'-Bis-pyridin-4-ylmethylene-hydrazine inclusion complex","cyclomaltoheptaose + N,N'-Bis-pyridin-4-ylmethylene-hydrazine inclusion complex","","- C150 H165.28 N8 O142.05 -","- C150 H165.28 N8 O142.06 -","- C150 H165.28 N8 O142.06 -","1","1","","Chatziefthimiou, Spyros D.; Yannakopoulou, Konstantina; Mavridis, Irene M.","β-Cyclodextrin trimers enclosing an unusual organization of guest: The inclusion complex β-cyclodextrin/4-pyridinealdazine","CrystEngComm","2007","9","11","976","","10.1039/b709155a","","","0.8015","SYNCHROTRON","","0.0681","0.0653","","","0.1772","0.1804","","","","","","1.037","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203052","7.1982","0.0005","8.634","0.0006","9.2042","0.0007","105.813","0.001","99.892","0.001","112.181","0.001","484.83","0.06","100","1","100","1","","","","","","","","6","P -1","-P 1","2","","","","- C10 H16 Cs2 N4 Ni O14 -","- C10 H16 Cs2 N4 Ni O14 -","- C10 H16 Cs2 N4 Ni O14 -","1","0.5","","Falvello, Larry R.; Ferrer, Daniel; Piedrafita, María; Soler, Tatiana; Tomás, Milagros","Using the crystal to engineer the molecule: cis-trans-isomer selection in anionic bis(orotate) complexes","CrystEngComm","2007","9","10","852","","10.1039/b709168k","","","0.71073","MoKα","","0.0147","0.014","","","0.0359","0.0363","","","","","","1.008","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203053","12.1915","0.0004","12.3098","0.0006","16.4178","0.0007","90.374","0.004","96.009","0.003","95.849","0.003","2437.24","0.18","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","","","- C42 H84 N6 Ni O12 -","- C42 H82 N6 Ni O12 -","- C84 H164 N12 Ni2 O24 -","2","1","","Falvello, Larry R.; Ferrer, Daniel; Piedrafita, María; Soler, Tatiana; Tomás, Milagros","Using the crystal to engineer the molecule: cis-trans-isomer selection in anionic bis(orotate) complexes","CrystEngComm","2007","9","10","852","","10.1039/b709168k","","","0.71073","MoKα","","0.1034","0.0758","","","0.1316","0.1422","","","","","","1.139","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203054","7.9761","0.0001","8.2004","0.0001","7.3668","0.0001","90","","103.414","0.001","90","","468.697","0.011","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C H5 N3 O4 -","- C H5 N3 O4 -","- C4 H20 N12 O16 -","4","1","","Nelyubina, Yulia V.; Lyssenko, Konstantin A.; Golovanov, Denis G.; Antipin, Mikhail Yu.","NO3‒⋯NO3‒ and NO3‒⋯π interactions in the crystal of urea nitrate","CrystEngComm","2007","9","11","991","","10.1039/b709180j","","","0.71073","MoKα","","0.048","0.033","","","0.0869","0.0985","","","","","","1","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203055","22.3238","0.0011","10.0035","0.0005","38.1841","0.0018","90","","90","","90","","8527.1","0.7","113","2","113","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C96 H106 Er2 N4 O12 -","- C96 H106 Er2 N4 O12 -","- C384 H424 Er8 N16 O48 -","4","0.5","","Song, Limei; Liu, Xinhou; Zhen, Zhen; Chen, Cong; Zhang, Daming","Solution-processable erbium‒ytterbium complex for potential planar optical amplifier application","Journal of Materials Chemistry","2007","17","43","4586","","10.1039/b709237g","","","0.7107","MoKα","","0.0572","0.0509","","","0.0826","0.0845","","","","","","1.282","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203056","14.745","0.002","5.7176","0.0005","20.659","0.003","90","","90","","90","","1741.7","0.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C9 H8 O S -","- C9 H8 O S -","- C72 H64 O8 S8 -","8","1","","Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.","Impact of sulfur substituents on the C‒H⋯O interaction of terminal alkynes in crystal engineering","CrystEngComm","2007","9","11","1041","","10.1039/b709261j","","","0.71073","MoKα","","0.1854","0.0585","","","0.1081","0.14","","","","","","0.998","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203057","5.9369","0.0006","10.9023","0.001","13.2907","0.0019","90","","90","","90","","860.25","0.17","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H8 O S -","- C9 H8 O S -","- C36 H32 O4 S4 -","4","1","","Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.","Impact of sulfur substituents on the C‒H⋯O interaction of terminal alkynes in crystal engineering","CrystEngComm","2007","9","11","1041","","10.1039/b709261j","","","0.71073","MoKα","","0.0345","0.029","","","0.077","0.0836","","","","","","1.091","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203058","22.1885","0.0013","5.6567","0.0005","14.0833","0.0009","90","","90","","90","","1767.6","0.2","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C9 H8 O2 S -","- C9 H8 O2 S -","- C72 H64 O16 S8 -","8","2","","Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.","Impact of sulfur substituents on the C‒H⋯O interaction of terminal alkynes in crystal engineering","CrystEngComm","2007","9","11","1041","","10.1039/b709261j","","","0.71073","MoKα","","0.0554","0.0371","","","0.0888","0.1066","","","","","","1.153","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203059","6.0507","0.001","9.6244","0.0011","7.9662","0.0006","90","","109.273","0.01","90","","437.91","0.1","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C9 H8 O2 S -","- C9 H8 O2 S -","- C18 H16 O4 S2 -","2","1","","Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.","Impact of sulfur substituents on the C‒H⋯O interaction of terminal alkynes in crystal engineering","CrystEngComm","2007","9","11","1041","","10.1039/b709261j","","","0.71073","MoKα","","0.0583","0.0562","","","0.1452","0.1476","","","","","","1.172","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203060","6.7881","0.0004","7.9542","0.0004","8.7386","0.0004","94.048","0.005","92.037","0.006","95.872","0.007","467.75","0.04","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H10 O S -","- C10 H10 O S -","- C20 H20 O2 S2 -","2","1","","Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.","Impact of sulfur substituents on the C‒H⋯O interaction of terminal alkynes in crystal engineering","CrystEngComm","2007","9","11","1041","","10.1039/b709261j","","","0.71073","MoKα","","0.0552","0.0399","","","0.1012","0.1156","","","","","","1.129","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203061","10.5942","0.0007","7.9196","0.0003","11.5721","0.0005","90","","98.59","0.004","90","","960.03","0.08","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 O2 S -","- C10 H10 O2 S -","- C40 H40 O8 S4 -","4","1","","Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.","Impact of sulfur substituents on the C‒H⋯O interaction of terminal alkynes in crystal engineering","CrystEngComm","2007","9","11","1041","","10.1039/b709261j","","","0.71069","MoKα","","0.0503","0.0388","","","0.1019","0.1151","","","","","","1.118","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203062","7.9083","0.0004","8.889","0.0004","14.4521","0.0007","90","","90","","90","","1015.94","0.08","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H10 O3 S -","- C10 H10 O3 S -","- C40 H40 O12 S4 -","4","1","","Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.","Impact of sulfur substituents on the C‒H⋯O interaction of terminal alkynes in crystal engineering","CrystEngComm","2007","9","11","1041","","10.1039/b709261j","","","0.71069","MoKα","","0.0365","0.029","","","0.0675","0.0766","","","","","","1.133","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203063","7.389","0.001","8.134","0.003","8.474","0.002","109.23","0.02","98.6","0.02","106.01","0.02","445.7","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H7 F O2 S -","- C9 H7 F O2 S -","- C18 H14 F2 O4 S2 -","2","1","","Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.","Impact of sulfur substituents on the C‒H⋯O interaction of terminal alkynes in crystal engineering","CrystEngComm","2007","9","11","1041","","10.1039/b709261j","","","0.71073","MoKα","","0.1602","0.078","","","0.234","0.3204","","","","","","1.066","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203064","6.586","0.0002","10.1867","0.0003","16.9358","0.0006","90","","90","","90","","1136.22","0.06","240","2","240","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H12 O3 S -","- C11 H12 O3 S -","- C44 H48 O12 S4 -","4","1","","Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R.","Impact of sulfur substituents on the C‒H⋯O interaction of terminal alkynes in crystal engineering","CrystEngComm","2007","9","11","1041","","10.1039/b709261j","","","0.71073","MoKα","","0.044","0.0325","","","0.0753","0.08","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203065","10.9387","0.0011","11.4172","0.0013","14.3741","0.0016","90","","99.686","0.007","90","","1769.6","0.3","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H14 S4 -","- C22 H14 S4 -","- C88 H56 S16 -","4","1","","Zhao, Tianyue; Wei, Zhongming; Song, Yabin; Xu, Wei; Hu, Wenping; Zhu, Daoben","Tetrathia[22]annulene[2,1,2,1]: physical properties, crystal structure and application in organic field-effect transistors","Journal of Materials Chemistry","2007","17","41","4377","","10.1039/b709324a","","","0.7107","MoKα","","0.0533","0.0417","","","0.0894","0.0953","","","","","","1.123","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203066","5.8976","0.001","16.381","0.003","16.464","0.003","90","","90","","90","","1590.6","0.5","303","2","303","2","","","101","","","","synthetic","5","P 21 21 21","P 2ac 2ab","19","none","(10-nitro-phenantren-9-yl)(phenyl)sulphide","","- C20 H13 N O2 S -","- C20 H13 N O2 S -","- C80 H52 N4 O8 S4 -","4","1","","Lennartson, Anders; Wiklund, Tove; Håkansson, Mikael","Concomitant formation of chiral and racemic crystals of a diaryl sulfide","CrystEngComm","2007","9","10","856","","10.1039/b709387j","","x-ray","0.71073","mokα","","0.0327","0.0298","","","0.078","0.0793","","","","","","1.051","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203067","8.6557","0.0015","12.706","0.002","14.439","0.003","90","","94.42","0.007","90","","1583.3","0.5","303","2","303","2","","","101","","","","synthetic","5","P 1 21/c 1","-P 2ybc","14","none","(10-nitro-phenantren-9-yl)(phenyl)sulphide","","- C20 H13 N O2 S -","- C20 H13 N O2 S -","- C80 H52 N4 O8 S4 -","4","1","","Lennartson, Anders; Wiklund, Tove; Håkansson, Mikael","Concomitant formation of chiral and racemic crystals of a diaryl sulfide","CrystEngComm","2007","9","10","856","","10.1039/b709387j","","x-ray","0.71073","MoKα","","0.0494","0.0412","","","0.1145","0.119","","","","","","1.069","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203068","10.864","0.002","5.116","0.001","12.282","0.002","90","","104.53","0.01","90","","660.8","0.2","293","2","293","2","","","","","","","","5","P 1 c 1","P -2yc","7","catena-(mu-cyanido-kappaC,N)(mu-isonicotinato-kappaN,O) (mu- isonicotinic acid-kappaN,O)dicopper(i)","catena-(μ-cyanido-κC,N)(μ-isonicotinato-κN,O) (μ-isonicotinic acid-κN,O)dicopper(I)","","- C13 H9 Cu2 N3 O4 -","- C13 H9 Cu2 N3 O4 -","- C26 H18 Cu4 N6 O8 -","2","1","","Amo-Ochoa, Pilar; Miguel, Pablo J. Sanz; Castillo, Oscar; Zamora, Félix","An unusual triple parallel interpenetrated 2D Cu-polymer, with a 3D triple interpenetration via H-bonding","CrystEngComm","2007","9","11","987","","10.1039/b709457d","","","0.71069","MoKα","","0.0438","0.0298","","","0.0727","0.0756","","","","","","0.947","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203069","9.5456","0.0006","11.1348","0.0007","37.703","0.002","82.05","0.002","86.294","0.002","66.254","0.002","3632.7","0.4","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H46 Fe N O13 S32 -","- C54 H46 Fe N O13 S32 -","- C108 H92 Fe2 N2 O26 S64 -","2","1","","Lee Martin; Peter Day; Hiroki Akutsu; Jun-ichi Yamada; Shin'ichi Nakatsuji; William Clegg; Ross W. Harrington; Peter N. Horton; Michael B. Hursthouse; Paul McMillan; Steven Firth","Metallic molecular crystals containing chiral or racemic guest molecules","CrystEngComm","2007","9","10","865","","10.1039/b709558a","","","0.6814","synchrotron","","0.0866","0.0469","","","0.097","0.1099","","","","","","1.011","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203070","9.5293","0.0004","11.168","0.0005","37.6039","0.0016","81.788","0.002","86.147","0.001","66.364","0.001","3628.4","0.3","120","2","120","2","","","","","","","","6","P 1","P 1","1","","","","- C54 H46 Fe N O13 S32 -","- C54 H46 Fe N O13 S32 -","- C108 H92 Fe2 N2 O26 S64 -","2","2","","Lee Martin; Peter Day; Hiroki Akutsu; Jun-ichi Yamada; Shin'ichi Nakatsuji; William Clegg; Ross W. Harrington; Peter N. Horton; Michael B. Hursthouse; Paul McMillan; Steven Firth","Metallic molecular crystals containing chiral or racemic guest molecules","CrystEngComm","2007","9","10","865","","10.1039/b709558a","","","0.71073","MoKα","","0.1094","0.0835","","","0.1869","0.2113","","","","","","1.088","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203071","7.802","0.003","8.471","0.003","8.709","0.003","114.3","0.04","96.46","0.03","114.38","0.04","449.3","0.4","293","2","294","2","","","","","","","","4","P -1","-P 1","2","","N,N'-dimesitylethanediamide","","- C20 H24 N2 O2 -","- C20 H24 N2 O2 -","- C20 H24 N2 O2 -","1","0.5","","Piotrkowska, Barbara; Gdaniec, Maria; Milewska, Maria J.; Połoński, Tadeusz","Aryl‒perfluoroaryl stacking interactions, hydrogen bonding and steric effects in controlling the structure of supramolecular assemblies of N,N′-diaryloxalamides","CrystEngComm","2007","9","10","868","","10.1039/b709654b","","","0.71073","MoKα","","0.0638","0.0491","","","0.1418","0.153","","","","","","1.079","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203072","10.875","0.0013","4.72","0.0007","15.978","0.002","90","","107.312","0.011","90","","783","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-bis(3,5-dimethylphenyl)ethanediamide","","- C18 H20 N2 O2 -","- C18 H20 N2 O2 -","- C36 H40 N4 O4 -","2","0.5","","Piotrkowska, Barbara; Gdaniec, Maria; Milewska, Maria J.; Połoński, Tadeusz","Aryl‒perfluoroaryl stacking interactions, hydrogen bonding and steric effects in controlling the structure of supramolecular assemblies of N,N′-diaryloxalamides","CrystEngComm","2007","9","10","868","","10.1039/b709654b","","","0.71073","MoKα","","0.0506","0.0459","","","0.1293","0.1345","","","","","","1.1","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203073","9.9263","0.0005","5.6969","0.0005","21.257","0.0013","90","","94.431","0.005","90","","1198.47","0.14","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-diphenylethanediamide 2,3,4,5,6-pentafluorophenol 1:2","","- C26 H14 F10 N2 O4 -","- C26 H14 F10 N2 O4 -","- C52 H28 F20 N4 O8 -","2","0.5","","Piotrkowska, Barbara; Gdaniec, Maria; Milewska, Maria J.; Połoński, Tadeusz","Aryl‒perfluoroaryl stacking interactions, hydrogen bonding and steric effects in controlling the structure of supramolecular assemblies of N,N′-diaryloxalamides","CrystEngComm","2007","9","10","868","","10.1039/b709654b","","","0.71073","MoKα","","0.0518","0.0465","","","0.1236","0.1289","","","","","","1.087","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203074","6.9797","0.0007","8.1338","0.0007","15.0081","0.0011","78.383","0.007","80.223","0.007","67.53","0.008","767.15","0.12","170","2","170","2","","","","","","","","5","P -1","-P 1","2","","N,N'-dimesitylethanediamide 2,3,4,5,6-pentafluorophenol 1:2","","- C16 H13 F5 N O2 -","- C16 H13 F5 N O2 -","- C32 H26 F10 N2 O4 -","2","1","","Piotrkowska, Barbara; Gdaniec, Maria; Milewska, Maria J.; Połoński, Tadeusz","Aryl‒perfluoroaryl stacking interactions, hydrogen bonding and steric effects in controlling the structure of supramolecular assemblies of N,N′-diaryloxalamides","CrystEngComm","2007","9","10","868","","10.1039/b709654b","","","0.71073","MoKα","","0.0534","0.0429","","","0.1233","0.1293","","","","","","1.154","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203075","15.6385","0.0009","6.974","0.0006","15.1543","0.001","90","","118.275","0.006","90","","1455.6","0.2","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-bis(2,6-dimethylphenyl)ethanediamide bis-2,3,4,5,6-pentafluorophenol","","- C30 H22 F10 N2 O4 -","- C30 H22 F10 N2 O4 -","- C60 H44 F20 N4 O8 -","2","0.5","","Piotrkowska, Barbara; Gdaniec, Maria; Milewska, Maria J.; Połoński, Tadeusz","Aryl‒perfluoroaryl stacking interactions, hydrogen bonding and steric effects in controlling the structure of supramolecular assemblies of N,N′-diaryloxalamides","CrystEngComm","2007","9","10","868","","10.1039/b709654b","","","0.71073","MoKα","","0.0522","0.0449","","","0.1207","0.127","","","","","","1.106","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203076","7.0285","0.0005","7.5525","0.0005","13.6546","0.0009","91.511","0.005","101.938","0.006","92.892","0.006","707.74","0.08","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","N,N'-bis(3,5-dimethylphenyl)ethanediamide bis-2,3,4,5,6-pentafluorophenol","","- C30 H22 F10 N2 O4 -","- C30 H22 F10 N2 O4 -","- C30 H22 F10 N2 O4 -","1","0.5","","Piotrkowska, Barbara; Gdaniec, Maria; Milewska, Maria J.; Połoński, Tadeusz","Aryl‒perfluoroaryl stacking interactions, hydrogen bonding and steric effects in controlling the structure of supramolecular assemblies of N,N′-diaryloxalamides","CrystEngComm","2007","9","10","868","","10.1039/b709654b","","","0.71073","MoKα","","0.0447","0.0382","","","0.1065","0.1112","","","","","","1.069","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203077","6.9617","0.001","8.311","0.0011","13.3819","0.0019","91.559","0.015","104.416","0.011","92.117","0.011","748.84","0.18","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","N,N'-bis(3,5-dimethylphenyl)ethanediamide bis-2,3,4,5,6-pentafluorobenzoic acid","","- C16 H11 F5 N O3 -","- C16 H11 F5 N O3 -","- C32 H22 F10 N2 O6 -","2","1","","Piotrkowska, Barbara; Gdaniec, Maria; Milewska, Maria J.; Połoński, Tadeusz","Aryl‒perfluoroaryl stacking interactions, hydrogen bonding and steric effects in controlling the structure of supramolecular assemblies of N,N′-diaryloxalamides","CrystEngComm","2007","9","10","868","","10.1039/b709654b","","","0.71073","MoKα","","0.0581","0.0462","","","0.1244","0.132","","","","","","1.069","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203078","11.292","0.006","15.112","0.01","15.805","0.012","90","","90","","90","","2697","3","298.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H38 N4 O4 -","- C26 H31 N4 O4 -","- C104 H124 N16 O16 -","4","1","","Rajesh, B. M.; Iqbal, Javed; Babu, N. Jagadeesh; Nangia, Ashwini","Water mediated tube in tetrapeptide cyclo(Phe-Pro-Leu-Aha) trihydrate and crystal structure of cyclo(d-Phe-Pro-Leu-Aha) anhydrate","CrystEngComm","2007","9","10","860","","10.1039/b709700j","","","0.7107","MoKα","","","0.082","","","","0.097","","","","","","1.133","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203079","9.4493","0.0016","14.125","0.002","21.736","0.004","90","","90","","90","","2901.1","0.8","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","cyclo(Phe-Pro-Leu-Aha)","","","- C26 H44 N4 O7 -","- C26 H44 N4 O7 -","- C104 H176 N16 O28 -","4","1","","Rajesh, B. M.; Iqbal, Javed; Babu, N. Jagadeesh; Nangia, Ashwini","Water mediated tube in tetrapeptide cyclo(Phe-Pro-Leu-Aha) trihydrate and crystal structure of cyclo(d-Phe-Pro-Leu-Aha) anhydrate","CrystEngComm","2007","9","10","860","","10.1039/b709700j","","","0.71073","MoKα","","0.0768","0.0665","","","0.1537","0.1596","","","","","","1.149","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203080","18.473","0.004","37.249","0.007","15.502","0.003","90","","90","","90","","10667","4","293","2","293","2","","","","","","","","5","I b a m","-I 2 2c","72","","","","- C12 H24 Cu4 I4 N4 -","- C12 H18 Cu4 I4 N4 -","- C192 H288 Cu64 I64 N64 -","16","1","","Bi, Minghui; Li, Guanghua; Hua, Jia; Liu, Xiaomin; Hu, Yawei; Shi, Zhan; Feng, Shouhua","A coordination polymer of copper(i) iodide with 654 topology constructed from Cu4I4(DABCO)4","CrystEngComm","2007","9","11","984","","10.1039/b709852a","","","0.71073","MoKα","","0.1473","0.0771","","","0.21","0.253","","","","","","1.021","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203081","9.955","0.009","10.404","0.009","10.839","0.009","97.689","0.009","98.771","0.007","111.382","0.016","1011","1.5","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H27 N O7 P2 -","- C16 H27 N O7 P2 -","- C32 H54 N2 O14 P4 -","2","1","","Zhang, Jianfeng; Cui, Zhanwei; Wang, Fei; Wang, Yadan; Miao, Zhiwei; Chen, Ruyu","Mannich type reactions of chlorophosphites, phosphoramides and aldehydes (ketones) under solvent-free and catalyst-free conditions—synthesis of N-phosphoramino α-aminophosphonates","Green Chemistry","2007","9","12","1341","","10.1039/b710008f","","","0.7107","MoKα","","0.0725","0.0574","","","0.1303","0.1388","","","","","","1.123","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203082","14.367","0.011","16.29","0.013","18.72","0.015","90","","105.06","0.014","90","","4231","6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Fe(tpypy)(tpypyH)](ClO4)3.EtOH","","","- C42 H35 Cl3 Fe N8 O13 -","- C42 H35 Cl3 Fe N8 O13 -","- C168 H140 Cl12 Fe4 N32 O52 -","4","1","","Beves, Jonathon E.; Constable, Edwin C.; Housecroft, Catherine E.; Kepert, Cameron J.; Neuburger, Markus; Price, David J.; Schaffner, Silvia","The conjugate acid of bis{4′-(4-pyridyl)-2,2′:6′,2″-terpyridine}iron(ii) as a self-complementary hydrogen-bonded building block","CrystEngComm","2007","9","11","1073","","10.1039/b710332h","","","0.71073","MoKα","","0.1488","0.0615","","","0.112","0.139","","","","","","0.975","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203083","13.1562","0.0001","20.3741","0.0002","18.8557","0.0002","90","","90","","90","","5054.19","0.08","173","","173","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C46 H33 Fe2 N14 O2 S6 -","- C46 H33 Fe2 N14 O2 S6 -","- C184 H132 Fe8 N56 O8 S24 -","4","0.5","","Beves, Jonathon E.; Constable, Edwin C.; Housecroft, Catherine E.; Kepert, Cameron J.; Neuburger, Markus; Price, David J.; Schaffner, Silvia","The conjugate acid of bis{4′-(4-pyridyl)-2,2′:6′,2″-terpyridine}iron(ii) as a self-complementary hydrogen-bonded building block","CrystEngComm","2007","9","11","1073","","10.1039/b710332h","","","0.71073","MoKα","","0.0445","0.0279","","0.0463","0.0319","0.0319","","","","","","1.0827","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203084","13.3057","0.0001","20.3495","0.0002","18.4014","0.0002","90","","90","","90","","4982.44","0.08","173","","173","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C48 H32 Fe2 N15 S6 -","- C48 H32 Fe2 N15 S6 -","- C192 H128 Fe8 N60 S24 -","4","0.5","","Beves, Jonathon E.; Constable, Edwin C.; Housecroft, Catherine E.; Kepert, Cameron J.; Neuburger, Markus; Price, David J.; Schaffner, Silvia","The conjugate acid of bis{4′-(4-pyridyl)-2,2′:6′,2″-terpyridine}iron(ii) as a self-complementary hydrogen-bonded building block","CrystEngComm","2007","9","11","1073","","10.1039/b710332h","","","0.71073","MoKα","","0.091","0.0701","","0.0432","0.0414","0.0414","","","","","","0.9055","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203085","9.632","0.004","13.811","0.007","11.323","0.005","90","","107.433","0.007","90","","1437.1","1.1","291","2","291","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H28 N8 Ni O11 -","- C19 H28 N8 Ni O11 -","- C38 H56 N16 Ni2 O22 -","2","1","","Wang, Su-Na; Bai, Junfeng; Li, Yi-Zhi; Pan, Yi; Scheer, Manfred; You, Xiao-Zeng","Synthesis, structures and properties of nickel(ii) and cobalt(ii) metal‒organic frameworks based on a flexible tricarboxylate ligand H3TTG and different pyridyl-containing ligands","CrystEngComm","2007","9","11","1084","","10.1039/b710413h","","","0.71073","MoKα","","0.0757","0.0627","","","0.1484","0.1517","","","","","","1.017","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203086","29.059","0.0016","10.0284","0.0005","18.1396","0.001","90","","90","","90","","5286.2","0.5","291","2","291","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C42 H58 N16 Ni2 O19 -","- C42 H58 N16 Ni2 O19 -","- C168 H232 N64 Ni8 O76 -","4","0.5","","Wang, Su-Na; Bai, Junfeng; Li, Yi-Zhi; Pan, Yi; Scheer, Manfred; You, Xiao-Zeng","Synthesis, structures and properties of nickel(ii) and cobalt(ii) metal‒organic frameworks based on a flexible tricarboxylate ligand H3TTG and different pyridyl-containing ligands","CrystEngComm","2007","9","11","1084","","10.1039/b710413h","","","0.71073","MoKα","","0.069","0.0546","","","0.1602","0.1689","","","","","","1.046","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203087","29.1836","0.0017","10.0604","0.0006","18.1377","0.001","90","","90","","90","","5325.2","0.5","291","2","291","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C42 H58 Co2 N16 O19 -","- C42 H58 Co2 N16 O19 -","- C168 H232 Co8 N64 O76 -","4","0.5","","Wang, Su-Na; Bai, Junfeng; Li, Yi-Zhi; Pan, Yi; Scheer, Manfred; You, Xiao-Zeng","Synthesis, structures and properties of nickel(ii) and cobalt(ii) metal‒organic frameworks based on a flexible tricarboxylate ligand H3TTG and different pyridyl-containing ligands","CrystEngComm","2007","9","11","1084","","10.1039/b710413h","","","0.71073","MoKα","","0.0874","0.0643","","","0.1601","0.169","","","","","","1.036","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203088","10.473","0.002","17.597","0.004","14.503","0.003","90","","106.452","0.003","90","","2563.4","0.9","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C84 H92 Co6 N32 O28 -","- C84 H92 Co6 N32 O28 -","- C84 H92 Co6 N32 O28 -","1","0.25","","Wang, Su-Na; Bai, Junfeng; Li, Yi-Zhi; Pan, Yi; Scheer, Manfred; You, Xiao-Zeng","Synthesis, structures and properties of nickel(ii) and cobalt(ii) metal‒organic frameworks based on a flexible tricarboxylate ligand H3TTG and different pyridyl-containing ligands","CrystEngComm","2007","9","11","1084","","10.1039/b710413h","","","0.71073","MoKα","","0.084","0.056","","","0.1101","0.1146","","","","","","1.094","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203089","14.5255","0.0005","7.921","0.0003","14.9241","0.0005","90","","98.607","0.003","90","","1697.78","0.1","0","","293","2","","","","","","","see text","4","P 1 21 1","P 2yb","4","","","","- C34 H65 N O6 -","- C34 H65 N O6 -","- C68 H130 N2 O12 -","2","1","","Tomašić, Vlasta; Štefanić, Zoran","Cholic acid as host for long linear molecules: a series of co-crystals with n-alkylammonia","CrystEngComm","2007","9","11","1124","","10.1039/b710469c","","x-ray","1.54128","CuKα","","0.0628","0.0488","","","0.1402","0.1517","","","","","","1.089","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203090","18.291","0.007","7.973","0.003","20.566","0.007","90","","95.049","0.003","90","","2987.6","1.9","293","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C60 H111 N O12 -","- C60 H89 N O12 -","- C120 H178 N2 O24 -","2","1","","Tomašić, Vlasta; Štefanić, Zoran","Cholic acid as host for long linear molecules: a series of co-crystals with n-alkylammonia","CrystEngComm","2007","9","11","1124","","10.1039/b710469c","","x-ray","1.54184","CuKα","","","0.0896","","","","0.294","","","","","","1.052","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203091","14.6044","0.0007","7.9746","0.0004","17.2816","0.0007","90","","102.785","0.003","90","","1962.79","0.16","293","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C38 H73 N O6 -","- C38 H73 N O6 -","- C76 H146 N2 O12 -","2","1","","Tomašić, Vlasta; Štefanić, Zoran","Cholic acid as host for long linear molecules: a series of co-crystals with n-alkylammonia","CrystEngComm","2007","9","11","1124","","10.1039/b710469c","","x-ray","1.54128","CuKα","","","0.0725","","","","0.191","","","","","","1.009","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203092","14.593","0.004","7.99","0.002","18.702","0.008","90","","109.52","0.03","90","","2055.3","1.2","293","2","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C40 H77 N O6 -","- C40 H77 N O6 -","- C80 H154 N2 O12 -","2","1","","Tomašić, Vlasta; Štefanić, Zoran","Cholic acid as host for long linear molecules: a series of co-crystals with n-alkylammonia","CrystEngComm","2007","9","11","1124","","10.1039/b710469c","","x-ray","1.5412","CuKα","","","0.0726","","","","0.2303","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7203093","8.3621","0.0004","11.0698","0.0005","9.8203","0.0005","90","","101.459","0.003","90","","890.91","0.07","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H18 Au2 Cu N6 -","- C12 H18 Au2 Cu N6 -","- C24 H36 Au4 Cu2 N12 -","2","1","","Geisheimer, Andrew R.; Katz, Michael J.; Batchelor, Raymond J.; Leznoff, Daniel B.","Preparation and characterization of two chiral Au(CN)2-based coordination polymers containing (1R,2R)-N,N′-dimethylcyclohexanediamine","CrystEngComm","2007","9","11","1078","","10.1039/b711275k","","","0.71073","MoKα","","0.0536","0.0434","","0.06","0.0558","0.0558","","","","","","0.9877","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203094","7.2413","0.0002","17.2528","0.0005","12.9833","0.0003","90","","90","","90","","1622.04","0.07","293","","293","","","","","","","","","7","C 2 2 21","C 2c 2","20","","","","- C10 H18 Au Cl Cu N4 O4 -","- C10 H18 Au Cl Cu N4 O4 -","- C40 H72 Au4 Cl4 Cu4 N16 O16 -","4","0.5","","Geisheimer, Andrew R.; Katz, Michael J.; Batchelor, Raymond J.; Leznoff, Daniel B.","Preparation and characterization of two chiral Au(CN)2-based coordination polymers containing (1R,2R)-N,N′-dimethylcyclohexanediamine","CrystEngComm","2007","9","11","1078","","10.1039/b711275k","","","0.71073","MoKα","","0.0554","0.0278","","0.0333","0.0254","0.0254","","","","","","0.7832","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7203095","24.0685","0.0006","24.0685","0.0006","10.9542","0.0006","90","","90","","90","","6345.7","0.4","100","2","100","2","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- C48 H168 N40 O100 -","- C48 H48 N40 O101.12 -","- C96 H96 N80 O202.24 -","2","0.0625","","Bardelang, David; Udachin, Konstantin A.; Leek, Donald M.; Ripmeester, John A.","Highly symmetric columnar channels in metal-free cucurbit[n]uril hydrate crystals (n = 6, 8)","CrystEngComm","2007","9","11","973","","10.1039/b711285h","","","0.7107","MoKα","","0.1262","0.1181","","","0.3212","0.3465","","","","","","1.744","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203096","14.4486","0.0003","14.4486","0.0003","10.5175","0.0005","90","","90","","120","","1901.49","0.11","100","2","100.1","1","","","","","","","","5","P 6/m m m","-P 6 2","191","","","","- C18 H55 Cl N12 O24 -","- C18 H18 Cl N12 O24.02 -","- C36 H36 Cl2 N24 O48.04 -","2","0.0833333","","Bardelang, David; Udachin, Konstantin A.; Leek, Donald M.; Ripmeester, John A.","Highly symmetric columnar channels in metal-free cucurbit[n]uril hydrate crystals (n = 6, 8)","CrystEngComm","2007","9","11","973","","10.1039/b711285h","","","0.7107","MoKα","","0.1581","0.1471","","","0.4227","0.4548","","","","","","2.232","","","","has coordinates,has disorder","180361","2020-10-21","18:00:00",""
"7203097","11.8672","0.0018","12.2217","0.0019","6.4287","0.001","90","","90","","90","","932.4","0.2","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","Pyrazine-N,N'-dioxide","Pyrazine-N,N'-dioxide","","- C4 H4 N2 O2 -","- C4 H4 N2 O2 -","- C32 H32 N16 O16 -","8","1","","Babu, N. Jagadeesh; Nangia, Ashwini","High Z′ polymorphs have shorter C‒H⋯O interactions and O‒H⋯O hydrogen bonds","CrystEngComm","2007","9","11","980","","10.1039/b711739f","","","0.71073","MoKα","","0.0874","0.0605","","","0.1439","0.1584","","","","","","1.151","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203098","3.7239","0.0013","11.01","0.004","5.683","0.002","90","","96.237","0.005","90","","231.62","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Pyrazine-N,N'-dioxide","Pyrazine-N,N'-dioxide","","- C4 H4 N2 O2 -","- C4 H4 N2 O2 -","- C8 H8 N4 O4 -","2","0.5","","Babu, N. Jagadeesh; Nangia, Ashwini","High Z′ polymorphs have shorter C‒H⋯O interactions and O‒H⋯O hydrogen bonds","CrystEngComm","2007","9","11","980","","10.1039/b711739f","","","0.71073","MoKα","","0.0651","0.0564","","","0.1178","0.122","","","","","","1.24","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7203099","7.6982","0.0004","10.662","0.0006","19.4343","0.001","87.531","0.001","86.42","0.001","75.938","0.001","1543.67","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H40 Fe N2 O8 -","- C34 H40 Fe N2 O8 -","- C68 H80 Fe2 N4 O16 -","2","1","","Braga, Dario; Giaffreda, Stefano Luca; Grepioni, Fabrizia; Chierotti, Michele R.; Gobetto, Roberto; Palladino, Giuseppe; Polito, Marco","Solvent effect in a “solvent free” reaction","CrystEngComm","2007","9","10","879","","10.1039/b711983f","","","0.71073","MoKα","","0.0516","0.0338","","","0.0843","0.0916","","","","","","0.843","","","","has coordinates","180361","2020-10-21","18:00:00",""
"7209353","15.347","","15.659","","13.691","","90","","90","","90","","3290.2","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Ag10 Te4 Br2.404 Cl0.596","","- Ag10 Br2.404 Cl0.596 Te4 -","- Ag10 Br2.39 Cl0.61 Te4 -","- Ag80 Br19.12 Cl4.88 Te32 -","8","0.5","","Nilges, T.; Bawohl, M.; Lange, S.","Ag10 Te4 Br(3-x) Cl(x) and Ag10 Te4 Br(3-y) I(y): structural and electrical property tuning of a mixed conductor by partial anion substitution","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","955","964","","","","","","","","","","","","","","","","","","","","","","has coordinates","180424","2020-10-21","18:00:00",""
"7209355","13.759","","13.759","","15.356","","90","","90","","120","","2517.57","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ag10.003 Te3.993 Br2.646 I0.354","","- Ag10.003 Br2.646 I0.354 Te3.993 -","- Ag10.0073 Br2.64 I0.36 Te3.99333 -","- Ag60.044 Br15.84 I2.16 Te23.96 -","6","0.25","","Nilges, T.; Lange, S.; Bawohl, M.","Ag10 Te4 Br(3-x) Cl(x) and Ag10 Te4 Br(3-y) I(y): structural and electrical property tuning of a mixed conductor by partial anion substitution","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","955","964","","","","","","","","","","","","","","","","","","","","","","has coordinates","180424","2020-10-21","18:00:00",""
"7209492","7.2034","","7.2034","","4.1006","","90","","90","","90","","212.776","","","","","","","","","","","","","2","P 4/m b m","-P 4 2ab","127","","Ce B4","","- B4 Ce -","- B4 Ce -","- B16 Ce4 -","4","0.25","","Hiebl, K.; Simon, A.; Babizhetskyy, V.","Single crystal investigation and physical properties of the binary compound Ce B4","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","896","900","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7221477","4.416","","4.416","","4.681","","90","","90","","120","","79.055","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Sr Ga1.67 In0.33","","- Ga1.67 In0.33 Sr -","- Ga1.666 In0.334 Sr -","- Ga1.666 In0.334 Sr -","1","0.0416667","","Harms, W.; Wendorff, M.; Roehr, C.","Gemischte Erdalkalimetall-Trielide A(II) M1(III)(x) M2(III)(2-x) (A(II) = Ca, Sr, Ba; M(III) = Al, Ga, In): Strukturchemische und bindungstheoretische Untersuchungen","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","177","194","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221493","12.6375","","9.7243","","8.4117","","90","","90","","90","","1033.72","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","Yb5 Bi3","","- Bi3 Yb5 -","- Bi3 Yb5 -","- Bi12 Yb20 -","4","0.5","","Liang Ying; Cardoso-Gil, R.; Schnelle, W.; Grin', Yu.; Zhao Jingtai; Schmidt, M.","Chemical bonding and physical properties of Yb5 Bi3","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","935","940","","","","","","","","","","","","","","","","","","","","","","has coordinates","151259","2020-10-21","18:00:00",""
"7221499","4.2911","","4.2911","","7.8893","","90","","90","","120","","125.807","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ce Cu Ge -","- Ce Cu Ge -","- Ce2 Cu2 Ge2 -","2","0.0833333","","Pasturel, M.; Weill, F.; Bobet, J.L.","Superstructures in room - temperature ordered deuterides Ce Cu Si D(x) and Ce Cu Ge D(x)","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7221500","4.229","","4.229","","24.815","","90","","90","","120","","384.344","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ce Cu Ge D1.15","","- Ce Cu D1.15 Ge -","- Ce Cu D1.14667 Ge -","- Ce6 Cu6 D6.88 Ge6 -","6","0.25","","Pasturel, M.; Weill, F.; Bobet, J.L.","Superstructures in room - temperature ordered deuterides Ce Cu Si D(x) and Ce Cu Ge D(x)","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221501","4.2194","","4.2194","","7.9548","","90","","90","","120","","122.648","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ce Cu Si -","- Ce Cu Si -","- Ce2 Cu2 Si2 -","2","0.0833333","","Pasturel, M.; Weill, F.; Bobet, J.L.","Superstructures in room - temperature ordered deuterides Ce Cu Si D(x) and Ce Cu Ge D(x)","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7221502","4.1803","","4.1803","","58.15","","90","","90","","120","","880.025","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ce Cu Si D1.64","","- Ce Cu D1.64 Si -","- Ce Cu D1.63429 Si -","- Ce14 Cu14 D22.88 Si14 -","14","0.583333","","Pasturel, M.; Weill, F.; Bobet, J.L.","Superstructures in room - temperature ordered deuterides Ce Cu Si D(x) and Ce Cu Ge D(x)","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221503","8.9233","","15.521","","37.255","","90","","90","","90","","5159.76","","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","((C H3)4 N)2 (Mo S4)","","- C8 H24 Mo N2 S4 -","- C8 H24 Mo N2 S4 -","- C96 H288 Mo12 N24 S48 -","12","3","","Poisot, M.; Naether, C.; Bensch, W.","Synthesis, spectroscopic and X-ray structure characterisation of bis(tetramethylammonium) and bis(tetra-n-butylammonium) tetrathiomolybdates","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","209","214","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221505","9.629","","9.629","","8.692","","90","","90","","120","","697.931","","","","","","","","","","","","","4","R 3 :H","R 3","146","","Li3 (V O4) (H2 O)6","","- H12 Li3 O10 V -","- Li3 O10 V -","- Li9 O30 V3 -","3","0.333333","","Schnabel, S.; Roehr, C.","Hydrates of Li3 V O4: synthesis and structural chemistry","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","1235","1245","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221506","5.926","","6.513","","7.302","","89.09","","89.43","","88.968","","281.734","","","","","","","","","","","","","4","P 1","P 1","1","","Li3 (V O4) (H2 O)8","","- H16 Li3 O12 V -","- Li3 O12 V -","- Li3 O12 V -","1","1","","Schnabel, S.; Roehr, C.","Hydrates of Li3 V O4: synthesis and structural chemistry","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","1235","1245","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221507","7.326","","6.537","","12.929","","90","","112.21","","90","","573.231","","","","","","","","","","","","","4","P 1 c 1","P -2yc","7","","Li3 (V O4) (H2 O)8","","- H16 Li3 O12 V -","- Li3 O12 V -","- Li6 O24 V2 -","2","1","","Schnabel, S.; Roehr, C.","Hydrates of Li3 V O4: synthesis and structural chemistry","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","1235","1245","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221516","13.4251","","3.9796","","6.2743","","90","","90","","90","","335.214","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Cu Dy S2 -","- Cu Dy S2 -","- Cu4 Dy4 S8 -","4","0.5","","Strobel, S.; Schleid, T.","Muenzmetall-Lanthanid-Chalkogenide: II. Kupfer(I)-Lanthanid(III)-Sulfide der Zusammensetzung Cu M S2 (M = Dy - Lu) im orthorhombischen B-Typ","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","15","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7221517","13.3682","","3.9658","","6.2667","","90","","90","","90","","332.233","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Cu Ho S2 -","- Cu Ho S2 -","- Cu4 Ho4 S8 -","4","0.5","","Strobel, S.; Schleid, T.","Muenzmetall-Lanthanid-Chalkogenide: II. Kupfer(I)-Lanthanid(III)-Sulfide der Zusammensetzung Cu M S2 (M = Dy - Lu) im orthorhombischen B-Typ","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","15","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7221518","13.3124","","3.9517","","6.2596","","90","","90","","90","","329.296","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Cu Er S2 -","- Cu Er S2 -","- Cu4 Er4 S8 -","4","0.5","","Strobel, S.; Schleid, T.","Muenzmetall-Lanthanid-Chalkogenide: II. Kupfer(I)-Lanthanid(III)-Sulfide der Zusammensetzung Cu M S2 (M = Dy - Lu) im orthorhombischen B-Typ","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","15","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7221519","13.2573","","3.9379","","6.2532","","90","","90","","90","","326.454","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Cu Tm S2","","- Cu S2 Tm -","- Cu S2 Tm -","- Cu4 S8 Tm4 -","4","0.5","","Strobel, S.; Schleid, T.","Muenzmetall-Lanthanid-Chalkogenide: II. Kupfer(I)-Lanthanid(III)-Sulfide der Zusammensetzung Cu M S2 (M = Dy - Lu) im orthorhombischen B-Typ","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","15","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221520","13.2035","","3.9241","","6.247","","90","","90","","90","","323.669","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Cu Yb S2","","- Cu S2 Yb -","- Cu S2 Yb -","- Cu4 S8 Yb4 -","4","0.5","","Strobel, S.; Schleid, T.","Muenzmetall-Lanthanid-Chalkogenide: II. Kupfer(I)-Lanthanid(III)-Sulfide der Zusammensetzung Cu M S2 (M = Dy - Lu) im orthorhombischen B-Typ","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","15","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221521","13.1506","","3.9104","","6.2418","","90","","90","","90","","320.979","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Cu Lu S2 -","- Cu Lu S2 -","- Cu4 Lu4 S8 -","4","0.5","","Strobel, S.; Schleid, T.","Muenzmetall-Lanthanid-Chalkogenide: II. Kupfer(I)-Lanthanid(III)-Sulfide der Zusammensetzung Cu M S2 (M = Dy - Lu) im orthorhombischen B-Typ","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","15","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7221522","11.9658","","11.9658","","40.1033","","90","","90","","120","","4972.72","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Sr14 (Al4)2 Ge3","","- Al8 Ge3 Sr14 -","- Al8 Ge3 Sr14 -","- Al48 Ge18 Sr84 -","6","0.333333","","Wendorff, M.; Roehr, C.","Sr14 [Al4]2 [Ge]3: a Zintl phase with isolated [Ge4](4-)- and [Al4](8-) anions","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","1227","1234","","","","","","","","","","","","","","","","","","","","","","has coordinates","151868","2020-10-21","18:00:00",""
"7222639","10.487","","6.035","","8.306","","90","","103.68","","90","","510.766","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Sr2 Pd2 In","","- In Pd2 Sr2 -","- In Pd2 Sr2 -","- In4 Pd8 Sr8 -","4","0.5","","Muts, I.; Nilges, T.; Rodewald, U.C.; Zaremba, V.I.; Poettgen, R.","Synthesis and structure of Sr2 Pd2 In and Sr2 Pt2 In","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","1563","1566","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222640","10.268","","5.99","","8.303","","90","","103.17","","90","","497.247","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Sr2 Pt2 In","","- In Pt2 Sr2 -","- In Pt2 Sr2 -","- In4 Pt8 Sr8 -","4","0.5","","Muts, I.; Nilges, T.; Poettgen, R.; Rodewald, U.C.; Zaremba, V.I.","Synthesis and Structure of Sr2 Pd2 In and Sr2 Pt2 In","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","1563","1566","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222777","4.4492","","4.4492","","7.5448","","90","","90","","120","","129.343","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Ba2 H3 Br","","- Ba2 Br H3 -","- Ba2 Br H3 -","- Ba2 Br H3 -","1","0.0833333","","Reckeweg, O.; Molstad, J.C.; Levy, S.; DiSalvo, F.J.","Syntheses and crystal structures of the new ternary barium halide hydrides Ba2 H3 X (X = Cl or Br)","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","23","27","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222799","15.1683","","15.1683","","8.8708","","90","","90","","120","","1767.53","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Ba13.3498 Al30.6996 Si5.3004 O70","","- Al30.6996 Ba13.3498 O70 Si5.3004 -","- Al30.6996 Ba13.35 O70 Si5.3004 -","- Al30.6996 Ba13.35 O70 Si5.3004 -","1","0.0833333","","Rief, A.; Kubel, F.; Hagemann, H.","Optical and structural properties of a Eu(II)-doped silico-aluminate with channel structure and partial site occupation","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2007","62","","1535","1542","","","","","","","","","","","","","","","","","","","","","","has coordinates","165006","2020-10-21","18:00:00",""
"8000137","11.4829","0.001","11.8021","0.0009","12.482","0.001","85.808","0.005","87.215","0.006","81.942","0.006","1669.1","0.2","293.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C37 H40 N2 O8 -","- C37 H40 N2 O8 -","- C74 H80 N4 O16 -","2","1","","Sekiguchi, Yumiko; Takayama, Satoshi; Gotanda, Takeshi; Sano, Kenji","Molecular Structures of the Coloring Species of a Leuco Dye with Phenolic Color Developers","Chemistry Letters","2007","36","8","1010","","10.1246/cl.2007.1010","","","1.54187","CuKα","","","0.0834","","","","0.1515","","","","","","1.002","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000138","7.351","0.004","22.339","0.014","24.788","0.012","90","","92.31","0.04","90","","4067","4","120","1","120","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H27 Cl N2 O Ti -","- C22 H27 Cl N2 O Ti -","- C176 H216 Cl8 N16 O8 Ti8 -","8","2","","Yasumoto, Takahiro; Yamagata, Tsuneaki; Mashima, Kazushi","Olefin Polymerization Catalyst Derived by Activation of a Neutral Monoalkyl Titanium Complex with an Aminopyrrole Ligand Using Triisobutylaluminum and Trityl Borate","Chemistry Letters","2007","36","8","1030","","10.1246/cl.2007.1030","","","0.71075","MoKα","","0.1817","0.1493","","","0.3935","0.4082","","","","","","1.082","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8000139","18.782","0.003","16.57","0.002","20.709","0.003","90","","114.562","0.002","90","","5861.8","1.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H28 Fe N6 S2 -","- C24.8889 H24.4444 Fe0.888889 N5.33333 S1.77778 -","- C224 H220 Fe8 N48 S16 -","9","2.25","","Atsuchi, Masaki; Higashikawa, Hiroyuki; Yoshida, Yusuke; Nakashima, Satoru; Inoue, Katsuya","Novel 2D Interpenetrated Structure and Occurrence of the Spin-crossover Phenomena of Assembled Complexes, Fe(NCX)2(bpp)2 (X = S, Se, BH3; bpp = 1,3-Bis(4-pyridyl)propane)","Chemistry Letters","2007","36","8","1064","","10.1246/cl.2007.1064","","","0.71073","MoKα","","0.1122","0.0602","","","0.1655","0.1948","","","","","","0.877","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8000140","4.9585","0.0003","7.5475","0.0004","10.443","0.001","83.622","0.004","87.979","0.003","84.641","0.002","386.58","0.05","113.2","","","","","","","","","","","4","P -1","-P 1","2","4NHMe6Opym","4-methylamino-6-oxopyrimidine","","- C5 H11 N3 O3 -","- C5 H11 N3 O3 -","- C10 H22 N6 O6 -","2","1","","Goto, Kenta; Shinmyozu, Teruo","Regulated Formation of 2D Water Layers with Alternating Six-membered Quasi-planar and Chair Cluster Units by 1D Supramolecular Chain","Chemistry Letters","2007","36","9","1100","","10.1246/cl.2007.1100","","x-ray","0.7107","MoKα","","","0.0393","","","","0.1214","","","","","","1.834","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8000141","14.778","0.003","11.618","0.002","17.513","0.004","90","","95.58","0.03","90","","2992.6","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H37 Ce O10 -","- C25 H37 Ce O10 -","- C100 H148 Ce4 O40 -","4","1","","Bai, Fenghua; Su, Haiquan; Chang, Fei","A Dimeric Cerium(III) Acetylacetonate Complex Containing Intramolecular and Intermolecular Hydrogen Bond","Chemistry Letters","2007","36","9","1104","","10.1246/cl.2007.1104","","","0.71073","MoKα","","0.1143","0.0401","","","0.0793","0.0905","","","","","","0.88","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8000142","14.197","0.003","14.197","0.003","12.052","0.003","90","","90","","90","","2429.1","0.9","200","2","200","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C32 H36 Co4 F24 N4 O12 -","- C32 H36 Co4 F24 N4 O12 -","- C64 H72 Co8 F48 N8 O24 -","2","0.25","","Mitsumoto, Kiyotaka; Koizumi, Satoshi; Shiga, Takuya; Nishikawa, Hiroyuki; Chi, Yun; Oshio, Hiroki","Alkoxo-bridged Cobalt(II) Cube and Its Radical Adduct","Chemistry Letters","2007","36","9","1154","","10.1246/cl.2007.1154","","","0.71073","MoKα","","0.0198","0.019","","","0.0518","0.0526","","","","","","1.093","","","","has coordinates,has disorder","211175","2020-10-21","18:00:00",""
"8000143","18.723","0.002","18.723","0.002","30.706","0.005","90","","90","","90","","10764","2","200","2","200","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C88 H84 Co4 F24 N20 O18 -","- C88 H84 Co4 F24 N20 O18 -","- C352 H336 Co16 F96 N80 O72 -","4","0.25","","Mitsumoto, Kiyotaka; Koizumi, Satoshi; Shiga, Takuya; Nishikawa, Hiroyuki; Chi, Yun; Oshio, Hiroki","Alkoxo-bridged Cobalt(II) Cube and Its Radical Adduct","Chemistry Letters","2007","36","9","1154","","10.1246/cl.2007.1154","","","0.71073","MoKα","","0.0618","0.0481","","","0.1361","0.1451","","","","","","1.029","","","","has coordinates,has disorder","211175","2020-10-21","18:00:00",""
"8000144","8.3731","0.0007","9.641","0.001","13.283","0.002","71.783","0.006","79.461","0.008","83.485","0.007","999.5","0.2","296.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C23 H28 N O2 -","- C23 H28 N O2 -","- C46 H56 N2 O4 -","2","1","","Hatano, Bunpei; Aikawa, Akiko; Katagiri, Hiroshi; Tagaya, Hideyuki; Takahashi, Hiroki","Complexation of Some Phenol Hosts with Quinoline N-Oxide and the Structural Studies of Their Complexes by X-ray Crystallography","Chemistry Letters","2007","36","10","1272","","10.1246/cl.2007.1272","","","0.7107","MoKα","","","0.076","","","","0.094","","","","","","1.344","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000145","10.027","0.002","18.751","0.004","13.911","0.002","90","","124.174","0.01","90","","2163.9","0.7","108","","108","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H27 N O3 -","- C27 H27 N O3 -","- C108 H108 N4 O12 -","4","1","","Hatano, Bunpei; Aikawa, Akiko; Katagiri, Hiroshi; Tagaya, Hideyuki; Takahashi, Hiroki","Complexation of Some Phenol Hosts with Quinoline N-Oxide and the Structural Studies of Their Complexes by X-ray Crystallography","Chemistry Letters","2007","36","10","1272","","10.1246/cl.2007.1272","","","0.71075","MoKα","","0.1948","0.1351","","","0.3129","0.3485","","","","","","0.997","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8000146","9.1679","0.0005","9.9262","0.0007","12.427","0.0008","93.706","0.002","90.7958","0.0017","119.212","0.0016","983.66","0.11","108","","108","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H23 N O3 -","- C24 H23 N O3 -","- C48 H46 N2 O6 -","2","1","","Hatano, Bunpei; Aikawa, Akiko; Katagiri, Hiroshi; Tagaya, Hideyuki; Takahashi, Hiroki","Complexation of Some Phenol Hosts with Quinoline N-Oxide and the Structural Studies of Their Complexes by X-ray Crystallography","Chemistry Letters","2007","36","10","1272","","10.1246/cl.2007.1272","","","0.71075","MoKα","","0.0782","0.0558","","","0.1339","0.1471","","","","","","1.085","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8000147","16.0009","0.001","17.2727","0.001","19.8102","0.0011","90","","102.548","0.0019","90","","5344.3","0.5","103.1","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H39 Cl4 Fe2 N23 O26 -","- C29 H39 Cl4 Fe2 N23 O26 -","- C116 H156 Cl16 Fe8 N92 O104 -","4","1","","Fujita, Kunihiro; Kawamoto, Ryohei; Tsubouchi, Ryohei; Sunatsuki, Yukinari; Kojima, Masaaki; Iijima, Seiichiro; Matsumoto, Naohide","Spin States of Mono- and Dinuclear Iron(II) Complexes with Bis(imidazolylimine) Ligands","Chemistry Letters","2007","36","10","1284","","10.1246/cl.2007.1284","","","0.71075","MoKα","","","0.0649","","","","0.1736","","","","","","1.052","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000148","13.859","0.006","18.244","0.007","25.48","0.01","90","","90","","90","","6442","5","173.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C62 H92 Cl6 O15 -","- C62 H91 Cl6 O15 -","- C248 H364 Cl24 O60 -","4","1","","Yoshida, Sanae; Kito, Keijiro; Ooi, Takashi; Kanoh, Kaneo; Shizuri, Yoshikazu; Kusumi, Takenori","Four Pimarane Diterpenes from Marine Fungus: Chloroform Incorporated in Crystal Lattice for Absolute Configuration Analysis by X-ray","Chemistry Letters","2007","36","11","1386","","10.1246/cl.2007.1386","","","0.7107","MoKα","","","0.059","","","","0.129","","","","","","1","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000149","12.653","0.006","13.068","0.007","25.67","0.01","90","","90","","90","","4245","3","173.1","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20.5 H30.5 Cl1.5 O6 -","- C20.5 H30.5 Cl1.5 O6 -","- C164 H244 Cl12 O48 -","8","2","","Yoshida, Sanae; Kito, Keijiro; Ooi, Takashi; Kanoh, Kaneo; Shizuri, Yoshikazu; Kusumi, Takenori","Four Pimarane Diterpenes from Marine Fungus: Chloroform Incorporated in Crystal Lattice for Absolute Configuration Analysis by X-ray","Chemistry Letters","2007","36","11","1386","","10.1246/cl.2007.1386","","","0.7107","MoKα","","","0.036","","","","0.055","","","","","","1.001","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000150","22.397","0.009","10.14","0.003","8.257","0.003","90","","106.03","0.03","90","","1802.3","1.1","173.1","","","","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C20 H28 O5 -","- C20 H28 O5 -","- C80 H112 O20 -","4","1","","Yoshida, Sanae; Kito, Keijiro; Ooi, Takashi; Kanoh, Kaneo; Shizuri, Yoshikazu; Kusumi, Takenori","Four Pimarane Diterpenes from Marine Fungus: Chloroform Incorporated in Crystal Lattice for Absolute Configuration Analysis by X-ray","Chemistry Letters","2007","36","11","1386","","10.1246/cl.2007.1386","","","0.7107","MoKα","","","0.041","","","","0.049","","","","","","1.049","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000151","7.627","0.002","12.066","0.003","12.701","0.003","63.76","0.02","82.24","0.03","80.17","0.02","1030.7","0.5","173.1","","","","","","","","","","","4","P 1","P 1","1","","","","- C20.5 H28.5 Cl1.5 O6 -","- C20.5 H28.5 Cl1.5 O6 -","- C41 H57 Cl3 O12 -","2","2","","Yoshida, Sanae; Kito, Keijiro; Ooi, Takashi; Kanoh, Kaneo; Shizuri, Yoshikazu; Kusumi, Takenori","Four Pimarane Diterpenes from Marine Fungus: Chloroform Incorporated in Crystal Lattice for Absolute Configuration Analysis by X-ray","Chemistry Letters","2007","36","11","1386","","10.1246/cl.2007.1386","","","0.7107","MoKα","","","0.042","","","","0.092","","","","","","1.012","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000152","14.013","0.003","14.983","0.003","23.595","0.005","85.485","0.013","80.455","0.011","67.351","0.012","4508","1.7","273.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C102 H100 Cl2 N4 O12 P4 -","- C102 H100 Cl2 N4 O12 P4 -","- C204 H200 Cl4 N8 O24 P8 -","2","1","","Yuge, Tetsuharu; Kai, Nobuyasu; Hisaki, Ichiro; Miyata, Mikiji; Norimitsu, Tohnai","Topologically Different Two Pseudo-decahedral Hydrogen-bond Networks Composed of Triphenylmethylammonium Phosphonates","Chemistry Letters","2007","36","11","1390","","10.1246/cl.2007.1390","","","1.54187","CuKα","","","0.0594","","","","0.1597","","","","","","1.059","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000153","26.6767","0.0007","13.7847","0.0004","25.0072","0.0006","90","","113.082","0.0012","90","","8459.7","0.4","213.1","","","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C22 H26 N O3 P -","- C22 H26 N O3 P -","- C352 H416 N16 O48 P16 -","16","4","","Yuge, Tetsuharu; Kai, Nobuyasu; Hisaki, Ichiro; Miyata, Mikiji; Norimitsu, Tohnai","Topologically Different Two Pseudo-decahedral Hydrogen-bond Networks Composed of Triphenylmethylammonium Phosphonates","Chemistry Letters","2007","36","11","1390","","10.1246/cl.2007.1390","","","1.54187","CuKα","","","0.1146","","","","0.3425","","","","","","1.077","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000154","11.0235","0.0007","12.4819","0.0008","16.7108","0.0012","97.217","0.002","97.205","0.002","108.524","0.002","2129.2","0.2","120","1","120","1","","","","","","","","4","P -1","-P 1","2","","","","- C53 H56 N2 Zr -","- C53 H56 N2 Zr -","- C106 H112 N4 Zr2 -","2","1","","Mashima, Kazushi; Ohnishi, Ryuji; Yamagata, Tsuneaki; Tsurugi, Hayato","Benzylation of α-Diimine Ligands Bound to Zirconium and Hafnium. A New Convenient Route to Olefin Polymerization Catalysts","Chemistry Letters","2007","36","12","1420","","10.1246/cl.2007.1420","","","0.71075","MoKα","","0.1098","0.0681","","","0.1412","0.1714","","","","","","1.062","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8000155","26.507","0.007","14.78","0.003","11.512","0.002","90","","108.359","0.01","90","","4280.5","1.6","293","1","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C27 H28 Cu3 N20 O7 W2 -","- C27 H8 Cu3 N20 O7 W2 -","- C108 H32 Cu12 N80 O28 W8 -","4","0.5","","Tsunobuchi, Yoshihide; Hashimoto, Kazuhito; Shiro, Motoo; Hozumi, Toshiya; Ohkoshi, Shin-ichi","Porous Magnets Based on Copper‒Octacyanotungsten Containing Noncoordinated Alcohol Molecules","Chemistry Letters","2007","36","12","1464","","10.1246/cl.2007.1464","","","0.71075","MoKα","","","0.0297","","","","0.0695","","","","","","1.166","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000156","26.7378","0.0019","14.7776","0.0009","11.516","0.0008","90","","108.695","0.002","90","","4310.1","0.5","293","1","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C28 H28 Cu3 N20 O6 W2 -","- C28 H8 Cu3 N20 O6 W2 -","- C112 H32 Cu12 N80 O24 W8 -","4","0.5","","Tsunobuchi, Yoshihide; Hashimoto, Kazuhito; Shiro, Motoo; Hozumi, Toshiya; Ohkoshi, Shin-ichi","Porous Magnets Based on Copper‒Octacyanotungsten Containing Noncoordinated Alcohol Molecules","Chemistry Letters","2007","36","12","1464","","10.1246/cl.2007.1464","","","0.71075","MoKα","","","0.0343","","","","0.0823","","","","","","1.13","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000157","14.8933","0.0006","12.9949","0.0005","18.6164","0.0008","90","","100.496","0.002","90","","3542.7","0.3","296.1","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","brucinium 3,5-di-tert-butyl-4-hydroxybenzoate acetone solvate","","","- C79 H102 N4 O15 -","- C79 H102 N4 O15 -","- C158 H204 N8 O30 -","2","1","","Watabe, Tsuyoshi; Hisaki, Ichiro; Tohnai, Norimitsu; Miyata, Mikiji","Four Kinds of 21 Helical Assemblies with the Molecular Tilt as Well as Three-directional and Facial Chirality","Chemistry Letters","2007","36","2","234","","10.1246/cl.2007.234","","x-ray","1.54187","CuKα","","","0.1653","","","","0.3851","","","","","","1.182","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8000158","7.7284","0.0002","13.6981","0.0003","25.2319","0.0006","90","","90","","90","","2671.16","0.11","296.1","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","brucinium benzoate hydrate","","","- C30 H34 N2 O7 -","- C30 H34 N2 O7 -","- C120 H136 N8 O28 -","4","1","","Watabe, Tsuyoshi; Hisaki, Ichiro; Tohnai, Norimitsu; Miyata, Mikiji","Four Kinds of 21 Helical Assemblies with the Molecular Tilt as Well as Three-directional and Facial Chirality","Chemistry Letters","2007","36","2","234","","10.1246/cl.2007.234","","x-ray","1.54187","CuKα","","","0.0649","","","","0.2151","","","","","","1.129","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8000159","10.0057","0.0005","13.0461","0.0006","13.0849","0.0006","94.771","0.001","109.52","","102.923","0.001","1545.74","0.13","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H22 Cu N5 O14.5 V5 -","- C25 H20 Cu N5 O14.5 V5 -","- C50 H40 Cu2 N10 O29 V10 -","2","1","","Li, Taohai; Lü, Jian; Gao, Shuiying; Li, Feng; Cao, Rong","Inorganic‒Organic Hybrid with 3D Supramolecular Channel Assembled through C‒H···O Interactions Based on the Decavanadate","Chemistry Letters","2007","36","3","356","","10.1246/cl.2007.356","","x-ray","0.71073","MoKα","","0.0766","0.0643","","","0.1375","0.1452","","","","","","1.264","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8000160","6.194","0.001","10.686","0.002","13.007","0.002","91.913","0.004","91.046","0.005","99.929","0.006","847.3","0.2","123.2","","","","","","","","","","","4","P 1","P 1","1","","","","- C40 H41 N O5 -","- C40 H41 N O5 -","- C40 H41 N O5 -","1","1","","Konishi, Atsuko; Wei, Weilin; Kobayashi, Masato; Fujinami, Shuhei; Ukaji, Yutaka; Inomata, Katsuhiko","Catalytic Asymmetric Addition of Alkynylzinc Reagents to Nitrones","Chemistry Letters","2007","36","1","44","","10.1246/cl.2007.44","","","0.7107","MoKα","","","0.042","","","","0.0594","","","","","","1.356","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000161","15.8386","0.0016","8.5314","0.0008","17.3856","0.0018","90","","90","","90","","2349.2","0.4","173","2","173","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C30 H25 N3 O3 -","- C30 H25 N3 O3 -","- C120 H100 N12 O12 -","4","1","","Wang, Xiang-Shan; Zhang, Mei-Mei; Jiang, Hong; Yao, Chang-Sheng; Tu, Shu-Jiang","Unexpected Spiro-benzoquinolines in the Reaction of N-(Arylidene)naphthalen-2-amine, Arylaldehyde, and 1,3-Dimethylbarbituric Acid in Water","Chemistry Letters","2007","36","3","450","","10.1246/cl.2007.450","","","0.7107","MoKα","","0.0392","0.0374","","","0.0888","0.0899","","","","","","1.101","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8000162","12.809","0.003","9.3747","0.0019","11.205","0.002","90","","90","","90","","1345.5","0.5","293","2","293","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C0 H10 N O14 P3 Ti2 -","- H6 N1.04 O14 P3 Ti2 -","- H24 N4.16 O56 P12 Ti8 -","4","0.5","","Zhao, Yongnan; Yang, Yang; Yang, Xiaoqin; Guo, Wenjun","A New Open-structured Titanophosphate with Intersecting 12-Ring Channels","Chemistry Letters","2007","36","3","456","","10.1246/cl.2007.456","","","0.71073","MoKα","","0.0646","0.0527","","","0.1293","0.1368","","","","","","1.099","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8000163","3.966","0.002","20.041","0.01","11.556","0.006","90","","96.784","0.015","90","","912.1","0.8","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H12 F6 O4 -","- C20 H12 F6 O4 -","- C40 H24 F12 O8 -","2","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Photodimerization Mechanism of Bis(3,4,5-trifluorobenzyl) (E,E)-Muconate in a Columnar Assembly in the Crystalline State","Chemistry Letters","2007","36","4","510","","10.1246/cl.2007.510","","","0.71075","MoKα","","0.1015","0.0697","","","0.1943","0.2075","","","","","","1.082","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8000164","3.979","0.003","20.55","0.02","11.537","0.008","90","","95.15","0.04","90","","939.6","1.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H12 F6 O4 -","- C20 H11.408 F6 O4 -","- C40 H22.816 F12 O8 -","2","0.5","","Mori, Yutaka; Matsumoto, Akikazu","Photodimerization Mechanism of Bis(3,4,5-trifluorobenzyl) (E,E)-Muconate in a Columnar Assembly in the Crystalline State","Chemistry Letters","2007","36","4","510","","10.1246/cl.2007.510","","","0.71075","MoKα","","0.1806","0.0657","","","0.1661","0.2159","","","","","","0.876","","","","has coordinates,has disorder","211175","2020-10-21","18:00:00",""
"8000165","12.6722","0.0012","14.2473","0.0019","14.8856","0.0013","100.369","0.005","92.3857","0.0001","115.551","0.004","2363.5","0.4","103","2","103","2","","","","","","","","3","P -1","-P 1","2","dibenzo-7-silanorbornadiene","dibenzo-7-silanorbornadiene","","- C41 H70 Si7 -","- C41 H70 Si7 -","- C82 H140 Si14 -","2","1","","Sasamori, Takahiro; Ozaki, Shuhei; Tokitoh, Norihiro","Unexpected Reaction of an Overcrowded 9,10-Dihydroanthrylchlorosilane Leading to the Formation of a Dibenzo-7-silanorbornadiene Derivative","Chemistry Letters","2007","36","5","588","","10.1246/cl.2007.588","","","0.7107","MoKα","","0.0365","0.0332","","","0.0873","0.0897","","","","","","1.041","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8000166","13.817","0.008","15.322","0.015","17.809","0.015","89.15","0.05","86.44","0.04","77.36","0.04","3672","5","123.1","","","","","","","","","","","9","P -1","-P 1","2","","","","- C73 H66 B F24 Ir N2 P Re S2 -","- C73 H66 B F24 Ir N2 P Re S2 -","- C146 H132 B2 F48 Ir2 N4 P2 Re2 S4 -","2","1","","Arashiba, Kazuya; Tanabe, Yoshiaki; Ishii, Youichi","Synthesis and Reactivities of Sulfido-bridged Ir‒W and Ir‒Re Heterodinuclear Complexes with Imido Ligands","Chemistry Letters","2007","36","5","622","","10.1246/cl.2007.622","","","0.7107","MoKα","","","0.0328","","","","0.0383","","","","","","1","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000167","8.4702","0.0012","12.985","0.002","16.275","0.003","90","","90","","90","","1790","0.5","123.1","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C13 H24 Ir O2 P S2 W -","- C13 H24 Ir O2 P S2 W -","- C52 H96 Ir4 O8 P4 S8 W4 -","4","1","","Arashiba, Kazuya; Tanabe, Yoshiaki; Ishii, Youichi","Synthesis and Reactivities of Sulfido-bridged Ir‒W and Ir‒Re Heterodinuclear Complexes with Imido Ligands","Chemistry Letters","2007","36","5","622","","10.1246/cl.2007.622","","","0.7107","MoKα","","","0.022","","","","0.0254","","","","","","1.005","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000168","9.5917","0.0016","14.842","0.002","21.05","0.004","90","","102.054","0.0019","90","","2930.6","0.8","123.1","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H41 Ir N P S3 W -","- C25 H41 Ir N P S3 W -","- C100 H164 Ir4 N4 P4 S12 W4 -","4","1","","Arashiba, Kazuya; Tanabe, Yoshiaki; Ishii, Youichi","Synthesis and Reactivities of Sulfido-bridged Ir‒W and Ir‒Re Heterodinuclear Complexes with Imido Ligands","Chemistry Letters","2007","36","5","622","","10.1246/cl.2007.622","","","0.7107","MoKα","","","0.0467","","","","0.0505","","","","","","1","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000169","21.684","0.003","12.9161","0.0019","17.115","0.003","90","","90","","90","","4793.4","1.3","123.1","","","","","","","","","","","8","P c a 21","P 2c -2ac","29","","","","- C52 H65 Cl Ir N2 P S W -","- C52 H64 Cl Ir N2 P S W -","- C208 H256 Cl4 Ir4 N8 P4 S4 W4 -","4","1","","Arashiba, Kazuya; Tanabe, Yoshiaki; Ishii, Youichi","Synthesis and Reactivities of Sulfido-bridged Ir‒W and Ir‒Re Heterodinuclear Complexes with Imido Ligands","Chemistry Letters","2007","36","5","622","","10.1246/cl.2007.622","","","0.7107","MoKα","","","0.0333","","","","0.0359","","","","","","1.004","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000170","8.494","0.0003","17.521","0.0011","11.458","0.0007","90","","104.666","0.003","90","","1649.66","0.16","120","2","120","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","SIBS ring","SiBS","","- C27 H60 B N S Si3 -","- C28 H60 B N S Si3 -","- C56 H120 B2 N2 S2 Si6 -","2","0.5","","Nakata, Norio; Sekiguchi, Akira","Thia- and Selenasilaboriranes and 1,3,2,4-Dioxasilaboretane from a Stable Silaborene","Chemistry Letters","2007","36","5","662","","10.1246/cl.2007.662","","","0.7107","MoKα","","0.0549","0.0479","","","0.1236","0.129","","","","","","1.031","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8000171","8.535","0.0003","17.516","0.001","11.516","0.0006","90","","105.343","0.0003","90","","1660.27","0.14","120","2","120","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","SiBSe ring","SiBSe","","- C27 H60 B N Se Si3 -","- C27 H60 B N Se Si3 -","- C54 H120 B2 N2 Se2 Si6 -","2","0.5","","Nakata, Norio; Sekiguchi, Akira","Thia- and Selenasilaboriranes and 1,3,2,4-Dioxasilaboretane from a Stable Silaborene","Chemistry Letters","2007","36","5","662","","10.1246/cl.2007.662","","","0.7107","MoKα","","0.041","0.0377","","","0.0985","0.1012","","","","","","1.056","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8000172","11.416","0.0007","17.629","0.0011","16.893","0.0006","90","","102.371","0.003","90","","3320.8","0.3","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","SiOBO ring","SiOBO ring","","- C27 H60 B N O2 Si3 -","- C27 H60 B N O2 Si3 -","- C108 H240 B4 N4 O8 Si12 -","4","1","","Nakata, Norio; Sekiguchi, Akira","Thia- and Selenasilaboriranes and 1,3,2,4-Dioxasilaboretane from a Stable Silaborene","Chemistry Letters","2007","36","5","662","","10.1246/cl.2007.662","","","0.7107","MoKα","","0.0785","0.058","","","0.1564","0.1679","","","","","","0.996","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8000173","9.352","0.005","15.145","0.005","26.961","0.005","90","","54.24","0.005","90","","3099","2","153","2","153","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C31 H29 Cl3 Co N4 O4 -","- C31 H29 Cl3 Co N4 O4 -","- C124 H116 Cl12 Co4 N16 O16 -","4","0.5","","Yoshida, Jun; Nishikiori, Shin-ichi; Kuroda, Reiko","Construction of Supramolecular Complexes by Use of Planar Bis(β-diketonato)cobalt(II) Complexes as Building Blocks","Chemistry Letters","2007","36","5","678","","10.1246/cl.2007.678","","x-ray","0.71069","MoKα","","","0.0554","","","","0.1691","","","","","","0.829","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8000174","10.423","0.0003","15.4308","0.0005","26.7556","0.0009","90","","77.211","0.001","90","","4196.5","0.2","153","2","153","","","","","","","","","5","P 1 21/c 1","-P 2yc","14","","","","- C80 H86 Co3 N14 O16 -","- C79.96 H67.32 Co3 N13.98 O16 -","- C159.92 H134.64 Co6 N27.96 O32 -","2","0.5","","Yoshida, Jun; Nishikiori, Shin-ichi; Kuroda, Reiko","Construction of Supramolecular Complexes by Use of Planar Bis(β-diketonato)cobalt(II) Complexes as Building Blocks","Chemistry Letters","2007","36","5","678","","10.1246/cl.2007.678","","x-ray","0.71069","MoKα","","","0.0564","","","","0.1516","","","","","","0.74","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8000175","12.179","0.012","14.775","0.01","12.01","0.012","90","","117.22","0.03","90","","1922","3","173.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C44 H50 N2 O6 S2 -","- C44 H50 N2 O6 S2 -","- C88 H100 N4 O12 S4 -","2","1","","Sugiura, Hiroki; Sakai, Daisuke; Otani, Harunori; Teranishi, Kazuhiro; Takahira, Yusuke; Amemiya, Ryo; Yamaguchi, Masahiko","Synthesis and Structure of Optically Active 1,12-Diethyl- and 1,12-Diisopropylbenzo[c]phenanthrenes: An Isopropyl Group Can Be Smaller than a Methyl Group","Chemistry Letters","2007","36","1","72","","10.1246/cl.2007.72","","","0.71075","MoKα","","","0.0386","","","","0.0729","","","","","","0.928","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000176","10.993","0.012","13.367","0.011","28.13","0.02","90","","90","","90","","4134","6","173.1","","","","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C46 H54 N2 O6 S2 -","- C46 H54 N2 O6 S2 -","- C184 H216 N8 O24 S8 -","4","0.5","","Sugiura, Hiroki; Sakai, Daisuke; Otani, Harunori; Teranishi, Kazuhiro; Takahira, Yusuke; Amemiya, Ryo; Yamaguchi, Masahiko","Synthesis and Structure of Optically Active 1,12-Diethyl- and 1,12-Diisopropylbenzo[c]phenanthrenes: An Isopropyl Group Can Be Smaller than a Methyl Group","Chemistry Letters","2007","36","1","72","","10.1246/cl.2007.72","","","0.71075","MoKα","","","0.0495","","","","0.0571","","","","","","1.01","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000177","8.15","0.004","9.612","0.005","16.02","0.008","90","","90","","90","","1255","1.1","296.1","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C9 H17 B F4 N O -","- C12.51 H18 B1.08 F5.49 N1.19 O1.12 -","- C50.04 H72 B4.32 F21.96 N4.76 O4.48 -","4","1","","Yonekuta, Yasunori; Oyaizu, Kenichi; Nishide, Hiroyuki","Structural Implication of Oxoammonium Cations for Reversible Organic One-electron Redox Reaction to Nitroxide Radicals","Chemistry Letters","2007","36","7","866","","10.1246/cl.2007.866","","","0.71075","MoKα","","","0.0872","","","","0.0706","","","","","","2.009","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000178","21.332","0.005","22.771","0.005","7.9362","0.0018","90","","90","","90","","3855","1.5","93.1","","","","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C9 H18 N O -","- C9 H18 N O -","- C144 H288 N16 O16 -","16","1","","Yonekuta, Yasunori; Oyaizu, Kenichi; Nishide, Hiroyuki","Structural Implication of Oxoammonium Cations for Reversible Organic One-electron Redox Reaction to Nitroxide Radicals","Chemistry Letters","2007","36","7","866","","10.1246/cl.2007.866","","","0.71075","MoKα","","","0.0643","","","","0.065","","","","","","6.436","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000179","15.5751","0.0009","11.202","0.001","11.9673","0.0006","90","","102.49","0.001","90","","2038.5","0.2","293.2","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H14 Co N6 S2 -","- C22 H14 Co N6 S2 -","- C88 H56 Co4 N24 S8 -","4","0.5","","Masuhara, Naoji; Hayami, Shinya; Motokawa, Natsuko; Shuto, Aya; Inoue, Katsuya; Maeda, Yonezo","Crystal Structure and Magnetic Property of Two Novel 1-D Cobalt(II) Assemblies","Chemistry Letters","2007","36","1","90","","10.1246/cl.2007.90","","","0.7107","MoKα","","","0.0417","","","","0.1061","","","","","","1.359","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8000196","9.629","0.001","16.286","0.002","15.267","0.002","90","","105.031","0.004","90","","2312.2","0.5","113.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H26 Co N4 O7 S -","- C23 H26 Co N4 O7 S -","- C92 H104 Co4 N16 O28 S4 -","4","1","","Masuhara, Naoji; Hayami, Shinya; Motokawa, Natsuko; Shuto, Aya; Inoue, Katsuya; Maeda, Yonezo","Crystal Structure and Magnetic Property of Two Novel 1-D Cobalt(II) Assemblies","Chemistry Letters","2007","36","1","90","","10.1246/cl.2007.90","","","0.7107","MoKα","","","0.0653","","","","0.1525","","","","","","1.668","","","","has coordinates","193981","2020-10-21","18:00:00",""
"8102085","10.616","0.005","11.123","0.005","16.451","0.005","108.34","0.005","98.52","0.005","108.93","0.005","1675.1","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","[Cu~2~(Ibuprofenate)~4~(DMF)~2~] . xDMF","","- C29 H41 Cu N O5 -","- C29 H41 Cu N O5 -","- C58 H82 Cu2 N2 O10 -","2","1","","Ahn-Thou, P.-N.; Lemoine, P.; Viossat, B.; Chaumei, J.-C.; Tomas, A.","Crystal structures of bis(dimethylformamide)tetrakis(ibuprofenato) dicopper(II) dimethylformamide solvate (1:2), Cu~2~(C~3~H~7~NO)~2~ (C~13~H~17~O~2~)~4~ · 2C~3~H~7~NO, and bis(dimethylsulfoxide) tetrakis(ibuprofenato)dicopper(II) dichloromethane solvate (1:2), Cu~2~(C~2~H~6~SO)~2~(C~13~H~17~O~2~)~4~ · 2CH~2~Cl~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","93","97","","","","1.5418","CuKα","","0.0905","0.0525","","","0.151","0.1629","","","","","","0.976","","","","has coordinates,has disorder","176466","2020-10-21","18:00:00",""
"8102086","18.712","0.004","16.926","0.003","24.627","0.005","90","","90","","90","","7800","3","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","catena-[bis{[1,3-bis(4-pyridyl)propane]-silver(I)}] benzene-1,4-dicarboxylate octahydrate","","- C34 H32 Ag2 N4 O12 -","- C34 H32 Ag2 N4 O12 -","- C272 H256 Ag16 N32 O96 -","8","2","","Wang, C.-C.; Ma, H.-W.","Crystal structure of catena-(bis((1,3-bis(4-pyridyl)propane)-silver(I))) benzene-1,4-dicarboxylate octahydrate, [{Ag(C~13~H~14~N~2~)}~2~][C~8~H~4~O~4~] · 8H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","101","104","","","","0.71073","MoKα","","0.0869","0.0517","","","0.1281","0.1407","","","","","","1.001","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102087","22.1571","0.0003","10.2408","0.0001","20.3943","0.0002","90","","103.867","0.001","90","","4492.72","0.09","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(1,10-phenanthroline-N,N')-bis(2-fluorobenzoato)-cadmium(II)","","- C52 H32 Cd2 F4 N4 O8 -","- C52 H32 Cd2 F4 N4 O8 -","- C208 H128 Cd8 F16 N16 O32 -","4","0.5","","Lou, Q.-Z.","Crystal structure of (1,10-phenanthroline-N,N')-bis(2-fluorobenzoato)- cadmium(II), Cd(C~7~H~4~O~2~F)~2~(C~12~H~8~N~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","105","106","","","","0.71073","MoKα","","0.0453","0.0319","","","0.0741","0.0811","","","","","","1.082","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102088","34.466","0.007","12.646","0.003","24.301","0.005","90","","131.63","0.03","90","","7917","5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(1,10-phenanthroline-N,N')-bis(2-indolylformato)-cadmium(II) hydrate (1:3.5)","","- C42 H35 Cd N6 O7.5 -","- C42 H35 Cd N6 O7.5 -","- C336 H280 Cd8 N48 O60 -","8","1","","Lou, Qi-Zheng; Zhang, Bi-Song","Crystal structure of bis(1,10-phenanthroline-N,N')-bis(2-indolylformato)- cadmium(II) hydrate, Cd(C~9~H~7~NO~2~)~2~(C~12~H~8~N~2~)~2~ · 3.5H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","199","201","","","","0.71073","MoKα","","0.0519","0.0437","","","0.1383","0.1444","","","","","","1.056","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102089","14.4997","0.0003","9.9858","0.0002","22.1235","0.0004","90","","92.123","0.001","90","","3201.09","0.11","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trichloro-bis(N,N'-1,10-phenanthroline)-dimethylformamide-cerium(III) dimethylformamide solvate","","- C30 H30 Ce Cl3 N6 O2 -","- C30 H30 Ce Cl3 N6 O2 -","- C120 H120 Ce4 Cl12 N24 O8 -","4","1","","Jin, Q.-H.; Deng, S.-F.; Dong, J.-C.; Gao, H.-W.; Li, P.-Z.","Crystal structure of trichloro-bis(N,N'-1,10-phenanthroline)-dimethylformamide- cerium(III) dimethylformamide solvate, Ce(C~12~H~8~N~2~)~2~((CH~3~)~2~NCHO)Cl~3~ · (CH~3~)~2~NCHO","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","98","100","","","","0.71073","MoKα","","0.0583","0.0345","","","0.0726","0.0801","","","","","","1.035","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102090","6.9235","0.0013","7.4268","0.0014","8.2517","0.0015","90.118","0.002","109.774","0.002","93.329","0.002","398.5","0.13","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","catena-[bis(diaquazinc(II)) μ~6~-1,2,4,5-benzenetetracarboxylate] tetrahydrate","","- C10 H18 O16 Zn2 -","- C10 H18 O16 Zn2 -","- C10 H18 O16 Zn2 -","1","0.5","","Du, Z.-X.; Li, J.-X.; Zhang, G.-Y.; Hou, H.-W.","Crystal structure of catena-[bis(diaquazinc(II)) μ~6~-1,2,4, 5-benzenetetracarboxylate] tetrahydrate, [Zn(H~2~O)~2~]~2~[C~10~H~2~O~8~] · 4H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","107","108","","","","0.71073","MoKα","","0.0436","0.0364","","","0.0978","0.1017","","","","","","1.07","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8102091","10.64","0.002","16.007","0.003","19.46","0.004","90","","90","","90","","3314.3","1.1","200","2","200","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","Et-Ferrotane (COD)","(η^4^-cyclo-octa-1,5-dien)-((+)-1,1'-bis((2R,4R)-2,4-diethyl-phosphotano)- ferrocene)-rhodium(I) tetrafluoroborate","","- C32 H48 B F4 Fe P2 Rh -","- C32 H48 B F4 Fe P2 Rh -","- C128 H192 B4 F16 Fe4 P8 Rh4 -","4","1","","Dai, Z.; Heller, D.; Spannenberg, A.; Drexler, H.-J.","Crystal structure of (h^4^-cycloocta-1,5-dien)-((+)-1,1'-bis((2R,4R)- 2,4-diethyl-phosphotano)-ferrocene)-rhodium(I) tetrafluoroborate, [Rh(C~8~H~12~)Fe(C~12~H~18~FeP)~2~][BF~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","109","110","","","","0.71073","MoKα","","0.0515","0.0435","","","0.0862","0.0889","","","","","","0.967","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102092","8.06","0.002","11.318","0.002","11.547","0.002","90","","90","","90","","1053.4","0.4","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,2-bis(4-pyridyl)-glycol","","- C24 H24 N4 O4 -","- C24 H24 N4 O4 -","- C48 H48 N8 O8 -","2","0.25","","Li, J.; Li, D.-S.; Fu, F.; Wang, D.-J.; Dai, J.-Y.; Qi, G.-C.","Crystal structure of 1,2-bis(4-pyridyl)-glycol, C~24~H~24~N~4~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","125","126","","","","0.71073","MoKα","","0.0667","0.0461","","","0.1231","0.1345","","","","","","1.017","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102093","9.7413","0.0004","11.7","0.0004","12.4184","0.0005","65.207","0.001","70.108","0.001","65.546","0.002","1145.61","0.08","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H22 N2 O6 Pb S2 -","- C20 H22 N2 O6 Pb S2 -","- C40 H44 N4 O12 Pb2 S4 -","2","1","","Li, X.-H.; Jia, S.-C.; Jalbout, A. F.","Crystal structure of catena-(μ-(N,N-dimethylformamide)-N,N- dimethylformamide-μ-(2,2'-dithiodibenzoato)-lead(II)), Pb[ (CH~3~)~2~NCHO]~2~[S~2~(C~6~H~4~COO)~2~]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","117","118","","","","0.71073","MoKα","","0.0276","0.0257","","","0.0647","0.0655","","","","","","1.087","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8102094","7.7278","0.0011","10.9679","0.0016","14.092","0.002","71.003","0.002","88.221","0.003","80.503","0.003","1113.5","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","tetraaqua-bis(4,4'-bipyridine)-cobalt(II) bis(2,2'-hydrogendithiodibenzoate)","","- C48 H42 Co N4 O12 S4 -","- C48 H42 Co N4 O12 S4 -","- C48 H42 Co N4 O12 S4 -","1","0.5","","Li, X.-H.; Lu, J.-L.; Jalbout, A. F.","Crystal structure of tetraaqua-bis(4,4'-bipyridine)-cobalt(II) bis (2,2'-hydrogendithiodibenzoate), [Co(H~2~O)~4~(C~10~H~8~N~2~)~2~] [C~14~H~9~O~4~S~2~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","114","116","","","","0.71073","MoKα","","0.1273","0.103","","","0.191","0.2023","","","","","","1.24","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8102095","8.1047","0.0004","23.9262","0.0012","35.7168","0.0017","90","","90","","90","","6926","0.6","291","2","291","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","trans-diethanol-bis(hexafluoroacetyl acetonato)nickel(II) 4,4,5,5-tetramethyl-2-(thiophenal-2-yl)imidazoline-1-oxyl-3-oxide) solvate","","- C25 H29 F12 N2 Ni O8 S -","- C25 H29 F12 N2 Ni O8 S -","- C200 H232 F96 N16 Ni8 O64 S8 -","8","1","","Wang, L.-Y.; Wang, X.-Q.; Jiang, K.; Ma, L.-F.; Wang, J.-G.","Crystal structure of trans-diethanol-bis(hexafluoroacetylacetonato)- nickel(II) 4,4,5,5-tetramethyl-2-(thiophenal-2-yl)imidazoline-1-oxyl- 3-oxide solvate, Ni(C~2~H~5~OH)~2~[C~3~HO~2~(CF~3~)~2~]~2~ · C~7~H~15~N~2~O~2~S","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","143","145","","","","0.71073","MoKα","","0.0626","0.0491","","","0.139","0.1535","","","","","","1.031","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102096","10.1626","0.0009","10.9171","0.001","16.1566","0.0015","76.978","0.002","77.78","0.001","66.711","0.001","1589","0.3","291","2","291","2","","","","","","","","7","P -1","-P 1","2","","4,4,5,5-tetramethylimidazoline-2-yl-(2'-chloro-5'-nitrophenyl)-1-hydroxide)- (hexafluoroacetyl acetonato)-zinc(II)","","- C23 H17 Cl F12 N3 O7 Zn -","- C23 H17 Cl F12 N3 O7 Zn -","- C46 H34 Cl2 F24 N6 O14 Zn2 -","2","1","","Wang, Li-Ya; Zhao, Bao-Li; Jiang, Kai; Wang, Yu-Fang","Crystal structure of 4,4,5,5-tetramethylimidazoline-2-yl-(2'-chloro- 5'-nitrophenyl)-1-hydroxide-bis(hexafluoroacetyl acetonato)-zinc(II), Zn[C~3~HO~2~(CF~3~)~2~]~2~(C~13~H~15~ClN~3~O~3~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","181","183","","","","0.71073","MoKα","","0.1005","0.0706","","","0.2064","0.2374","","","","","","1.056","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102097","9.553","0.001","12.26","0.002","36.798","0.004","90","","90","","90","","4309.8","1","298","2","298","2","","","","","","","","5","P b c n","-P 2n 2ab","60","hexaaquanickel(II) bis(bis(((1-(2-hydroxyphenyl)methylidene)amino)acetato)nickel(II)) dihydrate","hexaaquanickel(II) bis(bis(N-salicylideneglycinato-O,O')nickelate(II)) dihydrate","","- C36 H44 N4 Ni3 O20 -","- C36 H44 N4 Ni3 O20 -","- C144 H176 N16 Ni12 O80 -","4","0.5","","Li, L.-Z.; Wang, L.-H.","Crystal structure of hexaaquanickel(II) bis(bis(N-salicylideneglycinato- O,O')nickelate(II)) dihydrate, [Ni(H~2~O)~6~][Ni(C~9~H~7~NO~3~)~2~] · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","119","121","","","","0.71073","MoKα","","0.0909","0.0594","","","0.1295","0.1442","","","","","","1.055","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102098","10.277","0.001","10.8289","0.0011","15.0129","0.0015","90","","107.109","0.001","90","","1596.8","0.3","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","diaqua-(μ-4,4'-bipyridine)-bis(N-salicylideneaspartato)-dicopper(II)","","- C32 H30 Cu2 N4 O12 -","- C32 H30 Cu2 N4 O12 -","- C64 H60 Cu4 N8 O24 -","2","0.5","","Feng, X.; Li, H.-L.; Han, M.-L.; Hu, S.-Q.","Crystal structure of diaqua-(μ-4,4¢-bipyridine)-bis(N- salicylideneaspartato)-dicopper(II), Cu~2~(H~2~O)~2~(C~11~H~9~NO~5~) ~2~(C~10~H~8~N~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","129","130","","","","0.71073","MoKα","","0.0336","0.0272","","","0.0692","0.0728","","","","","","1.028","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102099","11.887","0.002","9.4216","0.0019","13.535","0.002","90","","108.744","0.011","90","","1435.5","0.4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(μ~2~-malato)-bis(pyrazino(2,3-f)quinoxaline)-dicopper(II)","","- C28 H20 Cu2 N8 O10 -","- C28 H20 Cu2 N8 O10 -","- C56 H40 Cu4 N16 O20 -","2","0.5","","Li, D.-S.; Li, J.; Fu, F.; Ren, Y.-X.; Qi, G.-C.","Crystal structure of bis(μ~2~-malato)-bis(pyrazino(2,3-f)-quinoxaline)- dicopper(II), Cu~2~(C~4~H~4~O~5~)~2~(C~10~H~6~N~4~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","127","128","","","","0.71073","MoKα","","0.1262","0.0552","","","0.0847","0.1039","","","","","","0.975","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102100","7.139","0.002","24.886","0.003","9.473","0.003","90","","96.66","0.002","90","","1671.6","0.7","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-((4-methoxy-benzylidene)-amino)-1,5-dimethl-2-phenyl-pyrazolidin-3-ol","","- C19 H19 N3 O2 -","- C19 H19 N3 O2 -","- C76 H76 N12 O8 -","4","1","","Li, Z.-X.; Fei, N.; Yuan, W.","Crystal structure of 4-((4-methoxy-benzylidene)-amino)-1,5-dimethyl- 2-phenylpyrazolidin-3-ol, C~19~H~19~N~3~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","133","134","","","","0.71073","MoKα","","0.0828","0.0544","","","0.1377","0.1615","","","","","","1.039","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102101","7.3019","0.0008","7.3173","0.0008","11.9931","0.0013","87.66","0.002","81.889","0.002","72.126","0.001","603.76","0.11","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","potassium 3-carboxy-4-hydroxybenzenesulfonate","","- C7 H11 K O9 S -","- C7 H11 K O9 S -","- C14 H22 K2 O18 S2 -","2","1","","Han, M.-L.; Du, Z.-X.; Wang, L.-Z.","Crystal structure of triaquapotassium 3-carboxy-4-hydroxybenzenesulfonate, K(H~2~O)~3~(C~7~H~5~SO~6~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","131","132","","","","0.71073","MoKα","","0.0287","0.0269","","","0.0736","0.0752","","","","","","1.067","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102102","5.939","0.005","21.462","0.005","13.195","0.005","90","0.005","100.379","0.005","90","0.005","1654.4","1.6","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","poly(bis(1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7- (1-piperazinyl)-1,8-naphtyridine-3-carboxylato)zinc(II))","","- C30 H32 F2 N8 O8 Zn -","- C30 H32 F2 N8 O8 Zn -","- C60 H64 F4 N16 O16 Zn2 -","2","0.5","","An, Z.; Cui, R.-H.; Wang, R.-S.","Crystal structure of poly(bis(1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7- (1-piperazinyl)-1,8-naphtyridine-3-carboxylato)-zinc(II)) dihydrate, Zn(C~15~H~16~FN~4~O~3~)~2~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","135","136","","","","0.71069","MoKα","","0.055","0.0428","","","0.1247","0.1332","","","","","","1.106","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102103","5.2719","0.0013","7.2944","0.0019","7.5948","0.0019","79.286","0.003","70.251","0.003","71.238","0.003","259.3","0.11","291","2","291","2","","","","","","","","3","P 1","P 1","1","","","","- C11 H12 O5 -","- C11 H12 O5 -","- C11 H12 O5 -","1","1","","Tan, S.-S.; Wen, H.-L.; Liu, C.-B.; Peng, X.-P.; Li, X.-S.","Crystal structure of 3-(4-(carboxymethoxy)phenyl)propanoic acid, C~11~H~12~O~5~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","137","138","","","","0.71073","MoKα","","0.0552","0.0396","","","0.093","0.1033","","","","","","1.085","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102104","35.939","0.002","10.4219","0.0007","10.1829","0.0008","90","","90","","90","","3814","0.4","153","2","153","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","N-(2-tert-butyl-5-methyl-4H-1,3-dioxin-4-yl)-2-(trimethylsilyl)- ethanesulfonamide","","- C14 H29 N O4 S Si -","- C14 H29 N O4 S Si -","- C112 H232 N8 O32 S8 Si8 -","8","1","","Tatarov, E.; Bruhn, C.; Frauenrath, H.","Crystal structure of N-((2R*,4S*)-2-tert-butyl-5-methyl-4H-1,3-dioxin- 4-yl)-2-(trimethylsilyl)ethanesulfonamide, C~14~H~29~NO~4~Si","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","139","140","","","","0.71073","MoKα","","0.0633","0.0396","","","0.096","0.1047","","","","","","1.014","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102105","6.13","0.0006","11.2647","0.0012","15.1974","0.0017","107.647","0.008","95.494","0.009","102.445","0.008","961.8","0.19","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H29 N O5 S Si -","- C14 H29 N O5 S Si -","- C28 H58 N2 O10 S2 Si2 -","2","1","","Tatarov, E.; Bruhn, C.; Frauenrath, H.","Crystal structure of (2R*,4S*)-methyl 2-isopropyl-4-methyl-3-(2- (trimethylsilyl)ethylsulfonyl)-1,3-oxazolidine-4-carboxylate, C~14~H~29~NO~5~SSi","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","141","142","","","","0.71073","MoKα","","0.0586","0.0456","","","0.1404","0.1464","","","","","","1.014","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8102106","8.073","0.001","33.072","0.004","13.141","0.002","90","","97.77","0.002","90","","3476.3","0.8","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","bis(4-chloro-2-((3-dimethylaminopropylimino)methyl)phenolato)thiocyanato- cobalt(III) perchlorate hemihydrate","","- C25 H34 Cl3 Co N5 O6.5 S -","- C25 H34 Cl3 Co N5 O6.5 S -","- C100 H136 Cl12 Co4 N20 O26 S4 -","4","1","","Wang, L.-H.; Li, L.-Z.","Crystal structure of bis(4-chloro-2-((3-dimethylaminopropylimino)- methyl)phenolato)thiocyanato-cobalt(III) perchlorate hemihydrate, [Co(C~12~H~16~ClN~2~O)(C~12~H~17~ClN~2~O)(NCS)][ClO~4~] · 0.5H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","122","124","","","","0.71073","MoKα","","0.1398","0.095","","","0.2179","0.2445","","","","","","1.061","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102107","23.757","0.005","11.097","0.002","22.569","0.005","90","","113.84","0.03","90","","5442","2","169","2","169","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3,5-bis(phtalimidomethyl)phenol-tert-butyldimethylsilyl ether","","- C30 H30 N2 O5 Si -","- C30 H30 N2 O5 Si -","- C240 H240 N16 O40 Si8 -","8","1","","Domínguez, Z.; Jancik, V.; Leyva, M. A.; Salas-Reyes, M.; Guzmán-Márquez, V.; Hernández, J.; Bagatella-Flores, N.; Ramos, R.","Crystal structure of 3,5-bis(phtalimidomethyl)benzene-tert-butyldimethylsilyl ether, C~30~H~30~N~2~O~5~Si","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","146","148","","","","0.71073","MoKα","","0.1057","0.053","","","0.1176","0.143","","","","","","1.007","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102108","6.002","0.0009","6.357","0.0011","12.288","0.002","90","","90","","90","","468.85","0.13","191","2","191","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C3 H5 N3 O -","- C1.5 H2.5 N1.5 O0.5 -","- C12 H20 N12 O4 -","8","1","","Irrgang, T.; Friedrich, D.; Clemente, R.; Kutlescha, K.; Glatz, G.; Kempe, R.","Crystal structure of 2-amino-5-methyl-1,3,4-oxadiazole, (CH~3~)C~2~N~2~O (NH~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","151","152","","","","0.71069","MoKα","","0.0578","0.0543","","","0.19","0.1931","","","","","","1.175","","","","has coordinates","211175","2020-10-21","18:00:00",""
"8102109","9.82","0.002","10.806","0.002","11.12","0.002","74.198","0.002","82.053","0.002","69.88","0.002","1064.8","0.4","291","2","291","2","","","","","","","","7","P -1","-P 1","2","","diaqua-bis(2,5-bis(2-pyridyl)-1,3,4-thiadiazole)cobalt(II) diperchlorate dihydrate 2,5-bis(2-pyridyl)-1,3,4-thiadiazole monosolvate","","- C36 H32 Cl2 Co N12 O12 S3 -","- C36 H32 Cl2 Co N12 O12 S3 -","- C36 H32 Cl2 Co N12 O12 S3 -","1","0.5","","Wan, X.-S.; Ning, A.-M.; Hou, S.-C.; Niu, C.-Y.; Kou, C.-H.; Dang, Y.-L.","Crystal structure of diaqua-bis(2,5-bis(2-pyridyl)-1,3,4-thiadiazole)- cobalt(II) diperchlorate 2,5-bis(2-pyridyl)-1,3,4-thiadiazole monosolvate dihydrate, [Co(H~2~O)~2~(C~12~H~8~N~4~S)~2~][ClO~4~]~2~ · C~12~H~8~N~4~S · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","153","154","","","","0.71073","MoKα","","0.1236","0.1059","","","0.2726","0.2889","","","","","","1.853","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102110","8","0.006","14.835","0.0013","14.8351","0.0015","90","","101.017","0.006","90","","1728.2","1.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","methanol-(1,10-phenanthroline-N,N')-trichloro-iron(III) methanol solvate","","- C14 H16 Cl3 Fe N2 O2 -","- C14 H16 Cl3 Fe N2 O2 -","- C56 H64 Cl12 Fe4 N8 O8 -","4","1","","Khavasi, H. R.; Amani, V.; Safari, N.","Refinement of the crystal structure of methanol-(1,10-phenanthroline- N,N')-trichloro-iron(III) methanol solvate, FeCl~3~(CH~3~OH)(C~12~H~8~N~2~) · CH~3~OH","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","155","156","","","","0.71073","MoKα","","0.0553","0.0365","","","0.0888","0.0947","","","","","","0.946","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102111","11.442","0.001","9.7998","0.0006","19.8266","0.0016","90","","95.229","0.007","90","","2213.9","0.3","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","μ-oxo-bis[σ-1,2-bis(trimethylsilyl)vinylhafnocene] benzene solvate","","- C42 H64 Hf2 O Si4 -","- C42 H64 Hf2 O Si4 -","- C84 H128 Hf4 O2 Si8 -","2","0.5","","Spannenberg, Anke; Beweries, Torsten; Bach, Marc A.; Rosenthal, Uwe","Crystal structure of μ-oxo-bis(σ-1,2-bis(trimethylsilyl) vinylhafnocene) benzene solvate, [C~2~H{Si(CH~3~)~3~}~2~Hf(C~5~H~5~) ~2~]~2~O · C~6~H~6~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","187","188","","","","0.71073","MoKα","","0.0231","0.0173","","","0.0362","0.037","","","","","","0.959","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102112","12.378","0.003","10.353","0.002","38.031","0.008","90","","95.74","0.03","90","","4849.2","1.8","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3,3-bis(tert-butyl-cyclopentadienyl)-bicyclo[3.1.0]hex-3-zircona-1(5)-ene- 6-nickela-6,6-bis(triphenylphosphine)","","- C58 H60 Ni P2 Zr -","- C58 H60 Ni P2 Zr -","- C232 H240 Ni4 P8 Zr4 -","4","1","","Spannenberg, Anke; Bach, Marc A.; Beweries, Torsten; Rosenthal, Uwe","Crystal structure of 3,3-bis(tert-butyl-cyclopentadienyl)-bicyclo [3.1.0]hex-3-zircona-1(5)-ene-6-nickela-6,6-bis(triphenylphosphine), (C~9~H~13~)~2~(ZrC~4~H~4~)Ni(C~18~H~15~P)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","189","191","","","","0.71073","MoKα","","0.029","0.0225","","","0.053","0.0539","","","","","","0.917","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102113","10.864","0.002","14.281","0.003","27.535","0.006","90","","90","","90","","4272","1.5","200","2","200","2","","","","","","","","4","P b c m","-P 2c 2b","57","","bis(η^5^-cyclopentadienyl)-pyrrolide-titanium(III)","","- C24 H34 N Ti -","- C24 H34 N Ti -","- C192 H272 N8 Ti8 -","8","1","","Spannenberg, Anke; Burlakov, Vladimir V.; Arndt, Perdita; Klahn, Marcus; Rosenthal, Uwe","Crystal structure of bis(η^5^-cyclopentadienyl)-pyrrolide-titanium (III), Ti(C~10~H~15~)~2~(C~4~H~4~N)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","192","194","","","","0.71073","MoKα","","0.0979","0.0427","","","0.0982","0.1111","","","","","","0.833","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102114","11.246","0.002","12.222","0.002","19.637","0.004","90","","90","","90","","2699.1","0.9","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","dichloro((S)-2-(anilinomethyl)-pyrrolidine)palladium(II)","","- C11 H16 Cl2 N2 Pd -","- C11 H16 Cl2 N2 Pd -","- C88 H128 Cl16 N16 Pd8 -","8","2","","El Firdoussi, Larbi; Ait Ali, Mustapha; Karim, Abdallah; Spannenberg, Anke","Crystal structure of dichloro((S)-2-(anilinomethyl)pyrrolidine)-palladium (II), Pd(Cl)~2~(C~11~H~16~N~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","195","196","","","","0.71073","MoKα","","0.0316","0.0265","","","0.0587","0.0604","","","","","","0.986","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102115","14.052","0.0005","12.15","0.0004","16.57","0.0007","90","","114.371","0.002","90","","2576.94","0.17","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","chloro(pyridine-2-aldoxime-N,N')palladium(II)","","- C12 H11 Cl N4 O2 Pd -","- C12 H11 Cl N4 O2 Pd -","- C96 H88 Cl8 N32 O16 Pd8 -","8","1","","Torabi, Ali A.; Soudozi, Abdullah; Welter, Richard","Crystal structure of (pyridine-2-aldoxime-N,N')palladium(II) chloride, [Pd(C~12~H~11~ClN~4~O~2~)]Cl","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","197","198","","","","0.71073","MoKα","","0.0428","0.0266","","","0.0674","0.0754","","","","","","1.055","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102116","9.8038","0.0012","13.3687","0.0016","21.574","0.003","90","","90","","90","","2827.6","0.6","295","2","295","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","bromo-(1,10-phenanthroline-N,N')- (4-(N,N-dimethylamino)phenyldiphenylphosphine)-copper(i)","","- C32 H28 Br Cu N3 P -","- C32 H28 Br Cu N3 P -","- C128 H112 Br4 Cu4 N12 P4 -","4","1","","Al-Fayez, Sahar; Abdel-Rahman, Laila H.; Shemsi, Ahsan M.; Seddigi, Zaki S.; Fettouhi, Mohammed","Crystal structure of bromo-(1,10-phenanthroline-N,N')-(4-(N,N-dimethylamino) phenyldiphenylphosphine)-copper(I), CuBr(C~12~H~8~N~2~)(C~20~H~20~NP)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","205","206","","","","0.71073","MoKα","","0.0522","0.0364","","","0.0792","0.0859","","","","","","1.022","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102117","6.297","0.002","12.825","0.002","18.487","0.004","90","","90.57","0.02","90","","1492.9","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1-ferrocenyl-4-phenyl-1,3-butadiyne","","- C20 H14 Fe -","- C20 H14 Fe -","- C80 H56 Fe4 -","4","1","","Laus, Gerhard; Lukasser, Josef; Wurst, Klaus; Schottenberger, Herwig","Crystal structure of 1-ferrocenyl-4-phenyl-1,3-butadiyne, (C~5~H~5~) Fe(C~15~H~9~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","207","208","","","","0.71073","MoKα","","0.1293","0.0773","","","0.1932","0.2159","","","","","","0.978","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102118","8.7314","0.0007","14.5026","0.0011","15.8054","0.0012","90","","98.037","0.002","90","","1981.7","0.3","243","2","243","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(2,2'-bipyridine-N,N')dibromomanganese(II)","","- C20 H16 Br2 Mn N4 -","- C20 H16 Br2 Mn N4 -","- C80 H64 Br8 Mn4 N16 -","4","1","","Hwang, In-Chul; Ha, Kwang","Crystal structure of bis(2,2'-bipyridine-N,N')dibromomanganese(II), MnBr~2~(C~10~H~8~N~2~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","209","210","","","","0.71073","MoKα","","0.0423","0.029","","","0.0505","0.053","","","","","","0.868","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102119","8.2154","0.0015","16.404","0.003","8.0937","0.0014","90","","109.772","0.002","90","","1026.4","0.3","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tetra(imidazole)copper(II) diperchlorate","","- C12 H16 Cl2 Cu N8 O8 -","- C12 H16 Cl2 Cu N8 O8 -","- C24 H32 Cl4 Cu2 N16 O16 -","2","0.5","","Yao, Jing-Cai; Yao, Feng-Juan; Li, Yun-Chao; Wang, Jian-Ge","Refinement of the crystal structure of tetra(imidazole)copper(II) diperchlorate, Cu(C~3~N~2~H~4~)~4~(ClO~4~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","211","212","","","","0.71073","MoKα","","0.0396","0.0352","","","0.0937","0.0971","","","","","","1.029","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102120","12.722","0.003","15.248","0.003","12.818","0.003","90","","115.8","0.03","90","","2238.6","1","200","2","200","2","","","","","","","","8","P 1 21 1","P 2yb","4","","(η^4^-cyclo-octa-1,5-dien)-N-(2-(diphenylphosphinooxy)-3-(naphthalen-1- yloxy)propyl)-N-(pentan-3-yl)-1,1-diphenylphosphinamine-rhodium(I) tetrafluoroborate","","- C50 H55 B F4 N O2 P2 Rh -","- C50 H55 B F4 N O2 P2 Rh -","- C100 H110 B2 F8 N2 O4 P4 Rh2 -","2","1","","Dai, Z.; Heller, D.; Preetz, A.; Drexler, H.-J.","Crystal structure of (h^4^-cycloocta-1,5-dien)-N-(2-(diphenylphosphinooxy)- 3-(naphthalen-1-yloxy)propyl)-N-(pentan-3-yl)-1,1-diphenylphosphinamine- rhodium(I) tetrafluoroborate, [Rh(C~8~H~12~)(C~42~H~43~NO~2~P~2~)] [BF~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","111","113","","","","0.71073","MoKα","","0.0423","0.0362","","","0.0774","0.079","","","","","","1.093","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102121","10.7784","0.001","12.2977","0.001","13.321","0.002","76.304","0.01","89.922","0.01","65.608","0.01","1553.1","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","(2,5-bis(octyloxy)-1,4-phenylene)dimethyl bis(triphenylphosphonium) bromide benzene solvate dihydrate","","- C66 H80 Br2 O4 P2 -","- C66 H80 Br2 O4 P2 -","- C66 H80 Br2 O4 P2 -","1","0.5","","Liu, Hui-Jun; Tao, Xu-Tang; Xin, Qian; Yu, Wen-Tao; Jiang, Min-Hua","Crystal structure of 1,4-bis(triphenylphosphonio)-2,5-bis(octyloxy) xylene bromide benzene solvate dihydrate, (C~60~H~70~O~2~P~2~)Br~2~ · C~6~H~6~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","213","214","","","","0.71073","MoKα","","0.1747","0.1114","","","0.3148","0.3357","","","","","","1.482","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8102122","17.3283","0.0014","9.0329","0.0007","13.1898","0.001","90","","103.957","0.001","90","","2003.6","0.3","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","cesium gallate dihydrate","cesium 3,4,5-trihydroxybenzoate dihydrate","","- C7 H9 Cs O7 -","- C7 H9 Cs O7 -","- C56 H72 Cs8 O56 -","8","1","","Hu, M.-C.; Wang, X.-H.; Jiang, Y.-C.; Li, S.-N.; Yang, Z.-Q.","Crystal structure of cesium 3,4,5-trihydroxybenzoate dihydrate, Cs [C~7~H~5~O~5~] · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","157","158","","","","0.71073","MoKα","","0.0318","0.0299","","","0.1149","0.1176","","","","","","1.002","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102123","6.6514","0.0013","12.862","0.003","25.968","0.005","90","","95.82","0.03","90","","2210.1","0.8","103","2","103","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","dimethylformamide-diethanolateamine-dioxomolybdenum(VI)","","- C7 H16 Mo N2 O5 -","- C7 H16 Mo N2 O5 -","- C56 H128 Mo8 N16 O40 -","8","1","","Zhang, Qingwei; Schulzke, Carola; Schmidt, Hans-Georg; Noltemeyer, Mathias","Crystal structure of dimethylformamide-diethanolateamine-dioxomolybdenum (VI), MoO~2~[O(CH~2~)~2~NH(CH~2~)~2~O][(CH~3~)~2~NCHO]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","215","216","","","","0.71073","MoKα","","0.0248","0.0237","","","0.0505","0.051","","","","","","1.226","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102124","16.01","0.003","13.516","0.003","23.694","0.005","90","","99.82","0.03","90","","5052.1","1.9","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","μ-aqua-(bis(μ-2-nitrobenzoato-κ^2^O:O')(bis(2-nitrobenzoato- κO)tetrakis[(pyridine-κN)]dicopper(II)","","- C48 H38 Cu2 N8 O17 -","- C48 H38 Cu2 N8 O17 -","- C192 H152 Cu8 N32 O68 -","4","0.5","","Cai, Wen-Xuan","Crystal structure of μ-aqua-bis(μ-2-nitrobenzoato-κ ^2^O:O')(bis(2-nitrobenzoato-κO)tetrakis(pyridine-κN)- dicopper(II), Cu~2~(H~2~O)(C~5~H~5~N)~4~(C~7~H~4~NO~4~)~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","217","218","","","","0.71073","MoKα","","0.117","0.0916","","","0.2304","0.2563","","","","","","0.993","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102125","13.618","0.003","14.038","0.003","14.664","0.003","94.08","0.03","106.88","0.03","103.06","0.03","2584.9","1.1","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","bis[(pentaqua)(4-nitrobenzonato-κO)bis(4-nitrobenzonato-κO,O')tris(μ~2~- 4-nitrobenzoato-κ-O,O')diyttrium(III)] dihydrate","","- C84 H72 N12 O60 Y4 -","- C84 H72 N12 O60 Y4 -","- C84 H72 N12 O60 Y4 -","1","0.5","","Cai, Wen-Xuan","Crystal structure of bis((pentaaqua)(4-nitrobenzoato-κO)bis (4-nitrobenzoato-κO,O')tris(μ-4-nitrobenzoato-κO, O')-diyttrium(III)) dihydrate, Y~4~(H~2~O)~10~(C~7~H~4~NO~4~)~12~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","219","221","","","","0.71073","MoKα","","0.0588","0.0351","","","0.0802","0.0901","","","","","","1.01","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8102126","10.38","0.003","7.1365","0.0019","20.973","0.006","90","","103.887","0.004","90","","1508.2","0.7","193","2","193","2","","","","","","","Purchased from Aldrich","4","C 1 2/c 1","-C 2yc","15","tropinone","8-methyl-8-azabicyclo(3.2.1)octan-3-one","","- C8 H13 N O -","- C8 H13 N O -","- C64 H104 N8 O8 -","8","1","","Staples, Richard J.; Qi, Yan","Crystal structure of 8-methyl-8-azabicyclo(3.2.1)octan-3-one, C~8~H~13~NO","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","225","226","","","x-ray","0.71073","MoKα","","0.0656","0.0576","","","0.1419","0.1456","","","","","","1.244","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102127","6.137","0.0012","12.55","0.002","7.2224","0.0014","90","","114.953","0.003","90","","504.34","0.16","193","2","193","2","","","","","","","Aldrich","4","P 1 21/n 1","-P 2yn","14","5-bromopyrimidine","5-bromopyrimidine","","- C4 H3 Br N2 -","- C4 H3 Br N2 -","- C16 H12 Br4 N8 -","4","1","","Staples, Richard J.; Lee, Vallent","Crystal structure of 5-bromopyrimidine, C~4~H~3~BrN~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","227","228","","","x-ray","0.71073","MoKα","","0.0264","0.0221","","","0.0542","0.056","","","","","","1.086","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102128","10.4864","0.0017","10.5097","0.0016","12.912","0.002","90","","94.561","0.003","90","","1418.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(6-(1-(perfluorophenylimino)ethyl)pyridin-2-yl)ethanone","","- C15 H9 F5 N2 O -","- C15 H9 F5 N2 O -","- C60 H36 F20 N8 O4 -","4","1","","Xie, Guang-Yong; Liao, Gui-Ying","Crystal structure of 1-(6-(1-(perfluorophenylimino)ethyl)pyridin-2- yl)ethanone, C~15~H~9~F~5~N~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","229","230","","","","0.71073","MoKα","","0.1084","0.0539","","","0.1187","0.1328","","","","","","0.783","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102129","10.3709","0.0003","23.2467","0.0006","25.1444","0.0007","90","","92.66","0.001","90","","6055.5","0.3","273","2","273","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","25,26,27,28-tetrabenzyloxy-5,11,17,23-tert-butylcalix[4]arene","","- C72 H80 O4 -","- C72 H80 O4 -","- C288 H320 O16 -","4","1","","Gruber, Tobias; Seichter, Wilhelm; Weber, Edwin","Crystal structure of 25,26,27,28-tetrabenzyloxy-5,11,17,23-tert-butylcalix [4]arene, C~72~H~80~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","222","224","","","","0.71073","MoKα","","0.1235","0.0595","","","0.1491","0.1902","","","","","","1.006","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102130","8.251","0.004","9.23","0.004","10.784","0.005","94.047","0.008","104.358","0.008","114.193","0.008","711.8","0.6","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","hexaaquamagnesium(II) bisperchlorate bisadamantane solvate dihydrate","","- C20 H48 Cl2 Mg O16 -","- C20 H48 Cl2 Mg O16 -","- C20 H48 Cl2 Mg O16 -","1","0.5","","Tai, Xi-Shi; Yin, Jie; Hao, Ming-Yang","Crystal structure of hexaaquamagnesium(II) diperchlorate diadamantane dihydrate, [Mg(H~2~O)~6~][ClO~4~]~2~ · 2C~10~H~16~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","231","232","","","","0.71073","MoKα","","0.1141","0.0739","","","0.1891","0.2226","","","","","","1.06","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102131","9.281","0.002","9.311","0.002","13.085","0.003","86.72","0.09","69.71","0.08","81.48","0.09","1048.9","0.7","133","2","","","","","","","","","synthesis as described","6","P -1","-P 1","2","","dilead(II) 2,2'-iminodiethanolate dibromide","","- C4 H9 Br2 N O2 Pb2 -","- C4 H9 Br2 N O2 Pb2 -","- C16 H36 Br8 N4 O8 Pb8 -","4","2","","Keller, Hans-Lothar; Oldag, Thorsten; Ewald, Bastian","Crystal structure of dilead(II) 2,2'-iminodiethanolate dibromide, Pb~2~Br~2~(C~4~H~9~O~2~N)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","235","236","","","","0.71073","MoKα","","","0.0394","","","","0.0889","","","","","","1.05","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102132","6.8088","0.001","11.987","0.0018","14.349","0.002","87.88","0.003","80.469","0.002","76.185","0.002","1121.5","0.3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","4,4'-bipyridine ethylene‒di(4-oxybenzoic acid)","","- C26 H22 N2 O6 -","- C26 H22 N2 O6 -","- C52 H44 N4 O12 -","2","1","","Qi, Guang-Cai; Tang, Long; Li, Dong-Sheng; Fu, Feng; Wang, Ji-Jiang; Guo, Li","Crystal structure of ethylene-4,4'-di(oxybenzoic acid)-4,4'-bipyridine (1:1), C~16~H~14~O~6~ · C~10~H~8~N~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","237","238","","","","0.71073","MoKα","","0.1786","0.0639","","","0.1276","0.1781","","","","","","0.969","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102133","6.6095","0.0005","13.1672","0.0009","21.4674","0.0014","90","","90","","90","","1868.3","0.2","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-(N,N-dimethyl)aminodithiocarbamoyloxymatrine","","- C18 H29 N3 O S2 -","- C18 H29 N3 O S2 -","- C72 H116 N12 O4 S8 -","4","1","","Wang, Wei; Duan, Zhen-Hua; Zhang, Jing-Tao; Li, Bao-Lin","Crystal structure of 4-(N,N-dimethyl)aminodithiocarbamoyloxymatrine, C~18~H~29~N~3~OS~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","239","240","","","","0.71073","MoKα","","0.0367","0.0319","","","0.0763","0.0793","","","","","","1.058","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102134","6.5219","0.0005","17.7925","0.0014","17.3437","0.0013","90","","100.664","0.001","90","","1977.8","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","aqua(N,N'-disalicylideneethylenediamino)(nicotinato-N)manganese(III)","","- C22 H20 Mn N3 O5 -","- C22 H20 Mn N3 O5 -","- C88 H80 Mn4 N12 O20 -","4","1","","Li, Shu-Ni; Wei, Xiao-Yun; Wang, Xiu-Hang; Hu, Man-Cheng","Crystal structure of aqua(N,N'-disalicylideneethylenediamino)(nicotinato- N)manganese(III), Mn(C~6~H~4~NO~2~)(C~16~H~14~N~2~O~2~)(H~2~O)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","241","242","","","","0.71073","MoKα","","0.0556","0.0424","","","0.108","0.1191","","","","","","1.037","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8102135","13.491","0.001","14.26","0.001","21.43","0.002","90","","90","","90","","4122.7","0.6","273.2","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","aqua(benzoylacetonato)(R,R-dibenzoylstilbene-diamine)(nitro)nickel(II) ethanol solvate","","- C41.88 H48.43 N3 Ni O7.91 -","- C41.82 H48.46 N3 Ni O7.91 -","- C167.28 H193.84 N12 Ni4 O31.64 -","4","1","","Miyamoto, Keiko; Yajima, Tomoko; Horn, Ernst; Fukuda, Yutaka","Crystal structure of aqua(benzoylacetonato)(R,R-dibenzylstilbene-diamine) (nitrato)nickel(II) ethanol disolvate, Ni(H~2~O)(C~10~H~10~O~2~)(C~28~H~28~N~2~) (NO~3~) · 1.9C~2~H~5~OH","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","243","245","","","","0.7107","MoKα","","","0.05","","","","0.0528","","","","","","0.252","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102136","8.8625","0.0014","13.939","0.008","17.061","0.01","81.67","0.05","85.68","0.03","84.91","0.03","2073","1.8","293","2","","","","","","","","","","6","P -1","-P 1","2","","hexakis(μ~2~-chloro)-μ~4~-oxo-tetrakis((3,5-dimethylpyrazole)copper(II)) ethanol tetrasolvate","","- C28 H56 Cl6 Cu4 N8 O5 -","- C20 H32 Cl6 Cu4 N8 O -","- C40 H64 Cl12 Cu8 N16 O2 -","2","1","","Jaćimović, Željko K.; Leovać, Vukadin M.; Tomić, Zoran D.","Crystal structure of hexakis(μ~2~-chloro)-μ~4~-oxo-tetrakis ((3,5-dimethylpyrazole)copper(II)) ethanol tetrasolvate, Cu~4~OCl~6~ (C~5~H~8~N~2~)~4~ · 4C~2~H~5~OH","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","246","248","","","x-ray","0.71073","MoKα","","","0.0803","","","","0.1938","","","","","","0.795","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102137","10.413","0.005","9.857","0.005","14.995","0.005","90","0.005","108.324","0.005","90","0.005","1461.1","1.1","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","dichloro-bis(4-amino-2-chloropyridine)zinc(II)","","- C10 H10 Cl4 N4 Zn -","- C10 H10 Cl4 N4 Zn -","- C40 H40 Cl16 N16 Zn4 -","4","0.5","","Zhou, Tian; Xu, Wen; Li, Chun-Hai; Guo, Ji-Xun","Crystal structure of dichloro-bis(4-amino-2-chloropyridine)zinc(II), ZnCl~2~(C~10~H~10~Cl~2~N~4~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","249","250","","","","0.71069","MoKα","","0.024","0.0218","","","0.0538","0.055","","","","","","1.066","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102138","8.837","0.001","15.625","0.002","10.366","0.001","90","","103.362","0.012","90","","1392.6","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(isothiocyanato)(2-pyridinecarboxaldehydebenzoyl-hydrazonato)copper(I)","","- C14 H10 Cu N4 O S -","- C14 H10 Cu N4 O S -","- C56 H40 Cu4 N16 O4 S4 -","4","1","","Batistakis, Chrysostomos; Gan, Yu; Cardin, Christine J.; Paschalidis, Damianos G.; Kavounis, Constantinos A.","Crystal structure of (isothiocyanato)(2-pyridinecarboxaldehydebenzoyl- hydrazonato)copper(I), Cu(C~13~H~10~N~3~O)(NCS)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","251","252","","","","0.7093","Mo","","0.0386","0.0291","","","0.0745","0.0761","","","","","","1.007","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102139","8.6267","0.0007","23.4871","0.0019","28.7","0.002","90","","90","","90","","5815.1","0.8","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","tetraphenylphosphonium dichlorotetrakis(3-phenoxypropionato)diruthenium(II,III)","","- C60 H56 Cl2 O12 P Ru2 -","- C60 H56 Cl2 O12 P Ru2 -","- C240 H224 Cl8 O48 P4 Ru8 -","4","1","","González-Prieto, Rodrigo; Jiménez-Aparicio, Reyes; Luis Priego, J.; Rosario Torres, M.","Crystal structure of tetraphenylphosphonium dichlorotetrakis (3-phenoxypropionato)diruthenium(II,III), [P(C~6~H~5~)~4~][Ru~2~Cl~2~(O~3~C~9~H~9~)~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","271","273","","","","0.71073","MoKα","","0.1663","0.0639","","","0.1506","0.1837","","","","","","0.879","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102140","7.933","0.003","12.903","0.004","15.214","0.005","86.79","0.003","79.881","0.004","89.345","0.003","1530.7","0.9","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","3,5-diiodosalicylaldehyde (2-hydroxybenzoyl)hydrazone","","- C14 H10 I2 N2 O3 -","- C14 H10 I2 N2 O3 -","- C56 H40 I8 N8 O12 -","4","2","","Li, Zhi-Ping","Crystal structure of 3,5-diiodosalicylaldehyde (2-hydroxybenzoyl)hydrazone, C~14~H~10~I~2~N~2~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","253","254","","","","0.71073","MoKα","","0.0664","0.0407","","","0.0818","0.0954","","","","","","1.031","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102141","7.247","0.002","10.045","0.003","11.324","0.004","96.668","0.005","105.805","0.005","98.427","0.005","774","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","bis(4-nitro-2-((3-dimethylaminopropylimino)methyl)phenolato)- diisothiocyanato-nickel(II)","","- C26 H34 N8 Ni O6 S2 -","- C26 H34 N8 Ni O6 S2 -","- C26 H34 N8 Ni O6 S2 -","1","0.5","","Li, Wen-Hui","Crystal structure of bis(4-nitro-2-((3-dimethylamino-propylimino)methyl)- phenolato)-diisothiocyanato-nickel(II), Ni(C~12~H~17~N~3~O~3~)~2~ (NCS)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","255","256","","","","0.71073","MoKα","","0.1614","0.0699","","","0.0669","0.0825","","","","","","0.781","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102142","6.8064","0.0007","11.5989","0.0012","13.4207","0.0014","72.683","0.002","84.523","0.002","83.237","0.002","1002.42","0.18","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-[(4- trifluoromethyl)methyleneimino]-1H-pyrazole-3-carbonitrile","","- C19 H8 Cl2 F6 N4 -","- C19 H8 Cl2 F6 N4 -","- C38 H16 Cl4 F12 N8 -","2","1","","Zhang, Xing-Guo; Chen, Mu-Wang; Hu, Mao-Lin; Zhong, Ping","Crystal structure of 1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-5- ((4-trifluoromethyl)methyleneimino)-1H-pyrazole-3-carbonitrile, C~19~H~8~Cl~2~F~6~N~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","257","258","","","","0.71073","MoKα","","0.1004","0.0851","","","0.2054","0.2171","","","","","","1.091","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102143","3.822","","12.122","","13.194","","115.26","","91.28","","93.45","","551.048","","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-phenylquinolin-3,4-diones","","- C15 H9 N O2 -","- C15 H9 N O2 -","- C30 H18 N2 O4 -","2","1","","Ganszky, Ildikó; Kaizer, József; Czaun, Miklós; Speier, Gábor; Párkányi, László","Crystal structure of 2-phenylquinolin-3,4-dione, C~15~H~9~NO~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","259","260","","","","1.54184","CuKα","","0.0447","0.0373","","","0.1092","0.1141","","","","","","1.054","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102144","15.325","0.001","15.325","0.001","10.505","0.0006","90","","90","","90","","2467.2","0.3","191","2","191","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","tetra-μ~3~-bromo-tetrakis(tert-butyl-(4-methyl-pyridin-2-yl)-amine)- tetracopper(I)","","- C40 H64 Br4 Cu4 N8 -","- C40 H64 Br4 Cu4 N8 -","- C80 H128 Br8 Cu8 N16 -","2","0.25","","Glatz, Germund; Irrgang, Torsten; Kempe, Rhett","Crystal structure of tetra-μ~3~-bromo-tetrakis(tert-butyl- (4-methyl-pyridin-2-yl)-amine)-tetracopper(I), Cu~4~Br~4~(C~10~H~16~N~2~) ~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","261","262","","","","0.71069","MoKα","","0.0762","0.0556","","","0.1492","0.1615","","","","","","1.065","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102145","13.964","0.0008","15.146","0.0009","17.621","0.0014","90","","105.772","0.007","90","","3586.5","0.4","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(2,6-diisopropyl-phenyl)-pyridin-2-yl-amine toluene solvate","","- C20.5 H26 N2 -","- C41 H52 N4 -","- C164 H208 N16 -","4","0.5","","Noor, Awal; Irrgang, Torsten; Glatz, Germund; Kempe, Rhett","Crystal structure of (2,6-diisopropyl-phenyl)-pyridin-2-yl-amine toluene hemisolvate, C~17~H~22~N~2~ · 0.5C~7~H~8~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","263","264","","","","0.71069","MoKα","","0.0542","0.0364","","","0.0862","0.0897","","","","","","0.986","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102146","7.636","0.0009","8.035","0.0009","11.208","0.0013","79.418","0.009","73.391","0.009","84.103","0.009","646.85","0.13","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","(4-methyl-pyridin-2-yl)-(2,4,6-trimethyl-phenyl)-amine","","- C15 H18 N2 -","- C15 H18 N2 -","- C30 H36 N4 -","2","1","","Glatz, Germund; Irrgang, Torsten; Kempe, Rhett","Crystal structure of (4-methyl-pyridin-2-yl)-(2,4,6-trimethyl-phenyl)- amine, C~15~H~18~N~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","265","266","","","","0.71069","MoKα","","0.0542","0.0465","","","0.1265","0.1309","","","","","","1.073","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102147","26.941","0.012","4.32","0.002","23.173","0.011","90","","102.882","0.007","90","","2629","2","193","2","193","2","","","","","","","Sigma","4","C 1 2/c 1","-C 2yc","15","5,5'-dibromosalicil","bis(5-bromo-2-hydroxyphenyl)ethanedione","","- C14 H8 Br2 O4 -","- C14 H8 Br2 O4 -","- C112 H64 Br16 O32 -","8","1","","Staples, Richard J.","Crystal structure of bis(5-bromo-2-hydroxyphenyl)ethanedione, C~14~H~8~Br~2~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","267","268","","","x-ray","0.71073","MoKα","","0.0429","0.032","","","0.0788","0.0835","","","","","","1.028","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102148","5.542","0.003","18.677","0.01","8.723","0.005","90","","102.868","0.009","90","","880.2","0.8","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-(4-chlorophenyl)-2-cyanoacetamide","","- C9 H7 Cl N2 O -","- C9 H7 Cl N2 O -","- C36 H28 Cl4 N8 O4 -","4","1","","Staples, Richard J.; Vidnovio, Nicholas","Crystal structure of N-(4-chlorophenyl)-2-cyanoacetamide, C~9~H~7~ClN~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","269","270","","","","0.71073","MoKα","","0.0531","0.0362","","","0.084","0.0884","","","","","","1.032","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102149","13.7928","0.0012","19.7357","0.0019","11.2061","0.001","90","","93.572","0.004","90","","3044.5","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis[bis(1,10-phenanthroline-N,N')(μ-2-iodo-benzoato)manganese(II)] diiodide dihydrate, [Mn(C7H4O2I)(C12H8N2)2]2I2 τimes 2H~2~O","","- C62 H44 I4 Mn2 N8 O6 -","- C62 H44 I4 Mn2 N8 O6 -","- C124 H88 I8 Mn4 N16 O12 -","2","0.5","","Zhang, Bi-Song","Crystal structure of bis(bis(1,10-phenanthroline-N,N')(μ-2- iodobenzoato)manganese(II)) diiodide dihydrate, [Mn~2~(C~7~H~4~O~2~I) ~2~(C~12~H~8~N~2~)~4~][I]~2~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","274","276","","","","0.71073","MoKα","","0.1613","0.0754","","","0.2062","0.2417","","","","","","0.965","","","","has coordinates,has disorder","194594","2020-10-21","18:00:00",""
"8102150","9.5046","0.0003","6.726","0.0001","18.2493","0.0004","90","","92.931","0.001","90","","1165.11","0.05","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,4-diazabicyclo[2.2.2]octane tetrachlorozincate","","- C6 H14 Cl4 N2 Zn -","- C6 H14 Cl4 N2 Zn -","- C24 H56 Cl16 N8 Zn4 -","4","1","","Lu, Lu-Ping; Xie, Jian-Wu; Chen, Zhen-Hua; Tong, Guo-Tong; Li, Zu-Guang","Refinement of the crystal structure of 1,4-diazabicyclo[2.2.2]octane tetrachlorozincate, (C~6~H~14~N~2~)(ZnCl~4~), at 153 K","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","277","278","","","","0.71073","MoKα","","0.0336","0.0331","","","0.0893","0.09","","","","","","1.007","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8102151","4.912","0.002","10.048","0.002","11.302","0.003","96.251","0.003","98.113","0.003","90.118","0.002","548.9","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","N,N'-(1,6-hexamethylene)-bis-benzoylthiourea","","- C22 H26 N4 O2 S2 -","- C22 H26 N4 O2 S2 -","- C22 H26 N4 O2 S2 -","1","0.5","","Dong, Wen-Kui; Yang, Xiao-Qing; Xu, Li; Wang, Li; Liu, Gai-Lan; Feng, Jian-Hua","Crystal structure of N,N'-(1,6-hexamethylene)bis(benzoylthiourea), C~22~H~26~N~4~O~2~S~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","279","280","","","","0.71073","MoKα","","0.1335","0.0941","","","0.2045","0.2283","","","","","","1.018","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102152","10.712","0.0008","19.47","0.0016","20.681","0.0019","90","","94.178","0.007","90","","4301.8","0.6","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2,6-diisopropyl-phenyl)-[6-(2,6-dimethyl-phenyl)-pyridin-2-yl]-amine- (2,6-diisopropyl-phenyl)-[6-(2,6-dimethyl-phenyl)-pyridin-2-yl]-amido-lithium","","- C50 H59 Li N4 -","- C50 H59 Li N4 -","- C200 H236 Li4 N16 -","4","1","","Espiga Ayuso, Andrea; Noor, Awal; Irrgang, Torsten; Glatz, Germund; Kempe, Rhett","Crystal structure of (2,6-diisopropyl-phenyl)-(6-(2,6-dimethyl-phenyl)- pyridin-2-yl)-amine-(2,6-diisopropylphenyl)-(6-(2,6-dimethyl-phenyl)- pyridin-2-yl)-amidolithium, Li(C~25~H~29~N~2~)(C~25~H~30~N~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","281","283","","","","0.71069","MoKα","","0.1871","0.0651","","","0.0919","0.1147","","","","","","0.861","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102153","11.389","0.0007","16.507","0.0008","23.728","0.0019","90","","96.604","0.006","90","","4431.2","0.5","191","2","191","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","bis(μ-bromo)-tetrakis(tert-butyl-(4-methyl-pyridin-2-yl)-amine)-dicopper(I)","","- C40 H64 Br2 Cu2 N8 -","- C40 H64 Br2 Cu2 N8 -","- C160 H256 Br8 Cu8 N32 -","4","0.5","","Glatz, Germund; Irrgang, Torsten; Kempe, Rhett","Crystal structure of bis(μ-bromo)-tetrakis(tert-butyl-(4-methyl- pyridin-2-yl)-amine)-dicopper(I), Cu~2~Br~2~(C~10~H~16~N~2~)~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","287","288","","","","0.71069","MoKα","","0.0776","0.0393","","","0.0728","0.0806","","","","","","0.854","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102154","19.441","0.003","7.7452","0.0018","13.875","0.002","90","","119.884","0.002","90","","1811.4","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,2'-((1,4-butylene)dioxybis(nitrilethylidyne))diphenol","","- C20 H24 N2 O4 -","- C20 H24 N2 O4 -","- C80 H96 N8 O16 -","4","0.5","","Dong, Wen-Kui; He, Xue-Ni; Dong, Chen-Ming; Wang, Li; Zhong, Jin-Kui; Chen, Xiao; Yu, Tian-Zhi","Crystal structure of 2,2'-((1,4-butylene)dioxybis(nitriloethylidyne)) diphenol, C~20~H~24~N~2~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","289","290","","","","0.71073","MoKα","","0.0669","0.0486","","","0.1222","0.1396","","","","","","1.037","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102155","8.118","0.003","10.085","0.003","13.106","0.004","90","","118.5","0.005","90","","943","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","dibromo[(1,2,5,6-η)-1,3,5,7-cyclooctatetraene]platinum(II)","","- C8 H8 Br2 Pt -","- C8 H8 Br2 Pt -","- C32 H32 Br8 Pt4 -","4","1","","Song, Ah-Ran; Hwang, In-Chul; Ha, Kwang","Crystal structure of dibromo((1,2,5,6-h)-1,3,5,7-cyclooctatetraene) platinum(II), PtBr~2~(C~8~H~8~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","291","292","","","","0.71073","MoKα","","0.032","0.0274","","","0.0734","0.0751","","","","","","1.091","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102156","7.886","0.003","8.046","0.003","11.116","0.004","87.853","0.006","69.68","0.006","71.245","0.006","624.1","0.4","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","3'-nitro-4',7-dihydroxyisoflavone","","- C15 H9 N O6 -","- C15 H9 N O6 -","- C30 H18 N2 O12 -","2","1","","Tan, Da-Jin; Zhang, Zun-Ting","Crystal structure of 3'-nitro-4',7-dihydroxyisoflavone, C~15~H~9~NO~6~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","293","294","","","","0.71073","MoKα","","0.1056","0.0684","","","0.1822","0.2139","","","","","","1.045","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102157","10.6419","0.0013","8.8592","0.0011","20.66","0.003","90","","90.386","0.002","90","","1947.8","0.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5',6,8-tribromo-2,3,4'-trimethoxy-7-hydroxylisoflavanone","","- C18 H15 Br3 O6 -","- C18 H15 Br3 O6 -","- C72 H60 Br12 O24 -","4","1","","Wang, Chun-Yan; Zhang, Zun-Ting; Chang, Yong","Crystal structure of 5',6,8-tribromo-2,3,4'-trimethoxy-7-hydroxylisoflavanone, C~18~H~15~Br~3~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","295","296","","","","0.71073","MoKα","","0.0467","0.0312","","","0.0706","0.0748","","","","","","1.046","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102158","36.6123","0.0016","36.6123","0.0016","5.5797","0.0003","90","","90","","120","","6477.3","0.5","296","2","296","2","","","","","","","","4","R -3 :H","-R 3","148","","3-amino-5-(furan-2-yl)-2-nitrobiphenyl-4-carbonitrile","","- C17 H11 N3 O3 -","- C17 H11 N3 O3 -","- C306 H198 N54 O54 -","18","1","","Li, Jie; Xue, Dong; Zhang, Zun-Ting","Crystal structure of 3-amino-5-(furan-2-yl)-2-nitrobiphenyl-4-carbonitrile, C~17~H~11~N~3~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","297","298","","","","0.71073","MoKα","","0.0732","0.0416","","","0.1067","0.1211","","","","","","0.936","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102159","5.9839","0.0002","12.0726","0.0004","16.6654","0.0004","90","","90.179","0.002","90","","1203.92","0.06","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,5-Bis(2-benzimidazolyl)hydroquinone dimethylformamide 1:2 complex","2,5-bis(2-benzimidazolyl)hydroquinone dimethylformamide disolvate","","- C26 H28 N6 O4 -","- C26 H28 N6 O4 -","- C52 H56 N12 O8 -","2","0.5","","Weber, Edwin; Klomfaß, Detlef; Csöregh, Ingeborg","Crystal structure of 2,5-bis(2-benzimidazolyl)hydroquinone dimethylformamide disolvate, C~20~H~14~N~4~O~2~ · 2C~3~H~7~NO","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","299","300","","","","1.5418","CuKα","","0.0375","0.0339","","","0.0732","0.0776","","","","","","0.502","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8102160","12.927","0.001","16.841","0.002","17.478","0.002","83.93","0.008","76.23","0.01","74.52","0.01","3558","0.7","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","catena-(tetraaqua-hexakis(N-p-tolylsulfonylglycinato)dineodymium) dihydrate methanol hemisolvate","","- C54.5 H74 N6 Nd2 O30.5 S6 -","- C54.5 H73 N6 Nd2 O30.5 S6 -","- C109 H146 N12 Nd4 O61 S12 -","2","1","","Chen, Man-Sheng; Kuang, Dai-Zhi; Zhang, Chun-Hua; Deng, Yi-Fang","Crystal structure of catena-(tetraaqua-hexakis(N-p-tolylsulfonylglycinato) dineodymium) dihydrate methanol hemisolvate, Nd~2~(H~2~O)~4~(C~9~H~10~NO~4~S) ~6~ · 2H~2~O · 0.5CH~3~OH","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","303","306","","","","0.71073","MoKα","","0.0352","0.0264","","","0.0653","0.0671","","","","","","1.07","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102161","9.3461","0.001","13.8709","0.0016","19.126","0.002","109.77","0.002","91.533","0.002","98.89","0.002","2297","0.4","298","2","298","2","","","","","","","","2","P -1","-P 1","2","","6,6',12,12'-tetrabutyl-6,12-dihydroindeno[1,2b]fluorene","","- C36 H46 -","- C36 H46 -","- C108 H138 -","3","1.5","","Zhang, Guo-Hui; Cao, Du-Xia; Chen, Hong-Yu; Liu, Zhi-Qiang","Crystal structure of 6,6',12,12'-tetrabutyl-6,12-dihydroindeno[1,2b] fluorene, C~36~H~46~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","310","312","","","","0.71073","MoKα","","0.0895","0.0738","","","0.1712","0.1831","","","","","","1.127","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102162","10.1979","0.0006","10.8417","0.0006","11.5399","0.0012","101.789","0.001","95.45","0.001","117.947","0.001","1076.15","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","N,N'-dibenzyl-N,N'-dimethyl-N""-(2-fluorobenzoyl)phosphoric diamide","","- C23 H25 F N3 O2 P -","- C23 H25 F N3 O2 P -","- C46 H50 F2 N6 O4 P2 -","2","1","","Mahmoudi, Ali; Hadjikhani, Ramin","Crystal structure of N,N'-dibenzyl-N,N'-dimethyl-N""-(2-fluorobenzoyl) phosphoric diamide, C~23~H~25~FN~3~O~2~P","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","313","314","","","","0.71073","MoKα","","0.045","0.0371","","","0.0966","0.1034","","","","","","1.029","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102163","14.273","0.003","14.778","0.003","16.97","0.003","90","","103.21","0.03","90","","3484.7","1.3","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(2-(2,6-diisopropyl-phenylamino)-6-(2,4,6-triisopropylphenyl)-pyridinium) hexachloro-titanate(IV) toluene solvate","","- C71 H98 Cl6 N4 Ti -","- C71 H98 Cl6 N4 Ti -","- C142 H196 Cl12 N8 Ti2 -","2","0.5","","Dietel, Anna M.; Irrgang, Torsten; Glatz, Germund; Karthikeyan, Sangeetha; Kempe, Rhett","Crystal structure of bis(2-(2,6-diisopropyl-phenylamino)-6-(2,4,6- triisopropylphenyl)-pyridinium) hexachlorotitanate(IV) toluene solvate, (C~32~H~45~N~2~)~2~[TiCl~6~] · C~7~H~8~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","284","286","","","","0.71073","MoKα","","0.0954","0.0545","","","0.135","0.1511","","","","","","1.027","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102164","8.633","0.0014","5.885","0.0012","16.492","0.002","90","","96.2","0.002","90","","833","0.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-[(1,4-butylene)dioxybis(nitrilomethylidyne)]diphenol","","- C18 H20 N2 O4 -","- C18 H20 N2 O4 -","- C36 H40 N4 O8 -","2","0.5","","Dong, Wen-Kui; Duan, Jin-Gui; Dong, Chen-Ming; Ren, Zong-Li; Shi, Jun-Yan","Crystal structure of 2,2'-((1,4-butylene)dioxybis(nitrilomethylidyne)) diphenol, C~18~H~20~N~2~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","327","328","","","","0.71073","MoKα","","0.0942","0.0507","","","0.117","0.1316","","","","","","0.998","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102165","8.304","0.001","8.465","0.001","10.852","0.002","111.33","0.01","95.85","0.02","104.7","0.02","671.2","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","dichloro[N-ethyl-N'-(1-pyridin-2-yl-methylidene)ethane-1,2-diamino)zinc(II)","","- C10 H15 Cl2 N3 Zn -","- C10 H15 Cl2 N3 Zn -","- C20 H30 Cl4 N6 Zn2 -","2","1","","Wang, Ying-Zhen; Li, Lan-Lan; Su, Yong-Qing; Li, Cong","Crystal structure of dichloro(N-ethyl-N'-(1-pyridin-2-yl-methylidene) ethane-1,2-diamino)zinc(II), Zn(C~10~H~15~N~3~)Cl~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","329","330","","","","0.71073","MoKα","","0.0511","0.035","","","0.0793","0.0861","","","","","","0.973","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102166","8.4051","0.0004","10.9557","0.0005","12.4462","0.0009","106.37","0.003","103.077","0.003","109.306","0.002","971.07","0.1","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","N-trifluoroacetyl-N',N""-bis(N-cyclohexylmethyl)phosphoric triamide, CF3C(O)N(H)P(O)[N(CH3)(C6H11)]2","","- C16 H29 F3 N3 O2 P -","- C16 H29 F3 N3 O2 P -","- C32 H58 F6 N6 O4 P2 -","2","1","","Yazdanbakhsh, Mohammad; Sabbaghi, Fahimeh; Boese, Roland","Crystal structure of N-trifluoroacetyl-N',N""-bis(N-cyclohexylmethyl) phosphoric triamide, CF~3~C(O)N(H)P(O)[N(CH~3~)(C~6~H~11~)]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","331","332","","","","0.71073","MoKα","","0.0645","0.0518","","","0.1474","0.1591","","","","","","1.046","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102167","9.8087","0.0002","22.7606","0.0004","13.6501","0.0002","90","","97.6453","0.0011","90","","3020.32","0.09","150","1","150","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","dimethyl-μ-oxosilane-dibromo-zirconium(IV) di(nonabromozirconate(IV)),","","- C12 H36 Br20 O6 Si6 Zr5 -","- C12 H36 Br20 O6 Si6 Zr5 -","- C24 H72 Br40 O12 Si12 Zr10 -","2","0.5","","Ernst, Richard D.; Glöckner, Andreas; Arif, Atta M.","Crystal structure of hexakis(dimethyl-μ-oxosilane)dibromozirconium (IV) bis(nonabromodizirconate(IV)), [Zr{(CH~3~)~2~SiO}~6~Br~2~][Zr~2~Br~9~] ~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","333","334","","","","0.71073","MoKα","","0.0711","0.0423","","","0.0807","0.088","","","","","","1.052","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102168","7.6112","0.0002","9.2521","0.0004","20.2174","0.0009","90","","90","","90","","1423.7","0.1","200","0.1","200","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","bis(η^5^-6,6-dimethylcyclohexadienyl)chromium","","- C16 H22 Cr -","- C16 H22 Cr -","- C64 H88 Cr4 -","4","1","","Ernst, Richard D.; Basta, Rehan; Arif, Atta M.","Crystal structure of bis(η^5^-6,6-dimethylcyclohexadienyl)chromium, Cr(C~8~H~11~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","335","336","","","","0.71073","MoKα","","0.0837","0.0456","","","0.0739","0.0847","","","","","","1.041","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102169","14.4031","0.0004","15.568","0.0005","11.0762","0.0003","90","","90","","90","","2483.59","0.13","150","1","150","1","","","","","","","","5","P n a 21","P 2c -2n","33","","1,3,5-tri(tert-butyl)benzene-cyclopentadienyl-iron trifluorodimethylsilicate","","- C25 H41 F3 Fe Si -","- C25 H41 F3 Fe Si -","- C100 H164 F12 Fe4 Si4 -","4","1","","Ernst, Richard D.; Harvey, Benjamin G.; Bode, Stefan; Arif, Atta M.","Crystal structure of 1,3,5-tri(tert-butyl)benzenecyclopentadienyl- iron trifluorodimethylsilicate, [Fe(C~5~H~5~){C~6~H~3~(C~4~H~9~)~3~}] [Si(CH~3~)~2~F~3~]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","337","338","","","","0.71073","MoKα","","0.0513","0.0412","","","0.0878","0.0936","","","","","","1.028","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102170","11.9238","0.0005","13.606","0.0005","14.028","0.0003","114.995","0.002","92.035","0.002","92.39","0.002","2057.35","0.13","296","2","293","2","","","","","","","","6","P -1","-P 1","2","","potassium trifluoro[2-methyl-1,3-dithiano]borate","","- C20 H36 B4 F12 K4 S8 -","- C5 H9 B F3 K S2 -","- C40 H72 B8 F24 K8 S16 -","8","4","","Caracelli, Ignez; Stefani, Hélio A.; Siqueira Vieira, Adriano; Pereira Machado, Maria M.; Zukerman-Schpector, Julio","Crystal structure of potassium trifluoro(2-methyl-1,3-dithiano)borate, K(C~5~H~9~BF~3~S~2~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","345","347","","","","0.71073","MoKα","","0.068","0.0487","","","0.1082","0.117","","","","","","1.05","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102171","6.0555","0.0012","6.8582","0.0014","14.37","0.003","98.111","0.005","97.798","0.005","105.44","0.005","560","0.2","100","0.2","100","0.2","","","","","","","","6","P -1","-P 1","2","","N,N'-dimethylphosphoramidochloridic acid 4-methyl phenyl ester","","- C9 H13 Cl N O2 P -","- C9 H13 Cl N O2 P -","- C18 H26 Cl2 N2 O4 P2 -","2","1","","Ghadimi, Saied; Valmoozi, Ali A. E.; Pourayoubi, Mehrdad","Crystal structure of N,N-dimethylphosphoramidochloridic acid 4-methylphenyl ester, ClP(O)[N(CH~3~)~2~][OC~6~H~4~(CH~3~)]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","339","340","","","","0.71073","MoKα","","0.0374","0.0315","","","0.0776","0.082","","","","","","1.001","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102172","13.5422","0.0008","3.6958","0.0002","24.8378","0.0012","90","","118.965","0.003","90","","1087.62","0.11","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","bis(imidazolium) bis(μ~2~-2-oxybenzene-1,3-dicarboxylato)-dicuprate(II) monohydrate","","- C22 H18 Cu2 N4 O11 -","- C22 H18 Cu2 N4 O11 -","- C44 H36 Cu4 N8 O22 -","2","0.5","","He, Yin-Hua; Feng, Xia; Wen, Yi-Hang","Crystal structure of bis(imidazolium) bis(μ~2~-2-oxy-benzene- 1,3-dicarboxylato)-dicuprate(II) monohydrate, (C~3~H~5~N~2~)~2~[Cu~2~ (C~8~H~3~O~5~)~2~] · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","361","362","","","","0.71073","MoKα","","","0.0722","","","0.164","0.1913","","","","","","1.06","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102173","9.5027","0.0013","10.2463","0.0012","21.1","0.002","90","","90","","90","","2054.5","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S,3S,4R,5R)-3-(tert-butoxycarbonylamino-1,2-O-isopropylidene-4-O-methoxy- methyl-5-methylhexane-1,2,4,6-tetrol","","- C17 H33 N O7 -","- C17 H33 N O7 -","- C68 H132 N4 O28 -","4","1","","Frey, Wolfgang; Li, Feng; Jäger, Volker","Crystal structure of (2S,3S,4R,5R)-3-(tert-butoxycarbonylamino-1,2- O-isopropylidene-4-O-methoxymethyl-5-methylhexane-1,2,4,6-tetrol, C~17~H~33~NO~7~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","353","354","","","","1.54178","CuKα","","0.1375","0.077","","","0.1831","0.241","","","","","","1.046","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102174","7.5297","0.0018","7.7321","0.0017","18.921","0.003","90","","90","","90","","1101.6","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S,3R,4S)-1'-deoxy-omuralide","","- C10 H15 N O3 -","- C10 H15 N O3 -","- C40 H60 N4 O12 -","4","1","","Frey, Wolfgang; Li, Feng; Jäger, Volker","Crystal structure of (2S,3R,4S)-1'-deoxy-omuralide, C~10~H~15~NO~3~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","355","356","","","","0.71073","MoKα","","0.0742","0.0573","","","0.1329","0.1413","","","","","","1.091","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102175","9.0983","0.0007","10.838","0.0009","9.3763","0.0006","90","","103.321","0.005","90","","899.7","0.12","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(2S,3R,4R)-1-tert-butoxycarbonyl-3-hydroxy-2-(2'-methyl-allyl)-4-methylproline methyl ester","","- C16 H27 N O5 -","- C16 H27 N O5 -","- C32 H54 N2 O10 -","2","1","","Frey, Wolfgang; Li, Feng; Jäger, Volker","Crystal structure of (2S,3R,4R)-1-tert-butoxycarbonyl-3-hydroxy-2- (2'-methylallyl)-4-methylproline methyl ester, C~16~H~27~NO~5~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","357","358","","","","1.54178","CuKα","","0.0744","0.0562","","","0.1402","0.1635","","","","","","1.01","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102176","9.1627","0.0007","11.9106","0.0012","16.6391","0.0013","90","","90","","90","","1815.9","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(2S,3S,4R)-1-tert-butoxycarbonylamino-3-hydroxy-2-isobutyl-4-methylproline methyl ester","","- C16 H29 N O5 -","- C16 H29 N O5 -","- C64 H116 N4 O20 -","4","1","","Frey, Wolfgang; Li, Feng; Jäger, Volker","Crystal structure of (2S,3S,4R)-1-tert-butoxycarbonylamino-3-hydroxy- 2-isobutyl-4-methylproline methyl ester, C~16~H~29~NO~5~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","359","360","","","","1.54178","CuKα","","0.0874","0.0613","","","0.1564","0.2027","","","","","","1.066","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102177","7.7399","0.0015","9.951","0.002","15.091","0.003","90","","98.51","0.03","90","","1149.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","catena-tetraaqua(bis(μ~4~-pyridine-3,5-dicarboxylato)(μ~2~- oxalato)dicerium(III) dihydrate","","- C8 H9 Ce N O9 -","- C8 H9 Ce N O9 -","- C32 H36 Ce4 N4 O36 -","4","1","","Wang, Chong-Chen","Crystal structure of catena-tetraaqua-bis(μ~4~-pyridine-3,5- dicarboxylato)-μ~2~-oxalato-dicerium(III) dihydrate, Ce~2~ (H~2~O)~4~(C~7~H~3~NO~4~)~2~(C~2~O~4~) · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","351","352","","","","0.71073","MoKα","","0.0163","0.0154","","","0.0407","0.0412","","","","","","1.024","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102178","9.932","0.004","10.552","0.004","10.646","0.005","90","","113.76","0.05","90","","1021.2","0.8","95","2","95","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","bis(η^5^-1-tert-butylindenyl)cobalt(II)","","- C26 H30 Co -","- C26 H30 Co -","- C52 H60 Co2 -","2","0.5","","Guo, Shengli; Hauptmann, Ralf; Belaj, Ferdinand; Schneider, Jörg J.","Crystal structure of bis(h^5^-1-tert-butylindenyl)cobalt(II), Co(C~13~H~15~) ~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","363","364","","","","0.71073","MoKα","","0.0423","0.0347","","","0.0886","0.0928","","","","","","1.026","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102179","10.341","0.002","16.063","0.003","27.425","0.005","90","","98.76","0.03","90","","4502.4","1.5","200","2","200","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","1-(2-(dicyclohexylphosphinophenyl)pyrol-2-dicyclohexylphosphino-rhodium(I) norborna-2,5-diene tetrafluoroborate tetrahydrofuran hemisolvate","","- C43 H63 B F4 N O0.5 P2 Rh -","- C43 H63 B F4 N O0.5 P2 Rh -","- C172 H252 B4 F16 N4 O2 P8 Rh4 -","4","1","","Jackstell, Ralf; Dai, Zhenya; Schmidt, Thomas; Heller, Detlef; Drexler, Hans-Joachim","Crystal structures of 1-(2-(dicyclohexylphosphinophenyl)-pyrol-2- dicyclohexylphosphino-rhodium(I) norborna-2,5-diene tetrafluoroborate tetrahydrofuran hemisolvate, [Rh(C~34~H~51~NP~2~)(C~7~H~8~)][BF~4~] · 0.5C~4~H~8~O, and 1-(2-(dicyclohexylphosphinophenyl)-pyrol-2-dicyclohexyl- phosphino-rhodium(I) (Z,Z)-cycloocta-1,5-diene tetrafluoroborate, [Rh(C~34~H~51~NP~2~)(C~8~H~12~)][BF~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","458","462","","","","0.71073","MoKα","","0.1007","0.0596","","","0.1336","0.1433","","","","","","0.886","","","","has coordinates,has disorder","187550","2020-10-21","18:00:00",""
"8102180","18.389","0.004","28.248","0.007","7.8468","0.0018","90","","99.155","0.003","90","","4024.1","1.6","291","2","291","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","dichloro-bis(1,10-phenanthroline)-(5-bromosalicylaldehyde- (4-aminobenzene)sulfonic acid)magnesium (II) perchlorate monohydrate","","- C37 H29 Br Cl3 Mg N5 O9 S -","- C37 H29 Br Cl3 Mg N5 O9 S -","- C148 H116 Br4 Cl12 Mg4 N20 O36 S4 -","4","1","","Tai, Xi-Shi; Yin, Jie; Feng, Yi-Min","Crystal structure of dichlorobis(1,10-phenanthroline)(5-bromosalicylaldehyde- (4-aminobenzene)hydrogensulfonic acid)magnesium(II) perchlorate monohydrate, [Mg(C~12~H~8~N~2~)~2~(C~13~H~11~BrNO~4~S)Cl~2~][ClO~4~] · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","398","400","","","","0.71073","MoKα","","0.0822","0.0536","","","0.116","0.1234","","","","","","1.02","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102181","22.235","0.003","7.4117","0.001","15.99","0.002","90","","109.253","0.003","90","","2487.8","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(2Z,4E,6E,8E)-4-formyl-2-methoxyphenyl-3,7-dimethyl-9-(2,6,6- trimethylcyclohex-1-enyl) nona-2,4,6,8-tetraenoate","","- C28 H34 O4 -","- C28 H34 O4 -","- C112 H136 O16 -","4","1","","Gu, Zheng; Li, Zhi-Zhang; Zhao, Na; Wang, Ying; Yan, Jing; Xiang, Jian-Nan","Crystal structure of (2Z,4E,6E,8E)-4-formyl-2-methoxy-phenyl-3,7-dimethyl- 9-(2,6,6-trimethylcyclohex-1-enyl) nona-2,4,6,8-tetraenoate, C~28~H~34~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","383","384","","","","0.71073","MoKα","","0.1299","0.0613","","","0.1437","0.1644","","","","","","0.814","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102183","8.7463","0.0008","10.5254","0.0009","10.9292","0.001","80.408","0.002","77.738","0.001","66.934","0.001","900.67","0.14","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","4-[(4-chloro-benzylidene)-amino]-5-naphthalen-1-ylmethyl-2,4-dihydro- [1,2,4]triazole-3-thione","","- C20 H15 Cl N4 S -","- C20 H15 Cl N4 S -","- C40 H30 Cl2 N8 S2 -","2","1","","Zhang, Kang; Jin, Jian-Yu; Zhang, Li-Xue; Lei, Xin-Xiang; Zhang, An-Jiang","Crystal structure of 4-((4-chloro-benzylidene)-amino)-5-naphthalen- 1-ylmethyl-2,4-dihydro-[1,2,4]triazole-3-thione, C~20~H~15~ClN~4~S","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","389","390","","","","0.71073","MoKα","","0.0606","0.0552","","","0.1233","0.1268","","","","","","1.13","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102184","8.7231","0.0003","9.6718","0.0003","12.8745","0.0004","77.501","0.001","74.023","0.001","67.092","0.001","954.53","0.05","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","4,4'-bipyridine - 2-nitro-benzene-1,4-dioxyacetic acid - water (1:1:1)","","- C20 H19 N3 O9 -","- C20 H19 N3 O9 -","- C40 H38 N6 O18 -","2","1","","Wang, Ying-Hua","Crystal structure of 4,4'-bipyridine - 2-nitrobenzene-1,4-dioxyacetic acid - water (1:1:1), C~10~H~7~NO~8~ · C~10~H~10~N~2~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","393","394","","","","0.71073","MoKα","","0.0379","0.0344","","","0.1029","0.1057","","","","","","1.036","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102185","5.9522","0.0001","10.2591","0.0002","9.3392","0.0002","90","","95.698","0.001","90","","567.473","0.019","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Tetraacetylethylenediamine","tetraacetylethylenediamine","","- C10 H16 N2 O4 -","- C10 H16 N2 O4 -","- C20 H32 N4 O8 -","2","0.5","","Liu, Sheng-Li; Wen, Chun-Lin","Crystal structure of tetraacetylethylenediamine, C~10~H~16~N~2~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","385","386","","","","0.71073","MoKα","","0.0419","0.039","","","0.1093","0.1134","","","","","","1.053","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102186","8.846","0.003","16.296","0.006","8.744","0.003","90","","106.647","0.006","90","","1207.7","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","imidazolium pentaborate","imidazolium tetrahydroxohexaoxopentaborate","","- C3 H9 B5 N2 O10 -","- C3 H9 B5 N2 O10 -","- C12 H36 B20 N8 O40 -","4","1","","Han, Wei-He; Dang, Li-Long; Zhang, Wen-Juan","Crystal structure of imidazolium tetrahydroxohexaoxopentaborate, [C~3~H~5~N~2~][B~5~O~6~(OH)~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","403","404","","","","0.71073","MoKα","","0.1069","0.0526","","","0.1164","0.1398","","","","","","1.009","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102187","9.1625","0.0013","10.8104","0.0019","14.19","0.002","107.309","0.003","101.878","0.003","92.192","0.002","1305.7","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","2-carboxybenzaldehyde furan-2-carbohydrazide methanol hemisolvate","","- C13.5 H12 N2 O4.5 -","- C13.5 H12 N2 O4.5 -","- C54 H48 N8 O18 -","4","2","","Tai, Xi-Shi; Yin, Jie; Kong, Fan-Yuan","Crystal structure of 2-carboxybenzaldehyde furan-2-carbohydrazide methanol hemisolvate, C~13~H~10~N~2~O~4~ · 0~.~5CH~3~OH","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","401","402","","","","0.71073","MoKα","","0.0907","0.0453","","","0.1038","0.132","","","","","","1.003","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102188","10.147","0.002","13.246","0.003","18.827","0.004","90","","90","","90","","2530.5","0.9","200","2","200","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","(R)-catASium M-Rh-NBD","(2,3-bis((2R,5R)-2,5-dimethylphosphonalyl)maleic anhydride)- (η^4^-norbornadiene)-rhodium(I) tetrafluoroborate","","- C23 H32 B F4 O3 P2 Rh -","- C23 H32 B F4 O3 P2 Rh -","- C92 H128 B4 F16 O12 P8 Rh4 -","4","1","","Holz, Jens; Börner, Armin; Heller, Detlef; Drexler, Hans-Joachim","Crystal structure of (2,3-bis((2R,5R)-2,5-dimethyl-phosphonalyl)maleic anhydride)-(η^4^-norbornadiene)-rhodium(I) tetrafluoroborate, [Rh(C~7~H~8~)(C~16~H~24~O~3~P~2~)][BF~4~]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","463","464","","","","0.71073","MoKα","","0.0272","0.0252","","","0.0665","0.067","","","","","","1.048","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102189","10.5035","0.0009","17.8918","0.0015","18.7366","0.0015","90","","93.383","0.001","90","","3515","0.5","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","tris(1,10-phenanthroline-5,6-dione)-nickel diperchlorate","tris(1,10-phenanthroline-5,6-dione)nickel(II) diperchlorate","","- C36 H18 Cl2 N6 Ni O14 -","- C36 H18 Cl2 N6 Ni O14 -","- C144 H72 Cl8 N24 Ni4 O56 -","4","1","","Li, Ren-Tao; Jiang, Wen-Jun; Li, Xiao-Xiang; Cai, Tie-Jun; Deng, Qian; Peng, Zhen-Shan; Huang, Ming-Zhong","Crystal structure of tris(1,10-phenanthroline-5,6-dione)nickel(II) diperchlorate, [Ni(C~12~H~6~N~2~O~2~)~3~][ClO~4~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","395","397","","","","0.71073","MoKα","","0.1087","0.0569","","","0.1389","0.1682","","","","","","1.033","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102190","11.0623","0.0018","10.8776","0.0017","12.666","0.002","90","","90","","90","","1524.1","0.4","298","2","298","2","","","","","","","","6","P n a 21","P 2c -2n","33","","1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-iodo-5-amino-1H-pyrazole-3- carbonitrile","","- C11 H4 Cl2 F3 I N4 -","- C11 H4 Cl2 F3 I N4 -","- C44 H16 Cl8 F12 I4 N16 -","4","1","","Li, Shu-Yan; Zhong, Ping; Hu, Mao-Lin","Crystal structure of 1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4- iodo-5-amino-1H-pyrazole-3-carbonitrile, C~11~H~4~Cl~2~F~3~IN~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","423","424","","","","0.71073","MoKα","","0.0555","0.0537","","","0.1148","0.1156","","","","","","1.257","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102191","8.539","0.002","9.23","0.002","10.702","0.003","109.976","0.006","93.92","0.006","111.081","0.006","721.9","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","N,N'-bis-(4-methoxy-benzylidene)-hydrazine","","- C16 H16 N2 O2 -","- C16 H16 N2 O2 -","- C32 H32 N4 O4 -","2","1","","Jin, Jian-Yu; Zhang, Kang; Zhang, Li-Xue; Zhang, An-Jiang; Liu, Yu-Zhen","Crystal structure of N,N'-bis(4-methoxy-benzylidene)hydrazine, C~16~H~16~N~2~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","391","392","","","","0.71073","MoKα","","0.109","0.0806","","","0.155","0.1781","","","","","","1.256","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102192","11.9369","0.0018","12.3316","0.0013","20.268","0.002","90","","106.197","0.012","90","","2865.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5,17-dibromo-25,26,27,28-tetramethoxycalix[4]arene","","- C32 H30 Br2 O4 -","- C32 H30 Br2 O4 -","- C128 H120 Br8 O16 -","4","1","","Hu, Xiao-Jun; Zhang, Pin; Li, Yong; Yang, Hai-Jun; Wang, Ru-Ji","Crystal structure of 5,17-dibromo-25,26,27,28-tetramethoxycalix[4] arene, C~32~H~30~Br~2~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","405","406","","","","0.71073","MoKα","","0.1011","0.0531","","","0.0908","0.1053","","","","","","1.027","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102195","8.446","0.003","8.561","0.003","11.258","0.003","111.791","0.003","96.397","0.002","106.341","0.003","703.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","dibromo(N-ethyl-N'-pyridinylmethyleneethane-1,2-diamino)zinc(II),","","- C10 H15 Br2 N3 Zn -","- C10 H15 Br2 N3 Zn -","- C20 H30 Br4 N6 Zn2 -","2","1","","Peng, San-Jun; Ping, Wei-Jun; Song, Liu-Bin","Crystal structure of dibromo(N-ethyl-N'-pyridinylmethyleneethane-1, 2-diamino)zinc(II), ZnBr~2~(C~10~H~15~N~3~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","425","426","","","","0.71073","MoKα","","0.0451","0.0328","","","0.0738","0.078","","","","","","1.052","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102196","11.0915","0.0009","42.064","0.004","5.0972","0.0004","90","","90","","90","","2378.1","0.4","292","2","292","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","triaqua-cis-bis((2-carboxybenzene)sulfonylglycinato)zinc(II)","","- C18 H22 N2 O15 S2 Zn -","- C18 H22 N2 O15 S2 Zn -","- C72 H88 N8 O60 S8 Zn4 -","4","0.5","","Ma, Lu-Fang; Wu, Ye; Lu, Dan-Hua","Crystal structure of triaqua-cis-bis((2-carboxybenzene)sulfonylglycinato) zinc(II), Zn(H~2~O)~3~(C~9~H~8~NO~6~S)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","435","436","","","","0.71073","MoKα","","0.0348","0.0298","","","0.0845","0.0883","","","","","","1.044","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102199","15.036","0.003","7.66","0.002","20.327","0.004","96.72","0.02","111.05","0.01","78.55","0.02","2138.8","0.8","293","2","293","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","1-(2,3-dimethylphenyl)piperazine dihydrogentriphosphate trihydrate","","- C36 H65 N6 O13 P3 -","- C36 H65 N6 O13 P3 -","- C72 H130 N12 O26 P6 -","2","1","","Mechergui, Jalloul; Belam, Wahid; Rzaigui, Mohamed","Crystal structure of 1-(2,3-dimethylphenyl)piperazinium dihydrogentriphosphate trihydrate, [C~12~H~19~N~2~]~3~[H~2~P~3~O~10~] · 3H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","409","411","","","x-ray","0.71073","MoKα","","0.0972","0.0578","","","0.1493","0.1706","","","","","","1.023","","","","has coordinates","194048","2020-10-21","18:00:00",""
"8102204","12.457","0.003","8.351","0.002","12.584","0.003","90","","118.296","0.011","90","","1152.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-benzylsalicylamide","","- C14 H13 N O2 -","- C14 H13 N O2 -","- C56 H52 N4 O8 -","4","1","","Liu, Sheng-Li; Liang, En-Xiang; Yu, Liang-Cai; Huang, Li","Crystal structure of N-benzylsalicylamide, C~14~H~13~NO~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","433","434","","","","0.71073","MoKα","","0.2106","0.0701","","","0.167","0.241","","","","","","1.023","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102206","6.227","0.005","12.962","0.003","17.327","0.006","94.65","0.02","98.41","0.05","97.48","0.05","1364.6","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-(2,3-dimethylphenyl)piperazine dihydrogendiphosphate","","- C24 H40 N4 O7 P2 -","- C24 H40 N4 O7 P2 -","- C48 H80 N8 O14 P4 -","2","1","","Mechergui, Jalloul; Belam, Wahid; Rzaigui, Mohamed","Crystal structure of 1-(2,3-dimethylphenyl)piperazinium dihydrogendiphosphate, [C~12~H~19~N~2~]~2~[H~2~P~2~O~7~]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","412","414","","","x-ray","0.71073","MoKα","","0.089","0.0489","","","0.1153","0.1316","","","","","","1.017","","","","has coordinates","194048","2020-10-21","18:00:00",""
"8102208","14.3314","0.0012","19.3918","0.0016","25.521","0.002","90","","90","","90","","7092.6","1","298","2","298","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","azido-(2-bromo-4-chloro-6-((2-diethylaminoethylimino)methyl)phenolato)- (2-bromo-4-chloro-6-((2-diethylhdrogenaminoethylimino)methyl)phenolato)- cobalt(III) nitrate","","- C26 H35 Br2 Cl2 Co N8 O5 -","- C26 H35 Br2 Cl2 Co N8 O5 -","- C208 H280 Br16 Cl16 Co8 N64 O40 -","8","1","","Peng, San-Jun; Wu, Dao-Xin; Song, Liu-Bin","Crystal structure of azido(2-bromo-4-chloro-6-((2-diethylaminoethylimino) methyl)phenolato)(2-bromo-4-chloro-6-((2-diethylhydrogenaminoethylimino) methyl)phenolato)cobalt(III) nitrate, [Co(C~13~H~17~BrClN~2~O)(C~13~H~18~BrClN~2~O)(N~3~)][NO~3~]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","427","429","","","","0.71073","MoKα","","0.1741","0.0621","","","0.1363","0.1887","","","","","","0.987","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102217","10.338","0.006","13.024","0.005","14.491","0.005","81.017","0.016","87.65","0.03","66.95","0.03","1772.9","1.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","cis-dichloro-1,2-ethylenediamine-bis(1,4-(diphenylphosphino)butane)- ruthenium(II)","","- C32 H40 Cl6 N2 P2 Ru -","- C32 H40 Cl6 N2 P2 Ru -","- C64 H80 Cl12 N4 P4 Ru2 -","2","1","","Warad, Ismail","Crystal structure of cis-dichloro-1,2-ethylenediamine-bis(1,4- (diphenylphosphino)butane)-ruthenium(II) dichloromethane disolvate, RuCl~2~(C~2~H~8~N~2~)(C~28~H~28~P~2~) · 2CH~2~Cl~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","415","417","","","","0.71073","MoKα","","0.0325","0.0282","","","0.072","0.0746","","","","","","1.032","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102218","9.433","0.003","22.15","0.008","10.728","0.004","90","","111.643","0.007","90","","2083.5","1.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(2,6-dichloro-4-trifluoromethyl-phenyl)-5-((naphthalen-1-ylmethylene)- amino)-1H-pyrazole-3-carbonitrile","","- C22 H11 Cl2 F3 N4 -","- C22 H11 Cl2 F3 N4 -","- C88 H44 Cl8 F12 N16 -","4","1","","Yan, Xi-Yuan; Zhao, Yun; Chen, Mu-Wang","Crystal structure of 1-(2,6-dichloro-4-trifluoromethylphenyl)-5-((naphthalen-1- ylmethylene)-amino)-1H-pyrazole-3-carbonitrile, C~22~H~11~Cl~2~F~3~N~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","421","422","","","","0.71073","MoKα","","0.1283","0.1122","","","0.367","0.3854","","","","","","1.016","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102222","11.9945","0.0019","17.309","0.003","7.4999","0.0012","90","","90","","90","","1557.1","0.4","173","2","173","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","(8S*,9S*,13S*,14R*,17S*)-estra-1(10),2,4,6-tetraene-14,17-diol monohydrate","","- C18 H24 O3 -","- C18 H24 O3 -","- C72 H96 O12 -","4","1","","Wefelscheid, Ulrike K.; Brüdgam, Irene; Hartl, Hans; Reißig, Hans-Ulrich","Crystal structure of (8S*,9S*,13S*,14R*,17S*)-estra-1(10),2,4,6-tetraene- 14,17-diol monohydrate, C~18~H~22~O~2~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","467","468","","","","0.71073","MoKα","","0.0608","0.0438","","","0.1014","0.1096","","","","","","0.979","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102223","9.897","0.002","15.461","0.004","10.407","0.002","90","","99.292","0.003","90","","1571.6","0.6","291","2","291","2","","","","","","","","6","P 1 21 1","P 2yb","4","","tris(ethylenediamine)nickel(II) diperchlorate 2-(4-pyridyl)-4,4,5,5-tetramethylimidazoline-1-oxyl-3-oxide solvate monohydrate","","- C18 H42 Cl2 N9 Ni O11 -","- C18 H42 Cl2 N9 Ni O11 -","- C36 H84 Cl4 N18 Ni2 O22 -","2","1","","Wang, Yu-Fang; Liu, Yuan-Ying","Crystal structure of tris(ethylenediamine)nickel(II) diperchlorate 2-(4-pyridyl)-4,4,5,5-tetramethylimidazoline-1-oxyl-3-oxide solvate monohydrate, [Ni(C~2~H~8~N~2~)~3~][ClO~4~]~2~ · C~12~H~16~N~3~O~2~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","439","441","","","","0.71073","MoKα","","0.0933","0.0728","","","0.1819","0.2037","","","","","","0.995","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102224","12.0407","0.0007","11.8861","0.0006","15.7389","0.0009","90","","93.904","0.001","90","","2247.3","0.2","120","2","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","bis(μ~2~-thiocyanato)tetrakis(3,5-dimethyl-1-(thiocarbamoyl)pyrazole)- dinickel(II) dichloride ethanol disolvate","","- C30 H48 Cl2 N14 Ni2 O2 S6 -","- C30 H48 Cl2 N14 Ni2 O2 S6 -","- C60 H96 Cl4 N28 Ni4 O4 S12 -","2","0.5","","Jacimovic, Zeljko K.; Radovic, Ana; Leovac, Vukadin M.; Tomic, Zoran D.; Radosavljevic Evans, Ivana","Crystal structure of bis(μ~2~-thiocyanato)tetrakis(3,5-dimethyl- 1-(thiocarbamoyl)pyrazole)dinickel(II) dichloride ethanol disolvate, [Ni(NCS)~2~(C~6~H~6~N~3~S)~4~][Cl]~2~ · 2C~2~H~5~OH","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","430","432","","","x-ray","0.71073","MoKα","","","0.032","","","","0.0693","","","","","","0.9095","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102226","10.952","0.002","12.31","0.003","12.553","0.003","81.549","0.003","82.404","0.004","78.348","0.003","1630.3","0.6","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","bis(2,2'-bipyridine)bis(3-iodobenzoate-O,O')tetrakis(μ-(3-iodobenzoate- O,O'))disamarium(III)","","- C31 H20 I3 N2 O6 Sm -","- C62 H40 I6 N4 O12 Sm2 -","- C62 H40 I6 N4 O12 Sm2 -","1","0.5","","Xu, Jin-Sheng; Zhang, Chun-Hua; Kuang, Dai-Zhi; Feng, Yong-Lan","Crystal structure of bis(2,2'-bipyridine)bis(3-iodobenzoate-O,O')tetrakis (μ-3-iodobenzoate-O,O')disamarium(III), Sm~2~(C~10~H~8~N~2~)~2~(C~7~H~4~O~2~I)~6~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","442","444","","","","0.71073","MoKα","","0.0468","0.0329","","","0.0723","0.0793","","","","","","1.04","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102228","19.449","0.004","11.156","0.002","13.09","0.003","90","","110.71","0.03","90","","2656.7","1.1","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-aminopyridinium norcantharidate","","- C13 H16 N2 O5 -","- C13 H16 N2 O5 -","- C104 H128 N16 O40 -","8","1","","Lin, Qiu-Yue; Zhu, Wen-Zhong; Cheng, Jian-Ping; Su, Hong","Crystal structure of 2-aminopyridinium norcantharidate, (C~5~H~7~N~2~) (C~8~H~9~O~5~)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","445","446","","","","0.71073","MoKα","","","0.0369","","","0.0989","0.1047","","","","","","1.064","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102229","7.3721","0.0009","7.3909","0.001","11.574","0.0014","79.584","0.005","77.951","0.006","79.682","0.005","599.98","0.13","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","N-ethoxycarbonyl-N'-p-chlorophenylthiourea","","- C10 H11 Cl N2 O2 S -","- C10 H11 Cl N2 O2 S -","- C20 H22 Cl2 N4 O4 S2 -","2","1","","Zhang, Bin; Xian, Liang; Xiang, Xiao-Ming","Crystal structure of N-ethoxycarbonyl-N'-p-chlorophenyl-thiourea, C~10~H~11~ClN~2~O~2~S","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","447","448","","","","0.71073","MoKα","","0.0463","0.0355","","","0.0875","0.0938","","","","","","1.274","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8102234","11.2453","0.0011","7.1554","0.0007","17.3387","0.0016","90","","101.106","0.001","90","","1369","0.2","273","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2,2'-dipyridylamine)(carbonato)copper(II) trihydrate","","- C11 H15 Cu N3 O6 -","- C11 H15 Cu N3 O6 -","- C44 H60 Cu4 N12 O24 -","4","1","","Qin, Jian-Hua; Kou, Yu-Peng; Zhang, Gui-Ying","Crystal structure of (2,2'-dipyridylamine)(carbonato)copper(II) trihydrate, Cu(CO~3~)(C~10~H~9~N~3~) · 3H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","449","450","","","","0.71073","MoKα","","0.0448","0.03","","","0.0765","0.0797","","","","","","0.991","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102241","9.2513","0.0006","8.4347","0.0005","24.105","0.0015","90","","90","","90","","1881","0.2","291","2","291","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis(1,3,4-thiadiazolium-2-thiolato)lead(II)","","- C4 H2 N4 Pb S4 -","- C4 H2 N4 Pb S4 -","- C32 H16 N32 Pb8 S32 -","8","1","","Qin, Jian-Hua; Hu, Pu-Zhou; Wang, Jian-Ge; Zhao, Bang-Tun","Crystal structure of poly-bis(1,3,4-thiadiazolium-2-thiolato)lead (II), Pb(C~2~HN~2~S~2~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","451","452","","","","0.71073","MoKα","","0.0176","0.0153","","","0.0346","0.0356","","","","","","1.055","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102243","12.7872","0.001","18.713","0.0014","28.391","0.002","90","","102.55","0.001","90","","6631.3","0.9","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-diaquasesqui(1,3-bis(4-pyridyl)propane)cobalt(II) diperchlorate 1,3-bis(4-pyridyl)propane trisolvate monohydrate","","- C65 H76 Cl2 Co N10 O11 -","- C65 H76 Cl2 Co N10 O11 -","- C260 H304 Cl8 Co4 N40 O44 -","4","0.5","","Qin, Jian-Hua; Zhao, Shi-Ju; Wang, Jian-Ge; Zhao, Bang-Tun","Crystal structure of catena-diaquabis(1,3-bis(4-pyridyl)-propane)cobalt (II) diperchlorate - 1,3-bis(4-pyridyl)-propane - water (1:3:1), [Co(C~13~H~14~N~2~)~2~(H~2~O)~2~][ClO~4~]~2~ · 3C~13~H~14~N~2~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","455","457","","","","0.71073","MoKα","","0.057","0.0451","","","0.1168","0.1257","","","","","","1.027","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8102963","6.533","0.001","6.533","0.001","5.32","0.002","90","","90","","90","","227.06","0.1","295","2","295","2","","","","","","","","2","I 4/m c m","-I 4 2c","140","iron distannide","iron distannide","","- Fe Sn2 -","- Fe Sn2 -","- Fe4 Sn8 -","4","0.125","","Armbrüster, M.; Schmidt, M.; Cardoso-Gil, R.; Borrmann, H.; Grin, Yu.","Crystal structures of iron distannide, FeSn~2~, and cobalt distannide, CoSn~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","83","84","","","","0.71073","Molybdenum","","0.0286","0.0286","","","0.0683","0.0683","","","","","","1.167","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102964","10.275","0.001","10.275","0.001","10.275","0.001","90","","90","","90","","1084.79","0.18","","","","","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","","","- Ba6 Na2 Si46 -","- Ba6 Na2 Si46 -","- Ba6 Na2 Si46 -","1","0.0208333","","Baitinger, M.; von Schnering, H. G.; Chang, J.-H.; Peters, K.; Grin, Yu.","Crystal structure of sodium barium silicide (2:6:46), Na~2~Ba~6~Si~46~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","87","88","","","x-ray","0.71073","MoKα","","","0.036","","","0.0281","","","","","1.39","1.39","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102965","6.641","0.0013","6.8341","0.0014","19.554","0.004","90","","99.22","0.03","90","","876","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","distrontium manganese tetraoxophosphate heptaoxodiphosphate","","- Mn O11 P3 Sr2 -","- Mn O11 P3 Sr2 -","- Mn4 O44 P12 Sr8 -","4","1","","Dogan, L.; Emirdag-Eanes, M.","Crystal structure of distrontium manganese(III) tetraoxophosphate heptaoxodiphosphate, Sr~2~Mn[PO~4~][P~2~O~7~]","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","89","90","","","","0.71073","MoKα","","0.052","0.051","","","0.0901","0.0904","","","","","","1.416","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102966","10.022","0.002","5.2875","0.0011","7.1714","0.0014","90","","90","","90","","380.02","0.13","153","2","152","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","lead vanadium oxychloride","","- Cl O3 Pb V -","- Cl O3 Pb V -","- Cl4 O12 Pb4 V4 -","4","0.5","","Sahin, Aytac; Emirdag-Eanes, Mehtap","Crystal structure of lead(II) trioxovanadate(V) chloride, Pb[VO~3~] Cl","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","159","160","","","","0.71073","MoKα","","0.0359","0.035","","","0.104","0.1049","","","","","","1.155","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102967","6.479","0.001","6.11","0.001","10.741","0.002","90","","103.61","0.03","90","","413.26","0.13","293","2","293","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","rubidium zinc bis(hydrogenselenate(IV)) chloride","","- Cl H2 O6 Rb Se2 Zn -","- Cl H2 O6 Rb Se2 Zn -","- Cl2 H4 O12 Rb2 Se4 Zn2 -","2","0.5","","Spirovski, F.; Wagener, M.; Stefov, V.; Engelen, B.","Crystal structures of rubidium zinc bis(hydrogenselenate(IV)) chloride, RbZn(HSeO~3~)~2~Cl, and rubidium zinc bis(hydrogenselenate(IV)) bromide, RbZn(HSeO~3~)~2~Br","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","2","91","92","","","","0.71069","MoKα","","0.0305","0.0245","","","0.0513","0.0528","","","","","","1.087","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102968","6.4609","0.0012","7.0308","0.0014","9.584","0.0017","108.84","0.02","90.89","0.02","116.16","0.02","363.38","0.15","215","2","215","2","","","","","","","","2","P -1","-P 1","2","","niobium pentabromide","","- Br5 Nb -","- Br5 Nb -","- Br10 Nb2 -","2","1","","Tragl, Sonja; Meyer, Hans-Jürgen","Crystal structure of niobium pentabromide, NbBr~5~, a triclinic phase","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","161","162","","","","0.71073","MoKα","","0.0444","0.036","","","0.0842","0.0862","","","","","","1.007","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102969","5.7529","0.0006","5.7537","0.0006","26.866","0.004","90","","90","","120","","770.14","0.16","293","2","295.15","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- As2 K4 Zn -","- As2 K4 Zn -","- As6 K12 Zn3 -","3","0.0833333","","Prots, Yurii; Aydemir, Umut; Öztürk, Sinan S.; Somer, Mehmet","Crystal structure of tetrapotassium diarsenidozincate, K~4~ZnAs~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","163","164","","","","0.71073","MoKα","","0.05","0.04","","","0.084","0.092","","","","","","1.142","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102970","8.0767","0.0001","8.0767","0.0001","12.14011","0.00016","90","","90","","90","","791.937","0.017","295","","","","","","","","","","","3","P 4/n c c :2","-P 4a 2ac","130","","pentacalcium bis[dinitridocobaltate(I)]","","- Ca5 Co2 N4 -","- Ca5 Co2 N4 -","- Ca20 Co8 N16 -","4","0.25","","Bendyna, Joanna K.; Höhn, Peter; Kniep, Rüdiger","Crystal structure of pentacalcium bis(dinitridocobaltate(I)), Ca~5~ [CoN~2~]~2~, and a note on ""Ca~3~CoN~3~""","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","165","166","","powder diffraction","","","X-ray","","","","","","","","","6.2486","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102971","8.3422","0.0003","8.3422","0.0003","12.2201","0.0008","90","","90","","90","","850.42","0.07","295","2","295","2","","","","","","","","4","P 4/n c c :2","-P 4a 2ac","130","barium tetracalcium bis[dinitridocobaltate(I)]","barium tetracalcium bis[dinitridocobaltate(I)]","","- Ba0.5 Ca2 Co N2 -","- Ba0.5 Ca2 Co N2 -","- Ba4 Ca16 Co8 N16 -","8","0.5","","Bendyna, Joanna K.; Höhn, Peter; Prots, Yurii; Kniep, Rüdiger","Crystal structure of barium tetracalcium bis(dinitridocobaltate(I)), BaCa~4~[CoN~2~]~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","167","168","","","","0.7107","MoKα","","0.0261","0.0257","","","0.0483","0.0484","","","","","","1.398","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102972","3.9965","0.0004","3.9965","0.0004","15.82","0.002","90","","90","","120","","218.82","0.04","293","2","293","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","trinickel tin ditelluride","","- Ni3 Sn Te2 -","- Ni2.867 Sn1.007 Te2 -","- Ni5.734 Sn2.014 Te4 -","2","0.0833333","","Deiseroth, Hans-Jörg; Spirovski, Filip; Reiner, Christof; Schlosser, Marc","Crystal structure of trinickel tin ditelluride, Ni~3-x~SnTe~2~ (x = 0.13)","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","169","170","","","","0.71073","MoKα","","0.0353","0.0315","","","0.0704","0.0723","","","","","","1.268","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102973","3.6117","0.0004","3.6117","0.0004","18.281","0.003","90","","90","","90","","238.46","0.05","293","2","293","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","nickel germanium sellenide","","- Ge Ni5 Se2 -","- Ge Ni5.448 Se2 -","- Ge2 Ni10.896 Se4 -","2","0.0625","","Deiseroth, Hans-Jörg; Spirovski, Filip; Reiner, Christof; Schlosser, Marc","Crystal structures of nickel germanium selenide, Ni~5.45~GeSe~2~, and nickel germanium telluride, Ni~5.45~GeTe~2~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","171","172","","","","0.71073","MoKα","","0.0531","0.051","","","0.0714","0.0778","","","","","","1.275","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102974","6.603","0.0004","6.603","0.0004","3.6998","0.0003","90","","90","","120","","139.698","0.016","293","2","295.15","","","","","","","","","3","P -6 2 m","P -6 -2","189","","","","- Ge Pd Ti -","- Ge Pd Ti -","- Ge3 Pd3 Ti3 -","3","0.25","","Demchyna, Roman; Prots, Yurii; Schwarz, Ulrich","Crystal structures of titanium palladium germanium, TiPdGe, two polymorphic modifications","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","173","174","","","","0.7107","MoKα","","","0.022","","","","0.045","","","","","","1.04","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102975","15.888","0.002","15.888","0.002","21.014","0.003","90","","90","","90","","5304.5","1.2","153","2","153","2","","","","","","","","3","I 41/a c d :2","-I 4bd 2c","142","decalanthanum oxide tetradecaselenide","decalanthanum monooxide tetradecaselenide","","- La10 O Se14 -","- La10 O Se14 -","- La80 O8 Se112 -","8","0.25","","Wu, Li-Bin; Huang, Fu-Qiang","Refinement of the crystal structure of decalanthanum monooxide tetradecaselenide, La~10~OSe~14~, at 153 K","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","175","176","","","","0.71073","MoKα","","0.0242","0.02","","","0.0425","0.0439","","","","","","1.111","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102976","9.9702","0.0003","9.9702","0.0003","9.9702","0.0003","90","","90","","90","","991.09","0.05","295","2","295","2","","","","","","","","3","P m -3","-P 2 2 3","200","silicon-phosphorus telluride","silicon-phosphorus telluride","","- P14.7 Si31.3 Te7.35 -","- P14.7 Si31.3 Te7.3472 -","- P14.7 Si31.3 Te7.3472 -","1","0.0416667","","Zaikina, Julia V.; Kovnir, Kirill A.; Schwarz, Ulrich; Borrmann, Horst; Shevelkov, Andrei V.","Crystal structure of silicon phosphorus telluride, Si~46-x~P~x~Te~y~ (y = 7.35, 6.98, 6.88; x ≤ 2y), a cationic clathrate-I","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","3","177","180","","","","0.5608","AgKα","","0.0173","0.016","","","0.0363","0.0366","","","","","","1.319","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102977","10.013","0.001","10.013","0.001","10.013","0.001","90","","90","","90","","1003.91","0.17","295","2","295","2","","","","","","","","5","I m -3","-I 2 2 3","204","","potassium lead bismuth oxide hydrate (1.09/0.07/0.93/3/0.17)","","- Bi0.93 H0.33 K1.09 O3.17 Pb0.07 -","- Bi0.93 K1.09 O3.16667 Pb0.07 -","- Bi11.16 K13.08 O38 Pb0.84 -","12","0.25","","Poleti, Dejan; Karanovic, Ljiljana; Djordjevic, Tamara; Hadzi-Tonic, Aleksandra","Crystal structure of potassium lead bismuth oxide hydrate, K~1.09~ (Bi~0.93~Pb~0.07~)O~3~ · 1/6H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","365","366","","","","0.71069","MoKα","","0.011","0.01","","","0.023","0.023","","","","","","1.22","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8102978","11.9771","0.0005","8.7826","0.0004","17.5237","0.0007","90","","90","","90","","1843.32","0.14","293","1","293","1","","","","","","","","4","P b c n","-P 2n 2ab","60","","alpha antimony dimercury tetrachloroaluminate","","- Al Cl4 Hg2 Sb -","- Al Cl4 Hg2 Sb -","- Al8 Cl32 Hg16 Sb8 -","8","1","","Schlirf, Jens; Deiseroth, Hans-Jörg","Crystal structures of α-and β-antimony dimercury tetrachloroaluminate, SbHg~2~AlCl~4~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","367","368","","","x-ray","0.71073","MoKα","","0.0566","0.0429","","","0.0929","0.0977","","","","","","1.103","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8102979","3.70841","0.00005","3.70841","0.00005","8.0496","0.0001","90","","90","","90","","110.701","0.003","295","2","295","2","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","hafnium arsenide selenide","","- As1.69 Hf Se0.21 -","- As1.69 Hf Se0.21 -","- As3.38 Hf2 Se0.42 -","2","0.125","","Schlechte, Andreas; Niewa, Rainer; Borrmann, Horst; Auffermann, Gudrun; Schmidt, Marcus; Kniep, Rüdiger","Crystal structure of hafnium arsenide selenide, HfAs~1.69~Se~0.21~","Zeitschrift für Kristallographie - New Crystal Structures","2007","222","4","369","370","","","","0.5608","AgKα","","0.03","0.022","","","0.035","0.04","","","","","","1.197","","","","has coordinates","176466","2020-10-21","18:00:00",""
"9010139","8.0883","","8.0883","","8.0883","","90","","90","","90","","529.141","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.992 Mg0.994 Mn0.015 O4 -","- Al15.936 Mg7.952 Mn0.12 O32 -","- Al15.936 Mg7.952 Mn0.12 O32 -","","","","Bosi, F.; Halenius, U.; Andreozzi, G. B.; Skogby, H.; Lucchesi, S.","Structural refinement and crystal chemistry of Mn-doped spinel: A case for tetrahedrally coordinated Mn3+ in an oxygen-based structure Sample: MgMn01","American Mineralogist","2007","92","","27","33","10.2138/am.2007.2266","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:23",""
"9010140","8.0965","","8.0965","","8.0965","","90","","90","","90","","530.752","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.972 Mg0.966 Mn0.063 O4 -","- Al15.776 Mg7.728 Mn0.504 O32 -","- Al15.776 Mg7.728 Mn0.504 O32 -","","","","Bosi, F.; Halenius, U.; Andreozzi, G. B.; Skogby, H.; Lucchesi, S.","Structural refinement and crystal chemistry of Mn-doped spinel: A case for tetrahedrally coordinated Mn3+ in an oxygen-based structure Sample: MgMn05","American Mineralogist","2007","92","","27","33","10.2138/am.2007.2266","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:23",""
"9010141","8.1321","","8.1321","","8.1321","","90","","90","","90","","537.784","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.808 Mg0.887 Mn0.304 O4 -","- Al14.464 Mg7.096 Mn2.432 O32 -","- Al14.464 Mg7.096 Mn2.432 O32 -","","","","Bosi, F.; Halenius, U.; Andreozzi, G. B.; Skogby, H.; Lucchesi, S.","Structural refinement and crystal chemistry of Mn-doped spinel: A case for tetrahedrally coordinated Mn3+ in an oxygen-based structure Sample: MgMn10","American Mineralogist","2007","92","","27","33","10.2138/am.2007.2266","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:23",""
"9010142","8.1413","","8.1413","","8.1413","","90","","90","","90","","539.612","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.75 Mg0.899 Mn0.351 O4 -","- Al14 Mg7.192 Mn2.808 O32 -","- Al14 Mg7.192 Mn2.808 O32 -","","","","Bosi, F.; Halenius, U.; Andreozzi, G. B.; Skogby, H.; Lucchesi, S.","Structural refinement and crystal chemistry of Mn-doped spinel: A case for tetrahedrally coordinated Mn3+ in an oxygen-based structure Sample: MgMn20","American Mineralogist","2007","92","","27","33","10.2138/am.2007.2266","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:23",""
"9010143","7.14","","12.371","","7.175","","90","","120.34","","90","","546.962","","","","","","","","","","","","Yangkou meta-igneous complex in the middle part of the Sulu UHP terrain, eastern China","2","C 1 2/c 1","-C 2yc","15","","","Coesite","- O2 Si -","- O32 Si16 -","- O32 Si16 -","","","","Ikuta, D.; Kawame, N.; Banno, S.; Hirajima, T.; Ito, K.; Rakovan, J. F.; Downs, R. T.; Tamada, O.","First in situ X-ray diffraction identification of coesite and retrograde quartz on a glass thin section of an ultrahigh-pressure metamorphic rock and their crystal structure details Locality: Yangkou meta-igneous complex in the middle part of the Sulu UHP terrain, eastern China Note: Sample is on a thin section","American Mineralogist","2007","92","","57","63","10.2138/am.2007.2228","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:23",""
"9010144","4.923","","4.923","","5.409","","90","","90","","120","","113.529","","","","","","","","","","","","Yangkou meta-igneous complex in the middle part of the Sulu UHP terrain, eastern China","2","P 32 2 1","","","","","Quartz","- O2 Si -","- O6 Si3 -","- O6 Si3 -","","","","Ikuta, D.; Kawame, N.; Banno, S.; Hirajima, T.; Ito, K.; Rakovan, J. F.; Downs, R. T.; Tamada, O.","First in situ X-ray diffraction identification of coesite and retrograde quartz on a glass thin section of an ultrahigh-pressure metamorphic rock and their crystal structure details Locality: Yangkou meta-igneous complex in the middle part of the Sulu UHP terrain, eastern China Note: Sample is on a thin section","American Mineralogist","2007","92","","57","63","10.2138/am.2007.2228","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:23",""
"9010145","4.918","","4.918","","5.407","","90","","90","","120","","113.257","","","","","","","","","","","","Oomine granite, Tenkawa-mura, Nara, Southwest Japan","2","P 32 2 1","","","","","Quartz","- O2 Si -","- O6 Si3 -","- O6 Si3 -","","","","Ikuta, D.; Kawame, N.; Banno, S.; Hirajima, T.; Ito, K.; Rakovan, J. F.; Downs, R. T.; Tamada, O.","First in situ X-ray diffraction identification of coesite and retrograde quartz on a glass thin section of an ultrahigh-pressure metamorphic rock and their crystal structure details Locality: Oomine granite, Tenkawa-mura, Nara, Southwest Japan Sample: in air","American Mineralogist","2007","92","","57","63","10.2138/am.2007.2228","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:23",""
"9010146","4.917","","4.917","","5.41","","90","","90","","120","","113.273","","","","","","","","","","","","Oomine granite, Tenkawa-mura, Nara, Southwest Japan","2","P 32 2 1","","","","","Quartz","- O2 Si -","- O6 Si3 -","- O6 Si3 -","","","","Ikuta, D.; Kawame, N.; Banno, S.; Hirajima, T.; Ito, K.; Rakovan, J. F.; Downs, R. T.; Tamada, O.","First in situ X-ray diffraction identification of coesite and retrograde quartz on a glass thin section of an ultrahigh-pressure metamorphic rock and their crystal structure details Locality: Oomine granite, Tenkawa-mura, Nara, Southwest Japan Sample: in a thin section","American Mineralogist","2007","92","","57","63","10.2138/am.2007.2228","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:23",""
"9010147","10.394","","10.777","","8.896","","105.953","","96.294","","124.948","","738.874","","","","","","","","","","","","","10","P 1","P 1","1","","","Welshite","- Al1.71 As0.27 Be3.33 Ca3.78 Fe0.96 Mg7.87 Mn1.35 O40 Sb3 Si5.73 -","- Al1.71 As0.27 Be3.33 Ca3.78 Fe0.96 Mg7.87 Mn1.35 O40 Sb3 Si5.73 -","- Al1.71 As0.27 Be3.33 Ca3.78 Fe0.96 Mg7.87 Mn1.35 O40 Sb3 Si5.73 -","","","","Grew, E. S.; Barbier, J.; Britten, J.; Halenius, U.; Shearer, C. K.","The crystal chemistry of welshite, a non-centrosymmetric (P1) aenigmatite- sapphirine-surinamite group mineral","American Mineralogist","2007","92","","80","90","10.2138/am.2007.2250","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:23",""
"9010148","13.405","","27.016","","5.275","","90","","90","","90","","1910.34","","","","","","","","","","","","Durango, Mexico","4","P n c n","-P 2ab 2n","52","","","Sepiolite","- H8.48 Mg4 O22.91 Si6 -","- H13.82 Mg4 O22.91 Si6 -","- H55.28 Mg16 O91.64 Si24 -","4","0.5","","Post, J. E.; Bish, D. L.; Heaney, P. J.","Synchrotron powder X-ray diffraction study of the structure and dehydration behavior of sepiolite Sample: T = room temperature, in air","American Mineralogist","2007","92","","91","97","10.2138/am.2007.2134","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010149","23.446","","11.352","","5.2782","","90","","89.06","","90","","1404.65","","","","742","","","","","","","","Durango, Mexico","4","P 1 21/n 1","-P 2yn","14","","","Sepiolite","- H2 Mg2 O9 Si3 -","- H2 Mg2 O9 Si3 -","- H16 Mg16 O72 Si24 -","8","2","","Post, J. E.; Bish, D. L.; Heaney, P. J.","Synchrotron powder X-ray diffraction study of the structure and dehydration behavior of sepiolite Sample: T = 742 K","American Mineralogist","2007","92","","91","97","10.2138/am.2007.2134","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010150","8.9575","","6.4238","","9.7912","","90","","96.032","","90","","560.278","","","","","","","","","","","","Tooele County, Utah","5","C 1 2/m 1","-C 2y","12","","","Tooeleite","- As2 Fe3 H6 O12.6 S0.65 -","- As2 Fe3 H6 O12.6 S0.65 -","- As4 Fe6 H12 O25.2 S1.3 -","2","0.25","","Morin, G.; Rousse, G.; Elkaim, E.","Crystal structure of tooeleite, Fe6(AsO3)4SO4(OH)4 * 4H2O, a new iron arsenite oxyhydroxysulfate mineral relevant of acid mine drainage Locality: Tooele County, Utah","American Mineralogist","2007","92","","193","197","10.2138/am.2007.2361","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010151","9.15","","9.15","","9.745","","90","","90","","120","","706.569","","","","","","","","","","","","Apuan Alps, Tuscany, Italy","5","P -3","-P 3","147","","","Cualstibite","- Al Cu2 H12 O12 Sb -","- Al3 Cu6 H36 O36 Sb3 -","- Al3 Cu6 H36 O36 Sb3 -","","","","Bonaccorsi, E.; Merlino, S.; Orlandi, P.","Zincalstibite, a new mineral, and cualstibite: Crystal chemical and structural relationships","American Mineralogist","2007","92","","198","203","10.2138/am.2007.2240","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:23",""
"9010152","5.327","","5.327","","9.792","","90","","90","","120","","240.64","","","","","","","","","","","","Lucchetti marble quarry, Fantiscritti marble basin, Carrara, Apuan","5","P -3","-P 3","147","","","Zincalstibite","- Al1.01 H12 O12 Sb Zn1.99 -","- Al1.01 H12 O12 Sb Zn1.99 -","- Al1.01 H12 O12 Sb Zn1.99 -","","","","Bonaccorsi, E.; Merlino, S.; Orlandi, P.","Zincalstibite, a new mineral, and cualstibite: Crystal chemical and structural relationships Locality: Lucchetti marble quarry, Fantiscritti marble basin, Carrara, Apuan Alps, Tuscany, Italy","American Mineralogist","2007","92","","198","203","10.2138/am.2007.2240","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:23",""
"9010153","5.1717","","5.1717","","5.1717","","90","","90","","90","","138.325","","","","","","","","","","","","Zaklodzie enstatite achondrite meteorite","7","F m -3 m","-F 4 2 3","225","","","Keilite","- Ca0.017 Cr0.019 Fe0.437 Mg0.16 Mn0.356 S Zn0.001 -","- Ca0.068 Cr0.076 Fe1.748 Mg0.64 Mn1.424 S4 Zn0.004 -","- Ca0.068 Cr0.076 Fe1.748 Mg0.64 Mn1.424 S4 Zn0.004 -","","","","Karwowski, L.; Kryza, R.; Przylibski, T. A.","New chemical and physical data on keilite from the Zaklodzie enstatite achondrite Locality: Zaklodzie enstatite achondrite meteorite","American Mineralogist","2007","92","","204","209","10.2138/am.2007.2133","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010154","18.259","","8.883","","5.271","","90","","90","","90","","854.928","","","","","","","","","","","","Synthetic","5","P b c a","-P 2ac 2ab","61","","","","- Li0.52 Mg0.96 O6 Sc0.52 Si2 -","- Li4.16 Mg7.68 O48 Sc4.16 Si16 -","- Li4.16 Mg7.68 O48 Sc4.16 Si16 -","","","","Yang, H.; Downs, R. T.","Synthesis and crystal structure of Li0.52Mg0.96Sc0.52Si2O6 orthopyroxene","American Mineralogist","2007","92","","225","228","10.2138/am.2007.2439","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010155","5.178","","2.8509","","7.3344","","89.45","","103.18","","89.91","","105.412","","","","","","","","","","","","Synthetic","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Birnessite","- H4 Mn Na0.29 O2.691 -","- H1.3812 Mn Na0.29 O2.6906 -","- H2.7624 Mn2 Na0.58 O5.3812 -","2","","","Lopano, C. L.; Heaney, P. J.; Post, J. E.; Hanson, J.; Komarneni, S.","Time-resolved structural analysis of K-and Ba-exchange reactions with synthetic Na-birnessite using synchrotron X-ray diffraction Locality: synthetic Sample: Na-birnessite","American Mineralogist","2007","92","","380","387","10.2138/am.2007.2242","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:45",""
"9010156","5.1371","","2.8476","","7.2131","","89.96","","100.75","","89.702","","103.663","","","","","","","","","","","","Synthetic","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Birnessite","- H4 K0.23 Mn O2.776 -","- H1.552 K0.23 Mn O2.776 -","- H3.104 K0.46 Mn2 O5.552 -","2","","","Lopano, C. L.; Heaney, P. J.; Post, J. E.; Hanson, J.; Komarneni, S.","Time-resolved structural analysis of K-and Ba-exchange reactions with synthetic Na-birnessite using synchrotron X-ray diffraction Locality: synthetic Sample: K-birnessite","American Mineralogist","2007","92","","380","387","10.2138/am.2007.2242","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010157","5.1711","","2.8476","","7.3076","","89.516","","102.957","","89.897","","104.862","","","","","","","","","","","","Synthetic","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","","- Ba0.145 H4 Mn O2.444 -","- Ba0.145 H0.888 Mn O2.444 -","- Ba0.29 H1.776 Mn2 O4.888 -","2","","","Lopano, C. L.; Heaney, P. J.; Post, J. E.; Hanson, J.; Komarneni, S.","Time-resolved structural analysis of K-and Ba-exchange reactions with synthetic Na-birnessite using synchrotron X-ray diffraction Locality: synthetic Sample: Ba-birnessite","American Mineralogist","2007","92","","380","387","10.2138/am.2007.2242","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010158","3.081","","3.081","","15.1248","","90","","90","","120","","124.338","","","","","","","","","","","","150 km NW from Izmir, Turkey","2","P 63 m c","P 6c -2c","186","","","Moissanite","- C Si -","- C6 Si6 -","- C6 Si6 -","","","","Capitani, G. C.; Di Pierro, S.; Tempesta, G.","The 6H-SiC structure model: Further refinement from SCXRD data from a terrestrial moissanite","American Mineralogist","2007","92","","403","407","10.2138/am.2007.2346","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010159","7.552","","7.6872","","2.8843","","90","","90","","90","","167.444","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","Mullite","- Al2.28 O4.86 Si0.72 -","- Al2.28 O4.86 Si0.72 -","- Al4.56 O9.72 Si1.44 -","2","0.25","","Popović, J.; Tkalčec, E.; Gržeta, B.; Kurajica, S.; Schmauch, J.","Cobalt incorporation in mullite Sample: MU0","American Mineralogist","2007","92","","408","411","10.2138/am.2007.2114","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9010160","7.5618","","7.6882","","2.886","","90","","90","","90","","167.782","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","","Mullite","- Al2.25 Co0.015 O4.86 Si0.735 -","- Al2.25 Co0.015 O4.86 Si0.735 -","- Al4.5 Co0.03 O9.72 Si1.47 -","2","0.25","","Popovic, J.; Tkalcec, E.; Grzeta, B.; Kurajica, S.; Schmauch, J.","Cobalt incorporation in mullite Sample: MU1","American Mineralogist","2007","92","","408","411","10.2138/am.2007.2114","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:08",""
"9010161","17.333","","23.539","","13.4895","","90","","115.069","","90","","4985.27","","","","","","","","","","","","Khibiny alkaline massif, Kola Peninsula, Russia","6","C 1 2/m 1","-C 2y","12","","","Armbrusterite","- H46 K5 Mn15 Na6 O104.02 Si36 -","- H22.04 K5 Mn15 Na6 O104.02 Si36 -","- H44.08 K10 Mn30 Na12 O208.04 Si72 -","2","0.25","","Yakovenchuk, V. N.; Krivovichev, S. K.; Pakhomovsky, Y. A.; Ivanyuk, G. Y.; Selivanova, E. A.; Men'shikov, Y. P.; Britvin, S. N.","Armbrusterite, K5Na6Mn3+Mn2+14[Si9O22]4(OH)10*4H2O, a new Mn hydrous heterophyllosilicate from the Khibiny alkaline massif, Kola Peninsula, Russia","American Mineralogist","2007","92","","416","423","10.2138/am.2007.2200","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010162","7.306","","8.268","","5.714","","90","","90","","90","","345.16","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","","","- Ca Ge2 O5 -","- Ca4 Ge8 O20 -","- Ca4 Ge8 O20 -","","","","Nemeth, P.; Leinenweber, K.; Groy, T. L.; Buseck, P. R.","A new high-pressure CaGe2O5 polymorph with 5- and 6-coordinated germanium","American Mineralogist","2007","92","","441","443","10.2138/am.2007.2411","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010163","5.3363","","9.24","","14.37","","90","","96.93","","90","","703.371","","","","","","","","100","","","","Alpe Raguzzolo, Val Malenco, Italy","6","C 1 2/m 1","-C 2y","12","","","Chlorite","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al3.46 Fe1.02 H16 Mg9.168 O36 Si6.352 -","4","0.5","","Zanazzi, P. F.; Montagnoli, M.; Nazzareni, S.; Comodi, P.","Structural effects of pressure on monoclinic chlorite: a single-crystal study","American Mineralogist","2007","92","","655","661","10.2138/am.2007.2341","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010164","5.327","","9.227","","14.23","","90","","96.9","","90","","694.37","","","","","","","","770000","","","","Alpe Raguzzolo, Val Malenco, Italy","6","C 1 2/m 1","-C 2y","12","","","Chlorite","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al3.46 Fe1.02 H16 Mg9.168 O36 Si6.352 -","4","0.5","","Zanazzi, P. F.; Montagnoli, M.; Nazzareni, S.; Comodi, P.","Structural effects of pressure on monoclinic chlorite: a single-crystal study","American Mineralogist","2007","92","","655","661","10.2138/am.2007.2341","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010165","5.304","","9.19","","14.2","","90","","96.9","","90","","687.148","","","","","","","","1520000","","","","Alpe Raguzzolo, Val Malenco, Italy","6","C 1 2/m 1","-C 2y","12","","","Chlorite","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al3.46 Fe1.02 H16 Mg9.168 O36 Si6.352 -","4","0.5","","Zanazzi, P. F.; Montagnoli, M.; Nazzareni, S.; Comodi, P.","Structural effects of pressure on monoclinic chlorite: a single-crystal study","American Mineralogist","2007","92","","655","661","10.2138/am.2007.2341","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010166","5.293","","9.168","","14.19","","90","","96.79","","90","","683.757","","","","","","","","2280000","","","","Alpe Raguzzolo, Val Malenco, Italy","6","C 1 2/m 1","-C 2y","12","","","Chlorite","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al3.46 Fe1.02 H16 Mg9.168 O36 Si6.352 -","4","0.5","","Zanazzi, P. F.; Montagnoli, M.; Nazzareni, S.; Comodi, P.","Structural effects of pressure on monoclinic chlorite: a single-crystal study","American Mineralogist","2007","92","","655","661","10.2138/am.2007.2341","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010167","5.27","","9.132","","14.11","","90","","96.77","","90","","674.318","","","","","","","","3660000","","","","Alpe Raguzzolo, Val Malenco, Italy","6","C 1 2/m 1","-C 2y","12","","","Chlorite","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al3.46 Fe1.02 H16 Mg9.168 O36 Si6.352 -","4","0.5","","Zanazzi, P. F.; Montagnoli, M.; Nazzareni, S.; Comodi, P.","Structural effects of pressure on monoclinic chlorite: a single-crystal study","American Mineralogist","2007","92","","655","661","10.2138/am.2007.2341","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010168","5.252","","9.103","","14.08","","90","","96.71","","90","","668.539","","","","","","","","4520000","","","","Alpe Raguzzolo, Val Malenco, Italy","6","C 1 2/m 1","-C 2y","12","","","Chlorite","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al3.46 Fe1.02 H16 Mg9.168 O36 Si6.352 -","4","0.5","","Zanazzi, P. F.; Montagnoli, M.; Nazzareni, S.; Comodi, P.","Structural effects of pressure on monoclinic chlorite: a single-crystal study","American Mineralogist","2007","92","","655","661","10.2138/am.2007.2341","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010169","5.237","","9.078","","14","","90","","96.64","","90","","661.116","","","","","","","","5470000","","","","Alpe Raguzzolo, Val Malenco, Italy","6","C 1 2/m 1","-C 2y","12","","","Chlorite","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al0.865 Fe0.255 H4 Mg2.292 O9 Si1.588 -","- Al3.46 Fe1.02 H16 Mg9.168 O36 Si6.352 -","4","0.5","","Zanazzi, P. F.; Montagnoli, M.; Nazzareni, S.; Comodi, P.","Structural effects of pressure on monoclinic chlorite: a single-crystal study","American Mineralogist","2007","92","","655","661","10.2138/am.2007.2341","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010170","5.3332","","9.2376","","20.069","","90","","95.125","","90","","984.766","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/c 1","-C 2yc","15","","","Phlogopite","- Al1.2 Fe1.11 K0.93 Mg1.5 Na0.07 O12 Si2.8 Ti0.39 -","- Al1.2 Fe1.11 K0.93 Mg1.5 Na0.07 O12 Si2.8 Ti0.39 -","- Al4.8 Fe4.44 K3.72 Mg6 Na0.28 O48 Si11.2 Ti1.56 -","4","0.5","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010171","5.3369","","9.2423","","10.1618","","90","","100.222","","90","","493.277","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.08 Fe1.11 K0.87 Mg1.5 Na0.06 O12 Si2.92 Ti0.39 -","- Al1.08 Fe1.11 K0.87 Mg1.5 Na0.06 O12 Si2.92 Ti0.39 -","- Al2.16 Fe2.22 K1.74 Mg3 Na0.12 O24 Si5.84 Ti0.78 -","2","0.25","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010172","5.3368","","9.2377","","20.086","","90","","95.128","","90","","986.272","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/c 1","-C 2yc","15","","","Phlogopite","- Al1.12 Fe1.11 K0.89 Mg1.5 Na0.07 O12 Si2.88 Ti0.39 -","- Al1.12 Fe1.11 K0.89 Mg1.5 Na0.07 O12 Si2.88 Ti0.39 -","- Al4.48 Fe4.44 K3.56 Mg6 Na0.28 O48 Si11.52 Ti1.56 -","4","0.5","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010173","5.3304","","9.2277","","10.1918","","90","","100.051","","90","","493.614","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al0.94 Fe1.2 K0.9 Mg1.35 Na0.06 O12 Si2.84 Ti0.27 -","- Al0.94 Fe1.2 K0.9 Mg1.35 Na0.06 O12 Si2.84 Ti0.27 -","- Al1.88 Fe2.4 K1.8 Mg2.7 Na0.12 O24 Si5.68 Ti0.54 -","2","0.25","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010174","5.333","","9.244","","10.152","","90","","100.164","","90","","492.622","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.08 Fe1.11 K0.93 Mg1.5 Na0.07 O12 Si2.92 Ti0.39 -","- Al1.08 Fe1.11 K0.93 Mg1.5 Na0.07 O12 Si2.92 Ti0.39 -","- Al2.16 Fe2.22 K1.86 Mg3 Na0.14 O24 Si5.84 Ti0.78 -","2","0.25","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010175","5.3402","","9.2461","","10.1866","","90","","100.138","","90","","495.121","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.32 Fe1.14 K0.94 Mg1.44 Na0.06 O12 Si2.8 Ti0.3 -","- Al1.32 Fe1.14 K0.94 Mg1.44 Na0.06 O12 Si2.8 Ti0.3 -","- Al2.64 Fe2.28 K1.88 Mg2.88 Na0.12 O24 Si5.6 Ti0.6 -","2","0.25","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010176","5.3403","","9.2485","","10.1867","","90","","100.132","","90","","495.273","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.32 Fe1.14 K0.94 Mg1.44 Na0.06 O12 Si2.8 Ti0.3 -","- Al1.32 Fe1.14 K0.94 Mg1.44 Na0.06 O12 Si2.8 Ti0.3 -","- Al2.64 Fe2.28 K1.88 Mg2.88 Na0.12 O24 Si5.6 Ti0.6 -","2","0.25","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010177","5.3314","","9.229","","10.1801","","90","","100.051","","90","","493.209","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.43 Fe1.14 K0.93 Mg1.47 Na0.07 O12 Si2.72 Ti0.24 -","- Al1.43 Fe1.14 K0.93 Mg1.47 Na0.07 O12 Si2.72 Ti0.24 -","- Al2.86 Fe2.28 K1.86 Mg2.94 Na0.14 O24 Si5.44 Ti0.48 -","2","0.25","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010178","5.3207","","9.2099","","10.1034","","90","","99.959","","90","","487.638","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/m 1","-C 2y","12","","","Annite","- Al1.28 Fe1.41 K0.93 Mg1.02 Na0.07 O12 Si2.72 Ti0.46 -","- Al1.28 Fe1.41 K0.93 Mg1.02 Na0.07 O12 Si2.72 Ti0.46 -","- Al2.56 Fe2.82 K1.86 Mg2.04 Na0.14 O24 Si5.44 Ti0.92 -","2","0.25","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010179","5.3216","","9.2114","","10.106","","90","","99.949","","90","","487.94","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/m 1","-C 2y","12","","","Annite","- Al1.34 Fe1.35 K0.92 Mg1.11 Na0.07 O12 Si2.72 Ti0.18 -","- Al1.34 Fe1.35 K0.92 Mg1.11 Na0.07 O12 Si2.72 Ti0.18 -","- Al2.68 Fe2.7 K1.84 Mg2.22 Na0.14 O24 Si5.44 Ti0.36 -","2","0.25","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010180","5.3213","","9.2034","","10.1048","","90","","99.954","","90","","487.424","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/m 1","-C 2y","12","","","Annite","- Al1.34 Fe1.35 K0.92 Mg1.11 Na0.07 O12 Si2.72 Ti0.18 -","- Al1.34 Fe1.35 K0.92 Mg1.11 Na0.07 O12 Si2.72 Ti0.18 -","- Al2.68 Fe2.7 K1.84 Mg2.22 Na0.14 O24 Si5.44 Ti0.36 -","2","0.25","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010181","5.342","","9.2461","","10.1635","","90","","100.219","","90","","494.039","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.12 Fe1.11 K0.93 Mg1.5 Na0.07 O12 Si2.88 Ti0.39 -","- Al1.12 Fe1.11 K0.93 Mg1.5 Na0.07 O12 Si2.88 Ti0.39 -","- Al2.24 Fe2.22 K1.86 Mg3 Na0.14 O24 Si5.76 Ti0.78 -","2","0.25","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010182","5.3408","","9.2497","","10.1633","","90","","100.205","","90","","494.132","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.12 Fe1.14 K0.94 Mg1.5 Na0.06 O12 Si2.88 Ti0.36 -","- Al1.12 Fe1.14 K0.94 Mg1.5 Na0.06 O12 Si2.88 Ti0.36 -","- Al2.24 Fe2.28 K1.88 Mg3 Na0.12 O24 Si5.76 Ti0.72 -","2","0.25","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010183","5.3399","","9.2483","","10.1688","","90","","100.217","","90","","494.223","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.16 Fe1.11 K0.93 Mg1.5 Na0.07 O12 Si2.84 Ti0.39 -","- Al1.16 Fe1.11 K0.93 Mg1.5 Na0.07 O12 Si2.84 Ti0.39 -","- Al2.32 Fe2.22 K1.86 Mg3 Na0.14 O24 Si5.68 Ti0.78 -","2","0.25","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010184","5.3341","","9.2403","","20.085","","90","","95.151","","90","","985.965","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/c 1","-C 2yc","15","","","Phlogopite","- Al1.16 Fe1.11 K0.93 Mg1.5 Na0.07 O12 Si2.84 Ti0.39 -","- Al1.16 Fe1.11 K0.93 Mg1.5 Na0.07 O12 Si2.84 Ti0.39 -","- Al4.64 Fe4.44 K3.72 Mg6 Na0.28 O48 Si11.36 Ti1.56 -","4","0.5","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) 2M_1 polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010185","5.3449","","9.2375","","20.095","","90","","95.143","","90","","988.166","","","","","","","","","","","","Mt. Sassetto, Tolfa district, Latium, Italy","8","C 1 2/c 1","-C 2yc","15","","","Phlogopite","- Al1.27 Fe1.08 K0.93 Mg1.44 Na0.06 O12 Si2.88 Ti0.33 -","- Al1.27 Fe1.08 K0.93 Mg1.44 Na0.06 O12 Si2.88 Ti0.33 -","- Al5.08 Fe4.32 K3.72 Mg5.76 Na0.24 O48 Si11.52 Ti1.32 -","4","0.5","","Laurora, A.; Brigatti, M. F.; Mottana, A.; Malferrari, D.; Caprilli, E.","Crystal chemistry of trioctahedral micas in alkaline and subalkaline volcanic rocks: A case study from Mt. Sassetto (Tolfa district, Latium, central Italy) 2M_1 polytype","American Mineralogist","2007","92","","468","480","10.2138/am.2007.2339","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010186","9.5531","","8.6983","","5.2684","","90","","107.629","","90","","417.222","","","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ga Na O6 Si2 -","- Ga4 Na4 O24 Si8 -","- Ga4 Na4 O24 Si8 -","","","","Nestola, F.; Rotiroti, N.; Bruno, M.; Tribaudino, M.; van Smaalen, S.; Ohashi, H.; Redhammer, G. J.","Low-temperature behavior of NaGaSi2O6 Sample: T = 295 K","American Mineralogist","2007","92","","560","569","10.2138/am.2007.2304","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010187","9.5494","","8.6924","","5.2673","","90","","107.631","","90","","416.686","","","","235","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ga Na O6 Si2 -","- Ga4 Na4 O24 Si8 -","- Ga4 Na4 O24 Si8 -","","","","Nestola, F.; Rotiroti, N.; Bruno, M.; Tribaudino, M.; van Smaalen, S.; Ohashi, H.; Redhammer, G. J.","Low-temperature behavior of NaGaSi2O6 Sample: T = 235 K","American Mineralogist","2007","92","","560","569","10.2138/am.2007.2304","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010188","9.5472","","8.6894","","5.2667","","90","","107.632","","90","","416.397","","","","190","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ga Na O6 Si2 -","- Ga4 Na4 O24 Si8 -","- Ga4 Na4 O24 Si8 -","","","","Nestola, F.; Rotiroti, N.; Bruno, M.; Tribaudino, M.; van Smaalen, S.; Ohashi, H.; Redhammer, G. J.","Low-temperature behavior of NaGaSi2O6 Sample: T = 190 K","American Mineralogist","2007","92","","560","569","10.2138/am.2007.2304","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010189","9.5453","","8.6864","","5.2662","","90","","107.63","","90","","416.135","","","","145","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ga Na O6 Si2 -","- Ga4 Na4 O24 Si8 -","- Ga4 Na4 O24 Si8 -","","","","Nestola, F.; Rotiroti, N.; Bruno, M.; Tribaudino, M.; van Smaalen, S.; Ohashi, H.; Redhammer, G. J.","Low-temperature behavior of NaGaSi2O6 Sample: T = 145 K","American Mineralogist","2007","92","","560","569","10.2138/am.2007.2304","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010190","9.5442","","8.6849","","5.2662","","90","","107.628","","90","","416.02","","","","110","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ga Na O6 Si2 -","- Ga4 Na4 O24 Si8 -","- Ga4 Na4 O24 Si8 -","","","","Nestola, F.; Rotiroti, N.; Bruno, M.; Tribaudino, M.; van Smaalen, S.; Ohashi, H.; Redhammer, G. J.","Low-temperature behavior of NaGaSi2O6 Sample: T = 110 K","American Mineralogist","2007","92","","560","569","10.2138/am.2007.2304","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010191","19.352","","10.166","","8.697","","90","","90","","90","","1710.98","","","","","","","","","","","","","2","P c c n","-P 2ab 2ac","56","","","","- As4 S4.93 -","- As32 S39.44 -","- As32 S39.44 -","","","","Bindi, L.; Bonazzi, P.","Light-induced alteration of arsenic sulfides: A new product having an orthorhombic crystal structure","American Mineralogist","2007","92","","617","620","10.2138/am.2007.2332","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010192","5.3002","","5.3002","","19.2351","","90","","90","","120","","467.961","","","","","","","","27900000","","","","","3","R -3 m :H","-R 3 2""","166","","","","- Ba O3 Si -","- Ba9 O27 Si9 -","- Ba9 O27 Si9 -","","","","Yusa, H.; Sata, N.; Ohishi, Y.","Rhombohedral (9R) and hexagonal (6H) perovskites in barium silicates under high pressure Sample: P = 27.9 GPa","American Mineralogist","2007","92","","648","654","10.2138/am.2007.2314","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010193","5.1125","","5.1125","","12.3871","","90","","90","","120","","280.393","","","","","","","","48500000","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ba O3 Si -","- Ba6 O18 Si6 -","- Ba6 O18 Si6 -","","","","Yusa, H.; Sata, N.; Ohishi, Y.","Rhombohedral (9R) and hexagonal (6H) perovskites in barium silicates under high pressure Sample: P = 48.5 GPa","American Mineralogist","2007","92","","648","654","10.2138/am.2007.2314","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010194","14.6801","","14.0287","","16.7196","","90","","90","","90","","3443.28","","","","","","","","","","","","Katanga, Congo","4","P b c n","-P 2n 2ab","60","","","Metaschoepite","- H34 Na0.48 O37.91 U8 -","- H27.82 Na0.48 O37.91 U8 -","- H111.28 Na1.92 O151.64 U32 -","4","0.5","","Klingensmith, A. L.; Deely, K. M.; Kinman, W. S.; Kelly, V.; Burns, P. C.","Neptunium incorporation in sodium-substituted metaschoepite Sample: Natural","American Mineralogist","2007","92","","662","669","10.2138/am.2007.2350","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010195","14.705","","14.0565","","16.7051","","90","","90","","90","","3452.96","","","","","","","","","","","","Synthetic","4","P b c n","-P 2n 2ab","60","","","Metaschoepite","- H32 Na1.09 O38.328 U8 -","- H26.656 Na1.09 O38.328 U8 -","- H106.624 Na4.36 O153.312 U32 -","4","0.5","","Klingensmith, A. L.; Deely, K. M.; Kinman, W. S.; Kelly, V.; Burns, P. C.","Neptunium incorporation in sodium-substituted metaschoepite Sample: Na-Ms-CRY","American Mineralogist","2007","92","","662","669","10.2138/am.2007.2350","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010196","14.6401","","14.0417","","16.7044","","90","","90","","90","","3433.96","","","","","","","","","","","","Synthetic","4","P b c n","-P 2n 2ab","60","","","Metaschoepite","- H32 Na1.22 O39.09 U8 -","- H28.18 Na1.22 O39.09 U8 -","- H112.72 Na4.88 O156.36 U32 -","4","0.5","","Klingensmith, A. L.; Deely, K. M.; Kinman, W. S.; Kelly, V.; Burns, P. C.","Neptunium incorporation in sodium-substituted metaschoepite Sample: Na-Ms-CRY-Np","American Mineralogist","2007","92","","662","669","10.2138/am.2007.2350","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010197","14.6317","","14.0147","","16.6977","","90","","90","","90","","3424.01","","","","","","","","","","","","Synthetic","4","P b c n","-P 2n 2ab","60","","","Metaschoepite","- H34 Na1.16 O37.9 U8 -","- H27.8 Na1.16 O37.9 U8 -","- H111.2 Na4.64 O151.6 U32 -","4","0.5","","Klingensmith, A. L.; Deely, K. M.; Kinman, W. S.; Kelly, V.; Burns, P. C.","Neptunium incorporation in sodium-substituted metaschoepite Sample: Na-Ms-AB1","American Mineralogist","2007","92","","662","669","10.2138/am.2007.2350","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010198","14.6592","","14.0358","","16.7148","","90","","90","","90","","3439.13","","","","","","","","","","","","Synthetic","4","P b c n","-P 2n 2ab","60","","","Metaschoepite","- H34 Na0.47 O37.082 U8 -","- H26.164 Na0.47 O37.082 U8 -","- H104.656 Na1.88 O148.328 U32 -","4","0.5","","Klingensmith, A. L.; Deely, K. M.; Kinman, W. S.; Kelly, V.; Burns, P. C.","Neptunium incorporation in sodium-substituted metaschoepite Sample: Na-Ms-AB2","American Mineralogist","2007","92","","662","669","10.2138/am.2007.2350","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010199","12.7228","","12.7228","","5.198","","90","","90","","120","","728.672","","","","","","","","","","","","Latium, Italy","6","P 63","P 6c","173","","","Vishnevite","- Al3 K1.29 Na1.88 O14.62 S0.29 Si3 -","- Al6 K2.58 Na3.76 O29.24 S0.58 Si6 -","- Al6 K2.58 Na3.76 O29.24 S0.58 Si6 -","","","","Della Ventura, G.; Bellatreccia, F.; Parodi, G. C.; Camara, F.; Piccinini, M.","Single-crystal FTIR and X-ray study of vishnevite, ideally [Na6(SO4)][Na2(H2O)2](Si6Al6O24) Sample: Pi4","American Mineralogist","2007","92","","713","721","10.2138/am.2007.2197","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010200","4.7821","","4.7821","","15.697","","90","","90","","120","","310.874","","","","","","","","","","synthesized at 500 C","synthesized at 500 C, 1 GPa, 96 h","Synthetic","4","R -3 :H","-R 3","148","","","Magnesite","- C Cd0.5 Mg0.5 O3 -","- C6 Cd3 Mg3 O18 -","- C6 Cd3 Mg3 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 500 C, 1 GPa, 96 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010201","4.7822","","4.7822","","15.691","","90","","90","","120","","310.768","","","","873.15","","","","","","synthesized at 500 C","synthesized at 500 C, 1 GPa, 96 h","Synthetic","4","R -3 :H","-R 3","148","","","Magnesite","- C Cd0.5 Mg0.5 O3 -","- C6 Cd3 Mg3 O18 -","- C6 Cd3 Mg3 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 500 C, 1 GPa, 96 h Sample: disordered at T = 600 C, t = 20 min","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010202","4.7819","","4.7819","","15.698","","90","","90","","120","","310.868","","","","873.15","","","","","","synthesized at 500 C","synthesized at 500 C, 1 GPa, 96 h","Synthetic","4","R -3 :H","-R 3","148","","","Magnesite","- C Cd0.5 Mg0.5 O3 -","- C6 Cd3 Mg3 O18 -","- C6 Cd3 Mg3 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 500 C, 1 GPa, 96 h Sample: disordered at T = 600 C, t = 48 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010203","4.9207","","4.9207","","16.2968","","90","","90","","120","","341.733","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 3 h","Synthetic","3","R -3 c :H","-R 3 2""c","167","","","Otavite","- C Cd O3 -","- C6 Cd6 O18 -","- C6 Cd6 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = 0, synthesized at 600 C, 1 GPa, 3 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010204","4.895","","4.895","","16.1938","","90","","90","","120","","336.035","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 3 h","Synthetic","4","R -3 c :H","-R 3 2""c","167","","","Otavite","- C Cd0.9 Mg0.1 O3 -","- C6 Cd5.4 Mg0.6 O18 -","- C6 Cd5.4 Mg0.6 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .1, synthesized at 600 C, 1 GPa, 3 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010205","4.867","","4.867","","16.0787","","90","","90","","120","","329.841","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 3 h","Synthetic","4","R -3 c :H","-R 3 2""c","167","","","Otavite","- C Cd0.8 Mg0.2 O3 -","- C6 Cd4.8 Mg1.2 O18 -","- C6 Cd4.8 Mg1.2 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .2, synthesized at 600 C, 1 GPa, 3 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010206","4.8398","","4.8398","","15.9621","","90","","90","","120","","323.799","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 3 h","Synthetic","4","R -3 c :H","-R 3 2""c","167","","","Otavite","- C Cd0.7 Mg0.3 O3 -","- C6 Cd4.2 Mg1.8 O18 -","- C6 Cd4.2 Mg1.8 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .3, synthesized at 600 C, 1 GPa, 3 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010207","4.8113","","4.8113","","15.8356","","90","","90","","120","","317.461","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 3 h","Synthetic","4","R -3 :H","-R 3","148","","","Otavite","- C Cd0.6 Mg0.4 O3 -","- C6 Cd3.6 Mg2.4 O18 -","- C6 Cd3.6 Mg2.4 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .4, synthesized at 600 C, 1 GPa, 3 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010208","4.7792","","4.7792","","15.6884","","90","","90","","120","","310.327","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 3 h","Synthetic","4","R -3 :H","-R 3","148","","","Magnesite","- C Cd0.5 Mg0.5 O3 -","- C6 Cd3 Mg3 O18 -","- C6 Cd3 Mg3 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 600 C, 1 GPa, 3 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010209","4.759","","4.759","","15.5956","","90","","90","","120","","305.889","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 3 h","Synthetic","4","R -3 :H","-R 3","148","","","Magnesite","- C Cd0.4 Mg0.6 O3 -","- C6 Cd2.4 Mg3.6 O18 -","- C6 Cd2.4 Mg3.6 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .6, synthesized at 600 C, 1 GPa, 3 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010210","4.6338","","4.6338","","15.0192","","90","","90","","120","","279.288","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 3 h","Synthetic","3","R -3 c :H","-R 3 2""c","167","","","Magnesite","- C Mg O3 -","- C6 Mg6 O18 -","- C6 Mg6 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = 1, synthesized at 600 C, 1 GPa, 3 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010211","4.8116","","4.8116","","15.8303","","90","","90","","120","","317.394","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 19 h","Synthetic","4","R -3 :H","-R 3","148","","","Otavite","- C Cd0.6 Mg0.4 O3 -","- C6 Cd3.6 Mg2.4 O18 -","- C6 Cd3.6 Mg2.4 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .4, synthesized at 600 C, 1 GPa, 19 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010212","4.7963","","4.7963","","15.7663","","90","","90","","120","","314.104","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 19 h","Synthetic","4","R -3 :H","-R 3","148","","","Otavite","- C Cd0.55 Mg0.45 O3 -","- C6 Cd3.3 Mg2.7 O18 -","- C6 Cd3.3 Mg2.7 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .45, synthesized at 600 C, 1 GPa, 19 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010213","4.7813","","4.7813","","15.7023","","90","","90","","120","","310.875","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 19 h","Synthetic","4","R -3 :H","-R 3","148","","","Magnesite","- C Cd0.5 Mg0.5 O3 -","- C6 Cd3 Mg3 O18 -","- C6 Cd3 Mg3 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 600 C, 1 GPa, 19 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010214","4.7752","","4.7752","","15.673","","90","","90","","120","","309.504","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 19 h","Synthetic","4","R -3 :H","-R 3","148","","","Magnesite","- C Cd0.45 Mg0.55 O3 -","- C6 Cd2.7 Mg3.3 O18 -","- C6 Cd2.7 Mg3.3 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .55, synthesized at 600 C, 1 GPa, 19 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010215","4.7818","","4.7818","","15.7028","","90","","90","","120","","310.95","","","","","","","","","","synthesized at 600 C","synthesized at 600 C, 1 GPa, 96 h","Synthetic","4","R -3 :H","-R 3","148","","","Magnesite","- C Cd0.5 Mg0.5 O3 -","- C6 Cd3 Mg3 O18 -","- C6 Cd3 Mg3 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 600 C, 1 GPa, 96 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010216","4.7824","","4.7824","","15.7082","","90","","90","","120","","311.135","","","","","","","","","","synthesized at 650 C","synthesized at 650 C, 1 GPa, 120 h","Synthetic","4","R -3 :H","-R 3","148","","","Magnesite","- C Cd0.5 Mg0.5 O3 -","- C6 Cd3 Mg3 O18 -","- C6 Cd3 Mg3 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 650 C, 1 GPa, 120 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010217","4.782","","4.782","","15.7028","","90","","90","","120","","310.976","","","","","","","","","","synthesized at 700 C","synthesized at 700 C, 1 GPa, 24 h","Synthetic","4","R -3 c :H","-R 3 2""c","167","","","Magnesite","- C Cd0.5 Mg0.5 O3 -","- C6 Cd3 Mg3 O18 -","- C6 Cd3 Mg3 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 700 C, 1 GPa, 24 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010218","4.9204","","4.9204","","16.2948","","90","","90","","120","","341.649","","","","","","","","","","synthesized at 800 C","synthesized at 800 C, 1 GPa, 1 h","Synthetic","3","R -3 c :H","-R 3 2""c","167","","","Otavite","- C Cd O3 -","- C6 Cd6 O18 -","- C6 Cd6 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = 0, synthesized at 800 C, 1 GPa, 1 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010219","4.8934","","4.8934","","16.1892","","90","","90","","120","","335.72","","","","","","","","","","synthesized at 800 C","synthesized at 800 C, 1 GPa, 1 h","Synthetic","4","R -3 c :H","-R 3 2""c","167","","","Otavite","- C Cd0.9 Mg0.1 O3 -","- C6 Cd5.4 Mg0.6 O18 -","- C6 Cd5.4 Mg0.6 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .1, synthesized at 800 C, 1 GPa, 1 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010220","4.8638","","4.8638","","16.0679","","90","","90","","120","","329.186","","","","","","","","","","synthesized at 800 C","synthesized at 800 C, 1 GPa, 1 h","Synthetic","4","R -3 c :H","-R 3 2""c","167","","","Otavite","- C Cd0.8 Mg0.2 O3 -","- C6 Cd4.8 Mg1.2 O18 -","- C6 Cd4.8 Mg1.2 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .2, synthesized at 800 C, 1 GPa, 1 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010221","4.8341","","4.8341","","15.9434","","90","","90","","120","","322.658","","","","","","","","","","synthesized at 800 C","synthesized at 800 C, 1 GPa, 1 h","Synthetic","4","R -3 c :H","-R 3 2""c","167","","","Otavite","- C Cd0.7 Mg0.3 O3 -","- C6 Cd4.2 Mg1.8 O18 -","- C6 Cd4.2 Mg1.8 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .3, synthesized at 800 C, 1 GPa, 1 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010222","4.8095","","4.8095","","15.8358","","90","","90","","120","","317.227","","","","","","","","","","synthesized at 800 C","synthesized at 800 C, 1 GPa, 1 h","Synthetic","4","R -3 c :H","-R 3 2""c","167","","","Otavite","- C Cd0.6 Mg0.4 O3 -","- C6 Cd3.6 Mg2.4 O18 -","- C6 Cd3.6 Mg2.4 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .4, synthesized at 800 C, 1 GPa, 1 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010223","4.7788","","4.7788","","15.6968","","90","","90","","120","","310.441","","","","","","","","","","synthesized at 800 C","synthesized at 800 C, 1 GPa, 1 h","Synthetic","4","R -3 c :H","-R 3 2""c","167","","","Magnesite","- C Cd0.5 Mg0.5 O3 -","- C6 Cd3 Mg3 O18 -","- C6 Cd3 Mg3 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 800 C, 1 GPa, 1 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010224","4.751","","4.751","","15.5745","","90","","90","","120","","304.449","","","","","","","","","","synthesized at 800 C","synthesized at 800 C, 1 GPa, 1 h","Synthetic","4","R -3 c :H","-R 3 2""c","167","","","Magnesite","- C Cd0.4 Mg0.6 O3 -","- C6 Cd2.4 Mg3.6 O18 -","- C6 Cd2.4 Mg3.6 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .6, synthesized at 800 C, 1 GPa, 1 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010225","4.6638","","4.6638","","15.172","","90","","90","","120","","285.794","","","","","","","","","","synthesized at 800 C","synthesized at 800 C, 1 GPa, 1 h","Synthetic","4","R -3 c :H","-R 3 2""c","167","","","Magnesite","- C Cd0.1 Mg0.9 O3 -","- C6 Cd0.6 Mg5.4 O18 -","- C6 Cd0.6 Mg5.4 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .9, synthesized at 800 C, 1 GPa, 1 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010226","4.6334","","4.6334","","15.0178","","90","","90","","120","","279.214","","","","","","","","","","synthesized at 800 C","synthesized at 800 C, 1 GPa, 1 h","Synthetic","3","R -3 c :H","-R 3 2""c","167","","","Magnesite","- C Mg O3 -","- C6 Mg6 O18 -","- C6 Mg6 O18 -","","","","Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F.","Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = 1, synthesized at 800 C, 1 GPa, 1 h","American Mineralogist","2007","92","","829","836","10.2138/am.2007.2315","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010227","10.325","","10.9575","","5.76","","90","","90","","90","","651.664","","","","","","","","","","","","Madagascar","6","P b n m","-P 2c 2ab","62","","","Grandidierite","- Al3 B Fe0.024 Mg0.976 O9 Si -","- Al12 B4 Fe0.096 Mg3.904 O36 Si4 -","- Al12 B4 Fe0.096 Mg3.904 O36 Si4 -","","","","Dzikowski, T. J.; Groat, L. A.; Grew, E. S.","The geometric effects of VFe2+ for VMg substitution on the crystal structures of the grandidierite-ominelite series Sample: G17 Locality: Madagascar","American Mineralogist","2007","92","","863","872","10.2138/am.2007.2275","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010228","10.333","","10.9858","","5.7667","","90","","90","","90","","654.614","","","","","","","","","","","","Long Lake, Larsemann Hills, Antarctica","6","P b n m","-P 2c 2ab","62","","","Grandidierite","- Al3 B Fe0.126 Mg0.874 O9 Si -","- Al12 B4 Fe0.504 Mg3.496 O36 Si4 -","- Al12 B4 Fe0.504 Mg3.496 O36 Si4 -","","","","Dzikowski, T. J.; Groat, L. A.; Grew, E. S.","The geometric effects of VFe2+ for VMg substitution on the crystal structures of the grandidierite-ominelite series Sample: G8 Locality: Long Lake, Larsemann Hills, Antarctica","American Mineralogist","2007","92","","863","872","10.2138/am.2007.2275","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010229","10.3317","","10.9904","","5.7634","","90","","90","","90","","654.431","","","","","","","","","","","","Sahakondra, Ampamatoa, Madagascar","6","P b n m","-P 2c 2ab","62","","","Grandidierite","- Al3 B Fe0.182 Mg0.818 O9 Si -","- Al12 B4 Fe0.728 Mg3.272 O36 Si4 -","- Al12 B4 Fe0.728 Mg3.272 O36 Si4 -","","","","Dzikowski, T. J.; Groat, L. A.; Grew, E. S.","The geometric effects of VFe2+ for VMg substitution on the crystal structures of the grandidierite-ominelite series Sample: G4 Locality: Sahakondra, Ampamatoa, Madagascar","American Mineralogist","2007","92","","863","872","10.2138/am.2007.2275","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010230","10.3347","","11.0034","","5.7627","","90","","90","","90","","655.316","","","","","","","","","","","","Zimbabwe","6","P b n m","-P 2c 2ab","62","","","Grandidierite","- Al3 B Fe0.274 Mg0.726 O9 Si -","- Al12 B4 Fe1.096 Mg2.904 O36 Si4 -","- Al12 B4 Fe1.096 Mg2.904 O36 Si4 -","","","","Dzikowski, T. J.; Groat, L. A.; Grew, E. S.","The geometric effects of VFe2+ for VMg substitution on the crystal structures of the grandidierite-ominelite series Sample: G12 Locality: Zimbabwe","American Mineralogist","2007","92","","863","872","10.2138/am.2007.2275","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010231","10.336","","11.0148","","5.7657","","90","","90","","90","","656.419","","","","","","","","","","","","Karibe area, Zimbabwe","6","P b n m","-P 2c 2ab","62","","","Grandidierite","- Al3 B Fe0.334 Mg0.666 O9 Si -","- Al12 B4 Fe1.336 Mg2.664 O36 Si4 -","- Al12 B4 Fe1.336 Mg2.664 O36 Si4 -","","","","Dzikowski, T. J.; Groat, L. A.; Grew, E. S.","The geometric effects of VFe2+ for VMg substitution on the crystal structures of the grandidierite-ominelite series Sample: G1 Locality: Karibe area, Zimbabwe","American Mineralogist","2007","92","","863","872","10.2138/am.2007.2275","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010232","10.3403","","11.0332","","5.7655","","90","","90","","90","","657.766","","","","","","","","","","","","Andrahomana, Madagascar","6","P b n m","-P 2c 2ab","62","","","Grandidierite","- Al3 B Fe0.45 Mg0.55 O9 Si -","- Al12 B4 Fe1.8 Mg2.2 O36 Si4 -","- Al12 B4 Fe1.8 Mg2.2 O36 Si4 -","","","","Dzikowski, T. J.; Groat, L. A.; Grew, E. S.","The geometric effects of VFe2+ for VMg substitution on the crystal structures of the grandidierite-ominelite series Sample: G2 Locality: Andrahomana, Madagascar","American Mineralogist","2007","92","","863","872","10.2138/am.2007.2275","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010233","10.345","","11.0519","","5.7656","","90","","90","","90","","659.192","","","","","","","","","","","","Almgjotheii, Rogaland, Norway","6","P b n m","-P 2c 2ab","62","","","Ominelite","- Al3 B Fe0.522 Mg0.478 O9 Si -","- Al12 B4 Fe2.088 Mg1.912 O36 Si4 -","- Al12 B4 Fe2.088 Mg1.912 O36 Si4 -","","","","Dzikowski, T. J.; Groat, L. A.; Grew, E. S.","The geometric effects of VFe2+ for VMg substitution on the crystal structures of the grandidierite-ominelite series Sample: G9 Locality: Almgjotheii, Rogaland, Norway","American Mineralogist","2007","92","","863","872","10.2138/am.2007.2275","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010234","10.363","","11.129","","5.769","","90","","90","","90","","665.338","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","","Ominelite","- Al3 B Fe O9 Si -","- Al12 B4 Fe4 O36 Si4 -","- Al12 B4 Fe4 O36 Si4 -","","","","Dzikowski, T. J.; Groat, L. A.; Grew, E. S.","The geometric effects of VFe2+ for VMg substitution on the crystal structures of the grandidierite-ominelite series Sample: ominelite","American Mineralogist","2007","92","","863","872","10.2138/am.2007.2275","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010235","10.3702","","8.0647","","6.64","","90","","92.676","","90","","554.715","","","","100","","","","","","","","St. Andreasberg, Hartz Mountains, Germany","4","P 1 21/n 1","-P 2yn","14","","","Samsonite","- Ag4 Mn S6 Sb2 -","- Ag8 Mn2 S12 Sb4 -","- Ag8 Mn2 S12 Sb4 -","","","","Bindi, L.; Evain, M.","Gram-Charlier development of the atomic displacement factors into mineral structures: The case of samsonite, Ag4MnSb2S6 Sample: T = 100 K","American Mineralogist","2007","92","","886","891","10.2138/am.2007.2364","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010236","10.3861","","8.1108","","6.663","","90","","92.639","","90","","560.693","","","","300","","","","","","","","St. Andreasberg, Hartz Mountains, Germany","4","P 1 21/n 1","-P 2yn","14","","","Samsonite","- Ag4 Mn S6 Sb2 -","- Ag8 Mn2 S12 Sb4 -","- Ag8 Mn2 S12 Sb4 -","","","","Bindi, L.; Evain, M.","Gram-Charlier development of the atomic displacement factors into mineral structures: The case of samsonite, Ag4MnSb2S6 Sample: T = 300 K","American Mineralogist","2007","92","","886","891","10.2138/am.2007.2364","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010237","10.3861","","8.1108","","6.663","","90","","92.639","","90","","560.693","","","","300","","","","","","","","St. Andreasberg, Hartz Mountains, Germany","4","P 1 21/n 1","-P 2yn","14","","","Samsonite","- Ag4 Mn S6 Sb2 -","- Ag8 Mn2 S12 Sb4 -","- Ag8 Mn2 S12 Sb4 -","","","","Bindi, L.; Evain, M.","Gram-Charlier development of the atomic displacement factors into mineral structures: The case of samsonite, Ag4MnSb2S6 Sample: T = 300 K, refined using Gram-Charlier displacement factors","American Mineralogist","2007","92","","886","891","10.2138/am.2007.2364","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010238","10.3838","","8.1364","","6.6737","","90","","92.64","","90","","563.241","","","","400","","","","","","","","St. Andreasberg, Hartz Mountains, Germany","4","P 1 21/n 1","-P 2yn","14","","","Samsonite","- Ag4 Mn S6 Sb2 -","- Ag8 Mn2 S12 Sb4 -","- Ag8 Mn2 S12 Sb4 -","","","","Bindi, L.; Evain, M.","Gram-Charlier development of the atomic displacement factors into mineral structures: The case of samsonite, Ag4MnSb2S6 Sample: T = 400 K","American Mineralogist","2007","92","","886","891","10.2138/am.2007.2364","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010239","10.3838","","8.1364","","6.6737","","90","","92.64","","90","","563.241","","","","400","","","","","","","","St. Andreasberg, Hartz Mountains, Germany","4","P 1 21/n 1","-P 2yn","14","","","Samsonite","- Ag4 Mn S6 Sb2 -","- Ag8 Mn2 S12 Sb4 -","- Ag8 Mn2 S12 Sb4 -","","","","Bindi, L.; Evain, M.","Gram-Charlier development of the atomic displacement factors into mineral structures: The case of samsonite, Ag4MnSb2S6 Sample: T = 400 K, refined using Gram-Charlier displacement factors","American Mineralogist","2007","92","","886","891","10.2138/am.2007.2364","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010240","7.282","","7.282","","17.604","","90","","90","","120","","808.432","","","","","","","","","","","","Langban mine, Varmland, Sweden","5","P 31 2 1","P 31 2""","152","","","Ingersonite","- Ca3 Mg0.017 Mn O14 Sb3.983 -","- Ca9 Mg0.051 Mn3 O42 Sb11.949 -","- Ca9 Mg0.051 Mn3 O42 Sb11.949 -","","","","Bonazzi, P.; Bindi, L.","The crystal structure of ingersonite, Ca3Mn2+Sb5+4O14, and its relationships with pyrochlore Locality: Langban mine, Varmland, Sweden","American Mineralogist","2007","92","","947","953","10.2138/am.2007.2421","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010241","18.1876","","8.7352","","5.1789","","90","","90","","90","","822.784","","","","","","","","","","","","Synthetic","4","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.23 Mg0.874 O3 Si0.875 -","- Al3.68 Mg13.984 O48 Si14 -","- Al3.68 Mg13.984 O48 Si14 -","","","","Smyth, J. R.; Mierdel, K.; Keppler, H.; Langenhorst, F.; Dubrovinsky, L.; Nestola, F.","Crystal chemistry of hydration in aluminous orthopyroxene","American Mineralogist","2007","92","","973","976","10.2138/am.2007.2560","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010242","6.1443","","5.2974","","4.2133","","95.109","","100.743","","108.934","","125.784","","","","","","","","5500000","","","","","4","P -1","-P 1","2","","","Kalicinite","- C H K O3 -","- C2 H2 K2 O6 -","- C2 H2 K2 O6 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Sample: P = 5.5 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010243","15.195","","5.6298","","3.7088","","90","","104.534","","90","","307.116","","","","","","","","0","","","","","4","P 1 21/a 1","-P 2yab","14","","","Kalicinite (deuterated)","- C D K O3 -","- C4 D4 K4 O12 -","- C4 D4 K4 O12 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Note: Kalicinite-type structure Sample: P = 0.00 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010244","15.097","","5.6144","","3.6932","","90","","104.11","","90","","303.593","","","","","","","","300000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Kalicinite (deuterated)","- C D K O3 -","- C4 D4 K4 O12 -","- C4 D4 K4 O12 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Note: Kalicinite-type structure Sample: P = 0.30 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010245","14.945","","5.588","","3.6691","","90","","103.538","","90","","297.902","","","","","","","","740000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Kalicinite (deuterated)","- C D K O3 -","- C4 D4 K4 O12 -","- C4 D4 K4 O12 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Note: Kalicinite-type structure Sample: P = 0.74 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010246","14.803","","5.5641","","3.6509","","90","","103.021","","90","","292.976","","","","","","","","1170000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Kalicinite (deuterated)","- C D K O3 -","- C4 D4 K4 O12 -","- C4 D4 K4 O12 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Note: Kalicinite-type structure Sample: P = 1.17 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010247","14.663","","5.5384","","3.6323","","90","","102.527","","90","","287.955","","","","","","","","1670000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Kalicinite (deuterated)","- C D K O3 -","- C4 D4 K4 O12 -","- C4 D4 K4 O12 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Note: Kalicinite-type structure Sample: P = 1.67 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010248","14.545","","5.5216","","3.6211","","90","","102.132","","90","","284.322","","","","","","","","2100000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Kalicinite (deuterated)","- C D K O3 -","- C4 D4 K4 O12 -","- C4 D4 K4 O12 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Note: Kalicinite-type structure Sample: P = 2.10 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010249","14.419","","5.5011","","3.6093","","90","","101.731","","90","","280.311","","","","","","","","2500000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Kalicinite (deuterated)","- C D K O3 -","- C4 D4 K4 O12 -","- C4 D4 K4 O12 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Note: Kalicinite-type structure Sample: P = 2.50 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010250","14.33","","5.4868","","3.6024","","90","","101.457","","90","","277.598","","","","","","","","2840000","","","","","4","P 1 21/a 1","-P 2yab","14","","","Kalicinite (deuterated)","- C D K O3 -","- C4 D4 K4 O12 -","- C4 D4 K4 O12 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Note: Kalicinite-type structure Sample: P = 2.84 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010251","6.3043","","5.3587","","4.2501","","95.132","","101.113","","109.326","","131.116","","","","","","","","3450000","","","","","4","P -1","-P 1","2","","","Kalicinite (deuterated)","- C D K O3 -","- C2 D2 K2 O6 -","- C2 D2 K2 O6 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Sample: P = 3.45 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010252","6.2435","","5.3363","","4.2448","","95.216","","100.935","","109.167","","129.358","","","","","","","","4100000","","","","","4","P -1","-P 1","2","","","Kalicinite (deuterated)","- C D K O3 -","- C2 D2 K2 O6 -","- C2 D2 K2 O6 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Sample: P = 4.10 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010253","6.1858","","5.3147","","4.233","","95.253","","100.793","","109.016","","127.485","","","","","","","","4770000","","","","","4","P -1","-P 1","2","","","Kalicinite (deuterated)","- C D K O3 -","- C2 D2 K2 O6 -","- C2 D2 K2 O6 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Sample: P = 4.77 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010254","6.1393","","5.2958","","4.2228","","95.297","","100.665","","108.892","","125.931","","","","","","","","5380000","","","","","4","P -1","-P 1","2","","","Kalicinite (deuterated)","- C D K O3 -","- C2 D2 K2 O6 -","- C2 D2 K2 O6 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Sample: P = 5.38 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010255","6.0938","","5.2765","","4.2139","","95.306","","100.539","","108.786","","124.432","","","","","","","","6020000","","","","","4","P -1","-P 1","2","","","Kalicinite (deuterated)","- C D K O3 -","- C2 D2 K2 O6 -","- C2 D2 K2 O6 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Sample: P = 6.02 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010256","6.0564","","5.261","","4.2047","","95.293","","100.438","","108.689","","123.174","","","","","","","","6570000","","","","","4","P -1","-P 1","2","","","Kalicinite (deuterated)","- C D K O3 -","- C2 D2 K2 O6 -","- C2 D2 K2 O6 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Sample: P = 6.57 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010257","6.0237","","5.2476","","4.1958","","95.292","","100.348","","108.578","","122.074","","","","","","","","7180000","","","","","4","P -1","-P 1","2","","","Kalicinite (deuterated)","- C D K O3 -","- C2 D2 K2 O6 -","- C2 D2 K2 O6 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Sample: P = 7.18 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010258","5.9935","","5.2346","","4.1889","","95.298","","100.273","","108.498","","121.061","","","","","","","","7610000","","","","","4","P -1","-P 1","2","","","Kalicinite (deuterated)","- C D K O3 -","- C2 D2 K2 O6 -","- C2 D2 K2 O6 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Sample: P = 7.61 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010259","5.9577","","5.2189","","4.1792","","95.306","","100.155","","108.412","","119.822","","","","","","","","8300000","","","","","4","P -1","-P 1","2","","","Kalicinite (deuterated)","- C D K O3 -","- C2 D2 K2 O6 -","- C2 D2 K2 O6 -","","","","Allan, D. R.; Marshall, W. G.; Pulham, C. R.","The high-pressure crystal structure of potassium hydrogen carbonate (KHCO3) Sample: P = 8.30 GPa","American Mineralogist","2007","92","","1018","1025","10.2138/am.2007.2336","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010260","9.9498","","8.6468","","2.7901","","90","","90","","90","","240.043","","","","","","","","","","synthesized from MgAl2O4 spinel at 27 GPa and 2200 C","synthesized from MgAl2O4 spinel at 27 GPa","","3","P b n m","-P 2c 2ab","62","","","Spinel","- Al2 Mg O4 -","- Al8 Mg4 O16 -","- Al8 Mg4 O16 -","","","","Kojitani, H.; Hisatomi, R.; Akaogi, M.","High-pressure relations and crystal chemistry of calcium ferrite-type solid solutions in the system MgAl2O4-Mg2SiO4 Note: synthesized from MgAl2O4 spinel at 27 GPa and 2200 C Note: data collected at room conditinos","American Mineralogist","2007","92","","1112","1118","10.2138/am.2007.2255","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010261","16.1941","","5.5505","","10.0483","","90","","90","","90","","903.195","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca1.89 H O13 Si3 Sr0.11 -","- Al12 Ca7.56 H4 O52 Si12 Sr0.44 -","- Al12 Ca7.56 H4 O52 Si12 Sr0.44 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au32, X(Sr) = .06","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010262","16.2023","","5.5512","","10.0589","","90","","90","","90","","904.72","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca1.74 H O13 Si3 Sr0.26 -","- Al12 Ca6.96 H4 O52 Si12 Sr1.04 -","- Al12 Ca6.96 H4 O52 Si12 Sr1.04 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au40, X(Sr) = .13","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010263","16.21","","5.5529","","10.0695","","90","","90","","90","","906.381","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca1.68 H O13 Si3 Sr0.32 -","- Al12 Ca6.72 H4 O52 Si12 Sr1.28 -","- Al12 Ca6.72 H4 O52 Si12 Sr1.28 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au45, X(Sr) = .16","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010264","16.2384","","5.558","","10.0877","","90","","90","","90","","910.445","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca1.57 H O13 Si3 Sr0.43 -","- Al12 Ca6.28 H4 O52 Si12 Sr1.72 -","- Al12 Ca6.28 H4 O52 Si12 Sr1.72 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Pt4, X(Sr) = .22","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010265","16.2278","","5.5576","","10.0893","","90","","90","","90","","909.93","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca1.5 H O13 Si3 Sr0.5 -","- Al12 Ca6 H4 O52 Si12 Sr2 -","- Al12 Ca6 H4 O52 Si12 Sr2 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au31, X(Sr) = .25","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010266","16.2383","","5.5603","","10.1019","","90","","90","","90","","912.099","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca1.5 H O13 Si3 Sr0.5 -","- Al12 Ca6 H4 O52 Si12 Sr2 -","- Al12 Ca6 H4 O52 Si12 Sr2 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au34, X(Sr) = .24","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010267","16.2435","","5.5592","","10.1083","","90","","90","","90","","912.788","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca1.37 H O13 Si3 Sr0.63 -","- Al12 Ca5.48 H4 O52 Si12 Sr2.52 -","- Al12 Ca5.48 H4 O52 Si12 Sr2.52 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au30, X(Sr) = .32","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010268","16.253","","5.563","","10.1196","","90","","90","","90","","914.968","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca1.24 H O13 Si3 Sr0.76 -","- Al12 Ca4.96 H4 O52 Si12 Sr3.04 -","- Al12 Ca4.96 H4 O52 Si12 Sr3.04 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au42, X(Sr) = .37","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010269","16.2798","","5.5676","","10.1388","","90","","90","","90","","918.975","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca1.15 H O13 Si3 Sr0.85 -","- Al12 Ca4.6 H4 O52 Si12 Sr3.4 -","- Al12 Ca4.6 H4 O52 Si12 Sr3.4 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Pt3, X(Sr) = .42","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010270","16.2864","","5.5719","","10.1606","","90","","90","","90","","922.036","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca0.96 H O13 Si3 Sr1.04 -","- Al12 Ca3.84 H4 O52 Si12 Sr4.16 -","- Al12 Ca3.84 H4 O52 Si12 Sr4.16 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Pt36, X(Sr) = .52","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010271","16.3048","","5.5769","","10.1819","","90","","90","","90","","925.843","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca0.73 H O13 Si3 Sr1.27 -","- Al12 Ca2.92 H4 O52 Si12 Sr5.08 -","- Al12 Ca2.92 H4 O52 Si12 Sr5.08 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Pt2, X(Sr) = .63","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010272","16.3095","","5.5814","","10.1907","","90","","90","","90","","927.658","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca0.67 H O13 Si3 Sr1.33 -","- Al12 Ca2.68 H4 O52 Si12 Sr5.32 -","- Al12 Ca2.68 H4 O52 Si12 Sr5.32 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au23, X(Sr) = .66","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010273","16.3229","","5.5871","","10.2132","","90","","90","","90","","931.42","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca0.46 H O13 Si3 Sr1.54 -","- Al12 Ca1.84 H4 O52 Si12 Sr6.16 -","- Al12 Ca1.84 H4 O52 Si12 Sr6.16 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au22, X(Sr) = .77","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010274","16.3432","","5.5943","","10.2378","","90","","90","","90","","936.029","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca0.28 H O13 Si3 Sr1.72 -","- Al12 Ca1.12 H4 O52 Si12 Sr6.88 -","- Al12 Ca1.12 H4 O52 Si12 Sr6.88 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au33, X(Sr) = .86","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010275","16.3376","","5.5936","","10.2407","","90","","90","","90","","935.857","","","","","","","","","","","","Synthetic","6","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 Ca0.26 H O13 Si3 Sr1.74 -","- Al12 Ca1.04 H4 O52 Si12 Sr6.96 -","- Al12 Ca1.04 H4 O52 Si12 Sr6.96 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au44, X(Sr) = .87","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010276","16.3548","","5.5985","","10.26","","90","","90","","90","","939.43","","","","","","","","","","","","Synthetic","5","P n m a","-P 2ac 2n","62","","","Zoisite","- Al3 H O13 Si3 Sr2 -","- Al12 H4 O52 Si12 Sr8 -","- Al12 H4 O52 Si12 Sr8 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au21, X(Sr) = 1","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010277","8.8652","","5.5753","","10.1449","","90","","115.42","","90","","452.878","","","","","","","","","","","","Synthetic","6","P 1 21/m 1","-P 2yb","11","","","Clinozoisite","- Al3 Ca1.843 H O13 Si3 Sr0.157 -","- Al6 Ca3.686 H2 O26 Si6 Sr0.314 -","- Al6 Ca3.686 H2 O26 Si6 Sr0.314 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au32, X(Sr) = .078","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010278","8.8688","","5.5739","","10.1696","","90","","115.29","","90","","454.54","","","","","","","","","","","","Synthetic","6","P 1 21/m 1","-P 2yb","11","","","Clinozoisite","- Al3 Ca1.7 H O13 Si3 Sr0.3 -","- Al6 Ca3.4 H2 O26 Si6 Sr0.6 -","- Al6 Ca3.4 H2 O26 Si6 Sr0.6 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au45, X(Sr) = .15","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010279","8.8795","","5.5766","","10.1873","","90","","115.19","","90","","456.476","","","","","","","","","","","","Synthetic","6","P 1 21/m 1","-P 2yb","11","","","Clinozoisite","- Al3 Ca1.518 H O13 Si3 Sr0.482 -","- Al6 Ca3.036 H2 O26 Si6 Sr0.964 -","- Al6 Ca3.036 H2 O26 Si6 Sr0.964 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au31, X(Sr) = .233","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010280","8.8737","","5.5763","","10.2014","","90","","115.15","","90","","456.935","","","","","","","","","","","","Synthetic","6","P 1 21/m 1","-P 2yb","11","","","Clinozoisite","- Al3 Ca1.504 H O13 Si3 Sr0.496 -","- Al6 Ca3.008 H2 O26 Si6 Sr0.992 -","- Al6 Ca3.008 H2 O26 Si6 Sr0.992 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au35, X(Sr) = .248","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010281","8.8763","","5.5774","","10.2055","","90","","115.12","","90","","457.455","","","","","","","","","","","","Synthetic","6","P 1 21/m 1","-P 2yb","11","","","Clinozoisite","- Al3 Ca1.504 H O13 Si3 Sr0.496 -","- Al6 Ca3.008 H2 O26 Si6 Sr0.992 -","- Al6 Ca3.008 H2 O26 Si6 Sr0.992 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au34, X(Sr) = .248","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010282","8.874","","5.5767","","10.2189","","90","","115.1","","90","","457.954","","","","","","","","","","","","Synthetic","6","P 1 21/m 1","-P 2yb","11","","","Clinozoisite","- Al3 Ca1.416 H O13 Si3 Sr0.584 -","- Al6 Ca2.832 H2 O26 Si6 Sr1.168 -","- Al6 Ca2.832 H2 O26 Si6 Sr1.168 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Pt8, X(Sr) = .292","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010283","8.8796","","5.579","","10.2257","","90","","115.06","","90","","458.887","","","","","","","","","","","","Synthetic","6","P 1 21/m 1","-P 2yb","11","","","Clinozoisite","- Al3 Ca1.302 H O13 Si3 Sr0.699 -","- Al6 Ca2.602 H2 O26 Si6 Sr1.398 -","- Al6 Ca2.602 H2 O26 Si6 Sr1.398 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au42, X(Sr) = .37","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010284","8.8871","","5.5828","","10.2452","","90","","114.97","","90","","460.802","","","","","","","","","","","","Synthetic","6","P 1 21/m 1","-P 2yb","11","","","Clinozoisite","- Al3 Ca1.085 H O13 Si3 Sr0.915 -","- Al6 Ca2.17 H2 O26 Si6 Sr1.83 -","- Al6 Ca2.17 H2 O26 Si6 Sr1.83 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Pt35, X(Sr) = .458","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010285","8.8923","","5.5844","","10.2585","","90","","114.99","","90","","461.727","","","","","","","","","","","","Synthetic","6","P 1 21/m 1","-P 2yb","11","","","Clinozoisite","- Al3 Ca0.974 H O13 Si3 Sr1.026 -","- Al6 Ca1.948 H2 O26 Si6 Sr2.052 -","- Al6 Ca1.948 H2 O26 Si6 Sr2.052 -","","","","Dorsam, G.; Liebscher, A.; Franz, G.; Gottschalk, M.","Crystal chemistry of synthetic Ca2Al3Si3O12OH - Sr2Al3Si3O12OH solid solution series of zoisite and clinozoisite Sample: Run no. = Au43, X(Sr) = .513","American Mineralogist","2007","92","","1133","1147","10.2138/am.2007.2353","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010286","8.37","","12.967","","14.262","","90.58","","115.55","","90.44","","1396.34","","","","","","","","100","","","","Synthetic","5","I -1","-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)","2","","","Slawsonite","- Al2 Ca0.2 O8 Si2 Sr0.8 -","- Al2 Ca0.2 O8 Si2 Sr0.8 -","- Al16 Ca1.6 O64 Si16 Sr6.4 -","8","","","Benna, P.; Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Lundegaard, L. F.; Bruno, E.","The high-pressure structural configurations of Ca0.2Sr0.8Al2Si2O8 feldspar: The I-1-I2/c and I2/c-P2_1/c phase transitions Sample: P = 0.0001 GPa","American Mineralogist","2007","92","","1190","1199","10.2138/am.2007.2402","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010287","8.256","","12.842","","14.088","","90.51","","115.38","","90.88","","1349.14","","","","","","","","3200000","","","","Synthetic","5","I -1","-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)","2","","","Slawsonite","- Al2 Ca0.2 O8 Si2 Sr0.8 -","- Al2 Ca0.2 O8 Si2 Sr0.8 -","- Al16 Ca1.6 O64 Si16 Sr6.4 -","8","","","Benna, P.; Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Lundegaard, L. F.; Bruno, E.","The high-pressure structural configurations of Ca0.2Sr0.8Al2Si2O8 feldspar: The I-1-I2/c and I2/c-P2_1/c phase transitions Sample: P = 3.2 GPa","American Mineralogist","2007","92","","1190","1199","10.2138/am.2007.2402","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010288","8.209","","12.78","","14.009","","90","","115.27","","90","","1329.06","","","","","","","","4400000","","","","Synthetic","5","I 1 2/c 1","-I 2yc","15","","","Slawsonite","- Al2 Ca0.2 O8 Si2 Sr0.8 -","- Al2 Ca0.2 O8 Si2 Sr0.8 -","- Al16 Ca1.6 O64 Si16 Sr6.4 -","8","1","","Benna, P.; Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Lundegaard, L. F.; Bruno, E.","The high-pressure structural configurations of Ca0.2Sr0.8Al2Si2O8 feldspar: The I-1-I2/c and I2/c-P2_1/c phase transitions Sample: P = 4.4 GPa","American Mineralogist","2007","92","","1190","1199","10.2138/am.2007.2402","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010289","8.128","","12.671","","13.866","","90","","114.98","","90","","1294.47","","","","","","","","6200000","","","","Synthetic","5","I 1 2/c 1","-I 2yc","15","","","Slawsonite","- Al2 Ca0.2 O8 Si2 Sr0.8 -","- Al2 Ca0.2 O8 Si2 Sr0.8 -","- Al16 Ca1.6 O64 Si16 Sr6.4 -","8","1","","Benna, P.; Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Lundegaard, L. F.; Bruno, E.","The high-pressure structural configurations of Ca0.2Sr0.8Al2Si2O8 feldspar: The I-1-I2/c and I2/c-P2_1/c phase transitions Sample: P = 6.2 GPa","American Mineralogist","2007","92","","1190","1199","10.2138/am.2007.2402","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010290","8.116","","12.41","","13.728","","90","","114.19","","90","","1261.27","","","","","","","","7400000","","","","Synthetic","5","P 1 21/c 1","-P 2ybc","14","","","Slawsonite","- Al2 Ca0.2 O8 Si2 Sr0.8 -","- Al2 Ca0.2 O8 Si2 Sr0.8 -","- Al16 Ca1.6 O64 Si16 Sr6.4 -","8","2","","Benna, P.; Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Lundegaard, L. F.; Bruno, E.","The high-pressure structural configurations of Ca0.2Sr0.8Al2Si2O8 feldspar: The I-1-I2/c and I2/c-P2_1/c phase transitions Sample: P = 7.4 GPa","American Mineralogist","2007","92","","1190","1199","10.2138/am.2007.2402","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9010291","16.094","","4.69","","10.049","","90","","110.79","","90","","709.119","","","","","","","","","","","","","2","P 1 21/a 1","-P 2yab","14","","","Carpathite/Karpalite?","- C2 H -","- C48 H24 -","- C48 H24 -","","","","Echigo, T.; Kimata, M.; Maruoka, T.","Crystal-chemical and carbon-isotopic characteristics of karpatite (C24H12) from the Picacho Peak Area, San Benito County, California: Evidences for the hydrothermal formation Locality: Picacho Peak Area, San Benito County, California, USA","American Mineralogist","2007","92","","1262","1269","10.2138/am.2007.2509","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9010292","10.024","","6.912","","4.1868","","115.92","","90","","90","","260.905","","","","","","","","4600000","","","","Synthetic","3","P 21/b 1 1","-P 2xab","14","","","","- C K O3 -","- C4 K4 O12 -","- C4 K4 O12 -","","","","Komatsu, K.; Kagi, H.; Nagai, T.; Kuribayashi, T.; Parise, J. B.; Kudoh, Y.","Single-crystal X-ray diffraction study of high-pressure phases of KHCO3 Sample: phase IV, P = 4.6 GPa Note: high-pressure polymorph of kalcinite","American Mineralogist","2007","92","","1270","1275","10.2138/am.2007.2392","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010293","5.8309","","5.8309","","8.2218","","90","","90","","90","","279.536","","","","","","","","","","","","","3","P 41 2 2","P 4w 2c","91","","","","- Fe2 Mg O4 -","- Fe8 Mg4 O16 -","- Fe8 Mg4 O16 -","","","","Palin, E. J.; Harrison, R. J.","A Monte Carlo investigation of the thermodynamics of cation ordering in 2-3 spinels Note: theoretical atom sites using GULP","American Mineralogist","2007","92","","1334","1345","10.2138/am.2007.2485","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010294","5.264","","9.086","","10.099","","90","","100.719","","90","","474.594","","","","","","","","","","","","Hirukawa mine, Ena county, Gifu prefecture, Chibu region, Japan","11","C 1 2 1","C 2y","5","","","Polylithionite","- Al1.56 F1.88 Fe0.38 H0.12 K0.95 Li1.44 Mg0.01 Mn0.17 Na0.05 O10.12 Si3.44 -","- Al1.56 F1.88 Fe0.38 H0.12 K0.95 Li1.44 Mg0.01 Mn0.17 Na0.05 O10.12 Si3.44 -","- Al3.12 F3.76 Fe0.76 H0.24 K1.9 Li2.88 Mg0.02 Mn0.34 Na0.1 O20.24 Si6.88 -","2","0.5","","Brigatti, M. F.; Mottana, A.; Malferrari, D.; Cibin, G.","Crystal structure and chemical composition of Li-, Fe-, and Mn-rich micas Sample: Hirukawa","American Mineralogist","2007","92","","1395","1400","10.2138/am.2007.2497","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010295","5.297","","9.133","","10.168","","90","","100.78","","90","","483.222","","","","","","","","","","","","Mokrusha mine, Yuzhakova village, Murzinka region, Russia","12","C 1 2 1","C 2y","5","","","Polylithionite","- Al1.68 Ca0.01 F1.9 Fe0.36 H0.1 K0.94 Li1.32 Mg0.16 Mn0.16 Na0.04 O10.1 Si3.32 -","- Al1.68 Ca0.01 F1.9 Fe0.36 H0.1 K0.94 Li1.32 Mg0.16 Mn0.16 Na0.04 O10.1 Si3.32 -","- Al3.36 Ca0.02 F3.8 Fe0.72 H0.2 K1.88 Li2.64 Mg0.32 Mn0.32 Na0.08 O20.2 Si6.64 -","2","0.5","","Brigatti, M. F.; Mottana, A.; Malferrari, D.; Cibin, G.","Crystal structure and chemical composition of Li-, Fe-, and Mn-rich micas Sample: Mokrusha","American Mineralogist","2007","92","","1395","1400","10.2138/am.2007.2497","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010296","5.2984","","9.1461","","10.0966","","90","","100.818","","90","","480.583","","","","","","","","","","","","Sawtooth Mountains, Boise county, Idaho, USA","13","C 1 2 1","C 2y","5","","","Masutomilite","- Al1.79 F1.88 Fe0.46 H0.12 K0.92 Li1.06 Mg0.03 Mn0.52 Na0.05 O10.12 Rb0.02 Si3.12 Ti0.02 -","- Al1.79 F1.88 Fe0.46 H0.12 K0.92 Li1.06 Mg0.03 Mn0.52 Na0.05 O10.12 Rb0.02 Si3.12 Ti0.02 -","- Al3.58 F3.76 Fe0.92 H0.24 K1.84 Li2.12 Mg0.06 Mn1.04 Na0.1 O20.24 Rb0.04 Si6.24 Ti0.04 -","2","0.5","","Brigatti, M. F.; Mottana, A.; Malferrari, D.; Cibin, G.","Crystal structure and chemical composition of Li-, Fe-, and Mn-rich micas Sample: Boise","American Mineralogist","2007","92","","1395","1400","10.2138/am.2007.2497","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10",""
"9010297","9.7489","","17.9377","","5.3233","","90","","104.539","","90","","901.09","","","","","","","","","","","","Liset kyanite-eclogite pod, Vestlandet, Norway","13","C 1 2/m 1","-C 2y","12","","","Aluminotaramite","- Al2.88 Ca1.08 F0.14 Fe2.25 H1.86 K0.01 Mg1.64 Mn0.01 Na1.71 O23.86 Si6.24 Ti0.06 Zn0.02 -","- Al2.88 Ca1.08 F0.14 Fe2.25 H1.86 K0.01 Mg1.64 Mn0.01 Na1.71 O23.86 Si6.24 Ti0.06 Zn0.02 -","- Al5.76 Ca2.16 F0.28 Fe4.5 H3.72 K0.02 Mg3.28 Mn0.02 Na3.42 O47.72 Si12.48 Ti0.12 Zn0.04 -","2","0.25","","Oberti, R.; Boiocchi, M.; Smith, D. C.; Medenbach, O.","Aluminotaramite, alumino-magnesiotaramite, and fluoro-alumino-magnesiotaramite: Mineral data and crystal chemistry Locality: Liset kyanite-eclogite pod, near Selje, More og Romsdal County, Vestlandet, Norway Note: amphibole Sample: K22-2","American Mineralogist","2007","92","","1428","1435","10.2138/am.2007.2529","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10",""
"9010298","9.7899","","17.8991","","5.3192","","90","","104.9","","90","","900.745","","","","","","","","","","","","Liset kyanite-eclogite pod, Vestlandet, Norway","9","C 1 2/m 1","-C 2y","12","","","Alumino-magnesiotaramite","- Al3.12 Ca1.22 Fe1.4 H2 Mg2.42 Na1.79 O24 Si6.08 Ti0.04 -","- Al6.24 Ca2.44 Fe2.8 H4 Mg4.84 Na3.58 O48 Si12.16 Ti0.08 -","- Al6.24 Ca2.44 Fe2.8 H4 Mg4.84 Na3.58 O48 Si12.16 Ti0.08 -","","","","Oberti, R.; Boiocchi, M.; Smith, D. C.; Medenbach, O.","Aluminotaramite, alumino-magnesiotaramite, and fluoro-alumino-magnesiotaramite: Mineral data and crystal chemistry Locality: Liset kyanite-eclogite pod, near Selje, More og Romsdal County, Vestlandet, Norway Sample: Q99-3","American Mineralogist","2007","92","","1428","1435","10.2138/am.2007.2529","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010299","9.7414","","17.9095","","5.3335","","90","","104.672","","90","","900.16","","","","","","","","","","","","Jianchang eclogite, Su-Lu coesite-eclogite province, China","11","C 1 2/m 1","-C 2y","12","","","Fluoro-alumino-magnesiotaramite","- Al3.04 Ca1.22 F1.04 Fe1.81 H0.96 Mg2.13 Mn0.02 Na1.76 O22.96 Si6 Ti0.02 -","- Al3.04 Ca1.22 F1.04 Fe1.81 H0.96 Mg2.13 Mn0.02 Na1.76 O22.96 Si6 Ti0.02 -","- Al6.08 Ca2.44 F2.08 Fe3.62 H1.92 Mg4.26 Mn0.04 Na3.52 O45.92 Si12 Ti0.04 -","2","0.25","","Oberti, R.; Boiocchi, M.; Smith, D. C.; Medenbach, O.","Aluminotaramite, alumino-magnesiotaramite, and fluoro-alumino-magnesiotaramite: Mineral data and crystal chemistry Locality: Jianchang eclogite, Su-Lu coesite-eclogite province, China Sample: DJ102-23","American Mineralogist","2007","92","","1428","1435","10.2138/am.2007.2529","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9010300","9.9995","","9.9995","","8.3766","","90","","90","","120","","725.362","","","","","","","","100","","","","intrusive aplite of Snipe River, Tambani, Nyasaland, Malawi","6","P 63","P 6c","173","","","Nepheline","- Al4 Ca0.03 K0.54 Na3.24 O16 Si4 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","","","","Gatta, G. D.; Angel, R. J.","Elastic behavior and pressure-induced structural evolution of nepheline: Implications for the nature of the modulated superstructure Sample: P = .0001 GPa, in air","American Mineralogist","2007","92","","1446","1455","10.2138/am.2007.2501","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010301","9.991","","9.991","","8.3702","","90","","90","","120","","723.576","","","","","","","","100","","","","intrusive aplite of Snipe River, Tambani, Nyasaland, Malawi","6","P 63","P 6c","173","","","Nepheline","- Al4 Ca0.03 K0.54 Na3.24 O16 Si4 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","","","","Gatta, G. D.; Angel, R. J.","Elastic behavior and pressure-induced structural evolution of nepheline: Implications for the nature of the modulated superstructure Sample: P = .0001 GPa, in DAC","American Mineralogist","2007","92","","1446","1455","10.2138/am.2007.2501","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010302","9.8499","","9.8499","","8.2838","","90","","90","","120","","696.023","","","","","","","","1967000","","","","intrusive aplite of Snipe River, Tambani, Nyasaland, Malawi","6","P 63","P 6c","173","","","Nepheline","- Al4 Ca0.03 K0.54 Na3.24 O16 Si4 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","","","","Gatta, G. D.; Angel, R. J.","Elastic behavior and pressure-induced structural evolution of nepheline: Implications for the nature of the modulated superstructure Sample: P = 1.967 GPa","American Mineralogist","2007","92","","1446","1455","10.2138/am.2007.2501","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010303","9.7178","","9.7178","","8.203","","90","","90","","120","","670.871","","","","","","","","4130000","","","","intrusive aplite of Snipe River, Tambani, Nyasaland, Malawi","6","P 63","P 6c","173","","","Nepheline","- Al4 Ca0.03 K0.54 Na3.24 O16 Si4 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","","","","Gatta, G. D.; Angel, R. J.","Elastic behavior and pressure-induced structural evolution of nepheline: Implications for the nature of the modulated superstructure Sample: P = 4.130 GPa","American Mineralogist","2007","92","","1446","1455","10.2138/am.2007.2501","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010304","9.6189","","9.6189","","8.1423","","90","","90","","120","","652.422","","","","","","","","6108000","","","","intrusive aplite of Snipe River, Tambani, Nyasaland, Malawi","6","P 63","P 6c","173","","","Nepheline","- Al4 Ca0.03 K0.54 Na3.24 O16 Si4 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","","","","Gatta, G. D.; Angel, R. J.","Elastic behavior and pressure-induced structural evolution of nepheline: Implications for the nature of the modulated superstructure Sample: P = 6.108 GPa","American Mineralogist","2007","92","","1446","1455","10.2138/am.2007.2501","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010305","9.5587","","9.5587","","8.1051","","90","","90","","120","","641.338","","","","","","","","7462000","","","","intrusive aplite of Snipe River, Tambani, Nyasaland, Malawi","6","P 63","P 6c","173","","","Nepheline","- Al4 Ca0.03 K0.54 Na3.24 O16 Si4 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","","","","Gatta, G. D.; Angel, R. J.","Elastic behavior and pressure-induced structural evolution of nepheline: Implications for the nature of the modulated superstructure Sample: P = 7.462 GPa","American Mineralogist","2007","92","","1446","1455","10.2138/am.2007.2501","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010306","9.9907","","9.9907","","8.3695","","90","","90","","120","","723.472","","","","","","","","100","","","","intrusive aplite of Snipe River, Tambani, Nyasaland, Malawi","6","P 63","P 6c","173","","","Nepheline","- Al4 Ca0.03 K0.54 Na3.24 O16 Si4 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","- Al8 Ca0.06 K1.08 Na6.48 O32 Si8 -","","","","Gatta, G. D.; Angel, R. J.","Elastic behavior and pressure-induced structural evolution of nepheline: Implications for the nature of the modulated superstructure Sample: P = .0001 GPa, in air after decompression","American Mineralogist","2007","92","","1446","1455","10.2138/am.2007.2501","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010307","7.3552","","7.3552","","16.9945","","90","","90","","120","","796.211","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","Hydronium jarosite","- Fe3 H6.92 O14 S2 -","- Fe3 H6.92 O14 S2 -","- Fe9 H20.76 O42 S6 -","3","0.0833333","","Basciano, L. C.; Peterson, R. C.","Jarosite - hydronium jarosite solid solution series with full iron occupancy: Mineralogy and crystal chemistry Locality: synthetic Sample: A","American Mineralogist","2007","92","","1464","1473","10.2138/am.2007.2432","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9010308","7.3521","","7.3521","","17.0108","","90","","90","","120","","796.303","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","Hydronium jarosite","- Fe3 H6.86 K0.1 O14 S2 -","- Fe9 H20.58 K0.3 O42 S6 -","- Fe9 H20.58 K0.3 O42 S6 -","","","","Basciano, L. C.; Peterson, R. C.","Jarosite - hydronium jarosite solid solution series with full iron occupancy: Mineralogy and crystal chemistry Locality: synthetic Sample: B","American Mineralogist","2007","92","","1464","1473","10.2138/am.2007.2432","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9010309","7.3428","","7.3428","","17.0316","","90","","90","","120","","795.261","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","Hydronium jarosite","- Fe3 H6.81 K0.2 O14 S2 -","- Fe9 H20.43 K0.6 O42 S6 -","- Fe9 H20.43 K0.6 O42 S6 -","","","","Basciano, L. C.; Peterson, R. C.","Jarosite - hydronium jarosite solid solution series with full iron occupancy: Mineralogy and crystal chemistry Locality: synthetic Sample: C","American Mineralogist","2007","92","","1464","1473","10.2138/am.2007.2432","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9010310","7.3373","","7.3373","","17.103","","90","","90","","120","","797.399","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","Hydronium jarosite","- Fe3 H6.65 K0.35 O14 S2 -","- Fe9 H19.95 K1.05 O42 S6 -","- Fe9 H19.95 K1.05 O42 S6 -","","","","Basciano, L. C.; Peterson, R. C.","Jarosite - hydronium jarosite solid solution series with full iron occupancy: Mineralogy and crystal chemistry Locality: synthetic Sample: D","American Mineralogist","2007","92","","1464","1473","10.2138/am.2007.2432","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9010311","7.33009","","7.33009","","17.1374","","90","","90","","120","","797.433","","","","","","","","","","","","Synthetic","5","R -3 m :H","-R 3 2""","166","","","Jarosite","- Fe3 H6.49 K0.51 O14 S2 -","- Fe9 H19.47 K1.53 O42 S6 -","- Fe9 H19.47 K1.53 O42 S6 -","","","","Basciano, L. C.; Peterson, R. C.","Jarosite - hydronium jarosite solid solution series with full iron occupancy: Mineralogy and crystal chemistry Sample: E","American Mineralogist","2007","92","","1464","1473","10.2138/am.2007.2432","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010312","7.3207","","7.3207","","17.1517","","90","","90","","120","","796.055","","","","","","","","","","","","Synthetic","5","R -3 m :H","-R 3 2""","166","","","Jarosite","- Fe3 H6.4 K0.6 O14 S2 -","- Fe9 H19.2 K1.8 O42 S6 -","- Fe9 H19.2 K1.8 O42 S6 -","","","","Basciano, L. C.; Peterson, R. C.","Jarosite - hydronium jarosite solid solution series with full iron occupancy: Mineralogy and crystal chemistry Sample: F","American Mineralogist","2007","92","","1464","1473","10.2138/am.2007.2432","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010313","7.3112","","7.3112","","17.1792","","90","","90","","120","","795.263","","","","","","","","","","","","Synthetic","5","R -3 m :H","-R 3 2""","166","","","Jarosite","- Fe3 H6.3 K0.7 O14 S2 -","- Fe9 H18.9 K2.1 O42 S6 -","- Fe9 H18.9 K2.1 O42 S6 -","","","","Basciano, L. C.; Peterson, R. C.","Jarosite - hydronium jarosite solid solution series with full iron occupancy: Mineralogy and crystal chemistry Sample: G","American Mineralogist","2007","92","","1464","1473","10.2138/am.2007.2432","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010314","7.307","","7.307","","17.1916","","90","","90","","120","","794.923","","","","","","","","","","","","Synthetic","5","R -3 m :H","-R 3 2""","166","","","Jarosite","- Fe3 H6.14 K0.86 O14 S2 -","- Fe9 H18.42 K2.58 O42 S6 -","- Fe9 H18.42 K2.58 O42 S6 -","","","","Basciano, L. C.; Peterson, R. C.","Jarosite - hydronium jarosite solid solution series with full iron occupancy: Mineralogy and crystal chemistry Sample: H","American Mineralogist","2007","92","","1464","1473","10.2138/am.2007.2432","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010315","7.30293","","7.30293","","17.2043","","90","","90","","120","","794.624","","","","","","","","","","","","Synthetic","5","R -3 m :H","-R 3 2""","166","","","Jarosite","- Fe3 H6.05 K0.95 O14 S2 -","- Fe9 H18.15 K2.85 O42 S6 -","- Fe9 H18.15 K2.85 O42 S6 -","","","","Basciano, L. C.; Peterson, R. C.","Jarosite - hydronium jarosite solid solution series with full iron occupancy: Mineralogy and crystal chemistry Sample: I","American Mineralogist","2007","92","","1464","1473","10.2138/am.2007.2432","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010316","7.3063","","7.3063","","17.0341","","90","","90","","120","","787.49","","","","","","","","","","","","Synthetic","5","R -3 m :H","-R 3 2""","166","","","Jarosite","- Fe2.79 H6.13 K0.87 O14 S2 -","- Fe8.37 H18.39 K2.61 O42 S6 -","- Fe8.37 H18.39 K2.61 O42 S6 -","","","","Basciano, L. C.; Peterson, R. C.","Jarosite - hydronium jarosite solid solution series with full iron occupancy: Mineralogy and crystal chemistry Sample: J","American Mineralogist","2007","92","","1464","1473","10.2138/am.2007.2432","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010317","7.3478","","7.3478","","17.028","","90","","90","","120","","796.176","","","","","","","","","","","","Rio Tonto, Huelva, Spain","5","R -3 m :H","-R 3 2""","166","","","Jarosite","- Fe3 H7 K0.02 O14 S2 -","- Fe9 H21 K0.06 O42 S6 -","- Fe9 H21 K0.06 O42 S6 -","","","","Basciano, L. C.; Peterson, R. C.","Jarosite - hydronium jarosite solid solution series with full iron occupancy: Mineralogy and crystal chemistry Sample: 7-13-2-1","American Mineralogist","2007","92","","1464","1473","10.2138/am.2007.2432","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010318","7.3128","","7.3128","","17.1973","","90","","90","","120","","796.45","","","","","","","","","","","","Rio Tonto, Huelva, Spain","5","R -3 m :H","-R 3 2""","166","","","Jarosite","- Fe2.73 H6.16 K0.84 O14 S2 -","- Fe8.19 H18.48 K2.52 O42 S6 -","- Fe8.19 H18.48 K2.52 O42 S6 -","","","","Basciano, L. C.; Peterson, R. C.","Jarosite - hydronium jarosite solid solution series with full iron occupancy: Mineralogy and crystal chemistry Sample: 7-11-3-8 Note: could not reproduce reported bond lengths","American Mineralogist","2007","92","","1464","1473","10.2138/am.2007.2432","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010323","9.4278","","8.5651","","5.2262","","90","","107.624","","90","","402.208","","","","","","","","","","","","Synthetic","4","C 1 2/c 1","-C 2yc","15","","","Jadeite","- Al Na O6 Si2 -","- Al4 Na4 O24 Si8 -","- Al4 Na4 O24 Si8 -","","","","Nestola, F.; Tribaudino, M.; Ballaran, T. B.; Liebske, C.; Bruno, M.","The crystal structures of pyroxenes along the jadeite - hedenbergite and jadeite - aegirine joins Sample: Jd100Ae0","American Mineralogist","2007","92","","1492","1501","10.2138/am.2007.2540","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010324","9.4781","","8.618","","5.2449","","90","","107.57","","90","","408.429","","","","","","","","","","","","Synthetic","5","C 1 2/c 1","-C 2yc","15","","","Jadeite","- Al0.74 Fe0.26 Na O6 Si2 -","- Al2.96 Fe1.04 Na4 O24 Si8 -","- Al2.96 Fe1.04 Na4 O24 Si8 -","","","","Nestola, F.; Tribaudino, M.; Ballaran, T. B.; Liebske, C.; Bruno, M.","The crystal structures of pyroxenes along the jadeite - hedenbergite and jadeite - aegirine joins Sample: Jd74Ae26","American Mineralogist","2007","92","","1492","1501","10.2138/am.2007.2540","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010325","9.5663","","8.704","","5.2733","","90","","107.6","","90","","418.529","","","","","","","","","","","","Synthetic","5","C 1 2/c 1","-C 2yc","15","","","Aegirine","- Al0.35 Fe0.65 Na O6 Si2 -","- Al1.4 Fe2.6 Na4 O24 Si8 -","- Al1.4 Fe2.6 Na4 O24 Si8 -","","","","Nestola, F.; Tribaudino, M.; Ballaran, T. B.; Liebske, C.; Bruno, M.","The crystal structures of pyroxenes along the jadeite - hedenbergite and jadeite - aegirine joins Sample: Jd35Ae65","American Mineralogist","2007","92","","1492","1501","10.2138/am.2007.2540","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010326","9.6623","","8.8","","5.2956","","90","","107.579","","90","","429.248","","","","","","","","","","","","Synthetic","4","C 1 2/c 1","-C 2yc","15","","","Aegirine","- Fe Na O6 Si2 -","- Fe4 Na4 O24 Si8 -","- Fe4 Na4 O24 Si8 -","","","","Nestola, F.; Tribaudino, M.; Ballaran, T. B.; Liebske, C.; Bruno, M.","The crystal structures of pyroxenes along the jadeite - hedenbergite and jadeite - aegirine joins Sample: Jd0Ae100","American Mineralogist","2007","92","","1492","1501","10.2138/am.2007.2540","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010327","9.6031","","8.7735","","5.2656","","90","","106.725","","90","","424.874","","","","","","","","","","","","Synthetic","6","C 1 2/c 1","-C 2yc","15","","","Jadeite","- Al0.52 Ca0.47 Fe0.51 Na0.53 O6 Si2 -","- Al2.08 Ca1.88 Fe2.04 Na2.12 O24 Si8 -","- Al2.08 Ca1.88 Fe2.04 Na2.12 O24 Si8 -","","","","Nestola, F.; Tribaudino, M.; Ballaran, T. B.; Liebske, C.; Bruno, M.","The crystal structures of pyroxenes along the jadeite - hedenbergite and jadeite - aegirine joins Sample: Jd53Hd47","American Mineralogist","2007","92","","1492","1501","10.2138/am.2007.2540","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010328","9.734","","8.9103","","5.2682","","90","","105.904","","90","","439.436","","","","","","","","","","","","Synthetic","6","C 1 2/c 1","-C 2yc","15","","","Hedenbergite","- Al0.24 Ca0.76 Fe0.76 Na0.24 O6 Si2 -","- Al0.96 Ca3.04 Fe3.04 Na0.96 O24 Si8 -","- Al0.96 Ca3.04 Fe3.04 Na0.96 O24 Si8 -","","","","Nestola, F.; Tribaudino, M.; Ballaran, T. B.; Liebske, C.; Bruno, M.","The crystal structures of pyroxenes along the jadeite - hedenbergite and jadeite - aegirine joins Sample: Jd24Hde76","American Mineralogist","2007","92","","1492","1501","10.2138/am.2007.2540","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010329","9.8447","","9.0234","","5.2509","","90","","104.862","","90","","450.847","","","","","","","","","","","","Synthetic","4","C 1 2/c 1","-C 2yc","15","","","Hedenbergite","- Ca0.99 Fe1.01 O6 Si2 -","- Ca3.96 Fe4.04 O24 Si8 -","- Ca3.96 Fe4.04 O24 Si8 -","","","","Nestola, F.; Tribaudino, M.; Ballaran, T. B.; Liebske, C.; Bruno, M.","The crystal structures of pyroxenes along the jadeite - hedenbergite and jadeite - aegirine joins Sample: Jd0Hd100","American Mineralogist","2007","92","","1492","1501","10.2138/am.2007.2540","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010330","29.018","","5.1892","","19.695","","90","","106.987","","90","","2836.29","","","","","","","","","","","","Santa Rita mine, Grant County, New Mexico","5","C 1 2/c 1","-C 2yc","15","","","Meurigite-K","- Fe7.452 H21 K0.924 O37.435 P5.454 -","- Fe7.452 H19.87 K0.924 O37.435 P5.454 -","- Fe29.808 H79.48 K3.696 O149.74 P21.816 -","4","0.5","","Kampf, A. R.; Pluth, J. J.; Chen, Y. S.","The crystal structure of meurigite","American Mineralogist","2007","92","","1518","1524","10.2138/am.2007.2486","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010331","14.972","","14.137","","14.594","","90","","90","","90","","3088.95","","","","","","","","","","","","Khibiny massif, Kola Peninsula, Russia","8","P c c a","-P 2a 2ac","54","","","Yakovenchukite-(Y)","- Ca1.12 H8 K2.76 Na O34 Si12 Y1.66 Yb0.34 -","- Ca1.12 H8 K2.76 Na O34 Si12 Y1.66 Yb0.34 -","- Ca4.48 H32 K11.04 Na4 O136 Si48 Y6.64 Yb1.36 -","4","0.5","","Krivovichev, S. V.; Pakhomovsky, Y. A.; Ivanyuk, G. Y.; Mikhailova, J. A.; Men'shikov, Y. P.; Armbruster, T.; Selivanova, E. A.; Meisser, N.","Yakovenchukite-(Y), K3NaCaY2(Si12O30)(H2O)4, a new mineral from the Khibiny massif, Kola Peninsula, Russia: a novel type of octahedral-tetrahedral open-framework structure","American Mineralogist","2007","92","","1525","1530","10.2138/am.2007.2488","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010332","11.4586","","11.4586","","11.4586","","90","","90","","90","","1504.51","","","","","","","","100","","","","Synthetic","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al2 Co3 O12 Si3 -","- Al16 Co24 O96 Si24 -","- Al16 Co24 O96 Si24 -","","","","Taran, M. N.; Nestola, F.; Ohashi, H.; Koch-Muller M; Balic-Zunic T; Olsen, L. A.","High-pressure optical spectroscopy and X-ray diffraction studies on synthetic cobalt aluminum silicate garnet Sample: P = 0.0001 GPa","American Mineralogist","2007","92","","1616","1623","10.2138/am.2007.2457","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010333","11.4264","","11.4264","","11.4264","","90","","90","","90","","1491.86","","","","","","","","1800000","","","","Synthetic","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al2 Co3 O12 Si3 -","- Al16 Co24 O96 Si24 -","- Al16 Co24 O96 Si24 -","","","","Taran, M. N.; Nestola, F.; Ohashi, H.; Koch-Muller M; Balic-Zunic T; Olsen, L. A.","High-pressure optical spectroscopy and X-ray diffraction studies on synthetic cobalt aluminum silicate garnet Sample: P = 1.80 GPa","American Mineralogist","2007","92","","1616","1623","10.2138/am.2007.2457","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010334","11.4063","","11.4063","","11.4063","","90","","90","","90","","1484","","","","","","","","2780000","","","","Synthetic","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al2 Co3 O12 Si3 -","- Al16 Co24 O96 Si24 -","- Al16 Co24 O96 Si24 -","","","","Taran, M. N.; Nestola, F.; Ohashi, H.; Koch-Muller M; Balic-Zunic T; Olsen, L. A.","High-pressure optical spectroscopy and X-ray diffraction studies on synthetic cobalt aluminum silicate garnet Sample: P = 2.78 GPa","American Mineralogist","2007","92","","1616","1623","10.2138/am.2007.2457","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010335","11.3956","","11.3956","","11.3956","","90","","90","","90","","1479.83","","","","","","","","2990000","","","","Synthetic","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al2 Co3 O12 Si3 -","- Al16 Co24 O96 Si24 -","- Al16 Co24 O96 Si24 -","","","","Taran, M. N.; Nestola, F.; Ohashi, H.; Koch-Muller M; Balic-Zunic T; Olsen, L. A.","High-pressure optical spectroscopy and X-ray diffraction studies on synthetic cobalt aluminum silicate garnet Sample: P = 2.99 GPa","American Mineralogist","2007","92","","1616","1623","10.2138/am.2007.2457","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010336","11.3692","","11.3692","","11.3692","","90","","90","","90","","1469.57","","","","","","","","4770000","","","","Synthetic","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al2 Co3 O12 Si3 -","- Al16 Co24 O96 Si24 -","- Al16 Co24 O96 Si24 -","","","","Taran, M. N.; Nestola, F.; Ohashi, H.; Koch-Muller M; Balic-Zunic T; Olsen, L. A.","High-pressure optical spectroscopy and X-ray diffraction studies on synthetic cobalt aluminum silicate garnet Sample: P = 4.77 GPa","American Mineralogist","2007","92","","1616","1623","10.2138/am.2007.2457","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010337","11.366","","11.366","","11.366","","90","","90","","90","","1468.33","","","","","","","","4840000","","","","Synthetic","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al2 Co3 O12 Si3 -","- Al16 Co24 O96 Si24 -","- Al16 Co24 O96 Si24 -","","","","Taran, M. N.; Nestola, F.; Ohashi, H.; Koch-Muller M; Balic-Zunic T; Olsen, L. A.","High-pressure optical spectroscopy and X-ray diffraction studies on synthetic cobalt aluminum silicate garnet Sample: P = 4.84 GPa","American Mineralogist","2007","92","","1616","1623","10.2138/am.2007.2457","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010338","11.3351","","11.3351","","11.3351","","90","","90","","90","","1456.39","","","","","","","","6550000","","","","Synthetic","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al2 Co3 O12 Si3 -","- Al16 Co24 O96 Si24 -","- Al16 Co24 O96 Si24 -","","","","Taran, M. N.; Nestola, F.; Ohashi, H.; Koch-Muller M; Balic-Zunic T; Olsen, L. A.","High-pressure optical spectroscopy and X-ray diffraction studies on synthetic cobalt aluminum silicate garnet Sample: P = 6.55 GPa","American Mineralogist","2007","92","","1616","1623","10.2138/am.2007.2457","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010339","11.3262","","11.3262","","11.3262","","90","","90","","90","","1452.96","","","","","","","","7010000","","","","Synthetic","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al2 Co3 O12 Si3 -","- Al16 Co24 O96 Si24 -","- Al16 Co24 O96 Si24 -","","","","Taran, M. N.; Nestola, F.; Ohashi, H.; Koch-Muller M; Balic-Zunic T; Olsen, L. A.","High-pressure optical spectroscopy and X-ray diffraction studies on synthetic cobalt aluminum silicate garnet Sample: P = 7.01 GPa","American Mineralogist","2007","92","","1616","1623","10.2138/am.2007.2457","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010340","11.3255","","11.3255","","11.3255","","90","","90","","90","","1452.69","","","","","","","","7250000","","","","Synthetic","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al2 Co3 O12 Si3 -","- Al16 Co24 O96 Si24 -","- Al16 Co24 O96 Si24 -","","","","Taran, M. N.; Nestola, F.; Ohashi, H.; Koch-Muller M; Balic-Zunic T; Olsen, L. A.","High-pressure optical spectroscopy and X-ray diffraction studies on synthetic cobalt aluminum silicate garnet Sample: P = 7.25 GPa","American Mineralogist","2007","92","","1616","1623","10.2138/am.2007.2457","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010341","11.32","","11.32","","11.32","","90","","90","","90","","1450.57","","","","","","","","7400000","","","","Synthetic","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al2 Co3 O12 Si3 -","- Al16 Co24 O96 Si24 -","- Al16 Co24 O96 Si24 -","","","","Taran, M. N.; Nestola, F.; Ohashi, H.; Koch-Muller M; Balic-Zunic T; Olsen, L. A.","High-pressure optical spectroscopy and X-ray diffraction studies on synthetic cobalt aluminum silicate garnet Sample: P = 7.40 GPa","American Mineralogist","2007","92","","1616","1623","10.2138/am.2007.2457","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010342","8.0888","","8.0888","","8.0888","","90","","90","","90","","529.24","","","","","","","","100","","","","Sri Lanka","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al16 Mg8 O32 -","- Al16 Mg8 O32 -","","","","Nestola, F.; Boffa Ballaran, T.; Balic-Zunic T; Princivalle, F.; Secco, L.; Dal Negro, A.","Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: the independency on the degree of cation order Locality: Sri Lanka Sample: P = 0.0001 GPa, in air, ordered","American Mineralogist","2007","92","","1838","1843","10.2138/am.2007.2573","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010343","8.0961","","8.0961","","8.0961","","90","","90","","90","","530.674","","","","","","","","100","","","","Sri Lanka","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al16 Mg8 O32 -","- Al16 Mg8 O32 -","","","","Nestola, F.; Boffa Ballaran, T.; Balic-Zunic T; Princivalle, F.; Secco, L.; Dal Negro, A.","Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: the independency on the degree of cation order Locality: Sri Lanka Sample: P = 0.0001 GPa, in DAC, ordered","American Mineralogist","2007","92","","1838","1843","10.2138/am.2007.2573","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010344","8.0864","","8.0864","","8.0864","","90","","90","","90","","528.769","","","","","","","","440000","","","","Sri Lanka","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al16 Mg8 O32 -","- Al16 Mg8 O32 -","","","","Nestola, F.; Boffa Ballaran, T.; Balic-Zunic T; Princivalle, F.; Secco, L.; Dal Negro, A.","Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: the independency on the degree of cation order Locality: Sri Lanka Sample: P = 0.44 GPa, ordered","American Mineralogist","2007","92","","1838","1843","10.2138/am.2007.2573","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010345","8.0494","","8.0494","","8.0494","","90","","90","","90","","521.543","","","","","","","","2920000","","","","Sri Lanka","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al16 Mg8 O32 -","- Al16 Mg8 O32 -","","","","Nestola, F.; Boffa Ballaran, T.; Balic-Zunic T; Princivalle, F.; Secco, L.; Dal Negro, A.","Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: the independency on the degree of cation order Locality: Sri Lanka Sample: P = 2.92 GPa, ordered","American Mineralogist","2007","92","","1838","1843","10.2138/am.2007.2573","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010346","7.9996","","7.9996","","7.9996","","90","","90","","90","","511.923","","","","","","","","7340000","","","","Sri Lanka","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al16 Mg8 O32 -","- Al16 Mg8 O32 -","","","","Nestola, F.; Boffa Ballaran, T.; Balic-Zunic T; Princivalle, F.; Secco, L.; Dal Negro, A.","Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: the independency on the degree of cation order Locality: Sri Lanka Sample: P = 7.34 GPa, ordered","American Mineralogist","2007","92","","1838","1843","10.2138/am.2007.2573","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010347","7.9921","","7.9921","","7.9921","","90","","90","","90","","510.485","","","","","","","","8030000","","","","Sri Lanka","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al16 Mg8 O32 -","- Al16 Mg8 O32 -","","","","Nestola, F.; Boffa Ballaran, T.; Balic-Zunic T; Princivalle, F.; Secco, L.; Dal Negro, A.","Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: the independency on the degree of cation order Locality: Sri Lanka Sample: P = 8.03 GPa, ordered","American Mineralogist","2007","92","","1838","1843","10.2138/am.2007.2573","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010348","8.0849","","8.0849","","8.0849","","90","","90","","90","","528.474","","","","","","","","100","","","","Sri Lanka","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al16 Mg8 O32 -","- Al16 Mg8 O32 -","","","","Nestola, F.; Boffa Ballaran, T.; Balic-Zunic T; Princivalle, F.; Secco, L.; Dal Negro, A.","Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: the independency on the degree of cation order Locality: Sri Lanka Sample: P = 0.0001 GPa, in air, disordered","American Mineralogist","2007","92","","1838","1843","10.2138/am.2007.2573","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:24",""
"9010349","8.0899","","8.0899","","8.0899","","90","","90","","90","","529.455","","","","","","","","100","","","","Sri Lanka","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al16 Mg8 O32 -","- Al16 Mg8 O32 -","","","","Nestola, F.; Boffa Ballaran, T.; Balic-Zunic T; Princivalle, F.; Secco, L.; Dal Negro, A.","Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: the independency on the degree of cation order Locality: Sri Lanka Sample: P = 0.0001 GPa, in DAC, disordered","American Mineralogist","2007","92","","1838","1843","10.2138/am.2007.2573","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:26",""
"9010350","8.0801","","8.0801","","8.0801","","90","","90","","90","","527.534","","","","","","","","440000","","","","Sri Lanka","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al16 Mg8 O32 -","- Al16 Mg8 O32 -","","","","Nestola, F.; Boffa Ballaran, T.; Balic-Zunic T; Princivalle, F.; Secco, L.; Dal Negro, A.","Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: the independency on the degree of cation order Locality: Sri Lanka Sample: P = 0.440 GPa, disordered","American Mineralogist","2007","92","","1838","1843","10.2138/am.2007.2573","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:26",""
"9010351","8.0451","","8.0451","","8.0451","","90","","90","","90","","520.708","","","","","","","","2924000","","","","Sri Lanka","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al16 Mg8 O32 -","- Al16 Mg8 O32 -","","","","Nestola, F.; Boffa Ballaran, T.; Balic-Zunic T; Princivalle, F.; Secco, L.; Dal Negro, A.","Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: the independency on the degree of cation order Locality: Sri Lanka Sample: P = 2.924 GPa, disordered","American Mineralogist","2007","92","","1838","1843","10.2138/am.2007.2573","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:26",""
"9010352","7.9928","","7.9928","","7.9928","","90","","90","","90","","510.619","","","","","","","","7342000","","","","Sri Lanka","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al16 Mg8 O32 -","- Al16 Mg8 O32 -","","","","Nestola, F.; Boffa Ballaran, T.; Balic-Zunic T; Princivalle, F.; Secco, L.; Dal Negro, A.","Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: the independency on the degree of cation order Locality: Sri Lanka Sample: P = 7.342 GPa, disordered","American Mineralogist","2007","92","","1838","1843","10.2138/am.2007.2573","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:26",""
"9010353","7.9874","","7.9874","","7.9874","","90","","90","","90","","509.585","","","","","","","","8027000","","","","Sri Lanka","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al16 Mg8 O32 -","- Al16 Mg8 O32 -","","","","Nestola, F.; Boffa Ballaran, T.; Balic-Zunic T; Princivalle, F.; Secco, L.; Dal Negro, A.","Comparative compressibility and structural behavior of spinel MgAl2O4 at high pressures: the independency on the degree of cation order Locality: Sri Lanka Sample: P = 8.027 GPa, disordered","American Mineralogist","2007","92","","1838","1843","10.2138/am.2007.2573","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:28",""
"9010354","3.13451","","9.87568","","7.29518","","90","","90","","90","","225.825","","","","2","","","","100","","","","","3","C m c m","-C 2c 2","63","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Note: Ca(z) and O(y) changed to match normal structure Sample: T = 2.0 K, P = 1 bar","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9010355","3.13493","","9.87709","","7.29562","","90","","90","","90","","225.901","","","","100","","","","100","","","","","3","C m c m","-C 2c 2","63","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Note: Ca(z) and O(y) changed to match normal structure Sample: T = 100.0 K, P = 1 bar","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:28",""
"9010356","3.13622","","9.88198","","7.29871","","90","","90","","90","","226.202","","","","205","","","","100","","","","","3","C m c m","-C 2c 2","63","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Note: Ca(z) and O(y) changed to match normal structure Sample: T = 205.0 K, P = 1 bar","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:28",""
"9010357","3.13645","","9.88352","","7.29903","","90","","90","","90","","226.264","","","","293","","","","100","","","","","3","C m c m","-C 2c 2","63","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Note: Ca(z) and O(y) changed to match normal structure Sample: T = 293 K, P = 1 bar","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:28",""
"9010358","3.13642","","9.88337","","7.29891","","90","","90","","90","","226.255","","","","293","","","","","","","","","3","C m c 21","C 2c -2","36","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Sample: T = 293 K","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:28",""
"9010359","3.1345","","9.87576","","7.29521","","90","","90","","90","","225.827","","","","2","","","","","","","","","3","C m c 21","C 2c -2","36","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Sample: T = 2.0 K","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9010360","3.101","","9.6588","","7.2111","","90","","90","","90","","215.986","","","","","","","","9720000","","","","","3","C m c 21","C 2c -2","36","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Sample: P = 9.72 GPa, room temp","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:28",""
"9010361","3.14341","","9.8816","","7.3021","","90","","90","","90","","226.817","","","","","","","","0","","","","","3","C m c m","-C 2c 2","63","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Note: Ca(z) and O(y) changed to match normal structure Sample: P = 0.00 GPa","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:30",""
"9010362","3.1332","","9.8271","","7.2805","","90","","90","","90","","224.169","","","","","","","","2170000","","","","","3","C m c m","-C 2c 2","63","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Note: Ca(z) and O(y) changed to match normal structure Sample: P = 2.17 GPa","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:30",""
"9010363","3.1193","","9.7505","","7.2496","","90","","90","","90","","220.495","","","","","","","","5400000","","","","","3","C m c m","-C 2c 2","63","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Note: Ca(z) and O(y) changed to match normal structure Sample: P = 5.40 GPa","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:30",""
"9010364","3.1084","","9.6931","","7.228","","90","","90","","90","","217.78","","","","","","","","7950000","","","","","3","C m c m","-C 2c 2","63","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Note: Ca(z) and O(y) changed to match normal structure Sample: P = 7.95 GPa","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:30",""
"9010365","3.1011","","9.6587","","7.2111","","90","","90","","90","","215.991","","","","","","","","9720000","","","","","3","C m c m","-C 2c 2","63","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Note: Ca(z) and O(y) changed to match normal structure Sample: P = 9.72 GPa","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:30",""
"9010366","3.1015","","9.6551","","7.2141","","90","","90","","90","","216.028","","","","","","","","9680000","","","","","3","C m c m","-C 2c 2","63","","","","- Ca Ir O3 -","- Ca4 Ir4 O12 -","- Ca4 Ir4 O12 -","","","","Martin, C. D.; Smith, R. I.; Marshall, W. G.; Parise, J. B.","High-pressure structure and bonding in CaIrO3: the structure model of MgSiO3 post-perovskite investigated with time-of-flight neutron powder diffraction Note: Ca(z) and O(y) changed to match normal structure Sample: P = 9.68 GPa","American Mineralogist","2007","92","","1912","1918","10.2138/am.2007.2585","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:30",""
"9010367","4.9458","","4.9458","","10.9526","","90","","90","","120","","232.018","","","","","","","","","","","","Cioclovina Cave, Romania","3","P 31 2 1","P 31 2""","152","","","Berlinite","- Al O4 P -","- Al3 O12 P3 -","- Al3 O12 P3 -","","","","Onac, B. P.; Effenberger, H. S.","Re-examination of berlinite (AlPO4) from the Cioclovina Cave, Romania","American Mineralogist","2007","92","","1998","2001","10.2138/am.2007.2581","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:30",""
"9010614","15.678","","15.678","","11.828","","90","","90","","90","","2907.32","","","","","","","","","","","","Wiluy River, Sakha-Yakutia, Russia","10","P 4/n n c :2","-P 4a 2bc","126","","","Vesuvianite","- Al8.318 B0.484 Ca19 Cl0.18 Fe0.422 H12.672 Mg4.154 Mn0.106 O77.82 Si16.232 -","- Al8.318 B0.484 Ca19 Cl0.18 Fe0.422 H12.672 Mg4.154 Mn0.106 O77.82 Si16.232 -","- Al16.636 B0.968 Ca38 Cl0.36 Fe0.844 H25.344 Mg8.308 Mn0.212 O155.64 Si32.464 -","2","0.125","","Galuskin, E. V.; Galuskina, I. O.; Stadnicka, K.; Armbruster, T.; Kozanecki, M.","The crystal structure of Si-deficient, OH-substituted, boron-bearing vesuvianite from the Wiluy River, Sakha-Yakutia, Russia","The Canadian Mineralogist","2007","45","","239","248","10.2113/gscanmin.45.2.239","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010615","9.8125","","18.0188","","5.2781","","90","","104.62","","90","","903.002","","","","","","","","","","","","Biancavilla, Mt. Etna, Sicily, Italy","12","C 1 2/m 1","-C 2y","12","","","Fluoro-edenite","- Al0.64 Ca1.506 Cl0.02 F1.97 Fe0.497 K0.157 Mg4.255 Mn0.062 Na0.802 O22 Si7.464 Ti0.062 -","- Al0.64 Ca1.506 Cl0.02 F1.97 Fe0.497 K0.157 Mg4.255 Mn0.062 Na0.802 O22 Si7.464 Ti0.062 -","- Al1.28 Ca3.012 Cl0.04 F3.94 Fe0.994 K0.314 Mg8.51 Mn0.124 Na1.604 O44 Si14.928 Ti0.124 -","2","0.25","","Gianfagna, A.; Andreozzi, G. B.; Ballirano, P.; Mazziotti-Tagliani S; Bruni, B. M.","Structural and chemical contrasts between prismatic and fibrous fluoro-edenite from Biancavilla, Sicily, Italy Locality: Biancavilla, Mt. Etna, Sicily, Italy","The Canadian Mineralogist","2007","45","","249","262","10.2113/gscanmin.45.2.249","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010616","12.4595","","11.5955","","12.7504","","90","","90","","90","","1842.1","","","","","","","","","","","","Larsemann Hills, Prydz Bay, East Antarctica","7","P b c a","-P 2ac 2ab","61","","","Tassieite","- Ca2 Fe3.314 H4 Mg2.686 Na0.463 O26 P6 -","- Ca2 Fe3.314 H4 Mg2.686 Na0.463 O26 P6 -","- Ca8 Fe13.256 H16 Mg10.744 Na1.852 O104 P24 -","4","0.5","","Grew, E. S.; Armbruster, T.; Medenbach, O.; Yates, M. G.; Carson, C. J.","Tassieite, (Na,_)Ca2(Mg,Fe2+,Fe3+)2(Fe3+,Mg)2(Fe2+,Mg)2(PO4)6*2H2O, a new hydrothermal wicksite-group mineral in fluorapatite nodules from granulite- facies paragneiss in the Larsemann Hills, Prydz Bay, East Antarctica Sample: 2","The Canadian Mineralogist","2007","45","","293","305","10.2113/gscanmin.45.2.293","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9010617","12.4595","","11.5955","","12.7504","","90","","90","","90","","1842.1","","","","","","","","","","","","Larsemann Hills, Prydz Bay, East Antarctica","7","P b c a","-P 2ac 2ab","61","","","Tassieite","- Ca2 Fe3.254 H4 Mg2.746 Na0.478 O26 P6 -","- Ca2 Fe3.254 H4 Mg2.746 Na0.478 O26 P6 -","- Ca8 Fe13.016 H16 Mg10.984 Na1.912 O104 P24 -","4","0.5","","Grew, E. S.; Armbruster, T.; Medenbach, O.; Yates, M. G.; Carson, C. J.","Tassieite, (Na,_)Ca2(Mg,Fe2+,Fe3+)2(Fe3+,Mg)2(Fe2+,Mg)2(PO4)6*2H2O, a new hydrothermal wicksite-group mineral in fluorapatite nodules from granulite- facies paragneiss in the Larsemann Hills, Prydz Bay, East Antarctica Sample: 1","The Canadian Mineralogist","2007","45","","293","305","10.2113/gscanmin.45.2.293","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010618","6.8364","","6.8364","","13.8459","","90","","90","","120","","560.411","","","","","","","","","","","","132N deposit, Widgiemooltha, Australia","7","R -3 m :H","-R 3 2""","166","","","Gillardite","- Cl2 Co0.012 Cu3.081 Fe0.004 H6 Ni0.903 O6 -","- Cl6 Co0.036 Cu9.243 Fe0.012 H18 Ni2.709 O18 -","- Cl6 Co0.036 Cu9.243 Fe0.012 H18 Ni2.709 O18 -","","","","Clissold, M. E.; Leverett, P.; Williams, P. A.; Hibbs, D. E.; Nickel, E. H.","The structure of gillardite, the Ni-analogue of herbertsmithite, from Widgiemooltha, Western Australia","The Canadian Mineralogist","2007","45","","317","320","10.2113/gscanmin.45.2.317","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010619","7.4805","","7.4805","","11.8836","","90","","90","","120","","575.89","","","","330","","","","","","","","Eagle mine, Colorado, USA","5","P -3 m 1","-P 3 2""","164","","","Antimonpearceite","- Ag12.96 As0.154 Cu3.04 S11 Sb1.846 -","- Ag12.96 As0.154 Cu3.04 S11 Sb1.846 -","- Ag12.96 As0.154 Cu3.04 S11 Sb1.846 -","","","","Bindi, L.; Evain, M.; Menchetti, S.","Complex twinning, polytypism and disorder phenomena in the crystal structures of antimonpearceite and arsenpolybasite Locality: Eagle mine, Colorado, USA Sample: T = 330 K","The Canadian Mineralogist","2007","45","","321","333","10.2113/gscanmin.45.2.321","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010620","14.9746","","14.9746","","11.9982","","90","","90","","120","","2330.01","","","","","","","","","","","","St. Joachimsthal, Bohemia, Czech Republic","4","P 3 2 1","P 3 2""","150","","","Arsenpolybasite","- Ag29.046 As4 Cu2.954 S22 -","- Ag58.092 As8 Cu5.908 S44 -","- Ag58.092 As8 Cu5.908 S44 -","","","","Bindi, L.; Evain, M.; Menchetti, S.","Complex twinning, polytypism and disorder phenomena in the crystal structures of antimonpearceite and arsenpolybasite Locality: St. Joachimsthal, Bohemia, Czech Republic Sample: 221","The Canadian Mineralogist","2007","45","","321","333","10.2113/gscanmin.45.2.321","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010621","26.036","","15.0319","","24.042","","90","","90","","90","","9409.33","","","","","","","","","","","","Freiberg, Germany","5","C 1 2/c 1","-C 2yc","15","","","Arsenpolybasite","- Ag29.786 As3.762 Cu2.214 S22 Sb0.238 -","- Ag238.288 As30.096 Cu17.712 S176 Sb1.904 -","- Ag238.288 As30.096 Cu17.712 S176 Sb1.904 -","","","","Bindi, L.; Evain, M.; Menchetti, S.","Complex twinning, polytypism and disorder phenomena in the crystal structures of antimonpearceite and arsenpolybasite Locality: Freiberg, Germany Sample: 222","The Canadian Mineralogist","2007","45","","321","333","10.2113/gscanmin.45.2.321","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010622","13.095","","4.0032","","14.711","","90","","115.59","","90","","695.532","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Kudriavite","- Bi4.173 Cd In0.771 Pb3.06 S7.6 Se0.4 -","- Bi8.346 Cd2 In1.542 Pb6.12 S15.2 Se0.8 -","- Bi8.346 Cd2 In1.542 Pb6.12 S15.2 Se0.8 -","","","","Balic-Zunic T; Makovicky, E.","The crystal structure of kudriavite, (Cd,Pb)Bi2S4","The Canadian Mineralogist","2007","45","","437","443","10.2113/gscanmin.45.3.437","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010623","9.005","","11.046","","9.349","","90","","90","","90","","929.938","","","","","","","","","","","","Great fissure Tolbachik eruption, Kamchatka Peninsula, Russia","5","I b a m","-I 2 2c","72","","","Leningradite","- Cl2 Cu3 O8 Pb V2 -","- Cl8 Cu12 O32 Pb4 V8 -","- Cl8 Cu12 O32 Pb4 V8 -","","","","Siidra, O. I.; Krivovichev, S. V.; Armbruster, T.; Filatov, S. K.; Pekov, I. V.","The crystal structure of leningradite, PbCu3(VO4)2Cl2 Locality: Great fissure Tolbachik eruption, Kamchatka Peninsula, Russia Note: Changed signs of Cu2(y) and Cl(y) by personal communication with Krivovichev","The Canadian Mineralogist","2007","45","","445","449","10.2113/gscanmin.45.3.445","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010624","14.0774","","6.5039","","11.0506","","90","","105.604","","90","","974.481","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","Melanterite (deuterated)","- D13.16 Fe H0.84 O11 S -","- D13.16 Fe H0.84 O11 S -","- D52.64 Fe4 H3.36 O44 S4 -","4","1","","Anderson, J. L.; Peterson, R. C.; Swainson, I. P.","The atomic structure and hydrogen bonding of deuterated melanterite, FeSO4*7D2O Locality: synthetic","The Canadian Mineralogist","2007","45","","457","469","10.2113/gscanmin.45.3.457","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010625","6.9564","","6.9564","","17.826","","90","","90","","90","","862.627","","","","","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- H8 K Np O9 P -","- H6 K Np O9 P -","- H24 K4 Np4 O36 P4 -","4","0.25","","Forbes, T. Z.; Burns, P. C.","The crystal structures of X(NpO2)(PO4)(H2O)3 (X = K+, Na+, Rb+, NH4+) and their relationship to the autunite group Sample: KP1","The Canadian Mineralogist","2007","45","","471","477","10.2113/gscanmin.45.3.471","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010626","7.005","","7.005","","16.986","","90","","90","","90","","833.503","","","","","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- H16 Na Np O9 P -","- H6 Na Np O9 P -","- H24 Na4 Np4 O36 P4 -","4","0.25","","Forbes, T. Z.; Burns, P. C.","The crystal structures of X(NpO2)(PO4)(H2O)3 (X = K+, Na+, Rb+, NH4+) and their relationship to the autunite group Sample: NaP1","The Canadian Mineralogist","2007","45","","471","477","10.2113/gscanmin.45.3.471","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010627","7.031","","7.031","","17.87","","90","","90","","90","","883.403","","","","","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- H4 Np O9 P Rb -","- H6 Np O9 P Rb -","- H24 Np4 O36 P4 Rb4 -","4","0.25","","Forbes, T. Z.; Burns, P. C.","The crystal structures of X(NpO2)(PO4)(H2O)3 (X = K+, Na+, Rb+, NH4+) and their relationship to the autunite group Sample: RbP1","The Canadian Mineralogist","2007","45","","471","477","10.2113/gscanmin.45.3.471","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010628","6.9843","","6.9843","","18.023","","90","","90","","90","","879.17","","","","","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- H4 N Np O9 P -","- H6 N Np O9 P -","- H24 N4 Np4 O36 P4 -","4","0.25","","Forbes, T. Z.; Burns, P. C.","The crystal structures of X(NpO2)(PO4)(H2O)3 (X = K+, Na+, Rb+, NH4+) and their relationship to the autunite group Sample: NH4P1","The Canadian Mineralogist","2007","45","","471","477","10.2113/gscanmin.45.3.471","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010629","7.389","","6.274","","7.0788","","90","","90","","90","","328.163","","","","","","","","","","","","Great Fissure Tolbachik eruption, Kamchatka Peninsula, Russia","3","P n m a","-P 2ac 2n","62","","","Pauflerite","- O5 S V -","- O20 S4 V4 -","- O20 S4 V4 -","","","","Krivovichev, S. V.; Vergasova, L. P.; Britvin, S. N.; Filatov, S. K.; Kahlenberg, V.; Ananiev, V. V.","Pauflerite, B-VO(SO4), a new mineral species from the Tolbachik volcano, Kamchatka Peninsula, Russia","The Canadian Mineralogist","2007","45","","921","927","10.2113/gscanmin.45.4.921","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010630","5.3982","","8.0543","","11.1277","","90","","99.258","","90","","477.516","","","","","","","","","","","","Great Fissure Tolbachik eruption, Kamchatka Peninsula, Russia","4","P 1 21/c 1","-P 2ybc","14","","","Parageorgbokiite","- Cl2 Cu5 O8 Se2 -","- Cl4 Cu10 O16 Se4 -","- Cl4 Cu10 O16 Se4 -","","","","Krivovichev, S. V.; Filatov, S. K.; Burns, P. C.; Vergasova, L. P.","The crystal structure of parageorgbokiite, B-Cu5O2(SeO3)2Cl2","The Canadian Mineralogist","2007","45","","929","934","10.2113/gscanmin.45.4.929","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010631","31.2329","","5.2398","","9.0966","","90","","106.933","","90","","1424.16","","","","","","","","","","","","Esquire #1 claim, Rush Creek, Fresno County, California","6","C 1 c 1","C -2yc","9","","","Kampfite","- C2 Al1.3 Ba3 Cl1.24 O14 Si2.7 -","- C8 Al5.2 Ba12 Cl4.96 O56 Si10.8 -","- C8 Al5.2 Ba12 Cl4.96 O56 Si10.8 -","","","","Basciano, L. C.; Groat, L. A.","The crystal structure of kampfite","The Canadian Mineralogist","2007","45","","935","943","10.2113/gscanmin.45.4.935","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010632","10.385","","10.385","","10.385","","90","","90","","90","","1120","","","","","","","","","","","","Guli dunite complex, Polar Siberia, Russia","5","P m -3 m","-P 4 2 3","221","","","Djerfisherite","- Cl Cu Fe24 K6 S26 -","- Cl Cu Fe24 K6 S26 -","- Cl Cu Fe24 K6 S26 -","","","","Zaccarini, F.; Thalhammer, O. A. R.; Princivalle, F.; Lenaz, D.; Stanley, C. J.; Garuti, G.","Djerfisherite in the Guli dunite complex, Polar Siberia: a primary or metasomatic phase? Note: Occupancy of Cl1 was changed from S1 to reproduce chemical formula","The Canadian Mineralogist","2007","45","","1201","1211","10.2113/gscanmin.45.5.1201","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010633","3.909","","3.909","","15.682","","90","","90","","120","","207.522","","","","","","","","","","","","Synthetic","3","P 63/m m c","-P 6c 2c","194","","","Vavrinite","- Ni2 Sb Te2 -","- Ni4 Sb2 Te4 -","- Ni4 Sb2 Te4 -","","","","Laufek, F.; Drabek, M.; Skala, R.; Haloda, J.; Taborsky, Z.; Cisarova, I.","Vavrinite, Ni2SbTe2, a new mineral species from the Kunratice Cu-Ni sulfide deposit, Czech Republic","The Canadian Mineralogist","2007","45","","1213","1219","10.2113/gscanmin.45.5.1213","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010634","35.095","","3.9067","","43.222","","90","","96.71","","90","","5885.39","","","","","","","","","","","","Piz Grisch Mountain, Val Ferrera, Graubunden, Switzerland","5","C 1 2/m 1","-C 2y","12","","","Pizgrischite","- Bi17 Cu14.77 Fe0.23 Pb S35 -","- Bi68 Cu59.08 Fe0.92 Pb4 S140 -","- Bi68 Cu59.08 Fe0.92 Pb4 S140 -","","","","Meisser, N.; Schenk, K.; Berlepsch, P.; Brugger, J.; Bonin, M.; Criddle, A. J.; Thelin, P.; Bussy, F.","Pizgrischite, (Cu,Fe)Cu14PbBi17S35, a new sulfosalt from the Swiss Alps: Description, crystal structure and occurrence","The Canadian Mineralogist","2007","45","","1229","1245","10.2113/gscanmin.45.5.1229","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010635","10.6968","","13.7535","","21.5758","","90","","93.975","","90","","3166.56","","","","","","","","","","","","Mt. Yuksporr, Khibina alkaline massif, Kola Peninsula, Russia","12","C 1 2/c 1","-C 2yc","15","","","Delindeite","- Al0.1 Ba3.84 F1.32 Fe0.34 H13.58 K0.52 Mn0.04 Na2.66 Nb0.26 O38.04 Si8 Ti5.4 -","- Al0.1 Ba3.84 F1.32 Fe0.34 H10.38 K0.52 Mn0.04 Na2.66 Nb0.26 O38.04 Si8 Ti5.4 -","- Al0.4 Ba15.36 F5.28 Fe1.36 H41.52 K2.08 Mn0.16 Na10.64 Nb1.04 O152.16 Si32 Ti21.6 -","4","0.5","","Sokolova, E.; Camara, F.","From structure topology to chemical composition. II. Titanium silicates: revision of the crystal structure and chemical formula of delindeite","The Canadian Mineralogist","2007","45","","1247","1261","10.2113/gscanmin.45.5.1247","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010636","5.6461","","5.6461","","9.2322","","90","","90","","120","","254.878","","","","","","","","","","","","La Fossa Crater, Vulcano Island, Aeolian Archipelago, Sicily, Italy","3","P 63 m c","P 6c -2c","186","","","Demartinite","- F6 K2 Si -","- F12 K4 Si2 -","- F12 K4 Si2 -","","","","Gramaccioli, C. M.; Campostrini, I.","Demartinite, a new polymorph of K2SiF6 from La Fossa Crater, Vulcano, Aeolian Islands, Italy Locality: La Fossa Crater, Vulcano Island, Aeolian Archipelago, Sicily, Italy","The Canadian Mineralogist","2007","45","","1275","1280","10.2113/gscanmin.45.5.1275","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010637","9.5437","","9.5349","","14.0268","","108.943","","74.154","","119.78","","1038.08","","","","","","","","","","","","Poudrette quarry, Mont Saint-Hilaire, Rouville County, Quebec, Canada","7","P -1","-P 1","2","","","Martinite","- B2.84 Ca4.58 F2 H5.96 Na9.34 O44 Si13.16 -","- B2.84 Ca4.58 F2 H10 Na9.34 O44 Si13.16 -","- B2.84 Ca4.58 F2 H10 Na9.34 O44 Si13.16 -","1","0.5","","McDonald, A. M.; Chao, G. Y.","Martinite, a new hydrated sodium calcium fluorborosilicate species from Mont Saint-Hilaire, Quebec: description, structure determination and genetic implications Note: changed F(y) to match reported bond distances Locality: Poudrette quarry, Mont Saint-Hilaire, Rouville County, Quebec, Canada","The Canadian Mineralogist","2007","45","","1281","1292","10.2113/gscanmin.45.5.1281","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010638","11.5526","","4.3852","","15.6373","","90","","91.845","","90","","791.782","","","","","","","","","","","","Gomi deposit, Rioni River Valley, Caucacus Mountains, Georgia","4","P 1 21/n 1","-P 2yn","14","","","Tvalchrelidzeite","- As Hg3 S3 Sb -","- As4 Hg12 S12 Sb4 -","- As4 Hg12 S12 Sb4 -","","","","Yang, H.; Downs, R. T.; Costin, G.; Eichler, C. M.","The crystal structure of tvalchrelidzeite, Hg3SbAsS3, and a revision of its chemical formula","The Canadian Mineralogist","2007","45","","1529","1533","10.3749/canmin.45.6.1529","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:44",""
"9010775","4.7733","","10.2676","","6.0112","","90","","90","","90","","294.611","","","","293.15","","","","","","","","Saar-Nahe basin, Germany","4","P b n m","-P 2c 2ab","62","","","Forsterite","- Fe0.45 Mg1.55 O4 Si -","- Fe1.8 Mg6.2 O16 Si4 -","- Fe1.8 Mg6.2 O16 Si4 -","","","","Heinemann, R.; Kroll, H.; Kirfel, A.; Barbier, B.","Order and anti-order in olivine III: variation of the cation distribution in the Fe,Mg olivine solid solution series with temperature and composition Sample: CSR-2, T = 20 C","European Journal of Mineralogy","2007","19","","15","27","10.1127/0935-1221/2007/0019-0015","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:51",""
"9010776","4.7908","","10.3232","","6.0434","","90","","90","","90","","298.885","","","","723.15","","","","","","","","Saar-Nahe basin, Germany","4","P b n m","-P 2c 2ab","62","","","Forsterite","- Fe0.45 Mg1.55 O4 Si -","- Fe1.8 Mg6.2 O16 Si4 -","- Fe1.8 Mg6.2 O16 Si4 -","","","","Heinemann, R.; Kroll, H.; Kirfel, A.; Barbier, B.","Order and anti-order in olivine III: variation of the cation distribution, in the Fe,Mg olivine solid solution series with temperature and composition Sample: CSR-2, T = 450 C","European Journal of Mineralogy","2007","19","","15","27","10.1127/0935-1221/2007/0019-0015","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:51",""
"9010777","4.7967","","10.3412","","6.0543","","90","","90","","90","","300.315","","","","873.15","","","","","","","","Saar-Nahe basin, Germany","4","P b n m","-P 2c 2ab","62","","","Forsterite","- Fe0.44 Mg1.56 O4 Si -","- Fe1.76 Mg6.24 O16 Si4 -","- Fe1.76 Mg6.24 O16 Si4 -","","","","Heinemann, R.; Kroll, H.; Kirfel, A.; Barbier, B.","Order and anti-order in olivine III: variation of the cation distribution, in the Fe,Mg olivine solid solution series with temperature and composition Sample: CSR-2, T = 600 C","European Journal of Mineralogy","2007","19","","15","27","10.1127/0935-1221/2007/0019-0015","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:53",""
"9010778","4.801","","10.3537","","6.0613","","90","","90","","90","","301.296","","","","950.15","","","","","","","","Saar-Nahe basin, Germany","4","P b n m","-P 2c 2ab","62","","","Forsterite","- Fe0.44 Mg1.56 O4 Si -","- Fe1.76 Mg6.24 O16 Si4 -","- Fe1.76 Mg6.24 O16 Si4 -","","","","Heinemann, R.; Kroll, H.; Kirfel, A.; Barbier, B.","Order and anti-order in olivine III: variation of the cation distribution, in the Fe,Mg olivine solid solution series with temperature and composition Sample: CSR-2, T = 677 C","European Journal of Mineralogy","2007","19","","15","27","10.1127/0935-1221/2007/0019-0015","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:53",""
"9010779","4.8046","","10.3634","","6.0668","","90","","90","","90","","302.078","","","","998.15","","","","","","","","Saar-Nahe basin, Germany","4","P b n m","-P 2c 2ab","62","","","Forsterite","- Fe0.44 Mg1.56 O4 Si -","- Fe1.76 Mg6.24 O16 Si4 -","- Fe1.76 Mg6.24 O16 Si4 -","","","","Heinemann, R.; Kroll, H.; Kirfel, A.; Barbier, B.","Order and anti-order in olivine III: variation of the cation distribution, in the Fe,Mg olivine solid solution series with temperature and composition Sample: CSR-2, T = 725 C","European Journal of Mineralogy","2007","19","","15","27","10.1127/0935-1221/2007/0019-0015","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:53",""
"9010780","4.8081","","10.3727","","6.0722","","90","","90","","90","","302.839","","","","1073.15","","","","","","","","Saar-Nahe basin, Germany","4","P b n m","-P 2c 2ab","62","","","Forsterite","- Fe0.44 Mg1.56 O4 Si -","- Fe1.76 Mg6.24 O16 Si4 -","- Fe1.76 Mg6.24 O16 Si4 -","","","","Heinemann, R.; Kroll, H.; Kirfel, A.; Barbier, B.","Order and anti-order in olivine III: variation of the cation distribution, in the Fe,Mg olivine solid solution series with temperature and composition Sample: CSR-2, T = 800 C","European Journal of Mineralogy","2007","19","","15","27","10.1127/0935-1221/2007/0019-0015","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:25:53",""
"9010781","10.011","","19.478","","10.056","","90","","90.37","","90","","1960.82","","","","","","","","","","","","Hilarion mine, Lavrion, Greece","7","P 1 21/n 1","-P 2yn","14","","","Lavendulan","- As4 Ca Cl Cu5 H10 Na O21 -","- As4 Ca Cl Cu5 H10 Na O21 -","- As16 Ca4 Cl4 Cu20 H40 Na4 O84 -","4","1","","Giester, G.; Kolitsch, U.; Leverett, P.; Turner, P.; Williams, P. A.","The crystal structures of lavendulan, sampleite, and a new polymorph of sampleite Locality: Hilarion mine, Lavrion, Greece","European Journal of Mineralogy","2007","19","","75","93","10.1127/0935-1221/2007/0019-0075","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010782","9.676","","19.284","","9.766","","90","","90.07","","90","","1822.26","","","","","","","","","","","","Northparkes mine, Goonumbla, New South Wales, Australia","7","P 1 21/n 1","-P 2yn","14","","","Sampleite","- Ca Cl Cu5 H10 Na O21 P4 -","- Ca Cl Cu5 H10 Na O21 P4 -","- Ca4 Cl4 Cu20 H40 Na4 O84 P16 -","4","1","","Giester, G.; Kolitsch, U.; Leverett, P.; Turner, P.; Williams, P. A.","The crystal structures of lavendulan, sampleite, and a new polymorph of sampleite Locality: Northparkes mine, Goonumbla, New South Wales, Australia","European Journal of Mineralogy","2007","19","","75","93","10.1127/0935-1221/2007/0019-0075","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010783","9.695","","9.673","","19.739","","90","","102.61","","90","","1806.47","","","","","","","","","","","","Lake Boga, Victoria, Australia","7","P 1 21/c 1","-P 2ybc","14","","","Sampleite","- Ca Cl Cu5 H10 Na O20.56 P4 -","- Ca Cl Cu5 H9.12 Na O20.56 P4 -","- Ca4 Cl4 Cu20 H36.48 Na4 O82.24 P16 -","4","1","","Giester, G.; Kolitsch, U.; Leverett, P.; Turner, P.; Williams, P. A.","The crystal structures of lavendulan, sampleite, and a new polymorph of sampleite Locality: Lake Boga, Victoria, Australia Note: This is a polymorph or perhaps polytype of sampleite","European Journal of Mineralogy","2007","19","","75","93","10.1127/0935-1221/2007/0019-0075","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010784","9.58","","9.58","","6.985","","90","","90","","120","","555.173","","","","","","","","","","","","Mount Kukisvumchorr, Khibiny alkaline complex, Kola Peninsula, Russia","10","P 63/m","-P 6c","176","","","Fluorcalciobritholite","- Ca3.006 Ce0.931 F La0.542 Nd0.261 O12 P1.05 Pr0.079 Si1.95 Y0.179 -","- Ca6.012 Ce1.862 F2 La1.084 Nd0.522 O24 P2.1 Pr0.158 Si3.9 Y0.358 -","- Ca6.012 Ce1.862 F2 La1.084 Nd0.522 O24 P2.1 Pr0.158 Si3.9 Y0.358 -","","","","Pekov, I. V.; Pasero, M.; Yaskovskaya, A. N.; Chukanov, N. V.; Pushcharovsky, D. Y.; Merlino, S.; Zubkova, N. V.; Kononkova, N. N.; Men'shikov, Y. P.; Zadov, A. E.","Fluorcalciobritholite, (Ca,REE)5[(Si,P)O4]3F, a new mineral: description and crystal chemistry Locality: Mount Kukisvumchorr, Khibiny alkaline complex, Kola Peninsula, Russia","European Journal of Mineralogy","2007","19","","95","103","10.1127/0935-1221/2007/0019-0095","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:01",""
"9010785","7.39675","","7.39675","","15.8465","","90","","90","","90","","866.992","","","","5","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Effenbergerite","- Ba0.5 Cu O12 Si4 Sr0.5 -","- Ba2 Cu4 O48 Si16 Sr2 -","- Ba2 Cu4 O48 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 5 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","176465","2020-10-21","18:00:00",""
"9010786","7.3964","","7.3964","","15.8466","","90","","90","","90","","866.916","","","","25","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Effenbergerite","- Ba0.5 Cu O12 Si4 Sr0.5 -","- Ba2 Cu4 O48 Si16 Sr2 -","- Ba2 Cu4 O48 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 25 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","176465","2020-10-21","18:00:00",""
"9010787","7.39601","","7.39601","","15.8469","","90","","90","","90","","866.841","","","","50","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Effenbergerite","- Ba0.5 Cu O12 Si4 Sr0.5 -","- Ba2 Cu4 O48 Si16 Sr2 -","- Ba2 Cu4 O48 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 50 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","176465","2020-10-21","18:00:00",""
"9010788","7.39533","","7.39533","","15.8482","","90","","90","","90","","866.752","","","","100","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Effenbergerite","- Ba0.5 Cu O12 Si4 Sr0.5 -","- Ba2 Cu4 O48 Si16 Sr2 -","- Ba2 Cu4 O48 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 100 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","176465","2020-10-21","18:00:00",""
"9010789","7.39482","","7.39482","","15.8504","","90","","90","","90","","866.753","","","","150","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Effenbergerite","- Ba0.5 Cu O12 Si4 Sr0.5 -","- Ba2 Cu4 O48 Si16 Sr2 -","- Ba2 Cu4 O48 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 150 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","176465","2020-10-21","18:00:00",""
"9010790","7.39447","","7.39447","","15.8534","","90","","90","","90","","866.835","","","","200","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Effenbergerite","- Ba0.5 Cu O12 Si4 Sr0.5 -","- Ba2 Cu4 O48 Si16 Sr2 -","- Ba2 Cu4 O48 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 200 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","176465","2020-10-21","18:00:00",""
"9010791","7.39428","","7.39428","","15.8573","","90","","90","","90","","867.004","","","","250","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Effenbergerite","- Ba0.5 Cu O12 Si4 Sr0.5 -","- Ba2 Cu4 O48 Si16 Sr2 -","- Ba2 Cu4 O48 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 250 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","176465","2020-10-21","18:00:00",""
"9010792","7.39425","","7.39425","","15.8621","","90","","90","","90","","867.259","","","","300","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Effenbergerite","- Ba0.5 Cu O12 Si4 Sr0.5 -","- Ba2 Cu4 O48 Si16 Sr2 -","- Ba2 Cu4 O48 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 300 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","176465","2020-10-21","18:00:00",""
"9010801","7.278","","14.134","","7.118","","90","","90","","90","","732.209","","","","","","","","","","","","","5","C m m m","-C 2 2","65","","","Labuntsovite","- H6.7 Na1.33 O9.57 Si2 Ti -","- H5.14 Na1.33 O9.57 Si2 Ti -","- H20.56 Na5.32 O38.28 Si8 Ti4 -","4","0.25","","Cadoni, M.; Ferraris, G.","Microporous titanosilicates - synthesis and structural characterization of a new orthorhombic-type labuntsovite","European Journal of Mineralogy","2007","19","","217","222","10.1127/0935-1221/2007/0019-1717","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010802","5.9305","","4.7583","","10.2566","","90","","90.663","","90","","289.413","","","","","","","","","","","","Brattnevet, Larsemann Hills, Prydz Bay, East Antarctica","4","P 1 21/c 1","-P 2ybc","14","","","Chopinite","- Fe0.732 Mg2.268 O8 P2 -","- Fe1.464 Mg4.536 O16 P4 -","- Fe1.464 Mg4.536 O16 P4 -","","","","Grew, E. S.; Armbruster, T.; Medenbach, O.; Yates, M. G.; Carson, C. J.","Chopinite, [(Mg,Fe)3_](PO4)2, a new mineral isostructural with sarcopside, from a fluorapatite segregation in granulite-facies paragneiss, Larsemann Hills, Prydz Bay, East Antarctica Locality: Brattnevet, Larsemann Hills, Prydz Bay, East Antarctica","European Journal of Mineralogy","2007","19","","229","245","10.1127/0935-1221/2007/0019-1712","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:01",""
"9010803","8.818","","5.898","","19.126","","90","","97.26","","90","","986.741","","","","","","","","","","","","Bertrix, Ardennes mountains, Belgium","6","A 1 2/m 1","-A 2y","12","","","Pumpellyite-(Al)","- Al2.75 Ca2 Fe0.125 Mg0.125 O14 Si3 -","- Al11 Ca8 Fe0.5 Mg0.5 O56 Si12 -","- Al11 Ca8 Fe0.5 Mg0.5 O56 Si12 -","","","","Hatert, F.; Pasero, M.; Perchiazzi, N.; Theye, T.","Pumpellyite-(Al), a new mineral from Bertrix, Belgian Ardennes","European Journal of Mineralogy","2007","19","","247","253","10.1127/0935-1221/2007/0019-1720","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:01",""
"9010804","4.277","","4.277","","86.93","","90","","90","","120","","1377.14","","","","","","","","","","","","Vihorlat Mountains, eastern Slovakia","4","P -3 m 1","-P 3 2""","164","","","Vihorlatite","- Bi21.68 S1.7 Se15.3 Te6.32 -","- Bi21.68 S1.7 Se15.3 Te6.32 -","- Bi21.68 S1.7 Se15.3 Te6.32 -","","","","Skala, R.; Ondrus, P.; Veselovky, F.; Taborsky, Z.; Duda, R.","Vihorlatite, Bi24Se17Te4, a new mineral of the tetradymite group from Vihorlat Mts, Slovakia Locality: Vihorlat Mountains, eastern Slovakia","European Journal of Mineralogy","2007","19","","255","265","10.1127/0935-1221/2007/0019-1715","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:01",""
"9010805","48.32","","4.117","","24.056","","90","","118.84","","90","","4191.99","","","","","","","","","","","","Buca della Vena mine, Apuan Alps, Tuscany, Italy","4","C 1 2/m 1","-C 2y","12","","","Marrucciite","- Hg3 Pb16.08 S46 Sb17.92 -","- Hg6 Pb32.16 S92 Sb35.84 -","- Hg6 Pb32.16 S92 Sb35.84 -","","","","Orlandi, P.; Moelo, Y.; Campostrini, I.; Meerschaut, A.","Lead-antimony sulfosalts from Tuscany (Italy). IX. Marrucciite, Hg3Pb16Sb18S46,a new sulfosalt from Buca della Vena mine, Apuan Alps: definition and crystal structure","European Journal of Mineralogy","2007","19","","267","279","10.1127/0935-1221/2007/0019-1718","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:01",""
"9010806","18.975","","6.585","","10.955","","90","","100.42","","90","","1346.26","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- As4 Fe3 H2 K O16 -","- As16 Fe12 H8 K4 O64 -","- As16 Fe12 H8 K4 O64 -","","","","Schwendtner, K.; Kolitsch, U.","Two new structure types: KFe3(AsO4)2(HAsO4)2 and K(H2O)M3+(H1.5AsO4)2(H2AsO4) (M3+ = Fe, Ga, In) - synthesis, crystal structure and spectroscopy","European Journal of Mineralogy","2007","19","","399","409","10.1127/0935-1221/2007/0019-1726","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:01",""
"9010807","4.7","","8.712","","13.828","","90","","94.86","","90","","564.171","","","","","","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- As3 Fe H7 K O13 -","- As6 Fe2 H14 K2 O26 -","- As6 Fe2 H14 K2 O26 -","","","","Schwendtner, K.; Kolitsch, U.","Two new structure types: KFe3(AsO4)2(HAsO4)2 and K(H2O)M3+(H1.5AsO4)2(H2AsO4) (M3+ = Fe, Ga, In) - synthesis, crystal structure and spectroscopy","European Journal of Mineralogy","2007","19","","399","409","10.1127/0935-1221/2007/0019-1726","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:01",""
"9010808","4.641","","8.696","","13.772","","90","","94.71","","90","","553.935","","","","","","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- As3 Ga H7 K O13 -","- As6 Ga2 H14 K2 O26 -","- As6 Ga2 H14 K2 O26 -","","","","Schwendtner, K.; Kolitsch, U.","Two new structure types: KFe3(AsO4)2(HAsO4)2 and K(H2O)M3+(H1.5AsO4)2(H2AsO4) (M3+ = Fe, Ga, In) - synthesis, crystal structure and spectroscopy","European Journal of Mineralogy","2007","19","","399","409","10.1127/0935-1221/2007/0019-1726","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:01",""
"9010809","4.798","","8.832","","13.971","","90","","94.68","","90","","590.06","","","","","","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- As3 H7 In K O13 -","- As6 H14 In2 K2 O26 -","- As6 H14 In2 K2 O26 -","","","","Schwendtner, K.; Kolitsch, U.","Two new structure types: KFe3(AsO4)2(HAsO4)2 and K(H2O)M3+(H1.5AsO4)2(H2AsO4) (M3+ = Fe, Ga, In) - synthesis, crystal structure and spectroscopy","European Journal of Mineralogy","2007","19","","399","409","10.1127/0935-1221/2007/0019-1726","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:01",""
"9010810","5.3641","","5.3641","","13.5771","","90","","90","","90","","390.662","","","","","","","","","","","","Krupka, Czech Republic","5","P b a a","-P 2a 2b","54","","","Kettnerite","- C Bi Ca F O4 -","- C4 Bi4 Ca4 F4 O16 -","- C4 Bi4 Ca4 F4 O16 -","","","","Hybler, J.; Dusek, M.","Revision of the crystal structure of kettnerite CaBi[OFCO3]","European Journal of Mineralogy","2007","19","","411","418","10.1127/0935-1221/2007/0019-1722","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:01",""
"9010811","4.1035","","27.3144","","22.9366","","90","","90.359","","90","","2570.79","","","","","","","","","","","","Kutna Hora, central Bohemia, Czech Republic","4","P 1 21/c 1","-P 2ybc","14","","","Owyheeite","- Ag1.5 Pb4.43 S14 Sb6.07 -","- Ag6 Pb17.72 S56 Sb24.28 -","- Ag6 Pb17.72 S56 Sb24.28 -","","","","Laufek, F.; Pazout, R.; Makovicky, E.","Crystal structure of owyheeite, Ag1.5Pb4.43Sb6.07S14: refinement from powder synchrotron X-ray diffraction","European Journal of Mineralogy","2007","19","","557","566","10.1127/0935-1221/2007/0019-1740","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:01",""
"9010812","8.2996","","8.2996","","8.2996","","90","","90","","90","","571.704","","","","","","","","","","","","Bushveld complex, South Africa","9","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.538 Cr1.222 Fe0.705 Mg0.499 Mn0.008 Ni0.004 O4 Ti0.016 V0.008 -","- Al0.538 Cr1.222 Fe0.705 Mg0.499 Mn0.008 Ni0.004 O4 Ti0.016 V0.008 -","- Al4.304 Cr9.776 Fe5.64 Mg3.992 Mn0.064 Ni0.032 O32 Ti0.128 V0.064 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV21, LG","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010813","8.3039","","8.3039","","8.3039","","90","","90","","90","","572.593","","","","","","","","","","","","Bushveld complex, South Africa","9","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.488 Cr1.256 Fe0.754 Mg0.463 Mn0.009 Ni0.004 O4 Ti0.016 V0.01 -","- Al0.488 Cr1.256 Fe0.754 Mg0.463 Mn0.009 Ni0.004 O4 Ti0.016 V0.01 -","- Al3.904 Cr10.048 Fe6.032 Mg3.704 Mn0.072 Ni0.032 O32 Ti0.128 V0.08 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV21A, LG","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010814","8.3011","","8.3011","","8.3011","","90","","90","","90","","572.014","","","","","","","","","","","","Bushveld complex, South Africa","10","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.596 Cr1.182 Fe0.704 Mg0.482 Mn0.007 Ni0.004 O4 Ti0.014 V0.01 Zn0.001 -","- Al0.596 Cr1.182 Fe0.704 Mg0.482 Mn0.007 Ni0.004 O4 Ti0.014 V0.01 Zn0.001 -","- Al4.768 Cr9.456 Fe5.632 Mg3.856 Mn0.056 Ni0.032 O32 Ti0.112 V0.08 Zn0.008 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV20, LG","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010815","8.3004","","8.3004","","8.3004","","90","","90","","90","","571.87","","","","","","","","","","","","Bushveld complex, South Africa","9","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.601 Cr1.186 Fe0.708 Mg0.468 Mn0.007 Ni0.004 O4 Ti0.016 V0.01 -","- Al0.601 Cr1.186 Fe0.708 Mg0.468 Mn0.007 Ni0.004 O4 Ti0.016 V0.01 -","- Al4.808 Cr9.488 Fe5.664 Mg3.744 Mn0.056 Ni0.032 O32 Ti0.128 V0.08 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV20A, LG","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010816","8.3171","","8.3171","","8.3171","","90","","90","","90","","575.328","","","","","","","","","","","","Bushveld complex, South Africa","9","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.451 Cr1.186 Fe0.915 Mg0.4 Mn0.01 Ni0.004 O4 Ti0.026 V0.008 -","- Al0.451 Cr1.186 Fe0.915 Mg0.4 Mn0.01 Ni0.004 O4 Ti0.026 V0.008 -","- Al3.608 Cr9.488 Fe7.32 Mg3.2 Mn0.08 Ni0.032 O32 Ti0.208 V0.064 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV28, MG","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010817","8.3191","","8.3191","","8.3191","","90","","90","","90","","575.743","","","","","","","","","","","","Bushveld complex, South Africa","9","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.45 Cr1.2 Fe0.916 Mg0.38 Mn0.01 Ni0.004 O4 Ti0.03 V0.01 -","- Al0.45 Cr1.2 Fe0.916 Mg0.38 Mn0.01 Ni0.004 O4 Ti0.03 V0.01 -","- Al3.6 Cr9.6 Fe7.328 Mg3.04 Mn0.08 Ni0.032 O32 Ti0.24 V0.08 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV28A, MG","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010818","8.2829","","8.2829","","8.2829","","90","","90","","90","","568.26","","","","","","","","","","","","Bushveld complex, South Africa","9","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.75 Cr1.126 Fe0.64 Mg0.445 Mn0.007 Ni0.004 O4 Ti0.018 V0.01 -","- Al0.75 Cr1.126 Fe0.64 Mg0.445 Mn0.007 Ni0.004 O4 Ti0.018 V0.01 -","- Al6 Cr9.008 Fe5.12 Mg3.56 Mn0.056 Ni0.032 O32 Ti0.144 V0.08 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV27, TW","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010819","8.2822","","8.2822","","8.2822","","90","","90","","90","","568.116","","","","","","","","","","","","Bushveld complex, South Africa","9","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.724 Cr1.152 Fe0.648 Mg0.431 Mn0.007 Ni0.004 O4 Ti0.022 V0.012 -","- Al0.724 Cr1.152 Fe0.648 Mg0.431 Mn0.007 Ni0.004 O4 Ti0.022 V0.012 -","- Al5.792 Cr9.216 Fe5.184 Mg3.448 Mn0.056 Ni0.032 O32 Ti0.176 V0.096 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV27A, TW","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010820","8.325","","8.325","","8.325","","90","","90","","90","","576.969","","","","","","","","","","","","Bushveld complex, South Africa","10","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.488 Cr1.18 Fe0.951 Mg0.314 Mn0.01 Ni0.004 O4 Ti0.036 V0.014 Zn0.003 -","- Al0.488 Cr1.18 Fe0.951 Mg0.314 Mn0.01 Ni0.004 O4 Ti0.036 V0.014 Zn0.003 -","- Al3.904 Cr9.44 Fe7.608 Mg2.512 Mn0.08 Ni0.032 O32 Ti0.288 V0.112 Zn0.024 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV34, UG1","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010821","8.3269","","8.3269","","8.3269","","90","","90","","90","","577.364","","","","","","","","","","","","Bushveld complex, South Africa","9","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.506 Cr1.188 Fe0.944 Mg0.299 Mn0.011 O4 Ti0.036 V0.014 Zn0.002 -","- Al0.506 Cr1.188 Fe0.944 Mg0.299 Mn0.011 O4 Ti0.036 V0.014 Zn0.002 -","- Al4.048 Cr9.504 Fe7.552 Mg2.392 Mn0.088 O32 Ti0.288 V0.112 Zn0.016 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV34A, UG1","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010822","8.2913","","8.2913","","8.2913","","90","","90","","90","","569.991","","","","","","","","","","","","Bushveld complex, South Africa","10","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.702 Cr1.072 Fe0.749 Mg0.434 Mn0.007 Ni0.004 O4 Ti0.02 V0.01 Zn0.002 -","- Al0.702 Cr1.072 Fe0.749 Mg0.434 Mn0.007 Ni0.004 O4 Ti0.02 V0.01 Zn0.002 -","- Al5.616 Cr8.576 Fe5.992 Mg3.472 Mn0.056 Ni0.032 O32 Ti0.16 V0.08 Zn0.016 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV29, UG2","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010823","8.2942","","8.2942","","8.2942","","90","","90","","90","","570.589","","","","","","","","","","","","Bushveld complex, South Africa","9","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.679 Cr1.082 Fe0.755 Mg0.439 Mn0.007 Ni0.004 O4 Ti0.024 V0.01 -","- Al0.679 Cr1.082 Fe0.755 Mg0.439 Mn0.007 Ni0.004 O4 Ti0.024 V0.01 -","- Al5.432 Cr8.656 Fe6.04 Mg3.512 Mn0.056 Ni0.032 O32 Ti0.192 V0.08 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV29A, UG2","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010824","8.2944","","8.2944","","8.2944","","90","","90","","90","","570.63","","","","","","","","","","","","Bushveld complex, South Africa","9","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.679 Cr1.062 Fe0.754 Mg0.462 Mn0.007 Ni0.006 O4 Ti0.02 V0.01 -","- Al0.679 Cr1.062 Fe0.754 Mg0.462 Mn0.007 Ni0.006 O4 Ti0.02 V0.01 -","- Al5.432 Cr8.496 Fe6.032 Mg3.696 Mn0.056 Ni0.048 O32 Ti0.16 V0.08 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV32, UG2","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010825","8.295","","8.295","","8.295","","90","","90","","90","","570.754","","","","","","","","","","","","Bushveld complex, South Africa","10","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.667 Cr1.07 Fe0.747 Mg0.468 Mn0.007 Ni0.006 O4 Ti0.022 V0.01 Zn0.003 -","- Al0.667 Cr1.07 Fe0.747 Mg0.468 Mn0.007 Ni0.006 O4 Ti0.022 V0.01 Zn0.003 -","- Al5.336 Cr8.56 Fe5.976 Mg3.744 Mn0.056 Ni0.048 O32 Ti0.176 V0.08 Zn0.024 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV32A, UG2","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010826","8.2902","","8.2902","","8.2902","","90","","90","","90","","569.764","","","","","","","","","","","","Bushveld complex, South Africa","10","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.685 Cr1.068 Fe0.739 Mg0.464 Mn0.007 Ni0.008 O4 Ti0.018 V0.008 Zn0.003 -","- Al0.685 Cr1.068 Fe0.739 Mg0.464 Mn0.007 Ni0.008 O4 Ti0.018 V0.008 Zn0.003 -","- Al5.48 Cr8.544 Fe5.912 Mg3.712 Mn0.056 Ni0.064 O32 Ti0.144 V0.064 Zn0.024 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV31, UG3","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010827","8.29","","8.29","","8.29","","90","","90","","90","","569.723","","","","","","","","","","","","Bushveld complex, South Africa","10","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.698 Cr1.064 Fe0.727 Mg0.469 Mn0.007 Ni0.006 O4 Ti0.018 V0.008 Zn0.003 -","- Al0.698 Cr1.064 Fe0.727 Mg0.469 Mn0.007 Ni0.006 O4 Ti0.018 V0.008 Zn0.003 -","- Al5.584 Cr8.512 Fe5.816 Mg3.752 Mn0.056 Ni0.048 O32 Ti0.144 V0.064 Zn0.024 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV31A, UG3","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010828","8.2994","","8.2994","","8.2994","","90","","90","","90","","571.663","","","","","","","","","","","","Bushveld complex, South Africa","10","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.62 Cr1.072 Fe0.842 Mg0.408 Mn0.009 Ni0.006 O4 Ti0.032 V0.01 Zn0.001 -","- Al0.62 Cr1.072 Fe0.842 Mg0.408 Mn0.009 Ni0.006 O4 Ti0.032 V0.01 Zn0.001 -","- Al4.96 Cr8.576 Fe6.736 Mg3.264 Mn0.072 Ni0.048 O32 Ti0.256 V0.08 Zn0.008 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV30, UG3B","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010829","8.3013","","8.3013","","8.3013","","90","","90","","90","","572.056","","","","","","","","","","","","Bushveld complex, South Africa","10","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.541 Cr1.118 Fe0.873 Mg0.406 Mn0.009 Ni0.006 O4 Ti0.034 V0.01 Zn0.003 -","- Al0.541 Cr1.118 Fe0.873 Mg0.406 Mn0.009 Ni0.006 O4 Ti0.034 V0.01 Zn0.003 -","- Al4.328 Cr8.944 Fe6.984 Mg3.248 Mn0.072 Ni0.048 O32 Ti0.272 V0.08 Zn0.024 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: BV30A, UG3B","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010830","8.2929","","8.2929","","8.2929","","90","","90","","90","","570.321","","","","","","","","","","","","Bushveld complex, South Africa","10","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.582 Cr1.168 Fe0.752 Mg0.453 Mn0.008 Ni0.006 O4 Ti0.022 V0.008 Zn0.001 -","- Al0.582 Cr1.168 Fe0.752 Mg0.453 Mn0.008 Ni0.006 O4 Ti0.022 V0.008 Zn0.001 -","- Al4.656 Cr9.344 Fe6.016 Mg3.624 Mn0.064 Ni0.048 O32 Ti0.176 V0.064 Zn0.008 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: MER, MR","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010831","8.2963","","8.2963","","8.2963","","90","","90","","90","","571.023","","","","","","","","","","","","Bushveld complex, South Africa","9","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Al0.618 Cr1.126 Fe0.745 Mg0.467 Mn0.008 Ni0.006 O4 Ti0.022 V0.008 -","- Al0.618 Cr1.126 Fe0.745 Mg0.467 Mn0.008 Ni0.006 O4 Ti0.022 V0.008 -","- Al4.944 Cr9.008 Fe5.96 Mg3.736 Mn0.064 Ni0.048 O32 Ti0.176 V0.064 -","8","0.0416667","","Lenaz, D.; Braidotti, R.; Princivalle, F.; Garuti, G.; Zaccarini, F.","Crystal chemistry and structural refinement of chromites from different chromitite layers and xenoliths of the Bushveld complex Sample: MER-A, MR","European Journal of Mineralogy","2007","19","","599","609","10.1127/0935-1221/2007/0019-1744","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010832","8.677","","6.317","","7.396","","90","","115.4","","90","","366.207","","","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","NaCoS","- Co2 H3 Na O10 S2 -","- Co2 H3 Na O10 S2 -","- Co4 H6 Na2 O20 S4 -","2","0.25","","Krickl, R.; Wildner, M.","Crystal chemistry of synthetic Co- and Ni-analogues of natrochalcite - the shortest known hydrogen bonds among mineral-type compounds Part I: single-crystal X-ray structures Sample: T = 293 K","European Journal of Mineralogy","2007","19","","805","816","10.1127/0935-1221/2007/0019-1770","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9010833","8.659","","6.281","","7.368","","90","","115.41","","90","","361.959","","","","105","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","NaCoS","- Co2 H3 Na O10 S2 -","- Co2 H3 Na O10 S2 -","- Co4 H6 Na2 O20 S4 -","2","0.25","","Krickl, R.; Wildner, M.","Crystal chemistry of synthetic Co- and Ni-analogues of natrochalcite - the shortest known hydrogen bonds among mineral-type compounds Part I: single-crystal X-ray structures Sample: T = 105 K","European Journal of Mineralogy","2007","19","","805","816","10.1127/0935-1221/2007/0019-1770","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9010834","8.605","","6.185","","7.336","","90","","114.78","","90","","354.486","","","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","NaNiS","- H3 Na Ni2 O10 S2 -","- H3 Na Ni2 O10 S2 -","- H6 Na2 Ni4 O20 S4 -","2","0.25","","Krickl, R.; Wildner, M.","Crystal chemistry of synthetic Co- and Ni-analogues of natrochalcite - the shortest known hydrogen bonds among mineral-type compounds Part I: single-crystal X-ray structures Sample: T = 293 K","European Journal of Mineralogy","2007","19","","805","816","10.1127/0935-1221/2007/0019-1770","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9010835","8.595","","6.172","","7.319","","90","","114.81","","90","","352.426","","","","105","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","NaNiS","- H3 Na Ni2 O10 S2 -","- H3 Na Ni2 O10 S2 -","- H6 Na2 Ni4 O20 S4 -","2","0.25","","Krickl, R.; Wildner, M.","Crystal chemistry of synthetic Co- and Ni-analogues of natrochalcite - the shortest known hydrogen bonds among mineral-type compounds Part I: single-crystal X-ray structures Sample: T = 105 K","European Journal of Mineralogy","2007","19","","805","816","10.1127/0935-1221/2007/0019-1770","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9010836","8.939","","6.382","","7.554","","90","","115.09","","90","","390.283","","","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","NaCoSe","- Co2 H3 Na O10 Se2 -","- Co2 H3 Na O10 Se2 -","- Co4 H6 Na2 O20 Se4 -","2","0.25","","Krickl, R.; Wildner, M.","Crystal chemistry of synthetic Co- and Ni-analogues of natrochalcite - the shortest known hydrogen bonds among mineral-type compounds Part I: single-crystal X-ray structures Sample: T = 293 K","European Journal of Mineralogy","2007","19","","805","816","10.1127/0935-1221/2007/0019-1770","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9010837","9.078","","6.471","","7.687","","90","","113.99","","90","","412.555","","","","293","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","KCoSe","- Co2 Cr0.08 H3 K O10 Se1.92 -","- Co2 Cr0.08 H3 K O10 Se1.92 -","- Co4 Cr0.16 H6 K2 O20 Se3.84 -","2","0.25","","Krickl, R.; Wildner, M.","Crystal chemistry of synthetic Co- and Ni-analogues of natrochalcite - the shortest known hydrogen bonds among mineral-type compounds Part I: single-crystal X-ray structures Sample: T = 293 K","European Journal of Mineralogy","2007","19","","805","816","10.1127/0935-1221/2007/0019-1770","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9010838","12.396","","9.407","","3.2152","","90","","97.78","","90","","371.471","","","","","","","","","","","","Dronino meteorite, Dronino village, Kasimov district, Ryazan Oblast, Russia","4","P 1 21/a 1","-P 2yab","14","","","Chukanovite","- C H2 Fe2 O5 -","- C H2 Fe2 O5 -","- C4 H8 Fe8 O20 -","4","1","","Pekov, I. V.; Perchiazzi, N.; Merlino, S.; Kalachev, V. N.; Merlini, M.; Zadov, A. E.","Chukanovite, Fe2(CO3)(OH)2, a new mineral from the weathered iron meteorite Dronino Locality: Dronino meteorite, Dronino village, Kasimov district, Ryazan Oblast, Russia","European Journal of Mineralogy","2007","19","","891","898","10.1127/0935-1221/2007/0019-1767","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9010880","5.3007","","9.186","","10.185","","90","","99.97","","90","","488.441","","","","293","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- H5.92 Mg3 O13 Si4 -","- H4 Mg3 O13 Si4 -","- H8 Mg6 O26 Si8 -","2","0.25","","Zanazzi, P. F.; Comodi, P.; Nazzareni, S.; Rotiroti, N.; van Smaalen, S.","Behavior of 10-A phase at low temperatures Sample: T = 293 K","Physics and Chemistry of Minerals","2007","34","","23","29","10.1007/s00269-006-0123-9","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010881","5.3","","9.182","","10.096","","90","","100.05","","90","","483.779","","","","116","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- H5.92 Mg3 O13 Si4 -","- H4 Mg3 O13 Si4 -","- H8 Mg6 O26 Si8 -","2","0.25","","Zanazzi, P. F.; Comodi, P.; Nazzareni, S.; Rotiroti, N.; van Smaalen, S.","Behavior of 10-A phase at low temperatures Sample: T = 116 K","Physics and Chemistry of Minerals","2007","34","","23","29","10.1007/s00269-006-0123-9","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:10",""
"9010882","4.374","","9.39","","2.833","","90","","90","","90","","116.357","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","","Diaspore","- Al H O2 -","- Al4 H4 O8 -","- Al4 H4 O8 -","","","","Friedrich, A.; Wilson, D. J.; Haussuhl, E.; Winkler, B.; Morgenroth, W.; Refson, K.; Milman, V.","High-pressure properties of diaspore, AlO(OH) Sample: p = 2.0 GPa","Physics and Chemistry of Minerals","2007","34","","145","157","10.1007/s00269-006-0135-5","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010883","4.354","","9.369","","2.8281","","90","","90","","90","","115.366","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","","Diaspore","- Al H O2 -","- Al4 H4 O8 -","- Al4 H4 O8 -","","","","Friedrich, A.; Wilson, D. J.; Haussuhl, E.; Winkler, B.; Morgenroth, W.; Refson, K.; Milman, V.","High-pressure properties of diaspore, AlO(OH) Sample: p = 3.41 GPa","Physics and Chemistry of Minerals","2007","34","","145","157","10.1007/s00269-006-0135-5","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010884","4.335","","9.34","","2.82","","90","","90","","90","","114.179","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","","Diaspore","- Al H O2 -","- Al4 H4 O8 -","- Al4 H4 O8 -","","","","Friedrich, A.; Wilson, D. J.; Haussuhl, E.; Winkler, B.; Morgenroth, W.; Refson, K.; Milman, V.","High-pressure properties of diaspore, AlO(OH) Sample: p = 4.89 GPa","Physics and Chemistry of Minerals","2007","34","","145","157","10.1007/s00269-006-0135-5","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010885","4.328","","9.336","","2.818","","90","","90","","90","","113.865","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","","Diaspore","- Al H O2 -","- Al4 H4 O8 -","- Al4 H4 O8 -","","","","Friedrich, A.; Wilson, D. J.; Haussuhl, E.; Winkler, B.; Morgenroth, W.; Refson, K.; Milman, V.","High-pressure properties of diaspore, AlO(OH) Sample: p = 5.71 GPa","Physics and Chemistry of Minerals","2007","34","","145","157","10.1007/s00269-006-0135-5","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010886","4.315","","9.32","","2.812","","90","","90","","90","","113.087","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","","Diaspore","- Al H O2 -","- Al4 H4 O8 -","- Al4 H4 O8 -","","","","Friedrich, A.; Wilson, D. J.; Haussuhl, E.; Winkler, B.; Morgenroth, W.; Refson, K.; Milman, V.","High-pressure properties of diaspore, AlO(OH) Sample: p = 7.1 GPa","Physics and Chemistry of Minerals","2007","34","","145","157","10.1007/s00269-006-0135-5","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010887","18.2429","","8.8171","","5.1894","","90","","90","","90","","834.712","","","","293.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.03 Fe0.15 Mg1.82 O6 Si1.97 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","","","","Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 20 C","Physics and Chemistry of Minerals","2007","34","","185","200","10.1007/s00269-006-0138-2","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010888","18.4588","","8.9638","","5.2848","","90","","90","","90","","874.428","","","","1473.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.03 Fe0.15 Mg1.82 O6 Si1.97 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","","","","Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,200 C","Physics and Chemistry of Minerals","2007","34","","185","200","10.1007/s00269-006-0138-2","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010889","18.4517","","8.9612","","5.2797","","90","","90","","90","","872.995","","","","1448.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.03 Fe0.15 Mg1.82 O6 Si1.97 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","","","","Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,175 C","Physics and Chemistry of Minerals","2007","34","","185","200","10.1007/s00269-006-0138-2","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010890","18.445","","8.9589","","5.2749","","90","","90","","90","","871.661","","","","1423.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.03 Fe0.15 Mg1.82 O6 Si1.97 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","","","","Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,150 C","Physics and Chemistry of Minerals","2007","34","","185","200","10.1007/s00269-006-0138-2","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010891","18.4378","","8.9555","","5.2711","","90","","90","","90","","870.363","","","","1398.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.03 Fe0.15 Mg1.82 O6 Si1.97 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","","","","Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,125 C","Physics and Chemistry of Minerals","2007","34","","185","200","10.1007/s00269-006-0138-2","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010892","18.4314","","8.952","","5.2674","","90","","90","","90","","869.11","","","","1373.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.03 Fe0.15 Mg1.82 O6 Si1.97 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","","","","Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,100 C","Physics and Chemistry of Minerals","2007","34","","185","200","10.1007/s00269-006-0138-2","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010893","18.4244","","8.9481","","5.2639","","90","","90","","90","","867.824","","","","1348.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.03 Fe0.15 Mg1.82 O6 Si1.97 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","","","","Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,075 C","Physics and Chemistry of Minerals","2007","34","","185","200","10.1007/s00269-006-0138-2","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010894","18.4197","","8.9449","","5.2609","","90","","90","","90","","866.798","","","","1323.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.03 Fe0.15 Mg1.82 O6 Si1.97 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","","","","Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,050 C","Physics and Chemistry of Minerals","2007","34","","185","200","10.1007/s00269-006-0138-2","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010895","18.4125","","8.9408","","5.2577","","90","","90","","90","","865.536","","","","1298.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.03 Fe0.15 Mg1.82 O6 Si1.97 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","","","","Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,025 C","Physics and Chemistry of Minerals","2007","34","","185","200","10.1007/s00269-006-0138-2","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010896","18.4047","","8.9366","","5.2543","","90","","90","","90","","864.203","","","","1273.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.03 Fe0.15 Mg1.82 O6 Si1.97 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","","","","Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,000 C","Physics and Chemistry of Minerals","2007","34","","185","200","10.1007/s00269-006-0138-2","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010897","18.3995","","8.9329","","5.2519","","90","","90","","90","","863.207","","","","1248.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.03 Fe0.15 Mg1.82 O6 Si1.97 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","","","","Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 975 C","Physics and Chemistry of Minerals","2007","34","","185","200","10.1007/s00269-006-0138-2","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010898","18.2513","","8.8274","","5.1929","","90","","90","","90","","836.636","","","","423.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","Enstatite","- Al0.03 Fe0.15 Mg1.82 O6 Si1.97 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","- Al0.24 Fe1.2 Mg14.56 O48 Si15.76 -","","","","Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G.","High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 150 C","Physics and Chemistry of Minerals","2007","34","","185","200","10.1007/s00269-006-0138-2","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010899","3.5717","","3.57","","4.8743","","90","","90","","120","","53.825","","","","","","","","70000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite (deuterated)","- Ca D2 O2 -","- Ca D1.99998 O2 -","- Ca D1.99998 O2 -","","","","Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.","In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = .07 GPa","Physics and Chemistry of Minerals","2007","34","","223","232","10.1007/s00269-007-0141-2","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010900","3.5692","","3.5692","","4.8758","","90","","90","","120","","53.792","","","","","","","","150000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite (deuterated)","- Ca D2 O2 -","- Ca D1.99998 O2 -","- Ca D1.99998 O2 -","","","","Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.","In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = .15 GPa","Physics and Chemistry of Minerals","2007","34","","223","232","10.1007/s00269-007-0141-2","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010901","3.5592","","3.5592","","4.8155","","90","","90","","120","","52.83","","","","","","","","780000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite (deuterated)","- Ca D2 O2 -","- Ca D1.99998 O2 -","- Ca D1.99998 O2 -","","","","Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.","In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = .78 GPa","Physics and Chemistry of Minerals","2007","34","","223","232","10.1007/s00269-007-0141-2","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010902","3.5462","","3.5462","","4.7428","","90","","90","","120","","51.653","","","","","","","","1610000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite (deuterated)","- Ca D2 O2 -","- Ca D1.99998 O2 -","- Ca D1.99998 O2 -","","","","Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.","In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = 1.61 GPa","Physics and Chemistry of Minerals","2007","34","","223","232","10.1007/s00269-007-0141-2","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010903","3.5384","","3.5384","","4.7084","","90","","90","","120","","51.053","","","","","","","","2080000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite (deuterated)","- Ca D2 O2 -","- Ca D1.99998 O2 -","- Ca D1.99998 O2 -","","","","Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.","In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = 2.08 GPa","Physics and Chemistry of Minerals","2007","34","","223","232","10.1007/s00269-007-0141-2","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010904","3.5341","","3.5341","","4.6861","","90","","90","","120","","50.687","","","","","","","","2350000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite (deuterated)","- Ca D2 O2 -","- Ca D1.99998 O2 -","- Ca D1.99998 O2 -","","","","Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.","In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = 2.35 GPa","Physics and Chemistry of Minerals","2007","34","","223","232","10.1007/s00269-007-0141-2","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010905","3.5317","","3.5317","","4.6775","","90","","90","","120","","50.526","","","","","","","","2440000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite (deuterated)","- Ca D2 O2 -","- Ca D1.99998 O2 -","- Ca D1.99998 O2 -","","","","Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.","In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = 2.44 GPa","Physics and Chemistry of Minerals","2007","34","","223","232","10.1007/s00269-007-0141-2","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010906","3.5175","","3.5175","","4.6186","","90","","90","","120","","49.489","","","","","","","","3400000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite (deuterated)","- Ca D2 O2 -","- Ca D1.99998 O2 -","- Ca D1.99998 O2 -","","","","Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.","In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = 3.40 GPa","Physics and Chemistry of Minerals","2007","34","","223","232","10.1007/s00269-007-0141-2","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010907","3.5002","","3.5002","","4.5646","","90","","90","","120","","48.431","","","","","","","","4530000","","","","","3","P -3 m 1","-P 3 2""","164","","","Portlandite (deuterated)","- Ca D2 O2 -","- Ca D1.99998 O2 -","- Ca D1.99998 O2 -","","","","Xu, H.; Zhao, Y.; Zhang, J.; Hickmott, D. D.; Daemen, L. L.","In situ neutron diffraction study of deuterated portlandite Ca(OD)2 at high pressure and temperature Sample: P = 4.53 GPa","Physics and Chemistry of Minerals","2007","34","","223","232","10.1007/s00269-007-0141-2","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010908","4.7785","","4.9326","","6.9059","","90","","90","","90","","162.775","","","","","","","","","","","","Synthetic","4","P b n m","-P 2c 2ab","62","","","Perovskite-type MgSiO3","- Al0.05 Mg0.99 O2.985 Si0.96 -","- Al0.2 Mg3.96 O11.94 Si3.84 -","- Al0.2 Mg3.96 O11.94 Si3.84 -","","","","Kojitani, H.; Katsura, T.; Akaogi, M.","Aluminum substitution mechanisms in perovskite-type MgSiO3: an investigation by Rietveld analysis Sample: Nonstoichiometric with XAl = 0.05","Physics and Chemistry of Minerals","2007","34","","257","267","10.1007/s00269-007-0144-z","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010909","4.7769","","4.9336","","6.9085","","90","","90","","90","","162.815","","","","","","","","","","","","Synthetic","4","P b n m","-P 2c 2ab","62","","","Perovskite-type MgSiO3","- Al0.1 Mg0.97 O2.979 Si0.93 -","- Al0.4 Mg3.88 O11.916 Si3.72 -","- Al0.4 Mg3.88 O11.916 Si3.72 -","","","","Kojitani, H.; Katsura, T.; Akaogi, M.","Aluminum substitution mechanisms in perovskite-type MgSiO3: an investigation by Rietveld analysis Sample: Nonstoichiometric with XAl = 0.10","Physics and Chemistry of Minerals","2007","34","","257","267","10.1007/s00269-007-0144-z","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010910","4.7783","","4.9327","","6.9051","","90","","90","","90","","162.753","","","","","","","","","","","","Synthetic","4","P b n m","-P 2c 2ab","62","","","Perovskite-type MgSiO3","- Al0.05 Mg0.975 O3 Si0.975 -","- Al0.2 Mg3.9 O12 Si3.9 -","- Al0.2 Mg3.9 O12 Si3.9 -","","","","Kojitani, H.; Katsura, T.; Akaogi, M.","Aluminum substitution mechanisms in perovskite-type MgSiO3: an investigation by Rietveld analysis Sample: Stoichiometric with XAl = 0.05","Physics and Chemistry of Minerals","2007","34","","257","267","10.1007/s00269-007-0144-z","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010911","4.7767","","4.9342","","6.913","","90","","90","","90","","162.934","","","","","","","","","","","","Synthetic","4","P b n m","-P 2c 2ab","62","","","Perovskite-type MgSiO3","- Al0.1 Mg0.95 O3 Si0.95 -","- Al0.4 Mg3.8 O12 Si3.8 -","- Al0.4 Mg3.8 O12 Si3.8 -","","","","Kojitani, H.; Katsura, T.; Akaogi, M.","Aluminum substitution mechanisms in perovskite-type MgSiO3: an investigation by Rietveld analysis Sample: Stoichiometric with XAl = 0.10","Physics and Chemistry of Minerals","2007","34","","257","267","10.1007/s00269-007-0144-z","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010912","5.0881","","5.0881","","14.091","","90","","90","","120","","315.925","","","","","","","","100","","","","Synthetic","3","R -3 :H","-R 3","148","","","Ilmenite","- Fe O3 Ti -","- Fe6 O18 Ti6 -","- Fe6 O18 Ti6 -","","","","Yamanaka, T.; Komatsu, Y.; Nomori, H.","Electron density distribution of FeTiO3 ilmenite under high pressure analyzed by MEM using single crystal diffraction intensities Locality: synthetic Sample: P = 1 atm","Physics and Chemistry of Minerals","2007","34","","307","318","10.1007/s00269-007-0149-7","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010913","5.0678","","5.0678","","13.9956","","90","","90","","120","","311.287","","","","","","","","3600000","","","","Synthetic","3","R -3 :H","-R 3","148","","","Ilmenite","- Fe O3 Ti -","- Fe6 O18 Ti6 -","- Fe6 O18 Ti6 -","","","","Yamanaka, T.; Komatsu, Y.; Nomori, H.","Electron density distribution of FeTiO3 ilmenite under high pressure analyzed by MEM using single crystal diffraction intensities Locality: synthetic Sample: P = 3.6 Gpa","Physics and Chemistry of Minerals","2007","34","","307","318","10.1007/s00269-007-0149-7","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010914","5.0567","","5.0567","","13.8892","","90","","90","","120","","307.569","","","","","","","","5300000","","","","Synthetic","3","R -3 :H","-R 3","148","","","Ilmenite","- Fe O3 Ti -","- Fe6 O18 Ti6 -","- Fe6 O18 Ti6 -","","","","Yamanaka, T.; Komatsu, Y.; Nomori, H.","Electron density distribution of FeTiO3 ilmenite under high pressure analyzed by MEM using single crystal diffraction intensities Locality: synthetic Sample: P = 5.3 GPa","Physics and Chemistry of Minerals","2007","34","","307","318","10.1007/s00269-007-0149-7","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:10",""
"9010915","5.0398","","5.0398","","13.7968","","90","","90","","120","","303.484","","","","","","","","8200000","","","","Synthetic","3","R -3 :H","-R 3","148","","","Ilmenite","- Fe O3 Ti -","- Fe6 O18 Ti6 -","- Fe6 O18 Ti6 -","","","","Yamanaka, T.; Komatsu, Y.; Nomori, H.","Electron density distribution of FeTiO3 ilmenite under high pressure analyzed by MEM using single crystal diffraction intensities Locality: synthetic Sample: P = 8.2 GPa","Physics and Chemistry of Minerals","2007","34","","307","318","10.1007/s00269-007-0149-7","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:12",""
"9010916","11.8021","","14.569","","4.0758","","90","","90","","90","","700.813","","","","","","","","100","","","","Synthetic","3","P n a m","-P 2c 2n","62","","","Galenobismutite","- Bi2 Pb S4 -","- Bi8 Pb4 S16 -","- Bi8 Pb4 S16 -","","","","Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.","Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = .0001 GPa","Physics and Chemistry of Minerals","2007","34","","467","475","10.1007/s00269-007-0163-9","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:15",""
"9010917","11.7854","","14.5531","","4.069","","90","","90","","90","","697.891","","","","","","","","160000","","","","Synthetic","3","P n a m","-P 2c 2n","62","","","Galenobismutite","- Bi2 Pb S4 -","- Bi8 Pb4 S16 -","- Bi8 Pb4 S16 -","","","","Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.","Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = .16 GPa","Physics and Chemistry of Minerals","2007","34","","467","475","10.1007/s00269-007-0163-9","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:17",""
"9010918","11.7253","","14.485","","4.0606","","90","","90","","90","","689.656","","","","","","","","600000","","","","Synthetic","3","P n a m","-P 2c 2n","62","","","Galenobismutite","- Bi2 Pb S4 -","- Bi8 Pb4 S16 -","- Bi8 Pb4 S16 -","","","","Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.","Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = .60 GPa","Physics and Chemistry of Minerals","2007","34","","467","475","10.1007/s00269-007-0163-9","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:20",""
"9010919","11.6682","","14.435","","4.0424","","90","","90","","90","","680.863","","","","","","","","1390000","","","","Synthetic","3","P n a m","-P 2c 2n","62","","","Galenobismutite","- Bi2 Pb S4 -","- Bi8 Pb4 S16 -","- Bi8 Pb4 S16 -","","","","Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.","Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 1.39 GPa","Physics and Chemistry of Minerals","2007","34","","467","475","10.1007/s00269-007-0163-9","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010920","11.5609","","14.2968","","4.01","","90","","90","","90","","662.788","","","","","","","","2970000","","","","Synthetic","3","P n a m","-P 2c 2n","62","","","Galenobismutite","- Bi2 Pb S4 -","- Bi8 Pb4 S16 -","- Bi8 Pb4 S16 -","","","","Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.","Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 2.97 GPa","Physics and Chemistry of Minerals","2007","34","","467","475","10.1007/s00269-007-0163-9","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010921","11.4902","","14.2045","","3.9895","","90","","90","","90","","651.136","","","","","","","","4150000","","","","Synthetic","3","P n a m","-P 2c 2n","62","","","Galenobismutite","- Bi2 Pb S4 -","- Bi8 Pb4 S16 -","- Bi8 Pb4 S16 -","","","","Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.","Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 4.15 GPa","Physics and Chemistry of Minerals","2007","34","","467","475","10.1007/s00269-007-0163-9","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010922","11.4828","","14.1434","","3.9787","","90","","90","","90","","646.164","","","","","","","","4780000","","","","Synthetic","3","P n a m","-P 2c 2n","62","","","Galenobismutite","- Bi2 Pb S4 -","- Bi8 Pb4 S16 -","- Bi8 Pb4 S16 -","","","","Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.","Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 4.78 GPa","Physics and Chemistry of Minerals","2007","34","","467","475","10.1007/s00269-007-0163-9","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010923","11.3949","","14.0654","","3.9591","","90","","90","","90","","634.54","","","","","","","","6060000","","","","Synthetic","3","P n a m","-P 2c 2n","62","","","Galenobismutite","- Bi2 Pb S4 -","- Bi8 Pb4 S16 -","- Bi8 Pb4 S16 -","","","","Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.","Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 6.06 GPa","Physics and Chemistry of Minerals","2007","34","","467","475","10.1007/s00269-007-0163-9","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010924","11.2963","","13.9073","","3.9266","","90","","90","","90","","616.873","","","","","","","","8650000","","","","Synthetic","3","P n a m","-P 2c 2n","62","","","Galenobismutite","- Bi2 Pb S4 -","- Bi8 Pb4 S16 -","- Bi8 Pb4 S16 -","","","","Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.","Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 8.65 GPa","Physics and Chemistry of Minerals","2007","34","","467","475","10.1007/s00269-007-0163-9","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010925","11.2863","","13.8907","","3.9233","","90","","90","","90","","615.074","","","","","","","","8920000","","","","Synthetic","3","P n a m","-P 2c 2n","62","","","Galenobismutite","- Bi2 Pb S4 -","- Bi8 Pb4 S16 -","- Bi8 Pb4 S16 -","","","","Olsen, L. A.; Balic-Zunic T; Makovicky, E.; Ullrich, A.; Miletich, R.","Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Sample: P = 8.92 GPa","Physics and Chemistry of Minerals","2007","34","","467","475","10.1007/s00269-007-0163-9","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010926","9.4082","","5.479","","4.4288","","90","","90","","90","","228.294","","","","","","","","","","","","Malyshevo near Terem Tschanka, Sverdlovsk, Ural, Russia","4","P n m a","-P 2ac 2n","62","","","Chrysoberyl","- Al1.98 Be Cr0.02 O4 -","- Al7.92 Be4 Cr0.08 O16 -","- Al7.92 Be4 Cr0.08 O16 -","","","","Weber, S. U.; Grodzicki, M.; Lottermoser, W.; Redhammer, G. J.; Tippelt, G.; Ponahlo, J.; Amthauer, G.","57Fe Mossbauer spectroscopy, X-ray single-crystal diffractometry, and electronic structure calculations on natural alexandrite Note: changed O1(z) from .788822 to .78822","Physics and Chemistry of Minerals","2007","34","","507","515","10.1007/s00269-007-0166-6","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010927","9.563","","8.571","","5.269","","90","","110.273","","90","","405.117","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ga Li O6 Si2 -","- Ga4 Li4 O24 Si8 -","- Ga4 Li4 O24 Si8 -","","","","Bianchi, R.; Forni, A.; Camara, F.; Oberti, R.; Ohashi, H.","Experimental multipole-refined and theoretical charge density study of LiGaSi2O6 clinopyroxene at ambient conditions","Physics and Chemistry of Minerals","2007","34","","519","527","10.1007/s00269-007-0167-5","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010928","5.3103","","8.9122","","6.4365","","90","","90","","90","","304.617","","","","298.15","","","","","","","","Synthetic","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C4 Ba4 O12 -","- C4 Ba4 O12 -","","","","Antao, S. M.; Hassan, I.","BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 25 C","Physics and Chemistry of Minerals","2007","34","","573","580","10.1007/s00269-007-0172-8","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010929","5.314","","8.9146","","6.4642","","90","","90","","90","","306.223","","","","366.15","","","","","","","","Synthetic","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C4 Ba4 O12 -","- C4 Ba4 O12 -","","","","Antao, S. M.; Hassan, I.","BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 93 C","Physics and Chemistry of Minerals","2007","34","","573","580","10.1007/s00269-007-0172-8","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010930","5.319","","8.9189","","6.5019","","90","","90","","90","","308.448","","","","469.15","","","","","","","","Synthetic","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C4 Ba4 O12 -","- C4 Ba4 O12 -","","","","Antao, S. M.; Hassan, I.","BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 196 C","Physics and Chemistry of Minerals","2007","34","","573","580","10.1007/s00269-007-0172-8","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010931","5.3226","","8.9212","","6.5374","","90","","90","","90","","310.422","","","","571.15","","","","","","","","Synthetic","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C4 Ba4 O12 -","- C4 Ba4 O12 -","","","","Antao, S. M.; Hassan, I.","BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 298 C","Physics and Chemistry of Minerals","2007","34","","573","580","10.1007/s00269-007-0172-8","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010932","5.3264","","8.9247","","6.5751","","90","","90","","90","","312.557","","","","674.15","","","","","","","","Synthetic","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C4 Ba4 O12 -","- C4 Ba4 O12 -","","","","Antao, S. M.; Hassan, I.","BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 401 C","Physics and Chemistry of Minerals","2007","34","","573","580","10.1007/s00269-007-0172-8","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010933","5.3293","","8.9275","","6.6076","","90","","90","","90","","314.372","","","","759.15","","","","","","","","Synthetic","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C4 Ba4 O12 -","- C4 Ba4 O12 -","","","","Antao, S. M.; Hassan, I.","BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 486 C","Physics and Chemistry of Minerals","2007","34","","573","580","10.1007/s00269-007-0172-8","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010934","5.3322","","8.931","","6.6537","","90","","90","","90","","316.862","","","","879.15","","","","","","","","Synthetic","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C4 Ba4 O12 -","- C4 Ba4 O12 -","","","","Antao, S. M.; Hassan, I.","BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 606 C","Physics and Chemistry of Minerals","2007","34","","573","580","10.1007/s00269-007-0172-8","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010935","5.3336","","8.9354","","6.6877","","90","","90","","90","","318.721","","","","964.15","","","","","","","","Synthetic","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C4 Ba4 O12 -","- C4 Ba4 O12 -","","","","Antao, S. M.; Hassan, I.","BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 691 C","Physics and Chemistry of Minerals","2007","34","","573","580","10.1007/s00269-007-0172-8","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010936","5.3337","","8.9361","","6.6949","","90","","90","","90","","319.096","","","","981.15","","","","","","","","Synthetic","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C4 Ba4 O12 -","- C4 Ba4 O12 -","","","","Antao, S. M.; Hassan, I.","BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 708 C","Physics and Chemistry of Minerals","2007","34","","573","580","10.1007/s00269-007-0172-8","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010937","5.3338","","8.9403","","6.7252","","90","","90","","90","","320.696","","","","1050.15","","","","","","","","Synthetic","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C4 Ba4 O12 -","- C4 Ba4 O12 -","","","","Antao, S. M.; Hassan, I.","BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 777 C","Physics and Chemistry of Minerals","2007","34","","573","580","10.1007/s00269-007-0172-8","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010938","5.3333","","8.9417","","6.7339","","90","","90","","90","","321.131","","","","1067.15","","","","","","","","Synthetic","3","P m c n","-P 2n 2a","62","","","Witherite","- C Ba O3 -","- C4 Ba4 O12 -","- C4 Ba4 O12 -","","","","Antao, S. M.; Hassan, I.","BaCO3: high-temperature crystal structures and the Pmcn –> R3m phase transition at 811 C Sample: T = 794 C","Physics and Chemistry of Minerals","2007","34","","573","580","10.1007/s00269-007-0172-8","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010939","8.395","","8.395","","8.395","","90","","90","","90","","591.646","","","","293","","","","100","","","","Synthetic","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe24 O32 -","- Fe24 O32 -","","","","Gatta, G. D.; Kantor, I.; Ballaran, T. B.; Dubrovinsky, L.; McCammon, C.","Effect of non-hydrostatic conditions on the elastic behaviour of magnetite: an in situ single-crystal X-ray diffraction study Sample: P = 0.0001 GPa, T = 293 K","Physics and Chemistry of Minerals","2007","34","","627","635","10.1007/s00269-007-0177-3","","","","","","","","","","","","","","","","","","","","","has coordinates","282067","2023-03-26","07:49:22",""
"9010940","8.3198","","8.3198","","8.3198","","90","","90","","90","","575.889","","","","293","","","","4990000","","","","Synthetic","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe24 O32 -","- Fe24 O32 -","","","","Gatta, G. D.; Kantor, I.; Ballaran, T. B.; Dubrovinsky, L.; McCammon, C.","Effect of non-hydrostatic conditions on the elastic behaviour of magnetite: an in situ single-crystal X-ray diffraction study Sample: P = 4.99 GPa, T = 293 K","Physics and Chemistry of Minerals","2007","34","","627","635","10.1007/s00269-007-0177-3","","","","","","","","","","","","","","","","","","","","","has coordinates","282067","2023-03-26","07:49:22",""
"9010941","8.2634","","8.2634","","8.2634","","90","","90","","90","","564.256","","","","293","","","","9210000","","","","Synthetic","2","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnetite","- Fe3 O4 -","- Fe24 O32 -","- Fe24 O32 -","","","","Gatta, G. D.; Kantor, I.; Ballaran, T. B.; Dubrovinsky, L.; McCammon, C.","Effect of non-hydrostatic conditions on the elastic behaviour of magnetite: an in situ single-crystal X-ray diffraction study Sample: P = 9.21 GPa, T = 293 K","Physics and Chemistry of Minerals","2007","34","","627","635","10.1007/s00269-007-0177-3","","","","","","","","","","","","","","","","","","","","","has coordinates","282067","2023-03-26","07:49:22",""
"9010942","4.71236","","4.2311","","2.8289","","90","","90","","90","","56.404","","","","","","","","","","","","","4","P 21 n m","P -2 2ac","31","","","Boehmite (deuterated)","- Al D0.744 H0.256 O2 -","- Al2 D1.488 H0.512 O4 -","- Al2 D1.488 H0.512 O4 -","","","","Vanpeteghem, C. B.; Sano, A.; Komatsu, K.; Ohtani, E.; Suzuki, A.","Neutron diffraction study of aluminous hydroxide d-AlOOD","Physics and Chemistry of Minerals","2007","34","","657","661","10.1007/s00269-007-0180-8","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9010943","5.3622","","5.4885","","7.6694","","90","","90","","90","","225.714","","","","300","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 300 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010944","5.358","","5.4874","","7.6642","","90","","90","","90","","225.339","","","","275","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 275 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010945","5.3535","","5.4858","","7.6596","","90","","90","","90","","224.949","","","","250","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 250 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010946","5.3494","","5.4846","","7.6557","","90","","90","","90","","224.613","","","","225","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 225 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010947","5.3453","","5.4835","","7.6507","","90","","90","","90","","224.249","","","","200","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 200 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010948","5.3416","","5.4826","","7.6475","","90","","90","","90","","223.964","","","","175","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 175 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010949","5.3382","","5.4818","","7.6436","","90","","90","","90","","223.674","","","","150","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 150 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010950","5.3353","","5.4814","","7.6405","","90","","90","","90","","223.446","","","","125","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 125 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010951","5.3325","","5.4813","","7.6375","","90","","90","","90","","223.237","","","","100","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 100 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010952","5.3308","","5.4814","","7.6352","","90","","90","","90","","223.102","","","","75","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 75 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010953","5.3294","","5.4813","","7.6338","","90","","90","","90","","222.999","","","","50","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 50 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010954","5.3292","","5.4813","","7.6336","","90","","90","","90","","222.985","","","","25","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 25 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9010955","5.3287","","5.4811","","7.6335","","90","","90","","90","","222.953","","","","3.6","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Neighborite","- F3 Mg Na -","- F12 Mg4 Na4 -","- F12 Mg4 Na4 -","","","","Mitchell, R. H.; Alexander, M.; Cranswick, L. M. D.; Swainson, I. P.","A powder neutron diffraction study of the crystal structure of the fluoroperovskite NaMgF3 (neighborite) from 300 to 3.6 K Sample: T = 3.6 K","Physics and Chemistry of Minerals","2007","34","","705","712","10.1007/s00269-007-0188-0","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011321","6.2733","","6.2733","","5.7472","","90","","90","","120","","195.875","","","","","","","","","","","","Haydee mine, Salar Grande, Atacama desert, Chile","5","P -3 m 1","-P 3 2""","164","","","Haydeeite","- Cl2 Cu3 H6 Mg O6 -","- Cl2 Cu3 H6 Mg O6 -","- Cl2 Cu3 H6 Mg O6 -","","","","Malcherek, T.; Schluter, J.","Cu3MgCl2(OH)6 and the bond-valence parameters of the OH-Cl bond","Acta Crystallographica, Section B","2007","63","1","157","160","10.1107/S0108768106053870","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011322","4.21616","","11.023","","7.2951","","90","","90","","90","","339.038","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","","","- Cl H6 Mg0.5 O2 -","- Cl H4 Mg0.5 O2 -","- Cl4 H16 Mg2 O8 -","4","0.25","","Sugimoto, K.; Dinnebier, R. E.; Hanson, J. C.","Structures of three dehydration products of bischofite from in situ synchrotron powder diffraction data (MgCl2*nH2O; n = 1,2,4)","Acta Crystallographica, Section B","2007","63","2","235","242","10.1107/S0108768107002558","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:11",""
"9011327","10.1541","","10.1541","","2.9735","","90","","90","","90","","306.585","","","","","","","","","","","","Synthetic","4","I 4/m","-I 4","87","","","Hollandite","- K0.778 Mg0.388 O8 Ti3.612 -","- K1.556 Mg0.776 O16 Ti7.2232 -","- K1.556 Mg0.776 O16 Ti7.2232 -","","","","Michiue, Y.","Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 1","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011328","10.1541","","10.1541","","2.9735","","90","","90","","90","","306.585","","","","","","","","","","","","Synthetic","4","I 4/m","-I 4","87","","","Hollandite","- K0.774 Mg0.384 O8 Ti3.616 -","- K1.548 Mg0.7688 O16 Ti7.2312 -","- K1.548 Mg0.7688 O16 Ti7.2312 -","","","","Michiue, Y.","Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 2","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011329","10.1541","","10.1541","","2.9735","","90","","90","","90","","306.585","","","","","","","","","","","","Synthetic","4","I 4/m","-I 4","87","","","Hollandite","- K0.765 Mg0.383 O8 Ti3.617 -","- K1.53 Mg0.7656 O16 Ti7.2344 -","- K1.53 Mg0.7656 O16 Ti7.2344 -","","","","Michiue, Y.","Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 3","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011330","10.1541","","10.1541","","2.9735","","90","","90","","90","","306.585","","","","","","","","","","","","Synthetic","4","I 4/m","-I 4","87","","","Hollandite","- K0.77 Mg0.385 O8 Ti3.615 -","- K1.54 Mg0.7696 O16 Ti7.2304 -","- K1.54 Mg0.7696 O16 Ti7.2304 -","","","","Michiue, Y.","Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 4","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011331","10.2052","","10.2052","","2.9717","","90","","90","","90","","309.491","","","","","","","","","","","","Synthetic","4","I 4/m","-I 4","87","","","Hollandite","- Mg0.377 O8 Rb0.754 Ti3.623 -","- Mg0.7544 O16 Rb1.508 Ti7.2456 -","- Mg0.7544 O16 Rb1.508 Ti7.2456 -","","","","Michiue, Y.","Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 5","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011332","10.2052","","10.2052","","2.9717","","90","","90","","90","","309.491","","","","","","","","","","","","Synthetic","4","I 4/m","-I 4","87","","","Hollandite","- Mg0.377 O8 Rb0.754 Ti3.623 -","- Mg0.7544 O16 Rb1.508 Ti7.2456 -","- Mg0.7544 O16 Rb1.508 Ti7.2456 -","","","","Michiue, Y.","Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 6","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011333","10.2052","","10.2052","","2.9717","","90","","90","","90","","309.491","","","","","","","","","","","","Synthetic","4","I 4/m","-I 4","87","","","Hollandite","- Mg0.375 O8 Rb0.751 Ti3.625 -","- Mg0.7504 O16 Rb1.502 Ti7.2496 -","- Mg0.7504 O16 Rb1.502 Ti7.2496 -","","","","Michiue, Y.","Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 7","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011334","10.2052","","10.2052","","2.9717","","90","","90","","90","","309.491","","","","","","","","","","","","Synthetic","4","I 4/m","-I 4","87","","","Hollandite","- Mg0.376 O8 Rb0.751 Ti3.624 -","- Mg0.7512 O16 Rb1.502 Ti7.2488 -","- Mg0.7512 O16 Rb1.502 Ti7.2488 -","","","","Michiue, Y.","Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 8","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011335","10.2052","","10.2052","","2.9717","","90","","90","","90","","309.491","","","","","","","","","","","","Synthetic","4","I 4/m","-I 4","87","","","Hollandite","- Mg0.378 O8 Rb0.756 Ti3.622 -","- Mg0.7568 O16 Rb1.512 Ti7.2432 -","- Mg0.7568 O16 Rb1.512 Ti7.2432 -","","","","Michiue, Y.","Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 9","Acta Crystallographica, Section B","2007","63","4","577","583","10.1107/S0108768107023531","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011338","12.0449","","12.0449","","12.0449","","90","","90","","90","","1747.47","","","","1223","","","","","","","","Synthetic","3","I -4 3 d","I -4bd 2c 3","220","","","Mayenite","- Al7 Ca6 O16.348 -","- Al28 Ca24 O65.392 -","- Al28 Ca24 O65.392 -","","","","Boysen, H.; Lerch, M.; Stys, A.; Senyshyn, A.","Structure and oxygen mobility in mayenite (Ca12Al14O33): a high-temperature neutron powder diffraction study Sample: T = 1223 K","Acta Crystallographica, Section B","2007","63","5","675","682","10.1107/S0108768107030005","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011392","9.9885","","9.9885","","9.9885","","90","","90","","90","","996.554","","","","","","","","","","","","Eagle Claims, Beaverlodge Lake area, Saskatchewan, Canada","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Tyrrellite","- Co1.36 Cu Ni0.64 Se4 -","- Co10.88 Cu8 Ni5.12 Se32 -","- Co10.88 Cu8 Ni5.12 Se32 -","","","","Yang, H.; Hubler, D. K.; Lavina, B.; Downs, R. T.; Costin, G.","Tyrrellite, Cu(Co0.68Ni0.32)2Se4, isostructural with spinel","Acta Crystallographica, Section C","2007","63","","i73","i74","10.1107/S010827010703048X","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:23",""
"9011393","6.5109","","8.7301","","6.9046","","90","","112.246","","90","","363.251","","","","","","","","","","","","Kjorrestad, near Bamle, Norway","6","C 1 2/c 1","-C 2yc","15","","","Isokite","- Ca F0.8 H0.2 Mg O4.2 P -","- Ca F0.8 H0.2 Mg O4.2 P -","- Ca4 F3.2 H0.8 Mg4 O16.8 P4 -","4","0.5","","Yang, H.; Zwick, J.; Downs, R. T.; Costin, G.","Isokite, CaMg(PO4)F0.8(OH)0.2, isomorphous with titanite","Acta Crystallographica, Section C","2007","63","","i89","i90","10.1107/S0108270107041169","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9011394","5.4258","","10.2027","","8.9074","","90","","90.502","","90","","493.075","","","","","","","","","","","","Hot Springs County, Arkansas, USA","7","P 1 21/n 1","-P 2yn","14","","","Kolbeckite","- Al0.01 Fe0.02 H4 O6 P Sc0.94 V0.03 -","- Al0.04 Fe0.08 H16 O24 P4 Sc3.76 V0.12 -","- Al0.04 Fe0.08 H16 O24 P4 Sc3.76 V0.12 -","","","","Yang, H.; Li, C.; Jenkins, R. A.; Downs, R. T.; Costin, G.","Kolbeckite, ScPO4*2H2O, isomorphous with metavariscite","Acta Crystallographica, Section C","2007","63","","i91","i92","10.1107/S0108270107038036","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:23",""
"9011395","7.4919","","8.9946","","5.9158","","90","","90","","90","","398.646","","","","","","","","","","","","Dome Rock, Mingary, South Australia, Australia","6","P 21 21 21","P 2ac 2ab","19","","","Cobaltaustinite","- As Ca Co0.95 Cu0.05 H O5 -","- As4 Ca4 Co3.8 Cu0.2 H4 O20 -","- As4 Ca4 Co3.8 Cu0.2 H4 O20 -","","","","Yang, H.; Costin, G.; Keogh, J.; Lu, R.; Downs, R. T.","Cobaltaustinite, CaCo(AsO4)(OH)","Acta Crystallographica, Section E","2007","63","","i53","i55","10.1107/S1600536807003029","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:23",""
"9011397","10.3355","","10.7847","","8.9142","","105.048","","96.461","","125.302","","738.372","","","","","","","","","","","","Warrumbungle Volcano, central New South Wales, Australia","4","P -1","-P 1","2","","","Wilkinsonite","- Fe2.75 Na O10 Si3 -","- Fe11 Na4 O40 Si12 -","- Fe11 Na4 O40 Si12 -","","","","Burt, J. B.; Downs, R. T.; Costin, G.","Single-crystal X-ray refinement of wilkinsonite, Na2Fe2+4Fe3+2Si6O20.","Acta Crystallographica, Section E","2007","63","","i122","i124","10.1107/S1600536807015048","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:23",""
"9011536","12.501","","5.846","","9.443","","90","","90","","90","","690.102","","","","","","","","","","","","Kirovskii mine, Khibiny alkaline massif, Kola Peninsula, Russia","5","C m c m","-C 2c 2","63","","","Podlesnoite","- C2 Ba Ca2 F2 O6 -","- C8 Ba4 Ca8 F8 O24 -","- C8 Ba4 Ca8 F8 O24 -","","","","Zubkova, N. V.; Pushcharovsky, D. Y.; Pekov, I. V.; Rabadanov, M. K.","The crystal structure of podlesnoite, BaCa2(CO3)2F2","Zeitschrift fur Kristallographie","2007","222","","474","476","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:29",""
"9011571","5.928","","5.928","","9.126","","90","","90","","120","","277.733","","","","","","","","","","","","Synthetic","3","P 63 m c","P 6c -2c","186","","","Ferrihydrite","- Fe4.93 H O8 -","- Fe4.93 H O8 -","- Fe9.86 H2 O16 -","2","0.166667","","Michel, F. M.; Ehm, L.; Antao, S. M.; Lee, P. L.; Chupas, P. J.; Liu, G.; Strongin, D. R.; Schoonen, M. A. A.; Phillips, B. L.; Parise, J. B.","The structure of ferrihydrite, a nanocrystalline material Sample: Fhyd6","Science","2007","316","","1726","1729","10.1126/science.1142525","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9011572","5.953","","5.953","","9.096","","90","","90","","120","","279.16","","","","","","","","","","","","Synthetic","3","P 63 m c","P 6c -2c","186","","","Ferrihydrite","- Fe4.87 H O8 -","- Fe4.87 H O8 -","- Fe9.74 H2 O16 -","2","0.166667","","Michel, F. M.; Ehm, L.; Antao, S. M.; Lee, P. L.; Chupas, P. J.; Liu, G.; Strongin, D. R.; Schoonen, M. A. A.; Phillips, B. L.; Parise, J. B.","The structure of ferrihydrite, a nanocrystalline material Sample: Fhyd3","Science","2007","316","","1726","1729","10.1126/science.1142525","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9011573","5.958","","5.958","","8.965","","90","","90","","120","","275.602","","","","","","","","","","","","Synthetic","3","P 63 m c","P 6c -2c","186","","","Ferrihydrite","- Fe4.75 H O8 -","- Fe9.56 O16 -","- Fe9.56 O16 -","","","","Michel, F. M.; Ehm, L.; Antao, S. M.; Lee, P. L.; Chupas, P. J.; Liu, G.; Strongin, D. R.; Schoonen, M. A. A.; Phillips, B. L.; Parise, J. B.","The structure of ferrihydrite, a nanocrystalline material Sample: Fhyd2","Science","2007","316","","1726","1729","10.1126/science.1142525","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:29",""
"9011596","3.19","","3.19","","23.85","","90","","90","","120","","210.184","","","","","","","","","","","","Synthetic","4","R -3 m :H","-R 3 2""","166","","","Fougerite","- Cl0.5 Fe H13.75 O2.25 -","- Cl0.49998 Fe H2.74996 O2.24998 -","- Cl1.49994 Fe3 H8.24988 O6.74994 -","3","0.0833333","","Trolard, F.; Bourrie, G.; Abdelmoula, M.; Refait, P.; Feder, F.","Fougerite, a new mineral of the pyroaurite-iowaite group: Description and crystal structure","Clays and Clay Minerals","2007","55","","323","334","10.1346/CCMN.2007.0550308","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9011735","11.888","","6.409","","9.804","","90","","106.17","","90","","717.418","","","","","","","","","","","","Helikon II mine, Karibib, Namibia","4","I 1 2/a 1","-I 2ya","15","","","Joosteite","- Fe0.48 Mn1.436 O5 P -","- Fe3.84 Mn11.488 O40 P8 -","- Fe3.84 Mn11.488 O40 P8 -","","","","Keller, P.; Lissner, F.; Schleid, T.","The crystal structure of joosteite, (Mn2+,Mn3+,Fe3+)2[PO4]O, from the Helikon II mine, Karibib (Namibia), and its relationship to stanekite, (Fe3+,Mn2+,Fe2+,Mg)2[PO4]O Note: M1 and M2 Fe/Mn occupancies not determined, below are estimates Locality: Helikon II mine, Karibib, Namibia","Neues Jahrbuch fur Mineralogie, Abhandlungen","2007","184","","225","230","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:57",""
"9011832","9.249","","9.076","","10.342","","90","","90","","90","","868.148","","","","","","","","","","","","N'Chwaning II mine, Republic of South Africa","6","P b c a","-P 2ac 2ab","61","","","Olmiite","- Ca1.14 Fe0.01 H2 Mn0.84 O5 Si -","- Ca9.12 Fe0.08 H16 Mn6.72 O40 Si8 -","- Ca9.12 Fe0.08 H16 Mn6.72 O40 Si8 -","","","","Bonazzi, P.; Bindi, L.; Medenbach, O.; Pagano, R.; Lampronti, G. I.; Menchetti, S.","Olmiite, CaMn[SiO3(OH)](OH), the Mn-dominant analogue of poldervaartite, a new mineral species from Kalahari manganese fields (Republic of South Africa)","Mineralogical Magazine","2007","71","","193","201","10.1180/minmag.2007.071.2.193","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:27:04",""
"9011833","7.3177","","7.3177","","17.534","","90","","90","","120","","813.132","","","","","","","","","","","","Synthetic","5","R -3 m :H","-R 3 2""","166","","","Ammoniojarosite","- Fe3 H10 N O14 S2 -","- Fe9 H21 N3 O42 S6 -","- Fe9 H21 N3 O42 S6 -","","","","Basciano, L. C.; Peterson, R. C.","The crystal structure of ammoniojarosite, (NH4)Fe3(SO4)2(OH)6 and the crystal chemistry of the ammoniojarosite-hydronium jarosite solid-solution series","Mineralogical Magazine","2007","71","","427","441","10.1180/minmag.2007.071.4.427","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:27:04",""
"9012665","17.02","","17.02","","9.679","","90","","90","","120","","2428.18","","","","","","","","","","","","Rov-Gora Mountain, West Keivy, Kola Peninsula, Russia","6","R -3 :H","-R 3","148","","","Tveitite","- Ca9.434 F41.06 Ho0.48 Na1.958 Nd0.954 Y5.298 -","- Ca9.434 F41.06 Ho0.48 Na1.958 Nd0.954 Y5.298 -","- Ca28.302 F123.18 Ho1.44 Na5.874 Nd2.862 Y15.894 -","3","0.166667","","Yakubovich, O. V.; Massa, W.; Pekov, I. V.; Gavrilenko, P. G.","Crystal structure of tveitite-(Y): fractionation of rare-earth elements between positions and the variety of defects","Crystallography Reports","2007","52","","71","79","10.1134/S1063774507010087","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9012778","16.4821","","12.5195","","10.0292","","90","","115.474","","90","","1868.31","","","","","","","","","","","","","7","C 1 c 1","C -2yc","9","","","Mangan-neptunite","- Fe2 K Li Na2 O24 Si8 Ti2 -","- Fe8 K4 Li4 Na8 O96 Si32 Ti8 -","- Fe8 K4 Li4 Na8 O96 Si32 Ti8 -","","","","Zolotarev, A. A.; Krivovichev, S. V.; Yakovenchuk, V. N.","Refinement of the mangan-neptunite structure Locality: synthetic Note: changed signs of z-coordinates of O12 and O14, Ti1(y) to .32364","Zapiski Vserossijskogo Mineralogicheskogo Obshchetstva","2007","136","","118","123","","","","","","","","","","","","","","","","","","","","","","has coordinates","287548","2023-11-11","13:26:52",""
"9013067","4.4446","","5.4246","","3.3864","","90","","90","","90","","81.647","","","","","","","","","","","","Synthetic","2","P n n m","-P 2 2n","58","","","Marcasite","- Fe S2 -","- Fe2 S4 -","- Fe2 S4 -","","","","Rieder, M.; Crelling, J. C.; Sustai, O.; Drabek, M.; Weiss, Z.; Klementova, M.","Arsenic in iron disulfides in a brown coal from the North Bohemian Basin, Czech Republic Sample: As-free marcasite","International Journal of Coal Geology","2007","71","","115","121","10.1016/j.coal.2006.07.003","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:22",""
"9013068","4.449","","5.432","","3.391","","90","","90","","90","","81.95","","","","","","","","","","","","Dul CSA mine, North Bohemian Basin, Czech Republic","3","P n n m","-P 2 2n","58","","","Marcasite","- As0.4 Fe S1.6 -","- As0.8 Fe2 S3.2 -","- As0.8 Fe2 S3.2 -","","","","Rieder, M.; Crelling, J. C.; Sustai, O.; Drabek, M.; Weiss, Z.; Klementova, M.","Arsenic in iron disulfides in a brown coal from the North Bohemian Basin, Czech Republic Sample: Natural As-marcasite","International Journal of Coal Geology","2007","71","","115","121","10.1016/j.coal.2006.07.003","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:22",""
"9013069","5.416","","5.416","","5.416","","90","","90","","90","","158.868","","","","","","","","","","","","Synthetic","2","P a -3","-P 2ac 2ab 3","205","","","Pyrite","- Fe S2 -","- Fe4 S8 -","- Fe4 S8 -","","","","Rieder, M.; Crelling, J. C.; Sustai, O.; Drabek, M.; Weiss, Z.; Klementova, M.","Arsenic in iron disulfides in a brown coal from the North Bohemian Basin, Czech Republic Sample: As-free pyrite","International Journal of Coal Geology","2007","71","","115","121","10.1016/j.coal.2006.07.003","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:22",""
"9013070","5.428","","5.428","","5.428","","90","","90","","90","","159.926","","","","","","","","","","","","Synthetic","3","P a -3","-P 2ac 2ab 3","205","","","Pyrite","- As0.026 Fe S1.974 -","- As0.104 Fe4 S7.896 -","- As0.104 Fe4 S7.896 -","","","","Rieder, M.; Crelling, J. C.; Sustai, O.; Drabek, M.; Weiss, Z.; Klementova, M.","Arsenic in iron disulfides in a brown coal from the North Bohemian Basin, Czech Republic Sample: As-pyrite","International Journal of Coal Geology","2007","71","","115","121","10.1016/j.coal.2006.07.003","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:22",""
"9013071","5.429","","5.429","","5.429","","90","","90","","90","","160.015","","","","","","","","","","","","Dul CSA mine, North Bohemian Basin, Czech Republic","3","P a -3","-P 2ac 2ab 3","205","","","Pyrite","- As0.54 Fe S1.46 -","- As2.16 Fe4 S5.84 -","- As2.16 Fe4 S5.84 -","","","","Rieder, M.; Crelling, J. C.; Sustai, O.; Drabek, M.; Weiss, Z.; Klementova, M.","Arsenic in iron disulfides in a brown coal from the North Bohemian Basin, Czech Republic Sample: natural As-pyrite","International Journal of Coal Geology","2007","71","","115","121","10.1016/j.coal.2006.07.003","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:22",""
"9013143","11.7119","","19.973","","11.5652","","90","","90","","90","","2705.35","","","","","","","","","","","","Mt. Kedykverpakhk, Lovozero alkaline pluton, Kola Peninsula, Russia","4","I b c a","-I 2b 2c","73","","","Chesnokovite","- H18 Na2 O12 Si -","- H144 Na16 O96 Si8 -","- H144 Na16 O96 Si8 -","","","","Pekova, I. V.; Chukanov, N. V.; Zadov, A. E.; Zubkova, N. V.; Pushcharovsky D Yu","Chesnokovite, Na2[SiO2(OH)2]*8H2O, the first natural sodium orthosilicate from the Lovozero alkaline pluton, Kola Peninsula: Description and crystal structure of a new mineral species Locality: Mt. Kedykverpakhk, Lovozero alkaline pluton, Kola Peninsula, Russia","Geology of Ore Deposits","2007","49","","727","738","10.1134/S1075701507080077","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:29",""
"9013156","4.961","","12.181","","18.974","","90","","90.96","","90","","1146.44","","","","","","","","","","","","Great Australia mine, Concurry, Queensland, Australia","8","P 1 21/c 1","-P 2ybc","14","","","Cloncurryite","- Al3.96 Cu1.12 F2 Fe0.04 H28 O28.72 P4 V0.88 -","- Al3.96 Cu1.12 F2 Fe0.04 H21.68 O28.72 P4 V0.88 -","- Al7.92 Cu2.24 F4 Fe0.08 H43.36 O57.44 P8 V1.76 -","2","0.5","","Colchester, D. M.; Leverett, P.; McKinnon, A. R.; Sharpe, J. L.; Williams, P. A.","Cloncurryite, Cu0.56(VO)0.44Al2(PO4)2(F,OH)2*5H2O, a new mineral from the Great Australia mine, Cloncurry, Queensland, Australia, and its relationship to nevadaite Locality: Great Australia mine, Concurry, Queensland, Australia","Australian Journal of Mineralogy","2007","13","","5","14","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07",""
"9013160","24.8219","","11.9236","","14.8765","","90","","94.486","","90","","4389.46","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","Megacyclite","- H46 K Na8 O46 Si9 -","- H46 K Na8 O46 Si9 -","- H184 K4 Na32 O184 Si36 -","4","1","","Zubkova, N. V.; Pekov, I. V.; Chukanov, N. V.; Listsin, D. V.; Rabadanov, M. K.; Pushcharovsky, D. Y.","New data on megacyclite","New Data on Minerals. Moscow","2007","42","","81","92","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9013404","12.265","","13.197","","9.7385","","90","","108.63","","90","","1493.69","","","","1063","","","","2500000","","","","Synthetic","4","P 1 21/a 1","-P 2yab","14","","","Wolfeite","- Fe2 H O5 P -","- Fe32 H16 O80 P16 -","- Fe32 H16 O80 P16 -","","","","Hatert, F.","Fe2(PO4)(OH), a synthetic analogue of wolfeite Sample: T = 1063 K, P = 2.5 GPa","Acta Crystallographica, Section C","2007","63","","i119","i121","10.1107/S0108270107053462","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:36",""
"9013428","7.3277","","7.3277","","11.7752","","90","","90","","120","","547.563","","","","","","","","","","","","Premier mine, Stewart, British Columbia, Canada","5","P -3 m 1","-P 3 2""","164","","","Cupropolybasite","- Ag11.706 As0.618 Cu4.294 S11 Sb1.382 -","- Ag11.706 As0.618 Cu4.294 S11 Sb1.382 -","- Ag11.706 As0.618 Cu4.294 S11 Sb1.382 -","","","","Bindi, L.; Evain, M.; Spry, P. G.; Tait, K. T.; Menchetti, S.","Structural role of copper in the minerals of the pearceite-polybasite group: the case of the new minerals cupropearceite and cupropolybasite","Mineralogical Magazine","2007","71","","641","650","10.1180/minmag.2007.071.6.641","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:31:36",""
"9013917","7.97187","","8.62844","","10.26276","","90","","94.801","","90","","703.445","","","","","","","","","","","","Synthetic","3","P 1 21/c 1","-P 2ybc","14","","","Dmitryivanovite","- Al2 Ca O4 -","- Al16 Ca8 O32 -","- Al16 Ca8 O32 -","","","","Lazic, B.; Kahlenberg, V.; Konzett, J.","Structural studies on a stuffed framework high pressure polymorph of CaAl2O4","Zeitschrift fur Kristallographie","2007","222","","690","695","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013936","10.5702","","10.5702","","6.6509","","90","","90","","120","","643.543","","","","","","","","","","","","Santa Rosa mine, near Iquique, Chile","5","P 63 m c","P 6c -2c","186","","","Sanromanite","- C5 Ca Na2 O15 Pb3 -","- C10 Ca1.99998 Na4.00002 O30 Pb6 -","- C10 Ca1.99998 Na4.00002 O30 Pb6 -","","","","Schluter, J.; Malcherek, T.; Pohl, D.","Sanromanite, from the Santa Rosa mine, Atacama desert, Chile, a new mineral of the burbankite group","Neues Jahrbuch fur Mineralogie, Abhandlungen","2007","183","","117","121","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013963","12.5122","","12.5122","","12.5122","","90","","90","","90","","1958.85","","","","","","","","","","","","Synthetic","6","I a -3 d","-I 4bd 2c 3","230","","","","- Al1.05 Ca3 Fe0.93 O12 Si0.93 Zr2 -","- Al8.4 Ca24 Fe7.44 O96 Si7.44 Zr16 -","- Al8.4 Ca24 Fe7.44 O96 Si7.44 Zr16 -","","","","Whittle, K. R.; Lumpkin, G. R.; Berry, F. J.; Oates, G.; Smith, K. L.; Yudintsev, S.; Zaluzec, N. J.","The structure and ordering of zirconium and hafnium containing garnets studied by electron channelling, neutron diffraction and Mossbauer spectroscopy Locality: synthetic","Journal of Solid State Chemistry","2007","180","","785","791","10.1016/j.jssc.2006.12.006","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013964","12.5844","","12.5844","","12.5844","","90","","90","","90","","1992.95","","","","","","","","","","","","Synthetic","6","I a -3 d","-I 4bd 2c 3","230","","","","- Al0.48 Ca3 Fe1.44 O12 Si0.81 Zr2 -","- Al3.84 Ca24 Fe11.52 O96 Si6.48 Zr16 -","- Al3.84 Ca24 Fe11.52 O96 Si6.48 Zr16 -","","","","Whittle, K. R.; Lumpkin, G. R.; Berry, F. J.; Oates, G.; Smith, K. L.; Yudintsev, S.; Zaluzec, N. J.","The structure and ordering of zirconium and hafnium containing garnets studied by electron channelling, neutron diffraction and Mossbauer spectroscopy Locality: synthetic","Journal of Solid State Chemistry","2007","180","","785","791","10.1016/j.jssc.2006.12.006","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013965","12.6164","","12.6164","","12.6164","","90","","90","","90","","2008.2","","","","","","","","","","","","Synthetic","5","I a -3 d","-I 4bd 2c 3","230","","","Kerimasit","- Ca3 Fe1.95 O12 Si0.93 Zr2 -","- Ca24 Fe15.6 O96 Si7.44 Zr16 -","- Ca24 Fe15.6 O96 Si7.44 Zr16 -","","","","Whittle, K. R.; Lumpkin, G. R.; Berry, F. J.; Oates, G.; Smith, K. L.; Yudintsev, S.; Zaluzec, N. J.","The structure and ordering of zirconium and hafnium containing garnets studied by electron channelling, neutron diffraction and Mossbauer spectroscopy Locality: synthetic","Journal of Solid State Chemistry","2007","180","","785","791","10.1016/j.jssc.2006.12.006","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013966","12.5145","","12.5145","","12.5145","","90","","90","","90","","1959.93","","","","","","","","","","","","Synthetic","6","I a -3 d","-I 4bd 2c 3","230","","","","- Al1.23 Ca3 Fe0.99 Hf2 O12 Si0.99 -","- Al9.84 Ca24 Fe7.92 Hf16 O96 Si7.92 -","- Al9.84 Ca24 Fe7.92 Hf16 O96 Si7.92 -","","","","Whittle, K. R.; Lumpkin, G. R.; Berry, F. J.; Oates, G.; Smith, K. L.; Yudintsev, S.; Zaluzec, N. J.","The structure and ordering of zirconium and hafnium containing garnets studied by electron channelling, neutron diffraction and Mossbauer spectroscopy Locality: synthetic","Journal of Solid State Chemistry","2007","180","","785","791","10.1016/j.jssc.2006.12.006","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013967","12.5898","","12.5898","","12.5898","","90","","90","","90","","1995.52","","","","","","","","","","","","Synthetic","5","I a -3 d","-I 4bd 2c 3","230","","","","- Ca3 Fe2.16 Hf2 O12 Si0.99 -","- Ca24 Fe17.28 Hf16 O96 Si7.92 -","- Ca24 Fe17.28 Hf16 O96 Si7.92 -","","","","Whittle, K. R.; Lumpkin, G. R.; Berry, F. J.; Oates, G.; Smith, K. L.; Yudintsev, S.; Zaluzec, N. J.","The structure and ordering of zirconium and hafnium containing garnets studied by electron channelling, neutron diffraction and Mossbauer spectroscopy Locality: synthetic","Journal of Solid State Chemistry","2007","180","","785","791","10.1016/j.jssc.2006.12.006","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013996","12.892","","12.892","","21.34","","90","","90","","120","","3071.61","","","","","","","","","","","","Sabatino volcanic complex, Latium, Italy","10","P 3 1 c","P 3 -2c","159","","","Alloriite","- C0.31 H18 Al12 Ca2.23 Cl0.17 K2.16 Na11.61 O61.79 S2.7 Si12 -","- C0.31 H6.26 Al12 Ca2.23 Cl0.17 K2.16 Na11.61 O61.79 S2.7 Si12 -","- C0.62 H12.52 Al24 Ca4.46 Cl0.34 K4.32 Na23.22 O123.58 S5.4 Si24 -","2","0.333333","","Rastsvetaeva, R. K.; Ivanova, A. G.; Chukanov, N. V.; Verin, I. A.","Crystal structure of alloriite","Doklady Earth Sciences","2007","415","","815","819","10.1134/S1028334X07050340","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07",""
"9014181","7.3964","","7.3964","","15.8466","","90","","90","","90","","866.916","","","","","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Wesselsite","- Ba0.5 Cu O10 Si4 Sr0.5 -","- Ba2 Cu4 O40 Si16 Sr2 -","- Ba2 Cu4 O40 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 25 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014206","7.39533","","7.39533","","15.8482","","90","","90","","90","","866.752","","","","","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Effenbergerite","- Ba0.5 Cu O10 Si4 Sr0.5 -","- Ba2 Cu4 O40 Si16 Sr2 -","- Ba2 Cu4 O40 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 100 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014330","4.365","","4.365","","12.389","","90","","90","","90","","236.05","","","","","","","","","","","","synthetic, Fluka 83379","2","P 42/n m c :2","-P 4ac 2a","137","","","Coccinite","- Hg I2 -","- Hg2 I4 -","- Hg2 I4 -","","","","Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.","Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 200 K, powder neutron data","Acta Crystallographica, Section B","2007","63","5","828","835","10.1107/S0108768107043327","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014338","7.39425","","7.39425","","15.8621","","90","","90","","90","","867.259","","","","","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Wesselsite","- Ba0.5 Cu O10 Si4 Sr0.5 -","- Ba2 Cu4 O40 Si16 Sr2 -","- Ba2 Cu4 O40 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 300 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014434","4.359","","4.359","","12.319","","90","","90","","90","","234.072","","","","","","","","","","","","synthetic, Fluka 83379","2","P 42/n m c :2","-P 4ac 2a","137","","","Coccinite","- Hg I2 -","- Hg2 I4 -","- Hg2 I4 -","","","","Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.","Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 60 K, powder neutron data","Acta Crystallographica, Section B","2007","63","6","828","835","10.1107/S0108768107043327","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014438","8.924","","8.924","","3.116","","90","","90","","120","","214.905","","","","","","","","","","","","the Titovsky deposit, Sakha-Yakutia Republic, Russia","4","P 63/m","-P 6c","176","","","Hydroxylborite","- B H3 Mg3 O6 -","- B2 H6 Mg6 O12 -","- B2 H6 Mg6 O12 -","","","","Rudnev, V. V.; Chukanov, N. V.; Nechelyustov, G. N.; Yamnova, N. A.","Hydroxylborite, Mg3(BO3)(OH)3, a new mineral species and isomorphous series fluoborite-hydroxylborite series","Geology of Ore Deposits","2007","49","","710","719","10.1134/S1075701507080053","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014451","6.617","","8.813","","5.426","","87.26","","85.68","","71.75","","299.553","","","","","","","","","","","","Alluaiv Mountain (Lovozero), Kola Peninsula, Russia","5","P -1","-P 1","2","","","Parakeldyshite","- H0.066 Na1.934 O7 Si2 Zr -","- H0.132 Na3.868 O14 Si4 Zr2 -","- H0.132 Na3.868 O14 Si4 Zr2 -","","","","Pekov, I. V.; Zubkova, N. V.; Pushcharovsky, D. Y.; Kolitsch, U.; Tillmanns, E.","Refined crystal structure of parakeldyshite and genetic crystal chemistry of zirconium minerals with [Si2O7] diorthogroups","Crystallography Reports","2007","52","","1066","1071","10.1134/S1063774507060223","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014462","4.358","","4.358","","12.306","","90","","90","","90","","233.718","","","","","","","","","","","","synthetic, Fluka 83379","2","P 42/n m c :2","-P 4ac 2a","137","","","Coccinite","- Hg I2 -","- Hg2 I4 -","- Hg2 I4 -","","","","Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.","Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 30 K, powder neutron data","Acta Crystallographica, Section B","2007","63","6","828","835","10.1107/S0108768107043327","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014489","7.0755","","4.8739","","8.4471","","90","","90","","90","","291.301","","","","","","","","","","","","Synthetic","4","P 21 21 21","P 2ac 2ab","19","","","","- C H Gd O4 -","- C H Gd O4 -","- C4 H4 Gd4 O16 -","4","1","","Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.","Crystal chemistry of RE(CO3)OH","Zeitschrift fur Kristallographie","2007","222","","326","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9014581","7.39447","","7.39447","","15.8534","","90","","90","","90","","866.835","","","","","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Effenbergerite","- Ba0.5 Cu O10 Si4 Sr0.5 -","- Ba2 Cu4 O40 Si16 Sr2 -","- Ba2 Cu4 O40 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 200 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014617","7.39601","","7.39601","","15.8469","","90","","90","","90","","866.841","","","","","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Wesselsite","- Ba0.5 Cu O10 Si4 Sr0.5 -","- Ba2 Cu4 O40 Si16 Sr2 -","- Ba2 Cu4 O40 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 50 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014655","4.37","","4.37","","12.437","","90","","90","","90","","237.508","","","","","","","","","","","","synthetic, Fluka 83379","2","P 42/n m c :2","-P 4ac 2a","137","","","Coccinite","- Hg I2 -","- Hg2 I4 -","- Hg2 I4 -","","","","Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.","Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 293 K, powder neutron data","Acta Crystallographica, Section B","2007","63","6","828","835","10.1107/S0108768107043327","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014702","7.1388","","4.9151","","8.4717","","90","","90","","90","","297.254","","","","","","","","","","","","Synthetic","4","P n m a","-P 2ac 2n","62","","","Kozoite-(Sm)","- C H O4 Sm -","- C H O4 Sm -","- C4 H4 O16 Sm4 -","4","0.5","","Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.","Crystal chemistry of RE(CO3)OH","Zeitschrift fur Kristallographie","2007","222","","326","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9014709","7.1002","","4.8932","","8.453","","90","","90","","90","","293.68","","","","","","","","","","","","Synthetic","4","P 21 21 21","P 2ac 2ab","19","","","","- C H Eu O4 -","- C H Eu O4 -","- C4 H4 Eu4 O16 -","4","1","","Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.","Crystal chemistry of RE(CO3)OH","Zeitschrift fur Kristallographie","2007","222","","326","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9014825","6.9591","","4.8141","","8.4722","","90","","90","","90","","283.834","","","","","","","","","","","","Synthetic","4","P 21 21 21","P 2ac 2ab","19","","","","- C H O4 Y -","- C H O4 Y -","- C4 H4 O16 Y4 -","4","1","","Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.","Crystal chemistry of RE(CO3)OH","Zeitschrift fur Kristallographie","2007","222","","326","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9014993","22.6791","","22.6791","","7.22336","","90","","90","","120","","3217.52","","","","","","","","","","","","Synthetic","5","R 3 c :H","R 3 -2""c","161","","","Chlorartinite","- C H5 Cl Mg2 O6 -","- C H5 Cl Mg2 O6 -","- C18 H90 Cl18 Mg36 O108 -","18","1","","Sugimoto, K.; Dinnebier, R. E.; Schlecht, T.","Crystal structure of dehydrated chlorartinite by X-ray powder diffraction Note: this is a dehydrated chlorartinite","Powder Diffraction","2007","22","","64","67","10.1154/1.2436546","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9015091","7.39428","","7.39428","","15.8573","","90","","90","","90","","867.004","","","","","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Effenbergerite","- Ba0.5 Cu O10 Si4 Sr0.5 -","- Ba2 Cu4 O40 Si16 Sr2 -","- Ba2 Cu4 O40 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 250 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015295","6.9028","","4.7833","","8.5086","","90","","90","","90","","280.938","","","","","","","","","","","","Synthetic","4","P 21 21 21","P 2ac 2ab","19","","","","- C H O4 Tm -","- C H O4 Tm -","- C4 H4 O16 Tm4 -","4","1","","Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.","Crystal chemistry of RE(CO3)OH","Zeitschrift fur Kristallographie","2007","222","","326","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9015332","4.358","","4.358","","12.3","","90","","90","","90","","233.604","","","","","","","","","","","","synthetic, Fluka 83379","2","P 42/n m c :2","-P 4ac 2a","137","","","Coccinite","- Hg I2 -","- Hg2 I4 -","- Hg2 I4 -","","","","Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.","Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 10 K, powder neutron data","Acta Crystallographica, Section B","2007","63","6","828","835","10.1107/S0108768107043327","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015346","7.3715","","7.3715","","5.302","","90","","90","","120","","249.507","","","","","","","","","","","","Synthetic","2","P -3","-P 3","147","","","","- Ni Ti0.885 -","- Ni9 Ti7.965 -","- Ni9 Ti7.965 -","","","","Sitepu, H.","Structural refinement of neutron powder diffraction data of two-stage martensitic phase transformations in Ti50.75Ni47.75Fe1.50 shape memory alloy","Powder Diffraction","2007","22","","209","218","10.1154/1.2754715","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015414","4.3675","","4.3675","","12.47","","90","","90","","90","","237.866","","","","","","","","","","","","synthetic, Fluka 83379","2","P 42/n m c :2","-P 4ac 2a","137","","","Coccinite","- Hg I2 -","- Hg2 I4 -","- Hg2 I4 -","","","","Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.","Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 293 K, single crystal X-ray data","Acta Crystallographica, Section B","2007","63","6","828","835","10.1107/S0108768107043327","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015519","2.725","","2.725","","5.202","","90","","90","","90","","38.628","","","","","","","","","","","","Luobusha, Tibet","2","P 4/m m m","-P 4 2","123","","","Linzhiite","- Fe Si2 -","- Fe Si2 -","- Fe Si2 -","","","","Li, G.; Shi, N.; Xiong, M.; Ma, Z.; Bai, W.; Fang, Q.","X-ray diffraction investigation of native Si-Fe alloy minerals from Luobusha, Tibet","Frontiers of Earth Science in China","2007","1","","21","25","10.1007/s11707-007-0003-8","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015581","3.0191","","3.0191","","3.0191","","90","","90","","90","","27.519","","","","","","","","","","","","Synthetic","2","P m -3 m","-P 4 2 3","221","","","","- Ni0.106 Ti0.942 -","- Ni0.10581 Ti0.9419 -","- Ni0.10581 Ti0.9419 -","","","","Sitepu, H.","Structural refinement of neutron powder diffraction data of two-stage martensitic phase transformations in Ti50.75Ni47.75Fe1.50 shape memory alloy","Powder Diffraction","2007","22","","209","218","10.1154/1.2754715","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015582","13.6322","","30.469","","18.4671","","90","","91.134","","90","","7668.98","","","","","","","","","","","","Bou Azzer, Anti-Atlas, Morocco","7","P 1 21/n 1","-P 2yn","14","","","Bouazzerite","- As18 Bi6 Co0.24 Fe14 H176 Mg10.76 O174 -","- As18 Bi6 Co0.24 Fe14 H176 Mg10.76 O174 -","- As36 Bi12 Co0.48 Fe28 H352 Mg21.52 O348 -","2","0.5","","Brugger, J.; Meisser, N.; Krivovichev, S.; Armbruster, T.; Favreau, G.","Mineralogy and crystal structure of bouazzerite from Bou Azzer, Anti-Atlas, Morocco: Bi-As-Fe nanoclusters containing Fe3+ in trigonal prismatic coordination","American Mineralogist","2007","92","","1630","1639","10.2138/am.2007.2508","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9015649","7.2333","","4.964","","8.4908","","90","","90","","90","","304.872","","","","","","","","","","","","Synthetic","4","P n m a","-P 2ac 2n","62","","","Kozoite-(Nd)","- C H Nd O4 -","- C H Nd O4 -","- C4 H4 Nd4 O16 -","4","0.5","","Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.","Crystal chemistry of RE(CO3)OH","Zeitschrift fur Kristallographie","2007","222","","326","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9015723","4.36","","4.36","","12.337","","90","","90","","90","","234.521","","","","","","","","","","","","synthetic, Fluka 83379","2","P 42/n m c :2","-P 4ac 2a","137","","","Coccinite","- Hg I2 -","- Hg2 I4 -","- Hg2 I4 -","","","","Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P.","Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 100 K, powder neutron data","Acta Crystallographica, Section B","2007","63","6","828","835","10.1107/S0108768107043327","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015733","2.92617","","4.17272","","4.69631","","90","","90","","97.4036","","56.864","","","","","","","","","","","","Synthetic","2","P 1 1 21/m","-P 2c","11","","","","- Ni Ti0.921 -","- Ni2.158 Ti1.842 -","- Ni2.158 Ti1.842 -","","","","Sitepu, H.","Structural refinement of neutron powder diffraction data of two-stage martensitic phase transformations in Ti50.75Ni47.75Fe1.50 shape memory alloy","Powder Diffraction","2007","22","","209","218","10.1154/1.2754715","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015908","6.9583","","4.8121","","8.4558","","90","","90","","90","","283.134","","","","","","","","","","","","Synthetic","4","P 21 21 21","P 2ac 2ab","19","","","","- C H Ho O4 -","- C H Ho O4 -","- C4 H4 Ho4 O16 -","4","1","","Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.","Crystal chemistry of RE(CO3)OH","Zeitschrift fur Kristallographie","2007","222","","326","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9015925","9.3771","","9.3771","","7.7117","","90","","90","","90","","678.09","","","","","","","","","","","","Synthetic","4","P 42/n m c :2","-P 4ac 2a","137","","","","- C H O4 Yb -","- C H O4 Yb -","- C8 H8 O32 Yb8 -","8","0.5","","Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.","Crystal chemistry of RE(CO3)OH","Zeitschrift fur Kristallographie","2007","222","","326","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9015939","9.3943","","9.3943","","9.3943","","94.369","","94.369","","94.369","","821.455","","","","","","","","","","","","Komuro, Ohhito, Shizuoka Prefecture, Japan","6","R -3 m :R","-P 3* 2","166","","","Chabazite-Ca","- Al3.396 Ca1.568 H24.942 Na0.492 O36.471 Si8.556 -","- Al3.396 Ca1.568 H24.942 Na0.492 O36.471 Si8.556 -","- Al3.396 Ca1.568 H24.942 Na0.492 O36.471 Si8.556 -","1","0.0833333","","Nakatsuka, A.; Okada, H.; Fujiwara, K.; Nakayama, N.; Mizota, T.","Crystallographic configurations of water molecules and exchangeable cations in a hydrated natural CHA-zeolite (chabazite)","Microporous and Mesoporous Materials","2007","102","","188","195","10.1016/j.micromeso.2006.12.032","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9015940","10.675","","10.675","","27.02","","90","","90","","120","","2666.56","","","","","","","","","","","","Hundholmen, Tysfjord, Nordland County, Norway","13","R 3 m :H","R 3 -2""","160","","","Hundholmenite-(Y)","- Al0.66 As0.48 B3 Ca3.15 F11.16 Fe0.27 Mn0.03 Na0.27 O39.64 P0.05 Si6.69 Sm7.71 Y4.38 -","- Al0.66 As0.48 B3 Ca3.15 F11.16 Fe0.27 Mn0.03 Na0.27 O36.64 P0.05 Si6.69 Sm7.71 Y4.38 -","- Al1.98 As1.44 B9 Ca9.45 F33.48 Fe0.81 Mn0.09 Na0.81 O109.92 P0.15 Si20.07 Sm23.13 Y13.14 -","3","0.166667","","Raade, G.; Johnsen, O.; Erambert, M.; Petersen, O. V.","Hundholmenite-(Y) from Norway - a new mineral species in the vicanite group: descriptive data and crystal structure","Mineralogical Magazine","2007","71","","179","192","10.1180/minmag.2007.071.2.179","","","","","","","","","","","","","","","","","","","","","has coordinates","285096","2023-07-08","08:53:35",""
"9016000","7.39675","","7.39675","","15.8465","","90","","90","","90","","866.992","","","","","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Effenbergerite","- Ba0.5 Cu O10 Si4 Sr0.5 -","- Ba2 Cu4 O40 Si16 Sr2 -","- Ba2 Cu4 O40 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 5 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9016089","7.0256","","4.8577","","8.4657","","90","","90","","90","","288.92","","","","","","","","","","","","Synthetic","4","P 21 21 21","P 2ac 2ab","19","","","","- C H O4 Tb -","- C H O4 Tb -","- C4 H4 O16 Tb4 -","4","1","","Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.","Crystal chemistry of RE(CO3)OH","Zeitschrift fur Kristallographie","2007","222","","326","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9016109","7.39482","","7.39482","","15.8504","","90","","90","","90","","866.753","","","","","","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","Wesselsite","- Ba0.5 Cu O10 Si4 Sr0.5 -","- Ba2 Cu4 O40 Si16 Sr2 -","- Ba2 Cu4 O40 Si16 Sr2 -","","","","Knight, K. S.; Henderson, C. M. B.","Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 150 K","European Journal of Mineralogy","2007","19","","189","200","10.1127/0935-1221/2007/0019-1711","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9016264","6.9386","","4.7963","","8.4863","","90","","90","","90","","282.421","","","","","","","","","","","","Synthetic","4","P 21 21 21","P 2ac 2ab","19","","","","- C H Er O4 -","- C H Er O4 -","- C4 H4 Er4 O16 -","4","1","","Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.","Crystal chemistry of RE(CO3)OH","Zeitschrift fur Kristallographie","2007","222","","326","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9016396","9.883","","7.6091","","4.7423","","90","","90.342","","90","","356.618","","","","","","","","","","","","Tahara, Hirukawa-mura, Gifu Prefecture, Japan","7","P 1 21/a 1","-P 2yab","14","","","Hingganite-(Y)","- Be2 Ca0.3 Dy0.4 Fe0.242 O10 Si2 Y1.3 -","- Be4 Ca0.6 Dy0.8 Fe0.484 O20 Si4 Y2.6 -","- Be4 Ca0.6 Dy0.8 Fe0.484 O20 Si4 Y2.6 -","","","","Miyawaki, R.; Matsubara, S.; Yokoyama, K.; Okamoto, A.","Hingganite-(Ce) and hingganite-(Y) from Tahara, Hirukawa-mura, Gifu Prefecture, Japan: The description on a new mineral species of the Ce-analogue of hingannite-(Y) with a refinement of the crystal structure of hingganite-(Y)","Journal of Mineralogical and Petrological Sciences","2007","102","","1","7","10.2465/jmps.051212","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9016509","9.3951","","9.3951","","7.7546","","90","","90","","90","","684.482","","","","","","","","","","","","Synthetic","4","P 42/n m c :2","-P 4ac 2a","137","","","","- C H O4 Tm -","- C H O4 Tm -","- C8 H8 O32 Tm8 -","8","0.5","","Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.","Crystal chemistry of RE(CO3)OH","Zeitschrift fur Kristallographie","2007","222","","326","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9016605","9.8362","","7.8301","","7.8655","","90","","90","","90","","605.788","","","","","","","","","","","","","2","C m c a","-C 2ac 2","64","","","Luobusaite","- Fe0.96 Si2 -","- Fe15.36 Si32 -","- Fe15.36 Si32 -","","","","Li, G.; Sh, N.; Xiong, M.; Ma, Z.; Bai, W.; Fang, Q.","Rietveld structure refinement of new mineral luobusaite (beta-FeSi2)","Journal of Mineralogy and Petrology","2007","27","","1","5","","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9016652","6.9813","","4.8336","","8.4449","","90","","90","","90","","284.972","","","","","","","","","","","","Synthetic","4","P 21 21 21","P 2ac 2ab","19","","","","- C H Dy O4 -","- C H Dy O4 -","- C4 H4 Dy4 O16 -","4","1","","Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.","Crystal chemistry of RE(CO3)OH","Zeitschrift fur Kristallographie","2007","222","","326","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9017348","11.7648","","5.644","","9.6367","","90","","125.843","","90","","518.704","","","","","","","","","","","","Synthetic","4","C 1 2/c 1","-C 2yc","15","","","Lindbergite","- C2 H4 Mn O6 -","- C8 H16 Mn4 O24 -","- C8 H16 Mn4 O24 -","","","","Soleimannejad, J.; Aghabozorg, H.; Hooshmand, S.; Ghadermaz, M.; Gharamaleki, J. A.","The monoclinic polymorph of catena-poly [[diaquamanganese(II)]-mu-oxalato-4O1,O2:O1',O2']","Acta Crystallographica, Section E","2007","63","","m2389","m2390","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","07:57:56",""